Program PWSCF v.5.1.1 starts on 3Jun2015 at 23:54: 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), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./MgP4.save/ file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 59 36 10 3498 1664 251 Max 60 37 11 3508 1687 257 Sum 2865 1749 497 168135 80363 12135 bravais-lattice index = 14 lattice parameter (alat) = 9.6093 a.u. unit-cell volume = 1313.3271 (a.u.)^3 number of atoms/cell = 10 number of atomic types = 2 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.609257 celldm(2)= 1.011603 celldm(3)= 1.480039 celldm(4)= 0.150571 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.011603 0.000000 ) a(3) = ( 0.000000 0.222851 1.463166 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.988530 -0.150560 ) b(3) = ( 0.000000 0.000000 0.683450 ) PseudoPot. # 1 for Mg read from file: /home/autes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for P read from file: /home/autes/Pseudo/P.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: 782f947b08835e3b01fca5c2a6fe19fa Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Mg 10.00 24.30500 Mg( 1.00) P 5.00 30.97380 P( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.1114253 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.7315829 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.1114253 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.7315829 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 252 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039683 k( 2) = ( 0.0000000 0.0000000 0.0155329), wk = 0.0039683 k( 3) = ( 0.0000000 0.0000000 0.0310659), wk = 0.0039683 k( 4) = ( 0.0000000 0.0000000 0.0465988), wk = 0.0039683 k( 5) = ( 0.0000000 0.0000000 0.0621318), wk = 0.0039683 k( 6) = ( 0.0000000 0.0000000 0.0776647), wk = 0.0039683 k( 7) = ( 0.0000000 0.0000000 0.0931977), wk = 0.0039683 k( 8) = ( 0.0000000 0.0000000 0.1087306), wk = 0.0039683 k( 9) = ( 0.0000000 0.0000000 0.1242636), wk = 0.0039683 k( 10) = ( 0.0000000 0.0000000 0.1397965), wk = 0.0039683 k( 11) = ( 0.0000000 0.0000000 0.1553294), wk = 0.0039683 k( 12) = ( 0.0000000 0.0000000 0.1708624), wk = 0.0039683 k( 13) = ( 0.0000000 0.0000000 0.1863953), wk = 0.0039683 k( 14) = ( 0.0000000 0.0000000 0.2019283), wk = 0.0039683 k( 15) = ( 0.0000000 0.0000000 0.2174612), wk = 0.0039683 k( 16) = ( 0.0000000 0.0000000 0.2329942), wk = 0.0039683 k( 17) = ( 0.0000000 0.0000000 0.2485271), wk = 0.0039683 k( 18) = ( 0.0000000 0.0000000 0.2640601), wk = 0.0039683 k( 19) = ( 0.0000000 0.0000000 0.2795930), wk = 0.0039683 k( 20) = ( 0.0000000 0.0000000 0.2951259), wk = 0.0039683 k( 21) = ( 0.0000000 0.0000000 0.3106589), wk = 0.0039683 k( 22) = ( 0.0000000 0.0000000 0.3261918), wk = 0.0039683 k( 23) = ( 0.0000000 0.0000000 0.3417248), wk = 0.0039683 k( 24) = ( 0.0000000 0.0000000 0.3417248), wk = 0.0039683 k( 25) = ( 0.0000000 0.0156443 0.3417248), wk = 0.0039683 k( 26) = ( 0.0000000 0.0312885 0.3417248), wk = 0.0039683 k( 27) = ( 0.0000000 0.0469328 0.3417248), wk = 0.0039683 k( 28) = ( 0.0000000 0.0625771 0.3417248), wk = 0.0039683 k( 29) = ( 0.0000000 0.0782213 0.3417248), wk = 0.0039683 k( 30) = ( 0.0000000 0.0938656 0.3417248), wk = 0.0039683 k( 31) = ( 0.0000000 0.1095099 0.3417248), wk = 0.0039683 k( 32) = ( 0.0000000 0.1251541 0.3417248), wk = 0.0039683 k( 33) = ( 0.0000000 0.1407984 0.3417248), wk = 0.0039683 k( 34) = ( 0.0000000 0.1564427 0.3417248), wk = 0.0039683 k( 35) = ( 0.0000000 0.1720869 0.3417248), wk = 0.0039683 k( 36) = ( 0.0000000 0.1877312 0.3417248), wk = 0.0039683 k( 37) = ( 0.0000000 0.2033755 0.3417248), wk = 0.0039683 k( 38) = ( 0.0000000 0.2190197 0.3417248), wk = 0.0039683 k( 39) = ( 0.0000000 0.2346640 0.3417248), wk = 0.0039683 k( 40) = ( 0.0000000 0.2503083 0.3417248), wk = 0.0039683 k( 41) = ( 0.0000000 0.2659525 0.3417248), wk = 0.0039683 k( 42) = ( 0.0000000 0.2815968 0.3417248), wk = 0.0039683 k( 43) = ( 0.0000000 0.2972411 0.3417248), wk = 0.0039683 k( 44) = ( 0.0000000 0.3128853 0.3417248), wk = 0.0039683 k( 45) = ( 0.0000000 0.3285296 0.3417248), wk = 0.0039683 k( 46) = ( 0.0000000 0.3441739 0.3417248), wk = 0.0039683 k( 47) = ( 0.0000000 0.3598181 0.3417248), wk = 0.0039683 k( 48) = ( 0.0000000 0.3754624 0.3417248), wk = 0.0039683 k( 49) = ( 0.0000000 0.3911067 0.3417248), wk = 0.0039683 k( 50) = ( 0.0000000 0.4067509 0.3417248), wk = 0.0039683 k( 51) = ( 0.0000000 0.4223952 0.3417248), wk = 0.0039683 k( 52) = ( 0.0000000 0.4380395 0.3417248), wk = 0.0039683 k( 53) = ( 0.0000000 0.4536837 0.3417248), wk = 0.0039683 k( 54) = ( 0.0000000 0.4536837 0.3417248), wk = 0.0039683 k( 55) = ( 0.0000000 0.4604473 0.3291781), wk = 0.0039683 k( 56) = ( 0.0000000 0.4672109 0.3166314), wk = 0.0039683 k( 57) = ( 0.0000000 0.4739745 0.3040847), wk = 0.0039683 k( 58) = ( 0.0000000 0.4807380 0.2915380), wk = 0.0039683 k( 59) = ( 0.0000000 0.4875016 0.2789914), wk = 0.0039683 k( 60) = ( 0.0000000 0.4942652 0.2664447), wk = 0.0039683 k( 61) = ( 0.0000000 0.4942652 0.2664447), wk = 0.0039683 k( 62) = ( 0.0161290 0.4942652 0.2664447), wk = 0.0039683 k( 63) = ( 0.0322581 0.4942652 0.2664447), wk = 0.0039683 k( 64) = ( 0.0483871 0.4942652 0.2664447), wk = 0.0039683 k( 65) = ( 0.0645161 0.4942652 0.2664447), wk = 0.0039683 k( 66) = ( 0.0806452 0.4942652 0.2664447), wk = 0.0039683 k( 67) = ( 0.0967742 0.4942652 0.2664447), wk = 0.0039683 k( 68) = ( 0.1129032 0.4942652 0.2664447), wk = 0.0039683 k( 69) = ( 0.1290323 0.4942652 0.2664447), wk = 0.0039683 k( 70) = ( 0.1451613 0.4942652 0.2664447), wk = 0.0039683 k( 71) = ( 0.1612903 0.4942652 0.2664447), wk = 0.0039683 k( 72) = ( 0.1774194 0.4942652 0.2664447), wk = 0.0039683 k( 73) = ( 0.1935484 0.4942652 0.2664447), wk = 0.0039683 k( 74) = ( 0.2096774 0.4942652 0.2664447), wk = 0.0039683 k( 75) = ( 0.2258064 0.4942652 0.2664447), wk = 0.0039683 k( 76) = ( 0.2419355 0.4942652 0.2664447), wk = 0.0039683 k( 77) = ( 0.2580645 0.4942652 0.2664447), wk = 0.0039683 k( 78) = ( 0.2741936 0.4942652 0.2664447), wk = 0.0039683 k( 79) = ( 0.2903226 0.4942652 0.2664447), wk = 0.0039683 k( 80) = ( 0.3064516 0.4942652 0.2664447), wk = 0.0039683 k( 81) = ( 0.3225807 0.4942652 0.2664447), wk = 0.0039683 k( 82) = ( 0.3387097 0.4942652 0.2664447), wk = 0.0039683 k( 83) = ( 0.3548387 0.4942652 0.2664447), wk = 0.0039683 k( 84) = ( 0.3709677 0.4942652 0.2664447), wk = 0.0039683 k( 85) = ( 0.3870968 0.4942652 0.2664447), wk = 0.0039683 k( 86) = ( 0.4032258 0.4942652 0.2664447), wk = 0.0039683 k( 87) = ( 0.4193548 0.4942652 0.2664447), wk = 0.0039683 k( 88) = ( 0.4354839 0.4942652 0.2664447), wk = 0.0039683 k( 89) = ( 0.4516129 0.4942652 0.2664447), wk = 0.0039683 k( 90) = ( 0.4677419 0.4942652 0.2664447), wk = 0.0039683 k( 91) = ( 0.4838710 0.4942652 0.2664447), wk = 0.0039683 k( 92) = ( 0.5000000 0.4942652 0.2664447), wk = 0.0039683 k( 93) = ( 0.5000000 0.4942652 0.2664447), wk = 0.0039683 k( 94) = ( 0.5000000 0.5010287 0.2538980), wk = 0.0039683 k( 95) = ( 0.5000000 0.5077923 0.2413513), wk = 0.0039683 k( 96) = ( 0.5000000 0.5145559 0.2288046), wk = 0.0039683 k( 97) = ( 0.5000000 0.5213194 0.2162580), wk = 0.0039683 k( 98) = ( 0.5000000 0.5280830 0.2037113), wk = 0.0039683 k( 99) = ( 0.5000000 0.5348466 0.1911646), wk = 0.0039683 k( 100) = ( 0.5000000 0.5348466 0.1911646), wk = 0.0039683 k( 101) = ( 0.5000000 0.5324594 0.1754914), wk = 0.0039683 k( 102) = ( 0.5000000 0.5300723 0.1598182), wk = 0.0039683 k( 103) = ( 0.5000000 0.5276851 0.1441449), wk = 0.0039683 k( 104) = ( 0.5000000 0.5252980 0.1284717), wk = 0.0039683 k( 105) = ( 0.5000000 0.5229109 0.1127985), wk = 0.0039683 k( 106) = ( 0.5000000 0.5205237 0.0971253), wk = 0.0039683 k( 107) = ( 0.5000000 0.5181366 0.0814521), wk = 0.0039683 k( 108) = ( 0.5000000 0.5157494 0.0657789), wk = 0.0039683 k( 109) = ( 0.5000000 0.5133623 0.0501056), wk = 0.0039683 k( 110) = ( 0.5000000 0.5109752 0.0344324), wk = 0.0039683 k( 111) = ( 0.5000000 0.5085880 0.0187592), wk = 0.0039683 k( 112) = ( 0.5000000 0.5062009 0.0030860), wk = 0.0039683 k( 113) = ( 0.5000000 0.5038137 -0.0125872), wk = 0.0039683 k( 114) = ( 0.5000000 0.5014266 -0.0282604), wk = 0.0039683 k( 115) = ( 0.5000000 0.4990394 -0.0439337), wk = 0.0039683 k( 116) = ( 0.5000000 0.4966523 -0.0596069), wk = 0.0039683 k( 117) = ( 0.5000000 0.4942652 -0.0752801), wk = 0.0039683 k( 118) = ( 0.5000000 0.4942652 -0.0752801), wk = 0.0039683 k( 119) = ( 0.4838710 0.4942652 -0.0752801), wk = 0.0039683 k( 120) = ( 0.4677419 0.4942652 -0.0752801), wk = 0.0039683 k( 121) = ( 0.4516129 0.4942652 -0.0752801), wk = 0.0039683 k( 122) = ( 0.4354839 0.4942652 -0.0752801), wk = 0.0039683 k( 123) = ( 0.4193548 0.4942652 -0.0752801), wk = 0.0039683 k( 124) = ( 0.4032258 0.4942652 -0.0752801), wk = 0.0039683 k( 125) = ( 0.3870968 0.4942652 -0.0752801), wk = 0.0039683 k( 126) = ( 0.3709677 0.4942652 -0.0752801), wk = 0.0039683 k( 127) = ( 0.3548387 0.4942652 -0.0752801), wk = 0.0039683 k( 128) = ( 0.3387097 0.4942652 -0.0752801), wk = 0.0039683 k( 129) = ( 0.3225807 0.4942652 -0.0752801), wk = 0.0039683 k( 130) = ( 0.3064516 0.4942652 -0.0752801), wk = 0.0039683 k( 131) = ( 0.2903226 0.4942652 -0.0752801), wk = 0.0039683 k( 132) = ( 0.2741936 0.4942652 -0.0752801), wk = 0.0039683 k( 133) = ( 0.2580645 0.4942652 -0.0752801), wk = 0.0039683 k( 134) = ( 0.2419355 0.4942652 -0.0752801), wk = 0.0039683 k( 135) = ( 0.2258064 0.4942652 -0.0752801), wk = 0.0039683 k( 136) = ( 0.2096774 0.4942652 -0.0752801), wk = 0.0039683 k( 137) = ( 0.1935484 0.4942652 -0.0752801), wk = 0.0039683 k( 138) = ( 0.1774194 0.4942652 -0.0752801), wk = 0.0039683 k( 139) = ( 0.1612903 0.4942652 -0.0752801), wk = 0.0039683 k( 140) = ( 0.1451613 0.4942652 -0.0752801), wk = 0.0039683 k( 141) = ( 0.1290323 0.4942652 -0.0752801), wk = 0.0039683 k( 142) = ( 0.1129032 0.4942652 -0.0752801), wk = 0.0039683 k( 143) = ( 0.0967742 0.4942652 -0.0752801), wk = 0.0039683 k( 144) = ( 0.0806452 0.4942652 -0.0752801), wk = 0.0039683 k( 145) = ( 0.0645161 0.4942652 -0.0752801), wk = 0.0039683 k( 146) = ( 0.0483871 0.4942652 -0.0752801), wk = 0.0039683 k( 147) = ( 0.0322581 0.4942652 -0.0752801), wk = 0.0039683 k( 148) = ( 0.0161290 0.4942652 -0.0752801), wk = 0.0039683 k( 149) = ( 0.0000000 0.4942652 -0.0752801), wk = 0.0039683 k( 150) = ( 0.0000000 0.4942652 -0.0752801), wk = 0.0039683 k( 151) = ( 0.0000000 0.4966523 -0.0596069), wk = 0.0039683 k( 152) = ( 0.0000000 0.4990394 -0.0439337), wk = 0.0039683 k( 153) = ( 0.0000000 0.5014266 -0.0282604), wk = 0.0039683 k( 154) = ( 0.0000000 0.5038137 -0.0125872), wk = 0.0039683 k( 155) = ( 0.0000000 0.5062009 0.0030860), wk = 0.0039683 k( 156) = ( 0.0000000 0.5085880 0.0187592), wk = 0.0039683 k( 157) = ( 0.0000000 0.5109752 0.0344324), wk = 0.0039683 k( 158) = ( 0.0000000 0.5133623 0.0501056), wk = 0.0039683 k( 159) = ( 0.0000000 0.5157494 0.0657789), wk = 0.0039683 k( 160) = ( 0.0000000 0.5181366 0.0814521), wk = 0.0039683 k( 161) = ( 0.0000000 0.5205237 0.0971253), wk = 0.0039683 k( 162) = ( 0.0000000 0.5229109 0.1127985), wk = 0.0039683 k( 163) = ( 0.0000000 0.5252980 0.1284717), wk = 0.0039683 k( 164) = ( 0.0000000 0.5276851 0.1441449), wk = 0.0039683 k( 165) = ( 0.0000000 0.5300723 0.1598182), wk = 0.0039683 k( 166) = ( 0.0000000 0.5324594 0.1754914), wk = 0.0039683 k( 167) = ( 0.0000000 0.5348466 0.1911646), wk = 0.0039683 k( 168) = ( 0.5000000 0.4536837 0.3417248), wk = 0.0039683 k( 169) = ( 0.5000000 0.4380395 0.3417248), wk = 0.0039683 k( 170) = ( 0.5000000 0.4223952 0.3417248), wk = 0.0039683 k( 171) = ( 0.5000000 0.4067509 0.3417248), wk = 0.0039683 k( 172) = ( 0.5000000 0.3911067 0.3417248), wk = 0.0039683 k( 173) = ( 0.5000000 0.3754624 0.3417248), wk = 0.0039683 k( 174) = ( 0.5000000 0.3598181 0.3417248), wk = 0.0039683 k( 175) = ( 0.5000000 0.3441739 0.3417248), wk = 0.0039683 k( 176) = ( 0.5000000 0.3285296 0.3417248), wk = 0.0039683 k( 177) = ( 0.5000000 0.3128853 0.3417248), wk = 0.0039683 k( 178) = ( 0.5000000 0.2972411 0.3417248), wk = 0.0039683 k( 179) = ( 0.5000000 0.2815968 0.3417248), wk = 0.0039683 k( 180) = ( 0.5000000 0.2659525 0.3417248), wk = 0.0039683 k( 181) = ( 0.5000000 0.2503083 0.3417248), wk = 0.0039683 k( 182) = ( 0.5000000 0.2346640 0.3417248), wk = 0.0039683 k( 183) = ( 0.5000000 0.2190197 0.3417248), wk = 0.0039683 k( 184) = ( 0.5000000 0.2033755 0.3417248), wk = 0.0039683 k( 185) = ( 0.5000000 0.1877312 0.3417248), wk = 0.0039683 k( 186) = ( 0.5000000 0.1720869 0.3417248), wk = 0.0039683 k( 187) = ( 0.5000000 0.1564427 0.3417248), wk = 0.0039683 k( 188) = ( 0.5000000 0.1407984 0.3417248), wk = 0.0039683 k( 189) = ( 0.5000000 0.1251541 0.3417248), wk = 0.0039683 k( 190) = ( 0.5000000 0.1095099 0.3417248), wk = 0.0039683 k( 191) = ( 0.5000000 0.0938656 0.3417248), wk = 0.0039683 k( 192) = ( 0.5000000 0.0782213 0.3417248), wk = 0.0039683 k( 193) = ( 0.5000000 0.0625771 0.3417248), wk = 0.0039683 k( 194) = ( 0.5000000 0.0469328 0.3417248), wk = 0.0039683 k( 195) = ( 0.5000000 0.0312885 0.3417248), wk = 0.0039683 k( 196) = ( 0.5000000 0.0156443 0.3417248), wk = 0.0039683 k( 197) = ( 0.5000000 -0.0000000 0.3417248), wk = 0.0039683 k( 198) = ( 0.5000000 -0.0000000 0.3417248), wk = 0.0039683 k( 199) = ( 0.5000000 -0.0000000 0.3261918), wk = 0.0039683 k( 200) = ( 0.5000000 -0.0000000 0.3106589), wk = 0.0039683 k( 201) = ( 0.5000000 -0.0000000 0.2951259), wk = 0.0039683 k( 202) = ( 0.5000000 -0.0000000 0.2795930), wk = 0.0039683 k( 203) = ( 0.5000000 -0.0000000 0.2640601), wk = 0.0039683 k( 204) = ( 0.5000000 -0.0000000 0.2485271), wk = 0.0039683 k( 205) = ( 0.5000000 -0.0000000 0.2329942), wk = 0.0039683 k( 206) = ( 0.5000000 -0.0000000 0.2174612), wk = 0.0039683 k( 207) = ( 0.5000000 -0.0000000 0.2019283), wk = 0.0039683 k( 208) = ( 0.5000000 -0.0000000 0.1863953), wk = 0.0039683 k( 209) = ( 0.5000000 -0.0000000 0.1708624), wk = 0.0039683 k( 210) = ( 0.5000000 -0.0000000 0.1553294), wk = 0.0039683 k( 211) = ( 0.5000000 -0.0000000 0.1397965), wk = 0.0039683 k( 212) = ( 0.5000000 -0.0000000 0.1242636), wk = 0.0039683 k( 213) = ( 0.5000000 -0.0000000 0.1087306), wk = 0.0039683 k( 214) = ( 0.5000000 -0.0000000 0.0931977), wk = 0.0039683 k( 215) = ( 0.5000000 -0.0000000 0.0776647), wk = 0.0039683 k( 216) = ( 0.5000000 -0.0000000 0.0621318), wk = 0.0039683 k( 217) = ( 0.5000000 -0.0000000 0.0465988), wk = 0.0039683 k( 218) = ( 0.5000000 -0.0000000 0.0310659), wk = 0.0039683 k( 219) = ( 0.5000000 -0.0000000 0.0155329), wk = 0.0039683 k( 220) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0039683 k( 221) = ( 0.0000000 0.0000000 0.3417248), wk = 0.0039683 k( 222) = ( 0.0161290 -0.0000000 0.3417248), wk = 0.0039683 k( 223) = ( 0.0322581 -0.0000000 0.3417248), wk = 0.0039683 k( 224) = ( 0.0483871 -0.0000000 0.3417248), wk = 0.0039683 k( 225) = ( 0.0645161 -0.0000000 0.3417248), wk = 0.0039683 k( 226) = ( 0.0806452 -0.0000000 0.3417248), wk = 0.0039683 k( 227) = ( 0.0967742 -0.0000000 0.3417248), wk = 0.0039683 k( 228) = ( 0.1129032 -0.0000000 0.3417248), wk = 0.0039683 k( 229) = ( 0.1290323 -0.0000000 0.3417248), wk = 0.0039683 k( 230) = ( 0.1451613 -0.0000000 0.3417248), wk = 0.0039683 k( 231) = ( 0.1612903 -0.0000000 0.3417248), wk = 0.0039683 k( 232) = ( 0.1774194 -0.0000000 0.3417248), wk = 0.0039683 k( 233) = ( 0.1935484 -0.0000000 0.3417248), wk = 0.0039683 k( 234) = ( 0.2096774 -0.0000000 0.3417248), wk = 0.0039683 k( 235) = ( 0.2258064 -0.0000000 0.3417248), wk = 0.0039683 k( 236) = ( 0.2419355 -0.0000000 0.3417248), wk = 0.0039683 k( 237) = ( 0.2580645 -0.0000000 0.3417248), wk = 0.0039683 k( 238) = ( 0.2741936 -0.0000000 0.3417248), wk = 0.0039683 k( 239) = ( 0.2903226 -0.0000000 0.3417248), wk = 0.0039683 k( 240) = ( 0.3064516 -0.0000000 0.3417248), wk = 0.0039683 k( 241) = ( 0.3225807 -0.0000000 0.3417248), wk = 0.0039683 k( 242) = ( 0.3387097 -0.0000000 0.3417248), wk = 0.0039683 k( 243) = ( 0.3548387 -0.0000000 0.3417248), wk = 0.0039683 k( 244) = ( 0.3709677 -0.0000000 0.3417248), wk = 0.0039683 k( 245) = ( 0.3870968 -0.0000000 0.3417248), wk = 0.0039683 k( 246) = ( 0.4032258 -0.0000000 0.3417248), wk = 0.0039683 k( 247) = ( 0.4193548 -0.0000000 0.3417248), wk = 0.0039683 k( 248) = ( 0.4354839 -0.0000000 0.3417248), wk = 0.0039683 k( 249) = ( 0.4516129 -0.0000000 0.3417248), wk = 0.0039683 k( 250) = ( 0.4677419 -0.0000000 0.3417248), wk = 0.0039683 k( 251) = ( 0.4838710 -0.0000000 0.3417248), wk = 0.0039683 k( 252) = ( 0.5000000 -0.0000000 0.3417248), wk = 0.0039683 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0039683 k( 2) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0039683 k( 3) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0039683 k( 4) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0039683 k( 5) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0039683 k( 6) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0039683 k( 7) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0039683 k( 8) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0039683 k( 9) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0039683 k( 10) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0039683 k( 11) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0039683 k( 12) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0039683 k( 13) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0039683 k( 14) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0039683 k( 15) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0039683 k( 16) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0039683 k( 17) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0039683 k( 18) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0039683 k( 19) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0039683 k( 20) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0039683 k( 21) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0039683 k( 22) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0039683 k( 23) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039683 k( 24) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039683 k( 25) = ( 0.0000000 0.0158258 0.5034863), wk = 0.0039683 k( 26) = ( 0.0000000 0.0316516 0.5069727), wk = 0.0039683 k( 27) = ( 0.0000000 0.0474774 0.5104590), wk = 0.0039683 k( 28) = ( 0.0000000 0.0633031 0.5139453), wk = 0.0039683 k( 29) = ( 0.0000000 0.0791289 0.5174317), wk = 0.0039683 k( 30) = ( 0.0000000 0.0949547 0.5209180), wk = 0.0039683 k( 31) = ( 0.0000000 0.1107805 0.5244043), wk = 0.0039683 k( 32) = ( 0.0000000 0.1266063 0.5278907), wk = 0.0039683 k( 33) = ( 0.0000000 0.1424321 0.5313770), wk = 0.0039683 k( 34) = ( 0.0000000 0.1582578 0.5348633), wk = 0.0039683 k( 35) = ( 0.0000000 0.1740836 0.5383497), wk = 0.0039683 k( 36) = ( 0.0000000 0.1899094 0.5418360), wk = 0.0039683 k( 37) = ( 0.0000000 0.2057352 0.5453223), wk = 0.0039683 k( 38) = ( 0.0000000 0.2215610 0.5488087), wk = 0.0039683 k( 39) = ( 0.0000000 0.2373868 0.5522950), wk = 0.0039683 k( 40) = ( 0.0000000 0.2532125 0.5557813), wk = 0.0039683 k( 41) = ( 0.0000000 0.2690383 0.5592677), wk = 0.0039683 k( 42) = ( 0.0000000 0.2848641 0.5627540), wk = 0.0039683 k( 43) = ( 0.0000000 0.3006899 0.5662403), wk = 0.0039683 k( 44) = ( 0.0000000 0.3165157 0.5697267), wk = 0.0039683 k( 45) = ( 0.0000000 0.3323415 0.5732130), wk = 0.0039683 k( 46) = ( 0.0000000 0.3481672 0.5766993), wk = 0.0039683 k( 47) = ( 0.0000000 0.3639930 0.5801857), wk = 0.0039683 k( 48) = ( 0.0000000 0.3798188 0.5836720), wk = 0.0039683 k( 49) = ( 0.0000000 0.3956446 0.5871583), wk = 0.0039683 k( 50) = ( 0.0000000 0.4114704 0.5906447), wk = 0.0039683 k( 51) = ( 0.0000000 0.4272962 0.5941310), wk = 0.0039683 k( 52) = ( 0.0000000 0.4431219 0.5976173), wk = 0.0039683 k( 53) = ( 0.0000000 0.4589477 0.6011037), wk = 0.0039683 k( 54) = ( 0.0000000 0.4589477 0.6011037), wk = 0.0039683 k( 55) = ( 0.0000000 0.4657898 0.5842531), wk = 0.0039683 k( 56) = ( 0.0000000 0.4726318 0.5674024), wk = 0.0039683 k( 57) = ( 0.0000000 0.4794739 0.5505518), wk = 0.0039683 k( 58) = ( 0.0000000 0.4863159 0.5337012), wk = 0.0039683 k( 59) = ( 0.0000000 0.4931580 0.5168506), wk = 0.0039683 k( 60) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039683 k( 61) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0039683 k( 62) = ( 0.0161290 0.5000000 0.5000000), wk = 0.0039683 k( 63) = ( 0.0322581 0.5000000 0.5000000), wk = 0.0039683 k( 64) = ( 0.0483871 0.5000000 0.5000000), wk = 0.0039683 k( 65) = ( 0.0645161 0.5000000 0.5000000), wk = 0.0039683 k( 66) = ( 0.0806452 0.5000000 0.5000000), wk = 0.0039683 k( 67) = ( 0.0967742 0.5000000 0.5000000), wk = 0.0039683 k( 68) = ( 0.1129032 0.5000000 0.5000000), wk = 0.0039683 k( 69) = ( 0.1290323 0.5000000 0.5000000), wk = 0.0039683 k( 70) = ( 0.1451613 0.5000000 0.5000000), wk = 0.0039683 k( 71) = ( 0.1612903 0.5000000 0.5000000), wk = 0.0039683 k( 72) = ( 0.1774194 0.5000000 0.5000000), wk = 0.0039683 k( 73) = ( 0.1935484 0.5000000 0.5000000), wk = 0.0039683 k( 74) = ( 0.2096774 0.5000000 0.5000000), wk = 0.0039683 k( 75) = ( 0.2258064 0.5000000 0.5000000), wk = 0.0039683 k( 76) = ( 0.2419355 0.5000000 0.5000000), wk = 0.0039683 k( 77) = ( 0.2580645 0.5000000 0.5000000), wk = 0.0039683 k( 78) = ( 0.2741936 0.5000000 0.5000000), wk = 0.0039683 k( 79) = ( 0.2903226 0.5000000 0.5000000), wk = 0.0039683 k( 80) = ( 0.3064516 0.5000000 0.5000000), wk = 0.0039683 k( 81) = ( 0.3225807 0.5000000 0.5000000), wk = 0.0039683 k( 82) = ( 0.3387097 0.5000000 0.5000000), wk = 0.0039683 k( 83) = ( 0.3548387 0.5000000 0.5000000), wk = 0.0039683 k( 84) = ( 0.3709677 0.5000000 0.5000000), wk = 0.0039683 k( 85) = ( 0.3870968 0.5000000 0.5000000), wk = 0.0039683 k( 86) = ( 0.4032258 0.5000000 0.5000000), wk = 0.0039683 k( 87) = ( 0.4193548 0.5000000 0.5000000), wk = 0.0039683 k( 88) = ( 0.4354839 0.5000000 0.5000000), wk = 0.0039683 k( 89) = ( 0.4516129 0.5000000 0.5000000), wk = 0.0039683 k( 90) = ( 0.4677419 0.5000000 0.5000000), wk = 0.0039683 k( 91) = ( 0.4838710 0.5000000 0.5000000), wk = 0.0039683 k( 92) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039683 k( 93) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0039683 k( 94) = ( 0.5000000 0.5068421 0.4831494), wk = 0.0039683 k( 95) = ( 0.5000000 0.5136841 0.4662988), wk = 0.0039683 k( 96) = ( 0.5000000 0.5205261 0.4494482), wk = 0.0039683 k( 97) = ( 0.5000000 0.5273682 0.4325976), wk = 0.0039683 k( 98) = ( 0.5000000 0.5342102 0.4157470), wk = 0.0039683 k( 99) = ( 0.5000000 0.5410523 0.3988963), wk = 0.0039683 k( 100) = ( 0.5000000 0.5410523 0.3988963), wk = 0.0039683 k( 101) = ( 0.5000000 0.5386374 0.3754318), wk = 0.0039683 k( 102) = ( 0.5000000 0.5362226 0.3519674), wk = 0.0039683 k( 103) = ( 0.5000000 0.5338078 0.3285029), wk = 0.0039683 k( 104) = ( 0.5000000 0.5313929 0.3050384), wk = 0.0039683 k( 105) = ( 0.5000000 0.5289781 0.2815739), wk = 0.0039683 k( 106) = ( 0.5000000 0.5265632 0.2581094), wk = 0.0039683 k( 107) = ( 0.5000000 0.5241484 0.2346449), wk = 0.0039683 k( 108) = ( 0.5000000 0.5217336 0.2111804), wk = 0.0039683 k( 109) = ( 0.5000000 0.5193187 0.1877159), wk = 0.0039683 k( 110) = ( 0.5000000 0.5169039 0.1642514), wk = 0.0039683 k( 111) = ( 0.5000000 0.5144890 0.1407869), wk = 0.0039683 k( 112) = ( 0.5000000 0.5120742 0.1173224), wk = 0.0039683 k( 113) = ( 0.5000000 0.5096594 0.0938580), wk = 0.0039683 k( 114) = ( 0.5000000 0.5072445 0.0703935), wk = 0.0039683 k( 115) = ( 0.5000000 0.5048297 0.0469290), wk = 0.0039683 k( 116) = ( 0.5000000 0.5024148 0.0234645), wk = 0.0039683 k( 117) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0039683 k( 118) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0039683 k( 119) = ( 0.4838710 0.5000000 0.0000000), wk = 0.0039683 k( 120) = ( 0.4677419 0.5000000 0.0000000), wk = 0.0039683 k( 121) = ( 0.4516129 0.5000000 0.0000000), wk = 0.0039683 k( 122) = ( 0.4354839 0.5000000 0.0000000), wk = 0.0039683 k( 123) = ( 0.4193548 0.5000000 0.0000000), wk = 0.0039683 k( 124) = ( 0.4032258 0.5000000 0.0000000), wk = 0.0039683 k( 125) = ( 0.3870968 0.5000000 0.0000000), wk = 0.0039683 k( 126) = ( 0.3709677 0.5000000 0.0000000), wk = 0.0039683 k( 127) = ( 0.3548387 0.5000000 0.0000000), wk = 0.0039683 k( 128) = ( 0.3387097 0.5000000 0.0000000), wk = 0.0039683 k( 129) = ( 0.3225807 0.5000000 0.0000000), wk = 0.0039683 k( 130) = ( 0.3064516 0.5000000 0.0000000), wk = 0.0039683 k( 131) = ( 0.2903226 0.5000000 0.0000000), wk = 0.0039683 k( 132) = ( 0.2741936 0.5000000 0.0000000), wk = 0.0039683 k( 133) = ( 0.2580645 0.5000000 0.0000000), wk = 0.0039683 k( 134) = ( 0.2419355 0.5000000 0.0000000), wk = 0.0039683 k( 135) = ( 0.2258064 0.5000000 0.0000000), wk = 0.0039683 k( 136) = ( 0.2096774 0.5000000 0.0000000), wk = 0.0039683 k( 137) = ( 0.1935484 0.5000000 0.0000000), wk = 0.0039683 k( 138) = ( 0.1774194 0.5000000 0.0000000), wk = 0.0039683 k( 139) = ( 0.1612903 0.5000000 0.0000000), wk = 0.0039683 k( 140) = ( 0.1451613 0.5000000 0.0000000), wk = 0.0039683 k( 141) = ( 0.1290323 0.5000000 0.0000000), wk = 0.0039683 k( 142) = ( 0.1129032 0.5000000 0.0000000), wk = 0.0039683 k( 143) = ( 0.0967742 0.5000000 0.0000000), wk = 0.0039683 k( 144) = ( 0.0806452 0.5000000 0.0000000), wk = 0.0039683 k( 145) = ( 0.0645161 0.5000000 0.0000000), wk = 0.0039683 k( 146) = ( 0.0483871 0.5000000 0.0000000), wk = 0.0039683 k( 147) = ( 0.0322581 0.5000000 0.0000000), wk = 0.0039683 k( 148) = ( 0.0161290 0.5000000 0.0000000), wk = 0.0039683 k( 149) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0039683 k( 150) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0039683 k( 151) = ( 0.0000000 0.5024148 0.0234645), wk = 0.0039683 k( 152) = ( 0.0000000 0.5048297 0.0469290), wk = 0.0039683 k( 153) = ( 0.0000000 0.5072445 0.0703935), wk = 0.0039683 k( 154) = ( 0.0000000 0.5096594 0.0938580), wk = 0.0039683 k( 155) = ( 0.0000000 0.5120742 0.1173224), wk = 0.0039683 k( 156) = ( 0.0000000 0.5144890 0.1407869), wk = 0.0039683 k( 157) = ( 0.0000000 0.5169039 0.1642514), wk = 0.0039683 k( 158) = ( 0.0000000 0.5193187 0.1877159), wk = 0.0039683 k( 159) = ( 0.0000000 0.5217336 0.2111804), wk = 0.0039683 k( 160) = ( 0.0000000 0.5241484 0.2346449), wk = 0.0039683 k( 161) = ( 0.0000000 0.5265632 0.2581094), wk = 0.0039683 k( 162) = ( 0.0000000 0.5289781 0.2815739), wk = 0.0039683 k( 163) = ( 0.0000000 0.5313929 0.3050384), wk = 0.0039683 k( 164) = ( 0.0000000 0.5338078 0.3285029), wk = 0.0039683 k( 165) = ( 0.0000000 0.5362226 0.3519674), wk = 0.0039683 k( 166) = ( 0.0000000 0.5386374 0.3754318), wk = 0.0039683 k( 167) = ( 0.0000000 0.5410523 0.3988963), wk = 0.0039683 k( 168) = ( 0.5000000 0.4589477 0.6011037), wk = 0.0039683 k( 169) = ( 0.5000000 0.4431219 0.5976173), wk = 0.0039683 k( 170) = ( 0.5000000 0.4272962 0.5941310), wk = 0.0039683 k( 171) = ( 0.5000000 0.4114704 0.5906447), wk = 0.0039683 k( 172) = ( 0.5000000 0.3956446 0.5871583), wk = 0.0039683 k( 173) = ( 0.5000000 0.3798188 0.5836720), wk = 0.0039683 k( 174) = ( 0.5000000 0.3639930 0.5801857), wk = 0.0039683 k( 175) = ( 0.5000000 0.3481672 0.5766993), wk = 0.0039683 k( 176) = ( 0.5000000 0.3323415 0.5732130), wk = 0.0039683 k( 177) = ( 0.5000000 0.3165157 0.5697267), wk = 0.0039683 k( 178) = ( 0.5000000 0.3006899 0.5662403), wk = 0.0039683 k( 179) = ( 0.5000000 0.2848641 0.5627540), wk = 0.0039683 k( 180) = ( 0.5000000 0.2690383 0.5592677), wk = 0.0039683 k( 181) = ( 0.5000000 0.2532125 0.5557813), wk = 0.0039683 k( 182) = ( 0.5000000 0.2373868 0.5522950), wk = 0.0039683 k( 183) = ( 0.5000000 0.2215610 0.5488087), wk = 0.0039683 k( 184) = ( 0.5000000 0.2057352 0.5453223), wk = 0.0039683 k( 185) = ( 0.5000000 0.1899094 0.5418360), wk = 0.0039683 k( 186) = ( 0.5000000 0.1740836 0.5383497), wk = 0.0039683 k( 187) = ( 0.5000000 0.1582578 0.5348633), wk = 0.0039683 k( 188) = ( 0.5000000 0.1424321 0.5313770), wk = 0.0039683 k( 189) = ( 0.5000000 0.1266063 0.5278907), wk = 0.0039683 k( 190) = ( 0.5000000 0.1107805 0.5244043), wk = 0.0039683 k( 191) = ( 0.5000000 0.0949547 0.5209180), wk = 0.0039683 k( 192) = ( 0.5000000 0.0791289 0.5174317), wk = 0.0039683 k( 193) = ( 0.5000000 0.0633031 0.5139453), wk = 0.0039683 k( 194) = ( 0.5000000 0.0474774 0.5104590), wk = 0.0039683 k( 195) = ( 0.5000000 0.0316516 0.5069727), wk = 0.0039683 k( 196) = ( 0.5000000 0.0158258 0.5034863), wk = 0.0039683 k( 197) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0039683 k( 198) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0039683 k( 199) = ( 0.5000000 0.0000000 0.4772727), wk = 0.0039683 k( 200) = ( 0.5000000 0.0000000 0.4545455), wk = 0.0039683 k( 201) = ( 0.5000000 0.0000000 0.4318182), wk = 0.0039683 k( 202) = ( 0.5000000 0.0000000 0.4090909), wk = 0.0039683 k( 203) = ( 0.5000000 0.0000000 0.3863636), wk = 0.0039683 k( 204) = ( 0.5000000 0.0000000 0.3636364), wk = 0.0039683 k( 205) = ( 0.5000000 0.0000000 0.3409091), wk = 0.0039683 k( 206) = ( 0.5000000 0.0000000 0.3181818), wk = 0.0039683 k( 207) = ( 0.5000000 0.0000000 0.2954545), wk = 0.0039683 k( 208) = ( 0.5000000 0.0000000 0.2727273), wk = 0.0039683 k( 209) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0039683 k( 210) = ( 0.5000000 0.0000000 0.2272727), wk = 0.0039683 k( 211) = ( 0.5000000 0.0000000 0.2045454), wk = 0.0039683 k( 212) = ( 0.5000000 0.0000000 0.1818182), wk = 0.0039683 k( 213) = ( 0.5000000 0.0000000 0.1590909), wk = 0.0039683 k( 214) = ( 0.5000000 0.0000000 0.1363636), wk = 0.0039683 k( 215) = ( 0.5000000 0.0000000 0.1136364), wk = 0.0039683 k( 216) = ( 0.5000000 0.0000000 0.0909091), wk = 0.0039683 k( 217) = ( 0.5000000 0.0000000 0.0681818), wk = 0.0039683 k( 218) = ( 0.5000000 0.0000000 0.0454546), wk = 0.0039683 k( 219) = ( 0.5000000 0.0000000 0.0227273), wk = 0.0039683 k( 220) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0039683 k( 221) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0039683 k( 222) = ( 0.0161290 0.0000000 0.5000000), wk = 0.0039683 k( 223) = ( 0.0322581 0.0000000 0.5000000), wk = 0.0039683 k( 224) = ( 0.0483871 -0.0000000 0.5000000), wk = 0.0039683 k( 225) = ( 0.0645161 0.0000000 0.5000000), wk = 0.0039683 k( 226) = ( 0.0806452 0.0000000 0.5000000), wk = 0.0039683 k( 227) = ( 0.0967742 0.0000000 0.5000000), wk = 0.0039683 k( 228) = ( 0.1129032 0.0000000 0.5000000), wk = 0.0039683 k( 229) = ( 0.1290323 0.0000000 0.5000000), wk = 0.0039683 k( 230) = ( 0.1451613 -0.0000000 0.5000000), wk = 0.0039683 k( 231) = ( 0.1612903 0.0000000 0.5000000), wk = 0.0039683 k( 232) = ( 0.1774194 0.0000000 0.5000000), wk = 0.0039683 k( 233) = ( 0.1935484 -0.0000000 0.5000000), wk = 0.0039683 k( 234) = ( 0.2096774 0.0000000 0.5000000), wk = 0.0039683 k( 235) = ( 0.2258064 -0.0000000 0.5000000), wk = 0.0039683 k( 236) = ( 0.2419355 -0.0000000 0.5000000), wk = 0.0039683 k( 237) = ( 0.2580645 0.0000000 0.5000000), wk = 0.0039683 k( 238) = ( 0.2741936 0.0000000 0.5000000), wk = 0.0039683 k( 239) = ( 0.2903226 -0.0000000 0.5000000), wk = 0.0039683 k( 240) = ( 0.3064516 0.0000000 0.5000000), wk = 0.0039683 k( 241) = ( 0.3225807 0.0000000 0.5000000), wk = 0.0039683 k( 242) = ( 0.3387097 0.0000000 0.5000000), wk = 0.0039683 k( 243) = ( 0.3548387 -0.0000000 0.5000000), wk = 0.0039683 k( 244) = ( 0.3709677 0.0000000 0.5000000), wk = 0.0039683 k( 245) = ( 0.3870968 -0.0000000 0.5000000), wk = 0.0039683 k( 246) = ( 0.4032258 0.0000000 0.5000000), wk = 0.0039683 k( 247) = ( 0.4193548 0.0000000 0.5000000), wk = 0.0039683 k( 248) = ( 0.4354839 0.0000000 0.5000000), wk = 0.0039683 k( 249) = ( 0.4516129 -0.0000000 0.5000000), wk = 0.0039683 k( 250) = ( 0.4677419 0.0000000 0.5000000), wk = 0.0039683 k( 251) = ( 0.4838710 0.0000000 0.5000000), wk = 0.0039683 k( 252) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0039683 Dense grid: 168135 G-vectors FFT dimensions: ( 64, 64, 90) Smooth grid: 80363 G-vectors FFT dimensions: ( 48, 48, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.47 Mb ( 426, 72) NL pseudopotentials 0.46 Mb ( 213, 140) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.03 Mb ( 3499) G-vector shells 0.03 Mb ( 3362) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.87 Mb ( 426, 288) Each subspace H/S matrix 1.27 Mb ( 288, 288) Each matrix 0.31 Mb ( 140, 2, 72) Check: negative/imaginary core charge= -0.000007 0.000000 The potential is recalculated from file : ./MgP4.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 42.9 secs Computing kpt #: 2 total cpu time spent up to now is 48.2 secs Computing kpt #: 3 total cpu time spent up to now is 53.7 secs Computing kpt #: 4 total cpu time spent up to now is 59.3 secs Computing kpt #: 5 total cpu time spent up to now is 65.0 secs Computing kpt #: 6 total cpu time spent up to now is 71.2 secs Computing kpt #: 7 total cpu time spent up to now is 77.0 secs Computing kpt #: 8 total cpu time spent up to now is 82.3 secs Computing kpt #: 9 total cpu time spent up to now is 87.7 secs Computing kpt #: 10 total cpu time spent up to now is 92.9 secs Computing kpt #: 11 total cpu time spent up to now is 98.1 secs Computing kpt #: 12 total cpu time spent up to now is 103.0 secs Computing kpt #: 13 total cpu time spent up to now is 107.9 secs Computing kpt #: 14 total cpu time spent up to now is 113.0 secs Computing kpt #: 15 total cpu time spent up to now is 117.9 secs Computing kpt #: 16 total cpu time spent up to now is 122.8 secs Computing kpt #: 17 total cpu time spent up to now is 127.7 secs Computing kpt #: 18 total cpu time spent up to now is 132.6 secs Computing kpt #: 19 total cpu time spent up to now is 137.5 secs Computing kpt #: 20 total cpu time spent up to now is 142.5 secs Computing kpt #: 21 total cpu time spent up to now is 147.5 secs Computing kpt #: 22 total cpu time spent up to now is 152.2 secs Computing kpt #: 23 total cpu time spent up to now is 157.0 secs Computing kpt #: 24 total cpu time spent up to now is 162.3 secs Computing kpt #: 25 total cpu time spent up to now is 167.2 secs Computing kpt #: 26 total cpu time spent up to now is 172.3 secs Computing kpt #: 27 total cpu time spent up to now is 177.3 secs Computing kpt #: 28 total cpu time spent up to now is 182.4 secs Computing kpt #: 29 total cpu time spent up to now is 187.4 secs Computing kpt #: 30 total cpu time spent up to now is 192.5 secs Computing kpt #: 31 total cpu time spent up to now is 197.5 secs Computing kpt #: 32 total cpu time spent up to now is 202.6 secs Computing kpt #: 33 total cpu time spent up to now is 207.8 secs Computing kpt #: 34 total cpu time spent up to now is 213.1 secs Computing kpt #: 35 total cpu time spent up to now is 218.3 secs Computing kpt #: 36 total cpu time spent up to now is 223.4 secs Computing kpt #: 37 total cpu time spent up to now is 228.4 secs Computing kpt #: 38 total cpu time spent up to now is 233.4 secs Computing kpt #: 39 total cpu time spent up to now is 238.6 secs Computing kpt #: 40 total cpu time spent up to now is 243.7 secs Computing kpt #: 41 total cpu time spent up to now is 249.1 secs Computing kpt #: 42 total cpu time spent up to now is 254.8 secs Computing kpt #: 43 total cpu time spent up to now is 260.2 secs Computing kpt #: 44 total cpu time spent up to now is 265.7 secs Computing kpt #: 45 total cpu time spent up to now is 271.3 secs Computing kpt #: 46 total cpu time spent up to now is 276.9 secs Computing kpt #: 47 total cpu time spent up to now is 282.5 secs Computing kpt #: 48 total cpu time spent up to now is 288.1 secs Computing kpt #: 49 total cpu time spent up to now is 293.7 secs Computing kpt #: 50 total cpu time spent up to now is 299.3 secs Computing kpt #: 51 total cpu time spent up to now is 305.0 secs Computing kpt #: 52 total cpu time spent up to now is 310.8 secs Computing kpt #: 53 total cpu time spent up to now is 316.9 secs Computing kpt #: 54 total cpu time spent up to now is 322.8 secs Computing kpt #: 55 total cpu time spent up to now is 328.9 secs Computing kpt #: 56 total cpu time spent up to now is 334.6 secs Computing kpt #: 57 total cpu time spent up to now is 340.3 secs Computing kpt #: 58 total cpu time spent up to now is 345.9 secs Computing kpt #: 59 total cpu time spent up to now is 351.5 secs Computing kpt #: 60 total cpu time spent up to now is 357.0 secs Computing kpt #: 61 total cpu time spent up to now is 362.4 secs Computing kpt #: 62 total cpu time spent up to now is 367.9 secs Computing kpt #: 63 total cpu time spent up to now is 373.3 secs Computing kpt #: 64 total cpu time spent up to now is 378.9 secs Computing kpt #: 65 total cpu time spent up to now is 384.4 secs Computing kpt #: 66 total cpu time spent up to now is 390.0 secs Computing kpt #: 67 total cpu time spent up to now is 395.6 secs Computing kpt #: 68 total cpu time spent up to now is 401.4 secs Computing kpt #: 69 total cpu time spent up to now is 407.1 secs Computing kpt #: 70 total cpu time spent up to now is 413.0 secs Computing kpt #: 71 total cpu time spent up to now is 418.8 secs Computing kpt #: 72 total cpu time spent up to now is 424.8 secs Computing kpt #: 73 total cpu time spent up to now is 430.7 secs Computing kpt #: 74 total cpu time spent up to now is 436.6 secs Computing kpt #: 75 total cpu time spent up to now is 442.4 secs Computing kpt #: 76 total cpu time spent up to now is 448.3 secs Computing kpt #: 77 total cpu time spent up to now is 454.2 secs Computing kpt #: 78 total cpu time spent up to now is 459.9 secs Computing kpt #: 79 total cpu time spent up to now is 465.5 secs Computing kpt #: 80 total cpu time spent up to now is 470.9 secs Computing kpt #: 81 total cpu time spent up to now is 476.2 secs Computing kpt #: 82 total cpu time spent up to now is 481.4 secs Computing kpt #: 83 total cpu time spent up to now is 486.7 secs Computing kpt #: 84 total cpu time spent up to now is 492.0 secs Computing kpt #: 85 total cpu time spent up to now is 497.2 secs Computing kpt #: 86 total cpu time spent up to now is 502.4 secs Computing kpt #: 87 total cpu time spent up to now is 507.8 secs Computing kpt #: 88 total cpu time spent up to now is 513.3 secs Computing kpt #: 89 total cpu time spent up to now is 518.4 secs Computing kpt #: 90 total cpu time spent up to now is 523.6 secs Computing kpt #: 91 total cpu time spent up to now is 528.8 secs Computing kpt #: 92 total cpu time spent up to now is 533.9 secs Computing kpt #: 93 total cpu time spent up to now is 538.9 secs Computing kpt #: 94 total cpu time spent up to now is 544.1 secs Computing kpt #: 95 total cpu time spent up to now is 549.4 secs Computing kpt #: 96 total cpu time spent up to now is 554.8 secs Computing kpt #: 97 total cpu time spent up to now is 560.1 secs Computing kpt #: 98 total cpu time spent up to now is 565.6 secs Computing kpt #: 99 total cpu time spent up to now is 571.1 secs Computing kpt #: 100 total cpu time spent up to now is 576.6 secs Computing kpt #: 101 total cpu time spent up to now is 582.2 secs Computing kpt #: 102 total cpu time spent up to now is 587.7 secs Computing kpt #: 103 total cpu time spent up to now is 593.5 secs Computing kpt #: 104 total cpu time spent up to now is 599.2 secs Computing kpt #: 105 total cpu time spent up to now is 605.0 secs Computing kpt #: 106 total cpu time spent up to now is 610.9 secs Computing kpt #: 107 total cpu time spent up to now is 616.6 secs Computing kpt #: 108 total cpu time spent up to now is 622.4 secs Computing kpt #: 109 total cpu time spent up to now is 628.3 secs Computing kpt #: 110 total cpu time spent up to now is 634.1 secs Computing kpt #: 111 total cpu time spent up to now is 640.1 secs Computing kpt #: 112 total cpu time spent up to now is 646.2 secs Computing kpt #: 113 total cpu time spent up to now is 652.4 secs Computing kpt #: 114 total cpu time spent up to now is 658.7 secs Computing kpt #: 115 total cpu time spent up to now is 665.0 secs Computing kpt #: 116 total cpu time spent up to now is 671.3 secs Computing kpt #: 117 total cpu time spent up to now is 677.4 secs Computing kpt #: 118 total cpu time spent up to now is 683.7 secs Computing kpt #: 119 total cpu time spent up to now is 690.0 secs Computing kpt #: 120 total cpu time spent up to now is 696.3 secs Computing kpt #: 121 total cpu time spent up to now is 702.7 secs Computing kpt #: 122 total cpu time spent up to now is 709.0 secs Computing kpt #: 123 total cpu time spent up to now is 715.3 secs Computing kpt #: 124 total cpu time spent up to now is 721.5 secs Computing kpt #: 125 total cpu time spent up to now is 727.7 secs Computing kpt #: 126 total cpu time spent up to now is 733.8 secs Computing kpt #: 127 total cpu time spent up to now is 739.6 secs Computing kpt #: 128 total cpu time spent up to now is 745.3 secs Computing kpt #: 129 total cpu time spent up to now is 751.8 secs Computing kpt #: 130 total cpu time spent up to now is 758.1 secs Computing kpt #: 131 total cpu time spent up to now is 764.4 secs Computing kpt #: 132 total cpu time spent up to now is 770.6 secs Computing kpt #: 133 total cpu time spent up to now is 777.0 secs Computing kpt #: 134 total cpu time spent up to now is 783.4 secs Computing kpt #: 135 total cpu time spent up to now is 789.8 secs Computing kpt #: 136 total cpu time spent up to now is 796.1 secs Computing kpt #: 137 total cpu time spent up to now is 802.4 secs Computing kpt #: 138 total cpu time spent up to now is 808.8 secs Computing kpt #: 139 total cpu time spent up to now is 815.0 secs Computing kpt #: 140 total cpu time spent up to now is 821.2 secs Computing kpt #: 141 total cpu time spent up to now is 827.3 secs Computing kpt #: 142 total cpu time spent up to now is 833.2 secs Computing kpt #: 143 total cpu time spent up to now is 839.6 secs Computing kpt #: 144 total cpu time spent up to now is 845.9 secs Computing kpt #: 145 total cpu time spent up to now is 852.2 secs Computing kpt #: 146 total cpu time spent up to now is 858.5 secs Computing kpt #: 147 total cpu time spent up to now is 864.7 secs Computing kpt #: 148 total cpu time spent up to now is 870.8 secs Computing kpt #: 149 total cpu time spent up to now is 876.9 secs Computing kpt #: 150 total cpu time spent up to now is 882.9 secs Computing kpt #: 151 total cpu time spent up to now is 889.1 secs Computing kpt #: 152 total cpu time spent up to now is 894.8 secs Computing kpt #: 153 total cpu time spent up to now is 900.6 secs Computing kpt #: 154 total cpu time spent up to now is 906.4 secs Computing kpt #: 155 total cpu time spent up to now is 912.3 secs Computing kpt #: 156 total cpu time spent up to now is 918.1 secs Computing kpt #: 157 total cpu time spent up to now is 924.1 secs Computing kpt #: 158 total cpu time spent up to now is 930.0 secs Computing kpt #: 159 total cpu time spent up to now is 936.0 secs Computing kpt #: 160 total cpu time spent up to now is 942.2 secs Computing kpt #: 161 total cpu time spent up to now is 948.1 secs Computing kpt #: 162 total cpu time spent up to now is 954.2 secs Computing kpt #: 163 total cpu time spent up to now is 960.5 secs Computing kpt #: 164 total cpu time spent up to now is 966.8 secs Computing kpt #: 165 total cpu time spent up to now is 973.0 secs Computing kpt #: 166 total cpu time spent up to now is 979.4 secs Computing kpt #: 167 total cpu time spent up to now is 985.6 secs Computing kpt #: 168 total cpu time spent up to now is 991.1 secs Computing kpt #: 169 total cpu time spent up to now is 996.6 secs Computing kpt #: 170 total cpu time spent up to now is 1002.1 secs Computing kpt #: 171 total cpu time spent up to now is 1007.7 secs Computing kpt #: 172 total cpu time spent up to now is 1013.3 secs Computing kpt #: 173 total cpu time spent up to now is 1019.0 secs Computing kpt #: 174 total cpu time spent up to now is 1025.1 secs Computing kpt #: 175 total cpu time spent up to now is 1031.1 secs Computing kpt #: 176 total cpu time spent up to now is 1037.3 secs Computing kpt #: 177 total cpu time spent up to now is 1043.7 secs Computing kpt #: 178 total cpu time spent up to now is 1049.7 secs Computing kpt #: 179 total cpu time spent up to now is 1055.9 secs Computing kpt #: 180 total cpu time spent up to now is 1061.6 secs Computing kpt #: 181 total cpu time spent up to now is 1067.1 secs Computing kpt #: 182 total cpu time spent up to now is 1072.7 secs Computing kpt #: 183 total cpu time spent up to now is 1078.2 secs Computing kpt #: 184 total cpu time spent up to now is 1083.6 secs Computing kpt #: 185 total cpu time spent up to now is 1089.1 secs Computing kpt #: 186 total cpu time spent up to now is 1094.7 secs Computing kpt #: 187 total cpu time spent up to now is 1100.1 secs Computing kpt #: 188 total cpu time spent up to now is 1105.5 secs Computing kpt #: 189 total cpu time spent up to now is 1111.0 secs Computing kpt #: 190 total cpu time spent up to now is 1116.7 secs Computing kpt #: 191 total cpu time spent up to now is 1122.3 secs Computing kpt #: 192 total cpu time spent up to now is 1127.8 secs Computing kpt #: 193 total cpu time spent up to now is 1133.3 secs Computing kpt #: 194 total cpu time spent up to now is 1138.8 secs Computing kpt #: 195 total cpu time spent up to now is 1144.3 secs Computing kpt #: 196 total cpu time spent up to now is 1149.7 secs Computing kpt #: 197 total cpu time spent up to now is 1155.1 secs Computing kpt #: 198 total cpu time spent up to now is 1160.5 secs Computing kpt #: 199 total cpu time spent up to now is 1166.1 secs Computing kpt #: 200 total cpu time spent up to now is 1171.8 secs Computing kpt #: 201 total cpu time spent up to now is 1177.4 secs Computing kpt #: 202 total cpu time spent up to now is 1183.1 secs Computing kpt #: 203 total cpu time spent up to now is 1188.7 secs Computing kpt #: 204 total cpu time spent up to now is 1194.2 secs Computing kpt #: 205 total cpu time spent up to now is 1199.7 secs Computing kpt #: 206 total cpu time spent up to now is 1205.1 secs Computing kpt #: 207 total cpu time spent up to now is 1210.5 secs Computing kpt #: 208 total cpu time spent up to now is 1216.0 secs Computing kpt #: 209 total cpu time spent up to now is 1221.2 secs Computing kpt #: 210 total cpu time spent up to now is 1226.5 secs Computing kpt #: 211 total cpu time spent up to now is 1231.8 secs Computing kpt #: 212 total cpu time spent up to now is 1237.1 secs Computing kpt #: 213 total cpu time spent up to now is 1242.4 secs Computing kpt #: 214 total cpu time spent up to now is 1247.8 secs Computing kpt #: 215 total cpu time spent up to now is 1253.3 secs Computing kpt #: 216 total cpu time spent up to now is 1258.8 secs Computing kpt #: 217 total cpu time spent up to now is 1264.4 secs Computing kpt #: 218 total cpu time spent up to now is 1269.9 secs Computing kpt #: 219 total cpu time spent up to now is 1275.4 secs Computing kpt #: 220 total cpu time spent up to now is 1280.7 secs Computing kpt #: 221 total cpu time spent up to now is 1285.4 secs Computing kpt #: 222 total cpu time spent up to now is 1290.4 secs Computing kpt #: 223 total cpu time spent up to now is 1295.4 secs Computing kpt #: 224 total cpu time spent up to now is 1300.5 secs Computing kpt #: 225 total cpu time spent up to now is 1305.6 secs Computing kpt #: 226 total cpu time spent up to now is 1310.8 secs Computing kpt #: 227 total cpu time spent up to now is 1315.9 secs Computing kpt #: 228 total cpu time spent up to now is 1321.0 secs Computing kpt #: 229 total cpu time spent up to now is 1326.1 secs Computing kpt #: 230 total cpu time spent up to now is 1331.3 secs Computing kpt #: 231 total cpu time spent up to now is 1336.4 secs Computing kpt #: 232 total cpu time spent up to now is 1341.7 secs Computing kpt #: 233 total cpu time spent up to now is 1346.9 secs Computing kpt #: 234 total cpu time spent up to now is 1352.0 secs Computing kpt #: 235 total cpu time spent up to now is 1357.2 secs Computing kpt #: 236 total cpu time spent up to now is 1362.6 secs Computing kpt #: 237 total cpu time spent up to now is 1367.9 secs Computing kpt #: 238 total cpu time spent up to now is 1373.3 secs Computing kpt #: 239 total cpu time spent up to now is 1378.8 secs Computing kpt #: 240 total cpu time spent up to now is 1384.4 secs Computing kpt #: 241 total cpu time spent up to now is 1390.1 secs Computing kpt #: 242 total cpu time spent up to now is 1395.8 secs Computing kpt #: 243 total cpu time spent up to now is 1401.4 secs Computing kpt #: 244 total cpu time spent up to now is 1407.0 secs Computing kpt #: 245 total cpu time spent up to now is 1412.9 secs Computing kpt #: 246 total cpu time spent up to now is 1418.6 secs Computing kpt #: 247 total cpu time spent up to now is 1424.3 secs Computing kpt #: 248 total cpu time spent up to now is 1429.9 secs Computing kpt #: 249 total cpu time spent up to now is 1435.4 secs Computing kpt #: 250 total cpu time spent up to now is 1440.9 secs Computing kpt #: 251 total cpu time spent up to now is 1446.4 secs Computing kpt #: 252 total cpu time spent up to now is 1451.6 secs ethr = 1.67E-11, avg # of iterations = 36.5 total cpu time spent up to now is 1451.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 10071 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9322 -7.9322 -6.3031 -6.3031 -5.8652 -5.8652 -4.0535 -4.0535 -3.4655 -3.4655 -2.9088 -2.9088 -1.2382 -1.2382 0.4030 0.4030 0.8851 0.8851 1.5640 1.5640 1.7147 1.7147 2.2457 2.2457 2.3379 2.3379 2.6364 2.6364 3.0433 3.0433 4.0431 4.0431 4.2884 4.2884 4.5473 4.5473 4.8017 4.8017 5.2861 5.2861 6.0536 6.0536 6.6631 6.6631 7.3375 7.3375 7.8370 7.8370 8.4497 8.4497 8.5428 8.5428 9.1517 9.1517 9.2940 9.2940 k = 0.0000 0.0000 0.0155 ( 10065 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9312 -7.9312 -6.3157 -6.3157 -5.8514 -5.8514 -4.0528 -4.0528 -3.4665 -3.4665 -2.9130 -2.9130 -1.2352 -1.2352 0.4011 0.4011 0.8855 0.8855 1.5652 1.5652 1.7139 1.7139 2.2476 2.2476 2.3403 2.3403 2.6338 2.6338 3.0431 3.0431 4.0390 4.0390 4.2912 4.2912 4.5474 4.5474 4.8036 4.8036 5.2881 5.2881 6.0503 6.0503 6.6591 6.6591 7.3375 7.3375 7.8395 7.8395 8.4147 8.4147 8.5815 8.5815 9.1473 9.1473 9.2858 9.2858 k = 0.0000 0.0000 0.0311 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9282 -7.9282 -6.3498 -6.3498 -5.8139 -5.8139 -4.0510 -4.0510 -3.4693 -3.4693 -2.9255 -2.9255 -1.2262 -1.2262 0.3955 0.3955 0.8868 0.8868 1.5687 1.5687 1.7117 1.7117 2.2532 2.2532 2.3473 2.3473 2.6260 2.6260 3.0426 3.0426 4.0274 4.0274 4.2990 4.2990 4.5476 4.5476 4.8090 4.8090 5.2941 5.2941 6.0406 6.0406 6.6475 6.6475 7.3376 7.3376 7.8468 7.8468 8.3599 8.3599 8.6460 8.6460 9.1344 9.1344 9.2648 9.2648 k = 0.0000 0.0000 0.0466 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9232 -7.9232 -6.3978 -6.3978 -5.7602 -5.7602 -4.0480 -4.0480 -3.4739 -3.4739 -2.9460 -2.9460 -1.2114 -1.2114 0.3858 0.3858 0.8896 0.8896 1.5745 1.5745 1.7082 1.7082 2.2621 2.2621 2.3585 2.3585 2.6132 2.6132 3.0421 3.0421 4.0095 4.0095 4.3111 4.3111 4.5481 4.5481 4.8173 4.8173 5.3039 5.3039 6.0244 6.0244 6.6283 6.6283 7.3383 7.3383 7.8583 7.8583 8.3089 8.3089 8.7074 8.7074 9.1150 9.1150 9.2392 9.2392 k = 0.0000 0.0000 0.0621 ( 10067 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9161 -7.9161 -6.4535 -6.4535 -5.6966 -5.6966 -4.0437 -4.0437 -3.4803 -3.4803 -2.9741 -2.9741 -1.1913 -1.1913 0.3720 0.3720 0.8942 0.8942 1.5824 1.5824 1.7037 1.7037 2.2736 2.2736 2.3733 2.3733 2.5959 2.5959 3.0419 3.0419 3.9869 3.9869 4.3265 4.3265 4.5491 4.5491 4.8277 4.8277 5.3169 5.3169 6.0022 6.0022 6.6020 6.6020 7.3402 7.3402 7.8733 7.8733 8.2658 8.2658 8.7505 8.7505 9.0962 9.0962 9.2183 9.2183 k = 0.0000 0.0000 0.0777 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.9071 -7.9071 -6.5132 -6.5132 -5.6266 -5.6266 -4.0382 -4.0382 -3.4884 -3.4884 -3.0093 -3.0093 -1.1664 -1.1664 0.3538 0.3538 0.9014 0.9014 1.5924 1.5924 1.6985 1.6985 2.2867 2.2867 2.3908 2.3908 2.5749 2.5749 3.0426 3.0426 3.9612 3.9612 4.3447 4.3447 4.5507 4.5507 4.8391 4.8391 5.3326 5.3326 5.9744 5.9744 6.5692 6.5692 7.3440 7.3440 7.8907 7.8907 8.2320 8.2320 8.7593 8.7593 9.0854 9.0854 9.2137 9.2137 k = 0.0000 0.0000 0.0932 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8960 -7.8960 -6.5750 -6.5750 -5.5524 -5.5524 -4.0316 -4.0316 -3.4982 -3.4982 -3.0509 -3.0509 -1.1371 -1.1371 0.3311 0.3311 0.9116 0.9116 1.6042 1.6042 1.6928 1.6928 2.3000 2.3000 2.4101 2.4101 2.5512 2.5512 3.0447 3.0447 3.9335 3.9335 4.3651 4.3651 4.5533 4.5533 4.8505 4.8505 5.3503 5.3503 5.9413 5.9413 6.5306 6.5306 7.3503 7.3503 7.9096 7.9096 8.2081 8.2081 8.7300 8.7300 9.0733 9.0733 9.2391 9.2391 k = 0.0000 0.0000 0.1087 ( 10067 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8830 -7.8830 -6.6375 -6.6375 -5.4753 -5.4753 -4.0238 -4.0238 -3.5096 -3.5096 -3.0984 -3.0984 -1.1040 -1.1040 0.3040 0.3040 0.9252 0.9252 1.6178 1.6178 1.6868 1.6868 2.3113 2.3113 2.4300 2.4300 2.5268 2.5268 3.0491 3.0491 3.9048 3.9048 4.3876 4.3876 4.5570 4.5570 4.8609 4.8609 5.3693 5.3693 5.9037 5.9037 6.4870 6.4870 7.3597 7.3597 7.9288 7.9288 8.1942 8.1942 8.6754 8.6754 9.0495 9.0495 9.1908 9.1908 k = 0.0000 0.0000 0.1243 ( 10071 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8679 -7.8679 -6.7000 -6.7000 -5.3959 -5.3959 -4.0149 -4.0149 -3.5224 -3.5224 -3.1511 -3.1511 -1.0676 -1.0676 0.2727 0.2727 0.9425 0.9425 1.6327 1.6327 1.6808 1.6808 2.3174 2.3174 2.4494 2.4494 2.5048 2.5048 3.0565 3.0565 3.8759 3.8759 4.4119 4.4119 4.5620 4.5620 4.8696 4.8696 5.3886 5.3886 5.8624 5.8624 6.4395 6.4395 7.3726 7.3726 7.9474 7.9474 8.1901 8.1901 8.6082 8.6082 9.0163 9.0163 9.1201 9.1201 k = 0.0000 0.0000 0.1398 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8509 -7.8509 -6.7621 -6.7621 -5.3148 -5.3148 -4.0048 -4.0048 -3.5365 -3.5365 -3.2085 -3.2085 -1.0284 -1.0284 0.2376 0.2376 0.9635 0.9635 1.6488 1.6488 1.6750 1.6750 2.3137 2.3137 2.4671 2.4671 2.4898 2.4898 3.0676 3.0676 3.8473 3.8473 4.4380 4.4380 4.5683 4.5683 4.8761 4.8761 5.4072 5.4072 5.8185 5.8185 6.3891 6.3891 7.3894 7.3894 7.9645 7.9645 8.1949 8.1949 8.5361 8.5361 8.9767 8.9767 9.0542 9.0542 k = 0.0000 0.0000 0.1553 ( 10075 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8319 -7.8319 -6.8234 -6.8234 -5.2324 -5.2324 -3.9937 -3.9937 -3.5520 -3.5520 -3.2701 -3.2701 -0.9868 -0.9868 0.1990 0.1990 0.9881 0.9881 1.6636 1.6636 1.6714 1.6714 2.2970 2.2970 2.4797 2.4797 2.4874 2.4874 3.0832 3.0832 3.8194 3.8194 4.4658 4.4658 4.5762 4.5762 4.8800 4.8800 5.4237 5.4237 5.7734 5.7734 6.3368 6.3368 7.4103 7.4103 7.9794 7.9794 8.2075 8.2075 8.4636 8.4636 8.9324 8.9324 8.9947 8.9947 k = 0.0000 0.0000 0.1709 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.8109 -7.8109 -6.8838 -6.8838 -5.1489 -5.1489 -3.9816 -3.9816 -3.5685 -3.5685 -3.3353 -3.3353 -0.9432 -0.9432 0.1575 0.1575 1.0161 1.0161 1.6614 1.6614 1.6855 1.6855 2.2685 2.2685 2.4856 2.4856 2.4977 2.4977 3.1033 3.1033 3.7923 3.7923 4.4951 4.4951 4.5854 4.5854 4.8813 4.8813 5.4358 5.4358 5.7296 5.7296 6.2834 6.2834 7.4352 7.4352 7.9916 7.9916 8.2250 8.2250 8.3947 8.3947 8.8846 8.8846 8.9428 8.9428 k = 0.0000 0.0000 0.1864 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7880 -7.7880 -6.9430 -6.9430 -5.0644 -5.0644 -3.9685 -3.9685 -3.5860 -3.5860 -3.4037 -3.4037 -0.8979 -0.8979 0.1134 0.1134 1.0473 1.0473 1.6551 1.6551 1.7038 1.7038 2.2320 2.2320 2.4942 2.4942 2.5074 2.5074 3.1281 3.1281 3.7662 3.7662 4.5260 4.5260 4.5961 4.5961 4.8799 4.8799 5.4401 5.4401 5.6910 5.6910 6.2298 6.2298 7.4640 7.4640 8.0009 8.0009 8.2379 8.2379 8.3392 8.3392 8.8342 8.8342 8.8991 8.8991 k = 0.0000 0.0000 0.2019 ( 10057 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7631 -7.7631 -7.0009 -7.0009 -4.9793 -4.9793 -3.9544 -3.9544 -3.6045 -3.6045 -3.4748 -3.4748 -0.8512 -0.8512 0.0672 0.0672 1.0815 1.0815 1.6480 1.6480 1.7225 1.7225 2.1909 2.1909 2.5044 2.5044 2.5146 2.5146 3.1572 3.1572 3.7409 3.7409 4.5583 4.5583 4.6081 4.6081 4.8763 4.8763 5.4317 5.4317 5.6628 5.6628 6.1767 6.1767 7.4964 7.4964 8.0078 8.0078 8.2163 8.2163 8.3265 8.3265 8.7819 8.7819 8.8640 8.8640 k = 0.0000 0.0000 0.2175 ( 10057 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7362 -7.7362 -7.0574 -7.0574 -4.8936 -4.8936 -3.9396 -3.9396 -3.6236 -3.6236 -3.5484 -3.5484 -0.8032 -0.8032 0.0193 0.0193 1.1182 1.1182 1.6396 1.6396 1.7411 1.7411 2.1477 2.1477 2.5145 2.5145 2.5195 2.5195 3.1900 3.1900 3.7161 3.7161 4.5919 4.5919 4.6212 4.6212 4.8709 4.8709 5.4070 5.4070 5.6490 5.6490 6.1248 6.1248 7.5319 7.5319 8.0131 8.0131 8.1646 8.1646 8.3504 8.3504 8.7292 8.7292 8.8369 8.8369 k = 0.0000 0.0000 0.2330 ( 10051 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7075 -7.7075 -7.1125 -7.1125 -4.8075 -4.8075 -3.9242 -3.9242 -3.6434 -3.6434 -3.6239 -3.6239 -0.7543 -0.7543 -0.0300 -0.0300 1.1571 1.1571 1.6294 1.6294 1.7595 1.7595 2.1043 2.1043 2.5223 2.5223 2.5238 2.5238 3.2257 3.2257 3.6917 3.6917 4.6261 4.6261 4.6355 4.6355 4.8645 4.8645 5.3679 5.3679 5.6486 5.6486 6.0745 6.0745 7.5696 7.5696 8.0181 8.0181 8.1089 8.1089 8.3817 8.3817 8.6789 8.6789 8.8170 8.8170 k = 0.0000 0.0000 0.2485 ( 10049 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6768 -7.6768 -7.1661 -7.1661 -4.7210 -4.7210 -3.9085 -3.9085 -3.7009 -3.7009 -3.6635 -3.6635 -0.7044 -0.7044 -0.0805 -0.0805 1.1979 1.1979 1.6166 1.6166 1.7774 1.7774 2.0619 2.0619 2.5248 2.5248 2.5307 2.5307 3.2635 3.2635 3.6670 3.6670 4.6491 4.6491 4.6620 4.6620 4.8583 4.8583 5.3192 5.3192 5.6575 5.6575 6.0262 6.0262 7.6087 7.6087 8.0247 8.0247 8.0556 8.0556 8.4072 8.4072 8.6372 8.6372 8.8027 8.8027 k = 0.0000 0.0000 0.2641 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.6442 -7.6442 -7.2182 -7.2182 -4.6344 -4.6344 -3.8942 -3.8942 -3.7773 -3.7773 -3.6841 -3.6841 -0.6538 -0.6538 -0.1317 -0.1317 1.2402 1.2402 1.6005 1.6005 1.7947 1.7947 2.0220 2.0220 2.5264 2.5264 2.5357 2.5357 3.3025 3.3025 3.6418 3.6418 4.6643 4.6643 4.6955 4.6955 4.8544 4.8544 5.2652 5.2652 5.6721 5.6721 5.9802 5.9802 7.6479 7.6479 8.0062 8.0062 8.0350 8.0350 8.4129 8.4129 8.6156 8.6156 8.7921 8.7921 k = 0.0000 0.0000 0.2796 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.6097 -7.6097 -7.2686 -7.2686 -4.5477 -4.5477 -3.8955 -3.8955 -3.8388 -3.8388 -3.7048 -3.7048 -0.6026 -0.6026 -0.1836 -0.1836 1.2834 1.2834 1.5802 1.5802 1.8115 1.8115 1.9855 1.9855 2.5280 2.5280 2.5387 2.5387 3.3420 3.3420 3.6154 3.6154 4.6795 4.6795 4.7242 4.7242 4.8567 4.8567 5.2089 5.2089 5.6905 5.6905 5.9368 5.9368 7.6860 7.6860 7.9612 7.9612 8.0511 8.0511 8.3898 8.3898 8.6219 8.6219 8.7833 8.7833 k = 0.0000 0.0000 0.2951 ( 10047 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.5734 -7.5734 -7.3174 -7.3174 -4.4612 -4.4612 -3.9558 -3.9558 -3.8420 -3.8420 -3.7257 -3.7257 -0.5510 -0.5510 -0.2359 -0.2359 1.3271 1.3271 1.5554 1.5554 1.8279 1.8279 1.9532 1.9532 2.5297 2.5297 2.5400 2.5400 3.3814 3.3814 3.5876 3.5876 4.6944 4.6944 4.7424 4.7424 4.8713 4.8713 5.1520 5.1520 5.7118 5.7118 5.8962 5.8962 7.7220 7.7220 7.9205 7.9205 8.0746 8.0746 8.3468 8.3468 8.6461 8.6461 8.7743 8.7743 k = 0.0000 0.0000 0.3107 ( 10047 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.5352 -7.5352 -7.3644 -7.3644 -4.3748 -4.3748 -4.0358 -4.0358 -3.8260 -3.8260 -3.7466 -3.7466 -0.4989 -0.4989 -0.2885 -0.2885 1.3706 1.3706 1.5257 1.5257 1.8444 1.8444 1.9251 1.9251 2.5318 2.5318 2.5397 2.5397 3.4199 3.4199 3.5579 3.5579 4.7088 4.7088 4.7476 4.7476 4.9008 4.9008 5.0956 5.0956 5.7357 5.7357 5.8584 5.8584 7.7556 7.7556 7.8836 7.8836 8.1063 8.1063 8.2956 8.2956 8.6757 8.6757 8.7631 8.7631 k = 0.0000 0.0000 0.3262 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4952 -7.4952 -7.4098 -7.4098 -4.2889 -4.2889 -4.1189 -4.1189 -3.8073 -3.8073 -3.7672 -3.7672 -0.4465 -0.4465 -0.3412 -0.3412 1.4131 1.4131 1.4916 1.4916 1.8616 1.8616 1.9009 1.9009 2.5340 2.5340 2.5384 2.5384 3.4571 3.4571 3.5263 3.5263 4.7222 4.7222 4.7434 4.7434 4.9416 4.9416 5.0410 5.0410 5.7623 5.7623 5.8235 5.8235 7.7873 7.7873 7.8498 7.8498 8.1459 8.1459 8.2429 8.2429 8.7042 8.7042 8.7483 8.7483 k = 0.0000 0.0000 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4534 -7.4534 -7.4534 -7.4534 -4.2035 -4.2035 -4.2035 -4.2035 -3.7875 -3.7875 -3.7875 -3.7875 -0.3939 -0.3939 -0.3939 -0.3939 1.4537 1.4537 1.4537 1.4537 1.8801 1.8801 1.8801 1.8801 2.5364 2.5364 2.5364 2.5364 3.4927 3.4927 3.4927 3.4927 4.7341 4.7341 4.7341 4.7341 4.9892 4.9892 4.9892 4.9892 5.7915 5.7915 5.7915 5.7915 7.8182 7.8182 7.8182 7.8182 8.1921 8.1921 8.1921 8.1921 8.7287 8.7287 8.7287 8.7287 k = 0.0000 0.0000 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4534 -7.4534 -7.4534 -7.4534 -4.2035 -4.2035 -4.2035 -4.2035 -3.7875 -3.7875 -3.7875 -3.7875 -0.3939 -0.3939 -0.3939 -0.3939 1.4537 1.4537 1.4537 1.4537 1.8801 1.8801 1.8801 1.8801 2.5364 2.5364 2.5364 2.5364 3.4927 3.4927 3.4927 3.4927 4.7341 4.7341 4.7341 4.7341 4.9892 4.9892 4.9892 4.9892 5.7915 5.7915 5.7915 5.7915 7.8182 7.8182 7.8182 7.8182 8.1921 8.1921 8.1921 8.1921 8.7287 8.7287 8.7287 8.7287 k = 0.0000 0.0156 0.3417 ( 10043 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4573 -7.4573 -7.4486 -7.4486 -4.2173 -4.2173 -4.1895 -4.1895 -3.7969 -3.7969 -3.7807 -3.7807 -0.4380 -0.4380 -0.3470 -0.3470 1.4211 1.4211 1.4836 1.4836 1.8570 1.8570 1.9022 1.9022 2.5195 2.5195 2.5558 2.5558 3.4922 3.4922 3.4933 3.4933 4.7234 4.7234 4.7370 4.7370 4.9506 4.9506 5.0346 5.0346 5.7838 5.7838 5.7965 5.7965 7.8141 7.8141 7.8252 7.8252 8.1570 8.1570 8.2327 8.2327 8.7109 8.7109 8.7507 8.7507 k = 0.0000 0.0313 0.3417 ( 10041 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4603 -7.4603 -7.4429 -7.4429 -4.2310 -4.2310 -4.1754 -4.1754 -3.8088 -3.8088 -3.7764 -3.7764 -0.4790 -0.4790 -0.2975 -0.2975 1.3861 1.3861 1.5105 1.5105 1.8328 1.8328 1.9233 1.9233 2.5057 2.5057 2.5770 2.5770 3.4918 3.4918 3.4944 3.4944 4.7078 4.7078 4.7283 4.7283 4.9217 4.9217 5.0840 5.0840 5.7735 5.7735 5.7986 5.7986 7.8116 7.8116 7.8361 7.8361 8.1281 8.1281 8.2782 8.2782 8.6978 8.6978 8.7767 8.7767 k = 0.0000 0.0469 0.3417 ( 10047 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4625 -7.4625 -7.4362 -7.4362 -4.2446 -4.2446 -4.1611 -4.1611 -3.8233 -3.8233 -3.7746 -3.7746 -0.5167 -0.5167 -0.2459 -0.2459 1.3491 1.3491 1.5342 1.5342 1.8077 1.8077 1.9433 1.9433 2.4953 2.4953 2.5991 2.5991 3.4913 3.4913 3.4964 3.4964 4.6897 4.6897 4.7065 4.7065 4.9032 4.9032 5.1357 5.1357 5.7613 5.7613 5.7980 5.7980 7.8090 7.8090 7.8519 7.8519 8.1063 8.1063 8.3277 8.3277 8.6898 8.6898 8.8064 8.8064 k = 0.0000 0.0626 0.3417 ( 10043 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4638 -7.4638 -7.4287 -7.4287 -4.2581 -4.2581 -4.1468 -4.1468 -3.8401 -3.8401 -3.7751 -3.7751 -0.5509 -0.5509 -0.1926 -0.1926 1.3106 1.3106 1.5546 1.5546 1.7815 1.7815 1.9622 1.9622 2.4885 2.4885 2.6212 2.6212 3.4909 3.4909 3.5000 3.5000 4.6696 4.6696 4.6749 4.6749 4.8916 4.8916 5.1886 5.1886 5.7478 5.7478 5.7951 5.7951 7.8048 7.8048 7.8729 7.8729 8.0921 8.0921 8.3800 8.3800 8.6881 8.6881 8.8392 8.8392 k = 0.0000 0.0782 0.3417 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4643 -7.4643 -7.4203 -7.4203 -4.2715 -4.2715 -4.1324 -4.1324 -3.8593 -3.8593 -3.7778 -3.7778 -0.5815 -0.5815 -0.1380 -0.1380 1.2712 1.2712 1.5717 1.5717 1.7546 1.7546 1.9799 1.9799 2.4855 2.4855 2.6421 2.6421 3.4907 3.4907 3.5062 3.5062 4.6359 4.6359 4.6506 4.6506 4.8817 4.8817 5.2416 5.2416 5.7336 5.7336 5.7904 5.7904 7.7980 7.7980 7.8996 7.8996 8.0857 8.0857 8.4329 8.4329 8.6945 8.6945 8.8745 8.8745 k = 0.0000 0.0939 0.3417 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4641 -7.4641 -7.4109 -7.4109 -4.2849 -4.2849 -4.1181 -4.1181 -3.8805 -3.8805 -3.7827 -3.7827 -0.6084 -0.6084 -0.0827 -0.0827 1.2313 1.2313 1.5856 1.5856 1.7270 1.7270 1.9963 1.9963 2.4861 2.4861 2.6606 2.6606 3.4908 3.4908 3.5157 3.5157 4.5956 4.5956 4.6304 4.6304 4.8695 4.8695 5.2940 5.2940 5.7195 5.7195 5.7846 5.7846 7.7884 7.7884 7.9322 7.9322 8.0865 8.0865 8.4831 8.4831 8.7124 8.7124 8.9114 8.9114 k = 0.0000 0.1095 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4631 -7.4631 -7.4007 -7.4007 -4.2982 -4.2982 -4.1039 -4.1039 -3.9035 -3.9035 -3.7896 -3.7896 -0.6316 -0.6316 -0.0271 -0.0271 1.1915 1.1915 1.5965 1.5965 1.6989 1.6989 2.0111 2.0111 2.4902 2.4902 2.6758 2.6758 3.4914 3.4914 3.5294 3.5294 4.5549 4.5549 4.6104 4.6104 4.8526 4.8526 5.3448 5.3448 5.7060 5.7060 5.7785 5.7785 7.7766 7.7766 7.9707 7.9707 8.0933 8.0933 8.5260 8.5260 8.7460 8.7460 8.9488 8.9488 k = 0.0000 0.1252 0.3417 ( 10051 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4615 -7.4615 -7.3897 -7.3897 -4.3115 -4.3115 -4.0904 -4.0904 -3.9276 -3.9276 -3.7983 -3.7983 -0.6509 -0.6509 0.0280 0.0280 1.1523 1.1523 1.6045 1.6045 1.6708 1.6708 2.0241 2.0241 2.4976 2.4976 2.6868 2.6868 3.4928 3.4928 3.5480 3.5480 4.5152 4.5152 4.5908 4.5908 4.8298 4.8298 5.3928 5.3928 5.6933 5.6933 5.7731 5.7731 7.7637 7.7637 8.0149 8.0149 8.1045 8.1045 8.5596 8.5596 8.7975 8.7975 8.9853 8.9853 k = 0.0000 0.1408 0.3417 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4593 -7.4593 -7.3778 -7.3778 -4.3248 -4.3248 -4.0784 -4.0784 -3.9519 -3.9519 -3.8087 -3.8087 -0.6666 -0.6666 0.0819 0.0819 1.1143 1.1143 1.6096 1.6096 1.6430 1.6430 2.0352 2.0352 2.5079 2.5079 2.6934 2.6934 3.4952 3.4952 3.5718 3.5718 4.4773 4.4773 4.5717 4.5717 4.8007 4.8007 5.4364 5.4364 5.6815 5.6815 5.7697 5.7697 7.7509 7.7509 8.0645 8.0645 8.1188 8.1188 8.5860 8.5860 8.8644 8.8644 9.0196 9.0196 k = 0.0000 0.1564 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4565 -7.4565 -7.3652 -7.3652 -4.3381 -4.3381 -4.0701 -4.0701 -3.9739 -3.9739 -3.8205 -3.8205 -0.6786 -0.6786 0.1339 0.1339 1.0781 1.0781 1.6095 1.6095 1.6186 1.6186 2.0440 2.0440 2.5208 2.5208 2.6955 2.6955 3.4990 3.4990 3.6006 3.6006 4.4418 4.4418 4.5533 4.5533 4.7655 4.7655 5.4736 5.4736 5.6705 5.6705 5.7699 5.7699 7.7393 7.7393 8.1190 8.1190 8.1352 8.1352 8.6092 8.6092 8.9428 8.9428 9.0506 9.0506 k = 0.0000 0.1721 0.3417 ( 10045 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4532 -7.4532 -7.3518 -7.3518 -4.3514 -4.3514 -4.0705 -4.0705 -3.9883 -3.9883 -3.8337 -3.8337 -0.6869 -0.6869 0.1829 0.1829 1.0442 1.0442 1.5877 1.5877 1.6145 1.6145 2.0504 2.0504 2.5360 2.5360 2.6937 2.6937 3.5044 3.5044 3.6338 3.6338 4.4090 4.4090 4.5358 4.5358 4.7247 4.7247 5.5020 5.5020 5.6598 5.6598 5.7756 5.7756 7.7298 7.7298 8.1521 8.1521 8.1783 8.1783 8.6327 8.6327 9.0291 9.0291 9.0777 9.0777 k = 0.0000 0.1877 0.3417 ( 10043 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4496 -7.4496 -7.3378 -7.3378 -4.3648 -4.3648 -4.0844 -4.0844 -3.9900 -3.9900 -3.8481 -3.8481 -0.6919 -0.6919 0.2281 0.2281 1.0134 1.0134 1.5630 1.5630 1.6125 1.6125 2.0539 2.0539 2.5528 2.5528 2.6888 2.6888 3.5118 3.5118 3.6706 3.6706 4.3793 4.3793 4.5195 4.5195 4.6793 4.6793 5.5201 5.5201 5.6490 5.6490 5.7876 5.7876 7.7233 7.7233 8.1707 8.1707 8.2399 8.2399 8.6590 8.6590 9.1004 9.1004 9.1215 9.1215 k = 0.0000 0.2034 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4456 -7.4456 -7.3231 -7.3231 -4.3782 -4.3782 -4.1087 -4.1087 -3.9820 -3.9820 -3.8635 -3.8635 -0.6934 -0.6934 0.2683 0.2683 0.9863 0.9863 1.5399 1.5399 1.6088 1.6088 2.0544 2.0544 2.5709 2.5709 2.6819 2.6819 3.5216 3.5216 3.7098 3.7098 4.3528 4.3528 4.5047 4.5047 4.6302 4.6302 5.5275 5.5275 5.6377 5.6377 5.8055 5.8055 7.7205 7.7205 8.1902 8.1902 8.3029 8.3029 8.6901 8.6901 9.1200 9.1200 9.2177 9.2177 k = 0.0000 0.2190 0.3417 ( 10047 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4414 -7.4414 -7.3079 -7.3079 -4.3916 -4.3916 -4.1379 -4.1379 -3.9696 -3.9696 -3.8798 -3.8798 -0.6918 -0.6918 0.3023 0.3023 0.9635 0.9635 1.5193 1.5193 1.6034 1.6034 2.0514 2.0514 2.5896 2.5896 2.6742 2.6742 3.5342 3.5342 3.7499 3.7499 4.3295 4.3295 4.4921 4.4921 4.5786 4.5786 5.5257 5.5257 5.6256 5.6256 5.8271 5.8271 7.7221 7.7221 8.2109 8.2109 8.3651 8.3651 8.7279 8.7279 9.1371 9.1371 9.3170 9.3170 k = 0.0000 0.2347 0.3417 ( 10045 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4370 -7.4370 -7.2921 -7.2921 -4.4051 -4.4051 -4.1691 -4.1691 -3.9551 -3.9551 -3.8967 -3.8967 -0.6872 -0.6872 0.3292 0.3292 0.9456 0.9456 1.5015 1.5015 1.5963 1.5963 2.0447 2.0447 2.6083 2.6083 2.6667 2.6667 3.5499 3.5499 3.7897 3.7897 4.3091 4.3091 4.4819 4.4819 4.5259 4.5259 5.5167 5.5167 5.6124 5.6124 5.8495 5.8495 7.7288 7.7288 8.2332 8.2332 8.4240 8.4240 8.7744 8.7744 9.1531 9.1531 9.4183 9.4183 k = 0.0000 0.2503 0.3417 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4327 -7.4327 -7.2759 -7.2759 -4.4185 -4.4185 -4.2012 -4.2012 -3.9397 -3.9397 -3.9141 -3.9141 -0.6796 -0.6796 0.3483 0.3483 0.9328 0.9328 1.4873 1.4873 1.5877 1.5877 2.0342 2.0342 2.6264 2.6264 2.6604 2.6604 3.5692 3.5692 3.8278 3.8278 4.2909 4.2909 4.4689 4.4689 4.4796 4.4796 5.5019 5.5019 5.5981 5.5981 5.8703 5.8703 7.7411 7.7411 8.2574 8.2574 8.4773 8.4773 8.8309 8.8309 9.1695 9.1695 9.5207 9.5207 k = 0.0000 0.2660 0.3417 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4283 -7.4283 -7.2594 -7.2594 -4.4319 -4.4319 -4.2334 -4.2334 -3.9322 -3.9322 -3.9235 -3.9235 -0.6694 -0.6694 0.3592 0.3592 0.9246 0.9246 1.4772 1.4772 1.5778 1.5778 2.0198 2.0198 2.6426 2.6426 2.6569 2.6569 3.5923 3.5923 3.8630 3.8630 4.2733 4.2733 4.4220 4.4220 4.4738 4.4738 5.4825 5.4825 5.5828 5.5828 5.8876 5.8876 7.7594 7.7594 8.2839 8.2839 8.5238 8.5238 8.8973 8.8973 9.1876 9.1876 9.6230 9.6230 k = 0.0000 0.2816 0.3417 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4241 -7.4241 -7.2426 -7.2426 -4.4451 -4.4451 -4.2653 -4.2653 -3.9502 -3.9502 -3.9073 -3.9073 -0.6567 -0.6567 0.3624 0.3624 0.9203 0.9203 1.4717 1.4717 1.5669 1.5669 2.0014 2.0014 2.6497 2.6497 2.6632 2.6632 3.6194 3.6194 3.8943 3.8943 4.2527 4.2527 4.3791 4.3791 4.4752 4.4752 5.4592 5.4592 5.5666 5.5666 5.9002 5.9002 7.7842 7.7842 8.3128 8.3128 8.5634 8.5634 8.9723 8.9723 9.2089 9.2089 9.7240 9.7240 k = 0.0000 0.2972 0.3417 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4202 -7.4202 -7.2256 -7.2256 -4.4583 -4.4583 -4.2963 -4.2963 -3.9685 -3.9685 -3.8909 -3.8909 -0.6416 -0.6416 0.3587 0.3587 0.9185 0.9185 1.4712 1.4712 1.5551 1.5551 1.9794 1.9794 2.6508 2.6508 2.6761 2.6761 3.6505 3.6505 3.9211 3.9211 4.2242 4.2242 4.3488 4.3488 4.4812 4.4812 5.4322 5.4322 5.5499 5.5499 5.9075 5.9075 7.8156 7.8156 8.3441 8.3441 8.5967 8.5967 9.0534 9.0534 9.2346 9.2346 9.8222 9.8222 k = 0.0000 0.3129 0.3417 ( 10078 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4166 -7.4166 -7.2085 -7.2085 -4.4712 -4.4712 -4.3262 -4.3262 -3.9867 -3.9867 -3.8745 -3.8745 -0.6244 -0.6244 0.3492 0.3492 0.9181 0.9181 1.4760 1.4760 1.5427 1.5427 1.9540 1.9540 2.6533 2.6533 2.6877 2.6877 3.6855 3.6855 3.9434 3.9434 4.1857 4.1857 4.3336 4.3336 4.4914 4.4914 5.4018 5.4018 5.5330 5.5330 5.9091 5.9091 7.8536 7.8536 8.3778 8.3778 8.6246 8.6246 9.1378 9.1378 9.2656 9.2656 9.9155 9.9155 k = 0.0000 0.3285 0.3417 ( 10084 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.4136 -7.4136 -7.1914 -7.1914 -4.4840 -4.4840 -4.3548 -4.3548 -4.0048 -4.0048 -3.8581 -3.8581 -0.6052 -0.6052 0.3352 0.3352 0.9178 0.9178 1.4860 1.4860 1.5300 1.5300 1.9257 1.9257 2.6578 2.6578 2.6971 2.6971 3.7239 3.7239 3.9614 3.9614 4.1411 4.1411 4.3303 4.3303 4.5051 4.5051 5.3681 5.3681 5.5162 5.5162 5.9054 5.9054 7.8980 7.8980 8.4139 8.4139 8.6473 8.6473 9.2221 9.2221 9.3029 9.3029 10.0008 10.0008 k = 0.0000 0.3442 0.3417 ( 10078 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4110 -7.4110 -7.1745 -7.1745 -4.4964 -4.4964 -4.3816 -4.3816 -4.0227 -4.0227 -3.8418 -3.8418 -0.5843 -0.5843 0.3178 0.3178 0.9168 0.9168 1.5006 1.5006 1.5175 1.5175 1.8948 1.8948 2.6642 2.6642 2.7038 2.7038 3.7653 3.7653 3.9759 3.9759 4.0946 4.0946 4.3354 4.3354 4.5213 4.5213 5.3312 5.3312 5.5001 5.5001 5.8966 5.8966 7.9481 7.9481 8.4525 8.4525 8.6652 8.6652 9.3029 9.3029 9.3471 9.3471 10.0735 10.0735 k = 0.0000 0.3598 0.3417 ( 10081 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4092 -7.4092 -7.1577 -7.1577 -4.5085 -4.5085 -4.4065 -4.4065 -4.0402 -4.0402 -3.8257 -3.8257 -0.5618 -0.5618 0.2979 0.2979 0.9147 0.9147 1.5031 1.5031 1.5217 1.5217 1.8618 1.8618 2.6721 2.6721 2.7078 2.7078 3.8087 3.8087 3.9879 3.9879 4.0490 4.0490 4.3468 4.3468 4.5389 4.5389 5.2911 5.2911 5.4851 5.4851 5.8835 5.8835 8.0027 8.0027 8.4943 8.4943 8.6782 8.6782 9.3756 9.3756 9.3988 9.3988 10.1289 10.1289 k = 0.0000 0.3755 0.3417 ( 10083 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4081 -7.4081 -7.1413 -7.1413 -4.5202 -4.5202 -4.4292 -4.4292 -4.0571 -4.0571 -3.8099 -3.8099 -0.5379 -0.5379 0.2762 0.2762 0.9116 0.9116 1.4909 1.4909 1.5449 1.5449 1.8272 1.8272 2.6812 2.6812 2.7089 2.7089 3.8533 3.8533 3.9973 3.9973 4.0065 4.0065 4.3635 4.3635 4.5566 4.5566 5.2479 5.2479 5.4717 5.4717 5.8669 5.8669 8.0604 8.0604 8.5400 8.5400 8.6860 8.6860 9.4368 9.4368 9.4560 9.4560 10.1663 10.1663 k = 0.0000 0.3911 0.3417 ( 10078 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4079 -7.4079 -7.1252 -7.1252 -4.5314 -4.5314 -4.4496 -4.4496 -4.0734 -4.0734 -3.7943 -3.7943 -0.5128 -0.5128 0.2533 0.2533 0.9076 0.9076 1.4788 1.4788 1.5718 1.5718 1.7914 1.7914 2.6910 2.6910 2.7073 2.7073 3.8981 3.8981 3.9648 3.9648 4.0086 4.0086 4.3852 4.3852 4.5733 4.5733 5.2020 5.2020 5.4604 5.4604 5.8478 5.8478 8.1193 8.1193 8.5910 8.5910 8.6882 8.6882 9.4826 9.4826 9.5160 9.5160 10.1933 10.1933 k = 0.0000 0.4068 0.3417 ( 10075 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4086 -7.4086 -7.1097 -7.1097 -4.5422 -4.5422 -4.4675 -4.4675 -4.0889 -4.0889 -3.7791 -3.7791 -0.4868 -0.4868 0.2295 0.2295 0.9030 0.9030 1.4672 1.4672 1.6016 1.6016 1.7548 1.7548 2.6978 2.6978 2.7061 2.7061 3.9280 3.9280 3.9424 3.9424 4.0185 4.0185 4.4116 4.4116 4.5878 4.5878 5.1536 5.1536 5.4519 5.4519 5.8273 5.8273 8.1772 8.1772 8.6487 8.6487 8.6845 8.6845 9.5039 9.5039 9.5810 9.5810 10.2206 10.2206 k = 0.0000 0.4224 0.3417 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4103 -7.4103 -7.0948 -7.0948 -4.5526 -4.5526 -4.4827 -4.4827 -4.1034 -4.1034 -3.7643 -3.7643 -0.4600 -0.4600 0.2053 0.2053 0.8984 0.8984 1.4563 1.4563 1.6335 1.6335 1.7179 1.7179 2.6917 2.6917 2.7149 2.7149 3.8961 3.8961 3.9843 3.9843 4.0293 4.0293 4.4423 4.4423 4.5992 4.5992 5.1033 5.1033 5.4468 5.4468 5.8061 5.8061 8.2321 8.2321 8.6742 8.6742 8.7151 8.7151 9.4975 9.4975 9.6493 9.6493 10.2559 10.2559 k = 0.0000 0.4380 0.3417 ( 10075 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4130 -7.4130 -7.0805 -7.0805 -4.5626 -4.5626 -4.4951 -4.4951 -4.1168 -4.1168 -3.7499 -3.7499 -0.4327 -0.4327 0.1807 0.1807 0.8939 0.8939 1.4459 1.4459 1.6672 1.6672 1.6814 1.6814 2.6803 2.6803 2.7260 2.7260 3.8683 3.8683 4.0238 4.0238 4.0414 4.0414 4.4768 4.4768 4.6065 4.6065 5.0516 5.0516 5.4456 5.4456 5.7853 5.7853 8.2824 8.2824 8.6580 8.6580 8.7899 8.7899 9.4640 9.4640 9.7183 9.7183 10.3005 10.3005 k = 0.0000 0.4537 0.3417 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4168 -7.4168 -7.0671 -7.0671 -4.5722 -4.5722 -4.5047 -4.5047 -4.1288 -4.1288 -3.7360 -3.7360 -0.4050 -0.4050 0.1559 0.1559 0.8900 0.8900 1.4359 1.4359 1.6453 1.6453 1.7026 1.7026 2.6656 2.6656 2.7373 2.7373 3.8450 3.8450 4.0537 4.0537 4.0616 4.0616 4.5143 4.5143 4.6091 4.6091 4.9997 4.9997 5.4490 5.4490 5.7656 5.7656 8.3276 8.3276 8.6351 8.6351 8.8735 8.8735 9.4072 9.4072 9.7856 9.7856 10.3406 10.3406 k = 0.0000 0.4537 0.3417 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4168 -7.4168 -7.0671 -7.0671 -4.5722 -4.5722 -4.5047 -4.5047 -4.1288 -4.1288 -3.7360 -3.7360 -0.4050 -0.4050 0.1559 0.1559 0.8900 0.8900 1.4359 1.4359 1.6453 1.6453 1.7026 1.7026 2.6656 2.6656 2.7373 2.7373 3.8450 3.8450 4.0537 4.0537 4.0616 4.0616 4.5143 4.5143 4.6091 4.6091 4.9997 4.9997 5.4490 5.4490 5.7656 5.7656 8.3276 8.3276 8.6351 8.6351 8.8735 8.8735 9.4072 9.4072 9.7856 9.7856 10.3406 10.3406 k = 0.0000 0.4604 0.3292 ( 10071 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3914 -7.3914 -7.1000 -7.1000 -4.5287 -4.5287 -4.4923 -4.4923 -4.1363 -4.1363 -3.7897 -3.7897 -0.3562 -0.3562 0.1198 0.1198 0.9164 0.9164 1.3816 1.3816 1.6499 1.6499 1.6998 1.6998 2.6787 2.6787 2.7395 2.7395 3.8686 3.8686 4.0397 4.0397 4.1309 4.1309 4.5121 4.5121 4.5982 4.5982 4.9203 4.9203 5.4761 5.4761 5.7439 5.7439 8.3587 8.3587 8.6105 8.6105 8.9000 8.9000 9.3708 9.3708 9.8087 9.8087 10.2870 10.2870 k = 0.0000 0.4672 0.3166 ( 10079 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3653 -7.3653 -7.1322 -7.1322 -4.4923 -4.4923 -4.4798 -4.4798 -4.1366 -4.1366 -3.8430 -3.8430 -0.3068 -0.3068 0.0794 0.0794 0.9490 0.9490 1.3276 1.3276 1.6548 1.6548 1.6961 1.6961 2.6907 2.6907 2.7402 2.7402 3.8913 3.8913 4.0257 4.0257 4.2030 4.2030 4.5127 4.5127 4.5854 4.5854 4.8404 4.8404 5.5038 5.5038 5.7206 5.7206 8.3884 8.3884 8.5866 8.5866 8.9337 8.9337 9.3280 9.3280 9.8363 9.8363 10.2239 10.2239 k = 0.0000 0.4740 0.3041 ( 10078 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3385 -7.3385 -7.1637 -7.1637 -4.4677 -4.4677 -4.4648 -4.4648 -4.1274 -4.1274 -3.8954 -3.8954 -0.2570 -0.2570 0.0357 0.0357 0.9866 0.9866 1.2742 1.2742 1.6599 1.6599 1.6917 1.6917 2.7016 2.7016 2.7392 2.7392 3.9128 3.9128 4.0121 4.0121 4.2769 4.2769 4.5162 4.5162 4.5713 4.5713 4.7606 4.7606 5.5318 5.5318 5.6959 5.6959 8.4167 8.4167 8.5632 8.5632 8.9739 8.9739 9.2802 9.2802 9.8686 9.8686 10.1617 10.1617 k = 0.0000 0.4807 0.2915 ( 10078 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.3111 -7.3111 -7.1945 -7.1945 -4.4564 -4.4564 -4.4479 -4.4479 -4.1075 -4.1075 -3.9462 -3.9462 -0.2069 -0.2069 -0.0104 -0.0104 1.0282 1.0282 1.2216 1.2216 1.6652 1.6652 1.6868 1.6868 2.7113 2.7113 2.7366 2.7366 3.9328 3.9328 3.9982 3.9982 4.3518 4.3518 4.5226 4.5226 4.5561 4.5561 4.6820 4.6820 5.5599 5.5599 5.6700 5.6700 8.4434 8.4434 8.5400 8.5400 9.0195 9.0195 9.2289 9.2289 9.9059 9.9059 10.1022 10.1022 k = 0.0000 0.4875 0.2790 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2830 -7.2830 -7.2247 -7.2247 -4.4471 -4.4471 -4.4407 -4.4407 -4.0773 -4.0773 -3.9945 -3.9945 -0.1569 -0.1569 -0.0582 -0.0582 1.0731 1.0731 1.1703 1.1703 1.6706 1.6706 1.6815 1.6815 2.7197 2.7197 2.7325 2.7325 3.9512 3.9512 3.9837 3.9837 4.4264 4.4264 4.5284 4.5284 4.5415 4.5415 4.6084 4.6084 5.5880 5.5880 5.6433 5.6433 8.4688 8.4688 8.5168 8.5168 9.0693 9.0693 9.1756 9.1756 9.9480 9.9480 10.0465 10.0465 k = 0.0000 0.4943 0.2664 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2542 -7.2542 -7.2542 -7.2542 -4.4412 -4.4412 -4.4412 -4.4412 -4.0389 -4.0389 -4.0389 -4.0389 -0.1072 -0.1072 -0.1072 -0.1072 1.1206 1.1206 1.1206 1.1206 1.6761 1.6761 1.6761 1.6761 2.7268 2.7268 2.7268 2.7268 3.9681 3.9681 3.9681 3.9681 4.4938 4.4938 4.4938 4.4938 4.5572 4.5572 4.5572 4.5572 5.6159 5.6159 5.6159 5.6159 8.4932 8.4932 8.4932 8.4932 9.1219 9.1219 9.1219 9.1219 9.9949 9.9949 9.9949 9.9949 k = 0.0000 0.4943 0.2664 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2542 -7.2542 -7.2542 -7.2542 -4.4412 -4.4412 -4.4412 -4.4412 -4.0389 -4.0389 -4.0389 -4.0389 -0.1072 -0.1072 -0.1072 -0.1072 1.1206 1.1206 1.1206 1.1206 1.6761 1.6761 1.6761 1.6761 2.7268 2.7268 2.7268 2.7268 3.9681 3.9681 3.9681 3.9681 4.4938 4.4938 4.4938 4.4938 4.5572 4.5572 4.5572 4.5572 5.6159 5.6159 5.6159 5.6159 8.4932 8.4932 8.4932 8.4932 9.1219 9.1219 9.1219 9.1219 9.9949 9.9949 9.9949 9.9949 k = 0.0161 0.4943 0.2664 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2535 -7.2535 -7.2534 -7.2534 -4.4485 -4.4485 -4.4480 -4.4480 -4.0319 -4.0319 -4.0316 -4.0316 -0.1135 -0.1135 -0.1127 -0.1127 1.1244 1.1244 1.1256 1.1256 1.6732 1.6732 1.6744 1.6744 2.7295 2.7295 2.7296 2.7296 3.9627 3.9627 3.9636 3.9636 4.4938 4.4938 4.4956 4.4956 4.5637 4.5637 4.5642 4.5642 5.6149 5.6149 5.6170 5.6170 8.4948 8.4948 8.4960 8.4960 9.1232 9.1232 9.1233 9.1233 9.9949 9.9949 9.9956 9.9956 k = 0.0323 0.4943 0.2664 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2513 -7.2513 -7.2512 -7.2512 -4.4684 -4.4684 -4.4676 -4.4676 -4.0120 -4.0120 -4.0115 -4.0115 -0.1312 -0.1312 -0.1296 -0.1296 1.1363 1.1363 1.1388 1.1388 1.6661 1.6661 1.6685 1.6685 2.7372 2.7372 2.7374 2.7374 3.9485 3.9485 3.9502 3.9502 4.4953 4.4953 4.4985 4.4985 4.5831 4.5831 4.5838 4.5838 5.6140 5.6140 5.6182 5.6182 8.5011 8.5011 8.5034 8.5034 9.1271 9.1271 9.1275 9.1275 9.9955 9.9955 9.9969 9.9969 k = 0.0484 0.4943 0.2664 ( 10080 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3539 -35.3539 -7.2476 -7.2476 -7.2475 -7.2475 -4.4982 -4.4982 -4.4971 -4.4971 -3.9820 -3.9820 -3.9815 -3.9815 -0.1594 -0.1594 -0.1572 -0.1572 1.1551 1.1551 1.1587 1.1587 1.6564 1.6564 1.6598 1.6598 2.7485 2.7485 2.7490 2.7490 3.9282 3.9282 3.9306 3.9306 4.4981 4.4981 4.5024 4.5024 4.6133 4.6133 4.6139 4.6139 5.6134 5.6134 5.6198 5.6198 8.5118 8.5118 8.5152 8.5152 9.1338 9.1338 9.1344 9.1344 9.9966 9.9966 9.9987 9.9987 k = 0.0645 0.4943 0.2664 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2425 -7.2425 -7.2424 -7.2424 -4.5347 -4.5347 -4.5334 -4.5334 -3.9450 -3.9450 -3.9444 -3.9444 -0.1969 -0.1969 -0.1942 -0.1942 1.1781 1.1781 1.1827 1.1827 1.6462 1.6462 1.6506 1.6506 2.7617 2.7617 2.7626 2.7626 3.9054 3.9054 3.9085 3.9085 4.5017 4.5017 4.5069 4.5069 4.6516 4.6516 4.6520 4.6520 5.6134 5.6134 5.6219 5.6219 8.5269 8.5269 8.5314 8.5314 9.1431 9.1431 9.1439 9.1439 9.9982 9.9982 10.0008 10.0008 k = 0.0806 0.4943 0.2664 ( 10072 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2360 -7.2360 -7.2358 -7.2358 -4.5758 -4.5758 -4.5743 -4.5743 -3.9031 -3.9031 -3.9026 -3.9026 -0.2425 -0.2425 -0.2393 -0.2393 1.2022 1.2022 1.2077 1.2077 1.6388 1.6388 1.6440 1.6440 2.7743 2.7743 2.7758 2.7758 3.8836 3.8836 3.8874 3.8874 4.5058 4.5058 4.5118 4.5118 4.6955 4.6955 4.6959 4.6959 5.6141 5.6141 5.6248 5.6248 8.5463 8.5463 8.5517 8.5517 9.1550 9.1550 9.1559 9.1559 10.0001 10.0001 10.0031 10.0031 k = 0.0968 0.4943 0.2664 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2281 -7.2281 -7.2279 -7.2279 -4.6199 -4.6199 -4.6183 -4.6183 -3.8579 -3.8579 -3.8574 -3.8574 -0.2947 -0.2947 -0.2912 -0.2912 1.2235 1.2235 1.2298 1.2298 1.6377 1.6377 1.6437 1.6437 2.7839 2.7839 2.7861 2.7861 3.8659 3.8659 3.8702 3.8702 4.5100 4.5100 4.5168 4.5168 4.7430 4.7430 4.7436 4.7436 5.6160 5.6160 5.6288 5.6288 8.5697 8.5697 8.5760 8.5760 9.1692 9.1692 9.1703 9.1703 10.0021 10.0021 10.0054 10.0054 k = 0.1129 0.4943 0.2664 ( 10074 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2188 -7.2188 -7.2185 -7.2185 -4.6660 -4.6660 -4.6644 -4.6644 -3.8102 -3.8102 -3.8098 -3.8098 -0.3525 -0.3525 -0.3488 -0.3488 1.2383 1.2383 1.2453 1.2453 1.6466 1.6466 1.6533 1.6533 2.7882 2.7882 2.7911 2.7911 3.8548 3.8548 3.8595 3.8595 4.5138 4.5138 4.5215 4.5215 4.7930 4.7930 4.7938 4.7938 5.6194 5.6194 5.6344 5.6344 8.5970 8.5970 8.6040 8.6040 9.1854 9.1854 9.1868 9.1868 10.0041 10.0041 10.0075 10.0075 k = 0.1290 0.4943 0.2664 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2082 -7.2082 -7.2079 -7.2079 -4.7135 -4.7135 -4.7118 -4.7118 -3.7607 -3.7607 -3.7603 -3.7603 -0.4147 -0.4147 -0.4109 -0.4109 1.2442 1.2442 1.2518 1.2518 1.6679 1.6679 1.6752 1.6752 2.7854 2.7854 2.7892 2.7892 3.8520 3.8520 3.8569 3.8569 4.5172 4.5172 4.5254 4.5254 4.8443 4.8443 4.8454 4.8454 5.6249 5.6249 5.6418 5.6418 8.6278 8.6278 8.6354 8.6354 9.2035 9.2035 9.2050 9.2050 10.0059 10.0059 10.0092 10.0092 k = 0.1452 0.4943 0.2664 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1963 -7.1963 -7.1959 -7.1959 -4.7619 -4.7619 -4.7601 -4.7601 -3.7097 -3.7097 -3.7094 -3.7094 -0.4807 -0.4807 -0.4768 -0.4768 1.2413 1.2413 1.2493 1.2493 1.7013 1.7013 1.7092 1.7092 2.7746 2.7746 2.7791 2.7791 3.8582 3.8582 3.8630 3.8630 4.5198 4.5198 4.5285 4.5285 4.8963 4.8963 4.8980 4.8980 5.6326 5.6326 5.6515 5.6515 8.6618 8.6618 8.6699 8.6699 9.2227 9.2227 9.2246 9.2246 10.0074 10.0074 10.0104 10.0104 k = 0.1613 0.4943 0.2664 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1832 -7.1832 -7.1828 -7.1828 -4.8108 -4.8108 -4.8089 -4.8089 -3.6575 -3.6575 -3.6573 -3.6573 -0.5498 -0.5498 -0.5458 -0.5458 1.2313 1.2313 1.2397 1.2397 1.7449 1.7449 1.7534 1.7534 2.7556 2.7556 2.7608 2.7608 3.8730 3.8730 3.8773 3.8773 4.5219 4.5219 4.5307 4.5307 4.9486 4.9486 4.9508 4.9508 5.6429 5.6429 5.6636 5.6636 8.6985 8.6985 8.7070 8.7070 9.2427 9.2427 9.2448 9.2448 10.0085 10.0085 10.0109 10.0109 k = 0.1774 0.4943 0.2664 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1689 -7.1689 -7.1685 -7.1685 -4.8600 -4.8600 -4.8580 -4.8580 -3.6042 -3.6042 -3.6042 -3.6042 -0.6212 -0.6212 -0.6173 -0.6173 1.2168 1.2168 1.2254 1.2254 1.7959 1.7959 1.8049 1.8049 2.7292 2.7292 2.7350 2.7350 3.8949 3.8949 3.8982 3.8982 4.5240 4.5240 4.5325 4.5325 5.0007 5.0007 5.0037 5.0037 5.6560 5.6560 5.6782 5.6782 8.7375 8.7375 8.7463 8.7463 9.2626 9.2626 9.2650 9.2650 10.0091 10.0091 10.0107 10.0107 k = 0.1935 0.4943 0.2664 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1536 -7.1536 -7.1531 -7.1531 -4.9092 -4.9092 -4.9072 -4.9072 -3.5501 -3.5501 -3.5501 -3.5501 -0.6947 -0.6947 -0.6908 -0.6908 1.2001 1.2001 1.2088 1.2088 1.8516 1.8516 1.8612 1.8612 2.6968 2.6968 2.7031 2.7031 3.9215 3.9215 3.9233 3.9233 4.5271 4.5271 4.5347 4.5347 5.0523 5.0523 5.0561 5.0561 5.6720 5.6720 5.6955 5.6955 8.7782 8.7782 8.7873 8.7873 9.2815 9.2815 9.2844 9.2844 10.0091 10.0091 10.0096 10.0096 k = 0.2097 0.4943 0.2664 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1372 -7.1372 -7.1367 -7.1367 -4.9582 -4.9582 -4.9561 -4.9561 -3.4952 -3.4952 -3.4950 -3.4950 -0.7697 -0.7697 -0.7659 -0.7659 1.1826 1.1826 1.1916 1.1916 1.9098 1.9098 1.9198 1.9198 2.6603 2.6603 2.6670 2.6670 3.9493 3.9493 3.9497 3.9497 4.5330 4.5330 4.5389 4.5389 5.1032 5.1032 5.1078 5.1078 5.6908 5.6908 5.7153 5.7153 8.8199 8.8199 8.8292 8.8292 9.2987 9.2987 9.3022 9.3022 10.0071 10.0071 10.0078 10.0078 k = 0.2258 0.4943 0.2664 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1199 -7.1199 -7.1194 -7.1194 -5.0068 -5.0068 -5.0047 -5.0047 -3.4395 -3.4395 -3.4391 -3.4391 -0.8460 -0.8460 -0.8423 -0.8423 1.1658 1.1658 1.1749 1.1749 1.9681 1.9681 1.9785 1.9785 2.6220 2.6220 2.6291 2.6291 3.9726 3.9726 3.9757 3.9757 4.5438 4.5438 4.5473 4.5473 5.1528 5.1528 5.1584 5.1584 5.7122 5.7122 5.7375 5.7375 8.8618 8.8618 8.8713 8.8713 9.3135 9.3135 9.3175 9.3175 10.0025 10.0025 10.0043 10.0043 k = 0.2419 0.4943 0.2664 ( 10032 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1019 -7.1019 -7.1013 -7.1013 -5.0548 -5.0548 -5.0527 -5.0527 -3.3830 -3.3830 -3.3825 -3.3825 -0.9231 -0.9231 -0.9196 -0.9196 1.1504 1.1504 1.1595 1.1595 2.0240 2.0240 2.0348 2.0348 2.5849 2.5849 2.5923 2.5923 3.9895 3.9895 3.9958 3.9958 4.5618 4.5618 4.5624 4.5624 5.2010 5.2010 5.2075 5.2075 5.7359 5.7359 5.7618 5.7618 8.9030 8.9030 8.9126 8.9126 9.3254 9.3254 9.3301 9.3301 9.9944 9.9944 9.9972 9.9972 k = 0.2581 0.4943 0.2664 ( 10032 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0832 -7.0832 -7.0825 -7.0825 -5.1020 -5.1020 -5.0998 -5.0998 -3.3258 -3.3258 -3.3252 -3.3252 -1.0009 -1.0009 -0.9976 -0.9976 1.1368 1.1368 1.1460 1.1460 2.0740 2.0740 2.0849 2.0849 2.5529 2.5529 2.5608 2.5608 3.9971 3.9971 4.0068 4.0068 4.5865 4.5865 4.5892 4.5892 5.2472 5.2472 5.2547 5.2547 5.7616 5.7616 5.7878 5.7878 8.9421 8.9421 8.9520 8.9520 9.3342 9.3342 9.3395 9.3395 9.9818 9.9818 9.9851 9.9851 k = 0.2742 0.4943 0.2664 ( 10050 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0639 -7.0639 -7.0633 -7.0633 -5.1482 -5.1482 -5.1460 -5.1460 -3.2679 -3.2679 -3.2671 -3.2671 -1.0791 -1.0791 -1.0759 -1.0759 1.1256 1.1256 1.1347 1.1347 2.1130 2.1130 2.1238 2.1238 2.5315 2.5315 2.5402 2.5402 3.9939 3.9939 4.0066 4.0066 4.6208 4.6208 4.6265 4.6265 5.2910 5.2910 5.2994 5.2994 5.7888 5.7888 5.8152 5.8152 8.9779 8.9779 8.9879 8.9879 9.3401 9.3401 9.3459 9.3459 9.9644 9.9644 9.9677 9.9677 k = 0.2903 0.4943 0.2664 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0443 -7.0443 -7.0436 -7.0436 -5.1931 -5.1931 -5.1910 -5.1910 -3.2095 -3.2095 -3.2085 -3.2085 -1.1573 -1.1573 -1.1543 -1.1543 1.1168 1.1168 1.1259 1.1259 2.1349 2.1349 2.1452 2.1452 2.5273 2.5273 2.5371 2.5371 3.9799 3.9799 3.9949 3.9949 4.6651 4.6651 4.6733 4.6733 5.3319 5.3319 5.3413 5.3413 5.8171 5.8171 5.8435 5.8435 9.0088 9.0088 9.0191 9.0191 9.3433 9.3433 9.3493 9.3493 9.9438 9.9438 9.9465 9.9465 k = 0.3065 0.4943 0.2664 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0246 -7.0246 -7.0238 -7.0238 -5.2366 -5.2366 -5.2345 -5.2345 -3.1505 -3.1505 -3.1494 -3.1494 -1.2354 -1.2354 -1.2325 -1.2325 1.1105 1.1105 1.1196 1.1196 2.1362 2.1362 2.1460 2.1460 2.5442 2.5442 2.5552 2.5552 3.9560 3.9560 3.9727 3.9727 4.7179 4.7179 4.7280 4.7280 5.3694 5.3694 5.3798 5.3798 5.8459 5.8459 5.8721 5.8721 9.0335 9.0335 9.0439 9.0439 9.3437 9.3437 9.3495 9.3495 9.9231 9.9231 9.9246 9.9246 k = 0.3226 0.4943 0.2664 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0049 -7.0049 -7.0041 -7.0041 -5.2784 -5.2784 -5.2762 -5.2762 -3.0911 -3.0911 -3.0898 -3.0898 -1.3129 -1.3129 -1.3103 -1.3103 1.1067 1.1067 1.1157 1.1157 2.1194 2.1194 2.1287 2.1287 2.5802 2.5802 2.5923 2.5923 3.9238 3.9238 3.9415 3.9415 4.7771 4.7771 4.7887 4.7887 5.4032 5.4032 5.4145 5.4145 5.8746 5.8746 5.9006 5.9006 9.0513 9.0513 9.0616 9.0616 9.3406 9.3406 9.3457 9.3457 9.9062 9.9062 9.9063 9.9063 k = 0.3387 0.4943 0.2664 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9854 -6.9854 -6.9846 -6.9846 -5.3182 -5.3182 -5.3160 -5.3160 -3.0315 -3.0315 -3.0300 -3.0300 -1.3897 -1.3897 -1.3873 -1.3873 1.1053 1.1053 1.1142 1.1142 2.0908 2.0908 2.0998 2.0998 2.6296 2.6296 2.6426 2.6426 3.8847 3.8847 3.9030 3.9030 4.8408 4.8408 4.8534 4.8534 5.4329 5.4329 5.4450 5.4450 5.9027 5.9027 5.9284 5.9284 9.0622 9.0622 9.0723 9.0723 9.3327 9.3327 9.3367 9.3367 9.8952 9.8952 9.8973 9.8973 k = 0.3548 0.4943 0.2664 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9665 -6.9665 -6.9656 -6.9656 -5.3556 -5.3556 -5.3534 -5.3534 -2.9719 -2.9719 -2.9702 -2.9702 -1.4652 -1.4652 -1.4631 -1.4631 1.1060 1.1060 1.1149 1.1149 2.0559 2.0559 2.0647 2.0647 2.6871 2.6871 2.7009 2.7009 3.8400 3.8400 3.8586 3.8586 4.9071 4.9071 4.9204 4.9204 5.4579 5.4579 5.4707 5.4707 5.9296 5.9296 5.9550 5.9550 9.0669 9.0669 9.0767 9.0767 9.3189 9.3189 9.3214 9.3214 9.8943 9.8943 9.8983 9.8983 k = 0.3710 0.4943 0.2664 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9483 -6.9483 -6.9475 -6.9475 -5.3904 -5.3904 -5.3882 -5.3882 -2.9126 -2.9126 -2.9107 -2.9107 -1.5392 -1.5392 -1.5373 -1.5373 1.1087 1.1087 1.1176 1.1176 2.0185 2.0185 2.0273 2.0273 2.7493 2.7493 2.7638 2.7638 3.7909 3.7909 3.8094 3.8094 4.9744 4.9744 4.9884 4.9884 5.4780 5.4780 5.4915 5.4915 5.9547 5.9547 5.9799 5.9799 9.0670 9.0670 9.0764 9.0764 9.2987 9.2987 9.2999 9.2999 9.9037 9.9037 9.9095 9.9095 k = 0.3871 0.4943 0.2664 ( 10074 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9313 -6.9313 -6.9304 -6.9304 -5.4223 -5.4223 -5.4201 -5.4201 -2.8541 -2.8541 -2.8519 -2.8519 -1.6109 -1.6109 -1.6093 -1.6093 1.1130 1.1130 1.1217 1.1217 1.9812 1.9812 1.9900 1.9900 2.8142 2.8142 2.8294 2.8294 3.7382 3.7382 3.7565 3.7565 5.0414 5.0414 5.0558 5.0558 5.4927 5.4927 5.5067 5.5067 5.9777 5.9777 6.0026 6.0026 9.0640 9.0640 9.0731 9.0731 9.2735 9.2735 9.2736 9.2736 9.9218 9.9218 9.9293 9.9293 k = 0.4032 0.4943 0.2664 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9156 -6.9156 -6.9147 -6.9147 -5.4508 -5.4508 -5.4487 -5.4487 -2.7970 -2.7970 -2.7946 -2.7946 -1.6796 -1.6796 -1.6783 -1.6783 1.1185 1.1185 1.1271 1.1271 1.9457 1.9457 1.9545 1.9545 2.8806 2.8806 2.8964 2.8964 3.6825 3.6825 3.7005 3.7005 5.1069 5.1069 5.1217 5.1217 5.5018 5.5018 5.5163 5.5163 5.9980 5.9980 6.0227 6.0227 9.0593 9.0593 9.0684 9.0684 9.2445 9.2445 9.2452 9.2452 9.9457 9.9457 9.9546 9.9546 k = 0.4194 0.4943 0.2664 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9016 -6.9016 -6.9007 -6.9007 -5.4758 -5.4758 -5.4736 -5.4736 -2.7423 -2.7423 -2.7396 -2.7396 -1.7444 -1.7444 -1.7433 -1.7433 1.1246 1.1246 1.1331 1.1331 1.9132 1.9132 1.9221 1.9221 2.9475 2.9475 2.9640 2.9640 3.6247 3.6247 3.6421 3.6421 5.1697 5.1697 5.1848 5.1848 5.5049 5.5049 5.5197 5.5197 6.0154 6.0154 6.0399 6.0399 9.0544 9.0544 9.0634 9.0634 9.2150 9.2150 9.2161 9.2161 9.9722 9.9722 9.9821 9.9821 k = 0.4355 0.4943 0.2664 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8897 -6.8897 -6.8888 -6.8888 -5.4967 -5.4967 -5.4945 -5.4945 -2.6914 -2.6914 -2.6884 -2.6884 -1.8035 -1.8035 -1.8028 -1.8028 1.1308 1.1308 1.1392 1.1392 1.8850 1.8850 1.8939 1.8939 3.0143 3.0143 3.0316 3.0316 3.5653 3.5653 3.5820 3.5820 5.2288 5.2288 5.2442 5.2442 5.5018 5.5018 5.5167 5.5167 6.0297 6.0297 6.0541 6.0541 9.0501 9.0501 9.0593 9.0593 9.1873 9.1873 9.1885 9.1885 9.9980 9.9980 10.0088 10.0088 k = 0.4516 0.4943 0.2664 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8801 -6.8801 -6.8791 -6.8791 -5.5134 -5.5134 -5.5112 -5.5112 -2.6465 -2.6465 -2.6432 -2.6432 -1.8550 -1.8550 -1.8546 -1.8546 1.1365 1.1365 1.1448 1.1448 1.8619 1.8619 1.8709 1.8709 3.0801 3.0801 3.0983 3.0983 3.5052 3.5052 3.5211 3.5211 5.2832 5.2832 5.2989 5.2989 5.4923 5.4923 5.5073 5.5073 6.0408 6.0408 6.0651 6.0651 9.0470 9.0470 9.0566 9.0566 9.1630 9.1630 9.1640 9.1640 10.0206 10.0206 10.0320 10.0320 k = 0.4677 0.4943 0.2664 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8730 -6.8730 -6.8720 -6.8720 -5.5255 -5.5255 -5.5233 -5.5233 -2.6103 -2.6103 -2.6067 -2.6067 -1.8958 -1.8958 -1.8957 -1.8957 1.1410 1.1410 1.1493 1.1493 1.8447 1.8447 1.8538 1.8538 3.1431 3.1431 3.1628 3.1628 3.4462 3.4462 3.4607 3.4607 5.3317 5.3317 5.3479 5.3479 5.4766 5.4766 5.4914 5.4914 6.0487 6.0487 6.0729 6.0729 9.0453 9.0453 9.0555 9.0555 9.1439 9.1439 9.1444 9.1444 10.0380 10.0380 10.0499 10.0499 k = 0.4839 0.4943 0.2664 ( 10050 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8687 -6.8687 -6.8677 -6.8677 -5.5328 -5.5328 -5.5307 -5.5307 -2.5865 -2.5865 -2.5827 -2.5827 -1.9226 -1.9226 -1.9225 -1.9225 1.1440 1.1440 1.1522 1.1522 1.8341 1.8341 1.8432 1.8432 3.1982 3.1982 3.2203 3.2203 3.3934 3.3934 3.4056 3.4056 5.3722 5.3722 5.3891 5.3891 5.4562 5.4562 5.4703 5.4703 6.0535 6.0535 6.0776 6.0776 9.0448 9.0448 9.0556 9.0556 9.1314 9.1314 9.1315 9.1315 10.0489 10.0489 10.0612 10.0612 k = 0.5000 0.4943 0.2664 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8672 -6.8672 -6.8663 -6.8663 -5.5353 -5.5353 -5.5331 -5.5331 -2.5781 -2.5781 -2.5742 -2.5742 -1.9320 -1.9320 -1.9318 -1.9318 1.1451 1.1451 1.1532 1.1532 1.8305 1.8305 1.8396 1.8396 3.2253 3.2253 3.2498 3.2498 3.3671 3.3671 3.3769 3.3769 5.3933 5.3933 5.4115 5.4115 5.4418 5.4418 5.4547 5.4547 6.0550 6.0550 6.0792 6.0792 9.0448 9.0448 9.0558 9.0558 9.1269 9.1269 9.1271 9.1271 10.0527 10.0527 10.0650 10.0650 k = 0.5000 0.4943 0.2664 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8672 -6.8672 -6.8663 -6.8663 -5.5353 -5.5353 -5.5331 -5.5331 -2.5781 -2.5781 -2.5742 -2.5742 -1.9320 -1.9320 -1.9318 -1.9318 1.1451 1.1451 1.1532 1.1532 1.8305 1.8305 1.8396 1.8396 3.2253 3.2253 3.2498 3.2498 3.3671 3.3671 3.3769 3.3769 5.3933 5.3933 5.4115 5.4115 5.4418 5.4418 5.4547 5.4547 6.0550 6.0550 6.0792 6.0792 9.0448 9.0448 9.0558 9.0558 9.1269 9.1269 9.1271 9.1271 10.0527 10.0527 10.0650 10.0650 k = 0.5000 0.5010 0.2539 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8674 -6.8674 -6.8665 -6.8665 -5.5348 -5.5348 -5.5327 -5.5327 -2.5814 -2.5814 -2.5775 -2.5775 -1.9279 -1.9279 -1.9276 -1.9276 1.1406 1.1406 1.1487 1.1487 1.8363 1.8363 1.8453 1.8453 3.2030 3.2030 3.2228 3.2228 3.3930 3.3930 3.3980 3.3980 5.3827 5.3827 5.3952 5.3952 5.4579 5.4579 5.4652 5.4652 6.0545 6.0545 6.0786 6.0786 9.0224 9.0224 9.0313 9.0313 9.1477 9.1477 9.1501 9.1501 10.0532 10.0532 10.0655 10.0655 k = 0.5000 0.5078 0.2414 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8681 -6.8681 -6.8672 -6.8672 -5.5335 -5.5335 -5.5313 -5.5313 -2.5910 -2.5910 -2.5872 -2.5872 -1.9157 -1.9157 -1.9153 -1.9153 1.1278 1.1278 1.1356 1.1356 1.8530 1.8530 1.8617 1.8617 3.1550 3.1550 3.1702 3.1702 3.4422 3.4422 3.4425 3.4425 5.3607 5.3607 5.3693 5.3693 5.4831 5.4831 5.4866 5.4866 6.0528 6.0528 6.0767 6.0767 8.9801 8.9801 8.9874 8.9874 9.1855 9.1855 9.1895 9.1895 10.0548 10.0548 10.0671 10.0671 k = 0.5000 0.5146 0.2288 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8693 -6.8693 -6.8683 -6.8683 -5.5312 -5.5312 -5.5290 -5.5290 -2.6062 -2.6062 -2.6025 -2.6025 -1.8962 -1.8962 -1.8957 -1.8957 1.1078 1.1078 1.1151 1.1151 1.8793 1.8793 1.8876 1.8876 3.0989 3.0989 3.1115 3.1115 3.4930 3.4930 3.4954 3.4954 5.3353 5.3353 5.3420 5.3420 5.5090 5.5090 5.5109 5.5109 6.0502 6.0502 6.0738 6.0738 8.9334 8.9334 8.9398 8.9398 9.2251 9.2251 9.2297 9.2297 10.0575 10.0575 10.0697 10.0697 k = 0.5000 0.5213 0.2163 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8709 -6.8709 -6.8700 -6.8700 -5.5280 -5.5280 -5.5258 -5.5258 -2.6259 -2.6259 -2.6223 -2.6223 -1.8705 -1.8705 -1.8699 -1.8699 1.0822 1.0822 1.0889 1.0889 1.9135 1.9135 1.9214 1.9214 3.0405 3.0405 3.0515 3.0515 3.5438 3.5438 3.5478 3.5478 5.3085 5.3085 5.3143 5.3143 5.5345 5.5345 5.5357 5.5357 6.0468 6.0468 6.0700 6.0700 8.8856 8.8856 8.8914 8.8914 9.2631 9.2631 9.2681 9.2681 10.0613 10.0613 10.0734 10.0734 k = 0.5000 0.5281 0.2037 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8729 -6.8729 -6.8720 -6.8720 -5.5239 -5.5239 -5.5218 -5.5218 -2.6491 -2.6491 -2.6457 -2.6457 -1.8397 -1.8397 -1.8390 -1.8390 1.0523 1.0523 1.0586 1.0586 1.9538 1.9538 1.9613 1.9613 2.9819 2.9819 2.9920 2.9920 3.5929 3.5929 3.5980 3.5980 5.2811 5.2811 5.2861 5.2861 5.5588 5.5588 5.5599 5.5599 6.0430 6.0430 6.0656 6.0656 8.8381 8.8381 8.8434 8.8434 9.2987 9.2987 9.3039 9.3039 10.0663 10.0663 10.0782 10.0782 k = 0.5000 0.5348 0.1912 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8754 -6.8754 -6.8745 -6.8745 -5.5191 -5.5191 -5.5170 -5.5170 -2.6747 -2.6747 -2.6715 -2.6715 -1.8049 -1.8049 -1.8041 -1.8041 1.0197 1.0197 1.0255 1.0255 1.9984 1.9984 2.0055 2.0055 2.9247 2.9247 2.9340 2.9340 3.6391 3.6391 3.6451 3.6451 5.2531 5.2531 5.2577 5.2577 5.5814 5.5814 5.5826 5.5826 6.0393 6.0393 6.0610 6.0610 8.7919 8.7919 8.7968 8.7968 9.3313 9.3313 9.3366 9.3366 10.0724 10.0724 10.0841 10.0841 k = 0.5000 0.5348 0.1912 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8754 -6.8754 -6.8745 -6.8745 -5.5191 -5.5191 -5.5170 -5.5170 -2.6747 -2.6747 -2.6715 -2.6715 -1.8049 -1.8049 -1.8041 -1.8041 1.0197 1.0197 1.0255 1.0255 1.9984 1.9984 2.0055 2.0055 2.9247 2.9247 2.9340 2.9340 3.6391 3.6391 3.6451 3.6451 5.2531 5.2531 5.2577 5.2577 5.5814 5.5814 5.5826 5.5826 6.0393 6.0393 6.0610 6.0610 8.7919 8.7919 8.7968 8.7968 9.3313 9.3313 9.3366 9.3366 10.0724 10.0724 10.0841 10.0841 k = 0.5000 0.5325 0.1755 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8778 -6.8778 -6.8770 -6.8770 -5.5103 -5.5103 -5.5083 -5.5083 -2.7114 -2.7114 -2.7084 -2.7084 -1.7643 -1.7643 -1.7634 -1.7634 0.9688 0.9688 0.9740 0.9740 2.0691 2.0691 2.0759 2.0759 2.8519 2.8519 2.8607 2.8607 3.6982 3.6982 3.7051 3.7051 5.2348 5.2348 5.2386 5.2386 5.6008 5.6008 5.6022 5.6022 6.0449 6.0449 6.0654 6.0654 8.7368 8.7368 8.7412 8.7412 9.3710 9.3710 9.3762 9.3762 10.0575 10.0575 10.0690 10.0690 k = 0.5000 0.5301 0.1598 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8808 -6.8808 -6.8799 -6.8799 -5.5002 -5.5002 -5.4982 -5.4982 -2.7500 -2.7500 -2.7471 -2.7471 -1.7213 -1.7213 -1.7203 -1.7203 0.9167 0.9167 0.9213 0.9213 2.1426 2.1426 2.1492 2.1492 2.7836 2.7836 2.7920 2.7920 3.7538 3.7538 3.7613 3.7613 5.2162 5.2162 5.2195 5.2195 5.6146 5.6146 5.6166 5.6166 6.0528 6.0528 6.0717 6.0717 8.6859 8.6859 8.6898 8.6898 9.4086 9.4086 9.4137 9.4137 10.0390 10.0390 10.0502 10.0502 k = 0.5000 0.5277 0.1441 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8840 -6.8840 -6.8832 -6.8832 -5.4888 -5.4888 -5.4869 -5.4869 -2.7893 -2.7893 -2.7866 -2.7866 -1.6769 -1.6769 -1.6758 -1.6758 0.8650 0.8650 0.8691 0.8691 2.2140 2.2140 2.2206 2.2206 2.7239 2.7239 2.7322 2.7322 3.8050 3.8050 3.8131 3.8131 5.1980 5.1980 5.2006 5.2006 5.6213 5.6213 5.6243 5.6243 6.0640 6.0640 6.0809 6.0809 8.6402 8.6402 8.6436 8.6436 9.4439 9.4439 9.4488 9.4488 10.0176 10.0176 10.0283 10.0283 k = 0.5000 0.5253 0.1285 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8876 -6.8876 -6.8869 -6.8869 -5.4764 -5.4764 -5.4746 -5.4746 -2.8287 -2.8287 -2.8261 -2.8261 -1.6320 -1.6320 -1.6309 -1.6309 0.8146 0.8146 0.8183 0.8183 2.2749 2.2749 2.2814 2.2814 2.6808 2.6808 2.6886 2.6886 3.8511 3.8511 3.8597 3.8597 5.1804 5.1804 5.1824 5.1824 5.6203 5.6203 5.6245 5.6245 6.0791 6.0791 6.0938 6.0938 8.6004 8.6004 8.6032 8.6032 9.4764 9.4764 9.4809 9.4809 9.9941 9.9941 10.0043 10.0043 k = 0.5000 0.5229 0.1128 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8914 -6.8914 -6.8907 -6.8907 -5.4633 -5.4633 -5.4616 -5.4616 -2.8675 -2.8675 -2.8651 -2.8651 -1.5873 -1.5873 -1.5862 -1.5862 0.7664 0.7664 0.7697 0.7697 2.3121 2.3121 2.3175 2.3175 2.6679 2.6679 2.6744 2.6744 3.8914 3.8914 3.9005 3.9005 5.1636 5.1636 5.1651 5.1651 5.6114 5.6114 5.6168 5.6168 6.0979 6.0979 6.1103 6.1103 8.5669 8.5669 8.5692 8.5692 9.5055 9.5055 9.5095 9.5095 9.9697 9.9697 9.9790 9.9790 k = 0.5000 0.5205 0.0971 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8952 -6.8952 -6.8946 -6.8946 -5.4497 -5.4497 -5.4481 -5.4481 -2.9051 -2.9051 -2.9029 -2.9029 -1.5435 -1.5435 -1.5423 -1.5423 0.7209 0.7209 0.7239 0.7239 2.3144 2.3144 2.3177 2.3177 2.6960 2.6960 2.7002 2.7002 3.9253 3.9253 3.9347 3.9347 5.1480 5.1480 5.1489 5.1489 5.5955 5.5955 5.6018 5.6018 6.1197 6.1197 6.1299 6.1299 8.5405 8.5405 8.5421 8.5421 9.5301 9.5301 9.5334 9.5334 9.9453 9.9453 9.9534 9.9534 k = 0.5000 0.5181 0.0815 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8991 -6.8991 -6.8985 -6.8985 -5.4360 -5.4360 -5.4344 -5.4344 -2.9411 -2.9411 -2.9391 -2.9391 -1.5011 -1.5011 -1.4999 -1.4999 0.6785 0.6785 0.6812 0.6812 2.2883 2.2883 2.2899 2.2899 2.7572 2.7572 2.7593 2.7593 3.9520 3.9520 3.9617 3.9617 5.1336 5.1336 5.1341 5.1341 5.5736 5.5736 5.5807 5.5807 6.1434 6.1434 6.1516 6.1516 8.5211 8.5211 8.5222 8.5222 9.5490 9.5490 9.5515 9.5515 9.9223 9.9223 9.9290 9.9290 k = 0.5000 0.5157 0.0658 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9028 -6.9028 -6.9023 -6.9023 -5.4223 -5.4223 -5.4209 -5.4209 -2.9751 -2.9751 -2.9733 -2.9733 -1.4607 -1.4607 -1.4596 -1.4596 0.6394 0.6394 0.6418 0.6418 2.2484 2.2484 2.2488 2.2488 2.8364 2.8364 2.8370 2.8370 3.9710 3.9710 3.9808 3.9808 5.1209 5.1209 5.1209 5.1209 5.5474 5.5474 5.5548 5.5548 6.1679 6.1679 6.1744 6.1744 8.5090 8.5090 8.5095 8.5095 9.5604 9.5604 9.5619 9.5619 9.9025 9.9025 9.9072 9.9072 k = 0.5000 0.5134 0.0501 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9064 -6.9064 -6.9060 -6.9060 -5.4090 -5.4090 -5.4078 -5.4078 -3.0066 -3.0066 -3.0050 -3.0050 -1.4228 -1.4228 -1.4217 -1.4217 0.6040 0.6040 0.6061 0.6061 2.2039 2.2039 2.2041 2.2041 2.9235 2.9235 2.9239 2.9239 3.9815 3.9815 3.9914 3.9914 5.1095 5.1095 5.1099 5.1099 5.5184 5.5184 5.5258 5.5258 6.1922 6.1922 6.1972 6.1972 8.5038 8.5038 8.5038 8.5038 9.5627 9.5627 9.5630 9.5630 9.8876 9.8876 9.8901 9.8901 k = 0.5000 0.5110 0.0344 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9098 -6.9098 -6.9094 -6.9094 -5.3965 -5.3965 -5.3953 -5.3953 -3.0354 -3.0354 -3.0339 -3.0339 -1.3879 -1.3879 -1.3869 -1.3869 0.5724 0.5724 0.5743 0.5743 2.1598 2.1598 2.1603 2.1603 3.0137 3.0137 3.0148 3.0148 3.9833 3.9833 3.9930 3.9930 5.1001 5.1001 5.1009 5.1009 5.4881 5.4881 5.4952 5.4952 6.2152 6.2152 6.2191 6.2191 8.5046 8.5046 8.5051 8.5051 9.5538 9.5538 9.5545 9.5545 9.8788 9.8788 9.8791 9.8791 k = 0.5000 0.5086 0.0188 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9129 -6.9129 -6.9125 -6.9125 -5.3848 -5.3848 -5.3838 -5.3838 -3.0610 -3.0610 -3.0597 -3.0597 -1.3564 -1.3564 -1.3555 -1.3555 0.5448 0.5448 0.5464 0.5464 2.1188 2.1188 2.1194 2.1194 3.1045 3.1045 3.1062 3.1062 3.9760 3.9760 3.9854 3.9854 5.0929 5.0929 5.0939 5.0939 5.4582 5.4582 5.4647 5.4647 6.2363 6.2363 6.2392 6.2392 8.5110 8.5110 8.5118 8.5118 9.5352 9.5352 9.5366 9.5366 9.8745 9.8745 9.8760 9.8760 k = 0.5000 0.5062 0.0031 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9155 -6.9155 -6.9152 -6.9152 -5.3745 -5.3745 -5.3736 -5.3736 -3.0832 -3.0832 -3.0821 -3.0821 -1.3289 -1.3289 -1.3281 -1.3281 0.5212 0.5212 0.5226 0.5226 2.0825 2.0825 2.0831 2.0831 3.1937 3.1937 3.1959 3.1959 3.9599 3.9599 3.9688 3.9688 5.0877 5.0877 5.0888 5.0888 5.4299 5.4299 5.4356 5.4356 6.2549 6.2549 6.2570 6.2570 8.5217 8.5217 8.5227 8.5227 9.5097 9.5097 9.5112 9.5112 9.8752 9.8752 9.8781 9.8781 k = 0.5000 0.5038-0.0126 ( 10050 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9178 -6.9178 -6.9176 -6.9176 -5.3656 -5.3656 -5.3649 -5.3649 -3.1018 -3.1018 -3.1009 -3.1009 -1.3057 -1.3057 -1.3051 -1.3051 0.5018 0.5018 0.5029 0.5029 2.0517 2.0517 2.0522 2.0522 3.2790 3.2790 3.2816 3.2816 3.9360 3.9360 3.9441 3.9441 5.0845 5.0845 5.0856 5.0856 5.4046 5.4046 5.4093 5.4093 6.2706 6.2706 6.2721 6.2721 8.5350 8.5350 8.5361 8.5361 9.4809 9.4809 9.4823 9.4823 9.8795 9.8795 9.8833 9.8833 k = 0.5000 0.5014-0.0283 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9196 -6.9196 -6.9194 -6.9194 -5.3584 -5.3584 -5.3579 -5.3579 -3.1164 -3.1164 -3.1158 -3.1158 -1.2872 -1.2872 -1.2867 -1.2867 0.4867 0.4867 0.4875 0.4875 2.0271 2.0271 2.0275 2.0275 3.3576 3.3576 3.3603 3.3603 3.9061 3.9061 3.9132 3.9132 5.0829 5.0829 5.0838 5.0838 5.3835 5.3835 5.3872 5.3872 6.2831 6.2831 6.2841 6.2841 8.5490 8.5490 8.5500 8.5500 9.4530 9.4530 9.4541 9.4541 9.8857 9.8857 9.8896 9.8896 k = 0.5000 0.4990-0.0439 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9209 -6.9209 -6.9208 -6.9208 -5.3531 -5.3531 -5.3528 -5.3528 -3.1270 -3.1270 -3.1265 -3.1265 -1.2738 -1.2738 -1.2734 -1.2734 0.4759 0.4759 0.4764 0.4764 2.0092 2.0092 2.0095 2.0095 3.4249 3.4249 3.4275 3.4275 3.8744 3.8744 3.8799 3.8799 5.0823 5.0823 5.0830 5.0830 5.3677 5.3677 5.3702 5.3702 6.2921 6.2921 6.2928 6.2928 8.5614 8.5614 8.5621 8.5621 9.4297 9.4297 9.4304 9.4304 9.8922 9.8922 9.8956 9.8956 k = 0.5000 0.4967-0.0596 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9217 -6.9217 -6.9216 -6.9216 -5.3499 -5.3499 -5.3497 -5.3497 -3.1333 -3.1333 -3.1331 -3.1331 -1.2656 -1.2656 -1.2654 -1.2654 0.4694 0.4694 0.4697 0.4697 1.9984 1.9984 1.9985 1.9985 3.4736 3.4736 3.4752 3.4752 3.8484 3.8484 3.8516 3.8516 5.0823 5.0823 5.0827 5.0827 5.3580 5.3580 5.3593 5.3593 6.2977 6.2977 6.2980 6.2980 8.5700 8.5700 8.5704 8.5704 9.4142 9.4142 9.4146 9.4146 9.8976 9.8976 9.8997 9.8997 k = 0.5000 0.4943-0.0753 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -6.9219 -6.9219 -6.9219 -6.9219 -5.3487 -5.3487 -5.3487 -5.3487 -3.1354 -3.1354 -3.1354 -3.1354 -1.2628 -1.2628 -1.2628 -1.2628 0.4674 0.4674 0.4674 0.4674 1.9948 1.9948 1.9948 1.9948 3.4926 3.4926 3.4926 3.4926 3.8388 3.8388 3.8388 3.8388 5.0825 5.0825 5.0825 5.0825 5.3552 5.3552 5.3552 5.3552 6.2996 6.2996 6.2996 6.2996 8.5732 8.5732 8.5732 8.5732 9.4089 9.4089 9.4089 9.4089 9.9005 9.9005 9.9005 9.9005 k = 0.5000 0.4943-0.0753 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -6.9219 -6.9219 -6.9219 -6.9219 -5.3487 -5.3487 -5.3487 -5.3487 -3.1354 -3.1354 -3.1354 -3.1354 -1.2628 -1.2628 -1.2628 -1.2628 0.4674 0.4674 0.4674 0.4674 1.9948 1.9948 1.9948 1.9948 3.4926 3.4926 3.4926 3.4926 3.8388 3.8388 3.8388 3.8388 5.0825 5.0825 5.0825 5.0825 5.3552 5.3552 5.3552 5.3552 6.2996 6.2996 6.2996 6.2996 8.5732 8.5732 8.5732 8.5732 9.4089 9.4089 9.4089 9.4089 9.9005 9.9005 9.9005 9.9005 k = 0.4839 0.4943-0.0753 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9669 -6.9669 -6.8763 -6.8763 -5.3949 -5.3949 -5.3016 -5.3016 -3.2126 -3.2126 -3.0569 -3.0569 -1.3378 -1.3378 -1.1867 -1.1867 0.4418 0.4418 0.4967 0.4967 1.9207 1.9207 2.0699 2.0699 3.4549 3.4549 3.5250 3.5250 3.8175 3.8175 3.8587 3.8587 5.0729 5.0729 5.0938 5.0938 5.3455 5.3455 5.3551 5.3551 6.2677 6.2677 6.3295 6.3295 8.5729 8.5729 8.5782 8.5782 9.3631 9.3631 9.4544 9.4544 9.8994 9.8994 9.9038 9.9038 k = 0.4677 0.4943-0.0753 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0111 -7.0111 -6.8300 -6.8300 -5.4401 -5.4401 -5.2535 -5.2535 -3.2886 -3.2886 -2.9772 -2.9772 -1.4119 -1.4119 -1.1098 -1.1098 0.4199 0.4199 0.5295 0.5295 1.8476 1.8476 2.1456 2.1456 3.4126 3.4126 3.5515 3.5515 3.7951 3.7951 3.8767 3.8767 5.0654 5.0654 5.1062 5.1062 5.3264 5.3264 5.3454 5.3454 6.2347 6.2347 6.3565 6.3565 8.5765 8.5765 8.5881 8.5881 9.3183 9.3183 9.4982 9.4982 9.8995 9.8995 9.9065 9.9065 k = 0.4516 0.4943-0.0753 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0544 -7.0544 -6.7833 -6.7833 -5.4842 -5.4842 -5.2046 -5.2046 -3.3631 -3.3631 -2.8964 -2.8964 -1.4849 -1.4849 -1.0320 -1.0320 0.4018 0.4018 0.5659 0.5659 1.7758 1.7758 2.2216 2.2216 3.3667 3.3667 3.5714 3.5714 3.7719 3.7719 3.8921 3.8921 5.0603 5.0603 5.1190 5.1190 5.2989 5.2989 5.3264 5.3264 6.2012 6.2012 6.3797 6.3797 8.5829 8.5829 8.6027 8.6027 9.2760 9.2760 9.5389 9.5389 9.8977 9.8977 9.9002 9.9002 k = 0.4355 0.4943-0.0753 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0968 -7.0968 -6.7361 -6.7361 -5.5272 -5.5272 -5.1549 -5.1549 -3.4363 -3.4363 -2.8145 -2.8145 -1.5568 -1.5568 -0.9534 -0.9534 0.3877 0.3877 0.6055 0.6055 1.7054 1.7054 2.2975 2.2975 3.3181 3.3181 3.5847 3.5847 3.7479 3.7479 3.9043 3.9043 5.0577 5.0577 5.1310 5.1310 5.2651 5.2651 5.2989 5.2989 6.1677 6.1677 6.3984 6.3984 8.5902 8.5902 8.6211 8.6211 9.2376 9.2376 9.5752 9.5752 9.8817 9.8817 9.8947 9.8947 k = 0.4194 0.4943-0.0753 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1382 -7.1382 -6.6885 -6.6885 -5.5691 -5.5691 -5.1045 -5.1045 -3.5080 -3.5080 -2.7316 -2.7316 -1.6277 -1.6277 -0.8742 -0.8742 0.3775 0.3775 0.6483 0.6483 1.6366 1.6366 2.3726 2.3726 3.2678 3.2678 3.5913 3.5913 3.7229 3.7229 3.9123 3.9123 5.0575 5.0575 5.1390 5.1390 5.2294 5.2294 5.2636 5.2636 6.1344 6.1344 6.4119 6.4119 8.5964 8.5964 8.6419 8.6419 9.2044 9.2044 9.6062 9.6062 9.8651 9.8651 9.8840 9.8840 k = 0.4032 0.4943-0.0753 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.1786 -7.1786 -6.6407 -6.6407 -5.6097 -5.6097 -5.0535 -5.0535 -3.5782 -3.5782 -2.6478 -2.6478 -1.6974 -1.6974 -0.7944 -0.7944 0.3714 0.3714 0.6941 0.6941 1.5696 1.5696 2.4459 2.4459 3.2173 3.2173 3.5918 3.5918 3.6963 3.6963 3.9153 3.9153 5.0592 5.0592 5.1328 5.1328 5.2032 5.2032 5.2223 5.2223 6.1014 6.1014 6.4200 6.4200 8.5992 8.5992 8.6635 8.6635 9.1785 9.1785 9.6311 9.6311 9.8559 9.8559 9.8671 9.8671 k = 0.3871 0.4943-0.0753 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2179 -7.2179 -6.5928 -6.5928 -5.6492 -5.6492 -5.0019 -5.0019 -3.6468 -3.6468 -2.5631 -2.5631 -1.7661 -1.7661 -0.7141 -0.7141 0.3693 0.3693 0.7426 0.7426 1.5046 1.5046 2.5158 2.5158 3.1684 3.1684 3.5872 3.5872 3.6675 3.6675 3.9122 3.9122 5.0615 5.0615 5.1024 5.1024 5.1732 5.1732 5.2019 5.2019 6.0686 6.0686 6.4225 6.4225 8.5971 8.5971 8.6833 8.6833 9.1617 9.1617 9.6491 9.6491 9.8447 9.8447 9.8600 9.8600 k = 0.3710 0.4943-0.0753 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2560 -7.2560 -6.5448 -6.5448 -5.6873 -5.6873 -4.9499 -4.9499 -3.7137 -3.7137 -2.4777 -2.4777 -1.8336 -1.8336 -0.6337 -0.6337 0.3713 0.3713 0.7935 0.7935 1.4421 1.4421 2.5795 2.5795 3.1241 3.1241 3.5783 3.5783 3.6358 3.6358 3.9022 3.9022 5.0560 5.0560 5.0646 5.0646 5.1266 5.1266 5.2089 5.2089 6.0361 6.0361 6.4195 6.4195 8.5891 8.5891 8.6987 8.6987 9.1562 9.1562 9.6602 9.6602 9.8194 9.8194 9.8797 9.8797 k = 0.3548 0.4943-0.0753 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2928 -7.2928 -6.4968 -6.4968 -5.7241 -5.7241 -4.8975 -4.8975 -3.7789 -3.7789 -2.3917 -2.3917 -1.9000 -1.9000 -0.5533 -0.5533 0.3775 0.3775 0.8460 0.8460 1.3827 1.3827 2.6320 2.6320 3.0891 3.0891 3.5662 3.5662 3.6006 3.6006 3.8845 3.8845 5.0173 5.0173 5.0346 5.0346 5.1004 5.1004 5.2187 5.2187 6.0037 6.0037 6.4113 6.4113 8.5752 8.5752 8.7077 8.7077 9.1635 9.1635 9.6660 9.6660 9.7921 9.7921 9.9153 9.9153 k = 0.3387 0.4943-0.0753 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3284 -7.3284 -6.4490 -6.4490 -5.7595 -5.7595 -4.8450 -4.8450 -3.8423 -3.8423 -2.3051 -2.3051 -1.9653 -1.9653 -0.4731 -0.4731 0.3879 0.3879 0.8992 0.8992 1.3276 1.3276 2.6661 2.6661 3.0702 3.0702 3.5485 3.5485 3.5649 3.5649 3.8589 3.8589 4.9776 4.9776 4.9794 4.9794 5.0994 5.0994 5.2284 5.2284 5.9716 5.9716 6.3981 6.3981 8.5565 8.5565 8.7092 8.7092 9.1836 9.1836 9.6684 9.6684 9.7640 9.7640 9.9640 9.9640 k = 0.3226 0.4943-0.0753 ( 10068 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3626 -7.3626 -6.4014 -6.4014 -5.7935 -5.7935 -4.7924 -4.7924 -3.9037 -3.9037 -2.2181 -2.2181 -2.0295 -2.0295 -0.3936 -0.3936 0.4024 0.4024 0.9507 0.9507 1.2792 1.2792 2.6749 2.6749 3.0737 3.0737 3.5108 3.5108 3.5437 3.5437 3.8262 3.8262 4.9120 4.9120 4.9454 4.9454 5.1042 5.1042 5.2372 5.2372 5.9397 5.9397 6.3805 6.3805 8.5348 8.5348 8.7037 8.7037 9.2151 9.2151 9.6687 9.6687 9.7365 9.7365 10.0151 10.0151 k = 0.3065 0.4943-0.0753 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3955 -7.3955 -6.3542 -6.3542 -5.8261 -5.8261 -4.7401 -4.7401 -3.9629 -3.9629 -2.1308 -2.1308 -2.0925 -2.0925 -0.3151 -0.3151 0.4210 0.4210 0.9946 0.9946 1.2435 1.2435 2.6585 2.6585 3.0977 3.0977 3.4621 3.4621 3.5286 3.5286 3.7882 3.7882 4.8408 4.8408 4.9184 4.9184 5.1093 5.1093 5.2445 5.2445 5.9082 5.9082 6.3590 6.3590 8.5123 8.5123 8.6924 8.6924 9.2555 9.2555 9.6673 9.6673 9.7106 9.7106 10.0156 10.0156 k = 0.2903 0.4943-0.0753 ( 10068 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4269 -7.4269 -6.3075 -6.3075 -5.8573 -5.8573 -4.6883 -4.6883 -4.0197 -4.0197 -2.1545 -2.1545 -2.0433 -2.0433 -0.2383 -0.2383 0.4438 0.4438 1.0193 1.0193 1.2325 1.2325 2.6239 2.6239 3.1323 3.1323 3.4082 3.4082 3.5146 3.5146 3.7488 3.7488 4.7659 4.7659 4.8979 4.8979 5.1131 5.1131 5.2501 5.2501 5.8772 5.8772 6.3341 6.3341 8.4910 8.4910 8.6768 8.6768 9.3014 9.3014 9.6638 9.6638 9.6879 9.6879 10.0124 10.0124 k = 0.2742 0.4943-0.0753 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4568 -7.4568 -6.2614 -6.2614 -5.8869 -5.8869 -4.6377 -4.6377 -4.0735 -4.0735 -2.2153 -2.2153 -1.9559 -1.9559 -0.1639 -0.1639 0.4708 0.4708 1.0154 1.0154 1.2561 1.2561 2.5785 2.5785 3.1650 3.1650 3.3500 3.3500 3.5015 3.5015 3.7142 3.7142 4.6880 4.6880 4.8835 4.8835 5.1148 5.1148 5.2538 5.2538 5.8469 5.8469 6.3063 6.3063 8.4728 8.4728 8.6579 8.6579 9.3496 9.3496 9.6581 9.6581 9.6706 9.6706 10.0056 10.0056 k = 0.2581 0.4943-0.0753 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4852 -7.4852 -6.2160 -6.2160 -5.9150 -5.9150 -4.5892 -4.5892 -4.1235 -4.1235 -2.2750 -2.2750 -1.8687 -1.8687 -0.0931 -0.0931 0.5018 0.5018 0.9925 0.9925 1.3052 1.3052 2.5271 2.5271 3.1833 3.1833 3.2880 3.2880 3.4893 3.4893 3.6934 3.6934 4.6074 4.6074 4.8744 4.8744 5.1138 5.1138 5.2555 5.2555 5.8173 5.8173 6.2764 6.2764 8.4592 8.4592 8.6364 8.6364 9.3955 9.3955 9.6497 9.6497 9.6619 9.6619 9.9949 9.9949 k = 0.2419 0.4943-0.0753 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5121 -7.5121 -6.1715 -6.1715 -5.9415 -5.9415 -4.5442 -4.5442 -4.1681 -4.1681 -2.3334 -2.3334 -1.7818 -1.7818 -0.0271 -0.0271 0.5369 0.5369 0.9642 0.9642 1.3672 1.3672 2.4726 2.4726 3.1773 3.1773 3.2229 3.2229 3.4782 3.4782 3.6950 3.6950 4.5246 4.5246 4.8698 4.8698 5.1099 5.1099 5.2553 5.2553 5.7888 5.7888 6.2450 6.2450 8.4511 8.4511 8.6126 8.6126 9.4336 9.4336 9.6386 9.6386 9.6663 9.6663 9.9803 9.9803 k = 0.2258 0.4943-0.0753 ( 10050 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5374 -7.5374 -6.1279 -6.1279 -5.9664 -5.9664 -4.5060 -4.5060 -4.2044 -4.2044 -2.3906 -2.3906 -1.6955 -1.6955 0.0322 0.0322 0.5759 0.5759 0.9384 0.9384 1.4357 1.4357 2.4165 2.4165 3.1436 3.1436 3.1564 3.1564 3.4684 3.4684 3.7212 3.7212 4.4398 4.4398 4.8685 4.8685 5.1029 5.1029 5.2531 5.2531 5.7612 5.7612 6.2125 6.2125 8.4493 8.4493 8.5865 8.5865 9.4593 9.4593 9.6243 9.6243 9.6882 9.6882 9.9620 9.9620 k = 0.2097 0.4943-0.0753 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5611 -7.5611 -6.0855 -6.0855 -5.9898 -5.9898 -4.4800 -4.4800 -4.2270 -4.2270 -2.4465 -2.4465 -1.6101 -1.6101 0.0826 0.0826 0.6188 0.6188 0.9195 0.9195 1.5077 1.5077 2.3597 2.3597 3.0827 3.0827 3.0942 3.0942 3.4598 3.4598 3.7667 3.7667 4.3532 4.3532 4.8697 4.8697 5.0931 5.0931 5.2490 5.2490 5.7348 5.7348 6.1798 6.1798 8.4539 8.4539 8.5584 8.5584 9.4730 9.4730 9.6070 9.6070 9.7262 9.7262 9.9409 9.9409 k = 0.1935 0.4943-0.0753 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5831 -7.5831 -6.0445 -6.0445 -6.0115 -6.0115 -4.4723 -4.4723 -4.2298 -4.2298 -2.5009 -2.5009 -1.5258 -1.5258 0.1218 0.1218 0.6654 0.6654 0.9107 0.9107 1.5818 1.5818 2.3025 2.3025 3.0124 3.0124 3.0268 3.0268 3.4525 3.4525 3.8245 3.8245 4.2652 4.2652 4.8727 4.8727 5.0806 5.0806 5.2433 5.2433 5.7095 5.7095 6.1473 6.1473 8.4648 8.4648 8.5285 8.5285 9.4796 9.4796 9.5871 9.5871 9.7743 9.7743 9.9179 9.9179 k = 0.1774 0.4943-0.0753 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6035 -7.6035 -6.0315 -6.0315 -6.0049 -6.0049 -4.4837 -4.4837 -4.2122 -4.2122 -2.5537 -2.5537 -1.4429 -1.4429 0.1477 0.1477 0.7156 0.7156 0.9144 0.9144 1.6567 1.6567 2.2452 2.2452 2.9410 2.9410 2.9532 2.9532 3.4465 3.4465 3.8891 3.8891 4.1761 4.1761 4.8767 4.8767 5.0658 5.0658 5.2361 5.2361 5.6853 5.6853 6.1155 6.1155 8.4800 8.4800 8.4986 8.4986 9.4838 9.4838 9.5650 9.5650 9.8260 9.8260 9.8947 9.8947 k = 0.1613 0.4943-0.0753 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6222 -7.6222 -6.0499 -6.0499 -5.9671 -5.9671 -4.5075 -4.5075 -4.1812 -4.1812 -2.6048 -2.6048 -1.3619 -1.3619 0.1594 0.1594 0.7693 0.7693 0.9316 0.9316 1.7313 1.7313 2.1877 2.1877 2.8698 2.8698 2.8776 2.8776 3.4417 3.4417 3.9569 3.9569 4.0863 4.0863 4.8811 4.8811 5.0493 5.0493 5.2278 5.2278 5.6623 5.6623 6.0851 6.0851 8.4617 8.4617 8.5063 8.5063 9.4882 9.4882 9.5415 9.5415 9.8643 9.8643 9.8846 9.8846 k = 0.1452 0.4943-0.0753 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6391 -7.6391 -6.0665 -6.0665 -5.9314 -5.9314 -4.5367 -4.5367 -4.1436 -4.1436 -2.6538 -2.6538 -1.2831 -1.2831 0.1577 0.1577 0.8261 0.8261 0.9615 0.9615 1.8041 1.8041 2.1297 2.1297 2.7975 2.7975 2.8058 2.8058 3.4379 3.4379 3.9961 3.9961 4.0256 4.0256 4.8854 4.8854 5.0316 5.0316 5.2185 5.2185 5.6405 5.6405 6.0564 6.0564 8.4283 8.4283 8.5328 8.5328 9.4935 9.4935 9.5175 9.5175 9.8483 9.8483 9.9038 9.9038 k = 0.1290 0.4943-0.0753 ( 10048 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6544 -7.6544 -6.0815 -6.0815 -5.8978 -5.8978 -4.5675 -4.5675 -4.1037 -4.1037 -2.7004 -2.7004 -1.2072 -1.2072 0.1447 0.1447 0.8859 0.8859 1.0017 1.0017 1.8734 1.8734 2.0709 2.0709 2.7252 2.7252 2.7412 2.7412 3.4352 3.4352 3.9068 3.9068 4.0930 4.0930 4.8891 4.8891 5.0133 5.0133 5.2088 5.2088 5.6199 5.6199 6.0298 6.0298 8.3947 8.3947 8.5632 8.5632 9.4915 9.4915 9.5021 9.5021 9.8314 9.8314 9.8928 9.8928 k = 0.1129 0.4943-0.0753 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6678 -7.6678 -6.0947 -6.0947 -5.8669 -5.8669 -4.5975 -4.5975 -4.0639 -4.0639 -2.7441 -2.7441 -1.1348 -1.1348 0.1232 0.1232 0.9483 0.9483 1.0494 1.0494 1.9363 1.9363 2.0111 2.0111 2.6571 2.6571 2.6844 2.6844 3.4333 3.4333 3.8188 3.8188 4.1579 4.1579 4.8920 4.8920 4.9952 4.9952 5.1988 5.1988 5.6007 5.6007 6.0056 6.0056 8.3619 8.3619 8.5958 8.5958 9.4693 9.4693 9.5084 9.5084 9.8191 9.8191 9.8844 9.8844 k = 0.0968 0.4943-0.0753 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6795 -7.6795 -6.1062 -6.1062 -5.8389 -5.8389 -4.6256 -4.6256 -4.0259 -4.0259 -2.7845 -2.7845 -1.0669 -1.0669 0.0962 0.0962 1.0128 1.0128 1.1014 1.1014 1.9496 1.9496 1.9896 1.9896 2.5954 2.5954 2.6384 2.6384 3.4320 3.4320 3.7332 3.7332 4.2190 4.2190 4.8937 4.8937 4.9779 4.9779 5.1891 5.1891 5.5830 5.5830 5.9842 5.9842 8.3311 8.3311 8.6291 8.6291 9.4475 9.4475 9.5152 9.5152 9.8123 9.8123 9.8790 9.8790 k = 0.0806 0.4943-0.0753 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6895 -7.6895 -6.1160 -6.1160 -5.8143 -5.8143 -4.6507 -4.6507 -3.9910 -3.9910 -2.8208 -2.8208 -1.0045 -1.0045 0.0664 0.0664 1.0786 1.0786 1.1545 1.1545 1.8870 1.8870 2.0287 2.0287 2.5416 2.5416 2.6073 2.6073 3.4313 3.4313 3.6519 3.6519 4.2749 4.2749 4.8941 4.8941 4.9620 4.9620 5.1800 5.1800 5.5672 5.5672 5.9658 5.9658 8.3031 8.3031 8.6617 8.6617 9.4278 9.4278 9.5210 9.5210 9.8116 9.8116 9.8763 9.8763 k = 0.0645 0.4943-0.0753 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6976 -7.6976 -6.1240 -6.1240 -5.7934 -5.7934 -4.6722 -4.6722 -3.9603 -3.9603 -2.8523 -2.8523 -0.9492 -0.9492 0.0364 0.0364 1.1447 1.1447 1.2056 1.2056 1.8236 1.8236 2.0510 2.0510 2.4968 2.4968 2.5936 2.5936 3.4307 3.4307 3.5770 3.5770 4.3241 4.3241 4.8932 4.8932 4.9482 4.9482 5.1719 5.1719 5.5535 5.5535 5.9504 5.9504 8.2788 8.2788 8.6916 8.6916 9.4105 9.4105 9.5252 9.5252 9.8166 9.8166 9.8761 9.8761 k = 0.0484 0.4943-0.0753 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7040 -7.7040 -6.1302 -6.1302 -5.7766 -5.7766 -4.6896 -4.6896 -3.9349 -3.9349 -2.8781 -2.8781 -0.9027 -0.9027 0.0090 0.0090 1.2092 1.2092 1.2514 1.2514 1.7612 1.7612 2.0572 2.0572 2.4616 2.4616 2.5960 2.5960 3.4299 3.4299 3.5120 3.5120 4.3651 4.3651 4.8914 4.8914 4.9368 4.9368 5.1652 5.1652 5.5424 5.5424 5.9384 5.9384 8.2591 8.2591 8.7174 8.7174 9.3964 9.3964 9.5279 9.5279 9.8259 9.8259 9.8775 9.8775 k = 0.0323 0.4943-0.0753 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7085 -7.7085 -6.1346 -6.1346 -5.7643 -5.7643 -4.7024 -4.7024 -3.9159 -3.9159 -2.8973 -2.8973 -0.8671 -0.8671 -0.0132 -0.0132 1.2683 1.2683 1.2882 1.2882 1.7035 1.7035 2.0532 2.0532 2.4363 2.4363 2.6077 2.6077 3.4270 3.4270 3.4626 3.4626 4.3961 4.3961 4.8892 4.8892 4.9284 4.9284 5.1602 5.1602 5.5341 5.5341 5.9297 5.9297 8.2445 8.2445 8.7372 8.7372 9.3858 9.3858 9.5293 9.5293 9.8371 9.8371 9.8797 9.8797 k = 0.0161 0.4943-0.0753 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7112 -7.7112 -6.1373 -6.1373 -5.7567 -5.7567 -4.7103 -4.7103 -3.9041 -3.9041 -2.9092 -2.9092 -0.8447 -0.8447 -0.0278 -0.0278 1.3119 1.3119 1.3146 1.3146 1.6585 1.6585 2.0467 2.0467 2.4211 2.4211 2.6199 2.6199 3.4146 3.4146 3.4407 3.4407 4.4155 4.4155 4.8874 4.8874 4.9232 4.9232 5.1571 5.1571 5.5290 5.5290 5.9245 5.9245 8.2355 8.2355 8.7497 8.7497 9.3792 9.3792 9.5299 9.5299 9.8466 9.8466 9.8816 9.8816 k = 0.0000 0.4943-0.0753 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7121 -7.7121 -6.1382 -6.1382 -5.7542 -5.7542 -4.7129 -4.7129 -3.9001 -3.9001 -2.9132 -2.9132 -0.8370 -0.8370 -0.0329 -0.0329 1.3207 1.3207 1.3327 1.3327 1.6403 1.6403 2.0437 2.0437 2.4160 2.4160 2.6249 2.6249 3.4055 3.4055 3.4378 3.4378 4.4221 4.4221 4.8867 4.8867 4.9215 4.9215 5.1561 5.1561 5.5272 5.5272 5.9227 5.9227 8.2325 8.2325 8.7540 8.7540 9.3769 9.3769 9.5300 9.5300 9.8505 9.8505 9.8824 9.8824 k = 0.0000 0.4943-0.0753 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7121 -7.7121 -6.1382 -6.1382 -5.7542 -5.7542 -4.7129 -4.7129 -3.9001 -3.9001 -2.9132 -2.9132 -0.8370 -0.8370 -0.0329 -0.0329 1.3207 1.3207 1.3327 1.3327 1.6403 1.6403 2.0437 2.0437 2.4160 2.4160 2.6249 2.6249 3.4055 3.4055 3.4378 3.4378 4.4221 4.4221 4.8867 4.8867 4.9215 4.9215 5.1561 5.1561 5.5272 5.5272 5.9227 5.9227 8.2325 8.2325 8.7540 8.7540 9.3769 9.3769 9.5300 9.5300 9.8505 9.8505 9.8824 9.8824 k = 0.0000 0.4967-0.0596 ( 10059 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7111 -7.7111 -6.1524 -6.1524 -5.7389 -5.7389 -4.7121 -4.7121 -3.9013 -3.9013 -2.9169 -2.9169 -0.8350 -0.8350 -0.0309 -0.0309 1.3116 1.3116 1.3339 1.3339 1.6475 1.6475 2.0419 2.0419 2.4163 2.4163 2.6251 2.6251 3.4073 3.4073 3.4399 3.4399 4.4223 4.4223 4.8871 4.8871 4.9148 4.9148 5.1555 5.1555 5.5303 5.5303 5.9203 5.9203 8.2309 8.2309 8.7548 8.7548 9.3770 9.3770 9.5420 9.5420 9.8362 9.8362 9.8528 9.8528 k = 0.0000 0.4990-0.0439 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7080 -7.7080 -6.1899 -6.1899 -5.6982 -5.6982 -4.7097 -4.7097 -3.9050 -3.9050 -2.9279 -2.9279 -0.8291 -0.8291 -0.0248 -0.0248 1.2865 1.2865 1.3377 1.3377 1.6667 1.6667 2.0362 2.0362 2.4171 2.4171 2.6258 2.6258 3.4127 3.4127 3.4461 3.4461 4.4229 4.4229 4.8878 4.8878 4.8957 4.8957 5.1541 5.1541 5.5385 5.5385 5.9131 5.9131 8.2265 8.2265 8.7569 8.7569 9.3788 9.3788 9.5755 9.5755 9.7960 9.7960 9.8003 9.8003 k = 0.0000 0.5014-0.0283 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.7028 -7.7028 -6.2411 -6.2411 -5.6415 -5.6415 -4.7057 -4.7057 -3.9111 -3.9111 -2.9460 -2.9460 -0.8195 -0.8195 -0.0147 -0.0147 1.2505 1.2505 1.3441 1.3441 1.6928 1.6928 2.0266 2.0266 2.4186 2.4186 2.6273 2.6273 3.4214 3.4214 3.4567 3.4567 4.4232 4.4232 4.8668 4.8668 4.8883 4.8883 5.1526 5.1526 5.5490 5.5490 5.9021 5.9021 8.2202 8.2202 8.7601 8.7601 9.3847 9.3847 9.6252 9.6252 9.7375 9.7375 9.7483 9.7483 k = 0.0000 0.5038-0.0126 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6956 -7.6956 -6.2993 -6.2993 -5.5757 -5.5757 -4.7002 -4.7002 -3.9195 -3.9195 -2.9710 -2.9710 -0.8062 -0.8062 -0.0009 -0.0009 1.2078 1.2078 1.3529 1.3529 1.7214 1.7214 2.0127 2.0127 2.4212 2.4212 2.6299 2.6299 3.4335 3.4335 3.4718 3.4718 4.4222 4.4222 4.8316 4.8316 4.8868 4.8868 5.1524 5.1524 5.5579 5.5579 5.8885 5.8885 8.2133 8.2133 8.7637 8.7637 9.3936 9.3936 9.6776 9.6776 9.6834 9.6834 9.6986 9.6986 k = 0.0000 0.5062 0.0031 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6863 -7.6863 -6.3609 -6.3609 -5.5044 -5.5044 -4.6931 -4.6931 -3.9301 -3.9301 -3.0026 -3.0026 -0.7894 -0.7894 0.0164 0.0164 1.1614 1.1614 1.3642 1.3642 1.7493 1.7493 1.9941 1.9941 2.4251 2.4251 2.6340 2.6340 3.4488 3.4488 3.4918 3.4918 4.4187 4.4187 4.7939 4.7939 4.8818 4.8818 5.1550 5.1550 5.5614 5.5614 5.8744 5.8744 8.2074 8.2074 8.7671 8.7671 9.3993 9.3993 9.6217 9.6217 9.6481 9.6481 9.7580 9.7580 k = 0.0000 0.5086 0.0188 ( 10058 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6750 -7.6750 -6.4240 -6.4240 -5.4296 -5.4296 -4.6845 -4.6845 -3.9428 -3.9428 -3.0404 -3.0404 -0.7695 -0.7695 0.0366 0.0366 1.1135 1.1135 1.3777 1.3777 1.7742 1.7742 1.9707 1.9707 2.4309 2.4309 2.6400 2.6400 3.4671 3.4671 3.5168 3.5168 4.4108 4.4108 4.7571 4.7571 4.8718 4.8718 5.1620 5.1620 5.5558 5.5558 5.8617 5.8617 8.2036 8.2036 8.7693 8.7693 9.3891 9.3891 9.5695 9.5695 9.6278 9.6278 9.8314 9.8314 k = 0.0000 0.5110 0.0344 ( 10060 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6616 -7.6616 -6.4874 -6.4874 -5.3524 -5.3524 -4.6744 -4.6744 -3.9573 -3.9573 -3.0839 -3.0839 -0.7467 -0.7467 0.0593 0.0593 1.0655 1.0655 1.3933 1.3933 1.7947 1.7947 1.9423 1.9423 2.4390 2.4390 2.6480 2.6480 3.4884 3.4884 3.5469 3.5469 4.3965 4.3965 4.7246 4.7246 4.8559 4.8559 5.1741 5.1741 5.5390 5.5390 5.8517 5.8517 8.2029 8.2029 8.7693 8.7693 9.3553 9.3553 9.5230 9.5230 9.6413 9.6413 9.9032 9.9032 k = 0.0000 0.5134 0.0501 ( 10066 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6462 -7.6462 -6.5506 -6.5506 -5.2736 -5.2736 -4.6628 -4.6628 -3.9735 -3.9735 -3.1327 -3.1327 -0.7211 -0.7211 0.0837 0.0837 1.0187 1.0187 1.4111 1.4111 1.8097 1.8097 1.9089 1.9089 2.4501 2.4501 2.6579 2.6579 3.5125 3.5125 3.5820 3.5820 4.3746 4.3746 4.6987 4.6987 4.8339 4.8339 5.1913 5.1913 5.5107 5.5107 5.8445 5.8445 8.2059 8.2059 8.7662 8.7662 9.3052 9.3052 9.4835 9.4835 9.6820 9.6820 9.9654 9.9654 k = 0.0000 0.5157 0.0658 ( 10065 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6287 -7.6287 -6.6130 -6.6130 -5.1936 -5.1936 -4.6498 -4.6498 -3.9910 -3.9910 -3.1863 -3.1863 -0.6931 -0.6931 0.1089 0.1089 0.9743 0.9743 1.4307 1.4307 1.8185 1.8185 1.8708 1.8708 2.4643 2.4643 2.6695 2.6695 3.5396 3.5396 3.6219 3.6219 4.3451 4.3451 4.6799 4.6799 4.8064 4.8064 5.2130 5.2130 5.4722 5.4722 5.8390 5.8390 8.2126 8.2126 8.7595 8.7595 9.2488 9.2488 9.4517 9.4517 9.7400 9.7400 10.0064 10.0064 k = 0.0000 0.5181 0.0815 ( 10065 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.6092 -7.6092 -6.6745 -6.6745 -5.1130 -5.1130 -4.6354 -4.6354 -4.0097 -4.0097 -3.2443 -3.2443 -0.6629 -0.6629 0.1336 0.1336 0.9337 0.9337 1.4520 1.4520 1.8201 1.8201 1.8292 1.8292 2.4817 2.4817 2.6823 2.6823 3.5695 3.5695 3.6663 3.6663 4.3097 4.3097 4.6670 4.6670 4.7746 4.7746 5.2382 5.2382 5.4255 5.4255 5.8340 5.8340 8.2230 8.2230 8.7490 8.7490 9.1914 9.1914 9.4278 9.4278 9.8097 9.8097 10.0167 10.0167 k = 0.0000 0.5205 0.0971 ( 10075 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5877 -7.5877 -6.7349 -6.7349 -5.0320 -5.0320 -4.6197 -4.6197 -4.0292 -4.0292 -3.3063 -3.3063 -0.6307 -0.6307 0.1564 0.1564 0.8986 0.8986 1.4749 1.4749 1.7808 1.7808 1.8182 1.8182 2.5024 2.5024 2.6955 2.6955 3.6021 3.6021 3.7148 3.7148 4.2706 4.2706 4.6582 4.6582 4.7392 4.7392 5.2658 5.2658 5.3727 5.3727 5.8281 5.8281 8.2364 8.2364 8.7352 8.7352 9.1357 9.1357 9.4113 9.4113 9.8880 9.8880 9.9986 9.9986 k = 0.0000 0.5229 0.1128 ( 10072 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5642 -7.5642 -6.7940 -6.7940 -4.9510 -4.9510 -4.6029 -4.6029 -4.0491 -4.0491 -3.3717 -3.3717 -0.5967 -0.5967 0.1753 0.1753 0.8706 0.8706 1.4992 1.4992 1.7307 1.7307 1.8089 1.8089 2.5259 2.5259 2.7085 2.7085 3.6374 3.6374 3.7669 3.7669 4.2301 4.2301 4.6514 4.6514 4.7016 4.7016 5.2932 5.2932 5.3174 5.3174 5.8209 5.8209 8.2520 8.2520 8.7187 8.7187 9.0828 9.0828 9.4015 9.4015 9.9631 9.9631 9.9730 9.9730 k = 0.0000 0.5253 0.1285 ( 10062 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5386 -7.5386 -6.8517 -6.8517 -4.8706 -4.8706 -4.5848 -4.5848 -4.0689 -4.0689 -3.4402 -3.4402 -0.5611 -0.5611 0.1883 0.1883 0.8518 0.8518 1.5243 1.5243 1.6779 1.6779 1.7947 1.7947 2.5518 2.5518 2.7202 2.7202 3.6752 3.6752 3.8220 3.8220 4.1902 4.1902 4.6446 4.6446 4.6630 4.6630 5.2531 5.2531 5.3274 5.3274 5.8121 5.8121 8.2689 8.2689 8.7009 8.7009 9.0333 9.0333 9.3969 9.3969 9.9214 9.9214 10.0619 10.0619 k = 0.0000 0.5277 0.1441 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.5111 -7.5111 -6.9079 -6.9079 -4.7914 -4.7914 -4.5658 -4.5658 -4.0880 -4.0880 -3.5113 -3.5113 -0.5239 -0.5239 0.1935 0.1935 0.8438 0.8438 1.5483 1.5483 1.6247 1.6247 1.7762 1.7762 2.5793 2.5793 2.7297 2.7297 3.7153 3.7153 3.8796 3.8796 4.1520 4.1520 4.6222 4.6222 4.6390 4.6390 5.1908 5.1908 5.3580 5.3580 5.8020 5.8020 8.2859 8.2859 8.6827 8.6827 8.9877 8.9877 9.3963 9.3963 9.8793 9.8793 10.1533 10.1533 k = 0.0000 0.5301 0.1598 ( 10063 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4817 -7.4817 -6.9626 -6.9626 -4.7141 -4.7141 -4.5460 -4.5460 -4.1055 -4.1055 -3.5846 -3.5846 -0.4854 -0.4854 0.1898 0.1898 0.8478 0.8478 1.5475 1.5475 1.5954 1.5954 1.7542 1.7542 2.6079 2.6079 2.7362 2.7362 3.7573 3.7573 3.9391 3.9391 4.1165 4.1165 4.5841 4.5841 4.6303 4.6303 5.1272 5.1272 5.3888 5.3888 5.7906 5.7906 8.3019 8.3019 8.6652 8.6652 8.9458 8.9458 9.3984 9.3984 9.8411 9.8411 10.2448 10.2448 k = 0.0000 0.5325 0.1755 ( 10070 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4502 -7.4502 -7.0156 -7.0156 -4.6403 -4.6403 -4.5255 -4.5255 -4.1198 -4.1198 -3.6597 -3.6597 -0.4457 -0.4457 0.1770 0.1770 0.8635 0.8635 1.4957 1.4957 1.6165 1.6165 1.7294 1.7294 2.6369 2.6369 2.7389 2.7389 3.8007 3.8007 3.9997 3.9997 4.0840 4.0840 4.5475 4.5475 4.6204 4.6204 5.0632 5.0632 5.4192 5.4192 5.7784 5.7784 8.3161 8.3161 8.6492 8.6492 8.9078 8.9078 9.4023 9.4023 9.8094 9.8094 10.3329 10.3329 k = 0.0000 0.5348 0.1912 ( 10076 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.4168 -7.4168 -7.0671 -7.0671 -4.5722 -4.5722 -4.5047 -4.5047 -4.1288 -4.1288 -3.7360 -3.7360 -0.4050 -0.4050 0.1559 0.1559 0.8900 0.8900 1.4359 1.4359 1.6453 1.6453 1.7026 1.7026 2.6656 2.6656 2.7373 2.7373 3.8450 3.8450 4.0537 4.0537 4.0616 4.0616 4.5143 4.5143 4.6091 4.6091 4.9997 4.9997 5.4490 5.4490 5.7656 5.7656 8.3276 8.3276 8.6351 8.6351 8.8735 8.8735 9.4072 9.4072 9.7856 9.7856 10.3406 10.3406 k = 0.5000 0.4537 0.3417 ( 10046 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8754 -6.8754 -6.8745 -6.8745 -5.5191 -5.5191 -5.5170 -5.5170 -2.6747 -2.6747 -2.6715 -2.6715 -1.8049 -1.8049 -1.8041 -1.8041 1.0197 1.0197 1.0255 1.0255 1.9984 1.9984 2.0055 2.0055 2.9247 2.9247 2.9340 2.9340 3.6391 3.6391 3.6451 3.6451 5.2531 5.2531 5.2577 5.2577 5.5814 5.5814 5.5826 5.5826 6.0393 6.0393 6.0610 6.0610 8.7919 8.7919 8.7968 8.7968 9.3313 9.3313 9.3366 9.3366 10.0724 10.0724 10.0841 10.0841 k = 0.5000 0.4380 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8773 -6.8773 -6.8764 -6.8764 -5.5214 -5.5214 -5.5193 -5.5193 -2.6706 -2.6706 -2.6673 -2.6673 -1.7944 -1.7944 -1.7937 -1.7937 1.0314 1.0314 1.0372 1.0372 1.9840 1.9840 1.9911 1.9911 2.9315 2.9315 2.9407 2.9407 3.6318 3.6318 3.6378 3.6378 5.2253 5.2253 5.2302 5.2302 5.5864 5.5864 5.5884 5.5884 6.0234 6.0234 6.0445 6.0445 8.7961 8.7961 8.8007 8.8007 9.3295 9.3295 9.3349 9.3349 10.1050 10.1050 10.1164 10.1164 k = 0.5000 0.4224 0.3417 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8800 -6.8800 -6.8791 -6.8791 -5.5240 -5.5240 -5.5219 -5.5219 -2.6646 -2.6646 -2.6613 -2.6613 -1.7823 -1.7823 -1.7815 -1.7815 1.0441 1.0441 1.0501 1.0501 1.9702 1.9702 1.9771 1.9771 2.9402 2.9402 2.9491 2.9491 3.6237 3.6237 3.6298 3.6298 5.1915 5.1915 5.1966 5.1966 5.5858 5.5858 5.5888 5.5888 6.0023 6.0023 6.0226 6.0226 8.8071 8.8071 8.8115 8.8115 9.3287 9.3287 9.3343 9.3343 10.1416 10.1416 10.1526 10.1526 k = 0.5000 0.4068 0.3417 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8833 -6.8833 -6.8824 -6.8824 -5.5269 -5.5269 -5.5248 -5.5248 -2.6566 -2.6566 -2.6533 -2.6533 -1.7686 -1.7686 -1.7678 -1.7678 1.0581 1.0581 1.0642 1.0642 1.9570 1.9570 1.9639 1.9639 2.9505 2.9505 2.9593 2.9593 3.6145 3.6145 3.6206 3.6206 5.1526 5.1526 5.1579 5.1579 5.5790 5.5790 5.5833 5.5833 5.9774 5.9774 5.9965 5.9965 8.8244 8.8244 8.8285 8.8285 9.3287 9.3287 9.3345 9.3345 10.1816 10.1816 10.1921 10.1921 k = 0.5000 0.3911 0.3417 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8874 -6.8874 -6.8864 -6.8864 -5.5302 -5.5302 -5.5281 -5.5281 -2.6468 -2.6468 -2.6434 -2.6434 -1.7535 -1.7535 -1.7527 -1.7527 1.0732 1.0732 1.0794 1.0794 1.9448 1.9448 1.9515 1.9515 2.9625 2.9625 2.9711 2.9711 3.6039 3.6039 3.6101 3.6101 5.1092 5.1092 5.1147 5.1147 5.5654 5.5654 5.5712 5.5712 5.9501 5.9501 5.9677 5.9677 8.8473 8.8473 8.8510 8.8510 9.3294 9.3294 9.3354 9.3354 10.2242 10.2242 10.2341 10.2341 k = 0.5000 0.3755 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8920 -6.8920 -6.8911 -6.8911 -5.5337 -5.5337 -5.5316 -5.5316 -2.6351 -2.6351 -2.6317 -2.6317 -1.7372 -1.7372 -1.7364 -1.7364 1.0896 1.0896 1.0959 1.0959 1.9336 1.9336 1.9402 1.9402 2.9757 2.9757 2.9841 2.9841 3.5917 3.5917 3.5979 3.5979 5.0621 5.0621 5.0677 5.0677 5.5446 5.5446 5.5520 5.5520 5.9220 5.9220 5.9380 5.9380 8.8746 8.8746 8.8780 8.8780 9.3304 9.3304 9.3366 9.3366 10.2682 10.2682 10.2772 10.2772 k = 0.5000 0.3598 0.3417 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.8971 -6.8971 -6.8962 -6.8962 -5.5375 -5.5375 -5.5354 -5.5354 -2.6216 -2.6216 -2.6181 -2.6181 -1.7199 -1.7199 -1.7191 -1.7191 1.1073 1.1073 1.1136 1.1136 1.9237 1.9237 1.9299 1.9299 2.9896 2.9896 2.9979 2.9979 3.5778 3.5778 3.5841 3.5841 5.0120 5.0120 5.0176 5.0176 5.5165 5.5165 5.5256 5.5256 5.8945 5.8945 5.9087 5.9087 8.9052 8.9052 8.9083 8.9083 9.3316 9.3316 9.3381 9.3381 10.3105 10.3105 10.3185 10.3185 k = 0.5000 0.3442 0.3417 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9028 -6.9028 -6.9019 -6.9019 -5.5416 -5.5416 -5.5395 -5.5395 -2.6063 -2.6063 -2.6029 -2.6029 -1.7017 -1.7017 -1.7010 -1.7010 1.1263 1.1263 1.1326 1.1326 1.9151 1.9151 1.9211 1.9211 3.0037 3.0037 3.0117 3.0117 3.5623 3.5623 3.5686 3.5686 4.9596 4.9596 4.9651 4.9651 5.4817 5.4817 5.4923 5.4923 5.8684 5.8684 5.8809 5.8809 8.9379 8.9379 8.9407 8.9407 9.3330 9.3330 9.3397 9.3397 10.3429 10.3429 10.3495 10.3495 k = 0.5000 0.3285 0.3417 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9088 -6.9088 -6.9079 -6.9079 -5.5459 -5.5459 -5.5438 -5.5438 -2.5895 -2.5895 -2.5860 -2.5860 -1.6830 -1.6830 -1.6823 -1.6823 1.1468 1.1468 1.1531 1.1531 1.9080 1.9080 1.9137 1.9137 3.0169 3.0169 3.0246 3.0246 3.5454 3.5454 3.5517 3.5517 4.9055 4.9055 4.9108 4.9108 5.4412 5.4412 5.4530 5.4530 5.8440 5.8440 5.8549 5.8549 8.9715 8.9715 8.9740 8.9740 9.3345 9.3345 9.3414 9.3414 10.3422 10.3422 10.3474 10.3474 k = 0.5000 0.3129 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9152 -6.9152 -6.9143 -6.9143 -5.5504 -5.5504 -5.5483 -5.5483 -2.5711 -2.5711 -2.5676 -2.5676 -1.6639 -1.6639 -1.6632 -1.6632 1.1688 1.1688 1.1751 1.1751 1.9026 1.9026 1.9080 1.9080 3.0279 3.0279 3.0354 3.0354 3.5276 3.5276 3.5341 3.5341 4.8504 4.8504 4.8553 4.8553 5.3966 5.3966 5.4093 5.4093 5.8211 5.8211 5.8307 5.8307 9.0046 9.0046 9.0069 9.0069 9.3359 9.3359 9.3431 9.3431 10.2965 10.2965 10.3017 10.3017 k = 0.5000 0.2972 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9219 -6.9219 -6.9210 -6.9210 -5.5551 -5.5551 -5.5530 -5.5530 -2.5515 -2.5515 -2.5478 -2.5478 -1.6446 -1.6446 -1.6440 -1.6440 1.1924 1.1924 1.1987 1.1987 1.8991 1.8991 1.9042 1.9042 3.0352 3.0352 3.0424 3.0424 3.5098 3.5098 3.5165 3.5165 4.7950 4.7950 4.7995 4.7995 5.3498 5.3498 5.3629 5.3629 5.7990 5.7990 5.8076 5.8076 9.0362 9.0362 9.0384 9.0384 9.3375 9.3375 9.3446 9.3446 10.2320 10.2320 10.2378 10.2378 k = 0.5000 0.2816 0.3417 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9287 -6.9287 -6.9278 -6.9278 -5.5599 -5.5599 -5.5578 -5.5578 -2.5306 -2.5306 -2.5269 -2.5269 -1.6253 -1.6253 -1.6247 -1.6247 1.2177 1.2177 1.2240 1.2240 1.8977 1.8977 1.9023 1.9023 3.0372 3.0372 3.0439 3.0439 3.4928 3.4928 3.4998 3.4998 4.7401 4.7401 4.7439 4.7439 5.3023 5.3023 5.3156 5.3156 5.7773 5.7773 5.7851 5.7851 9.0650 9.0650 9.0674 9.0674 9.3390 9.3390 9.3461 9.3461 10.1647 10.1647 10.1709 10.1709 k = 0.5000 0.2660 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9357 -6.9357 -6.9348 -6.9348 -5.5648 -5.5648 -5.5627 -5.5627 -2.5088 -2.5088 -2.5050 -2.5050 -1.6062 -1.6062 -1.6057 -1.6057 1.2448 1.2448 1.2511 1.2511 1.8985 1.8985 1.9027 1.9027 3.0321 3.0321 3.0384 3.0384 3.4775 3.4775 3.4847 3.4847 4.6865 4.6865 4.6896 4.6896 5.2558 5.2558 5.2688 5.2688 5.7552 5.7552 5.7624 5.7624 9.0901 9.0901 9.0928 9.0928 9.3406 9.3406 9.3473 9.3473 10.1001 10.1001 10.1068 10.1068 k = 0.5000 0.2503 0.3417 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9426 -6.9426 -6.9417 -6.9417 -5.5697 -5.5697 -5.5676 -5.5676 -2.4862 -2.4862 -2.4823 -2.4823 -1.5875 -1.5875 -1.5870 -1.5870 1.2738 1.2738 1.2799 1.2799 1.9016 1.9016 1.9054 1.9054 3.0187 3.0187 3.0246 3.0246 3.4640 3.4640 3.4716 3.4716 4.6355 4.6355 4.6377 4.6377 5.2114 5.2114 5.2240 5.2240 5.7323 5.7323 5.7391 5.7391 9.1104 9.1104 9.1137 9.1137 9.3423 9.3423 9.3483 9.3483 10.0412 10.0412 10.0482 10.0482 k = 0.5000 0.2347 0.3417 ( 10064 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9496 -6.9496 -6.9487 -6.9487 -5.5746 -5.5746 -5.5726 -5.5726 -2.4630 -2.4630 -2.4591 -2.4591 -1.5694 -1.5694 -1.5690 -1.5690 1.3045 1.3045 1.3106 1.3106 1.9072 1.9072 1.9106 1.9106 2.9968 2.9968 3.0021 3.0021 3.4518 3.4518 3.4597 3.4597 4.5882 4.5882 4.5896 4.5896 5.1700 5.1700 5.1820 5.1820 5.7081 5.7081 5.7147 5.7147 9.1247 9.1247 9.1290 9.1290 9.3447 9.3447 9.3494 9.3494 9.9895 9.9895 9.9968 9.9968 k = 0.5000 0.2190 0.3417 ( 10056 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6569 -35.6569 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9565 -6.9565 -6.9556 -6.9556 -5.5795 -5.5795 -5.5775 -5.5775 -2.4395 -2.4395 -2.4355 -2.4355 -1.5520 -1.5520 -1.5517 -1.5517 1.3371 1.3371 1.3431 1.3431 1.9154 1.9154 1.9182 1.9182 2.9668 2.9668 2.9716 2.9716 3.4392 3.4392 3.4474 3.4474 4.5466 4.5466 4.5470 4.5470 5.1322 5.1322 5.1434 5.1434 5.6823 5.6823 5.6888 5.6888 9.1320 9.1320 9.1374 9.1374 9.3484 9.3484 9.3516 9.3516 9.9461 9.9461 9.9536 9.9536 k = 0.5000 0.2034 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9631 -6.9631 -6.9623 -6.9623 -5.5843 -5.5843 -5.5823 -5.5823 -2.4160 -2.4160 -2.4119 -2.4119 -1.5355 -1.5355 -1.5352 -1.5352 1.3715 1.3715 1.3774 1.3774 1.9261 1.9261 1.9284 1.9284 2.9299 2.9299 2.9343 2.9343 3.4240 3.4240 3.4323 3.4323 4.5119 4.5119 4.5122 4.5122 5.0982 5.0982 5.1086 5.1086 5.6547 5.6547 5.6611 5.6611 9.1313 9.1313 9.1380 9.1380 9.3547 9.3547 9.3561 9.3561 9.9112 9.9112 9.9186 9.9186 k = 0.5000 0.1877 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9696 -6.9696 -6.9687 -6.9687 -5.5890 -5.5890 -5.5869 -5.5869 -2.3926 -2.3926 -2.3885 -2.3885 -1.5200 -1.5200 -1.5197 -1.5197 1.4076 1.4076 1.4134 1.4134 1.9392 1.9392 1.9410 1.9410 2.8880 2.8880 2.8919 2.8919 3.4037 3.4037 3.4120 3.4120 4.4858 4.4858 4.4868 4.4868 5.0680 5.0680 5.0775 5.0775 5.6251 5.6251 5.6315 5.6315 9.1227 9.1227 9.1304 9.1304 9.3641 9.3641 9.3642 9.3642 9.8842 9.8842 9.8914 9.8914 k = 0.5000 0.1721 0.3417 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9758 -6.9758 -6.9749 -6.9749 -5.5934 -5.5934 -5.5914 -5.5914 -2.3698 -2.3698 -2.3656 -2.3656 -1.5055 -1.5055 -1.5054 -1.5054 1.4453 1.4453 1.4510 1.4510 1.9546 1.9546 1.9558 1.9558 2.8429 2.8429 2.8463 2.8463 3.3765 3.3765 3.3846 3.3846 4.4701 4.4701 4.4715 4.4715 5.0415 5.0415 5.0501 5.0501 5.5934 5.5934 5.6000 5.6000 9.1072 9.1072 9.1153 9.1153 9.3760 9.3760 9.3774 9.3774 9.8638 9.8638 9.8709 9.8709 k = 0.5000 0.1564 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9816 -6.9816 -6.9807 -6.9807 -5.5977 -5.5977 -5.5957 -5.5957 -2.3477 -2.3477 -2.3434 -2.3434 -1.4922 -1.4922 -1.4922 -1.4922 1.4844 1.4844 1.4900 1.4900 1.9717 1.9717 1.9723 1.9723 2.7965 2.7965 2.7995 2.7995 3.3413 3.3413 3.3490 3.3490 4.4652 4.4652 4.4670 4.4670 5.0183 5.0183 5.0259 5.0259 5.5599 5.5599 5.5666 5.5666 9.0865 9.0865 9.0947 9.0947 9.3919 9.3919 9.3940 9.3940 9.8487 9.8487 9.8557 9.8557 k = 0.5000 0.1408 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9870 -6.9870 -6.9861 -6.9861 -5.6017 -5.6017 -5.5997 -5.5997 -2.3266 -2.3266 -2.3222 -2.3222 -1.4802 -1.4802 -1.4802 -1.4802 1.5250 1.5250 1.5305 1.5305 1.9897 1.9897 1.9897 1.9897 2.7510 2.7510 2.7535 2.7535 3.2979 3.2979 3.3052 3.3052 4.4709 4.4709 4.4728 4.4728 4.9982 4.9982 5.0048 5.0048 5.5245 5.5245 5.5316 5.5316 9.0625 9.0625 9.0706 9.0706 9.4111 9.4111 9.4137 9.4137 9.8371 9.8371 9.8440 9.8440 k = 0.5000 0.1252 0.3417 ( 10032 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9920 -6.9920 -6.9911 -6.9911 -5.6053 -5.6053 -5.6034 -5.6034 -2.3068 -2.3068 -2.3024 -2.3024 -1.4695 -1.4695 -1.4694 -1.4694 1.5667 1.5667 1.5721 1.5721 2.0067 2.0067 2.0074 2.0074 2.7086 2.7086 2.7106 2.7106 3.2472 3.2472 3.2538 3.2538 4.4859 4.4859 4.4879 4.4879 4.9807 4.9807 4.9862 4.9862 5.4878 5.4878 5.4952 5.4952 9.0373 9.0373 9.0450 9.0450 9.4331 9.4331 9.4360 9.4360 9.8275 9.8275 9.8345 9.8345 k = 0.5000 0.1095 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -6.9965 -6.9965 -6.9956 -6.9956 -5.6087 -5.6087 -5.6067 -5.6067 -2.2886 -2.2886 -2.2841 -2.2841 -1.4601 -1.4601 -1.4599 -1.4599 1.6094 1.6094 1.6148 1.6148 2.0216 2.0216 2.0229 2.0229 2.6719 2.6719 2.6735 2.6735 3.1902 3.1902 3.1963 3.1963 4.5087 4.5087 4.5107 4.5107 4.9654 4.9654 4.9698 4.9698 5.4502 5.4502 5.4582 5.4582 9.0123 9.0123 9.0197 9.0197 9.4573 9.4573 9.4602 9.4602 9.8185 9.8185 9.8257 9.8257 k = 0.5000 0.0939 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0005 -7.0005 -6.9996 -6.9996 -5.6116 -5.6116 -5.6097 -5.6097 -2.2723 -2.2723 -2.2677 -2.2677 -1.4519 -1.4519 -1.4517 -1.4517 1.6529 1.6529 1.6583 1.6583 2.0319 2.0319 2.0339 2.0339 2.6440 2.6440 2.6452 2.6452 3.1287 3.1287 3.1341 3.1341 4.5372 4.5372 4.5393 4.5393 4.9520 4.9520 4.9551 4.9551 5.4125 5.4125 5.4212 5.4212 8.9888 8.9888 8.9958 8.9958 9.4830 9.4830 9.4859 9.4859 9.8092 9.8092 9.8167 9.8167 k = 0.5000 0.0782 0.3417 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0039 -7.0039 -7.0030 -7.0030 -5.6142 -5.6142 -5.6122 -5.6122 -2.2580 -2.2580 -2.2533 -2.2533 -1.4451 -1.4451 -1.4448 -1.4448 1.6971 1.6971 1.7025 1.7025 2.0352 2.0352 2.0377 2.0377 2.6279 2.6279 2.6288 2.6288 3.0643 3.0643 3.0690 3.0690 4.5692 4.5692 4.5714 4.5714 4.9401 4.9401 4.9417 4.9417 5.3758 5.3758 5.3853 5.3853 8.9677 8.9677 8.9743 8.9743 9.5097 9.5097 9.5124 9.5124 9.7988 9.7988 9.8068 9.8068 k = 0.5000 0.0626 0.3417 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0067 -7.0067 -7.0058 -7.0058 -5.6163 -5.6163 -5.6143 -5.6143 -2.2460 -2.2460 -2.2413 -2.2413 -1.4395 -1.4395 -1.4392 -1.4392 1.7415 1.7415 1.7471 1.7471 2.0294 2.0294 2.0321 2.0321 2.6259 2.6259 2.6266 2.6266 2.9984 2.9984 3.0025 3.0025 4.6022 4.6022 4.6049 4.6049 4.9293 4.9293 4.9294 4.9294 5.3415 5.3415 5.3519 5.3519 8.9497 8.9497 8.9560 8.9560 9.5363 9.5363 9.5387 9.5387 9.7870 9.7870 9.7957 9.7957 k = 0.5000 0.0469 0.3417 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0089 -7.0089 -7.0081 -7.0081 -5.6180 -5.6180 -5.6160 -5.6160 -2.2364 -2.2364 -2.2317 -2.2317 -1.4352 -1.4352 -1.4349 -1.4349 1.7858 1.7858 1.7918 1.7918 2.0137 2.0137 2.0164 2.0164 2.6388 2.6388 2.6396 2.6396 2.9328 2.9328 2.9363 2.9363 4.6337 4.6337 4.6369 4.6369 4.9178 4.9178 4.9198 4.9198 5.3114 5.3114 5.3227 5.3227 8.9352 8.9352 8.9413 8.9413 9.5617 9.5617 9.5636 9.5636 9.7741 9.7741 9.7836 9.7836 k = 0.5000 0.0313 0.3417 ( 10026 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0105 -7.0105 -7.0097 -7.0097 -5.6192 -5.6192 -5.6172 -5.6172 -2.2295 -2.2295 -2.2247 -2.2247 -1.4322 -1.4322 -1.4318 -1.4318 1.8293 1.8293 1.8360 1.8360 1.9893 1.9893 1.9914 1.9914 2.6657 2.6657 2.6667 2.6667 2.8689 2.8689 2.8718 2.8718 4.6605 4.6605 4.6645 4.6645 4.9076 4.9076 4.9115 4.9115 5.2875 5.2875 5.2998 5.2998 8.9246 8.9246 8.9306 8.9306 9.5839 9.5839 9.5852 9.5852 9.7614 9.7614 9.7718 9.7718 k = 0.5000 0.0156 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3537 -35.3537 -7.0115 -7.0115 -7.0106 -7.0106 -5.6199 -5.6199 -5.6180 -5.6180 -2.2253 -2.2253 -2.2205 -2.2205 -1.4304 -1.4304 -1.4300 -1.4300 1.8702 1.8702 1.8790 1.8790 1.9592 1.9592 1.9593 1.9593 2.7045 2.7045 2.7059 2.7059 2.8084 2.8084 2.8107 2.8107 4.6789 4.6789 4.6836 4.6836 4.9000 4.9000 4.9056 4.9056 5.2720 5.2720 5.2850 5.2850 8.9182 8.9182 8.9241 8.9241 9.5999 9.5999 9.6006 9.6006 9.7512 9.7512 9.7625 9.7625 k = 0.5000-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3537 -35.3537 -7.0118 -7.0118 -7.0110 -7.0110 -5.6202 -5.6202 -5.6182 -5.6182 -2.2239 -2.2239 -2.2191 -2.2191 -1.4298 -1.4298 -1.4294 -1.4294 1.8959 1.8959 1.9136 1.9136 1.9281 1.9281 1.9369 1.9369 2.7506 2.7506 2.7518 2.7518 2.7552 2.7552 2.7576 2.7576 4.6855 4.6855 4.6905 4.6905 4.8972 4.8972 4.9034 4.9034 5.2667 5.2667 5.2799 5.2799 8.9161 8.9161 8.9219 8.9219 9.6060 9.6060 9.6063 9.6063 9.7471 9.7471 9.7588 9.7588 k = 0.5000-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3537 -35.3537 -7.0118 -7.0118 -7.0110 -7.0110 -5.6202 -5.6202 -5.6182 -5.6182 -2.2239 -2.2239 -2.2191 -2.2191 -1.4298 -1.4298 -1.4294 -1.4294 1.8959 1.8959 1.9136 1.9136 1.9281 1.9281 1.9369 1.9369 2.7506 2.7506 2.7518 2.7518 2.7552 2.7552 2.7576 2.7576 4.6855 4.6855 4.6905 4.6905 4.8972 4.8972 4.9034 4.9034 5.2667 5.2667 5.2799 5.2799 8.9161 8.9161 8.9219 8.9219 9.6060 9.6060 9.6063 9.6063 9.7471 9.7471 9.7588 9.7588 k = 0.5000-0.0000 0.3262 ( 10018 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.0122 -7.0122 -7.0113 -7.0113 -5.6192 -5.6192 -5.6172 -5.6172 -2.2285 -2.2285 -2.2237 -2.2237 -1.4254 -1.4254 -1.4251 -1.4251 1.8566 1.8566 1.8641 1.8641 1.9783 1.9783 1.9796 1.9796 2.7107 2.7107 2.7128 2.7128 2.7954 2.7954 2.7971 2.7971 4.6761 4.6761 4.6810 4.6810 4.9026 4.9026 4.9083 4.9083 5.2697 5.2697 5.2827 5.2827 8.9146 8.9146 8.9205 8.9205 9.5885 9.5885 9.5897 9.5897 9.7567 9.7567 9.7671 9.7671 k = 0.5000-0.0000 0.3107 ( 10032 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0132 -7.0132 -7.0123 -7.0123 -5.6162 -5.6162 -5.6142 -5.6142 -2.2419 -2.2419 -2.2373 -2.2373 -1.4127 -1.4127 -1.4124 -1.4124 1.8043 1.8043 1.8102 1.8102 2.0367 2.0367 2.0393 2.0393 2.6693 2.6693 2.6717 2.6717 2.8378 2.8378 2.8393 2.8393 4.6514 4.6514 4.6557 4.6557 4.9152 4.9152 4.9198 4.9198 5.2789 5.2789 5.2913 5.2913 8.9102 8.9102 8.9160 8.9160 9.5478 9.5478 9.5504 9.5504 9.7740 9.7740 9.7823 9.7823 k = 0.5000-0.0000 0.2951 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0149 -7.0149 -7.0140 -7.0140 -5.6113 -5.6113 -5.6093 -5.6093 -2.2631 -2.2631 -2.2587 -2.2587 -1.3926 -1.3926 -1.3925 -1.3925 1.7533 1.7533 1.7586 1.7586 2.0974 2.0974 2.1004 2.1004 2.6290 2.6290 2.6319 2.6319 2.8800 2.8800 2.8813 2.8813 4.6172 4.6172 4.6212 4.6212 4.9286 4.9286 4.9318 4.9318 5.2944 5.2944 5.3057 5.3057 8.9024 8.9024 8.9080 8.9080 9.4983 9.4983 9.5017 9.5017 9.7868 9.7868 9.7932 9.7932 k = 0.5000-0.0000 0.2796 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0172 -7.0172 -7.0163 -7.0163 -5.6045 -5.6045 -5.6026 -5.6026 -2.2909 -2.2909 -2.2867 -2.2867 -1.3665 -1.3665 -1.3664 -1.3664 1.7046 1.7046 1.7095 1.7095 2.1591 2.1591 2.1619 2.1619 2.5905 2.5905 2.5942 2.5942 2.9215 2.9215 2.9226 2.9226 4.5782 4.5782 4.5821 4.5821 4.9381 4.9381 4.9398 4.9398 5.3160 5.3160 5.3258 5.3258 8.8906 8.8906 8.8959 8.8959 9.4471 9.4471 9.4509 9.4509 9.7921 9.7921 9.7968 9.7968 k = 0.5000-0.0000 0.2641 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0200 -7.0200 -7.0192 -7.0192 -5.5961 -5.5961 -5.5942 -5.5942 -2.3238 -2.3238 -2.3198 -2.3198 -1.3359 -1.3359 -1.3357 -1.3357 1.6584 1.6584 1.6631 1.6631 2.2203 2.2203 2.2222 2.2222 2.5551 2.5551 2.5600 2.5600 2.9620 2.9620 2.9630 2.9630 4.5375 4.5375 4.5415 4.5415 4.9415 4.9415 4.9418 4.9418 5.3427 5.3427 5.3510 5.3510 8.8741 8.8741 8.8790 8.8790 9.3979 9.3979 9.4017 9.4017 9.7912 9.7912 9.7945 9.7945 k = 0.5000-0.0000 0.2485 ( 10032 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0233 -7.0233 -7.0226 -7.0226 -5.5860 -5.5860 -5.5843 -5.5843 -2.3603 -2.3603 -2.3565 -2.3565 -1.3021 -1.3021 -1.3017 -1.3017 1.6150 1.6150 1.6194 1.6194 2.2777 2.2777 2.2781 2.2781 2.5257 2.5257 2.5326 2.5326 3.0011 3.0011 3.0020 3.0020 4.4970 4.4970 4.5012 4.5012 4.9376 4.9376 4.9384 4.9384 5.3730 5.3730 5.3799 5.3799 8.8524 8.8524 8.8568 8.8568 9.3527 9.3527 9.3565 9.3565 9.7871 9.7871 9.7892 9.7892 k = 0.5000-0.0000 0.2330 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0270 -7.0270 -7.0263 -7.0263 -5.5747 -5.5747 -5.5729 -5.5729 -2.3993 -2.3993 -2.3958 -2.3958 -1.2662 -1.2662 -1.2657 -1.2657 1.5744 1.5744 1.5785 1.5785 2.3216 2.3216 2.3240 2.3240 2.5097 2.5097 2.5196 2.5196 3.0385 3.0385 3.0393 3.0393 4.4579 4.4579 4.4624 4.4624 4.9276 4.9276 4.9293 4.9293 5.4053 5.4053 5.4108 5.4108 8.8253 8.8253 8.8291 8.8291 9.3129 9.3129 9.3164 9.3164 9.7828 9.7828 9.7840 9.7840 k = 0.5000-0.0000 0.2175 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0311 -7.0311 -7.0304 -7.0304 -5.5622 -5.5622 -5.5605 -5.5605 -2.4397 -2.4397 -2.4365 -2.4365 -1.2292 -1.2292 -1.2286 -1.2286 1.5366 1.5366 1.5405 1.5405 2.3403 2.3403 2.3449 2.3449 2.5211 2.5211 2.5334 2.5334 3.0737 3.0737 3.0744 3.0744 4.4213 4.4213 4.4261 4.4261 4.9126 4.9126 4.9150 4.9150 5.4380 5.4380 5.4423 5.4423 8.7932 8.7932 8.7964 8.7964 9.2789 9.2789 9.2820 9.2820 9.7807 9.7807 9.7812 9.7812 k = 0.5000-0.0000 0.2019 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0353 -7.0353 -7.0347 -7.0347 -5.5487 -5.5487 -5.5471 -5.5471 -2.4807 -2.4807 -2.4777 -2.4777 -1.1920 -1.1920 -1.1912 -1.1912 1.5017 1.5017 1.5054 1.5054 2.3331 2.3331 2.3374 2.3374 2.5626 2.5626 2.5750 2.5750 3.1065 3.1065 3.1070 3.1070 4.3877 4.3877 4.3930 4.3930 4.8935 4.8935 4.8963 4.8963 5.4696 5.4696 5.4729 5.4729 8.7570 8.7570 8.7595 8.7595 9.2506 9.2506 9.2533 9.2533 9.7825 9.7825 9.7826 9.7826 k = 0.5000-0.0000 0.1864 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0397 -7.0397 -7.0391 -7.0391 -5.5346 -5.5346 -5.5331 -5.5331 -2.5215 -2.5215 -2.5187 -2.5187 -1.1552 -1.1552 -1.1544 -1.1544 1.4697 1.4697 1.4732 1.4732 2.3123 2.3123 2.3158 2.3158 2.6198 2.6198 2.6315 2.6315 3.1363 3.1363 3.1366 3.1366 4.3578 4.3578 4.3634 4.3634 4.8711 4.8711 4.8742 4.8742 5.4992 5.4992 5.5017 5.5017 8.7180 8.7180 8.7199 8.7199 9.2279 9.2279 9.2302 9.2302 9.7886 9.7886 9.7892 9.7892 k = 0.5000-0.0000 0.1709 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0442 -7.0442 -7.0436 -7.0436 -5.5202 -5.5202 -5.5188 -5.5188 -2.5613 -2.5613 -2.5588 -2.5588 -1.1194 -1.1194 -1.1186 -1.1186 1.4406 1.4406 1.4438 1.4438 2.2867 2.2867 2.2894 2.2894 2.6828 2.6828 2.6940 2.6940 3.1630 3.1630 3.1631 3.1631 4.3317 4.3317 4.3377 4.3377 4.8463 4.8463 4.8494 4.8494 5.5259 5.5259 5.5277 5.5277 8.6776 8.6776 8.6790 8.6790 9.2104 9.2104 9.2124 9.2124 9.7999 9.7999 9.8008 9.8008 k = 0.5000-0.0000 0.1553 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0485 -7.0485 -7.0480 -7.0480 -5.5056 -5.5056 -5.5043 -5.5043 -2.5997 -2.5997 -2.5974 -2.5974 -1.0853 -1.0853 -1.0844 -1.0844 1.4144 1.4144 1.4174 1.4174 2.2601 2.2601 2.2622 2.2622 2.7475 2.7475 2.7584 2.7584 3.1862 3.1862 3.1863 3.1863 4.3096 4.3096 4.3159 4.3159 4.8198 4.8198 4.8228 4.8228 5.5493 5.5493 5.5505 5.5505 8.6371 8.6371 8.6380 8.6380 9.1979 9.1979 9.1996 9.1996 9.8158 9.8158 9.8170 9.8170 k = 0.5000-0.0000 0.1398 ( 10042 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0528 -7.0528 -7.0523 -7.0523 -5.4912 -5.4912 -5.4900 -5.4900 -2.6361 -2.6361 -2.6340 -2.6340 -1.0531 -1.0531 -1.0522 -1.0522 1.3910 1.3910 1.3937 1.3937 2.2339 2.2339 2.2357 2.2357 2.8120 2.8120 2.8226 2.8226 3.2057 3.2057 3.2062 3.2062 4.2913 4.2913 4.2979 4.2979 4.7924 4.7924 4.7952 4.7952 5.5691 5.5691 5.5698 5.5698 8.5976 8.5976 8.5981 8.5981 9.1902 9.1902 9.1916 9.1916 9.8357 9.8357 9.8371 9.8371 k = 0.5000-0.0000 0.1243 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0568 -7.0568 -7.0564 -7.0564 -5.4774 -5.4774 -5.4763 -5.4763 -2.6700 -2.6700 -2.6681 -2.6681 -1.0233 -1.0233 -1.0225 -1.0225 1.3704 1.3704 1.3729 1.3729 2.2092 2.2092 2.2107 2.2107 2.8747 2.8747 2.8851 2.8851 3.2218 3.2218 3.2226 3.2226 4.2765 4.2765 4.2833 4.2833 4.7649 4.7649 4.7674 4.7674 5.5851 5.5851 5.5855 5.5855 8.5602 8.5602 8.5604 8.5604 9.1870 9.1870 9.1882 9.1882 9.8586 9.8586 9.8601 9.8601 k = 0.5000-0.0000 0.1087 ( 10052 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0605 -7.0605 -7.0601 -7.0601 -5.4643 -5.4643 -5.4633 -5.4633 -2.7010 -2.7010 -2.6993 -2.6993 -0.9962 -0.9962 -0.9954 -0.9954 1.3525 1.3525 1.3547 1.3547 2.1865 2.1865 2.1876 2.1876 2.9347 2.9347 2.9448 2.9448 3.2345 3.2345 3.2358 3.2358 4.2647 4.2647 4.2715 4.2715 4.7382 4.7382 4.7403 4.7403 5.5977 5.5977 5.5977 5.5977 8.5256 8.5256 8.5256 8.5256 9.1877 9.1877 9.1888 9.1888 9.8834 9.8834 9.8849 9.8849 k = 0.5000-0.0000 0.0932 ( 10054 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0638 -7.0638 -7.0635 -7.0635 -5.4522 -5.4522 -5.4514 -5.4514 -2.7287 -2.7287 -2.7273 -2.7273 -0.9721 -0.9721 -0.9714 -0.9714 1.3373 1.3373 1.3392 1.3392 2.1660 2.1660 2.1670 2.1670 2.9907 2.9907 3.0006 3.0006 3.2442 3.2442 3.2460 3.2460 4.2553 4.2553 4.2619 4.2619 4.7133 4.7133 4.7149 4.7149 5.6068 5.6068 5.6070 5.6070 8.4944 8.4944 8.4945 8.4945 9.1919 9.1919 9.1928 9.1928 9.9089 9.9089 9.9103 9.9103 k = 0.5000-0.0000 0.0777 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0668 -7.0668 -7.0665 -7.0665 -5.4415 -5.4415 -5.4408 -5.4408 -2.7527 -2.7527 -2.7515 -2.7515 -0.9513 -0.9513 -0.9507 -0.9507 1.3247 1.3247 1.3263 1.3263 2.1482 2.1482 2.1490 2.1490 3.0417 3.0417 3.0511 3.0511 3.2511 3.2511 3.2534 3.2534 4.2477 4.2477 4.2540 4.2540 4.6909 4.6909 4.6921 4.6921 5.6132 5.6132 5.6135 5.6135 8.4672 8.4672 8.4674 8.4674 9.1985 9.1985 9.1992 9.1992 9.9337 9.9337 9.9350 9.9350 k = 0.5000-0.0000 0.0621 ( 10044 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0692 -7.0692 -7.0690 -7.0690 -5.4324 -5.4324 -5.4318 -5.4318 -2.7728 -2.7728 -2.7719 -2.7719 -0.9339 -0.9339 -0.9334 -0.9334 1.3145 1.3145 1.3158 1.3158 2.1333 2.1333 2.1339 2.1339 3.0865 3.0865 3.0952 3.0952 3.2558 3.2558 3.2585 3.2585 4.2416 4.2416 4.2472 4.2472 4.6718 4.6718 4.6726 4.6726 5.6175 5.6175 5.6177 5.6177 8.4445 8.4445 8.4447 8.4447 9.2065 9.2065 9.2071 9.2071 9.9565 9.9565 9.9577 9.9577 k = 0.5000-0.0000 0.0466 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0712 -7.0712 -7.0710 -7.0710 -5.4250 -5.4250 -5.4246 -5.4246 -2.7887 -2.7887 -2.7880 -2.7880 -0.9202 -0.9202 -0.9198 -0.9198 1.3067 1.3067 1.3077 1.3077 2.1215 2.1215 2.1219 2.1219 3.1237 3.1237 3.1314 3.1314 3.2586 3.2586 3.2616 3.2616 4.2368 4.2368 4.2413 4.2413 4.6565 4.6565 4.6570 4.6570 5.6200 5.6200 5.6203 5.6203 8.4266 8.4266 8.4268 8.4268 9.2145 9.2145 9.2150 9.2150 9.9761 9.9761 9.9771 9.9771 k = 0.5000-0.0000 0.0311 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.0726 -7.0726 -7.0725 -7.0725 -5.4196 -5.4196 -5.4193 -5.4193 -2.8001 -2.8001 -2.7997 -2.7997 -0.9103 -0.9103 -0.9101 -0.9101 1.3013 1.3013 1.3019 1.3019 2.1129 2.1129 2.1132 2.1132 3.1524 3.1524 3.1584 3.1584 3.2601 3.2601 3.2629 3.2629 4.2333 4.2333 4.2365 4.2365 4.6455 4.6455 4.6458 4.6458 5.6215 5.6215 5.6217 5.6217 8.4137 8.4137 8.4138 8.4138 9.2215 9.2215 9.2218 9.2218 9.9912 9.9912 9.9919 9.9919 k = 0.5000-0.0000 0.0155 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.0735 -7.0735 -7.0734 -7.0734 -5.4163 -5.4163 -5.4161 -5.4161 -2.8070 -2.8070 -2.8068 -2.8068 -0.9043 -0.9043 -0.9042 -0.9042 1.2981 1.2981 1.2984 1.2984 2.1078 2.1078 2.1079 2.1079 3.1711 3.1711 3.1745 3.1745 3.2611 3.2611 3.2628 3.2628 4.2314 4.2314 4.2330 4.2330 4.6388 4.6388 4.6390 4.6390 5.6222 5.6222 5.6223 5.6223 8.4059 8.4059 8.4059 8.4059 9.2262 9.2262 9.2264 9.2264 10.0008 10.0008 10.0012 10.0012 k = 0.5000-0.0000-0.0000 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.0737 -7.0737 -7.0737 -7.0737 -5.4151 -5.4151 -5.4151 -5.4151 -2.8093 -2.8093 -2.8093 -2.8093 -0.9023 -0.9023 -0.9023 -0.9023 1.2971 1.2971 1.2971 1.2971 2.1061 2.1061 2.1061 2.1061 3.1788 3.1788 3.1788 3.1788 3.2620 3.2620 3.2620 3.2620 4.2313 4.2313 4.2313 4.2313 4.6367 4.6367 4.6367 4.6367 5.6224 5.6224 5.6224 5.6224 8.4033 8.4033 8.4033 8.4033 9.2279 9.2279 9.2279 9.2279 10.0042 10.0042 10.0042 10.0042 k = 0.0000 0.0000 0.3417 ( 10040 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4534 -7.4534 -7.4534 -7.4534 -4.2035 -4.2035 -4.2035 -4.2035 -3.7875 -3.7875 -3.7875 -3.7875 -0.3939 -0.3939 -0.3939 -0.3939 1.4537 1.4537 1.4537 1.4537 1.8801 1.8801 1.8801 1.8801 2.5364 2.5364 2.5364 2.5364 3.4927 3.4927 3.4927 3.4927 4.7341 4.7341 4.7341 4.7341 4.9892 4.9892 4.9892 4.9892 5.7915 5.7915 5.7915 5.7915 7.8182 7.8182 7.8182 7.8182 8.1921 8.1921 8.1921 8.1921 8.7287 8.7287 8.7287 8.7287 k = 0.0161-0.0000 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4526 -7.4526 -7.4526 -7.4526 -4.2148 -4.2148 -4.2142 -4.2142 -3.7769 -3.7769 -3.7764 -3.7764 -0.3962 -0.3962 -0.3958 -0.3958 1.4536 1.4536 1.4547 1.4547 1.8807 1.8807 1.8815 1.8815 2.5384 2.5384 2.5387 2.5387 3.4893 3.4893 3.4897 3.4897 4.7311 4.7311 4.7326 4.7326 4.9862 4.9862 4.9892 4.9892 5.7922 5.7922 5.7929 5.7929 7.8233 7.8233 7.8240 7.8240 8.1910 8.1910 8.1910 8.1910 8.7339 8.7339 8.7342 8.7342 k = 0.0323-0.0000 0.3417 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4502 -7.4502 -7.4501 -7.4501 -4.2451 -4.2451 -4.2441 -4.2441 -3.7473 -3.7473 -3.7465 -3.7465 -0.4028 -0.4028 -0.4019 -0.4019 1.4542 1.4542 1.4565 1.4565 1.8834 1.8834 1.8849 1.8849 2.5448 2.5448 2.5454 2.5454 3.4799 3.4799 3.4806 3.4806 4.7231 4.7231 4.7262 4.7262 4.9807 4.9807 4.9865 4.9865 5.7948 5.7948 5.7961 5.7961 7.8392 7.8392 7.8405 7.8405 8.1878 8.1878 8.1878 8.1878 8.7495 8.7495 8.7502 8.7502 k = 0.0484-0.0000 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4461 -7.4461 -7.4460 -7.4460 -4.2887 -4.2887 -4.2873 -4.2873 -3.7045 -3.7045 -3.7037 -3.7037 -0.4135 -0.4135 -0.4121 -0.4121 1.4558 1.4558 1.4591 1.4591 1.8878 1.8878 1.8901 1.8901 2.5554 2.5554 2.5564 2.5564 3.4649 3.4649 3.4659 3.4659 4.7092 4.7092 4.7136 4.7136 4.9739 4.9739 4.9823 4.9823 5.7994 5.7994 5.8012 5.8012 7.8655 7.8655 7.8673 7.8673 8.1832 8.1832 8.1834 8.1834 8.7750 8.7750 8.7759 8.7759 k = 0.0645-0.0000 0.3417 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4405 -7.4405 -7.4403 -7.4403 -4.3404 -4.3404 -4.3388 -4.3388 -3.6537 -3.6537 -3.6528 -3.6528 -0.4282 -0.4282 -0.4264 -0.4264 1.4583 1.4583 1.4626 1.4626 1.8937 1.8937 1.8969 1.8969 2.5703 2.5703 2.5714 2.5714 3.4452 3.4452 3.4464 3.4464 4.6881 4.6881 4.6937 4.6937 4.9672 4.9672 4.9777 4.9777 5.8058 5.8058 5.8079 5.8079 7.9014 7.9014 7.9037 7.9037 8.1783 8.1783 8.1785 8.1785 8.8095 8.8095 8.8106 8.8106 k = 0.0806-0.0000 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4333 -7.4333 -7.4331 -7.4331 -4.3971 -4.3971 -4.3954 -4.3954 -3.5979 -3.5979 -3.5970 -3.5970 -0.4467 -0.4467 -0.4446 -0.4446 1.4618 1.4618 1.4671 1.4671 1.9009 1.9009 1.9047 1.9047 2.5889 2.5889 2.5900 2.5900 3.4220 3.4220 3.4231 3.4231 4.6590 4.6590 4.6653 4.6653 4.9618 4.9618 4.9739 4.9739 5.8137 5.8137 5.8160 5.8160 7.9459 7.9459 7.9486 7.9486 8.1742 8.1742 8.1746 8.1746 8.8520 8.8520 8.8532 8.8532 k = 0.0968-0.0000 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4245 -7.4245 -7.4243 -7.4243 -4.4569 -4.4569 -4.4551 -4.4551 -3.5392 -3.5392 -3.5384 -3.5384 -0.4689 -0.4689 -0.4664 -0.4664 1.4664 1.4664 1.4725 1.4725 1.9088 1.9088 1.9134 1.9134 2.6108 2.6108 2.6116 2.6116 3.3966 3.3966 3.3975 3.3975 4.6218 4.6218 4.6284 4.6284 4.9581 4.9581 4.9711 4.9711 5.8228 5.8228 5.8250 5.8250 7.9976 7.9976 8.0006 8.0006 8.1725 8.1725 8.1731 8.1731 8.9014 8.9014 8.9027 8.9027 k = 0.1129-0.0000 0.3417 ( 10038 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4142 -7.4142 -7.4139 -7.4139 -4.5185 -4.5185 -4.5166 -4.5166 -3.4786 -3.4786 -3.4778 -3.4778 -0.4945 -0.4945 -0.4916 -0.4916 1.4721 1.4721 1.4791 1.4791 1.9175 1.9175 1.9227 1.9227 2.6349 2.6349 2.6352 2.6352 3.3709 3.3709 3.3713 3.3713 4.5770 4.5770 4.5837 4.5837 4.9560 4.9560 4.9694 4.9694 5.8325 5.8325 5.8344 5.8344 8.0539 8.0539 8.0571 8.0571 8.1759 8.1759 8.1765 8.1765 8.9568 8.9568 8.9580 8.9580 k = 0.1290-0.0000 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.4023 -7.4023 -7.4021 -7.4021 -4.5813 -4.5813 -4.5793 -4.5793 -3.4168 -3.4168 -3.4162 -3.4162 -0.5232 -0.5232 -0.5201 -0.5201 1.4789 1.4789 1.4866 1.4866 1.9266 1.9266 1.9324 1.9324 2.6593 2.6593 2.6598 2.6598 3.3463 3.3463 3.3467 3.3467 4.5258 4.5258 4.5322 4.5322 4.9548 4.9548 4.9683 4.9683 5.8422 5.8422 5.8437 5.8437 8.1083 8.1083 8.1109 8.1109 8.1913 8.1913 8.1913 8.1913 9.0171 9.0171 9.0183 9.0183 k = 0.1452-0.0000 0.3417 ( 10024 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.3891 -7.3891 -7.3888 -7.3888 -4.6447 -4.6447 -4.6427 -4.6427 -3.3543 -3.3543 -3.3537 -3.3537 -0.5549 -0.5549 -0.5515 -0.5515 1.4869 1.4869 1.4953 1.4953 1.9363 1.9363 1.9425 1.9425 2.6817 2.6817 2.6835 2.6835 3.3251 3.3251 3.3266 3.3266 4.4693 4.4693 4.4753 4.4753 4.9541 4.9541 4.9673 4.9673 5.8511 5.8511 5.8519 5.8519 8.1466 8.1466 8.1472 8.1472 8.2315 8.2315 8.2333 8.2333 9.0815 9.0815 9.0824 9.0824 k = 0.1613-0.0000 0.3417 ( 10026 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3538 -35.3538 -35.3538 -35.3538 -7.3745 -7.3745 -7.3741 -7.3741 -4.7082 -4.7082 -4.7062 -4.7062 -3.2912 -3.2912 -3.2909 -3.2909 -0.5893 -0.5893 -0.5857 -0.5857 1.4959 1.4959 1.5049 1.5049 1.9466 1.9466 1.9531 1.9531 2.6999 2.6999 2.7033 2.7033 3.3103 3.3103 3.3132 3.3132 4.4088 4.4088 4.4144 4.4144 4.9535 4.9535 4.9663 4.9663 5.8582 5.8582 5.8584 5.8584 8.1691 8.1691 8.1698 8.1698 8.2957 8.2957 8.2987 8.2987 9.1488 9.1488 9.1496 9.1496 k = 0.1774-0.0000 0.3417 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3585 -7.3585 -7.3581 -7.3581 -4.7717 -4.7717 -4.7697 -4.7697 -3.2280 -3.2280 -3.2278 -3.2278 -0.6261 -0.6261 -0.6225 -0.6225 1.5058 1.5058 1.5155 1.5155 1.9576 1.9576 1.9644 1.9644 2.7111 2.7111 2.7163 2.7163 3.3046 3.3046 3.3091 3.3091 4.3456 4.3456 4.3508 4.3508 4.9527 4.9527 4.9650 4.9650 5.8622 5.8622 5.8626 5.8626 8.1905 8.1905 8.1917 8.1917 8.3697 8.3697 8.3731 8.3731 9.2181 9.2181 9.2186 9.2186 k = 0.1935-0.0000 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3413 -7.3413 -7.3409 -7.3409 -4.8349 -4.8349 -4.8328 -4.8328 -3.1646 -3.1646 -3.1646 -3.1646 -0.6652 -0.6652 -0.6615 -0.6615 1.5166 1.5166 1.5269 1.5269 1.9697 1.9697 1.9766 1.9766 2.7129 2.7129 2.7201 2.7201 3.3102 3.3102 3.3162 3.3162 4.2810 4.2810 4.2858 4.2858 4.9518 4.9518 4.9637 4.9637 5.8625 5.8625 5.8636 5.8636 8.2162 8.2162 8.2177 8.2177 8.4476 8.4476 8.4511 8.4511 9.2882 9.2882 9.2885 9.2885 k = 0.2097-0.0000 0.3417 ( 10036 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.3230 -7.3230 -7.3225 -7.3225 -4.8975 -4.8975 -4.8954 -4.8954 -3.1014 -3.1014 -3.1013 -3.1013 -0.7064 -0.7064 -0.7026 -0.7026 1.5283 1.5283 1.5391 1.5391 1.9832 1.9832 1.9900 1.9900 2.7046 2.7046 2.7134 2.7134 3.3274 3.3274 3.3345 3.3345 4.2166 4.2166 4.2208 4.2208 4.9509 4.9509 4.9623 4.9623 5.8586 5.8586 5.8604 5.8604 8.2478 8.2478 8.2495 8.2495 8.5270 8.5270 8.5305 8.5305 9.3581 9.3581 9.3581 9.3581 k = 0.2258-0.0000 0.3417 ( 10024 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.3036 -7.3036 -7.3031 -7.3031 -4.9593 -4.9593 -4.9572 -4.9572 -3.0383 -3.0383 -3.0380 -3.0380 -0.7494 -0.7494 -0.7456 -0.7456 1.5406 1.5406 1.5520 1.5520 1.9981 1.9981 2.0049 2.0049 2.6866 2.6866 2.6968 2.6968 3.3544 3.3544 3.3622 3.3622 4.1541 4.1541 4.1577 4.1577 4.9500 4.9500 4.9610 4.9610 5.8499 5.8499 5.8524 5.8524 8.2857 8.2857 8.2876 8.2876 8.6064 8.6064 8.6098 8.6098 9.4259 9.4259 9.4263 9.4263 k = 0.2419-0.0000 0.3417 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.2832 -7.2832 -7.2827 -7.2827 -5.0201 -5.0201 -5.0180 -5.0180 -2.9755 -2.9755 -2.9750 -2.9750 -0.7940 -0.7940 -0.7902 -0.7902 1.5537 1.5537 1.5656 1.5656 2.0148 2.0148 2.0214 2.0214 2.6608 2.6608 2.6719 2.6719 3.3876 3.3876 3.3953 3.3953 4.0962 4.0962 4.0990 4.0990 4.9494 4.9494 4.9600 4.9600 5.8361 5.8361 5.8392 5.8392 8.3301 8.3301 8.3320 8.3320 8.6847 8.6847 8.6878 8.6878 9.4905 9.4905 9.4912 9.4912 k = 0.2581-0.0000 0.3417 ( 10024 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.2621 -7.2621 -7.2615 -7.2615 -5.0797 -5.0797 -5.0776 -5.0776 -2.9130 -2.9130 -2.9123 -2.9123 -0.8401 -0.8401 -0.8363 -0.8363 1.5674 1.5674 1.5798 1.5798 2.0332 2.0332 2.0396 2.0396 2.6291 2.6291 2.6409 2.6409 3.4213 3.4213 3.4283 3.4283 4.0467 4.0467 4.0483 4.0483 4.9492 4.9492 4.9595 4.9595 5.8170 5.8170 5.8208 5.8208 8.3806 8.3806 8.3824 8.3824 8.7608 8.7608 8.7637 8.7637 9.5499 9.5499 9.5510 9.5510 k = 0.2742-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.2403 -7.2403 -7.2397 -7.2397 -5.1377 -5.1377 -5.1356 -5.1356 -2.8509 -2.8509 -2.8499 -2.8499 -0.8873 -0.8873 -0.8837 -0.8837 1.5819 1.5819 1.5946 1.5946 2.0534 2.0534 2.0595 2.0595 2.5936 2.5936 2.6059 2.6059 3.4486 3.4486 3.4542 3.4542 4.0110 4.0110 4.0110 4.0110 4.9495 4.9495 4.9594 4.9594 5.7927 5.7927 5.7971 5.7971 8.4363 8.4363 8.4380 8.4380 8.8341 8.8341 8.8367 8.8367 9.6025 9.6025 9.6039 9.6039 k = 0.2903-0.0000 0.3417 ( 10012 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.2180 -7.2180 -7.2174 -7.2174 -5.1941 -5.1941 -5.1920 -5.1920 -2.7894 -2.7894 -2.7882 -2.7882 -0.9356 -0.9356 -0.9320 -0.9320 1.5970 1.5970 1.6102 1.6102 2.0749 2.0749 2.0808 2.0808 2.5563 2.5563 2.5690 2.5690 3.4615 3.4615 3.4650 3.4650 3.9937 3.9937 3.9957 3.9957 4.9503 4.9503 4.9599 4.9599 5.7633 5.7633 5.7683 5.7683 8.4963 8.4963 8.4977 8.4977 8.9038 8.9038 8.9061 8.9061 9.6465 9.6465 9.6483 9.6483 k = 0.3065-0.0000 0.3417 ( 10008 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.1954 -7.1954 -7.1948 -7.1948 -5.2485 -5.2485 -5.2464 -5.2464 -2.7285 -2.7285 -2.7271 -2.7271 -0.9845 -0.9845 -0.9812 -0.9812 1.6131 1.6131 1.6266 1.6266 2.0972 2.0972 2.1028 2.1028 2.5191 2.5191 2.5320 2.5320 3.4540 3.4540 3.4553 3.4553 4.0008 4.0008 4.0050 4.0050 4.9516 4.9516 4.9610 4.9610 5.7293 5.7293 5.7348 5.7348 8.5592 8.5592 8.5603 8.5603 8.9695 8.9695 8.9714 8.9714 9.6812 9.6812 9.6832 9.6832 k = 0.3226-0.0000 0.3417 ( 10014 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.1728 -7.1728 -7.1722 -7.1722 -5.3006 -5.3006 -5.2985 -5.2985 -2.6686 -2.6686 -2.6669 -2.6669 -1.0340 -1.0340 -1.0307 -1.0307 1.6301 1.6301 1.6439 1.6439 2.1188 2.1188 2.1243 2.1243 2.4841 2.4841 2.4971 2.4971 3.4255 3.4255 3.4261 3.4261 4.0317 4.0317 4.0375 4.0375 4.9533 4.9533 4.9624 4.9624 5.6910 5.6910 5.6970 5.6970 8.6233 8.6233 8.6239 8.6239 9.0312 9.0312 9.0326 9.0326 9.7069 9.7069 9.7090 9.7090 k = 0.3387-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.1504 -7.1504 -7.1497 -7.1497 -5.3501 -5.3501 -5.3480 -5.3480 -2.6098 -2.6098 -2.6078 -2.6078 -1.0835 -1.0835 -1.0805 -1.0805 1.6482 1.6482 1.6622 1.6622 2.1374 2.1374 2.1430 2.1430 2.4544 2.4544 2.4672 2.4672 3.3805 3.3805 3.3824 3.3824 4.0809 4.0809 4.0877 4.0877 4.9552 4.9552 4.9641 4.9641 5.6489 5.6489 5.6554 5.6554 8.6863 8.6863 8.6863 8.6863 9.0892 9.0892 9.0901 9.0901 9.7253 9.7253 9.7272 9.7272 k = 0.3548-0.0000 0.3417 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.1285 -7.1285 -7.1278 -7.1278 -5.3966 -5.3966 -5.3946 -5.3946 -2.5524 -2.5524 -2.5501 -2.5501 -1.1327 -1.1327 -1.1300 -1.1300 1.6676 1.6676 1.6818 1.6818 2.1494 2.1494 2.1554 2.1554 2.4340 2.4340 2.4464 2.4464 3.3257 3.3257 3.3284 3.3284 4.1423 4.1423 4.1496 4.1496 4.9570 4.9570 4.9656 4.9656 5.6037 5.6037 5.6108 5.6108 8.7448 8.7448 8.7456 8.7456 9.1448 9.1448 9.1449 9.1449 9.7389 9.7389 9.7403 9.7403 k = 0.3710-0.0000 0.3417 ( 10024 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.1075 -7.1075 -7.1067 -7.1067 -5.4399 -5.4399 -5.4379 -5.4379 -2.4969 -2.4969 -2.4943 -2.4943 -1.1812 -1.1812 -1.1787 -1.1787 1.6883 1.6883 1.7026 1.7026 2.1506 2.1506 2.1576 2.1576 2.4276 2.4276 2.4389 2.4389 3.2649 3.2649 3.2682 3.2682 4.2110 4.2110 4.2184 4.2184 4.9583 4.9583 4.9667 4.9667 5.5561 5.5561 5.5638 5.5638 8.7964 8.7964 8.7981 8.7981 9.1990 9.1990 9.1996 9.1996 9.7499 9.7499 9.7507 9.7507 k = 0.3871-0.0000 0.3417 ( 10026 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.0876 -7.0876 -7.0868 -7.0868 -5.4795 -5.4795 -5.4775 -5.4775 -2.4438 -2.4438 -2.4409 -2.4409 -1.2283 -1.2283 -1.2261 -1.2261 1.7105 1.7105 1.7249 1.7249 2.1390 2.1390 2.1473 2.1473 2.4373 2.4373 2.4472 2.4472 3.2009 3.2009 3.2045 3.2045 4.2836 4.2836 4.2910 4.2910 4.9587 4.9587 4.9669 4.9669 5.5070 5.5070 5.5154 5.5154 8.8387 8.8387 8.8414 8.8414 9.2542 9.2542 9.2556 9.2556 9.7598 9.7598 9.7600 9.7600 k = 0.4032-0.0000 0.3417 ( 10024 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.0692 -7.0692 -7.0684 -7.0684 -5.5150 -5.5150 -5.5130 -5.5130 -2.3938 -2.3938 -2.3905 -2.3905 -1.2732 -1.2732 -1.2714 -1.2714 1.7342 1.7342 1.7486 1.7486 2.1166 2.1166 2.1261 2.1261 2.4613 2.4613 2.4700 2.4700 3.1352 3.1352 3.1391 3.1391 4.3578 4.3578 4.3650 4.3650 4.9575 4.9575 4.9654 4.9654 5.4575 5.4575 5.4666 5.4666 8.8703 8.8703 8.8739 8.8739 9.3121 9.3121 9.3142 9.3142 9.7680 9.7680 9.7694 9.7694 k = 0.4194-0.0000 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0527 -7.0527 -7.0519 -7.0519 -5.5460 -5.5460 -5.5440 -5.5440 -2.3477 -2.3477 -2.3441 -2.3441 -1.3151 -1.3151 -1.3136 -1.3136 1.7595 1.7595 1.7740 1.7740 2.0871 2.0871 2.0975 2.0975 2.4960 2.4960 2.5037 2.5037 3.0690 3.0690 3.0732 3.0732 4.4314 4.4314 4.4383 4.4383 4.9539 4.9539 4.9614 4.9614 5.4092 5.4092 5.4191 5.4191 8.8916 8.8916 8.8961 8.8961 9.3726 9.3726 9.3753 9.3753 9.7744 9.7744 9.7771 9.7771 k = 0.4355-0.0000 0.3417 ( 10030 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0386 -7.0386 -7.0378 -7.0378 -5.5721 -5.5721 -5.5701 -5.5701 -2.3068 -2.3068 -2.3028 -2.3028 -1.3527 -1.3527 -1.3515 -1.3515 1.7865 1.7865 1.8009 1.8009 2.0538 2.0538 2.0649 2.0649 2.5383 2.5383 2.5452 2.5452 3.0030 3.0030 3.0074 3.0074 4.5026 4.5026 4.5091 4.5091 4.9468 4.9468 4.9539 4.9539 5.3639 5.3639 5.3747 5.3747 8.9045 8.9045 8.9096 8.9096 9.4343 9.4343 9.4371 9.4371 9.7772 9.7772 9.7816 9.7816 k = 0.4516-0.0000 0.3417 ( 10034 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0272 -7.0272 -7.0263 -7.0263 -5.5928 -5.5928 -5.5909 -5.5909 -2.2724 -2.2724 -2.2681 -2.2681 -1.3845 -1.3845 -1.3836 -1.3836 1.8149 1.8149 1.8294 1.8294 2.0189 2.0189 2.0304 2.0304 2.5860 2.5860 2.5923 2.5923 2.9378 2.9378 2.9424 2.9424 4.5689 4.5689 4.5750 4.5750 4.9354 4.9354 4.9421 4.9421 5.3243 5.3243 5.3360 5.3360 8.9114 8.9114 8.9169 8.9169 9.4942 9.4942 9.4968 9.4968 9.7747 9.7747 9.7809 9.7809 k = 0.4677-0.0000 0.3417 ( 10028 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3800 -35.3800 -35.3799 -35.3799 -35.3539 -35.3539 -35.3538 -35.3538 -7.0187 -7.0187 -7.0179 -7.0179 -5.6079 -5.6079 -5.6060 -5.6060 -2.2461 -2.2461 -2.2416 -2.2416 -1.4090 -1.4090 -1.4083 -1.4083 1.8448 1.8448 1.8594 1.8594 1.9838 1.9838 1.9955 1.9955 2.6379 2.6379 2.6438 2.6438 2.8739 2.8739 2.8787 2.8787 4.6266 4.6266 4.6323 4.6323 4.9201 4.9201 4.9265 4.9265 5.2933 5.2933 5.3058 5.3058 8.9146 8.9146 8.9203 8.9203 9.5482 9.5482 9.5501 9.5501 9.7661 9.7661 9.7743 9.7743 k = 0.4839-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3538 -35.3538 -7.0136 -7.0136 -7.0127 -7.0127 -5.6171 -5.6171 -5.6151 -5.6151 -2.2296 -2.2296 -2.2248 -2.2248 -1.4244 -1.4244 -1.4240 -1.4240 1.8750 1.8750 1.8902 1.8902 1.9502 1.9502 1.9615 1.9615 2.6931 2.6931 2.6987 2.6987 2.8116 2.8116 2.8166 2.8166 4.6690 4.6690 4.6743 4.6743 4.9045 4.9045 4.9107 4.9107 5.2735 5.2735 5.2865 5.2865 8.9158 8.9158 8.9216 8.9216 9.5895 9.5895 9.5901 9.5901 9.7538 9.7538 9.7643 9.7643 k = 0.5000-0.0000 0.3417 ( 10020 PWs) bands (ev): -68.7136 -68.7136 -68.7136 -68.7136 -35.6568 -35.6568 -35.6568 -35.6568 -35.3799 -35.3799 -35.3798 -35.3798 -35.3539 -35.3539 -35.3537 -35.3537 -7.0118 -7.0118 -7.0110 -7.0110 -5.6202 -5.6202 -5.6182 -5.6182 -2.2239 -2.2239 -2.2191 -2.2191 -1.4298 -1.4298 -1.4294 -1.4294 1.8959 1.8959 1.9136 1.9136 1.9281 1.9281 1.9369 1.9369 2.7506 2.7506 2.7518 2.7518 2.7552 2.7552 2.7576 2.7576 4.6855 4.6855 4.6905 4.6905 4.8972 4.8972 4.9034 4.9034 5.2667 5.2667 5.2799 5.2799 8.9161 8.9161 8.9219 8.9219 9.6060 9.6060 9.6063 9.6063 9.7471 9.7471 9.7588 9.7588 Writing output data file MgP4.save init_run : 2.48s CPU 11.35s WALL ( 1 calls) electrons : 1402.47s CPU 1416.88s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.37s CPU 1.62s WALL ( 1 calls) Called by electrons: c_bands : 1402.42s CPU 1416.57s WALL ( 1 calls) v_of_rho : 0.17s CPU 1.00s WALL ( 1 calls) v_h : 0.01s CPU 0.05s WALL ( 1 calls) v_xc : 0.16s CPU 0.61s WALL ( 1 calls) newd : 0.35s CPU 0.64s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.10s WALL ( 252 calls) cegterg : 1340.20s CPU 1351.35s WALL ( 551 calls) Called by sum_band: Called by *egterg: h_psi : 605.27s CPU 613.39s WALL ( 9999 calls) s_psi : 39.13s CPU 39.44s WALL ( 9999 calls) g_psi : 2.08s CPU 2.12s WALL ( 9196 calls) cdiaghg : 448.16s CPU 446.46s WALL ( 9448 calls) cegterg:over : 137.53s CPU 135.61s WALL ( 9196 calls) cegterg:upda : 53.62s CPU 56.10s WALL ( 9196 calls) cegterg:last : 42.86s CPU 43.55s WALL ( 1815 calls) Called by h_psi: h_psi:vloc : 505.33s CPU 510.74s WALL ( 9999 calls) h_psi:vnl : 98.83s CPU 100.63s WALL ( 9999 calls) add_vuspsi : 32.09s CPU 35.43s WALL ( 9999 calls) General routines calbec : 66.69s CPU 65.14s WALL ( 9999 calls) fft : 0.70s CPU 1.60s WALL ( 19 calls) ffts : 0.00s CPU 0.06s WALL ( 4 calls) fftw : 478.06s CPU 481.87s WALL ( 1566004 calls) interpolate : 0.02s CPU 0.08s WALL ( 4 calls) davcio : 0.02s CPU 2.22s WALL ( 504 calls) Parallel routines fft_scatter : 313.67s CPU 311.83s WALL ( 1566027 calls) PWSCF : 24m45.85s CPU 27m39.38s WALL This run was terminated on: 0:21:46 4Jun2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=