Program PWSCF v.5.4.0 starts on 21Mar2017 at 21:47: 7 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 & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./CdCu2SnTe4.save/ file Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D renormalized file Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 135 40 11 6018 980 146 Max 136 41 12 6021 1010 149 Sum 9759 2935 813 433389 71419 10575 bravais-lattice index = 14 lattice parameter (alat) = 14.2370 a.u. unit-cell volume = 1588.6141 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 639.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.237049 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.661600 celldm(5)= -0.661600 celldm(6)= 0.323199 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.323199 0.946331 0.000000 ) a(3) = ( -0.661600 -0.473165 0.581722 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.341529 0.859517 ) b(2) = ( 0.000000 1.056713 0.859517 ) b(3) = ( 0.000000 0.000000 1.719034 ) PseudoPot. # 1 for Cd read from file: /users/gautes/Pseudo/Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1d41bce1441572f114805845d9d822b0 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1239 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sn read from file: /users/gautes/Pseudo/Sn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 9499e19b89e678f7f9f46ad7de03aa82 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1243 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 Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for Cu read from file: /users/gautes/Pseudo/Cu.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: bfb9b73be46f5385f72b338ff57911ad Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1199 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 Cd 12.00 112.41100 Cd( 1.00) Sn 14.00 118.71000 Sn( 1.00) Te 6.00 127.60000 Te( 1.00) Cu 11.00 63.54600 Cu( 1.00) 2 Sym. Ops. (no inversion) found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E s 2 inv. 180 deg rotation - cart. axis [0,0,1] -s -2 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 250 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 2) = ( 0.0000000 0.0000000 0.0238755), wk = 0.0040000 k( 3) = ( 0.0000000 0.0000000 0.0477510), wk = 0.0040000 k( 4) = ( 0.0000000 0.0000000 0.0716264), wk = 0.0040000 k( 5) = ( 0.0000000 0.0000000 0.0955019), wk = 0.0040000 k( 6) = ( 0.0000000 0.0000000 0.1193774), wk = 0.0040000 k( 7) = ( 0.0000000 0.0000000 0.1432529), wk = 0.0040000 k( 8) = ( 0.0000000 0.0000000 0.1671283), wk = 0.0040000 k( 9) = ( 0.0000000 0.0000000 0.1910038), wk = 0.0040000 k( 10) = ( 0.0000000 0.0000000 0.2148793), wk = 0.0040000 k( 11) = ( 0.0000000 0.0000000 0.2387548), wk = 0.0040000 k( 12) = ( 0.0000000 0.0000000 0.2626303), wk = 0.0040000 k( 13) = ( 0.0000000 0.0000000 0.2865057), wk = 0.0040000 k( 14) = ( 0.0000000 0.0000000 0.3103812), wk = 0.0040000 k( 15) = ( 0.0000000 0.0000000 0.3342567), wk = 0.0040000 k( 16) = ( 0.0000000 0.0000000 0.3581322), wk = 0.0040000 k( 17) = ( 0.0000000 0.0000000 0.3820076), wk = 0.0040000 k( 18) = ( 0.0000000 0.0000000 0.4058831), wk = 0.0040000 k( 19) = ( 0.0000000 0.0000000 0.4297586), wk = 0.0040000 k( 20) = ( 0.0000000 0.0000000 0.4536341), wk = 0.0040000 k( 21) = ( 0.0000000 0.0000000 0.4775096), wk = 0.0040000 k( 22) = ( 0.0000000 0.0000000 0.5013850), wk = 0.0040000 k( 23) = ( 0.0000000 0.0000000 0.5252605), wk = 0.0040000 k( 24) = ( 0.0000000 0.0000000 0.5491360), wk = 0.0040000 k( 25) = ( 0.0000000 0.0000000 0.5730115), wk = 0.0040000 k( 26) = ( 0.0000000 0.0000000 0.5968869), wk = 0.0040000 k( 27) = ( 0.0000000 0.0000000 0.6207624), wk = 0.0040000 k( 28) = ( 0.0000000 0.0000000 0.6446379), wk = 0.0040000 k( 29) = ( 0.0000000 0.0000000 0.6685134), wk = 0.0040000 k( 30) = ( 0.0000000 0.0000000 0.6923889), wk = 0.0040000 k( 31) = ( 0.0000000 0.0000000 0.7162643), wk = 0.0040000 k( 32) = ( 0.0000000 0.0000000 0.7401398), wk = 0.0040000 k( 33) = ( 0.0000000 0.0000000 0.7640153), wk = 0.0040000 k( 34) = ( 0.0000000 0.0000000 0.7878908), wk = 0.0040000 k( 35) = ( 0.0000000 0.0000000 0.8117662), wk = 0.0040000 k( 36) = ( 0.0000000 0.0000000 0.8356417), wk = 0.0040000 k( 37) = ( 0.0000000 0.0000000 0.8595172), wk = 0.0040000 k( 38) = ( 0.0000000 0.0000000 0.8595172), wk = 0.0040000 k( 39) = ( -0.0127872 0.0178796 0.8595172), wk = 0.0040000 k( 40) = ( -0.0255744 0.0357592 0.8595172), wk = 0.0040000 k( 41) = ( -0.0383616 0.0536388 0.8595172), wk = 0.0040000 k( 42) = ( -0.0511488 0.0715184 0.8595172), wk = 0.0040000 k( 43) = ( -0.0639360 0.0893980 0.8595172), wk = 0.0040000 k( 44) = ( -0.0767232 0.1072776 0.8595172), wk = 0.0040000 k( 45) = ( -0.0895104 0.1251572 0.8595172), wk = 0.0040000 k( 46) = ( -0.1022976 0.1430368 0.8595172), wk = 0.0040000 k( 47) = ( -0.1150849 0.1609164 0.8595172), wk = 0.0040000 k( 48) = ( -0.1278720 0.1787960 0.8595172), wk = 0.0040000 k( 49) = ( -0.1278720 0.1787960 0.8595172), wk = 0.0040000 k( 50) = ( -0.1376649 0.1924888 0.8426830), wk = 0.0040000 k( 51) = ( -0.1474577 0.2061815 0.8258487), wk = 0.0040000 k( 52) = ( -0.1572506 0.2198743 0.8090145), wk = 0.0040000 k( 53) = ( -0.1670434 0.2335670 0.7921803), wk = 0.0040000 k( 54) = ( -0.1768363 0.2472598 0.7753461), wk = 0.0040000 k( 55) = ( -0.1866291 0.2609525 0.7585118), wk = 0.0040000 k( 56) = ( -0.1964219 0.2746453 0.7416776), wk = 0.0040000 k( 57) = ( -0.2062148 0.2883381 0.7248433), wk = 0.0040000 k( 58) = ( -0.2160076 0.3020308 0.7080091), wk = 0.0040000 k( 59) = ( -0.2258005 0.3157236 0.6911749), wk = 0.0040000 k( 60) = ( -0.2355933 0.3294163 0.6743407), wk = 0.0040000 k( 61) = ( -0.2453861 0.3431091 0.6575064), wk = 0.0040000 k( 62) = ( -0.2551790 0.3568018 0.6406722), wk = 0.0040000 k( 63) = ( -0.2649718 0.3704946 0.6238380), wk = 0.0040000 k( 64) = ( -0.2747647 0.3841873 0.6070037), wk = 0.0040000 k( 65) = ( -0.2845575 0.3978801 0.5901695), wk = 0.0040000 k( 66) = ( -0.2943503 0.4115729 0.5733353), wk = 0.0040000 k( 67) = ( -0.3041432 0.4252656 0.5565011), wk = 0.0040000 k( 68) = ( -0.3139360 0.4389584 0.5396668), wk = 0.0040000 k( 69) = ( -0.3139360 0.4389584 0.5396668), wk = 0.0040000 k( 70) = ( -0.3041255 0.4252409 0.5228022), wk = 0.0040000 k( 71) = ( -0.2943150 0.4115235 0.5059377), wk = 0.0040000 k( 72) = ( -0.2845045 0.3978060 0.4890731), wk = 0.0040000 k( 73) = ( -0.2746940 0.3840886 0.4722085), wk = 0.0040000 k( 74) = ( -0.2648835 0.3703711 0.4553439), wk = 0.0040000 k( 75) = ( -0.2550730 0.3566537 0.4384793), wk = 0.0040000 k( 76) = ( -0.2452625 0.3429362 0.4216147), wk = 0.0040000 k( 77) = ( -0.2354520 0.3292188 0.4047501), wk = 0.0040000 k( 78) = ( -0.2256415 0.3155013 0.3878855), wk = 0.0040000 k( 79) = ( -0.2158310 0.3017839 0.3710209), wk = 0.0040000 k( 80) = ( -0.2060205 0.2880664 0.3541564), wk = 0.0040000 k( 81) = ( -0.1962100 0.2743490 0.3372918), wk = 0.0040000 k( 82) = ( -0.1863995 0.2606315 0.3204272), wk = 0.0040000 k( 83) = ( -0.1765890 0.2469141 0.3035626), wk = 0.0040000 k( 84) = ( -0.1667785 0.2331966 0.2866980), wk = 0.0040000 k( 85) = ( -0.1569680 0.2194792 0.2698334), wk = 0.0040000 k( 86) = ( -0.1471575 0.2057617 0.2529688), wk = 0.0040000 k( 87) = ( -0.1373470 0.1920443 0.2361042), wk = 0.0040000 k( 88) = ( -0.1275365 0.1783268 0.2192396), wk = 0.0040000 k( 89) = ( -0.1177260 0.1646094 0.2023751), wk = 0.0040000 k( 90) = ( -0.1079155 0.1508919 0.1855105), wk = 0.0040000 k( 91) = ( -0.0981050 0.1371745 0.1686459), wk = 0.0040000 k( 92) = ( -0.0882945 0.1234570 0.1517813), wk = 0.0040000 k( 93) = ( -0.0784840 0.1097396 0.1349167), wk = 0.0040000 k( 94) = ( -0.0686735 0.0960222 0.1180521), wk = 0.0040000 k( 95) = ( -0.0588630 0.0823047 0.1011875), wk = 0.0040000 k( 96) = ( -0.0490525 0.0685872 0.0843229), wk = 0.0040000 k( 97) = ( -0.0392420 0.0548698 0.0674583), wk = 0.0040000 k( 98) = ( -0.0294315 0.0411523 0.0505938), wk = 0.0040000 k( 99) = ( -0.0196210 0.0274349 0.0337292), wk = 0.0040000 k( 100) = ( -0.0098105 0.0137174 0.0168646), wk = 0.0040000 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 103) = ( 0.0192308 0.0137535 -0.0000000), wk = 0.0040000 k( 104) = ( 0.0384615 0.0275071 -0.0000000), wk = 0.0040000 k( 105) = ( 0.0576923 0.0412606 -0.0000000), wk = 0.0040000 k( 106) = ( 0.0769231 0.0550142 -0.0000000), wk = 0.0040000 k( 107) = ( 0.0961538 0.0687677 -0.0000000), wk = 0.0040000 k( 108) = ( 0.1153846 0.0825212 -0.0000000), wk = 0.0040000 k( 109) = ( 0.1346154 0.0962748 -0.0000000), wk = 0.0040000 k( 110) = ( 0.1538461 0.1100283 -0.0000000), wk = 0.0040000 k( 111) = ( 0.1730769 0.1237819 -0.0000000), wk = 0.0040000 k( 112) = ( 0.1923077 0.1375354 -0.0000000), wk = 0.0040000 k( 113) = ( 0.2115385 0.1512889 -0.0000000), wk = 0.0040000 k( 114) = ( 0.2307692 0.1650425 -0.0000000), wk = 0.0040000 k( 115) = ( 0.2500000 0.1787960 -0.0000000), wk = 0.0040000 k( 116) = ( 0.2692308 0.1925496 -0.0000000), wk = 0.0040000 k( 117) = ( 0.2884615 0.2063031 -0.0000000), wk = 0.0040000 k( 118) = ( 0.3076923 0.2200566 -0.0000000), wk = 0.0040000 k( 119) = ( 0.3269231 0.2338102 -0.0000000), wk = 0.0040000 k( 120) = ( 0.3461538 0.2475637 -0.0000000), wk = 0.0040000 k( 121) = ( 0.3653846 0.2613173 -0.0000000), wk = 0.0040000 k( 122) = ( 0.3846154 0.2750708 -0.0000000), wk = 0.0040000 k( 123) = ( 0.4038462 0.2888243 -0.0000000), wk = 0.0040000 k( 124) = ( 0.4230769 0.3025779 -0.0000000), wk = 0.0040000 k( 125) = ( 0.4423077 0.3163314 -0.0000000), wk = 0.0040000 k( 126) = ( 0.4615385 0.3300849 -0.0000000), wk = 0.0040000 k( 127) = ( 0.4807692 0.3438385 -0.0000000), wk = 0.0040000 k( 128) = ( 0.5000000 0.3575920 -0.0000000), wk = 0.0040000 k( 129) = ( 0.5000000 0.3575920 -0.0000000), wk = 0.0040000 k( 130) = ( 0.4902072 0.3712848 0.0168342), wk = 0.0040000 k( 131) = ( 0.4804143 0.3849775 0.0336685), wk = 0.0040000 k( 132) = ( 0.4706215 0.3986703 0.0505027), wk = 0.0040000 k( 133) = ( 0.4608286 0.4123630 0.0673369), wk = 0.0040000 k( 134) = ( 0.4510358 0.4260558 0.0841711), wk = 0.0040000 k( 135) = ( 0.4412430 0.4397486 0.1010054), wk = 0.0040000 k( 136) = ( 0.4314501 0.4534413 0.1178396), wk = 0.0040000 k( 137) = ( 0.4216573 0.4671341 0.1346738), wk = 0.0040000 k( 138) = ( 0.4118644 0.4808268 0.1515081), wk = 0.0040000 k( 139) = ( 0.4020716 0.4945196 0.1683423), wk = 0.0040000 k( 140) = ( 0.3922788 0.5082123 0.1851765), wk = 0.0040000 k( 141) = ( 0.3824859 0.5219051 0.2020108), wk = 0.0040000 k( 142) = ( 0.3726931 0.5355979 0.2188450), wk = 0.0040000 k( 143) = ( 0.3629002 0.5492906 0.2356792), wk = 0.0040000 k( 144) = ( 0.3531074 0.5629834 0.2525134), wk = 0.0040000 k( 145) = ( 0.3433145 0.5766761 0.2693477), wk = 0.0040000 k( 146) = ( 0.3335217 0.5903689 0.2861819), wk = 0.0040000 k( 147) = ( 0.3237289 0.6040616 0.3030161), wk = 0.0040000 k( 148) = ( 0.3139360 0.6177544 0.3198504), wk = 0.0040000 k( 149) = ( 0.3139360 0.6177544 0.3198504), wk = 0.0040000 k( 150) = ( 0.2930070 0.6117945 0.3271776), wk = 0.0040000 k( 151) = ( 0.2720779 0.6058347 0.3345048), wk = 0.0040000 k( 152) = ( 0.2511488 0.5998748 0.3418320), wk = 0.0040000 k( 153) = ( 0.2302198 0.5939149 0.3491592), wk = 0.0040000 k( 154) = ( 0.2092907 0.5879551 0.3564865), wk = 0.0040000 k( 155) = ( 0.1883616 0.5819952 0.3638137), wk = 0.0040000 k( 156) = ( 0.1674326 0.5760353 0.3711409), wk = 0.0040000 k( 157) = ( 0.1465035 0.5700754 0.3784681), wk = 0.0040000 k( 158) = ( 0.1255744 0.5641156 0.3857953), wk = 0.0040000 k( 159) = ( 0.1046453 0.5581557 0.3931225), wk = 0.0040000 k( 160) = ( 0.0837163 0.5521959 0.4004497), wk = 0.0040000 k( 161) = ( 0.0627872 0.5462360 0.4077769), wk = 0.0040000 k( 162) = ( 0.0418581 0.5402761 0.4151042), wk = 0.0040000 k( 163) = ( 0.0209291 0.5343162 0.4224314), wk = 0.0040000 k( 164) = ( 0.0000000 0.5283564 0.4297586), wk = 0.0040000 k( 165) = ( 0.0000000 0.5283564 0.4297586), wk = 0.0040000 k( 166) = ( 0.0096154 0.5149118 0.4462878), wk = 0.0040000 k( 167) = ( 0.0192308 0.5014671 0.4628170), wk = 0.0040000 k( 168) = ( 0.0288462 0.4880225 0.4793461), wk = 0.0040000 k( 169) = ( 0.0384615 0.4745779 0.4958753), wk = 0.0040000 k( 170) = ( 0.0480769 0.4611332 0.5124045), wk = 0.0040000 k( 171) = ( 0.0576923 0.4476886 0.5289337), wk = 0.0040000 k( 172) = ( 0.0673077 0.4342440 0.5454628), wk = 0.0040000 k( 173) = ( 0.0769231 0.4207993 0.5619920), wk = 0.0040000 k( 174) = ( 0.0865385 0.4073547 0.5785212), wk = 0.0040000 k( 175) = ( 0.0961538 0.3939101 0.5950504), wk = 0.0040000 k( 176) = ( 0.1057692 0.3804655 0.6115795), wk = 0.0040000 k( 177) = ( 0.1153846 0.3670208 0.6281087), wk = 0.0040000 k( 178) = ( 0.1250000 0.3535762 0.6446379), wk = 0.0040000 k( 179) = ( 0.1346154 0.3401316 0.6611671), wk = 0.0040000 k( 180) = ( 0.1442308 0.3266869 0.6776963), wk = 0.0040000 k( 181) = ( 0.1538461 0.3132423 0.6942254), wk = 0.0040000 k( 182) = ( 0.1634615 0.2997977 0.7107546), wk = 0.0040000 k( 183) = ( 0.1730769 0.2863531 0.7272838), wk = 0.0040000 k( 184) = ( 0.1826923 0.2729084 0.7438130), wk = 0.0040000 k( 185) = ( 0.1923077 0.2594638 0.7603421), wk = 0.0040000 k( 186) = ( 0.2019231 0.2460192 0.7768713), wk = 0.0040000 k( 187) = ( 0.2115385 0.2325745 0.7934005), wk = 0.0040000 k( 188) = ( 0.2211539 0.2191299 0.8099297), wk = 0.0040000 k( 189) = ( 0.2307692 0.2056853 0.8264588), wk = 0.0040000 k( 190) = ( 0.2403846 0.1922406 0.8429880), wk = 0.0040000 k( 191) = ( 0.2500000 0.1787960 0.8595172), wk = 0.0040000 k( 192) = ( 0.2500000 0.1787960 0.8595172), wk = 0.0040000 k( 193) = ( 0.2656250 0.1899708 0.8457787), wk = 0.0040000 k( 194) = ( 0.2812500 0.2011455 0.8320401), wk = 0.0040000 k( 195) = ( 0.2968750 0.2123203 0.8183016), wk = 0.0040000 k( 196) = ( 0.3125000 0.2234950 0.8045631), wk = 0.0040000 k( 197) = ( 0.3281250 0.2346698 0.7908245), wk = 0.0040000 k( 198) = ( 0.3437500 0.2458445 0.7770860), wk = 0.0040000 k( 199) = ( 0.3593750 0.2570193 0.7633475), wk = 0.0040000 k( 200) = ( 0.3750000 0.2681940 0.7496090), wk = 0.0040000 k( 201) = ( 0.3906250 0.2793688 0.7358704), wk = 0.0040000 k( 202) = ( 0.4062500 0.2905435 0.7221319), wk = 0.0040000 k( 203) = ( 0.4218750 0.3017183 0.7083934), wk = 0.0040000 k( 204) = ( 0.4375000 0.3128930 0.6946549), wk = 0.0040000 k( 205) = ( 0.4531250 0.3240678 0.6809163), wk = 0.0040000 k( 206) = ( 0.4687500 0.3352425 0.6671778), wk = 0.0040000 k( 207) = ( 0.4843750 0.3464173 0.6534393), wk = 0.0040000 k( 208) = ( 0.5000000 0.3575920 0.6397007), wk = 0.0040000 k( 209) = ( 0.5000000 0.3575920 0.6397007), wk = 0.0040000 k( 210) = ( 0.5000000 0.3575920 0.6160081), wk = 0.0040000 k( 211) = ( 0.5000000 0.3575920 0.5923155), wk = 0.0040000 k( 212) = ( 0.5000000 0.3575920 0.5686229), wk = 0.0040000 k( 213) = ( 0.5000000 0.3575920 0.5449303), wk = 0.0040000 k( 214) = ( 0.5000000 0.3575920 0.5212376), wk = 0.0040000 k( 215) = ( 0.5000000 0.3575920 0.4975450), wk = 0.0040000 k( 216) = ( 0.5000000 0.3575920 0.4738524), wk = 0.0040000 k( 217) = ( 0.5000000 0.3575920 0.4501598), wk = 0.0040000 k( 218) = ( 0.5000000 0.3575920 0.4264672), wk = 0.0040000 k( 219) = ( 0.5000000 0.3575920 0.4027745), wk = 0.0040000 k( 220) = ( 0.5000000 0.3575920 0.3790819), wk = 0.0040000 k( 221) = ( 0.5000000 0.3575920 0.3553893), wk = 0.0040000 k( 222) = ( 0.5000000 0.3575920 0.3316967), wk = 0.0040000 k( 223) = ( 0.5000000 0.3575920 0.3080041), wk = 0.0040000 k( 224) = ( 0.5000000 0.3575920 0.2843114), wk = 0.0040000 k( 225) = ( 0.5000000 0.3575920 0.2606188), wk = 0.0040000 k( 226) = ( 0.5000000 0.3575920 0.2369262), wk = 0.0040000 k( 227) = ( 0.5000000 0.3575920 0.2132336), wk = 0.0040000 k( 228) = ( 0.5000000 0.3575920 0.1895410), wk = 0.0040000 k( 229) = ( 0.5000000 0.3575920 0.1658483), wk = 0.0040000 k( 230) = ( 0.5000000 0.3575920 0.1421557), wk = 0.0040000 k( 231) = ( 0.5000000 0.3575920 0.1184631), wk = 0.0040000 k( 232) = ( 0.5000000 0.3575920 0.0947705), wk = 0.0040000 k( 233) = ( 0.5000000 0.3575920 0.0710779), wk = 0.0040000 k( 234) = ( 0.5000000 0.3575920 0.0473852), wk = 0.0040000 k( 235) = ( 0.5000000 0.3575920 0.0236926), wk = 0.0040000 k( 236) = ( 0.5000000 0.3575920 -0.0000000), wk = 0.0040000 k( 237) = ( 0.0000000 0.0000000 0.8595172), wk = 0.0040000 k( 238) = ( 0.0192308 0.0137535 0.8595172), wk = 0.0040000 k( 239) = ( 0.0384615 0.0275071 0.8595172), wk = 0.0040000 k( 240) = ( 0.0576923 0.0412606 0.8595172), wk = 0.0040000 k( 241) = ( 0.0769231 0.0550142 0.8595172), wk = 0.0040000 k( 242) = ( 0.0961538 0.0687677 0.8595172), wk = 0.0040000 k( 243) = ( 0.1153846 0.0825212 0.8595172), wk = 0.0040000 k( 244) = ( 0.1346154 0.0962748 0.8595172), wk = 0.0040000 k( 245) = ( 0.1538461 0.1100283 0.8595172), wk = 0.0040000 k( 246) = ( 0.1730769 0.1237819 0.8595172), wk = 0.0040000 k( 247) = ( 0.1923077 0.1375354 0.8595172), wk = 0.0040000 k( 248) = ( 0.2115385 0.1512889 0.8595172), wk = 0.0040000 k( 249) = ( 0.2307692 0.1650425 0.8595172), wk = 0.0040000 k( 250) = ( 0.2500000 0.1787960 0.8595172), wk = 0.0040000 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 2) = ( 0.0000000 0.0000000 0.0138889), wk = 0.0040000 k( 3) = ( 0.0000000 0.0000000 0.0277778), wk = 0.0040000 k( 4) = ( 0.0000000 0.0000000 0.0416667), wk = 0.0040000 k( 5) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0040000 k( 6) = ( 0.0000000 0.0000000 0.0694444), wk = 0.0040000 k( 7) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0040000 k( 8) = ( 0.0000000 0.0000000 0.0972222), wk = 0.0040000 k( 9) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0040000 k( 10) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0040000 k( 11) = ( 0.0000000 0.0000000 0.1388889), wk = 0.0040000 k( 12) = ( 0.0000000 0.0000000 0.1527778), wk = 0.0040000 k( 13) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0040000 k( 14) = ( 0.0000000 0.0000000 0.1805556), wk = 0.0040000 k( 15) = ( 0.0000000 0.0000000 0.1944444), wk = 0.0040000 k( 16) = ( 0.0000000 0.0000000 0.2083333), wk = 0.0040000 k( 17) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0040000 k( 18) = ( 0.0000000 0.0000000 0.2361111), wk = 0.0040000 k( 19) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0040000 k( 20) = ( 0.0000000 0.0000000 0.2638889), wk = 0.0040000 k( 21) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0040000 k( 22) = ( 0.0000000 0.0000000 0.2916667), wk = 0.0040000 k( 23) = ( 0.0000000 0.0000000 0.3055556), wk = 0.0040000 k( 24) = ( 0.0000000 0.0000000 0.3194444), wk = 0.0040000 k( 25) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0040000 k( 26) = ( 0.0000000 0.0000000 0.3472222), wk = 0.0040000 k( 27) = ( 0.0000000 0.0000000 0.3611111), wk = 0.0040000 k( 28) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0040000 k( 29) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0040000 k( 30) = ( 0.0000000 0.0000000 0.4027778), wk = 0.0040000 k( 31) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0040000 k( 32) = ( 0.0000000 0.0000000 0.4305556), wk = 0.0040000 k( 33) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0040000 k( 34) = ( 0.0000000 0.0000000 0.4583333), wk = 0.0040000 k( 35) = ( 0.0000000 0.0000000 0.4722222), wk = 0.0040000 k( 36) = ( 0.0000000 0.0000000 0.4861111), wk = 0.0040000 k( 37) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040000 k( 38) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040000 k( 39) = ( -0.0127872 0.0127872 0.5000000), wk = 0.0040000 k( 40) = ( -0.0255744 0.0255744 0.5000000), wk = 0.0040000 k( 41) = ( -0.0383616 0.0383616 0.5000000), wk = 0.0040000 k( 42) = ( -0.0511488 0.0511488 0.5000000), wk = 0.0040000 k( 43) = ( -0.0639360 0.0639360 0.5000000), wk = 0.0040000 k( 44) = ( -0.0767232 0.0767232 0.5000000), wk = 0.0040000 k( 45) = ( -0.0895104 0.0895104 0.5000000), wk = 0.0040000 k( 46) = ( -0.1022976 0.1022976 0.5000000), wk = 0.0040000 k( 47) = ( -0.1150849 0.1150849 0.5000000), wk = 0.0040000 k( 48) = ( -0.1278720 0.1278720 0.5000000), wk = 0.0040000 k( 49) = ( -0.1278720 0.1278720 0.5000000), wk = 0.0040000 k( 50) = ( -0.1376649 0.1376649 0.4902072), wk = 0.0040000 k( 51) = ( -0.1474577 0.1474577 0.4804143), wk = 0.0040000 k( 52) = ( -0.1572506 0.1572506 0.4706215), wk = 0.0040000 k( 53) = ( -0.1670434 0.1670434 0.4608286), wk = 0.0040000 k( 54) = ( -0.1768363 0.1768363 0.4510358), wk = 0.0040000 k( 55) = ( -0.1866291 0.1866291 0.4412430), wk = 0.0040000 k( 56) = ( -0.1964219 0.1964219 0.4314501), wk = 0.0040000 k( 57) = ( -0.2062148 0.2062148 0.4216573), wk = 0.0040000 k( 58) = ( -0.2160076 0.2160076 0.4118644), wk = 0.0040000 k( 59) = ( -0.2258005 0.2258005 0.4020716), wk = 0.0040000 k( 60) = ( -0.2355933 0.2355933 0.3922788), wk = 0.0040000 k( 61) = ( -0.2453861 0.2453861 0.3824859), wk = 0.0040000 k( 62) = ( -0.2551790 0.2551790 0.3726931), wk = 0.0040000 k( 63) = ( -0.2649718 0.2649718 0.3629002), wk = 0.0040000 k( 64) = ( -0.2747647 0.2747647 0.3531074), wk = 0.0040000 k( 65) = ( -0.2845575 0.2845575 0.3433145), wk = 0.0040000 k( 66) = ( -0.2943503 0.2943503 0.3335217), wk = 0.0040000 k( 67) = ( -0.3041432 0.3041432 0.3237289), wk = 0.0040000 k( 68) = ( -0.3139360 0.3139360 0.3139360), wk = 0.0040000 k( 69) = ( -0.3139360 0.3139360 0.3139360), wk = 0.0040000 k( 70) = ( -0.3041255 0.3041255 0.3041255), wk = 0.0040000 k( 71) = ( -0.2943150 0.2943150 0.2943150), wk = 0.0040000 k( 72) = ( -0.2845045 0.2845045 0.2845045), wk = 0.0040000 k( 73) = ( -0.2746940 0.2746940 0.2746940), wk = 0.0040000 k( 74) = ( -0.2648835 0.2648835 0.2648835), wk = 0.0040000 k( 75) = ( -0.2550730 0.2550730 0.2550730), wk = 0.0040000 k( 76) = ( -0.2452625 0.2452625 0.2452625), wk = 0.0040000 k( 77) = ( -0.2354520 0.2354520 0.2354520), wk = 0.0040000 k( 78) = ( -0.2256415 0.2256415 0.2256415), wk = 0.0040000 k( 79) = ( -0.2158310 0.2158310 0.2158310), wk = 0.0040000 k( 80) = ( -0.2060205 0.2060205 0.2060205), wk = 0.0040000 k( 81) = ( -0.1962100 0.1962100 0.1962100), wk = 0.0040000 k( 82) = ( -0.1863995 0.1863995 0.1863995), wk = 0.0040000 k( 83) = ( -0.1765890 0.1765890 0.1765890), wk = 0.0040000 k( 84) = ( -0.1667785 0.1667785 0.1667785), wk = 0.0040000 k( 85) = ( -0.1569680 0.1569680 0.1569680), wk = 0.0040000 k( 86) = ( -0.1471575 0.1471575 0.1471575), wk = 0.0040000 k( 87) = ( -0.1373470 0.1373470 0.1373470), wk = 0.0040000 k( 88) = ( -0.1275365 0.1275365 0.1275365), wk = 0.0040000 k( 89) = ( -0.1177260 0.1177260 0.1177260), wk = 0.0040000 k( 90) = ( -0.1079155 0.1079155 0.1079155), wk = 0.0040000 k( 91) = ( -0.0981050 0.0981050 0.0981050), wk = 0.0040000 k( 92) = ( -0.0882945 0.0882945 0.0882945), wk = 0.0040000 k( 93) = ( -0.0784840 0.0784840 0.0784840), wk = 0.0040000 k( 94) = ( -0.0686735 0.0686735 0.0686735), wk = 0.0040000 k( 95) = ( -0.0588630 0.0588630 0.0588630), wk = 0.0040000 k( 96) = ( -0.0490525 0.0490525 0.0490525), wk = 0.0040000 k( 97) = ( -0.0392420 0.0392420 0.0392420), wk = 0.0040000 k( 98) = ( -0.0294315 0.0294315 0.0294315), wk = 0.0040000 k( 99) = ( -0.0196210 0.0196210 0.0196210), wk = 0.0040000 k( 100) = ( -0.0098105 0.0098105 0.0098105), wk = 0.0040000 k( 101) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 103) = ( 0.0192308 0.0192308 -0.0192308), wk = 0.0040000 k( 104) = ( 0.0384615 0.0384615 -0.0384615), wk = 0.0040000 k( 105) = ( 0.0576923 0.0576923 -0.0576923), wk = 0.0040000 k( 106) = ( 0.0769231 0.0769231 -0.0769231), wk = 0.0040000 k( 107) = ( 0.0961538 0.0961538 -0.0961538), wk = 0.0040000 k( 108) = ( 0.1153846 0.1153846 -0.1153846), wk = 0.0040000 k( 109) = ( 0.1346154 0.1346154 -0.1346154), wk = 0.0040000 k( 110) = ( 0.1538461 0.1538461 -0.1538461), wk = 0.0040000 k( 111) = ( 0.1730769 0.1730769 -0.1730769), wk = 0.0040000 k( 112) = ( 0.1923077 0.1923077 -0.1923077), wk = 0.0040000 k( 113) = ( 0.2115385 0.2115385 -0.2115385), wk = 0.0040000 k( 114) = ( 0.2307692 0.2307692 -0.2307692), wk = 0.0040000 k( 115) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0040000 k( 116) = ( 0.2692308 0.2692308 -0.2692308), wk = 0.0040000 k( 117) = ( 0.2884615 0.2884615 -0.2884615), wk = 0.0040000 k( 118) = ( 0.3076923 0.3076923 -0.3076923), wk = 0.0040000 k( 119) = ( 0.3269231 0.3269231 -0.3269231), wk = 0.0040000 k( 120) = ( 0.3461538 0.3461538 -0.3461538), wk = 0.0040000 k( 121) = ( 0.3653846 0.3653846 -0.3653846), wk = 0.0040000 k( 122) = ( 0.3846154 0.3846154 -0.3846154), wk = 0.0040000 k( 123) = ( 0.4038462 0.4038462 -0.4038461), wk = 0.0040000 k( 124) = ( 0.4230769 0.4230769 -0.4230769), wk = 0.0040000 k( 125) = ( 0.4423077 0.4423077 -0.4423077), wk = 0.0040000 k( 126) = ( 0.4615385 0.4615385 -0.4615385), wk = 0.0040000 k( 127) = ( 0.4807692 0.4807692 -0.4807692), wk = 0.0040000 k( 128) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0040000 k( 129) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0040000 k( 130) = ( 0.4902072 0.5097928 -0.4902072), wk = 0.0040000 k( 131) = ( 0.4804143 0.5195857 -0.4804143), wk = 0.0040000 k( 132) = ( 0.4706215 0.5293785 -0.4706215), wk = 0.0040000 k( 133) = ( 0.4608286 0.5391714 -0.4608286), wk = 0.0040000 k( 134) = ( 0.4510358 0.5489642 -0.4510358), wk = 0.0040000 k( 135) = ( 0.4412430 0.5587570 -0.4412430), wk = 0.0040000 k( 136) = ( 0.4314501 0.5685499 -0.4314501), wk = 0.0040000 k( 137) = ( 0.4216573 0.5783427 -0.4216573), wk = 0.0040000 k( 138) = ( 0.4118644 0.5881356 -0.4118644), wk = 0.0040000 k( 139) = ( 0.4020716 0.5979284 -0.4020716), wk = 0.0040000 k( 140) = ( 0.3922788 0.6077212 -0.3922788), wk = 0.0040000 k( 141) = ( 0.3824859 0.6175141 -0.3824859), wk = 0.0040000 k( 142) = ( 0.3726931 0.6273069 -0.3726931), wk = 0.0040000 k( 143) = ( 0.3629002 0.6370998 -0.3629002), wk = 0.0040000 k( 144) = ( 0.3531074 0.6468926 -0.3531074), wk = 0.0040000 k( 145) = ( 0.3433145 0.6566855 -0.3433145), wk = 0.0040000 k( 146) = ( 0.3335217 0.6664783 -0.3335217), wk = 0.0040000 k( 147) = ( 0.3237289 0.6762711 -0.3237289), wk = 0.0040000 k( 148) = ( 0.3139360 0.6860640 -0.3139360), wk = 0.0040000 k( 149) = ( 0.3139360 0.6860640 -0.3139360), wk = 0.0040000 k( 150) = ( 0.2930070 0.6736597 -0.2930070), wk = 0.0040000 k( 151) = ( 0.2720779 0.6612554 -0.2720779), wk = 0.0040000 k( 152) = ( 0.2511488 0.6488512 -0.2511488), wk = 0.0040000 k( 153) = ( 0.2302198 0.6364469 -0.2302198), wk = 0.0040000 k( 154) = ( 0.2092907 0.6240427 -0.2092907), wk = 0.0040000 k( 155) = ( 0.1883616 0.6116384 -0.1883616), wk = 0.0040000 k( 156) = ( 0.1674326 0.5992341 -0.1674326), wk = 0.0040000 k( 157) = ( 0.1465035 0.5868298 -0.1465035), wk = 0.0040000 k( 158) = ( 0.1255744 0.5744256 -0.1255744), wk = 0.0040000 k( 159) = ( 0.1046453 0.5620213 -0.1046453), wk = 0.0040000 k( 160) = ( 0.0837163 0.5496171 -0.0837163), wk = 0.0040000 k( 161) = ( 0.0627872 0.5372128 -0.0627872), wk = 0.0040000 k( 162) = ( 0.0418581 0.5248085 -0.0418581), wk = 0.0040000 k( 163) = ( 0.0209291 0.5124043 -0.0209291), wk = 0.0040000 k( 164) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040000 k( 165) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0040000 k( 166) = ( 0.0096154 0.4903846 0.0096154), wk = 0.0040000 k( 167) = ( 0.0192308 0.4807692 0.0192308), wk = 0.0040000 k( 168) = ( 0.0288462 0.4711538 0.0288462), wk = 0.0040000 k( 169) = ( 0.0384615 0.4615385 0.0384615), wk = 0.0040000 k( 170) = ( 0.0480769 0.4519231 0.0480769), wk = 0.0040000 k( 171) = ( 0.0576923 0.4423077 0.0576923), wk = 0.0040000 k( 172) = ( 0.0673077 0.4326923 0.0673077), wk = 0.0040000 k( 173) = ( 0.0769231 0.4230769 0.0769231), wk = 0.0040000 k( 174) = ( 0.0865385 0.4134615 0.0865385), wk = 0.0040000 k( 175) = ( 0.0961538 0.4038462 0.0961538), wk = 0.0040000 k( 176) = ( 0.1057692 0.3942308 0.1057692), wk = 0.0040000 k( 177) = ( 0.1153846 0.3846154 0.1153846), wk = 0.0040000 k( 178) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0040000 k( 179) = ( 0.1346154 0.3653846 0.1346154), wk = 0.0040000 k( 180) = ( 0.1442308 0.3557692 0.1442308), wk = 0.0040000 k( 181) = ( 0.1538461 0.3461538 0.1538461), wk = 0.0040000 k( 182) = ( 0.1634615 0.3365385 0.1634615), wk = 0.0040000 k( 183) = ( 0.1730769 0.3269231 0.1730769), wk = 0.0040000 k( 184) = ( 0.1826923 0.3173077 0.1826923), wk = 0.0040000 k( 185) = ( 0.1923077 0.3076923 0.1923077), wk = 0.0040000 k( 186) = ( 0.2019231 0.2980769 0.2019231), wk = 0.0040000 k( 187) = ( 0.2115385 0.2884615 0.2115385), wk = 0.0040000 k( 188) = ( 0.2211539 0.2788462 0.2211539), wk = 0.0040000 k( 189) = ( 0.2307692 0.2692308 0.2307692), wk = 0.0040000 k( 190) = ( 0.2403846 0.2596154 0.2403846), wk = 0.0040000 k( 191) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0040000 k( 192) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0040000 k( 193) = ( 0.2656250 0.2656250 0.2263830), wk = 0.0040000 k( 194) = ( 0.2812500 0.2812500 0.2027660), wk = 0.0040000 k( 195) = ( 0.2968750 0.2968750 0.1791490), wk = 0.0040000 k( 196) = ( 0.3125000 0.3125000 0.1555320), wk = 0.0040000 k( 197) = ( 0.3281250 0.3281250 0.1319150), wk = 0.0040000 k( 198) = ( 0.3437500 0.3437500 0.1082980), wk = 0.0040000 k( 199) = ( 0.3593750 0.3593750 0.0846810), wk = 0.0040000 k( 200) = ( 0.3750000 0.3750000 0.0610640), wk = 0.0040000 k( 201) = ( 0.3906250 0.3906250 0.0374470), wk = 0.0040000 k( 202) = ( 0.4062500 0.4062500 0.0138300), wk = 0.0040000 k( 203) = ( 0.4218750 0.4218750 -0.0097870), wk = 0.0040000 k( 204) = ( 0.4375000 0.4375000 -0.0334040), wk = 0.0040000 k( 205) = ( 0.4531250 0.4531250 -0.0570210), wk = 0.0040000 k( 206) = ( 0.4687500 0.4687500 -0.0806380), wk = 0.0040000 k( 207) = ( 0.4843750 0.4843750 -0.1042551), wk = 0.0040000 k( 208) = ( 0.5000000 0.5000000 -0.1278720), wk = 0.0040000 k( 209) = ( 0.5000000 0.5000000 -0.1278720), wk = 0.0040000 k( 210) = ( 0.5000000 0.5000000 -0.1416546), wk = 0.0040000 k( 211) = ( 0.5000000 0.5000000 -0.1554371), wk = 0.0040000 k( 212) = ( 0.5000000 0.5000000 -0.1692196), wk = 0.0040000 k( 213) = ( 0.5000000 0.5000000 -0.1830021), wk = 0.0040000 k( 214) = ( 0.5000000 0.5000000 -0.1967846), wk = 0.0040000 k( 215) = ( 0.5000000 0.5000000 -0.2105671), wk = 0.0040000 k( 216) = ( 0.5000000 0.5000000 -0.2243497), wk = 0.0040000 k( 217) = ( 0.5000000 0.5000000 -0.2381322), wk = 0.0040000 k( 218) = ( 0.5000000 0.5000000 -0.2519147), wk = 0.0040000 k( 219) = ( 0.5000000 0.5000000 -0.2656972), wk = 0.0040000 k( 220) = ( 0.5000000 0.5000000 -0.2794797), wk = 0.0040000 k( 221) = ( 0.5000000 0.5000000 -0.2932622), wk = 0.0040000 k( 222) = ( 0.5000000 0.5000000 -0.3070448), wk = 0.0040000 k( 223) = ( 0.5000000 0.5000000 -0.3208273), wk = 0.0040000 k( 224) = ( 0.5000000 0.5000000 -0.3346098), wk = 0.0040000 k( 225) = ( 0.5000000 0.5000000 -0.3483923), wk = 0.0040000 k( 226) = ( 0.5000000 0.5000000 -0.3621748), wk = 0.0040000 k( 227) = ( 0.5000000 0.5000000 -0.3759573), wk = 0.0040000 k( 228) = ( 0.5000000 0.5000000 -0.3897399), wk = 0.0040000 k( 229) = ( 0.5000000 0.5000000 -0.4035224), wk = 0.0040000 k( 230) = ( 0.5000000 0.5000000 -0.4173049), wk = 0.0040000 k( 231) = ( 0.5000000 0.5000000 -0.4310874), wk = 0.0040000 k( 232) = ( 0.5000000 0.5000000 -0.4448699), wk = 0.0040000 k( 233) = ( 0.5000000 0.5000000 -0.4586524), wk = 0.0040000 k( 234) = ( 0.5000000 0.5000000 -0.4724350), wk = 0.0040000 k( 235) = ( 0.5000000 0.5000000 -0.4862175), wk = 0.0040000 k( 236) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0040000 k( 237) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040000 k( 238) = ( 0.0192308 0.0192308 0.4807692), wk = 0.0040000 k( 239) = ( 0.0384615 0.0384615 0.4615385), wk = 0.0040000 k( 240) = ( 0.0576923 0.0576923 0.4423077), wk = 0.0040000 k( 241) = ( 0.0769231 0.0769231 0.4230769), wk = 0.0040000 k( 242) = ( 0.0961538 0.0961538 0.4038462), wk = 0.0040000 k( 243) = ( 0.1153846 0.1153846 0.3846154), wk = 0.0040000 k( 244) = ( 0.1346154 0.1346154 0.3653846), wk = 0.0040000 k( 245) = ( 0.1538461 0.1538461 0.3461538), wk = 0.0040000 k( 246) = ( 0.1730769 0.1730769 0.3269231), wk = 0.0040000 k( 247) = ( 0.1923077 0.1923077 0.3076923), wk = 0.0040000 k( 248) = ( 0.2115385 0.2115385 0.2884615), wk = 0.0040000 k( 249) = ( 0.2307692 0.2307692 0.2692308), wk = 0.0040000 k( 250) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0040000 Dense grid: 433389 G-vectors FFT dimensions: ( 120, 120, 120) Smooth grid: 71419 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 250, 86) NL pseudopotentials 0.52 Mb ( 125, 272) Each V/rho on FFT grid 0.44 Mb ( 28800) Each G-vector array 0.05 Mb ( 6018) G-vector shells 0.02 Mb ( 2787) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.31 Mb ( 250, 344) Each subspace H/S matrix 0.05 Mb ( 57, 57) Each matrix 0.71 Mb ( 272, 2, 86) The potential is recalculated from file : ./CdCu2SnTe4.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 7.1 secs Computing kpt #: 2 total cpu time spent up to now is 8.9 secs Computing kpt #: 3 total cpu time spent up to now is 10.8 secs Computing kpt #: 4 total cpu time spent up to now is 12.7 secs Computing kpt #: 5 total cpu time spent up to now is 14.6 secs Computing kpt #: 6 total cpu time spent up to now is 17.0 secs Computing kpt #: 7 total cpu time spent up to now is 19.0 secs Computing kpt #: 8 total cpu time spent up to now is 21.2 secs Computing kpt #: 9 total cpu time spent up to now is 23.5 secs Computing kpt #: 10 total cpu time spent up to now is 25.8 secs Computing kpt #: 11 total cpu time spent up to now is 28.2 secs Computing kpt #: 12 total cpu time spent up to now is 30.7 secs Computing kpt #: 13 total cpu time spent up to now is 33.0 secs Computing kpt #: 14 total cpu time spent up to now is 35.2 secs Computing kpt #: 15 total cpu time spent up to now is 37.3 secs Computing kpt #: 16 total cpu time spent up to now is 39.4 secs Computing kpt #: 17 total cpu time spent up to now is 41.6 secs Computing kpt #: 18 total cpu time spent up to now is 43.8 secs Computing kpt #: 19 total cpu time spent up to now is 45.9 secs Computing kpt #: 20 total cpu time spent up to now is 47.9 secs Computing kpt #: 21 total cpu time spent up to now is 49.7 secs Computing kpt #: 22 total cpu time spent up to now is 51.5 secs Computing kpt #: 23 total cpu time spent up to now is 53.4 secs Computing kpt #: 24 total cpu time spent up to now is 55.2 secs Computing kpt #: 25 total cpu time spent up to now is 57.1 secs Computing kpt #: 26 total cpu time spent up to now is 59.1 secs Computing kpt #: 27 total cpu time spent up to now is 61.0 secs Computing kpt #: 28 total cpu time spent up to now is 62.9 secs Computing kpt #: 29 total cpu time spent up to now is 64.8 secs Computing kpt #: 30 total cpu time spent up to now is 66.8 secs Computing kpt #: 31 total cpu time spent up to now is 68.9 secs Computing kpt #: 32 total cpu time spent up to now is 71.0 secs Computing kpt #: 33 total cpu time spent up to now is 73.3 secs Computing kpt #: 34 total cpu time spent up to now is 75.8 secs Computing kpt #: 35 total cpu time spent up to now is 78.5 secs Computing kpt #: 36 total cpu time spent up to now is 81.1 secs Computing kpt #: 37 total cpu time spent up to now is 83.5 secs Computing kpt #: 38 total cpu time spent up to now is 86.0 secs Computing kpt #: 39 total cpu time spent up to now is 88.5 secs Computing kpt #: 40 total cpu time spent up to now is 90.6 secs Computing kpt #: 41 total cpu time spent up to now is 92.8 secs Computing kpt #: 42 total cpu time spent up to now is 94.9 secs Computing kpt #: 43 total cpu time spent up to now is 97.0 secs Computing kpt #: 44 total cpu time spent up to now is 99.0 secs Computing kpt #: 45 total cpu time spent up to now is 101.1 secs Computing kpt #: 46 total cpu time spent up to now is 103.1 secs Computing kpt #: 47 total cpu time spent up to now is 105.2 secs Computing kpt #: 48 total cpu time spent up to now is 107.3 secs Computing kpt #: 49 total cpu time spent up to now is 109.3 secs Computing kpt #: 50 total cpu time spent up to now is 111.4 secs Computing kpt #: 51 total cpu time spent up to now is 113.5 secs Computing kpt #: 52 total cpu time spent up to now is 115.6 secs Computing kpt #: 53 total cpu time spent up to now is 117.5 secs Computing kpt #: 54 total cpu time spent up to now is 119.3 secs Computing kpt #: 55 total cpu time spent up to now is 121.2 secs Computing kpt #: 56 total cpu time spent up to now is 123.0 secs Computing kpt #: 57 total cpu time spent up to now is 124.9 secs Computing kpt #: 58 total cpu time spent up to now is 126.9 secs Computing kpt #: 59 total cpu time spent up to now is 128.9 secs Computing kpt #: 60 total cpu time spent up to now is 130.9 secs Computing kpt #: 61 total cpu time spent up to now is 133.1 secs Computing kpt #: 62 total cpu time spent up to now is 135.6 secs Computing kpt #: 63 total cpu time spent up to now is 137.6 secs Computing kpt #: 64 total cpu time spent up to now is 139.8 secs Computing kpt #: 65 total cpu time spent up to now is 142.0 secs Computing kpt #: 66 total cpu time spent up to now is 144.2 secs Computing kpt #: 67 total cpu time spent up to now is 146.0 secs Computing kpt #: 68 total cpu time spent up to now is 148.0 secs Computing kpt #: 69 total cpu time spent up to now is 149.8 secs Computing kpt #: 70 total cpu time spent up to now is 151.7 secs Computing kpt #: 71 total cpu time spent up to now is 153.6 secs Computing kpt #: 72 total cpu time spent up to now is 155.5 secs Computing kpt #: 73 total cpu time spent up to now is 157.5 secs Computing kpt #: 74 total cpu time spent up to now is 159.7 secs Computing kpt #: 75 total cpu time spent up to now is 161.9 secs Computing kpt #: 76 total cpu time spent up to now is 164.0 secs Computing kpt #: 77 total cpu time spent up to now is 166.4 secs Computing kpt #: 78 total cpu time spent up to now is 168.6 secs Computing kpt #: 79 total cpu time spent up to now is 171.1 secs Computing kpt #: 80 total cpu time spent up to now is 173.6 secs Computing kpt #: 81 total cpu time spent up to now is 175.9 secs Computing kpt #: 82 total cpu time spent up to now is 178.6 secs Computing kpt #: 83 total cpu time spent up to now is 181.0 secs Computing kpt #: 84 total cpu time spent up to now is 183.3 secs Computing kpt #: 85 total cpu time spent up to now is 185.5 secs Computing kpt #: 86 total cpu time spent up to now is 188.0 secs Computing kpt #: 87 total cpu time spent up to now is 190.4 secs Computing kpt #: 88 total cpu time spent up to now is 192.9 secs Computing kpt #: 89 total cpu time spent up to now is 195.1 secs Computing kpt #: 90 total cpu time spent up to now is 197.5 secs Computing kpt #: 91 total cpu time spent up to now is 199.8 secs Computing kpt #: 92 total cpu time spent up to now is 202.3 secs Computing kpt #: 93 total cpu time spent up to now is 204.4 secs Computing kpt #: 94 total cpu time spent up to now is 206.2 secs Computing kpt #: 95 total cpu time spent up to now is 208.1 secs Computing kpt #: 96 total cpu time spent up to now is 210.0 secs Computing kpt #: 97 total cpu time spent up to now is 211.9 secs Computing kpt #: 98 total cpu time spent up to now is 213.9 secs Computing kpt #: 99 total cpu time spent up to now is 215.9 secs Computing kpt #: 100 total cpu time spent up to now is 217.8 secs Computing kpt #: 101 total cpu time spent up to now is 219.6 secs Computing kpt #: 102 total cpu time spent up to now is 221.6 secs Computing kpt #: 103 total cpu time spent up to now is 223.4 secs Computing kpt #: 104 total cpu time spent up to now is 225.3 secs Computing kpt #: 105 total cpu time spent up to now is 227.2 secs Computing kpt #: 106 total cpu time spent up to now is 229.0 secs Computing kpt #: 107 total cpu time spent up to now is 230.9 secs Computing kpt #: 108 total cpu time spent up to now is 232.9 secs Computing kpt #: 109 total cpu time spent up to now is 234.8 secs Computing kpt #: 110 total cpu time spent up to now is 236.8 secs Computing kpt #: 111 total cpu time spent up to now is 238.8 secs Computing kpt #: 112 total cpu time spent up to now is 240.8 secs Computing kpt #: 113 total cpu time spent up to now is 242.7 secs Computing kpt #: 114 total cpu time spent up to now is 244.8 secs Computing kpt #: 115 total cpu time spent up to now is 246.7 secs Computing kpt #: 116 total cpu time spent up to now is 249.1 secs Computing kpt #: 117 total cpu time spent up to now is 251.2 secs Computing kpt #: 118 total cpu time spent up to now is 253.0 secs Computing kpt #: 119 total cpu time spent up to now is 255.1 secs Computing kpt #: 120 total cpu time spent up to now is 257.1 secs Computing kpt #: 121 total cpu time spent up to now is 259.2 secs Computing kpt #: 122 total cpu time spent up to now is 261.0 secs Computing kpt #: 123 total cpu time spent up to now is 263.0 secs Computing kpt #: 124 total cpu time spent up to now is 264.8 secs Computing kpt #: 125 total cpu time spent up to now is 266.8 secs Computing kpt #: 126 total cpu time spent up to now is 269.0 secs Computing kpt #: 127 total cpu time spent up to now is 271.3 secs Computing kpt #: 128 total cpu time spent up to now is 273.6 secs Computing kpt #: 129 total cpu time spent up to now is 275.9 secs Computing kpt #: 130 total cpu time spent up to now is 278.2 secs Computing kpt #: 131 total cpu time spent up to now is 280.5 secs Computing kpt #: 132 total cpu time spent up to now is 282.8 secs Computing kpt #: 133 total cpu time spent up to now is 284.8 secs Computing kpt #: 134 total cpu time spent up to now is 287.1 secs Computing kpt #: 135 total cpu time spent up to now is 290.0 secs Computing kpt #: 136 total cpu time spent up to now is 292.0 secs Computing kpt #: 137 total cpu time spent up to now is 293.9 secs Computing kpt #: 138 total cpu time spent up to now is 296.1 secs Computing kpt #: 139 total cpu time spent up to now is 297.9 secs Computing kpt #: 140 total cpu time spent up to now is 300.2 secs Computing kpt #: 141 total cpu time spent up to now is 302.1 secs Computing kpt #: 142 total cpu time spent up to now is 303.9 secs Computing kpt #: 143 total cpu time spent up to now is 305.8 secs Computing kpt #: 144 total cpu time spent up to now is 307.9 secs Computing kpt #: 145 total cpu time spent up to now is 310.0 secs Computing kpt #: 146 total cpu time spent up to now is 311.7 secs Computing kpt #: 147 total cpu time spent up to now is 313.8 secs Computing kpt #: 148 total cpu time spent up to now is 316.2 secs Computing kpt #: 149 total cpu time spent up to now is 318.2 secs Computing kpt #: 150 total cpu time spent up to now is 320.1 secs Computing kpt #: 151 total cpu time spent up to now is 322.0 secs Computing kpt #: 152 total cpu time spent up to now is 323.8 secs Computing kpt #: 153 total cpu time spent up to now is 325.7 secs Computing kpt #: 154 total cpu time spent up to now is 327.8 secs Computing kpt #: 155 total cpu time spent up to now is 329.8 secs Computing kpt #: 156 total cpu time spent up to now is 331.9 secs Computing kpt #: 157 total cpu time spent up to now is 333.8 secs Computing kpt #: 158 total cpu time spent up to now is 335.6 secs Computing kpt #: 159 total cpu time spent up to now is 337.4 secs Computing kpt #: 160 total cpu time spent up to now is 339.5 secs Computing kpt #: 161 total cpu time spent up to now is 341.3 secs Computing kpt #: 162 total cpu time spent up to now is 343.2 secs Computing kpt #: 163 total cpu time spent up to now is 345.1 secs Computing kpt #: 164 total cpu time spent up to now is 347.1 secs Computing kpt #: 165 total cpu time spent up to now is 348.9 secs Computing kpt #: 166 total cpu time spent up to now is 350.8 secs Computing kpt #: 167 total cpu time spent up to now is 352.7 secs Computing kpt #: 168 total cpu time spent up to now is 354.6 secs Computing kpt #: 169 total cpu time spent up to now is 356.6 secs Computing kpt #: 170 total cpu time spent up to now is 358.5 secs Computing kpt #: 171 total cpu time spent up to now is 360.6 secs Computing kpt #: 172 total cpu time spent up to now is 362.7 secs Computing kpt #: 173 total cpu time spent up to now is 365.0 secs Computing kpt #: 174 total cpu time spent up to now is 367.3 secs Computing kpt #: 175 total cpu time spent up to now is 369.6 secs Computing kpt #: 176 total cpu time spent up to now is 371.8 secs Computing kpt #: 177 total cpu time spent up to now is 374.1 secs Computing kpt #: 178 total cpu time spent up to now is 376.4 secs Computing kpt #: 179 total cpu time spent up to now is 378.5 secs Computing kpt #: 180 total cpu time spent up to now is 380.4 secs Computing kpt #: 181 total cpu time spent up to now is 382.3 secs Computing kpt #: 182 total cpu time spent up to now is 384.1 secs Computing kpt #: 183 total cpu time spent up to now is 386.0 secs Computing kpt #: 184 total cpu time spent up to now is 387.8 secs Computing kpt #: 185 total cpu time spent up to now is 389.7 secs Computing kpt #: 186 total cpu time spent up to now is 391.6 secs Computing kpt #: 187 total cpu time spent up to now is 393.4 secs Computing kpt #: 188 total cpu time spent up to now is 395.2 secs Computing kpt #: 189 total cpu time spent up to now is 397.2 secs Computing kpt #: 190 total cpu time spent up to now is 398.9 secs Computing kpt #: 191 total cpu time spent up to now is 400.7 secs Computing kpt #: 192 total cpu time spent up to now is 402.6 secs Computing kpt #: 193 total cpu time spent up to now is 404.5 secs Computing kpt #: 194 total cpu time spent up to now is 406.4 secs Computing kpt #: 195 total cpu time spent up to now is 408.3 secs Computing kpt #: 196 total cpu time spent up to now is 410.2 secs Computing kpt #: 197 total cpu time spent up to now is 412.0 secs Computing kpt #: 198 total cpu time spent up to now is 413.9 secs Computing kpt #: 199 total cpu time spent up to now is 416.0 secs Computing kpt #: 200 total cpu time spent up to now is 418.0 secs Computing kpt #: 201 total cpu time spent up to now is 420.2 secs Computing kpt #: 202 total cpu time spent up to now is 422.7 secs Computing kpt #: 203 total cpu time spent up to now is 424.6 secs Computing kpt #: 204 total cpu time spent up to now is 426.8 secs Computing kpt #: 205 total cpu time spent up to now is 428.9 secs Computing kpt #: 206 total cpu time spent up to now is 431.1 secs Computing kpt #: 207 total cpu time spent up to now is 433.2 secs Computing kpt #: 208 total cpu time spent up to now is 435.4 secs Computing kpt #: 209 total cpu time spent up to now is 437.5 secs Computing kpt #: 210 total cpu time spent up to now is 439.4 secs Computing kpt #: 211 total cpu time spent up to now is 441.2 secs Computing kpt #: 212 total cpu time spent up to now is 443.3 secs Computing kpt #: 213 total cpu time spent up to now is 445.2 secs Computing kpt #: 214 total cpu time spent up to now is 447.0 secs Computing kpt #: 215 total cpu time spent up to now is 448.9 secs Computing kpt #: 216 total cpu time spent up to now is 450.8 secs Computing kpt #: 217 total cpu time spent up to now is 452.6 secs Computing kpt #: 218 total cpu time spent up to now is 454.5 secs Computing kpt #: 219 total cpu time spent up to now is 456.3 secs Computing kpt #: 220 total cpu time spent up to now is 458.1 secs Computing kpt #: 221 total cpu time spent up to now is 460.0 secs Computing kpt #: 222 total cpu time spent up to now is 462.0 secs Computing kpt #: 223 total cpu time spent up to now is 464.0 secs Computing kpt #: 224 total cpu time spent up to now is 466.1 secs Computing kpt #: 225 total cpu time spent up to now is 468.4 secs Computing kpt #: 226 total cpu time spent up to now is 470.8 secs Computing kpt #: 227 total cpu time spent up to now is 473.8 secs Computing kpt #: 228 total cpu time spent up to now is 476.5 secs Computing kpt #: 229 total cpu time spent up to now is 478.9 secs Computing kpt #: 230 total cpu time spent up to now is 481.3 secs Computing kpt #: 231 total cpu time spent up to now is 483.4 secs Computing kpt #: 232 total cpu time spent up to now is 485.7 secs Computing kpt #: 233 total cpu time spent up to now is 488.2 secs Computing kpt #: 234 total cpu time spent up to now is 490.4 secs Computing kpt #: 235 total cpu time spent up to now is 492.6 secs Computing kpt #: 236 total cpu time spent up to now is 494.7 secs Computing kpt #: 237 total cpu time spent up to now is 496.9 secs Computing kpt #: 238 total cpu time spent up to now is 499.3 secs Computing kpt #: 239 total cpu time spent up to now is 501.4 secs Computing kpt #: 240 total cpu time spent up to now is 503.6 secs Computing kpt #: 241 total cpu time spent up to now is 505.8 secs Computing kpt #: 242 total cpu time spent up to now is 508.0 secs Computing kpt #: 243 total cpu time spent up to now is 510.1 secs Computing kpt #: 244 total cpu time spent up to now is 512.1 secs Computing kpt #: 245 total cpu time spent up to now is 514.3 secs Computing kpt #: 246 total cpu time spent up to now is 516.2 secs Computing kpt #: 247 total cpu time spent up to now is 518.2 secs Computing kpt #: 248 total cpu time spent up to now is 520.3 secs Computing kpt #: 249 total cpu time spent up to now is 522.2 secs Computing kpt #: 250 total cpu time spent up to now is 524.2 secs ethr = 1.39E-08, avg # of iterations = 19.7 total cpu time spent up to now is 524.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2011 -6.2011 -4.8165 -4.8165 -4.8042 -4.8042 -4.7871 -4.7871 -2.7463 -2.7463 -2.7183 -2.7183 -2.1325 -2.1325 -2.0805 -2.0805 -2.0689 -2.0689 -1.2676 -1.2676 1.3632 1.3632 1.9710 1.9710 2.1159 2.1159 2.6009 2.6009 2.6644 2.6644 3.1857 3.1857 3.4515 3.4515 3.5370 3.5370 3.7244 3.7244 4.0572 4.0572 4.0702 4.0702 4.4549 4.4549 4.5143 4.5143 4.5427 4.5427 4.5791 4.5791 4.7086 4.7086 4.7795 4.7795 4.8538 4.8538 6.1665 6.1665 6.6823 6.6823 6.6858 6.6858 6.7072 6.7072 7.9529 7.9529 8.7809 8.7809 9.5135 9.5135 9.5797 9.5797 9.7641 9.7641 10.3725 10.3725 k = 0.0000 0.0000 0.0239 ( 8945 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2003 -6.2003 -4.8172 -4.8165 -4.8049 -4.8048 -4.7879 -4.7870 -2.7490 -2.7443 -2.7186 -2.7182 -2.1383 -2.1274 -2.0818 -2.0794 -2.0708 -2.0677 -1.2697 -1.2615 1.3620 1.3662 1.9663 1.9748 2.0988 2.1284 2.5888 2.6126 2.6561 2.6786 3.1800 3.1928 3.4486 3.4548 3.5333 3.5394 3.7242 3.7245 4.0392 4.0590 4.0710 4.0729 4.4473 4.4634 4.5105 4.5210 4.5407 4.5465 4.5727 4.5871 4.7032 4.7154 4.7726 4.7884 4.8546 4.8559 6.1581 6.1641 6.6025 6.6177 6.6879 6.6903 6.7708 6.7813 7.9524 7.9635 8.7830 8.7907 9.5110 9.5119 9.5637 9.5951 9.7452 9.7815 10.3723 10.3808 k = 0.0000 0.0000 0.0478 ( 8935 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1980 -6.1980 -4.8185 -4.8171 -4.8069 -4.8064 -4.7891 -4.7876 -2.7522 -2.7429 -2.7189 -2.7181 -2.1449 -2.1232 -2.0832 -2.0784 -2.0733 -2.0670 -1.2677 -1.2515 1.3623 1.3708 1.9610 1.9779 2.0784 2.1354 2.5785 2.6228 2.6524 2.6983 3.1759 3.2010 3.4459 3.4584 3.5283 3.5407 3.7239 3.7246 4.0109 4.0493 4.0703 4.0751 4.4409 4.4724 4.5108 4.5286 4.5417 4.5517 4.5679 4.5966 4.6996 4.7230 4.7676 4.7990 4.8580 4.8611 6.1389 6.1499 6.5235 6.5437 6.6821 6.6843 6.8553 6.8630 7.9623 7.9840 8.7971 8.8121 9.5030 9.5070 9.5498 9.6081 9.7266 9.7966 10.3801 10.3970 k = 0.0000 0.0000 0.0716 ( 8931 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1942 -6.1941 -4.8205 -4.8185 -4.8102 -4.8090 -4.7906 -4.7889 -2.7559 -2.7424 -2.7190 -2.7183 -2.1522 -2.1196 -2.0847 -2.0785 -2.0757 -2.0666 -1.2616 -1.2381 1.3641 1.3769 1.9554 1.9806 2.0556 2.1357 2.5726 2.6317 2.6514 2.7220 3.1734 3.2101 3.4432 3.4621 3.5225 3.5410 3.7236 3.7245 3.9751 4.0317 4.0654 4.0762 4.4356 4.4812 4.5154 4.5338 4.5477 4.5580 4.5645 4.6070 4.6988 4.7313 4.7646 4.8113 4.8641 4.8699 6.1080 6.1223 6.4499 6.4764 6.6724 6.6745 6.9387 6.9443 7.9829 8.0141 8.8229 8.8442 9.4884 9.4987 9.5399 9.6170 9.7102 9.8086 10.3956 10.4209 k = 0.0000 0.0000 0.0955 ( 8923 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1888 -6.1887 -4.8236 -4.8211 -4.8146 -4.8125 -4.7922 -4.7907 -2.7601 -2.7427 -2.7187 -2.7187 -2.1602 -2.1167 -2.0863 -2.0818 -2.0757 -2.0665 -1.2518 -1.2218 1.3668 1.3843 1.9497 1.9832 2.0318 2.1289 2.5730 2.6393 2.6511 2.7482 3.1727 3.2201 3.4405 3.4650 3.5169 3.5404 3.7231 3.7243 3.9345 4.0059 4.0591 4.0763 4.4314 4.4894 4.5235 4.5374 4.5565 4.5625 4.5650 4.6171 4.7015 4.7400 4.7640 4.8247 4.8729 4.8830 6.0648 6.0799 6.3832 6.4183 6.6595 6.6610 7.0190 7.0235 8.0147 8.0539 8.8600 8.8863 9.4688 9.4869 9.5331 9.6200 9.6986 9.8175 10.4183 10.4521 k = 0.0000 0.0000 0.1194 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1820 -6.1818 -4.8279 -4.8254 -4.8196 -4.8166 -4.7937 -4.7928 -2.7647 -2.7438 -2.7193 -2.7182 -2.1687 -2.1146 -2.0880 -2.0863 -2.0750 -2.0664 -1.2387 -1.2030 1.3701 1.3926 1.9431 1.9863 2.0092 2.1154 2.5803 2.6448 2.6494 2.7761 3.1741 3.2307 3.4380 3.4652 3.5133 3.5389 3.7224 3.7238 3.8919 3.9733 4.0524 4.0755 4.4280 4.4967 4.5340 4.5414 4.5607 4.5667 4.5727 4.6253 4.7083 4.7494 4.7665 4.8385 4.8848 4.9010 6.0095 6.0233 6.3234 6.3692 6.6438 6.6442 7.0948 7.0995 8.0579 8.1031 8.9076 8.9372 9.4467 9.4719 9.5277 9.6167 9.6930 9.8235 10.4473 10.4894 k = 0.0000 0.0000 0.1433 ( 8923 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1737 -6.1735 -4.8339 -4.8322 -4.8244 -4.8212 -4.7952 -4.7950 -2.7697 -2.7457 -2.7201 -2.7174 -2.1775 -2.1133 -2.0910 -2.0897 -2.0742 -2.0664 -1.2227 -1.1823 1.3733 1.4014 1.9323 1.9897 1.9924 2.0969 2.5941 2.6448 2.6476 2.8051 3.1774 3.2418 3.4361 3.4608 3.5137 3.5360 3.7211 3.7232 3.8502 3.9365 4.0455 4.0740 4.4251 4.5035 4.5455 4.5460 4.5610 4.5750 4.5809 4.6307 4.7186 4.7595 4.7732 4.8520 4.9000 4.9245 5.9443 5.9556 6.2690 6.3266 6.6246 6.6258 7.1644 7.1711 8.1126 8.1614 8.9646 8.9956 9.4237 9.4539 9.5226 9.6087 9.6922 9.8272 10.4807 10.5304 k = 0.0000 0.0000 0.1671 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1639 -6.1637 -4.8414 -4.8409 -4.8295 -4.8263 -4.7975 -4.7963 -2.7750 -2.7481 -2.7211 -2.7164 -2.1863 -2.1134 -2.0951 -2.0913 -2.0734 -2.0664 -1.2043 -1.1603 1.3758 1.4101 1.9131 1.9871 1.9915 2.0777 2.6112 2.6378 2.6467 2.8351 3.1827 3.2533 3.4356 3.4514 3.5183 3.5309 3.7186 3.7223 3.8125 3.8980 4.0386 4.0718 4.4228 4.5097 4.5512 4.5570 4.5625 4.5825 4.5899 4.6334 4.7311 4.7709 4.7849 4.8653 4.9191 4.9531 5.8720 5.8807 6.2173 6.2868 6.6028 6.6061 7.2269 7.2371 8.1779 8.2283 9.0302 9.0602 9.4008 9.4339 9.5178 9.5985 9.6937 9.8293 10.5152 10.5684 k = 0.0000 0.0000 0.1910 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1528 -6.1526 -4.8510 -4.8505 -4.8352 -4.8321 -4.7998 -4.7975 -2.7806 -2.7509 -2.7222 -2.7153 -2.1950 -2.1155 -2.0976 -2.0929 -2.0725 -2.0664 -1.1842 -1.1377 1.3769 1.4183 1.8866 1.9850 1.9935 2.0665 2.6092 2.6413 2.6485 2.8659 3.1898 3.2649 3.4365 3.4385 3.5229 3.5257 3.7140 3.7211 3.7825 3.8601 4.0317 4.0692 4.4208 4.5155 4.5559 4.5660 4.5678 4.5887 4.5993 4.6344 4.7445 4.7840 4.8013 4.8787 4.9428 4.9865 5.7959 5.8022 6.1660 6.2465 6.5797 6.5852 7.2818 7.2970 8.2522 8.3027 9.1030 9.1294 9.3784 9.4129 9.5133 9.5875 9.6965 9.8312 10.5459 10.5903 k = 0.0000 0.0000 0.2149 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1403 -6.1401 -4.8622 -4.8608 -4.8416 -4.8385 -4.8020 -4.7987 -2.7864 -2.7539 -2.7234 -2.7141 -2.2034 -2.1193 -2.0985 -2.0943 -2.0717 -2.0664 -1.1628 -1.1148 1.3761 1.4255 1.8561 1.9638 2.0092 2.0721 2.5857 2.6309 2.6774 2.8973 3.1985 3.2767 3.4229 3.4367 3.5130 3.5346 3.7067 3.7197 3.7631 3.8250 4.0248 4.0661 4.4190 4.5208 4.5598 4.5716 4.5777 4.5937 4.6089 4.6341 4.7594 4.7992 4.8210 4.8922 4.9713 5.0240 5.7181 5.7225 6.1131 6.2036 6.5559 6.5636 7.3294 7.3504 8.3329 8.3827 9.1815 9.2008 9.3572 9.3921 9.5101 9.5764 9.7003 9.8343 10.5676 10.5892 k = 0.0000 0.0000 0.2388 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1265 -6.1264 -4.8743 -4.8722 -4.8487 -4.8457 -4.8042 -4.7999 -2.7924 -2.7571 -2.7247 -2.7130 -2.2114 -2.1242 -2.0985 -2.0957 -2.0708 -2.0664 -1.1409 -1.0922 1.3730 1.4314 1.8237 1.9319 2.0329 2.0917 2.5528 2.6156 2.7118 2.9293 3.2082 3.2887 3.4053 3.4295 3.5071 3.5438 3.6987 3.7178 3.7534 3.7946 4.0179 4.0628 4.4175 4.5257 4.5632 4.5786 4.5866 4.5977 4.6186 4.6330 4.7767 4.8168 4.8421 4.9060 5.0050 5.0650 5.6407 5.6436 6.0578 6.1568 6.5321 6.5414 7.3703 7.3974 8.4166 8.4661 9.2624 9.2694 9.3383 9.3735 9.5107 9.5655 9.7062 9.8408 10.5745 10.5777 k = 0.0000 0.0000 0.2626 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1115 -6.1115 -4.8870 -4.8846 -4.8564 -4.8534 -4.8064 -4.8014 -2.7983 -2.7603 -2.7261 -2.7119 -2.2187 -2.1293 -2.0981 -2.0970 -2.0700 -2.0664 -1.1187 -1.0702 1.3674 1.4355 1.7901 1.8951 2.0642 2.1210 2.5125 2.5959 2.7495 2.9614 3.2179 3.3009 3.3862 3.4073 3.5124 3.5524 3.6936 3.7154 3.7496 3.7708 4.0112 4.0593 4.4162 4.5301 4.5666 4.5864 4.5944 4.6007 4.6278 4.6322 4.7971 4.8373 4.8637 4.9203 5.0436 5.1089 5.5650 5.5668 5.9997 6.1055 6.5085 6.5189 7.4054 7.4385 8.4993 8.5496 9.3102 9.3271 9.3385 9.3727 9.5206 9.5560 9.7165 9.8542 10.5561 10.5780 k = 0.0000 0.0000 0.2865 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.0954 -6.0954 -4.9004 -4.8977 -4.8646 -4.8617 -4.8087 -4.8031 -2.8042 -2.7634 -2.7274 -2.7109 -2.2252 -2.1342 -2.0982 -2.0975 -2.0692 -2.0665 -1.0969 -1.0494 1.3592 1.4378 1.7558 1.8558 2.1024 2.1583 2.4667 2.5732 2.7898 2.9933 3.2261 3.3135 3.3671 3.3726 3.5271 3.5594 3.6925 3.7121 3.7492 3.7552 4.0046 4.0557 4.4151 4.5340 4.5701 4.5947 4.6007 4.6029 4.6300 4.6387 4.8211 4.8608 4.8852 4.9351 5.0864 5.1554 5.4920 5.4930 5.9388 6.0499 6.4853 6.4962 7.4356 7.4741 8.5769 8.6300 9.2999 9.3272 9.3694 9.4284 9.5474 9.5526 9.7362 9.8792 10.5395 10.5726 k = 0.0000 0.0000 0.3104 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.0784 -6.0783 -4.9141 -4.9115 -4.8732 -4.8704 -4.8111 -4.8052 -2.8099 -2.7664 -2.7289 -2.7101 -2.2311 -2.1388 -2.0993 -2.0969 -2.0686 -2.0667 -1.0757 -1.0299 1.3485 1.4381 1.7211 1.8153 2.1465 2.2024 2.4171 2.5491 2.8318 3.0236 3.2299 3.3236 3.3331 3.3510 3.5460 3.5639 3.6948 3.7084 3.7481 3.7516 3.9981 4.0519 4.4144 4.5375 4.5735 4.6018 4.6047 4.6060 4.6304 4.6485 4.8488 4.8878 4.9067 4.9503 5.1324 5.2038 5.4226 5.4228 5.8755 5.9903 6.4625 6.4734 7.4615 7.5048 8.6452 8.7033 9.2889 9.3166 9.3789 9.4650 9.5681 9.5868 9.7745 9.9223 10.5286 10.5664 k = 0.0000 0.0000 0.3343 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0604 -6.0601 -4.9280 -4.9256 -4.8822 -4.8794 -4.8139 -4.8076 -2.8153 -2.7692 -2.7303 -2.7093 -2.2361 -2.1429 -2.1003 -2.0963 -2.0680 -2.0669 -1.0556 -1.0120 1.3354 1.4363 1.6864 1.7745 2.1947 2.2526 2.3660 2.5264 2.8750 3.0502 3.2266 3.2818 3.3413 3.3428 3.5655 3.5659 3.6990 3.7052 3.7485 3.7576 3.9918 4.0481 4.4141 4.5406 4.5767 4.6034 4.6056 4.6147 4.6327 4.6589 4.8804 4.9181 4.9281 4.9662 5.1798 5.2537 5.3569 5.3586 5.8103 5.9274 6.4400 6.4502 7.4839 7.5313 8.7002 8.7652 9.2832 9.3103 9.3724 9.4650 9.5966 9.6236 9.8395 9.9869 10.5270 10.5641 k = 0.0000 0.0000 0.3581 ( 8940 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0415 -6.0412 -4.9421 -4.9400 -4.8915 -4.8888 -4.8169 -4.8105 -2.8203 -2.7717 -2.7317 -2.7087 -2.2402 -2.1465 -2.1012 -2.0957 -2.0675 -2.0673 -1.0367 -0.9958 1.3201 1.4321 1.6518 1.7339 2.2436 2.3020 2.3218 2.5094 2.9187 3.0679 3.2191 3.2315 3.3447 3.3555 3.5640 3.5842 3.7028 3.7031 3.7549 3.7689 3.9858 4.0443 4.4143 4.5434 4.5796 4.6033 4.6040 4.6252 4.6368 4.6699 4.9159 4.9494 4.9515 4.9831 5.2220 5.2946 5.3055 5.3063 5.7438 5.8621 6.4175 6.4269 7.5030 7.5538 8.7382 8.8114 9.2845 9.3118 9.3573 9.4495 9.6181 9.6505 9.9260 10.0685 10.5386 10.5701 k = 0.0000 0.0000 0.3820 ( 8934 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0220 -6.0215 -4.9560 -4.9545 -4.9009 -4.8983 -4.8203 -4.8138 -2.8248 -2.7739 -2.7331 -2.7083 -2.2435 -2.1496 -2.1020 -2.0953 -2.0677 -2.0672 -1.0193 -0.9814 1.3028 1.4252 1.6176 1.6937 2.2643 2.2865 2.3720 2.5054 2.9617 3.0684 3.1796 3.2182 3.3543 3.3704 3.5601 3.5999 3.7007 3.7056 3.7661 3.7864 3.9800 4.0404 4.4152 4.5460 4.5820 4.6009 4.6025 4.6368 4.6415 4.6815 4.9552 4.9705 4.9852 5.0039 5.2176 5.2388 5.3070 5.3562 5.6769 5.7953 6.3949 6.4031 7.5191 7.5726 8.7572 8.8382 9.2920 9.3230 9.3397 9.4284 9.6324 9.6688 10.0204 10.1560 10.5675 10.5886 k = 0.0000 0.0000 0.4059 ( 8942 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0018 -6.0011 -4.9697 -4.9688 -4.9105 -4.9080 -4.8241 -4.8177 -2.8288 -2.7758 -2.7345 -2.7082 -2.2459 -2.1521 -2.1028 -2.0949 -2.0683 -2.0671 -1.0035 -0.9689 1.2836 1.4152 1.5839 1.6543 2.2200 2.3136 2.4370 2.5246 3.0013 3.0484 3.1293 3.2308 3.3684 3.3857 3.5541 3.6124 3.6988 3.7060 3.7804 3.8096 3.9744 4.0365 4.4169 4.5483 4.5838 4.5971 4.6013 4.6462 4.6494 4.6937 4.9900 4.9989 5.0087 5.0387 5.1744 5.1872 5.3530 5.4076 5.6104 5.7279 6.3721 6.3791 7.5320 7.5879 8.7569 8.8440 9.2890 9.3373 9.3399 9.4085 9.6435 9.6819 10.1109 10.2370 10.6142 10.6220 k = 0.0000 0.0000 0.4298 ( 8942 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.9812 -5.9804 -4.9830 -4.9829 -4.9201 -4.9177 -4.8284 -4.8222 -2.8322 -2.7774 -2.7360 -2.7083 -2.2474 -2.1541 -2.1034 -2.0946 -2.0691 -2.0672 -0.9894 -0.9583 1.2628 1.4016 1.5509 1.6160 2.1812 2.3219 2.5057 2.5698 3.0146 3.0219 3.0965 3.2529 3.3852 3.4015 3.5462 3.6223 3.6971 3.7045 3.7968 3.8367 3.9692 4.0326 4.4197 4.5505 4.5846 4.5929 4.6002 4.6508 4.6631 4.7065 5.0069 5.0258 5.0457 5.0830 5.1332 5.1412 5.4054 5.4585 5.5451 5.6609 6.3490 6.3546 7.5415 7.5994 8.7393 8.8302 9.2631 9.3393 9.3621 9.4116 9.6540 9.6923 10.1902 10.3043 10.6612 10.6628 k = 0.0000 0.0000 0.4536 ( 8950 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.9603 -5.9592 -4.9965 -4.9957 -4.9296 -4.9273 -4.8332 -4.8274 -2.8350 -2.7787 -2.7374 -2.7087 -2.2481 -2.1557 -2.1040 -2.0943 -2.0700 -2.0677 -0.9771 -0.9495 1.2405 1.3843 1.5188 1.5788 2.1495 2.3195 2.5765 2.6316 2.9751 2.9909 3.1141 3.2789 3.4035 3.4176 3.5365 3.6302 3.6956 3.7016 3.8139 3.8657 3.9643 4.0288 4.4237 4.5525 4.5838 4.5885 4.5999 4.6550 4.6778 4.7196 5.0139 5.0395 5.0936 5.0989 5.1079 5.1354 5.4569 5.4839 5.5084 5.5955 6.3254 6.3297 7.5473 7.6070 8.7078 8.8003 9.2280 9.3104 9.3985 9.4459 9.6654 9.7019 10.2561 10.3590 10.6638 10.6852 k = 0.0000 0.0000 0.4775 ( 8954 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.9393 -5.9380 -5.0094 -5.0077 -4.9391 -4.9369 -4.8385 -4.8331 -2.8370 -2.7797 -2.7388 -2.7095 -2.2479 -2.1567 -2.1045 -2.0941 -2.0712 -2.0685 -0.9665 -0.9424 1.2169 1.3630 1.4878 1.5431 2.1258 2.3143 2.6478 2.6983 2.9373 2.9402 3.1508 3.3057 3.4227 3.4341 3.5250 3.6365 3.6944 3.6976 3.8311 3.8949 3.9598 4.0252 4.4291 4.5543 4.5812 4.5842 4.6008 4.6589 4.6935 4.7329 5.0018 5.0388 5.0783 5.0984 5.1522 5.1885 5.4203 5.5139 5.5292 5.5602 6.3015 6.3045 7.5487 7.6101 8.6655 8.7578 9.1875 9.2700 9.4407 9.4912 9.6784 9.7115 10.3112 10.4060 10.6405 10.6831 k = 0.0000 0.0000 0.5014 ( 8958 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.9183 -5.9167 -5.0215 -5.0187 -4.9483 -4.9462 -4.8445 -4.8396 -2.8383 -2.7804 -2.7403 -2.7107 -2.2469 -2.1574 -2.1050 -2.0940 -2.0725 -2.0698 -0.9575 -0.9368 1.1925 1.3379 1.4580 1.5088 2.1106 2.3102 2.7165 2.7515 2.8892 2.9168 3.1897 3.3316 3.4424 3.4509 3.5124 3.6419 3.6926 3.6938 3.8477 3.9229 3.9558 4.0221 4.4361 4.5558 4.5772 4.5799 4.6028 4.6625 4.7102 4.7459 4.9770 5.0133 5.0848 5.1100 5.2093 5.2462 5.3651 5.4706 5.5666 5.6061 6.2772 6.2792 7.5447 7.6080 8.6158 8.7061 9.1424 9.2231 9.4867 9.5406 9.6936 9.7219 10.3592 10.4490 10.6139 10.6686 k = 0.0000 0.0000 0.5253 ( 8954 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8975 -5.8957 -5.0325 -5.0288 -4.9572 -4.9552 -4.8510 -4.8468 -2.8389 -2.7807 -2.7418 -2.7123 -2.2450 -2.1576 -2.1054 -2.0940 -2.0741 -2.0714 -0.9501 -0.9326 1.1675 1.3095 1.4296 1.4762 2.1038 2.3092 2.7589 2.7675 2.8541 2.9441 3.2281 3.3555 3.4613 3.4679 3.4999 3.6467 3.6870 3.6937 3.8630 3.9478 3.9524 4.0203 4.4449 4.5569 4.5723 4.5761 4.6059 4.6659 4.7278 4.7580 4.9509 4.9840 5.0978 5.1259 5.2653 5.3073 5.3198 5.4153 5.6184 5.6515 6.2526 6.2536 7.5344 7.5997 8.5618 8.6482 9.0930 9.1706 9.5353 9.5917 9.7115 9.7334 10.4030 10.4895 10.5884 10.6492 k = 0.0000 0.0000 0.5491 ( 8958 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8771 -5.8750 -5.0424 -5.0376 -4.9659 -4.9640 -4.8581 -4.8546 -2.8387 -2.7808 -2.7433 -2.7144 -2.2423 -2.1575 -2.1058 -2.0940 -2.0758 -2.0736 -0.9441 -0.9296 1.1425 1.2787 1.4027 1.4454 2.1049 2.3119 2.7284 2.7525 2.8829 3.0097 3.2654 3.3762 3.4732 3.4853 3.4954 3.6512 3.6811 3.6944 3.8766 3.9498 3.9671 4.0216 4.4553 4.5571 4.5667 4.5727 4.6103 4.6693 4.7462 4.7684 4.9284 4.9564 5.1109 5.1397 5.2648 5.3424 5.3564 5.3804 5.6688 5.6950 6.2278 6.2281 7.5164 7.5840 8.5062 8.5870 9.0394 9.1130 9.5859 9.6425 9.7327 9.7462 10.4437 10.5272 10.5649 10.6282 k = 0.0000 0.0000 0.5730 ( 8958 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8573 -5.8550 -5.0510 -5.0452 -4.9741 -4.9723 -4.8659 -4.8632 -2.8378 -2.7807 -2.7447 -2.7169 -2.2390 -2.1570 -2.1062 -2.0940 -2.0777 -2.0762 -0.9394 -0.9277 1.1177 1.2463 1.3775 1.4164 2.1133 2.3184 2.6863 2.7066 2.9389 3.0845 3.3016 3.3913 3.4713 3.5028 3.5091 3.6560 3.6752 3.6960 3.8881 3.9482 3.9777 4.0285 4.4669 4.5561 4.5610 4.5704 4.6163 4.6729 4.7656 4.7757 4.9119 4.9311 5.1225 5.1438 5.2409 5.3187 5.4058 5.4415 5.7176 5.7362 6.2029 6.2030 7.4897 7.5596 8.4520 8.5256 8.9819 9.0508 9.6379 9.6904 9.7592 9.7606 10.4804 10.5443 10.5609 10.6073 k = 0.0000 0.0000 0.5969 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8382 -5.8357 -5.0582 -5.0513 -4.9819 -4.9802 -4.8742 -4.8724 -2.8361 -2.7803 -2.7462 -2.7198 -2.2348 -2.1562 -2.1065 -2.0941 -2.0797 -2.0793 -0.9359 -0.9266 1.0937 1.2132 1.3541 1.3893 2.1280 2.3285 2.6418 2.6582 2.9924 3.1548 3.3366 3.3980 3.4755 3.5204 3.5276 3.6616 3.6697 3.6989 3.8971 3.9479 3.9802 4.0401 4.4789 4.5537 4.5556 4.5689 4.6245 4.6772 4.7788 4.7856 4.9028 4.9080 5.1316 5.1317 5.2368 5.2834 5.4724 5.5101 5.7646 5.7752 6.1783 6.1784 7.4532 7.5252 8.4015 8.4669 8.9209 8.9845 9.6904 9.7309 9.7769 9.7950 10.5068 10.5311 10.5831 10.5925 k = 0.0000 0.0000 0.6208 ( 8932 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8201 -5.8174 -5.0638 -5.0560 -4.9892 -4.9876 -4.8831 -4.8823 -2.8338 -2.7797 -2.7478 -2.7233 -2.2300 -2.1551 -2.1070 -2.0944 -2.0829 -2.0818 -0.9333 -0.9262 1.0709 1.1804 1.3326 1.3642 2.1480 2.3418 2.5979 2.6113 3.0377 3.2091 3.3705 3.4011 3.4925 3.5376 3.5464 3.6651 3.6689 3.7037 3.9034 3.9488 3.9782 4.0523 4.4898 4.5500 4.5509 4.5680 4.6356 4.6824 4.7773 4.8061 4.8870 4.9011 5.1101 5.1374 5.2470 5.2574 5.5396 5.5798 5.8097 5.8119 6.1540 6.1548 7.4066 7.4801 8.3568 8.4131 8.8572 8.9149 9.7413 9.7621 9.7970 9.8413 10.5013 10.5449 10.5661 10.6099 k = 0.0000 0.0000 0.6446 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8032 -5.8004 -5.0677 -5.0591 -4.9959 -4.9944 -4.8926 -4.8926 -2.8308 -2.7789 -2.7494 -2.7273 -2.2245 -2.1538 -2.1076 -2.0949 -2.0869 -2.0840 -0.9316 -0.9263 1.0496 1.1485 1.3130 1.3412 2.1725 2.3577 2.5558 2.5673 3.0728 3.2356 3.4025 3.4118 3.5195 3.5537 3.5653 3.6619 3.6790 3.7118 3.9072 3.9507 3.9744 4.0627 4.4980 4.5454 4.5477 4.5670 4.6497 4.6890 4.7725 4.8259 4.8690 4.9054 5.0891 5.1394 5.2416 5.2623 5.6057 5.6487 5.8470 5.8526 6.1305 6.1329 7.3505 7.4244 8.3191 8.3663 8.7914 8.8433 9.7826 9.7875 9.8283 9.8937 10.4869 10.5473 10.5606 10.6205 k = 0.0000 0.0000 0.6685 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7876 -5.7847 -5.0700 -5.0607 -5.0020 -5.0006 -4.9035 -4.9024 -2.8272 -2.7779 -2.7510 -2.7318 -2.2186 -2.1524 -2.1083 -2.0962 -2.0906 -2.0862 -0.9305 -0.9267 1.0303 1.1182 1.2955 1.3204 2.2003 2.3753 2.5166 2.5269 3.0970 3.2343 3.4306 3.4316 3.5503 3.5678 3.5861 3.6602 3.6936 3.7257 3.9091 3.9528 3.9697 4.0703 4.5026 4.5402 4.5466 4.5658 4.6663 4.6971 4.7663 4.8353 4.8637 4.9133 5.0726 5.1393 5.2345 5.2787 5.6690 5.7144 5.8814 5.8930 6.1079 6.1136 7.2865 7.3592 8.2885 8.3270 8.7250 8.7708 9.8084 9.8100 9.8758 9.9487 10.4733 10.5292 10.5681 10.6222 k = 0.0000 0.0000 0.6924 ( 8934 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7734 -5.7706 -5.0706 -5.0609 -5.0074 -5.0061 -4.9146 -4.9127 -2.8230 -2.7769 -2.7526 -2.7367 -2.2121 -2.1508 -2.1093 -2.0995 -2.0928 -2.0883 -0.9299 -0.9274 1.0132 1.0900 1.2801 1.3017 2.2304 2.3935 2.4810 2.4908 3.1111 3.2167 3.4497 3.4566 3.5745 3.5793 3.6107 3.6598 3.7134 3.7494 3.9100 3.9543 3.9646 4.0749 4.5037 4.5344 4.5472 4.5643 4.6841 4.7065 4.7602 4.8240 4.8808 4.9229 5.0623 5.1404 5.2334 5.2945 5.7277 5.7737 5.9170 5.9296 6.0868 6.0985 7.2173 7.2868 8.2647 8.2951 8.6593 8.6992 9.8273 9.8303 9.9302 10.0042 10.4611 10.5120 10.5680 10.6161 k = 0.0000 0.0000 0.7163 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7608 -5.7581 -5.0696 -5.0597 -5.0121 -5.0110 -4.9259 -4.9231 -2.8182 -2.7757 -2.7543 -2.7420 -2.2052 -2.1492 -2.1105 -2.1044 -2.0936 -2.0901 -0.9298 -0.9281 0.9986 1.0643 1.2669 1.2852 2.2616 2.4104 2.4504 2.4595 3.1165 3.1921 3.4658 3.4767 3.5885 3.5902 3.6323 3.6603 3.7377 3.7851 3.9103 3.9547 3.9596 4.0764 4.5026 4.5283 4.5487 4.5628 4.7015 4.7168 4.7548 4.8092 4.9023 4.9331 5.0586 5.1449 5.2356 5.3088 5.7803 5.8227 5.9561 5.9597 6.0675 6.0909 7.1462 7.2104 8.2466 8.2699 8.5962 8.6304 9.8437 9.8486 9.9860 10.0586 10.4506 10.4959 10.5625 10.6049 k = 0.0000 0.0000 0.7401 ( 8946 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7500 -5.7475 -5.0672 -5.0574 -5.0160 -5.0150 -4.9370 -4.9335 -2.8130 -2.7746 -2.7560 -2.7476 -2.1979 -2.1478 -2.1122 -2.1100 -2.0941 -2.0916 -0.9299 -0.9289 0.9867 1.0413 1.2558 1.2710 2.2922 2.4129 2.4342 2.4368 3.1152 3.1657 3.4788 3.4917 3.5960 3.6011 3.6464 3.6614 3.7648 3.8282 3.9105 3.9537 3.9546 4.0747 4.5007 4.5222 4.5504 4.5613 4.7169 4.7269 4.7506 4.7952 4.9229 4.9432 5.0616 5.1529 5.2405 5.3208 5.8252 5.8590 5.9786 5.9985 6.0513 6.0951 7.0768 7.1339 8.2332 8.2503 8.5378 8.5666 9.8585 9.8646 10.0411 10.1102 10.4421 10.4811 10.5546 10.5909 k = 0.0000 0.0000 0.7640 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7409 -5.7388 -5.0635 -5.0544 -5.0190 -5.0183 -4.9477 -4.9437 -2.8073 -2.7735 -2.7577 -2.7532 -2.1902 -2.1469 -2.1152 -2.1140 -2.0944 -2.0928 -0.9301 -0.9296 0.9778 1.0213 1.2470 1.2591 2.3194 2.3933 2.4167 2.4469 3.1094 3.1403 3.4893 3.5022 3.6025 3.6090 3.6549 3.6628 3.7925 3.8709 3.9117 3.9500 3.9514 4.0699 4.4989 4.5162 4.5520 4.5600 4.7296 4.7358 4.7482 4.7827 4.9406 4.9528 5.0707 5.1614 5.2494 5.3299 5.8617 5.8841 5.9853 6.0262 6.0533 6.1113 7.0133 7.0614 8.2232 8.2350 8.4864 8.5099 9.8715 9.8779 10.0937 10.1568 10.4356 10.4678 10.5468 10.5765 k = 0.0000 0.0000 0.7879 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7337 -5.7321 -5.0592 -5.0512 -5.0211 -5.0206 -4.9572 -4.9532 -2.8013 -2.7728 -2.7594 -2.7587 -2.1825 -2.1473 -2.1197 -2.1162 -2.0946 -2.0937 -0.9304 -0.9302 0.9719 1.0044 1.2404 1.2495 2.3381 2.3750 2.4111 2.4561 3.1013 3.1184 3.4976 3.5087 3.6082 3.6146 3.6600 3.6641 3.8190 3.8977 3.9243 3.9459 3.9484 4.0617 4.4976 4.5108 4.5533 4.5589 4.7393 4.7415 4.7485 4.7722 4.9544 4.9611 5.0848 5.1656 5.2638 5.3352 5.8892 5.9009 5.9854 6.0180 6.0899 6.1321 6.9597 6.9972 8.2159 8.2234 8.4444 8.4626 9.8825 9.8883 10.1419 10.1955 10.4313 10.4563 10.5408 10.5632 k = 0.0000 0.0000 0.8118 ( 8944 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7285 -5.7273 -5.0546 -5.0487 -5.0222 -5.0221 -4.9649 -4.9614 -2.7951 -2.7735 -2.7630 -2.7610 -2.1748 -2.1495 -2.1225 -2.1184 -2.0948 -2.0943 -0.9307 -0.9306 0.9691 0.9908 1.2361 1.2421 2.3447 2.3611 2.4196 2.4601 3.0934 3.1015 3.5041 3.5122 3.6129 3.6178 3.6631 3.6651 3.8431 3.8985 3.9417 3.9426 3.9592 4.0498 4.4972 4.5060 4.5543 4.5578 4.7435 4.7457 4.7516 4.7637 4.9643 4.9677 5.1022 5.1627 5.2829 5.3356 5.9077 5.9118 5.9851 6.0079 6.1232 6.1499 6.9199 6.9456 8.2107 8.2148 8.4141 8.4266 9.8911 9.8955 10.1833 10.2230 10.4295 10.4466 10.5376 10.5523 k = 0.0000 0.0000 0.8356 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7252 -5.7246 -5.0507 -5.0475 -5.0227 -5.0226 -4.9696 -4.9676 -2.7888 -2.7771 -2.7643 -2.7625 -2.1672 -2.1540 -2.1231 -2.1205 -2.0948 -2.0946 -0.9309 -0.9309 0.9696 0.9804 1.2341 1.2372 2.3454 2.3517 2.4349 2.4577 3.0877 3.0907 3.5089 3.5131 3.6165 3.6191 3.6649 3.6657 3.8637 3.8919 3.9400 3.9402 3.9883 4.0339 4.4978 4.5022 4.5553 4.5570 4.7454 4.7488 4.7543 4.7580 4.9702 4.9717 5.1209 5.1532 5.3026 5.3304 5.9176 5.9181 5.9873 5.9993 6.1469 6.1598 6.8972 6.9103 8.2076 8.2093 8.3967 8.4031 9.8970 9.8994 10.2148 10.2361 10.4302 10.4389 10.5373 10.5444 k = 0.0000 0.0000 0.8595 ( 8950 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7239 -5.0482 -5.0482 -5.0227 -5.0227 -4.9706 -4.9706 -2.7827 -2.7827 -2.7638 -2.7638 -2.1602 -2.1602 -2.1223 -2.1223 -2.0948 -2.0948 -0.9310 -0.9310 0.9733 0.9733 1.2345 1.2345 2.3468 2.3468 2.4488 2.4488 3.0863 3.0863 3.5119 3.5119 3.6186 3.6186 3.6657 3.6657 3.8802 3.8802 3.9392 3.9392 4.0135 4.0135 4.4994 4.4994 4.5561 4.5561 4.7477 4.7477 4.7558 4.7558 4.9726 4.9726 5.1386 5.1386 5.3192 5.3192 5.9204 5.9204 5.9923 5.9923 6.1592 6.1592 6.8938 6.8938 8.2070 8.2070 8.3930 8.3930 9.8998 9.8998 10.2332 10.2332 10.4334 10.4334 10.5395 10.5395 k = 0.0000 0.0000 0.8595 ( 8950 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7239 -5.0482 -5.0482 -5.0227 -5.0227 -4.9706 -4.9706 -2.7827 -2.7827 -2.7638 -2.7638 -2.1602 -2.1602 -2.1223 -2.1223 -2.0948 -2.0948 -0.9310 -0.9310 0.9733 0.9733 1.2345 1.2345 2.3468 2.3468 2.4488 2.4488 3.0863 3.0863 3.5119 3.5119 3.6186 3.6186 3.6657 3.6657 3.8802 3.8802 3.9392 3.9392 4.0135 4.0135 4.4994 4.4994 4.5561 4.5561 4.7477 4.7477 4.7558 4.7558 4.9726 4.9726 5.1386 5.1386 5.3192 5.3192 5.9204 5.9204 5.9923 5.9923 6.1592 6.1592 6.8938 6.8938 8.2070 8.2070 8.3930 8.3930 9.8998 9.8998 10.2332 10.2332 10.4334 10.4334 10.5395 10.5395 k =-0.0128 0.0179 0.8595 ( 8940 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7241 -5.7237 -5.0483 -5.0476 -5.0236 -5.0228 -4.9711 -4.9701 -2.7867 -2.7801 -2.7653 -2.7612 -2.1670 -2.1545 -2.1234 -2.1207 -2.0963 -2.0932 -0.9294 -0.9293 0.9736 0.9751 1.2357 1.2371 2.3458 2.3468 2.4464 2.4525 3.0850 3.0875 3.5079 3.5154 3.6169 3.6191 3.6631 3.6678 3.8676 3.8906 3.9310 3.9449 4.0134 4.0149 4.4984 4.4999 4.5479 4.5634 4.7439 4.7497 4.7559 4.7562 4.9679 4.9722 5.1381 5.1390 5.3147 5.3248 5.9131 5.9231 5.9822 5.9954 6.1561 6.1582 6.8900 6.9062 8.2061 8.2219 8.3944 8.3980 9.8974 9.9054 10.2345 10.2413 10.4088 10.4203 10.5448 10.5574 k =-0.0256 0.0358 0.8595 ( 8932 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7244 -5.7236 -5.0480 -5.0465 -5.0253 -5.0236 -4.9716 -4.9696 -2.7920 -2.7789 -2.7659 -2.7577 -2.1750 -2.1502 -2.1241 -2.1189 -2.0978 -2.0917 -0.9246 -0.9243 0.9760 0.9790 1.2406 1.2434 2.3438 2.3456 2.4454 2.4573 3.0834 3.0885 3.5034 3.5182 3.6140 3.6182 3.6600 3.6694 3.8526 3.8990 3.9201 3.9483 4.0146 4.0176 4.4968 4.4997 4.5390 4.5698 4.7388 4.7490 4.7565 4.7571 4.9589 4.9668 5.1374 5.1390 5.3115 5.3314 5.9015 5.9211 5.9653 5.9915 6.1490 6.1533 6.8950 6.9269 8.2189 8.2504 8.4022 8.4094 9.8981 9.9136 10.2443 10.2563 10.3670 10.3784 10.5645 10.5812 k =-0.0384 0.0536 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7248 -5.7236 -5.0476 -5.0450 -5.0279 -5.0250 -4.9722 -4.9692 -2.7980 -2.7786 -2.7660 -2.7539 -2.1837 -2.1474 -2.1247 -2.1168 -2.0990 -2.0904 -0.9168 -0.9163 0.9805 0.9851 1.2493 1.2535 2.3410 2.3431 2.4460 2.4632 3.0815 3.0895 3.4983 3.5202 3.6101 3.6160 3.6563 3.6706 3.8349 3.9012 3.9113 3.9499 4.0169 4.0213 4.4946 4.4989 4.5296 4.5753 4.7326 4.7464 4.7566 4.7587 4.9466 4.9568 5.1366 5.1383 5.3093 5.3386 5.8858 5.9141 5.9422 5.9810 6.1382 6.1451 6.9088 6.9550 8.2441 8.2908 8.4171 8.4275 9.9013 9.9233 10.2571 10.2597 10.3282 10.3376 10.5836 10.6016 k =-0.0511 0.0715 0.8595 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7252 -5.7238 -5.0474 -5.0435 -5.0307 -5.0264 -4.9726 -4.9689 -2.8044 -2.7788 -2.7658 -2.7501 -2.1928 -2.1459 -2.1251 -2.1148 -2.0999 -2.0891 -0.9062 -0.9054 0.9869 0.9935 1.2615 1.2673 2.3374 2.3391 2.4481 2.4700 3.0791 3.0903 3.4928 3.5214 3.6051 3.6124 3.6521 3.6713 3.8146 3.8864 3.9158 3.9501 4.0201 4.0257 4.4917 4.4973 4.5201 4.5800 4.7253 4.7422 4.7565 4.7601 4.9323 4.9435 5.1355 5.1368 5.3079 5.3461 5.8663 5.9017 5.9135 5.9646 6.1245 6.1343 6.9306 6.9898 8.2797 8.3400 8.4408 8.4525 9.9058 9.9334 10.2159 10.2340 10.3135 10.3592 10.5978 10.6170 k =-0.0639 0.0894 0.8595 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7258 -5.7240 -5.0483 -5.0435 -5.0324 -5.0271 -4.9731 -4.9686 -2.8109 -2.7794 -2.7655 -2.7467 -2.2022 -2.1454 -2.1254 -2.1132 -2.1003 -2.0881 -0.8932 -0.8919 0.9955 1.0043 1.2773 1.2847 2.3330 2.3337 2.4518 2.4777 3.0760 3.0909 3.4868 3.5212 3.5993 3.6075 3.6473 3.6713 3.7921 3.8667 3.9219 3.9491 4.0243 4.0308 4.4881 4.4942 4.5113 4.5839 4.7170 4.7363 4.7563 4.7611 4.9172 4.9281 5.1341 5.1343 5.3073 5.3537 5.8434 5.8798 5.8833 5.9434 6.1088 6.1215 6.9598 7.0303 8.3229 8.3913 8.4778 8.4853 9.9098 9.9424 10.1510 10.1691 10.3409 10.4067 10.6068 10.6273 k =-0.0767 0.1073 0.8595 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7266 -5.7245 -5.0510 -5.0469 -5.0310 -5.0262 -4.9734 -4.9683 -2.8174 -2.7802 -2.7651 -2.7437 -2.2116 -2.1456 -2.1255 -2.1123 -2.1002 -2.0873 -0.8781 -0.8763 1.0062 1.0176 1.2965 1.3056 2.3267 2.3278 2.4570 2.4862 3.0721 3.0914 3.4803 3.5189 3.5926 3.6013 3.6421 3.6703 3.7687 3.8443 3.9280 3.9469 4.0293 4.0362 4.4838 4.4887 4.5045 4.5871 4.7079 4.7285 4.7559 4.7618 4.9023 4.9120 5.1310 5.1321 5.3072 5.3611 5.8176 5.8420 5.8587 5.9188 6.0919 6.1072 6.9954 7.0758 8.3704 8.4368 8.5264 8.5337 9.9103 9.9484 10.0807 10.0965 10.3758 10.4637 10.6119 10.6335 k =-0.0895 0.1252 0.8595 ( 8932 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7275 -5.7253 -5.0556 -5.0526 -5.0274 -5.0236 -4.9735 -4.9679 -2.8238 -2.7811 -2.7647 -2.7413 -2.2207 -2.1465 -2.1256 -2.1119 -2.0998 -2.0868 -0.8615 -0.8589 1.0190 1.0334 1.3189 1.3299 2.3184 2.3216 2.4636 2.4956 3.0672 3.0917 3.4734 3.5135 3.5852 3.5938 3.6364 3.6677 3.7464 3.8201 3.9339 3.9438 4.0352 4.0419 4.4789 4.4805 4.5001 4.5897 4.6982 4.7185 4.7554 4.7621 4.8884 4.8966 5.1266 5.1295 5.3075 5.3682 5.7890 5.8014 5.8280 5.8919 6.0745 6.0919 7.0364 7.1252 8.4191 8.4764 8.5761 8.6056 9.9014 9.9463 10.0126 10.0263 10.4086 10.5227 10.6148 10.6365 k =-0.1023 0.1430 0.8595 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7288 -5.7263 -5.0617 -5.0596 -5.0227 -5.0197 -4.9734 -4.9674 -2.8297 -2.7820 -2.7642 -2.7394 -2.2294 -2.1478 -2.1256 -2.1119 -2.0992 -2.0864 -0.8439 -0.8403 1.0341 1.0520 1.3444 1.3574 2.3086 2.3144 2.4716 2.5059 3.0610 3.0918 3.4660 3.5028 3.5771 3.5857 3.6306 3.6628 3.7281 3.7946 3.9397 3.9397 4.0420 4.0478 4.4713 4.4733 4.4968 4.5921 4.6883 4.7062 4.7550 4.7622 4.8758 4.8828 5.1213 5.1263 5.3081 5.3748 5.7533 5.7636 5.7917 5.8635 6.0570 6.0758 7.0817 7.1779 8.4668 8.5142 8.6328 8.6859 9.8695 9.9113 9.9718 9.9725 10.4318 10.5719 10.6175 10.6402 k =-0.1151 0.1609 0.8595 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7303 -5.7277 -5.0688 -5.0675 -5.0172 -5.0148 -4.9730 -4.9668 -2.8353 -2.7831 -2.7638 -2.7380 -2.2376 -2.1495 -2.1255 -2.1121 -2.0988 -2.0864 -0.8258 -0.8209 1.0514 1.0734 1.3729 1.3880 2.2975 2.3062 2.4807 2.5170 3.0531 3.0915 3.4582 3.4846 3.5683 3.5773 3.6246 3.6561 3.7158 3.7687 3.9349 3.9453 4.0497 4.0538 4.4621 4.4673 4.4938 4.5942 4.6785 4.6917 4.7545 4.7620 4.8647 4.8710 5.1151 5.1224 5.3089 5.3809 5.7085 5.7320 5.7511 5.8339 6.0397 6.0592 7.1305 7.2329 8.5125 8.5525 8.6938 8.7686 9.8083 9.8447 9.9409 9.9569 10.4396 10.5878 10.6206 10.6565 k =-0.1279 0.1788 0.8595 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7322 -5.7295 -5.0769 -5.0761 -5.0111 -5.0091 -4.9722 -4.9659 -2.8403 -2.7842 -2.7634 -2.7370 -2.2450 -2.1514 -2.1253 -2.1124 -2.0984 -2.0865 -0.8079 -0.8013 1.0710 1.0977 1.4040 1.4214 2.2850 2.2967 2.4910 2.5288 3.0434 3.0910 3.4498 3.4575 3.5590 3.5691 3.6187 3.6496 3.7091 3.7431 3.9293 3.9507 4.0582 4.0601 4.4535 4.4608 4.4907 4.5964 4.6692 4.6755 4.7540 4.7616 4.8550 4.8615 5.1081 5.1179 5.3098 5.3865 5.6615 5.7010 5.7074 5.8036 6.0224 6.0422 7.1819 7.2896 8.5560 8.5913 8.7551 8.8490 9.7349 9.7754 9.9145 9.9390 10.4311 10.5718 10.6211 10.6727 k =-0.1279 0.1788 0.8595 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7322 -5.7295 -5.0769 -5.0761 -5.0111 -5.0091 -4.9722 -4.9659 -2.8403 -2.7842 -2.7634 -2.7370 -2.2450 -2.1514 -2.1253 -2.1124 -2.0984 -2.0865 -0.8079 -0.8013 1.0710 1.0977 1.4040 1.4214 2.2850 2.2967 2.4910 2.5288 3.0434 3.0910 3.4498 3.4575 3.5590 3.5691 3.6187 3.6496 3.7091 3.7431 3.9293 3.9507 4.0582 4.0601 4.4535 4.4608 4.4907 4.5964 4.6692 4.6755 4.7540 4.7616 4.8550 4.8615 5.1081 5.1179 5.3098 5.3865 5.6615 5.7010 5.7074 5.8036 6.0224 6.0422 7.1819 7.2896 8.5560 8.5913 8.7551 8.8490 9.7349 9.7754 9.9145 9.9390 10.4311 10.5718 10.6211 10.6727 k =-0.1377 0.1925 0.8427 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7342 -5.7315 -5.0834 -5.0829 -5.0089 -5.0058 -4.9690 -4.9627 -2.8439 -2.7855 -2.7627 -2.7365 -2.2502 -2.1533 -2.1249 -2.1126 -2.0981 -2.0867 -0.7946 -0.7864 1.0883 1.1194 1.4300 1.4493 2.2757 2.2896 2.4967 2.5381 3.0355 3.0917 3.4305 3.4426 3.5500 3.5627 3.6140 3.6460 3.7042 3.7265 3.9239 3.9546 4.0519 4.0762 4.4474 4.4558 4.4884 4.5980 4.6589 4.6657 4.7527 4.7616 4.8482 4.8556 5.0970 5.1170 5.3089 5.3889 5.6253 5.6731 5.6785 5.7817 6.0066 6.0283 7.2256 7.3366 8.5889 8.6230 8.8012 8.9070 9.6733 9.7214 9.8916 9.9254 10.4117 10.5497 10.6138 10.6611 k =-0.1475 0.2062 0.8258 ( 8910 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7370 -5.7343 -5.0899 -5.0895 -5.0106 -5.0061 -4.9610 -4.9550 -2.8472 -2.7874 -2.7616 -2.7357 -2.2551 -2.1560 -2.1243 -2.1126 -2.0974 -2.0868 -0.7818 -0.7716 1.1085 1.1447 1.4583 1.4797 2.2679 2.2838 2.4980 2.5465 3.0277 3.0947 3.3985 3.4336 3.5387 3.5550 3.6088 3.6441 3.6918 3.7196 3.9177 3.9573 4.0436 4.0904 4.4416 4.4512 4.4862 4.5997 4.6437 4.6609 4.7496 4.7620 4.8416 4.8514 5.0823 5.1151 5.3050 5.3878 5.5898 5.6389 5.6586 5.7635 5.9867 6.0134 7.2755 7.3893 8.6216 8.6568 8.8465 8.9603 9.6069 9.6624 9.8715 9.9153 10.3818 10.5221 10.5896 10.6498 k =-0.1573 0.2199 0.8090 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7404 -5.7377 -5.0963 -5.0959 -5.0143 -5.0092 -4.9498 -4.9445 -2.8503 -2.7900 -2.7604 -2.7348 -2.2596 -2.1593 -2.1239 -2.1126 -2.0963 -2.0868 -0.7696 -0.7572 1.1317 1.1732 1.4885 1.5121 2.2614 2.2792 2.4964 2.5528 3.0193 3.0999 3.3625 3.4228 3.5254 3.5451 3.6029 3.6427 3.6756 3.7196 3.9116 3.9585 4.0344 4.1016 4.4364 4.4468 4.4841 4.6011 4.6279 4.6575 4.7450 4.7620 4.8350 4.8493 5.0672 5.1105 5.2984 5.3832 5.5551 5.6050 5.6415 5.7487 5.9650 5.9979 7.3305 7.4465 8.6524 8.6905 8.8903 9.0075 9.5391 9.5990 9.8576 9.9082 10.3464 10.4865 10.5601 10.6459 k =-0.1670 0.2336 0.7922 ( 8917 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7444 -5.7416 -5.1026 -5.1022 -5.0189 -5.0136 -4.9371 -4.9325 -2.8531 -2.7929 -2.7591 -2.7336 -2.2635 -2.1631 -2.1237 -2.1123 -2.0949 -2.0866 -0.7583 -0.7432 1.1580 1.2049 1.5206 1.5464 2.2561 2.2758 2.4931 2.5565 3.0095 3.1064 3.3234 3.4104 3.5104 3.5324 3.5963 3.6377 3.6640 3.7219 3.9059 3.9582 4.0243 4.1097 4.4322 4.4427 4.4821 4.6003 4.6139 4.6552 4.7388 4.7613 4.8282 4.8496 5.0534 5.1044 5.2894 5.3749 5.5211 5.5714 5.6273 5.7364 5.9436 5.9828 7.3889 7.5069 8.6788 8.7211 8.9322 9.0473 9.4728 9.5336 9.8512 9.9057 10.3089 10.4432 10.5359 10.6413 k =-0.1768 0.2473 0.7753 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7487 -5.7459 -5.1086 -5.1082 -5.0238 -5.0185 -4.9237 -4.9198 -2.8555 -2.7961 -2.7581 -2.7322 -2.2668 -2.1671 -2.1239 -2.1118 -2.0932 -2.0863 -0.7478 -0.7299 1.1874 1.2395 1.5543 1.5823 2.2517 2.2735 2.4887 2.5578 2.9975 3.1137 3.2822 3.3964 3.4936 3.5166 3.5892 3.6246 3.6623 3.7255 3.9008 3.9570 4.0137 4.1143 4.4292 4.4389 4.4802 4.5899 4.6096 4.6538 4.7311 4.7594 4.8215 4.8524 5.0419 5.0983 5.2781 5.3633 5.4878 5.5384 5.6156 5.7247 5.9245 5.9689 7.4494 7.5692 8.6991 8.7453 8.9717 9.0788 9.4109 9.4694 9.8534 9.9089 10.2715 10.3966 10.5157 10.6333 k =-0.1866 0.2610 0.7585 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7532 -5.7505 -5.1145 -5.1139 -5.0287 -5.0235 -4.9102 -4.9068 -2.8576 -2.7996 -2.7573 -2.7306 -2.2695 -2.1713 -2.1245 -2.1114 -2.0913 -2.0857 -0.7383 -0.7173 1.2196 1.2768 1.5892 1.6193 2.2482 2.2724 2.4838 2.5568 2.9828 3.1207 3.2396 3.3811 3.4746 3.4980 3.5810 3.6088 3.6655 3.7298 3.8965 3.9550 4.0031 4.1155 4.4279 4.4354 4.4783 4.5744 4.6108 4.6533 4.7218 4.7562 4.8154 4.8579 5.0333 5.0938 5.2647 5.3484 5.4551 5.5058 5.6060 5.7122 5.9093 5.9568 7.5105 7.6319 8.7120 8.7599 9.0085 9.1019 9.3564 9.4098 9.8650 9.9187 10.2354 10.3505 10.4971 10.6213 k =-0.1964 0.2746 0.7417 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7578 -5.7552 -5.1200 -5.1194 -5.0336 -5.0285 -4.8968 -4.8938 -2.8592 -2.8031 -2.7568 -2.7288 -2.2716 -2.1755 -2.1252 -2.1109 -2.0891 -2.0849 -0.7297 -0.7056 1.2545 1.3165 1.6250 1.6572 2.2453 2.2721 2.4788 2.5540 2.9652 3.1261 3.1968 3.3647 3.4526 3.4774 3.5704 3.5951 3.6705 3.7346 3.8931 3.9527 3.9931 4.1132 4.4278 4.4331 4.4765 4.5585 4.6131 4.6532 4.7112 4.7515 4.8108 4.8656 5.0280 5.0923 5.2493 5.3304 5.4230 5.4740 5.5983 5.6980 5.8988 5.9472 7.5707 7.6933 8.7171 8.7626 9.0420 9.1170 9.3117 9.3583 9.8860 9.9353 10.2013 10.3068 10.4787 10.6059 k =-0.2062 0.2883 0.7248 ( 8925 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7625 -5.7600 -5.1252 -5.1246 -5.0382 -5.0334 -4.8837 -4.8811 -2.8605 -2.8068 -2.7565 -2.7270 -2.2731 -2.1799 -2.1260 -2.1107 -2.0870 -2.0838 -0.7222 -0.6947 1.2917 1.3582 1.6614 1.6954 2.2430 2.2727 2.4740 2.5499 2.9446 3.1256 3.1577 3.3475 3.4267 3.4558 3.5566 3.5854 3.6758 3.7398 3.8907 3.9504 3.9842 4.1078 4.4267 4.4341 4.4748 4.5432 4.6157 4.6535 4.7000 4.7451 4.8088 4.8753 5.0259 5.0941 5.2320 5.3098 5.3913 5.4428 5.5918 5.6823 5.8927 5.9400 7.6282 7.7516 8.7151 8.7530 9.0719 9.1245 9.2774 9.3180 9.9151 9.9574 10.1695 10.2672 10.4602 10.5876 k =-0.2160 0.3020 0.7080 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7671 -5.7647 -5.1301 -5.1295 -5.0425 -5.0381 -4.8713 -4.8689 -2.8612 -2.8104 -2.7564 -2.7251 -2.2739 -2.1843 -2.1269 -2.1105 -2.0849 -2.0825 -0.7156 -0.6849 1.3309 1.4014 1.6980 1.7335 2.2413 2.2739 2.4695 2.5449 2.9213 3.0994 3.1420 3.3296 3.3972 3.4337 3.5411 3.5787 3.6811 3.7450 3.8894 3.9482 3.9770 4.0996 4.4245 4.4388 4.4731 4.5287 4.6185 4.6538 4.6891 4.7373 4.8098 4.8868 5.0268 5.0989 5.2133 5.2869 5.3601 5.4125 5.5864 5.6660 5.8903 5.9353 7.6814 7.8047 8.7074 8.7342 9.0973 9.1255 9.2516 9.2929 9.9498 9.9824 10.1400 10.2337 10.4415 10.5674 k =-0.2258 0.3157 0.6912 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7715 -5.7692 -5.1345 -5.1340 -5.0465 -5.0424 -4.8597 -4.8573 -2.8617 -2.8142 -2.7564 -2.7232 -2.2742 -2.1887 -2.1278 -2.1104 -2.0830 -2.0809 -0.7099 -0.6760 1.3714 1.4456 1.7342 1.7710 2.2399 2.2755 2.4656 2.5393 2.8957 3.0577 3.1391 3.3114 3.3655 3.4107 3.5257 3.5737 3.6860 3.7501 3.8891 3.9464 3.9717 4.0895 4.4222 4.4457 4.4716 4.5152 4.6212 4.6540 4.6793 4.7290 4.8135 4.8996 5.0301 5.1061 5.1937 5.2625 5.3296 5.3830 5.5816 5.6501 5.8905 5.9326 7.7284 7.8505 8.6947 8.7124 9.1099 9.1316 9.2301 9.2845 9.9847 10.0057 10.1137 10.2100 10.4228 10.5460 k =-0.2356 0.3294 0.6743 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7756 -5.7735 -5.1386 -5.1381 -5.0502 -5.0465 -4.8490 -4.8465 -2.8617 -2.8179 -2.7566 -2.7215 -2.2739 -2.1930 -2.1286 -2.1105 -2.0814 -2.0792 -0.7051 -0.6681 1.4127 1.4900 1.7697 1.8072 2.2391 2.2773 2.4620 2.5337 2.8685 3.0145 3.1353 3.2929 3.3336 3.3867 3.5115 3.5697 3.6903 3.7549 3.8899 3.9449 3.9685 4.0782 4.4203 4.4537 4.4705 4.5028 4.6234 4.6539 4.6714 4.7209 4.8196 4.9136 5.0354 5.1141 5.1746 5.2373 5.2999 5.3545 5.5775 5.6353 5.8923 5.9316 7.7678 7.8871 8.6758 8.6959 9.1055 9.1522 9.2115 9.2887 10.0065 10.0219 10.0967 10.2020 10.4046 10.5239 k =-0.2454 0.3431 0.6575 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7794 -5.7774 -5.1422 -5.1417 -5.0535 -5.0501 -4.8392 -4.8366 -2.8614 -2.8216 -2.7568 -2.7199 -2.2732 -2.1973 -2.1294 -2.1106 -2.0799 -2.0775 -0.7011 -0.6612 1.4540 1.5337 1.8037 1.8415 2.2386 2.2791 2.4589 2.5284 2.8408 2.9714 3.1295 3.2743 3.3035 3.3616 3.4991 3.5664 3.6939 3.7591 3.8916 3.9440 3.9671 4.0665 4.4189 4.4602 4.4717 4.4919 4.6247 4.6537 4.6659 4.7136 4.8272 4.9285 5.0418 5.1200 5.1586 5.2126 5.2714 5.3271 5.5737 5.6221 5.8952 5.9318 7.7985 7.9134 8.6553 8.6854 9.1012 9.1726 9.1994 9.3004 10.0035 10.0161 10.1048 10.2118 10.3874 10.5017 k =-0.2552 0.3568 0.6407 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7828 -5.7810 -5.1454 -5.1450 -5.0564 -5.0534 -4.8306 -4.8278 -2.8607 -2.8252 -2.7570 -2.7185 -2.2722 -2.2012 -2.1300 -2.1107 -2.0785 -2.0759 -0.6978 -0.6552 1.4944 1.5755 1.8357 1.8734 2.2385 2.2807 2.4561 2.5237 2.8136 2.9291 3.1217 3.2553 3.2773 3.3360 3.4888 3.5636 3.6968 3.7627 3.8940 3.9438 3.9671 4.0550 4.4181 4.4607 4.4788 4.4829 4.6249 4.6537 4.6625 4.7076 4.8360 4.9441 5.0486 5.1175 5.1512 5.1897 5.2447 5.3011 5.5704 5.6108 5.8985 5.9327 7.8204 7.9294 8.6390 8.6782 9.1009 9.1734 9.2122 9.3167 9.9806 9.9927 10.1280 10.2332 10.3720 10.4797 k =-0.2650 0.3705 0.6238 ( 8901 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7857 -5.7841 -5.1481 -5.1477 -5.0588 -5.0562 -4.8232 -4.8202 -2.8597 -2.8286 -2.7572 -2.7173 -2.2709 -2.2050 -2.1306 -2.1109 -2.0772 -2.0744 -0.6952 -0.6503 1.5327 1.6141 1.8648 1.9022 2.2386 2.2817 2.4536 2.5197 2.7883 2.8883 3.1131 3.2362 3.2563 3.3110 3.4806 3.5614 3.6991 3.7655 3.8969 3.9442 3.9679 4.0442 4.4179 4.4572 4.4762 4.4886 4.6243 4.6539 4.6606 4.7031 4.8451 4.9603 5.0548 5.1068 5.1486 5.1721 5.2215 5.2767 5.5674 5.6015 5.9019 5.9339 7.8342 7.9366 8.6281 8.6734 9.1047 9.1638 9.2410 9.3367 9.9442 9.9665 10.1488 10.2578 10.3589 10.4585 k =-0.2748 0.3842 0.6070 ( 8900 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7882 -5.7867 -5.1504 -5.1500 -5.0608 -5.0586 -4.8170 -4.8139 -2.8584 -2.8319 -2.7575 -2.7163 -2.2695 -2.2083 -2.1311 -2.1110 -2.0761 -2.0733 -0.6932 -0.6463 1.5676 1.6481 1.8903 1.9275 2.2389 2.2821 2.4515 2.5168 2.7665 2.8499 3.1046 3.2181 3.2402 3.2877 3.4743 3.5596 3.7008 3.7677 3.8999 3.9451 3.9691 4.0346 4.4185 4.4517 4.4723 4.4981 4.6238 4.6539 4.6595 4.7001 4.8539 4.9766 5.0593 5.0958 5.1385 5.1616 5.2063 5.2547 5.5648 5.5940 5.9051 5.9353 7.8416 7.9372 8.6219 8.6700 9.1111 9.1553 9.2743 9.3598 9.9024 9.9380 10.1629 10.2802 10.3487 10.4387 k =-0.2846 0.3979 0.5902 ( 8902 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7901 -5.7888 -5.1521 -5.1519 -5.0624 -5.0605 -4.8121 -4.8089 -2.8570 -2.8349 -2.7576 -2.7155 -2.2681 -2.2112 -2.1315 -2.1111 -2.0751 -2.0724 -0.6917 -0.6432 1.5976 1.6761 1.9111 1.9485 2.2393 2.2816 2.4498 2.5149 2.7495 2.8152 3.0973 3.2025 3.2282 3.2676 3.4696 3.5581 3.7020 3.7693 3.9027 3.9463 3.9704 4.0267 4.4199 4.4454 4.4702 4.5064 4.6238 4.6535 4.6588 4.6984 4.8616 4.9925 5.0614 5.0879 5.1260 5.1481 5.2024 5.2357 5.5627 5.5884 5.9078 5.9366 7.8444 7.9340 8.6192 8.6675 9.1181 9.1486 9.3090 9.3851 9.8595 9.9093 10.1708 10.2983 10.3416 10.4209 k =-0.2944 0.4116 0.5733 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7915 -5.7903 -5.1534 -5.1532 -5.0634 -5.0619 -4.8086 -4.8053 -2.8557 -2.8374 -2.7578 -2.7149 -2.2670 -2.2134 -2.1318 -2.1112 -2.0745 -2.0718 -0.6907 -0.6410 1.6208 1.6969 1.9266 1.9646 2.2397 2.2806 2.4486 2.5138 2.7387 2.7861 3.0921 3.1905 3.2198 3.2521 3.4665 3.5571 3.7028 3.7703 3.9050 3.9475 3.9715 4.0207 4.4220 4.4393 4.4689 4.5128 4.6244 4.6526 4.6584 4.6976 4.8675 5.0069 5.0619 5.0828 5.1166 5.1320 5.2042 5.2208 5.5610 5.5845 5.9099 5.9375 7.8448 7.9297 8.6184 8.6656 9.1242 9.1439 9.3408 9.4101 9.8198 9.8838 10.1745 10.3112 10.3378 10.4062 k =-0.3041 0.4253 0.5565 ( 8903 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7924 -5.7912 -5.1541 -5.1540 -5.0641 -5.0627 -4.8064 -4.8031 -2.8546 -2.8392 -2.7579 -2.7146 -2.2662 -2.2148 -2.1319 -2.1113 -2.0740 -2.0714 -0.6901 -0.6397 1.6357 1.7095 1.9362 1.9749 2.2401 2.2796 2.4479 2.5133 2.7347 2.7648 3.0890 3.1828 3.2150 3.2421 3.4646 3.5565 3.7032 3.7709 3.9065 3.9484 3.9722 4.0170 4.4250 4.4338 4.4684 4.5167 4.6253 4.6518 4.6581 4.6973 4.8713 5.0175 5.0638 5.0778 5.1112 5.1195 5.2065 5.2113 5.5600 5.5821 5.9112 5.9382 7.8443 7.9263 8.6184 8.6644 9.1283 9.1409 9.3636 9.4300 9.7902 9.8657 10.1758 10.3180 10.3374 10.3959 k =-0.3139 0.4390 0.5397 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7926 -5.7915 -5.1543 -5.1543 -5.0643 -5.0630 -4.8057 -4.8023 -2.8542 -2.8399 -2.7579 -2.7145 -2.2660 -2.2153 -2.1320 -2.1113 -2.0739 -2.0713 -0.6899 -0.6392 1.6409 1.7138 1.9394 1.9784 2.2402 2.2792 2.4477 2.5132 2.7350 2.7559 3.0880 3.1801 3.2135 3.2387 3.4640 3.5563 3.7034 3.7711 3.9070 3.9487 3.9724 4.0157 4.4281 4.4298 4.4681 4.5181 4.6257 4.6514 4.6580 4.6972 4.8726 5.0214 5.0672 5.0733 5.1096 5.1148 5.2064 5.2089 5.5597 5.5814 5.9116 5.9384 7.8440 7.9251 8.6184 8.6640 9.1298 9.1398 9.3720 9.4379 9.7789 9.8591 10.1761 10.3198 10.3382 10.3920 k =-0.3139 0.4390 0.5397 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7926 -5.7915 -5.1543 -5.1543 -5.0643 -5.0630 -4.8057 -4.8023 -2.8542 -2.8399 -2.7579 -2.7145 -2.2660 -2.2153 -2.1320 -2.1113 -2.0739 -2.0713 -0.6899 -0.6392 1.6409 1.7138 1.9394 1.9784 2.2402 2.2792 2.4477 2.5132 2.7350 2.7559 3.0880 3.1801 3.2135 3.2387 3.4640 3.5563 3.7034 3.7711 3.9070 3.9487 3.9724 4.0157 4.4281 4.4298 4.4681 4.5181 4.6257 4.6514 4.6580 4.6972 4.8726 5.0214 5.0672 5.0733 5.1096 5.1148 5.2064 5.2089 5.5597 5.5814 5.9116 5.9384 7.8440 7.9251 8.6184 8.6640 9.1298 9.1398 9.3720 9.4379 9.7789 9.8591 10.1761 10.3198 10.3382 10.3920 k =-0.3041 0.4252 0.5228 ( 8917 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7937 -5.7926 -5.1402 -5.1401 -5.0753 -5.0740 -4.8054 -4.8020 -2.8568 -2.8441 -2.7555 -2.7136 -2.2664 -2.2205 -2.1303 -2.1109 -2.0717 -2.0699 -0.6781 -0.6315 1.6433 1.7012 1.9110 1.9491 2.2743 2.3056 2.4341 2.5061 2.7245 2.7373 3.0690 3.1662 3.1924 3.2144 3.4536 3.5564 3.7021 3.7788 3.8971 3.9340 3.9533 3.9983 4.4335 4.4356 4.4832 4.5103 4.6220 4.6519 4.6690 4.6949 4.8838 5.0158 5.0668 5.0858 5.1067 5.1229 5.2313 5.2427 5.5709 5.5961 5.9066 5.9336 7.8584 7.9411 8.6465 8.6839 9.1285 9.1374 9.4126 9.4741 9.9181 9.9887 10.2549 10.3797 10.4393 10.5103 k =-0.2943 0.4115 0.5059 ( 8915 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7969 -5.7960 -5.1258 -5.1257 -5.0838 -5.0824 -4.8050 -4.8017 -2.8586 -2.8477 -2.7529 -2.7129 -2.2660 -2.2252 -2.1286 -2.1104 -2.0696 -2.0685 -0.6700 -0.6281 1.6484 1.6890 1.8831 1.9210 2.3061 2.3130 2.4407 2.5058 2.7161 2.7173 3.0498 3.1483 3.1718 3.1896 3.4474 3.5572 3.7020 3.7861 3.8872 3.9220 3.9342 3.9833 4.4383 4.4410 4.4975 4.5046 4.6182 4.6527 4.6800 4.6931 4.8950 5.0008 5.0466 5.0868 5.1282 5.1547 5.2566 5.2821 5.5774 5.6066 5.8968 5.9237 7.8727 7.9558 8.6756 8.7037 9.1203 9.1278 9.4498 9.5068 10.0527 10.1085 10.3396 10.4470 10.5426 10.6263 k =-0.2845 0.3978 0.4891 ( 8917 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8024 -5.8016 -5.1114 -5.1109 -5.0896 -5.0878 -4.8047 -4.8014 -2.8597 -2.8506 -2.7503 -2.7125 -2.2649 -2.2296 -2.1268 -2.1100 -2.0678 -2.0671 -0.6656 -0.6290 1.6554 1.6769 1.8567 1.8943 2.3025 2.3318 2.4653 2.5152 2.6956 2.7111 3.0314 3.1266 3.1524 3.1655 3.4454 3.5584 3.7032 3.7927 3.8769 3.9127 3.9154 3.9701 4.4430 4.4461 4.4947 4.5168 4.6144 4.6536 4.6885 4.6935 4.9051 4.9800 5.0262 5.0923 5.1551 5.1918 5.2846 5.3239 5.5788 5.6125 5.8820 5.9088 7.8870 7.9690 8.7057 8.7240 9.1086 9.1149 9.4828 9.5353 10.1737 10.2055 10.4341 10.5220 10.6425 10.7347 k =-0.2747 0.3841 0.4722 ( 8931 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8102 -5.8096 -5.0987 -5.0959 -5.0924 -5.0884 -4.8044 -4.8012 -2.8599 -2.8528 -2.7477 -2.7122 -2.2630 -2.2334 -2.1251 -2.1096 -2.0661 -2.0659 -0.6650 -0.6341 1.6636 1.6647 1.8323 1.8694 2.2851 2.3491 2.4947 2.5360 2.6724 2.7118 3.0143 3.1016 3.1348 3.1430 3.4468 3.5602 3.7056 3.7985 3.8660 3.8970 3.9056 3.9582 4.4477 4.4510 4.4881 4.5332 4.6106 4.6549 4.6887 4.7016 4.9117 4.9572 5.0114 5.1016 5.1847 5.2314 5.3152 5.3679 5.5747 5.6134 5.8623 5.8888 7.9017 7.9808 8.7370 8.7453 9.0966 9.1017 9.5107 9.5587 10.2651 10.2651 10.5382 10.6100 10.7358 10.8285 k =-0.2649 0.3704 0.4553 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8204 -5.8199 -5.0937 -5.0925 -5.0807 -5.0784 -4.8040 -4.8009 -2.8594 -2.8544 -2.7449 -2.7121 -2.2604 -2.2369 -2.1233 -2.1092 -2.0646 -2.0646 -0.6680 -0.6432 1.6521 1.6721 1.8101 1.8465 2.2676 2.3585 2.5194 2.5659 2.6491 2.7214 2.9992 3.0746 3.1196 3.1227 3.4509 3.5625 3.7089 3.8029 3.8548 3.8797 3.9003 3.9473 4.4524 4.4556 4.4818 4.5495 4.6069 4.6564 4.6875 4.7101 4.9109 4.9343 5.0069 5.1136 5.2164 5.2726 5.3480 5.4135 5.5652 5.6092 5.8380 5.8643 7.9169 7.9914 8.7680 8.7692 9.0865 9.0907 9.5325 9.5763 10.2813 10.3091 10.6359 10.7182 10.8260 10.8984 k =-0.2551 0.3567 0.4385 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8328 -5.8325 -5.0902 -5.0897 -5.0654 -5.0639 -4.8037 -4.8007 -2.8579 -2.8552 -2.7422 -2.7122 -2.2572 -2.2399 -2.1216 -2.1088 -2.0634 -2.0633 -0.6747 -0.6562 1.6390 1.6797 1.7905 1.8260 2.2531 2.3629 2.5335 2.5900 2.6373 2.7427 2.9862 3.0474 3.1046 3.1076 3.4568 3.5651 3.7131 3.8051 3.8435 3.8642 3.8960 3.9371 4.4569 4.4602 4.4759 4.5655 4.6032 4.6581 4.6863 4.7172 4.9012 4.9121 5.0148 5.1278 5.2501 5.3146 5.3825 5.4602 5.5505 5.5998 5.8100 5.8362 7.9327 8.0009 8.7922 8.8021 9.0803 9.0833 9.5474 9.5873 10.2561 10.3011 10.6973 10.8432 10.9273 10.9346 k =-0.2453 0.3429 0.4216 ( 8925 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8473 -5.8470 -5.0847 -5.0844 -5.0500 -5.0487 -4.8033 -4.8005 -2.8557 -2.8553 -2.7394 -2.7124 -2.2533 -2.2424 -2.1199 -2.1084 -2.0623 -2.0622 -0.6847 -0.6727 1.6254 1.6851 1.7733 1.8078 2.2436 2.3650 2.5360 2.5763 2.6660 2.7751 2.9756 3.0219 3.0885 3.0994 3.4641 3.5681 3.7178 3.8032 3.8323 3.8521 3.8926 3.9277 4.4608 4.4646 4.4709 4.5809 4.5997 4.6600 4.6852 4.7227 4.8856 4.8910 5.0321 5.1441 5.2852 5.3564 5.4182 5.5052 5.5324 5.5853 5.7795 5.8062 7.9491 8.0095 8.8178 8.8351 9.0790 9.0807 9.5549 9.5913 10.1959 10.2502 10.7093 10.9200 10.9850 11.0395 k =-0.2355 0.3292 0.4048 ( 8913 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8634 -5.8633 -5.0769 -5.0766 -5.0347 -5.0335 -4.8030 -4.8004 -2.8547 -2.8527 -2.7367 -2.7128 -2.2488 -2.2445 -2.1183 -2.1079 -2.0613 -2.0612 -0.6980 -0.6925 1.6114 1.6875 1.7585 1.7920 2.2403 2.3663 2.5291 2.5478 2.7103 2.8145 2.9677 2.9999 3.0744 3.0955 3.4723 3.5712 3.7230 3.7953 3.8212 3.8451 3.8897 3.9189 4.4613 4.4690 4.4697 4.5955 4.5963 4.6621 4.6842 4.7265 4.8677 4.8711 5.0555 5.1626 5.3210 5.3956 5.4544 5.5034 5.5542 5.5662 5.7501 5.7771 7.9659 8.0169 8.8444 8.8677 9.0833 9.0834 9.5550 9.5881 10.1100 10.1686 10.6813 10.8784 11.1004 11.1059 k =-0.2256 0.3155 0.3879 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8810 -5.8810 -5.0671 -5.0668 -5.0194 -5.0183 -4.8027 -4.8003 -2.8534 -2.8490 -2.7341 -2.7133 -2.2461 -2.2437 -2.1169 -2.1075 -2.0607 -2.0602 -0.7152 -0.7143 1.5972 1.6863 1.7458 1.7782 2.2439 2.3677 2.5155 2.5162 2.7567 2.8554 2.9630 2.9843 3.0624 3.0963 3.4811 3.5745 3.7285 3.7820 3.8103 3.8421 3.8872 3.9111 4.4573 4.4732 4.4732 4.5930 4.6091 4.6643 4.6830 4.7285 4.8492 4.8526 5.0833 5.1833 5.3554 5.4267 5.4758 5.4910 5.5434 5.5886 5.7302 5.7542 7.9825 8.0231 8.8713 8.8993 9.0914 9.0932 9.5484 9.5782 10.0072 10.0670 10.6250 10.8049 11.0898 11.0991 k =-0.2158 0.3018 0.3710 ( 8927 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8999 -5.8998 -5.0555 -5.0552 -5.0042 -5.0032 -4.8023 -4.8002 -2.8515 -2.8447 -2.7316 -2.7139 -2.2472 -2.2381 -2.1155 -2.1070 -2.0602 -2.0594 -0.7405 -0.7332 1.5829 1.6816 1.7352 1.7661 2.2547 2.3696 2.4834 2.4972 2.8017 2.8885 2.9623 2.9824 3.0528 3.1022 3.4904 3.5777 3.7340 3.7655 3.7995 3.8403 3.8851 3.9049 4.4527 4.4773 4.4776 4.5898 4.6216 4.6665 4.6816 4.7287 4.8310 4.8355 5.1147 5.2066 5.3826 5.4401 5.4475 5.5144 5.5334 5.6004 5.7372 5.7451 7.9983 8.0273 8.8978 8.9291 9.1042 9.1078 9.5365 9.5629 9.8948 9.9536 10.5492 10.7121 11.0721 11.0830 k =-0.2060 0.2881 0.3542 ( 8941 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.9196 -5.9195 -5.0424 -5.0422 -4.9892 -4.9883 -4.8020 -4.8001 -2.8490 -2.8396 -2.7292 -2.7146 -2.2479 -2.2319 -2.1143 -2.1066 -2.0600 -2.0587 -0.7679 -0.7546 1.5688 1.6734 1.7266 1.7560 2.2719 2.3717 2.4503 2.4753 2.8422 2.9014 2.9673 3.0050 3.0456 3.1135 3.4999 3.5806 3.7395 3.7473 3.7891 3.8375 3.8835 3.9009 4.4481 4.4814 4.4822 4.5867 4.6328 4.6688 4.6800 4.7273 4.8135 4.8199 5.1492 5.2325 5.3828 5.4300 5.4322 5.4862 5.5755 5.5946 5.7558 5.7730 8.0121 8.0289 8.9228 8.9569 9.1205 9.1252 9.5217 9.5442 9.7789 9.8346 10.4601 10.6071 11.0523 11.0660 k =-0.1962 0.2743 0.3373 ( 8941 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.9399 -5.9397 -5.0281 -5.0279 -4.9744 -4.9736 -4.8017 -4.8000 -2.8458 -2.8339 -2.7270 -2.7154 -2.2479 -2.2251 -2.1132 -2.1061 -2.0600 -2.0581 -0.7973 -0.7782 1.5548 1.6619 1.7201 1.7481 2.2946 2.3734 2.4182 2.4511 2.8744 2.8994 2.9800 3.0395 3.0473 3.1308 3.5097 3.5832 3.7280 3.7446 3.7795 3.8326 3.8824 3.8997 4.4438 4.4853 4.4867 4.5838 4.6425 4.6711 4.6778 4.7244 4.7969 4.8057 5.1863 5.2608 5.3520 5.4020 5.4234 5.4512 5.5986 5.6218 5.7851 5.8223 8.0224 8.0266 8.9449 8.9819 9.1381 9.1428 9.5065 9.5246 9.6653 9.7159 10.3621 10.4950 11.0314 11.0496 k =-0.1864 0.2606 0.3204 ( 8945 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.9605 -5.9603 -5.0128 -5.0127 -4.9599 -4.9592 -4.8013 -4.8000 -2.8421 -2.8278 -2.7250 -2.7161 -2.2474 -2.2178 -2.1122 -2.1055 -2.0601 -2.0577 -0.8281 -0.8036 1.5408 1.6474 1.7159 1.7433 2.3212 2.3682 2.3938 2.4254 2.8934 2.8964 3.0007 3.0385 3.0932 3.1547 3.5197 3.5850 3.7080 3.7478 3.7719 3.8254 3.8820 3.9013 4.4397 4.4891 4.4911 4.5810 4.6505 4.6734 4.6749 4.7200 4.7815 4.7930 5.2251 5.2885 5.3154 5.3641 5.3972 5.4115 5.6233 5.6700 5.8271 5.8768 8.0190 8.0275 8.9620 9.0035 9.1529 9.1566 9.4900 9.5069 9.5613 9.6076 10.2581 10.3786 11.0099 11.0346 k =-0.1766 0.2469 0.3036 ( 8949 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.9811 -5.9809 -4.9970 -4.9969 -4.9457 -4.9453 -4.8010 -4.8000 -2.8379 -2.8211 -2.7231 -2.7169 -2.2462 -2.2100 -2.1113 -2.1048 -2.0605 -2.0575 -0.8602 -0.8306 1.5269 1.6301 1.7143 1.7418 2.3434 2.3487 2.3902 2.4006 2.8870 2.9101 3.0262 3.0393 3.1414 3.1852 3.5300 3.5858 3.6874 3.7462 3.7695 3.8164 3.8828 3.9052 4.4360 4.4928 4.4954 4.5784 4.6564 4.6711 4.6758 4.7145 4.7673 4.7818 5.2607 5.2655 5.3241 5.3243 5.3633 5.3707 5.6620 5.7192 5.8769 5.9340 8.0046 8.0253 8.9699 9.0208 9.1579 9.1592 9.4510 9.4776 9.4949 9.5428 10.1504 10.2600 10.9882 11.0210 k =-0.1668 0.2332 0.2867 ( 8945 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0016 -6.0013 -4.9808 -4.9807 -4.9319 -4.9317 -4.8006 -4.8000 -2.8332 -2.8141 -2.7215 -2.7177 -2.2443 -2.2017 -2.1106 -2.1040 -2.0610 -2.0575 -0.8931 -0.8590 1.5131 1.6108 1.7155 1.7439 2.3126 2.3585 2.3939 2.3946 2.8808 2.9188 3.0428 3.0524 3.1889 3.2214 3.5407 3.5854 3.6667 3.7398 3.7725 3.8063 3.8850 3.9109 4.4326 4.4965 4.4996 4.5759 4.6601 4.6658 4.6783 4.7079 4.7544 4.7722 5.2216 5.2557 5.3036 5.3066 5.3469 5.3757 5.7076 5.7690 5.9315 5.9924 7.9818 8.0135 8.9598 9.0339 9.1358 9.1480 9.3927 9.4306 9.4887 9.5367 10.0407 10.1407 10.9667 11.0089 k =-0.1570 0.2195 0.2698 ( 8941 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0218 -6.0214 -4.9644 -4.9643 -4.9187 -4.9186 -4.8002 -4.8000 -2.8281 -2.8069 -2.7200 -2.7184 -2.2418 -2.1929 -2.1099 -2.1031 -2.0616 -2.0576 -0.9265 -0.8884 1.4991 1.5902 1.7198 1.7493 2.2816 2.3364 2.3993 2.4210 2.8747 2.9244 3.0492 3.0776 3.2345 3.2615 3.5514 3.5836 3.6464 3.7319 3.7775 3.7957 3.8892 3.9182 4.4296 4.4999 4.5036 4.5735 4.6587 4.6616 4.6808 4.7008 4.7428 4.7642 5.1761 5.2115 5.2579 5.2720 5.3804 5.4155 5.7569 5.8191 5.9892 6.0516 7.9496 7.9905 8.9189 9.0409 9.0757 9.1350 9.3673 9.4207 9.4909 9.5523 9.9305 10.0220 10.9452 10.9972 k =-0.1472 0.2058 0.2530 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0414 -6.0410 -4.9482 -4.9479 -4.9062 -4.9058 -4.8000 -4.7998 -2.8227 -2.7994 -2.7191 -2.7188 -2.2384 -2.1837 -2.1094 -2.1022 -2.0624 -2.0579 -0.9602 -0.9185 1.4851 1.5689 1.7274 1.7578 2.2515 2.3101 2.4059 2.4516 2.8681 2.9274 3.0584 3.1015 3.2774 3.3033 3.5613 3.5801 3.6284 3.7245 3.7835 3.7852 3.8956 3.9267 4.4269 4.5033 4.5074 4.5712 4.6498 4.6612 4.6828 4.6930 4.7325 4.7578 5.1303 5.1632 5.2109 5.2293 5.4298 5.4606 5.8084 5.8692 6.0488 6.1109 7.9074 7.9550 8.8465 8.9738 9.0616 9.1346 9.3739 9.4330 9.5014 9.5765 9.8215 9.9051 10.9238 10.9839 k =-0.1373 0.1920 0.2361 ( 8927 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -6.0603 -6.0599 -4.9322 -4.9318 -4.8943 -4.8935 -4.8000 -4.7994 -2.8170 -2.7920 -2.7197 -2.7179 -2.2343 -2.1743 -2.1090 -2.1010 -2.0633 -2.0584 -0.9937 -0.9492 1.4712 1.5475 1.7382 1.7693 2.2227 2.2840 2.4135 2.4814 2.8602 2.9277 3.0703 3.1242 3.3167 3.3445 3.5654 3.5751 3.6183 3.7182 3.7751 3.7902 3.9044 3.9363 4.4247 4.5065 4.5110 4.5691 4.6391 4.6590 4.6838 4.6845 4.7235 4.7530 5.0846 5.1160 5.1652 5.1862 5.4838 5.5093 5.8612 5.9190 6.1095 6.1699 7.8553 7.9068 8.7566 8.8708 9.0765 9.1468 9.3962 9.4524 9.5198 9.6036 9.7162 9.7924 10.9022 10.9625 k =-0.1275 0.1783 0.2192 ( 8931 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.0784 -6.0780 -4.9167 -4.9161 -4.8831 -4.8818 -4.8000 -4.7989 -2.8110 -2.7847 -2.7203 -2.7172 -2.2295 -2.1645 -2.1087 -2.0997 -2.0644 -2.0592 -1.0269 -0.9801 1.4575 1.5263 1.7523 1.7834 2.1952 2.2590 2.4221 2.5094 2.8504 2.9250 3.0843 3.1455 3.3515 3.3833 3.5571 3.5685 3.6240 3.7137 3.7660 3.7983 3.9156 3.9469 4.4228 4.5095 4.5144 4.5671 4.6269 4.6555 4.6747 4.6838 4.7159 4.7498 5.0397 5.0712 5.1219 5.1440 5.5411 5.5614 5.9146 5.9683 6.1704 6.2282 7.7941 7.8469 8.6607 8.7651 9.0975 9.1676 9.4247 9.4653 9.5444 9.6173 9.6220 9.6983 10.8779 10.9031 k =-0.1177 0.1646 0.2024 ( 8943 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.0955 -6.0952 -4.9017 -4.9011 -4.8726 -4.8708 -4.7999 -4.7983 -2.8050 -2.7776 -2.7207 -2.7167 -2.2239 -2.1547 -2.1086 -2.0983 -2.0655 -2.0600 -1.0594 -1.0109 1.4441 1.5058 1.7695 1.7998 2.1694 2.2356 2.4318 2.5350 2.8382 2.9189 3.0997 3.1652 3.3813 3.4174 3.5411 3.5609 3.6420 3.7114 3.7583 3.8090 3.9289 3.9583 4.4214 4.5122 4.5175 4.5652 4.6135 4.6507 4.6635 4.6824 4.7097 4.7479 4.9961 5.0297 5.0813 5.1033 5.6011 5.6165 5.9682 6.0168 6.2311 6.2853 7.7249 7.7766 8.5646 8.6615 9.1243 9.1947 9.4429 9.4542 9.5504 9.5558 9.5822 9.6894 10.8200 10.8602 k =-0.1079 0.1509 0.1855 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1116 -6.1113 -4.8876 -4.8867 -4.8629 -4.8605 -4.7998 -4.7977 -2.7989 -2.7708 -2.7210 -2.7164 -2.2174 -2.1447 -2.1086 -2.0966 -2.0667 -2.0610 -1.0908 -1.0414 1.4313 1.4861 1.7897 1.8181 2.1453 2.2142 2.4426 2.5581 2.8233 2.9091 3.1157 3.1828 3.4057 3.4451 3.5236 3.5530 3.6665 3.7111 3.7526 3.8235 3.9439 3.9704 4.4205 4.5149 4.5204 4.5635 4.5992 4.6448 4.6507 4.6797 4.7048 4.7471 4.9543 4.9921 5.0438 5.0646 5.6634 5.6741 6.0218 6.0643 6.2909 6.3409 7.6493 7.6979 8.4715 8.5620 9.1561 9.2253 9.3705 9.4460 9.4884 9.5546 9.6092 9.7156 10.7488 10.8096 k =-0.0981 0.1372 0.1686 ( 8937 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1266 -6.1263 -4.8743 -4.8733 -4.8540 -4.8510 -4.7996 -4.7969 -2.7928 -2.7645 -2.7212 -2.7164 -2.2103 -2.1350 -2.1087 -2.0947 -2.0680 -2.0622 -1.1208 -1.0714 1.4191 1.4675 1.8125 1.8379 2.1231 2.1951 2.4545 2.5785 2.8054 2.8955 3.1309 3.1977 3.4247 3.4651 3.5080 3.5457 3.6941 3.7125 3.7504 3.8430 3.9602 3.9831 4.4201 4.5171 4.5229 4.5620 4.5844 4.6365 4.6380 4.6757 4.7007 4.7471 4.9148 4.9586 5.0096 5.0282 5.7276 5.7337 6.0752 6.1108 6.3490 6.3943 7.5685 7.6127 8.3834 8.4678 9.1904 9.2444 9.2996 9.3523 9.5114 9.5660 9.6372 9.7430 10.6831 10.7609 k =-0.0883 0.1235 0.1518 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -6.1404 -6.1401 -4.8621 -4.8609 -4.8460 -4.8422 -4.7993 -4.7960 -2.7867 -2.7588 -2.7213 -2.7164 -2.2026 -2.1258 -2.1088 -2.0926 -2.0693 -2.0633 -1.1490 -1.1004 1.4077 1.4501 1.8377 1.8584 2.1030 2.1787 2.4675 2.5962 2.7849 2.8780 3.1443 3.2095 3.4380 3.4768 3.4963 3.5402 3.7147 3.7169 3.7582 3.8678 3.9771 3.9960 4.4202 4.5191 4.5252 4.5607 4.5694 4.6211 4.6301 4.6704 4.6975 4.7477 4.8782 4.9291 4.9787 4.9946 5.7929 5.7946 6.1284 6.1564 6.4049 6.4452 7.4840 7.5228 8.3013 8.3798 9.1835 9.2121 9.2767 9.3126 9.5320 9.5789 9.6607 9.7676 10.6236 10.7081 k =-0.0785 0.1097 0.1349 ( 8925 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1528 -6.1526 -4.8511 -4.8497 -4.8389 -4.8344 -4.7988 -4.7949 -2.7809 -2.7538 -2.7212 -2.7166 -2.1943 -2.1176 -2.1086 -2.0902 -2.0706 -2.0644 -1.1752 -1.1283 1.3973 1.4341 1.8646 1.8789 2.0851 2.1653 2.4816 2.6111 2.7620 2.8570 3.1550 3.2177 3.4448 3.4812 3.4913 3.5374 3.7171 3.7250 3.7850 3.8971 3.9944 4.0089 4.4209 4.5206 4.5273 4.5546 4.5599 4.6047 4.6214 4.6636 4.6951 4.7487 4.8450 4.9033 4.9511 4.9640 5.8557 5.8585 6.1815 6.2012 6.4579 6.4928 7.3970 7.4297 8.2264 8.2987 9.1045 9.1556 9.2872 9.3498 9.5471 9.5904 9.6781 9.7877 10.5705 10.6483 k =-0.0687 0.0960 0.1181 ( 8917 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1640 -6.1637 -4.8414 -4.8399 -4.8324 -4.8275 -4.7980 -4.7937 -2.7752 -2.7496 -2.7210 -2.7169 -2.1858 -2.1132 -2.1056 -2.0876 -2.0719 -2.0654 -1.1988 -1.1546 1.3881 1.4195 1.8926 1.8985 2.0699 2.1552 2.4964 2.6234 2.7375 2.8328 3.1627 3.2222 3.4458 3.4802 3.4934 3.5370 3.7191 3.7260 3.8218 3.9291 4.0114 4.0215 4.4223 4.5207 4.5289 4.5412 4.5594 4.5876 4.6119 4.6552 4.6934 4.7499 4.8157 4.8807 4.9269 4.9370 5.9159 5.9230 6.2352 6.2461 6.5071 6.5368 7.3083 7.3346 8.1594 8.2250 9.0305 9.0784 9.3259 9.3882 9.5564 9.5999 9.6894 9.8025 10.5233 10.5908 k =-0.0589 0.0823 0.1012 ( 8907 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1737 -6.1735 -4.8332 -4.8321 -4.8263 -4.8216 -4.7968 -4.7924 -2.7698 -2.7463 -2.7207 -2.7172 -2.1770 -2.1133 -2.0995 -2.0848 -2.0732 -2.0662 -1.2196 -1.1791 1.3801 1.4065 1.9163 1.9204 2.0579 2.1483 2.5120 2.6329 2.7124 2.8063 3.1674 3.2229 3.4444 3.4764 3.4996 3.5379 3.7207 3.7257 3.8618 3.9616 4.0277 4.0334 4.4243 4.5163 4.5301 4.5324 4.5595 4.5707 4.6014 4.6452 4.6925 4.7509 4.7910 4.8606 4.9062 4.9139 5.9734 5.9845 6.2902 6.2924 6.5519 6.5763 7.2189 7.2387 8.1010 8.1594 8.9642 9.0067 9.3666 9.4244 9.5602 9.6072 9.6957 9.8116 10.4820 10.5385 k =-0.0491 0.0686 0.0843 ( 8919 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1820 -6.1819 -4.8267 -4.8266 -4.8202 -4.8166 -4.7952 -4.7909 -2.7648 -2.7440 -2.7203 -2.7175 -2.1684 -2.1147 -2.0938 -2.0819 -2.0745 -2.0667 -1.2372 -1.2014 1.3734 1.3950 1.9316 1.9459 2.0508 2.1444 2.5279 2.6396 2.6880 2.7782 3.1700 3.2203 3.4433 3.4717 3.5073 3.5391 3.7219 3.7253 3.9024 3.9922 4.0430 4.0441 4.4271 4.5060 4.5293 4.5308 4.5548 4.5603 4.5901 4.6335 4.6925 4.7505 4.7723 4.8426 4.8890 4.8949 6.0263 6.0406 6.3418 6.3476 6.5915 6.6110 7.1294 7.1427 8.0516 8.1021 8.9068 8.9432 9.4061 9.4558 9.5599 9.6122 9.6995 9.8152 10.4466 10.4924 k =-0.0392 0.0549 0.0675 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1889 -6.1887 -4.8229 -4.8219 -4.8146 -4.8125 -4.7932 -4.7896 -2.7602 -2.7427 -2.7199 -2.7177 -2.1601 -2.1169 -2.0892 -2.0790 -2.0757 -2.0669 -1.2512 -1.2211 1.3682 1.3853 1.9439 1.9654 2.0513 2.1423 2.5439 2.6432 2.6661 2.7500 3.1716 3.2152 3.4433 3.4669 3.5149 3.5402 3.7228 3.7249 3.9420 4.0184 4.0535 4.0568 4.4307 4.4943 4.5258 4.5307 4.5434 4.5618 4.5781 4.6209 4.6935 4.7444 4.7638 4.8264 4.8753 4.8799 6.0727 6.0883 6.3966 6.4086 6.6252 6.6401 7.0404 7.0474 8.0118 8.0535 8.8593 8.8892 9.4427 9.4802 9.5570 9.6147 9.7042 9.8134 10.4175 10.4532 k =-0.0294 0.0412 0.0506 ( 8927 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1942 -6.1941 -4.8202 -4.8189 -4.8101 -4.8090 -4.7912 -4.7883 -2.7559 -2.7423 -2.7194 -2.7178 -2.1521 -2.1197 -2.0858 -2.0772 -2.0757 -2.0670 -1.2614 -1.2380 1.3645 1.3772 1.9534 1.9752 2.0618 2.1403 2.5596 2.6394 2.6528 2.7229 3.1733 3.2082 3.4443 3.4625 3.5221 3.5408 3.7234 3.7248 3.9793 4.0386 4.0609 4.0680 4.4353 4.4831 4.5187 4.5296 4.5393 4.5643 4.5657 4.6083 4.6956 4.7338 4.7641 4.8118 4.8651 4.8687 6.1108 6.1253 6.4584 6.4740 6.6524 6.6632 6.9523 6.9534 7.9819 8.0140 8.8225 8.8453 9.4746 9.4968 9.5540 9.6132 9.7132 9.8069 10.3951 10.4213 k =-0.0196 0.0274 0.0337 ( 8935 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1980 -6.1980 -4.8184 -4.8172 -4.8068 -4.8064 -4.7893 -4.7874 -2.7522 -2.7429 -2.7190 -2.7180 -2.1448 -2.1232 -2.0835 -2.0782 -2.0731 -2.0672 -1.2676 -1.2515 1.3624 1.3708 1.9606 1.9770 2.0795 2.1364 2.5745 2.6260 2.6523 2.6985 3.1760 3.2005 3.4462 3.4584 3.5283 3.5407 3.7239 3.7247 4.0124 4.0523 4.0661 4.0744 4.4408 4.4728 4.5124 4.5265 4.5391 4.5546 4.5678 4.5969 4.6987 4.7238 4.7674 4.7991 4.8583 4.8608 6.1395 6.1506 6.5276 6.5441 6.6725 6.6798 6.8614 6.8659 7.9620 7.9840 8.7969 8.8123 9.4988 9.5065 9.5549 9.6065 9.7275 9.7960 10.3799 10.3971 k =-0.0098 0.0137 0.0169 ( 8945 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2003 -6.2003 -4.8172 -4.8165 -4.8049 -4.8048 -4.7879 -4.7870 -2.7490 -2.7443 -2.7187 -2.7181 -2.1383 -2.1275 -2.0818 -2.0793 -2.0707 -2.0678 -1.2697 -1.2615 1.3620 1.3662 1.9663 1.9748 2.0989 2.1285 2.5883 2.6130 2.6561 2.6786 3.1801 3.1927 3.4486 3.4548 3.5333 3.5394 3.7242 3.7245 4.0394 4.0598 4.0689 4.0740 4.4473 4.4634 4.5108 4.5207 4.5404 4.5469 4.5727 4.5871 4.7031 4.7155 4.7726 4.7884 4.8546 4.8559 6.1581 6.1641 6.6036 6.6183 6.6850 6.6897 6.7722 6.7818 7.9524 7.9635 8.7830 8.7907 9.5110 9.5116 9.5643 9.5948 9.7453 9.7814 10.3723 10.3808 k = 0.0000 0.0000 0.0000 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2011 -6.2011 -4.8165 -4.8165 -4.8042 -4.8042 -4.7871 -4.7871 -2.7463 -2.7463 -2.7183 -2.7183 -2.1325 -2.1325 -2.0805 -2.0805 -2.0689 -2.0689 -1.2676 -1.2676 1.3632 1.3632 1.9710 1.9710 2.1159 2.1159 2.6009 2.6009 2.6644 2.6644 3.1857 3.1857 3.4515 3.4515 3.5370 3.5370 3.7244 3.7244 4.0572 4.0572 4.0702 4.0702 4.4549 4.4549 4.5143 4.5143 4.5427 4.5427 4.5791 4.5791 4.7086 4.7086 4.7795 4.7795 4.8538 4.8538 6.1665 6.1665 6.6823 6.6823 6.6858 6.6858 6.7072 6.7072 7.9529 7.9529 8.7809 8.7809 9.5135 9.5135 9.5797 9.5797 9.7641 9.7641 10.3725 10.3725 k = 0.0000 0.0000 0.0000 ( 8933 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2011 -6.2011 -4.8165 -4.8165 -4.8042 -4.8042 -4.7871 -4.7871 -2.7463 -2.7463 -2.7183 -2.7183 -2.1325 -2.1325 -2.0805 -2.0805 -2.0689 -2.0689 -1.2676 -1.2676 1.3632 1.3632 1.9710 1.9710 2.1159 2.1159 2.6009 2.6009 2.6644 2.6644 3.1857 3.1857 3.4515 3.4515 3.5370 3.5370 3.7244 3.7244 4.0572 4.0572 4.0702 4.0702 4.4549 4.4549 4.5143 4.5143 4.5427 4.5427 4.5791 4.5791 4.7086 4.7086 4.7795 4.7795 4.8538 4.8538 6.1665 6.1665 6.6823 6.6823 6.6858 6.6858 6.7072 6.7072 7.9529 7.9529 8.7809 8.7809 9.5135 9.5135 9.5797 9.5797 9.7641 9.7641 10.3725 10.3725 k = 0.0192 0.0138-0.0000 ( 8941 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.2003 -6.2003 -4.8173 -4.8173 -4.8042 -4.8042 -4.7879 -4.7879 -2.7464 -2.7464 -2.7185 -2.7185 -2.1325 -2.1325 -2.0806 -2.0806 -2.0691 -2.0691 -1.2666 -1.2666 1.3632 1.3632 1.9725 1.9725 2.1163 2.1163 2.6017 2.6017 2.6650 2.6650 3.1875 3.1875 3.4519 3.4519 3.5366 3.5366 3.7231 3.7231 4.0564 4.0564 4.0732 4.0732 4.4552 4.4552 4.5143 4.5143 4.5430 4.5430 4.5793 4.5793 4.7088 4.7088 4.7796 4.7796 4.8539 4.8539 6.1586 6.1586 6.6028 6.6028 6.7004 6.7004 6.7732 6.7732 7.9534 7.9534 8.7841 8.7841 9.5134 9.5134 9.5714 9.5714 9.7578 9.7578 10.3760 10.3760 k = 0.0385 0.0275-0.0000 ( 8945 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1980 -6.1980 -4.8199 -4.8199 -4.8043 -4.8043 -4.7898 -4.7898 -2.7467 -2.7467 -2.7189 -2.7189 -2.1328 -2.1328 -2.0808 -2.0808 -2.0696 -2.0696 -1.2637 -1.2637 1.3632 1.3632 1.9765 1.9765 2.1181 2.1181 2.6040 2.6040 2.6667 2.6667 3.1926 3.1926 3.4531 3.4531 3.5353 3.5353 3.7194 3.7194 4.0557 4.0557 4.0807 4.0807 4.4563 4.4563 4.5143 4.5143 4.5442 4.5442 4.5798 4.5798 4.7092 4.7092 4.7796 4.7796 4.8541 4.8541 6.1351 6.1351 6.5279 6.5279 6.6886 6.6886 6.8635 6.8635 7.9548 7.9548 8.7935 8.7935 9.5124 9.5124 9.5463 9.5463 9.7410 9.7410 10.3842 10.3842 k = 0.0577 0.0413-0.0000 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1941 -6.1941 -4.8247 -4.8247 -4.8044 -4.8044 -4.7924 -4.7924 -2.7470 -2.7470 -2.7197 -2.7197 -2.1332 -2.1332 -2.0812 -2.0812 -2.0704 -2.0704 -1.2590 -1.2590 1.3635 1.3635 1.9816 1.9816 2.1225 2.1225 2.6077 2.6077 2.6695 2.6695 3.2009 3.2009 3.4551 3.4551 3.5332 3.5332 3.7132 3.7132 4.0565 4.0565 4.0911 4.0911 4.4580 4.4580 4.5144 4.5144 4.5463 4.5463 4.5806 4.5806 4.7100 4.7100 4.7794 4.7794 4.8548 4.8548 6.0963 6.0963 6.4615 6.4615 6.6691 6.6691 6.9552 6.9552 7.9572 7.9572 8.8092 8.8092 9.5028 9.5029 9.5101 9.5101 9.7164 9.7164 10.3927 10.3927 k = 0.0769 0.0550-0.0000 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1886 -6.1886 -4.8325 -4.8325 -4.8046 -4.8046 -4.7948 -4.7948 -2.7474 -2.7474 -2.7207 -2.7207 -2.1336 -2.1336 -2.0817 -2.0817 -2.0714 -2.0714 -1.2526 -1.2526 1.3646 1.3646 1.9858 1.9858 2.1312 2.1312 2.6128 2.6128 2.6734 2.6734 3.2120 3.2120 3.4580 3.4580 3.5302 3.5302 3.7047 3.7047 4.0590 4.0590 4.1039 4.1039 4.4605 4.4605 4.5145 4.5145 4.5491 4.5491 4.5815 4.5815 4.7112 4.7112 4.7786 4.7786 4.8564 4.8564 6.0439 6.0439 6.4036 6.4036 6.6424 6.6424 7.0468 7.0468 7.9607 7.9607 8.8312 8.8312 9.4470 9.4470 9.5003 9.5003 9.6849 9.6849 10.3961 10.3961 k = 0.0962 0.0688-0.0000 ( 8901 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1816 -6.1816 -4.8436 -4.8436 -4.8048 -4.8048 -4.7968 -4.7968 -2.7480 -2.7480 -2.7219 -2.7219 -2.1343 -2.1343 -2.0825 -2.0825 -2.0727 -2.0727 -1.2447 -1.2447 1.3669 1.3669 1.9869 1.9869 2.1460 2.1460 2.6192 2.6192 2.6784 2.6784 3.2254 3.2254 3.4619 3.4619 3.5264 3.5264 3.6941 3.6941 4.0633 4.0633 4.1188 4.1188 4.4635 4.4635 4.5144 4.5144 4.5529 4.5529 4.5824 4.5824 4.7126 4.7126 4.7769 4.7769 4.8594 4.8594 5.9811 5.9811 6.3524 6.3524 6.6093 6.6093 7.1367 7.1367 7.9652 7.9652 8.8594 8.8594 9.3798 9.3798 9.4825 9.4825 9.6447 9.6447 10.3909 10.3909 k = 0.1154 0.0825-0.0000 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1732 -6.1732 -4.8578 -4.8578 -4.8051 -4.8051 -4.7983 -4.7983 -2.7488 -2.7488 -2.7234 -2.7234 -2.1350 -2.1350 -2.0835 -2.0835 -2.0741 -2.0741 -1.2355 -1.2355 1.3708 1.3708 1.9840 1.9840 2.1675 2.1675 2.6268 2.6268 2.6845 2.6845 3.2407 3.2407 3.4668 3.4668 3.5218 3.5218 3.6815 3.6815 4.0693 4.0693 4.1357 4.1357 4.4672 4.4672 4.5142 4.5142 4.5575 4.5575 4.5830 4.5830 4.7144 4.7144 4.7740 4.7740 4.8641 4.8641 5.9118 5.9118 6.3052 6.3052 6.5703 6.5703 7.2236 7.2236 7.9707 7.9707 8.8938 8.8938 9.3063 9.3063 9.4525 9.4525 9.5933 9.5933 10.3762 10.3762 k = 0.1346 0.0963-0.0000 ( 8885 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1632 -6.1632 -4.8748 -4.8748 -4.8054 -4.8054 -4.7994 -4.7994 -2.7496 -2.7496 -2.7249 -2.7249 -2.1357 -2.1357 -2.0847 -2.0847 -2.0755 -2.0755 -1.2254 -1.2254 1.3770 1.3770 1.9772 1.9772 2.1950 2.1950 2.6354 2.6354 2.6917 2.6917 3.2572 3.2572 3.4726 3.4726 3.5164 3.5164 3.6672 3.6672 4.0769 4.0769 4.1544 4.1544 4.4715 4.4715 4.5138 4.5138 4.5630 4.5630 4.5832 4.5832 4.7167 4.7167 4.7702 4.7702 4.8710 4.8710 5.8391 5.8391 6.2601 6.2601 6.5264 6.5264 7.3063 7.3063 7.9772 7.9772 8.9342 8.9342 9.2305 9.2305 9.4083 9.4083 9.5301 9.5301 10.3541 10.3541 k = 0.1538 0.1100-0.0000 ( 8881 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1519 -6.1519 -4.8944 -4.8944 -4.8057 -4.8057 -4.8003 -4.8003 -2.7505 -2.7505 -2.7266 -2.7266 -2.1365 -2.1365 -2.0861 -2.0861 -2.0770 -2.0770 -1.2146 -1.2146 1.3857 1.3857 1.9674 1.9674 2.2274 2.2274 2.6449 2.6449 2.6997 2.6997 3.2742 3.2742 3.4790 3.4790 3.5104 3.5104 3.6517 3.6517 4.0860 4.0860 4.1745 4.1745 4.4763 4.4763 4.5131 4.5131 4.5692 4.5692 4.5826 4.5826 4.7193 4.7193 4.7657 4.7657 4.8800 4.8800 5.7655 5.7655 6.2155 6.2155 6.4783 6.4783 7.3835 7.3835 7.9846 7.9846 8.9799 8.9799 9.1557 9.1557 9.3500 9.3500 9.4559 9.4559 10.3262 10.3262 k = 0.1731 0.1238-0.0000 ( 8881 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1392 -6.1392 -4.9162 -4.9162 -4.8060 -4.8060 -4.8010 -4.8010 -2.7516 -2.7516 -2.7285 -2.7285 -2.1373 -2.1373 -2.0878 -2.0878 -2.0784 -2.0784 -1.2034 -1.2034 1.3974 1.3974 1.9554 1.9554 2.2634 2.2634 2.6552 2.6552 2.7086 2.7086 3.2911 3.2911 3.4839 3.4839 3.5058 3.5058 3.6356 3.6356 4.0963 4.0963 4.1961 4.1961 4.4818 4.4818 4.5119 4.5119 4.5750 4.5750 4.5818 4.5818 4.7225 4.7225 4.7611 4.7611 4.8912 4.8912 5.6929 5.6929 6.1707 6.1707 6.4268 6.4268 7.4540 7.4540 7.9927 7.9927 9.0256 9.0256 9.0893 9.0893 9.2797 9.2797 9.3731 9.3731 10.2928 10.2928 k = 0.1923 0.1375-0.0000 ( 8877 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1253 -6.1253 -4.9400 -4.9400 -4.8064 -4.8064 -4.8016 -4.8016 -2.7527 -2.7527 -2.7303 -2.7303 -2.1380 -2.1380 -2.0898 -2.0898 -2.0797 -2.0797 -1.1919 -1.1919 1.4124 1.4124 1.9420 1.9420 2.3016 2.3016 2.6662 2.6662 2.7182 2.7182 3.3074 3.3074 3.4812 3.4812 3.5086 3.5086 3.6195 3.6195 4.1078 4.1078 4.2187 4.2187 4.4876 4.4876 4.5102 4.5102 4.5744 4.5744 4.5864 4.5864 4.7262 4.7262 4.7572 4.7572 4.9042 4.9042 5.6223 5.6223 6.1256 6.1256 6.3728 6.3728 7.5169 7.5169 8.0013 8.0013 9.0040 9.0040 9.0991 9.0991 9.2013 9.2013 9.2844 9.2844 10.2521 10.2521 k = 0.2115 0.1513-0.0000 ( 8865 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.1101 -6.1101 -4.9655 -4.9655 -4.8068 -4.8068 -4.8021 -4.8021 -2.7538 -2.7538 -2.7322 -2.7322 -2.1387 -2.1387 -2.0919 -2.0919 -2.0809 -2.0809 -1.1806 -1.1806 1.4307 1.4307 1.9278 1.9278 2.3409 2.3409 2.6776 2.6776 2.7284 2.7284 3.3224 3.3224 3.4706 3.4706 3.5185 3.5185 3.6045 3.6045 4.1202 4.1202 4.2423 4.2423 4.4938 4.4938 4.5076 4.5076 4.5687 4.5687 4.5949 4.5949 4.7305 4.7305 4.7546 4.7546 4.9190 4.9190 5.5546 5.5546 6.0802 6.0802 6.3169 6.3169 7.5712 7.5712 8.0099 8.0099 8.9440 8.9440 9.1069 9.1069 9.1679 9.1679 9.1932 9.1932 10.1755 10.1755 k = 0.2308 0.1650-0.0000 ( 8849 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0938 -6.0938 -4.9924 -4.9924 -4.8072 -4.8072 -4.8026 -4.8026 -2.7549 -2.7549 -2.7340 -2.7340 -2.1392 -2.1392 -2.0942 -2.0942 -2.0820 -2.0820 -1.1695 -1.1695 1.4526 1.4526 1.9132 1.9132 2.3802 2.3802 2.6894 2.6894 2.7389 2.7389 3.3356 3.3356 3.4561 3.4561 3.5312 3.5312 3.5914 3.5914 4.1334 4.1334 4.2666 4.2666 4.5001 4.5001 4.5038 4.5038 4.5609 4.5609 4.6044 4.6044 4.7355 4.7355 4.7539 4.7539 4.9354 4.9354 5.4902 5.4902 6.0347 6.0347 6.2599 6.2599 7.6162 7.6162 8.0184 8.0184 8.8875 8.8875 9.0217 9.0217 9.1010 9.1010 9.2326 9.2326 10.0536 10.0536 k = 0.2500 0.1788-0.0000 ( 8882 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0765 -6.0765 -5.0204 -5.0204 -4.8076 -4.8076 -4.8030 -4.8030 -2.7562 -2.7562 -2.7360 -2.7360 -2.1398 -2.1398 -2.0967 -2.0967 -2.0832 -2.0832 -1.1589 -1.1589 1.4779 1.4779 1.8985 1.8985 2.4184 2.4184 2.7015 2.7015 2.7495 2.7495 3.3467 3.3467 3.4394 3.4394 3.5448 3.5448 3.5812 3.5812 4.1471 4.1471 4.2913 4.2913 4.4963 4.4963 4.5074 4.5074 4.5521 4.5521 4.6147 4.6147 4.7410 4.7410 4.7551 4.7551 4.9531 4.9531 5.4295 5.4295 5.9895 5.9895 6.2026 6.2026 7.6516 7.6516 8.0267 8.0267 8.8358 8.8358 8.9326 8.9326 9.0125 9.0125 9.3045 9.3045 9.9322 9.9322 k = 0.2692 0.1925-0.0000 ( 8890 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0583 -6.0583 -5.0492 -5.0492 -4.8081 -4.8081 -4.8034 -4.8034 -2.7574 -2.7574 -2.7378 -2.7378 -2.1401 -2.1401 -2.0992 -2.0992 -2.0842 -2.0842 -1.1489 -1.1489 1.5067 1.5067 1.8841 1.8841 2.4541 2.4541 2.7138 2.7138 2.7599 2.7599 3.3545 3.3546 3.4225 3.4225 3.5557 3.5557 3.5770 3.5770 4.1611 4.1611 4.3163 4.3163 4.4855 4.4855 4.5141 4.5141 4.5442 4.5442 4.6257 4.6257 4.7473 4.7473 4.7582 4.7582 4.9719 4.9719 5.3727 5.3727 5.9450 5.9450 6.1455 6.1455 7.6769 7.6769 8.0353 8.0353 8.7857 8.7857 8.8451 8.8451 8.9315 8.9315 9.3799 9.3799 9.8158 9.8158 k = 0.2885 0.2063-0.0000 ( 8874 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0394 -6.0394 -5.0785 -5.0785 -4.8085 -4.8085 -4.8038 -4.8038 -2.7584 -2.7584 -2.7395 -2.7395 -2.1402 -2.1402 -2.1017 -2.1017 -2.0852 -2.0852 -1.1396 -1.1396 1.5386 1.5386 1.8703 1.8703 2.4861 2.4861 2.7261 2.7261 2.7699 2.7699 3.3572 3.3572 3.4089 3.4089 3.5566 3.5566 3.5854 3.5854 4.1753 4.1753 4.3412 4.3412 4.4700 4.4700 4.5209 4.5209 4.5383 4.5383 4.6373 4.6373 4.7543 4.7543 4.7631 4.7631 4.9916 4.9916 5.3197 5.3197 5.9016 5.9016 6.0893 6.0893 7.6923 7.6923 8.0449 8.0449 8.7301 8.7301 8.7623 8.7623 8.8645 8.8645 9.4571 9.4571 9.7055 9.7055 k = 0.3077 0.2201-0.0000 ( 8878 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0200 -6.0200 -5.1079 -5.1079 -4.8089 -4.8089 -4.8041 -4.8041 -2.7594 -2.7594 -2.7411 -2.7411 -2.1402 -2.1402 -2.1042 -2.1042 -2.0861 -2.0861 -1.1311 -1.1311 1.5734 1.5734 1.8572 1.8572 2.5132 2.5132 2.7384 2.7384 2.7792 2.7792 3.3522 3.3522 3.4028 3.4028 3.5531 3.5531 3.5999 3.5999 4.1894 4.1894 4.3658 4.3658 4.4502 4.4502 4.5274 4.5274 4.5345 4.5345 4.6494 4.6494 4.7618 4.7618 4.7695 4.7695 5.0117 5.0117 5.2705 5.2705 5.8598 5.8598 6.0346 6.0346 7.6984 7.6984 8.0561 8.0561 8.6621 8.6621 8.6872 8.6872 8.8165 8.8165 9.5343 9.5343 9.6023 9.6023 k = 0.3269 0.2338-0.0000 ( 8886 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -6.0004 -6.0004 -5.1371 -5.1371 -4.8092 -4.8092 -4.8045 -4.8045 -2.7604 -2.7604 -2.7427 -2.7427 -2.1400 -2.1400 -2.1068 -2.1068 -2.0870 -2.0870 -1.1235 -1.1235 1.6105 1.6105 1.8449 1.8449 2.5338 2.5338 2.7506 2.7506 2.7876 2.7876 3.3419 3.3419 3.4034 3.4034 3.5499 3.5499 3.6153 3.6153 4.2031 4.2031 4.3895 4.3895 4.4277 4.4277 4.5317 4.5317 4.5342 4.5342 4.6618 4.6618 4.7694 4.7694 4.7771 4.7771 5.0319 5.0319 5.2251 5.2251 5.8201 5.8201 5.9821 5.9821 7.6964 7.6964 8.0695 8.0695 8.5887 8.5887 8.6165 8.6165 8.7841 8.7841 9.5059 9.5059 9.6105 9.6105 k = 0.3462 0.2476-0.0000 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.9807 -5.9807 -5.1657 -5.1657 -4.8096 -4.8096 -4.8048 -4.8048 -2.7613 -2.7613 -2.7442 -2.7442 -2.1397 -2.1397 -2.1094 -2.1094 -2.0878 -2.0878 -1.1167 -1.1167 1.6495 1.6495 1.8338 1.8338 2.5472 2.5472 2.7623 2.7623 2.7948 2.7948 3.3317 3.3317 3.4067 3.4067 3.5476 3.5476 3.6302 3.6302 4.2162 4.2162 4.4015 4.4015 4.4141 4.4141 4.5310 4.5310 4.5396 4.5396 4.6746 4.6746 4.7767 4.7767 4.7857 4.7857 5.0517 5.0517 5.1833 5.1833 5.7830 5.7830 5.9324 5.9324 7.6882 7.6882 8.0850 8.0850 8.5183 8.5183 8.5485 8.5485 8.7606 8.7606 9.4181 9.4181 9.6822 9.6822 k = 0.3654 0.2613-0.0000 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.9615 -5.9615 -5.1931 -5.1931 -4.8099 -4.8099 -4.8051 -4.8051 -2.7621 -2.7621 -2.7455 -2.7455 -2.1392 -2.1392 -2.1118 -2.1118 -2.0885 -2.0885 -1.1108 -1.1108 1.6895 1.6895 1.8241 1.8241 2.5526 2.5526 2.7733 2.7733 2.8011 2.8011 3.3247 3.3247 3.4106 3.4106 3.5463 3.5463 3.6441 3.6441 4.2284 4.2284 4.3773 4.3773 4.4343 4.4343 4.5311 4.5311 4.5449 4.5449 4.6875 4.6875 4.7837 4.7837 4.7949 4.7949 5.0708 5.0708 5.1451 5.1451 5.7490 5.7490 5.8861 5.8861 7.6758 7.6758 8.1021 8.1021 8.4537 8.4537 8.4853 8.4853 8.7415 8.7415 9.3388 9.3388 9.7472 9.7472 k = 0.3846 0.2751-0.0000 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.9430 -5.9430 -5.2188 -5.2188 -4.8102 -4.8102 -4.8053 -4.8053 -2.7628 -2.7628 -2.7467 -2.7467 -2.1385 -2.1385 -2.1142 -2.1142 -2.0892 -2.0892 -1.1057 -1.1057 1.7291 1.7291 1.8161 1.8161 2.5503 2.5503 2.7833 2.7833 2.8065 2.8065 3.3218 3.3218 3.4143 3.4143 3.5460 3.5460 3.6566 3.6566 4.2396 4.2396 4.3526 4.3526 4.4532 4.4532 4.5323 4.5323 4.5496 4.5496 4.7004 4.7004 4.7902 4.7902 4.8043 4.8043 5.0883 5.0883 5.1108 5.1108 5.7186 5.7186 5.8440 5.8440 7.6612 7.6612 8.1202 8.1202 8.3961 8.3961 8.4283 8.4283 8.7247 8.7247 9.2687 9.2687 9.8018 9.8018 k = 0.4038 0.2888-0.0000 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.9258 -5.9258 -5.2423 -5.2423 -4.8104 -4.8104 -4.8055 -4.8055 -2.7633 -2.7633 -2.7477 -2.7477 -2.1376 -2.1376 -2.1165 -2.1165 -2.0897 -2.0897 -1.1015 -1.1015 1.7654 1.7654 1.8117 1.8117 2.5414 2.5414 2.7917 2.7917 2.8114 2.8114 3.3227 3.3227 3.4175 3.4175 3.5465 3.5465 3.6675 3.6675 4.2495 4.2495 4.3291 4.3291 4.4691 4.4691 4.5349 4.5349 4.5536 4.5536 4.7130 4.7130 4.7960 4.7960 4.8134 4.8134 5.0788 5.0788 5.1055 5.1055 5.6921 5.6921 5.8067 5.8067 7.6462 7.6462 8.1383 8.1383 8.3462 8.3462 8.3786 8.3786 8.7091 8.7091 9.2083 9.2083 9.8418 9.8418 k = 0.4231 0.3026-0.0000 ( 8954 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.9105 -5.9105 -5.2630 -5.2630 -4.8107 -4.8107 -4.8057 -4.8057 -2.7638 -2.7638 -2.7486 -2.7486 -2.1368 -2.1368 -2.1187 -2.1187 -2.0902 -2.0902 -1.0982 -1.0982 1.7871 1.7871 1.8208 1.8208 2.5277 2.5277 2.7984 2.7984 2.8158 2.8158 3.3263 3.3263 3.4200 3.4200 3.5476 3.5476 3.6767 3.6767 4.2579 4.2579 4.3079 4.3079 4.4812 4.4812 4.5391 4.5391 4.5569 4.5569 4.7247 4.7247 4.8010 4.8010 4.8216 4.8216 5.0521 5.0521 5.1192 5.1192 5.6699 5.6699 5.7748 5.7748 7.6323 7.6323 8.1552 8.1552 8.3048 8.3048 8.3371 8.3371 8.6947 8.6947 9.1580 9.1580 9.8668 9.8668 k = 0.4423 0.3163-0.0000 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8976 -5.8976 -5.2800 -5.2800 -4.8108 -4.8108 -4.8058 -4.8058 -2.7641 -2.7641 -2.7493 -2.7493 -2.1357 -2.1357 -2.1206 -2.1206 -2.0906 -2.0906 -1.0956 -1.0956 1.7888 1.7888 1.8468 1.8468 2.5120 2.5120 2.8034 2.8034 2.8197 2.8197 3.3313 3.3313 3.4218 3.4218 3.5492 3.5492 3.6839 3.6839 4.2645 4.2645 4.2902 4.2902 4.4894 4.4894 4.5445 4.5445 4.5594 4.5594 4.7353 4.7353 4.8051 4.8051 4.8286 4.8286 5.0297 5.0297 5.1305 5.1305 5.6524 5.6524 5.7492 5.7492 7.6204 7.6204 8.1698 8.1698 8.2724 8.2724 8.3041 8.3041 8.6820 8.6820 9.1184 9.1184 9.8811 9.8811 k = 0.4615 0.3301-0.0000 ( 8934 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8878 -5.8878 -5.2928 -5.2928 -4.8109 -4.8109 -4.8059 -4.8059 -2.7644 -2.7644 -2.7497 -2.7497 -2.1348 -2.1348 -2.1222 -2.1222 -2.0908 -2.0908 -1.0937 -1.0937 1.7868 1.7868 1.8712 1.8712 2.4975 2.4975 2.8068 2.8068 2.8228 2.8228 3.3361 3.3361 3.4230 3.4230 3.5507 3.5507 3.6891 3.6891 4.2686 4.2686 4.2774 4.2774 4.4942 4.4942 4.5499 4.5499 4.5611 4.5611 4.7438 4.7438 4.8082 4.8082 4.8339 4.8339 5.0126 5.0126 5.1389 5.1389 5.6397 5.6397 5.7303 5.7303 7.6114 7.6114 8.1808 8.1808 8.2496 8.2496 8.2803 8.2803 8.6718 8.6718 9.0899 9.0899 9.8893 9.8893 k = 0.4808 0.3438-0.0000 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8817 -5.8817 -5.3007 -5.3007 -4.8110 -4.8110 -4.8060 -4.8060 -2.7645 -2.7645 -2.7500 -2.7500 -2.1340 -2.1340 -2.1232 -2.1232 -2.0909 -2.0909 -1.0926 -1.0926 1.7852 1.7852 1.8875 1.8875 2.4872 2.4872 2.8087 2.8087 2.8248 2.8248 3.3395 3.3395 3.4236 3.4236 3.5517 3.5517 3.6923 3.6923 4.2662 4.2662 4.2743 4.2743 4.4967 4.4967 4.5540 4.5540 4.5619 4.5619 4.7495 4.7495 4.8101 4.8101 4.8373 4.8373 5.0017 5.0017 5.1440 5.1440 5.6321 5.6321 5.7187 5.7187 7.6058 7.6058 8.1872 8.1872 8.2366 8.2366 8.2658 8.2658 8.6652 8.6652 9.0726 9.0726 9.8938 9.8938 k = 0.5000 0.3576-0.0000 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8796 -5.8796 -5.3034 -5.3034 -4.8110 -4.8110 -4.8060 -4.8060 -2.7645 -2.7645 -2.7501 -2.7501 -2.1338 -2.1338 -2.1237 -2.1237 -2.0910 -2.0910 -1.0923 -1.0923 1.7846 1.7846 1.8933 1.8933 2.4834 2.4834 2.8093 2.8093 2.8255 2.8255 3.3407 3.3407 3.4238 3.4238 3.5521 3.5521 3.6933 3.6933 4.2638 4.2638 4.2748 4.2748 4.4975 4.4975 4.5556 4.5556 4.5621 4.5621 4.7514 4.7514 4.8107 4.8107 4.8384 4.8384 4.9980 4.9980 5.1458 5.1458 5.6295 5.6295 5.7148 5.7148 7.6039 7.6039 8.1891 8.1891 8.2326 8.2326 8.2610 8.2610 8.6630 8.6630 9.0668 9.0668 9.8952 9.8952 k = 0.5000 0.3576-0.0000 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8796 -5.8796 -5.3034 -5.3034 -4.8110 -4.8110 -4.8060 -4.8060 -2.7645 -2.7645 -2.7501 -2.7501 -2.1338 -2.1338 -2.1237 -2.1237 -2.0910 -2.0910 -1.0923 -1.0923 1.7846 1.7846 1.8933 1.8933 2.4834 2.4834 2.8093 2.8093 2.8255 2.8255 3.3407 3.3407 3.4238 3.4238 3.5521 3.5521 3.6933 3.6933 4.2638 4.2638 4.2748 4.2748 4.4975 4.4975 4.5556 4.5556 4.5621 4.5621 4.7514 4.7514 4.8107 4.8107 4.8384 4.8384 4.9980 4.9980 5.1458 5.1458 5.6295 5.6295 5.7148 5.7148 7.6039 7.6039 8.1891 8.1891 8.2326 8.2326 8.2610 8.2610 8.6630 8.6630 9.0668 9.0668 9.8952 9.8952 k = 0.4902 0.3713 0.0168 ( 8918 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8792 -5.8791 -5.3030 -5.3030 -4.8117 -4.8115 -4.8067 -4.8063 -2.7657 -2.7636 -2.7530 -2.7477 -2.1359 -2.1318 -2.1292 -2.1191 -2.0925 -2.0900 -1.0936 -1.0857 1.7837 1.7882 1.8853 1.8988 2.4793 2.4824 2.8060 2.8110 2.8246 2.8275 3.3235 3.3506 3.4230 3.4286 3.5394 3.5659 3.6865 3.6995 4.2633 4.2654 4.2674 4.2786 4.4776 4.5117 4.5423 4.5510 4.5672 4.5749 4.7451 4.7551 4.8016 4.8191 4.8361 4.8424 5.0006 5.0036 5.1425 5.1472 5.6285 5.6299 5.7140 5.7145 7.6028 7.6080 8.1920 8.1935 8.2349 8.2391 8.2623 8.2682 8.6620 8.6723 9.0686 9.0717 9.8969 9.9016 k = 0.4804 0.3850 0.0337 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8779 -5.8777 -5.3016 -5.3016 -4.8142 -4.8137 -4.8078 -4.8070 -2.7668 -2.7629 -2.7566 -2.7458 -2.1397 -2.1343 -2.1298 -2.1155 -2.0950 -2.0895 -1.0897 -1.0741 1.7855 1.7945 1.8751 1.9018 2.4704 2.4764 2.7996 2.8127 2.8229 2.8319 3.3033 3.3487 3.4308 3.4331 3.5276 3.5803 3.6795 3.7050 4.2564 4.2640 4.2680 4.2787 4.4549 4.5110 4.5281 4.5499 4.5765 4.5878 4.7367 4.7559 4.7931 4.8256 4.8350 4.8488 5.0113 5.0170 5.1376 5.1470 5.6266 5.6287 5.7130 5.7134 7.6045 7.6150 8.2029 8.2050 8.2441 8.2524 8.2732 8.2860 8.6693 8.6897 9.0769 9.0831 9.9066 9.9161 k = 0.4706 0.3987 0.0505 ( 8902 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8757 -5.8754 -5.2993 -5.2993 -4.8191 -4.8185 -4.8084 -4.8073 -2.7680 -2.7629 -2.7607 -2.7441 -2.1471 -2.1368 -2.1278 -2.1126 -2.0984 -2.0890 -1.0806 -1.0578 1.7900 1.8036 1.8626 1.9023 2.4569 2.4657 2.7901 2.8135 2.8208 2.8385 3.2823 3.3369 3.4358 3.4458 3.5163 3.5946 3.6726 3.7097 4.2419 4.2661 4.2712 4.2753 4.4303 4.4954 4.5126 4.5597 4.5841 4.5997 4.7266 4.7535 4.7864 4.8307 4.8350 4.8581 5.0287 5.0365 5.1312 5.1453 5.6221 5.6240 5.7129 5.7140 7.6092 7.6247 8.2218 8.2234 8.2573 8.2700 8.2962 8.3166 8.6844 8.7149 9.0919 9.1015 9.9244 9.9387 k = 0.4608 0.4124 0.0673 ( 8910 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8726 -5.8722 -5.2961 -5.2961 -4.8264 -4.8257 -4.8086 -4.8073 -2.7691 -2.7655 -2.7637 -2.7425 -2.1566 -2.1383 -2.1259 -2.1103 -2.1031 -2.0885 -1.0668 -1.0373 1.7972 1.8153 1.8483 1.9004 2.4396 2.4507 2.7780 2.8087 2.8225 2.8461 3.2616 3.3199 3.4362 3.4636 3.5053 3.6074 3.6668 3.7136 4.2243 4.2674 4.2702 4.2741 4.4050 4.4735 4.4970 4.5710 4.5905 4.6100 4.7153 4.7488 4.7818 4.8356 4.8361 4.8692 5.0514 5.0606 5.1236 5.1426 5.6132 5.6138 5.7153 5.7191 7.6164 7.6369 8.2461 8.2473 8.2767 8.2932 8.3306 8.3596 8.7069 8.7471 9.1137 9.1268 9.9500 9.9695 k = 0.4510 0.4261 0.0842 ( 8923 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8688 -5.8682 -5.2920 -5.2920 -4.8358 -4.8350 -4.8087 -4.8072 -2.7717 -2.7693 -2.7654 -2.7409 -2.1671 -2.1395 -2.1241 -2.1095 -2.1077 -2.0879 -1.0487 -1.0131 1.8070 1.8294 1.8326 1.8961 2.4190 2.4319 2.7638 2.7991 2.8263 2.8539 3.2420 3.3009 3.4343 3.4820 3.4940 3.6162 3.6642 3.7167 4.2038 4.2573 4.2744 4.2752 4.3806 4.4477 4.4826 4.5812 4.5960 4.6184 4.7033 4.7433 4.7789 4.8387 4.8413 4.8813 5.0779 5.0875 5.1155 5.1396 5.5978 5.5987 5.7219 5.7289 7.6261 7.6512 8.2689 8.2740 8.3103 8.3253 8.3746 8.4133 8.7358 8.7852 9.1426 9.1596 9.9831 10.0084 k = 0.4412 0.4397 0.1010 ( 8923 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8641 -5.8634 -5.2871 -5.2870 -4.8470 -4.8462 -4.8087 -4.8069 -2.7773 -2.7703 -2.7680 -2.7390 -2.1781 -2.1403 -2.1225 -2.1159 -2.1061 -2.0873 -1.0269 -0.9858 1.8147 1.8194 1.8468 1.8895 2.3955 2.4097 2.7479 2.7862 2.8301 2.8609 3.2241 3.2816 3.4302 3.4821 3.4998 3.6183 3.6674 3.7189 4.1810 4.2433 4.2714 4.2800 4.3604 4.4192 4.4698 4.5896 4.6003 4.6251 4.6912 4.7386 4.7772 4.8426 4.8485 4.8941 5.1018 5.1125 5.1135 5.1395 5.5772 5.5788 5.7328 5.7428 7.6377 7.6673 8.2892 8.3011 8.3591 8.3685 8.4266 8.4763 8.7703 8.8281 9.1788 9.2000 10.0225 10.0554 k = 0.4315 0.4534 0.1178 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8588 -5.8580 -5.2812 -5.2812 -4.8601 -4.8592 -4.8087 -4.8067 -2.7837 -2.7716 -2.7709 -2.7370 -2.1891 -2.1409 -2.1241 -2.1203 -2.1041 -2.0865 -1.0020 -0.9562 1.7963 1.8343 1.8665 1.8810 2.3699 2.3848 2.7305 2.7704 2.8330 2.8663 3.2084 3.2632 3.4239 3.4693 3.5162 3.6144 3.6752 3.7205 4.1564 4.2263 4.2586 4.2863 4.3490 4.3889 4.4588 4.5958 4.6032 4.6304 4.6795 4.7350 4.7767 4.8481 4.8575 4.9069 5.0967 5.1236 5.1406 5.1566 5.5532 5.5548 5.7472 5.7597 7.6511 7.6850 8.3098 8.3289 8.4198 8.4222 8.4855 8.5478 8.8095 8.8747 9.2227 9.2483 10.0632 10.1105 k = 0.4217 0.4671 0.1347 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8528 -5.8519 -5.2746 -5.2745 -4.8747 -4.8737 -4.8086 -4.8064 -2.7903 -2.7760 -2.7711 -2.7348 -2.2000 -2.1412 -2.1320 -2.1192 -2.1019 -2.0856 -0.9746 -0.9248 1.7771 1.8513 1.8711 1.8886 2.3423 2.3574 2.7121 2.7518 2.8345 2.8694 3.1951 3.2466 3.4154 3.4556 3.5306 3.6077 3.6846 3.7214 4.1305 4.2068 4.2362 4.2918 4.3470 4.3589 4.4499 4.5995 4.6048 4.6347 4.6691 4.7323 4.7776 4.8553 4.8684 4.9197 5.0890 5.1223 5.1725 5.1857 5.5274 5.5281 5.7640 5.7787 7.6658 7.7039 8.3319 8.3577 8.4849 8.4906 8.5501 8.6268 8.8523 8.9237 9.2745 9.3049 10.0898 10.1539 k = 0.4119 0.4808 0.1515 ( 8919 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8463 -5.8454 -5.2671 -5.2670 -4.8907 -4.8897 -4.8084 -4.8060 -2.7972 -2.7810 -2.7712 -2.7326 -2.2105 -2.1413 -2.1405 -2.1180 -2.0996 -2.0845 -0.9455 -0.8923 1.7577 1.8571 1.8730 1.9132 2.3133 2.3282 2.6928 2.7305 2.8339 2.8698 3.1845 3.2325 3.4048 3.4408 3.5426 3.5999 3.6938 3.7219 4.1038 4.1853 4.2080 4.2905 4.3356 4.3509 4.4429 4.5999 4.6053 4.6383 4.6609 4.7297 4.7804 4.8641 4.8812 4.9322 5.0824 5.1202 5.2039 5.2153 5.5006 5.5014 5.7825 5.7991 7.6815 7.7237 8.3555 8.3879 8.5548 8.5703 8.6196 8.7126 8.8981 8.9739 9.3342 9.3697 10.1021 10.2153 k = 0.4021 0.4945 0.1683 ( 8907 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8395 -5.8385 -5.2588 -5.2587 -4.9079 -4.9068 -4.8082 -4.8057 -2.8042 -2.7867 -2.7709 -2.7302 -2.2202 -2.1492 -2.1412 -2.1169 -2.0971 -2.0834 -0.9153 -0.8594 1.7385 1.8445 1.8941 1.9401 2.2833 2.2975 2.6730 2.7068 2.8310 2.8671 3.1763 3.2212 3.3919 3.4248 3.5513 3.5921 3.7017 3.7225 4.0770 4.1625 4.1774 4.2707 4.3314 4.3579 4.4376 4.5967 4.6055 4.6410 4.6554 4.7270 4.7852 4.8750 4.8961 4.9443 5.0775 5.1191 5.2323 5.2418 5.4745 5.4777 5.8019 5.8202 7.6980 7.7442 8.3802 8.4190 8.6304 8.6571 8.6935 8.8048 8.9462 9.0246 9.4017 9.4427 10.1082 10.2321 k = 0.3923 0.5082 0.1852 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8324 -5.8313 -5.2497 -5.2497 -4.9260 -4.9248 -4.8080 -4.8053 -2.8112 -2.7927 -2.7704 -2.7280 -2.2292 -2.1579 -2.1409 -2.1161 -2.0946 -2.0822 -0.8846 -0.8266 1.7199 1.8304 1.9177 1.9691 2.2525 2.2660 2.6528 2.6810 2.8257 2.8616 3.1700 3.2129 3.3770 3.4077 3.5560 3.5846 3.7079 3.7235 4.0507 4.1391 4.1460 4.2399 4.3388 4.3662 4.4340 4.5904 4.6060 4.6427 4.6524 4.7239 4.7918 4.8878 4.9128 4.9561 5.0749 5.1194 5.2543 5.2617 5.4535 5.4598 5.8215 5.8412 7.7149 7.7651 8.4059 8.4507 8.7100 8.7455 8.7750 8.9026 8.9962 9.0751 9.4766 9.5236 10.1101 10.2372 k = 0.3825 0.5219 0.2020 ( 8903 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8253 -5.8241 -5.2399 -5.2399 -4.9446 -4.9434 -4.8078 -4.8049 -2.8181 -2.7990 -2.7696 -2.7258 -2.2373 -2.1664 -2.1404 -2.1152 -2.0919 -2.0809 -0.8542 -0.7947 1.7024 1.8155 1.9424 1.9998 2.2216 2.2345 2.6326 2.6534 2.8180 2.8536 3.1647 3.2074 3.3600 3.3895 3.5562 3.5779 3.7123 3.7256 4.0254 4.1151 4.1157 4.2069 4.3498 4.3753 4.4318 4.5821 4.6073 4.6434 4.6511 4.7204 4.8000 4.9028 4.9310 4.9674 5.0752 5.1217 5.2646 5.2701 5.4429 5.4523 5.8406 5.8617 7.7319 7.7863 8.4320 8.4824 8.7913 8.8255 8.8712 9.0059 9.0481 9.1251 9.5581 9.6122 10.1088 10.2364 k = 0.3727 0.5356 0.2188 ( 8903 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8183 -5.8171 -5.2294 -5.2294 -4.9636 -4.9624 -4.8076 -4.8045 -2.8246 -2.8054 -2.7686 -2.7237 -2.2443 -2.1746 -2.1397 -2.1146 -2.0892 -2.0796 -0.8245 -0.7642 1.6863 1.8002 1.9672 2.0311 2.1917 2.2046 2.6125 2.6242 2.8084 2.8434 3.1595 3.2042 3.3413 3.3702 3.5515 3.5721 3.7147 3.7291 4.0017 4.0854 4.0928 4.1740 4.3623 4.3843 4.4310 4.5728 4.6100 4.6431 4.6506 4.7167 4.8092 4.9202 4.9505 4.9782 5.0792 5.1260 5.2596 5.2644 5.4462 5.4580 5.8587 5.8809 7.7490 7.8075 8.4585 8.5133 8.8714 8.8974 8.9777 9.1028 9.1143 9.1743 9.6453 9.7077 10.1063 10.2312 k = 0.3629 0.5493 0.2357 ( 8887 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8116 -5.8104 -5.2183 -5.2183 -4.9826 -4.9813 -4.8073 -4.8042 -2.8309 -2.8118 -2.7673 -2.7217 -2.2504 -2.1824 -2.1388 -2.1138 -2.0865 -2.0782 -0.7961 -0.7357 1.6721 1.7848 1.9895 2.0600 2.1659 2.1789 2.5928 2.5939 2.7972 2.8316 3.1534 3.2024 3.3211 3.3500 3.5420 3.5672 3.7152 3.7340 3.9800 4.0573 4.0708 4.1423 4.3755 4.3932 4.4316 4.5631 4.6140 4.6420 4.6506 4.7130 4.8191 4.9400 4.9706 4.9885 5.0875 5.1325 5.2417 5.2473 5.4610 5.4741 5.8750 5.8983 7.7659 7.8286 8.4850 8.5430 8.9469 8.9625 9.0846 9.1652 9.2203 9.2299 9.7371 9.8096 10.1060 10.2251 k = 0.3531 0.5630 0.2525 ( 8899 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8055 -5.8043 -5.2066 -5.2065 -5.0013 -4.9999 -4.8070 -4.8038 -2.8367 -2.8181 -2.7659 -2.7199 -2.2554 -2.1899 -2.1377 -2.1133 -2.0838 -2.0768 -0.7696 -0.7097 1.6603 1.7696 2.0042 2.0751 2.1555 2.1626 2.5628 2.5738 2.7850 2.8185 3.1455 3.2012 3.3000 3.3290 3.5285 3.5633 3.7140 3.7403 3.9608 4.0312 4.0497 4.1122 4.3889 4.4016 4.4335 4.5534 4.6195 4.6402 4.6506 4.7094 4.8293 4.9622 4.9908 4.9982 5.1008 5.1411 5.2164 5.2237 5.4817 5.4957 5.8890 5.9133 7.7825 7.8494 8.5115 8.5710 9.0140 9.0194 9.1706 9.2543 9.2687 9.3467 9.8318 9.9171 10.1132 10.2227 k = 0.3433 0.5767 0.2693 ( 8903 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8003 -5.7991 -5.1943 -5.1942 -5.0191 -5.0178 -4.8067 -4.8034 -2.8421 -2.8242 -2.7642 -2.7183 -2.2595 -2.1969 -2.1365 -2.1128 -2.0812 -2.0755 -0.7453 -0.6867 1.6510 1.7547 2.0048 2.0632 2.1625 2.1737 2.5316 2.5558 2.7722 2.8043 3.1350 3.1995 3.2784 3.3073 3.5123 3.5603 3.7116 3.7474 3.9441 4.0072 4.0296 4.0842 4.4018 4.4095 4.4375 4.5440 4.6261 4.6383 4.6507 4.7060 4.8399 4.9869 5.0063 5.0118 5.1193 5.1512 5.1882 5.1982 5.5040 5.5191 5.9002 5.9253 7.7986 7.8697 8.5379 8.5970 9.0658 9.0686 9.2309 9.3140 9.3730 9.4698 9.9266 10.0293 10.1347 10.2289 k = 0.3335 0.5904 0.2862 ( 8899 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7962 -5.7950 -5.1814 -5.1813 -5.0358 -5.0345 -4.8064 -4.8030 -2.8468 -2.8299 -2.7622 -2.7168 -2.2626 -2.2035 -2.1351 -2.1123 -2.0786 -2.0741 -0.7237 -0.6670 1.6446 1.7405 1.9903 2.0374 2.1795 2.2070 2.5009 2.5392 2.7593 2.7892 3.1218 3.1962 3.2567 3.2851 3.4949 3.5582 3.7087 3.7552 3.9299 3.9854 4.0103 4.0586 4.4131 4.4168 4.4443 4.5350 4.6305 4.6396 4.6508 4.7028 4.8506 5.0137 5.0140 5.0320 5.1414 5.1545 5.1613 5.1810 5.5254 5.5420 5.9080 5.9338 7.8142 7.8892 8.5644 8.6210 9.1000 9.1079 9.2818 9.3575 9.5037 9.5970 10.0169 10.1445 10.1780 10.2485 k = 0.3237 0.6041 0.3030 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7936 -5.7924 -5.1681 -5.1680 -5.0510 -5.0497 -4.8061 -4.8027 -2.8508 -2.8351 -2.7602 -2.7156 -2.2647 -2.2096 -2.1336 -2.1118 -2.0762 -2.0727 -0.7051 -0.6511 1.6412 1.7268 1.9667 2.0082 2.2073 2.2439 2.4720 2.5247 2.7467 2.7731 3.1059 3.1900 3.2350 3.2622 3.4782 3.5569 3.7057 3.7632 3.9177 3.9659 3.9913 4.0357 4.4217 4.4236 4.4547 4.5263 4.6289 4.6477 4.6510 4.6998 4.8615 5.0196 5.0419 5.0527 5.1305 5.1349 5.1741 5.1904 5.5442 5.5631 5.9120 5.9383 7.8293 7.9077 8.5912 8.6432 9.1211 9.1311 9.3284 9.3990 9.6399 9.7274 10.0990 10.2476 10.2543 10.2905 k = 0.3139 0.6178 0.3199 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7926 -5.7915 -5.1543 -5.1543 -5.0643 -5.0630 -4.8057 -4.8023 -2.8542 -2.8399 -2.7579 -2.7145 -2.2660 -2.2153 -2.1320 -2.1113 -2.0739 -2.0713 -0.6899 -0.6392 1.6409 1.7138 1.9394 1.9784 2.2402 2.2792 2.4477 2.5132 2.7350 2.7559 3.0880 3.1801 3.2135 3.2387 3.4640 3.5563 3.7034 3.7711 3.9070 3.9487 3.9724 4.0157 4.4281 4.4298 4.4681 4.5181 4.6257 4.6514 4.6580 4.6972 4.8726 5.0214 5.0672 5.0733 5.1096 5.1148 5.2064 5.2089 5.5597 5.5814 5.9116 5.9384 7.8440 7.9251 8.6184 8.6640 9.1298 9.1398 9.3720 9.4379 9.7789 9.8591 10.1761 10.3198 10.3382 10.3920 k = 0.3139 0.6178 0.3199 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7926 -5.7915 -5.1543 -5.1543 -5.0643 -5.0630 -4.8057 -4.8023 -2.8542 -2.8399 -2.7579 -2.7145 -2.2660 -2.2153 -2.1320 -2.1113 -2.0739 -2.0713 -0.6899 -0.6392 1.6409 1.7138 1.9394 1.9784 2.2402 2.2792 2.4477 2.5132 2.7350 2.7559 3.0880 3.1801 3.2135 3.2387 3.4640 3.5563 3.7034 3.7711 3.9070 3.9487 3.9724 4.0157 4.4281 4.4298 4.4681 4.5181 4.6257 4.6514 4.6580 4.6972 4.8726 5.0214 5.0672 5.0733 5.1096 5.1148 5.2064 5.2089 5.5597 5.5814 5.9116 5.9384 7.8440 7.9251 8.6184 8.6640 9.1298 9.1398 9.3720 9.4379 9.7789 9.8591 10.1761 10.3198 10.3382 10.3920 k = 0.2930 0.6118 0.3272 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7934 -5.7923 -5.1493 -5.1479 -5.0684 -5.0663 -4.8058 -4.8024 -2.8554 -2.8417 -2.7568 -2.7141 -2.2662 -2.2176 -2.1312 -2.1111 -2.0729 -2.0707 -0.6847 -0.6358 1.6400 1.7077 1.9274 1.9691 2.2542 2.2917 2.4366 2.5083 2.7313 2.7495 3.0757 3.1607 3.2195 3.2329 3.4591 3.5562 3.7029 3.7738 3.9021 3.9385 3.9672 4.0081 4.4255 4.4372 4.4753 4.5147 4.6237 4.6501 4.6633 4.6961 4.8781 5.0205 5.0719 5.0820 5.1051 5.1138 5.2187 5.2207 5.5563 5.5873 5.9136 5.9417 7.8513 7.9340 8.6308 8.6750 9.1269 9.1411 9.3920 9.4567 9.8376 9.9154 10.2034 10.3154 10.4023 10.4696 k = 0.2721 0.6058 0.3345 ( 8907 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7954 -5.7943 -5.1461 -5.1432 -5.0688 -5.0653 -4.8063 -4.8030 -2.8564 -2.8434 -2.7554 -2.7138 -2.2662 -2.2199 -2.1302 -2.1108 -2.0719 -2.0701 -0.6808 -0.6340 1.6368 1.7011 1.9172 1.9655 2.2654 2.2999 2.4229 2.5028 2.7300 2.7453 3.0558 3.1310 3.2349 3.2394 3.4553 3.5560 3.7032 3.7753 3.8962 3.9246 3.9654 4.0011 4.4226 4.4439 4.4839 4.5115 4.6209 4.6468 4.6686 4.6950 4.8851 5.0194 5.0713 5.0892 5.1072 5.1202 5.2304 5.2329 5.5413 5.5854 5.9216 5.9504 7.8608 7.9460 8.6440 8.6915 9.1207 9.1421 9.4155 9.4792 9.8921 9.9694 10.2185 10.3044 10.4790 10.5750 k = 0.2511 0.5999 0.3418 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7983 -5.7974 -5.1456 -5.1416 -5.0643 -5.0596 -4.8074 -4.8041 -2.8573 -2.8449 -2.7538 -2.7137 -2.2659 -2.2221 -2.1291 -2.1105 -2.0711 -2.0695 -0.6782 -0.6337 1.6323 1.6945 1.9097 1.9652 2.2721 2.3018 2.4098 2.4983 2.7301 2.7425 3.0310 3.1008 3.2448 3.2620 3.4527 3.5559 3.7040 3.7757 3.8890 3.9105 3.9644 3.9945 4.4203 4.4494 4.4934 4.5084 4.6171 4.6420 4.6735 4.6937 4.8934 5.0184 5.0686 5.0940 5.1168 5.1301 5.2413 5.2457 5.5205 5.5744 5.9337 5.9595 7.8730 7.9607 8.6591 8.7143 9.1156 9.1437 9.4423 9.5046 9.9427 10.0205 10.2265 10.2941 10.5672 10.6883 k = 0.2302 0.5939 0.3492 ( 8909 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8020 -5.8012 -5.1475 -5.1430 -5.0551 -5.0497 -4.8091 -4.8059 -2.8580 -2.8462 -2.7521 -2.7137 -2.2655 -2.2243 -2.1278 -2.1101 -2.0703 -2.0689 -0.6766 -0.6348 1.6276 1.6885 1.9050 1.9667 2.2731 2.2953 2.4014 2.4958 2.7299 2.7412 3.0044 3.0720 3.2585 3.2880 3.4512 3.5560 3.7054 3.7749 3.8800 3.8978 3.9632 3.9881 4.4187 4.4540 4.5030 4.5055 4.6123 4.6362 4.6777 4.6923 4.9028 5.0182 5.0663 5.0984 5.1298 5.1426 5.2482 5.2627 5.4968 5.5565 5.9464 5.9654 7.8881 7.9778 8.6779 8.7436 9.1133 9.1469 9.4720 9.5322 9.9895 10.0681 10.2320 10.2851 10.6604 10.8025 k = 0.2093 0.5880 0.3565 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8062 -5.8054 -5.1511 -5.1466 -5.0424 -5.0368 -4.8114 -4.8082 -2.8586 -2.8475 -2.7501 -2.7139 -2.2648 -2.2265 -2.1264 -2.1097 -2.0697 -2.0683 -0.6760 -0.6370 1.6235 1.6832 1.9025 1.9690 2.2681 2.2805 2.3995 2.4954 2.7263 2.7421 2.9782 3.0458 3.2746 3.3161 3.4506 3.5568 3.7071 3.7733 3.8685 3.8874 3.9617 3.9817 4.4177 4.4579 4.5024 4.5126 4.6061 4.6300 4.6812 4.6908 4.9129 5.0189 5.0652 5.1036 5.1404 5.1608 5.2523 5.2829 5.4722 5.5345 5.9560 5.9656 7.9065 7.9969 8.7020 8.7794 9.1143 9.1522 9.5040 9.5616 10.0327 10.1113 10.2378 10.2779 10.7520 10.9102 k = 0.1884 0.5820 0.3638 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8106 -5.8099 -5.1555 -5.1513 -5.0276 -5.0220 -4.8145 -4.8114 -2.8590 -2.8486 -2.7480 -2.7142 -2.2639 -2.2288 -2.1248 -2.1093 -2.0691 -2.0679 -0.6760 -0.6403 1.6208 1.6789 1.9015 1.9712 2.2566 2.2621 2.4024 2.4966 2.7194 2.7442 2.9542 3.0230 3.2919 3.3460 3.4508 3.5588 3.7089 3.7708 3.8551 3.8786 3.9598 3.9753 4.4174 4.4614 4.4994 4.5212 4.5984 4.6237 4.6838 4.6894 4.9234 5.0205 5.0655 5.1095 5.1476 5.1850 5.2543 5.3061 5.4482 5.5104 5.9583 5.9604 7.9284 8.0176 8.7326 8.8211 9.1186 9.1597 9.5377 9.5925 10.0717 10.1488 10.2457 10.2735 10.8343 10.9256 k = 0.1674 0.5760 0.3711 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8151 -5.8144 -5.1601 -5.1564 -5.0115 -5.0062 -4.8183 -4.8152 -2.8592 -2.8497 -2.7457 -2.7148 -2.2628 -2.2310 -2.1232 -2.1090 -2.0687 -2.0674 -0.6766 -0.6442 1.6198 1.6756 1.9015 1.9728 2.2360 2.2476 2.4079 2.4983 2.7104 2.7452 2.9338 3.0037 3.3095 3.3766 3.4518 3.5625 3.7106 3.7679 3.8407 3.8706 3.9574 3.9690 4.4179 4.4646 4.4965 4.5289 4.5892 4.6179 4.6856 4.6880 4.9341 5.0227 5.0673 5.1156 5.1529 5.2124 5.2555 5.3315 5.4265 5.4859 5.9437 5.9574 7.9535 8.0395 8.7697 8.8677 9.1256 9.1690 9.5723 9.6245 10.1051 10.1792 10.2546 10.2763 10.8273 10.8739 k = 0.1465 0.5701 0.3785 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8194 -5.8188 -5.1646 -5.1613 -4.9950 -4.9898 -4.8230 -4.8199 -2.8593 -2.8507 -2.7434 -2.7155 -2.2615 -2.2332 -2.1215 -2.1087 -2.0683 -2.0671 -0.6774 -0.6487 1.6207 1.6734 1.9019 1.9732 2.2140 2.2335 2.4142 2.4993 2.7003 2.7438 2.9183 2.9879 3.3267 3.4059 3.4548 3.5687 3.7115 3.7648 3.8259 3.8625 3.9547 3.9630 4.4193 4.4674 4.4935 4.5354 4.5790 4.6124 4.6867 4.6870 4.9446 5.0250 5.0706 5.1216 5.1570 5.2338 5.2649 5.3551 5.4113 5.4627 5.9210 5.9467 7.9815 8.0621 8.8127 8.9177 9.1350 9.1800 9.6070 9.6569 10.1307 10.2022 10.2597 10.2929 10.7352 10.7890 k = 0.1256 0.5641 0.3858 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8234 -5.8229 -5.1688 -5.1659 -4.9784 -4.9734 -4.8285 -4.8254 -2.8592 -2.8516 -2.7410 -2.7165 -2.2600 -2.2354 -2.1198 -2.1086 -2.0680 -2.0668 -0.6784 -0.6534 1.6234 1.6720 1.9026 1.9717 2.1941 2.2192 2.4208 2.4988 2.6907 2.7393 2.9083 2.9749 3.3428 3.4274 3.4652 3.5776 3.7108 3.7621 3.8109 3.8542 3.9518 3.9574 4.4215 4.4699 4.4908 4.5402 4.5692 4.6072 4.6860 4.6875 4.9550 5.0268 5.0755 5.1268 5.1605 5.2356 5.2959 5.3629 5.4121 5.4464 5.8910 5.9282 8.0112 8.0845 8.8599 8.9685 9.1466 9.1921 9.6410 9.6888 10.1471 10.2183 10.2670 10.3178 10.6422 10.6952 k = 0.1046 0.5582 0.3931 ( 8928 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8269 -5.8265 -5.1724 -5.1701 -4.9621 -4.9574 -4.8348 -4.8317 -2.8590 -2.8525 -2.7385 -2.7177 -2.2584 -2.2377 -2.1181 -2.1085 -2.0678 -2.0667 -0.6793 -0.6582 1.6277 1.6711 1.9037 1.9681 2.1776 2.2055 2.4273 2.4963 2.6828 2.7318 2.9036 2.9642 3.3576 3.4342 3.4891 3.5895 3.7076 3.7598 3.7964 3.8454 3.9488 3.9524 4.4247 4.4714 4.4886 4.5407 4.5626 4.6021 4.6853 4.6876 4.9651 5.0275 5.0819 5.1308 5.1640 5.2299 5.3356 5.3548 5.4067 5.4608 5.8548 5.9025 8.0416 8.1057 8.9095 9.0168 9.1606 9.2051 9.6736 9.7189 10.1557 10.2270 10.2802 10.3443 10.5550 10.6038 k = 0.0837 0.5522 0.4004 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8300 -5.8297 -5.1755 -5.1736 -4.9464 -4.9420 -4.8420 -4.8389 -2.8586 -2.8534 -2.7360 -2.7190 -2.2567 -2.2399 -2.1164 -2.1086 -2.0675 -2.0666 -0.6798 -0.6629 1.6332 1.6702 1.9054 1.9622 2.1655 2.1928 2.4337 2.4917 2.6775 2.7223 2.9033 2.9549 3.3708 3.4334 3.5185 3.6038 3.7014 3.7559 3.7849 3.8361 3.9458 3.9483 4.4288 4.4713 4.4879 4.5348 4.5624 4.5973 4.6848 4.6874 4.9748 5.0269 5.0895 5.1332 5.1679 5.2220 5.3435 5.3743 5.3967 5.4961 5.8136 5.8706 8.0709 8.1244 8.9587 9.0577 9.1777 9.2183 9.7042 9.7455 10.1594 10.2308 10.2922 10.3692 10.4771 10.5242 k = 0.0628 0.5462 0.4078 ( 8923 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8324 -5.8322 -5.1779 -5.1765 -4.9317 -4.9276 -4.8498 -4.8467 -2.8582 -2.8542 -2.7335 -2.7206 -2.2548 -2.2421 -2.1148 -2.1089 -2.0673 -2.0665 -0.6800 -0.6672 1.6395 1.6688 1.9082 1.9542 2.1579 2.1815 2.4402 2.4853 2.6752 2.7119 2.9062 2.9466 3.3827 3.4298 3.5483 3.6194 3.6926 3.7459 3.7810 3.8264 3.9433 3.9450 4.4338 4.4688 4.4893 4.5259 4.5656 4.5925 4.6847 4.6870 4.9842 5.0247 5.0979 5.1337 5.1723 5.2132 5.3359 5.3685 5.4333 5.5357 5.7698 5.8336 8.0977 8.1391 9.0046 9.0866 9.1983 9.2309 9.7322 9.7671 10.1611 10.2327 10.2904 10.3899 10.4099 10.4710 k = 0.0419 0.5403 0.4151 ( 8921 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8342 -5.8340 -5.1795 -5.1786 -4.9183 -4.9147 -4.8579 -4.8550 -2.8577 -2.8550 -2.7310 -2.7223 -2.2528 -2.2443 -2.1133 -2.1094 -2.0671 -2.0666 -0.6795 -0.6710 1.6462 1.6666 1.9125 1.9449 2.1545 2.1717 2.4470 2.4778 2.6758 2.7017 2.9112 2.9389 3.3932 3.4246 3.5765 3.6330 3.6839 3.7304 3.7839 3.8166 3.9414 3.9426 4.4396 4.4644 4.4923 4.5169 4.5697 4.5878 4.6847 4.6864 4.9932 5.0209 5.1067 5.1321 5.1773 5.2043 5.3318 5.3548 5.4818 5.5731 5.7277 5.7933 8.1203 8.1485 9.0442 9.1016 9.2196 9.2413 9.7565 9.7821 10.1638 10.2304 10.2734 10.3501 10.4109 10.4498 k = 0.0209 0.5343 0.4224 ( 8911 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8353 -5.8352 -5.1804 -5.1800 -4.9074 -4.9049 -4.8649 -4.8627 -2.8571 -2.8557 -2.7286 -2.7243 -2.2508 -2.2465 -2.1120 -2.1100 -2.0669 -2.0667 -0.6785 -0.6742 1.6526 1.6631 1.9186 1.9353 2.1547 2.1638 2.4542 2.4698 2.6792 2.6925 2.9174 2.9314 3.4025 3.4182 3.6019 3.6360 3.6834 3.7128 3.7901 3.8070 3.9403 3.9410 4.4459 4.4588 4.4967 4.5089 4.5742 4.5832 4.6850 4.6859 5.0016 5.0156 5.1152 5.1284 5.1827 5.1961 5.3317 5.3435 5.5305 5.5935 5.7019 5.7522 8.1374 8.1517 9.0749 9.1040 9.2368 9.2472 9.7753 9.7890 10.1715 10.2124 10.2676 10.3077 10.4265 10.4437 k = 0.0000 0.5284 0.4298 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8356 -5.8356 -5.1806 -5.1806 -4.9017 -4.9017 -4.8672 -4.8672 -2.8564 -2.8564 -2.7264 -2.7264 -2.2487 -2.2487 -2.1110 -2.1110 -2.0668 -2.0668 -0.6767 -0.6767 1.6584 1.6584 1.9263 1.9263 2.1580 2.1580 2.4618 2.4618 2.6848 2.6848 2.9242 2.9242 3.4109 3.4109 3.6231 3.6231 3.6956 3.6956 3.7980 3.7980 3.9402 3.9402 4.4524 4.4524 4.5022 4.5022 4.5787 4.5787 4.6853 4.6853 5.0091 5.0091 5.1226 5.1226 5.1890 5.1890 5.3357 5.3357 5.5738 5.5738 5.7156 5.7156 8.1480 8.1480 9.0950 9.0950 9.2462 9.2462 9.7867 9.7867 10.1880 10.1880 10.2806 10.2806 10.4375 10.4375 k = 0.0000 0.5284 0.4298 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8356 -5.8356 -5.1806 -5.1806 -4.9017 -4.9017 -4.8672 -4.8672 -2.8564 -2.8564 -2.7264 -2.7264 -2.2487 -2.2487 -2.1110 -2.1110 -2.0668 -2.0668 -0.6767 -0.6767 1.6584 1.6584 1.9263 1.9263 2.1580 2.1580 2.4618 2.4618 2.6848 2.6848 2.9242 2.9242 3.4109 3.4109 3.6231 3.6231 3.6956 3.6956 3.7980 3.7980 3.9402 3.9402 4.4524 4.4524 4.5022 4.5022 4.5787 4.5787 4.6853 4.6853 5.0091 5.0091 5.1226 5.1226 5.1890 5.1890 5.3357 5.3357 5.5738 5.5738 5.7156 5.7156 8.1480 8.1480 9.0950 9.0950 9.2462 9.2462 9.7867 9.7867 10.1880 10.1880 10.2806 10.2806 10.4375 10.4375 k = 0.0096 0.5149 0.4463 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8354 -5.8351 -5.1803 -5.1802 -4.9027 -4.9016 -4.8675 -4.8673 -2.8591 -2.8535 -2.7280 -2.7248 -2.2528 -2.2442 -2.1112 -2.1107 -2.0672 -2.0665 -0.6782 -0.6771 1.6416 1.6614 1.9196 1.9298 2.1481 2.1737 2.4569 2.4640 2.6857 2.6909 2.9274 2.9288 3.4093 3.4142 3.6213 3.6247 3.6946 3.6971 3.7942 3.8024 3.9373 3.9443 4.4499 4.4546 4.5001 4.5051 4.5785 4.5796 4.6851 4.6857 5.0028 5.0116 5.1057 5.1280 5.1897 5.2047 5.3396 5.3402 5.5730 5.5735 5.7136 5.7160 8.1381 8.1495 9.0875 9.0983 9.2412 9.2509 9.7650 9.7970 10.1844 10.1963 10.2759 10.2866 10.4360 10.4380 k = 0.0192 0.5015 0.4628 ( 8918 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8345 -5.8339 -5.1794 -5.1791 -4.9046 -4.9023 -4.8682 -4.8678 -2.8613 -2.8502 -2.7296 -2.7232 -2.2565 -2.2395 -2.1114 -2.1104 -2.0676 -2.0662 -0.6818 -0.6797 1.6135 1.6502 1.9103 1.9299 2.1438 2.1903 2.4528 2.4646 2.6939 2.7019 2.9376 2.9414 3.4096 3.4192 3.6192 3.6259 3.6941 3.6992 3.7910 3.8074 3.9357 3.9494 4.4474 4.4562 4.4995 4.5084 4.5790 4.5815 4.6850 4.6861 4.9933 5.0104 5.0867 5.1194 5.2092 5.2278 5.3517 5.3526 5.5713 5.5722 5.7099 5.7146 8.1202 8.1429 9.0752 9.0977 9.2369 9.2543 9.7339 9.7949 10.1851 10.2088 10.2723 10.2940 10.4348 10.4363 k = 0.0288 0.4880 0.4793 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8329 -5.8320 -5.1778 -5.1773 -4.9072 -4.9039 -4.8693 -4.8686 -2.8631 -2.8467 -2.7312 -2.7217 -2.2599 -2.2346 -2.1116 -2.1101 -2.0681 -2.0660 -0.6873 -0.6842 1.5771 1.6263 1.8991 1.9273 2.1406 2.2001 2.4562 2.4682 2.7082 2.7154 2.9538 2.9619 3.4116 3.4259 3.6168 3.6268 3.6941 3.7019 3.7884 3.8130 3.9354 3.9554 4.4451 4.4569 4.5008 4.5117 4.5801 4.5844 4.6853 4.6864 4.9814 5.0062 5.0687 5.1064 5.2378 5.2550 5.3706 5.3719 5.5690 5.5700 5.7045 5.7116 8.0949 8.1284 9.0574 9.0926 9.2344 9.2562 9.6954 9.7803 10.1890 10.2243 10.2694 10.3028 10.4321 10.4349 k = 0.0385 0.4746 0.4959 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.8307 -5.8294 -5.1755 -5.1749 -4.9108 -4.9063 -4.8707 -4.8698 -2.8644 -2.8430 -2.7328 -2.7202 -2.2626 -2.2294 -2.1118 -2.1098 -2.0686 -2.0659 -0.6946 -0.6906 1.5351 1.5926 1.8864 1.9223 2.1327 2.1966 2.4729 2.4797 2.7272 2.7302 2.9747 2.9892 3.4153 3.4340 3.6144 3.6275 3.6946 3.7051 3.7866 3.8191 3.9363 3.9621 4.4431 4.4568 4.5041 4.5149 4.5817 4.5886 4.6860 4.6867 4.9681 5.0000 5.0526 5.0934 5.2706 5.2853 5.3948 5.3967 5.5668 5.5672 5.6976 5.7071 8.0629 8.1067 9.0338 9.0820 9.2342 9.2569 9.6522 9.7543 10.1942 10.2407 10.2669 10.3128 10.4253 10.4368 k = 0.0481 0.4611 0.5124 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8278 -5.8262 -5.1726 -5.1718 -4.9150 -4.9096 -4.8725 -4.8714 -2.8653 -2.8391 -2.7343 -2.7189 -2.2648 -2.2242 -2.1120 -2.1095 -2.0692 -2.0659 -0.7035 -0.6988 1.4899 1.5524 1.8723 1.9150 2.1165 2.1789 2.5016 2.5031 2.7459 2.7500 2.9992 3.0219 3.4205 3.4435 3.6119 3.6279 3.6954 3.7087 3.7856 3.8258 3.9384 3.9693 4.4416 4.4563 4.5094 4.5177 4.5838 4.5941 4.6870 4.6873 4.9543 4.9927 5.0388 5.0815 5.3061 5.3181 5.4222 5.4255 5.5644 5.5656 5.6892 5.7010 8.0252 8.0788 9.0045 9.0642 9.2363 9.2573 9.6067 9.7191 10.1984 10.2530 10.2672 10.3237 10.4157 10.4399 k = 0.0577 0.4477 0.5289 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8242 -5.8224 -5.1691 -5.1681 -4.9200 -4.9136 -4.8746 -4.8734 -2.8656 -2.8351 -2.7357 -2.7177 -2.2664 -2.2188 -2.1122 -2.1091 -2.0698 -2.0660 -0.7138 -0.7086 1.4429 1.5082 1.8569 1.9052 2.0919 2.1506 2.5330 2.5427 2.7627 2.7761 3.0263 3.0586 3.4270 3.4540 3.6094 3.6281 3.6965 3.7128 3.7855 3.8330 3.9416 3.9766 4.4405 4.4557 4.5164 4.5203 4.5863 4.6008 4.6873 4.6892 4.9406 4.9850 5.0272 5.0710 5.3431 5.3524 5.4498 5.4564 5.5628 5.5678 5.6796 5.6937 7.9829 8.0456 8.9696 9.0378 9.2402 9.2579 9.5614 9.6776 10.1992 10.2505 10.2780 10.3351 10.4035 10.4431 k = 0.0673 0.4342 0.5455 ( 8918 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8201 -5.8180 -5.1649 -5.1638 -4.9257 -4.9184 -4.8772 -4.8758 -2.8655 -2.8310 -2.7372 -2.7168 -2.2673 -2.2135 -2.1124 -2.1087 -2.0705 -2.0663 -0.7254 -0.7198 1.3955 1.4619 1.8402 1.8929 2.0608 2.1156 2.5712 2.5873 2.7813 2.8055 3.0549 3.0976 3.4347 3.4656 3.6069 3.6282 3.6979 3.7171 3.7863 3.8407 3.9458 3.9838 4.4399 4.4557 4.5226 4.5247 4.5893 4.6086 4.6878 4.6918 4.9274 4.9774 5.0177 5.0619 5.3806 5.3869 5.4742 5.4861 5.5657 5.5771 5.6690 5.6855 7.9370 8.0081 8.9296 9.0018 9.2453 9.2590 9.5187 9.6326 10.1948 10.2402 10.2894 10.3450 10.3902 10.4455 k = 0.0769 0.4208 0.5620 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8154 -5.8131 -5.1602 -5.1589 -4.9319 -4.9238 -4.8801 -4.8786 -2.8648 -2.8268 -2.7386 -2.7161 -2.2675 -2.2081 -2.1125 -2.1083 -2.0712 -2.0668 -0.7380 -0.7322 1.3485 1.4149 1.8224 1.8782 2.0252 2.0767 2.6135 2.6337 2.8023 2.8381 3.0843 3.1378 3.4433 3.4779 3.6047 3.6283 3.6995 3.7217 3.7882 3.8489 3.9508 3.9906 4.4399 4.4563 4.5248 4.5342 4.5927 4.6174 4.6889 4.6954 4.9153 4.9703 5.0103 5.0540 5.4160 5.4181 5.4938 5.5096 5.5784 5.5964 5.6586 5.6775 7.8886 7.9672 8.8844 8.9560 9.2511 9.2607 9.4802 9.5870 10.1841 10.2243 10.2970 10.3453 10.3839 10.4469 k = 0.0865 0.4074 0.5785 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8102 -5.8077 -5.1549 -5.1534 -4.9387 -4.9299 -4.8834 -4.8818 -2.8636 -2.8227 -2.7400 -2.7157 -2.2670 -2.2027 -2.1127 -2.1079 -2.0720 -2.0675 -0.7513 -0.7455 1.3025 1.3681 1.8036 1.8610 1.9871 2.0359 2.6574 2.6795 2.8260 2.8737 3.1139 3.1781 3.4526 3.4909 3.6026 3.6284 3.7013 3.7266 3.7914 3.8575 3.9564 3.9968 4.4404 4.4579 4.5271 4.5446 4.5968 4.6267 4.6910 4.7001 4.9044 4.9639 5.0046 5.0471 5.4394 5.4441 5.5152 5.5279 5.6008 5.6207 5.6521 5.6738 7.8384 7.9237 8.8344 8.9012 9.2569 9.2624 9.4471 9.5431 10.1675 10.2032 10.2993 10.3297 10.3917 10.4480 k = 0.0962 0.3939 0.5951 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.8046 -5.8019 -5.1490 -5.1474 -4.9459 -4.9366 -4.8871 -4.8854 -2.8618 -2.8186 -2.7414 -2.7157 -2.2656 -2.1974 -2.1129 -2.1075 -2.0730 -2.0685 -0.7652 -0.7596 1.2580 1.3222 1.7839 1.8419 1.9477 1.9941 2.7016 2.7232 2.8528 2.9118 3.1434 3.2174 3.4623 3.5044 3.6009 3.6286 3.7032 3.7314 3.7960 3.8665 3.9624 4.0020 4.4415 4.4603 4.5294 4.5554 4.6017 4.6361 4.6947 4.7060 4.8950 4.9583 5.0006 5.0412 5.4469 5.4586 5.5451 5.5508 5.6141 5.6323 5.6643 5.6888 7.7874 7.8784 8.7797 8.8387 9.2624 9.2637 9.4198 9.5028 10.1465 10.1782 10.2959 10.3074 10.4054 10.4502 k = 0.1058 0.3805 0.6116 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7986 -5.7957 -5.1427 -5.1410 -4.9535 -4.9437 -4.8912 -4.8894 -2.8596 -2.8146 -2.7428 -2.7161 -2.2634 -2.1922 -2.1131 -2.1071 -2.0740 -2.0698 -0.7795 -0.7741 1.2155 1.2778 1.7635 1.8211 1.9081 1.9523 2.7449 2.7639 2.8829 2.9517 3.1725 3.2548 3.4724 3.5183 3.5995 3.6289 3.7053 3.7363 3.8022 3.8756 3.9686 4.0061 4.4432 4.4637 4.5319 4.5659 4.6082 4.6449 4.7009 4.7132 4.8873 4.9534 4.9979 5.0358 5.4453 5.4606 5.5732 5.5794 5.6183 5.6289 5.6981 5.7235 7.7364 7.8319 8.7207 8.7703 9.2642 9.2670 9.3980 9.4674 10.1235 10.1513 10.2835 10.2868 10.4206 10.4543 k = 0.1154 0.3670 0.6281 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7923 -5.7892 -5.1359 -5.1340 -4.9613 -4.9512 -4.8957 -4.8938 -2.8568 -2.8107 -2.7441 -2.7169 -2.2604 -2.1871 -2.1133 -2.1067 -2.0752 -2.0715 -0.7938 -0.7888 1.1751 1.2352 1.7428 1.7989 1.8690 1.9110 2.7867 2.8012 2.9156 2.9926 3.2008 3.2896 3.4825 3.5324 3.5986 3.6295 3.7075 3.7411 3.8100 3.8849 3.9748 4.0089 4.4455 4.4677 4.5344 4.5749 4.6173 4.6527 4.7100 4.7219 4.8816 4.9493 4.9966 5.0309 5.4396 5.4563 5.5739 5.5994 5.6371 5.6437 5.7382 5.7645 7.6860 7.7849 8.6582 8.6978 9.2637 9.2704 9.3809 9.4373 10.1008 10.1247 10.2596 10.2731 10.4360 10.4602 k = 0.1250 0.3536 0.6446 ( 8932 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7857 -5.7826 -5.1287 -5.1267 -4.9693 -4.9590 -4.9005 -4.8986 -2.8535 -2.8069 -2.7455 -2.7183 -2.2566 -2.1821 -2.1135 -2.1063 -2.0765 -2.0736 -0.8080 -0.8035 1.1372 1.1946 1.7220 1.7760 1.8311 1.8709 2.8266 2.8354 2.9500 3.0334 3.2283 3.3210 3.4927 3.5465 3.5983 3.6303 3.7098 3.7458 3.8196 3.8941 3.9808 4.0104 4.4485 4.4724 4.5370 4.5813 4.6298 4.6595 4.7221 4.7320 4.8780 4.9458 4.9961 5.0263 5.4325 5.4495 5.5619 5.5924 5.6714 5.6817 5.7795 5.8068 7.6368 7.7379 8.5930 8.6230 9.2621 9.2724 9.3677 9.4127 10.0808 10.1006 10.2365 10.2561 10.4508 10.4671 k = 0.1346 0.3401 0.6612 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7790 -5.7758 -5.1212 -5.1190 -4.9773 -4.9670 -4.9057 -4.9037 -2.8497 -2.8032 -2.7469 -2.7201 -2.2519 -2.1772 -2.1137 -2.1060 -2.0779 -2.0760 -0.8220 -0.8180 1.1019 1.1564 1.7015 1.7526 1.7946 1.8321 2.8643 2.8671 2.9851 3.0733 3.2547 3.3487 3.5030 3.5604 3.5986 3.6314 3.7123 3.7503 3.8309 3.9032 3.9863 4.0105 4.4521 4.4774 4.5394 4.5850 4.6456 4.6660 4.7367 4.7433 4.8767 4.9428 4.9965 5.0216 5.4251 5.4419 5.5472 5.5795 5.7105 5.7220 5.8204 5.8489 7.5896 7.6914 8.5262 8.5475 9.2600 9.2730 9.3571 9.3930 10.0650 10.0805 10.2149 10.2374 10.4643 10.4741 k = 0.1442 0.3267 0.6777 ( 8928 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7723 -5.7690 -5.1133 -5.1111 -4.9853 -4.9750 -4.9112 -4.9092 -2.8455 -2.7996 -2.7482 -2.7224 -2.2465 -2.1725 -2.1139 -2.1056 -2.0794 -2.0789 -0.8354 -0.8320 1.0694 1.1206 1.6814 1.7292 1.7602 1.7952 2.8966 2.8996 3.0198 3.1112 3.2797 3.3723 3.5133 3.5737 3.5996 3.6327 3.7151 3.7547 3.8436 3.9118 3.9910 4.0094 4.4564 4.4826 4.5416 4.5863 4.6639 4.6730 4.7529 4.7555 4.8777 4.9400 4.9973 5.0166 5.4185 5.4348 5.5319 5.5658 5.7492 5.7619 5.8599 5.8895 7.5449 7.6459 8.4590 8.4727 9.2576 9.2725 9.3481 9.3773 10.0546 10.0657 10.1954 10.2185 10.4758 10.4798 k = 0.1538 0.3132 0.6942 ( 8928 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7656 -5.7623 -5.1052 -5.1028 -4.9931 -4.9830 -4.9171 -4.9151 -2.8409 -2.7962 -2.7496 -2.7253 -2.2404 -2.1681 -2.1141 -2.1053 -2.0822 -2.0811 -0.8482 -0.8454 1.0398 1.0874 1.6622 1.7061 1.7282 1.7603 2.9244 2.9322 3.0534 3.1466 3.3031 3.3920 3.5239 3.5862 3.6013 3.6342 3.7180 3.7590 3.8574 3.9200 3.9948 4.0070 4.4613 4.4879 4.5434 4.5859 4.6811 4.6839 4.7683 4.7699 4.8809 4.9374 4.9983 5.0113 5.4131 5.4287 5.5170 5.5522 5.7863 5.8000 5.8973 5.9279 7.5032 7.6018 8.3926 8.4000 9.2554 9.2711 9.3402 9.3646 10.0502 10.0568 10.1788 10.2009 10.4833 10.4843 k = 0.1635 0.2998 0.7108 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7590 -5.7558 -5.0969 -5.0944 -5.0006 -4.9908 -4.9232 -4.9212 -2.8358 -2.7929 -2.7510 -2.7287 -2.2336 -2.1638 -2.1143 -2.1050 -2.0860 -2.0829 -0.8602 -0.8579 1.0131 1.0569 1.6441 1.6836 1.6989 1.7278 2.9505 2.9619 3.0853 3.1789 3.3243 3.4078 3.5351 3.5976 3.6037 3.6359 3.7213 3.7631 3.8718 3.9275 3.9975 4.0036 4.4668 4.4930 4.5446 4.5840 4.6908 4.7048 4.7815 4.7870 4.8859 4.9347 4.9992 5.0053 5.4094 5.4243 5.5030 5.5393 5.8211 5.8357 5.9321 5.9632 7.4649 7.5596 8.3281 8.3304 9.2534 9.2694 9.3327 9.3538 10.0518 10.0540 10.1657 10.1858 10.4834 10.4889 k = 0.1731 0.2864 0.7273 ( 8934 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7527 -5.7497 -5.0886 -5.0860 -5.0076 -4.9983 -4.9296 -4.9276 -2.8305 -2.7898 -2.7525 -2.7326 -2.2263 -2.1598 -2.1146 -2.1048 -2.0901 -2.0848 -0.8712 -0.8695 0.9894 1.0291 1.6274 1.6617 1.6728 1.6979 2.9747 2.9885 3.1153 3.2075 3.3432 3.4203 3.5470 3.6066 3.6075 3.6376 3.7249 3.7670 3.8863 3.9343 3.9990 3.9994 4.4727 4.4980 4.5452 4.5809 4.7023 4.7258 4.7950 4.8035 4.8919 4.9319 4.9987 4.9994 5.4075 5.4219 5.4904 5.5277 5.8532 5.8681 5.9638 5.9951 7.4306 7.5196 8.2652 8.2668 9.2519 9.2674 9.3255 9.3444 10.0574 10.0592 10.1569 10.1743 10.4796 10.4890 k = 0.1827 0.2729 0.7438 ( 8944 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7467 -5.7439 -5.0802 -5.0775 -5.0140 -5.0054 -4.9362 -4.9342 -2.8248 -2.7869 -2.7540 -2.7369 -2.2185 -2.1562 -2.1150 -2.1048 -2.0945 -2.0868 -0.8812 -0.8800 0.9689 1.0042 1.6124 1.6408 1.6503 1.6707 2.9970 3.0118 3.1432 3.2322 3.3595 3.4297 3.5597 3.6100 3.6160 3.6391 3.7289 3.7706 3.9004 3.9403 3.9946 3.9993 4.4791 4.5028 4.5451 4.5767 4.7156 4.7462 4.8090 4.8188 4.8978 4.9290 4.9913 4.9986 5.4075 5.4219 5.4797 5.5176 5.8820 5.8969 5.9922 6.0228 7.4005 7.4823 8.2053 8.2096 9.2508 9.2654 9.3187 9.3358 10.0664 10.0716 10.1529 10.1674 10.4713 10.4838 k = 0.1923 0.2595 0.7603 ( 8958 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7412 -5.7387 -5.0721 -5.0692 -5.0197 -5.0118 -4.9429 -4.9410 -2.8190 -2.7841 -2.7556 -2.7416 -2.2103 -2.1530 -2.1153 -2.1053 -2.0987 -2.0888 -0.8901 -0.8892 0.9514 0.9822 1.5992 1.6214 1.6310 1.6465 3.0171 3.0319 3.1688 3.2524 3.3736 3.4364 3.5728 3.6136 3.6228 3.6405 3.7335 3.7736 3.9137 3.9455 3.9894 3.9983 4.4858 4.5074 4.5444 4.5716 4.7308 4.7650 4.8237 4.8322 4.9025 4.9263 4.9836 4.9964 5.4091 5.4240 5.4712 5.5093 5.9075 5.9217 6.0170 6.0461 7.3751 7.4481 8.1517 8.1577 9.2501 9.2633 9.3124 9.3280 10.0802 10.0881 10.1543 10.1657 10.4586 10.4733 k = 0.2019 0.2460 0.7769 ( 8946 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7363 -5.7341 -5.0642 -5.0614 -5.0245 -5.0173 -4.9495 -4.9477 -2.8128 -2.7816 -2.7571 -2.7466 -2.2018 -2.1504 -2.1158 -2.1075 -2.1012 -2.0908 -0.8978 -0.8972 0.9370 0.9630 1.5880 1.6044 1.6146 1.6255 3.0349 3.0485 3.1922 3.2678 3.3858 3.4406 3.5860 3.6174 3.6280 3.6414 3.7386 3.7760 3.9259 3.9499 3.9843 3.9962 4.4928 4.5117 4.5430 4.5658 4.7476 4.7819 4.8392 4.8429 4.9050 4.9242 4.9757 4.9924 5.4118 5.4273 5.4655 5.5029 5.9293 5.9424 6.0383 6.0648 7.3544 7.4175 8.1051 8.1118 9.2498 9.2612 9.3069 9.3207 10.0977 10.1069 10.1615 10.1695 10.4419 10.4579 k = 0.2115 0.2326 0.7934 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7321 -5.7302 -5.0571 -5.0542 -5.0280 -5.0218 -4.9560 -4.9543 -2.8065 -2.7793 -2.7587 -2.7517 -2.1932 -2.1488 -2.1163 -2.1113 -2.1017 -2.0928 -0.9041 -0.9038 0.9258 0.9468 1.5791 1.5904 1.6007 1.6078 3.0500 3.0617 3.2132 3.2780 3.3968 3.4427 3.5986 3.6212 3.6317 3.6418 3.7443 3.7773 3.9369 3.9535 3.9795 3.9932 4.5001 4.5159 4.5413 4.5595 4.7655 4.7966 4.8502 4.8540 4.9052 4.9236 4.9681 4.9864 5.4150 5.4304 5.4635 5.4981 5.9474 5.9587 6.0561 6.0790 7.3388 7.3906 8.0663 8.0728 9.2497 9.2591 9.3024 9.3141 10.1172 10.1260 10.1745 10.1789 10.4226 10.4388 k = 0.2212 0.2191 0.8099 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7286 -5.7272 -5.0511 -5.0486 -5.0299 -5.0250 -4.9619 -4.9605 -2.8002 -2.7777 -2.7603 -2.7568 -2.1846 -2.1488 -2.1169 -2.1151 -2.1015 -2.0946 -0.9091 -0.9089 0.9177 0.9336 1.5725 1.5797 1.5894 1.5935 3.0623 3.0716 3.2318 3.2832 3.4070 3.4427 3.6099 3.6248 3.6338 3.6415 3.7505 3.7774 3.9465 3.9563 3.9754 3.9893 4.5076 4.5198 4.5390 4.5526 4.7842 4.8096 4.8531 4.8643 4.9063 4.9252 4.9610 4.9781 5.4184 5.4316 5.4658 5.4945 5.9619 5.9708 6.0704 6.0886 7.3281 7.3678 8.0359 8.0415 9.2499 9.2571 9.2990 9.3084 10.1367 10.1436 10.1918 10.1930 10.4024 10.4175 k = 0.2308 0.2057 0.8265 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7260 -5.7251 -5.0469 -5.0453 -5.0297 -5.0266 -4.9669 -4.9658 -2.7939 -2.7770 -2.7619 -2.7612 -2.1762 -2.1508 -2.1177 -2.1176 -2.1010 -2.0964 -0.9128 -0.9127 0.9127 0.9234 1.5682 1.5723 1.5808 1.5828 3.0717 3.0781 3.2480 3.2836 3.4163 3.4407 3.6196 3.6281 3.6347 3.6401 3.7569 3.7760 3.9543 3.9585 3.9725 3.9847 4.5151 4.5235 4.5364 4.5454 4.8032 4.8210 4.8519 4.8639 4.9139 4.9291 4.9542 4.9678 5.4215 5.4308 5.4711 5.4913 5.9726 5.9788 6.0815 6.0942 7.3225 7.3494 8.0143 8.0183 9.2505 9.2553 9.2970 9.3035 10.1539 10.1584 10.2092 10.2098 10.3843 10.3966 k = 0.2404 0.1922 0.8430 ( 8946 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7243 -5.7238 -5.0447 -5.0441 -5.0282 -5.0268 -4.9702 -4.9696 -2.7879 -2.7785 -2.7639 -2.7633 -2.1683 -2.1550 -2.1188 -2.1184 -2.1002 -2.0979 -0.9149 -0.9149 0.9108 0.9161 1.5662 1.5680 1.5752 1.5759 3.0781 3.0814 3.2615 3.2797 3.4245 3.4370 3.6273 3.6309 3.6343 3.6374 3.7630 3.7729 3.9596 3.9601 3.9719 3.9797 4.5228 4.5271 4.5336 4.5380 4.8217 4.8312 4.8472 4.8540 4.9270 4.9346 4.9476 4.9554 5.4243 5.4290 5.4774 5.4877 5.9797 5.9828 6.0894 6.0959 7.3220 7.3355 8.0016 8.0038 9.2513 9.2537 9.2965 9.2998 10.1664 10.1686 10.2229 10.2236 10.3721 10.3794 k = 0.2500 0.1788 0.8595 ( 8940 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0440 -5.0440 -5.0270 -5.0270 -4.9712 -4.9712 -2.7824 -2.7824 -2.7642 -2.7642 -2.1610 -2.1610 -2.1189 -2.1189 -2.0992 -2.0992 -0.9157 -0.9157 0.9119 0.9119 1.5662 1.5662 1.5733 1.5733 3.0813 3.0813 3.2722 3.2722 3.4315 3.4315 3.6328 3.6328 3.6334 3.6334 3.7685 3.7685 3.9610 3.9610 3.9749 3.9749 4.5304 4.5304 4.5305 4.5305 4.8389 4.8389 4.8403 4.8403 4.9408 4.9408 4.9418 4.9418 5.4268 5.4268 5.4831 5.4831 5.9831 5.9831 6.0943 6.0943 7.3263 7.3263 7.9981 7.9981 9.2523 9.2523 9.2974 9.2974 10.1717 10.1717 10.2286 10.2286 10.3702 10.3702 k = 0.2500 0.1788 0.8595 ( 8940 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0440 -5.0440 -5.0270 -5.0270 -4.9712 -4.9712 -2.7824 -2.7824 -2.7642 -2.7642 -2.1610 -2.1610 -2.1189 -2.1189 -2.0992 -2.0992 -0.9157 -0.9157 0.9119 0.9119 1.5662 1.5662 1.5733 1.5733 3.0813 3.0813 3.2722 3.2722 3.4315 3.4315 3.6328 3.6328 3.6334 3.6334 3.7685 3.7685 3.9610 3.9610 3.9749 3.9749 4.5304 4.5304 4.5305 4.5305 4.8389 4.8389 4.8403 4.8403 4.9408 4.9408 4.9418 4.9418 5.4268 5.4268 5.4831 5.4831 5.9831 5.9831 6.0943 6.0943 7.3263 7.3263 7.9981 7.9981 9.2523 9.2523 9.2974 9.2974 10.1717 10.1717 10.2286 10.2286 10.3702 10.3702 k = 0.2656 0.1900 0.8458 ( 8942 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7236 -5.0442 -5.0440 -5.0276 -5.0268 -4.9709 -4.9706 -2.7855 -2.7799 -2.7644 -2.7636 -2.1651 -2.1573 -2.1191 -2.1185 -2.0999 -2.0984 -0.9155 -0.9155 0.9116 0.9145 1.5299 1.5329 1.6104 1.6121 3.0742 3.0761 3.2678 3.2756 3.4261 3.4360 3.6281 3.6292 3.6376 3.6379 3.7663 3.7737 3.9594 3.9597 3.9743 3.9785 4.5264 4.5275 4.5295 4.5381 4.8235 4.8352 4.8422 4.8490 4.9302 4.9362 4.9520 4.9566 5.4076 5.4103 5.5002 5.5058 5.9811 5.9834 6.0924 6.0957 7.3182 7.3254 8.0024 8.0042 9.1890 9.1903 9.3586 9.3613 10.1649 10.1683 10.2295 10.2321 10.3718 10.3758 k = 0.2812 0.2011 0.8320 ( 8929 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7244 -5.7239 -5.0446 -5.0444 -5.0284 -5.0269 -4.9698 -4.9695 -2.7887 -2.7782 -2.7644 -2.7622 -2.1696 -2.1540 -2.1194 -2.1178 -2.1004 -2.0972 -0.9150 -0.9150 0.9135 0.9190 1.4943 1.4997 1.6531 1.6566 3.0562 3.0593 3.2640 3.2743 3.4187 3.4412 3.6238 3.6254 3.6421 3.6429 3.7656 3.7829 3.9551 3.9567 3.9767 3.9834 4.5223 4.5243 4.5282 4.5457 4.8067 4.8275 4.8418 4.8496 4.9251 4.9324 4.9702 4.9754 5.3756 5.3812 5.5352 5.5449 5.9767 5.9821 6.0911 6.0965 7.3019 7.3141 8.0167 8.0217 9.1091 9.1105 9.4369 9.4428 10.1535 10.1622 10.2261 10.2333 10.3815 10.3888 k = 0.2969 0.2123 0.8183 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7251 -5.7243 -5.0449 -5.0449 -5.0294 -5.0273 -4.9682 -4.9681 -2.7922 -2.7773 -2.7643 -2.7600 -2.1744 -2.1514 -2.1199 -2.1168 -2.1009 -2.0959 -0.9139 -0.9138 0.9178 0.9253 1.4626 1.4701 1.6982 1.7034 3.0295 3.0332 3.2576 3.2675 3.4124 3.4468 3.6203 3.6217 3.6452 3.6483 3.7663 3.7951 3.9489 3.9532 3.9806 3.9890 4.5182 4.5209 4.5265 4.5530 4.7904 4.8176 4.8385 4.8436 4.9236 4.9294 4.9945 4.9967 5.3432 5.3516 5.5759 5.5882 5.9693 5.9787 6.0907 6.0967 7.2782 7.2928 8.0405 8.0503 9.0310 9.0319 9.5138 9.5232 10.1434 10.1587 10.2150 10.2272 10.3976 10.4080 k = 0.3125 0.2235 0.8046 ( 8938 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7259 -5.7249 -5.0455 -5.0454 -5.0304 -5.0279 -4.9668 -4.9664 -2.7959 -2.7771 -2.7643 -2.7575 -2.1795 -2.1493 -2.1205 -2.1156 -2.1013 -2.0946 -0.9119 -0.9118 0.9240 0.9333 1.4349 1.4440 1.7454 1.7522 2.9959 3.0002 3.2459 3.2553 3.4097 3.4527 3.6175 3.6179 3.6470 3.6535 3.7680 3.8091 3.9411 3.9498 3.9854 3.9950 4.5140 4.5172 4.5244 4.5598 4.7751 4.8065 4.8327 4.8345 4.9230 4.9265 5.0197 5.0221 5.3128 5.3239 5.6197 5.6326 5.9588 5.9728 6.0913 6.0968 7.2489 7.2632 8.0729 8.0887 8.9568 8.9570 9.5867 9.6002 10.1363 10.1604 10.1978 10.2159 10.4172 10.4305 k = 0.3281 0.2347 0.7908 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7267 -5.7254 -5.0463 -5.0459 -5.0312 -5.0284 -4.9657 -4.9647 -2.7996 -2.7773 -2.7643 -2.7547 -2.1848 -2.1478 -2.1211 -2.1143 -2.1016 -2.0931 -0.9091 -0.9088 0.9321 0.9428 1.4112 1.4216 1.7944 1.8028 2.9570 2.9621 3.2287 3.2385 3.4114 3.4592 3.6141 3.6151 3.6477 3.6580 3.7698 3.8235 3.9320 3.9467 3.9908 4.0012 4.5098 4.5134 4.5220 4.5659 4.7612 4.7951 4.8243 4.8251 4.9219 4.9234 5.0440 5.0512 5.2851 5.2991 5.6650 5.6764 5.9451 5.9640 6.0930 6.0969 7.2166 7.2278 8.1122 8.1354 8.8872 8.8879 9.6539 9.6713 10.1313 10.1682 10.1780 10.2044 10.4377 10.4539 k = 0.3438 0.2458 0.7771 ( 8944 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7274 -5.7259 -5.0472 -5.0466 -5.0317 -5.0287 -4.9649 -4.9634 -2.8034 -2.7777 -2.7642 -2.7520 -2.1903 -2.1469 -2.1218 -2.1130 -2.1016 -2.0918 -0.9050 -0.9046 0.9417 0.9536 1.3914 1.4029 1.8449 1.8549 2.9140 2.9201 3.2072 3.2187 3.4165 3.4662 3.6102 3.6126 3.6475 3.6615 3.7707 3.8371 3.9221 3.9441 3.9966 4.0075 4.5054 4.5093 4.5192 4.5713 4.7485 4.7837 4.8140 4.8162 4.9195 4.9198 5.0690 5.0798 5.2606 5.2781 5.7101 5.7171 5.9285 5.9524 6.0956 6.0970 7.1843 7.1896 8.1571 8.1883 8.8238 8.8251 9.7132 9.7343 10.1241 10.1512 10.1899 10.2003 10.4577 10.4768 k = 0.3594 0.2570 0.7633 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7281 -5.7264 -5.0484 -5.0475 -5.0317 -5.0286 -4.9647 -4.9625 -2.8073 -2.7782 -2.7642 -2.7493 -2.1959 -2.1463 -2.1225 -2.1120 -2.1014 -2.0905 -0.8998 -0.8991 0.9526 0.9656 1.3756 1.3879 1.8968 1.9082 2.8678 2.8754 3.1837 3.1974 3.4235 3.4735 3.6061 3.6100 3.6465 3.6641 3.7698 3.8483 3.9126 3.9422 4.0026 4.0138 4.5011 4.5050 4.5162 4.5760 4.7371 4.7725 4.8041 4.8068 4.9147 4.9165 5.0937 5.1062 5.2398 5.2624 5.7522 5.7524 5.9094 5.9381 6.0970 6.0986 7.1518 7.1552 8.2060 8.2458 8.7676 8.7694 9.7631 9.7872 10.1092 10.1253 10.2109 10.2199 10.4768 10.4985 k = 0.3750 0.2682 0.7496 ( 8934 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7286 -5.7268 -5.0499 -5.0488 -5.0313 -5.0281 -4.9650 -4.9621 -2.8112 -2.7788 -2.7641 -2.7469 -2.2017 -2.1461 -2.1231 -2.1113 -2.1011 -2.0893 -0.8932 -0.8922 0.9646 0.9785 1.3637 1.3765 1.9496 1.9623 2.8193 2.8287 3.1598 3.1761 3.4312 3.4806 3.6018 3.6069 3.6449 3.6657 3.7668 3.8544 3.9060 3.9408 4.0088 4.0200 4.4965 4.5005 4.5130 4.5801 4.7269 4.7615 4.7950 4.7973 4.9090 4.9121 5.1167 5.1275 5.2240 5.2543 5.7795 5.7894 5.8880 5.9215 6.0965 6.1015 7.1177 7.1325 8.2574 8.3061 8.7196 8.7215 9.8028 9.8294 10.0872 10.0975 10.2360 10.2612 10.4949 10.5190 k = 0.3906 0.2794 0.7359 ( 8931 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7290 -5.7270 -5.0516 -5.0504 -5.0302 -5.0271 -4.9658 -4.9622 -2.8151 -2.7794 -2.7641 -2.7448 -2.2075 -2.1461 -2.1237 -2.1110 -2.1006 -2.0884 -0.8853 -0.8839 0.9773 0.9920 1.3557 1.3688 2.0030 2.0168 2.7691 2.7807 3.1369 3.1559 3.4386 3.4869 3.5974 3.6034 3.6428 3.6665 3.7613 3.8520 3.9057 3.9399 4.0151 4.0260 4.4918 4.4957 4.5097 4.5835 4.7176 4.7505 4.7869 4.7881 4.9026 4.9068 5.1343 5.1403 5.2162 5.2567 5.7968 5.8178 5.8650 5.9038 6.0948 6.1031 7.0906 7.1192 8.3098 8.3675 8.6811 8.6824 9.8328 9.8617 10.0607 10.0680 10.2711 10.3120 10.5122 10.5383 k = 0.4062 0.2905 0.7221 ( 8928 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7293 -5.7272 -5.0538 -5.0525 -5.0287 -5.0257 -4.9670 -4.9627 -2.8191 -2.7801 -2.7641 -2.7429 -2.2133 -2.1463 -2.1242 -2.1109 -2.1000 -2.0876 -0.8761 -0.8743 0.9905 1.0062 1.3514 1.3648 2.0564 2.0712 2.7179 2.7322 3.1159 3.1379 3.4452 3.4921 3.5926 3.5994 3.6402 3.6664 3.7537 3.8418 3.9111 3.9394 4.0215 4.0317 4.4868 4.4907 4.5065 4.5863 4.7092 4.7396 4.7795 4.7801 4.8957 4.9006 5.1417 5.1439 5.2205 5.2703 5.8027 5.8336 5.8411 5.8873 6.0909 6.1021 7.0735 7.1173 8.3612 8.4271 8.6536 8.6542 9.8542 9.8857 10.0313 10.0367 10.3114 10.3690 10.5293 10.5565 k = 0.4219 0.3017 0.7084 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7296 -5.7273 -5.0564 -5.0550 -5.0268 -5.0239 -4.9685 -4.9635 -2.8229 -2.7807 -2.7640 -2.7413 -2.2191 -2.1468 -2.1246 -2.1110 -2.0996 -2.0870 -0.8659 -0.8636 1.0040 1.0207 1.3508 1.3645 2.1093 2.1247 2.6667 2.6839 3.0974 3.1225 3.4506 3.4954 3.5876 3.5950 3.6371 3.6655 3.7446 3.8273 3.9189 3.9389 4.0279 4.0372 4.4815 4.4855 4.5034 4.5886 4.7014 4.7287 4.7720 4.7744 4.8885 4.8939 5.1395 5.1414 5.2358 5.2912 5.7959 5.8182 5.8312 5.8771 6.0839 6.0976 7.0682 7.1276 8.4092 8.4799 8.6371 8.6434 9.8673 9.9024 10.0003 10.0040 10.3520 10.4286 10.5467 10.5740 k = 0.4375 0.3129 0.6947 ( 8927 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7298 -5.7274 -5.0594 -5.0580 -5.0244 -5.0216 -4.9699 -4.9645 -2.8267 -2.7814 -2.7640 -2.7400 -2.2247 -2.1474 -2.1250 -2.1113 -2.0992 -2.0867 -0.8548 -0.8519 1.0176 1.0355 1.3539 1.3679 2.1607 2.1763 2.6164 2.6371 3.0818 3.1103 3.4544 3.4962 3.5823 3.5900 3.6337 3.6637 3.7350 3.8109 3.9270 3.9382 4.0342 4.0424 4.4759 4.4803 4.5004 4.5906 4.6943 4.7179 4.7657 4.7698 4.8813 4.8870 5.1331 5.1364 5.2557 5.3152 5.7762 5.7977 5.8136 5.8706 6.0737 6.0894 7.0750 7.1489 8.4504 8.5174 8.6357 8.6564 9.8701 9.9098 9.9709 9.9729 10.3883 10.4864 10.5649 10.5915 k = 0.4531 0.3241 0.6809 ( 8927 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7300 -5.7276 -5.0630 -5.0616 -5.0216 -5.0190 -4.9712 -4.9654 -2.8304 -2.7821 -2.7639 -2.7390 -2.2302 -2.1482 -2.1252 -2.1116 -2.0990 -2.0864 -0.8431 -0.8394 1.0312 1.0507 1.3608 1.3752 2.2089 2.2239 2.5687 2.5936 3.0690 3.1013 3.4563 3.4936 3.5767 3.5848 3.6301 3.6609 3.7260 3.7937 3.9346 3.9370 4.0405 4.0472 4.4702 4.4751 4.4977 4.5922 4.6875 4.7072 4.7606 4.7664 4.8742 4.8800 5.1259 5.1308 5.2756 5.3393 5.7497 5.7755 5.7896 5.8600 6.0610 6.0785 7.0926 7.1791 8.4826 8.5381 8.6511 8.6941 9.8567 9.8968 9.9493 9.9548 10.4160 10.5363 10.5841 10.6103 k = 0.4688 0.3352 0.6672 ( 8925 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7304 -5.7279 -5.0671 -5.0659 -5.0184 -5.0160 -4.9721 -4.9660 -2.8340 -2.7828 -2.7638 -2.7382 -2.2355 -2.1491 -2.1253 -2.1119 -2.0988 -2.0864 -0.8312 -0.8266 1.0446 1.0661 1.3713 1.3865 2.2508 2.2643 2.5269 2.5566 3.0587 3.0954 3.4563 3.4866 3.5709 3.5795 3.6263 3.6573 3.7184 3.7763 3.9351 3.9412 4.0466 4.0517 4.4644 4.4700 4.4951 4.5937 4.6811 4.6966 4.7571 4.7639 4.8674 4.8734 5.1191 5.1257 5.2927 5.3610 5.7210 5.7499 5.7631 5.8438 6.0473 6.0662 7.1184 7.2147 8.5077 8.5526 8.6803 8.7447 9.8248 9.8617 9.9375 9.9514 10.4323 10.5692 10.6025 10.6339 k = 0.4844 0.3464 0.6534 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7311 -5.7285 -5.0718 -5.0708 -5.0149 -5.0127 -4.9725 -4.9663 -2.8373 -2.7835 -2.7636 -2.7376 -2.2404 -2.1502 -2.1254 -2.1121 -2.0986 -2.0864 -0.8193 -0.8138 1.0579 1.0818 1.3857 1.4018 2.2795 2.2912 2.4976 2.5325 3.0504 3.0921 3.4541 3.4746 3.5650 3.5742 3.6224 3.6533 3.7128 3.7593 3.9326 3.9467 4.0525 4.0560 4.4588 4.4652 4.4928 4.5950 4.6750 4.6860 4.7549 4.7623 4.8609 4.8671 5.1132 5.1214 5.3049 5.3779 5.6913 5.7236 5.7355 5.8238 6.0341 6.0537 7.1492 7.2526 8.5310 8.5695 8.7169 8.7980 9.7817 9.8190 9.9283 9.9483 10.4368 10.5798 10.6166 10.6591 k = 0.5000 0.3576 0.6397 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7322 -5.7295 -5.0769 -5.0761 -5.0110 -5.0091 -4.9722 -4.9659 -2.8404 -2.7842 -2.7633 -2.7370 -2.2450 -2.1514 -2.1253 -2.1123 -2.0985 -2.0865 -0.8079 -0.8013 1.0710 1.0978 1.4040 1.4214 2.2850 2.2968 2.4911 2.5288 3.0434 3.0909 3.4498 3.4575 3.5590 3.5691 3.6187 3.6495 3.7091 3.7431 3.9293 3.9508 4.0582 4.0601 4.4535 4.4608 4.4907 4.5963 4.6692 4.6755 4.7540 4.7617 4.8550 4.8615 5.1081 5.1179 5.3098 5.3864 5.6614 5.7010 5.7074 5.8036 6.0224 6.0422 7.1819 7.2896 8.5560 8.5913 8.7551 8.8490 9.7349 9.7754 9.9145 9.9390 10.4311 10.5718 10.6211 10.6727 k = 0.5000 0.3576 0.6397 ( 8912 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7322 -5.7295 -5.0769 -5.0761 -5.0110 -5.0091 -4.9722 -4.9659 -2.8404 -2.7842 -2.7633 -2.7370 -2.2450 -2.1514 -2.1253 -2.1123 -2.0985 -2.0865 -0.8079 -0.8013 1.0710 1.0978 1.4040 1.4214 2.2850 2.2968 2.4911 2.5288 3.0434 3.0909 3.4498 3.4575 3.5590 3.5691 3.6187 3.6495 3.7091 3.7431 3.9293 3.9508 4.0582 4.0601 4.4535 4.4608 4.4907 4.5963 4.6692 4.6755 4.7540 4.7617 4.8550 4.8615 5.1081 5.1179 5.3098 5.3864 5.6614 5.7010 5.7074 5.8036 6.0224 6.0422 7.1819 7.2896 8.5560 8.5913 8.7551 8.8490 9.7349 9.7754 9.9145 9.9390 10.4311 10.5718 10.6211 10.6727 k = 0.5000 0.3576 0.6160 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7346 -5.7320 -5.0864 -5.0860 -5.0038 -5.0022 -4.9709 -4.9645 -2.8451 -2.7854 -2.7629 -2.7365 -2.2521 -2.1535 -2.1250 -2.1127 -2.0983 -2.0869 -0.7894 -0.7806 1.0949 1.1273 1.4404 1.4604 2.2701 2.2852 2.5032 2.5424 3.0307 3.0899 3.4195 3.4401 3.5485 3.5604 3.6124 3.6454 3.7060 3.7169 3.9227 3.9563 4.0671 4.0683 4.4454 4.4534 4.4872 4.5988 4.6566 4.6598 4.7535 4.7610 4.8459 4.8534 5.0996 5.1124 5.3109 5.3918 5.6099 5.6580 5.6679 5.7706 6.0039 6.0236 7.2391 7.3516 8.5996 8.6330 8.8172 8.9283 9.6550 9.7046 9.8791 9.9091 10.4070 10.5388 10.6090 10.6641 k = 0.5000 0.3576 0.5923 ( 8908 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7377 -5.7350 -5.0965 -5.0965 -4.9960 -4.9946 -4.9688 -4.9627 -2.8490 -2.7866 -2.7625 -2.7364 -2.2582 -2.1558 -2.1247 -2.1131 -2.0983 -2.0875 -0.7726 -0.7610 1.1215 1.1604 1.4794 1.5022 2.2537 2.2721 2.5165 2.5567 3.0153 3.0884 3.3748 3.4298 3.5378 3.5516 3.6066 3.6451 3.6931 3.7052 3.9156 3.9614 4.0745 4.0792 4.4387 4.4458 4.4834 4.6015 4.6371 4.6512 4.7530 4.7603 4.8380 4.8471 5.0903 5.1062 5.3119 5.3964 5.5586 5.6074 5.6355 5.7378 5.9855 6.0047 7.2973 7.4136 8.6381 8.6727 8.8714 8.9948 9.5810 9.6412 9.8322 9.8659 10.3722 10.4973 10.5747 10.6260 k = 0.5000 0.3576 0.5686 ( 8900 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7412 -5.7387 -5.1074 -5.1072 -4.9877 -4.9865 -4.9661 -4.9602 -2.8520 -2.7878 -2.7621 -2.7366 -2.2631 -2.1580 -2.1243 -2.1135 -2.0984 -2.0883 -0.7579 -0.7433 1.1508 1.1971 1.5209 1.5466 2.2360 2.2575 2.5307 2.5716 2.9972 3.0864 3.3263 3.4188 3.5271 3.5423 3.6013 3.6482 3.6720 3.7059 3.9084 3.9662 4.0823 4.0908 4.4339 4.4380 4.4793 4.6047 4.6176 4.6436 4.7525 4.7594 4.8312 4.8421 5.0804 5.0994 5.3128 5.4001 5.5083 5.5566 5.6042 5.7057 5.9671 5.9856 7.3555 7.4745 8.6689 8.7077 8.9153 9.0438 9.5180 9.5877 9.7732 9.8091 10.3298 10.4508 10.5211 10.5667 k = 0.5000 0.3576 0.5449 ( 8900 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7454 -5.7430 -5.1186 -5.1184 -4.9789 -4.9778 -4.9625 -4.9571 -2.8541 -2.7889 -2.7617 -2.7370 -2.2670 -2.1602 -2.1238 -2.1140 -2.0985 -2.0894 -0.7462 -0.7280 1.1829 1.2371 1.5644 1.5931 2.2169 2.2412 2.5457 2.5872 2.9768 3.0838 3.2763 3.4073 3.5170 3.5326 3.5967 3.6538 3.6541 3.7076 3.9012 3.9708 4.0906 4.1031 4.4300 4.4309 4.4749 4.5983 4.6085 4.6368 4.7518 4.7585 4.8252 4.8379 5.0700 5.0922 5.3132 5.4027 5.4594 5.5062 5.5746 5.6749 5.9488 5.9666 7.4127 7.5334 8.6890 8.7347 8.9483 9.0715 9.4714 9.5463 9.7033 9.7399 10.2816 10.3998 10.4548 10.4957 k = 0.5000 0.3576 0.5212 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7502 -5.7480 -5.1302 -5.1298 -4.9698 -4.9688 -4.9581 -4.9533 -2.8553 -2.7899 -2.7614 -2.7377 -2.2697 -2.1622 -2.1233 -2.1145 -2.0988 -2.0907 -0.7377 -0.7157 1.2175 1.2803 1.6098 1.6414 2.1968 2.2234 2.5615 2.6031 2.9542 3.0807 3.2265 3.3954 3.5078 3.5226 3.5929 3.6392 3.6611 3.7101 3.8947 3.9751 4.0996 4.1161 4.4219 4.4300 4.4703 4.5796 4.6126 4.6310 4.7508 4.7575 4.8199 4.8340 5.0594 5.0848 5.3131 5.4032 5.4132 5.4569 5.5475 5.6458 5.9304 5.9476 7.4678 7.5891 8.6962 8.7497 8.9703 9.0773 9.4453 9.5188 9.6251 9.6607 10.2275 10.3419 10.3814 10.4218 k = 0.5000 0.3576 0.4975 ( 8918 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7556 -5.7537 -5.1419 -5.1415 -4.9604 -4.9593 -4.9527 -4.9487 -2.8555 -2.7908 -2.7611 -2.7384 -2.2712 -2.1640 -2.1227 -2.1150 -2.0989 -2.0921 -0.7330 -0.7070 1.2545 1.3263 1.6568 1.6910 2.1759 2.2041 2.5778 2.6193 2.9302 3.0770 3.1787 3.3836 3.4995 3.5126 3.5899 3.6270 3.6692 3.7135 3.8892 3.9797 4.1093 4.1297 4.4136 4.4310 4.4656 4.5617 4.6167 4.6267 4.7494 4.7565 4.8152 4.8300 5.0490 5.0774 5.3120 5.3679 5.4027 5.4094 5.5240 5.6189 5.9123 5.9287 7.5200 7.6405 8.6901 8.7499 8.9808 9.0652 9.4385 9.5060 9.5424 9.5748 10.1668 10.2726 10.3048 10.3522 k = 0.5000 0.3576 0.4739 ( 8920 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7616 -5.7600 -5.1537 -5.1533 -4.9511 -4.9496 -4.9461 -4.9434 -2.8547 -2.7914 -2.7608 -2.7391 -2.2716 -2.1655 -2.1220 -2.1155 -2.0990 -2.0936 -0.7323 -0.7021 1.2937 1.3747 1.7052 1.7414 2.1545 2.1833 2.5946 2.6356 2.9056 3.0719 3.1345 3.3719 3.4924 3.5027 3.5877 3.6173 3.6774 3.7176 3.8855 3.9848 4.1197 4.1440 4.4051 4.4333 4.4614 4.5447 4.6171 4.6274 4.7474 4.7556 4.8111 4.8256 5.0389 5.0703 5.3093 5.3262 5.3640 5.3974 5.5055 5.5949 5.8943 5.9102 7.5681 7.6864 8.6732 8.7348 8.9785 9.0406 9.4271 9.4780 9.4784 9.5152 10.0990 10.1918 10.2268 10.2875 k = 0.5000 0.3576 0.4502 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7681 -5.7668 -5.1655 -5.1651 -4.9423 -4.9396 -4.9381 -4.9373 -2.8528 -2.7919 -2.7606 -2.7399 -2.2708 -2.1667 -2.1212 -2.1159 -2.0991 -2.0953 -0.7358 -0.7014 1.3346 1.4248 1.7548 1.7919 2.1333 2.1612 2.6118 2.6518 2.8811 3.0621 3.0984 3.3607 3.4865 3.4930 3.5862 3.6095 3.6848 3.7220 3.8847 3.9909 4.1308 4.1589 4.3965 4.4353 4.4592 4.5287 4.6138 4.6331 4.7444 4.7549 4.8075 4.8203 5.0296 5.0636 5.2874 5.3023 5.3235 5.3872 5.4933 5.5742 5.8765 5.8919 7.6111 7.7257 8.6490 8.7074 8.9630 9.0076 9.3502 9.3861 9.4916 9.5317 10.0246 10.1049 10.1468 10.2213 k = 0.5000 0.3576 0.4265 ( 8932 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7752 -5.7741 -5.1773 -5.1769 -4.9340 -4.9306 -4.9294 -4.9287 -2.8501 -2.7920 -2.7604 -2.7406 -2.2689 -2.1676 -2.1204 -2.1162 -2.0992 -2.0970 -0.7434 -0.7051 1.3768 1.4758 1.8053 1.8412 2.1131 2.1381 2.6291 2.6676 2.8578 3.0385 3.0801 3.3502 3.4816 3.4836 3.5852 3.6034 3.6911 3.7260 3.8876 3.9984 4.1426 4.1744 4.3877 4.4339 4.4620 4.5139 4.6102 4.6402 4.7405 4.7543 4.8043 4.8141 5.0213 5.0577 5.2515 5.2743 5.3043 5.3720 5.4876 5.5574 5.8591 5.8741 7.6481 7.7573 8.6215 8.6725 8.9351 8.9675 9.2600 9.2909 9.5276 9.5624 9.9454 10.0161 10.0626 10.1479 k = 0.5000 0.3576 0.4028 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7826 -5.7818 -5.1889 -5.1886 -4.9255 -4.9231 -4.9193 -4.9187 -2.8465 -2.7919 -2.7602 -2.7411 -2.2659 -2.1680 -2.1195 -2.1163 -2.0993 -2.0987 -0.7550 -0.7131 1.4198 1.5269 1.8565 1.8871 2.0962 2.1143 2.6464 2.6829 2.8365 3.0079 3.0737 3.3405 3.4747 3.4778 3.5844 3.5989 3.6962 3.7286 3.8951 4.0077 4.1551 4.1905 4.3786 4.4287 4.4700 4.5005 4.6069 4.6480 4.7353 4.7539 4.8016 4.8066 5.0145 5.0526 5.2186 5.2368 5.2946 5.3532 5.4870 5.5449 5.8421 5.8567 7.6783 7.7805 8.5937 8.6346 8.8971 8.9216 9.1691 9.1958 9.5716 9.6013 9.8635 9.9275 9.9719 10.0635 k = 0.5000 0.3576 0.3791 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3105 -15.3105 -5.7904 -5.7899 -5.2003 -5.2000 -4.9165 -4.9150 -4.9091 -4.9087 -2.8421 -2.7914 -2.7600 -2.7416 -2.2618 -2.1679 -2.1185 -2.1162 -2.1005 -2.0993 -0.7705 -0.7253 1.4631 1.5770 1.9077 1.9250 2.0869 2.0904 2.6636 2.6973 2.8180 2.9790 3.0708 3.3316 3.4663 3.4750 3.5829 3.5963 3.7001 3.7292 3.9078 4.0192 4.1682 4.2073 4.3694 4.4212 4.4815 4.4886 4.6040 4.6562 4.7290 4.7538 4.7978 4.7992 5.0091 5.0483 5.1890 5.2008 5.2835 5.3324 5.4899 5.5368 5.8256 5.8399 7.7010 7.7948 8.5678 8.5971 8.8514 8.8708 9.0796 9.1022 9.6193 9.6441 9.7804 9.8405 9.8738 9.9677 k = 0.5000 0.3576 0.3554 ( 8926 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.7984 -5.7981 -5.2114 -5.2111 -4.9072 -4.9065 -4.8991 -4.8986 -2.8369 -2.7907 -2.7598 -2.7420 -2.2566 -2.1674 -2.1175 -2.1159 -2.1024 -2.0994 -0.7896 -0.7416 1.5061 1.6253 1.9467 1.9573 2.0682 2.0930 2.6805 2.7105 2.8031 2.9540 3.0699 3.3238 3.4586 3.4731 3.5799 3.5962 3.7028 3.7279 3.9254 4.0333 4.1817 4.2246 4.3601 4.4124 4.4783 4.4954 4.6016 4.6642 4.7216 4.7536 4.7879 4.7971 5.0049 5.0443 5.1628 5.1676 5.2701 5.3106 5.4954 5.5332 5.8096 5.8236 7.7159 7.8006 8.5446 8.5621 8.8005 8.8166 8.9924 9.0109 9.6656 9.6844 9.6977 9.7558 9.7709 9.8648 k = 0.5000 0.3576 0.3317 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8065 -5.8065 -5.2221 -5.2219 -4.8977 -4.8976 -4.8891 -4.8887 -2.8311 -2.7896 -2.7597 -2.7423 -2.2504 -2.1663 -2.1165 -2.1154 -2.1041 -2.0995 -0.8117 -0.7615 1.5483 1.6708 1.9484 1.9955 2.0574 2.1183 2.6969 2.7219 2.7925 2.9332 3.0711 3.3171 3.4516 3.4721 3.5754 3.5982 3.7038 3.7255 3.9471 4.0499 4.1957 4.2425 4.3508 4.4027 4.4698 4.5111 4.5997 4.6715 4.7139 4.7530 4.7776 4.7953 5.0013 5.0396 5.1379 5.1407 5.2547 5.2884 5.5028 5.5336 5.7943 5.8080 7.7234 7.7985 8.5244 8.5303 8.7464 8.7603 8.9085 8.9228 9.6033 9.6653 9.6717 9.6935 9.7211 9.7861 k = 0.5000 0.3576 0.3080 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8148 -5.8146 -5.2323 -5.2322 -4.8886 -4.8880 -4.8795 -4.8790 -2.8248 -2.7882 -2.7596 -2.7424 -2.2433 -2.1649 -2.1155 -2.1146 -2.1058 -2.0996 -0.8363 -0.7847 1.5891 1.7128 1.9372 1.9950 2.0851 2.1554 2.7125 2.7311 2.7868 2.9162 3.0746 3.3118 3.4453 3.4721 3.5696 3.6017 3.7022 3.7235 3.9723 4.0691 4.2100 4.2609 4.3416 4.3924 4.4633 4.5283 4.5982 4.6759 4.7077 4.7501 4.7691 4.7938 4.9970 5.0328 5.1128 5.1240 5.2374 5.2661 5.5118 5.5376 5.7798 5.7932 7.7239 7.7899 8.5018 8.5061 8.6905 8.7032 8.8284 8.8386 9.4998 9.5770 9.5840 9.6106 9.7650 9.7986 k = 0.5000 0.3576 0.2843 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8230 -5.8227 -5.2421 -5.2420 -4.8794 -4.8783 -4.8701 -4.8697 -2.8181 -2.7865 -2.7595 -2.7425 -2.2353 -2.1630 -2.1148 -2.1135 -2.1072 -2.0998 -0.8630 -0.8106 1.6280 1.7506 1.9204 1.9747 2.1321 2.1965 2.7272 2.7379 2.7862 2.9026 3.0810 3.3079 3.4399 3.4728 3.5629 3.6063 3.6974 3.7227 3.9999 4.0907 4.2243 4.2795 4.3331 4.3820 4.4587 4.5464 4.5972 4.6742 4.7066 4.7418 4.7656 4.7926 4.9899 5.0224 5.0942 5.1135 5.2186 5.2437 5.5221 5.5447 5.7660 5.7790 7.7187 7.7763 8.4755 8.4887 8.6342 8.6466 8.7526 8.7588 9.3859 9.4717 9.5000 9.5297 9.8069 9.8322 k = 0.5000 0.3576 0.2606 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3105 -5.8310 -5.8306 -5.2513 -5.2513 -4.8703 -4.8688 -4.8612 -4.8607 -2.8112 -2.7847 -2.7595 -2.7426 -2.2265 -2.1609 -2.1146 -2.1121 -2.1080 -2.1000 -0.8911 -0.8387 1.6648 1.7840 1.9017 1.9513 2.1812 2.2380 2.7408 2.7434 2.7894 2.8918 3.0909 3.3058 3.4354 3.4743 3.5551 3.6118 3.6901 3.7228 4.0294 4.1145 4.2385 4.2964 4.3274 4.3720 4.4560 4.5653 4.5965 4.6663 4.7105 4.7298 4.7660 4.7916 4.9782 5.0082 5.0836 5.1090 5.1987 5.2212 5.5337 5.5541 5.7532 5.7658 7.7090 7.7593 8.4500 8.4703 8.5786 8.5917 8.6817 8.6842 9.2700 9.3518 9.4310 9.4593 9.8445 9.8640 k = 0.5000 0.3576 0.2369 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8387 -5.8381 -5.2599 -5.2599 -4.8613 -4.8596 -4.8527 -4.8522 -2.8041 -2.7827 -2.7596 -2.7425 -2.2169 -2.1584 -2.1152 -2.1104 -2.1078 -2.1002 -0.9199 -0.8683 1.6991 1.8129 1.8828 1.9279 2.2289 2.2778 2.7489 2.7532 2.7947 2.8830 3.1045 3.3055 3.4316 3.4765 3.5464 3.6180 3.6812 3.7231 4.0599 4.1397 4.2521 4.3032 4.3331 4.3630 4.4555 4.5842 4.5959 4.6555 4.7165 4.7166 4.7682 4.7908 4.9619 4.9911 5.0806 5.1090 5.1779 5.1987 5.5463 5.5654 5.7415 5.7534 7.6963 7.7404 8.4238 8.4494 8.5250 8.5396 8.6152 8.6159 9.1575 9.2349 9.3681 9.3947 9.8772 9.8912 k = 0.5000 0.3576 0.2132 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8459 -5.8453 -5.2679 -5.2679 -4.8527 -4.8509 -4.8448 -4.8442 -2.7970 -2.7805 -2.7596 -2.7425 -2.2067 -2.1557 -2.1165 -2.1087 -2.1069 -2.1002 -0.9487 -0.8987 1.7307 1.8371 1.8645 1.9053 2.2738 2.3152 2.7554 2.7643 2.8005 2.8754 3.1220 3.3074 3.4287 3.4793 3.5368 3.6249 3.6711 3.7231 4.0907 4.1659 4.2646 4.2986 4.3517 4.3562 4.4571 4.5953 4.6023 4.6437 4.7039 4.7229 4.7715 4.7902 4.9430 4.9724 5.0832 5.1118 5.1564 5.1762 5.5595 5.5777 5.7311 5.7422 7.6818 7.7208 8.3952 8.4239 8.4746 8.4911 8.5527 8.5555 9.0521 9.1252 9.3109 9.3354 9.9047 9.9128 k = 0.5000 0.3576 0.1895 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8526 -5.8520 -5.2751 -5.2751 -4.8447 -4.8428 -4.8374 -4.8368 -2.7900 -2.7784 -2.7598 -2.7425 -2.1961 -2.1530 -2.1182 -2.1075 -2.1056 -2.0997 -0.9768 -0.9293 1.7594 1.8473 1.8564 1.8844 2.3152 2.3495 2.7627 2.7743 2.8062 2.8684 3.1430 3.3115 3.4264 3.4824 3.5263 3.6323 3.6600 3.7227 4.1211 4.1918 4.2746 4.2917 4.3533 4.3743 4.4610 4.5940 4.6180 4.6319 4.6932 4.7290 4.7756 4.7896 4.9234 4.9531 5.0891 5.1153 5.1344 5.1542 5.5729 5.5903 5.7222 5.7322 7.6668 7.7013 8.3640 8.3921 8.4291 8.4465 8.4970 8.5004 8.9570 9.0255 9.2593 9.2817 9.9269 9.9285 k = 0.5000 0.3576 0.1658 ( 8924 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8587 -5.8581 -5.2816 -5.2816 -4.8372 -4.8354 -4.8307 -4.8299 -2.7833 -2.7762 -2.7600 -2.7426 -2.1852 -2.1502 -2.1200 -2.1070 -2.1040 -2.0984 -1.0035 -0.9592 1.7854 1.8318 1.8607 1.8760 2.3524 2.3804 2.7706 2.7830 2.8113 2.8616 3.1670 3.3176 3.4248 3.4855 3.5157 3.6400 3.6482 3.7216 4.1502 4.2161 4.2806 4.2849 4.3567 4.3986 4.4672 4.5916 4.6206 4.6280 4.6878 4.7348 4.7805 4.7893 4.9044 4.9336 5.0965 5.1124 5.1147 5.1369 5.5862 5.6024 5.7153 5.7238 7.6521 7.6827 8.3310 8.3545 8.3886 8.4055 8.4482 8.4500 8.8747 8.9378 9.2136 9.2335 9.9381 9.9436 k = 0.5000 0.3576 0.1422 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8641 -5.8635 -5.2873 -5.2873 -4.8305 -4.8290 -4.8247 -4.8238 -2.7770 -2.7740 -2.7602 -2.7427 -2.1743 -2.1475 -2.1218 -2.1075 -2.1022 -2.0964 -1.0279 -0.9878 1.8080 1.8186 1.8443 1.8864 2.3853 2.4077 2.7786 2.7907 2.8155 2.8549 3.1932 3.3254 3.4236 3.4862 3.5071 3.6356 3.6479 3.7198 4.1774 4.2373 4.2787 4.2818 4.3677 4.4239 4.4759 4.5872 4.6105 4.6286 4.6912 4.7403 4.7863 4.7891 4.8871 4.9143 5.0884 5.0994 5.1067 5.1343 5.5984 5.6128 5.7106 5.7173 7.6385 7.6654 8.2984 8.3155 8.3513 8.3677 8.4035 8.4053 8.8067 8.8634 9.1738 9.1912 9.9415 9.9540 k = 0.5000 0.3576 0.1185 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8688 -5.8683 -5.2922 -5.2921 -4.8247 -4.8234 -4.8194 -4.8185 -2.7720 -2.7711 -2.7606 -2.7431 -2.1637 -2.1449 -2.1237 -2.1086 -2.1003 -2.0942 -1.0493 -1.0143 1.8060 1.8285 1.8295 1.8947 2.4136 2.4312 2.7860 2.7972 2.8189 2.8482 3.2206 3.3343 3.4228 3.4794 3.5060 3.6224 3.6559 3.7173 4.2020 4.2543 4.2734 4.2798 4.3853 4.4492 4.4866 4.5798 4.6021 4.6214 4.7015 4.7456 4.7892 4.7930 4.8722 4.8955 5.0665 5.0774 5.1152 5.1379 5.6090 5.6209 5.7086 5.7129 7.6266 7.6497 8.2682 8.2790 8.3172 8.3337 8.3604 8.3671 8.7534 8.8023 9.1401 9.1548 9.9385 9.9565 k = 0.5000 0.3576 0.0948 ( 8918 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8727 -5.8722 -5.2962 -5.2962 -4.8198 -4.8189 -4.8149 -4.8140 -2.7702 -2.7659 -2.7609 -2.7437 -2.1537 -2.1424 -2.1257 -2.1103 -2.0983 -2.0922 -1.0672 -1.0380 1.7968 1.8147 1.8471 1.8999 2.4372 2.4506 2.7925 2.8027 2.8214 2.8418 3.2484 3.3431 3.4222 3.4669 3.5110 3.6086 3.6639 3.7140 4.2235 4.2664 4.2691 4.2763 4.4072 4.4737 4.4993 4.5700 4.5945 4.6108 4.7140 4.7503 4.7899 4.8006 4.8602 4.8774 5.0453 5.0551 5.1237 5.1419 5.6173 5.6261 5.7089 5.7109 7.6167 7.6360 8.2418 8.2471 8.2874 8.3040 8.3218 8.3333 8.7139 8.7539 9.1127 9.1245 9.9297 9.9489 k = 0.5000 0.3576 0.0711 ( 8916 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8757 -5.8754 -5.2994 -5.2993 -4.8160 -4.8154 -4.8112 -4.8104 -2.7685 -2.7626 -2.7600 -2.7446 -2.1446 -2.1401 -2.1276 -2.1125 -2.0963 -2.0908 -1.0808 -1.0582 1.7898 1.8033 1.8623 1.9022 2.4561 2.4658 2.7980 2.8069 2.8231 2.8359 3.2754 3.3504 3.4216 3.4530 3.5187 3.5944 3.6718 3.7099 4.2418 4.2659 4.2710 4.2756 4.4312 4.4956 4.5132 4.5590 4.5867 4.5991 4.7261 4.7541 4.7918 4.8086 4.8514 4.8606 5.0262 5.0342 5.1312 5.1451 5.6230 5.6289 5.7108 5.7109 7.6093 7.6243 8.2202 8.2213 8.2632 8.2779 8.2913 8.3048 8.6865 8.7169 9.0915 9.1005 9.9173 9.9330 k = 0.5000 0.3576 0.0474 ( 8902 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8779 -5.8777 -5.3016 -5.3016 -4.8133 -4.8129 -4.8085 -4.8079 -2.7669 -2.7627 -2.7564 -2.7459 -2.1379 -2.1365 -2.1295 -2.1154 -2.0942 -2.0900 -1.0897 -1.0743 1.7855 1.7945 1.8750 1.9018 2.4702 2.4765 2.8026 2.8097 2.8242 2.8308 3.3008 3.3540 3.4213 3.4399 3.5283 3.5800 3.6794 3.7050 4.2564 4.2640 4.2681 4.2788 4.4552 4.5114 4.5278 4.5497 4.5779 4.5870 4.7366 4.7560 4.7957 4.8158 4.8457 4.8461 5.0106 5.0163 5.1377 5.1470 5.6265 5.6300 5.7123 5.7130 7.6046 7.6149 8.2028 8.2039 8.2454 8.2551 8.2719 8.2826 8.6696 8.6900 9.0768 9.0828 9.9050 9.9151 k = 0.5000 0.3576 0.0237 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8792 -5.8791 -5.3030 -5.3030 -4.8116 -4.8115 -4.8067 -4.8064 -2.7657 -2.7635 -2.7530 -2.7477 -2.1358 -2.1320 -2.1291 -2.1191 -2.0924 -2.0901 -1.0936 -1.0858 1.7837 1.7882 1.8854 1.8988 2.4793 2.4824 2.8065 2.8106 2.8248 2.8273 3.3231 3.3513 3.4217 3.4296 3.5395 3.5658 3.6866 3.6995 4.2632 4.2654 4.2675 4.2786 4.4777 4.5117 4.5422 4.5510 4.5676 4.5746 4.7452 4.7552 4.8022 4.8177 4.8376 4.8417 5.0006 5.0036 5.1425 5.1472 5.6285 5.6300 5.7139 5.7145 7.6028 7.6080 8.1920 8.1934 8.2349 8.2393 8.2622 8.2679 8.6620 8.6722 9.0686 9.0716 9.8968 9.9015 k = 0.5000 0.3576-0.0000 ( 8922 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3582 -15.3582 -15.3242 -15.3242 -15.3106 -15.3106 -5.8796 -5.8796 -5.3034 -5.3034 -4.8110 -4.8110 -4.8060 -4.8060 -2.7645 -2.7645 -2.7501 -2.7501 -2.1338 -2.1338 -2.1237 -2.1237 -2.0910 -2.0910 -1.0923 -1.0923 1.7846 1.7846 1.8933 1.8933 2.4834 2.4834 2.8093 2.8093 2.8255 2.8255 3.3407 3.3407 3.4238 3.4238 3.5521 3.5521 3.6933 3.6933 4.2638 4.2638 4.2748 4.2748 4.4975 4.4975 4.5556 4.5556 4.5621 4.5621 4.7514 4.7514 4.8107 4.8107 4.8384 4.8384 4.9980 4.9980 5.1458 5.1458 5.6295 5.6295 5.7148 5.7148 7.6039 7.6039 8.1891 8.1891 8.2326 8.2326 8.2610 8.2610 8.6630 8.6630 9.0668 9.0668 9.8952 9.8952 k = 0.0000 0.0000 0.8595 ( 8950 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7239 -5.0482 -5.0482 -5.0227 -5.0227 -4.9706 -4.9706 -2.7827 -2.7827 -2.7638 -2.7638 -2.1602 -2.1602 -2.1223 -2.1223 -2.0948 -2.0948 -0.9310 -0.9310 0.9733 0.9733 1.2345 1.2345 2.3468 2.3468 2.4488 2.4488 3.0863 3.0863 3.5119 3.5119 3.6186 3.6186 3.6657 3.6657 3.8802 3.8802 3.9392 3.9392 4.0135 4.0135 4.4994 4.4994 4.5561 4.5561 4.7477 4.7477 4.7558 4.7558 4.9726 4.9726 5.1386 5.1386 5.3192 5.3192 5.9204 5.9204 5.9923 5.9923 6.1592 6.1592 6.8938 6.8938 8.2070 8.2070 8.3930 8.3930 9.8998 9.8998 10.2332 10.2332 10.4334 10.4334 10.5395 10.5395 k = 0.0192 0.0138 0.8595 ( 8946 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7239 -5.0482 -5.0482 -5.0228 -5.0228 -4.9706 -4.9706 -2.7827 -2.7827 -2.7638 -2.7638 -2.1602 -2.1602 -2.1222 -2.1222 -2.0949 -2.0949 -0.9307 -0.9307 0.9724 0.9724 1.2366 1.2366 2.3106 2.3106 2.4847 2.4847 3.0892 3.0892 3.5109 3.5109 3.6187 3.6187 3.6656 3.6656 3.8792 3.8792 3.9392 3.9392 4.0132 4.0132 4.4996 4.4996 4.5560 4.5560 4.7475 4.7475 4.7575 4.7575 4.9722 4.9722 5.1393 5.1393 5.3152 5.3152 5.9179 5.9179 5.9913 5.9913 6.1572 6.1572 6.8996 6.8996 8.2057 8.2057 8.3995 8.3995 9.8994 9.8994 10.2293 10.2293 10.4314 10.4314 10.5366 10.5366 k = 0.0385 0.0275 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7239 -5.7239 -5.0480 -5.0480 -5.0229 -5.0229 -4.9706 -4.9706 -2.7827 -2.7827 -2.7638 -2.7638 -2.1602 -2.1602 -2.1221 -2.1221 -2.0950 -2.0950 -0.9301 -0.9301 0.9697 0.9697 1.2428 1.2428 2.2475 2.2475 2.5470 2.5470 3.0975 3.0975 3.5079 3.5079 3.6187 3.6187 3.6653 3.6653 3.8762 3.8762 3.9393 3.9393 4.0121 4.0121 4.5003 4.5003 4.5555 4.5555 4.7477 4.7477 4.7621 4.7621 4.9710 4.9710 5.1413 5.1413 5.3039 5.3039 5.9101 5.9101 5.9886 5.9886 6.1517 6.1517 6.9167 6.9167 8.2016 8.2016 8.4192 8.4192 9.8976 9.8976 10.2179 10.2179 10.4256 10.4256 10.5282 10.5282 k = 0.0577 0.0413 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7238 -5.7238 -5.0478 -5.0478 -5.0232 -5.0232 -4.9706 -4.9706 -2.7826 -2.7826 -2.7638 -2.7638 -2.1602 -2.1602 -2.1219 -2.1219 -2.0953 -2.0953 -0.9291 -0.9291 0.9654 0.9654 1.2531 1.2531 2.1802 2.1802 2.6128 2.6128 3.1109 3.1109 3.5028 3.5028 3.6189 3.6189 3.6648 3.6648 3.8710 3.8710 3.9395 3.9395 4.0104 4.0104 4.5014 4.5014 4.5547 4.5547 4.7491 4.7491 4.7686 4.7686 4.9691 4.9691 5.1437 5.1437 5.2871 5.2871 5.8955 5.8955 5.9854 5.9854 6.1437 6.1437 6.9440 6.9440 8.1935 8.1935 8.4524 8.4524 9.8933 9.8933 10.1998 10.1998 10.4160 10.4160 10.5149 10.5149 k = 0.0769 0.0550 0.8595 ( 8948 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7238 -5.7238 -5.0474 -5.0474 -5.0235 -5.0235 -4.9707 -4.9707 -2.7826 -2.7826 -2.7639 -2.7639 -2.1603 -2.1603 -2.1216 -2.1216 -2.0957 -2.0957 -0.9277 -0.9277 0.9598 0.9598 1.2675 1.2675 2.1123 2.1123 2.6784 2.6784 3.1289 3.1289 3.4958 3.4958 3.6191 3.6191 3.6641 3.6641 3.8637 3.8637 3.9400 3.9400 4.0081 4.0081 4.5028 4.5028 4.5536 4.5536 4.7518 4.7518 4.7766 4.7766 4.9663 4.9663 5.1443 5.1443 5.2685 5.2685 5.8727 5.8727 5.9826 5.9826 6.1348 6.1348 6.9801 6.9801 8.1808 8.1808 8.4987 8.4987 9.8843 9.8843 10.1772 10.1772 10.4030 10.4030 10.4978 10.4978 k = 0.0962 0.0688 0.8595 ( 8950 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7238 -5.7238 -5.0470 -5.0470 -5.0239 -5.0239 -4.9708 -4.9708 -2.7826 -2.7826 -2.7639 -2.7639 -2.1604 -2.1604 -2.1213 -2.1213 -2.0961 -2.0961 -0.9261 -0.9261 0.9531 0.9531 1.2860 1.2860 2.0449 2.0449 2.7426 2.7426 3.1506 3.1506 3.4871 3.4871 3.6194 3.6194 3.6630 3.6630 3.8543 3.8543 3.9409 3.9409 4.0051 4.0051 4.5047 4.5047 4.5522 4.5522 4.7561 4.7561 4.7859 4.7859 4.9628 4.9628 5.1391 5.1391 5.2541 5.2541 5.8415 5.8415 5.9809 5.9809 6.1261 6.1261 7.0231 7.0231 8.1637 8.1637 8.5571 8.5571 9.8668 9.8668 10.1538 10.1538 10.3869 10.3869 10.4783 10.4783 k = 0.1154 0.0825 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7238 -5.7238 -5.0466 -5.0466 -5.0244 -5.0244 -4.9708 -4.9708 -2.7826 -2.7826 -2.7639 -2.7639 -2.1605 -2.1605 -2.1209 -2.1209 -2.0966 -2.0966 -0.9243 -0.9243 0.9459 0.9459 1.3084 1.3084 1.9785 1.9785 2.8046 2.8046 3.1749 3.1749 3.4767 3.4767 3.6198 3.6198 3.6616 3.6616 3.8428 3.8428 3.9424 3.9424 4.0017 4.0017 4.5070 4.5070 4.5506 4.5506 4.7620 4.7620 4.7963 4.7963 4.9586 4.9586 5.1233 5.1233 5.2506 5.2506 5.8029 5.8029 5.9801 5.9801 6.1183 6.1183 7.0709 7.0709 8.1425 8.1425 8.6259 8.6259 9.8364 9.8364 10.1344 10.1344 10.3683 10.3683 10.4577 10.4577 k = 0.1346 0.0963 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7237 -5.7237 -5.0461 -5.0461 -5.0249 -5.0249 -4.9709 -4.9709 -2.7825 -2.7825 -2.7640 -2.7640 -2.1606 -2.1606 -2.1205 -2.1205 -2.0971 -2.0971 -0.9224 -0.9224 0.9385 0.9385 1.3348 1.3348 1.9136 1.9136 2.8636 2.8636 3.2004 3.2004 3.4653 3.4653 3.6203 3.6203 3.6597 3.6597 3.8298 3.8298 3.9444 3.9444 3.9978 3.9978 4.5097 4.5097 4.5485 4.5485 4.7696 4.7696 4.8073 4.8073 4.9538 4.9538 5.0976 5.0976 5.2592 5.2592 5.7583 5.7583 5.9801 5.9801 6.1117 6.1117 7.1212 7.1212 8.1181 8.1181 8.7035 8.7035 9.7899 9.7899 10.1229 10.1229 10.3475 10.3475 10.4373 10.4373 k = 0.1538 0.1100 0.8595 ( 8936 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7237 -5.7237 -5.0456 -5.0456 -5.0254 -5.0254 -4.9710 -4.9710 -2.7825 -2.7825 -2.7641 -2.7641 -2.1607 -2.1607 -2.1201 -2.1201 -2.0976 -2.0976 -0.9206 -0.9206 0.9314 0.9314 1.3650 1.3650 1.8504 1.8504 2.9187 2.9187 3.2250 3.2250 3.4537 3.4537 3.6210 3.6210 3.6571 3.6571 3.8157 3.8157 3.9469 3.9469 3.9935 3.9935 4.5126 4.5126 4.5462 4.5462 4.7789 4.7789 4.8184 4.8184 4.9484 4.9484 5.0666 5.0666 5.2770 5.2770 5.7097 5.7097 5.9805 5.9805 6.1062 6.1062 7.1717 7.1717 8.0916 8.0916 8.7884 8.7884 9.7275 9.7275 10.1205 10.1205 10.3253 10.3253 10.4184 10.4184 k = 0.1731 0.1238 0.8595 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7237 -5.7237 -5.0451 -5.0451 -5.0259 -5.0259 -4.9710 -4.9710 -2.7824 -2.7824 -2.7641 -2.7641 -2.1608 -2.1608 -2.1197 -2.1197 -2.0981 -2.0981 -0.9190 -0.9190 0.9249 0.9249 1.3989 1.3989 1.7893 1.7893 2.9690 2.9690 3.2465 3.2465 3.4432 3.4432 3.6220 3.6220 3.6537 3.6537 3.8016 3.8016 3.9498 3.9498 3.9891 3.9891 4.5159 4.5159 4.5436 4.5436 4.7899 4.7899 4.8290 4.8290 4.9429 4.9429 5.0344 5.0344 5.3017 5.3017 5.6588 5.6588 5.9812 5.9812 6.1019 6.1019 7.2197 7.2197 8.0645 8.0645 8.8792 8.8792 9.6517 9.6517 10.1257 10.1257 10.3021 10.3021 10.4017 10.4017 k = 0.1923 0.1375 0.8595 ( 8914 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0446 -5.0446 -5.0264 -5.0264 -4.9711 -4.9711 -2.7824 -2.7824 -2.7641 -2.7641 -2.1608 -2.1608 -2.1193 -2.1193 -2.0985 -2.0985 -0.9176 -0.9176 0.9195 0.9195 1.4365 1.4365 1.7305 1.7305 3.0131 3.0131 3.2621 3.2621 3.4355 3.4355 3.6235 3.6235 3.6494 3.6494 3.7885 3.7885 3.9531 3.9531 3.9845 3.9845 4.5194 4.5194 4.5407 4.5407 4.8024 4.8024 4.8382 4.8382 4.9377 4.9377 5.0037 5.0037 5.3318 5.3318 5.6073 5.6073 5.9819 5.9819 6.0986 6.0986 7.2623 7.2623 8.0390 8.0390 8.9743 8.9743 9.5660 9.5660 10.1364 10.1364 10.2788 10.2788 10.3882 10.3882 k = 0.2115 0.1513 0.8595 ( 8930 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0443 -5.0443 -5.0267 -5.0267 -4.9711 -4.9711 -2.7824 -2.7824 -2.7642 -2.7642 -2.1609 -2.1609 -2.1191 -2.1191 -2.0989 -2.0989 -0.9165 -0.9165 0.9153 0.9153 1.4776 1.4776 1.6742 1.6742 3.0487 3.0487 3.2702 3.2702 3.4318 3.4318 3.6256 3.6256 3.6441 3.6441 3.7779 3.7779 3.9565 3.9565 3.9801 3.9801 4.5231 4.5231 4.5375 4.5375 4.8158 4.8158 4.8442 4.8442 4.9342 4.9342 4.9768 4.9768 5.3662 5.3662 5.5569 5.5569 5.9826 5.9826 6.0962 6.0962 7.2964 7.2964 8.0177 8.0177 9.0724 9.0724 9.4736 9.4736 10.1504 10.1504 10.2563 10.2563 10.3783 10.3783 k = 0.2308 0.1650 0.8595 ( 8942 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0441 -5.0441 -5.0269 -5.0269 -4.9711 -4.9711 -2.7824 -2.7824 -2.7642 -2.7642 -2.1610 -2.1610 -2.1189 -2.1189 -2.0991 -2.0991 -0.9159 -0.9159 0.9128 0.9128 1.5220 1.5220 1.6206 1.6206 3.0727 3.0727 3.2723 3.2723 3.4313 3.4313 3.6288 3.6288 3.6384 3.6384 3.7709 3.7709 3.9596 3.9596 3.9765 3.9765 4.5268 4.5268 4.5340 4.5340 4.8289 4.8289 4.8451 4.8451 4.9346 4.9346 4.9555 4.9555 5.4028 5.4028 5.5104 5.5104 5.9830 5.9830 6.0947 6.0947 7.3186 7.3186 8.0033 8.0033 9.1715 9.1715 9.3774 9.3774 10.1646 10.1646 10.2374 10.2374 10.3722 10.3722 k = 0.2500 0.1788 0.8595 ( 8940 PWs) bands (ev): -16.3659 -16.3659 -16.3547 -16.3547 -15.3583 -15.3583 -15.3242 -15.3242 -15.3105 -15.3105 -5.7236 -5.7236 -5.0440 -5.0440 -5.0270 -5.0270 -4.9712 -4.9712 -2.7824 -2.7824 -2.7642 -2.7642 -2.1610 -2.1610 -2.1189 -2.1189 -2.0992 -2.0992 -0.9157 -0.9157 0.9119 0.9119 1.5662 1.5662 1.5733 1.5733 3.0813 3.0813 3.2722 3.2722 3.4315 3.4315 3.6328 3.6328 3.6334 3.6334 3.7685 3.7685 3.9610 3.9610 3.9749 3.9749 4.5304 4.5304 4.5305 4.5305 4.8389 4.8389 4.8403 4.8403 4.9408 4.9408 4.9418 4.9418 5.4268 5.4268 5.4831 5.4831 5.9831 5.9831 6.0943 6.0943 7.3263 7.3263 7.9981 7.9981 9.2523 9.2523 9.2974 9.2974 10.1717 10.1717 10.2286 10.2286 10.3702 10.3702 Writing output data file CdCu2SnTe4.save init_run : 2.58s CPU 1.86s WALL ( 1 calls) electrons : 590.99s CPU 518.93s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.02s WALL ( 1 calls) potinit : 0.19s CPU 0.20s WALL ( 1 calls) Called by electrons: c_bands : 590.97s CPU 518.92s WALL ( 1 calls) v_of_rho : 0.07s CPU 0.04s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.07s CPU 0.04s WALL ( 1 calls) newd : 0.91s CPU 0.50s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.50s CPU 0.45s WALL ( 250 calls) cegterg : 498.90s CPU 467.81s WALL ( 330 calls) Called by sum_band: Called by *egterg: h_psi : 323.03s CPU 262.71s WALL ( 5511 calls) s_psi : 24.61s CPU 20.89s WALL ( 5511 calls) g_psi : 0.37s CPU 0.31s WALL ( 4931 calls) cdiaghg : 186.19s CPU 182.14s WALL ( 5181 calls) cegterg:over : 19.08s CPU 19.33s WALL ( 4931 calls) cegterg:upda : 11.95s CPU 12.23s WALL ( 4931 calls) cegterg:last : 6.83s CPU 6.84s WALL ( 830 calls) cdiaghg:chol : 6.83s CPU 6.75s WALL ( 5181 calls) cdiaghg:inve : 5.16s CPU 5.22s WALL ( 5181 calls) cdiaghg:para : 11.41s CPU 11.62s WALL ( 10362 calls) Called by h_psi: h_psi:vloc : 282.92s CPU 228.83s WALL ( 5511 calls) h_psi:vnl : 39.75s CPU 33.54s WALL ( 5511 calls) add_vuspsi : 22.26s CPU 18.40s WALL ( 5511 calls) General routines calbec : 17.46s CPU 15.12s WALL ( 5511 calls) fft : 0.18s CPU 0.15s WALL ( 19 calls) ffts : 0.01s CPU 0.01s WALL ( 4 calls) fftw : 262.48s CPU 210.64s WALL ( 989788 calls) interpolate : 0.03s CPU 0.02s WALL ( 4 calls) davcio : 0.28s CPU 1.10s WALL ( 500 calls) Parallel routines fft_scatter : 198.20s CPU 170.59s WALL ( 989811 calls) PWSCF : 11m 0.52s CPU 10m 7.80s WALL This run was terminated on: 21:57:15 21Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=