Program PWSCF v.5.1.1 starts on 29Dec2015 at 9: 7:23 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: ./AlPO4.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 48 28 8 2462 1082 166 Max 49 29 9 2469 1099 172 Sum 2337 1353 385 118333 52427 8111 bravais-lattice index = 14 lattice parameter (alat) = 9.5043 a.u. unit-cell volume = 1201.5625 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.504328 celldm(2)= 1.000000 celldm(3)= 1.399530 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.000605 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.000605 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 1.399530 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.000605 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.714526 ) 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 Al read from file: /home/autes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 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 P read from file: /home/autes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 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) Al 3.00 26.98150 Al( 1.00) P 5.00 30.97380 P( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.6997650 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 C2 2 -E -1 -C2 -2 Cartesian axes number of k points= 350 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 2) = ( 0.0111044 0.0111111 -0.0000000), wk = 0.0028571 k( 3) = ( 0.0222088 0.0222222 -0.0000000), wk = 0.0028571 k( 4) = ( 0.0333132 0.0333333 -0.0000000), wk = 0.0028571 k( 5) = ( 0.0444176 0.0444445 -0.0000000), wk = 0.0028571 k( 6) = ( 0.0555220 0.0555556 -0.0000000), wk = 0.0028571 k( 7) = ( 0.0666264 0.0666667 -0.0000000), wk = 0.0028571 k( 8) = ( 0.0777308 0.0777778 -0.0000000), wk = 0.0028571 k( 9) = ( 0.0888352 0.0888889 -0.0000000), wk = 0.0028571 k( 10) = ( 0.0999396 0.1000000 -0.0000000), wk = 0.0028571 k( 11) = ( 0.1110440 0.1111111 -0.0000000), wk = 0.0028571 k( 12) = ( 0.1221484 0.1222222 -0.0000000), wk = 0.0028571 k( 13) = ( 0.1332528 0.1333334 -0.0000000), wk = 0.0028571 k( 14) = ( 0.1443572 0.1444445 -0.0000000), wk = 0.0028571 k( 15) = ( 0.1554616 0.1555556 -0.0000000), wk = 0.0028571 k( 16) = ( 0.1665660 0.1666667 -0.0000000), wk = 0.0028571 k( 17) = ( 0.1776704 0.1777778 -0.0000000), wk = 0.0028571 k( 18) = ( 0.1887748 0.1888889 -0.0000000), wk = 0.0028571 k( 19) = ( 0.1998792 0.2000000 -0.0000000), wk = 0.0028571 k( 20) = ( 0.2109836 0.2111111 -0.0000000), wk = 0.0028571 k( 21) = ( 0.2220880 0.2222223 -0.0000000), wk = 0.0028571 k( 22) = ( 0.2331924 0.2333334 -0.0000000), wk = 0.0028571 k( 23) = ( 0.2442968 0.2444445 -0.0000000), wk = 0.0028571 k( 24) = ( 0.2554012 0.2555556 -0.0000000), wk = 0.0028571 k( 25) = ( 0.2665055 0.2666667 -0.0000000), wk = 0.0028571 k( 26) = ( 0.2776099 0.2777778 -0.0000000), wk = 0.0028571 k( 27) = ( 0.2887144 0.2888889 -0.0000000), wk = 0.0028571 k( 28) = ( 0.2998188 0.3000001 -0.0000000), wk = 0.0028571 k( 29) = ( 0.3109231 0.3111112 -0.0000000), wk = 0.0028571 k( 30) = ( 0.3220275 0.3222223 -0.0000000), wk = 0.0028571 k( 31) = ( 0.3331319 0.3333334 -0.0000000), wk = 0.0028571 k( 32) = ( 0.3442363 0.3444445 -0.0000000), wk = 0.0028571 k( 33) = ( 0.3553407 0.3555556 -0.0000000), wk = 0.0028571 k( 34) = ( 0.3664451 0.3666667 -0.0000000), wk = 0.0028571 k( 35) = ( 0.3775495 0.3777778 -0.0000000), wk = 0.0028571 k( 36) = ( 0.3886539 0.3888890 -0.0000000), wk = 0.0028571 k( 37) = ( 0.3997583 0.4000001 -0.0000000), wk = 0.0028571 k( 38) = ( 0.4108627 0.4111112 -0.0000000), wk = 0.0028571 k( 39) = ( 0.4219671 0.4222223 -0.0000000), wk = 0.0028571 k( 40) = ( 0.4330715 0.4333334 -0.0000000), wk = 0.0028571 k( 41) = ( 0.4441759 0.4444445 -0.0000000), wk = 0.0028571 k( 42) = ( 0.4552803 0.4555556 -0.0000000), wk = 0.0028571 k( 43) = ( 0.4663847 0.4666667 -0.0000000), wk = 0.0028571 k( 44) = ( 0.4774891 0.4777779 -0.0000000), wk = 0.0028571 k( 45) = ( 0.4885935 0.4888890 -0.0000000), wk = 0.0028571 k( 46) = ( 0.4996979 0.5000001 -0.0000000), wk = 0.0028571 k( 47) = ( 0.4996979 0.5000001 -0.0000000), wk = 0.0028571 k( 48) = ( 0.4840823 0.5000001 -0.0000000), wk = 0.0028571 k( 49) = ( 0.4684668 0.5000001 -0.0000000), wk = 0.0028571 k( 50) = ( 0.4528512 0.5000001 -0.0000000), wk = 0.0028571 k( 51) = ( 0.4372357 0.5000001 -0.0000000), wk = 0.0028571 k( 52) = ( 0.4216201 0.5000001 -0.0000000), wk = 0.0028571 k( 53) = ( 0.4060046 0.5000001 -0.0000000), wk = 0.0028571 k( 54) = ( 0.3903890 0.5000001 -0.0000000), wk = 0.0028571 k( 55) = ( 0.3747734 0.5000001 -0.0000000), wk = 0.0028571 k( 56) = ( 0.3591579 0.5000001 -0.0000000), wk = 0.0028571 k( 57) = ( 0.3435423 0.5000001 -0.0000000), wk = 0.0028571 k( 58) = ( 0.3279267 0.5000001 -0.0000000), wk = 0.0028571 k( 59) = ( 0.3123112 0.5000001 -0.0000000), wk = 0.0028571 k( 60) = ( 0.2966956 0.5000001 -0.0000000), wk = 0.0028571 k( 61) = ( 0.2810801 0.5000001 -0.0000000), wk = 0.0028571 k( 62) = ( 0.2654645 0.5000001 -0.0000000), wk = 0.0028571 k( 63) = ( 0.2498489 0.5000001 -0.0000000), wk = 0.0028571 k( 64) = ( 0.2342334 0.5000001 -0.0000000), wk = 0.0028571 k( 65) = ( 0.2186178 0.5000001 -0.0000000), wk = 0.0028571 k( 66) = ( 0.2030023 0.5000001 -0.0000000), wk = 0.0028571 k( 67) = ( 0.1873867 0.5000001 -0.0000000), wk = 0.0028571 k( 68) = ( 0.1717712 0.5000001 -0.0000000), wk = 0.0028571 k( 69) = ( 0.1561556 0.5000001 -0.0000000), wk = 0.0028571 k( 70) = ( 0.1405400 0.5000001 -0.0000000), wk = 0.0028571 k( 71) = ( 0.1249245 0.5000001 -0.0000000), wk = 0.0028571 k( 72) = ( 0.1093089 0.5000001 -0.0000000), wk = 0.0028571 k( 73) = ( 0.0936934 0.5000001 -0.0000000), wk = 0.0028571 k( 74) = ( 0.0780778 0.5000001 -0.0000000), wk = 0.0028571 k( 75) = ( 0.0624622 0.5000001 -0.0000000), wk = 0.0028571 k( 76) = ( 0.0468467 0.5000001 -0.0000000), wk = 0.0028571 k( 77) = ( 0.0312311 0.5000001 -0.0000000), wk = 0.0028571 k( 78) = ( 0.0156156 0.5000001 -0.0000000), wk = 0.0028571 k( 79) = ( 0.0000000 0.5000001 -0.0000000), wk = 0.0028571 k( 80) = ( 0.0000000 0.5000001 -0.0000000), wk = 0.0028571 k( 81) = ( 0.0000000 0.5000001 0.0155332), wk = 0.0028571 k( 82) = ( 0.0000000 0.5000001 0.0310663), wk = 0.0028571 k( 83) = ( 0.0000000 0.5000001 0.0465995), wk = 0.0028571 k( 84) = ( 0.0000000 0.5000001 0.0621327), wk = 0.0028571 k( 85) = ( 0.0000000 0.5000001 0.0776658), wk = 0.0028571 k( 86) = ( 0.0000000 0.5000001 0.0931990), wk = 0.0028571 k( 87) = ( 0.0000000 0.5000001 0.1087321), wk = 0.0028571 k( 88) = ( 0.0000000 0.5000001 0.1242653), wk = 0.0028571 k( 89) = ( 0.0000000 0.5000001 0.1397985), wk = 0.0028571 k( 90) = ( 0.0000000 0.5000001 0.1553316), wk = 0.0028571 k( 91) = ( 0.0000000 0.5000001 0.1708648), wk = 0.0028571 k( 92) = ( 0.0000000 0.5000001 0.1863980), wk = 0.0028571 k( 93) = ( 0.0000000 0.5000001 0.2019311), wk = 0.0028571 k( 94) = ( 0.0000000 0.5000001 0.2174643), wk = 0.0028571 k( 95) = ( 0.0000000 0.5000001 0.2329975), wk = 0.0028571 k( 96) = ( 0.0000000 0.5000001 0.2485306), wk = 0.0028571 k( 97) = ( 0.0000000 0.5000001 0.2640638), wk = 0.0028571 k( 98) = ( 0.0000000 0.5000001 0.2795970), wk = 0.0028571 k( 99) = ( 0.0000000 0.5000001 0.2951301), wk = 0.0028571 k( 100) = ( 0.0000000 0.5000001 0.3106633), wk = 0.0028571 k( 101) = ( 0.0000000 0.5000001 0.3261965), wk = 0.0028571 k( 102) = ( 0.0000000 0.5000001 0.3417296), wk = 0.0028571 k( 103) = ( 0.0000000 0.5000001 0.3572628), wk = 0.0028571 k( 104) = ( 0.0000000 0.5000001 0.3572628), wk = 0.0028571 k( 105) = ( 0.0156156 0.5000001 0.3572628), wk = 0.0028571 k( 106) = ( 0.0312311 0.5000001 0.3572628), wk = 0.0028571 k( 107) = ( 0.0468467 0.5000001 0.3572628), wk = 0.0028571 k( 108) = ( 0.0624622 0.5000001 0.3572628), wk = 0.0028571 k( 109) = ( 0.0780778 0.5000001 0.3572628), wk = 0.0028571 k( 110) = ( 0.0936934 0.5000001 0.3572628), wk = 0.0028571 k( 111) = ( 0.1093089 0.5000001 0.3572628), wk = 0.0028571 k( 112) = ( 0.1249245 0.5000001 0.3572628), wk = 0.0028571 k( 113) = ( 0.1405400 0.5000001 0.3572628), wk = 0.0028571 k( 114) = ( 0.1561556 0.5000001 0.3572628), wk = 0.0028571 k( 115) = ( 0.1717712 0.5000001 0.3572628), wk = 0.0028571 k( 116) = ( 0.1873867 0.5000001 0.3572628), wk = 0.0028571 k( 117) = ( 0.2030023 0.5000001 0.3572628), wk = 0.0028571 k( 118) = ( 0.2186178 0.5000001 0.3572628), wk = 0.0028571 k( 119) = ( 0.2342334 0.5000001 0.3572628), wk = 0.0028571 k( 120) = ( 0.2498489 0.5000001 0.3572628), wk = 0.0028571 k( 121) = ( 0.2654645 0.5000001 0.3572628), wk = 0.0028571 k( 122) = ( 0.2810801 0.5000001 0.3572628), wk = 0.0028571 k( 123) = ( 0.2966956 0.5000001 0.3572628), wk = 0.0028571 k( 124) = ( 0.3123112 0.5000001 0.3572628), wk = 0.0028571 k( 125) = ( 0.3279267 0.5000001 0.3572628), wk = 0.0028571 k( 126) = ( 0.3435423 0.5000001 0.3572628), wk = 0.0028571 k( 127) = ( 0.3591579 0.5000001 0.3572628), wk = 0.0028571 k( 128) = ( 0.3747734 0.5000001 0.3572628), wk = 0.0028571 k( 129) = ( 0.3903890 0.5000001 0.3572628), wk = 0.0028571 k( 130) = ( 0.4060046 0.5000001 0.3572628), wk = 0.0028571 k( 131) = ( 0.4216201 0.5000001 0.3572628), wk = 0.0028571 k( 132) = ( 0.4372357 0.5000001 0.3572628), wk = 0.0028571 k( 133) = ( 0.4528512 0.5000001 0.3572628), wk = 0.0028571 k( 134) = ( 0.4684668 0.5000001 0.3572628), wk = 0.0028571 k( 135) = ( 0.4840823 0.5000001 0.3572628), wk = 0.0028571 k( 136) = ( 0.4996979 0.5000001 0.3572628), wk = 0.0028571 k( 137) = ( 0.4996979 0.5000001 0.3572628), wk = 0.0028571 k( 138) = ( 0.4885935 0.4888890 0.3572628), wk = 0.0028571 k( 139) = ( 0.4774891 0.4777779 0.3572628), wk = 0.0028571 k( 140) = ( 0.4663847 0.4666667 0.3572628), wk = 0.0028571 k( 141) = ( 0.4552803 0.4555556 0.3572628), wk = 0.0028571 k( 142) = ( 0.4441759 0.4444445 0.3572628), wk = 0.0028571 k( 143) = ( 0.4330715 0.4333334 0.3572628), wk = 0.0028571 k( 144) = ( 0.4219671 0.4222223 0.3572628), wk = 0.0028571 k( 145) = ( 0.4108627 0.4111112 0.3572628), wk = 0.0028571 k( 146) = ( 0.3997583 0.4000001 0.3572628), wk = 0.0028571 k( 147) = ( 0.3886539 0.3888890 0.3572628), wk = 0.0028571 k( 148) = ( 0.3775495 0.3777778 0.3572628), wk = 0.0028571 k( 149) = ( 0.3664451 0.3666667 0.3572628), wk = 0.0028571 k( 150) = ( 0.3553407 0.3555556 0.3572628), wk = 0.0028571 k( 151) = ( 0.3442363 0.3444445 0.3572628), wk = 0.0028571 k( 152) = ( 0.3331319 0.3333334 0.3572628), wk = 0.0028571 k( 153) = ( 0.3220275 0.3222223 0.3572628), wk = 0.0028571 k( 154) = ( 0.3109231 0.3111112 0.3572628), wk = 0.0028571 k( 155) = ( 0.2998188 0.3000001 0.3572628), wk = 0.0028571 k( 156) = ( 0.2887144 0.2888889 0.3572628), wk = 0.0028571 k( 157) = ( 0.2776099 0.2777778 0.3572628), wk = 0.0028571 k( 158) = ( 0.2665055 0.2666667 0.3572628), wk = 0.0028571 k( 159) = ( 0.2554012 0.2555556 0.3572628), wk = 0.0028571 k( 160) = ( 0.2442968 0.2444445 0.3572628), wk = 0.0028571 k( 161) = ( 0.2331924 0.2333334 0.3572628), wk = 0.0028571 k( 162) = ( 0.2220880 0.2222223 0.3572628), wk = 0.0028571 k( 163) = ( 0.2109836 0.2111111 0.3572628), wk = 0.0028571 k( 164) = ( 0.1998792 0.2000000 0.3572628), wk = 0.0028571 k( 165) = ( 0.1887748 0.1888889 0.3572628), wk = 0.0028571 k( 166) = ( 0.1776704 0.1777778 0.3572628), wk = 0.0028571 k( 167) = ( 0.1665660 0.1666667 0.3572628), wk = 0.0028571 k( 168) = ( 0.1554616 0.1555556 0.3572628), wk = 0.0028571 k( 169) = ( 0.1443572 0.1444445 0.3572628), wk = 0.0028571 k( 170) = ( 0.1332528 0.1333334 0.3572628), wk = 0.0028571 k( 171) = ( 0.1221484 0.1222222 0.3572628), wk = 0.0028571 k( 172) = ( 0.1110440 0.1111111 0.3572628), wk = 0.0028571 k( 173) = ( 0.0999396 0.1000000 0.3572628), wk = 0.0028571 k( 174) = ( 0.0888352 0.0888889 0.3572628), wk = 0.0028571 k( 175) = ( 0.0777308 0.0777778 0.3572628), wk = 0.0028571 k( 176) = ( 0.0666264 0.0666667 0.3572628), wk = 0.0028571 k( 177) = ( 0.0555220 0.0555556 0.3572628), wk = 0.0028571 k( 178) = ( 0.0444176 0.0444445 0.3572628), wk = 0.0028571 k( 179) = ( 0.0333132 0.0333333 0.3572628), wk = 0.0028571 k( 180) = ( 0.0222088 0.0222222 0.3572628), wk = 0.0028571 k( 181) = ( 0.0111044 0.0111111 0.3572628), wk = 0.0028571 k( 182) = ( 0.0000000 0.0000000 0.3572628), wk = 0.0028571 k( 183) = ( 0.0000000 0.0000000 0.3572628), wk = 0.0028571 k( 184) = ( 0.0000000 0.0000000 0.3417296), wk = 0.0028571 k( 185) = ( 0.0000000 0.0000000 0.3261965), wk = 0.0028571 k( 186) = ( 0.0000000 0.0000000 0.3106633), wk = 0.0028571 k( 187) = ( 0.0000000 0.0000000 0.2951301), wk = 0.0028571 k( 188) = ( 0.0000000 0.0000000 0.2795970), wk = 0.0028571 k( 189) = ( 0.0000000 0.0000000 0.2640638), wk = 0.0028571 k( 190) = ( 0.0000000 0.0000000 0.2485306), wk = 0.0028571 k( 191) = ( 0.0000000 0.0000000 0.2329975), wk = 0.0028571 k( 192) = ( 0.0000000 0.0000000 0.2174643), wk = 0.0028571 k( 193) = ( 0.0000000 0.0000000 0.2019311), wk = 0.0028571 k( 194) = ( 0.0000000 0.0000000 0.1863980), wk = 0.0028571 k( 195) = ( 0.0000000 0.0000000 0.1708648), wk = 0.0028571 k( 196) = ( 0.0000000 0.0000000 0.1553316), wk = 0.0028571 k( 197) = ( 0.0000000 0.0000000 0.1397985), wk = 0.0028571 k( 198) = ( 0.0000000 0.0000000 0.1242653), wk = 0.0028571 k( 199) = ( 0.0000000 0.0000000 0.1087321), wk = 0.0028571 k( 200) = ( 0.0000000 0.0000000 0.0931990), wk = 0.0028571 k( 201) = ( 0.0000000 0.0000000 0.0776658), wk = 0.0028571 k( 202) = ( 0.0000000 0.0000000 0.0621327), wk = 0.0028571 k( 203) = ( 0.0000000 0.0000000 0.0465995), wk = 0.0028571 k( 204) = ( 0.0000000 0.0000000 0.0310663), wk = 0.0028571 k( 205) = ( 0.0000000 0.0000000 0.0155332), wk = 0.0028571 k( 206) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 207) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 208) = ( -0.0111111 0.0111044 0.0000000), wk = 0.0028571 k( 209) = ( -0.0222222 0.0222088 0.0000000), wk = 0.0028571 k( 210) = ( -0.0333333 0.0333132 0.0000000), wk = 0.0028571 k( 211) = ( -0.0444444 0.0444176 0.0000000), wk = 0.0028571 k( 212) = ( -0.0555556 0.0555220 0.0000000), wk = 0.0028571 k( 213) = ( -0.0666667 0.0666264 0.0000000), wk = 0.0028571 k( 214) = ( -0.0777778 0.0777308 0.0000000), wk = 0.0028571 k( 215) = ( -0.0888889 0.0888352 0.0000000), wk = 0.0028571 k( 216) = ( -0.1000000 0.0999396 0.0000000), wk = 0.0028571 k( 217) = ( -0.1111111 0.1110440 0.0000000), wk = 0.0028571 k( 218) = ( -0.1222222 0.1221484 0.0000000), wk = 0.0028571 k( 219) = ( -0.1333333 0.1332527 0.0000000), wk = 0.0028571 k( 220) = ( -0.1444444 0.1443571 0.0000000), wk = 0.0028571 k( 221) = ( -0.1555556 0.1554615 0.0000000), wk = 0.0028571 k( 222) = ( -0.1666667 0.1665659 0.0000000), wk = 0.0028571 k( 223) = ( -0.1777778 0.1776703 0.0000000), wk = 0.0028571 k( 224) = ( -0.1888889 0.1887747 0.0000000), wk = 0.0028571 k( 225) = ( -0.2000000 0.1998791 0.0000000), wk = 0.0028571 k( 226) = ( -0.2111111 0.2109835 0.0000000), wk = 0.0028571 k( 227) = ( -0.2222222 0.2220879 0.0000000), wk = 0.0028571 k( 228) = ( -0.2333333 0.2331923 0.0000000), wk = 0.0028571 k( 229) = ( -0.2444444 0.2442967 0.0000000), wk = 0.0028571 k( 230) = ( -0.2555556 0.2554011 0.0000000), wk = 0.0028571 k( 231) = ( -0.2666667 0.2665055 0.0000000), wk = 0.0028571 k( 232) = ( -0.2777778 0.2776099 0.0000000), wk = 0.0028571 k( 233) = ( -0.2888889 0.2887143 0.0000000), wk = 0.0028571 k( 234) = ( -0.3000000 0.2998187 0.0000000), wk = 0.0028571 k( 235) = ( -0.3111111 0.3109231 0.0000000), wk = 0.0028571 k( 236) = ( -0.3222222 0.3220275 0.0000000), wk = 0.0028571 k( 237) = ( -0.3333333 0.3331319 0.0000000), wk = 0.0028571 k( 238) = ( -0.3444444 0.3442363 0.0000000), wk = 0.0028571 k( 239) = ( -0.3555556 0.3553407 0.0000000), wk = 0.0028571 k( 240) = ( -0.3666667 0.3664451 0.0000000), wk = 0.0028571 k( 241) = ( -0.3777778 0.3775495 0.0000000), wk = 0.0028571 k( 242) = ( -0.3888889 0.3886539 0.0000000), wk = 0.0028571 k( 243) = ( -0.4000000 0.3997583 0.0000000), wk = 0.0028571 k( 244) = ( -0.4111111 0.4108626 0.0000000), wk = 0.0028571 k( 245) = ( -0.4222222 0.4219670 0.0000000), wk = 0.0028571 k( 246) = ( -0.4333333 0.4330714 0.0000000), wk = 0.0028571 k( 247) = ( -0.4444444 0.4441758 0.0000000), wk = 0.0028571 k( 248) = ( -0.4555556 0.4552802 0.0000000), wk = 0.0028571 k( 249) = ( -0.4666667 0.4663846 0.0000000), wk = 0.0028571 k( 250) = ( -0.4777778 0.4774890 0.0000000), wk = 0.0028571 k( 251) = ( -0.4888889 0.4885934 0.0000000), wk = 0.0028571 k( 252) = ( -0.5000000 0.4996978 0.0000000), wk = 0.0028571 k( 253) = ( -0.5000000 0.4996978 0.0000000), wk = 0.0028571 k( 254) = ( -0.4996979 0.5000001 -0.0000000), wk = 0.0028571 k( 255) = ( -0.4996979 0.5000001 -0.0000000), wk = 0.0028571 k( 256) = ( -0.4996979 0.5000001 0.0155332), wk = 0.0028571 k( 257) = ( -0.4996979 0.5000001 0.0310663), wk = 0.0028571 k( 258) = ( -0.4996979 0.5000001 0.0465995), wk = 0.0028571 k( 259) = ( -0.4996979 0.5000001 0.0621327), wk = 0.0028571 k( 260) = ( -0.4996979 0.5000001 0.0776658), wk = 0.0028571 k( 261) = ( -0.4996979 0.5000001 0.0931990), wk = 0.0028571 k( 262) = ( -0.4996979 0.5000001 0.1087321), wk = 0.0028571 k( 263) = ( -0.4996979 0.5000001 0.1242653), wk = 0.0028571 k( 264) = ( -0.4996979 0.5000001 0.1397985), wk = 0.0028571 k( 265) = ( -0.4996979 0.5000001 0.1553316), wk = 0.0028571 k( 266) = ( -0.4996979 0.5000001 0.1708648), wk = 0.0028571 k( 267) = ( -0.4996979 0.5000001 0.1863980), wk = 0.0028571 k( 268) = ( -0.4996979 0.5000001 0.2019311), wk = 0.0028571 k( 269) = ( -0.4996979 0.5000001 0.2174643), wk = 0.0028571 k( 270) = ( -0.4996979 0.5000001 0.2329975), wk = 0.0028571 k( 271) = ( -0.4996979 0.5000001 0.2485306), wk = 0.0028571 k( 272) = ( -0.4996979 0.5000001 0.2640638), wk = 0.0028571 k( 273) = ( -0.4996979 0.5000001 0.2795970), wk = 0.0028571 k( 274) = ( -0.4996979 0.5000001 0.2951301), wk = 0.0028571 k( 275) = ( -0.4996979 0.5000001 0.3106633), wk = 0.0028571 k( 276) = ( -0.4996979 0.5000001 0.3261965), wk = 0.0028571 k( 277) = ( -0.4996979 0.5000001 0.3417296), wk = 0.0028571 k( 278) = ( -0.4996979 0.5000001 0.3572628), wk = 0.0028571 k( 279) = ( -0.4996979 0.5000001 0.3572628), wk = 0.0028571 k( 280) = ( -0.5000000 0.4996978 0.3572628), wk = 0.0028571 k( 281) = ( -0.5000000 0.4996978 0.3572628), wk = 0.0028571 k( 282) = ( -0.5000000 0.4996978 0.3417296), wk = 0.0028571 k( 283) = ( -0.5000000 0.4996978 0.3261965), wk = 0.0028571 k( 284) = ( -0.5000000 0.4996978 0.3106633), wk = 0.0028571 k( 285) = ( -0.5000000 0.4996978 0.2951301), wk = 0.0028571 k( 286) = ( -0.5000000 0.4996978 0.2795970), wk = 0.0028571 k( 287) = ( -0.5000000 0.4996978 0.2640638), wk = 0.0028571 k( 288) = ( -0.5000000 0.4996978 0.2485306), wk = 0.0028571 k( 289) = ( -0.5000000 0.4996978 0.2329975), wk = 0.0028571 k( 290) = ( -0.5000000 0.4996978 0.2174643), wk = 0.0028571 k( 291) = ( -0.5000000 0.4996978 0.2019311), wk = 0.0028571 k( 292) = ( -0.5000000 0.4996978 0.1863980), wk = 0.0028571 k( 293) = ( -0.5000000 0.4996978 0.1708648), wk = 0.0028571 k( 294) = ( -0.5000000 0.4996978 0.1553316), wk = 0.0028571 k( 295) = ( -0.5000000 0.4996978 0.1397985), wk = 0.0028571 k( 296) = ( -0.5000000 0.4996978 0.1242653), wk = 0.0028571 k( 297) = ( -0.5000000 0.4996978 0.1087321), wk = 0.0028571 k( 298) = ( -0.5000000 0.4996978 0.0931990), wk = 0.0028571 k( 299) = ( -0.5000000 0.4996978 0.0776658), wk = 0.0028571 k( 300) = ( -0.5000000 0.4996978 0.0621327), wk = 0.0028571 k( 301) = ( -0.5000000 0.4996978 0.0465995), wk = 0.0028571 k( 302) = ( -0.5000000 0.4996978 0.0310663), wk = 0.0028571 k( 303) = ( -0.5000000 0.4996978 0.0155332), wk = 0.0028571 k( 304) = ( -0.5000000 0.4996978 0.0000000), wk = 0.0028571 k( 305) = ( 0.0000000 0.0000000 0.3572628), wk = 0.0028571 k( 306) = ( -0.0111111 0.0111044 0.3572628), wk = 0.0028571 k( 307) = ( -0.0222222 0.0222088 0.3572628), wk = 0.0028571 k( 308) = ( -0.0333333 0.0333132 0.3572628), wk = 0.0028571 k( 309) = ( -0.0444444 0.0444176 0.3572628), wk = 0.0028571 k( 310) = ( -0.0555556 0.0555220 0.3572628), wk = 0.0028571 k( 311) = ( -0.0666667 0.0666264 0.3572628), wk = 0.0028571 k( 312) = ( -0.0777778 0.0777308 0.3572628), wk = 0.0028571 k( 313) = ( -0.0888889 0.0888352 0.3572628), wk = 0.0028571 k( 314) = ( -0.1000000 0.0999396 0.3572628), wk = 0.0028571 k( 315) = ( -0.1111111 0.1110440 0.3572628), wk = 0.0028571 k( 316) = ( -0.1222222 0.1221484 0.3572628), wk = 0.0028571 k( 317) = ( -0.1333333 0.1332527 0.3572628), wk = 0.0028571 k( 318) = ( -0.1444444 0.1443571 0.3572628), wk = 0.0028571 k( 319) = ( -0.1555556 0.1554615 0.3572628), wk = 0.0028571 k( 320) = ( -0.1666667 0.1665659 0.3572628), wk = 0.0028571 k( 321) = ( -0.1777778 0.1776703 0.3572628), wk = 0.0028571 k( 322) = ( -0.1888889 0.1887747 0.3572628), wk = 0.0028571 k( 323) = ( -0.2000000 0.1998791 0.3572628), wk = 0.0028571 k( 324) = ( -0.2111111 0.2109835 0.3572628), wk = 0.0028571 k( 325) = ( -0.2222222 0.2220879 0.3572628), wk = 0.0028571 k( 326) = ( -0.2333333 0.2331923 0.3572628), wk = 0.0028571 k( 327) = ( -0.2444444 0.2442967 0.3572628), wk = 0.0028571 k( 328) = ( -0.2555556 0.2554011 0.3572628), wk = 0.0028571 k( 329) = ( -0.2666667 0.2665055 0.3572628), wk = 0.0028571 k( 330) = ( -0.2777778 0.2776099 0.3572628), wk = 0.0028571 k( 331) = ( -0.2888889 0.2887143 0.3572628), wk = 0.0028571 k( 332) = ( -0.3000000 0.2998187 0.3572628), wk = 0.0028571 k( 333) = ( -0.3111111 0.3109231 0.3572628), wk = 0.0028571 k( 334) = ( -0.3222222 0.3220275 0.3572628), wk = 0.0028571 k( 335) = ( -0.3333333 0.3331319 0.3572628), wk = 0.0028571 k( 336) = ( -0.3444444 0.3442363 0.3572628), wk = 0.0028571 k( 337) = ( -0.3555556 0.3553407 0.3572628), wk = 0.0028571 k( 338) = ( -0.3666667 0.3664451 0.3572628), wk = 0.0028571 k( 339) = ( -0.3777778 0.3775495 0.3572628), wk = 0.0028571 k( 340) = ( -0.3888889 0.3886539 0.3572628), wk = 0.0028571 k( 341) = ( -0.4000000 0.3997583 0.3572628), wk = 0.0028571 k( 342) = ( -0.4111111 0.4108626 0.3572628), wk = 0.0028571 k( 343) = ( -0.4222222 0.4219670 0.3572628), wk = 0.0028571 k( 344) = ( -0.4333333 0.4330714 0.3572628), wk = 0.0028571 k( 345) = ( -0.4444444 0.4441758 0.3572628), wk = 0.0028571 k( 346) = ( -0.4555556 0.4552802 0.3572628), wk = 0.0028571 k( 347) = ( -0.4666667 0.4663846 0.3572628), wk = 0.0028571 k( 348) = ( -0.4777778 0.4774890 0.3572628), wk = 0.0028571 k( 349) = ( -0.4888889 0.4885934 0.3572628), wk = 0.0028571 k( 350) = ( -0.5000000 0.4996978 0.3572628), wk = 0.0028571 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 2) = ( 0.0111044 0.0111044 0.0000000), wk = 0.0028571 k( 3) = ( 0.0222088 0.0222088 0.0000000), wk = 0.0028571 k( 4) = ( 0.0333132 0.0333132 0.0000000), wk = 0.0028571 k( 5) = ( 0.0444176 0.0444176 0.0000000), wk = 0.0028571 k( 6) = ( 0.0555220 0.0555220 0.0000000), wk = 0.0028571 k( 7) = ( 0.0666264 0.0666264 0.0000000), wk = 0.0028571 k( 8) = ( 0.0777308 0.0777308 0.0000000), wk = 0.0028571 k( 9) = ( 0.0888352 0.0888352 0.0000000), wk = 0.0028571 k( 10) = ( 0.0999396 0.0999396 0.0000000), wk = 0.0028571 k( 11) = ( 0.1110440 0.1110440 0.0000000), wk = 0.0028571 k( 12) = ( 0.1221484 0.1221484 0.0000000), wk = 0.0028571 k( 13) = ( 0.1332528 0.1332528 0.0000000), wk = 0.0028571 k( 14) = ( 0.1443572 0.1443572 0.0000000), wk = 0.0028571 k( 15) = ( 0.1554616 0.1554616 0.0000000), wk = 0.0028571 k( 16) = ( 0.1665660 0.1665660 0.0000000), wk = 0.0028571 k( 17) = ( 0.1776704 0.1776704 0.0000000), wk = 0.0028571 k( 18) = ( 0.1887748 0.1887748 0.0000000), wk = 0.0028571 k( 19) = ( 0.1998792 0.1998792 0.0000000), wk = 0.0028571 k( 20) = ( 0.2109836 0.2109836 0.0000000), wk = 0.0028571 k( 21) = ( 0.2220880 0.2220880 0.0000000), wk = 0.0028571 k( 22) = ( 0.2331924 0.2331924 0.0000000), wk = 0.0028571 k( 23) = ( 0.2442968 0.2442968 0.0000000), wk = 0.0028571 k( 24) = ( 0.2554012 0.2554011 0.0000000), wk = 0.0028571 k( 25) = ( 0.2665055 0.2665055 0.0000000), wk = 0.0028571 k( 26) = ( 0.2776099 0.2776099 -0.0000000), wk = 0.0028571 k( 27) = ( 0.2887144 0.2887143 0.0000000), wk = 0.0028571 k( 28) = ( 0.2998188 0.2998188 0.0000000), wk = 0.0028571 k( 29) = ( 0.3109231 0.3109231 0.0000000), wk = 0.0028571 k( 30) = ( 0.3220275 0.3220275 0.0000000), wk = 0.0028571 k( 31) = ( 0.3331319 0.3331319 0.0000000), wk = 0.0028571 k( 32) = ( 0.3442363 0.3442363 0.0000000), wk = 0.0028571 k( 33) = ( 0.3553407 0.3553407 0.0000000), wk = 0.0028571 k( 34) = ( 0.3664451 0.3664451 0.0000000), wk = 0.0028571 k( 35) = ( 0.3775495 0.3775495 0.0000000), wk = 0.0028571 k( 36) = ( 0.3886539 0.3886539 0.0000000), wk = 0.0028571 k( 37) = ( 0.3997583 0.3997583 0.0000000), wk = 0.0028571 k( 38) = ( 0.4108627 0.4108627 0.0000000), wk = 0.0028571 k( 39) = ( 0.4219671 0.4219671 0.0000000), wk = 0.0028571 k( 40) = ( 0.4330715 0.4330715 0.0000000), wk = 0.0028571 k( 41) = ( 0.4441759 0.4441759 0.0000000), wk = 0.0028571 k( 42) = ( 0.4552803 0.4552803 0.0000000), wk = 0.0028571 k( 43) = ( 0.4663847 0.4663847 0.0000000), wk = 0.0028571 k( 44) = ( 0.4774891 0.4774891 0.0000000), wk = 0.0028571 k( 45) = ( 0.4885935 0.4885935 0.0000000), wk = 0.0028571 k( 46) = ( 0.4996979 0.4996979 0.0000000), wk = 0.0028571 k( 47) = ( 0.4996979 0.4996979 0.0000000), wk = 0.0028571 k( 48) = ( 0.4840823 0.4997073 0.0000000), wk = 0.0028571 k( 49) = ( 0.4684668 0.4997168 -0.0000000), wk = 0.0028571 k( 50) = ( 0.4528512 0.4997262 0.0000000), wk = 0.0028571 k( 51) = ( 0.4372357 0.4997357 0.0000000), wk = 0.0028571 k( 52) = ( 0.4216201 0.4997451 0.0000000), wk = 0.0028571 k( 53) = ( 0.4060046 0.4997546 0.0000000), wk = 0.0028571 k( 54) = ( 0.3903890 0.4997640 0.0000000), wk = 0.0028571 k( 55) = ( 0.3747734 0.4997734 0.0000000), wk = 0.0028571 k( 56) = ( 0.3591579 0.4997829 0.0000000), wk = 0.0028571 k( 57) = ( 0.3435423 0.4997923 0.0000000), wk = 0.0028571 k( 58) = ( 0.3279267 0.4998017 0.0000000), wk = 0.0028571 k( 59) = ( 0.3123112 0.4998112 0.0000000), wk = 0.0028571 k( 60) = ( 0.2966956 0.4998206 0.0000000), wk = 0.0028571 k( 61) = ( 0.2810801 0.4998301 0.0000000), wk = 0.0028571 k( 62) = ( 0.2654645 0.4998395 0.0000000), wk = 0.0028571 k( 63) = ( 0.2498489 0.4998490 0.0000000), wk = 0.0028571 k( 64) = ( 0.2342334 0.4998584 0.0000000), wk = 0.0028571 k( 65) = ( 0.2186178 0.4998678 0.0000000), wk = 0.0028571 k( 66) = ( 0.2030023 0.4998773 0.0000000), wk = 0.0028571 k( 67) = ( 0.1873867 0.4998867 0.0000000), wk = 0.0028571 k( 68) = ( 0.1717712 0.4998962 -0.0000000), wk = 0.0028571 k( 69) = ( 0.1561556 0.4999056 0.0000000), wk = 0.0028571 k( 70) = ( 0.1405400 0.4999150 0.0000000), wk = 0.0028571 k( 71) = ( 0.1249245 0.4999245 0.0000000), wk = 0.0028571 k( 72) = ( 0.1093089 0.4999339 0.0000000), wk = 0.0028571 k( 73) = ( 0.0936934 0.4999434 0.0000000), wk = 0.0028571 k( 74) = ( 0.0780778 0.4999528 0.0000000), wk = 0.0028571 k( 75) = ( 0.0624622 0.4999622 0.0000000), wk = 0.0028571 k( 76) = ( 0.0468467 0.4999717 0.0000000), wk = 0.0028571 k( 77) = ( 0.0312311 0.4999811 -0.0000000), wk = 0.0028571 k( 78) = ( 0.0156156 0.4999906 -0.0000000), wk = 0.0028571 k( 79) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028571 k( 80) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0028571 k( 81) = ( 0.0000000 0.5000000 0.0217391), wk = 0.0028571 k( 82) = ( 0.0000000 0.5000000 0.0434783), wk = 0.0028571 k( 83) = ( 0.0000000 0.5000000 0.0652174), wk = 0.0028571 k( 84) = ( 0.0000000 0.5000000 0.0869565), wk = 0.0028571 k( 85) = ( 0.0000000 0.5000000 0.1086956), wk = 0.0028571 k( 86) = ( 0.0000000 0.5000000 0.1304348), wk = 0.0028571 k( 87) = ( 0.0000000 0.5000000 0.1521739), wk = 0.0028571 k( 88) = ( 0.0000000 0.5000000 0.1739130), wk = 0.0028571 k( 89) = ( 0.0000000 0.5000000 0.1956522), wk = 0.0028571 k( 90) = ( 0.0000000 0.5000000 0.2173913), wk = 0.0028571 k( 91) = ( 0.0000000 0.5000000 0.2391304), wk = 0.0028571 k( 92) = ( 0.0000000 0.5000000 0.2608696), wk = 0.0028571 k( 93) = ( 0.0000000 0.5000000 0.2826087), wk = 0.0028571 k( 94) = ( 0.0000000 0.5000000 0.3043478), wk = 0.0028571 k( 95) = ( 0.0000000 0.5000000 0.3260870), wk = 0.0028571 k( 96) = ( 0.0000000 0.5000000 0.3478261), wk = 0.0028571 k( 97) = ( 0.0000000 0.5000000 0.3695652), wk = 0.0028571 k( 98) = ( 0.0000000 0.5000000 0.3913043), wk = 0.0028571 k( 99) = ( 0.0000000 0.5000000 0.4130435), wk = 0.0028571 k( 100) = ( 0.0000000 0.5000000 0.4347826), wk = 0.0028571 k( 101) = ( 0.0000000 0.5000000 0.4565217), wk = 0.0028571 k( 102) = ( 0.0000000 0.5000000 0.4782609), wk = 0.0028571 k( 103) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028571 k( 104) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0028571 k( 105) = ( 0.0156156 0.4999906 0.5000000), wk = 0.0028571 k( 106) = ( 0.0312311 0.4999811 0.5000000), wk = 0.0028571 k( 107) = ( 0.0468467 0.4999717 0.5000000), wk = 0.0028571 k( 108) = ( 0.0624622 0.4999622 0.5000000), wk = 0.0028571 k( 109) = ( 0.0780778 0.4999528 0.5000000), wk = 0.0028571 k( 110) = ( 0.0936934 0.4999434 0.5000000), wk = 0.0028571 k( 111) = ( 0.1093089 0.4999339 0.5000000), wk = 0.0028571 k( 112) = ( 0.1249245 0.4999245 0.5000000), wk = 0.0028571 k( 113) = ( 0.1405400 0.4999150 0.5000000), wk = 0.0028571 k( 114) = ( 0.1561556 0.4999056 0.5000000), wk = 0.0028571 k( 115) = ( 0.1717712 0.4998962 0.5000000), wk = 0.0028571 k( 116) = ( 0.1873867 0.4998867 0.5000000), wk = 0.0028571 k( 117) = ( 0.2030023 0.4998773 0.5000000), wk = 0.0028571 k( 118) = ( 0.2186178 0.4998678 0.5000000), wk = 0.0028571 k( 119) = ( 0.2342334 0.4998584 0.5000000), wk = 0.0028571 k( 120) = ( 0.2498489 0.4998490 0.5000000), wk = 0.0028571 k( 121) = ( 0.2654645 0.4998395 0.5000000), wk = 0.0028571 k( 122) = ( 0.2810801 0.4998301 0.5000000), wk = 0.0028571 k( 123) = ( 0.2966956 0.4998206 0.5000000), wk = 0.0028571 k( 124) = ( 0.3123112 0.4998112 0.5000000), wk = 0.0028571 k( 125) = ( 0.3279267 0.4998017 0.5000000), wk = 0.0028571 k( 126) = ( 0.3435423 0.4997923 0.5000000), wk = 0.0028571 k( 127) = ( 0.3591579 0.4997829 0.5000000), wk = 0.0028571 k( 128) = ( 0.3747734 0.4997734 0.5000000), wk = 0.0028571 k( 129) = ( 0.3903890 0.4997640 0.5000000), wk = 0.0028571 k( 130) = ( 0.4060046 0.4997546 0.5000000), wk = 0.0028571 k( 131) = ( 0.4216201 0.4997451 0.5000000), wk = 0.0028571 k( 132) = ( 0.4372357 0.4997357 0.5000000), wk = 0.0028571 k( 133) = ( 0.4528512 0.4997262 0.5000000), wk = 0.0028571 k( 134) = ( 0.4684668 0.4997168 0.5000000), wk = 0.0028571 k( 135) = ( 0.4840823 0.4997073 0.5000000), wk = 0.0028571 k( 136) = ( 0.4996979 0.4996979 0.5000000), wk = 0.0028571 k( 137) = ( 0.4996979 0.4996979 0.5000000), wk = 0.0028571 k( 138) = ( 0.4885935 0.4885935 0.5000000), wk = 0.0028571 k( 139) = ( 0.4774891 0.4774891 0.5000000), wk = 0.0028571 k( 140) = ( 0.4663847 0.4663847 0.5000000), wk = 0.0028571 k( 141) = ( 0.4552803 0.4552803 0.5000000), wk = 0.0028571 k( 142) = ( 0.4441759 0.4441759 0.5000000), wk = 0.0028571 k( 143) = ( 0.4330715 0.4330715 0.5000000), wk = 0.0028571 k( 144) = ( 0.4219671 0.4219671 0.5000000), wk = 0.0028571 k( 145) = ( 0.4108627 0.4108627 0.5000000), wk = 0.0028571 k( 146) = ( 0.3997583 0.3997583 0.5000000), wk = 0.0028571 k( 147) = ( 0.3886539 0.3886539 0.5000000), wk = 0.0028571 k( 148) = ( 0.3775495 0.3775495 0.5000000), wk = 0.0028571 k( 149) = ( 0.3664451 0.3664451 0.5000000), wk = 0.0028571 k( 150) = ( 0.3553407 0.3553407 0.5000000), wk = 0.0028571 k( 151) = ( 0.3442363 0.3442363 0.5000000), wk = 0.0028571 k( 152) = ( 0.3331319 0.3331319 0.5000000), wk = 0.0028571 k( 153) = ( 0.3220275 0.3220275 0.5000000), wk = 0.0028571 k( 154) = ( 0.3109231 0.3109231 0.5000000), wk = 0.0028571 k( 155) = ( 0.2998188 0.2998188 0.5000000), wk = 0.0028571 k( 156) = ( 0.2887144 0.2887143 0.5000000), wk = 0.0028571 k( 157) = ( 0.2776099 0.2776099 0.5000000), wk = 0.0028571 k( 158) = ( 0.2665055 0.2665055 0.5000000), wk = 0.0028571 k( 159) = ( 0.2554012 0.2554011 0.5000000), wk = 0.0028571 k( 160) = ( 0.2442968 0.2442968 0.5000000), wk = 0.0028571 k( 161) = ( 0.2331924 0.2331924 0.5000000), wk = 0.0028571 k( 162) = ( 0.2220880 0.2220880 0.5000000), wk = 0.0028571 k( 163) = ( 0.2109836 0.2109836 0.5000000), wk = 0.0028571 k( 164) = ( 0.1998792 0.1998792 0.5000000), wk = 0.0028571 k( 165) = ( 0.1887748 0.1887748 0.5000000), wk = 0.0028571 k( 166) = ( 0.1776704 0.1776704 0.5000000), wk = 0.0028571 k( 167) = ( 0.1665660 0.1665660 0.5000000), wk = 0.0028571 k( 168) = ( 0.1554616 0.1554616 0.5000000), wk = 0.0028571 k( 169) = ( 0.1443572 0.1443572 0.5000000), wk = 0.0028571 k( 170) = ( 0.1332528 0.1332528 0.5000000), wk = 0.0028571 k( 171) = ( 0.1221484 0.1221484 0.5000000), wk = 0.0028571 k( 172) = ( 0.1110440 0.1110440 0.5000000), wk = 0.0028571 k( 173) = ( 0.0999396 0.0999396 0.5000000), wk = 0.0028571 k( 174) = ( 0.0888352 0.0888352 0.5000000), wk = 0.0028571 k( 175) = ( 0.0777308 0.0777308 0.5000000), wk = 0.0028571 k( 176) = ( 0.0666264 0.0666264 0.5000000), wk = 0.0028571 k( 177) = ( 0.0555220 0.0555220 0.5000000), wk = 0.0028571 k( 178) = ( 0.0444176 0.0444176 0.5000000), wk = 0.0028571 k( 179) = ( 0.0333132 0.0333132 0.5000000), wk = 0.0028571 k( 180) = ( 0.0222088 0.0222088 0.5000000), wk = 0.0028571 k( 181) = ( 0.0111044 0.0111044 0.5000000), wk = 0.0028571 k( 182) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 183) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 184) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0028571 k( 185) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0028571 k( 186) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0028571 k( 187) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0028571 k( 188) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0028571 k( 189) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0028571 k( 190) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0028571 k( 191) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0028571 k( 192) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0028571 k( 193) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0028571 k( 194) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0028571 k( 195) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0028571 k( 196) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0028571 k( 197) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0028571 k( 198) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0028571 k( 199) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0028571 k( 200) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0028571 k( 201) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0028571 k( 202) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0028571 k( 203) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0028571 k( 204) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0028571 k( 205) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0028571 k( 206) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 207) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0028571 k( 208) = ( -0.0111111 0.0111111 -0.0000000), wk = 0.0028571 k( 209) = ( -0.0222222 0.0222222 -0.0000000), wk = 0.0028571 k( 210) = ( -0.0333333 0.0333333 0.0000000), wk = 0.0028571 k( 211) = ( -0.0444444 0.0444444 -0.0000000), wk = 0.0028571 k( 212) = ( -0.0555556 0.0555556 0.0000000), wk = 0.0028571 k( 213) = ( -0.0666667 0.0666667 -0.0000000), wk = 0.0028571 k( 214) = ( -0.0777778 0.0777778 0.0000000), wk = 0.0028571 k( 215) = ( -0.0888889 0.0888889 0.0000000), wk = 0.0028571 k( 216) = ( -0.1000000 0.1000000 0.0000000), wk = 0.0028571 k( 217) = ( -0.1111111 0.1111111 -0.0000000), wk = 0.0028571 k( 218) = ( -0.1222222 0.1222222 -0.0000000), wk = 0.0028571 k( 219) = ( -0.1333333 0.1333333 -0.0000000), wk = 0.0028571 k( 220) = ( -0.1444444 0.1444444 -0.0000000), wk = 0.0028571 k( 221) = ( -0.1555556 0.1555556 0.0000000), wk = 0.0028571 k( 222) = ( -0.1666667 0.1666667 0.0000000), wk = 0.0028571 k( 223) = ( -0.1777778 0.1777778 0.0000000), wk = 0.0028571 k( 224) = ( -0.1888889 0.1888889 0.0000000), wk = 0.0028571 k( 225) = ( -0.2000000 0.2000000 0.0000000), wk = 0.0028571 k( 226) = ( -0.2111111 0.2111111 -0.0000000), wk = 0.0028571 k( 227) = ( -0.2222222 0.2222222 -0.0000000), wk = 0.0028571 k( 228) = ( -0.2333333 0.2333333 -0.0000000), wk = 0.0028571 k( 229) = ( -0.2444444 0.2444444 -0.0000000), wk = 0.0028571 k( 230) = ( -0.2555556 0.2555556 -0.0000000), wk = 0.0028571 k( 231) = ( -0.2666667 0.2666667 -0.0000000), wk = 0.0028571 k( 232) = ( -0.2777778 0.2777778 0.0000000), wk = 0.0028571 k( 233) = ( -0.2888889 0.2888889 -0.0000000), wk = 0.0028571 k( 234) = ( -0.3000000 0.3000000 -0.0000000), wk = 0.0028571 k( 235) = ( -0.3111111 0.3111111 -0.0000000), wk = 0.0028571 k( 236) = ( -0.3222222 0.3222222 -0.0000000), wk = 0.0028571 k( 237) = ( -0.3333333 0.3333333 0.0000000), wk = 0.0028571 k( 238) = ( -0.3444444 0.3444444 0.0000000), wk = 0.0028571 k( 239) = ( -0.3555556 0.3555556 0.0000000), wk = 0.0028571 k( 240) = ( -0.3666667 0.3666667 0.0000000), wk = 0.0028571 k( 241) = ( -0.3777778 0.3777778 0.0000000), wk = 0.0028571 k( 242) = ( -0.3888889 0.3888889 0.0000000), wk = 0.0028571 k( 243) = ( -0.4000000 0.4000000 0.0000000), wk = 0.0028571 k( 244) = ( -0.4111111 0.4111111 0.0000000), wk = 0.0028571 k( 245) = ( -0.4222222 0.4222222 -0.0000000), wk = 0.0028571 k( 246) = ( -0.4333333 0.4333333 -0.0000000), wk = 0.0028571 k( 247) = ( -0.4444444 0.4444444 -0.0000000), wk = 0.0028571 k( 248) = ( -0.4555556 0.4555556 0.0000000), wk = 0.0028571 k( 249) = ( -0.4666667 0.4666667 0.0000000), wk = 0.0028571 k( 250) = ( -0.4777778 0.4777778 -0.0000000), wk = 0.0028571 k( 251) = ( -0.4888889 0.4888889 -0.0000000), wk = 0.0028571 k( 252) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 253) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 254) = ( -0.4996979 0.5003021 -0.0000000), wk = 0.0028571 k( 255) = ( -0.4996979 0.5003021 -0.0000000), wk = 0.0028571 k( 256) = ( -0.4996979 0.5003021 0.0217391), wk = 0.0028571 k( 257) = ( -0.4996979 0.5003021 0.0434783), wk = 0.0028571 k( 258) = ( -0.4996979 0.5003021 0.0652174), wk = 0.0028571 k( 259) = ( -0.4996979 0.5003021 0.0869565), wk = 0.0028571 k( 260) = ( -0.4996979 0.5003021 0.1086957), wk = 0.0028571 k( 261) = ( -0.4996979 0.5003021 0.1304348), wk = 0.0028571 k( 262) = ( -0.4996979 0.5003021 0.1521739), wk = 0.0028571 k( 263) = ( -0.4996979 0.5003021 0.1739130), wk = 0.0028571 k( 264) = ( -0.4996979 0.5003021 0.1956522), wk = 0.0028571 k( 265) = ( -0.4996979 0.5003021 0.2173913), wk = 0.0028571 k( 266) = ( -0.4996979 0.5003021 0.2391304), wk = 0.0028571 k( 267) = ( -0.4996979 0.5003021 0.2608696), wk = 0.0028571 k( 268) = ( -0.4996979 0.5003021 0.2826087), wk = 0.0028571 k( 269) = ( -0.4996979 0.5003021 0.3043478), wk = 0.0028571 k( 270) = ( -0.4996979 0.5003021 0.3260870), wk = 0.0028571 k( 271) = ( -0.4996979 0.5003021 0.3478261), wk = 0.0028571 k( 272) = ( -0.4996979 0.5003021 0.3695652), wk = 0.0028571 k( 273) = ( -0.4996979 0.5003021 0.3913044), wk = 0.0028571 k( 274) = ( -0.4996979 0.5003021 0.4130435), wk = 0.0028571 k( 275) = ( -0.4996979 0.5003021 0.4347826), wk = 0.0028571 k( 276) = ( -0.4996979 0.5003021 0.4565217), wk = 0.0028571 k( 277) = ( -0.4996979 0.5003021 0.4782609), wk = 0.0028571 k( 278) = ( -0.4996979 0.5003021 0.5000000), wk = 0.0028571 k( 279) = ( -0.4996979 0.5003021 0.5000000), wk = 0.0028571 k( 280) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 k( 281) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 k( 282) = ( -0.5000000 0.5000000 0.4782609), wk = 0.0028571 k( 283) = ( -0.5000000 0.5000000 0.4565217), wk = 0.0028571 k( 284) = ( -0.5000000 0.5000000 0.4347826), wk = 0.0028571 k( 285) = ( -0.5000000 0.5000000 0.4130435), wk = 0.0028571 k( 286) = ( -0.5000000 0.5000000 0.3913044), wk = 0.0028571 k( 287) = ( -0.5000000 0.5000000 0.3695652), wk = 0.0028571 k( 288) = ( -0.5000000 0.5000000 0.3478261), wk = 0.0028571 k( 289) = ( -0.5000000 0.5000000 0.3260870), wk = 0.0028571 k( 290) = ( -0.5000000 0.5000000 0.3043478), wk = 0.0028571 k( 291) = ( -0.5000000 0.5000000 0.2826087), wk = 0.0028571 k( 292) = ( -0.5000000 0.5000000 0.2608696), wk = 0.0028571 k( 293) = ( -0.5000000 0.5000000 0.2391304), wk = 0.0028571 k( 294) = ( -0.5000000 0.5000000 0.2173913), wk = 0.0028571 k( 295) = ( -0.5000000 0.5000000 0.1956522), wk = 0.0028571 k( 296) = ( -0.5000000 0.5000000 0.1739130), wk = 0.0028571 k( 297) = ( -0.5000000 0.5000000 0.1521739), wk = 0.0028571 k( 298) = ( -0.5000000 0.5000000 0.1304348), wk = 0.0028571 k( 299) = ( -0.5000000 0.5000000 0.1086957), wk = 0.0028571 k( 300) = ( -0.5000000 0.5000000 0.0869565), wk = 0.0028571 k( 301) = ( -0.5000000 0.5000000 0.0652174), wk = 0.0028571 k( 302) = ( -0.5000000 0.5000000 0.0434783), wk = 0.0028571 k( 303) = ( -0.5000000 0.5000000 0.0217391), wk = 0.0028571 k( 304) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0028571 k( 305) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0028571 k( 306) = ( -0.0111111 0.0111111 0.5000000), wk = 0.0028571 k( 307) = ( -0.0222222 0.0222222 0.5000000), wk = 0.0028571 k( 308) = ( -0.0333333 0.0333333 0.5000000), wk = 0.0028571 k( 309) = ( -0.0444444 0.0444444 0.5000000), wk = 0.0028571 k( 310) = ( -0.0555556 0.0555556 0.5000000), wk = 0.0028571 k( 311) = ( -0.0666667 0.0666667 0.5000000), wk = 0.0028571 k( 312) = ( -0.0777778 0.0777778 0.5000000), wk = 0.0028571 k( 313) = ( -0.0888889 0.0888889 0.5000000), wk = 0.0028571 k( 314) = ( -0.1000000 0.1000000 0.5000000), wk = 0.0028571 k( 315) = ( -0.1111111 0.1111111 0.5000000), wk = 0.0028571 k( 316) = ( -0.1222222 0.1222222 0.5000000), wk = 0.0028571 k( 317) = ( -0.1333333 0.1333333 0.5000000), wk = 0.0028571 k( 318) = ( -0.1444444 0.1444444 0.5000000), wk = 0.0028571 k( 319) = ( -0.1555556 0.1555556 0.5000000), wk = 0.0028571 k( 320) = ( -0.1666667 0.1666667 0.5000000), wk = 0.0028571 k( 321) = ( -0.1777778 0.1777778 0.5000000), wk = 0.0028571 k( 322) = ( -0.1888889 0.1888889 0.5000000), wk = 0.0028571 k( 323) = ( -0.2000000 0.2000000 0.5000000), wk = 0.0028571 k( 324) = ( -0.2111111 0.2111111 0.5000000), wk = 0.0028571 k( 325) = ( -0.2222222 0.2222222 0.5000000), wk = 0.0028571 k( 326) = ( -0.2333333 0.2333333 0.5000000), wk = 0.0028571 k( 327) = ( -0.2444444 0.2444444 0.5000000), wk = 0.0028571 k( 328) = ( -0.2555556 0.2555556 0.5000000), wk = 0.0028571 k( 329) = ( -0.2666667 0.2666667 0.5000000), wk = 0.0028571 k( 330) = ( -0.2777778 0.2777778 0.5000000), wk = 0.0028571 k( 331) = ( -0.2888889 0.2888889 0.5000000), wk = 0.0028571 k( 332) = ( -0.3000000 0.3000000 0.5000000), wk = 0.0028571 k( 333) = ( -0.3111111 0.3111111 0.5000000), wk = 0.0028571 k( 334) = ( -0.3222222 0.3222222 0.5000000), wk = 0.0028571 k( 335) = ( -0.3333333 0.3333333 0.5000000), wk = 0.0028571 k( 336) = ( -0.3444444 0.3444444 0.5000000), wk = 0.0028571 k( 337) = ( -0.3555556 0.3555556 0.5000000), wk = 0.0028571 k( 338) = ( -0.3666667 0.3666667 0.5000000), wk = 0.0028571 k( 339) = ( -0.3777778 0.3777778 0.5000000), wk = 0.0028571 k( 340) = ( -0.3888889 0.3888889 0.5000000), wk = 0.0028571 k( 341) = ( -0.4000000 0.4000000 0.5000000), wk = 0.0028571 k( 342) = ( -0.4111111 0.4111111 0.5000000), wk = 0.0028571 k( 343) = ( -0.4222222 0.4222222 0.5000000), wk = 0.0028571 k( 344) = ( -0.4333333 0.4333333 0.5000000), wk = 0.0028571 k( 345) = ( -0.4444444 0.4444444 0.5000000), wk = 0.0028571 k( 346) = ( -0.4555556 0.4555556 0.5000000), wk = 0.0028571 k( 347) = ( -0.4666667 0.4666667 0.5000000), wk = 0.0028571 k( 348) = ( -0.4777778 0.4777778 0.5000000), wk = 0.0028571 k( 349) = ( -0.4888889 0.4888889 0.5000000), wk = 0.0028571 k( 350) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0028571 Dense grid: 118333 G-vectors FFT dimensions: ( 60, 60, 80) Smooth grid: 52427 G-vectors FFT dimensions: ( 45, 45, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.35 Mb ( 300, 76) NL pseudopotentials 0.57 Mb ( 150, 248) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2467) G-vector shells 0.01 Mb ( 1247) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.39 Mb ( 300, 304) Each subspace H/S matrix 1.41 Mb ( 304, 304) Each matrix 0.58 Mb ( 248, 2, 76) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./AlPO4.save/charge-density.dat Starting wfc are 96 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 51.3 secs Computing kpt #: 2 total cpu time spent up to now is 60.6 secs Computing kpt #: 3 total cpu time spent up to now is 70.1 secs Computing kpt #: 4 total cpu time spent up to now is 79.7 secs Computing kpt #: 5 total cpu time spent up to now is 88.9 secs Computing kpt #: 6 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 99.7 secs Computing kpt #: 7 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 110.6 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 121.4 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 132.4 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 143.3 secs Computing kpt #: 11 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 154.3 secs Computing kpt #: 12 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 165.2 secs Computing kpt #: 13 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 176.0 secs Computing kpt #: 14 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 186.6 secs Computing kpt #: 15 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 197.4 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 209.1 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 220.3 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 231.0 secs Computing kpt #: 19 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 241.5 secs Computing kpt #: 20 total cpu time spent up to now is 249.0 secs Computing kpt #: 21 total cpu time spent up to now is 256.1 secs Computing kpt #: 22 total cpu time spent up to now is 263.2 secs Computing kpt #: 23 total cpu time spent up to now is 270.6 secs Computing kpt #: 24 total cpu time spent up to now is 278.3 secs Computing kpt #: 25 total cpu time spent up to now is 286.1 secs Computing kpt #: 26 total cpu time spent up to now is 294.2 secs Computing kpt #: 27 total cpu time spent up to now is 302.0 secs Computing kpt #: 28 total cpu time spent up to now is 310.4 secs Computing kpt #: 29 total cpu time spent up to now is 319.8 secs Computing kpt #: 30 total cpu time spent up to now is 329.0 secs Computing kpt #: 31 total cpu time spent up to now is 338.3 secs Computing kpt #: 32 total cpu time spent up to now is 347.9 secs Computing kpt #: 33 total cpu time spent up to now is 357.4 secs Computing kpt #: 34 total cpu time spent up to now is 367.0 secs Computing kpt #: 35 total cpu time spent up to now is 377.9 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 389.1 secs Computing kpt #: 37 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 400.3 secs Computing kpt #: 38 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 411.3 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 422.4 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 433.4 secs Computing kpt #: 41 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 444.4 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 455.7 secs Computing kpt #: 43 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 466.7 secs Computing kpt #: 44 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 477.8 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 488.9 secs Computing kpt #: 46 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 499.9 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 512.5 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 523.7 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 535.0 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 546.3 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 558.0 secs Computing kpt #: 52 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 569.2 secs Computing kpt #: 53 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 580.4 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 591.7 secs Computing kpt #: 55 total cpu time spent up to now is 602.9 secs Computing kpt #: 56 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 614.0 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 625.4 secs Computing kpt #: 58 total cpu time spent up to now is 636.3 secs Computing kpt #: 59 total cpu time spent up to now is 647.3 secs Computing kpt #: 60 total cpu time spent up to now is 656.1 secs Computing kpt #: 61 total cpu time spent up to now is 665.5 secs Computing kpt #: 62 total cpu time spent up to now is 674.2 secs Computing kpt #: 63 total cpu time spent up to now is 682.7 secs Computing kpt #: 64 total cpu time spent up to now is 690.8 secs Computing kpt #: 65 total cpu time spent up to now is 698.9 secs Computing kpt #: 66 total cpu time spent up to now is 706.8 secs Computing kpt #: 67 total cpu time spent up to now is 715.4 secs Computing kpt #: 68 total cpu time spent up to now is 723.5 secs Computing kpt #: 69 total cpu time spent up to now is 731.7 secs Computing kpt #: 70 total cpu time spent up to now is 741.3 secs Computing kpt #: 71 total cpu time spent up to now is 750.3 secs Computing kpt #: 72 total cpu time spent up to now is 760.5 secs Computing kpt #: 73 total cpu time spent up to now is 771.3 secs Computing kpt #: 74 total cpu time spent up to now is 782.2 secs Computing kpt #: 75 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 794.1 secs Computing kpt #: 76 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 806.4 secs Computing kpt #: 77 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 819.7 secs Computing kpt #: 78 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 831.0 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 841.8 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 852.8 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 864.6 secs Computing kpt #: 82 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 876.8 secs Computing kpt #: 83 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 888.7 secs Computing kpt #: 84 total cpu time spent up to now is 900.0 secs Computing kpt #: 85 total cpu time spent up to now is 909.7 secs Computing kpt #: 86 total cpu time spent up to now is 919.3 secs Computing kpt #: 87 total cpu time spent up to now is 928.1 secs Computing kpt #: 88 total cpu time spent up to now is 936.5 secs Computing kpt #: 89 total cpu time spent up to now is 944.8 secs Computing kpt #: 90 total cpu time spent up to now is 952.5 secs Computing kpt #: 91 total cpu time spent up to now is 960.0 secs Computing kpt #: 92 total cpu time spent up to now is 967.5 secs Computing kpt #: 93 total cpu time spent up to now is 975.1 secs Computing kpt #: 94 total cpu time spent up to now is 982.4 secs Computing kpt #: 95 total cpu time spent up to now is 989.5 secs Computing kpt #: 96 total cpu time spent up to now is 996.8 secs Computing kpt #: 97 total cpu time spent up to now is 1003.9 secs Computing kpt #: 98 total cpu time spent up to now is 1011.0 secs Computing kpt #: 99 total cpu time spent up to now is 1017.8 secs Computing kpt #: 100 total cpu time spent up to now is 1024.8 secs Computing kpt #: 101 total cpu time spent up to now is 1031.7 secs Computing kpt #: 102 total cpu time spent up to now is 1038.9 secs Computing kpt #: 103 total cpu time spent up to now is 1045.9 secs Computing kpt #: 104 total cpu time spent up to now is 1052.7 secs Computing kpt #: 105 total cpu time spent up to now is 1060.0 secs Computing kpt #: 106 total cpu time spent up to now is 1067.0 secs Computing kpt #: 107 total cpu time spent up to now is 1074.6 secs Computing kpt #: 108 total cpu time spent up to now is 1081.9 secs Computing kpt #: 109 total cpu time spent up to now is 1089.1 secs Computing kpt #: 110 total cpu time spent up to now is 1096.6 secs Computing kpt #: 111 total cpu time spent up to now is 1103.7 secs Computing kpt #: 112 total cpu time spent up to now is 1111.6 secs Computing kpt #: 113 total cpu time spent up to now is 1118.7 secs Computing kpt #: 114 total cpu time spent up to now is 1125.9 secs Computing kpt #: 115 total cpu time spent up to now is 1133.0 secs Computing kpt #: 116 total cpu time spent up to now is 1140.1 secs Computing kpt #: 117 total cpu time spent up to now is 1147.2 secs Computing kpt #: 118 total cpu time spent up to now is 1154.2 secs Computing kpt #: 119 total cpu time spent up to now is 1161.4 secs Computing kpt #: 120 total cpu time spent up to now is 1168.7 secs Computing kpt #: 121 total cpu time spent up to now is 1176.4 secs Computing kpt #: 122 total cpu time spent up to now is 1183.6 secs Computing kpt #: 123 total cpu time spent up to now is 1190.9 secs Computing kpt #: 124 total cpu time spent up to now is 1198.3 secs Computing kpt #: 125 total cpu time spent up to now is 1205.7 secs Computing kpt #: 126 total cpu time spent up to now is 1213.5 secs Computing kpt #: 127 total cpu time spent up to now is 1221.6 secs Computing kpt #: 128 total cpu time spent up to now is 1229.7 secs Computing kpt #: 129 total cpu time spent up to now is 1238.0 secs Computing kpt #: 130 total cpu time spent up to now is 1246.4 secs Computing kpt #: 131 total cpu time spent up to now is 1254.7 secs Computing kpt #: 132 total cpu time spent up to now is 1263.2 secs Computing kpt #: 133 total cpu time spent up to now is 1271.6 secs Computing kpt #: 134 total cpu time spent up to now is 1280.7 secs Computing kpt #: 135 total cpu time spent up to now is 1288.7 secs Computing kpt #: 136 total cpu time spent up to now is 1296.9 secs Computing kpt #: 137 total cpu time spent up to now is 1304.9 secs Computing kpt #: 138 total cpu time spent up to now is 1313.0 secs Computing kpt #: 139 total cpu time spent up to now is 1321.0 secs Computing kpt #: 140 total cpu time spent up to now is 1329.5 secs Computing kpt #: 141 total cpu time spent up to now is 1337.7 secs Computing kpt #: 142 total cpu time spent up to now is 1345.4 secs Computing kpt #: 143 total cpu time spent up to now is 1353.1 secs Computing kpt #: 144 total cpu time spent up to now is 1360.5 secs Computing kpt #: 145 total cpu time spent up to now is 1367.7 secs Computing kpt #: 146 total cpu time spent up to now is 1375.0 secs Computing kpt #: 147 total cpu time spent up to now is 1383.0 secs Computing kpt #: 148 total cpu time spent up to now is 1390.8 secs Computing kpt #: 149 total cpu time spent up to now is 1398.7 secs Computing kpt #: 150 total cpu time spent up to now is 1407.5 secs Computing kpt #: 151 total cpu time spent up to now is 1417.0 secs Computing kpt #: 152 total cpu time spent up to now is 1425.9 secs Computing kpt #: 153 total cpu time spent up to now is 1434.6 secs Computing kpt #: 154 total cpu time spent up to now is 1444.0 secs Computing kpt #: 155 total cpu time spent up to now is 1453.1 secs Computing kpt #: 156 total cpu time spent up to now is 1462.7 secs Computing kpt #: 157 total cpu time spent up to now is 1472.3 secs Computing kpt #: 158 total cpu time spent up to now is 1481.5 secs Computing kpt #: 159 total cpu time spent up to now is 1491.1 secs Computing kpt #: 160 total cpu time spent up to now is 1500.1 secs Computing kpt #: 161 total cpu time spent up to now is 1509.5 secs Computing kpt #: 162 total cpu time spent up to now is 1518.6 secs Computing kpt #: 163 total cpu time spent up to now is 1528.3 secs Computing kpt #: 164 total cpu time spent up to now is 1537.7 secs Computing kpt #: 165 total cpu time spent up to now is 1546.4 secs Computing kpt #: 166 total cpu time spent up to now is 1554.7 secs Computing kpt #: 167 total cpu time spent up to now is 1562.6 secs Computing kpt #: 168 total cpu time spent up to now is 1570.7 secs Computing kpt #: 169 total cpu time spent up to now is 1578.8 secs Computing kpt #: 170 total cpu time spent up to now is 1586.8 secs Computing kpt #: 171 total cpu time spent up to now is 1594.9 secs Computing kpt #: 172 total cpu time spent up to now is 1602.7 secs Computing kpt #: 173 total cpu time spent up to now is 1610.6 secs Computing kpt #: 174 total cpu time spent up to now is 1617.9 secs Computing kpt #: 175 total cpu time spent up to now is 1625.3 secs Computing kpt #: 176 total cpu time spent up to now is 1632.6 secs Computing kpt #: 177 total cpu time spent up to now is 1639.7 secs Computing kpt #: 178 total cpu time spent up to now is 1646.5 secs Computing kpt #: 179 total cpu time spent up to now is 1653.2 secs Computing kpt #: 180 total cpu time spent up to now is 1660.0 secs Computing kpt #: 181 total cpu time spent up to now is 1666.5 secs Computing kpt #: 182 total cpu time spent up to now is 1673.1 secs Computing kpt #: 183 total cpu time spent up to now is 1679.5 secs Computing kpt #: 184 total cpu time spent up to now is 1686.4 secs Computing kpt #: 185 total cpu time spent up to now is 1693.3 secs Computing kpt #: 186 total cpu time spent up to now is 1699.9 secs Computing kpt #: 187 total cpu time spent up to now is 1707.5 secs Computing kpt #: 188 total cpu time spent up to now is 1715.3 secs Computing kpt #: 189 total cpu time spent up to now is 1722.7 secs Computing kpt #: 190 total cpu time spent up to now is 1730.9 secs Computing kpt #: 191 total cpu time spent up to now is 1742.2 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1753.8 secs Computing kpt #: 193 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1765.7 secs Computing kpt #: 194 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1777.6 secs Computing kpt #: 195 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1789.4 secs Computing kpt #: 196 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1801.2 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1812.3 secs Computing kpt #: 198 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1823.6 secs Computing kpt #: 199 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1834.9 secs Computing kpt #: 200 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1846.3 secs Computing kpt #: 201 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1857.1 secs Computing kpt #: 202 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1867.9 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1878.8 secs Computing kpt #: 204 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1889.4 secs Computing kpt #: 205 total cpu time spent up to now is 1898.7 secs Computing kpt #: 206 total cpu time spent up to now is 1907.5 secs Computing kpt #: 207 total cpu time spent up to now is 1916.6 secs Computing kpt #: 208 total cpu time spent up to now is 1925.9 secs Computing kpt #: 209 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1936.8 secs Computing kpt #: 210 total cpu time spent up to now is 1945.7 secs Computing kpt #: 211 total cpu time spent up to now is 1954.6 secs Computing kpt #: 212 total cpu time spent up to now is 1963.9 secs Computing kpt #: 213 total cpu time spent up to now is 1972.6 secs Computing kpt #: 214 total cpu time spent up to now is 1981.7 secs Computing kpt #: 215 total cpu time spent up to now is 1989.1 secs Computing kpt #: 216 total cpu time spent up to now is 1996.3 secs Computing kpt #: 217 total cpu time spent up to now is 2003.6 secs Computing kpt #: 218 total cpu time spent up to now is 2012.6 secs Computing kpt #: 219 total cpu time spent up to now is 2019.5 secs Computing kpt #: 220 total cpu time spent up to now is 2026.1 secs Computing kpt #: 221 total cpu time spent up to now is 2032.7 secs Computing kpt #: 222 total cpu time spent up to now is 2039.5 secs Computing kpt #: 223 total cpu time spent up to now is 2046.1 secs Computing kpt #: 224 total cpu time spent up to now is 2052.6 secs Computing kpt #: 225 total cpu time spent up to now is 2059.3 secs Computing kpt #: 226 total cpu time spent up to now is 2066.1 secs Computing kpt #: 227 total cpu time spent up to now is 2072.7 secs Computing kpt #: 228 total cpu time spent up to now is 2079.7 secs Computing kpt #: 229 total cpu time spent up to now is 2086.7 secs Computing kpt #: 230 total cpu time spent up to now is 2093.8 secs Computing kpt #: 231 total cpu time spent up to now is 2101.3 secs Computing kpt #: 232 total cpu time spent up to now is 2109.1 secs Computing kpt #: 233 total cpu time spent up to now is 2116.6 secs Computing kpt #: 234 total cpu time spent up to now is 2125.7 secs Computing kpt #: 235 total cpu time spent up to now is 2133.9 secs Computing kpt #: 236 total cpu time spent up to now is 2142.9 secs Computing kpt #: 237 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2154.2 secs Computing kpt #: 238 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2165.3 secs Computing kpt #: 239 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2176.4 secs Computing kpt #: 240 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2187.6 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2198.5 secs Computing kpt #: 242 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2209.5 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2220.7 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2231.8 secs Computing kpt #: 245 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2242.9 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2254.1 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2265.3 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2276.3 secs Computing kpt #: 249 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2287.4 secs Computing kpt #: 250 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2298.8 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2310.5 secs Computing kpt #: 252 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2321.2 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2332.5 secs Computing kpt #: 254 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2343.7 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2354.8 secs Computing kpt #: 256 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2365.9 secs Computing kpt #: 257 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2377.1 secs Computing kpt #: 258 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2388.4 secs Computing kpt #: 259 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2399.6 secs Computing kpt #: 260 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2410.9 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2422.1 secs Computing kpt #: 262 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2433.3 secs Computing kpt #: 263 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2444.9 secs Computing kpt #: 264 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2456.1 secs Computing kpt #: 265 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2467.4 secs Computing kpt #: 266 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2478.7 secs Computing kpt #: 267 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2489.7 secs Computing kpt #: 268 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2500.6 secs Computing kpt #: 269 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2511.7 secs Computing kpt #: 270 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2522.9 secs Computing kpt #: 271 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2534.2 secs Computing kpt #: 272 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2545.4 secs Computing kpt #: 273 total cpu time spent up to now is 2554.6 secs Computing kpt #: 274 total cpu time spent up to now is 2563.3 secs Computing kpt #: 275 total cpu time spent up to now is 2571.7 secs Computing kpt #: 276 total cpu time spent up to now is 2580.2 secs Computing kpt #: 277 total cpu time spent up to now is 2588.7 secs Computing kpt #: 278 total cpu time spent up to now is 2597.3 secs Computing kpt #: 279 total cpu time spent up to now is 2605.8 secs Computing kpt #: 280 total cpu time spent up to now is 2615.9 secs Computing kpt #: 281 total cpu time spent up to now is 2623.9 secs Computing kpt #: 282 total cpu time spent up to now is 2632.3 secs Computing kpt #: 283 total cpu time spent up to now is 2640.5 secs Computing kpt #: 284 total cpu time spent up to now is 2649.0 secs Computing kpt #: 285 total cpu time spent up to now is 2657.5 secs Computing kpt #: 286 total cpu time spent up to now is 2666.8 secs Computing kpt #: 287 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2677.9 secs Computing kpt #: 288 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2689.3 secs Computing kpt #: 289 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2700.3 secs Computing kpt #: 290 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2711.2 secs Computing kpt #: 291 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2722.1 secs Computing kpt #: 292 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2733.1 secs Computing kpt #: 293 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2743.9 secs Computing kpt #: 294 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2755.2 secs Computing kpt #: 295 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2766.3 secs Computing kpt #: 296 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2777.7 secs Computing kpt #: 297 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2788.9 secs Computing kpt #: 298 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2800.3 secs Computing kpt #: 299 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2811.6 secs Computing kpt #: 300 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2823.2 secs Computing kpt #: 301 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2834.6 secs Computing kpt #: 302 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2845.8 secs Computing kpt #: 303 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2857.0 secs Computing kpt #: 304 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2867.5 secs Computing kpt #: 305 total cpu time spent up to now is 2874.0 secs Computing kpt #: 306 total cpu time spent up to now is 2880.7 secs Computing kpt #: 307 total cpu time spent up to now is 2887.4 secs Computing kpt #: 308 total cpu time spent up to now is 2894.6 secs Computing kpt #: 309 total cpu time spent up to now is 2901.0 secs Computing kpt #: 310 total cpu time spent up to now is 2909.2 secs Computing kpt #: 311 total cpu time spent up to now is 2916.4 secs Computing kpt #: 312 total cpu time spent up to now is 2923.6 secs Computing kpt #: 313 total cpu time spent up to now is 2930.8 secs Computing kpt #: 314 total cpu time spent up to now is 2938.0 secs Computing kpt #: 315 total cpu time spent up to now is 2945.8 secs Computing kpt #: 316 total cpu time spent up to now is 2953.5 secs Computing kpt #: 317 total cpu time spent up to now is 2961.4 secs Computing kpt #: 318 total cpu time spent up to now is 2969.2 secs Computing kpt #: 319 total cpu time spent up to now is 2977.5 secs Computing kpt #: 320 total cpu time spent up to now is 2985.9 secs Computing kpt #: 321 total cpu time spent up to now is 2994.8 secs Computing kpt #: 322 total cpu time spent up to now is 3003.9 secs Computing kpt #: 323 total cpu time spent up to now is 3013.6 secs Computing kpt #: 324 total cpu time spent up to now is 3023.5 secs Computing kpt #: 325 total cpu time spent up to now is 3033.4 secs Computing kpt #: 326 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3044.8 secs Computing kpt #: 327 total cpu time spent up to now is 3054.9 secs Computing kpt #: 328 total cpu time spent up to now is 3066.1 secs Computing kpt #: 329 total cpu time spent up to now is 3077.2 secs Computing kpt #: 330 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3088.5 secs Computing kpt #: 331 total cpu time spent up to now is 3099.7 secs Computing kpt #: 332 total cpu time spent up to now is 3110.0 secs Computing kpt #: 333 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3121.2 secs Computing kpt #: 334 total cpu time spent up to now is 3132.5 secs Computing kpt #: 335 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3143.8 secs Computing kpt #: 336 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3155.2 secs Computing kpt #: 337 total cpu time spent up to now is 3166.2 secs Computing kpt #: 338 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3177.5 secs Computing kpt #: 339 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3188.4 secs Computing kpt #: 340 total cpu time spent up to now is 3198.7 secs Computing kpt #: 341 total cpu time spent up to now is 3210.5 secs Computing kpt #: 342 total cpu time spent up to now is 3220.7 secs Computing kpt #: 343 total cpu time spent up to now is 3229.8 secs Computing kpt #: 344 total cpu time spent up to now is 3238.6 secs Computing kpt #: 345 total cpu time spent up to now is 3249.3 secs Computing kpt #: 346 total cpu time spent up to now is 3259.5 secs Computing kpt #: 347 total cpu time spent up to now is 3268.5 secs Computing kpt #: 348 total cpu time spent up to now is 3277.1 secs Computing kpt #: 349 total cpu time spent up to now is 3285.6 secs Computing kpt #: 350 total cpu time spent up to now is 3293.7 secs ethr = 1.56E-11, avg # of iterations = 87.3 total cpu time spent up to now is 3294.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6577 PWs) bands (ev): -19.5402 -19.5402 -19.3023 -19.3023 -17.1977 -17.1977 -16.8013 -16.8013 -16.6820 -16.6820 -16.6791 -16.6791 -16.6644 -16.6644 -16.6576 -16.6576 -8.3521 -8.3521 -6.8965 -6.8965 -5.9314 -5.9314 -4.9231 -4.9231 -4.8440 -4.8440 -4.8032 -4.8032 -4.4285 -4.4285 -4.2893 -4.2893 -1.9741 -1.9741 -1.9651 -1.9651 -1.9618 -1.9618 -1.4370 -1.4370 -1.4193 -1.4193 -1.1613 -1.1613 -0.9622 -0.9622 -0.9361 -0.9361 -0.8968 -0.8968 -0.8115 -0.8115 0.0768 0.0768 0.1888 0.1888 0.4842 0.4842 0.7916 0.7916 0.8661 0.8661 1.0442 1.0442 6.8264 6.8264 9.4380 9.4380 10.3201 10.3201 10.4058 10.4058 10.4073 10.4073 10.7474 10.7474 k = 0.0111 0.0111-0.0000 ( 6565 PWs) bands (ev): -19.5399 -19.5399 -19.3023 -19.3023 -17.1978 -17.1975 -16.8014 -16.8013 -16.6843 -16.6826 -16.6790 -16.6776 -16.6645 -16.6644 -16.6576 -16.6576 -8.3509 -8.3509 -6.8965 -6.8963 -5.9314 -5.9309 -4.9227 -4.9224 -4.8448 -4.8447 -4.8027 -4.8024 -4.4285 -4.4285 -4.2898 -4.2895 -1.9768 -1.9714 -1.9662 -1.9660 -1.9635 -1.9590 -1.4372 -1.4372 -1.4189 -1.4183 -1.1613 -1.1608 -0.9644 -0.9606 -0.9387 -0.9338 -0.8985 -0.8980 -0.8116 -0.8109 0.0757 0.0768 0.1890 0.1905 0.4835 0.4837 0.7910 0.7910 0.8655 0.8658 1.0434 1.0438 6.8290 6.8290 9.4394 9.4399 10.3202 10.3205 10.4053 10.4055 10.4074 10.4077 10.7494 10.7495 k = 0.0222 0.0222-0.0000 ( 6569 PWs) bands (ev): -19.5392 -19.5392 -19.3023 -19.3022 -17.1977 -17.1971 -16.8014 -16.8014 -16.6874 -16.6855 -16.6778 -16.6764 -16.6648 -16.6646 -16.6577 -16.6577 -8.3474 -8.3474 -6.8966 -6.8962 -5.9311 -5.9301 -4.9212 -4.9205 -4.8471 -4.8469 -4.8011 -4.8005 -4.4285 -4.4284 -4.2909 -4.2903 -1.9794 -1.9701 -1.9691 -1.9682 -1.9635 -1.9557 -1.4376 -1.4375 -1.4170 -1.4158 -1.1609 -1.1598 -0.9672 -0.9599 -0.9415 -0.9318 -0.9029 -0.9019 -0.8111 -0.8098 0.0737 0.0759 0.1910 0.1938 0.4816 0.4820 0.7893 0.7894 0.8640 0.8644 1.0413 1.0420 6.8366 6.8366 9.4440 9.4451 10.3210 10.3214 10.4036 10.4044 10.4078 10.4088 10.7554 10.7557 k = 0.0333 0.0333-0.0000 ( 6573 PWs) bands (ev): -19.5379 -19.5379 -19.3022 -19.3021 -17.1974 -17.1965 -16.8016 -16.8015 -16.6913 -16.6893 -16.6769 -16.6758 -16.6652 -16.6649 -16.6578 -16.6578 -8.3415 -8.3415 -6.8967 -6.8961 -5.9304 -5.9289 -4.9185 -4.9174 -4.8508 -4.8505 -4.7982 -4.7973 -4.4285 -4.4284 -4.2927 -4.2918 -1.9818 -1.9734 -1.9724 -1.9702 -1.9611 -1.9522 -1.4382 -1.4382 -1.4137 -1.4119 -1.1600 -1.1583 -0.9705 -0.9602 -0.9445 -0.9303 -0.9100 -0.9083 -0.8099 -0.8080 0.0710 0.0741 0.1946 0.1986 0.4785 0.4791 0.7865 0.7867 0.8614 0.8621 1.0380 1.0390 6.8494 6.8494 9.4519 9.4536 10.3221 10.3227 10.4012 10.4025 10.4089 10.4105 10.7652 10.7657 k = 0.0444 0.0444-0.0000 ( 6557 PWs) bands (ev): -19.5361 -19.5361 -19.3021 -19.3019 -17.1969 -17.1958 -16.8018 -16.8017 -16.6959 -16.6939 -16.6764 -16.6756 -16.6657 -16.6653 -16.6581 -16.6580 -8.3333 -8.3332 -6.8967 -6.8959 -5.9294 -5.9274 -4.9147 -4.9132 -4.8561 -4.8557 -4.7942 -4.7929 -4.4285 -4.4284 -4.2950 -4.2939 -1.9839 -1.9790 -1.9771 -1.9720 -1.9574 -1.9483 -1.4391 -1.4391 -1.4093 -1.4070 -1.1587 -1.1565 -0.9744 -0.9616 -0.9481 -0.9298 -0.9193 -0.9167 -0.8081 -0.8055 0.0679 0.0716 0.1997 0.2047 0.4743 0.4752 0.7826 0.7829 0.8579 0.8588 1.0334 1.0348 6.8672 6.8672 9.4630 9.4652 10.3233 10.3241 10.3987 10.4003 10.4107 10.4127 10.7786 10.7792 k = 0.0555 0.0556-0.0000 ( 6553 PWs) bands (ev): -19.5338 -19.5338 -19.3019 -19.3018 -17.1963 -17.1949 -16.8020 -16.8019 -16.7013 -16.6993 -16.6764 -16.6758 -16.6663 -16.6659 -16.6583 -16.6582 -8.3227 -8.3227 -6.8967 -6.8957 -5.9280 -5.9255 -4.9098 -4.9080 -4.8628 -4.8623 -4.7889 -4.7873 -4.4285 -4.4283 -4.2979 -4.2965 -1.9858 -1.9857 -1.9831 -1.9736 -1.9531 -1.9443 -1.4401 -1.4401 -1.4039 -1.4011 -1.1570 -1.1542 -0.9790 -0.9641 -0.9533 -0.9348 -0.9263 -0.9262 -0.8054 -0.8023 0.0644 0.0687 0.2060 0.2118 0.4691 0.4701 0.7776 0.7780 0.8535 0.8547 1.0276 1.0294 6.8899 6.8899 9.4771 9.4800 10.3243 10.3251 10.3966 10.3986 10.4130 10.4155 10.7951 10.7959 k = 0.0666 0.0667-0.0000 ( 6555 PWs) bands (ev): -19.5309 -19.5309 -19.3017 -19.3015 -17.1955 -17.1938 -16.8024 -16.8022 -16.7074 -16.7054 -16.6767 -16.6765 -16.6671 -16.6665 -16.6587 -16.6586 -8.3099 -8.3098 -6.8967 -6.8955 -5.9262 -5.9233 -4.9039 -4.9017 -4.8709 -4.8703 -4.7824 -4.7806 -4.4284 -4.4283 -4.3013 -4.2996 -1.9935 -1.9902 -1.9873 -1.9751 -1.9487 -1.9401 -1.4413 -1.4413 -1.3978 -1.3945 -1.1549 -1.1516 -0.9844 -0.9678 -0.9619 -0.9483 -0.9347 -0.9277 -0.8019 -0.7982 0.0610 0.0656 0.2133 0.2197 0.4628 0.4640 0.7716 0.7720 0.8482 0.8496 1.0207 1.0227 6.9175 6.9175 9.4944 9.4977 10.3244 10.3252 10.3959 10.3981 10.4159 10.4188 10.8142 10.8152 k = 0.0777 0.0778-0.0000 ( 6573 PWs) bands (ev): -19.5277 -19.5277 -19.3015 -19.3013 -17.1946 -17.1926 -16.8027 -16.8026 -16.7143 -16.7124 -16.6775 -16.6774 -16.6680 -16.6673 -16.6591 -16.6589 -8.2948 -8.2947 -6.8967 -6.8954 -5.9242 -5.9209 -4.8975 -4.8950 -4.8799 -4.8792 -4.7748 -4.7726 -4.4284 -4.4282 -4.3052 -4.3032 -2.0019 -1.9980 -1.9888 -1.9764 -1.9441 -1.9358 -1.4426 -1.4426 -1.3913 -1.3876 -1.1525 -1.1488 -0.9914 -0.9769 -0.9711 -0.9640 -0.9411 -0.9292 -0.7974 -0.7932 0.0576 0.0625 0.2213 0.2283 0.4556 0.4570 0.7645 0.7650 0.8421 0.8437 1.0126 1.0150 6.9499 6.9499 9.5145 9.5183 10.3232 10.3238 10.3974 10.3996 10.4193 10.4225 10.8353 10.8366 k = 0.0888 0.0889-0.0000 ( 6561 PWs) bands (ev): -19.5239 -19.5239 -19.3012 -19.3010 -17.1934 -17.1912 -16.8031 -16.8030 -16.7220 -16.7201 -16.6789 -16.6784 -16.6689 -16.6682 -16.6596 -16.6594 -8.2774 -8.2774 -6.8967 -6.8952 -5.9219 -5.9181 -4.8959 -4.8949 -4.8837 -4.8827 -4.7660 -4.7636 -4.4282 -4.4280 -4.3094 -4.3071 -2.0107 -2.0064 -1.9901 -1.9776 -1.9394 -1.9315 -1.4439 -1.4438 -1.3847 -1.3806 -1.1498 -1.1457 -1.0020 -0.9949 -0.9789 -0.9764 -0.9462 -0.9314 -0.7919 -0.7873 0.0545 0.0596 0.2301 0.2375 0.4475 0.4492 0.7564 0.7569 0.8352 0.8370 1.0035 1.0062 6.9869 6.9869 9.5374 9.5417 10.3202 10.3204 10.4016 10.4035 10.4231 10.4265 10.8578 10.8594 k = 0.0999 0.1000-0.0000 ( 6565 PWs) bands (ev): -19.5196 -19.5196 -19.3009 -19.3007 -17.1922 -17.1897 -16.8036 -16.8034 -16.7304 -16.7286 -16.6806 -16.6797 -16.6700 -16.6692 -16.6602 -16.6599 -8.2579 -8.2578 -6.8968 -6.8951 -5.9194 -5.9152 -4.9064 -4.9062 -4.8767 -4.8743 -4.7561 -4.7534 -4.4280 -4.4278 -4.3138 -4.3113 -2.0197 -2.0150 -1.9913 -1.9787 -1.9347 -1.9273 -1.4451 -1.4450 -1.3782 -1.3737 -1.1470 -1.1424 -1.0191 -1.0163 -0.9900 -0.9819 -0.9511 -0.9347 -0.7854 -0.7805 0.0518 0.0569 0.2393 0.2471 0.4388 0.4406 0.7473 0.7479 0.8275 0.8295 0.9933 0.9964 7.0284 7.0284 9.5629 9.5677 10.3153 10.3155 10.4085 10.4100 10.4273 10.4307 10.8807 10.8826 k = 0.1110 0.1111-0.0000 ( 6551 PWs) bands (ev): -19.5149 -19.5149 -19.3006 -19.3003 -17.1907 -17.1880 -16.8041 -16.8039 -16.7396 -16.7378 -16.6826 -16.6813 -16.6711 -16.6703 -16.6608 -16.6605 -8.2361 -8.2360 -6.8969 -6.8950 -5.9167 -5.9121 -4.9204 -4.9200 -4.8667 -4.8639 -4.7451 -4.7422 -4.4277 -4.4274 -4.3184 -4.3157 -2.0287 -2.0236 -1.9924 -1.9799 -1.9302 -1.9232 -1.4463 -1.4460 -1.3720 -1.3673 -1.1440 -1.1391 -1.0414 -1.0402 -0.9982 -0.9878 -0.9563 -0.9390 -0.7781 -0.7730 0.0496 0.0547 0.2489 0.2570 0.4294 0.4315 0.7372 0.7378 0.8191 0.8214 0.9823 0.9857 7.0743 7.0743 9.5909 9.5960 10.3088 10.3095 10.4178 10.4184 10.4321 10.4348 10.9026 10.9049 k = 0.1221 0.1222-0.0000 ( 6559 PWs) bands (ev): -19.5098 -19.5098 -19.3003 -19.3000 -17.1892 -17.1862 -16.8046 -16.8044 -16.7495 -16.7478 -16.6849 -16.6832 -16.6723 -16.6715 -16.6615 -16.6611 -8.2123 -8.2122 -6.8970 -6.8950 -5.9139 -5.9088 -4.9362 -4.9356 -4.8554 -4.8523 -4.7331 -4.7299 -4.4273 -4.4270 -4.3231 -4.3202 -2.0375 -2.0322 -1.9936 -1.9811 -1.9258 -1.9193 -1.4472 -1.4469 -1.3665 -1.3614 -1.1411 -1.1360 -1.0667 -1.0660 -1.0055 -0.9941 -0.9623 -0.9445 -0.7701 -0.7648 0.0478 0.0530 0.2589 0.2673 0.4196 0.4219 0.7261 0.7268 0.8101 0.8127 0.9703 0.9741 7.1244 7.1244 9.6210 9.6265 10.3012 10.3024 10.4270 10.4289 10.4385 10.4388 10.9220 10.9247 k = 0.1333 0.1333-0.0000 ( 6545 PWs) bands (ev): -19.5043 -19.5043 -19.2999 -19.2996 -17.1875 -17.1843 -16.8052 -16.8050 -16.7600 -16.7584 -16.6874 -16.6853 -16.6736 -16.6727 -16.6622 -16.6618 -8.1864 -8.1863 -6.8972 -6.8951 -5.9109 -5.9055 -4.9535 -4.9528 -4.8430 -4.8396 -4.7200 -4.7166 -4.4268 -4.4265 -4.3278 -4.3247 -2.0459 -2.0403 -1.9948 -1.9824 -1.9217 -1.9157 -1.4478 -1.4474 -1.3617 -1.3562 -1.1386 -1.1337 -1.0936 -1.0927 -1.0124 -1.0007 -0.9692 -0.9509 -0.7615 -0.7561 0.0467 0.0518 0.2692 0.2777 0.4096 0.4121 0.7142 0.7149 0.8006 0.8033 0.9576 0.9617 7.1784 7.1785 9.6532 9.6590 10.2931 10.2947 10.4326 10.4382 10.4454 10.4490 10.9340 10.9389 k = 0.1444 0.1444-0.0000 ( 6549 PWs) bands (ev): -19.4983 -19.4983 -19.2995 -19.2991 -17.1856 -17.1822 -16.8058 -16.8056 -16.7712 -16.7697 -16.6901 -16.6877 -16.6749 -16.6741 -16.6629 -16.6625 -8.1584 -8.1583 -6.8975 -6.8952 -5.9079 -5.9021 -4.9723 -4.9715 -4.8296 -4.8261 -4.7060 -4.7025 -4.4261 -4.4258 -4.3323 -4.3290 -2.0539 -2.0480 -1.9962 -1.9839 -1.9180 -1.9125 -1.4481 -1.4475 -1.3578 -1.3520 -1.1393 -1.1370 -1.1190 -1.1153 -1.0194 -1.0076 -0.9768 -0.9584 -0.7527 -0.7472 0.0461 0.0512 0.2797 0.2884 0.3995 0.4021 0.7013 0.7021 0.7906 0.7936 0.9442 0.9486 7.2364 7.2364 9.6871 9.6932 10.2845 10.2865 10.4351 10.4408 10.4589 10.4630 10.9402 10.9458 k = 0.1555 0.1556-0.0000 ( 6551 PWs) bands (ev): -19.4920 -19.4920 -19.2991 -19.2987 -17.1836 -17.1800 -16.8065 -16.8063 -16.7830 -16.7815 -16.6931 -16.6903 -16.6763 -16.6755 -16.6637 -16.6633 -8.1285 -8.1284 -6.8979 -6.8954 -5.9049 -5.8987 -4.9926 -4.9917 -4.8154 -4.8116 -4.6911 -4.6874 -4.4253 -4.4249 -4.3366 -4.3332 -2.0611 -2.0551 -1.9978 -1.9857 -1.9147 -1.9098 -1.4481 -1.4472 -1.3551 -1.3489 -1.1597 -1.1590 -1.1267 -1.1200 -1.0264 -1.0147 -0.9854 -0.9669 -0.7439 -0.7383 0.0462 0.0512 0.2904 0.2993 0.3894 0.3923 0.6876 0.6884 0.7802 0.7834 0.9301 0.9348 7.2979 7.2979 9.7224 9.7287 10.2757 10.2782 10.4353 10.4405 10.4747 10.4789 10.9383 10.9413 k = 0.1666 0.1667-0.0000 ( 6547 PWs) bands (ev): -19.4854 -19.4854 -19.2986 -19.2982 -17.1815 -17.1777 -16.8074 -16.8073 -16.7952 -16.7937 -16.6962 -16.6931 -16.6778 -16.6769 -16.6645 -16.6641 -8.0967 -8.0966 -6.8983 -6.8958 -5.9019 -5.8954 -5.0144 -5.0133 -4.8002 -4.7963 -4.6754 -4.6715 -4.4242 -4.4239 -4.3406 -4.3370 -2.0676 -2.0614 -1.9997 -1.9878 -1.9119 -1.9076 -1.4476 -1.4465 -1.3535 -1.3469 -1.1902 -1.1894 -1.1248 -1.1179 -1.0335 -1.0221 -0.9948 -0.9764 -0.7354 -0.7297 0.0470 0.0519 0.3013 0.3102 0.3797 0.3827 0.6730 0.6740 0.7694 0.7728 0.9155 0.9205 7.3629 7.3629 9.7589 9.7652 10.2669 10.2698 10.4331 10.4377 10.4913 10.4958 10.9251 10.9272 k = 0.1777 0.1778-0.0000 ( 6549 PWs) bands (ev): -19.4784 -19.4784 -19.2981 -19.2977 -17.1793 -17.1753 -16.8105 -16.8100 -16.8057 -16.8045 -16.6995 -16.6961 -16.6793 -16.6784 -16.6653 -16.6650 -8.0631 -8.0630 -6.8989 -6.8963 -5.8990 -5.8922 -5.0376 -5.0365 -4.7843 -4.7803 -4.6588 -4.6548 -4.4230 -4.4226 -4.3441 -4.3404 -2.0732 -2.0669 -2.0019 -1.9903 -1.9096 -1.9060 -1.4467 -1.4454 -1.3532 -1.3462 -1.2226 -1.2217 -1.1218 -1.1148 -1.0406 -1.0296 -1.0050 -0.9867 -0.7274 -0.7217 0.0485 0.0532 0.3122 0.3213 0.3706 0.3737 0.6577 0.6587 0.7584 0.7620 0.9005 0.9057 7.4311 7.4311 9.7960 9.8024 10.2581 10.2614 10.4284 10.4324 10.5080 10.5130 10.9038 10.9050 k = 0.1888 0.1889-0.0000 ( 6539 PWs) bands (ev): -19.4711 -19.4711 -19.2976 -19.2972 -17.1770 -17.1728 -16.8224 -16.8212 -16.8079 -16.8075 -16.7029 -16.6993 -16.6808 -16.6800 -16.6662 -16.6659 -8.0277 -8.0276 -6.8995 -6.8968 -5.8962 -5.8891 -5.0623 -5.0611 -4.7677 -4.7636 -4.6416 -4.6374 -4.4215 -4.4211 -4.3471 -4.3433 -2.0779 -2.0714 -2.0045 -1.9933 -1.9078 -1.9049 -1.4456 -1.4440 -1.3543 -1.3468 -1.2558 -1.2548 -1.1185 -1.1115 -1.0477 -1.0374 -1.0158 -0.9979 -0.7202 -0.7144 0.0506 0.0553 0.3232 0.3325 0.3624 0.3655 0.6417 0.6428 0.7472 0.7511 0.8851 0.8906 7.5023 7.5024 9.8334 9.8397 10.2495 10.2533 10.4212 10.4244 10.5242 10.5297 10.8784 10.8786 k = 0.1999 0.2000-0.0000 ( 6537 PWs) bands (ev): -19.4635 -19.4635 -19.2972 -19.2967 -17.1746 -17.1702 -16.8360 -16.8348 -16.8088 -16.8085 -16.7065 -16.7026 -16.6824 -16.6816 -16.6671 -16.6668 -7.9906 -7.9905 -6.9003 -6.8975 -5.8936 -5.8862 -5.0885 -5.0871 -4.7504 -4.7462 -4.6236 -4.6194 -4.4198 -4.4194 -4.3495 -4.3456 -2.0815 -2.0749 -2.0077 -1.9969 -1.9066 -1.9044 -1.4443 -1.4424 -1.3570 -1.3487 -1.2895 -1.2881 -1.1149 -1.1079 -1.0549 -1.0455 -1.0271 -1.0098 -0.7142 -0.7083 0.0534 0.0579 0.3339 0.3434 0.3554 0.3585 0.6250 0.6261 0.7359 0.7400 0.8694 0.8752 7.5764 7.5764 9.8703 9.8766 10.2410 10.2453 10.4118 10.4141 10.5384 10.5446 10.8516 10.8527 k = 0.2110 0.2111-0.0000 ( 6537 PWs) bands (ev): -19.4557 -19.4557 -19.2966 -19.2962 -17.1721 -17.1675 -16.8500 -16.8489 -16.8096 -16.8093 -16.7101 -16.7060 -16.6840 -16.6832 -16.6680 -16.6677 -7.9519 -7.9517 -6.9012 -6.8984 -5.8912 -5.8836 -5.1160 -5.1146 -4.7326 -4.7283 -4.6051 -4.6007 -4.4178 -4.4174 -4.3513 -4.3473 -2.0839 -2.0772 -2.0114 -2.0011 -1.9058 -1.9045 -1.4433 -1.4410 -1.3615 -1.3520 -1.3229 -1.3207 -1.1111 -1.1041 -1.0622 -1.0544 -1.0385 -1.0223 -0.7094 -0.7036 0.0568 0.0612 0.3418 0.3497 0.3525 0.3573 0.6078 0.6089 0.7246 0.7288 0.8535 0.8595 7.6530 7.6530 9.9061 9.9121 10.2327 10.2375 10.4008 10.4023 10.5489 10.5558 10.8278 10.8300 k = 0.2221 0.2222-0.0000 ( 6537 PWs) bands (ev): -19.4477 -19.4477 -19.2961 -19.2957 -17.1695 -17.1647 -16.8644 -16.8633 -16.8104 -16.8101 -16.7139 -16.7096 -16.6857 -16.6849 -16.6689 -16.6687 -7.9116 -7.9115 -6.9022 -6.8994 -5.8891 -5.8812 -5.1450 -5.1434 -4.7143 -4.7100 -4.5860 -4.5816 -4.4154 -4.4151 -4.3523 -4.3482 -2.0852 -2.0785 -2.0158 -2.0060 -1.9056 -1.9050 -1.4434 -1.4407 -1.3697 -1.3573 -1.3545 -1.3498 -1.1069 -1.1001 -1.0699 -1.0647 -1.0491 -1.0351 -0.7063 -0.7004 0.0607 0.0650 0.3408 0.3460 0.3598 0.3674 0.5900 0.5912 0.7133 0.7177 0.8375 0.8437 7.7319 7.7320 9.9396 9.9452 10.2246 10.2300 10.3894 10.3900 10.5537 10.5610 10.8108 10.8139 k = 0.2332 0.2333-0.0000 ( 6529 PWs) bands (ev): -19.4395 -19.4395 -19.2956 -19.2951 -17.1668 -17.1620 -16.8790 -16.8779 -16.8112 -16.8108 -16.7177 -16.7133 -16.6874 -16.6866 -16.6699 -16.6696 -7.8699 -7.8698 -6.9034 -6.9005 -5.8872 -5.8792 -5.1753 -5.1736 -4.6956 -4.6913 -4.5666 -4.5621 -4.4127 -4.4124 -4.3525 -4.3484 -2.0853 -2.0785 -2.0208 -2.0116 -1.9060 -1.9058 -1.4469 -1.4441 -1.3880 -1.3838 -1.3666 -1.3624 -1.1023 -1.0957 -1.0783 -1.0770 -1.0583 -1.0480 -0.7049 -0.6990 0.0652 0.0694 0.3379 0.3426 0.3705 0.3785 0.5718 0.5731 0.7021 0.7067 0.8215 0.8279 7.8130 7.8131 9.9693 9.9745 10.2165 10.2226 10.3791 10.3793 10.5509 10.5580 10.8033 10.8069 k = 0.2443 0.2444-0.0000 ( 6537 PWs) bands (ev): -19.4311 -19.4311 -19.2951 -19.2946 -17.1641 -17.1591 -16.8938 -16.8927 -16.8119 -16.8116 -16.7216 -16.7170 -16.6890 -16.6883 -16.6708 -16.6706 -7.8269 -7.8267 -6.9046 -6.9017 -5.8856 -5.8775 -5.2069 -5.2051 -4.6767 -4.6724 -4.5468 -4.5423 -4.4096 -4.4094 -4.3519 -4.3478 -2.0842 -2.0773 -2.0265 -2.0178 -1.9074 -1.9063 -1.4594 -1.4571 -1.4059 -1.4026 -1.3761 -1.3696 -1.0972 -1.0913 -1.0904 -1.0879 -1.0664 -1.0601 -0.7053 -0.6994 0.0702 0.0741 0.3360 0.3406 0.3814 0.3895 0.5535 0.5547 0.6911 0.6958 0.8054 0.8121 7.8960 7.8960 9.9933 9.9979 10.2086 10.2154 10.3718 10.3729 10.5404 10.5465 10.8062 10.8095 k = 0.2554 0.2556-0.0000 ( 6535 PWs) bands (ev): -19.4227 -19.4227 -19.2945 -19.2941 -17.1613 -17.1563 -16.9087 -16.9076 -16.8127 -16.8124 -16.7255 -16.7208 -16.6907 -16.6900 -16.6717 -16.6715 -7.7826 -7.7824 -6.9060 -6.9031 -5.8844 -5.8761 -5.2399 -5.2380 -4.6576 -4.6534 -4.5267 -4.5222 -4.4061 -4.4060 -4.3504 -4.3464 -2.0818 -2.0749 -2.0329 -2.0248 -1.9090 -1.9072 -1.4834 -1.4819 -1.4135 -1.4096 -1.3853 -1.3780 -1.1064 -1.1001 -1.0910 -1.0851 -1.0738 -1.0708 -0.7076 -0.7017 0.0755 0.0793 0.3356 0.3402 0.3921 0.4000 0.5352 0.5365 0.6804 0.6852 0.7896 0.7964 7.9805 7.9806 10.0097 10.0136 10.2005 10.2081 10.3707 10.3724 10.5237 10.5285 10.8180 10.8206 k = 0.2665 0.2667-0.0000 ( 6537 PWs) bands (ev): -19.4142 -19.4142 -19.2940 -19.2936 -17.1585 -17.1534 -16.9236 -16.9225 -16.8135 -16.8131 -16.7295 -16.7246 -16.6924 -16.6917 -16.6726 -16.6725 -7.7371 -7.7369 -6.9075 -6.9046 -5.8835 -5.8752 -5.2740 -5.2720 -4.6385 -4.6344 -4.5066 -4.5020 -4.4021 -4.4021 -4.3481 -4.3442 -2.0781 -2.0713 -2.0399 -2.0325 -1.9108 -1.9084 -1.5132 -1.5122 -1.4157 -1.4108 -1.3950 -1.3875 -1.1227 -1.1140 -1.0847 -1.0812 -1.0795 -1.0784 -0.7117 -0.7060 0.0811 0.0847 0.3368 0.3414 0.4020 0.4096 0.5176 0.5187 0.6699 0.6748 0.7738 0.7808 8.0664 8.0665 10.0167 10.0199 10.1923 10.2008 10.3776 10.3799 10.5034 10.5067 10.8360 10.8378 k = 0.2776 0.2778-0.0000 ( 6537 PWs) bands (ev): -19.4057 -19.4057 -19.2935 -19.2930 -17.1557 -17.1505 -16.9384 -16.9374 -16.8142 -16.8138 -16.7334 -16.7285 -16.6940 -16.6934 -16.6736 -16.6734 -7.6905 -7.6903 -6.9090 -6.9062 -5.8829 -5.8746 -5.3094 -5.3072 -4.6196 -4.6156 -4.4864 -4.4818 -4.3977 -4.3975 -4.3450 -4.3411 -2.0732 -2.0665 -2.0476 -2.0407 -1.9129 -1.9098 -1.5448 -1.5440 -1.4168 -1.4105 -1.4049 -1.3980 -1.1397 -1.1300 -1.0880 -1.0879 -1.0764 -1.0713 -0.7177 -0.7121 0.0869 0.0903 0.3396 0.3441 0.4101 0.4172 0.5018 0.5025 0.6597 0.6648 0.7584 0.7655 8.1534 8.1535 10.0140 10.0167 10.1838 10.1931 10.3933 10.3959 10.4816 10.4834 10.8580 10.8590 k = 0.2887 0.2889-0.0000 ( 6537 PWs) bands (ev): -19.3972 -19.3972 -19.2930 -19.2925 -17.1529 -17.1476 -16.9531 -16.9521 -16.8149 -16.8146 -16.7373 -16.7324 -16.6957 -16.6950 -16.6744 -16.6743 -7.6430 -7.6429 -6.9107 -6.9079 -5.8828 -5.8744 -5.3458 -5.3435 -4.6010 -4.5972 -4.4663 -4.4617 -4.3926 -4.3923 -4.3412 -4.3373 -2.0675 -2.0609 -2.0555 -2.0489 -1.9150 -1.9114 -1.5766 -1.5759 -1.4213 -1.4117 -1.4101 -1.4090 -1.1575 -1.1473 -1.0951 -1.0946 -1.0678 -1.0630 -0.7254 -0.7198 0.0929 0.0961 0.3438 0.3483 0.4145 0.4204 0.4898 0.4901 0.6500 0.6551 0.7432 0.7504 8.2412 8.2413 10.0029 10.0053 10.1748 10.1849 10.4168 10.4191 10.4599 10.4607 10.8822 10.8825 k = 0.2998 0.3000-0.0000 ( 6539 PWs) bands (ev): -19.3887 -19.3887 -19.2925 -19.2920 -17.1500 -17.1448 -16.9676 -16.9666 -16.8156 -16.8153 -16.7412 -16.7362 -16.6973 -16.6967 -16.6753 -16.6752 -7.5947 -7.5945 -6.9124 -6.9097 -5.8830 -5.8747 -5.3832 -5.3807 -4.5829 -4.5792 -4.4466 -4.4419 -4.3869 -4.3863 -4.3365 -4.3328 -2.0667 -2.0612 -2.0577 -2.0506 -1.9172 -1.9131 -1.6080 -1.6074 -1.4317 -1.4214 -1.4135 -1.4095 -1.1758 -1.1656 -1.1020 -1.1015 -1.0581 -1.0537 -0.7345 -0.7291 0.0989 0.1019 0.3494 0.3538 0.4124 0.4162 0.4836 0.4856 0.6407 0.6459 0.7284 0.7357 8.3294 8.3296 9.9855 9.9876 10.1652 10.1760 10.4355 10.4394 10.4465 10.4521 10.9071 10.9075 k = 0.3109 0.3111-0.0000 ( 6545 PWs) bands (ev): -19.3804 -19.3804 -19.2920 -19.2916 -17.1472 -17.1420 -16.9818 -16.9809 -16.8163 -16.8160 -16.7450 -16.7401 -16.6989 -16.6983 -16.6762 -16.6761 -7.5457 -7.5456 -6.9142 -6.9115 -5.8837 -5.8754 -5.4214 -5.4188 -4.5655 -4.5620 -4.4273 -4.4225 -4.3803 -4.3794 -4.3312 -4.3275 -2.0752 -2.0701 -2.0498 -2.0428 -1.9195 -1.9150 -1.6387 -1.6381 -1.4439 -1.4341 -1.4144 -1.4096 -1.1947 -1.1847 -1.1088 -1.1084 -1.0474 -1.0434 -0.7448 -0.7396 0.1048 0.1076 0.3561 0.3606 0.4027 0.4045 0.4849 0.4884 0.6319 0.6371 0.7140 0.7214 8.4178 8.4180 9.9636 9.9656 10.1550 10.1664 10.4178 10.4209 10.4803 10.4837 10.9319 10.9329 k = 0.3220 0.3222-0.0000 ( 6549 PWs) bands (ev): -19.3722 -19.3722 -19.2915 -19.2911 -17.1444 -17.1392 -16.9958 -16.9948 -16.8170 -16.8167 -16.7487 -16.7438 -16.7004 -16.6998 -16.6770 -16.6769 -7.4962 -7.4960 -6.9160 -6.9135 -5.8848 -5.8765 -5.4605 -5.4577 -4.5490 -4.5458 -4.4087 -4.4040 -4.3725 -4.3714 -4.3253 -4.3217 -2.0848 -2.0801 -2.0399 -2.0331 -1.9218 -1.9171 -1.6683 -1.6678 -1.4568 -1.4471 -1.4156 -1.4104 -1.2140 -1.2044 -1.1157 -1.1155 -1.0357 -1.0320 -0.7561 -0.7511 0.1106 0.1132 0.3636 0.3683 0.3881 0.3885 0.4912 0.4956 0.6235 0.6288 0.7000 0.7075 8.5061 8.5063 9.9391 9.9410 10.1441 10.1559 10.4008 10.4046 10.5169 10.5198 10.9561 10.9576 k = 0.3331 0.3333-0.0000 ( 6548 PWs) bands (ev): -19.3642 -19.3642 -19.2910 -19.2906 -17.1417 -17.1365 -17.0092 -17.0083 -16.8176 -16.8173 -16.7524 -16.7476 -16.7018 -16.7013 -16.6778 -16.6777 -7.4463 -7.4461 -6.9179 -6.9154 -5.8863 -5.8781 -5.5000 -5.4971 -4.5335 -4.5306 -4.3914 -4.3868 -4.3631 -4.3618 -4.3188 -4.3154 -2.0948 -2.0904 -2.0288 -2.0221 -1.9242 -1.9192 -1.6968 -1.6963 -1.4699 -1.4604 -1.4172 -1.4117 -1.2337 -1.2247 -1.1229 -1.1228 -1.0231 -1.0198 -0.7680 -0.7632 0.1163 0.1186 0.3668 0.3696 0.3760 0.3776 0.5001 0.5048 0.6157 0.6210 0.6866 0.6941 8.5938 8.5940 9.9131 9.9149 10.1328 10.1447 10.3862 10.3906 10.5550 10.5575 10.9789 10.9809 k = 0.3442 0.3444-0.0000 ( 6544 PWs) bands (ev): -19.3565 -19.3565 -19.2906 -19.2902 -17.1390 -17.1339 -17.0223 -17.0213 -16.8182 -16.8179 -16.7559 -16.7512 -16.7033 -16.7028 -16.6786 -16.6785 -7.3962 -7.3960 -6.9197 -6.9173 -5.8884 -5.8802 -5.5399 -5.5368 -4.5193 -4.5166 -4.3757 -4.3718 -4.3514 -4.3504 -4.3119 -4.3087 -2.1048 -2.1009 -2.0165 -2.0099 -1.9265 -1.9215 -1.7239 -1.7235 -1.4830 -1.4738 -1.4192 -1.4137 -1.2538 -1.2455 -1.1306 -1.1302 -1.0098 -1.0068 -0.7803 -0.7757 0.1216 0.1237 0.3506 0.3510 0.3830 0.3865 0.5101 0.5148 0.6085 0.6137 0.6737 0.6812 8.6805 8.6807 9.8866 9.8884 10.1212 10.1331 10.3739 10.3788 10.5939 10.5959 10.9998 11.0022 k = 0.3553 0.3556-0.0000 ( 6546 PWs) bands (ev): -19.3490 -19.3490 -19.2902 -19.2898 -17.1364 -17.1314 -17.0347 -17.0337 -16.8188 -16.8185 -16.7592 -16.7547 -16.7046 -16.7042 -16.6793 -16.6793 -7.3461 -7.3460 -6.9215 -6.9193 -5.8910 -5.8829 -5.5799 -5.5765 -4.5064 -4.5040 -4.3619 -4.3589 -4.3374 -4.3371 -4.3048 -4.3017 -2.1149 -2.1113 -2.0032 -1.9967 -1.9289 -1.9239 -1.7496 -1.7492 -1.4961 -1.4872 -1.4217 -1.4161 -1.2742 -1.2666 -1.1385 -1.1378 -0.9959 -0.9933 -0.7926 -0.7883 0.1266 0.1285 0.3320 0.3320 0.3926 0.3961 0.5205 0.5251 0.6018 0.6070 0.6614 0.6688 8.7657 8.7660 9.8603 9.8620 10.1099 10.1214 10.3636 10.3688 10.6326 10.6342 11.0181 11.0208 k = 0.3664 0.3667-0.0000 ( 6544 PWs) bands (ev): -19.3419 -19.3419 -19.2898 -19.2894 -17.1340 -17.1291 -17.0466 -17.0455 -16.8194 -16.8191 -16.7624 -16.7580 -16.7059 -16.7055 -16.6800 -16.6800 -7.2963 -7.2961 -6.9233 -6.9212 -5.8944 -5.8863 -5.6195 -5.6159 -4.4948 -4.4928 -4.3494 -4.3474 -4.3226 -4.3224 -4.2974 -4.2944 -2.1249 -2.1216 -1.9890 -1.9826 -1.9313 -1.9264 -1.7736 -1.7733 -1.5088 -1.5002 -1.4244 -1.4189 -1.2949 -1.2880 -1.1466 -1.1458 -0.9817 -0.9794 -0.8047 -0.8007 0.1312 0.1327 0.3132 0.3135 0.4026 0.4061 0.5309 0.5353 0.5958 0.6008 0.6496 0.6570 8.8490 8.8494 9.8346 9.8363 10.0992 10.1103 10.3549 10.3601 10.6707 10.6719 11.0334 11.0363 k = 0.3775 0.3778-0.0000 ( 6532 PWs) bands (ev): -19.3351 -19.3351 -19.2894 -19.2891 -17.1316 -17.1269 -17.0577 -17.0566 -16.8199 -16.8196 -16.7654 -16.7612 -16.7071 -16.7067 -16.6806 -16.6806 -7.2470 -7.2468 -6.9250 -6.9231 -5.8987 -5.8906 -5.6583 -5.6545 -4.4847 -4.4829 -4.3376 -4.3364 -4.3079 -4.3073 -4.2899 -4.2871 -2.1346 -2.1316 -1.9739 -1.9678 -1.9338 -1.9290 -1.7959 -1.7957 -1.5211 -1.5129 -1.4274 -1.4221 -1.3156 -1.3095 -1.1550 -1.1539 -0.9673 -0.9652 -0.8163 -0.8126 0.1352 0.1365 0.2950 0.2955 0.4127 0.4161 0.5410 0.5452 0.5903 0.5951 0.6385 0.6458 8.9298 8.9302 9.8100 9.8116 10.0897 10.1002 10.3472 10.3524 10.7075 10.7083 11.0453 11.0482 k = 0.3887 0.3889-0.0000 ( 6532 PWs) bands (ev): -19.3288 -19.3288 -19.2890 -19.2887 -17.1294 -17.1248 -17.0681 -17.0670 -16.8203 -16.8201 -16.7682 -16.7643 -16.7082 -16.7078 -16.6812 -16.6812 -7.1985 -7.1983 -6.9267 -6.9249 -5.9042 -5.8963 -5.6956 -5.6915 -4.4758 -4.4744 -4.3263 -4.3256 -4.2935 -4.2928 -4.2825 -4.2798 -2.1440 -2.1413 -1.9582 -1.9523 -1.9363 -1.9318 -1.8164 -1.8162 -1.5328 -1.5250 -1.4304 -1.4254 -1.3365 -1.3312 -1.1635 -1.1622 -0.9530 -0.9512 -0.8272 -0.8238 0.1386 0.1396 0.2778 0.2784 0.4227 0.4261 0.5507 0.5546 0.5854 0.5901 0.6281 0.6353 9.0074 9.0079 9.7869 9.7884 10.0819 10.0917 10.3398 10.3449 10.7427 10.7431 11.0534 11.0564 k = 0.3998 0.4000-0.0000 ( 6534 PWs) bands (ev): -19.3229 -19.3229 -19.2887 -19.2884 -17.1274 -17.1230 -17.0777 -17.0765 -16.8208 -16.8206 -16.7707 -16.7671 -16.7092 -16.7089 -16.6818 -16.6818 -7.1512 -7.1511 -6.9282 -6.9266 -5.9116 -5.9039 -5.7304 -5.7262 -4.4682 -4.4670 -4.3153 -4.3150 -4.2800 -4.2795 -4.2751 -4.2723 -2.1529 -2.1504 -1.9421 -1.9387 -1.9366 -1.9344 -1.8349 -1.8348 -1.5437 -1.5364 -1.4335 -1.4288 -1.3572 -1.3527 -1.1719 -1.1705 -0.9391 -0.9374 -0.8372 -0.8342 0.1413 0.1420 0.2617 0.2624 0.4325 0.4358 0.5597 0.5634 0.5811 0.5855 0.6184 0.6254 9.0812 9.0817 9.7653 9.7667 10.0763 10.0854 10.3323 10.3371 10.7757 10.7757 11.0578 11.0607 k = 0.4109 0.4111-0.0000 ( 6554 PWs) bands (ev): -19.3175 -19.3175 -19.2884 -19.2882 -17.1256 -17.1214 -17.0864 -17.0851 -16.8212 -16.8210 -16.7730 -16.7697 -16.7102 -16.7099 -16.6823 -16.6823 -7.1056 -7.1055 -6.9297 -6.9282 -5.9214 -5.9140 -5.7616 -5.7573 -4.4618 -4.4608 -4.3049 -4.3048 -4.2692 -4.2687 -4.2664 -4.2639 -2.1612 -2.1590 -1.9416 -1.9378 -1.9255 -1.9201 -1.8513 -1.8513 -1.5536 -1.5468 -1.4365 -1.4322 -1.3778 -1.3740 -1.1801 -1.1787 -0.9257 -0.9243 -0.8463 -0.8436 0.1430 0.1435 0.2472 0.2481 0.4419 0.4451 0.5677 0.5715 0.5778 0.5815 0.6094 0.6162 9.1502 9.1507 9.7456 9.7468 10.0734 10.0818 10.3239 10.3286 10.8058 10.8060 11.0587 11.0614 k = 0.4220 0.4222-0.0000 ( 6556 PWs) bands (ev): -19.3127 -19.3127 -19.2881 -19.2879 -17.1241 -17.1200 -17.0940 -17.0926 -16.8215 -16.8213 -16.7751 -16.7721 -16.7110 -16.7107 -16.6827 -16.6827 -7.0622 -7.0621 -6.9309 -6.9296 -5.9343 -5.9276 -5.7877 -5.7837 -4.4563 -4.4555 -4.2952 -4.2951 -4.2623 -4.2613 -4.2553 -4.2537 -2.1688 -2.1668 -1.9443 -1.9411 -1.9091 -1.9041 -1.8656 -1.8654 -1.5624 -1.5563 -1.4394 -1.4356 -1.3977 -1.3948 -1.1880 -1.1866 -0.9131 -0.9119 -0.8543 -0.8519 0.1438 0.1441 0.2346 0.2355 0.4508 0.4538 0.5716 0.5766 0.5783 0.5800 0.6014 0.6078 9.2138 9.2143 9.7278 9.7290 10.0737 10.0814 10.3142 10.3187 10.8329 10.8334 11.0565 11.0590 k = 0.4331 0.4333-0.0000 ( 6548 PWs) bands (ev): -19.3084 -19.3084 -19.2879 -19.2877 -17.1230 -17.1191 -17.1006 -17.0991 -16.8218 -16.8217 -16.7769 -16.7743 -16.7117 -16.7115 -16.6831 -16.6831 -7.0217 -7.0216 -6.9321 -6.9309 -5.9505 -5.9447 -5.8079 -5.8046 -4.4518 -4.4511 -4.2864 -4.2862 -4.2564 -4.2553 -4.2452 -4.2438 -2.1755 -2.1739 -1.9472 -1.9444 -1.8932 -1.8889 -1.8775 -1.8770 -1.5700 -1.5645 -1.4422 -1.4391 -1.4166 -1.4146 -1.1952 -1.1939 -0.9015 -0.9005 -0.8612 -0.8592 0.1435 0.1435 0.2242 0.2251 0.4590 0.4620 0.5698 0.5739 0.5840 0.5857 0.5945 0.6002 9.2708 9.2714 9.7122 9.7132 10.0777 10.0846 10.3028 10.3071 10.8568 10.8574 11.0520 11.0542 k = 0.4442 0.4444-0.0000 ( 6548 PWs) bands (ev): -19.3047 -19.3047 -19.2877 -19.2875 -17.1223 -17.1187 -17.1058 -17.1042 -16.8221 -16.8219 -16.7784 -16.7762 -16.7123 -16.7122 -16.6834 -16.6834 -6.9849 -6.9848 -6.9331 -6.9321 -5.9690 -5.9644 -5.8224 -5.8199 -4.4481 -4.4476 -4.2786 -4.2784 -4.2512 -4.2502 -4.2364 -4.2353 -2.1814 -2.1800 -1.9501 -1.9479 -1.8877 -1.8876 -1.8776 -1.8732 -1.5762 -1.5714 -1.4454 -1.4440 -1.4328 -1.4324 -1.2017 -1.2005 -0.8913 -0.8904 -0.8670 -0.8653 0.1421 0.1422 0.2160 0.2169 0.4666 0.4693 0.5674 0.5708 0.5872 0.5895 0.5925 0.5939 9.3205 9.3211 9.6989 9.6997 10.0855 10.0917 10.2893 10.2934 10.8771 10.8778 11.0460 11.0478 k = 0.4553 0.4556-0.0000 ( 6548 PWs) bands (ev): -19.3017 -19.3017 -19.2875 -19.2874 -17.1223 -17.1193 -17.1093 -17.1079 -16.8223 -16.8222 -16.7796 -16.7778 -16.7129 -16.7127 -16.6837 -16.6837 -6.9526 -6.9526 -6.9338 -6.9331 -5.9881 -5.9847 -5.8324 -5.8306 -4.4451 -4.4447 -4.2719 -4.2717 -4.2468 -4.2460 -4.2290 -4.2281 -2.1863 -2.1852 -1.9530 -1.9513 -1.8951 -1.8949 -1.8639 -1.8603 -1.5810 -1.5769 -1.4550 -1.4537 -1.4429 -1.4407 -1.2073 -1.2062 -0.8826 -0.8818 -0.8717 -0.8704 0.1399 0.1401 0.2100 0.2109 0.4732 0.4756 0.5652 0.5678 0.5830 0.5875 0.5952 0.5966 9.3621 9.3626 9.6878 9.6885 10.0972 10.1028 10.2737 10.2776 10.8937 10.8944 11.0394 11.0409 k = 0.4664 0.4667-0.0000 ( 6552 PWs) bands (ev): -19.2993 -19.2993 -19.2874 -19.2873 -17.1229 -17.1208 -17.1110 -17.1101 -16.8224 -16.8224 -16.7805 -16.7791 -16.7133 -16.7131 -16.6839 -16.6839 -6.9346 -6.9340 -6.9258 -6.9257 -6.0057 -6.0033 -5.8389 -5.8378 -4.4429 -4.4426 -4.2666 -4.2664 -4.2432 -4.2426 -4.2232 -4.2225 -2.1902 -2.1894 -1.9556 -1.9544 -1.9007 -1.9004 -1.8520 -1.8491 -1.5843 -1.5810 -1.4682 -1.4670 -1.4457 -1.4437 -1.2118 -1.2109 -0.8761 -0.8750 -0.8746 -0.8742 0.1374 0.1376 0.2060 0.2067 0.4788 0.4808 0.5632 0.5649 0.5797 0.5830 0.5991 0.6002 9.3950 9.3954 9.6792 9.6797 10.1123 10.1172 10.2562 10.2599 10.9067 10.9072 11.0332 11.0343 k = 0.4775 0.4778-0.0000 ( 6560 PWs) bands (ev): -19.2975 -19.2975 -19.2873 -19.2872 -17.1239 -17.1226 -17.1115 -17.1111 -16.8226 -16.8225 -16.7811 -16.7801 -16.7135 -16.7135 -16.6841 -16.6841 -6.9349 -6.9345 -6.9057 -6.9057 -6.0198 -6.0183 -5.8430 -5.8423 -4.4413 -4.4411 -4.2627 -4.2625 -4.2406 -4.2402 -4.2189 -4.2185 -2.1930 -2.1924 -1.9576 -1.9568 -1.9044 -1.9042 -1.8426 -1.8407 -1.5862 -1.5839 -1.4791 -1.4783 -1.4469 -1.4456 -1.2150 -1.2144 -0.8779 -0.8771 -0.8702 -0.8699 0.1352 0.1354 0.2036 0.2041 0.4832 0.4847 0.5615 0.5624 0.5776 0.5797 0.6020 0.6028 9.4187 9.4190 9.6729 9.6733 10.1296 10.1339 10.2376 10.2411 10.9158 10.9163 11.0281 11.0288 k = 0.4886 0.4889-0.0000 ( 6572 PWs) bands (ev): -19.2965 -19.2965 -19.2872 -19.2872 -17.1246 -17.1240 -17.1117 -17.1115 -16.8226 -16.8226 -16.7813 -16.7809 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9349 -6.8931 -6.8931 -6.0289 -6.0281 -5.8452 -5.8449 -4.4403 -4.4402 -4.2602 -4.2602 -4.2390 -4.2388 -4.2163 -4.2161 -2.1946 -2.1943 -1.9589 -1.9585 -1.9066 -1.9064 -1.8365 -1.8355 -1.5869 -1.5857 -1.4861 -1.4857 -1.4475 -1.4468 -1.2170 -1.2167 -0.8793 -0.8789 -0.8670 -0.8668 0.1337 0.1338 0.2023 0.2025 0.4862 0.4870 0.5603 0.5607 0.5765 0.5776 0.6039 0.6043 9.4331 9.4333 9.6692 9.6694 10.1468 10.1498 10.2206 10.2233 10.9214 10.9216 11.0249 11.0252 k = 0.4997 0.5000-0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7812 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8339 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2176 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1568 10.1569 10.2131 10.2132 10.9234 10.9234 11.0238 11.0238 k = 0.4997 0.5000-0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7812 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8339 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2176 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1568 10.1569 10.2131 10.2132 10.9234 10.9234 11.0238 11.0238 k = 0.4841 0.5000-0.0000 ( 6572 PWs) bands (ev): -19.2963 -19.2963 -19.2873 -19.2873 -17.1248 -17.1243 -17.1114 -17.1113 -16.8226 -16.8226 -16.7813 -16.7808 -16.7137 -16.7137 -16.6842 -16.6842 -6.9373 -6.9370 -6.8906 -6.8905 -6.0304 -6.0297 -5.8440 -5.8438 -4.4404 -4.4403 -4.2602 -4.2601 -4.2392 -4.2389 -4.2159 -4.2158 -2.1947 -2.1945 -1.9591 -1.9583 -1.9087 -1.9077 -1.8343 -1.8334 -1.5860 -1.5850 -1.4902 -1.4865 -1.4480 -1.4434 -1.2170 -1.2166 -0.8819 -0.8814 -0.8649 -0.8643 0.1335 0.1336 0.2026 0.2028 0.4869 0.4874 0.5598 0.5601 0.5760 0.5768 0.6044 0.6049 9.4356 9.4358 9.6651 9.6653 10.1513 10.1537 10.2173 10.2195 10.9227 10.9229 11.0239 11.0249 k = 0.4685 0.5000-0.0000 ( 6560 PWs) bands (ev): -19.2970 -19.2969 -19.2878 -19.2878 -17.1246 -17.1236 -17.1105 -17.1103 -16.8226 -16.8225 -16.7811 -16.7801 -16.7136 -16.7135 -16.6841 -16.6841 -6.9434 -6.9428 -6.8960 -6.8957 -6.0254 -6.0242 -5.8385 -5.8381 -4.4418 -4.4416 -4.2626 -4.2624 -4.2415 -4.2408 -4.2175 -4.2171 -2.1935 -2.1930 -1.9579 -1.9565 -1.9119 -1.9101 -1.8342 -1.8326 -1.5829 -1.5809 -1.4912 -1.4848 -1.4445 -1.4363 -1.2150 -1.2143 -0.8869 -0.8862 -0.8627 -0.8619 0.1346 0.1348 0.2048 0.2051 0.4856 0.4867 0.5595 0.5601 0.5753 0.5769 0.6041 0.6051 9.4287 9.4290 9.6565 9.6569 10.1413 10.1448 10.2289 10.2320 10.9211 10.9214 11.0252 11.0272 k = 0.4529 0.5000-0.0000 ( 6556 PWs) bands (ev): -19.2980 -19.2979 -19.2886 -19.2886 -17.1240 -17.1226 -17.1090 -17.1088 -16.8226 -16.8225 -16.7806 -16.7791 -16.7134 -16.7132 -16.6839 -16.6839 -6.9533 -6.9524 -6.9047 -6.9043 -6.0172 -6.0154 -5.8294 -5.8288 -4.4441 -4.4438 -4.2664 -4.2661 -4.2451 -4.2442 -4.2199 -4.2194 -2.1913 -2.1907 -1.9558 -1.9537 -1.9164 -1.9141 -1.8339 -1.8318 -1.5776 -1.5745 -1.4915 -1.4838 -1.4369 -1.4265 -1.2116 -1.2107 -0.8934 -0.8926 -0.8605 -0.8596 0.1364 0.1366 0.2084 0.2089 0.4839 0.4855 0.5588 0.5600 0.5744 0.5769 0.6038 0.6053 9.4177 9.4181 9.6424 9.6430 10.1301 10.1343 10.2437 10.2472 10.9186 10.9190 11.0277 11.0304 k = 0.4372 0.5000-0.0000 ( 6548 PWs) bands (ev): -19.2994 -19.2993 -19.2897 -19.2896 -17.1232 -17.1214 -17.1070 -17.1067 -16.8225 -16.8224 -16.7798 -16.7778 -16.7130 -16.7128 -16.6836 -16.6836 -6.9666 -6.9655 -6.9165 -6.9160 -6.0059 -6.0035 -5.8169 -5.8161 -4.4473 -4.4468 -4.2716 -4.2712 -4.2502 -4.2489 -4.2233 -4.2226 -2.1884 -2.1876 -1.9528 -1.9501 -1.9217 -1.9192 -1.8337 -1.8312 -1.5704 -1.5661 -1.4909 -1.4830 -1.4257 -1.4142 -1.2070 -1.2058 -0.9008 -0.9001 -0.8588 -0.8578 0.1388 0.1391 0.2133 0.2139 0.4818 0.4838 0.5577 0.5596 0.5733 0.5769 0.6036 0.6055 9.4028 9.4033 9.6230 9.6238 10.1194 10.1239 10.2598 10.2634 10.9156 10.9160 11.0310 11.0344 k = 0.4216 0.5000-0.0000 ( 6548 PWs) bands (ev): -19.3011 -19.3011 -19.2911 -19.2910 -17.1221 -17.1200 -17.1044 -17.1041 -16.8224 -16.8223 -16.7786 -16.7763 -16.7126 -16.7124 -16.6833 -16.6833 -6.9828 -6.9816 -6.9313 -6.9307 -5.9918 -5.9889 -5.8014 -5.8005 -4.4512 -4.4507 -4.2783 -4.2778 -4.2566 -4.2550 -4.2274 -4.2265 -2.1847 -2.1837 -1.9492 -1.9460 -1.9269 -1.9249 -1.8337 -1.8309 -1.5616 -1.5560 -1.4891 -1.4818 -1.4115 -1.3996 -1.2012 -1.1997 -0.9091 -0.9084 -0.8577 -0.8565 0.1418 0.1422 0.2195 0.2203 0.4794 0.4818 0.5561 0.5589 0.5723 0.5769 0.6033 0.6056 9.3844 9.3850 9.5987 9.5995 10.1094 10.1141 10.2762 10.2798 10.9122 10.9127 11.0347 11.0387 k = 0.4060 0.5000-0.0000 ( 6548 PWs) bands (ev): -19.3032 -19.3031 -19.2928 -19.2927 -17.1206 -17.1183 -17.1013 -17.1010 -16.8223 -16.8221 -16.7772 -16.7745 -16.7120 -16.7118 -16.6829 -16.6829 -7.0017 -7.0003 -6.9487 -6.9481 -5.9752 -5.9719 -5.7832 -5.7822 -4.4560 -4.4553 -4.2862 -4.2856 -4.2643 -4.2624 -4.2322 -4.2312 -2.1804 -2.1793 -1.9459 -1.9422 -1.9305 -1.9302 -1.8341 -1.8311 -1.5521 -1.5451 -1.4859 -1.4792 -1.3949 -1.3829 -1.1944 -1.1926 -0.9180 -0.9173 -0.8571 -0.8559 0.1453 0.1457 0.2269 0.2277 0.4770 0.4796 0.5540 0.5576 0.5714 0.5769 0.6032 0.6056 9.3630 9.3638 9.5699 9.5708 10.1003 10.1052 10.2926 10.2962 10.9089 10.9093 11.0383 11.0426 k = 0.3904 0.5000-0.0000 ( 6546 PWs) bands (ev): -19.3056 -19.3055 -19.2948 -19.2947 -17.1189 -17.1163 -17.0979 -17.0975 -16.8221 -16.8220 -16.7756 -16.7725 -16.7114 -16.7111 -16.6825 -16.6824 -7.0227 -7.0213 -6.9685 -6.9678 -5.9564 -5.9527 -5.7627 -5.7615 -4.4615 -4.4608 -4.2954 -4.2947 -4.2732 -4.2710 -4.2377 -4.2365 -2.1756 -2.1743 -1.9460 -1.9415 -1.9320 -1.9290 -1.8348 -1.8316 -1.5429 -1.5346 -1.4802 -1.4742 -1.3765 -1.3645 -1.1866 -1.1847 -0.9274 -0.9268 -0.8571 -0.8557 0.1490 0.1495 0.2352 0.2362 0.4746 0.4776 0.5514 0.5557 0.5707 0.5769 0.6030 0.6057 9.3391 9.3399 9.5372 9.5380 10.0919 10.0970 10.3086 10.3122 10.9057 10.9061 11.0411 11.0455 k = 0.3748 0.5000-0.0000 ( 6544 PWs) bands (ev): -19.3082 -19.3082 -19.2970 -19.2969 -17.1169 -17.1141 -17.0940 -17.0936 -16.8219 -16.8218 -16.7736 -16.7703 -16.7106 -16.7102 -16.6819 -16.6819 -7.0455 -7.0440 -6.9902 -6.9895 -5.9357 -5.9317 -5.7401 -5.7389 -4.4677 -4.4669 -4.3057 -4.3049 -4.2831 -4.2807 -4.2438 -4.2425 -2.1705 -2.1691 -1.9495 -1.9453 -1.9275 -1.9232 -1.8358 -1.8325 -1.5349 -1.5260 -1.4713 -1.4660 -1.3566 -1.3447 -1.1781 -1.1760 -0.9371 -0.9367 -0.8576 -0.8560 0.1529 0.1534 0.2445 0.2454 0.4725 0.4758 0.5485 0.5533 0.5702 0.5769 0.6030 0.6058 9.3130 9.3139 9.5011 9.5020 10.0841 10.0893 10.3242 10.3278 10.9029 10.9032 11.0424 11.0468 k = 0.3592 0.5000-0.0000 ( 6540 PWs) bands (ev): -19.3112 -19.3111 -19.2995 -19.2993 -17.1147 -17.1118 -17.0899 -17.0893 -16.8216 -16.8215 -16.7715 -16.7679 -16.7096 -16.7093 -16.6814 -16.6813 -7.0696 -7.0681 -7.0135 -7.0129 -5.9135 -5.9092 -5.7159 -5.7146 -4.4746 -4.4737 -4.3170 -4.3161 -4.2940 -4.2914 -4.2505 -4.2490 -2.1653 -2.1638 -1.9533 -1.9497 -1.9204 -1.9159 -1.8369 -1.8335 -1.5288 -1.5201 -1.4586 -1.4543 -1.3358 -1.3240 -1.1690 -1.1667 -0.9469 -0.9466 -0.8583 -0.8565 0.1567 0.1574 0.2543 0.2554 0.4710 0.4744 0.5454 0.5505 0.5696 0.5766 0.6030 0.6061 9.2852 9.2862 9.4624 9.4632 10.0766 10.0819 10.3395 10.3430 10.9006 10.9008 11.0417 11.0458 k = 0.3435 0.5000-0.0000 ( 6537 PWs) bands (ev): -19.3143 -19.3142 -19.3021 -19.3020 -17.1123 -17.1093 -17.0855 -17.0848 -16.8214 -16.8212 -16.7691 -16.7653 -16.7085 -16.7082 -16.6807 -16.6806 -7.0949 -7.0933 -7.0382 -7.0376 -5.8901 -5.8855 -5.6904 -5.6890 -4.4821 -4.4811 -4.3293 -4.3283 -4.3058 -4.3030 -4.2576 -4.2560 -2.1602 -2.1586 -1.9564 -1.9532 -1.9123 -1.9076 -1.8381 -1.8345 -1.5244 -1.5164 -1.4430 -1.4398 -1.3143 -1.3026 -1.1594 -1.1571 -0.9566 -0.9564 -0.8592 -0.8571 0.1602 0.1610 0.2647 0.2657 0.4701 0.4738 0.5421 0.5474 0.5691 0.5761 0.6033 0.6065 9.2561 9.2572 9.4214 9.4222 10.0693 10.0747 10.3542 10.3577 10.8987 10.8988 11.0386 11.0423 k = 0.3279 0.5000-0.0000 ( 6540 PWs) bands (ev): -19.3176 -19.3175 -19.3050 -19.3048 -17.1098 -17.1066 -17.0809 -17.0801 -16.8210 -16.8209 -16.7666 -16.7627 -16.7073 -16.7069 -16.6799 -16.6799 -7.1208 -7.1193 -7.0639 -7.0632 -5.8656 -5.8609 -5.6637 -5.6623 -4.4901 -4.4891 -4.3425 -4.3414 -4.3182 -4.3153 -4.2653 -4.2636 -2.1554 -2.1537 -1.9584 -1.9556 -1.9034 -1.8987 -1.8392 -1.8354 -1.5212 -1.5141 -1.4259 -1.4234 -1.2927 -1.2811 -1.1496 -1.1471 -0.9658 -0.9657 -0.8602 -0.8577 0.1632 0.1642 0.2753 0.2764 0.4702 0.4741 0.5387 0.5442 0.5684 0.5754 0.6037 0.6071 9.2260 9.2271 9.3790 9.3797 10.0621 10.0675 10.3686 10.3721 10.8971 10.8974 11.0332 11.0365 k = 0.3123 0.5000-0.0000 ( 6544 PWs) bands (ev): -19.3211 -19.3210 -19.3080 -19.3078 -17.1071 -17.1039 -17.0761 -17.0752 -16.8207 -16.8205 -16.7640 -16.7600 -16.7059 -16.7055 -16.6791 -16.6790 -7.1472 -7.1457 -7.0902 -7.0895 -5.8405 -5.8356 -5.6363 -5.6348 -4.4986 -4.4975 -4.3564 -4.3552 -4.3312 -4.3282 -4.2733 -4.2715 -2.1513 -2.1495 -1.9588 -1.9564 -1.8939 -1.8894 -1.8400 -1.8360 -1.5187 -1.5125 -1.4083 -1.4062 -1.2714 -1.2600 -1.1397 -1.1370 -0.9742 -0.9739 -0.8610 -0.8581 0.1655 0.1666 0.2860 0.2870 0.4712 0.4755 0.5354 0.5410 0.5676 0.5745 0.6044 0.6081 9.1952 9.1964 9.3355 9.3361 10.0549 10.0604 10.3826 10.3860 10.8958 10.8963 11.0257 11.0288 k = 0.2967 0.5000-0.0000 ( 6548 PWs) bands (ev): -19.3247 -19.3246 -19.3111 -19.3109 -17.1044 -17.1011 -17.0712 -17.0702 -16.8203 -16.8200 -16.7613 -16.7572 -16.7043 -16.7039 -16.6783 -16.6782 -7.1737 -7.1723 -7.1168 -7.1162 -5.8149 -5.8098 -5.6083 -5.6068 -4.5075 -4.5064 -4.3710 -4.3697 -4.3446 -4.3415 -4.2817 -4.2798 -2.1479 -2.1462 -1.9578 -1.9555 -1.8840 -1.8799 -1.8401 -1.8360 -1.5167 -1.5113 -1.3912 -1.3889 -1.2511 -1.2401 -1.1297 -1.1266 -0.9811 -0.9806 -0.8615 -0.8582 0.1668 0.1681 0.2965 0.2975 0.4735 0.4781 0.5322 0.5378 0.5667 0.5735 0.6054 0.6093 9.1640 9.1652 9.2915 9.2921 10.0478 10.0533 10.3964 10.3997 10.8947 10.8954 11.0166 11.0195 k = 0.2811 0.5000-0.0000 ( 6552 PWs) bands (ev): -19.3283 -19.3282 -19.3143 -19.3141 -17.1016 -17.0983 -17.0663 -17.0651 -16.8199 -16.8196 -16.7585 -16.7544 -16.7025 -16.7022 -16.6773 -16.6772 -7.2002 -7.1988 -7.1436 -7.1430 -5.7890 -5.7838 -5.5799 -5.5784 -4.5167 -4.5155 -4.3861 -4.3847 -4.3582 -4.3551 -4.2904 -4.2884 -2.1454 -2.1437 -1.9553 -1.9529 -1.8739 -1.8707 -1.8392 -1.8350 -1.5149 -1.5101 -1.3751 -1.3726 -1.2327 -1.2225 -1.1197 -1.1158 -0.9859 -0.9852 -0.8615 -0.8577 0.1670 0.1685 0.3065 0.3075 0.4769 0.4819 0.5293 0.5348 0.5659 0.5724 0.6068 0.6109 9.1327 9.1338 9.2474 9.2480 10.0408 10.0463 10.4099 10.4131 10.8937 10.8947 11.0063 11.0092 k = 0.2655 0.5000-0.0000 ( 6546 PWs) bands (ev): -19.3321 -19.3319 -19.3175 -19.3173 -17.0988 -17.0956 -17.0614 -17.0601 -16.8195 -16.8190 -16.7557 -16.7517 -16.7006 -16.7003 -16.6763 -16.6762 -7.2264 -7.2251 -7.1702 -7.1696 -5.7630 -5.7578 -5.5514 -5.5499 -4.5261 -4.5249 -4.4017 -4.4002 -4.3720 -4.3689 -4.2992 -4.2972 -2.1439 -2.1423 -1.9514 -1.9489 -1.8641 -1.8624 -1.8366 -1.8321 -1.5132 -1.5090 -1.3605 -1.3579 -1.2175 -1.2084 -1.1090 -1.1040 -0.9880 -0.9870 -0.8610 -0.8566 0.1661 0.1678 0.3160 0.3169 0.4814 0.4869 0.5266 0.5321 0.5652 0.5714 0.6086 0.6129 9.1013 9.1025 9.2037 9.2043 10.0339 10.0394 10.4232 10.4263 10.8926 10.8939 10.9954 10.9985 k = 0.2498 0.5000-0.0000 ( 6538 PWs) bands (ev): -19.3358 -19.3357 -19.3208 -19.3206 -17.0961 -17.0929 -17.0564 -17.0551 -16.8190 -16.8185 -16.7529 -16.7491 -16.6984 -16.6982 -16.6753 -16.6751 -7.2521 -7.2509 -7.1964 -7.1959 -5.7372 -5.7319 -5.5228 -5.5214 -4.5357 -4.5344 -4.4177 -4.4161 -4.3858 -4.3827 -4.3081 -4.3061 -2.1434 -2.1417 -1.9464 -1.9437 -1.8557 -1.8552 -1.8315 -1.8265 -1.5116 -1.5079 -1.3478 -1.3451 -1.2068 -1.1993 -1.0967 -1.0903 -0.9870 -0.9857 -0.8597 -0.8546 0.1639 0.1658 0.3246 0.3255 0.4868 0.4928 0.5244 0.5297 0.5649 0.5708 0.6108 0.6154 9.0702 9.0714 9.1609 9.1614 10.0272 10.0327 10.4363 10.4393 10.8913 10.8929 10.9843 10.9878 k = 0.2342 0.5000-0.0000 ( 6538 PWs) bands (ev): -19.3395 -19.3394 -19.3240 -19.3238 -17.0933 -17.0902 -17.0516 -17.0502 -16.8185 -16.8180 -16.7503 -16.7466 -16.6961 -16.6960 -16.6742 -16.6740 -7.2772 -7.2760 -7.2221 -7.2215 -5.7116 -5.7063 -5.4945 -5.4930 -4.5454 -4.5441 -4.4339 -4.4323 -4.3995 -4.3965 -4.3170 -4.3150 -2.1436 -2.1420 -1.9409 -1.9378 -1.8500 -1.8479 -1.8236 -1.8180 -1.5099 -1.5066 -1.3374 -1.3348 -1.2018 -1.1957 -1.0819 -1.0745 -0.9830 -0.9812 -0.8576 -0.8518 0.1607 0.1626 0.3322 0.3331 0.4927 0.4992 0.5226 0.5277 0.5652 0.5707 0.6136 0.6183 9.0395 9.0407 9.1193 9.1197 10.0208 10.0262 10.4492 10.4521 10.8898 10.8918 10.9735 10.9775 k = 0.2186 0.5000-0.0000 ( 6528 PWs) bands (ev): -19.3431 -19.3430 -19.3273 -19.3271 -17.0907 -17.0877 -17.0469 -17.0455 -16.8180 -16.8174 -16.7477 -16.7442 -16.6937 -16.6936 -16.6730 -16.6728 -7.3014 -7.3003 -7.2469 -7.2464 -5.6865 -5.6812 -5.4665 -5.4651 -4.5551 -4.5537 -4.4503 -4.4486 -4.4130 -4.4101 -4.3259 -4.3239 -2.1445 -2.1430 -1.9353 -1.9318 -1.8444 -1.8412 -1.8133 -1.8075 -1.5083 -1.5054 -1.3293 -1.3269 -1.2021 -1.1973 -1.0647 -1.0567 -0.9765 -0.9739 -0.8547 -0.8481 0.1563 0.1584 0.3388 0.3397 0.4985 0.5056 0.5213 0.5262 0.5664 0.5716 0.6170 0.6217 9.0092 9.0103 9.0794 9.0798 10.0148 10.0201 10.4619 10.4647 10.8879 10.8904 10.9634 10.9681 k = 0.2030 0.5000-0.0000 ( 6526 PWs) bands (ev): -19.3466 -19.3465 -19.3304 -19.3302 -17.0882 -17.0853 -17.0424 -17.0410 -16.8175 -16.8169 -16.7452 -16.7420 -16.6912 -16.6910 -16.6718 -16.6716 -7.3246 -7.3236 -7.2708 -7.2703 -5.6620 -5.6568 -5.4391 -5.4376 -4.5647 -4.5633 -4.4666 -4.4650 -4.4262 -4.4235 -4.3346 -4.3326 -2.1458 -2.1445 -1.9300 -1.9264 -1.8378 -1.8341 -1.8016 -1.7959 -1.5068 -1.5041 -1.3237 -1.3216 -1.2069 -1.2031 -1.0457 -1.0377 -0.9681 -0.9643 -0.8509 -0.8436 0.1511 0.1532 0.3442 0.3451 0.5036 0.5112 0.5206 0.5253 0.5690 0.5737 0.6210 0.6257 8.9795 8.9805 9.0416 9.0420 10.0093 10.0144 10.4745 10.4771 10.8857 10.8887 10.9543 10.9596 k = 0.1874 0.5000-0.0000 ( 6526 PWs) bands (ev): -19.3500 -19.3499 -19.3335 -19.3333 -17.0858 -17.0830 -17.0381 -17.0367 -16.8169 -16.8163 -16.7430 -16.7400 -16.6886 -16.6883 -16.6706 -16.6704 -7.3467 -7.3457 -7.2936 -7.2931 -5.6383 -5.6332 -5.4123 -5.4109 -4.5742 -4.5727 -4.4829 -4.4813 -4.4389 -4.4364 -4.3431 -4.3411 -2.1476 -2.1463 -1.9255 -1.9219 -1.8297 -1.8258 -1.7892 -1.7836 -1.5053 -1.5029 -1.3205 -1.3186 -1.2150 -1.2118 -1.0258 -1.0185 -0.9583 -0.9530 -0.8464 -0.8382 0.1451 0.1472 0.3485 0.3493 0.5074 0.5146 0.5212 0.5251 0.5733 0.5774 0.6256 0.6302 8.9503 8.9513 9.0063 9.0067 10.0042 10.0092 10.4868 10.4893 10.8834 10.8869 10.9463 10.9521 k = 0.1718 0.5000-0.0000 ( 6526 PWs) bands (ev): -19.3533 -19.3532 -19.3364 -19.3362 -17.0835 -17.0809 -17.0341 -17.0327 -16.8164 -16.8158 -16.7409 -16.7381 -16.6859 -16.6856 -16.6694 -16.6692 -7.3675 -7.3666 -7.3151 -7.3146 -5.6156 -5.6106 -5.3864 -5.3851 -4.5834 -4.5819 -4.4990 -4.4974 -4.4511 -4.4488 -4.3512 -4.3493 -2.1495 -2.1483 -1.9219 -1.9185 -1.8198 -1.8160 -1.7764 -1.7710 -1.5039 -1.5017 -1.3195 -1.3179 -1.2251 -1.2225 -1.0060 -1.0000 -0.9474 -0.9403 -0.8413 -0.8323 0.1386 0.1406 0.3517 0.3525 0.5097 0.5153 0.5232 0.5256 0.5792 0.5827 0.6307 0.6351 8.9217 8.9226 8.9740 8.9743 9.9997 10.0045 10.4989 10.5012 10.8813 10.8852 10.9394 10.9457 k = 0.1562 0.5000-0.0000 ( 6527 PWs) bands (ev): -19.3563 -19.3562 -19.3392 -19.3390 -17.0814 -17.0790 -17.0303 -17.0289 -16.8159 -16.8153 -16.7389 -16.7365 -16.6833 -16.6829 -16.6682 -16.6680 -7.3869 -7.3861 -7.3351 -7.3347 -5.5939 -5.5892 -5.3615 -5.3603 -4.5923 -4.5908 -4.5147 -4.5131 -4.4627 -4.4606 -4.3589 -4.3571 -2.1516 -2.1505 -1.9193 -1.9161 -1.8085 -1.8049 -1.7634 -1.7584 -1.5027 -1.5007 -1.3204 -1.3190 -1.2366 -1.2344 -0.9871 -0.9829 -0.9357 -0.9266 -0.8356 -0.8259 0.1317 0.1337 0.3539 0.3548 0.5106 0.5146 0.5250 0.5266 0.5866 0.5895 0.6362 0.6404 8.8939 8.8947 8.9448 8.9450 9.9957 10.0002 10.5106 10.5127 10.8796 10.8838 10.9337 10.9400 k = 0.1405 0.5000-0.0000 ( 6522 PWs) bands (ev): -19.3592 -19.3591 -19.3417 -19.3416 -17.0794 -17.0772 -17.0268 -17.0255 -16.8154 -16.8148 -16.7372 -16.7350 -16.6807 -16.6803 -16.6670 -16.6668 -7.4048 -7.4041 -7.3537 -7.3533 -5.5736 -5.5691 -5.3379 -5.3367 -4.6008 -4.5993 -4.5299 -4.5284 -4.4736 -4.4717 -4.3661 -4.3645 -2.1536 -2.1526 -1.9175 -1.9146 -1.7961 -1.7928 -1.7506 -1.7458 -1.5017 -1.4998 -1.3231 -1.3218 -1.2487 -1.2469 -0.9701 -0.9676 -0.9232 -0.9120 -0.8298 -0.8194 0.1247 0.1266 0.3553 0.3562 0.5107 0.5136 0.5262 0.5277 0.5948 0.5971 0.6420 0.6460 8.8672 8.8679 8.9187 8.9189 9.9922 9.9965 10.5219 10.5238 10.8787 10.8829 10.9289 10.9350 k = 0.1249 0.5000-0.0000 ( 6530 PWs) bands (ev): -19.3618 -19.3617 -19.3441 -19.3440 -17.0776 -17.0756 -17.0236 -17.0224 -16.8149 -16.8143 -16.7357 -16.7338 -16.6782 -16.6777 -16.6659 -16.6657 -7.4211 -7.4204 -7.3706 -7.3702 -5.5547 -5.5505 -5.3158 -5.3147 -4.6088 -4.6073 -4.5445 -4.5429 -4.4835 -4.4819 -4.3728 -4.3712 -2.1556 -2.1547 -1.9163 -1.9138 -1.7831 -1.7802 -1.7380 -1.7335 -1.5010 -1.4992 -1.3272 -1.3260 -1.2609 -1.2594 -0.9556 -0.9545 -0.9097 -0.8969 -0.8239 -0.8130 0.1178 0.1195 0.3560 0.3569 0.5102 0.5124 0.5270 0.5285 0.6034 0.6052 0.6480 0.6516 8.8421 8.8426 8.8957 8.8959 9.9893 9.9932 10.5327 10.5343 10.8787 10.8829 10.9251 10.9305 k = 0.1093 0.5000-0.0000 ( 6536 PWs) bands (ev): -19.3642 -19.3641 -19.3463 -19.3461 -17.0760 -17.0742 -17.0208 -17.0197 -16.8145 -16.8139 -16.7343 -16.7327 -16.6758 -16.6754 -16.6648 -16.6646 -7.4356 -7.4351 -7.3857 -7.3854 -5.5374 -5.5336 -5.2953 -5.2943 -4.6162 -4.6148 -4.5581 -4.5566 -4.4926 -4.4912 -4.3788 -4.3774 -2.1574 -2.1566 -1.9156 -1.9135 -1.7700 -1.7675 -1.7258 -1.7217 -1.5005 -1.4988 -1.3323 -1.3310 -1.2727 -1.2716 -0.9438 -0.9432 -0.8956 -0.8818 -0.8184 -0.8070 0.1111 0.1127 0.3563 0.3571 0.5095 0.5112 0.5276 0.5290 0.6117 0.6132 0.6539 0.6571 8.8190 8.8194 8.8756 8.8757 9.9869 9.9905 10.5427 10.5441 10.8798 10.8836 10.9222 10.9264 k = 0.0937 0.5000-0.0000 ( 6536 PWs) bands (ev): -19.3663 -19.3662 -19.3482 -19.3481 -17.0746 -17.0731 -17.0183 -17.0173 -16.8140 -16.8136 -16.7332 -16.7318 -16.6737 -16.6732 -16.6638 -16.6637 -7.4484 -7.4480 -7.3990 -7.3987 -5.5220 -5.5186 -5.2768 -5.2759 -4.6228 -4.6216 -4.5706 -4.5692 -4.5006 -4.4994 -4.3841 -4.3829 -2.1591 -2.1584 -1.9152 -1.9134 -1.7573 -1.7551 -1.7142 -1.7106 -1.5004 -1.4988 -1.3380 -1.3367 -1.2839 -1.2829 -0.9345 -0.9338 -0.8814 -0.8673 -0.8133 -0.8017 0.1049 0.1063 0.3562 0.3569 0.5086 0.5099 0.5281 0.5294 0.6196 0.6207 0.6596 0.6624 8.7983 8.7986 8.8582 8.8584 9.9850 9.9881 10.5520 10.5532 10.8816 10.8852 10.9205 10.9229 k = 0.0781 0.5000-0.0000 ( 6543 PWs) bands (ev): -19.3681 -19.3680 -19.3498 -19.3497 -17.0734 -17.0721 -17.0161 -17.0153 -16.8137 -16.8133 -16.7322 -16.7310 -16.6717 -16.6713 -16.6630 -16.6628 -7.4594 -7.4590 -7.4103 -7.4101 -5.5085 -5.5056 -5.2605 -5.2597 -4.6286 -4.6276 -4.5817 -4.5805 -4.5075 -4.5065 -4.3886 -4.3876 -2.1605 -2.1600 -1.9150 -1.9136 -1.7454 -1.7436 -1.7035 -1.7004 -1.5006 -1.4992 -1.3439 -1.3426 -1.2939 -1.2932 -0.9270 -0.9263 -0.8678 -0.8540 -0.8089 -0.7973 0.0993 0.1005 0.3558 0.3565 0.5077 0.5087 0.5285 0.5296 0.6267 0.6275 0.6648 0.6671 8.7803 8.7805 8.8436 8.8438 9.9836 9.9862 10.5602 10.5612 10.8837 10.8875 10.9203 10.9206 k = 0.0625 0.5000-0.0000 ( 6547 PWs) bands (ev): -19.3695 -19.3695 -19.3511 -19.3511 -17.0724 -17.0713 -17.0144 -17.0137 -16.8134 -16.8130 -16.7313 -16.7304 -16.6701 -16.6697 -16.6622 -16.6621 -7.4684 -7.4681 -7.4197 -7.4195 -5.4972 -5.4947 -5.2467 -5.2460 -4.6336 -4.6328 -4.5913 -4.5902 -4.5132 -4.5125 -4.3924 -4.3916 -2.1617 -2.1613 -1.9150 -1.9138 -1.7349 -1.7335 -1.6939 -1.6913 -1.5010 -1.4999 -1.3495 -1.3483 -1.3026 -1.3020 -0.9211 -0.9204 -0.8554 -0.8424 -0.8053 -0.7941 0.0945 0.0955 0.3554 0.3560 0.5069 0.5077 0.5288 0.5297 0.6327 0.6334 0.6694 0.6713 8.7653 8.7655 8.8317 8.8318 9.9825 9.9847 10.5673 10.5681 10.8853 10.8897 10.9200 10.9225 k = 0.0468 0.5000-0.0000 ( 6544 PWs) bands (ev): -19.3707 -19.3707 -19.3522 -19.3522 -17.0715 -17.0707 -17.0130 -17.0124 -16.8131 -16.8128 -16.7307 -16.7300 -16.6688 -16.6685 -16.6616 -16.6615 -7.4755 -7.4752 -7.4271 -7.4269 -5.4881 -5.4862 -5.2355 -5.2350 -4.6375 -4.6369 -4.5990 -4.5981 -4.5177 -4.5172 -4.3954 -4.3947 -2.1626 -2.1623 -1.9149 -1.9141 -1.7261 -1.7251 -1.6857 -1.6837 -1.5017 -1.5007 -1.3543 -1.3534 -1.3096 -1.3092 -0.9165 -0.9160 -0.8446 -0.8330 -0.8024 -0.7922 0.0907 0.0914 0.3550 0.3555 0.5062 0.5068 0.5290 0.5297 0.6376 0.6381 0.6732 0.6746 8.7534 8.7536 8.8224 8.8225 9.9818 9.9835 10.5731 10.5737 10.8863 10.8909 10.9225 10.9267 k = 0.0312 0.5000-0.0000 ( 6542 PWs) bands (ev): -19.3716 -19.3715 -19.3530 -19.3529 -17.0709 -17.0704 -17.0119 -17.0116 -16.8129 -16.8127 -16.7302 -16.7298 -16.6678 -16.6676 -16.6612 -16.6611 -7.4805 -7.4804 -7.4323 -7.4323 -5.4814 -5.4802 -5.2273 -5.2270 -4.6403 -4.6399 -4.6047 -4.6040 -4.5209 -4.5206 -4.3975 -4.3971 -2.1633 -2.1631 -1.9149 -1.9143 -1.7196 -1.7189 -1.6793 -1.6780 -1.5023 -1.5017 -1.3580 -1.3573 -1.3148 -1.3145 -0.9133 -0.9129 -0.8356 -0.8267 -0.7998 -0.7917 0.0879 0.0884 0.3547 0.3550 0.5057 0.5061 0.5292 0.5297 0.6412 0.6415 0.6760 0.6770 8.7449 8.7450 8.8157 8.8158 9.9814 9.9826 10.5774 10.5778 10.8869 10.8906 10.9280 10.9326 k = 0.0156 0.5000-0.0000 ( 6552 PWs) bands (ev): -19.3721 -19.3721 -19.3534 -19.3534 -17.0705 -17.0702 -17.0113 -17.0111 -16.8128 -16.8127 -16.7299 -16.7296 -16.6672 -16.6671 -16.6609 -16.6609 -7.4835 -7.4835 -7.4355 -7.4355 -5.4772 -5.4766 -5.2223 -5.2222 -4.6420 -4.6418 -4.6081 -4.6077 -4.5228 -4.5226 -4.3987 -4.3985 -2.1637 -2.1636 -1.9149 -1.9146 -1.7154 -1.7151 -1.6752 -1.6745 -1.5028 -1.5024 -1.3603 -1.3599 -1.3179 -1.3178 -0.9114 -0.9112 -0.8289 -0.8239 -0.7971 -0.7926 0.0862 0.0865 0.3545 0.3547 0.5054 0.5056 0.5294 0.5296 0.6434 0.6436 0.6779 0.6783 8.7397 8.7398 8.8117 8.8118 9.9813 9.9819 10.5801 10.5803 10.8875 10.8896 10.9350 10.9383 k = 0.0000 0.5000-0.0000 ( 6552 PWs) bands (ev): -19.3722 -19.3722 -19.3536 -19.3536 -17.0702 -17.0702 -17.0110 -17.0110 -16.8127 -16.8127 -16.7297 -16.7297 -16.6669 -16.6669 -16.6608 -16.6608 -7.4845 -7.4845 -7.4366 -7.4366 -5.4756 -5.4756 -5.2206 -5.2206 -4.6425 -4.6425 -4.6091 -4.6091 -4.5234 -4.5234 -4.3990 -4.3990 -2.1638 -2.1638 -1.9147 -1.9147 -1.7139 -1.7139 -1.6735 -1.6735 -1.5028 -1.5028 -1.3610 -1.3610 -1.3189 -1.3189 -0.9107 -0.9107 -0.8248 -0.8248 -0.7945 -0.7945 0.0857 0.0857 0.3545 0.3545 0.5054 0.5054 0.5295 0.5295 0.6442 0.6442 0.6787 0.6787 8.7380 8.7380 8.8104 8.8104 9.9815 9.9815 10.5811 10.5811 10.8884 10.8884 10.9398 10.9398 k = 0.0000 0.5000-0.0000 ( 6552 PWs) bands (ev): -19.3722 -19.3722 -19.3536 -19.3536 -17.0702 -17.0702 -17.0110 -17.0110 -16.8127 -16.8127 -16.7297 -16.7297 -16.6669 -16.6669 -16.6608 -16.6608 -7.4845 -7.4845 -7.4366 -7.4366 -5.4756 -5.4756 -5.2206 -5.2206 -4.6425 -4.6425 -4.6091 -4.6091 -4.5234 -4.5234 -4.3990 -4.3990 -2.1638 -2.1638 -1.9147 -1.9147 -1.7139 -1.7139 -1.6735 -1.6735 -1.5028 -1.5028 -1.3610 -1.3610 -1.3189 -1.3189 -0.9107 -0.9107 -0.8248 -0.8248 -0.7945 -0.7945 0.0857 0.0857 0.3545 0.3545 0.5054 0.5054 0.5295 0.5295 0.6442 0.6442 0.6787 0.6787 8.7380 8.7380 8.8104 8.8104 9.9815 9.9815 10.5811 10.5811 10.8884 10.8884 10.9398 10.9398 k = 0.0000 0.5000 0.0155 ( 6554 PWs) bands (ev): -19.3722 -19.3722 -19.3536 -19.3536 -17.0702 -17.0702 -17.0112 -17.0111 -16.8125 -16.8124 -16.7298 -16.7296 -16.6670 -16.6668 -16.6609 -16.6607 -7.4846 -7.4846 -7.4367 -7.4367 -5.4750 -5.4749 -5.2204 -5.2204 -4.6425 -4.6423 -4.6092 -4.6090 -4.5238 -4.5235 -4.3994 -4.3994 -2.1641 -2.1640 -1.9168 -1.9165 -1.7135 -1.7132 -1.6733 -1.6731 -1.5015 -1.5012 -1.3606 -1.3603 -1.3191 -1.3188 -0.9111 -0.9108 -0.8256 -0.8251 -0.7950 -0.7949 0.0863 0.0864 0.3540 0.3542 0.5029 0.5034 0.5254 0.5257 0.6480 0.6484 0.6809 0.6814 8.7393 8.7394 8.8114 8.8114 9.9797 9.9805 10.5787 10.5792 10.8819 10.8839 10.9446 10.9454 k = 0.0000 0.5000 0.0311 ( 6550 PWs) bands (ev): -19.3721 -19.3721 -19.3537 -19.3537 -17.0703 -17.0702 -17.0118 -17.0117 -16.8119 -16.8118 -16.7300 -16.7296 -16.6670 -16.6667 -16.6611 -16.6606 -7.4847 -7.4847 -7.4372 -7.4372 -5.4731 -5.4729 -5.2197 -5.2197 -4.6424 -4.6420 -4.6093 -4.6090 -4.5246 -4.5240 -4.4005 -4.4005 -2.1650 -2.1648 -1.9225 -1.9219 -1.7119 -1.7115 -1.6723 -1.6720 -1.4973 -1.4967 -1.3591 -1.3586 -1.3193 -1.3188 -0.9122 -0.9115 -0.8273 -0.8264 -0.7962 -0.7961 0.0881 0.0883 0.3527 0.3530 0.4964 0.4973 0.5149 0.5153 0.6584 0.6592 0.6878 0.6887 8.7433 8.7435 8.8143 8.8144 9.9752 9.9769 10.5721 10.5731 10.8687 10.8718 10.9483 10.9487 k = 0.0000 0.5000 0.0466 ( 6550 PWs) bands (ev): -19.3720 -19.3720 -19.3538 -19.3537 -17.0703 -17.0701 -17.0127 -17.0125 -16.8109 -16.8107 -16.7303 -16.7297 -16.6671 -16.6666 -16.6612 -16.6605 -7.4849 -7.4849 -7.4380 -7.4380 -5.4698 -5.4695 -5.2187 -5.2187 -4.6422 -4.6415 -4.6094 -4.6089 -4.5259 -4.5250 -4.4024 -4.4023 -2.1665 -2.1662 -1.9315 -1.9306 -1.7092 -1.7087 -1.6707 -1.6703 -1.4906 -1.4898 -1.3565 -1.3558 -1.3195 -1.3188 -0.9139 -0.9127 -0.8299 -0.8286 -0.7983 -0.7981 0.0911 0.0913 0.3504 0.3509 0.4868 0.4881 0.5006 0.5009 0.6729 0.6739 0.6984 0.6996 8.7499 8.7502 8.8193 8.8193 9.9681 9.9705 10.5612 10.5626 10.8525 10.8562 10.9209 10.9224 k = 0.0000 0.5000 0.0621 ( 6550 PWs) bands (ev): -19.3718 -19.3718 -19.3539 -19.3539 -17.0703 -17.0701 -17.0140 -17.0138 -16.8095 -16.8092 -16.7306 -16.7298 -16.6671 -16.6665 -16.6614 -16.6604 -7.4852 -7.4852 -7.4392 -7.4391 -5.4653 -5.4649 -5.2173 -5.2172 -4.6417 -4.6408 -4.6095 -4.6089 -4.5276 -4.5265 -4.4050 -4.4048 -2.1684 -2.1680 -1.9432 -1.9421 -1.7056 -1.7050 -1.6685 -1.6679 -1.4821 -1.4810 -1.3526 -1.3517 -1.3198 -1.3190 -0.9162 -0.9146 -0.8335 -0.8318 -0.8012 -0.8010 0.0952 0.0956 0.3471 0.3479 0.4751 0.4768 0.4844 0.4845 0.6897 0.6908 0.7115 0.7130 8.7592 8.7595 8.8261 8.8262 9.9584 9.9616 10.5458 10.5477 10.8347 10.8387 10.8876 10.8896 k = 0.0000 0.5000 0.0777 ( 6542 PWs) bands (ev): -19.3716 -19.3716 -19.3541 -19.3540 -17.0702 -17.0700 -17.0156 -17.0153 -16.8078 -16.8074 -16.7311 -16.7301 -16.6671 -16.6664 -16.6615 -16.6603 -7.4856 -7.4856 -7.4406 -7.4406 -5.4596 -5.4590 -5.2156 -5.2155 -4.6411 -4.6400 -4.6096 -4.6089 -4.5298 -4.5283 -4.4083 -4.4080 -2.1709 -2.1704 -1.9570 -1.9558 -1.7012 -1.7005 -1.6656 -1.6649 -1.4723 -1.4710 -1.3472 -1.3461 -1.3202 -1.3192 -0.9190 -0.9170 -0.8380 -0.8357 -0.8048 -0.8046 0.1004 0.1009 0.3428 0.3439 0.4616 0.4640 0.4675 0.4685 0.7075 0.7087 0.7263 0.7279 8.7711 8.7715 8.8349 8.8350 9.9464 9.9501 10.5256 10.5279 10.8158 10.8201 10.8516 10.8539 k = 0.0000 0.5000 0.0932 ( 6540 PWs) bands (ev): -19.3714 -19.3713 -19.3543 -19.3542 -17.0702 -17.0700 -17.0174 -17.0171 -16.8058 -16.8053 -16.7316 -16.7304 -16.6671 -16.6662 -16.6616 -16.6602 -7.4860 -7.4860 -7.4423 -7.4422 -5.4526 -5.4520 -5.2137 -5.2136 -4.6403 -4.6389 -4.6097 -4.6088 -4.5323 -4.5306 -4.4122 -4.4120 -2.1737 -2.1731 -1.9725 -1.9711 -1.6959 -1.6952 -1.6621 -1.6612 -1.4621 -1.4607 -1.3400 -1.3390 -1.3207 -1.3196 -0.9224 -0.9198 -0.8433 -0.8405 -0.8092 -0.8089 0.1066 0.1072 0.3374 0.3388 0.4458 0.4478 0.4535 0.4545 0.7256 0.7269 0.7420 0.7437 8.7855 8.7860 8.8455 8.8457 9.9322 9.9364 10.5003 10.5031 10.7961 10.8005 10.8150 10.8174 k = 0.0000 0.5000 0.1087 ( 6536 PWs) bands (ev): -19.3710 -19.3710 -19.3545 -19.3545 -17.0702 -17.0699 -17.0195 -17.0191 -16.8034 -16.8028 -16.7321 -16.7308 -16.6670 -16.6660 -16.6618 -16.6601 -7.4864 -7.4864 -7.4442 -7.4442 -5.4446 -5.4438 -5.2117 -5.2115 -4.6392 -4.6377 -4.6098 -4.6088 -4.5351 -4.5331 -4.4169 -4.4166 -2.1769 -2.1763 -1.9891 -1.9877 -1.6900 -1.6893 -1.6580 -1.6570 -1.4520 -1.4506 -1.3309 -1.3303 -1.3210 -1.3201 -0.9263 -0.9232 -0.8494 -0.8461 -0.8142 -0.8139 0.1136 0.1144 0.3309 0.3328 0.4288 0.4303 0.4414 0.4423 0.7438 0.7451 0.7581 0.7598 8.8023 8.8029 8.8580 8.8582 9.9160 9.9205 10.4697 10.4729 10.7752 10.7799 10.7801 10.7820 k = 0.0000 0.5000 0.1243 ( 6538 PWs) bands (ev): -19.3707 -19.3707 -19.3548 -19.3547 -17.0701 -17.0697 -17.0218 -17.0213 -16.8008 -16.8002 -16.7328 -16.7313 -16.6670 -16.6659 -16.6619 -16.6601 -7.4869 -7.4868 -7.4464 -7.4463 -5.4355 -5.4346 -5.2096 -5.2094 -4.6379 -4.6362 -4.6099 -4.6087 -4.5383 -4.5360 -4.4222 -4.4218 -2.1804 -2.1797 -2.0064 -2.0049 -1.6835 -1.6828 -1.6534 -1.6523 -1.4426 -1.4412 -1.3240 -1.3208 -1.3197 -1.3171 -0.9307 -0.9270 -0.8562 -0.8522 -0.8199 -0.8196 0.1213 0.1223 0.3233 0.3256 0.4118 0.4129 0.4301 0.4312 0.7616 0.7629 0.7743 0.7760 8.8216 8.8223 8.8722 8.8724 9.8979 9.9027 10.4337 10.4371 10.7453 10.7485 10.7558 10.7596 k = 0.0000 0.5000 0.1398 ( 6544 PWs) bands (ev): -19.3703 -19.3703 -19.3551 -19.3550 -17.0699 -17.0696 -17.0242 -17.0238 -16.7980 -16.7973 -16.7336 -16.7319 -16.6669 -16.6657 -16.6621 -16.6601 -7.4873 -7.4873 -7.4487 -7.4487 -5.4255 -5.4245 -5.2076 -5.2074 -4.6363 -4.6344 -4.6099 -4.6086 -4.5416 -4.5391 -4.4281 -4.4277 -2.1841 -2.1833 -2.0240 -2.0225 -1.6764 -1.6758 -1.6483 -1.6471 -1.4341 -1.4329 -1.3242 -1.3218 -1.3066 -1.3050 -0.9356 -0.9312 -0.8636 -0.8589 -0.8262 -0.8259 0.1296 0.1309 0.3147 0.3176 0.3954 0.3961 0.4197 0.4211 0.7789 0.7803 0.7902 0.7919 8.8431 8.8439 8.8881 8.8883 9.8783 9.8831 10.3924 10.3959 10.7150 10.7179 10.7351 10.7387 k = 0.0000 0.5000 0.1553 ( 6538 PWs) bands (ev): -19.3699 -19.3698 -19.3554 -19.3554 -17.0697 -17.0693 -17.0268 -17.0263 -16.7951 -16.7942 -16.7344 -16.7326 -16.6669 -16.6655 -16.6623 -16.6600 -7.4877 -7.4877 -7.4512 -7.4512 -5.4146 -5.4136 -5.2059 -5.2055 -4.6344 -4.6323 -4.6098 -4.6085 -4.5452 -4.5424 -4.4346 -4.4342 -2.1879 -2.1870 -2.0416 -2.0401 -1.6689 -1.6683 -1.6429 -1.6416 -1.4266 -1.4256 -1.3254 -1.3230 -1.2917 -1.2906 -0.9410 -0.9359 -0.8714 -0.8660 -0.8330 -0.8327 0.1384 0.1400 0.3055 0.3088 0.3797 0.3801 0.4102 0.4120 0.7956 0.7969 0.8056 0.8073 8.8668 8.8677 8.9056 8.9057 9.8572 9.8621 10.3465 10.3499 10.6880 10.6906 10.7146 10.7179 k = 0.0000 0.5000 0.1709 ( 6528 PWs) bands (ev): -19.3694 -19.3694 -19.3558 -19.3557 -17.0695 -17.0691 -17.0294 -17.0289 -16.7920 -16.7910 -16.7353 -16.7334 -16.6668 -16.6652 -16.6624 -16.6601 -7.4881 -7.4881 -7.4538 -7.4538 -5.4030 -5.4019 -5.2044 -5.2040 -4.6321 -4.6300 -4.6097 -4.6083 -4.5488 -4.5458 -4.4417 -4.4412 -2.1917 -2.1908 -2.0590 -2.0575 -1.6610 -1.6605 -1.6371 -1.6357 -1.4202 -1.4194 -1.3270 -1.3245 -1.2754 -1.2746 -0.9468 -0.9410 -0.8795 -0.8734 -0.8402 -0.8400 0.1475 0.1495 0.2958 0.2996 0.3650 0.3650 0.4015 0.4037 0.8115 0.8128 0.8204 0.8221 8.8924 8.8934 8.9246 8.9247 9.8351 9.8398 10.2966 10.2999 10.6642 10.6665 10.6945 10.6975 k = 0.0000 0.5000 0.1864 ( 6532 PWs) bands (ev): -19.3689 -19.3689 -19.3562 -19.3561 -17.0692 -17.0687 -17.0321 -17.0316 -16.7889 -16.7878 -16.7364 -16.7343 -16.6667 -16.6650 -16.6626 -16.6601 -7.4884 -7.4884 -7.4565 -7.4564 -5.3908 -5.3895 -5.2035 -5.2030 -4.6295 -4.6273 -4.6095 -4.6080 -4.5525 -4.5492 -4.4493 -4.4488 -2.1954 -2.1944 -2.0760 -2.0744 -1.6528 -1.6524 -1.6311 -1.6296 -1.4145 -1.4139 -1.3289 -1.3264 -1.2581 -1.2577 -0.9531 -0.9465 -0.8877 -0.8808 -0.8478 -0.8477 0.1567 0.1591 0.2859 0.2902 0.3509 0.3515 0.3934 0.3960 0.8264 0.8278 0.8344 0.8361 8.9198 8.9209 8.9449 8.9449 9.8121 9.8166 10.2437 10.2468 10.6434 10.6453 10.6752 10.6778 k = 0.0000 0.5000 0.2019 ( 6540 PWs) bands (ev): -19.3684 -19.3683 -19.3566 -19.3566 -17.0688 -17.0683 -17.0349 -17.0343 -16.7856 -16.7844 -16.7375 -16.7353 -16.6666 -16.6647 -16.6628 -16.6601 -7.4887 -7.4887 -7.4592 -7.4592 -5.3780 -5.3767 -5.2031 -5.2026 -4.6265 -4.6243 -4.6092 -4.6077 -4.5562 -4.5526 -4.4573 -4.4567 -2.1989 -2.1979 -2.0923 -2.0908 -1.6445 -1.6442 -1.6251 -1.6235 -1.4096 -1.4091 -1.3312 -1.3286 -1.2401 -1.2400 -0.9600 -0.9526 -0.8958 -0.8883 -0.8556 -0.8556 0.1658 0.1688 0.2762 0.2809 0.3382 0.3392 0.3857 0.3887 0.8404 0.8418 0.8475 0.8492 8.9486 8.9499 8.9663 8.9664 9.7887 9.7929 10.1887 10.1915 10.6253 10.6269 10.6569 10.6590 k = 0.0000 0.5000 0.2175 ( 6530 PWs) bands (ev): -19.3678 -19.3678 -19.3571 -19.3570 -17.0683 -17.0677 -17.0376 -17.0370 -16.7824 -16.7811 -16.7387 -16.7365 -16.6664 -16.6645 -16.6630 -16.6602 -7.4888 -7.4888 -7.4620 -7.4619 -5.3649 -5.3635 -5.2035 -5.2028 -4.6232 -4.6210 -4.6087 -4.6072 -4.5596 -4.5559 -4.4658 -4.4651 -2.2021 -2.2010 -2.1079 -2.1063 -1.6363 -1.6360 -1.6190 -1.6173 -1.4051 -1.4048 -1.3338 -1.3312 -1.2218 -1.2216 -0.9674 -0.9594 -0.9036 -0.8954 -0.8636 -0.8636 0.1746 0.1783 0.2669 0.2719 0.3268 0.3286 0.3784 0.3817 0.8533 0.8547 0.8596 0.8613 8.9785 8.9799 8.9887 8.9888 9.7653 9.7691 10.1325 10.1351 10.6096 10.6108 10.6396 10.6413 k = 0.0000 0.5000 0.2330 ( 6522 PWs) bands (ev): -19.3672 -19.3672 -19.3576 -19.3575 -17.0677 -17.0671 -17.0403 -17.0396 -16.7791 -16.7777 -16.7401 -16.7378 -16.6663 -16.6642 -16.6632 -16.6603 -7.4888 -7.4888 -7.4647 -7.4647 -5.3515 -5.3501 -5.2047 -5.2039 -4.6195 -4.6176 -4.6079 -4.6066 -4.5628 -4.5589 -4.4745 -4.4739 -2.2049 -2.2037 -2.1225 -2.1210 -1.6281 -1.6280 -1.6131 -1.6113 -1.4009 -1.4008 -1.3367 -1.3342 -1.2036 -1.2029 -0.9754 -0.9670 -0.9106 -0.9021 -0.8718 -0.8715 0.1829 0.1874 0.2580 0.2635 0.3171 0.3196 0.3712 0.3748 0.8651 0.8665 0.8706 0.8723 9.0089 9.0106 9.0119 9.0121 9.7425 9.7459 10.0758 10.0782 10.5962 10.5969 10.6237 10.6250 k = 0.0000 0.5000 0.2485 ( 6530 PWs) bands (ev): -19.3667 -19.3666 -19.3581 -19.3580 -17.0669 -17.0664 -17.0429 -17.0422 -16.7759 -16.7744 -16.7416 -16.7393 -16.6661 -16.6639 -16.6634 -16.6605 -7.4887 -7.4887 -7.4674 -7.4673 -5.3380 -5.3365 -5.2068 -5.2060 -4.6157 -4.6143 -4.6068 -4.6059 -4.5654 -4.5615 -4.4836 -4.4829 -2.2071 -2.2059 -2.1362 -2.1347 -1.6203 -1.6203 -1.6074 -1.6057 -1.3970 -1.3969 -1.3400 -1.3376 -1.1853 -1.1843 -0.9842 -0.9756 -0.9166 -0.9081 -0.8798 -0.8794 0.1905 0.1959 0.2499 0.2557 0.3091 0.3126 0.3641 0.3680 0.8757 0.8771 0.8805 0.8821 9.0351 9.0356 9.0397 9.0413 9.7209 9.7239 10.0196 10.0217 10.5847 10.5851 10.6093 10.6101 k = 0.0000 0.5000 0.2641 ( 6538 PWs) bands (ev): -19.3660 -19.3660 -19.3586 -19.3586 -17.0661 -17.0655 -17.0454 -17.0448 -16.7728 -16.7711 -16.7432 -16.7408 -16.6660 -16.6637 -16.6636 -16.6606 -7.4884 -7.4884 -7.4700 -7.4699 -5.3245 -5.3230 -5.2100 -5.2090 -4.6119 -4.6114 -4.6051 -4.6050 -4.5673 -4.5634 -4.4928 -4.4921 -2.2086 -2.2074 -2.1488 -2.1472 -1.6131 -1.6129 -1.6022 -1.6004 -1.3932 -1.3931 -1.3436 -1.3413 -1.1673 -1.1658 -0.9937 -0.9852 -0.9215 -0.9132 -0.8877 -0.8869 0.1970 0.2034 0.2426 0.2487 0.3033 0.3077 0.3570 0.3612 0.8850 0.8864 0.8891 0.8907 9.0586 9.0592 9.0692 9.0711 9.7015 9.7041 9.9643 9.9662 10.5751 10.5752 10.5964 10.5968 k = 0.0000 0.5000 0.2796 ( 6536 PWs) bands (ev): -19.3654 -19.3654 -19.3592 -19.3591 -17.0652 -17.0645 -17.0479 -17.0472 -16.7697 -16.7679 -16.7450 -16.7426 -16.6658 -16.6638 -16.6634 -16.6608 -7.4879 -7.4879 -7.4725 -7.4724 -5.3112 -5.3097 -5.2142 -5.2132 -4.6093 -4.6084 -4.6038 -4.6031 -4.5680 -4.5644 -4.5021 -4.5014 -2.2095 -2.2082 -2.1602 -2.1587 -1.6065 -1.6061 -1.5976 -1.5958 -1.3894 -1.3893 -1.3475 -1.3454 -1.1495 -1.1477 -1.0040 -0.9960 -0.9250 -0.9173 -0.8952 -0.8941 0.2024 0.2097 0.2361 0.2426 0.2998 0.3051 0.3498 0.3544 0.8930 0.8944 0.8964 0.8979 9.0816 9.0824 9.0969 9.0989 9.6856 9.6876 9.9109 9.9126 10.5672 10.5674 10.5852 10.5852 k = 0.0000 0.5000 0.2951 ( 6540 PWs) bands (ev): -19.3648 -19.3647 -19.3598 -19.3597 -17.0641 -17.0634 -17.0502 -17.0495 -16.7667 -16.7648 -16.7468 -16.7445 -16.6656 -16.6640 -16.6631 -16.6610 -7.4872 -7.4872 -7.4748 -7.4748 -5.2982 -5.2967 -5.2195 -5.2184 -4.6077 -4.6058 -4.6022 -4.6012 -4.5670 -4.5641 -4.5114 -4.5107 -2.2094 -2.2081 -2.1705 -2.1689 -1.6007 -1.6002 -1.5937 -1.5920 -1.3856 -1.3854 -1.3516 -1.3497 -1.1321 -1.1298 -1.0152 -1.0078 -0.9272 -0.9201 -0.9022 -0.9008 0.2066 0.2146 0.2305 0.2374 0.2987 0.3048 0.3426 0.3475 0.8996 0.9011 0.9024 0.9039 9.1034 9.1044 9.1213 9.1234 9.6744 9.6760 9.8602 9.8616 10.5610 10.5614 10.5754 10.5757 k = 0.0000 0.5000 0.3107 ( 6544 PWs) bands (ev): -19.3641 -19.3641 -19.3603 -19.3603 -17.0628 -17.0622 -17.0525 -17.0518 -16.7637 -16.7618 -16.7488 -16.7465 -16.6654 -16.6642 -16.6628 -16.6612 -7.4864 -7.4864 -7.4771 -7.4770 -5.2856 -5.2841 -5.2260 -5.2248 -4.6062 -4.6040 -4.6008 -4.6003 -4.5641 -4.5620 -4.5206 -4.5199 -2.2085 -2.2071 -2.1795 -2.1780 -1.5958 -1.5951 -1.5907 -1.5890 -1.3817 -1.3813 -1.3559 -1.3542 -1.1153 -1.1125 -1.0273 -1.0205 -0.9280 -0.9218 -0.9086 -0.9067 0.2097 0.2182 0.2259 0.2331 0.3001 0.3066 0.3353 0.3406 0.9049 0.9064 0.9070 0.9085 9.1233 9.1246 9.1410 9.1432 9.6695 9.6708 9.8130 9.8143 10.5566 10.5572 10.5673 10.5678 k = 0.0000 0.5000 0.3262 ( 6546 PWs) bands (ev): -19.3635 -19.3634 -19.3610 -19.3609 -17.0615 -17.0608 -17.0545 -17.0538 -16.7609 -16.7589 -16.7510 -16.7487 -16.6652 -16.6644 -16.6625 -16.6614 -7.4853 -7.4853 -7.4791 -7.4791 -5.2736 -5.2721 -5.2336 -5.2323 -4.6048 -4.6026 -4.6003 -4.5999 -4.5593 -4.5581 -4.5295 -4.5289 -2.2065 -2.2051 -2.1873 -2.1858 -1.5921 -1.5911 -1.5887 -1.5871 -1.3776 -1.3771 -1.3603 -1.3588 -1.0989 -1.0956 -1.0401 -1.0341 -0.9275 -0.9222 -0.9143 -0.9119 0.2121 0.2207 0.2220 0.2296 0.3034 0.3101 0.3281 0.3337 0.9088 0.9102 0.9103 0.9117 9.1402 9.1417 9.1545 9.1568 9.6724 9.6735 9.7706 9.7717 10.5539 10.5547 10.5611 10.5618 k = 0.0000 0.5000 0.3417 ( 6548 PWs) bands (ev): -19.3629 -19.3628 -19.3616 -19.3615 -17.0600 -17.0593 -17.0565 -17.0558 -16.7583 -16.7561 -16.7533 -16.7510 -16.6650 -16.6646 -16.6622 -16.6617 -7.4841 -7.4841 -7.4810 -7.4809 -5.2623 -5.2608 -5.2422 -5.2408 -4.6035 -4.6014 -4.6010 -4.5999 -4.5531 -4.5526 -4.5379 -4.5376 -2.2034 -2.2020 -2.1939 -2.1924 -1.5894 -1.5883 -1.5877 -1.5863 -1.3735 -1.3727 -1.3648 -1.3635 -1.0832 -1.0793 -1.0538 -1.0485 -0.9259 -0.9213 -0.9192 -0.9161 0.2142 0.2189 0.2228 0.2269 0.3084 0.3149 0.3211 0.3270 0.9113 0.9120 0.9128 0.9135 9.1530 9.1548 9.1610 9.1632 9.6842 9.6851 9.7341 9.7351 10.5530 10.5539 10.5566 10.5574 k = 0.0000 0.5000 0.3573 ( 6544 PWs) bands (ev): -19.3622 -19.3622 -19.3622 -19.3622 -17.0583 -17.0583 -17.0576 -17.0576 -16.7557 -16.7557 -16.7535 -16.7535 -16.6648 -16.6648 -16.6620 -16.6620 -7.4826 -7.4826 -7.4826 -7.4826 -5.2518 -5.2518 -5.2504 -5.2504 -4.6021 -4.6021 -4.6005 -4.6005 -4.5457 -4.5457 -4.5457 -4.5457 -2.1992 -2.1992 -2.1978 -2.1978 -1.5880 -1.5880 -1.5867 -1.5867 -1.3692 -1.3692 -1.3681 -1.3681 -1.0681 -1.0681 -1.0635 -1.0635 -0.9230 -0.9230 -0.9193 -0.9193 0.2164 0.2164 0.2247 0.2247 0.3144 0.3144 0.3207 0.3207 0.9124 0.9124 0.9138 0.9138 9.1603 9.1603 9.1623 9.1623 9.7050 9.7050 9.7058 9.7058 10.5539 10.5539 10.5548 10.5548 k = 0.0000 0.5000 0.3573 ( 6544 PWs) bands (ev): -19.3622 -19.3622 -19.3622 -19.3622 -17.0583 -17.0583 -17.0576 -17.0576 -16.7557 -16.7557 -16.7535 -16.7535 -16.6648 -16.6648 -16.6620 -16.6620 -7.4826 -7.4826 -7.4826 -7.4826 -5.2518 -5.2518 -5.2504 -5.2504 -4.6021 -4.6021 -4.6005 -4.6005 -4.5457 -4.5457 -4.5457 -4.5457 -2.1992 -2.1992 -2.1978 -2.1978 -1.5880 -1.5880 -1.5867 -1.5867 -1.3692 -1.3692 -1.3681 -1.3681 -1.0681 -1.0681 -1.0635 -1.0635 -0.9230 -0.9230 -0.9193 -0.9193 0.2164 0.2164 0.2247 0.2247 0.3144 0.3144 0.3207 0.3207 0.9124 0.9124 0.9138 0.9138 9.1603 9.1603 9.1623 9.1623 9.7050 9.7050 9.7058 9.7058 10.5539 10.5539 10.5548 10.5548 k = 0.0156 0.5000 0.3573 ( 6534 PWs) bands (ev): -19.3621 -19.3621 -19.3620 -19.3620 -17.0584 -17.0584 -17.0577 -17.0577 -16.7558 -16.7558 -16.7536 -16.7536 -16.6650 -16.6650 -16.6621 -16.6621 -7.4815 -7.4815 -7.4815 -7.4815 -5.2535 -5.2535 -5.2520 -5.2520 -4.6016 -4.6016 -4.5997 -4.5997 -4.5454 -4.5454 -4.5445 -4.5445 -2.1990 -2.1990 -2.1976 -2.1976 -1.5886 -1.5886 -1.5873 -1.5873 -1.3704 -1.3704 -1.3693 -1.3693 -1.0676 -1.0676 -1.0629 -1.0629 -0.9225 -0.9225 -0.9186 -0.9186 0.2158 0.2158 0.2240 0.2240 0.3143 0.3143 0.3206 0.3206 0.9119 0.9119 0.9134 0.9134 9.1621 9.1621 9.1640 9.1640 9.7059 9.7059 9.7067 9.7067 10.5549 10.5549 10.5558 10.5558 k = 0.0312 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3616 -19.3616 -19.3615 -19.3615 -17.0588 -17.0588 -17.0579 -17.0579 -16.7562 -16.7562 -16.7539 -16.7539 -16.6654 -16.6654 -16.6624 -16.6624 -7.4783 -7.4783 -7.4783 -7.4783 -5.2585 -5.2585 -5.2568 -5.2568 -4.5998 -4.5998 -4.5974 -4.5974 -4.5434 -4.5434 -4.5417 -4.5417 -2.1985 -2.1985 -2.1970 -2.1970 -1.5905 -1.5905 -1.5891 -1.5891 -1.3740 -1.3740 -1.3727 -1.3727 -1.0661 -1.0661 -1.0612 -1.0612 -0.9209 -0.9209 -0.9168 -0.9168 0.2140 0.2140 0.2222 0.2222 0.3141 0.3141 0.3204 0.3204 0.9106 0.9106 0.9121 0.9121 9.1673 9.1673 9.1692 9.1692 9.7086 9.7086 9.7095 9.7095 10.5578 10.5578 10.5587 10.5587 k = 0.0468 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3608 -19.3608 -19.3607 -19.3607 -17.0594 -17.0594 -17.0583 -17.0583 -16.7567 -16.7567 -16.7544 -16.7544 -16.6661 -16.6661 -16.6631 -16.6631 -7.4730 -7.4730 -7.4729 -7.4729 -5.2668 -5.2668 -5.2647 -5.2647 -4.5968 -4.5968 -4.5939 -4.5939 -4.5400 -4.5400 -4.5374 -4.5374 -2.1976 -2.1976 -2.1961 -2.1961 -1.5935 -1.5935 -1.5920 -1.5920 -1.3798 -1.3798 -1.3782 -1.3782 -1.0636 -1.0636 -1.0585 -1.0585 -0.9182 -0.9182 -0.9138 -0.9138 0.2110 0.2110 0.2191 0.2191 0.3139 0.3139 0.3201 0.3201 0.9083 0.9083 0.9098 0.9098 9.1759 9.1759 9.1779 9.1779 9.7131 9.7131 9.7140 9.7140 10.5626 10.5626 10.5636 10.5636 k = 0.0625 0.5000 0.3573 ( 6524 PWs) bands (ev): -19.3597 -19.3597 -19.3596 -19.3596 -17.0602 -17.0602 -17.0588 -17.0588 -16.7575 -16.7575 -16.7551 -16.7551 -16.6671 -16.6671 -16.6639 -16.6639 -7.4655 -7.4655 -7.4654 -7.4654 -5.2781 -5.2781 -5.2756 -5.2756 -4.5927 -4.5927 -4.5892 -4.5892 -4.5350 -4.5350 -4.5317 -4.5317 -2.1964 -2.1964 -2.1948 -2.1948 -1.5978 -1.5978 -1.5961 -1.5961 -1.3876 -1.3876 -1.3856 -1.3856 -1.0606 -1.0606 -1.0549 -1.0549 -0.9147 -0.9147 -0.9097 -0.9097 0.2068 0.2068 0.2149 0.2149 0.3136 0.3136 0.3198 0.3198 0.9052 0.9052 0.9067 0.9067 9.1879 9.1879 9.1899 9.1899 9.7194 9.7194 9.7203 9.7203 10.5693 10.5693 10.5703 10.5703 k = 0.0781 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3583 -19.3583 -19.3581 -19.3581 -17.0612 -17.0612 -17.0596 -17.0596 -16.7585 -16.7585 -16.7560 -16.7560 -16.6683 -16.6683 -16.6649 -16.6649 -7.4560 -7.4560 -7.4558 -7.4558 -5.2922 -5.2922 -5.2894 -5.2894 -4.5874 -4.5874 -4.5835 -4.5835 -4.5285 -4.5285 -4.5247 -4.5247 -2.1948 -2.1948 -2.1931 -2.1931 -1.6030 -1.6030 -1.6012 -1.6012 -1.3971 -1.3971 -1.3948 -1.3948 -1.0570 -1.0570 -1.0509 -1.0509 -0.9102 -0.9102 -0.9047 -0.9047 0.2016 0.2016 0.2096 0.2096 0.3133 0.3133 0.3194 0.3194 0.9012 0.9012 0.9027 0.9027 9.2032 9.2032 9.2052 9.2052 9.7275 9.7275 9.7285 9.7285 10.5777 10.5777 10.5788 10.5788 k = 0.0937 0.5000 0.3573 ( 6528 PWs) bands (ev): -19.3566 -19.3566 -19.3564 -19.3564 -17.0625 -17.0625 -17.0606 -17.0606 -16.7598 -16.7598 -16.7572 -16.7572 -16.6697 -16.6697 -16.6662 -16.6662 -7.4444 -7.4444 -7.4442 -7.4442 -5.3088 -5.3088 -5.3058 -5.3058 -4.5812 -4.5812 -4.5769 -4.5769 -4.5208 -4.5208 -4.5164 -4.5164 -2.1928 -2.1928 -2.1910 -2.1910 -1.6093 -1.6093 -1.6073 -1.6073 -1.4081 -1.4081 -1.4054 -1.4054 -1.0533 -1.0533 -1.0466 -1.0466 -0.9051 -0.9051 -0.8990 -0.8990 0.1955 0.1955 0.2034 0.2034 0.3130 0.3130 0.3192 0.3192 0.8962 0.8962 0.8978 0.8978 9.2218 9.2218 9.2238 9.2238 9.7374 9.7374 9.7384 9.7384 10.5879 10.5879 10.5890 10.5890 k = 0.1093 0.5000 0.3573 ( 6522 PWs) bands (ev): -19.3546 -19.3546 -19.3544 -19.3544 -17.0639 -17.0639 -17.0617 -17.0617 -16.7612 -16.7612 -16.7585 -16.7585 -16.6713 -16.6713 -16.6676 -16.6676 -7.4309 -7.4309 -7.4307 -7.4307 -5.3279 -5.3279 -5.3245 -5.3245 -4.5741 -4.5741 -4.5697 -4.5697 -4.5118 -4.5118 -4.5070 -4.5070 -2.1905 -2.1905 -2.1886 -2.1886 -1.6164 -1.6164 -1.6143 -1.6143 -1.4203 -1.4203 -1.4171 -1.4171 -1.0497 -1.0497 -1.0423 -1.0423 -0.8994 -0.8994 -0.8927 -0.8927 0.1886 0.1886 0.1964 0.1964 0.3129 0.3129 0.3191 0.3191 0.8905 0.8905 0.8921 0.8921 9.2434 9.2434 9.2455 9.2455 9.7490 9.7490 9.7502 9.7502 10.5995 10.5995 10.6007 10.6007 k = 0.1249 0.5000 0.3573 ( 6522 PWs) bands (ev): -19.3524 -19.3524 -19.3522 -19.3522 -17.0655 -17.0655 -17.0631 -17.0631 -16.7629 -16.7629 -16.7600 -16.7600 -16.6730 -16.6730 -16.6691 -16.6691 -7.4155 -7.4155 -7.4152 -7.4152 -5.3490 -5.3490 -5.3454 -5.3454 -4.5662 -4.5662 -4.5617 -4.5617 -4.5018 -4.5018 -4.4967 -4.4967 -2.1879 -2.1879 -2.1859 -2.1859 -1.6244 -1.6244 -1.6220 -1.6220 -1.4333 -1.4333 -1.4298 -1.4298 -1.0463 -1.0463 -1.0383 -1.0383 -0.8933 -0.8933 -0.8860 -0.8860 0.1812 0.1812 0.1889 0.1889 0.3130 0.3130 0.3191 0.3191 0.8838 0.8838 0.8855 0.8855 9.2680 9.2680 9.2702 9.2702 9.7625 9.7625 9.7637 9.7637 10.6126 10.6126 10.6138 10.6138 k = 0.1405 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3499 -19.3499 -19.3497 -19.3497 -17.0673 -17.0673 -17.0646 -17.0646 -16.7647 -16.7647 -16.7618 -16.7618 -16.6748 -16.6748 -16.6707 -16.6707 -7.3983 -7.3983 -7.3980 -7.3980 -5.3720 -5.3720 -5.3681 -5.3681 -4.5576 -4.5576 -4.5532 -4.5532 -4.4910 -4.4910 -4.4856 -4.4856 -2.1850 -2.1850 -2.1828 -2.1828 -1.6331 -1.6331 -1.6305 -1.6305 -1.4470 -1.4470 -1.4431 -1.4431 -1.0434 -1.0434 -1.0348 -1.0348 -0.8870 -0.8870 -0.8792 -0.8792 0.1734 0.1734 0.1811 0.1811 0.3132 0.3132 0.3194 0.3194 0.8763 0.8763 0.8780 0.8780 9.2955 9.2955 9.2977 9.2977 9.7777 9.7777 9.7790 9.7790 10.6270 10.6270 10.6282 10.6282 k = 0.1562 0.5000 0.3573 ( 6520 PWs) bands (ev): -19.3472 -19.3472 -19.3469 -19.3469 -17.0693 -17.0693 -17.0664 -17.0664 -16.7667 -16.7667 -16.7637 -16.7637 -16.6767 -16.6767 -16.6724 -16.6724 -7.3794 -7.3794 -7.3790 -7.3790 -5.3966 -5.3966 -5.3926 -5.3926 -4.5485 -4.5485 -4.5441 -4.5441 -4.4794 -4.4794 -4.4739 -4.4739 -2.1817 -2.1817 -2.1794 -2.1794 -1.6425 -1.6425 -1.6397 -1.6397 -1.4611 -1.4611 -1.4569 -1.4569 -1.0412 -1.0412 -1.0320 -1.0320 -0.8806 -0.8806 -0.8723 -0.8723 0.1655 0.1655 0.1732 0.1732 0.3136 0.3136 0.3199 0.3199 0.8680 0.8680 0.8698 0.8698 9.3256 9.3256 9.3279 9.3279 9.7947 9.7947 9.7961 9.7961 10.6424 10.6424 10.6437 10.6437 k = 0.1718 0.5000 0.3573 ( 6514 PWs) bands (ev): -19.3443 -19.3443 -19.3440 -19.3440 -17.0714 -17.0714 -17.0683 -17.0683 -16.7689 -16.7689 -16.7658 -16.7658 -16.6786 -16.6786 -16.6742 -16.6742 -7.3589 -7.3589 -7.3584 -7.3584 -5.4227 -5.4227 -5.4185 -5.4185 -4.5388 -4.5388 -4.5346 -4.5346 -4.4674 -4.4674 -4.4617 -4.4617 -2.1781 -2.1781 -2.1757 -2.1757 -1.6525 -1.6525 -1.6495 -1.6495 -1.4753 -1.4753 -1.4708 -1.4708 -1.0399 -1.0399 -1.0302 -1.0302 -0.8742 -0.8742 -0.8655 -0.8655 0.1577 0.1577 0.1655 0.1655 0.3142 0.3142 0.3207 0.3207 0.8589 0.8589 0.8607 0.8607 9.3581 9.3581 9.3605 9.3605 9.8135 9.8135 9.8150 9.8150 10.6587 10.6587 10.6600 10.6600 k = 0.1874 0.5000 0.3573 ( 6514 PWs) bands (ev): -19.3412 -19.3412 -19.3410 -19.3410 -17.0738 -17.0738 -17.0705 -17.0705 -16.7712 -16.7712 -16.7680 -16.7680 -16.6805 -16.6805 -16.6759 -16.6759 -7.3368 -7.3368 -7.3363 -7.3363 -5.4500 -5.4500 -5.4456 -5.4456 -4.5287 -4.5287 -4.5247 -4.5247 -4.4549 -4.4549 -4.4491 -4.4491 -2.1742 -2.1742 -2.1717 -2.1717 -1.6632 -1.6632 -1.6600 -1.6600 -1.4894 -1.4894 -1.4845 -1.4845 -1.0396 -1.0396 -1.0296 -1.0296 -0.8680 -0.8680 -0.8590 -0.8590 0.1504 0.1504 0.1583 0.1583 0.3151 0.3151 0.3217 0.3217 0.8490 0.8490 0.8508 0.8508 9.3927 9.3927 9.3953 9.3953 9.8342 9.8342 9.8358 9.8358 10.6756 10.6756 10.6770 10.6770 k = 0.2030 0.5000 0.3573 ( 6516 PWs) bands (ev): -19.3380 -19.3380 -19.3377 -19.3377 -17.0763 -17.0763 -17.0728 -17.0728 -16.7736 -16.7736 -16.7704 -16.7704 -16.6824 -16.6824 -16.6777 -16.6777 -7.3135 -7.3135 -7.3129 -7.3129 -5.4783 -5.4783 -5.4738 -5.4738 -4.5183 -4.5183 -4.5144 -4.5144 -4.4422 -4.4422 -4.4363 -4.4363 -2.1701 -2.1701 -2.1674 -2.1674 -1.6746 -1.6746 -1.6711 -1.6711 -1.5031 -1.5031 -1.4980 -1.4980 -1.0406 -1.0406 -1.0302 -1.0302 -0.8621 -0.8621 -0.8529 -0.8529 0.1438 0.1438 0.1517 0.1517 0.3162 0.3162 0.3230 0.3230 0.8383 0.8383 0.8402 0.8402 9.4293 9.4293 9.4319 9.4319 9.8567 9.8567 9.8585 9.8585 10.6930 10.6930 10.6944 10.6944 k = 0.2186 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.3347 -19.3347 -19.3344 -19.3344 -17.0789 -17.0789 -17.0752 -17.0752 -16.7762 -16.7762 -16.7729 -16.7729 -16.6842 -16.6842 -16.6794 -16.6794 -7.2889 -7.2889 -7.2882 -7.2882 -5.5075 -5.5075 -5.5029 -5.5029 -4.5077 -4.5077 -4.5040 -4.5040 -4.4293 -4.4293 -4.4234 -4.4234 -2.1656 -2.1656 -2.1628 -2.1628 -1.6867 -1.6867 -1.6829 -1.6829 -1.5161 -1.5161 -1.5108 -1.5108 -1.0429 -1.0429 -1.0323 -1.0323 -0.8565 -0.8565 -0.8472 -0.8472 0.1380 0.1380 0.1461 0.1461 0.3176 0.3176 0.3246 0.3246 0.8269 0.8269 0.8289 0.8289 9.4673 9.4673 9.4702 9.4702 9.8813 9.8813 9.8832 9.8832 10.7105 10.7105 10.7119 10.7119 k = 0.2342 0.5000 0.3573 ( 6520 PWs) bands (ev): -19.3313 -19.3313 -19.3310 -19.3310 -17.0817 -17.0817 -17.0778 -17.0778 -16.7787 -16.7787 -16.7754 -16.7754 -16.6860 -16.6860 -16.6810 -16.6810 -7.2632 -7.2632 -7.2625 -7.2625 -5.5373 -5.5373 -5.5326 -5.5326 -4.4970 -4.4970 -4.4935 -4.4935 -4.4163 -4.4163 -4.4104 -4.4104 -2.1608 -2.1608 -2.1579 -2.1579 -1.6995 -1.6995 -1.6955 -1.6955 -1.5283 -1.5283 -1.5229 -1.5229 -1.0466 -1.0466 -1.0359 -1.0359 -0.8512 -0.8512 -0.8419 -0.8419 0.1334 0.1334 0.1415 0.1415 0.3193 0.3193 0.3266 0.3266 0.8148 0.8148 0.8169 0.8169 9.5065 9.5065 9.5095 9.5095 9.9079 9.9079 9.9100 9.9100 10.7279 10.7279 10.7292 10.7292 k = 0.2498 0.5000 0.3573 ( 6524 PWs) bands (ev): -19.3279 -19.3279 -19.3275 -19.3275 -17.0846 -17.0846 -17.0806 -17.0806 -16.7813 -16.7813 -16.7780 -16.7780 -16.6876 -16.6876 -16.6826 -16.6826 -7.2366 -7.2366 -7.2358 -7.2358 -5.5677 -5.5677 -5.5629 -5.5629 -4.4863 -4.4863 -4.4829 -4.4829 -4.4033 -4.4033 -4.3974 -4.3974 -2.1557 -2.1557 -2.1526 -2.1526 -1.7132 -1.7132 -1.7088 -1.7088 -1.5393 -1.5393 -1.5339 -1.5339 -1.0519 -1.0519 -1.0411 -1.0411 -0.8463 -0.8463 -0.8371 -0.8371 0.1298 0.1298 0.1382 0.1382 0.3213 0.3213 0.3289 0.3289 0.8021 0.8021 0.8043 0.8043 9.5464 9.5464 9.5496 9.5496 9.9368 9.9368 9.9391 9.9391 10.7448 10.7448 10.7461 10.7461 k = 0.2655 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3244 -19.3244 -19.3241 -19.3241 -17.0876 -17.0876 -17.0834 -17.0834 -16.7839 -16.7839 -16.7807 -16.7807 -16.6892 -16.6892 -16.6841 -16.6841 -7.2093 -7.2093 -7.2084 -7.2084 -5.5984 -5.5984 -5.5935 -5.5935 -4.4756 -4.4756 -4.4724 -4.4724 -4.3905 -4.3905 -4.3846 -4.3846 -2.1502 -2.1502 -2.1471 -2.1471 -1.7277 -1.7277 -1.7230 -1.7230 -1.5491 -1.5491 -1.5436 -1.5436 -1.0587 -1.0587 -1.0480 -1.0480 -0.8416 -0.8416 -0.8327 -0.8327 0.1276 0.1276 0.1360 0.1360 0.3237 0.3237 0.3315 0.3315 0.7888 0.7888 0.7911 0.7911 9.5865 9.5865 9.5899 9.5899 9.9680 9.9680 9.9706 9.9706 10.7609 10.7609 10.7622 10.7622 k = 0.2811 0.5000 0.3573 ( 6520 PWs) bands (ev): -19.3210 -19.3210 -19.3206 -19.3206 -17.0906 -17.0906 -17.0863 -17.0863 -16.7865 -16.7865 -16.7833 -16.7833 -16.6907 -16.6907 -16.6855 -16.6855 -7.1815 -7.1815 -7.1805 -7.1805 -5.6291 -5.6291 -5.6242 -5.6242 -4.4652 -4.4652 -4.4621 -4.4621 -4.3777 -4.3777 -4.3720 -4.3720 -2.1445 -2.1445 -2.1412 -2.1412 -1.7429 -1.7429 -1.7379 -1.7379 -1.5575 -1.5575 -1.5521 -1.5521 -1.0669 -1.0669 -1.0564 -1.0564 -0.8373 -0.8373 -0.8288 -0.8288 0.1266 0.1266 0.1352 0.1352 0.3265 0.3265 0.3346 0.3346 0.7750 0.7750 0.7774 0.7774 9.6264 9.6264 9.6299 9.6299 10.0018 10.0018 10.0046 10.0046 10.7759 10.7759 10.7772 10.7772 k = 0.2967 0.5000 0.3573 ( 6528 PWs) bands (ev): -19.3176 -19.3176 -19.3172 -19.3172 -17.0936 -17.0936 -17.0893 -17.0893 -16.7890 -16.7890 -16.7859 -16.7859 -16.6921 -16.6921 -16.6868 -16.6868 -7.1534 -7.1534 -7.1523 -7.1523 -5.6598 -5.6598 -5.6548 -5.6548 -4.4551 -4.4551 -4.4522 -4.4522 -4.3652 -4.3652 -4.3596 -4.3596 -2.1383 -2.1383 -2.1350 -2.1350 -1.7590 -1.7590 -1.7536 -1.7536 -1.5644 -1.5644 -1.5591 -1.5591 -1.0767 -1.0767 -1.0662 -1.0662 -0.8333 -0.8333 -0.8251 -0.8251 0.1267 0.1267 0.1355 0.1355 0.3297 0.3297 0.3381 0.3381 0.7608 0.7608 0.7632 0.7632 9.6655 9.6655 9.6691 9.6691 10.0383 10.0383 10.0413 10.0413 10.7894 10.7894 10.7907 10.7907 k = 0.3123 0.5000 0.3573 ( 6530 PWs) bands (ev): -19.3142 -19.3142 -19.3139 -19.3139 -17.0967 -17.0967 -17.0922 -17.0922 -16.7914 -16.7914 -16.7884 -16.7884 -16.6933 -16.6933 -16.6881 -16.6881 -7.1252 -7.1252 -7.1240 -7.1240 -5.6902 -5.6902 -5.6851 -5.6851 -4.4455 -4.4455 -4.4426 -4.4426 -4.3530 -4.3530 -4.3475 -4.3475 -2.1318 -2.1318 -2.1284 -2.1284 -1.7757 -1.7757 -1.7700 -1.7700 -1.5698 -1.5698 -1.5646 -1.5646 -1.0876 -1.0876 -1.0773 -1.0773 -0.8295 -0.8295 -0.8218 -0.8218 0.1280 0.1280 0.1368 0.1368 0.3334 0.3334 0.3421 0.3421 0.7462 0.7462 0.7487 0.7487 9.7032 9.7032 9.7070 9.7070 10.0777 10.0777 10.0808 10.0808 10.8012 10.8012 10.8026 10.8026 k = 0.3279 0.5000 0.3573 ( 6526 PWs) bands (ev): -19.3110 -19.3110 -19.3107 -19.3107 -17.0996 -17.0996 -17.0952 -17.0952 -16.7936 -16.7936 -16.7908 -16.7908 -16.6945 -16.6945 -16.6892 -16.6892 -7.0972 -7.0972 -7.0959 -7.0959 -5.7201 -5.7201 -5.7149 -5.7149 -4.4363 -4.4363 -4.4336 -4.4336 -4.3412 -4.3412 -4.3359 -4.3359 -2.1250 -2.1250 -2.1214 -2.1214 -1.7929 -1.7929 -1.7869 -1.7869 -1.5738 -1.5738 -1.5688 -1.5688 -1.0996 -1.0996 -1.0894 -1.0894 -0.8260 -0.8260 -0.8188 -0.8188 0.1303 0.1303 0.1391 0.1391 0.3377 0.3377 0.3466 0.3466 0.7313 0.7313 0.7340 0.7340 9.7391 9.7391 9.7430 9.7430 10.1199 10.1199 10.1232 10.1232 10.8109 10.8109 10.8125 10.8125 k = 0.3435 0.5000 0.3573 ( 6524 PWs) bands (ev): -19.3080 -19.3080 -19.3076 -19.3076 -17.1025 -17.1025 -17.0980 -17.0980 -16.7957 -16.7957 -16.7931 -16.7931 -16.6955 -16.6955 -16.6902 -16.6902 -7.0697 -7.0697 -7.0683 -7.0683 -5.7491 -5.7491 -5.7438 -5.7438 -4.4277 -4.4277 -4.4251 -4.4251 -4.3298 -4.3298 -4.3248 -4.3248 -2.1176 -2.1176 -2.1141 -2.1141 -1.8106 -1.8106 -1.8041 -1.8041 -1.5765 -1.5765 -1.5717 -1.5717 -1.1123 -1.1123 -1.1022 -1.1022 -0.8227 -0.8227 -0.8161 -0.8161 0.1333 0.1333 0.1421 0.1421 0.3424 0.3424 0.3516 0.3516 0.7163 0.7163 0.7191 0.7191 9.7729 9.7729 9.7768 9.7768 10.1648 10.1648 10.1683 10.1683 10.8185 10.8185 10.8203 10.8203 k = 0.3592 0.5000 0.3573 ( 6524 PWs) bands (ev): -19.3051 -19.3051 -19.3047 -19.3047 -17.1053 -17.1053 -17.1008 -17.1008 -16.7977 -16.7977 -16.7952 -16.7952 -16.6964 -16.6964 -16.6911 -16.6911 -7.0430 -7.0430 -7.0415 -7.0415 -5.7771 -5.7771 -5.7717 -5.7717 -4.4198 -4.4198 -4.4173 -4.4173 -4.3191 -4.3191 -4.3143 -4.3143 -2.1099 -2.1099 -2.1063 -2.1063 -1.8284 -1.8284 -1.8216 -1.8216 -1.5781 -1.5781 -1.5734 -1.5734 -1.1255 -1.1255 -1.1155 -1.1155 -0.8197 -0.8197 -0.8136 -0.8136 0.1368 0.1368 0.1456 0.1456 0.3477 0.3477 0.3571 0.3571 0.7013 0.7013 0.7042 0.7042 9.8041 9.8041 9.8081 9.8081 10.2123 10.2123 10.2159 10.2159 10.8238 10.8238 10.8260 10.8260 k = 0.3748 0.5000 0.3573 ( 6528 PWs) bands (ev): -19.3025 -19.3025 -19.3021 -19.3021 -17.1079 -17.1079 -17.1034 -17.1034 -16.7994 -16.7994 -16.7971 -16.7971 -16.6973 -16.6973 -16.6920 -16.6920 -7.0175 -7.0175 -7.0158 -7.0158 -5.8037 -5.8037 -5.7982 -5.7982 -4.4125 -4.4125 -4.4102 -4.4102 -4.3090 -4.3090 -4.3045 -4.3045 -2.1017 -2.1017 -2.0981 -2.0981 -1.8463 -1.8463 -1.8390 -1.8390 -1.5786 -1.5786 -1.5741 -1.5741 -1.1388 -1.1388 -1.1288 -1.1288 -0.8169 -0.8169 -0.8114 -0.8114 0.1407 0.1407 0.1494 0.1494 0.3535 0.3535 0.3631 0.3631 0.6865 0.6865 0.6895 0.6895 9.8326 9.8326 9.8365 9.8365 10.2619 10.2619 10.2657 10.2657 10.8269 10.8269 10.8296 10.8296 k = 0.3904 0.5000 0.3573 ( 6526 PWs) bands (ev): -19.3001 -19.3001 -19.2996 -19.2996 -17.1103 -17.1103 -17.1058 -17.1058 -16.8010 -16.8010 -16.7989 -16.7989 -16.6980 -16.6980 -16.6927 -16.6927 -6.9935 -6.9935 -6.9917 -6.9917 -5.8286 -5.8286 -5.8230 -5.8230 -4.4061 -4.4061 -4.4039 -4.4039 -4.2998 -4.2998 -4.2956 -4.2956 -2.0932 -2.0932 -2.0896 -2.0896 -1.8640 -1.8640 -1.8563 -1.8563 -1.5783 -1.5783 -1.5739 -1.5739 -1.1518 -1.1518 -1.1419 -1.1419 -0.8145 -0.8145 -0.8094 -0.8094 0.1447 0.1447 0.1532 0.1532 0.3597 0.3597 0.3694 0.3694 0.6721 0.6721 0.6752 0.6752 9.8582 9.8582 9.8620 9.8620 10.3131 10.3131 10.3171 10.3171 10.8281 10.8281 10.8311 10.8311 k = 0.4060 0.5000 0.3573 ( 6524 PWs) bands (ev): -19.2979 -19.2979 -19.2975 -19.2975 -17.1125 -17.1125 -17.1079 -17.1079 -16.8023 -16.8023 -16.8005 -16.8005 -16.6986 -16.6986 -16.6933 -16.6933 -6.9715 -6.9715 -6.9696 -6.9696 -5.8513 -5.8513 -5.8457 -5.8457 -4.4004 -4.4004 -4.3984 -4.3984 -4.2915 -4.2915 -4.2876 -4.2876 -2.0842 -2.0842 -2.0807 -2.0807 -1.8813 -1.8813 -1.8730 -1.8730 -1.5774 -1.5774 -1.5730 -1.5730 -1.1642 -1.1642 -1.1542 -1.1542 -0.8123 -0.8123 -0.8077 -0.8077 0.1486 0.1486 0.1569 0.1569 0.3661 0.3661 0.3760 0.3760 0.6583 0.6583 0.6615 0.6615 9.8807 9.8807 9.8844 9.8844 10.3652 10.3652 10.3695 10.3695 10.8272 10.8272 10.8308 10.8308 k = 0.4216 0.5000 0.3573 ( 6534 PWs) bands (ev): -19.2960 -19.2960 -19.2956 -19.2956 -17.1144 -17.1144 -17.1099 -17.1099 -16.8035 -16.8035 -16.8019 -16.8019 -16.6991 -16.6991 -16.6938 -16.6938 -6.9518 -6.9518 -6.9498 -6.9498 -5.8715 -5.8715 -5.8658 -5.8658 -4.3956 -4.3956 -4.3936 -4.3936 -4.2842 -4.2842 -4.2806 -4.2806 -2.0751 -2.0751 -2.0716 -2.0716 -1.8979 -1.8979 -1.8891 -1.8891 -1.5761 -1.5761 -1.5717 -1.5717 -1.1756 -1.1756 -1.1655 -1.1655 -0.8104 -0.8104 -0.8062 -0.8062 0.1522 0.1522 0.1603 0.1603 0.3726 0.3726 0.3826 0.3826 0.6454 0.6454 0.6488 0.6488 9.9000 9.9000 9.9036 9.9036 10.4174 10.4174 10.4219 10.4219 10.8246 10.8246 10.8288 10.8288 k = 0.4372 0.5000 0.3573 ( 6528 PWs) bands (ev): -19.2945 -19.2945 -19.2940 -19.2940 -17.1160 -17.1160 -17.1115 -17.1115 -16.8044 -16.8044 -16.8030 -16.8030 -16.6996 -16.6996 -16.6943 -16.6943 -6.9349 -6.9349 -6.9328 -6.9328 -5.8888 -5.8888 -5.8830 -5.8830 -4.3916 -4.3916 -4.3897 -4.3897 -4.2781 -4.2781 -4.2747 -4.2747 -2.0659 -2.0659 -2.0624 -2.0624 -1.9135 -1.9135 -1.9040 -1.9040 -1.5746 -1.5746 -1.5702 -1.5702 -1.1855 -1.1855 -1.1754 -1.1754 -0.8088 -0.8088 -0.8050 -0.8050 0.1554 0.1554 0.1633 0.1633 0.3789 0.3789 0.3889 0.3889 0.6339 0.6339 0.6374 0.6374 9.9160 9.9160 9.9195 9.9195 10.4684 10.4684 10.4733 10.4733 10.8201 10.8201 10.8248 10.8248 k = 0.4529 0.5000 0.3573 ( 6520 PWs) bands (ev): -19.2932 -19.2932 -19.2928 -19.2928 -17.1173 -17.1173 -17.1127 -17.1127 -16.8051 -16.8051 -16.8039 -16.8039 -16.6999 -16.6999 -16.6946 -16.6946 -6.9212 -6.9212 -6.9190 -6.9190 -5.9028 -5.9028 -5.8969 -5.8969 -4.3885 -4.3885 -4.3867 -4.3867 -4.2732 -4.2732 -4.2700 -4.2700 -2.0572 -2.0572 -2.0536 -2.0536 -1.9275 -1.9275 -1.9172 -1.9172 -1.5731 -1.5731 -1.5687 -1.5687 -1.1937 -1.1937 -1.1835 -1.1835 -0.8075 -0.8075 -0.8041 -0.8041 0.1580 0.1580 0.1657 0.1657 0.3845 0.3845 0.3945 0.3945 0.6241 0.6241 0.6278 0.6278 9.9285 9.9285 9.9321 9.9321 10.5164 10.5164 10.5216 10.5216 10.8135 10.8135 10.8187 10.8187 k = 0.4685 0.5000 0.3573 ( 6516 PWs) bands (ev): -19.2924 -19.2924 -19.2919 -19.2919 -17.1182 -17.1182 -17.1137 -17.1137 -16.8056 -16.8056 -16.8046 -16.8046 -16.7001 -16.7001 -16.6949 -16.6949 -6.9111 -6.9111 -6.9088 -6.9088 -5.9131 -5.9131 -5.9072 -5.9072 -4.3862 -4.3862 -4.3845 -4.3845 -4.2696 -4.2696 -4.2667 -4.2667 -2.0497 -2.0497 -2.0459 -2.0459 -1.9392 -1.9392 -1.9280 -1.9280 -1.5719 -1.5719 -1.5675 -1.5675 -1.1998 -1.1998 -1.1895 -1.1895 -0.8066 -0.8066 -0.8034 -0.8034 0.1599 0.1599 0.1675 0.1675 0.3889 0.3889 0.3990 0.3990 0.6167 0.6167 0.6204 0.6204 9.9376 9.9376 9.9411 9.9411 10.5584 10.5584 10.5640 10.5640 10.8053 10.8053 10.8101 10.8101 k = 0.4841 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.2918 -19.2918 -19.2914 -19.2914 -17.1188 -17.1188 -17.1142 -17.1142 -16.8059 -16.8059 -16.8050 -16.8050 -16.7003 -16.7003 -16.6950 -16.6950 -6.9049 -6.9049 -6.9026 -6.9026 -5.9195 -5.9195 -5.9135 -5.9135 -4.3849 -4.3849 -4.3832 -4.3832 -4.2675 -4.2675 -4.2646 -4.2646 -2.0444 -2.0444 -2.0402 -2.0402 -1.9473 -1.9473 -1.9353 -1.9353 -1.5711 -1.5711 -1.5667 -1.5667 -1.2036 -1.2036 -1.1933 -1.1933 -0.8061 -0.8061 -0.8030 -0.8030 0.1611 0.1611 0.1686 0.1686 0.3918 0.3918 0.4019 0.4019 0.6119 0.6119 0.6157 0.6157 9.9432 9.9432 9.9466 9.9466 10.5893 10.5893 10.5951 10.5951 10.7972 10.7972 10.8006 10.8006 k = 0.4997 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6013 10.6013 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k = 0.4997 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6013 10.6013 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k = 0.4886 0.4889 0.3573 ( 6512 PWs) bands (ev): -19.2918 -19.2918 -19.2914 -19.2914 -17.1188 -17.1188 -17.1142 -17.1142 -16.8059 -16.8059 -16.8051 -16.8051 -16.7003 -16.7003 -16.6950 -16.6950 -6.9049 -6.9049 -6.9026 -6.9026 -5.9194 -5.9194 -5.9134 -5.9134 -4.3850 -4.3850 -4.3833 -4.3833 -4.2674 -4.2674 -4.2646 -4.2646 -2.0433 -2.0433 -2.0390 -2.0390 -1.9486 -1.9486 -1.9364 -1.9364 -1.5711 -1.5711 -1.5667 -1.5667 -1.2034 -1.2034 -1.1930 -1.1930 -0.8062 -0.8062 -0.8031 -0.8031 0.1611 0.1611 0.1685 0.1685 0.3920 0.3920 0.4022 0.4022 0.6118 0.6118 0.6156 0.6156 9.9432 9.9432 9.9467 9.9467 10.5911 10.5911 10.5967 10.5967 10.7947 10.7947 10.7960 10.7960 k = 0.4775 0.4778 0.3573 ( 6520 PWs) bands (ev): -19.2924 -19.2924 -19.2919 -19.2919 -17.1182 -17.1182 -17.1136 -17.1136 -16.8056 -16.8056 -16.8046 -16.8046 -16.7001 -16.7001 -16.6948 -16.6948 -6.9112 -6.9112 -6.9090 -6.9090 -5.9129 -5.9129 -5.9070 -5.9070 -4.3867 -4.3867 -4.3849 -4.3849 -4.2695 -4.2695 -4.2664 -4.2664 -2.0458 -2.0458 -2.0416 -2.0416 -1.9441 -1.9441 -1.9323 -1.9323 -1.5719 -1.5719 -1.5674 -1.5674 -1.1988 -1.1988 -1.1885 -1.1885 -0.8069 -0.8069 -0.8037 -0.8037 0.1598 0.1598 0.1673 0.1673 0.3896 0.3896 0.3998 0.3998 0.6160 0.6160 0.6198 0.6198 9.9379 9.9379 9.9414 9.9414 10.5647 10.5647 10.5697 10.5697 10.7960 10.7960 10.7975 10.7975 k = 0.4664 0.4667 0.3573 ( 6518 PWs) bands (ev): -19.2933 -19.2933 -19.2928 -19.2928 -17.1172 -17.1172 -17.1127 -17.1127 -16.8052 -16.8052 -16.8040 -16.8040 -16.6998 -16.6998 -16.6946 -16.6946 -6.9214 -6.9214 -6.9192 -6.9192 -5.9025 -5.9025 -5.8966 -5.8966 -4.3895 -4.3895 -4.3876 -4.3876 -4.2728 -4.2728 -4.2695 -4.2695 -2.0494 -2.0494 -2.0454 -2.0454 -1.9373 -1.9373 -1.9261 -1.9261 -1.5732 -1.5732 -1.5685 -1.5685 -1.1915 -1.1915 -1.1812 -1.1812 -0.8082 -0.8082 -0.8048 -0.8048 0.1577 0.1577 0.1653 0.1653 0.3861 0.3861 0.3964 0.3964 0.6227 0.6227 0.6265 0.6265 9.9286 9.9286 9.9322 9.9322 10.5286 10.5286 10.5328 10.5328 10.7979 10.7979 10.7995 10.7995 k = 0.4553 0.4556 0.3573 ( 6512 PWs) bands (ev): -19.2945 -19.2945 -19.2941 -19.2941 -17.1159 -17.1159 -17.1113 -17.1113 -16.8045 -16.8045 -16.8031 -16.8031 -16.6995 -16.6995 -16.6942 -16.6942 -6.9353 -6.9353 -6.9332 -6.9332 -5.8883 -5.8883 -5.8824 -5.8824 -4.3934 -4.3934 -4.3914 -4.3914 -4.2773 -4.2773 -4.2738 -4.2738 -2.0537 -2.0537 -2.0497 -2.0497 -1.9288 -1.9288 -1.9181 -1.9181 -1.5745 -1.5745 -1.5697 -1.5697 -1.1816 -1.1816 -1.1713 -1.1713 -0.8100 -0.8100 -0.8064 -0.8064 0.1548 0.1548 0.1625 0.1625 0.3818 0.3818 0.3921 0.3921 0.6313 0.6313 0.6351 0.6351 9.9146 9.9146 9.9184 9.9184 10.4882 10.4882 10.4918 10.4918 10.8001 10.8001 10.8018 10.8018 k = 0.4442 0.4444 0.3573 ( 6530 PWs) bands (ev): -19.2961 -19.2961 -19.2957 -19.2957 -17.1142 -17.1142 -17.1096 -17.1096 -16.8037 -16.8037 -16.8020 -16.8020 -16.6990 -16.6990 -16.6937 -16.6937 -6.9524 -6.9524 -6.9504 -6.9504 -5.8707 -5.8707 -5.8650 -5.8650 -4.3984 -4.3984 -4.3963 -4.3963 -4.2830 -4.2830 -4.2791 -4.2791 -2.0581 -2.0581 -2.0541 -2.0541 -1.9192 -1.9192 -1.9090 -1.9090 -1.5758 -1.5758 -1.5708 -1.5708 -1.1695 -1.1695 -1.1593 -1.1593 -0.8123 -0.8123 -0.8084 -0.8084 0.1513 0.1513 0.1590 0.1590 0.3773 0.3773 0.3876 0.3876 0.6415 0.6415 0.6453 0.6453 9.8950 9.8950 9.8991 9.8991 10.4476 10.4476 10.4508 10.4508 10.8027 10.8027 10.8046 10.8046 k = 0.4331 0.4333 0.3573 ( 6522 PWs) bands (ev): -19.2981 -19.2981 -19.2977 -19.2977 -17.1121 -17.1121 -17.1076 -17.1076 -16.8026 -16.8026 -16.8007 -16.8007 -16.6984 -16.6984 -16.6931 -16.6931 -6.9724 -6.9724 -6.9705 -6.9705 -5.8502 -5.8502 -5.8446 -5.8446 -4.4045 -4.4045 -4.4022 -4.4022 -4.2898 -4.2898 -4.2855 -4.2855 -2.0623 -2.0623 -2.0584 -2.0584 -1.9089 -1.9089 -1.8991 -1.8991 -1.5768 -1.5768 -1.5715 -1.5715 -1.1556 -1.1556 -1.1453 -1.1453 -0.8150 -0.8150 -0.8108 -0.8108 0.1471 0.1471 0.1548 0.1548 0.3729 0.3729 0.3832 0.3832 0.6527 0.6527 0.6564 0.6564 9.8690 9.8690 9.8733 9.8733 10.4097 10.4097 10.4128 10.4128 10.8058 10.8058 10.8079 10.8079 k = 0.4220 0.4222 0.3573 ( 6518 PWs) bands (ev): -19.3003 -19.3003 -19.2999 -19.2999 -17.1097 -17.1097 -17.1052 -17.1052 -16.8013 -16.8013 -16.7991 -16.7991 -16.6978 -16.6978 -16.6925 -16.6925 -6.9949 -6.9949 -6.9932 -6.9932 -5.8272 -5.8272 -5.8217 -5.8217 -4.4116 -4.4116 -4.4091 -4.4091 -4.2974 -4.2974 -4.2928 -4.2928 -2.0661 -2.0661 -2.0621 -2.0621 -1.8983 -1.8983 -1.8889 -1.8889 -1.5771 -1.5771 -1.5716 -1.5716 -1.1401 -1.1401 -1.1298 -1.1298 -0.8182 -0.8182 -0.8137 -0.8137 0.1425 0.1425 0.1501 0.1501 0.3691 0.3691 0.3792 0.3792 0.6647 0.6647 0.6683 0.6683 9.8358 9.8358 9.8402 9.8402 10.3764 10.3764 10.3797 10.3797 10.8093 10.8093 10.8116 10.8116 k = 0.4109 0.4111 0.3573 ( 6510 PWs) bands (ev): -19.3029 -19.3029 -19.3025 -19.3025 -17.1070 -17.1070 -17.1024 -17.1024 -16.7999 -16.7999 -16.7974 -16.7974 -16.6970 -16.6970 -16.6917 -16.6917 -7.0196 -7.0196 -7.0179 -7.0179 -5.8021 -5.8021 -5.7967 -5.7967 -4.4197 -4.4197 -4.4171 -4.4171 -4.3059 -4.3059 -4.3009 -4.3009 -2.0693 -2.0693 -2.0653 -2.0653 -1.8876 -1.8876 -1.8786 -1.8786 -1.5765 -1.5765 -1.5709 -1.5709 -1.1235 -1.1235 -1.1132 -1.1132 -0.8219 -0.8219 -0.8170 -0.8170 0.1375 0.1375 0.1450 0.1450 0.3660 0.3660 0.3759 0.3759 0.6770 0.6770 0.6805 0.6805 9.7951 9.7951 9.7996 9.7996 10.3490 10.3490 10.3525 10.3525 10.8133 10.8133 10.8158 10.8158 k = 0.3998 0.4000 0.3573 ( 6502 PWs) bands (ev): -19.3058 -19.3058 -19.3054 -19.3054 -17.1040 -17.1040 -17.0994 -17.0994 -16.7982 -16.7982 -16.7955 -16.7955 -16.6962 -16.6962 -16.6909 -16.6909 -7.0460 -7.0460 -7.0444 -7.0444 -5.7753 -5.7753 -5.7700 -5.7700 -4.4288 -4.4288 -4.4260 -4.4260 -4.3150 -4.3150 -4.3097 -4.3097 -2.0717 -2.0717 -2.0677 -2.0677 -1.8772 -1.8772 -1.8685 -1.8685 -1.5748 -1.5748 -1.5691 -1.5691 -1.1060 -1.1060 -1.0957 -1.0957 -0.8260 -0.8260 -0.8207 -0.8207 0.1324 0.1324 0.1397 0.1397 0.3638 0.3638 0.3734 0.3734 0.6895 0.6895 0.6928 0.6928 9.7472 9.7472 9.7517 9.7517 10.3278 10.3278 10.3317 10.3317 10.8179 10.8179 10.8205 10.8205 k = 0.3887 0.3889 0.3573 ( 6510 PWs) bands (ev): -19.3089 -19.3089 -19.3085 -19.3085 -17.1007 -17.1007 -17.0961 -17.0961 -16.7963 -16.7963 -16.7933 -16.7933 -16.6952 -16.6952 -16.6899 -16.6899 -7.0737 -7.0737 -7.0723 -7.0723 -5.7472 -5.7472 -5.7420 -5.7420 -4.4388 -4.4388 -4.4359 -4.4359 -4.3248 -4.3248 -4.3191 -4.3191 -2.0732 -2.0732 -2.0692 -2.0692 -1.8673 -1.8673 -1.8589 -1.8589 -1.5718 -1.5718 -1.5660 -1.5660 -1.0882 -1.0882 -1.0778 -1.0778 -0.8304 -0.8304 -0.8247 -0.8247 0.1274 0.1274 0.1344 0.1344 0.3625 0.3625 0.3719 0.3719 0.7018 0.7018 0.7049 0.7049 9.6929 9.6929 9.6972 9.6972 10.3127 10.3127 10.3168 10.3168 10.8229 10.8229 10.8257 10.8257 k = 0.3775 0.3778 0.3573 ( 6518 PWs) bands (ev): -19.3123 -19.3123 -19.3119 -19.3119 -17.0971 -17.0971 -17.0925 -17.0925 -16.7942 -16.7942 -16.7910 -16.7910 -16.6942 -16.6942 -16.6889 -16.6889 -7.1027 -7.1027 -7.1013 -7.1013 -5.7182 -5.7182 -5.7130 -5.7130 -4.4497 -4.4497 -4.4467 -4.4467 -4.3350 -4.3350 -4.3291 -4.3291 -2.0737 -2.0737 -2.0697 -2.0697 -1.8581 -1.8581 -1.8499 -1.8499 -1.5674 -1.5674 -1.5616 -1.5616 -1.0702 -1.0702 -1.0597 -1.0597 -0.8353 -0.8353 -0.8292 -0.8292 0.1227 0.1227 0.1295 0.1295 0.3623 0.3623 0.3713 0.3713 0.7138 0.7138 0.7168 0.7168 9.6332 9.6332 9.6373 9.6373 10.3028 10.3028 10.3072 10.3072 10.8283 10.8283 10.8313 10.8313 k = 0.3664 0.3667 0.3573 ( 6522 PWs) bands (ev): -19.3160 -19.3160 -19.3156 -19.3156 -17.0934 -17.0934 -17.0887 -17.0887 -16.7919 -16.7919 -16.7885 -16.7885 -16.6932 -16.6932 -16.6879 -16.6879 -7.1324 -7.1324 -7.1312 -7.1312 -5.6884 -5.6884 -5.6834 -5.6834 -4.4614 -4.4614 -4.4583 -4.4583 -4.3455 -4.3455 -4.3394 -4.3394 -2.0731 -2.0731 -2.0691 -2.0691 -1.8497 -1.8497 -1.8417 -1.8417 -1.5615 -1.5615 -1.5558 -1.5558 -1.0525 -1.0525 -1.0419 -1.0419 -0.8404 -0.8404 -0.8339 -0.8339 0.1185 0.1185 0.1250 0.1250 0.3630 0.3630 0.3717 0.3717 0.7253 0.7253 0.7281 0.7281 9.5693 9.5693 9.5731 9.5731 10.2975 10.2975 10.3022 10.3022 10.8341 10.8341 10.8373 10.8373 k = 0.3553 0.3556 0.3573 ( 6526 PWs) bands (ev): -19.3198 -19.3198 -19.3195 -19.3195 -17.0893 -17.0893 -17.0847 -17.0847 -16.7894 -16.7894 -16.7858 -16.7858 -16.6920 -16.6920 -16.6867 -16.6867 -7.1628 -7.1628 -7.1616 -7.1616 -5.6583 -5.6583 -5.6533 -5.6533 -4.4737 -4.4737 -4.4705 -4.4705 -4.3564 -4.3564 -4.3500 -4.3500 -2.0714 -2.0714 -2.0675 -2.0675 -1.8421 -1.8421 -1.8345 -1.8345 -1.5541 -1.5541 -1.5485 -1.5485 -1.0353 -1.0353 -1.0245 -1.0245 -0.8458 -0.8458 -0.8388 -0.8388 0.1151 0.1151 0.1213 0.1213 0.3647 0.3647 0.3730 0.3730 0.7363 0.7363 0.7389 0.7389 9.5021 9.5021 9.5057 9.5057 10.2960 10.2960 10.3010 10.3010 10.8402 10.8402 10.8436 10.8436 k = 0.3442 0.3444 0.3573 ( 6514 PWs) bands (ev): -19.3239 -19.3239 -19.3235 -19.3235 -17.0851 -17.0851 -17.0806 -17.0806 -16.7868 -16.7868 -16.7829 -16.7829 -16.6908 -16.6908 -16.6855 -16.6855 -7.1935 -7.1935 -7.1925 -7.1925 -5.6281 -5.6281 -5.6231 -5.6231 -4.4866 -4.4866 -4.4833 -4.4833 -4.3674 -4.3674 -4.3609 -4.3609 -2.0686 -2.0686 -2.0647 -2.0647 -1.8355 -1.8355 -1.8282 -1.8282 -1.5453 -1.5453 -1.5398 -1.5398 -1.0190 -1.0190 -1.0080 -1.0080 -0.8514 -0.8514 -0.8440 -0.8440 0.1127 0.1127 0.1186 0.1186 0.3673 0.3673 0.3753 0.3753 0.7465 0.7465 0.7490 0.7490 9.4326 9.4326 9.4359 9.4359 10.2976 10.2976 10.3029 10.3029 10.8463 10.8463 10.8501 10.8501 k = 0.3331 0.3333 0.3573 ( 6518 PWs) bands (ev): -19.3282 -19.3282 -19.3278 -19.3278 -17.0808 -17.0808 -17.0762 -17.0762 -16.7839 -16.7839 -16.7799 -16.7799 -16.6896 -16.6896 -16.6843 -16.6843 -7.2245 -7.2245 -7.2235 -7.2235 -5.5980 -5.5980 -5.5931 -5.5931 -4.4999 -4.4999 -4.4966 -4.4966 -4.3785 -4.3785 -4.3720 -4.3720 -2.0645 -2.0645 -2.0607 -2.0607 -1.8299 -1.8299 -1.8229 -1.8229 -1.5351 -1.5351 -1.5299 -1.5299 -1.0039 -1.0039 -0.9926 -0.9926 -0.8571 -0.8571 -0.8492 -0.8492 0.1114 0.1114 0.1172 0.1172 0.3708 0.3708 0.3785 0.3785 0.7560 0.7560 0.7583 0.7583 9.3615 9.3615 9.3645 9.3645 10.3019 10.3019 10.3074 10.3074 10.8523 10.8523 10.8567 10.8567 k = 0.3220 0.3222 0.3573 ( 6512 PWs) bands (ev): -19.3325 -19.3325 -19.3322 -19.3322 -17.0763 -17.0763 -17.0718 -17.0718 -16.7809 -16.7809 -16.7767 -16.7767 -16.6883 -16.6883 -16.6830 -16.6830 -7.2556 -7.2556 -7.2546 -7.2546 -5.5683 -5.5683 -5.5634 -5.5634 -4.5135 -4.5135 -4.5101 -4.5101 -4.3896 -4.3896 -4.3831 -4.3831 -2.0593 -2.0593 -2.0554 -2.0554 -1.8252 -1.8252 -1.8185 -1.8185 -1.5238 -1.5238 -1.5188 -1.5188 -0.9902 -0.9902 -0.9786 -0.9786 -0.8627 -0.8627 -0.8543 -0.8543 0.1115 0.1115 0.1171 0.1171 0.3750 0.3750 0.3825 0.3825 0.7647 0.7647 0.7668 0.7668 9.2896 9.2896 9.2923 9.2923 10.3084 10.3084 10.3142 10.3142 10.8580 10.8580 10.8631 10.8631 k = 0.3109 0.3111 0.3573 ( 6518 PWs) bands (ev): -19.3371 -19.3371 -19.3367 -19.3367 -17.0717 -17.0717 -17.0672 -17.0672 -16.7778 -16.7778 -16.7733 -16.7733 -16.6870 -16.6870 -16.6817 -16.6817 -7.2865 -7.2865 -7.2856 -7.2856 -5.5391 -5.5391 -5.5342 -5.5342 -4.5272 -4.5272 -4.5238 -4.5238 -4.4008 -4.4008 -4.3942 -4.3942 -2.0528 -2.0528 -2.0490 -2.0490 -1.8213 -1.8213 -1.8149 -1.8149 -1.5115 -1.5115 -1.5067 -1.5067 -0.9784 -0.9784 -0.9665 -0.9665 -0.8681 -0.8681 -0.8591 -0.8591 0.1129 0.1129 0.1185 0.1185 0.3800 0.3800 0.3874 0.3874 0.7725 0.7725 0.7745 0.7745 9.2172 9.2172 9.2196 9.2196 10.3167 10.3167 10.3229 10.3229 10.8631 10.8631 10.8690 10.8690 k = 0.2998 0.3000 0.3573 ( 6524 PWs) bands (ev): -19.3417 -19.3417 -19.3414 -19.3414 -17.0670 -17.0670 -17.0626 -17.0626 -16.7745 -16.7745 -16.7698 -16.7698 -16.6857 -16.6857 -16.6804 -16.6804 -7.3172 -7.3172 -7.3164 -7.3164 -5.5107 -5.5107 -5.5058 -5.5058 -4.5409 -4.5409 -4.5374 -4.5374 -4.4119 -4.4119 -4.4054 -4.4054 -2.0452 -2.0452 -2.0414 -2.0414 -1.8182 -1.8182 -1.8121 -1.8121 -1.4984 -1.4984 -1.4939 -1.4939 -0.9688 -0.9688 -0.9566 -0.9566 -0.8729 -0.8729 -0.8635 -0.8635 0.1159 0.1159 0.1214 0.1214 0.3857 0.3857 0.3930 0.3930 0.7794 0.7794 0.7812 0.7812 9.1448 9.1448 9.1470 9.1470 10.3267 10.3267 10.3333 10.3333 10.8673 10.8673 10.8743 10.8743 k = 0.2887 0.2889 0.3573 ( 6522 PWs) bands (ev): -19.3464 -19.3464 -19.3461 -19.3461 -17.0623 -17.0623 -17.0579 -17.0579 -16.7710 -16.7710 -16.7662 -16.7662 -16.6843 -16.6843 -16.6790 -16.6790 -7.3476 -7.3476 -7.3468 -7.3468 -5.4832 -5.4832 -5.4784 -5.4784 -4.5544 -4.5544 -4.5509 -4.5509 -4.4230 -4.4230 -4.4164 -4.4164 -2.0364 -2.0364 -2.0326 -2.0326 -1.8156 -1.8156 -1.8099 -1.8099 -1.4846 -1.4846 -1.4804 -1.4804 -0.9616 -0.9616 -0.9492 -0.9492 -0.8769 -0.8769 -0.8673 -0.8673 0.1204 0.1204 0.1260 0.1260 0.3921 0.3921 0.3993 0.3993 0.7853 0.7853 0.7869 0.7869 9.0728 9.0728 9.0748 9.0748 10.3382 10.3382 10.3451 10.3451 10.8705 10.8705 10.8785 10.8785 k = 0.2776 0.2778 0.3573 ( 6526 PWs) bands (ev): -19.3512 -19.3512 -19.3509 -19.3509 -17.0575 -17.0575 -17.0532 -17.0532 -16.7674 -16.7674 -16.7625 -16.7625 -16.6830 -16.6830 -16.6777 -16.6777 -7.3775 -7.3775 -7.3767 -7.3767 -5.4568 -5.4568 -5.4520 -5.4520 -4.5676 -4.5676 -4.5640 -4.5640 -4.4338 -4.4338 -4.4274 -4.4274 -2.0265 -2.0265 -2.0226 -2.0226 -1.8136 -1.8136 -1.8082 -1.8082 -1.4705 -1.4705 -1.4665 -1.4665 -0.9571 -0.9571 -0.9448 -0.9448 -0.8798 -0.8798 -0.8702 -0.8702 0.1265 0.1265 0.1323 0.1323 0.3991 0.3991 0.4063 0.4063 0.7903 0.7903 0.7917 0.7917 9.0016 9.0016 9.0034 9.0034 10.3509 10.3509 10.3583 10.3583 10.8724 10.8724 10.8814 10.8814 k = 0.2665 0.2667 0.3573 ( 6534 PWs) bands (ev): -19.3560 -19.3560 -19.3557 -19.3557 -17.0528 -17.0528 -17.0485 -17.0485 -16.7637 -16.7637 -16.7586 -16.7586 -16.6817 -16.6817 -16.6763 -16.6763 -7.4069 -7.4069 -7.4062 -7.4062 -5.4316 -5.4316 -5.4269 -5.4269 -4.5803 -4.5803 -4.5766 -4.5766 -4.4445 -4.4445 -4.4381 -4.4381 -2.0156 -2.0156 -2.0117 -2.0117 -1.8120 -1.8120 -1.8069 -1.8069 -1.4560 -1.4560 -1.4524 -1.4524 -0.9552 -0.9552 -0.9434 -0.9434 -0.8815 -0.8815 -0.8723 -0.8723 0.1341 0.1341 0.1401 0.1401 0.4066 0.4066 0.4140 0.4140 0.7943 0.7943 0.7955 0.7955 8.9314 8.9314 8.9330 8.9330 10.3648 10.3648 10.3725 10.3725 10.8727 10.8727 10.8826 10.8826 k = 0.2554 0.2556 0.3573 ( 6542 PWs) bands (ev): -19.3608 -19.3608 -19.3605 -19.3605 -17.0480 -17.0480 -17.0438 -17.0438 -16.7599 -16.7599 -16.7547 -16.7547 -16.6803 -16.6803 -16.6750 -16.6750 -7.4357 -7.4357 -7.4349 -7.4349 -5.4079 -5.4079 -5.4032 -5.4032 -4.5924 -4.5924 -4.5886 -4.5886 -4.4549 -4.4549 -4.4486 -4.4486 -2.0038 -2.0038 -1.9999 -1.9999 -1.8106 -1.8106 -1.8056 -1.8056 -1.4416 -1.4416 -1.4382 -1.4382 -0.9556 -0.9556 -0.9446 -0.9446 -0.8824 -0.8824 -0.8739 -0.8739 0.1431 0.1431 0.1494 0.1494 0.4146 0.4146 0.4222 0.4222 0.7974 0.7974 0.7984 0.7984 8.8625 8.8625 8.8639 8.8639 10.3796 10.3796 10.3877 10.3877 10.8713 10.8713 10.8819 10.8819 k = 0.2443 0.2444 0.3573 ( 6546 PWs) bands (ev): -19.3656 -19.3656 -19.3654 -19.3654 -17.0434 -17.0434 -17.0393 -17.0393 -16.7560 -16.7560 -16.7507 -16.7507 -16.6790 -16.6790 -16.6737 -16.6737 -7.4637 -7.4637 -7.4630 -7.4630 -5.3857 -5.3857 -5.3811 -5.3811 -4.6037 -4.6037 -4.5999 -4.5999 -4.4651 -4.4651 -4.4589 -4.4589 -1.9913 -1.9913 -1.9873 -1.9873 -1.8091 -1.8091 -1.8044 -1.8044 -1.4271 -1.4271 -1.4239 -1.4239 -0.9581 -0.9581 -0.9479 -0.9479 -0.8831 -0.8831 -0.8753 -0.8753 0.1535 0.1535 0.1601 0.1601 0.4232 0.4232 0.4309 0.4309 0.7995 0.7995 0.8003 0.8003 8.7951 8.7951 8.7963 8.7963 10.3953 10.3953 10.4037 10.4037 10.8681 10.8681 10.8792 10.8792 k = 0.2332 0.2333 0.3573 ( 6550 PWs) bands (ev): -19.3704 -19.3704 -19.3701 -19.3701 -17.0387 -17.0387 -17.0347 -17.0347 -16.7520 -16.7520 -16.7466 -16.7466 -16.6778 -16.6778 -16.6724 -16.6724 -7.4910 -7.4910 -7.4903 -7.4903 -5.3651 -5.3651 -5.3605 -5.3605 -4.6142 -4.6142 -4.6103 -4.6103 -4.4749 -4.4749 -4.4688 -4.4688 -1.9783 -1.9783 -1.9743 -1.9743 -1.8074 -1.8074 -1.8029 -1.8029 -1.4128 -1.4128 -1.4099 -1.4099 -0.9620 -0.9620 -0.9526 -0.9526 -0.8840 -0.8840 -0.8770 -0.8770 0.1651 0.1651 0.1720 0.1720 0.4322 0.4322 0.4401 0.4401 0.8007 0.8007 0.8013 0.8013 8.7294 8.7294 8.7304 8.7304 10.4116 10.4116 10.4203 10.4203 10.8631 10.8631 10.8744 10.8744 k = 0.2221 0.2222 0.3573 ( 6550 PWs) bands (ev): -19.3751 -19.3751 -19.3749 -19.3749 -17.0342 -17.0342 -17.0303 -17.0303 -16.7479 -16.7479 -16.7425 -16.7425 -16.6766 -16.6766 -16.6712 -16.6712 -7.5174 -7.5174 -7.5168 -7.5168 -5.3463 -5.3463 -5.3418 -5.3418 -4.6237 -4.6237 -4.6198 -4.6198 -4.4843 -4.4843 -4.4783 -4.4783 -1.9652 -1.9652 -1.9612 -1.9612 -1.8051 -1.8051 -1.8008 -1.8008 -1.3988 -1.3988 -1.3960 -1.3960 -0.9669 -0.9669 -0.9582 -0.9582 -0.8858 -0.8858 -0.8792 -0.8792 0.1778 0.1778 0.1850 0.1850 0.4416 0.4416 0.4498 0.4498 0.8010 0.8010 0.8015 0.8015 8.6656 8.6656 8.6665 8.6665 10.4284 10.4284 10.4374 10.4374 10.8561 10.8561 10.8674 10.8674 k = 0.2110 0.2111 0.3573 ( 6550 PWs) bands (ev): -19.3798 -19.3798 -19.3795 -19.3795 -17.0298 -17.0298 -17.0260 -17.0260 -16.7438 -16.7438 -16.7383 -16.7383 -16.6754 -16.6754 -16.6700 -16.6700 -7.5429 -7.5429 -7.5423 -7.5423 -5.3292 -5.3292 -5.3248 -5.3248 -4.6322 -4.6322 -4.6283 -4.6283 -4.4932 -4.4932 -4.4874 -4.4874 -1.9523 -1.9523 -1.9483 -1.9483 -1.8018 -1.8018 -1.7977 -1.7977 -1.3852 -1.3852 -1.3826 -1.3826 -0.9726 -0.9726 -0.9643 -0.9643 -0.8885 -0.8885 -0.8824 -0.8824 0.1914 0.1914 0.1990 0.1990 0.4513 0.4513 0.4598 0.4598 0.8004 0.8004 0.8008 0.8008 8.6038 8.6038 8.6047 8.6047 10.4456 10.4456 10.4547 10.4547 10.8473 10.8473 10.8582 10.8582 k = 0.1999 0.2000 0.3573 ( 6554 PWs) bands (ev): -19.3843 -19.3843 -19.3841 -19.3841 -17.0255 -17.0255 -17.0219 -17.0219 -16.7397 -16.7397 -16.7341 -16.7341 -16.6743 -16.6743 -16.6689 -16.6689 -7.5675 -7.5675 -7.5668 -7.5668 -5.3140 -5.3140 -5.3096 -5.3096 -4.6398 -4.6398 -4.6358 -4.6358 -4.5016 -4.5016 -4.4960 -4.4960 -1.9402 -1.9402 -1.9362 -1.9362 -1.7971 -1.7971 -1.7932 -1.7932 -1.3719 -1.3719 -1.3695 -1.3695 -0.9785 -0.9785 -0.9707 -0.9707 -0.8924 -0.8924 -0.8866 -0.8866 0.2057 0.2057 0.2136 0.2136 0.4614 0.4614 0.4701 0.4701 0.7988 0.7988 0.7994 0.7994 8.5443 8.5443 8.5451 8.5451 10.4628 10.4628 10.4720 10.4720 10.8367 10.8367 10.8470 10.8470 k = 0.1888 0.1889 0.3573 ( 6550 PWs) bands (ev): -19.3887 -19.3887 -19.3885 -19.3885 -17.0214 -17.0214 -17.0179 -17.0179 -16.7356 -16.7356 -16.7299 -16.7299 -16.6733 -16.6733 -16.6679 -16.6679 -7.5910 -7.5910 -7.5904 -7.5904 -5.3005 -5.3005 -5.2963 -5.2963 -4.6462 -4.6462 -4.6422 -4.6422 -4.5095 -4.5095 -4.5041 -4.5041 -1.9294 -1.9294 -1.9255 -1.9255 -1.7903 -1.7903 -1.7867 -1.7867 -1.3592 -1.3592 -1.3569 -1.3569 -0.9847 -0.9847 -0.9772 -0.9772 -0.8975 -0.8975 -0.8920 -0.8920 0.2205 0.2205 0.2288 0.2288 0.4717 0.4717 0.4807 0.4807 0.7965 0.7965 0.7972 0.7972 8.4873 8.4873 8.4879 8.4879 10.4798 10.4798 10.4890 10.4890 10.8245 10.8245 10.8342 10.8342 k = 0.1777 0.1778 0.3573 ( 6542 PWs) bands (ev): -19.3930 -19.3930 -19.3928 -19.3928 -17.0174 -17.0174 -17.0141 -17.0141 -16.7315 -16.7315 -16.7258 -16.7258 -16.6724 -16.6724 -16.6669 -16.6669 -7.6134 -7.6134 -7.6128 -7.6128 -5.2889 -5.2889 -5.2848 -5.2848 -4.6517 -4.6517 -4.6477 -4.6477 -4.5168 -4.5168 -4.5115 -4.5115 -1.9203 -1.9203 -1.9167 -1.9167 -1.7811 -1.7811 -1.7779 -1.7779 -1.3470 -1.3470 -1.3448 -1.3448 -0.9909 -0.9909 -0.9837 -0.9837 -0.9038 -0.9038 -0.8985 -0.8985 0.2357 0.2357 0.2442 0.2442 0.4822 0.4822 0.4915 0.4915 0.7935 0.7935 0.7944 0.7944 8.4327 8.4327 8.4332 8.4332 10.4965 10.4965 10.5055 10.5055 10.8112 10.8112 10.8199 10.8199 k = 0.1666 0.1667 0.3573 ( 6538 PWs) bands (ev): -19.3971 -19.3971 -19.3969 -19.3969 -17.0136 -17.0136 -17.0104 -17.0104 -16.7274 -16.7274 -16.7216 -16.7216 -16.6716 -16.6716 -16.6661 -16.6661 -7.6347 -7.6347 -7.6341 -7.6341 -5.2789 -5.2789 -5.2751 -5.2751 -4.6563 -4.6563 -4.6523 -4.6523 -4.5234 -4.5234 -4.5183 -4.5183 -1.9133 -1.9133 -1.9100 -1.9100 -1.7693 -1.7693 -1.7665 -1.7665 -1.3354 -1.3354 -1.3333 -1.3333 -0.9971 -0.9971 -0.9901 -0.9901 -0.9112 -0.9112 -0.9061 -0.9061 0.2510 0.2510 0.2598 0.2598 0.4928 0.4928 0.5024 0.5024 0.7897 0.7897 0.7909 0.7909 8.3808 8.3808 8.3813 8.3813 10.5124 10.5124 10.5211 10.5211 10.7970 10.7970 10.8047 10.8047 k = 0.1555 0.1556 0.3573 ( 6534 PWs) bands (ev): -19.4010 -19.4010 -19.4008 -19.4008 -17.0100 -17.0100 -17.0070 -17.0070 -16.7233 -16.7233 -16.7176 -16.7176 -16.6709 -16.6709 -16.6654 -16.6654 -7.6548 -7.6548 -7.6543 -7.6543 -5.2706 -5.2706 -5.2670 -5.2670 -4.6601 -4.6601 -4.6560 -4.6560 -4.5294 -4.5294 -4.5244 -4.5244 -1.9084 -1.9084 -1.9054 -1.9054 -1.7548 -1.7548 -1.7525 -1.7525 -1.3245 -1.3245 -1.3223 -1.3223 -1.0031 -1.0031 -0.9964 -0.9964 -0.9197 -0.9197 -0.9147 -0.9147 0.2663 0.2663 0.2754 0.2754 0.5034 0.5034 0.5133 0.5133 0.7854 0.7854 0.7868 0.7868 8.3317 8.3317 8.3321 8.3321 10.5272 10.5272 10.5355 10.5355 10.7826 10.7826 10.7890 10.7890 k = 0.1444 0.1444 0.3573 ( 6546 PWs) bands (ev): -19.4047 -19.4047 -19.4046 -19.4046 -17.0066 -17.0066 -17.0038 -17.0038 -16.7193 -16.7193 -16.7136 -16.7136 -16.6703 -16.6703 -16.6648 -16.6648 -7.6738 -7.6738 -7.6733 -7.6733 -5.2638 -5.2638 -5.2604 -5.2604 -4.6632 -4.6632 -4.6591 -4.6591 -4.5346 -4.5346 -4.5298 -4.5298 -1.9053 -1.9053 -1.9027 -1.9027 -1.7383 -1.7383 -1.7364 -1.7364 -1.3142 -1.3142 -1.3121 -1.3121 -1.0089 -1.0089 -1.0024 -1.0024 -0.9292 -0.9292 -0.9243 -0.9243 0.2814 0.2814 0.2907 0.2907 0.5141 0.5141 0.5242 0.5242 0.7805 0.7805 0.7822 0.7822 8.2855 8.2855 8.2858 8.2858 10.5405 10.5405 10.5483 10.5483 10.7683 10.7683 10.7734 10.7734 k = 0.1333 0.1333 0.3573 ( 6546 PWs) bands (ev): -19.4083 -19.4083 -19.4081 -19.4081 -17.0034 -17.0034 -17.0007 -17.0007 -16.7154 -16.7154 -16.7097 -16.7097 -16.6699 -16.6699 -16.6643 -16.6643 -7.6914 -7.6914 -7.6909 -7.6909 -5.2583 -5.2583 -5.2551 -5.2551 -4.6657 -4.6657 -4.6615 -4.6615 -4.5391 -4.5391 -4.5344 -4.5344 -1.9038 -1.9038 -1.9015 -1.9015 -1.7200 -1.7200 -1.7185 -1.7185 -1.3046 -1.3046 -1.3025 -1.3025 -1.0145 -1.0145 -1.0082 -1.0082 -0.9396 -0.9396 -0.9348 -0.9348 0.2961 0.2961 0.3057 0.3057 0.5247 0.5247 0.5350 0.5350 0.7751 0.7751 0.7772 0.7772 8.2423 8.2423 8.2426 8.2426 10.5519 10.5519 10.5592 10.5592 10.7549 10.7549 10.7587 10.7587 k = 0.1221 0.1222 0.3573 ( 6546 PWs) bands (ev): -19.4116 -19.4116 -19.4114 -19.4114 -17.0004 -17.0004 -16.9980 -16.9980 -16.7116 -16.7116 -16.7058 -16.7058 -16.6696 -16.6696 -16.6640 -16.6640 -7.7078 -7.7078 -7.7074 -7.7074 -5.2541 -5.2541 -5.2511 -5.2511 -4.6678 -4.6678 -4.6635 -4.6635 -4.5429 -4.5429 -4.5383 -4.5383 -1.9034 -1.9034 -1.9014 -1.9014 -1.7005 -1.7005 -1.6994 -1.6994 -1.2956 -1.2956 -1.2936 -1.2936 -1.0198 -1.0198 -1.0137 -1.0137 -0.9507 -0.9507 -0.9459 -0.9459 0.3104 0.3104 0.3201 0.3201 0.5351 0.5351 0.5456 0.5456 0.7694 0.7694 0.7718 0.7718 8.2022 8.2022 8.2025 8.2025 10.5607 10.5607 10.5680 10.5680 10.7426 10.7426 10.7457 10.7457 k = 0.1110 0.1111 0.3573 ( 6540 PWs) bands (ev): -19.4146 -19.4146 -19.4145 -19.4145 -16.9976 -16.9976 -16.9954 -16.9954 -16.7079 -16.7079 -16.7022 -16.7022 -16.6694 -16.6694 -16.6638 -16.6638 -7.7229 -7.7229 -7.7225 -7.7225 -5.2508 -5.2508 -5.2481 -5.2481 -4.6695 -4.6695 -4.6650 -4.6650 -4.5460 -4.5460 -4.5414 -4.5414 -1.9038 -1.9038 -1.9021 -1.9021 -1.6804 -1.6804 -1.6796 -1.6796 -1.2874 -1.2874 -1.2854 -1.2854 -1.0248 -1.0248 -1.0188 -1.0188 -0.9623 -0.9623 -0.9575 -0.9575 0.3240 0.3240 0.3338 0.3338 0.5454 0.5454 0.5559 0.5559 0.7634 0.7634 0.7660 0.7660 8.1652 8.1652 8.1655 8.1655 10.5666 10.5666 10.5745 10.5745 10.7316 10.7316 10.7355 10.7355 k = 0.0999 0.1000 0.3573 ( 6532 PWs) bands (ev): -19.4174 -19.4174 -19.4173 -19.4173 -16.9951 -16.9951 -16.9931 -16.9931 -16.7044 -16.7044 -16.6986 -16.6986 -16.6694 -16.6694 -16.6638 -16.6638 -7.7366 -7.7366 -7.7362 -7.7362 -5.2484 -5.2484 -5.2460 -5.2460 -4.6710 -4.6710 -4.6664 -4.6664 -4.5484 -4.5484 -4.5438 -4.5438 -1.9048 -1.9048 -1.9032 -1.9032 -1.6602 -1.6602 -1.6595 -1.6595 -1.2800 -1.2800 -1.2780 -1.2780 -1.0295 -1.0295 -1.0236 -1.0236 -0.9742 -0.9742 -0.9694 -0.9694 0.3368 0.3368 0.3467 0.3467 0.5553 0.5553 0.5659 0.5659 0.7571 0.7571 0.7601 0.7601 8.1316 8.1316 8.1318 8.1318 10.5692 10.5692 10.5784 10.5784 10.7225 10.7225 10.7281 10.7281 k = 0.0888 0.0889 0.3573 ( 6528 PWs) bands (ev): -19.4200 -19.4200 -19.4199 -19.4199 -16.9928 -16.9928 -16.9910 -16.9910 -16.7010 -16.7010 -16.6952 -16.6952 -16.6695 -16.6695 -16.6640 -16.6640 -7.7490 -7.7490 -7.7486 -7.7486 -5.2468 -5.2468 -5.2446 -5.2446 -4.6724 -4.6724 -4.6675 -4.6675 -4.5503 -4.5503 -4.5456 -4.5456 -1.9061 -1.9061 -1.9047 -1.9047 -1.6401 -1.6401 -1.6396 -1.6396 -1.2733 -1.2733 -1.2713 -1.2713 -1.0339 -1.0339 -1.0281 -1.0281 -0.9862 -0.9862 -0.9814 -0.9814 0.3487 0.3487 0.3586 0.3586 0.5649 0.5649 0.5754 0.5754 0.7508 0.7508 0.7540 0.7540 8.1013 8.1013 8.1015 8.1015 10.5689 10.5689 10.5796 10.5796 10.7159 10.7159 10.7234 10.7234 k = 0.0777 0.0778 0.3573 ( 6532 PWs) bands (ev): -19.4222 -19.4222 -19.4221 -19.4221 -16.9908 -16.9908 -16.9892 -16.9892 -16.6977 -16.6977 -16.6921 -16.6921 -16.6698 -16.6698 -16.6643 -16.6643 -7.7599 -7.7599 -7.7596 -7.7596 -5.2457 -5.2457 -5.2438 -5.2438 -4.6735 -4.6735 -4.6685 -4.6685 -4.5516 -4.5516 -4.5468 -4.5468 -1.9076 -1.9076 -1.9063 -1.9063 -1.6208 -1.6208 -1.6203 -1.6203 -1.2674 -1.2674 -1.2655 -1.2655 -1.0380 -1.0380 -1.0322 -1.0322 -0.9980 -0.9980 -0.9930 -0.9930 0.3595 0.3595 0.3694 0.3694 0.5740 0.5740 0.5844 0.5844 0.7445 0.7445 0.7479 0.7479 8.0744 8.0744 8.0746 8.0746 10.5663 10.5663 10.5785 10.5785 10.7117 10.7117 10.7209 10.7209 k = 0.0666 0.0667 0.3573 ( 6540 PWs) bands (ev): -19.4242 -19.4242 -19.4241 -19.4241 -16.9890 -16.9890 -16.9876 -16.9876 -16.6946 -16.6946 -16.6891 -16.6891 -16.6702 -16.6702 -16.6648 -16.6648 -7.7695 -7.7695 -7.7691 -7.7691 -5.2450 -5.2450 -5.2433 -5.2433 -4.6746 -4.6746 -4.6693 -4.6693 -4.5525 -4.5525 -4.5476 -4.5476 -1.9091 -1.9091 -1.9079 -1.9079 -1.6027 -1.6027 -1.6021 -1.6021 -1.2624 -1.2624 -1.2605 -1.2605 -1.0418 -1.0418 -1.0360 -1.0360 -1.0092 -1.0092 -1.0040 -1.0040 0.3692 0.3692 0.3791 0.3791 0.5826 0.5826 0.5927 0.5927 0.7383 0.7383 0.7419 0.7419 8.0510 8.0510 8.0512 8.0512 10.5622 10.5622 10.5756 10.5756 10.7097 10.7097 10.7199 10.7199 k = 0.0555 0.0556 0.3573 ( 6532 PWs) bands (ev): -19.4259 -19.4259 -19.4258 -19.4258 -16.9874 -16.9874 -16.9863 -16.9863 -16.6917 -16.6917 -16.6864 -16.6864 -16.6707 -16.6707 -16.6654 -16.6654 -7.7776 -7.7776 -7.7772 -7.7772 -5.2446 -5.2446 -5.2432 -5.2432 -4.6756 -4.6756 -4.6701 -4.6701 -4.5530 -4.5530 -4.5481 -4.5481 -1.9105 -1.9105 -1.9094 -1.9094 -1.5861 -1.5861 -1.5855 -1.5855 -1.2581 -1.2581 -1.2563 -1.2563 -1.0454 -1.0454 -1.0395 -1.0395 -1.0194 -1.0194 -1.0139 -1.0139 0.3777 0.3777 0.3874 0.3874 0.5905 0.5905 0.6002 0.6002 0.7325 0.7325 0.7362 0.7362 8.0311 8.0311 8.0312 8.0312 10.5575 10.5575 10.5716 10.5716 10.7091 10.7091 10.7200 10.7200 k = 0.0444 0.0444 0.3573 ( 6536 PWs) bands (ev): -19.4273 -19.4273 -19.4272 -19.4272 -16.9862 -16.9862 -16.9852 -16.9852 -16.6891 -16.6891 -16.6840 -16.6840 -16.6712 -16.6712 -16.6663 -16.6663 -7.7842 -7.7842 -7.7839 -7.7839 -5.2444 -5.2444 -5.2433 -5.2433 -4.6764 -4.6764 -4.6707 -4.6707 -4.5533 -4.5533 -4.5483 -4.5483 -1.9118 -1.9118 -1.9108 -1.9108 -1.5716 -1.5716 -1.5709 -1.5709 -1.2546 -1.2546 -1.2530 -1.2530 -1.0489 -1.0489 -1.0428 -1.0428 -1.0281 -1.0281 -1.0223 -1.0223 0.3847 0.3847 0.3944 0.3944 0.5976 0.5976 0.6067 0.6067 0.7273 0.7273 0.7309 0.7309 8.0147 8.0147 8.0149 8.0149 10.5528 10.5528 10.5674 10.5674 10.7094 10.7094 10.7206 10.7206 k = 0.0333 0.0333 0.3573 ( 6544 PWs) bands (ev): -19.4284 -19.4284 -19.4283 -19.4283 -16.9851 -16.9851 -16.9844 -16.9844 -16.6867 -16.6867 -16.6821 -16.6821 -16.6717 -16.6717 -16.6672 -16.6672 -7.7894 -7.7894 -7.7891 -7.7891 -5.2443 -5.2443 -5.2434 -5.2434 -4.6770 -4.6770 -4.6713 -4.6713 -4.5535 -4.5535 -4.5484 -4.5484 -1.9129 -1.9129 -1.9119 -1.9119 -1.5597 -1.5597 -1.5589 -1.5589 -1.2520 -1.2520 -1.2505 -1.2505 -1.0522 -1.0522 -1.0462 -1.0462 -1.0345 -1.0345 -1.0287 -1.0287 0.3903 0.3903 0.3999 0.3999 0.6036 0.6036 0.6120 0.6120 0.7229 0.7229 0.7262 0.7262 8.0020 8.0020 8.0021 8.0021 10.5486 10.5486 10.5636 10.5636 10.7100 10.7100 10.7214 10.7214 k = 0.0222 0.0222 0.3573 ( 6550 PWs) bands (ev): -19.4291 -19.4291 -19.4291 -19.4291 -16.9844 -16.9844 -16.9839 -16.9839 -16.6845 -16.6845 -16.6809 -16.6809 -16.6719 -16.6719 -16.6683 -16.6683 -7.7931 -7.7931 -7.7928 -7.7928 -5.2442 -5.2442 -5.2436 -5.2436 -4.6775 -4.6775 -4.6716 -4.6716 -4.5535 -4.5535 -4.5484 -4.5484 -1.9136 -1.9136 -1.9127 -1.9127 -1.5507 -1.5507 -1.5500 -1.5500 -1.2501 -1.2501 -1.2488 -1.2488 -1.0551 -1.0551 -1.0495 -1.0495 -1.0386 -1.0386 -1.0332 -1.0332 0.3944 0.3944 0.4039 0.4039 0.6083 0.6083 0.6160 0.6160 0.7196 0.7196 0.7225 0.7225 7.9929 7.9929 7.9930 7.9930 10.5454 10.5454 10.5606 10.5606 10.7106 10.7106 10.7221 10.7221 k = 0.0111 0.0111 0.3573 ( 6570 PWs) bands (ev): -19.4296 -19.4296 -19.4296 -19.4296 -16.9839 -16.9839 -16.9836 -16.9836 -16.6827 -16.6827 -16.6806 -16.6806 -16.6716 -16.6716 -16.6695 -16.6695 -7.7954 -7.7954 -7.7951 -7.7951 -5.2442 -5.2442 -5.2438 -5.2438 -4.6778 -4.6778 -4.6719 -4.6719 -4.5535 -4.5535 -4.5484 -4.5484 -1.9141 -1.9141 -1.9132 -1.9132 -1.5452 -1.5452 -1.5444 -1.5444 -1.2490 -1.2490 -1.2478 -1.2478 -1.0572 -1.0572 -1.0520 -1.0520 -1.0406 -1.0406 -1.0357 -1.0357 0.3969 0.3969 0.4063 0.4063 0.6113 0.6113 0.6184 0.6184 0.7175 0.7175 0.7201 0.7201 7.9874 7.9874 7.9875 7.9875 10.5434 10.5434 10.5586 10.5586 10.7111 10.7111 10.7226 10.7226 k = 0.0000 0.0000 0.3573 ( 6582 PWs) bands (ev): -19.4298 -19.4298 -19.4298 -19.4298 -16.9836 -16.9836 -16.9836 -16.9836 -16.6816 -16.6816 -16.6811 -16.6811 -16.6709 -16.6709 -16.6704 -16.6704 -7.7961 -7.7961 -7.7958 -7.7958 -5.2442 -5.2442 -5.2439 -5.2439 -4.6779 -4.6779 -4.6720 -4.6720 -4.5535 -4.5535 -4.5484 -4.5484 -1.9143 -1.9143 -1.9134 -1.9134 -1.5434 -1.5434 -1.5425 -1.5425 -1.2486 -1.2486 -1.2474 -1.2474 -1.0579 -1.0579 -1.0529 -1.0529 -1.0412 -1.0412 -1.0365 -1.0365 0.3977 0.3977 0.4071 0.4071 0.6123 0.6123 0.6192 0.6192 0.7168 0.7168 0.7192 0.7192 7.9856 7.9856 7.9856 7.9856 10.5427 10.5427 10.5580 10.5580 10.7113 10.7113 10.7228 10.7228 k = 0.0000 0.0000 0.3573 ( 6582 PWs) bands (ev): -19.4298 -19.4298 -19.4298 -19.4298 -16.9836 -16.9836 -16.9836 -16.9836 -16.6816 -16.6816 -16.6811 -16.6811 -16.6709 -16.6709 -16.6704 -16.6704 -7.7961 -7.7961 -7.7958 -7.7958 -5.2442 -5.2442 -5.2439 -5.2439 -4.6779 -4.6779 -4.6720 -4.6720 -4.5535 -4.5535 -4.5484 -4.5484 -1.9143 -1.9143 -1.9134 -1.9134 -1.5434 -1.5434 -1.5425 -1.5425 -1.2486 -1.2486 -1.2474 -1.2474 -1.0579 -1.0579 -1.0529 -1.0529 -1.0412 -1.0412 -1.0365 -1.0365 0.3977 0.3977 0.4071 0.4071 0.6123 0.6123 0.6192 0.6192 0.7168 0.7168 0.7192 0.7192 7.9856 7.9856 7.9856 7.9856 10.5427 10.5427 10.5580 10.5580 10.7113 10.7113 10.7228 10.7228 k = 0.0000 0.0000 0.3417 ( 6573 PWs) bands (ev): -19.4378 -19.4378 -19.4217 -19.4217 -16.9976 -16.9975 -16.9698 -16.9698 -16.6818 -16.6814 -16.6814 -16.6806 -16.6714 -16.6707 -16.6704 -16.6701 -7.8393 -7.8391 -7.7518 -7.7515 -5.2731 -5.2728 -5.2165 -5.2162 -4.6921 -4.6860 -4.6634 -4.6576 -4.5707 -4.5654 -4.5362 -4.5312 -1.9161 -1.9150 -1.9130 -1.9123 -1.5725 -1.5716 -1.5144 -1.5137 -1.2645 -1.2636 -1.2323 -1.2308 -1.0718 -1.0613 -1.0571 -1.0472 -1.0426 -1.0419 -1.0274 -1.0267 0.3750 0.3841 0.4204 0.4300 0.6051 0.6113 0.6128 0.6196 0.7088 0.7136 0.7316 0.7323 7.8999 7.8999 8.0728 8.0728 10.5041 10.5199 10.5794 10.5938 10.7052 10.7174 10.7183 10.7290 k = 0.0000 0.0000 0.3262 ( 6569 PWs) bands (ev): -19.4457 -19.4457 -19.4136 -19.4136 -17.0115 -17.0115 -16.9562 -16.9562 -16.6820 -16.6817 -16.6811 -16.6801 -16.6719 -16.6710 -16.6699 -16.6697 -7.8813 -7.8811 -7.7064 -7.7061 -5.3032 -5.3029 -5.1900 -5.1898 -4.7059 -4.6997 -4.6487 -4.6430 -4.5878 -4.5822 -4.5189 -4.5141 -1.9184 -1.9172 -1.9124 -1.9118 -1.6016 -1.6007 -1.4860 -1.4855 -1.2798 -1.2791 -1.2155 -1.2138 -1.0853 -1.0711 -1.0693 -1.0556 -1.0329 -1.0291 -1.0166 -1.0129 0.3526 0.3614 0.4428 0.4527 0.5915 0.5963 0.6080 0.6148 0.7082 0.7153 0.7505 0.7507 7.8159 7.8159 8.1612 8.1612 10.4643 10.4805 10.6131 10.6262 10.6997 10.7126 10.7269 10.7365 k = 0.0000 0.0000 0.3107 ( 6561 PWs) bands (ev): -19.4534 -19.4534 -19.4054 -19.4054 -17.0254 -17.0254 -16.9428 -16.9428 -16.6821 -16.6819 -16.6808 -16.6796 -16.6724 -16.6712 -16.6695 -16.6694 -7.9220 -7.9217 -7.6601 -7.6598 -5.3346 -5.3341 -5.1648 -5.1647 -4.7192 -4.7129 -4.6339 -4.6283 -4.6046 -4.5988 -4.5016 -4.4970 -1.9211 -1.9198 -1.9123 -1.9118 -1.6304 -1.6294 -1.4588 -1.4584 -1.2943 -1.2939 -1.1984 -1.1965 -1.0979 -1.0838 -1.0778 -1.0644 -1.0234 -1.0153 -1.0061 -0.9984 0.3305 0.3390 0.4643 0.4743 0.5739 0.5773 0.6002 0.6071 0.7133 0.7218 0.7713 0.7719 7.7339 7.7339 8.2504 8.2504 10.4242 10.4406 10.6431 10.6543 10.6944 10.7079 10.7374 10.7453 k = 0.0000 0.0000 0.2951 ( 6569 PWs) bands (ev): -19.4610 -19.4610 -19.3973 -19.3973 -17.0393 -17.0393 -16.9298 -16.9297 -16.6822 -16.6821 -16.6805 -16.6789 -16.6728 -16.6713 -16.6690 -16.6690 -7.9613 -7.9610 -7.6131 -7.6128 -5.3670 -5.3665 -5.1409 -5.1408 -4.7321 -4.7257 -4.6214 -4.6204 -4.6136 -4.6132 -4.4845 -4.4801 -1.9243 -1.9229 -1.9128 -1.9125 -1.6587 -1.6577 -1.4333 -1.4332 -1.3078 -1.3078 -1.1812 -1.1789 -1.1093 -1.0957 -1.0854 -1.0726 -1.0139 -1.0024 -0.9948 -0.9841 0.3089 0.3171 0.4831 0.4925 0.5564 0.5582 0.5912 0.5981 0.7216 0.7309 0.7933 0.7940 7.6542 7.6542 8.3402 8.3403 10.3844 10.4009 10.6686 10.6774 10.6888 10.7030 10.7496 10.7555 k = 0.0000 0.0000 0.2796 ( 6569 PWs) bands (ev): -19.4683 -19.4683 -19.3893 -19.3893 -17.0529 -17.0529 -16.9172 -16.9171 -16.6823 -16.6823 -16.6801 -16.6782 -16.6733 -16.6714 -16.6686 -16.6686 -7.9990 -7.9988 -7.5654 -7.5651 -5.4005 -5.3999 -5.1183 -5.1182 -4.7445 -4.7380 -4.6374 -4.6317 -4.6033 -4.5985 -4.4676 -4.4635 -1.9278 -1.9263 -1.9139 -1.9138 -1.6862 -1.6852 -1.4110 -1.4104 -1.3205 -1.3201 -1.1638 -1.1612 -1.1190 -1.1062 -1.0921 -1.0801 -1.0044 -0.9910 -0.9823 -0.9700 0.2878 0.2957 0.4921 0.4981 0.5473 0.5494 0.5817 0.5885 0.7317 0.7415 0.8154 0.8162 7.5769 7.5769 8.4303 8.4303 10.3457 10.3622 10.6817 10.6891 10.6966 10.6983 10.7626 10.7665 k = 0.0000 0.0000 0.2641 ( 6561 PWs) bands (ev): -19.4755 -19.4755 -19.3814 -19.3814 -17.0664 -17.0664 -16.9050 -16.9049 -16.6824 -16.6823 -16.6798 -16.6774 -16.6737 -16.6713 -16.6683 -16.6681 -8.0352 -8.0350 -7.5172 -7.5169 -5.4349 -5.4344 -5.0969 -5.0969 -4.7562 -4.7496 -4.6531 -4.6471 -4.5884 -4.5837 -4.4510 -4.4471 -1.9316 -1.9300 -1.9157 -1.9156 -1.7130 -1.7119 -1.3932 -1.3917 -1.3313 -1.3302 -1.1466 -1.1435 -1.1261 -1.1149 -1.0975 -1.0866 -0.9951 -0.9807 -0.9690 -0.9562 0.2674 0.2749 0.4819 0.4839 0.5545 0.5604 0.5728 0.5787 0.7426 0.7527 0.8374 0.8382 7.5023 7.5023 8.5201 8.5202 10.3085 10.3251 10.6736 10.6890 10.7090 10.7122 10.7751 10.7773 k = 0.0000 0.0000 0.2485 ( 6543 PWs) bands (ev): -19.4823 -19.4823 -19.3737 -19.3737 -17.0795 -17.0795 -16.8933 -16.8932 -16.6824 -16.6823 -16.6795 -16.6765 -16.6740 -16.6711 -16.6679 -16.6677 -8.0698 -8.0696 -7.4687 -7.4683 -5.4702 -5.4696 -5.0768 -5.0768 -4.7673 -4.7607 -4.6683 -4.6622 -4.5736 -4.5691 -4.4348 -4.4311 -1.9357 -1.9339 -1.9180 -1.9178 -1.7387 -1.7376 -1.3825 -1.3799 -1.3383 -1.3366 -1.1333 -1.1269 -1.1259 -1.1216 -1.1009 -1.0915 -0.9859 -0.9712 -0.9556 -0.9427 0.2477 0.2548 0.4607 0.4615 0.5618 0.5689 0.5722 0.5812 0.7539 0.7642 0.8588 0.8596 7.4307 7.4307 8.6094 8.6095 10.2736 10.2900 10.6630 10.6798 10.7242 10.7261 10.7854 10.7867 k = 0.0000 0.0000 0.2330 ( 6555 PWs) bands (ev): -19.4889 -19.4889 -19.3661 -19.3661 -17.0922 -17.0922 -16.8822 -16.8821 -16.6825 -16.6823 -16.6793 -16.6759 -16.6740 -16.6707 -16.6675 -16.6673 -8.1026 -8.1025 -7.4199 -7.4195 -5.5063 -5.5057 -5.0581 -5.0580 -4.7778 -4.7711 -4.6830 -4.6768 -4.5590 -4.5547 -4.4191 -4.4157 -1.9398 -1.9380 -1.9209 -1.9205 -1.7634 -1.7623 -1.3807 -1.3779 -1.3393 -1.3381 -1.1339 -1.1269 -1.1119 -1.1087 -1.1008 -1.0937 -0.9770 -0.9621 -0.9423 -0.9297 0.2287 0.2354 0.4364 0.4368 0.5530 0.5596 0.5922 0.6016 0.7653 0.7757 0.8795 0.8803 7.3621 7.3621 8.6975 8.6976 10.2414 10.2575 10.6493 10.6673 10.7380 10.7392 10.7930 10.7941 k = 0.0000 0.0000 0.2175 ( 6565 PWs) bands (ev): -19.4952 -19.4951 -19.3588 -19.3588 -17.1045 -17.1045 -16.8717 -16.8716 -16.6825 -16.6823 -16.6791 -16.6758 -16.6733 -16.6702 -16.6672 -16.6670 -8.1337 -8.1335 -7.3712 -7.3708 -5.5430 -5.5424 -5.0405 -5.0405 -4.7875 -4.7808 -4.6971 -4.6908 -4.5448 -4.5406 -4.4040 -4.4008 -1.9441 -1.9421 -1.9242 -1.9236 -1.7868 -1.7858 -1.3853 -1.3831 -1.3375 -1.3375 -1.1345 -1.1314 -1.0985 -1.0978 -1.0905 -1.0894 -0.9684 -0.9536 -0.9292 -0.9170 0.2106 0.2169 0.4113 0.4115 0.5444 0.5506 0.6129 0.6224 0.7765 0.7869 0.8994 0.9001 7.2969 7.2969 8.7840 8.7842 10.2124 10.2283 10.6317 10.6507 10.7506 10.7518 10.7976 10.7992 k = 0.0000 0.0000 0.2019 ( 6545 PWs) bands (ev): -19.5011 -19.5011 -19.3518 -19.3518 -17.1163 -17.1163 -16.8618 -16.8617 -16.6825 -16.6823 -16.6790 -16.6760 -16.6722 -16.6694 -16.6668 -16.6666 -8.1629 -8.1627 -7.3227 -7.3223 -5.5801 -5.5795 -5.0242 -5.0241 -4.7965 -4.7899 -4.7105 -4.7042 -4.5309 -4.5270 -4.3895 -4.3865 -1.9483 -1.9463 -1.9279 -1.9271 -1.8090 -1.8080 -1.3924 -1.3907 -1.3385 -1.3371 -1.1356 -1.1355 -1.0897 -1.0891 -1.0758 -1.0741 -0.9601 -0.9455 -0.9164 -0.9048 0.1933 0.1993 0.3863 0.3864 0.5362 0.5420 0.6333 0.6429 0.7875 0.7978 0.9182 0.9189 7.2353 7.2353 8.8682 8.8685 10.1872 10.2028 10.6097 10.6293 10.7621 10.7642 10.7995 10.8026 k = 0.0000 0.0000 0.1864 ( 6545 PWs) bands (ev): -19.5066 -19.5066 -19.3451 -19.3451 -17.1275 -17.1274 -16.8527 -16.8526 -16.6825 -16.6823 -16.6789 -16.6763 -16.6710 -16.6685 -16.6665 -16.6663 -8.1902 -8.1900 -7.2746 -7.2742 -5.6175 -5.6169 -5.0092 -5.0091 -4.8048 -4.7981 -4.7233 -4.7170 -4.5175 -4.5138 -4.3758 -4.3730 -1.9525 -1.9504 -1.9318 -1.9309 -1.8299 -1.8288 -1.4000 -1.3988 -1.3420 -1.3397 -1.1396 -1.1375 -1.0786 -1.0768 -1.0602 -1.0580 -0.9522 -0.9380 -0.9040 -0.8931 0.1771 0.1826 0.3616 0.3617 0.5285 0.5339 0.6532 0.6628 0.7980 0.8082 0.9360 0.9366 7.1773 7.1773 8.9494 8.9497 10.1665 10.1816 10.5834 10.6031 10.7711 10.7757 10.7992 10.8065 k = 0.0000 0.0000 0.1709 ( 6545 PWs) bands (ev): -19.5118 -19.5118 -19.3387 -19.3387 -17.1380 -17.1380 -16.8443 -16.8442 -16.6824 -16.6822 -16.6789 -16.6767 -16.6695 -16.6675 -16.6662 -16.6659 -8.2155 -8.2154 -7.2274 -7.2270 -5.6549 -5.6542 -4.9953 -4.9953 -4.8122 -4.8057 -4.7353 -4.7291 -4.5047 -4.5013 -4.3628 -4.3603 -1.9566 -1.9544 -1.9359 -1.9348 -1.8493 -1.8483 -1.4074 -1.4065 -1.3478 -1.3448 -1.1434 -1.1404 -1.0645 -1.0620 -1.0449 -1.0426 -0.9447 -0.9310 -0.8920 -0.8819 0.1618 0.1669 0.3377 0.3378 0.5214 0.5263 0.6722 0.6817 0.8079 0.8180 0.9527 0.9532 7.1232 7.1232 9.0268 9.0272 10.1508 10.1654 10.5538 10.5729 10.7728 10.7815 10.7855 10.7865 k = 0.0000 0.0000 0.1553 ( 6553 PWs) bands (ev): -19.5166 -19.5166 -19.3328 -19.3328 -17.1478 -17.1478 -16.8367 -16.8365 -16.6824 -16.6822 -16.6789 -16.6770 -16.6681 -16.6664 -16.6658 -16.6657 -8.2388 -8.2387 -7.1811 -7.1807 -5.6919 -5.6913 -4.9828 -4.9827 -4.8189 -4.8125 -4.7466 -4.7404 -4.4926 -4.4895 -4.3508 -4.3484 -1.9604 -1.9582 -1.9402 -1.9389 -1.8674 -1.8663 -1.4141 -1.4135 -1.3552 -1.3518 -1.1468 -1.1435 -1.0491 -1.0460 -1.0300 -1.0280 -0.9377 -0.9246 -0.8804 -0.8712 0.1476 0.1523 0.3148 0.3149 0.5148 0.5194 0.6903 0.6996 0.8172 0.8270 0.9680 0.9686 7.0732 7.0732 9.0995 9.1000 10.1409 10.1549 10.5224 10.5404 10.7515 10.7548 10.7806 10.7853 k = 0.0000 0.0000 0.1398 ( 6549 PWs) bands (ev): -19.5210 -19.5210 -19.3273 -19.3272 -17.1569 -17.1569 -16.8298 -16.8296 -16.6823 -16.6822 -16.6790 -16.6773 -16.6666 -16.6658 -16.6654 -16.6649 -8.2600 -8.2599 -7.1364 -7.1360 -5.7283 -5.7277 -4.9714 -4.9713 -4.8248 -4.8186 -4.7570 -4.7510 -4.4814 -4.4785 -4.3396 -4.3375 -1.9640 -1.9617 -1.9444 -1.9429 -1.8839 -1.8829 -1.4201 -1.4198 -1.3636 -1.3599 -1.1499 -1.1465 -1.0335 -1.0296 -1.0155 -1.0143 -0.9311 -0.9189 -0.8693 -0.8610 0.1345 0.1387 0.2932 0.2932 0.5088 0.5130 0.7074 0.7164 0.8258 0.8353 0.9822 0.9826 7.0274 7.0274 9.1664 9.1671 10.1374 10.1507 10.4905 10.5073 10.7252 10.7275 10.7775 10.7818 k = 0.0000 0.0000 0.1243 ( 6541 PWs) bands (ev): -19.5250 -19.5250 -19.3222 -19.3222 -17.1652 -17.1652 -16.8237 -16.8235 -16.6823 -16.6821 -16.6790 -16.6776 -16.6655 -16.6652 -16.6650 -16.6637 -8.2791 -8.2790 -7.0935 -7.0931 -5.7636 -5.7630 -4.9612 -4.9611 -4.8299 -4.8239 -4.7666 -4.7607 -4.4710 -4.4684 -4.3295 -4.3276 -1.9672 -1.9648 -1.9485 -1.9469 -1.8989 -1.8979 -1.4253 -1.4251 -1.3723 -1.3686 -1.1526 -1.1494 -1.0188 -1.0139 -1.0016 -1.0014 -0.9250 -0.9137 -0.8588 -0.8515 0.1226 0.1264 0.2730 0.2730 0.5035 0.5072 0.7232 0.7318 0.8336 0.8426 0.9949 0.9953 6.9861 6.9861 9.2268 9.2276 10.1408 10.1534 10.4597 10.4752 10.6983 10.6997 10.7733 10.7768 k = 0.0000 0.0000 0.1087 ( 6541 PWs) bands (ev): -19.5285 -19.5285 -19.3177 -19.3177 -17.1727 -17.1726 -16.8183 -16.8182 -16.6822 -16.6821 -16.6791 -16.6779 -16.6652 -16.6650 -16.6636 -16.6625 -8.2961 -8.2960 -7.0531 -7.0527 -5.7973 -5.7968 -4.9523 -4.9522 -4.8341 -4.8284 -4.7752 -4.7696 -4.4615 -4.4593 -4.3204 -4.3187 -1.9700 -1.9675 -1.9524 -1.9506 -1.9123 -1.9114 -1.4296 -1.4295 -1.3811 -1.3775 -1.1549 -1.1520 -1.0057 -0.9999 -0.9891 -0.9881 -0.9194 -0.9092 -0.8491 -0.8427 0.1120 0.1153 0.2545 0.2545 0.4988 0.5020 0.7376 0.7457 0.8406 0.8491 1.0063 1.0067 6.9492 6.9492 9.2797 9.2806 10.1517 10.1635 10.4308 10.4450 10.6699 10.6707 10.7685 10.7713 k = 0.0000 0.0000 0.0932 ( 6525 PWs) bands (ev): -19.5316 -19.5316 -19.3137 -19.3137 -17.1792 -17.1792 -16.8138 -16.8136 -16.6822 -16.6821 -16.6791 -16.6782 -16.6650 -16.6648 -16.6622 -16.6613 -8.3109 -8.3108 -7.0157 -7.0153 -5.8289 -5.8284 -4.9445 -4.9445 -4.8376 -4.8323 -4.7828 -4.7776 -4.4532 -4.4512 -4.3124 -4.3109 -1.9723 -1.9697 -1.9560 -1.9540 -1.9242 -1.9234 -1.4331 -1.4328 -1.3896 -1.3861 -1.1569 -1.1543 -0.9944 -0.9882 -0.9771 -0.9753 -0.9143 -0.9054 -0.8401 -0.8347 0.1027 0.1055 0.2379 0.2379 0.4947 0.4975 0.7506 0.7581 0.8467 0.8545 1.0162 1.0166 6.9170 6.9170 9.3246 9.3257 10.1700 10.1811 10.4048 10.4178 10.6394 10.6396 10.7636 10.7658 k = 0.0000 0.0000 0.0777 ( 6541 PWs) bands (ev): -19.5342 -19.5342 -19.3103 -19.3103 -17.1848 -17.1848 -16.8099 -16.8098 -16.6822 -16.6820 -16.6791 -16.6784 -16.6648 -16.6647 -16.6609 -16.6602 -8.3234 -8.3233 -6.9820 -6.9817 -5.8575 -5.8571 -4.9380 -4.9379 -4.8403 -4.8356 -4.7893 -4.7846 -4.4459 -4.4442 -4.3055 -4.3043 -1.9741 -1.9714 -1.9593 -1.9570 -1.9345 -1.9340 -1.4356 -1.4351 -1.3975 -1.3943 -1.1584 -1.1562 -0.9850 -0.9792 -0.9658 -0.9637 -0.9097 -0.9023 -0.8321 -0.8277 0.0947 0.0971 0.2234 0.2234 0.4913 0.4937 0.7620 0.7687 0.8520 0.8589 1.0247 1.0250 6.8895 6.8895 9.3614 9.3625 10.1952 10.2058 10.3821 10.3941 10.6060 10.6063 10.7590 10.7607 k = 0.0000 0.0000 0.0621 ( 6549 PWs) bands (ev): -19.5363 -19.5363 -19.3074 -19.3074 -17.1894 -17.1894 -16.8068 -16.8067 -16.6821 -16.6820 -16.6792 -16.6786 -16.6647 -16.6645 -16.6598 -16.6593 -8.3337 -8.3337 -6.9528 -6.9526 -5.8826 -5.8822 -4.9326 -4.9326 -4.8423 -4.8382 -4.7947 -4.7906 -4.4398 -4.4385 -4.2998 -4.2988 -1.9753 -1.9725 -1.9622 -1.9595 -1.9433 -1.9430 -1.4372 -1.4366 -1.4047 -1.4018 -1.1597 -1.1579 -0.9773 -0.9722 -0.9558 -0.9538 -0.9058 -0.8998 -0.8253 -0.8218 0.0881 0.0900 0.2112 0.2112 0.4885 0.4904 0.7717 0.7774 0.8564 0.8623 1.0317 1.0319 6.8669 6.8669 9.3902 9.3913 10.2263 10.2367 10.3634 10.3748 10.5699 10.5705 10.7549 10.7563 k = 0.0000 0.0000 0.0466 ( 6565 PWs) bands (ev): -19.5380 -19.5380 -19.3052 -19.3052 -17.1930 -17.1930 -16.8044 -16.8043 -16.6821 -16.6820 -16.6792 -16.6787 -16.6646 -16.6645 -16.6589 -16.6585 -8.3417 -8.3417 -6.9290 -6.9288 -5.9032 -5.9029 -4.9285 -4.9285 -4.8436 -4.8403 -4.7988 -4.7955 -4.4350 -4.4340 -4.2953 -4.2946 -1.9758 -1.9730 -1.9645 -1.9615 -1.9506 -1.9505 -1.4380 -1.4372 -1.4108 -1.4083 -1.1606 -1.1592 -0.9712 -0.9672 -0.9476 -0.9459 -0.9024 -0.8980 -0.8197 -0.8171 0.0830 0.0844 0.2015 0.2016 0.4865 0.4879 0.7797 0.7842 0.8600 0.8647 1.0371 1.0373 6.8492 6.8492 9.4117 9.4126 10.2612 10.2721 10.3495 10.3608 10.5313 10.5320 10.7516 10.7526 k = 0.0000 0.0000 0.0311 ( 6565 PWs) bands (ev): -19.5392 -19.5392 -19.3036 -19.3036 -17.1956 -17.1956 -16.8027 -16.8026 -16.6821 -16.6820 -16.6792 -16.6789 -16.6645 -16.6644 -16.6582 -16.6579 -8.3475 -8.3475 -6.9112 -6.9110 -5.9186 -5.9184 -4.9255 -4.9255 -4.8443 -4.8420 -4.8016 -4.7993 -4.4315 -4.4308 -4.2921 -4.2916 -1.9757 -1.9731 -1.9661 -1.9627 -1.9567 -1.9559 -1.4380 -1.4372 -1.4156 -1.4137 -1.1611 -1.1602 -0.9666 -0.9639 -0.9415 -0.9403 -0.8998 -0.8969 -0.8155 -0.8138 0.0794 0.0803 0.1945 0.1945 0.4850 0.4860 0.7857 0.7888 0.8628 0.8661 1.0411 1.0412 6.8366 6.8366 9.4264 9.4271 10.2951 10.3072 10.3437 10.3559 10.4906 10.4913 10.7492 10.7499 k = 0.0000 0.0000 0.0155 ( 6565 PWs) bands (ev): -19.5400 -19.5400 -19.3026 -19.3026 -17.1972 -17.1972 -16.8017 -16.8016 -16.6820 -16.6820 -16.6791 -16.6790 -16.6644 -16.6644 -16.6577 -16.6576 -8.3509 -8.3509 -6.9002 -6.9001 -5.9282 -5.9281 -4.9237 -4.9237 -4.8444 -4.8432 -4.8031 -4.8019 -4.4293 -4.4290 -4.2901 -4.2898 -1.9750 -1.9733 -1.9665 -1.9633 -1.9611 -1.9597 -1.4375 -1.4370 -1.4186 -1.4175 -1.1614 -1.1609 -0.9636 -0.9623 -0.9376 -0.9370 -0.8979 -0.8965 -0.8127 -0.8119 0.0773 0.0778 0.1903 0.1903 0.4843 0.4847 0.7897 0.7913 0.8649 0.8665 1.0434 1.0435 6.8289 6.8289 9.4350 9.4354 10.3152 10.3211 10.3654 10.3714 10.4486 10.4490 10.7478 10.7481 k = 0.0000 0.0000 0.0000 ( 6577 PWs) bands (ev): -19.5402 -19.5402 -19.3023 -19.3023 -17.1977 -17.1977 -16.8013 -16.8013 -16.6820 -16.6820 -16.6791 -16.6791 -16.6644 -16.6644 -16.6576 -16.6576 -8.3521 -8.3521 -6.8965 -6.8965 -5.9314 -5.9314 -4.9231 -4.9231 -4.8440 -4.8440 -4.8032 -4.8032 -4.4285 -4.4285 -4.2893 -4.2893 -1.9741 -1.9741 -1.9651 -1.9651 -1.9618 -1.9618 -1.4370 -1.4370 -1.4193 -1.4193 -1.1613 -1.1613 -0.9622 -0.9622 -0.9361 -0.9361 -0.8968 -0.8968 -0.8115 -0.8115 0.0768 0.0768 0.1888 0.1888 0.4842 0.4842 0.7916 0.7916 0.8661 0.8661 1.0442 1.0442 6.8264 6.8264 9.4380 9.4380 10.3201 10.3201 10.4058 10.4058 10.4073 10.4073 10.7474 10.7474 k = 0.0000 0.0000 0.0000 ( 6577 PWs) bands (ev): -19.5402 -19.5402 -19.3023 -19.3023 -17.1977 -17.1977 -16.8013 -16.8013 -16.6820 -16.6820 -16.6791 -16.6791 -16.6644 -16.6644 -16.6576 -16.6576 -8.3521 -8.3521 -6.8965 -6.8965 -5.9314 -5.9314 -4.9231 -4.9231 -4.8440 -4.8440 -4.8032 -4.8032 -4.4285 -4.4285 -4.2893 -4.2893 -1.9741 -1.9741 -1.9651 -1.9651 -1.9618 -1.9618 -1.4370 -1.4370 -1.4193 -1.4193 -1.1613 -1.1613 -0.9622 -0.9622 -0.9361 -0.9361 -0.8968 -0.8968 -0.8115 -0.8115 0.0768 0.0768 0.1888 0.1888 0.4842 0.4842 0.7916 0.7916 0.8661 0.8661 1.0442 1.0442 6.8264 6.8264 9.4380 9.4380 10.3201 10.3201 10.4058 10.4058 10.4073 10.4073 10.7474 10.7474 k =-0.0111 0.0111 0.0000 ( 6565 PWs) bands (ev): -19.5399 -19.5399 -19.3023 -19.3023 -17.1978 -17.1975 -16.8014 -16.8014 -16.6825 -16.6818 -16.6792 -16.6791 -16.6649 -16.6648 -16.6576 -16.6575 -8.3509 -8.3509 -6.8965 -6.8963 -5.9316 -5.9310 -4.9230 -4.9222 -4.8438 -4.8430 -4.8039 -4.8039 -4.4290 -4.4285 -4.2893 -4.2893 -1.9858 -1.9813 -1.9693 -1.9693 -1.9494 -1.9465 -1.4371 -1.4371 -1.4197 -1.4187 -1.1613 -1.1610 -0.9625 -0.9623 -0.9366 -0.9360 -0.8975 -0.8969 -0.8125 -0.8123 0.0768 0.0772 0.1890 0.1891 0.4834 0.4838 0.7911 0.7911 0.8656 0.8656 1.0436 1.0436 6.8289 6.8289 9.4383 9.4383 10.3209 10.3217 10.4054 10.4062 10.4069 10.4072 10.7476 10.7480 k =-0.0222 0.0222 0.0000 ( 6569 PWs) bands (ev): -19.5391 -19.5391 -19.3023 -19.3022 -17.1977 -17.1971 -16.8015 -16.8015 -16.6833 -16.6819 -16.6794 -16.6792 -16.6665 -16.6663 -16.6577 -16.6575 -8.3474 -8.3474 -6.8964 -6.8960 -5.9318 -5.9306 -4.9217 -4.9201 -4.8424 -4.8408 -4.8060 -4.8060 -4.4300 -4.4291 -4.2892 -4.2892 -2.0022 -1.9977 -1.9695 -1.9680 -1.9333 -1.9303 -1.4374 -1.4373 -1.4197 -1.4178 -1.1611 -1.1604 -0.9633 -0.9630 -0.9374 -0.9363 -0.8988 -0.8975 -0.8154 -0.8150 0.0775 0.0782 0.1896 0.1899 0.4815 0.4823 0.7896 0.7896 0.8639 0.8640 1.0416 1.0416 6.8366 6.8366 9.4392 9.4392 10.3241 10.3258 10.4045 10.4048 10.4069 10.4078 10.7483 10.7492 k =-0.0333 0.0333 0.0000 ( 6565 PWs) bands (ev): -19.5378 -19.5378 -19.3023 -19.3022 -17.1974 -17.1965 -16.8016 -16.8016 -16.6843 -16.6823 -16.6797 -16.6794 -16.6691 -16.6688 -16.6577 -16.6574 -8.3415 -8.3415 -6.8961 -6.8956 -5.9319 -5.9301 -4.9193 -4.9170 -4.8399 -4.8375 -4.8096 -4.8095 -4.4316 -4.4302 -4.2890 -4.2890 -2.0190 -2.0145 -1.9688 -1.9661 -1.9173 -1.9144 -1.4377 -1.4376 -1.4195 -1.4167 -1.1606 -1.1597 -0.9647 -0.9643 -0.9387 -0.9370 -0.9007 -0.8988 -0.8199 -0.8193 0.0787 0.0797 0.1907 0.1911 0.4785 0.4798 0.7871 0.7873 0.8612 0.8614 1.0384 1.0384 6.8493 6.8493 9.4406 9.4407 10.3297 10.3322 10.4023 10.4023 10.4075 10.4093 10.7496 10.7508 k =-0.0444 0.0444 0.0000 ( 6561 PWs) bands (ev): -19.5360 -19.5360 -19.3022 -19.3021 -17.1970 -17.1958 -16.8019 -16.8019 -16.6856 -16.6831 -16.6800 -16.6797 -16.6725 -16.6723 -16.6578 -16.6574 -8.3333 -8.3333 -6.8958 -6.8950 -5.9319 -5.9295 -4.9158 -4.9127 -4.8364 -4.8331 -4.8144 -4.8142 -4.4336 -4.4318 -4.2888 -4.2887 -2.0358 -2.0311 -1.9675 -1.9636 -1.9017 -1.8990 -1.4382 -1.4380 -1.4190 -1.4153 -1.1602 -1.1589 -0.9668 -0.9661 -0.9404 -0.9381 -0.9033 -0.9008 -0.8259 -0.8251 0.0804 0.0818 0.1923 0.1928 0.4744 0.4761 0.7838 0.7839 0.8575 0.8577 1.0339 1.0340 6.8671 6.8671 9.4427 9.4427 10.3375 10.3409 10.3989 10.3992 10.4088 10.4115 10.7510 10.7526 k =-0.0556 0.0555 0.0000 ( 6557 PWs) bands (ev): -19.5336 -19.5336 -19.3021 -19.3020 -17.1964 -17.1949 -16.8022 -16.8022 -16.6873 -16.6843 -16.6804 -16.6801 -16.6768 -16.6766 -16.6580 -16.6574 -8.3227 -8.3227 -6.8953 -6.8944 -5.9318 -5.9289 -4.9112 -4.9074 -4.8325 -4.8283 -4.8199 -4.8195 -4.4361 -4.4338 -4.2884 -4.2884 -2.0524 -2.0476 -1.9656 -1.9606 -1.8868 -1.8842 -1.4386 -1.4384 -1.4183 -1.4138 -1.1598 -1.1583 -0.9695 -0.9687 -0.9425 -0.9396 -0.9066 -0.9033 -0.8330 -0.8320 0.0827 0.0844 0.1942 0.1950 0.4693 0.4715 0.7795 0.7797 0.8526 0.8529 1.0282 1.0282 6.8898 6.8898 9.4453 9.4454 10.3474 10.3518 10.3949 10.3953 10.4109 10.4143 10.7523 10.7542 k =-0.0667 0.0666 0.0000 ( 6549 PWs) bands (ev): -19.5307 -19.5307 -19.3020 -19.3019 -17.1957 -17.1939 -16.8026 -16.8026 -16.6895 -16.6865 -16.6815 -16.6815 -16.6806 -16.6806 -16.6581 -16.6575 -8.3099 -8.3099 -6.8947 -6.8936 -5.9317 -5.9283 -4.9056 -4.9010 -4.8327 -4.8305 -4.8209 -4.8187 -4.4389 -4.4362 -4.2880 -4.2879 -2.0687 -2.0637 -1.9632 -1.9573 -1.8727 -1.8703 -1.4388 -1.4387 -1.4175 -1.4121 -1.1599 -1.1581 -0.9731 -0.9721 -0.9452 -0.9415 -0.9105 -0.9065 -0.8408 -0.8396 0.0856 0.0876 0.1967 0.1976 0.4633 0.4659 0.7743 0.7745 0.8468 0.8471 1.0213 1.0214 6.9174 6.9174 9.4486 9.4487 10.3591 10.3643 10.3906 10.3912 10.4139 10.4181 10.7530 10.7552 k =-0.0778 0.0777 0.0000 ( 6573 PWs) bands (ev): -19.5273 -19.5273 -19.3019 -19.3017 -17.1948 -17.1927 -16.8030 -16.8030 -16.6931 -16.6911 -16.6863 -16.6847 -16.6813 -16.6812 -16.6583 -16.6577 -8.2948 -8.2948 -6.8940 -6.8927 -5.9316 -5.9277 -4.8989 -4.8936 -4.8403 -4.8392 -4.8153 -4.8112 -4.4420 -4.4389 -4.2875 -4.2874 -2.0845 -2.0794 -1.9605 -1.9535 -1.8595 -1.8573 -1.4389 -1.4387 -1.4167 -1.4105 -1.1607 -1.1588 -0.9777 -0.9765 -0.9483 -0.9438 -0.9151 -0.9103 -0.8487 -0.8474 0.0890 0.0914 0.1995 0.2007 0.4563 0.4594 0.7683 0.7685 0.8398 0.8402 1.0133 1.0133 6.9497 6.9497 9.4525 9.4525 10.3708 10.3765 10.3879 10.3882 10.4179 10.4229 10.7528 10.7552 k =-0.0889 0.0888 0.0000 ( 6561 PWs) bands (ev): -19.5234 -19.5234 -19.3018 -19.3016 -17.1937 -17.1914 -16.8036 -16.8035 -16.6989 -16.6980 -16.6899 -16.6870 -16.6819 -16.6819 -16.6586 -16.6579 -8.2775 -8.2774 -6.8932 -6.8918 -5.9316 -5.9271 -4.8913 -4.8853 -4.8506 -4.8496 -4.8071 -4.8022 -4.4453 -4.4418 -4.2869 -4.2868 -2.0998 -2.0946 -1.9573 -1.9494 -1.8474 -1.8455 -1.4386 -1.4383 -1.4158 -1.4089 -1.1627 -1.1605 -0.9835 -0.9820 -0.9521 -0.9465 -0.9205 -0.9147 -0.8563 -0.8548 0.0931 0.0958 0.2028 0.2042 0.4485 0.4521 0.7615 0.7617 0.8319 0.8323 1.0042 1.0043 6.9868 6.9868 9.4570 9.4570 10.3745 10.3770 10.3944 10.3977 10.4232 10.4291 10.7513 10.7539 k =-0.1000 0.0999 0.0000 ( 6565 PWs) bands (ev): -19.5191 -19.5191 -19.3017 -19.3014 -17.1925 -17.1899 -16.8041 -16.8041 -16.7066 -16.7061 -16.6926 -16.6890 -16.6826 -16.6825 -16.6589 -16.6582 -8.2579 -8.2579 -6.8923 -6.8908 -5.9316 -5.9266 -4.8833 -4.8764 -4.8622 -4.8610 -4.7975 -4.7920 -4.4486 -4.4447 -4.2862 -4.2861 -2.1145 -2.1091 -1.9539 -1.9451 -1.8366 -1.8349 -1.4377 -1.4375 -1.4151 -1.4074 -1.1662 -1.1640 -0.9904 -0.9888 -0.9566 -0.9497 -0.9265 -0.9197 -0.8629 -0.8613 0.0979 0.1007 0.2065 0.2082 0.4400 0.4441 0.7539 0.7542 0.8230 0.8235 0.9941 0.9942 7.0284 7.0284 9.4621 9.4622 10.3699 10.3716 10.4092 10.4135 10.4301 10.4375 10.7484 10.7511 k =-0.1111 0.1110 0.0000 ( 6555 PWs) bands (ev): -19.5143 -19.5143 -19.3015 -19.3012 -17.1912 -17.1883 -16.8047 -16.8047 -16.7155 -16.7152 -16.6952 -16.6911 -16.6835 -16.6832 -16.6592 -16.6585 -8.2362 -8.2362 -6.8913 -6.8897 -5.9316 -5.9262 -4.8801 -4.8773 -4.8681 -4.8645 -4.7867 -4.7806 -4.4520 -4.4477 -4.2854 -4.2853 -2.1286 -2.1230 -1.9502 -1.9405 -1.8273 -1.8257 -1.4362 -1.4359 -1.4145 -1.4062 -1.1717 -1.1694 -0.9984 -0.9966 -0.9617 -0.9532 -0.9333 -0.9252 -0.8682 -0.8664 0.1033 0.1064 0.2106 0.2125 0.4308 0.4355 0.7457 0.7460 0.8132 0.8137 0.9831 0.9831 7.0743 7.0743 9.4679 9.4679 10.3634 10.3651 10.4253 10.4290 10.4397 10.4492 10.7440 10.7467 k =-0.1222 0.1221 0.0000 ( 6551 PWs) bands (ev): -19.5090 -19.5090 -19.3013 -19.3010 -17.1897 -17.1866 -16.8054 -16.8054 -16.7254 -16.7251 -16.6978 -16.6934 -16.6843 -16.6841 -16.6596 -16.6590 -8.2124 -8.2124 -6.8903 -6.8886 -5.9318 -5.9259 -4.8923 -4.8918 -4.8602 -4.8539 -4.7748 -4.7682 -4.4552 -4.4506 -4.2845 -4.2844 -2.1418 -2.1361 -1.9463 -1.9358 -1.8195 -1.8182 -1.4338 -1.4335 -1.4142 -1.4054 -1.1796 -1.1775 -1.0074 -1.0053 -0.9675 -0.9571 -0.9409 -0.9312 -0.8719 -0.8701 0.1094 0.1127 0.2149 0.2173 0.4212 0.4265 0.7369 0.7371 0.8024 0.8029 0.9712 0.9712 7.1246 7.1246 9.4743 9.4743 10.3557 10.3577 10.4392 10.4425 10.4542 10.4653 10.7382 10.7408 k =-0.1333 0.1333 0.0000 ( 6545 PWs) bands (ev): -19.5033 -19.5033 -19.3011 -19.3008 -17.1881 -17.1847 -16.8062 -16.8061 -16.7360 -16.7359 -16.7004 -16.6958 -16.6853 -16.6849 -16.6601 -16.6595 -8.1865 -8.1865 -6.8893 -6.8874 -5.9322 -5.9259 -4.9083 -4.9081 -4.8490 -4.8420 -4.7619 -4.7548 -4.4582 -4.4532 -4.2835 -4.2834 -2.1542 -2.1485 -1.9423 -1.9310 -1.8135 -1.8123 -1.4304 -1.4301 -1.4143 -1.4050 -1.1904 -1.1883 -1.0170 -1.0146 -0.9740 -0.9614 -0.9491 -0.9375 -0.8741 -0.8722 0.1162 0.1197 0.2196 0.2224 0.4113 0.4172 0.7274 0.7277 0.7906 0.7912 0.9585 0.9586 7.1789 7.1789 9.4812 9.4813 10.3469 10.3493 10.4512 10.4550 10.4727 10.4845 10.7315 10.7339 k =-0.1444 0.1444 0.0000 ( 6545 PWs) bands (ev): -19.4972 -19.4972 -19.3009 -19.3006 -17.1863 -17.1828 -16.8069 -16.8069 -16.7475 -16.7473 -16.7032 -16.6983 -16.6863 -16.6858 -16.6607 -16.6600 -8.1587 -8.1586 -6.8883 -6.8862 -5.9328 -5.9260 -4.9259 -4.9259 -4.8367 -4.8292 -4.7479 -4.7405 -4.4608 -4.4556 -4.2823 -4.2822 -2.1657 -2.1599 -1.9382 -1.9262 -1.8093 -1.8083 -1.4260 -1.4256 -1.4149 -1.4052 -1.2040 -1.2021 -1.0269 -1.0241 -0.9813 -0.9662 -0.9578 -0.9441 -0.8749 -0.8730 0.1238 0.1275 0.2243 0.2277 0.4012 0.4078 0.7175 0.7178 0.7780 0.7786 0.9451 0.9452 7.2372 7.2372 9.4888 9.4889 10.3368 10.3397 10.4635 10.4678 10.4927 10.5050 10.7242 10.7263 k =-0.1556 0.1555 0.0000 ( 6543 PWs) bands (ev): -19.4907 -19.4907 -19.3007 -19.3003 -17.1845 -17.1807 -16.8078 -16.8077 -16.7596 -16.7595 -16.7060 -16.7009 -16.6873 -16.6868 -16.6613 -16.6607 -8.1289 -8.1288 -6.8872 -6.8851 -5.9336 -5.9265 -4.9451 -4.9451 -4.8235 -4.8157 -4.7329 -4.7252 -4.4630 -4.4575 -4.2810 -4.2809 -2.1763 -2.1704 -1.9341 -1.9214 -1.8070 -1.8062 -1.4204 -1.4202 -1.4159 -1.4060 -1.2205 -1.2187 -1.0369 -1.0337 -0.9894 -0.9723 -0.9661 -0.9509 -0.8746 -0.8726 0.1322 0.1360 0.2292 0.2331 0.3912 0.3986 0.7072 0.7075 0.7646 0.7652 0.9312 0.9312 7.2992 7.2992 9.4969 9.4971 10.3251 10.3286 10.4767 10.4815 10.5132 10.5258 10.7172 10.7189 k =-0.1667 0.1666 0.0000 ( 6543 PWs) bands (ev): -19.4839 -19.4839 -19.3005 -19.3001 -17.1825 -17.1785 -16.8086 -16.8086 -16.7723 -16.7722 -16.7089 -16.7036 -16.6884 -16.6878 -16.6619 -16.6614 -8.0972 -8.0971 -6.8861 -6.8839 -5.9346 -5.9272 -4.9657 -4.9656 -4.8095 -4.8014 -4.7171 -4.7091 -4.4645 -4.4589 -4.2796 -4.2795 -2.1859 -2.1799 -1.9301 -1.9167 -1.8066 -1.8061 -1.4184 -1.4140 -1.4130 -1.4075 -1.2395 -1.2378 -1.0469 -1.0434 -0.9984 -0.9813 -0.9727 -0.9577 -0.8732 -0.8713 0.1414 0.1453 0.2338 0.2384 0.3816 0.3899 0.6966 0.6968 0.7503 0.7510 0.9167 0.9168 7.3648 7.3648 9.5055 9.5057 10.3116 10.3158 10.4908 10.4962 10.5335 10.5464 10.7111 10.7124 k =-0.1778 0.1777 0.0000 ( 6541 PWs) bands (ev): -19.4767 -19.4767 -19.3002 -19.2998 -17.1805 -17.1763 -16.8096 -16.8096 -16.7855 -16.7854 -16.7120 -16.7065 -16.6895 -16.6889 -16.6627 -16.6622 -8.0637 -8.0636 -6.8851 -6.8828 -5.9360 -5.9283 -4.9876 -4.9875 -4.7949 -4.7866 -4.7003 -4.6922 -4.4655 -4.4596 -4.2781 -4.2779 -2.1945 -2.1884 -1.9261 -1.9122 -1.8082 -1.8078 -1.4208 -1.4105 -1.4061 -1.4058 -1.2602 -1.2586 -1.0571 -1.0532 -1.0084 -0.9922 -0.9783 -0.9647 -0.8712 -0.8692 0.1514 0.1553 0.2380 0.2434 0.3729 0.3820 0.6857 0.6859 0.7353 0.7360 0.9018 0.9019 7.4338 7.4338 9.5144 9.5148 10.2963 10.3011 10.5056 10.5117 10.5534 10.5663 10.7065 10.7074 k =-0.1889 0.1888 0.0000 ( 6533 PWs) bands (ev): -19.4692 -19.4691 -19.3000 -19.2996 -17.1783 -17.1739 -16.8109 -16.8108 -16.7990 -16.7988 -16.7150 -16.7094 -16.6907 -16.6900 -16.6634 -16.6630 -8.0284 -8.0283 -6.8841 -6.8818 -5.9377 -5.9297 -5.0109 -5.0108 -4.7796 -4.7712 -4.6828 -4.6745 -4.4657 -4.4597 -4.2764 -4.2762 -2.2020 -2.1959 -1.9222 -1.9078 -1.8116 -1.8113 -1.4241 -1.4135 -1.3991 -1.3984 -1.2816 -1.2801 -1.0675 -1.0632 -1.0193 -1.0042 -0.9838 -0.9717 -0.8687 -0.8667 0.1622 0.1661 0.2415 0.2475 0.3654 0.3754 0.6746 0.6747 0.7196 0.7203 0.8866 0.8867 7.5060 7.5060 9.5238 9.5242 10.2790 10.2844 10.5203 10.5274 10.5732 10.5857 10.7041 10.7045 k =-0.2000 0.1999 0.0000 ( 6533 PWs) bands (ev): -19.4614 -19.4614 -19.2997 -19.2993 -17.1761 -17.1715 -16.8160 -16.8156 -16.8093 -16.8090 -16.7182 -16.7124 -16.6918 -16.6912 -16.6643 -16.6639 -7.9915 -7.9914 -6.8832 -6.8808 -5.9397 -5.9315 -5.0355 -5.0354 -4.7637 -4.7553 -4.6645 -4.6562 -4.4650 -4.4589 -4.2746 -4.2744 -2.2084 -2.2022 -1.9186 -1.9037 -1.8167 -1.8166 -1.4283 -1.4177 -1.3934 -1.3926 -1.3018 -1.3003 -1.0782 -1.0737 -1.0312 -1.0171 -0.9896 -0.9789 -0.8658 -0.8638 0.1738 0.1776 0.2438 0.2504 0.3598 0.3705 0.6633 0.6634 0.7033 0.7040 0.8712 0.8712 7.5812 7.5813 9.5333 9.5339 10.2600 10.2660 10.5338 10.5422 10.5934 10.6050 10.7042 10.7042 k =-0.2111 0.2110 0.0000 ( 6537 PWs) bands (ev): -19.4533 -19.4533 -19.2995 -19.2990 -17.1738 -17.1691 -16.8292 -16.8291 -16.8114 -16.8112 -16.7214 -16.7155 -16.6930 -16.6923 -16.6652 -16.6648 -7.9531 -7.9530 -6.8823 -6.8798 -5.9420 -5.9337 -5.0614 -5.0613 -4.7474 -4.7390 -4.6455 -4.6372 -4.4635 -4.4573 -4.2726 -4.2724 -2.2137 -2.2075 -1.9152 -1.8999 -1.8234 -1.8234 -1.4332 -1.4227 -1.3927 -1.3921 -1.3167 -1.3154 -1.0894 -1.0847 -1.0441 -1.0307 -0.9957 -0.9863 -0.8627 -0.8608 0.1861 0.1897 0.2447 0.2514 0.3567 0.3679 0.6520 0.6521 0.6864 0.6872 0.8556 0.8556 7.6593 7.6593 9.5429 9.5435 10.2396 10.2462 10.5446 10.5547 10.6149 10.6251 10.7066 10.7070 k =-0.2222 0.2221 0.0000 ( 6537 PWs) bands (ev): -19.4451 -19.4451 -19.2992 -19.2988 -17.1714 -17.1665 -16.8440 -16.8439 -16.8125 -16.8124 -16.7246 -16.7186 -16.6942 -16.6935 -16.6661 -16.6657 -7.9131 -7.9130 -6.8815 -6.8790 -5.9447 -5.9363 -5.0886 -5.0885 -4.7307 -4.7224 -4.6260 -4.6177 -4.4610 -4.4548 -4.2705 -4.2703 -2.2179 -2.2117 -1.9120 -1.8964 -1.8317 -1.8315 -1.4389 -1.4287 -1.4018 -1.4017 -1.3214 -1.3205 -1.1011 -1.0961 -1.0578 -1.0450 -1.0022 -0.9939 -0.8596 -0.8576 0.1990 0.2021 0.2440 0.2502 0.3566 0.3677 0.6407 0.6407 0.6691 0.6699 0.8400 0.8400 7.7399 7.7399 9.5523 9.5531 10.2185 10.2254 10.5514 10.5631 10.6386 10.6474 10.7117 10.7125 k =-0.2333 0.2332 0.0000 ( 6525 PWs) bands (ev): -19.4366 -19.4366 -19.2989 -19.2985 -17.1689 -17.1640 -16.8591 -16.8591 -16.8134 -16.8134 -16.7279 -16.7218 -16.6955 -16.6947 -16.6670 -16.6667 -7.8717 -7.8716 -6.8807 -6.8783 -5.9478 -5.9393 -5.1170 -5.1170 -4.7137 -4.7056 -4.6059 -4.5977 -4.4575 -4.4514 -4.2682 -4.2680 -2.2209 -2.2148 -1.9092 -1.8934 -1.8412 -1.8408 -1.4454 -1.4359 -1.4206 -1.4198 -1.3166 -1.3162 -1.1131 -1.1080 -1.0723 -1.0601 -1.0092 -1.0018 -0.8565 -0.8546 0.2124 0.2145 0.2420 0.2467 0.3595 0.3702 0.6292 0.6294 0.6514 0.6523 0.8244 0.8245 7.8229 7.8229 9.5613 9.5623 10.1970 10.2044 10.5535 10.5664 10.6651 10.6726 10.7195 10.7205 k =-0.2444 0.2443 0.0000 ( 6537 PWs) bands (ev): -19.4280 -19.4280 -19.2987 -19.2982 -17.1665 -17.1614 -16.8744 -16.8744 -16.8144 -16.8143 -16.7312 -16.7251 -16.6967 -16.6959 -16.6680 -16.6677 -7.8291 -7.8290 -6.8801 -6.8776 -5.9511 -5.9427 -5.1467 -5.1466 -4.6966 -4.6887 -4.5855 -4.5773 -4.4529 -4.4470 -4.2658 -4.2656 -2.2229 -2.2168 -1.9068 -1.8907 -1.8518 -1.8512 -1.4527 -1.4479 -1.4441 -1.4386 -1.3069 -1.3068 -1.1253 -1.1199 -1.0876 -1.0757 -1.0167 -1.0101 -0.8536 -0.8517 0.2246 0.2262 0.2411 0.2415 0.3651 0.3750 0.6177 0.6181 0.6337 0.6347 0.8089 0.8090 7.9081 7.9081 9.5697 9.5708 10.1760 10.1836 10.5507 10.5643 10.6943 10.7010 10.7297 10.7309 k =-0.2556 0.2554 0.0000 ( 6543 PWs) bands (ev): -19.4194 -19.4194 -19.2984 -19.2980 -17.1640 -17.1589 -16.8899 -16.8899 -16.8152 -16.8152 -16.7345 -16.7284 -16.6979 -16.6971 -16.6690 -16.6688 -7.7852 -7.7851 -6.8795 -6.8771 -5.9549 -5.9464 -5.1776 -5.1775 -4.6793 -4.6717 -4.5646 -4.5567 -4.4474 -4.4417 -4.2633 -4.2631 -2.2237 -2.2177 -1.9048 -1.8886 -1.8632 -1.8625 -1.4710 -1.4706 -1.4593 -1.4488 -1.2959 -1.2958 -1.1370 -1.1315 -1.1036 -1.0920 -1.0247 -1.0188 -0.8508 -0.8490 0.2257 0.2346 0.2405 0.2481 0.3728 0.3818 0.6056 0.6063 0.6166 0.6178 0.7937 0.7938 7.9952 7.9952 9.5772 9.5784 10.1561 10.1639 10.5432 10.5571 10.7258 10.7323 10.7420 10.7437 k =-0.2667 0.2665 0.0000 ( 6537 PWs) bands (ev): -19.4106 -19.4106 -19.2981 -19.2977 -17.1614 -17.1563 -16.9054 -16.9054 -16.8161 -16.8160 -16.7378 -16.7316 -16.6991 -16.6983 -16.6700 -16.6698 -7.7403 -7.7402 -6.8791 -6.8766 -5.9588 -5.9505 -5.2096 -5.2095 -4.6620 -4.6548 -4.5436 -4.5358 -4.4408 -4.4353 -4.2607 -4.2605 -2.2236 -2.2175 -1.9032 -1.8871 -1.8753 -1.8744 -1.4968 -1.4966 -1.4673 -1.4575 -1.2856 -1.2855 -1.1472 -1.1417 -1.1201 -1.1088 -1.0332 -1.0279 -0.8482 -0.8465 0.2208 0.2274 0.2544 0.2603 0.3822 0.3903 0.5918 0.5927 0.6017 0.6030 0.7786 0.7788 8.0840 8.0840 9.5834 9.5846 10.1380 10.1459 10.5317 10.5454 10.7546 10.7560 10.7636 10.7663 k =-0.2778 0.2776 0.0000 ( 6537 PWs) bands (ev): -19.4018 -19.4018 -19.2979 -19.2974 -17.1589 -17.1537 -16.9208 -16.9208 -16.8169 -16.8168 -16.7410 -16.7349 -16.7003 -16.6995 -16.6710 -16.6709 -7.6944 -7.6943 -6.8787 -6.8763 -5.9631 -5.9549 -5.2427 -5.2426 -4.6448 -4.6380 -4.5223 -4.5148 -4.4332 -4.4280 -4.2580 -4.2578 -2.2224 -2.2164 -1.9022 -1.8878 -1.8876 -1.8854 -1.5227 -1.5227 -1.4754 -1.4662 -1.2783 -1.2780 -1.1546 -1.1489 -1.1369 -1.1261 -1.0424 -1.0376 -0.8459 -0.8442 0.2143 0.2196 0.2681 0.2732 0.3927 0.4000 0.5759 0.5766 0.5899 0.5908 0.7640 0.7642 8.1743 8.1744 9.5879 9.5892 10.1222 10.1301 10.5166 10.5301 10.7715 10.7718 10.7987 10.8027 k =-0.2889 0.2887 0.0000 ( 6537 PWs) bands (ev): -19.3930 -19.3930 -19.2976 -19.2972 -17.1564 -17.1512 -16.9362 -16.9362 -16.8176 -16.8176 -16.7443 -16.7382 -16.7015 -16.7007 -16.6721 -16.6719 -7.6477 -7.6475 -6.8784 -6.8761 -5.9676 -5.9595 -5.2768 -5.2767 -4.6278 -4.6214 -4.5011 -4.4937 -4.4247 -4.4199 -4.2551 -4.2549 -2.2202 -2.2144 -1.9021 -1.9003 -1.8997 -1.8856 -1.5483 -1.5482 -1.4834 -1.4749 -1.2764 -1.2756 -1.1599 -1.1514 -1.1510 -1.1436 -1.0521 -1.0477 -0.8439 -0.8422 0.2073 0.2116 0.2811 0.2857 0.4042 0.4106 0.5594 0.5600 0.5796 0.5803 0.7497 0.7499 8.2659 8.2659 9.5905 9.5919 10.1093 10.1171 10.4989 10.5119 10.7881 10.7886 10.8376 10.8414 k =-0.3000 0.2998 0.0000 ( 6535 PWs) bands (ev): -19.3843 -19.3843 -19.2973 -19.2969 -17.1539 -17.1487 -16.9513 -16.9513 -16.8183 -16.8183 -16.7475 -16.7415 -16.7026 -16.7018 -16.6731 -16.6730 -7.6003 -7.6001 -6.8782 -6.8760 -5.9723 -5.9644 -5.3119 -5.3118 -4.6111 -4.6052 -4.4799 -4.4728 -4.4153 -4.4108 -4.2523 -4.2521 -2.2172 -2.2116 -1.9136 -1.9123 -1.9018 -1.8861 -1.5732 -1.5730 -1.4913 -1.4834 -1.2813 -1.2797 -1.1747 -1.1621 -1.1495 -1.1470 -1.0623 -1.0583 -0.8421 -0.8405 0.2002 0.2038 0.2931 0.2972 0.4162 0.4220 0.5436 0.5442 0.5701 0.5705 0.7360 0.7362 8.3583 8.3584 9.5910 9.5923 10.0996 10.1073 10.4790 10.4916 10.8054 10.8059 10.8785 10.8821 k =-0.3111 0.3109 0.0000 ( 6545 PWs) bands (ev): -19.3757 -19.3757 -19.2971 -19.2967 -17.1514 -17.1463 -16.9662 -16.9662 -16.8190 -16.8190 -16.7507 -16.7448 -16.7037 -16.7029 -16.6741 -16.6740 -7.5524 -7.5522 -6.8781 -6.8760 -5.9771 -5.9695 -5.3478 -5.3477 -4.5948 -4.5894 -4.4588 -4.4521 -4.4052 -4.4011 -4.2493 -4.2491 -2.2135 -2.2081 -1.9262 -1.9247 -1.9026 -1.8872 -1.5971 -1.5969 -1.4987 -1.4917 -1.2924 -1.2900 -1.1927 -1.1804 -1.1394 -1.1374 -1.0730 -1.0693 -0.8406 -0.8391 0.1932 0.1962 0.3033 0.3070 0.4287 0.4337 0.5291 0.5299 0.5611 0.5615 0.7227 0.7230 8.4515 8.4515 9.5892 9.5905 10.0934 10.1009 10.4578 10.4697 10.8229 10.8235 10.9213 10.9245 k =-0.3222 0.3220 0.0000 ( 6557 PWs) bands (ev): -19.3673 -19.3673 -19.2968 -19.2964 -17.1489 -17.1440 -16.9807 -16.9807 -16.8196 -16.8196 -16.7537 -16.7480 -16.7048 -16.7040 -16.6751 -16.6750 -7.5041 -7.5039 -6.8781 -6.8760 -5.9820 -5.9746 -5.3844 -5.3844 -4.5790 -4.5741 -4.4381 -4.4317 -4.3943 -4.3906 -4.2464 -4.2462 -2.2093 -2.2041 -1.9383 -1.9366 -1.9040 -1.8892 -1.6201 -1.6198 -1.5056 -1.4995 -1.3079 -1.3049 -1.2113 -1.1990 -1.1251 -1.1236 -1.0840 -1.0806 -0.8394 -0.8379 0.1864 0.1890 0.3111 0.3143 0.4413 0.4458 0.5168 0.5179 0.5526 0.5529 0.7100 0.7104 8.5449 8.5450 9.5852 9.5864 10.0906 10.0979 10.4356 10.4470 10.8404 10.8409 10.9653 10.9681 k =-0.3333 0.3331 0.0000 ( 6557 PWs) bands (ev): -19.3591 -19.3591 -19.2966 -19.2962 -17.1465 -17.1417 -16.9948 -16.9948 -16.8202 -16.8202 -16.7568 -16.7511 -16.7058 -16.7051 -16.6761 -16.6760 -7.4556 -7.4554 -6.8782 -6.8762 -5.9869 -5.9799 -5.4217 -5.4217 -4.5637 -4.5593 -4.4178 -4.4117 -4.3829 -4.3797 -4.2434 -4.2432 -2.2047 -2.1997 -1.9495 -1.9476 -1.9061 -1.8919 -1.6419 -1.6416 -1.5118 -1.5067 -1.3264 -1.3230 -1.2301 -1.2177 -1.1082 -1.1075 -1.0951 -1.0923 -0.8384 -0.8370 0.1799 0.1821 0.3158 0.3184 0.4540 0.4578 0.5075 0.5089 0.5447 0.5450 0.6979 0.6984 8.6384 8.6385 9.5792 9.5802 10.0911 10.0980 10.4132 10.4239 10.8575 10.8579 11.0099 11.0121 k =-0.3444 0.3442 0.0000 ( 6552 PWs) bands (ev): -19.3511 -19.3511 -19.2963 -19.2959 -17.1442 -17.1395 -17.0084 -17.0084 -16.8207 -16.8207 -16.7597 -16.7542 -16.7068 -16.7061 -16.6770 -16.6770 -7.4071 -7.4069 -6.8784 -6.8765 -5.9918 -5.9851 -5.4595 -5.4594 -4.5491 -4.5452 -4.3981 -4.3923 -4.3710 -4.3683 -4.2405 -4.2403 -2.1999 -2.1953 -1.9596 -1.9573 -1.9089 -1.8954 -1.6625 -1.6622 -1.5170 -1.5130 -1.3469 -1.3432 -1.2490 -1.2364 -1.1076 -1.1042 -1.0898 -1.0886 -0.8377 -0.8364 0.1738 0.1757 0.3167 0.3188 0.4666 0.4698 0.5017 0.5037 0.5373 0.5376 0.6865 0.6870 8.7315 8.7316 9.5714 9.5723 10.0944 10.1009 10.3908 10.4008 10.8737 10.8741 11.0419 11.0443 k =-0.3556 0.3553 0.0000 ( 6546 PWs) bands (ev): -19.3434 -19.3434 -19.2961 -19.2957 -17.1419 -17.1374 -17.0214 -17.0214 -16.8212 -16.8211 -16.7625 -16.7572 -16.7077 -16.7071 -16.6779 -16.6779 -7.3589 -7.3586 -6.8786 -6.8768 -5.9966 -5.9904 -5.4975 -5.4975 -4.5351 -4.5318 -4.3791 -4.3736 -4.3589 -4.3565 -4.2376 -4.2374 -2.1953 -2.1911 -1.9680 -1.9655 -1.9123 -1.8996 -1.6819 -1.6815 -1.5212 -1.5183 -1.3686 -1.3647 -1.2678 -1.2551 -1.1192 -1.1161 -1.0707 -1.0700 -0.8373 -0.8360 0.1681 0.1697 0.3136 0.3152 0.4788 0.4814 0.4999 0.5023 0.5305 0.5309 0.6757 0.6763 8.8238 8.8239 9.5624 9.5632 10.1000 10.1062 10.3689 10.3782 10.8886 10.8890 11.0405 11.0441 k =-0.3667 0.3664 0.0000 ( 6548 PWs) bands (ev): -19.3361 -19.3360 -19.2958 -19.2955 -17.1398 -17.1355 -17.0338 -17.0338 -16.8216 -16.8215 -16.7651 -16.7601 -16.7086 -16.7080 -16.6788 -16.6788 -7.3112 -7.3109 -6.8788 -6.8773 -6.0014 -5.9955 -5.5356 -5.5355 -4.5220 -4.5190 -4.3610 -4.3559 -4.3465 -4.3446 -4.2348 -4.2345 -2.1912 -2.1875 -1.9745 -1.9716 -1.9163 -1.9045 -1.7001 -1.6997 -1.5242 -1.5226 -1.3912 -1.3872 -1.2865 -1.2736 -1.1309 -1.1280 -1.0513 -1.0508 -0.8372 -0.8359 0.1628 0.1642 0.3070 0.3081 0.4902 0.4921 0.5017 0.5047 0.5242 0.5248 0.6657 0.6664 8.9148 8.9148 9.5526 9.5532 10.1074 10.1132 10.3477 10.3563 10.9020 10.9023 11.0374 11.0416 k =-0.3778 0.3775 0.0000 ( 6536 PWs) bands (ev): -19.3291 -19.3291 -19.2956 -19.2953 -17.1377 -17.1336 -17.0455 -17.0455 -16.8219 -16.8218 -16.7677 -16.7629 -16.7094 -16.7088 -16.6796 -16.6796 -7.2643 -7.2640 -6.8792 -6.8778 -6.0059 -6.0004 -5.5734 -5.5734 -4.5096 -4.5071 -4.3442 -4.3395 -4.3339 -4.3322 -4.2320 -4.2318 -2.1878 -2.1846 -1.9786 -1.9753 -1.9207 -1.9099 -1.7171 -1.7167 -1.5260 -1.5257 -1.4141 -1.4101 -1.3049 -1.2919 -1.1425 -1.1398 -1.0319 -1.0316 -0.8374 -0.8361 0.1580 0.1591 0.2976 0.2984 0.4996 0.5015 0.5072 0.5104 0.5187 0.5198 0.6563 0.6571 9.0039 9.0039 9.5424 9.5430 10.1159 10.1212 10.3275 10.3354 10.9134 10.9137 11.0343 11.0389 k =-0.3889 0.3887 0.0000 ( 6536 PWs) bands (ev): -19.3226 -19.3226 -19.2953 -19.2950 -17.1358 -17.1319 -17.0564 -17.0564 -16.8222 -16.8220 -16.7700 -16.7655 -16.7102 -16.7096 -16.6803 -16.6803 -7.2186 -7.2182 -6.8796 -6.8783 -6.0102 -6.0052 -5.6108 -5.6108 -4.4981 -4.4959 -4.3291 -4.3254 -4.3210 -4.3190 -4.2294 -4.2292 -2.1855 -2.1828 -1.9801 -1.9765 -1.9255 -1.9157 -1.7330 -1.7325 -1.5275 -1.5265 -1.4372 -1.4331 -1.3230 -1.3098 -1.1538 -1.1512 -1.0127 -1.0126 -0.8379 -0.8366 0.1535 0.1545 0.2863 0.2869 0.5053 0.5091 0.5130 0.5145 0.5186 0.5199 0.6477 0.6487 9.0904 9.0904 9.5326 9.5331 10.1248 10.1297 10.3086 10.3157 10.9226 10.9229 11.0313 11.0364 k =-0.4000 0.3998 0.0000 ( 6538 PWs) bands (ev): -19.3167 -19.3166 -19.2951 -19.2948 -17.1339 -17.1304 -17.0665 -17.0665 -16.8224 -16.8222 -16.7722 -16.7680 -16.7108 -16.7103 -16.6810 -16.6810 -7.1744 -7.1740 -6.8800 -6.8789 -6.0142 -6.0097 -5.6473 -5.6473 -4.4875 -4.4857 -4.3160 -4.3134 -4.3076 -4.3052 -4.2270 -4.2268 -2.1843 -2.1821 -1.9789 -1.9749 -1.9305 -1.9217 -1.7478 -1.7473 -1.5281 -1.5258 -1.4600 -1.4559 -1.3407 -1.3274 -1.1646 -1.1622 -0.9941 -0.9941 -0.8387 -0.8375 0.1496 0.1504 0.2740 0.2744 0.5052 0.5075 0.5179 0.5189 0.5269 0.5287 0.6398 0.6409 9.1733 9.1733 9.5237 9.5242 10.1335 10.1381 10.2910 10.2974 10.9295 10.9297 11.0287 11.0341 k =-0.4111 0.4109 0.0000 ( 6554 PWs) bands (ev): -19.3113 -19.3112 -19.2948 -19.2945 -17.1322 -17.1290 -17.0757 -17.0757 -16.8226 -16.8223 -16.7742 -16.7704 -16.7115 -16.7110 -16.6817 -16.6817 -7.1321 -7.1317 -6.8805 -6.8796 -6.0180 -6.0138 -5.6824 -5.6824 -4.4778 -4.4764 -4.3046 -4.3028 -4.2944 -4.2919 -4.2247 -4.2245 -2.1843 -2.1825 -1.9750 -1.9707 -1.9355 -1.9278 -1.7616 -1.7610 -1.5274 -1.5239 -1.4821 -1.4781 -1.3578 -1.3445 -1.1749 -1.1725 -0.9763 -0.9762 -0.8399 -0.8388 0.1460 0.1468 0.2615 0.2618 0.5021 0.5035 0.5254 0.5254 0.5362 0.5375 0.6327 0.6339 9.2510 9.2511 9.5167 9.5172 10.1416 10.1458 10.2749 10.2806 10.9339 10.9341 11.0265 11.0320 k =-0.4222 0.4220 0.0000 ( 6558 PWs) bands (ev): -19.3065 -19.3065 -19.2944 -19.2941 -17.1307 -17.1278 -17.0839 -17.0839 -16.8227 -16.8224 -16.7760 -16.7726 -16.7120 -16.7116 -16.6823 -16.6822 -7.0923 -7.0918 -6.8811 -6.8804 -6.0213 -6.0177 -5.7158 -5.7158 -4.4692 -4.4680 -4.2945 -4.2931 -4.2820 -4.2797 -4.2227 -4.2225 -2.1852 -2.1838 -1.9687 -1.9642 -1.9404 -1.9338 -1.7744 -1.7738 -1.5256 -1.5209 -1.5032 -1.4993 -1.3742 -1.3610 -1.1843 -1.1822 -0.9594 -0.9592 -0.8416 -0.8404 0.1430 0.1436 0.2493 0.2494 0.4988 0.4998 0.5323 0.5327 0.5449 0.5457 0.6263 0.6277 9.3213 9.3215 9.5135 9.5142 10.1484 10.1522 10.2605 10.2655 10.9360 10.9362 11.0246 11.0303 k =-0.4333 0.4331 0.0000 ( 6544 PWs) bands (ev): -19.3026 -19.3025 -19.2938 -19.2936 -17.1293 -17.1268 -17.0911 -17.0911 -16.8227 -16.8225 -16.7776 -16.7745 -16.7125 -16.7121 -16.6828 -16.6828 -7.0556 -7.0550 -6.8817 -6.8813 -6.0242 -6.0211 -5.7468 -5.7468 -4.4616 -4.4607 -4.2856 -4.2845 -4.2710 -4.2689 -4.2208 -4.2206 -2.1867 -2.1857 -1.9605 -1.9558 -1.9447 -1.9394 -1.7865 -1.7857 -1.5244 -1.5238 -1.5174 -1.5159 -1.3899 -1.3769 -1.1928 -1.1909 -0.9435 -0.9432 -0.8437 -0.8426 0.1403 0.1408 0.2378 0.2379 0.4958 0.4966 0.5390 0.5394 0.5528 0.5532 0.6207 0.6222 9.3789 9.3794 9.5184 9.5193 10.1536 10.1570 10.2479 10.2521 10.9361 10.9363 11.0233 11.0289 k =-0.4444 0.4442 0.0000 ( 6548 PWs) bands (ev): -19.2996 -19.2996 -19.2928 -19.2926 -17.1281 -17.1260 -17.0974 -17.0973 -16.8228 -16.8225 -16.7789 -16.7763 -16.7129 -16.7126 -16.6832 -16.6832 -7.0224 -7.0218 -6.8826 -6.8823 -6.0267 -6.0241 -5.7748 -5.7748 -4.4551 -4.4544 -4.2778 -4.2770 -4.2614 -4.2596 -4.2192 -4.2190 -2.1887 -2.1879 -1.9529 -1.9469 -1.9465 -1.9437 -1.7978 -1.7969 -1.5414 -1.5387 -1.5172 -1.5111 -1.4048 -1.3920 -1.2002 -1.1986 -0.9288 -0.9283 -0.8464 -0.8453 0.1381 0.1385 0.2275 0.2276 0.4933 0.4938 0.5450 0.5455 0.5597 0.5598 0.6159 0.6174 9.4161 9.4168 9.5382 9.5393 10.1569 10.1599 10.2371 10.2407 10.9345 10.9347 11.0225 11.0277 k =-0.4556 0.4553 0.0000 ( 6548 PWs) bands (ev): -19.2978 -19.2978 -19.2914 -19.2912 -17.1270 -17.1253 -17.1025 -17.1025 -16.8228 -16.8225 -16.7800 -16.7778 -16.7132 -16.7130 -16.6836 -16.6835 -6.9936 -6.9929 -6.8836 -6.8835 -6.0288 -6.0267 -5.7991 -5.7990 -4.4498 -4.4492 -4.2714 -4.2708 -4.2533 -4.2518 -4.2179 -4.2177 -2.1907 -2.1901 -1.9539 -1.9495 -1.9384 -1.9351 -1.8083 -1.8073 -1.5570 -1.5546 -1.5121 -1.5051 -1.4185 -1.4063 -1.2064 -1.2051 -0.9153 -0.9148 -0.8497 -0.8487 0.1363 0.1366 0.2186 0.2187 0.4911 0.4916 0.5502 0.5506 0.5653 0.5657 0.6118 0.6133 9.4323 9.4328 9.5725 9.5735 10.1585 10.1610 10.2283 10.2311 10.9318 10.9320 11.0221 11.0268 k =-0.4667 0.4664 0.0000 ( 6552 PWs) bands (ev): -19.2969 -19.2969 -19.2897 -19.2897 -17.1262 -17.1249 -17.1065 -17.1065 -16.8227 -16.8226 -16.7807 -16.7791 -16.7135 -16.7133 -16.6838 -16.6838 -6.9696 -6.9690 -6.8850 -6.8849 -6.0303 -6.0287 -5.8189 -5.8189 -4.4455 -4.4451 -4.2662 -4.2658 -4.2469 -4.2458 -4.2168 -4.2167 -2.1925 -2.1921 -1.9564 -1.9533 -1.9278 -1.9248 -1.8179 -1.8169 -1.5698 -1.5679 -1.5061 -1.4987 -1.4308 -1.4196 -1.2114 -1.2103 -0.9032 -0.9026 -0.8537 -0.8527 0.1349 0.1351 0.2115 0.2115 0.4895 0.4898 0.5544 0.5547 0.5699 0.5704 0.6086 0.6100 9.4372 9.4376 9.6097 9.6105 10.1586 10.1606 10.2214 10.2235 10.9288 10.9289 11.0221 11.0260 k =-0.4778 0.4775 0.0000 ( 6560 PWs) bands (ev): -19.2964 -19.2964 -19.2884 -19.2883 -17.1255 -17.1246 -17.1094 -17.1094 -16.8227 -16.8226 -16.7812 -16.7801 -16.7136 -16.7135 -16.6840 -16.6840 -6.9513 -6.9507 -6.8866 -6.8864 -6.0314 -6.0303 -5.8337 -5.8336 -4.4425 -4.4422 -4.2625 -4.2622 -4.2423 -4.2415 -4.2160 -4.2159 -2.1939 -2.1937 -1.9582 -1.9562 -1.9180 -1.9156 -1.8262 -1.8252 -1.5793 -1.5779 -1.4995 -1.4925 -1.4410 -1.4315 -1.2149 -1.2142 -0.8927 -0.8920 -0.8583 -0.8574 0.1339 0.1340 0.2062 0.2063 0.4884 0.4886 0.5574 0.5576 0.5733 0.5739 0.6062 0.6073 9.4382 9.4385 9.6407 9.6412 10.1578 10.1592 10.2166 10.2180 10.9260 10.9261 11.0225 11.0252 k =-0.4889 0.4886 0.0000 ( 6572 PWs) bands (ev): -19.2962 -19.2962 -19.2875 -19.2875 -17.1250 -17.1245 -17.1111 -17.1111 -16.8227 -16.8226 -16.7814 -16.7808 -16.7137 -16.7137 -16.6842 -16.6842 -6.9394 -6.9391 -6.8881 -6.8879 -6.0319 -6.0314 -5.8428 -5.8428 -4.4406 -4.4405 -4.2602 -4.2601 -4.2394 -4.2390 -4.2155 -4.2155 -2.1948 -2.1947 -1.9592 -1.9582 -1.9106 -1.9092 -1.8320 -1.8314 -1.5850 -1.5843 -1.4931 -1.4883 -1.4474 -1.4413 -1.2170 -1.2166 -0.8841 -0.8835 -0.8632 -0.8625 0.1333 0.1334 0.2030 0.2030 0.4877 0.4878 0.5593 0.5594 0.5756 0.5760 0.6049 0.6055 9.4382 9.4383 9.6609 9.6612 10.1570 10.1577 10.2138 10.2145 10.9241 10.9241 11.0231 11.0245 k =-0.5000 0.4997 0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7813 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8340 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2175 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1569 10.1569 10.2131 10.2131 10.9234 10.9234 11.0238 11.0238 k =-0.5000 0.4997 0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7813 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8340 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2175 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1569 10.1569 10.2131 10.2131 10.9234 10.9234 11.0238 11.0238 k =-0.4997 0.5000-0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7812 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8339 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2176 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1568 10.1569 10.2131 10.2132 10.9234 10.9234 11.0238 11.0238 k =-0.4997 0.5000-0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7812 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8339 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2176 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1568 10.1569 10.2131 10.2132 10.9234 10.9234 11.0238 11.0238 k =-0.4997 0.5000 0.0155 ( 6572 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1248 -17.1245 -17.1118 -17.1115 -16.8227 -16.8225 -16.7814 -16.7813 -16.7139 -16.7134 -16.6844 -16.6841 -6.9351 -6.9350 -6.8887 -6.8886 -6.0318 -6.0314 -5.8462 -5.8457 -4.4400 -4.4399 -4.2596 -4.2594 -4.2388 -4.2383 -4.2161 -4.2154 -2.1946 -2.1944 -1.9599 -1.9587 -1.9084 -1.9074 -1.8340 -1.8337 -1.5909 -1.5897 -1.4881 -1.4867 -1.4440 -1.4422 -1.2191 -1.2189 -0.8801 -0.8798 -0.8648 -0.8644 0.1332 0.1334 0.2014 0.2018 0.4870 0.4879 0.5583 0.5585 0.5761 0.5765 0.6055 0.6059 9.4393 9.4397 9.6693 9.6693 10.1580 10.1582 10.2139 10.2144 10.9215 10.9222 11.0263 11.0267 k =-0.4997 0.5000 0.0311 ( 6570 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1249 -17.1243 -17.1120 -17.1114 -16.8226 -16.8224 -16.7816 -16.7814 -16.7140 -16.7131 -16.6846 -16.6840 -6.9349 -6.9346 -6.8888 -6.8885 -6.0311 -6.0304 -5.8467 -5.8458 -4.4400 -4.4397 -4.2600 -4.2595 -4.2396 -4.2386 -4.2177 -4.2162 -2.1930 -2.1926 -1.9609 -1.9584 -1.9108 -1.9087 -1.8337 -1.8334 -1.6008 -1.5990 -1.4855 -1.4829 -1.4328 -1.4297 -1.2236 -1.2231 -0.8810 -0.8804 -0.8616 -0.8606 0.1337 0.1340 0.2000 0.2010 0.4865 0.4883 0.5540 0.5541 0.5754 0.5760 0.6080 0.6088 9.4433 9.4441 9.6731 9.6731 10.1614 10.1618 10.2168 10.2178 10.9169 10.9182 11.0338 11.0345 k =-0.4997 0.5000 0.0466 ( 6556 PWs) bands (ev): -19.2961 -19.2960 -19.2873 -19.2872 -17.1249 -17.1240 -17.1122 -17.1112 -16.8225 -16.8221 -16.7820 -16.7817 -16.7141 -16.7126 -16.6849 -16.6840 -6.9345 -6.9340 -6.8889 -6.8885 -6.0298 -6.0287 -5.8475 -5.8462 -4.4400 -4.4396 -4.2605 -4.2598 -4.2409 -4.2393 -4.2201 -4.2178 -2.1902 -2.1897 -1.9621 -1.9584 -1.9144 -1.9113 -1.8331 -1.8328 -1.6140 -1.6121 -1.4808 -1.4773 -1.4163 -1.4121 -1.2306 -1.2301 -0.8824 -0.8815 -0.8562 -0.8548 0.1344 0.1350 0.1980 0.1995 0.4859 0.4886 0.5476 0.5477 0.5745 0.5752 0.6114 0.6126 9.4501 9.4512 9.6795 9.6796 10.1671 10.1677 10.2218 10.2232 10.9107 10.9124 11.0454 11.0462 k =-0.4997 0.5000 0.0621 ( 6556 PWs) bands (ev): -19.2960 -19.2959 -19.2874 -19.2873 -17.1249 -17.1238 -17.1124 -17.1111 -16.8223 -16.8219 -16.7825 -16.7822 -16.7140 -16.7121 -16.6853 -16.6841 -6.9339 -6.9332 -6.8891 -6.8884 -6.0279 -6.0265 -5.8485 -5.8467 -4.4399 -4.4394 -4.2612 -4.2603 -4.2428 -4.2405 -4.2232 -4.2200 -2.1864 -2.1856 -1.9635 -1.9588 -1.9190 -1.9150 -1.8322 -1.8321 -1.6286 -1.6271 -1.4743 -1.4699 -1.3965 -1.3915 -1.2400 -1.2394 -0.8842 -0.8831 -0.8491 -0.8473 0.1355 0.1364 0.1954 0.1973 0.4851 0.4887 0.5396 0.5400 0.5735 0.5741 0.6151 0.6166 9.4596 9.4610 9.6884 9.6885 10.1752 10.1760 10.2287 10.2306 10.9037 10.9057 11.0600 11.0609 k =-0.4997 0.5000 0.0777 ( 6564 PWs) bands (ev): -19.2959 -19.2958 -19.2875 -19.2873 -17.1249 -17.1234 -17.1127 -17.1111 -16.8221 -16.8215 -16.7832 -16.7827 -16.7138 -16.7114 -16.6857 -16.6842 -6.9331 -6.9323 -6.8892 -6.8884 -6.0255 -6.0238 -5.8497 -5.8475 -4.4398 -4.4392 -4.2620 -4.2609 -4.2452 -4.2423 -4.2267 -4.2227 -2.1815 -2.1805 -1.9654 -1.9597 -1.9245 -1.9196 -1.8314 -1.8309 -1.6432 -1.6425 -1.4661 -1.4609 -1.3746 -1.3691 -1.2514 -1.2507 -0.8864 -0.8851 -0.8406 -0.8385 0.1369 0.1380 0.1921 0.1945 0.4840 0.4885 0.5305 0.5313 0.5723 0.5729 0.6188 0.6206 9.4717 9.4736 9.6998 9.6998 10.1856 10.1865 10.2376 10.2401 10.8963 10.8986 11.0769 11.0778 k =-0.4997 0.5000 0.0932 ( 6534 PWs) bands (ev): -19.2958 -19.2956 -19.2876 -19.2874 -17.1248 -17.1231 -17.1129 -17.1110 -16.8218 -16.8211 -16.7839 -16.7834 -16.7135 -16.7108 -16.6862 -16.6844 -6.9321 -6.9312 -6.8894 -6.8884 -6.0226 -6.0204 -5.8511 -5.8485 -4.4396 -4.4388 -4.2629 -4.2616 -4.2485 -4.2450 -4.2305 -4.2257 -2.1756 -2.1744 -1.9677 -1.9612 -1.9306 -1.9249 -1.8306 -1.8293 -1.6575 -1.6572 -1.4563 -1.4505 -1.3516 -1.3456 -1.2644 -1.2637 -0.8890 -0.8874 -0.8312 -0.8288 0.1387 0.1400 0.1885 0.1912 0.4826 0.4878 0.5207 0.5219 0.5713 0.5718 0.6222 0.6243 9.4865 9.4887 9.7135 9.7135 10.1983 10.1994 10.2484 10.2514 10.8890 10.8915 11.0956 11.0964 k =-0.4997 0.5000 0.1087 ( 6532 PWs) bands (ev): -19.2957 -19.2955 -19.2877 -19.2875 -17.1246 -17.1227 -17.1132 -17.1110 -16.8214 -16.8206 -16.7848 -16.7843 -16.7132 -16.7100 -16.6867 -16.6846 -6.9309 -6.9299 -6.8896 -6.8885 -6.0191 -6.0166 -5.8528 -5.8498 -4.4392 -4.4383 -4.2639 -4.2624 -4.2526 -4.2489 -4.2340 -4.2287 -2.1687 -2.1674 -1.9704 -1.9634 -1.9372 -1.9307 -1.8302 -1.8276 -1.6714 -1.6698 -1.4454 -1.4389 -1.3282 -1.3220 -1.2785 -1.2781 -0.8917 -0.8900 -0.8212 -0.8186 0.1407 0.1423 0.1845 0.1875 0.4806 0.4866 0.5104 0.5120 0.5703 0.5709 0.6251 0.6275 9.5038 9.5063 9.7294 9.7294 10.2133 10.2145 10.2610 10.2644 10.8819 10.8845 11.1116 11.1140 k =-0.4997 0.5000 0.1243 ( 6524 PWs) bands (ev): -19.2955 -19.2953 -19.2879 -19.2876 -17.1245 -17.1222 -17.1134 -17.1110 -16.8209 -16.8201 -16.7857 -16.7852 -16.7127 -16.7092 -16.6873 -16.6849 -6.9296 -6.9284 -6.8898 -6.8886 -6.0151 -6.0123 -5.8548 -5.8514 -4.4387 -4.4377 -4.2650 -4.2633 -4.2576 -4.2540 -4.2370 -4.2317 -2.1610 -2.1596 -1.9737 -1.9663 -1.9440 -1.9369 -1.8302 -1.8259 -1.6838 -1.6805 -1.4333 -1.4263 -1.3048 -1.3009 -1.2934 -1.2910 -0.8945 -0.8926 -0.8111 -0.8082 0.1430 0.1449 0.1802 0.1836 0.4780 0.4847 0.4996 0.5017 0.5697 0.5704 0.6277 0.6303 9.5235 9.5263 9.7474 9.7474 10.2305 10.2319 10.2752 10.2792 10.8750 10.8778 11.1050 11.1062 k =-0.4997 0.5000 0.1398 ( 6514 PWs) bands (ev): -19.2954 -19.2951 -19.2880 -19.2878 -17.1243 -17.1218 -17.1137 -17.1110 -16.8204 -16.8195 -16.7867 -16.7862 -16.7122 -16.7084 -16.6879 -16.6853 -6.9282 -6.9269 -6.8901 -6.8887 -6.0107 -6.0076 -5.8571 -5.8533 -4.4380 -4.4368 -4.2662 -4.2646 -4.2631 -4.2602 -4.2396 -4.2345 -2.1525 -2.1510 -1.9776 -1.9699 -1.9510 -1.9432 -1.8310 -1.8247 -1.6939 -1.6888 -1.4205 -1.4129 -1.3110 -1.3097 -1.2816 -1.2735 -0.8971 -0.8952 -0.8012 -0.7982 0.1454 0.1477 0.1759 0.1796 0.4745 0.4819 0.4888 0.4912 0.5696 0.5704 0.6297 0.6325 9.5454 9.5486 9.7672 9.7672 10.2500 10.2515 10.2909 10.2955 10.8682 10.8712 11.0973 11.0979 k =-0.4997 0.5000 0.1553 ( 6524 PWs) bands (ev): -19.2952 -19.2949 -19.2882 -19.2879 -17.1240 -17.1213 -17.1140 -17.1110 -16.8198 -16.8188 -16.7878 -16.7874 -16.7117 -16.7075 -16.6886 -16.6857 -6.9266 -6.9252 -6.8904 -6.8889 -6.0058 -6.0024 -5.8596 -5.8555 -4.4370 -4.4357 -4.2707 -4.2693 -4.2656 -4.2648 -4.2420 -4.2372 -2.1434 -2.1417 -1.9819 -1.9742 -1.9579 -1.9495 -1.8330 -1.8246 -1.7013 -1.6943 -1.4073 -1.3994 -1.3268 -1.3260 -1.2594 -1.2512 -0.8994 -0.8975 -0.7919 -0.7886 0.1481 0.1508 0.1716 0.1756 0.4698 0.4776 0.4783 0.4810 0.5699 0.5709 0.6312 0.6342 9.5696 9.5730 9.7887 9.7887 10.2716 10.2733 10.3080 10.3131 10.8616 10.8647 11.0887 11.0893 k =-0.4997 0.5000 0.1709 ( 6528 PWs) bands (ev): -19.2950 -19.2947 -19.2884 -19.2881 -17.1238 -17.1208 -17.1143 -17.1111 -16.8191 -16.8181 -16.7890 -16.7886 -16.7110 -16.7066 -16.6894 -16.6862 -6.9250 -6.9234 -6.8908 -6.8892 -6.0005 -5.9968 -5.8625 -5.8581 -4.4358 -4.4344 -4.2782 -4.2767 -4.2673 -4.2656 -4.2442 -4.2398 -2.1338 -2.1320 -1.9867 -1.9790 -1.9644 -1.9555 -1.8366 -1.8262 -1.7054 -1.6967 -1.3947 -1.3867 -1.3418 -1.3415 -1.2386 -1.2300 -0.9011 -0.8991 -0.7833 -0.7800 0.1508 0.1539 0.1675 0.1717 0.4627 0.4688 0.4694 0.4746 0.5709 0.5721 0.6322 0.6354 9.5956 9.5993 9.8114 9.8115 10.2954 10.2971 10.3262 10.3319 10.8552 10.8584 11.0789 11.0795 k =-0.4997 0.5000 0.1864 ( 6548 PWs) bands (ev): -19.2947 -19.2944 -19.2886 -19.2883 -17.1235 -17.1203 -17.1147 -17.1112 -16.8184 -16.8173 -16.7902 -16.7899 -16.7103 -16.7057 -16.6901 -16.6867 -6.9232 -6.9215 -6.8913 -6.8896 -5.9949 -5.9909 -5.8656 -5.8609 -4.4342 -4.4327 -4.2864 -4.2852 -4.2683 -4.2663 -4.2464 -4.2423 -2.1237 -2.1218 -1.9919 -1.9843 -1.9706 -1.9611 -1.8417 -1.8298 -1.7058 -1.6961 -1.3866 -1.3808 -1.3525 -1.3500 -1.2196 -1.2106 -0.9018 -0.8998 -0.7759 -0.7725 0.1534 0.1571 0.1639 0.1682 0.4528 0.4586 0.4623 0.4692 0.5724 0.5739 0.6327 0.6361 9.6235 9.6274 9.8351 9.8352 10.3212 10.3230 10.3454 10.3518 10.8489 10.8523 11.0678 11.0686 k =-0.4997 0.5000 0.2019 ( 6550 PWs) bands (ev): -19.2945 -19.2942 -19.2888 -19.2885 -17.1231 -17.1198 -17.1150 -17.1113 -16.8176 -16.8164 -16.7915 -16.7912 -16.7096 -16.7048 -16.6909 -16.6873 -6.9214 -6.9196 -6.8918 -6.8900 -5.9889 -5.9846 -5.8691 -5.8642 -4.4322 -4.4306 -4.2950 -4.2943 -4.2691 -4.2670 -4.2486 -4.2447 -2.1133 -2.1114 -1.9973 -1.9898 -1.9761 -1.9660 -1.8484 -1.8355 -1.7027 -1.6925 -1.3923 -1.3899 -1.3496 -1.3431 -1.2029 -1.1935 -0.9011 -0.8992 -0.7698 -0.7663 0.1556 0.1601 0.1612 0.1654 0.4423 0.4483 0.4557 0.4632 0.5745 0.5763 0.6327 0.6362 9.6529 9.6571 9.8593 9.8593 10.3490 10.3508 10.3654 10.3724 10.8428 10.8464 11.0554 11.0562 k =-0.4997 0.5000 0.2175 ( 6520 PWs) bands (ev): -19.2943 -19.2939 -19.2891 -19.2887 -17.1228 -17.1192 -17.1153 -17.1115 -16.8167 -16.8155 -16.7928 -16.7926 -16.7088 -16.7038 -16.6918 -16.6879 -6.9195 -6.9176 -6.8925 -6.8905 -5.9827 -5.9781 -5.8730 -5.8678 -4.4298 -4.4281 -4.3040 -4.3036 -4.2697 -4.2675 -4.2507 -4.2470 -2.1029 -2.1010 -2.0027 -1.9954 -1.9807 -1.9701 -1.8563 -1.8429 -1.6965 -1.6863 -1.4073 -1.4059 -1.3373 -1.3293 -1.1890 -1.1792 -0.8986 -0.8968 -0.7653 -0.7616 0.1558 0.1608 0.1614 0.1649 0.4321 0.4386 0.4488 0.4568 0.5771 0.5792 0.6323 0.6359 9.6836 9.6880 9.8833 9.8833 10.3786 10.3804 10.3861 10.3937 10.8371 10.8409 11.0412 11.0422 k =-0.4997 0.5000 0.2330 ( 6520 PWs) bands (ev): -19.2940 -19.2936 -19.2893 -19.2890 -17.1224 -17.1187 -17.1157 -17.1117 -16.8157 -16.8146 -16.7942 -16.7941 -16.7079 -16.7028 -16.6926 -16.6885 -6.9175 -6.9156 -6.8932 -6.8912 -5.9762 -5.9714 -5.8771 -5.8717 -4.4269 -4.4251 -4.3131 -4.3131 -4.2701 -4.2678 -4.2528 -4.2493 -2.0926 -2.0908 -2.0082 -2.0011 -1.9843 -1.9731 -1.8652 -1.8517 -1.6878 -1.6780 -1.4247 -1.4234 -1.3225 -1.3138 -1.1784 -1.1682 -0.8942 -0.8924 -0.7624 -0.7587 0.1544 0.1601 0.1625 0.1672 0.4225 0.4296 0.4417 0.4499 0.5800 0.5825 0.6313 0.6350 9.7153 9.7198 9.9063 9.9064 10.4064 10.4105 10.4112 10.4163 10.8320 10.8361 11.0245 11.0256 k =-0.4997 0.5000 0.2485 ( 6516 PWs) bands (ev): -19.2937 -19.2933 -19.2896 -19.2892 -17.1220 -17.1181 -17.1161 -17.1119 -16.8147 -16.8136 -16.7956 -16.7955 -16.7071 -16.7018 -16.6935 -16.6892 -6.9156 -6.9135 -6.8940 -6.8919 -5.9696 -5.9645 -5.8816 -5.8760 -4.4235 -4.4217 -4.3227 -4.3224 -4.2704 -4.2680 -4.2548 -4.2515 -2.0828 -2.0809 -2.0136 -2.0067 -1.9865 -1.9749 -1.8749 -1.8615 -1.6771 -1.6678 -1.4429 -1.4415 -1.3070 -1.2979 -1.1713 -1.1609 -0.8876 -0.8858 -0.7614 -0.7577 0.1532 0.1591 0.1643 0.1696 0.4137 0.4214 0.4343 0.4428 0.5834 0.5861 0.6299 0.6337 9.7476 9.7522 9.9274 9.9277 10.4283 10.4364 10.4433 10.4458 10.8279 10.8323 11.0031 11.0042 k =-0.4997 0.5000 0.2641 ( 6532 PWs) bands (ev): -19.2934 -19.2930 -19.2899 -19.2895 -17.1216 -17.1175 -17.1165 -17.1122 -16.8136 -16.8125 -16.7970 -16.7969 -16.7062 -16.7008 -16.6945 -16.6900 -6.9136 -6.9115 -6.8949 -6.8928 -5.9628 -5.9575 -5.8865 -5.8807 -4.4196 -4.4178 -4.3322 -4.3317 -4.2705 -4.2680 -4.2569 -4.2536 -2.0737 -2.0718 -2.0187 -2.0121 -1.9871 -1.9750 -1.8851 -1.8720 -1.6647 -1.6562 -1.4614 -1.4597 -1.2913 -1.2819 -1.1677 -1.1572 -0.8789 -0.8770 -0.7623 -0.7586 0.1527 0.1588 0.1657 0.1716 0.4060 0.4144 0.4269 0.4357 0.5870 0.5899 0.6281 0.6320 9.7801 9.7848 9.9456 9.9462 10.4506 10.4594 10.4773 10.4794 10.8249 10.8297 10.9727 10.9729 k =-0.4997 0.5000 0.2796 ( 6524 PWs) bands (ev): -19.2931 -19.2927 -19.2901 -19.2897 -17.1212 -17.1170 -17.1169 -17.1125 -16.8125 -16.8114 -16.7986 -16.7983 -16.7052 -16.6999 -16.6954 -16.6907 -6.9117 -6.9095 -6.8960 -6.8938 -5.9559 -5.9504 -5.8916 -5.8858 -4.4152 -4.4133 -4.3417 -4.3408 -4.2703 -4.2678 -4.2588 -4.2557 -2.0657 -2.0637 -2.0235 -2.0172 -1.9857 -1.9733 -1.8958 -1.8828 -1.6511 -1.6433 -1.4800 -1.4780 -1.2756 -1.2661 -1.1676 -1.1569 -0.8684 -0.8664 -0.7651 -0.7615 0.1529 0.1593 0.1666 0.1730 0.3998 0.4086 0.4197 0.4288 0.5907 0.5939 0.6259 0.6298 9.8123 9.8169 9.9598 9.9607 10.4739 10.4830 10.5119 10.5139 10.8230 10.8283 10.9303 10.9325 k =-0.4997 0.5000 0.2951 ( 6526 PWs) bands (ev): -19.2929 -19.2924 -19.2904 -19.2900 -17.1208 -17.1173 -17.1165 -17.1128 -16.8113 -16.8102 -16.8001 -16.7997 -16.7043 -16.6989 -16.6964 -16.6915 -6.9098 -6.9075 -6.8971 -6.8948 -5.9489 -5.9433 -5.8971 -5.8912 -4.4102 -4.4083 -4.3509 -4.3498 -4.2700 -4.2674 -4.2606 -4.2576 -2.0590 -2.0567 -2.0280 -2.0219 -1.9822 -1.9696 -1.9067 -1.8940 -1.6365 -1.6294 -1.4986 -1.4961 -1.2603 -1.2505 -1.1705 -1.1598 -0.8566 -0.8543 -0.7698 -0.7663 0.1538 0.1604 0.1668 0.1736 0.3950 0.4044 0.4128 0.4221 0.5947 0.5980 0.6234 0.6273 9.8436 9.8482 9.9690 9.9703 10.4985 10.5076 10.5459 10.5478 10.8218 10.8276 10.8845 10.8879 k =-0.4997 0.5000 0.3107 ( 6516 PWs) bands (ev): -19.2926 -19.2921 -19.2907 -19.2903 -17.1203 -17.1177 -17.1159 -17.1132 -16.8100 -16.8090 -16.8016 -16.8011 -16.7033 -16.6979 -16.6973 -16.6924 -6.9079 -6.9056 -6.8984 -6.8961 -5.9420 -5.9363 -5.9029 -5.8969 -4.4046 -4.4027 -4.3599 -4.3586 -4.2695 -4.2668 -4.2624 -4.2594 -2.0536 -2.0509 -2.0321 -2.0264 -1.9766 -1.9639 -1.9177 -1.9052 -1.6210 -1.6147 -1.5170 -1.5141 -1.2453 -1.2354 -1.1761 -1.1655 -0.8439 -0.8414 -0.7765 -0.7730 0.1552 0.1622 0.1663 0.1735 0.3919 0.4017 0.4064 0.4161 0.5986 0.6021 0.6205 0.6244 9.8734 9.8778 9.9723 9.9741 10.5247 10.5335 10.5772 10.5792 10.8199 10.8259 10.8421 10.8459 k =-0.4997 0.5000 0.3262 ( 6516 PWs) bands (ev): -19.2922 -19.2918 -19.2910 -19.2906 -17.1199 -17.1181 -17.1154 -17.1136 -16.8087 -16.8078 -16.8030 -16.8025 -16.7023 -16.6983 -16.6969 -16.6932 -6.9061 -6.9038 -6.8997 -6.8974 -5.9351 -5.9293 -5.9089 -5.9029 -4.3984 -4.3966 -4.3685 -4.3671 -4.2688 -4.2660 -4.2640 -4.2611 -2.0493 -2.0460 -2.0358 -2.0305 -1.9691 -1.9565 -1.9288 -1.9164 -1.6048 -1.5992 -1.5352 -1.5319 -1.2310 -1.2209 -1.1840 -1.1734 -0.8309 -0.8282 -0.7848 -0.7814 0.1572 0.1643 0.1652 0.1726 0.3906 0.4005 0.4009 0.4107 0.6026 0.6062 0.6173 0.6212 9.9008 9.9050 9.9693 9.9717 10.5521 10.5604 10.6012 10.6038 10.8089 10.8122 10.8148 10.8203 k =-0.4997 0.5000 0.3417 ( 6516 PWs) bands (ev): -19.2919 -19.2915 -19.2913 -19.2909 -17.1194 -17.1186 -17.1149 -17.1140 -16.8073 -16.8065 -16.8045 -16.8039 -16.7013 -16.6993 -16.6960 -16.6941 -6.9044 -6.9021 -6.9012 -6.8988 -5.9283 -5.9224 -5.9152 -5.9091 -4.3917 -4.3899 -4.3767 -4.3751 -4.2678 -4.2654 -4.2651 -4.2626 -2.0457 -2.0419 -2.0392 -2.0343 -1.9602 -1.9478 -1.9397 -1.9274 -1.5880 -1.5830 -1.5532 -1.5493 -1.2175 -1.2073 -1.1937 -1.1832 -0.8181 -0.8152 -0.7947 -0.7915 0.1593 0.1635 0.1666 0.1710 0.3909 0.3962 0.4010 0.4063 0.6065 0.6102 0.6139 0.6178 9.9250 9.9288 9.9601 9.9630 10.5791 10.5865 10.6107 10.6147 10.7924 10.7939 10.8047 10.8086 k =-0.4997 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6013 10.6013 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k =-0.4997 0.5000 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6013 10.6013 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k =-0.5000 0.4997 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6014 10.6014 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k =-0.5000 0.4997 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6014 10.6014 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 k =-0.5000 0.4997 0.3417 ( 6516 PWs) bands (ev): -19.2919 -19.2915 -19.2913 -19.2909 -17.1194 -17.1186 -17.1149 -17.1140 -16.8073 -16.8065 -16.8045 -16.8039 -16.7013 -16.6993 -16.6960 -16.6941 -6.9044 -6.9021 -6.9012 -6.8988 -5.9283 -5.9224 -5.9152 -5.9091 -4.3917 -4.3899 -4.3767 -4.3751 -4.2678 -4.2654 -4.2651 -4.2626 -2.0457 -2.0419 -2.0392 -2.0343 -1.9602 -1.9478 -1.9397 -1.9274 -1.5880 -1.5830 -1.5532 -1.5493 -1.2175 -1.2073 -1.1937 -1.1832 -0.8181 -0.8152 -0.7947 -0.7915 0.1593 0.1635 0.1666 0.1710 0.3909 0.3962 0.4010 0.4063 0.6065 0.6102 0.6139 0.6178 9.9250 9.9288 9.9601 9.9630 10.5791 10.5865 10.6107 10.6147 10.7924 10.7939 10.8047 10.8086 k =-0.5000 0.4997 0.3262 ( 6516 PWs) bands (ev): -19.2922 -19.2918 -19.2910 -19.2906 -17.1199 -17.1181 -17.1154 -17.1136 -16.8087 -16.8078 -16.8030 -16.8025 -16.7023 -16.6983 -16.6969 -16.6932 -6.9061 -6.9038 -6.8997 -6.8974 -5.9351 -5.9293 -5.9089 -5.9029 -4.3984 -4.3966 -4.3685 -4.3671 -4.2688 -4.2660 -4.2640 -4.2611 -2.0493 -2.0460 -2.0358 -2.0305 -1.9691 -1.9565 -1.9288 -1.9164 -1.6048 -1.5992 -1.5352 -1.5319 -1.2310 -1.2209 -1.1840 -1.1734 -0.8309 -0.8282 -0.7848 -0.7814 0.1572 0.1643 0.1652 0.1726 0.3906 0.4006 0.4008 0.4107 0.6026 0.6062 0.6173 0.6212 9.9008 9.9050 9.9693 9.9717 10.5521 10.5604 10.6012 10.6038 10.8089 10.8122 10.8147 10.8203 k =-0.5000 0.4997 0.3107 ( 6516 PWs) bands (ev): -19.2926 -19.2921 -19.2907 -19.2903 -17.1203 -17.1177 -17.1159 -17.1132 -16.8100 -16.8090 -16.8016 -16.8011 -16.7033 -16.6979 -16.6973 -16.6924 -6.9079 -6.9056 -6.8984 -6.8961 -5.9420 -5.9363 -5.9029 -5.8969 -4.4046 -4.4027 -4.3599 -4.3586 -4.2695 -4.2668 -4.2624 -4.2594 -2.0536 -2.0509 -2.0321 -2.0264 -1.9766 -1.9639 -1.9177 -1.9052 -1.6210 -1.6147 -1.5170 -1.5141 -1.2453 -1.2354 -1.1761 -1.1655 -0.8439 -0.8414 -0.7765 -0.7730 0.1552 0.1622 0.1663 0.1735 0.3919 0.4017 0.4064 0.4161 0.5986 0.6021 0.6205 0.6244 9.8734 9.8778 9.9723 9.9741 10.5247 10.5335 10.5772 10.5792 10.8199 10.8259 10.8421 10.8459 k =-0.5000 0.4997 0.2951 ( 6524 PWs) bands (ev): -19.2929 -19.2924 -19.2904 -19.2900 -17.1208 -17.1173 -17.1165 -17.1128 -16.8113 -16.8102 -16.8001 -16.7997 -16.7043 -16.6989 -16.6964 -16.6915 -6.9098 -6.9075 -6.8971 -6.8948 -5.9489 -5.9433 -5.8971 -5.8912 -4.4102 -4.4083 -4.3509 -4.3498 -4.2700 -4.2674 -4.2606 -4.2576 -2.0590 -2.0567 -2.0280 -2.0219 -1.9822 -1.9696 -1.9067 -1.8940 -1.6365 -1.6294 -1.4986 -1.4961 -1.2603 -1.2505 -1.1705 -1.1598 -0.8566 -0.8543 -0.7698 -0.7663 0.1538 0.1604 0.1668 0.1736 0.3950 0.4044 0.4128 0.4221 0.5947 0.5980 0.6234 0.6273 9.8436 9.8482 9.9690 9.9703 10.4985 10.5076 10.5459 10.5478 10.8218 10.8276 10.8845 10.8879 k =-0.5000 0.4997 0.2796 ( 6524 PWs) bands (ev): -19.2931 -19.2927 -19.2901 -19.2897 -17.1212 -17.1170 -17.1169 -17.1125 -16.8125 -16.8114 -16.7986 -16.7983 -16.7052 -16.6999 -16.6954 -16.6907 -6.9117 -6.9095 -6.8960 -6.8938 -5.9559 -5.9504 -5.8916 -5.8858 -4.4152 -4.4133 -4.3417 -4.3408 -4.2703 -4.2678 -4.2588 -4.2557 -2.0657 -2.0637 -2.0235 -2.0172 -1.9857 -1.9733 -1.8958 -1.8828 -1.6511 -1.6433 -1.4800 -1.4780 -1.2756 -1.2661 -1.1676 -1.1569 -0.8684 -0.8664 -0.7651 -0.7614 0.1529 0.1593 0.1666 0.1730 0.3998 0.4087 0.4197 0.4288 0.5907 0.5939 0.6259 0.6298 9.8123 9.8170 9.9598 9.9607 10.4739 10.4830 10.5119 10.5139 10.8230 10.8283 10.9303 10.9325 k =-0.5000 0.4997 0.2641 ( 6532 PWs) bands (ev): -19.2934 -19.2930 -19.2899 -19.2895 -17.1216 -17.1175 -17.1165 -17.1122 -16.8136 -16.8125 -16.7970 -16.7969 -16.7062 -16.7008 -16.6945 -16.6900 -6.9136 -6.9115 -6.8949 -6.8928 -5.9628 -5.9575 -5.8865 -5.8807 -4.4196 -4.4178 -4.3322 -4.3317 -4.2705 -4.2680 -4.2569 -4.2536 -2.0737 -2.0718 -2.0187 -2.0121 -1.9871 -1.9750 -1.8851 -1.8720 -1.6647 -1.6562 -1.4614 -1.4597 -1.2913 -1.2819 -1.1677 -1.1572 -0.8789 -0.8770 -0.7623 -0.7586 0.1527 0.1588 0.1657 0.1716 0.4060 0.4144 0.4269 0.4357 0.5870 0.5899 0.6281 0.6320 9.7801 9.7848 9.9456 9.9462 10.4507 10.4594 10.4773 10.4794 10.8249 10.8297 10.9727 10.9729 k =-0.5000 0.4997 0.2485 ( 6516 PWs) bands (ev): -19.2937 -19.2933 -19.2896 -19.2892 -17.1220 -17.1181 -17.1161 -17.1119 -16.8147 -16.8136 -16.7956 -16.7956 -16.7071 -16.7018 -16.6935 -16.6892 -6.9156 -6.9135 -6.8940 -6.8919 -5.9696 -5.9645 -5.8816 -5.8760 -4.4235 -4.4217 -4.3227 -4.3224 -4.2704 -4.2680 -4.2548 -4.2515 -2.0828 -2.0809 -2.0136 -2.0067 -1.9865 -1.9749 -1.8749 -1.8615 -1.6771 -1.6678 -1.4429 -1.4415 -1.3070 -1.2979 -1.1713 -1.1609 -0.8876 -0.8858 -0.7614 -0.7577 0.1532 0.1591 0.1643 0.1696 0.4137 0.4214 0.4343 0.4428 0.5834 0.5861 0.6299 0.6337 9.7476 9.7522 9.9274 9.9277 10.4284 10.4365 10.4433 10.4457 10.8279 10.8323 11.0031 11.0042 k =-0.5000 0.4997 0.2330 ( 6520 PWs) bands (ev): -19.2940 -19.2936 -19.2893 -19.2890 -17.1224 -17.1187 -17.1157 -17.1117 -16.8157 -16.8146 -16.7942 -16.7941 -16.7079 -16.7028 -16.6926 -16.6885 -6.9175 -6.9156 -6.8932 -6.8912 -5.9762 -5.9714 -5.8771 -5.8717 -4.4269 -4.4251 -4.3131 -4.3131 -4.2701 -4.2678 -4.2528 -4.2493 -2.0926 -2.0908 -2.0082 -2.0011 -1.9843 -1.9731 -1.8652 -1.8517 -1.6878 -1.6780 -1.4247 -1.4234 -1.3225 -1.3138 -1.1784 -1.1682 -0.8942 -0.8924 -0.7624 -0.7587 0.1544 0.1601 0.1625 0.1672 0.4225 0.4296 0.4417 0.4499 0.5800 0.5825 0.6313 0.6350 9.7153 9.7198 9.9063 9.9064 10.4066 10.4106 10.4110 10.4162 10.8320 10.8361 11.0245 11.0256 k =-0.5000 0.4997 0.2175 ( 6520 PWs) bands (ev): -19.2943 -19.2939 -19.2891 -19.2887 -17.1228 -17.1192 -17.1153 -17.1115 -16.8167 -16.8155 -16.7928 -16.7926 -16.7088 -16.7038 -16.6918 -16.6879 -6.9195 -6.9176 -6.8925 -6.8905 -5.9827 -5.9781 -5.8730 -5.8678 -4.4298 -4.4281 -4.3040 -4.3036 -4.2697 -4.2675 -4.2507 -4.2470 -2.1029 -2.1010 -2.0027 -1.9954 -1.9807 -1.9701 -1.8563 -1.8429 -1.6965 -1.6863 -1.4073 -1.4059 -1.3373 -1.3293 -1.1890 -1.1792 -0.8986 -0.8968 -0.7653 -0.7616 0.1558 0.1608 0.1613 0.1649 0.4321 0.4386 0.4488 0.4568 0.5771 0.5792 0.6323 0.6359 9.6836 9.6880 9.8833 9.8833 10.3786 10.3804 10.3860 10.3937 10.8371 10.8409 11.0412 11.0422 k =-0.5000 0.4997 0.2019 ( 6550 PWs) bands (ev): -19.2945 -19.2942 -19.2888 -19.2885 -17.1231 -17.1198 -17.1150 -17.1113 -16.8176 -16.8164 -16.7915 -16.7912 -16.7096 -16.7048 -16.6909 -16.6873 -6.9214 -6.9196 -6.8918 -6.8900 -5.9889 -5.9846 -5.8691 -5.8642 -4.4322 -4.4306 -4.2950 -4.2943 -4.2691 -4.2670 -4.2486 -4.2447 -2.1133 -2.1114 -1.9973 -1.9898 -1.9761 -1.9660 -1.8484 -1.8355 -1.7027 -1.6925 -1.3923 -1.3899 -1.3496 -1.3431 -1.2029 -1.1935 -0.9011 -0.8992 -0.7698 -0.7663 0.1556 0.1601 0.1612 0.1654 0.4424 0.4484 0.4557 0.4632 0.5745 0.5763 0.6327 0.6362 9.6529 9.6571 9.8593 9.8593 10.3490 10.3508 10.3654 10.3724 10.8428 10.8464 11.0554 11.0562 k =-0.5000 0.4997 0.1864 ( 6548 PWs) bands (ev): -19.2947 -19.2944 -19.2886 -19.2883 -17.1235 -17.1203 -17.1147 -17.1112 -16.8184 -16.8173 -16.7902 -16.7899 -16.7103 -16.7057 -16.6901 -16.6867 -6.9232 -6.9215 -6.8913 -6.8896 -5.9949 -5.9909 -5.8656 -5.8609 -4.4342 -4.4327 -4.2864 -4.2852 -4.2683 -4.2663 -4.2464 -4.2423 -2.1237 -2.1218 -1.9919 -1.9843 -1.9706 -1.9611 -1.8417 -1.8298 -1.7058 -1.6961 -1.3866 -1.3808 -1.3525 -1.3500 -1.2196 -1.2106 -0.9018 -0.8998 -0.7759 -0.7725 0.1534 0.1571 0.1639 0.1682 0.4529 0.4586 0.4623 0.4692 0.5724 0.5739 0.6327 0.6361 9.6235 9.6274 9.8351 9.8352 10.3212 10.3230 10.3454 10.3517 10.8489 10.8523 11.0678 11.0686 k =-0.5000 0.4997 0.1709 ( 6528 PWs) bands (ev): -19.2950 -19.2947 -19.2884 -19.2881 -17.1238 -17.1208 -17.1143 -17.1111 -16.8191 -16.8181 -16.7890 -16.7886 -16.7110 -16.7066 -16.6894 -16.6862 -6.9250 -6.9234 -6.8908 -6.8892 -6.0005 -5.9968 -5.8625 -5.8581 -4.4358 -4.4344 -4.2782 -4.2767 -4.2673 -4.2656 -4.2442 -4.2398 -2.1338 -2.1320 -1.9867 -1.9790 -1.9644 -1.9555 -1.8366 -1.8262 -1.7054 -1.6967 -1.3947 -1.3867 -1.3418 -1.3415 -1.2386 -1.2300 -0.9011 -0.8991 -0.7833 -0.7800 0.1508 0.1539 0.1675 0.1717 0.4627 0.4690 0.4691 0.4746 0.5709 0.5721 0.6322 0.6354 9.5956 9.5993 9.8114 9.8115 10.2954 10.2971 10.3262 10.3319 10.8552 10.8584 11.0789 11.0795 k =-0.5000 0.4997 0.1553 ( 6524 PWs) bands (ev): -19.2952 -19.2949 -19.2882 -19.2879 -17.1240 -17.1213 -17.1140 -17.1110 -16.8198 -16.8188 -16.7878 -16.7874 -16.7117 -16.7075 -16.6886 -16.6857 -6.9266 -6.9252 -6.8904 -6.8889 -6.0058 -6.0024 -5.8596 -5.8555 -4.4370 -4.4357 -4.2707 -4.2693 -4.2656 -4.2648 -4.2420 -4.2372 -2.1434 -2.1417 -1.9819 -1.9742 -1.9579 -1.9495 -1.8330 -1.8246 -1.7013 -1.6943 -1.4073 -1.3994 -1.3268 -1.3260 -1.2594 -1.2512 -0.8994 -0.8975 -0.7919 -0.7886 0.1481 0.1508 0.1716 0.1756 0.4698 0.4778 0.4781 0.4810 0.5699 0.5709 0.6312 0.6342 9.5696 9.5730 9.7887 9.7887 10.2716 10.2733 10.3080 10.3131 10.8616 10.8647 11.0887 11.0893 k =-0.5000 0.4997 0.1398 ( 6512 PWs) bands (ev): -19.2954 -19.2951 -19.2880 -19.2878 -17.1243 -17.1218 -17.1137 -17.1110 -16.8204 -16.8195 -16.7867 -16.7862 -16.7122 -16.7084 -16.6879 -16.6853 -6.9282 -6.9269 -6.8901 -6.8887 -6.0107 -6.0076 -5.8571 -5.8533 -4.4380 -4.4368 -4.2662 -4.2646 -4.2631 -4.2602 -4.2396 -4.2345 -2.1525 -2.1510 -1.9776 -1.9699 -1.9510 -1.9432 -1.8310 -1.8247 -1.6939 -1.6888 -1.4205 -1.4129 -1.3110 -1.3097 -1.2816 -1.2735 -0.8971 -0.8952 -0.8012 -0.7982 0.1454 0.1477 0.1759 0.1796 0.4745 0.4819 0.4887 0.4912 0.5696 0.5704 0.6297 0.6325 9.5454 9.5486 9.7672 9.7672 10.2500 10.2515 10.2909 10.2955 10.8682 10.8712 11.0973 11.0979 k =-0.5000 0.4997 0.1243 ( 6524 PWs) bands (ev): -19.2955 -19.2953 -19.2879 -19.2876 -17.1245 -17.1222 -17.1134 -17.1110 -16.8209 -16.8201 -16.7857 -16.7852 -16.7127 -16.7092 -16.6873 -16.6849 -6.9296 -6.9284 -6.8898 -6.8886 -6.0151 -6.0123 -5.8548 -5.8514 -4.4387 -4.4377 -4.2650 -4.2632 -4.2576 -4.2540 -4.2370 -4.2317 -2.1610 -2.1596 -1.9737 -1.9663 -1.9440 -1.9369 -1.8302 -1.8259 -1.6838 -1.6805 -1.4333 -1.4263 -1.3048 -1.3009 -1.2933 -1.2910 -0.8945 -0.8926 -0.8111 -0.8082 0.1430 0.1449 0.1802 0.1836 0.4780 0.4847 0.4996 0.5017 0.5697 0.5704 0.6277 0.6303 9.5235 9.5263 9.7474 9.7474 10.2305 10.2319 10.2752 10.2792 10.8750 10.8778 11.1049 11.1054 k =-0.5000 0.4997 0.1087 ( 6532 PWs) bands (ev): -19.2957 -19.2955 -19.2877 -19.2875 -17.1246 -17.1227 -17.1132 -17.1110 -16.8214 -16.8206 -16.7848 -16.7843 -16.7132 -16.7100 -16.6867 -16.6846 -6.9309 -6.9299 -6.8896 -6.8885 -6.0191 -6.0166 -5.8528 -5.8498 -4.4392 -4.4383 -4.2639 -4.2624 -4.2526 -4.2489 -4.2340 -4.2287 -2.1687 -2.1674 -1.9704 -1.9634 -1.9372 -1.9307 -1.8302 -1.8276 -1.6714 -1.6698 -1.4454 -1.4389 -1.3282 -1.3220 -1.2785 -1.2781 -0.8917 -0.8900 -0.8212 -0.8186 0.1407 0.1423 0.1845 0.1875 0.4806 0.4866 0.5104 0.5120 0.5703 0.5709 0.6251 0.6275 9.5038 9.5063 9.7294 9.7294 10.2133 10.2146 10.2610 10.2644 10.8819 10.8845 11.1106 11.1122 k =-0.5000 0.4997 0.0932 ( 6532 PWs) bands (ev): -19.2958 -19.2956 -19.2876 -19.2874 -17.1248 -17.1231 -17.1129 -17.1110 -16.8218 -16.8211 -16.7839 -16.7834 -16.7135 -16.7108 -16.6862 -16.6844 -6.9321 -6.9312 -6.8894 -6.8884 -6.0226 -6.0204 -5.8511 -5.8485 -4.4396 -4.4388 -4.2629 -4.2616 -4.2485 -4.2450 -4.2305 -4.2257 -2.1756 -2.1744 -1.9677 -1.9612 -1.9306 -1.9249 -1.8306 -1.8293 -1.6575 -1.6572 -1.4563 -1.4505 -1.3516 -1.3456 -1.2644 -1.2637 -0.8890 -0.8874 -0.8312 -0.8288 0.1387 0.1400 0.1885 0.1912 0.4826 0.4878 0.5207 0.5219 0.5713 0.5718 0.6222 0.6243 9.4865 9.4887 9.7135 9.7135 10.1983 10.1994 10.2484 10.2513 10.8890 10.8915 11.0956 11.0964 k =-0.5000 0.4997 0.0777 ( 6564 PWs) bands (ev): -19.2959 -19.2958 -19.2875 -19.2873 -17.1249 -17.1234 -17.1127 -17.1111 -16.8221 -16.8215 -16.7832 -16.7827 -16.7138 -16.7114 -16.6857 -16.6842 -6.9331 -6.9323 -6.8892 -6.8884 -6.0255 -6.0238 -5.8497 -5.8475 -4.4398 -4.4392 -4.2620 -4.2609 -4.2452 -4.2423 -4.2267 -4.2227 -2.1815 -2.1805 -1.9654 -1.9597 -1.9245 -1.9196 -1.8314 -1.8309 -1.6432 -1.6425 -1.4661 -1.4609 -1.3746 -1.3691 -1.2514 -1.2507 -0.8864 -0.8851 -0.8406 -0.8385 0.1369 0.1380 0.1921 0.1945 0.4840 0.4885 0.5305 0.5313 0.5723 0.5729 0.6188 0.6206 9.4717 9.4736 9.6998 9.6998 10.1856 10.1865 10.2376 10.2400 10.8963 10.8986 11.0770 11.0778 k =-0.5000 0.4997 0.0621 ( 6556 PWs) bands (ev): -19.2960 -19.2959 -19.2874 -19.2873 -17.1249 -17.1238 -17.1124 -17.1111 -16.8223 -16.8219 -16.7825 -16.7822 -16.7140 -16.7121 -16.6853 -16.6841 -6.9339 -6.9332 -6.8891 -6.8884 -6.0279 -6.0265 -5.8485 -5.8467 -4.4399 -4.4394 -4.2612 -4.2603 -4.2428 -4.2405 -4.2232 -4.2200 -2.1864 -2.1856 -1.9635 -1.9588 -1.9190 -1.9150 -1.8322 -1.8321 -1.6286 -1.6271 -1.4743 -1.4699 -1.3965 -1.3915 -1.2400 -1.2394 -0.8842 -0.8831 -0.8491 -0.8473 0.1355 0.1363 0.1954 0.1973 0.4851 0.4887 0.5396 0.5400 0.5735 0.5741 0.6151 0.6166 9.4596 9.4610 9.6884 9.6885 10.1752 10.1760 10.2287 10.2306 10.9037 10.9057 11.0600 11.0609 k =-0.5000 0.4997 0.0466 ( 6556 PWs) bands (ev): -19.2961 -19.2960 -19.2873 -19.2872 -17.1249 -17.1240 -17.1122 -17.1112 -16.8225 -16.8221 -16.7820 -16.7817 -16.7141 -16.7126 -16.6849 -16.6840 -6.9345 -6.9340 -6.8889 -6.8884 -6.0298 -6.0287 -5.8475 -5.8462 -4.4400 -4.4396 -4.2605 -4.2598 -4.2409 -4.2393 -4.2201 -4.2178 -2.1902 -2.1897 -1.9621 -1.9584 -1.9144 -1.9113 -1.8331 -1.8328 -1.6140 -1.6121 -1.4808 -1.4773 -1.4163 -1.4121 -1.2306 -1.2301 -0.8824 -0.8815 -0.8562 -0.8548 0.1344 0.1350 0.1980 0.1995 0.4859 0.4886 0.5476 0.5477 0.5745 0.5752 0.6114 0.6126 9.4501 9.4512 9.6795 9.6796 10.1671 10.1677 10.2218 10.2232 10.9107 10.9124 11.0454 11.0462 k =-0.5000 0.4997 0.0311 ( 6568 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1249 -17.1243 -17.1120 -17.1114 -16.8226 -16.8224 -16.7816 -16.7814 -16.7140 -16.7131 -16.6846 -16.6840 -6.9349 -6.9346 -6.8888 -6.8885 -6.0311 -6.0304 -5.8467 -5.8458 -4.4400 -4.4397 -4.2600 -4.2595 -4.2396 -4.2386 -4.2177 -4.2162 -2.1930 -2.1926 -1.9609 -1.9584 -1.9108 -1.9087 -1.8337 -1.8334 -1.6008 -1.5990 -1.4855 -1.4829 -1.4328 -1.4297 -1.2236 -1.2231 -0.8810 -0.8804 -0.8616 -0.8606 0.1337 0.1340 0.2000 0.2010 0.4865 0.4883 0.5540 0.5541 0.5754 0.5760 0.6080 0.6088 9.4433 9.4441 9.6731 9.6731 10.1614 10.1618 10.2168 10.2178 10.9169 10.9182 11.0338 11.0345 k =-0.5000 0.4997 0.0155 ( 6572 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1248 -17.1245 -17.1118 -17.1115 -16.8227 -16.8225 -16.7814 -16.7813 -16.7139 -16.7134 -16.6844 -16.6841 -6.9351 -6.9350 -6.8887 -6.8886 -6.0318 -6.0314 -5.8462 -5.8457 -4.4400 -4.4399 -4.2596 -4.2594 -4.2388 -4.2383 -4.2161 -4.2154 -2.1946 -2.1944 -1.9599 -1.9587 -1.9084 -1.9074 -1.8340 -1.8337 -1.5909 -1.5897 -1.4881 -1.4867 -1.4440 -1.4422 -1.2191 -1.2189 -0.8801 -0.8798 -0.8648 -0.8644 0.1332 0.1334 0.2014 0.2018 0.4870 0.4879 0.5583 0.5585 0.5761 0.5765 0.6055 0.6059 9.4393 9.4397 9.6693 9.6693 10.1580 10.1582 10.2139 10.2144 10.9215 10.9222 11.0263 11.0267 k =-0.5000 0.4997 0.0000 ( 6564 PWs) bands (ev): -19.2961 -19.2961 -19.2872 -19.2872 -17.1247 -17.1247 -17.1117 -17.1117 -16.8226 -16.8226 -16.7813 -16.7813 -16.7137 -16.7137 -16.6842 -16.6842 -6.9351 -6.9351 -6.8886 -6.8886 -6.0319 -6.0319 -5.8458 -5.8458 -4.4399 -4.4399 -4.2594 -4.2594 -4.2383 -4.2383 -4.2153 -4.2153 -2.1951 -2.1951 -1.9592 -1.9592 -1.9072 -1.9072 -1.8340 -1.8340 -1.5867 -1.5867 -1.4885 -1.4885 -1.4474 -1.4474 -1.2175 -1.2175 -0.8796 -0.8796 -0.8658 -0.8658 0.1332 0.1332 0.2020 0.2020 0.4875 0.4875 0.5600 0.5600 0.5765 0.5765 0.6047 0.6047 9.4381 9.4381 9.6680 9.6680 10.1569 10.1569 10.2131 10.2131 10.9234 10.9234 11.0238 11.0238 k = 0.0000 0.0000 0.3573 ( 6582 PWs) bands (ev): -19.4298 -19.4298 -19.4298 -19.4298 -16.9836 -16.9836 -16.9836 -16.9836 -16.6816 -16.6816 -16.6811 -16.6811 -16.6709 -16.6709 -16.6704 -16.6704 -7.7961 -7.7961 -7.7958 -7.7958 -5.2442 -5.2442 -5.2439 -5.2439 -4.6779 -4.6779 -4.6720 -4.6720 -4.5535 -4.5535 -4.5484 -4.5484 -1.9143 -1.9143 -1.9134 -1.9134 -1.5434 -1.5434 -1.5425 -1.5425 -1.2486 -1.2486 -1.2474 -1.2474 -1.0579 -1.0579 -1.0529 -1.0529 -1.0412 -1.0412 -1.0365 -1.0365 0.3977 0.3977 0.4071 0.4071 0.6123 0.6123 0.6192 0.6192 0.7168 0.7168 0.7192 0.7192 7.9856 7.9856 7.9856 7.9856 10.5427 10.5427 10.5580 10.5580 10.7113 10.7113 10.7228 10.7228 k =-0.0111 0.0111 0.3573 ( 6570 PWs) bands (ev): -19.4296 -19.4296 -19.4296 -19.4296 -16.9839 -16.9839 -16.9836 -16.9836 -16.6824 -16.6824 -16.6808 -16.6808 -16.6715 -16.6715 -16.6698 -16.6698 -7.7954 -7.7954 -7.7951 -7.7951 -5.2443 -5.2443 -5.2438 -5.2438 -4.6778 -4.6778 -4.6719 -4.6719 -4.5534 -4.5534 -4.5482 -4.5482 -1.9145 -1.9145 -1.9136 -1.9136 -1.5449 -1.5449 -1.5436 -1.5436 -1.2488 -1.2488 -1.2476 -1.2476 -1.0632 -1.0632 -1.0493 -1.0493 -1.0434 -1.0434 -1.0303 -1.0303 0.3968 0.3968 0.4061 0.4061 0.6112 0.6112 0.6183 0.6183 0.7176 0.7176 0.7204 0.7204 7.9872 7.9872 7.9873 7.9873 10.5398 10.5398 10.5551 10.5551 10.7140 10.7140 10.7257 10.7257 k =-0.0222 0.0222 0.3573 ( 6546 PWs) bands (ev): -19.4291 -19.4291 -19.4291 -19.4291 -16.9844 -16.9844 -16.9839 -16.9839 -16.6837 -16.6837 -16.6808 -16.6808 -16.6720 -16.6720 -16.6691 -16.6691 -7.7932 -7.7932 -7.7929 -7.7929 -5.2447 -5.2447 -5.2437 -5.2437 -4.6776 -4.6776 -4.6715 -4.6715 -4.5531 -4.5531 -4.5479 -4.5479 -1.9153 -1.9153 -1.9141 -1.9141 -1.5491 -1.5491 -1.5470 -1.5470 -1.2494 -1.2494 -1.2483 -1.2483 -1.0694 -1.0694 -1.0537 -1.0537 -1.0353 -1.0353 -1.0211 -1.0211 0.3941 0.3941 0.4034 0.4034 0.6080 0.6080 0.6157 0.6157 0.7199 0.7199 0.7237 0.7237 7.9922 7.9922 7.9923 7.9923 10.5317 10.5317 10.5470 10.5470 10.7216 10.7216 10.7338 10.7338 k =-0.0333 0.0333 0.3573 ( 6544 PWs) bands (ev): -19.4284 -19.4284 -19.4283 -19.4283 -16.9852 -16.9852 -16.9845 -16.9845 -16.6853 -16.6853 -16.6815 -16.6815 -16.6724 -16.6724 -16.6684 -16.6684 -7.7895 -7.7895 -7.7892 -7.7892 -5.2452 -5.2452 -5.2437 -5.2437 -4.6772 -4.6772 -4.6709 -4.6709 -4.5525 -4.5525 -4.5473 -4.5473 -1.9166 -1.9166 -1.9152 -1.9152 -1.5556 -1.5556 -1.5526 -1.5526 -1.2504 -1.2504 -1.2494 -1.2494 -1.0746 -1.0746 -1.0587 -1.0587 -1.0245 -1.0245 -1.0107 -1.0107 0.3896 0.3896 0.3988 0.3988 0.6030 0.6030 0.6115 0.6115 0.7239 0.7239 0.7285 0.7285 8.0005 8.0005 8.0006 8.0006 10.5196 10.5196 10.5348 10.5348 10.7331 10.7331 10.7459 10.7459 k =-0.0444 0.0444 0.3573 ( 6540 PWs) bands (ev): -19.4273 -19.4273 -19.4272 -19.4272 -16.9863 -16.9863 -16.9853 -16.9853 -16.6872 -16.6872 -16.6827 -16.6827 -16.6725 -16.6725 -16.6679 -16.6679 -7.7844 -7.7844 -7.7841 -7.7841 -5.2458 -5.2458 -5.2439 -5.2439 -4.6766 -4.6766 -4.6701 -4.6701 -4.5518 -4.5518 -4.5465 -4.5465 -1.9184 -1.9184 -1.9167 -1.9167 -1.5640 -1.5640 -1.5602 -1.5602 -1.2519 -1.2519 -1.2511 -1.2511 -1.0788 -1.0788 -1.0628 -1.0628 -1.0126 -1.0126 -0.9994 -0.9994 0.3835 0.3835 0.3925 0.3925 0.5967 0.5967 0.6058 0.6058 0.7293 0.7293 0.7345 0.7345 8.0121 8.0121 8.0122 8.0122 10.5048 10.5048 10.5199 10.5199 10.7473 10.7473 10.7605 10.7605 k =-0.0556 0.0555 0.3573 ( 6538 PWs) bands (ev): -19.4259 -19.4259 -19.4258 -19.4258 -16.9877 -16.9877 -16.9865 -16.9865 -16.6894 -16.6894 -16.6845 -16.6845 -16.6726 -16.6726 -16.6675 -16.6675 -7.7778 -7.7778 -7.7775 -7.7775 -5.2467 -5.2467 -5.2443 -5.2443 -4.6757 -4.6757 -4.6690 -4.6690 -4.5507 -4.5507 -4.5454 -4.5454 -1.9210 -1.9210 -1.9189 -1.9189 -1.5739 -1.5739 -1.5693 -1.5693 -1.2542 -1.2542 -1.2535 -1.2535 -1.0820 -1.0820 -1.0661 -1.0661 -1.0000 -1.0000 -0.9872 -0.9872 0.3758 0.3758 0.3847 0.3847 0.5894 0.5894 0.5989 0.5989 0.7357 0.7357 0.7412 0.7412 8.0270 8.0270 8.0271 8.0271 10.4883 10.4883 10.5032 10.5032 10.7632 10.7632 10.7768 10.7768 k =-0.0667 0.0666 0.3573 ( 6540 PWs) bands (ev): -19.4242 -19.4242 -19.4241 -19.4241 -16.9893 -16.9893 -16.9878 -16.9878 -16.6917 -16.6917 -16.6866 -16.6866 -16.6726 -16.6726 -16.6672 -16.6672 -7.7698 -7.7698 -7.7694 -7.7694 -5.2479 -5.2479 -5.2451 -5.2451 -4.6745 -4.6745 -4.6676 -4.6676 -4.5494 -4.5494 -4.5441 -4.5441 -1.9243 -1.9243 -1.9219 -1.9219 -1.5848 -1.5848 -1.5795 -1.5795 -1.2572 -1.2572 -1.2566 -1.2566 -1.0843 -1.0843 -1.0685 -1.0685 -0.9867 -0.9867 -0.9745 -0.9745 0.3666 0.3666 0.3753 0.3753 0.5812 0.5812 0.5909 0.5909 0.7428 0.7428 0.7484 0.7484 8.0451 8.0451 8.0453 8.0453 10.4707 10.4707 10.4854 10.4854 10.7803 10.7803 10.7941 10.7941 k =-0.0778 0.0777 0.3573 ( 6536 PWs) bands (ev): -19.4222 -19.4222 -19.4221 -19.4221 -16.9911 -16.9911 -16.9895 -16.9895 -16.6943 -16.6943 -16.6891 -16.6891 -16.6726 -16.6726 -16.6671 -16.6671 -7.7603 -7.7603 -7.7600 -7.7600 -5.2495 -5.2495 -5.2462 -5.2462 -4.6731 -4.6731 -4.6659 -4.6659 -4.5478 -4.5478 -4.5424 -4.5424 -1.9285 -1.9285 -1.9257 -1.9257 -1.5962 -1.5962 -1.5903 -1.5903 -1.2610 -1.2610 -1.2605 -1.2605 -1.0857 -1.0857 -1.0702 -1.0702 -0.9730 -0.9730 -0.9614 -0.9614 0.3562 0.3562 0.3646 0.3646 0.5723 0.5723 0.5822 0.5822 0.7503 0.7503 0.7560 0.7560 8.0665 8.0665 8.0667 8.0667 10.4526 10.4526 10.4670 10.4670 10.7980 10.7980 10.8119 10.8119 k =-0.0889 0.0888 0.3573 ( 6532 PWs) bands (ev): -19.4200 -19.4200 -19.4199 -19.4199 -16.9933 -16.9933 -16.9914 -16.9914 -16.6972 -16.6972 -16.6918 -16.6918 -16.6727 -16.6727 -16.6671 -16.6671 -7.7495 -7.7495 -7.7491 -7.7491 -5.2515 -5.2515 -5.2478 -5.2478 -4.6712 -4.6712 -4.6638 -4.6638 -4.5459 -4.5459 -4.5405 -4.5405 -1.9337 -1.9337 -1.9306 -1.9306 -1.6077 -1.6077 -1.6013 -1.6013 -1.2658 -1.2658 -1.2651 -1.2651 -1.0865 -1.0865 -1.0713 -1.0713 -0.9591 -0.9591 -0.9480 -0.9480 0.3445 0.3445 0.3528 0.3528 0.5629 0.5629 0.5727 0.5727 0.7581 0.7581 0.7637 0.7637 8.0911 8.0911 8.0914 8.0914 10.4342 10.4342 10.4484 10.4484 10.8159 10.8159 10.8300 10.8300 k =-0.1000 0.0999 0.3573 ( 6540 PWs) bands (ev): -19.4174 -19.4174 -19.4173 -19.4173 -16.9957 -16.9957 -16.9936 -16.9936 -16.7002 -16.7002 -16.6947 -16.6947 -16.6730 -16.6730 -16.6672 -16.6672 -7.7372 -7.7372 -7.7369 -7.7369 -5.2542 -5.2542 -5.2501 -5.2501 -4.6689 -4.6689 -4.6612 -4.6612 -4.5437 -4.5437 -4.5382 -4.5382 -1.9400 -1.9400 -1.9366 -1.9366 -1.6189 -1.6189 -1.6119 -1.6119 -1.2714 -1.2714 -1.2706 -1.2706 -1.0867 -1.0867 -1.0717 -1.0717 -0.9452 -0.9452 -0.9346 -0.9346 0.3319 0.3319 0.3399 0.3399 0.5530 0.5530 0.5626 0.5626 0.7659 0.7659 0.7714 0.7714 8.1189 8.1189 8.1192 8.1192 10.4160 10.4160 10.4299 10.4299 10.8340 10.8340 10.8480 10.8480 k =-0.1111 0.1110 0.3573 ( 6540 PWs) bands (ev): -19.4146 -19.4146 -19.4145 -19.4145 -16.9983 -16.9983 -16.9960 -16.9960 -16.7034 -16.7034 -16.6979 -16.6979 -16.6733 -16.6733 -16.6675 -16.6675 -7.7237 -7.7237 -7.7233 -7.7233 -5.2577 -5.2577 -5.2532 -5.2532 -4.6660 -4.6660 -4.6581 -4.6581 -4.5410 -4.5410 -4.5355 -4.5355 -1.9475 -1.9475 -1.9438 -1.9438 -1.6293 -1.6293 -1.6220 -1.6220 -1.2780 -1.2780 -1.2770 -1.2770 -1.0863 -1.0863 -1.0716 -1.0716 -0.9315 -0.9315 -0.9213 -0.9213 0.3184 0.3184 0.3261 0.3261 0.5426 0.5426 0.5521 0.5521 0.7736 0.7736 0.7789 0.7789 8.1498 8.1498 8.1502 8.1502 10.3979 10.3979 10.4116 10.4116 10.8518 10.8518 10.8657 10.8657 k =-0.1222 0.1221 0.3573 ( 6546 PWs) bands (ev): -19.4116 -19.4116 -19.4114 -19.4114 -17.0012 -17.0012 -16.9986 -16.9986 -16.7067 -16.7067 -16.7013 -16.7013 -16.6737 -16.6737 -16.6679 -16.6679 -7.7087 -7.7087 -7.7083 -7.7083 -5.2620 -5.2620 -5.2572 -5.2572 -4.6625 -4.6625 -4.6545 -4.6545 -4.5380 -4.5380 -4.5325 -4.5325 -1.9563 -1.9563 -1.9523 -1.9523 -1.6388 -1.6388 -1.6311 -1.6311 -1.2855 -1.2855 -1.2842 -1.2842 -1.0854 -1.0854 -1.0711 -1.0711 -0.9182 -0.9182 -0.9082 -0.9082 0.3041 0.3041 0.3116 0.3116 0.5318 0.5318 0.5411 0.5411 0.7811 0.7811 0.7862 0.7862 8.1838 8.1838 8.1843 8.1843 10.3803 10.3803 10.3937 10.3937 10.8691 10.8691 10.8830 10.8830 k =-0.1333 0.1333 0.3573 ( 6546 PWs) bands (ev): -19.4083 -19.4083 -19.4081 -19.4081 -17.0042 -17.0042 -17.0015 -17.0015 -16.7103 -16.7103 -16.7048 -16.7048 -16.6742 -16.6742 -16.6684 -16.6684 -7.6925 -7.6925 -7.6920 -7.6920 -5.2673 -5.2673 -5.2622 -5.2622 -4.6583 -4.6583 -4.6502 -4.6502 -4.5346 -4.5346 -4.5291 -4.5291 -1.9662 -1.9662 -1.9620 -1.9620 -1.6471 -1.6471 -1.6392 -1.6392 -1.2939 -1.2939 -1.2923 -1.2923 -1.0842 -1.0842 -1.0702 -1.0702 -0.9052 -0.9052 -0.8956 -0.8956 0.2893 0.2893 0.2965 0.2965 0.5208 0.5208 0.5298 0.5298 0.7883 0.7883 0.7932 0.7932 8.2209 8.2209 8.2214 8.2214 10.3633 10.3633 10.3764 10.3764 10.8857 10.8857 10.8994 10.8994 k =-0.1444 0.1444 0.3573 ( 6550 PWs) bands (ev): -19.4047 -19.4047 -19.4046 -19.4046 -17.0076 -17.0076 -17.0046 -17.0046 -16.7139 -16.7139 -16.7085 -16.7085 -16.6748 -16.6748 -16.6690 -16.6690 -7.6749 -7.6749 -7.6745 -7.6745 -5.2738 -5.2738 -5.2684 -5.2684 -4.6534 -4.6534 -4.6452 -4.6452 -4.5308 -4.5308 -4.5253 -4.5253 -1.9773 -1.9773 -1.9729 -1.9729 -1.6542 -1.6542 -1.6461 -1.6461 -1.3032 -1.3032 -1.3012 -1.3012 -1.0826 -1.0826 -1.0689 -1.0689 -0.8929 -0.8929 -0.8835 -0.8835 0.2740 0.2740 0.2810 0.2810 0.5095 0.5095 0.5182 0.5182 0.7950 0.7950 0.7997 0.7997 8.2610 8.2610 8.2615 8.2615 10.3469 10.3469 10.3597 10.3597 10.9013 10.9013 10.9148 10.9148 k =-0.1556 0.1555 0.3573 ( 6534 PWs) bands (ev): -19.4010 -19.4010 -19.4008 -19.4008 -17.0111 -17.0111 -17.0080 -17.0080 -16.7177 -16.7177 -16.7123 -16.7123 -16.6755 -16.6755 -16.6697 -16.6697 -7.6561 -7.6561 -7.6557 -7.6557 -5.2815 -5.2815 -5.2759 -5.2759 -4.6476 -4.6476 -4.6394 -4.6394 -4.5265 -4.5265 -4.5211 -4.5211 -1.9892 -1.9892 -1.9847 -1.9847 -1.6600 -1.6600 -1.6519 -1.6519 -1.3133 -1.3133 -1.3111 -1.3111 -1.0807 -1.0807 -1.0674 -1.0674 -0.8813 -0.8813 -0.8721 -0.8721 0.2585 0.2585 0.2653 0.2653 0.4980 0.4980 0.5065 0.5065 0.8012 0.8012 0.8058 0.8058 8.3040 8.3040 8.3046 8.3046 10.3313 10.3313 10.3438 10.3438 10.9155 10.9155 10.9288 10.9288 k =-0.1667 0.1666 0.3573 ( 6534 PWs) bands (ev): -19.3971 -19.3971 -19.3969 -19.3969 -17.0148 -17.0148 -17.0115 -17.0115 -16.7216 -16.7216 -16.7162 -16.7162 -16.6762 -16.6762 -16.6704 -16.6704 -7.6361 -7.6361 -7.6357 -7.6357 -5.2906 -5.2906 -5.2849 -5.2849 -4.6409 -4.6409 -4.6328 -4.6328 -4.5218 -4.5218 -4.5164 -4.5164 -2.0020 -2.0020 -1.9974 -1.9974 -1.6646 -1.6646 -1.6565 -1.6565 -1.3244 -1.3244 -1.3217 -1.3217 -1.0786 -1.0786 -1.0656 -1.0656 -0.8705 -0.8705 -0.8614 -0.8614 0.2428 0.2428 0.2495 0.2495 0.4865 0.4865 0.4947 0.4947 0.8067 0.8067 0.8112 0.8112 8.3498 8.3498 8.3505 8.3505 10.3165 10.3165 10.3288 10.3288 10.9280 10.9280 10.9409 10.9409 k =-0.1778 0.1777 0.3573 ( 6542 PWs) bands (ev): -19.3929 -19.3929 -19.3927 -19.3927 -17.0186 -17.0186 -17.0152 -17.0152 -16.7256 -16.7256 -16.7202 -16.7202 -16.6771 -16.6771 -16.6713 -16.6713 -7.6150 -7.6150 -7.6145 -7.6145 -5.3012 -5.3012 -5.2953 -5.2953 -4.6333 -4.6333 -4.6254 -4.6254 -4.5167 -4.5167 -4.5114 -4.5114 -2.0152 -2.0152 -2.0106 -2.0106 -1.6682 -1.6682 -1.6601 -1.6601 -1.3362 -1.3362 -1.3332 -1.3332 -1.0763 -1.0763 -1.0636 -1.0636 -0.8606 -0.8606 -0.8516 -0.8516 0.2273 0.2273 0.2338 0.2338 0.4749 0.4749 0.4829 0.4829 0.8116 0.8116 0.8159 0.8159 8.3985 8.3985 8.3993 8.3993 10.3027 10.3027 10.3146 10.3146 10.9383 10.9383 10.9507 10.9507 k =-0.1889 0.1888 0.3573 ( 6546 PWs) bands (ev): -19.3887 -19.3887 -19.3885 -19.3885 -17.0227 -17.0227 -17.0191 -17.0191 -16.7297 -16.7297 -16.7243 -16.7243 -16.6780 -16.6780 -16.6722 -16.6722 -7.5926 -7.5926 -7.5922 -7.5922 -5.3133 -5.3133 -5.3073 -5.3073 -4.6248 -4.6248 -4.6170 -4.6170 -4.5112 -4.5112 -4.5059 -4.5059 -2.0288 -2.0288 -2.0242 -2.0242 -1.6708 -1.6708 -1.6629 -1.6629 -1.3490 -1.3490 -1.3456 -1.3456 -1.0739 -1.0739 -1.0616 -1.0616 -0.8516 -0.8516 -0.8427 -0.8427 0.2120 0.2120 0.2184 0.2184 0.4634 0.4634 0.4712 0.4712 0.8157 0.8157 0.8198 0.8198 8.4499 8.4499 8.4507 8.4507 10.2897 10.2897 10.3014 10.3014 10.9463 10.9463 10.9580 10.9580 k =-0.2000 0.1999 0.3573 ( 6546 PWs) bands (ev): -19.3843 -19.3843 -19.3840 -19.3840 -17.0269 -17.0269 -17.0231 -17.0231 -16.7338 -16.7338 -16.7285 -16.7285 -16.6789 -16.6789 -16.6732 -16.6732 -7.5693 -7.5693 -7.5687 -7.5687 -5.3270 -5.3270 -5.3209 -5.3209 -4.6153 -4.6153 -4.6078 -4.6078 -4.5053 -4.5053 -4.5000 -4.5000 -2.0424 -2.0424 -2.0378 -2.0378 -1.6727 -1.6727 -1.6650 -1.6650 -1.3625 -1.3625 -1.3587 -1.3587 -1.0715 -1.0715 -1.0595 -1.0595 -0.8436 -0.8436 -0.8348 -0.8348 0.1971 0.1971 0.2035 0.2035 0.4520 0.4520 0.4596 0.4596 0.8190 0.8190 0.8230 0.8230 8.5039 8.5039 8.5048 8.5048 10.2778 10.2778 10.2891 10.2891 10.9517 10.9517 10.9625 10.9625 k =-0.2111 0.2110 0.3573 ( 6542 PWs) bands (ev): -19.3797 -19.3797 -19.3795 -19.3795 -17.0312 -17.0312 -17.0273 -17.0273 -16.7380 -16.7380 -16.7327 -16.7327 -16.6799 -16.6799 -16.6742 -16.6742 -7.5448 -7.5448 -7.5443 -7.5443 -5.3423 -5.3423 -5.3362 -5.3362 -4.6050 -4.6050 -4.5977 -4.5977 -4.4990 -4.4990 -4.4937 -4.4937 -2.0558 -2.0558 -2.0513 -2.0513 -1.6740 -1.6740 -1.6665 -1.6665 -1.3769 -1.3769 -1.3726 -1.3726 -1.0691 -1.0691 -1.0574 -1.0574 -0.8366 -0.8366 -0.8278 -0.8278 0.1828 0.1828 0.1892 0.1892 0.4409 0.4409 0.4483 0.4483 0.8213 0.8213 0.8252 0.8252 8.5605 8.5605 8.5615 8.5615 10.2668 10.2668 10.2779 10.2779 10.9545 10.9545 10.9643 10.9643 k =-0.2222 0.2221 0.3573 ( 6548 PWs) bands (ev): -19.3751 -19.3751 -19.3748 -19.3748 -17.0357 -17.0357 -17.0317 -17.0317 -16.7422 -16.7422 -16.7370 -16.7370 -16.6809 -16.6809 -16.6752 -16.6752 -7.5194 -7.5194 -7.5188 -7.5188 -5.3593 -5.3593 -5.3532 -5.3532 -4.5938 -4.5938 -4.5868 -4.5868 -4.4923 -4.4923 -4.4870 -4.4870 -2.0688 -2.0688 -2.0644 -2.0644 -1.6749 -1.6749 -1.6676 -1.6676 -1.3920 -1.3920 -1.3873 -1.3873 -1.0668 -1.0668 -1.0555 -1.0555 -0.8306 -0.8306 -0.8219 -0.8219 0.1693 0.1693 0.1758 0.1758 0.4300 0.4300 0.4373 0.4373 0.8227 0.8227 0.8265 0.8265 8.6195 8.6195 8.6205 8.6205 10.2569 10.2569 10.2676 10.2676 10.9552 10.9552 10.9637 10.9637 k =-0.2333 0.2332 0.3573 ( 6550 PWs) bands (ev): -19.3704 -19.3704 -19.3701 -19.3701 -17.0402 -17.0402 -17.0361 -17.0361 -16.7463 -16.7463 -16.7412 -16.7412 -16.6820 -16.6820 -16.6763 -16.6763 -7.4930 -7.4930 -7.4925 -7.4925 -5.3778 -5.3778 -5.3718 -5.3718 -4.5817 -4.5817 -4.5751 -4.5751 -4.4852 -4.4852 -4.4799 -4.4799 -2.0812 -2.0812 -2.0769 -2.0769 -1.6755 -1.6755 -1.6685 -1.6685 -1.4078 -1.4078 -1.4027 -1.4027 -1.0648 -1.0648 -1.0538 -1.0538 -0.8257 -0.8257 -0.8170 -0.8170 0.1568 0.1568 0.1633 0.1633 0.4195 0.4195 0.4267 0.4267 0.8231 0.8231 0.8268 0.8268 8.6808 8.6808 8.6819 8.6819 10.2480 10.2480 10.2583 10.2583 10.9541 10.9541 10.9613 10.9613 k =-0.2444 0.2443 0.3573 ( 6546 PWs) bands (ev): -19.3656 -19.3656 -19.3653 -19.3653 -17.0448 -17.0448 -17.0406 -17.0406 -16.7505 -16.7505 -16.7454 -16.7454 -16.6831 -16.6831 -16.6774 -16.6774 -7.4658 -7.4658 -7.4652 -7.4652 -5.3979 -5.3979 -5.3919 -5.3919 -4.5691 -4.5691 -4.5628 -4.5628 -4.4776 -4.4776 -4.4723 -4.4723 -2.0929 -2.0929 -2.0886 -2.0886 -1.6760 -1.6760 -1.6693 -1.6693 -1.4242 -1.4242 -1.4187 -1.4187 -1.0631 -1.0631 -1.0524 -1.0524 -0.8217 -0.8217 -0.8131 -0.8131 0.1454 0.1454 0.1521 0.1521 0.4094 0.4094 0.4165 0.4165 0.8225 0.8225 0.8261 0.8261 8.7443 8.7443 8.7455 8.7455 10.2401 10.2401 10.2501 10.2501 10.9519 10.9519 10.9577 10.9577 k =-0.2556 0.2554 0.3573 ( 6542 PWs) bands (ev): -19.3608 -19.3608 -19.3605 -19.3605 -17.0495 -17.0495 -17.0452 -17.0452 -16.7546 -16.7546 -16.7497 -16.7497 -16.6842 -16.6842 -16.6786 -16.6786 -7.4378 -7.4378 -7.4372 -7.4372 -5.4196 -5.4196 -5.4136 -5.4136 -4.5558 -4.5558 -4.5500 -4.5500 -4.4697 -4.4697 -4.4643 -4.4643 -2.1037 -2.1037 -2.0995 -2.0995 -1.6765 -1.6765 -1.6701 -1.6701 -1.4411 -1.4411 -1.4352 -1.4352 -1.0620 -1.0620 -1.0516 -1.0516 -0.8187 -0.8187 -0.8101 -0.8101 0.1354 0.1354 0.1421 0.1421 0.3998 0.3998 0.4068 0.4068 0.8208 0.8208 0.8243 0.8243 8.8098 8.8098 8.8111 8.8111 10.2332 10.2332 10.2429 10.2429 10.9491 10.9491 10.9537 10.9537 k =-0.2667 0.2665 0.3573 ( 6538 PWs) bands (ev): -19.3560 -19.3560 -19.3557 -19.3557 -17.0542 -17.0542 -17.0498 -17.0498 -16.7586 -16.7586 -16.7538 -16.7538 -16.6853 -16.6853 -16.6797 -16.6797 -7.4090 -7.4090 -7.4084 -7.4084 -5.4426 -5.4426 -5.4367 -5.4367 -4.5422 -4.5422 -4.5368 -4.5368 -4.4614 -4.4614 -4.4559 -4.4559 -2.1134 -2.1134 -2.1093 -2.1093 -1.6772 -1.6772 -1.6711 -1.6711 -1.4584 -1.4584 -1.4520 -1.4520 -1.0615 -1.0615 -1.0514 -1.0514 -0.8166 -0.8166 -0.8080 -0.8080 0.1267 0.1267 0.1336 0.1336 0.3908 0.3908 0.3978 0.3978 0.8180 0.8180 0.8215 0.8215 8.8773 8.8773 8.8786 8.8786 10.2273 10.2273 10.2367 10.2367 10.9463 10.9463 10.9497 10.9497 k =-0.2778 0.2776 0.3573 ( 6528 PWs) bands (ev): -19.3511 -19.3511 -19.3508 -19.3508 -17.0589 -17.0589 -17.0545 -17.0545 -16.7626 -16.7626 -16.7579 -16.7579 -16.6865 -16.6865 -16.6809 -16.6809 -7.3796 -7.3796 -7.3789 -7.3789 -5.4670 -5.4670 -5.4611 -5.4611 -4.5284 -4.5284 -4.5233 -4.5233 -4.4526 -4.4526 -4.4470 -4.4470 -2.1220 -2.1220 -2.1179 -2.1179 -1.6784 -1.6784 -1.6726 -1.6726 -1.4759 -1.4759 -1.4691 -1.4691 -1.0617 -1.0617 -1.0519 -1.0519 -0.8152 -0.8152 -0.8066 -0.8066 0.1196 0.1196 0.1267 0.1267 0.3823 0.3823 0.3894 0.3894 0.8140 0.8140 0.8175 0.8175 8.9464 8.9464 8.9478 8.9478 10.2225 10.2225 10.2315 10.2315 10.9438 10.9438 10.9463 10.9463 k =-0.2889 0.2887 0.3573 ( 6526 PWs) bands (ev): -19.3464 -19.3464 -19.3460 -19.3460 -17.0636 -17.0636 -17.0591 -17.0591 -16.7665 -16.7665 -16.7619 -16.7619 -16.6876 -16.6876 -16.6820 -16.6820 -7.3497 -7.3497 -7.3489 -7.3489 -5.4925 -5.4925 -5.4867 -5.4867 -4.5146 -4.5146 -4.5099 -4.5099 -4.4433 -4.4433 -4.4375 -4.4375 -2.1294 -2.1294 -2.1254 -2.1254 -1.6802 -1.6802 -1.6746 -1.6746 -1.4933 -1.4933 -1.4861 -1.4861 -1.0629 -1.0629 -1.0534 -1.0534 -0.8144 -0.8144 -0.8058 -0.8058 0.1140 0.1140 0.1214 0.1214 0.3746 0.3746 0.3817 0.3817 0.8090 0.8090 0.8124 0.8124 9.0170 9.0170 9.0185 9.0185 10.2187 10.2187 10.2274 10.2274 10.9416 10.9416 10.9438 10.9438 k =-0.3000 0.2998 0.3573 ( 6524 PWs) bands (ev): -19.3417 -19.3417 -19.3413 -19.3413 -17.0683 -17.0683 -17.0638 -17.0638 -16.7702 -16.7702 -16.7658 -16.7658 -16.6887 -16.6887 -16.6831 -16.6831 -7.3192 -7.3192 -7.3184 -7.3184 -5.5192 -5.5192 -5.5134 -5.5134 -4.5010 -4.5010 -4.4967 -4.4967 -4.4334 -4.4334 -4.4275 -4.4275 -2.1355 -2.1355 -2.1315 -2.1315 -1.6829 -1.6829 -1.6776 -1.6776 -1.5103 -1.5103 -1.5028 -1.5028 -1.0652 -1.0652 -1.0559 -1.0559 -0.8140 -0.8140 -0.8056 -0.8056 0.1101 0.1101 0.1177 0.1177 0.3676 0.3676 0.3748 0.3748 0.8028 0.8028 0.8061 0.8061 9.0889 9.0889 9.0904 9.0904 10.2160 10.2160 10.2243 10.2243 10.9399 10.9399 10.9424 10.9424 k =-0.3111 0.3109 0.3573 ( 6518 PWs) bands (ev): -19.3370 -19.3370 -19.3367 -19.3367 -17.0729 -17.0729 -17.0683 -17.0683 -16.7739 -16.7739 -16.7696 -16.7696 -16.6898 -16.6898 -16.6843 -16.6843 -7.2884 -7.2884 -7.2876 -7.2876 -5.5467 -5.5467 -5.5411 -5.5411 -4.4879 -4.4879 -4.4840 -4.4840 -4.4229 -4.4229 -4.4169 -4.4169 -2.1402 -2.1402 -2.1362 -2.1362 -1.6869 -1.6869 -1.6819 -1.6819 -1.5263 -1.5263 -1.5187 -1.5187 -1.0687 -1.0687 -1.0596 -1.0596 -0.8140 -0.8140 -0.8056 -0.8056 0.1078 0.1078 0.1157 0.1157 0.3614 0.3614 0.3687 0.3687 0.7956 0.7956 0.7988 0.7988 9.1618 9.1618 9.1634 9.1634 10.2144 10.2144 10.2225 10.2225 10.9385 10.9385 10.9418 10.9418 k =-0.3222 0.3220 0.3573 ( 6516 PWs) bands (ev): -19.3325 -19.3325 -19.3321 -19.3321 -17.0774 -17.0774 -17.0728 -17.0728 -16.7774 -16.7774 -16.7733 -16.7733 -16.6908 -16.6908 -16.6853 -16.6853 -7.2574 -7.2574 -7.2565 -7.2565 -5.5751 -5.5751 -5.5695 -5.5695 -4.4754 -4.4754 -4.4718 -4.4718 -4.4118 -4.4118 -4.4057 -4.4057 -2.1435 -2.1435 -2.1395 -2.1395 -1.6926 -1.6926 -1.6879 -1.6879 -1.5410 -1.5410 -1.5334 -1.5334 -1.0735 -1.0735 -1.0645 -1.0645 -0.8141 -0.8141 -0.8059 -0.8059 0.1070 0.1070 0.1152 0.1152 0.3560 0.3560 0.3635 0.3635 0.7872 0.7872 0.7904 0.7904 9.2353 9.2353 9.2370 9.2370 10.2141 10.2141 10.2219 10.2219 10.9374 10.9374 10.9415 10.9415 k =-0.3333 0.3331 0.3573 ( 6518 PWs) bands (ev): -19.3281 -19.3281 -19.3277 -19.3277 -17.0818 -17.0818 -17.0772 -17.0772 -16.7807 -16.7807 -16.7768 -16.7768 -16.6919 -16.6919 -16.6864 -16.6864 -7.2262 -7.2262 -7.2253 -7.2253 -5.6040 -5.6040 -5.5984 -5.5984 -4.4638 -4.4638 -4.4605 -4.4605 -4.3999 -4.3999 -4.3939 -4.3939 -2.1454 -2.1454 -2.1414 -2.1414 -1.7004 -1.7004 -1.6961 -1.6961 -1.5537 -1.5537 -1.5463 -1.5463 -1.0796 -1.0796 -1.0707 -1.0707 -0.8143 -0.8143 -0.8062 -0.8062 0.1078 0.1078 0.1162 0.1162 0.3516 0.3516 0.3593 0.3593 0.7779 0.7779 0.7810 0.7810 9.3091 9.3091 9.3108 9.3108 10.2153 10.2153 10.2227 10.2227 10.9361 10.9361 10.9410 10.9410 k =-0.3444 0.3442 0.3573 ( 6510 PWs) bands (ev): -19.3238 -19.3238 -19.3235 -19.3235 -17.0861 -17.0861 -17.0815 -17.0815 -16.7839 -16.7839 -16.7802 -16.7802 -16.6928 -16.6928 -16.6874 -16.6874 -7.1951 -7.1951 -7.1941 -7.1941 -5.6333 -5.6333 -5.6278 -5.6278 -4.4531 -4.4531 -4.4500 -4.4500 -4.3876 -4.3876 -4.3817 -4.3817 -2.1458 -2.1458 -2.1419 -2.1419 -1.7108 -1.7108 -1.7067 -1.7067 -1.5639 -1.5639 -1.5571 -1.5571 -1.0869 -1.0869 -1.0781 -1.0781 -0.8144 -0.8144 -0.8065 -0.8065 0.1098 0.1098 0.1185 0.1185 0.3482 0.3482 0.3561 0.3561 0.7675 0.7675 0.7706 0.7706 9.3826 9.3826 9.3844 9.3844 10.2181 10.2181 10.2253 10.2253 10.9340 10.9340 10.9396 10.9396 k =-0.3556 0.3553 0.3573 ( 6518 PWs) bands (ev): -19.3198 -19.3198 -19.3194 -19.3194 -17.0902 -17.0902 -17.0856 -17.0856 -16.7869 -16.7869 -16.7834 -16.7834 -16.6938 -16.6938 -16.6884 -16.6884 -7.1642 -7.1642 -7.1631 -7.1631 -5.6628 -5.6628 -5.6573 -5.6573 -4.4432 -4.4432 -4.4404 -4.4404 -4.3748 -4.3748 -4.3691 -4.3691 -2.1448 -2.1448 -2.1408 -2.1408 -1.7238 -1.7238 -1.7198 -1.7198 -1.5716 -1.5716 -1.5655 -1.5655 -1.0955 -1.0955 -1.0867 -1.0867 -0.8143 -0.8143 -0.8067 -0.8067 0.1130 0.1130 0.1219 0.1219 0.3458 0.3458 0.3540 0.3540 0.7562 0.7562 0.7592 0.7592 9.4553 9.4553 9.4572 9.4572 10.2230 10.2230 10.2300 10.2300 10.9306 10.9306 10.9365 10.9365 k =-0.3667 0.3664 0.3573 ( 6518 PWs) bands (ev): -19.3159 -19.3159 -19.3155 -19.3155 -17.0941 -17.0941 -17.0895 -17.0895 -16.7897 -16.7897 -16.7864 -16.7864 -16.6947 -16.6947 -16.6893 -16.6893 -7.1336 -7.1336 -7.1324 -7.1324 -5.6923 -5.6923 -5.6868 -5.6868 -4.4343 -4.4343 -4.4317 -4.4317 -4.3619 -4.3619 -4.3565 -4.3565 -2.1423 -2.1423 -2.1384 -2.1384 -1.7394 -1.7394 -1.7352 -1.7352 -1.5769 -1.5769 -1.5715 -1.5715 -1.1051 -1.1051 -1.0962 -1.0962 -0.8141 -0.8141 -0.8067 -0.8067 0.1171 0.1171 0.1262 0.1262 0.3446 0.3446 0.3530 0.3530 0.7441 0.7441 0.7471 0.7471 9.5264 9.5264 9.5284 9.5284 10.2305 10.2305 10.2372 10.2372 10.9255 10.9255 10.9314 10.9314 k =-0.3778 0.3775 0.3573 ( 6518 PWs) bands (ev): -19.3123 -19.3123 -19.3119 -19.3119 -17.0978 -17.0978 -17.0932 -17.0932 -16.7923 -16.7923 -16.7892 -16.7892 -16.6956 -16.6956 -16.6902 -16.6902 -7.1037 -7.1037 -7.1024 -7.1024 -5.7214 -5.7214 -5.7159 -5.7159 -4.4262 -4.4262 -4.4238 -4.4238 -4.3491 -4.3491 -4.3440 -4.3440 -2.1383 -2.1383 -2.1344 -2.1344 -1.7571 -1.7571 -1.7525 -1.7525 -1.5800 -1.5800 -1.5754 -1.5754 -1.1155 -1.1155 -1.1066 -1.1066 -0.8136 -0.8136 -0.8066 -0.8066 0.1220 0.1220 0.1312 0.1312 0.3447 0.3447 0.3533 0.3533 0.7312 0.7312 0.7342 0.7342 9.5949 9.5949 9.5970 9.5970 10.2411 10.2411 10.2476 10.2476 10.9187 10.9187 10.9246 10.9246 k =-0.3889 0.3887 0.3573 ( 6514 PWs) bands (ev): -19.3089 -19.3089 -19.3085 -19.3085 -17.1013 -17.1013 -17.0966 -17.0966 -16.7947 -16.7947 -16.7918 -16.7918 -16.6963 -16.6963 -16.6910 -16.6910 -7.0746 -7.0746 -7.0732 -7.0732 -5.7499 -5.7499 -5.7444 -5.7444 -4.4189 -4.4189 -4.4166 -4.4166 -4.3366 -4.3366 -4.3318 -4.3318 -2.1330 -2.1330 -2.1291 -2.1291 -1.7763 -1.7763 -1.7713 -1.7713 -1.5815 -1.5815 -1.5776 -1.5776 -1.1265 -1.1265 -1.1176 -1.1176 -0.8129 -0.8129 -0.8064 -0.8064 0.1272 0.1272 0.1365 0.1365 0.3460 0.3460 0.3548 0.3548 0.7178 0.7178 0.7207 0.7207 9.6598 9.6598 9.6620 9.6620 10.2556 10.2556 10.2620 10.2620 10.9107 10.9107 10.9165 10.9165 k =-0.4000 0.3998 0.3573 ( 6502 PWs) bands (ev): -19.3057 -19.3057 -19.3053 -19.3053 -17.1045 -17.1045 -17.0999 -17.0999 -16.7968 -16.7968 -16.7942 -16.7942 -16.6971 -16.6971 -16.6917 -16.6917 -7.0466 -7.0466 -7.0451 -7.0451 -5.7775 -5.7775 -5.7720 -5.7720 -4.4123 -4.4123 -4.4102 -4.4102 -4.3246 -4.3246 -4.3201 -4.3201 -2.1262 -2.1262 -2.1224 -2.1224 -1.7967 -1.7967 -1.7911 -1.7911 -1.5817 -1.5817 -1.5783 -1.5783 -1.1379 -1.1379 -1.1288 -1.1288 -0.8121 -0.8121 -0.8060 -0.8060 0.1327 0.1327 0.1420 0.1420 0.3486 0.3486 0.3577 0.3577 0.7039 0.7039 0.7068 0.7068 9.7196 9.7196 9.7220 9.7220 10.2751 10.2751 10.2814 10.2814 10.9017 10.9017 10.9077 10.9077 k =-0.4111 0.4109 0.3573 ( 6514 PWs) bands (ev): -19.3029 -19.3029 -19.3024 -19.3024 -17.1074 -17.1074 -17.1028 -17.1028 -16.7988 -16.7988 -16.7964 -16.7964 -16.6977 -16.6977 -16.6924 -16.6924 -7.0201 -7.0201 -7.0184 -7.0184 -5.8039 -5.8039 -5.7983 -5.7983 -4.4065 -4.4065 -4.4045 -4.4045 -4.3134 -4.3134 -4.3092 -4.3092 -2.1182 -2.1182 -2.1145 -2.1145 -1.8177 -1.8177 -1.8116 -1.8116 -1.5810 -1.5810 -1.5779 -1.5779 -1.1493 -1.1493 -1.1401 -1.1401 -0.8112 -0.8112 -0.8055 -0.8055 0.1381 0.1381 0.1473 0.1473 0.3525 0.3525 0.3617 0.3617 0.6897 0.6897 0.6926 0.6926 9.7731 9.7731 9.7757 9.7757 10.3003 10.3003 10.3065 10.3065 10.8922 10.8922 10.8984 10.8984 k =-0.4222 0.4220 0.3573 ( 6522 PWs) bands (ev): -19.3003 -19.3003 -19.2999 -19.2999 -17.1101 -17.1101 -17.1055 -17.1055 -16.8005 -16.8005 -16.7984 -16.7984 -16.6983 -16.6983 -16.6930 -16.6930 -6.9953 -6.9953 -6.9935 -6.9935 -5.8286 -5.8286 -5.8230 -5.8230 -4.4013 -4.4013 -4.3994 -4.3994 -4.3031 -4.3031 -4.2992 -4.2992 -2.1090 -2.1090 -2.1053 -2.1053 -1.8390 -1.8390 -1.8322 -1.8322 -1.5797 -1.5797 -1.5767 -1.5767 -1.1604 -1.1604 -1.1510 -1.1510 -0.8103 -0.8103 -0.8050 -0.8050 0.1432 0.1432 0.1522 0.1522 0.3576 0.3576 0.3669 0.3669 0.6755 0.6755 0.6784 0.6784 9.8191 9.8191 9.8219 9.8219 10.3320 10.3320 10.3381 10.3381 10.8823 10.8823 10.8890 10.8890 k =-0.4333 0.4331 0.3573 ( 6526 PWs) bands (ev): -19.2980 -19.2980 -19.2976 -19.2976 -17.1124 -17.1124 -17.1078 -17.1078 -16.8020 -16.8020 -16.8001 -16.8001 -16.6989 -16.6989 -16.6935 -16.6935 -6.9726 -6.9726 -6.9707 -6.9707 -5.8513 -5.8513 -5.8456 -5.8456 -4.3968 -4.3968 -4.3950 -4.3950 -4.2938 -4.2938 -4.2902 -4.2902 -2.0987 -2.0987 -2.0951 -2.0951 -1.8601 -1.8601 -1.8528 -1.8528 -1.5781 -1.5781 -1.5750 -1.5750 -1.1709 -1.1709 -1.1614 -1.1614 -0.8093 -0.8093 -0.8045 -0.8045 0.1479 0.1479 0.1566 0.1566 0.3635 0.3635 0.3729 0.3729 0.6616 0.6616 0.6646 0.6646 9.8571 9.8571 9.8601 9.8601 10.3700 10.3700 10.3761 10.3761 10.8720 10.8720 10.8792 10.8792 k =-0.4444 0.4442 0.3573 ( 6528 PWs) bands (ev): -19.2961 -19.2961 -19.2957 -19.2957 -17.1144 -17.1144 -17.1098 -17.1098 -16.8032 -16.8032 -16.8016 -16.8016 -16.6993 -16.6993 -16.6940 -16.6940 -6.9524 -6.9524 -6.9504 -6.9504 -5.8716 -5.8716 -5.8658 -5.8658 -4.3931 -4.3931 -4.3913 -4.3913 -4.2858 -4.2858 -4.2824 -4.2824 -2.0875 -2.0875 -2.0840 -2.0840 -1.8808 -1.8808 -1.8728 -1.8728 -1.5763 -1.5763 -1.5730 -1.5730 -1.1805 -1.1805 -1.1708 -1.1708 -0.8084 -0.8084 -0.8040 -0.8040 0.1520 0.1520 0.1604 0.1604 0.3701 0.3701 0.3796 0.3796 0.6483 0.6483 0.6514 0.6514 9.8870 9.8870 9.8902 9.8902 10.4135 10.4135 10.4196 10.4196 10.8608 10.8608 10.8687 10.8687 k =-0.4556 0.4553 0.3573 ( 6522 PWs) bands (ev): -19.2945 -19.2945 -19.2941 -19.2941 -17.1160 -17.1160 -17.1115 -17.1115 -16.8042 -16.8042 -16.8029 -16.8029 -16.6997 -16.6997 -16.6944 -16.6944 -6.9352 -6.9352 -6.9331 -6.9331 -5.8889 -5.8889 -5.8830 -5.8830 -4.3899 -4.3899 -4.3882 -4.3882 -4.2790 -4.2790 -4.2759 -4.2759 -2.0758 -2.0758 -2.0724 -2.0724 -1.9006 -1.9006 -1.8918 -1.8918 -1.5746 -1.5746 -1.5709 -1.5709 -1.1888 -1.1888 -1.1789 -1.1789 -0.8076 -0.8076 -0.8036 -0.8036 0.1554 0.1554 0.1635 0.1635 0.3768 0.3768 0.3865 0.3865 0.6361 0.6361 0.6393 0.6393 9.9097 9.9097 9.9130 9.9130 10.4606 10.4606 10.4667 10.4667 10.8482 10.8482 10.8566 10.8566 k =-0.4667 0.4664 0.3573 ( 6518 PWs) bands (ev): -19.2933 -19.2933 -19.2928 -19.2928 -17.1173 -17.1173 -17.1128 -17.1128 -16.8050 -16.8050 -16.8039 -16.8039 -16.7000 -16.7000 -16.6947 -16.6947 -6.9213 -6.9213 -6.9191 -6.9191 -5.9029 -5.9029 -5.8970 -5.8970 -4.3875 -4.3875 -4.3858 -4.3858 -4.2737 -4.2737 -4.2707 -4.2707 -2.0640 -2.0640 -2.0607 -2.0607 -1.9189 -1.9189 -1.9092 -1.9092 -1.5731 -1.5731 -1.5691 -1.5691 -1.1957 -1.1957 -1.1856 -1.1856 -0.8069 -0.8069 -0.8033 -0.8033 0.1580 0.1580 0.1659 0.1659 0.3831 0.3831 0.3929 0.3929 0.6256 0.6256 0.6290 0.6290 9.9260 9.9260 9.9293 9.9293 10.5085 10.5085 10.5146 10.5146 10.8333 10.8333 10.8417 10.8417 k =-0.4778 0.4775 0.3573 ( 6520 PWs) bands (ev): -19.2924 -19.2924 -19.2919 -19.2919 -17.1182 -17.1182 -17.1137 -17.1137 -16.8055 -16.8055 -16.8046 -16.8046 -16.7002 -16.7002 -16.6949 -16.6949 -6.9111 -6.9111 -6.9088 -6.9088 -5.9132 -5.9132 -5.9073 -5.9073 -4.3858 -4.3858 -4.3841 -4.3841 -4.2698 -4.2698 -4.2669 -4.2669 -2.0534 -2.0534 -2.0498 -2.0498 -1.9346 -1.9346 -1.9238 -1.9238 -1.5719 -1.5719 -1.5676 -1.5676 -1.2008 -1.2008 -1.1905 -1.1905 -0.8063 -0.8063 -0.8030 -0.8030 0.1600 0.1600 0.1676 0.1676 0.3882 0.3882 0.3982 0.3982 0.6174 0.6174 0.6210 0.6210 9.9368 9.9368 9.9402 9.9402 10.5530 10.5530 10.5592 10.5592 10.8162 10.8162 10.8235 10.8235 k =-0.4889 0.4886 0.3573 ( 6512 PWs) bands (ev): -19.2918 -19.2918 -19.2914 -19.2914 -17.1188 -17.1188 -17.1143 -17.1143 -16.8058 -16.8058 -16.8050 -16.8050 -16.7003 -16.7003 -16.6950 -16.6950 -6.9048 -6.9048 -6.9025 -6.9025 -5.9195 -5.9195 -5.9135 -5.9135 -4.3848 -4.3848 -4.3831 -4.3831 -4.2675 -4.2675 -4.2647 -4.2647 -2.0454 -2.0454 -2.0414 -2.0414 -1.9460 -1.9460 -1.9341 -1.9341 -1.5711 -1.5711 -1.5667 -1.5667 -1.2039 -1.2039 -1.1936 -1.1936 -0.8060 -0.8060 -0.8029 -0.8029 0.1611 0.1611 0.1686 0.1686 0.3917 0.3917 0.4017 0.4017 0.6121 0.6121 0.6159 0.6159 9.9430 9.9430 9.9464 9.9464 10.5875 10.5875 10.5936 10.5936 10.8003 10.8003 10.8049 10.8049 k =-0.5000 0.4997 0.3573 ( 6512 PWs) bands (ev): -19.2916 -19.2916 -19.2912 -19.2912 -17.1190 -17.1190 -17.1144 -17.1144 -16.8059 -16.8059 -16.8052 -16.8052 -16.7003 -16.7003 -16.6950 -16.6950 -6.9027 -6.9027 -6.9004 -6.9004 -5.9217 -5.9217 -5.9157 -5.9157 -4.3844 -4.3844 -4.3827 -4.3827 -4.2667 -4.2667 -4.2639 -4.2639 -2.0424 -2.0424 -2.0380 -2.0380 -1.9503 -1.9503 -1.9379 -1.9379 -1.5708 -1.5708 -1.5664 -1.5664 -1.2050 -1.2050 -1.1946 -1.1946 -0.8059 -0.8059 -0.8028 -0.8028 0.1615 0.1615 0.1690 0.1690 0.3929 0.3929 0.4030 0.4030 0.6103 0.6103 0.6141 0.6141 9.9450 9.9450 9.9485 9.9485 10.6014 10.6014 10.6073 10.6073 10.7941 10.7941 10.7954 10.7954 Writing output data file AlPO4.save init_run : 4.76s CPU 13.60s WALL ( 1 calls) electrons : 3227.87s CPU 3255.20s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.41s CPU 1.51s WALL ( 1 calls) Called by electrons: c_bands : 3227.83s CPU 3254.77s WALL ( 1 calls) v_of_rho : 0.23s CPU 0.99s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.23s CPU 0.61s WALL ( 1 calls) newd : 0.82s CPU 0.89s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.20s WALL ( 350 calls) cegterg : 3119.80s CPU 3143.65s WALL ( 1641 calls) Called by sum_band: Called by *egterg: h_psi : 1080.30s CPU 1099.73s WALL ( 32556 calls) s_psi : 141.35s CPU 141.92s WALL ( 32556 calls) g_psi : 2.59s CPU 2.51s WALL ( 30565 calls) cdiaghg : 1463.64s CPU 1458.11s WALL ( 30915 calls) cegterg:over : 226.85s CPU 217.57s WALL ( 30565 calls) cegterg:upda : 83.59s CPU 91.57s WALL ( 30565 calls) cegterg:last : 48.83s CPU 49.79s WALL ( 3250 calls) Called by h_psi: h_psi:vloc : 780.75s CPU 795.99s WALL ( 32556 calls) h_psi:vnl : 298.05s CPU 300.96s WALL ( 32556 calls) add_vuspsi : 112.77s CPU 123.09s WALL ( 32556 calls) General routines calbec : 185.15s CPU 177.63s WALL ( 32556 calls) fft : 0.61s CPU 1.49s WALL ( 19 calls) ffts : 0.00s CPU 0.01s WALL ( 4 calls) fftw : 743.07s CPU 753.02s WALL ( 2935360 calls) interpolate : 0.05s CPU 0.07s WALL ( 4 calls) davcio : 0.02s CPU 2.93s WALL ( 700 calls) Parallel routines fft_scatter : 439.74s CPU 438.78s WALL ( 2935383 calls) PWSCF : 55m22.29s CPU 59m10.15s WALL This run was terminated on: 10: 6:32 29Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=