Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 14:33:26 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 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 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: ./KNa2BN2.save/ file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S renormalized file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 79 65 18 1713 1276 195 Max 80 66 19 1715 1295 198 Sum 2855 2351 673 61699 46235 7083 bravais-lattice index = 14 lattice parameter (alat) = 11.2595 a.u. unit-cell volume = 623.6690 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 4 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.259522 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.747292 celldm(5)= -0.747292 celldm(6)= 0.494584 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.494584 0.869130 0.000000 ) a(3) = ( -0.747292 -0.434565 0.502701 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.569056 0.994627 ) b(2) = ( 0.000000 1.150576 0.994627 ) b(3) = ( 0.000000 0.000000 1.989255 ) PseudoPot. # 1 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 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. # 4 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd 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 1085 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 K 9.00 39.09830 K( 1.00) Na 9.00 22.98980 Na( 1.00) B 3.00 10.81100 B( 1.00) N 5.00 14.00670 N( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 343 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 2) = ( 0.0000000 0.0000000 0.0187666), wk = 0.0029155 k( 3) = ( 0.0000000 0.0000000 0.0375331), wk = 0.0029155 k( 4) = ( 0.0000000 0.0000000 0.0562997), wk = 0.0029155 k( 5) = ( 0.0000000 0.0000000 0.0750662), wk = 0.0029155 k( 6) = ( 0.0000000 0.0000000 0.0938328), wk = 0.0029155 k( 7) = ( 0.0000000 0.0000000 0.1125993), wk = 0.0029155 k( 8) = ( 0.0000000 0.0000000 0.1313659), wk = 0.0029155 k( 9) = ( 0.0000000 0.0000000 0.1501324), wk = 0.0029155 k( 10) = ( 0.0000000 0.0000000 0.1688990), wk = 0.0029155 k( 11) = ( 0.0000000 0.0000000 0.1876655), wk = 0.0029155 k( 12) = ( 0.0000000 0.0000000 0.2064321), wk = 0.0029155 k( 13) = ( 0.0000000 0.0000000 0.2251987), wk = 0.0029155 k( 14) = ( 0.0000000 0.0000000 0.2439652), wk = 0.0029155 k( 15) = ( 0.0000000 0.0000000 0.2627318), wk = 0.0029155 k( 16) = ( 0.0000000 0.0000000 0.2814983), wk = 0.0029155 k( 17) = ( 0.0000000 0.0000000 0.3002649), wk = 0.0029155 k( 18) = ( 0.0000000 0.0000000 0.3190314), wk = 0.0029155 k( 19) = ( 0.0000000 0.0000000 0.3377980), wk = 0.0029155 k( 20) = ( 0.0000000 0.0000000 0.3565645), wk = 0.0029155 k( 21) = ( 0.0000000 0.0000000 0.3753311), wk = 0.0029155 k( 22) = ( 0.0000000 0.0000000 0.3940977), wk = 0.0029155 k( 23) = ( 0.0000000 0.0000000 0.4128642), wk = 0.0029155 k( 24) = ( 0.0000000 0.0000000 0.4316308), wk = 0.0029155 k( 25) = ( 0.0000000 0.0000000 0.4503973), wk = 0.0029155 k( 26) = ( 0.0000000 0.0000000 0.4691639), wk = 0.0029155 k( 27) = ( 0.0000000 0.0000000 0.4879304), wk = 0.0029155 k( 28) = ( 0.0000000 0.0000000 0.5066970), wk = 0.0029155 k( 29) = ( 0.0000000 0.0000000 0.5254635), wk = 0.0029155 k( 30) = ( 0.0000000 0.0000000 0.5442301), wk = 0.0029155 k( 31) = ( 0.0000000 0.0000000 0.5629966), wk = 0.0029155 k( 32) = ( 0.0000000 0.0000000 0.5817632), wk = 0.0029155 k( 33) = ( 0.0000000 0.0000000 0.6005297), wk = 0.0029155 k( 34) = ( 0.0000000 0.0000000 0.6192963), wk = 0.0029155 k( 35) = ( 0.0000000 0.0000000 0.6380629), wk = 0.0029155 k( 36) = ( 0.0000000 0.0000000 0.6568294), wk = 0.0029155 k( 37) = ( 0.0000000 0.0000000 0.6755960), wk = 0.0029155 k( 38) = ( 0.0000000 0.0000000 0.6943625), wk = 0.0029155 k( 39) = ( 0.0000000 0.0000000 0.7131291), wk = 0.0029155 k( 40) = ( 0.0000000 0.0000000 0.7318956), wk = 0.0029155 k( 41) = ( 0.0000000 0.0000000 0.7506622), wk = 0.0029155 k( 42) = ( 0.0000000 0.0000000 0.7694287), wk = 0.0029155 k( 43) = ( 0.0000000 0.0000000 0.7881953), wk = 0.0029155 k( 44) = ( 0.0000000 0.0000000 0.8069619), wk = 0.0029155 k( 45) = ( 0.0000000 0.0000000 0.8257284), wk = 0.0029155 k( 46) = ( 0.0000000 0.0000000 0.8444950), wk = 0.0029155 k( 47) = ( 0.0000000 0.0000000 0.8632615), wk = 0.0029155 k( 48) = ( 0.0000000 0.0000000 0.8820281), wk = 0.0029155 k( 49) = ( 0.0000000 0.0000000 0.9007946), wk = 0.0029155 k( 50) = ( 0.0000000 0.0000000 0.9195612), wk = 0.0029155 k( 51) = ( 0.0000000 0.0000000 0.9383277), wk = 0.0029155 k( 52) = ( 0.0000000 0.0000000 0.9570943), wk = 0.0029155 k( 53) = ( 0.0000000 0.0000000 0.9758609), wk = 0.0029155 k( 54) = ( 0.0000000 0.0000000 0.9946274), wk = 0.0029155 k( 55) = ( 0.0000000 0.0000000 0.9946274), wk = 0.0029155 k( 56) = ( -0.0093935 0.0161533 0.9946274), wk = 0.0029155 k( 57) = ( -0.0187870 0.0323066 0.9946274), wk = 0.0029155 k( 58) = ( -0.0281804 0.0484600 0.9946274), wk = 0.0029155 k( 59) = ( -0.0375739 0.0646133 0.9946274), wk = 0.0029155 k( 60) = ( -0.0469674 0.0807666 0.9946274), wk = 0.0029155 k( 61) = ( -0.0563609 0.0969199 0.9946274), wk = 0.0029155 k( 62) = ( -0.0657543 0.1130733 0.9946274), wk = 0.0029155 k( 63) = ( -0.0751478 0.1292266 0.9946274), wk = 0.0029155 k( 64) = ( -0.0845413 0.1453799 0.9946274), wk = 0.0029155 k( 65) = ( -0.0845413 0.1453799 0.9946274), wk = 0.0029155 k( 66) = ( -0.0912422 0.1569031 0.9812975), wk = 0.0029155 k( 67) = ( -0.0979432 0.1684263 0.9679676), wk = 0.0029155 k( 68) = ( -0.1046441 0.1799494 0.9546377), wk = 0.0029155 k( 69) = ( -0.1113451 0.1914726 0.9413078), wk = 0.0029155 k( 70) = ( -0.1180460 0.2029957 0.9279780), wk = 0.0029155 k( 71) = ( -0.1247470 0.2145189 0.9146481), wk = 0.0029155 k( 72) = ( -0.1314479 0.2260421 0.9013182), wk = 0.0029155 k( 73) = ( -0.1381489 0.2375652 0.8879883), wk = 0.0029155 k( 74) = ( -0.1448498 0.2490884 0.8746584), wk = 0.0029155 k( 75) = ( -0.1515508 0.2606116 0.8613285), wk = 0.0029155 k( 76) = ( -0.1582517 0.2721347 0.8479986), wk = 0.0029155 k( 77) = ( -0.1649527 0.2836579 0.8346687), wk = 0.0029155 k( 78) = ( -0.1716536 0.2951810 0.8213388), wk = 0.0029155 k( 79) = ( -0.1783546 0.3067042 0.8080089), wk = 0.0029155 k( 80) = ( -0.1850555 0.3182274 0.7946791), wk = 0.0029155 k( 81) = ( -0.1917564 0.3297506 0.7813492), wk = 0.0029155 k( 82) = ( -0.1984574 0.3412737 0.7680193), wk = 0.0029155 k( 83) = ( -0.2051583 0.3527969 0.7546894), wk = 0.0029155 k( 84) = ( -0.2118593 0.3643200 0.7413595), wk = 0.0029155 k( 85) = ( -0.2185602 0.3758432 0.7280296), wk = 0.0029155 k( 86) = ( -0.2252612 0.3873664 0.7146997), wk = 0.0029155 k( 87) = ( -0.2319621 0.3988895 0.7013698), wk = 0.0029155 k( 88) = ( -0.2386631 0.4104127 0.6880399), wk = 0.0029155 k( 89) = ( -0.2453640 0.4219359 0.6747100), wk = 0.0029155 k( 90) = ( -0.2520650 0.4334590 0.6613801), wk = 0.0029155 k( 91) = ( -0.2587659 0.4449822 0.6480502), wk = 0.0029155 k( 92) = ( -0.2654669 0.4565053 0.6347204), wk = 0.0029155 k( 93) = ( -0.2721678 0.4680285 0.6213905), wk = 0.0029155 k( 94) = ( -0.2788687 0.4795517 0.6080606), wk = 0.0029155 k( 95) = ( -0.2855697 0.4910748 0.5947307), wk = 0.0029155 k( 96) = ( -0.2922707 0.5025980 0.5814008), wk = 0.0029155 k( 97) = ( -0.2922707 0.5025980 0.5814008), wk = 0.0029155 k( 98) = ( -0.2856281 0.4911753 0.5681871), wk = 0.0029155 k( 99) = ( -0.2789856 0.4797526 0.5549735), wk = 0.0029155 k( 100) = ( -0.2723431 0.4683299 0.5417598), wk = 0.0029155 k( 101) = ( -0.2657006 0.4569073 0.5285462), wk = 0.0029155 k( 102) = ( -0.2590581 0.4454846 0.5153325), wk = 0.0029155 k( 103) = ( -0.2524156 0.4340619 0.5021189), wk = 0.0029155 k( 104) = ( -0.2457730 0.4226392 0.4889052), wk = 0.0029155 k( 105) = ( -0.2391305 0.4112165 0.4756916), wk = 0.0029155 k( 106) = ( -0.2324880 0.3997939 0.4624779), wk = 0.0029155 k( 107) = ( -0.2258455 0.3883712 0.4492642), wk = 0.0029155 k( 108) = ( -0.2192030 0.3769485 0.4360506), wk = 0.0029155 k( 109) = ( -0.2125605 0.3655258 0.4228369), wk = 0.0029155 k( 110) = ( -0.2059180 0.3541031 0.4096233), wk = 0.0029155 k( 111) = ( -0.1992754 0.3426805 0.3964096), wk = 0.0029155 k( 112) = ( -0.1926329 0.3312578 0.3831960), wk = 0.0029155 k( 113) = ( -0.1859904 0.3198351 0.3699823), wk = 0.0029155 k( 114) = ( -0.1793479 0.3084124 0.3567687), wk = 0.0029155 k( 115) = ( -0.1727054 0.2969897 0.3435550), wk = 0.0029155 k( 116) = ( -0.1660629 0.2855670 0.3303414), wk = 0.0029155 k( 117) = ( -0.1594203 0.2741444 0.3171277), wk = 0.0029155 k( 118) = ( -0.1527778 0.2627217 0.3039141), wk = 0.0029155 k( 119) = ( -0.1461353 0.2512990 0.2907004), wk = 0.0029155 k( 120) = ( -0.1394928 0.2398763 0.2774867), wk = 0.0029155 k( 121) = ( -0.1328503 0.2284536 0.2642731), wk = 0.0029155 k( 122) = ( -0.1262078 0.2170310 0.2510594), wk = 0.0029155 k( 123) = ( -0.1195653 0.2056083 0.2378458), wk = 0.0029155 k( 124) = ( -0.1129228 0.1941856 0.2246321), wk = 0.0029155 k( 125) = ( -0.1062802 0.1827629 0.2114185), wk = 0.0029155 k( 126) = ( -0.0996377 0.1713402 0.1982048), wk = 0.0029155 k( 127) = ( -0.0929952 0.1599176 0.1849912), wk = 0.0029155 k( 128) = ( -0.0863527 0.1484949 0.1717775), wk = 0.0029155 k( 129) = ( -0.0797102 0.1370722 0.1585639), wk = 0.0029155 k( 130) = ( -0.0730677 0.1256495 0.1453502), wk = 0.0029155 k( 131) = ( -0.0664252 0.1142268 0.1321365), wk = 0.0029155 k( 132) = ( -0.0597826 0.1028041 0.1189229), wk = 0.0029155 k( 133) = ( -0.0531401 0.0913815 0.1057092), wk = 0.0029155 k( 134) = ( -0.0464976 0.0799588 0.0924956), wk = 0.0029155 k( 135) = ( -0.0398551 0.0685361 0.0792819), wk = 0.0029155 k( 136) = ( -0.0332126 0.0571134 0.0660683), wk = 0.0029155 k( 137) = ( -0.0265701 0.0456907 0.0528546), wk = 0.0029155 k( 138) = ( -0.0199275 0.0342680 0.0396410), wk = 0.0029155 k( 139) = ( -0.0132850 0.0228454 0.0264273), wk = 0.0029155 k( 140) = ( -0.0066425 0.0114227 0.0132136), wk = 0.0029155 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 143) = ( 0.0161290 0.0093793 0.0000000), wk = 0.0029155 k( 144) = ( 0.0322581 0.0187587 0.0000000), wk = 0.0029155 k( 145) = ( 0.0483871 0.0281381 0.0000000), wk = 0.0029155 k( 146) = ( 0.0645161 0.0375174 0.0000000), wk = 0.0029155 k( 147) = ( 0.0806452 0.0468968 0.0000000), wk = 0.0029155 k( 148) = ( 0.0967742 0.0562761 0.0000000), wk = 0.0029155 k( 149) = ( 0.1129032 0.0656555 0.0000000), wk = 0.0029155 k( 150) = ( 0.1290323 0.0750348 0.0000000), wk = 0.0029155 k( 151) = ( 0.1451613 0.0844142 0.0000000), wk = 0.0029155 k( 152) = ( 0.1612903 0.0937935 0.0000000), wk = 0.0029155 k( 153) = ( 0.1774194 0.1031729 0.0000000), wk = 0.0029155 k( 154) = ( 0.1935484 0.1125522 0.0000000), wk = 0.0029155 k( 155) = ( 0.2096774 0.1219316 0.0000000), wk = 0.0029155 k( 156) = ( 0.2258064 0.1313109 0.0000000), wk = 0.0029155 k( 157) = ( 0.2419355 0.1406903 0.0000000), wk = 0.0029155 k( 158) = ( 0.2580645 0.1500696 0.0000000), wk = 0.0029155 k( 159) = ( 0.2741936 0.1594490 0.0000000), wk = 0.0029155 k( 160) = ( 0.2903226 0.1688283 0.0000000), wk = 0.0029155 k( 161) = ( 0.3064516 0.1782077 0.0000000), wk = 0.0029155 k( 162) = ( 0.3225807 0.1875870 0.0000000), wk = 0.0029155 k( 163) = ( 0.3387097 0.1969664 0.0000000), wk = 0.0029155 k( 164) = ( 0.3548387 0.2063457 0.0000000), wk = 0.0029155 k( 165) = ( 0.3709677 0.2157251 0.0000000), wk = 0.0029155 k( 166) = ( 0.3870968 0.2251044 0.0000000), wk = 0.0029155 k( 167) = ( 0.4032258 0.2344838 0.0000000), wk = 0.0029155 k( 168) = ( 0.4193548 0.2438631 0.0000000), wk = 0.0029155 k( 169) = ( 0.4354839 0.2532425 0.0000000), wk = 0.0029155 k( 170) = ( 0.4516129 0.2626218 0.0000000), wk = 0.0029155 k( 171) = ( 0.4677419 0.2720012 0.0000000), wk = 0.0029155 k( 172) = ( 0.4838710 0.2813805 0.0000000), wk = 0.0029155 k( 173) = ( 0.5000000 0.2907599 0.0000000), wk = 0.0029155 k( 174) = ( 0.5000000 0.2907599 0.0000000), wk = 0.0029155 k( 175) = ( 0.4932991 0.3022830 0.0133299), wk = 0.0029155 k( 176) = ( 0.4865981 0.3138062 0.0266598), wk = 0.0029155 k( 177) = ( 0.4798972 0.3253293 0.0399897), wk = 0.0029155 k( 178) = ( 0.4731962 0.3368525 0.0533196), wk = 0.0029155 k( 179) = ( 0.4664953 0.3483757 0.0666494), wk = 0.0029155 k( 180) = ( 0.4597943 0.3598988 0.0799793), wk = 0.0029155 k( 181) = ( 0.4530934 0.3714220 0.0933092), wk = 0.0029155 k( 182) = ( 0.4463924 0.3829452 0.1066391), wk = 0.0029155 k( 183) = ( 0.4396915 0.3944683 0.1199690), wk = 0.0029155 k( 184) = ( 0.4329905 0.4059915 0.1332989), wk = 0.0029155 k( 185) = ( 0.4262896 0.4175147 0.1466288), wk = 0.0029155 k( 186) = ( 0.4195886 0.4290378 0.1599587), wk = 0.0029155 k( 187) = ( 0.4128877 0.4405610 0.1732886), wk = 0.0029155 k( 188) = ( 0.4061867 0.4520842 0.1866185), wk = 0.0029155 k( 189) = ( 0.3994858 0.4636073 0.1999484), wk = 0.0029155 k( 190) = ( 0.3927849 0.4751305 0.2132783), wk = 0.0029155 k( 191) = ( 0.3860839 0.4866536 0.2266082), wk = 0.0029155 k( 192) = ( 0.3793830 0.4981768 0.2399380), wk = 0.0029155 k( 193) = ( 0.3726820 0.5097000 0.2532679), wk = 0.0029155 k( 194) = ( 0.3659811 0.5212231 0.2665978), wk = 0.0029155 k( 195) = ( 0.3592801 0.5327463 0.2799277), wk = 0.0029155 k( 196) = ( 0.3525792 0.5442695 0.2932576), wk = 0.0029155 k( 197) = ( 0.3458782 0.5557926 0.3065875), wk = 0.0029155 k( 198) = ( 0.3391773 0.5673158 0.3199174), wk = 0.0029155 k( 199) = ( 0.3324763 0.5788389 0.3332473), wk = 0.0029155 k( 200) = ( 0.3257754 0.5903621 0.3465772), wk = 0.0029155 k( 201) = ( 0.3190744 0.6018853 0.3599070), wk = 0.0029155 k( 202) = ( 0.3123735 0.6134084 0.3732369), wk = 0.0029155 k( 203) = ( 0.3056725 0.6249316 0.3865668), wk = 0.0029155 k( 204) = ( 0.2989716 0.6364548 0.3998967), wk = 0.0029155 k( 205) = ( 0.2922707 0.6479779 0.4132266), wk = 0.0029155 k( 206) = ( 0.2922707 0.6479779 0.4132266), wk = 0.0029155 k( 207) = ( 0.2750783 0.6437020 0.4181729), wk = 0.0029155 k( 208) = ( 0.2578859 0.6394262 0.4231192), wk = 0.0029155 k( 209) = ( 0.2406935 0.6351503 0.4280655), wk = 0.0029155 k( 210) = ( 0.2235011 0.6308744 0.4330118), wk = 0.0029155 k( 211) = ( 0.2063087 0.6265985 0.4379581), wk = 0.0029155 k( 212) = ( 0.1891163 0.6223226 0.4429044), wk = 0.0029155 k( 213) = ( 0.1719239 0.6180468 0.4478507), wk = 0.0029155 k( 214) = ( 0.1547315 0.6137709 0.4527970), wk = 0.0029155 k( 215) = ( 0.1375391 0.6094950 0.4577433), wk = 0.0029155 k( 216) = ( 0.1203467 0.6052191 0.4626896), wk = 0.0029155 k( 217) = ( 0.1031544 0.6009432 0.4676359), wk = 0.0029155 k( 218) = ( 0.0859620 0.5966674 0.4725822), wk = 0.0029155 k( 219) = ( 0.0687696 0.5923915 0.4775285), wk = 0.0029155 k( 220) = ( 0.0515772 0.5881156 0.4824748), wk = 0.0029155 k( 221) = ( 0.0343848 0.5838397 0.4874211), wk = 0.0029155 k( 222) = ( 0.0171924 0.5795638 0.4923674), wk = 0.0029155 k( 223) = ( 0.0000000 0.5752880 0.4973137), wk = 0.0029155 k( 224) = ( 0.0000000 0.5752880 0.4973137), wk = 0.0029155 k( 225) = ( 0.0065790 0.5639746 0.5104009), wk = 0.0029155 k( 226) = ( 0.0131579 0.5526612 0.5234881), wk = 0.0029155 k( 227) = ( 0.0197368 0.5413479 0.5365753), wk = 0.0029155 k( 228) = ( 0.0263158 0.5300345 0.5496625), wk = 0.0029155 k( 229) = ( 0.0328947 0.5187211 0.5627497), wk = 0.0029155 k( 230) = ( 0.0394737 0.5074078 0.5758369), wk = 0.0029155 k( 231) = ( 0.0460526 0.4960944 0.5889241), wk = 0.0029155 k( 232) = ( 0.0526316 0.4847810 0.6020113), wk = 0.0029155 k( 233) = ( 0.0592105 0.4734676 0.6150985), wk = 0.0029155 k( 234) = ( 0.0657895 0.4621543 0.6281857), wk = 0.0029155 k( 235) = ( 0.0723684 0.4508409 0.6412729), wk = 0.0029155 k( 236) = ( 0.0789474 0.4395275 0.6543601), wk = 0.0029155 k( 237) = ( 0.0855263 0.4282142 0.6674473), wk = 0.0029155 k( 238) = ( 0.0921053 0.4169008 0.6805345), wk = 0.0029155 k( 239) = ( 0.0986842 0.4055874 0.6936217), wk = 0.0029155 k( 240) = ( 0.1052632 0.3942741 0.7067090), wk = 0.0029155 k( 241) = ( 0.1118421 0.3829607 0.7197962), wk = 0.0029155 k( 242) = ( 0.1184210 0.3716473 0.7328833), wk = 0.0029155 k( 243) = ( 0.1250000 0.3603339 0.7459706), wk = 0.0029155 k( 244) = ( 0.1315790 0.3490206 0.7590578), wk = 0.0029155 k( 245) = ( 0.1381579 0.3377072 0.7721450), wk = 0.0029155 k( 246) = ( 0.1447368 0.3263938 0.7852322), wk = 0.0029155 k( 247) = ( 0.1513158 0.3150805 0.7983194), wk = 0.0029155 k( 248) = ( 0.1578947 0.3037671 0.8114066), wk = 0.0029155 k( 249) = ( 0.1644737 0.2924537 0.8244938), wk = 0.0029155 k( 250) = ( 0.1710526 0.2811404 0.8375810), wk = 0.0029155 k( 251) = ( 0.1776316 0.2698270 0.8506682), wk = 0.0029155 k( 252) = ( 0.1842105 0.2585136 0.8637554), wk = 0.0029155 k( 253) = ( 0.1907895 0.2472003 0.8768426), wk = 0.0029155 k( 254) = ( 0.1973684 0.2358869 0.8899298), wk = 0.0029155 k( 255) = ( 0.2039474 0.2245735 0.9030170), wk = 0.0029155 k( 256) = ( 0.2105263 0.2132601 0.9161042), wk = 0.0029155 k( 257) = ( 0.2171053 0.2019468 0.9291914), wk = 0.0029155 k( 258) = ( 0.2236842 0.1906334 0.9422786), wk = 0.0029155 k( 259) = ( 0.2302632 0.1793200 0.9553658), wk = 0.0029155 k( 260) = ( 0.2368421 0.1680067 0.9684530), wk = 0.0029155 k( 261) = ( 0.2434210 0.1566933 0.9815402), wk = 0.0029155 k( 262) = ( 0.2500000 0.1453799 0.9946274), wk = 0.0029155 k( 263) = ( 0.2500000 0.1453799 0.9946274), wk = 0.0029155 k( 264) = ( 0.2638889 0.1534566 0.9852844), wk = 0.0029155 k( 265) = ( 0.2777778 0.1615333 0.9759414), wk = 0.0029155 k( 266) = ( 0.2916667 0.1696099 0.9665984), wk = 0.0029155 k( 267) = ( 0.3055556 0.1776866 0.9572554), wk = 0.0029155 k( 268) = ( 0.3194444 0.1857632 0.9479123), wk = 0.0029155 k( 269) = ( 0.3333333 0.1938399 0.9385693), wk = 0.0029155 k( 270) = ( 0.3472222 0.2019166 0.9292263), wk = 0.0029155 k( 271) = ( 0.3611111 0.2099932 0.9198833), wk = 0.0029155 k( 272) = ( 0.3750000 0.2180699 0.9105403), wk = 0.0029155 k( 273) = ( 0.3888889 0.2261466 0.9011973), wk = 0.0029155 k( 274) = ( 0.4027778 0.2342232 0.8918543), wk = 0.0029155 k( 275) = ( 0.4166667 0.2422999 0.8825113), wk = 0.0029155 k( 276) = ( 0.4305556 0.2503765 0.8731683), wk = 0.0029155 k( 277) = ( 0.4444444 0.2584532 0.8638252), wk = 0.0029155 k( 278) = ( 0.4583333 0.2665299 0.8544823), wk = 0.0029155 k( 279) = ( 0.4722222 0.2746065 0.8451392), wk = 0.0029155 k( 280) = ( 0.4861111 0.2826832 0.8357962), wk = 0.0029155 k( 281) = ( 0.5000000 0.2907599 0.8264532), wk = 0.0029155 k( 282) = ( 0.5000000 0.2907599 0.8264532), wk = 0.0029155 k( 283) = ( 0.5000000 0.2907599 0.8076702), wk = 0.0029155 k( 284) = ( 0.5000000 0.2907599 0.7888872), wk = 0.0029155 k( 285) = ( 0.5000000 0.2907599 0.7701041), wk = 0.0029155 k( 286) = ( 0.5000000 0.2907599 0.7513211), wk = 0.0029155 k( 287) = ( 0.5000000 0.2907599 0.7325381), wk = 0.0029155 k( 288) = ( 0.5000000 0.2907599 0.7137551), wk = 0.0029155 k( 289) = ( 0.5000000 0.2907599 0.6949720), wk = 0.0029155 k( 290) = ( 0.5000000 0.2907599 0.6761890), wk = 0.0029155 k( 291) = ( 0.5000000 0.2907599 0.6574060), wk = 0.0029155 k( 292) = ( 0.5000000 0.2907599 0.6386229), wk = 0.0029155 k( 293) = ( 0.5000000 0.2907599 0.6198399), wk = 0.0029155 k( 294) = ( 0.5000000 0.2907599 0.6010569), wk = 0.0029155 k( 295) = ( 0.5000000 0.2907599 0.5822739), wk = 0.0029155 k( 296) = ( 0.5000000 0.2907599 0.5634908), wk = 0.0029155 k( 297) = ( 0.5000000 0.2907599 0.5447078), wk = 0.0029155 k( 298) = ( 0.5000000 0.2907599 0.5259248), wk = 0.0029155 k( 299) = ( 0.5000000 0.2907599 0.5071418), wk = 0.0029155 k( 300) = ( 0.5000000 0.2907599 0.4883587), wk = 0.0029155 k( 301) = ( 0.5000000 0.2907599 0.4695757), wk = 0.0029155 k( 302) = ( 0.5000000 0.2907599 0.4507927), wk = 0.0029155 k( 303) = ( 0.5000000 0.2907599 0.4320097), wk = 0.0029155 k( 304) = ( 0.5000000 0.2907599 0.4132266), wk = 0.0029155 k( 305) = ( 0.5000000 0.2907599 0.3944436), wk = 0.0029155 k( 306) = ( 0.5000000 0.2907599 0.3756606), wk = 0.0029155 k( 307) = ( 0.5000000 0.2907599 0.3568775), wk = 0.0029155 k( 308) = ( 0.5000000 0.2907599 0.3380945), wk = 0.0029155 k( 309) = ( 0.5000000 0.2907599 0.3193115), wk = 0.0029155 k( 310) = ( 0.5000000 0.2907599 0.3005284), wk = 0.0029155 k( 311) = ( 0.5000000 0.2907599 0.2817454), wk = 0.0029155 k( 312) = ( 0.5000000 0.2907599 0.2629624), wk = 0.0029155 k( 313) = ( 0.5000000 0.2907599 0.2441794), wk = 0.0029155 k( 314) = ( 0.5000000 0.2907599 0.2253963), wk = 0.0029155 k( 315) = ( 0.5000000 0.2907599 0.2066133), wk = 0.0029155 k( 316) = ( 0.5000000 0.2907599 0.1878303), wk = 0.0029155 k( 317) = ( 0.5000000 0.2907599 0.1690473), wk = 0.0029155 k( 318) = ( 0.5000000 0.2907599 0.1502642), wk = 0.0029155 k( 319) = ( 0.5000000 0.2907599 0.1314812), wk = 0.0029155 k( 320) = ( 0.5000000 0.2907599 0.1126982), wk = 0.0029155 k( 321) = ( 0.5000000 0.2907599 0.0939151), wk = 0.0029155 k( 322) = ( 0.5000000 0.2907599 0.0751321), wk = 0.0029155 k( 323) = ( 0.5000000 0.2907599 0.0563491), wk = 0.0029155 k( 324) = ( 0.5000000 0.2907599 0.0375661), wk = 0.0029155 k( 325) = ( 0.5000000 0.2907599 0.0187830), wk = 0.0029155 k( 326) = ( 0.5000000 0.2907599 0.0000000), wk = 0.0029155 k( 327) = ( 0.0000000 0.0000000 0.9946274), wk = 0.0029155 k( 328) = ( 0.0156250 0.0090862 0.9946274), wk = 0.0029155 k( 329) = ( 0.0312500 0.0181725 0.9946274), wk = 0.0029155 k( 330) = ( 0.0468750 0.0272587 0.9946274), wk = 0.0029155 k( 331) = ( 0.0625000 0.0363450 0.9946274), wk = 0.0029155 k( 332) = ( 0.0781250 0.0454312 0.9946274), wk = 0.0029155 k( 333) = ( 0.0937500 0.0545175 0.9946274), wk = 0.0029155 k( 334) = ( 0.1093750 0.0636037 0.9946274), wk = 0.0029155 k( 335) = ( 0.1250000 0.0726900 0.9946274), wk = 0.0029155 k( 336) = ( 0.1406250 0.0817762 0.9946274), wk = 0.0029155 k( 337) = ( 0.1562500 0.0908625 0.9946274), wk = 0.0029155 k( 338) = ( 0.1718750 0.0999487 0.9946274), wk = 0.0029155 k( 339) = ( 0.1875000 0.1090349 0.9946274), wk = 0.0029155 k( 340) = ( 0.2031250 0.1181212 0.9946274), wk = 0.0029155 k( 341) = ( 0.2187500 0.1272074 0.9946274), wk = 0.0029155 k( 342) = ( 0.2343750 0.1362937 0.9946274), wk = 0.0029155 k( 343) = ( 0.2500000 0.1453799 0.9946274), wk = 0.0029155 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 2) = ( 0.0000000 0.0000000 0.0094340), wk = 0.0029155 k( 3) = ( 0.0000000 0.0000000 0.0188679), wk = 0.0029155 k( 4) = ( 0.0000000 0.0000000 0.0283019), wk = 0.0029155 k( 5) = ( 0.0000000 0.0000000 0.0377359), wk = 0.0029155 k( 6) = ( 0.0000000 0.0000000 0.0471698), wk = 0.0029155 k( 7) = ( 0.0000000 0.0000000 0.0566038), wk = 0.0029155 k( 8) = ( 0.0000000 0.0000000 0.0660377), wk = 0.0029155 k( 9) = ( 0.0000000 0.0000000 0.0754717), wk = 0.0029155 k( 10) = ( 0.0000000 0.0000000 0.0849057), wk = 0.0029155 k( 11) = ( 0.0000000 0.0000000 0.0943396), wk = 0.0029155 k( 12) = ( 0.0000000 0.0000000 0.1037736), wk = 0.0029155 k( 13) = ( 0.0000000 0.0000000 0.1132076), wk = 0.0029155 k( 14) = ( 0.0000000 0.0000000 0.1226415), wk = 0.0029155 k( 15) = ( 0.0000000 0.0000000 0.1320755), wk = 0.0029155 k( 16) = ( 0.0000000 0.0000000 0.1415094), wk = 0.0029155 k( 17) = ( 0.0000000 0.0000000 0.1509434), wk = 0.0029155 k( 18) = ( 0.0000000 0.0000000 0.1603774), wk = 0.0029155 k( 19) = ( 0.0000000 0.0000000 0.1698113), wk = 0.0029155 k( 20) = ( 0.0000000 0.0000000 0.1792453), wk = 0.0029155 k( 21) = ( 0.0000000 0.0000000 0.1886792), wk = 0.0029155 k( 22) = ( 0.0000000 0.0000000 0.1981132), wk = 0.0029155 k( 23) = ( 0.0000000 0.0000000 0.2075472), wk = 0.0029155 k( 24) = ( 0.0000000 0.0000000 0.2169811), wk = 0.0029155 k( 25) = ( 0.0000000 0.0000000 0.2264151), wk = 0.0029155 k( 26) = ( 0.0000000 0.0000000 0.2358491), wk = 0.0029155 k( 27) = ( 0.0000000 0.0000000 0.2452830), wk = 0.0029155 k( 28) = ( 0.0000000 0.0000000 0.2547170), wk = 0.0029155 k( 29) = ( 0.0000000 0.0000000 0.2641509), wk = 0.0029155 k( 30) = ( 0.0000000 0.0000000 0.2735849), wk = 0.0029155 k( 31) = ( 0.0000000 0.0000000 0.2830189), wk = 0.0029155 k( 32) = ( 0.0000000 0.0000000 0.2924528), wk = 0.0029155 k( 33) = ( 0.0000000 0.0000000 0.3018868), wk = 0.0029155 k( 34) = ( 0.0000000 0.0000000 0.3113207), wk = 0.0029155 k( 35) = ( 0.0000000 0.0000000 0.3207547), wk = 0.0029155 k( 36) = ( 0.0000000 0.0000000 0.3301887), wk = 0.0029155 k( 37) = ( 0.0000000 0.0000000 0.3396226), wk = 0.0029155 k( 38) = ( 0.0000000 0.0000000 0.3490566), wk = 0.0029155 k( 39) = ( 0.0000000 0.0000000 0.3584906), wk = 0.0029155 k( 40) = ( 0.0000000 0.0000000 0.3679245), wk = 0.0029155 k( 41) = ( 0.0000000 0.0000000 0.3773585), wk = 0.0029155 k( 42) = ( 0.0000000 0.0000000 0.3867925), wk = 0.0029155 k( 43) = ( 0.0000000 0.0000000 0.3962264), wk = 0.0029155 k( 44) = ( 0.0000000 0.0000000 0.4056604), wk = 0.0029155 k( 45) = ( 0.0000000 0.0000000 0.4150943), wk = 0.0029155 k( 46) = ( 0.0000000 0.0000000 0.4245283), wk = 0.0029155 k( 47) = ( 0.0000000 0.0000000 0.4339623), wk = 0.0029155 k( 48) = ( 0.0000000 0.0000000 0.4433962), wk = 0.0029155 k( 49) = ( 0.0000000 0.0000000 0.4528302), wk = 0.0029155 k( 50) = ( 0.0000000 0.0000000 0.4622641), wk = 0.0029155 k( 51) = ( 0.0000000 0.0000000 0.4716981), wk = 0.0029155 k( 52) = ( 0.0000000 0.0000000 0.4811321), wk = 0.0029155 k( 53) = ( 0.0000000 0.0000000 0.4905660), wk = 0.0029155 k( 54) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029155 k( 55) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029155 k( 56) = ( -0.0093935 0.0093935 0.5000000), wk = 0.0029155 k( 57) = ( -0.0187870 0.0187870 0.5000000), wk = 0.0029155 k( 58) = ( -0.0281804 0.0281804 0.5000000), wk = 0.0029155 k( 59) = ( -0.0375739 0.0375739 0.5000000), wk = 0.0029155 k( 60) = ( -0.0469674 0.0469674 0.5000000), wk = 0.0029155 k( 61) = ( -0.0563609 0.0563609 0.5000000), wk = 0.0029155 k( 62) = ( -0.0657543 0.0657543 0.5000000), wk = 0.0029155 k( 63) = ( -0.0751478 0.0751478 0.5000000), wk = 0.0029155 k( 64) = ( -0.0845413 0.0845413 0.5000000), wk = 0.0029155 k( 65) = ( -0.0845413 0.0845413 0.5000000), wk = 0.0029155 k( 66) = ( -0.0912422 0.0912422 0.4932991), wk = 0.0029155 k( 67) = ( -0.0979432 0.0979432 0.4865981), wk = 0.0029155 k( 68) = ( -0.1046441 0.1046441 0.4798972), wk = 0.0029155 k( 69) = ( -0.1113451 0.1113451 0.4731962), wk = 0.0029155 k( 70) = ( -0.1180460 0.1180460 0.4664953), wk = 0.0029155 k( 71) = ( -0.1247470 0.1247470 0.4597943), wk = 0.0029155 k( 72) = ( -0.1314479 0.1314479 0.4530934), wk = 0.0029155 k( 73) = ( -0.1381489 0.1381489 0.4463924), wk = 0.0029155 k( 74) = ( -0.1448498 0.1448498 0.4396915), wk = 0.0029155 k( 75) = ( -0.1515508 0.1515508 0.4329905), wk = 0.0029155 k( 76) = ( -0.1582517 0.1582517 0.4262896), wk = 0.0029155 k( 77) = ( -0.1649527 0.1649527 0.4195886), wk = 0.0029155 k( 78) = ( -0.1716536 0.1716536 0.4128877), wk = 0.0029155 k( 79) = ( -0.1783546 0.1783546 0.4061867), wk = 0.0029155 k( 80) = ( -0.1850555 0.1850555 0.3994858), wk = 0.0029155 k( 81) = ( -0.1917564 0.1917565 0.3927849), wk = 0.0029155 k( 82) = ( -0.1984574 0.1984574 0.3860839), wk = 0.0029155 k( 83) = ( -0.2051583 0.2051583 0.3793830), wk = 0.0029155 k( 84) = ( -0.2118593 0.2118593 0.3726820), wk = 0.0029155 k( 85) = ( -0.2185602 0.2185602 0.3659811), wk = 0.0029155 k( 86) = ( -0.2252612 0.2252612 0.3592801), wk = 0.0029155 k( 87) = ( -0.2319621 0.2319621 0.3525792), wk = 0.0029155 k( 88) = ( -0.2386631 0.2386631 0.3458782), wk = 0.0029155 k( 89) = ( -0.2453640 0.2453640 0.3391773), wk = 0.0029155 k( 90) = ( -0.2520650 0.2520650 0.3324763), wk = 0.0029155 k( 91) = ( -0.2587659 0.2587659 0.3257754), wk = 0.0029155 k( 92) = ( -0.2654669 0.2654669 0.3190744), wk = 0.0029155 k( 93) = ( -0.2721678 0.2721678 0.3123735), wk = 0.0029155 k( 94) = ( -0.2788687 0.2788687 0.3056725), wk = 0.0029155 k( 95) = ( -0.2855697 0.2855697 0.2989716), wk = 0.0029155 k( 96) = ( -0.2922707 0.2922707 0.2922707), wk = 0.0029155 k( 97) = ( -0.2922707 0.2922707 0.2922707), wk = 0.0029155 k( 98) = ( -0.2856281 0.2856281 0.2856281), wk = 0.0029155 k( 99) = ( -0.2789856 0.2789856 0.2789856), wk = 0.0029155 k( 100) = ( -0.2723431 0.2723431 0.2723431), wk = 0.0029155 k( 101) = ( -0.2657006 0.2657006 0.2657006), wk = 0.0029155 k( 102) = ( -0.2590581 0.2590581 0.2590581), wk = 0.0029155 k( 103) = ( -0.2524156 0.2524156 0.2524156), wk = 0.0029155 k( 104) = ( -0.2457730 0.2457730 0.2457730), wk = 0.0029155 k( 105) = ( -0.2391305 0.2391305 0.2391305), wk = 0.0029155 k( 106) = ( -0.2324880 0.2324880 0.2324880), wk = 0.0029155 k( 107) = ( -0.2258455 0.2258455 0.2258455), wk = 0.0029155 k( 108) = ( -0.2192030 0.2192030 0.2192030), wk = 0.0029155 k( 109) = ( -0.2125605 0.2125605 0.2125605), wk = 0.0029155 k( 110) = ( -0.2059180 0.2059180 0.2059180), wk = 0.0029155 k( 111) = ( -0.1992754 0.1992754 0.1992754), wk = 0.0029155 k( 112) = ( -0.1926329 0.1926329 0.1926329), wk = 0.0029155 k( 113) = ( -0.1859904 0.1859904 0.1859904), wk = 0.0029155 k( 114) = ( -0.1793479 0.1793479 0.1793479), wk = 0.0029155 k( 115) = ( -0.1727054 0.1727054 0.1727054), wk = 0.0029155 k( 116) = ( -0.1660629 0.1660629 0.1660629), wk = 0.0029155 k( 117) = ( -0.1594203 0.1594204 0.1594203), wk = 0.0029155 k( 118) = ( -0.1527778 0.1527778 0.1527778), wk = 0.0029155 k( 119) = ( -0.1461353 0.1461353 0.1461353), wk = 0.0029155 k( 120) = ( -0.1394928 0.1394928 0.1394928), wk = 0.0029155 k( 121) = ( -0.1328503 0.1328503 0.1328503), wk = 0.0029155 k( 122) = ( -0.1262078 0.1262078 0.1262078), wk = 0.0029155 k( 123) = ( -0.1195653 0.1195653 0.1195653), wk = 0.0029155 k( 124) = ( -0.1129228 0.1129227 0.1129228), wk = 0.0029155 k( 125) = ( -0.1062802 0.1062802 0.1062802), wk = 0.0029155 k( 126) = ( -0.0996377 0.0996377 0.0996377), wk = 0.0029155 k( 127) = ( -0.0929952 0.0929952 0.0929952), wk = 0.0029155 k( 128) = ( -0.0863527 0.0863527 0.0863527), wk = 0.0029155 k( 129) = ( -0.0797102 0.0797102 0.0797102), wk = 0.0029155 k( 130) = ( -0.0730677 0.0730677 0.0730677), wk = 0.0029155 k( 131) = ( -0.0664252 0.0664252 0.0664252), wk = 0.0029155 k( 132) = ( -0.0597826 0.0597826 0.0597826), wk = 0.0029155 k( 133) = ( -0.0531401 0.0531401 0.0531401), wk = 0.0029155 k( 134) = ( -0.0464976 0.0464976 0.0464976), wk = 0.0029155 k( 135) = ( -0.0398551 0.0398551 0.0398551), wk = 0.0029155 k( 136) = ( -0.0332126 0.0332126 0.0332126), wk = 0.0029155 k( 137) = ( -0.0265701 0.0265701 0.0265701), wk = 0.0029155 k( 138) = ( -0.0199275 0.0199275 0.0199275), wk = 0.0029155 k( 139) = ( -0.0132850 0.0132850 0.0132850), wk = 0.0029155 k( 140) = ( -0.0066425 0.0066425 0.0066425), wk = 0.0029155 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 142) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029155 k( 143) = ( 0.0161290 0.0161290 -0.0161290), wk = 0.0029155 k( 144) = ( 0.0322581 0.0322581 -0.0322581), wk = 0.0029155 k( 145) = ( 0.0483871 0.0483871 -0.0483871), wk = 0.0029155 k( 146) = ( 0.0645161 0.0645161 -0.0645161), wk = 0.0029155 k( 147) = ( 0.0806452 0.0806452 -0.0806452), wk = 0.0029155 k( 148) = ( 0.0967742 0.0967742 -0.0967742), wk = 0.0029155 k( 149) = ( 0.1129032 0.1129032 -0.1129032), wk = 0.0029155 k( 150) = ( 0.1290323 0.1290323 -0.1290323), wk = 0.0029155 k( 151) = ( 0.1451613 0.1451613 -0.1451613), wk = 0.0029155 k( 152) = ( 0.1612903 0.1612903 -0.1612903), wk = 0.0029155 k( 153) = ( 0.1774194 0.1774194 -0.1774194), wk = 0.0029155 k( 154) = ( 0.1935484 0.1935484 -0.1935484), wk = 0.0029155 k( 155) = ( 0.2096774 0.2096774 -0.2096774), wk = 0.0029155 k( 156) = ( 0.2258064 0.2258064 -0.2258064), wk = 0.0029155 k( 157) = ( 0.2419355 0.2419355 -0.2419355), wk = 0.0029155 k( 158) = ( 0.2580645 0.2580645 -0.2580645), wk = 0.0029155 k( 159) = ( 0.2741936 0.2741936 -0.2741936), wk = 0.0029155 k( 160) = ( 0.2903226 0.2903226 -0.2903226), wk = 0.0029155 k( 161) = ( 0.3064516 0.3064516 -0.3064516), wk = 0.0029155 k( 162) = ( 0.3225807 0.3225807 -0.3225807), wk = 0.0029155 k( 163) = ( 0.3387097 0.3387097 -0.3387097), wk = 0.0029155 k( 164) = ( 0.3548387 0.3548387 -0.3548387), wk = 0.0029155 k( 165) = ( 0.3709677 0.3709677 -0.3709677), wk = 0.0029155 k( 166) = ( 0.3870968 0.3870968 -0.3870968), wk = 0.0029155 k( 167) = ( 0.4032258 0.4032258 -0.4032258), wk = 0.0029155 k( 168) = ( 0.4193548 0.4193548 -0.4193548), wk = 0.0029155 k( 169) = ( 0.4354839 0.4354839 -0.4354839), wk = 0.0029155 k( 170) = ( 0.4516129 0.4516129 -0.4516129), wk = 0.0029155 k( 171) = ( 0.4677419 0.4677419 -0.4677419), wk = 0.0029155 k( 172) = ( 0.4838710 0.4838710 -0.4838710), wk = 0.0029155 k( 173) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029155 k( 174) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029155 k( 175) = ( 0.4932991 0.5067010 -0.4932991), wk = 0.0029155 k( 176) = ( 0.4865981 0.5134019 -0.4865981), wk = 0.0029155 k( 177) = ( 0.4798972 0.5201028 -0.4798972), wk = 0.0029155 k( 178) = ( 0.4731962 0.5268038 -0.4731962), wk = 0.0029155 k( 179) = ( 0.4664953 0.5335047 -0.4664953), wk = 0.0029155 k( 180) = ( 0.4597943 0.5402057 -0.4597943), wk = 0.0029155 k( 181) = ( 0.4530934 0.5469066 -0.4530934), wk = 0.0029155 k( 182) = ( 0.4463924 0.5536076 -0.4463924), wk = 0.0029155 k( 183) = ( 0.4396915 0.5603085 -0.4396915), wk = 0.0029155 k( 184) = ( 0.4329905 0.5670095 -0.4329905), wk = 0.0029155 k( 185) = ( 0.4262896 0.5737104 -0.4262896), wk = 0.0029155 k( 186) = ( 0.4195886 0.5804114 -0.4195886), wk = 0.0029155 k( 187) = ( 0.4128877 0.5871123 -0.4128877), wk = 0.0029155 k( 188) = ( 0.4061867 0.5938133 -0.4061867), wk = 0.0029155 k( 189) = ( 0.3994858 0.6005142 -0.3994858), wk = 0.0029155 k( 190) = ( 0.3927849 0.6072152 -0.3927849), wk = 0.0029155 k( 191) = ( 0.3860839 0.6139161 -0.3860839), wk = 0.0029155 k( 192) = ( 0.3793830 0.6206170 -0.3793830), wk = 0.0029155 k( 193) = ( 0.3726820 0.6273180 -0.3726820), wk = 0.0029155 k( 194) = ( 0.3659811 0.6340189 -0.3659811), wk = 0.0029155 k( 195) = ( 0.3592801 0.6407199 -0.3592801), wk = 0.0029155 k( 196) = ( 0.3525792 0.6474208 -0.3525792), wk = 0.0029155 k( 197) = ( 0.3458782 0.6541218 -0.3458782), wk = 0.0029155 k( 198) = ( 0.3391773 0.6608227 -0.3391773), wk = 0.0029155 k( 199) = ( 0.3324763 0.6675237 -0.3324763), wk = 0.0029155 k( 200) = ( 0.3257754 0.6742246 -0.3257754), wk = 0.0029155 k( 201) = ( 0.3190744 0.6809256 -0.3190744), wk = 0.0029155 k( 202) = ( 0.3123735 0.6876265 -0.3123735), wk = 0.0029155 k( 203) = ( 0.3056725 0.6943275 -0.3056725), wk = 0.0029155 k( 204) = ( 0.2989716 0.7010284 -0.2989716), wk = 0.0029155 k( 205) = ( 0.2922707 0.7077294 -0.2922707), wk = 0.0029155 k( 206) = ( 0.2922707 0.7077294 -0.2922707), wk = 0.0029155 k( 207) = ( 0.2750783 0.6955100 -0.2750783), wk = 0.0029155 k( 208) = ( 0.2578859 0.6832906 -0.2578859), wk = 0.0029155 k( 209) = ( 0.2406935 0.6710712 -0.2406935), wk = 0.0029155 k( 210) = ( 0.2235011 0.6588519 -0.2235011), wk = 0.0029155 k( 211) = ( 0.2063087 0.6466325 -0.2063087), wk = 0.0029155 k( 212) = ( 0.1891163 0.6344131 -0.1891163), wk = 0.0029155 k( 213) = ( 0.1719239 0.6221937 -0.1719239), wk = 0.0029155 k( 214) = ( 0.1547315 0.6099744 -0.1547315), wk = 0.0029155 k( 215) = ( 0.1375391 0.5977550 -0.1375391), wk = 0.0029155 k( 216) = ( 0.1203467 0.5855356 -0.1203467), wk = 0.0029155 k( 217) = ( 0.1031544 0.5733162 -0.1031544), wk = 0.0029155 k( 218) = ( 0.0859620 0.5610969 -0.0859620), wk = 0.0029155 k( 219) = ( 0.0687696 0.5488775 -0.0687696), wk = 0.0029155 k( 220) = ( 0.0515772 0.5366581 -0.0515772), wk = 0.0029155 k( 221) = ( 0.0343848 0.5244388 -0.0343848), wk = 0.0029155 k( 222) = ( 0.0171924 0.5122194 -0.0171924), wk = 0.0029155 k( 223) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029155 k( 224) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029155 k( 225) = ( 0.0065790 0.4934211 0.0065789), wk = 0.0029155 k( 226) = ( 0.0131579 0.4868421 0.0131579), wk = 0.0029155 k( 227) = ( 0.0197368 0.4802632 0.0197368), wk = 0.0029155 k( 228) = ( 0.0263158 0.4736842 0.0263158), wk = 0.0029155 k( 229) = ( 0.0328947 0.4671053 0.0328947), wk = 0.0029155 k( 230) = ( 0.0394737 0.4605263 0.0394737), wk = 0.0029155 k( 231) = ( 0.0460526 0.4539474 0.0460526), wk = 0.0029155 k( 232) = ( 0.0526316 0.4473684 0.0526316), wk = 0.0029155 k( 233) = ( 0.0592105 0.4407895 0.0592105), wk = 0.0029155 k( 234) = ( 0.0657895 0.4342105 0.0657895), wk = 0.0029155 k( 235) = ( 0.0723684 0.4276316 0.0723684), wk = 0.0029155 k( 236) = ( 0.0789474 0.4210526 0.0789474), wk = 0.0029155 k( 237) = ( 0.0855263 0.4144737 0.0855263), wk = 0.0029155 k( 238) = ( 0.0921053 0.4078947 0.0921053), wk = 0.0029155 k( 239) = ( 0.0986842 0.4013158 0.0986842), wk = 0.0029155 k( 240) = ( 0.1052632 0.3947368 0.1052632), wk = 0.0029155 k( 241) = ( 0.1118421 0.3881579 0.1118421), wk = 0.0029155 k( 242) = ( 0.1184210 0.3815790 0.1184210), wk = 0.0029155 k( 243) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0029155 k( 244) = ( 0.1315790 0.3684211 0.1315789), wk = 0.0029155 k( 245) = ( 0.1381579 0.3618421 0.1381579), wk = 0.0029155 k( 246) = ( 0.1447368 0.3552632 0.1447368), wk = 0.0029155 k( 247) = ( 0.1513158 0.3486842 0.1513158), wk = 0.0029155 k( 248) = ( 0.1578947 0.3421053 0.1578947), wk = 0.0029155 k( 249) = ( 0.1644737 0.3355263 0.1644737), wk = 0.0029155 k( 250) = ( 0.1710526 0.3289474 0.1710526), wk = 0.0029155 k( 251) = ( 0.1776316 0.3223684 0.1776316), wk = 0.0029155 k( 252) = ( 0.1842105 0.3157895 0.1842105), wk = 0.0029155 k( 253) = ( 0.1907895 0.3092105 0.1907895), wk = 0.0029155 k( 254) = ( 0.1973684 0.3026316 0.1973684), wk = 0.0029155 k( 255) = ( 0.2039474 0.2960526 0.2039474), wk = 0.0029155 k( 256) = ( 0.2105263 0.2894737 0.2105263), wk = 0.0029155 k( 257) = ( 0.2171053 0.2828947 0.2171053), wk = 0.0029155 k( 258) = ( 0.2236842 0.2763158 0.2236842), wk = 0.0029155 k( 259) = ( 0.2302632 0.2697368 0.2302632), wk = 0.0029155 k( 260) = ( 0.2368421 0.2631579 0.2368421), wk = 0.0029155 k( 261) = ( 0.2434210 0.2565789 0.2434211), wk = 0.0029155 k( 262) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029155 k( 263) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029155 k( 264) = ( 0.2638889 0.2638889 0.2314144), wk = 0.0029155 k( 265) = ( 0.2777778 0.2777778 0.2128287), wk = 0.0029155 k( 266) = ( 0.2916667 0.2916667 0.1942431), wk = 0.0029155 k( 267) = ( 0.3055556 0.3055556 0.1756575), wk = 0.0029155 k( 268) = ( 0.3194444 0.3194444 0.1570719), wk = 0.0029155 k( 269) = ( 0.3333333 0.3333333 0.1384862), wk = 0.0029155 k( 270) = ( 0.3472222 0.3472222 0.1199006), wk = 0.0029155 k( 271) = ( 0.3611111 0.3611111 0.1013150), wk = 0.0029155 k( 272) = ( 0.3750000 0.3750000 0.0827293), wk = 0.0029155 k( 273) = ( 0.3888889 0.3888889 0.0641437), wk = 0.0029155 k( 274) = ( 0.4027778 0.4027778 0.0455581), wk = 0.0029155 k( 275) = ( 0.4166667 0.4166667 0.0269725), wk = 0.0029155 k( 276) = ( 0.4305556 0.4305556 0.0083868), wk = 0.0029155 k( 277) = ( 0.4444444 0.4444444 -0.0101988), wk = 0.0029155 k( 278) = ( 0.4583333 0.4583333 -0.0287844), wk = 0.0029155 k( 279) = ( 0.4722222 0.4722222 -0.0473700), wk = 0.0029155 k( 280) = ( 0.4861111 0.4861111 -0.0659557), wk = 0.0029155 k( 281) = ( 0.5000000 0.5000000 -0.0845413), wk = 0.0029155 k( 282) = ( 0.5000000 0.5000000 -0.0845413), wk = 0.0029155 k( 283) = ( 0.5000000 0.5000000 -0.0939835), wk = 0.0029155 k( 284) = ( 0.5000000 0.5000000 -0.1034258), wk = 0.0029155 k( 285) = ( 0.5000000 0.5000000 -0.1128680), wk = 0.0029155 k( 286) = ( 0.5000000 0.5000000 -0.1223103), wk = 0.0029155 k( 287) = ( 0.5000000 0.5000000 -0.1317525), wk = 0.0029155 k( 288) = ( 0.5000000 0.5000000 -0.1411948), wk = 0.0029155 k( 289) = ( 0.5000000 0.5000000 -0.1506370), wk = 0.0029155 k( 290) = ( 0.5000000 0.5000000 -0.1600792), wk = 0.0029155 k( 291) = ( 0.5000000 0.5000000 -0.1695215), wk = 0.0029155 k( 292) = ( 0.5000000 0.5000000 -0.1789637), wk = 0.0029155 k( 293) = ( 0.5000000 0.5000000 -0.1884060), wk = 0.0029155 k( 294) = ( 0.5000000 0.5000000 -0.1978482), wk = 0.0029155 k( 295) = ( 0.5000000 0.5000000 -0.2072905), wk = 0.0029155 k( 296) = ( 0.5000000 0.5000000 -0.2167327), wk = 0.0029155 k( 297) = ( 0.5000000 0.5000000 -0.2261749), wk = 0.0029155 k( 298) = ( 0.5000000 0.5000000 -0.2356172), wk = 0.0029155 k( 299) = ( 0.5000000 0.5000000 -0.2450594), wk = 0.0029155 k( 300) = ( 0.5000000 0.5000000 -0.2545017), wk = 0.0029155 k( 301) = ( 0.5000000 0.5000000 -0.2639439), wk = 0.0029155 k( 302) = ( 0.5000000 0.5000000 -0.2733862), wk = 0.0029155 k( 303) = ( 0.5000000 0.5000000 -0.2828284), wk = 0.0029155 k( 304) = ( 0.5000000 0.5000000 -0.2922707), wk = 0.0029155 k( 305) = ( 0.5000000 0.5000000 -0.3017129), wk = 0.0029155 k( 306) = ( 0.5000000 0.5000000 -0.3111551), wk = 0.0029155 k( 307) = ( 0.5000000 0.5000000 -0.3205974), wk = 0.0029155 k( 308) = ( 0.5000000 0.5000000 -0.3300396), wk = 0.0029155 k( 309) = ( 0.5000000 0.5000000 -0.3394819), wk = 0.0029155 k( 310) = ( 0.5000000 0.5000000 -0.3489241), wk = 0.0029155 k( 311) = ( 0.5000000 0.5000000 -0.3583664), wk = 0.0029155 k( 312) = ( 0.5000000 0.5000000 -0.3678086), wk = 0.0029155 k( 313) = ( 0.5000000 0.5000000 -0.3772508), wk = 0.0029155 k( 314) = ( 0.5000000 0.5000000 -0.3866931), wk = 0.0029155 k( 315) = ( 0.5000000 0.5000000 -0.3961353), wk = 0.0029155 k( 316) = ( 0.5000000 0.5000000 -0.4055776), wk = 0.0029155 k( 317) = ( 0.5000000 0.5000000 -0.4150198), wk = 0.0029155 k( 318) = ( 0.5000000 0.5000000 -0.4244621), wk = 0.0029155 k( 319) = ( 0.5000000 0.5000000 -0.4339043), wk = 0.0029155 k( 320) = ( 0.5000000 0.5000000 -0.4433465), wk = 0.0029155 k( 321) = ( 0.5000000 0.5000000 -0.4527888), wk = 0.0029155 k( 322) = ( 0.5000000 0.5000000 -0.4622310), wk = 0.0029155 k( 323) = ( 0.5000000 0.5000000 -0.4716733), wk = 0.0029155 k( 324) = ( 0.5000000 0.5000000 -0.4811155), wk = 0.0029155 k( 325) = ( 0.5000000 0.5000000 -0.4905578), wk = 0.0029155 k( 326) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0029155 k( 327) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029155 k( 328) = ( 0.0156250 0.0156250 0.4843750), wk = 0.0029155 k( 329) = ( 0.0312500 0.0312500 0.4687500), wk = 0.0029155 k( 330) = ( 0.0468750 0.0468750 0.4531250), wk = 0.0029155 k( 331) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0029155 k( 332) = ( 0.0781250 0.0781250 0.4218750), wk = 0.0029155 k( 333) = ( 0.0937500 0.0937500 0.4062500), wk = 0.0029155 k( 334) = ( 0.1093750 0.1093750 0.3906250), wk = 0.0029155 k( 335) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0029155 k( 336) = ( 0.1406250 0.1406250 0.3593750), wk = 0.0029155 k( 337) = ( 0.1562500 0.1562500 0.3437500), wk = 0.0029155 k( 338) = ( 0.1718750 0.1718750 0.3281250), wk = 0.0029155 k( 339) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0029155 k( 340) = ( 0.2031250 0.2031250 0.2968750), wk = 0.0029155 k( 341) = ( 0.2187500 0.2187500 0.2812500), wk = 0.0029155 k( 342) = ( 0.2343750 0.2343750 0.2656250), wk = 0.0029155 k( 343) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0029155 Dense grid: 61699 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 46235 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.24 Mb ( 326, 48) NL pseudopotentials 0.26 Mb ( 163, 104) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1714) G-vector shells 0.01 Mb ( 788) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.96 Mb ( 326, 192) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.15 Mb ( 104, 2, 48) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./KNa2BN2.save/charge-density.dat Starting wfc are 60 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.9 secs Computing kpt #: 2 total cpu time spent up to now is 3.5 secs Computing kpt #: 3 total cpu time spent up to now is 4.1 secs Computing kpt #: 4 total cpu time spent up to now is 4.7 secs Computing kpt #: 5 total cpu time spent up to now is 5.3 secs Computing kpt #: 6 total cpu time spent up to now is 5.8 secs Computing kpt #: 7 total cpu time spent up to now is 6.4 secs Computing kpt #: 8 total cpu time spent up to now is 7.0 secs Computing kpt #: 9 total cpu time spent up to now is 7.5 secs Computing kpt #: 10 total cpu time spent up to now is 8.1 secs Computing kpt #: 11 total cpu time spent up to now is 8.7 secs Computing kpt #: 12 total cpu time spent up to now is 9.2 secs Computing kpt #: 13 total cpu time spent up to now is 9.8 secs Computing kpt #: 14 total cpu time spent up to now is 10.3 secs Computing kpt #: 15 total cpu time spent up to now is 10.9 secs Computing kpt #: 16 total cpu time spent up to now is 11.5 secs Computing kpt #: 17 total cpu time spent up to now is 12.1 secs Computing kpt #: 18 total cpu time spent up to now is 12.6 secs Computing kpt #: 19 total cpu time spent up to now is 13.2 secs Computing kpt #: 20 total cpu time spent up to now is 13.8 secs Computing kpt #: 21 total cpu time spent up to now is 14.3 secs Computing kpt #: 22 total cpu time spent up to now is 14.9 secs Computing kpt #: 23 total cpu time spent up to now is 15.4 secs Computing kpt #: 24 total cpu time spent up to now is 16.0 secs Computing kpt #: 25 total cpu time spent up to now is 16.6 secs Computing kpt #: 26 total cpu time spent up to now is 17.1 secs Computing kpt #: 27 total cpu time spent up to now is 17.7 secs Computing kpt #: 28 total cpu time spent up to now is 18.3 secs Computing kpt #: 29 total cpu time spent up to now is 18.8 secs Computing kpt #: 30 total cpu time spent up to now is 19.4 secs Computing kpt #: 31 total cpu time spent up to now is 20.0 secs Computing kpt #: 32 total cpu time spent up to now is 20.5 secs Computing kpt #: 33 total cpu time spent up to now is 21.1 secs Computing kpt #: 34 total cpu time spent up to now is 21.7 secs Computing kpt #: 35 total cpu time spent up to now is 22.3 secs Computing kpt #: 36 total cpu time spent up to now is 22.9 secs Computing kpt #: 37 total cpu time spent up to now is 23.6 secs Computing kpt #: 38 total cpu time spent up to now is 24.3 secs Computing kpt #: 39 total cpu time spent up to now is 25.0 secs Computing kpt #: 40 total cpu time spent up to now is 25.6 secs Computing kpt #: 41 total cpu time spent up to now is 26.3 secs Computing kpt #: 42 total cpu time spent up to now is 27.0 secs Computing kpt #: 43 total cpu time spent up to now is 27.7 secs Computing kpt #: 44 total cpu time spent up to now is 28.4 secs Computing kpt #: 45 total cpu time spent up to now is 29.1 secs Computing kpt #: 46 total cpu time spent up to now is 29.8 secs Computing kpt #: 47 total cpu time spent up to now is 30.5 secs Computing kpt #: 48 total cpu time spent up to now is 31.2 secs Computing kpt #: 49 total cpu time spent up to now is 31.8 secs Computing kpt #: 50 total cpu time spent up to now is 32.5 secs Computing kpt #: 51 total cpu time spent up to now is 33.2 secs Computing kpt #: 52 total cpu time spent up to now is 33.9 secs Computing kpt #: 53 total cpu time spent up to now is 34.6 secs Computing kpt #: 54 total cpu time spent up to now is 35.3 secs Computing kpt #: 55 total cpu time spent up to now is 36.0 secs Computing kpt #: 56 total cpu time spent up to now is 36.6 secs Computing kpt #: 57 total cpu time spent up to now is 37.3 secs Computing kpt #: 58 total cpu time spent up to now is 38.0 secs Computing kpt #: 59 total cpu time spent up to now is 38.7 secs Computing kpt #: 60 total cpu time spent up to now is 39.4 secs Computing kpt #: 61 total cpu time spent up to now is 40.0 secs Computing kpt #: 62 total cpu time spent up to now is 40.6 secs Computing kpt #: 63 total cpu time spent up to now is 41.3 secs Computing kpt #: 64 total cpu time spent up to now is 41.9 secs Computing kpt #: 65 total cpu time spent up to now is 42.5 secs Computing kpt #: 66 total cpu time spent up to now is 43.2 secs Computing kpt #: 67 total cpu time spent up to now is 43.8 secs Computing kpt #: 68 total cpu time spent up to now is 44.5 secs Computing kpt #: 69 total cpu time spent up to now is 45.1 secs Computing kpt #: 70 total cpu time spent up to now is 45.7 secs Computing kpt #: 71 total cpu time spent up to now is 46.3 secs Computing kpt #: 72 total cpu time spent up to now is 46.9 secs Computing kpt #: 73 total cpu time spent up to now is 47.5 secs Computing kpt #: 74 total cpu time spent up to now is 48.1 secs Computing kpt #: 75 total cpu time spent up to now is 48.7 secs Computing kpt #: 76 total cpu time spent up to now is 49.2 secs Computing kpt #: 77 total cpu time spent up to now is 49.8 secs Computing kpt #: 78 total cpu time spent up to now is 50.4 secs Computing kpt #: 79 total cpu time spent up to now is 51.0 secs Computing kpt #: 80 total cpu time spent up to now is 51.6 secs Computing kpt #: 81 total cpu time spent up to now is 52.2 secs Computing kpt #: 82 total cpu time spent up to now is 52.8 secs Computing kpt #: 83 total cpu time spent up to now is 53.4 secs Computing kpt #: 84 total cpu time spent up to now is 54.0 secs Computing kpt #: 85 total cpu time spent up to now is 54.6 secs Computing kpt #: 86 total cpu time spent up to now is 55.2 secs Computing kpt #: 87 total cpu time spent up to now is 55.8 secs Computing kpt #: 88 total cpu time spent up to now is 56.4 secs Computing kpt #: 89 total cpu time spent up to now is 57.0 secs Computing kpt #: 90 total cpu time spent up to now is 57.6 secs Computing kpt #: 91 total cpu time spent up to now is 58.2 secs Computing kpt #: 92 total cpu time spent up to now is 58.8 secs Computing kpt #: 93 total cpu time spent up to now is 59.4 secs Computing kpt #: 94 total cpu time spent up to now is 60.0 secs Computing kpt #: 95 total cpu time spent up to now is 60.7 secs Computing kpt #: 96 total cpu time spent up to now is 61.4 secs Computing kpt #: 97 total cpu time spent up to now is 62.1 secs Computing kpt #: 98 total cpu time spent up to now is 62.8 secs Computing kpt #: 99 total cpu time spent up to now is 63.4 secs Computing kpt #: 100 total cpu time spent up to now is 64.1 secs Computing kpt #: 101 total cpu time spent up to now is 64.8 secs Computing kpt #: 102 total cpu time spent up to now is 65.5 secs Computing kpt #: 103 total cpu time spent up to now is 66.1 secs Computing kpt #: 104 total cpu time spent up to now is 66.8 secs Computing kpt #: 105 total cpu time spent up to now is 67.5 secs Computing kpt #: 106 total cpu time spent up to now is 68.2 secs Computing kpt #: 107 total cpu time spent up to now is 68.9 secs Computing kpt #: 108 total cpu time spent up to now is 69.5 secs Computing kpt #: 109 total cpu time spent up to now is 70.1 secs Computing kpt #: 110 total cpu time spent up to now is 70.8 secs Computing kpt #: 111 total cpu time spent up to now is 71.4 secs Computing kpt #: 112 total cpu time spent up to now is 72.1 secs Computing kpt #: 113 total cpu time spent up to now is 72.7 secs Computing kpt #: 114 total cpu time spent up to now is 73.4 secs Computing kpt #: 115 total cpu time spent up to now is 74.0 secs Computing kpt #: 116 total cpu time spent up to now is 74.6 secs Computing kpt #: 117 total cpu time spent up to now is 75.2 secs Computing kpt #: 118 total cpu time spent up to now is 75.8 secs Computing kpt #: 119 total cpu time spent up to now is 76.4 secs Computing kpt #: 120 total cpu time spent up to now is 77.0 secs Computing kpt #: 121 total cpu time spent up to now is 77.5 secs Computing kpt #: 122 total cpu time spent up to now is 78.1 secs Computing kpt #: 123 total cpu time spent up to now is 78.7 secs Computing kpt #: 124 total cpu time spent up to now is 79.3 secs Computing kpt #: 125 total cpu time spent up to now is 79.9 secs Computing kpt #: 126 total cpu time spent up to now is 80.5 secs Computing kpt #: 127 total cpu time spent up to now is 81.1 secs Computing kpt #: 128 total cpu time spent up to now is 81.6 secs Computing kpt #: 129 total cpu time spent up to now is 82.2 secs Computing kpt #: 130 total cpu time spent up to now is 82.8 secs Computing kpt #: 131 total cpu time spent up to now is 83.4 secs Computing kpt #: 132 total cpu time spent up to now is 83.9 secs Computing kpt #: 133 total cpu time spent up to now is 84.5 secs Computing kpt #: 134 total cpu time spent up to now is 85.1 secs Computing kpt #: 135 total cpu time spent up to now is 85.7 secs Computing kpt #: 136 total cpu time spent up to now is 86.3 secs Computing kpt #: 137 total cpu time spent up to now is 86.8 secs Computing kpt #: 138 total cpu time spent up to now is 87.4 secs Computing kpt #: 139 total cpu time spent up to now is 88.0 secs Computing kpt #: 140 total cpu time spent up to now is 88.6 secs Computing kpt #: 141 total cpu time spent up to now is 89.1 secs Computing kpt #: 142 total cpu time spent up to now is 89.7 secs Computing kpt #: 143 total cpu time spent up to now is 90.2 secs Computing kpt #: 144 total cpu time spent up to now is 90.8 secs Computing kpt #: 145 total cpu time spent up to now is 91.4 secs Computing kpt #: 146 total cpu time spent up to now is 91.9 secs Computing kpt #: 147 total cpu time spent up to now is 92.5 secs Computing kpt #: 148 total cpu time spent up to now is 93.0 secs Computing kpt #: 149 total cpu time spent up to now is 93.6 secs Computing kpt #: 150 total cpu time spent up to now is 94.2 secs Computing kpt #: 151 total cpu time spent up to now is 94.7 secs Computing kpt #: 152 total cpu time spent up to now is 95.3 secs Computing kpt #: 153 total cpu time spent up to now is 95.9 secs Computing kpt #: 154 total cpu time spent up to now is 96.6 secs Computing kpt #: 155 total cpu time spent up to now is 97.2 secs Computing kpt #: 156 total cpu time spent up to now is 97.8 secs Computing kpt #: 157 total cpu time spent up to now is 98.5 secs Computing kpt #: 158 total cpu time spent up to now is 99.2 secs Computing kpt #: 159 total cpu time spent up to now is 99.7 secs Computing kpt #: 160 total cpu time spent up to now is 100.3 secs Computing kpt #: 161 total cpu time spent up to now is 101.0 secs Computing kpt #: 162 total cpu time spent up to now is 101.6 secs Computing kpt #: 163 total cpu time spent up to now is 102.3 secs Computing kpt #: 164 total cpu time spent up to now is 102.8 secs Computing kpt #: 165 total cpu time spent up to now is 103.4 secs Computing kpt #: 166 total cpu time spent up to now is 104.1 secs Computing kpt #: 167 total cpu time spent up to now is 104.7 secs Computing kpt #: 168 total cpu time spent up to now is 105.2 secs Computing kpt #: 169 total cpu time spent up to now is 105.8 secs Computing kpt #: 170 total cpu time spent up to now is 106.4 secs Computing kpt #: 171 total cpu time spent up to now is 106.9 secs Computing kpt #: 172 total cpu time spent up to now is 107.5 secs Computing kpt #: 173 total cpu time spent up to now is 108.0 secs Computing kpt #: 174 total cpu time spent up to now is 108.6 secs Computing kpt #: 175 total cpu time spent up to now is 109.3 secs Computing kpt #: 176 total cpu time spent up to now is 109.9 secs Computing kpt #: 177 total cpu time spent up to now is 110.5 secs Computing kpt #: 178 total cpu time spent up to now is 111.1 secs Computing kpt #: 179 total cpu time spent up to now is 111.6 secs Computing kpt #: 180 total cpu time spent up to now is 112.2 secs Computing kpt #: 181 total cpu time spent up to now is 112.8 secs Computing kpt #: 182 total cpu time spent up to now is 113.4 secs Computing kpt #: 183 total cpu time spent up to now is 113.9 secs Computing kpt #: 184 total cpu time spent up to now is 114.5 secs Computing kpt #: 185 total cpu time spent up to now is 115.1 secs Computing kpt #: 186 total cpu time spent up to now is 115.6 secs Computing kpt #: 187 total cpu time spent up to now is 116.2 secs Computing kpt #: 188 total cpu time spent up to now is 116.8 secs Computing kpt #: 189 total cpu time spent up to now is 117.4 secs Computing kpt #: 190 total cpu time spent up to now is 117.9 secs Computing kpt #: 191 total cpu time spent up to now is 118.5 secs Computing kpt #: 192 total cpu time spent up to now is 119.0 secs Computing kpt #: 193 total cpu time spent up to now is 119.6 secs Computing kpt #: 194 total cpu time spent up to now is 120.2 secs Computing kpt #: 195 total cpu time spent up to now is 120.8 secs Computing kpt #: 196 total cpu time spent up to now is 121.4 secs Computing kpt #: 197 total cpu time spent up to now is 121.9 secs Computing kpt #: 198 total cpu time spent up to now is 122.5 secs Computing kpt #: 199 total cpu time spent up to now is 123.1 secs Computing kpt #: 200 total cpu time spent up to now is 123.7 secs Computing kpt #: 201 total cpu time spent up to now is 124.3 secs Computing kpt #: 202 total cpu time spent up to now is 125.0 secs Computing kpt #: 203 total cpu time spent up to now is 125.7 secs Computing kpt #: 204 total cpu time spent up to now is 126.4 secs Computing kpt #: 205 total cpu time spent up to now is 127.1 secs Computing kpt #: 206 total cpu time spent up to now is 127.8 secs Computing kpt #: 207 total cpu time spent up to now is 128.4 secs Computing kpt #: 208 total cpu time spent up to now is 129.0 secs Computing kpt #: 209 total cpu time spent up to now is 129.7 secs Computing kpt #: 210 total cpu time spent up to now is 130.3 secs Computing kpt #: 211 total cpu time spent up to now is 131.0 secs Computing kpt #: 212 total cpu time spent up to now is 131.7 secs Computing kpt #: 213 total cpu time spent up to now is 132.4 secs Computing kpt #: 214 total cpu time spent up to now is 133.1 secs Computing kpt #: 215 total cpu time spent up to now is 133.8 secs Computing kpt #: 216 total cpu time spent up to now is 134.5 secs Computing kpt #: 217 total cpu time spent up to now is 135.2 secs Computing kpt #: 218 total cpu time spent up to now is 135.8 secs Computing kpt #: 219 total cpu time spent up to now is 136.4 secs Computing kpt #: 220 total cpu time spent up to now is 137.1 secs Computing kpt #: 221 total cpu time spent up to now is 137.8 secs Computing kpt #: 222 total cpu time spent up to now is 138.5 secs Computing kpt #: 223 total cpu time spent up to now is 139.1 secs Computing kpt #: 224 total cpu time spent up to now is 139.7 secs Computing kpt #: 225 total cpu time spent up to now is 140.3 secs Computing kpt #: 226 total cpu time spent up to now is 141.0 secs Computing kpt #: 227 total cpu time spent up to now is 141.6 secs Computing kpt #: 228 total cpu time spent up to now is 142.2 secs Computing kpt #: 229 total cpu time spent up to now is 142.8 secs Computing kpt #: 230 total cpu time spent up to now is 143.4 secs Computing kpt #: 231 total cpu time spent up to now is 143.9 secs Computing kpt #: 232 total cpu time spent up to now is 144.5 secs Computing kpt #: 233 total cpu time spent up to now is 145.1 secs Computing kpt #: 234 total cpu time spent up to now is 145.7 secs Computing kpt #: 235 total cpu time spent up to now is 146.3 secs Computing kpt #: 236 total cpu time spent up to now is 146.9 secs Computing kpt #: 237 total cpu time spent up to now is 147.5 secs Computing kpt #: 238 total cpu time spent up to now is 148.1 secs Computing kpt #: 239 total cpu time spent up to now is 148.7 secs Computing kpt #: 240 total cpu time spent up to now is 149.3 secs Computing kpt #: 241 total cpu time spent up to now is 149.9 secs Computing kpt #: 242 total cpu time spent up to now is 150.4 secs Computing kpt #: 243 total cpu time spent up to now is 151.0 secs Computing kpt #: 244 total cpu time spent up to now is 151.6 secs Computing kpt #: 245 total cpu time spent up to now is 152.2 secs Computing kpt #: 246 total cpu time spent up to now is 152.7 secs Computing kpt #: 247 total cpu time spent up to now is 153.3 secs Computing kpt #: 248 total cpu time spent up to now is 153.9 secs Computing kpt #: 249 total cpu time spent up to now is 154.4 secs Computing kpt #: 250 total cpu time spent up to now is 155.0 secs Computing kpt #: 251 total cpu time spent up to now is 155.6 secs Computing kpt #: 252 total cpu time spent up to now is 156.1 secs Computing kpt #: 253 total cpu time spent up to now is 156.7 secs Computing kpt #: 254 total cpu time spent up to now is 157.2 secs Computing kpt #: 255 total cpu time spent up to now is 157.8 secs Computing kpt #: 256 total cpu time spent up to now is 158.4 secs Computing kpt #: 257 total cpu time spent up to now is 158.9 secs Computing kpt #: 258 total cpu time spent up to now is 159.5 secs Computing kpt #: 259 total cpu time spent up to now is 160.1 secs Computing kpt #: 260 total cpu time spent up to now is 160.6 secs Computing kpt #: 261 total cpu time spent up to now is 161.2 secs Computing kpt #: 262 total cpu time spent up to now is 161.9 secs Computing kpt #: 263 total cpu time spent up to now is 162.5 secs Computing kpt #: 264 total cpu time spent up to now is 163.2 secs Computing kpt #: 265 total cpu time spent up to now is 163.8 secs Computing kpt #: 266 total cpu time spent up to now is 164.4 secs Computing kpt #: 267 total cpu time spent up to now is 165.0 secs Computing kpt #: 268 total cpu time spent up to now is 165.6 secs Computing kpt #: 269 total cpu time spent up to now is 166.2 secs Computing kpt #: 270 total cpu time spent up to now is 166.8 secs Computing kpt #: 271 total cpu time spent up to now is 167.4 secs Computing kpt #: 272 total cpu time spent up to now is 167.9 secs Computing kpt #: 273 total cpu time spent up to now is 168.5 secs Computing kpt #: 274 total cpu time spent up to now is 169.1 secs Computing kpt #: 275 total cpu time spent up to now is 169.7 secs Computing kpt #: 276 total cpu time spent up to now is 170.3 secs Computing kpt #: 277 total cpu time spent up to now is 170.9 secs Computing kpt #: 278 total cpu time spent up to now is 171.5 secs Computing kpt #: 279 total cpu time spent up to now is 172.1 secs Computing kpt #: 280 total cpu time spent up to now is 172.8 secs Computing kpt #: 281 total cpu time spent up to now is 173.5 secs Computing kpt #: 282 total cpu time spent up to now is 174.2 secs Computing kpt #: 283 total cpu time spent up to now is 174.9 secs Computing kpt #: 284 total cpu time spent up to now is 175.5 secs Computing kpt #: 285 total cpu time spent up to now is 176.1 secs Computing kpt #: 286 total cpu time spent up to now is 176.7 secs Computing kpt #: 287 total cpu time spent up to now is 177.2 secs Computing kpt #: 288 total cpu time spent up to now is 177.8 secs Computing kpt #: 289 total cpu time spent up to now is 178.4 secs Computing kpt #: 290 total cpu time spent up to now is 179.0 secs Computing kpt #: 291 total cpu time spent up to now is 179.5 secs Computing kpt #: 292 total cpu time spent up to now is 180.1 secs Computing kpt #: 293 total cpu time spent up to now is 180.7 secs Computing kpt #: 294 total cpu time spent up to now is 181.3 secs Computing kpt #: 295 total cpu time spent up to now is 181.9 secs Computing kpt #: 296 total cpu time spent up to now is 182.4 secs Computing kpt #: 297 total cpu time spent up to now is 183.0 secs Computing kpt #: 298 total cpu time spent up to now is 183.6 secs Computing kpt #: 299 total cpu time spent up to now is 184.2 secs Computing kpt #: 300 total cpu time spent up to now is 184.8 secs Computing kpt #: 301 total cpu time spent up to now is 185.3 secs Computing kpt #: 302 total cpu time spent up to now is 185.9 secs Computing kpt #: 303 total cpu time spent up to now is 186.5 secs Computing kpt #: 304 total cpu time spent up to now is 187.1 secs Computing kpt #: 305 total cpu time spent up to now is 187.6 secs Computing kpt #: 306 total cpu time spent up to now is 188.2 secs Computing kpt #: 307 total cpu time spent up to now is 188.8 secs Computing kpt #: 308 total cpu time spent up to now is 189.3 secs Computing kpt #: 309 total cpu time spent up to now is 189.9 secs Computing kpt #: 310 total cpu time spent up to now is 190.4 secs Computing kpt #: 311 total cpu time spent up to now is 191.0 secs Computing kpt #: 312 total cpu time spent up to now is 191.5 secs Computing kpt #: 313 total cpu time spent up to now is 192.1 secs Computing kpt #: 314 total cpu time spent up to now is 192.7 secs Computing kpt #: 315 total cpu time spent up to now is 193.2 secs Computing kpt #: 316 total cpu time spent up to now is 193.8 secs Computing kpt #: 317 total cpu time spent up to now is 194.3 secs Computing kpt #: 318 total cpu time spent up to now is 194.9 secs Computing kpt #: 319 total cpu time spent up to now is 195.4 secs Computing kpt #: 320 total cpu time spent up to now is 196.0 secs Computing kpt #: 321 total cpu time spent up to now is 196.6 secs Computing kpt #: 322 total cpu time spent up to now is 197.2 secs Computing kpt #: 323 total cpu time spent up to now is 197.7 secs Computing kpt #: 324 total cpu time spent up to now is 198.3 secs Computing kpt #: 325 total cpu time spent up to now is 198.9 secs Computing kpt #: 326 total cpu time spent up to now is 199.4 secs Computing kpt #: 327 total cpu time spent up to now is 200.1 secs Computing kpt #: 328 total cpu time spent up to now is 200.8 secs Computing kpt #: 329 total cpu time spent up to now is 201.5 secs Computing kpt #: 330 total cpu time spent up to now is 202.2 secs Computing kpt #: 331 total cpu time spent up to now is 202.9 secs Computing kpt #: 332 total cpu time spent up to now is 203.5 secs Computing kpt #: 333 total cpu time spent up to now is 204.2 secs Computing kpt #: 334 total cpu time spent up to now is 204.9 secs Computing kpt #: 335 total cpu time spent up to now is 205.6 secs Computing kpt #: 336 total cpu time spent up to now is 206.6 secs Computing kpt #: 337 total cpu time spent up to now is 207.4 secs Computing kpt #: 338 total cpu time spent up to now is 208.0 secs Computing kpt #: 339 total cpu time spent up to now is 208.6 secs Computing kpt #: 340 total cpu time spent up to now is 209.2 secs Computing kpt #: 341 total cpu time spent up to now is 209.7 secs Computing kpt #: 342 total cpu time spent up to now is 210.3 secs Computing kpt #: 343 total cpu time spent up to now is 211.0 secs ethr = 2.50E-08, avg # of iterations = 19.5 total cpu time spent up to now is 211.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5793 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4358 -9.4358 -9.1847 -9.1847 -9.1666 -9.1666 -9.0617 -9.0617 -8.3569 -8.3569 0.4727 0.4727 2.3295 2.3295 2.4933 2.4933 2.5043 2.5043 4.2232 4.2232 4.2297 4.2297 6.5092 6.5092 9.0032 9.0032 10.4165 10.4165 10.7255 10.7255 k = 0.0000 0.0000 0.0188 ( 5787 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4361 -9.4361 -9.1944 -9.1944 -9.1588 -9.1588 -9.0593 -9.0593 -8.3570 -8.3570 0.4733 0.4733 2.3292 2.3292 2.4917 2.4917 2.5029 2.5029 4.2229 4.2229 4.2295 4.2295 6.5130 6.5130 9.0055 9.0055 10.4167 10.4167 10.7222 10.7222 k = 0.0000 0.0000 0.0375 ( 5791 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6990 -25.6990 -18.1492 -18.1492 -18.0937 -18.0937 -17.9893 -17.9893 -17.9425 -17.9425 -17.9139 -17.9139 -17.8519 -17.8519 -9.4368 -9.4368 -9.2105 -9.2105 -9.1485 -9.1485 -9.0519 -9.0519 -8.3574 -8.3574 0.4749 0.4749 2.3284 2.3284 2.4863 2.4863 2.4996 2.4996 4.2216 4.2216 4.2297 4.2297 6.5244 6.5244 9.0123 9.0123 10.4172 10.4172 10.7125 10.7125 k = 0.0000 0.0000 0.0563 ( 5799 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6989 -25.6989 -18.1491 -18.1491 -18.0937 -18.0937 -17.9891 -17.9891 -17.9426 -17.9426 -17.9141 -17.9141 -17.8523 -17.8523 -9.4382 -9.4382 -9.2277 -9.2277 -9.1406 -9.1406 -9.0401 -9.0401 -8.3580 -8.3580 0.4776 0.4776 2.3271 2.3271 2.4759 2.4759 2.4956 2.4956 4.2182 4.2182 4.2310 4.2310 6.5434 6.5434 9.0236 9.0236 10.4182 10.4182 10.6967 10.6967 k = 0.0000 0.0000 0.0751 ( 5807 PWs) bands (ev): -46.0493 -46.0493 -46.0258 -46.0258 -25.6989 -25.6989 -18.1489 -18.1489 -18.0938 -18.0938 -17.9888 -17.9888 -17.9426 -17.9426 -17.9144 -17.9144 -17.8528 -17.8528 -9.4402 -9.4402 -9.2448 -9.2448 -9.1353 -9.1353 -9.0246 -9.0246 -8.3588 -8.3588 0.4813 0.4813 2.3253 2.3253 2.4605 2.4605 2.4913 2.4913 4.2129 4.2129 4.2334 4.2334 6.5695 6.5695 9.0394 9.0394 10.4195 10.4195 10.6751 10.6751 k = 0.0000 0.0000 0.0938 ( 5811 PWs) bands (ev): -46.0492 -46.0492 -46.0259 -46.0259 -25.6988 -25.6988 -18.1487 -18.1487 -18.0938 -18.0938 -17.9884 -17.9884 -17.9427 -17.9427 -17.9148 -17.9148 -17.8534 -17.8534 -9.4429 -9.4429 -9.2613 -9.2613 -9.1320 -9.1320 -9.0066 -9.0066 -8.3599 -8.3599 0.4861 0.4861 2.3230 2.3230 2.4407 2.4407 2.4863 2.4863 4.2058 4.2058 4.2367 4.2367 6.6025 6.6025 9.0596 9.0596 10.4213 10.4213 10.6483 10.6483 k = 0.0000 0.0000 0.1126 ( 5819 PWs) bands (ev): -46.0490 -46.0490 -46.0260 -46.0260 -25.6986 -25.6986 -18.1483 -18.1483 -18.0939 -18.0939 -17.9879 -17.9879 -17.9427 -17.9427 -17.9153 -17.9153 -17.8541 -17.8541 -9.4465 -9.4465 -9.2766 -9.2766 -9.1301 -9.1301 -8.9869 -8.9869 -8.3612 -8.3612 0.4919 0.4919 2.3202 2.3202 2.4171 2.4171 2.4804 2.4804 4.1970 4.1970 4.2408 4.2408 6.6421 6.6421 9.0841 9.0841 10.4236 10.4236 10.6170 10.6170 k = 0.0000 0.0000 0.1314 ( 5819 PWs) bands (ev): -46.0489 -46.0489 -46.0262 -46.0262 -25.6985 -25.6985 -18.1479 -18.1479 -18.0940 -18.0940 -17.9872 -17.9872 -17.9428 -17.9428 -17.9159 -17.9159 -17.8549 -17.8549 -9.4512 -9.4512 -9.2905 -9.2905 -9.1292 -9.1292 -8.9663 -8.9663 -8.3627 -8.3627 0.4986 0.4986 2.3169 2.3169 2.3902 2.3902 2.4738 2.4738 4.1868 4.1868 4.2455 4.2455 6.6877 6.6877 9.1128 9.1128 10.4264 10.4264 10.5820 10.5820 k = 0.0000 0.0000 0.1501 ( 5811 PWs) bands (ev): -46.0487 -46.0487 -46.0263 -46.0263 -25.6983 -25.6983 -18.1475 -18.1475 -18.0940 -18.0940 -17.9865 -17.9865 -17.9428 -17.9428 -17.9165 -17.9165 -17.8558 -17.8558 -9.4570 -9.4570 -9.3027 -9.3027 -9.1288 -9.1288 -8.9453 -8.9453 -8.3644 -8.3644 0.5063 0.5063 2.3132 2.3132 2.3605 2.3605 2.4662 2.4662 4.1750 4.1750 4.2508 4.2508 6.7389 6.7389 9.1456 9.1456 10.4297 10.4297 10.5440 10.5440 k = 0.0000 0.0000 0.1689 ( 5811 PWs) bands (ev): -46.0486 -46.0486 -46.0265 -46.0265 -25.6982 -25.6982 -18.1470 -18.1470 -18.0941 -18.0941 -17.9858 -17.9858 -17.9428 -17.9428 -17.9173 -17.9173 -17.8567 -17.8567 -9.4640 -9.4640 -9.3132 -9.3132 -9.1290 -9.1290 -8.9241 -8.9241 -8.3663 -8.3663 0.5149 0.5149 2.3086 2.3086 2.3288 2.3288 2.4579 2.4579 4.1618 4.1618 4.2566 4.2566 6.7951 6.7951 9.1824 9.1824 10.4337 10.4337 10.5039 10.5039 k = 0.0000 0.0000 0.1877 ( 5807 PWs) bands (ev): -46.0484 -46.0484 -46.0267 -46.0267 -25.6980 -25.6980 -18.1465 -18.1465 -18.0942 -18.0942 -17.9849 -17.9849 -17.9428 -17.9428 -17.9181 -17.9181 -17.8577 -17.8577 -9.4720 -9.4720 -9.3217 -9.3217 -9.1294 -9.1294 -8.9031 -8.9031 -8.3683 -8.3683 0.5243 0.5243 2.2927 2.2927 2.3061 2.3061 2.4489 2.4489 4.1473 4.1473 4.2629 4.2629 6.8558 6.8558 9.2229 9.2229 10.4383 10.4383 10.4624 10.4624 k = 0.0000 0.0000 0.2064 ( 5801 PWs) bands (ev): -46.0481 -46.0481 -46.0269 -46.0269 -25.6977 -25.6977 -18.1460 -18.1460 -18.0943 -18.0943 -17.9839 -17.9839 -17.9427 -17.9427 -17.9191 -17.9191 -17.8587 -17.8587 -9.4810 -9.4810 -9.3285 -9.3285 -9.1302 -9.1302 -8.8825 -8.8825 -8.3705 -8.3705 0.5345 0.5345 2.2581 2.2581 2.3004 2.3004 2.4391 2.4391 4.1315 4.1315 4.2694 4.2694 6.9205 6.9205 9.2670 9.2670 10.4202 10.4202 10.4437 10.4437 k = 0.0000 0.0000 0.2252 ( 5805 PWs) bands (ev): -46.0479 -46.0479 -46.0271 -46.0271 -25.6975 -25.6975 -18.1455 -18.1455 -18.0945 -18.0945 -17.9829 -17.9829 -17.9426 -17.9426 -17.9203 -17.9203 -17.8597 -17.8597 -9.4908 -9.4908 -9.3337 -9.3337 -9.1311 -9.1311 -8.8623 -8.8623 -8.3728 -8.3728 0.5454 0.5454 2.2218 2.2218 2.2951 2.2951 2.4288 2.4288 4.1145 4.1145 4.2761 4.2761 6.9887 6.9887 9.3146 9.3146 10.3781 10.3781 10.4498 10.4498 k = 0.0000 0.0000 0.2440 ( 5805 PWs) bands (ev): -46.0477 -46.0477 -46.0273 -46.0273 -25.6973 -25.6973 -18.1449 -18.1449 -18.0948 -18.0948 -17.9819 -17.9819 -17.9424 -17.9424 -17.9217 -17.9217 -17.8607 -17.8607 -9.5009 -9.5009 -9.3375 -9.3375 -9.1322 -9.1322 -8.8428 -8.8428 -8.3752 -8.3752 0.5570 0.5570 2.1849 2.1849 2.2895 2.2895 2.4178 2.4178 4.0963 4.0963 4.2829 4.2829 7.0597 7.0597 9.3653 9.3653 10.3366 10.3366 10.4569 10.4569 k = 0.0000 0.0000 0.2627 ( 5801 PWs) bands (ev): -46.0474 -46.0474 -46.0276 -46.0276 -25.6970 -25.6970 -18.1444 -18.1444 -18.0950 -18.0950 -17.9808 -17.9808 -17.9420 -17.9420 -17.9232 -17.9232 -17.8617 -17.8617 -9.5112 -9.5112 -9.3402 -9.3402 -9.1334 -9.1334 -8.8240 -8.8240 -8.3777 -8.3777 0.5692 0.5692 2.1479 2.1479 2.2837 2.2837 2.4064 2.4064 4.0770 4.0770 4.2898 4.2898 7.1332 7.1332 9.4191 9.4191 10.2962 10.2962 10.4649 10.4649 k = 0.0000 0.0000 0.2815 ( 5797 PWs) bands (ev): -46.0471 -46.0471 -46.0278 -46.0278 -25.6967 -25.6967 -18.1438 -18.1438 -18.0954 -18.0954 -17.9797 -17.9797 -17.9416 -17.9416 -17.9248 -17.9248 -17.8626 -17.8626 -9.5214 -9.5214 -9.3420 -9.3420 -9.1347 -9.1347 -8.8061 -8.8061 -8.3802 -8.3802 0.5820 0.5820 2.1113 2.1113 2.2776 2.2776 2.3945 2.3945 4.0568 4.0568 4.2966 4.2966 7.2085 7.2085 9.4756 9.4756 10.2575 10.2575 10.4739 10.4739 k = 0.0000 0.0000 0.3003 ( 5783 PWs) bands (ev): -46.0468 -46.0468 -46.0281 -46.0281 -25.6964 -25.6964 -18.1433 -18.1433 -18.0957 -18.0957 -17.9786 -17.9786 -17.9410 -17.9410 -17.9265 -17.9265 -17.8634 -17.8634 -9.5313 -9.5313 -9.3431 -9.3431 -9.1362 -9.1362 -8.7892 -8.7892 -8.3828 -8.3828 0.5952 0.5952 2.0753 2.0753 2.2713 2.2713 2.3823 2.3823 4.0357 4.0357 4.3032 4.3032 7.2853 7.2853 9.5346 9.5346 10.2208 10.2208 10.4840 10.4840 k = 0.0000 0.0000 0.3190 ( 5779 PWs) bands (ev): -46.0465 -46.0465 -46.0284 -46.0284 -25.6961 -25.6961 -18.1428 -18.1428 -18.0962 -18.0962 -17.9776 -17.9776 -17.9403 -17.9403 -17.9284 -17.9284 -17.8642 -17.8642 -9.5408 -9.5408 -9.3435 -9.3435 -9.1377 -9.1377 -8.7734 -8.7734 -8.3855 -8.3855 0.6088 0.6088 2.0403 2.0403 2.2649 2.2649 2.3698 2.3698 4.0137 4.0137 4.3095 4.3095 7.3630 7.3630 9.5959 9.5959 10.1866 10.1866 10.4952 10.4952 k = 0.0000 0.0000 0.3378 ( 5769 PWs) bands (ev): -46.0462 -46.0462 -46.0287 -46.0287 -25.6958 -25.6958 -18.1423 -18.1423 -18.0967 -18.0967 -17.9766 -17.9766 -17.9393 -17.9393 -17.9304 -17.9304 -17.8649 -17.8649 -9.5495 -9.5495 -9.3436 -9.3436 -9.1393 -9.1393 -8.7588 -8.7588 -8.3881 -8.3881 0.6228 0.6228 2.0066 2.0066 2.2582 2.2582 2.3571 2.3571 3.9910 3.9910 4.3155 4.3155 7.4411 7.4411 9.6591 9.6591 10.1552 10.1552 10.5077 10.5077 k = 0.0000 0.0000 0.3566 ( 5773 PWs) bands (ev): -46.0459 -46.0459 -46.0290 -46.0290 -25.6955 -25.6955 -18.1419 -18.1419 -18.0973 -18.0973 -17.9758 -17.9758 -17.9382 -17.9382 -17.9326 -17.9326 -17.8655 -17.8655 -9.5576 -9.5576 -9.3432 -9.3432 -9.1409 -9.1409 -8.7454 -8.7454 -8.3907 -8.3907 0.6370 0.6370 1.9744 1.9744 2.2514 2.2514 2.3442 2.3442 3.9677 3.9677 4.3210 4.3210 7.5194 7.5194 9.7239 9.7239 10.1268 10.1268 10.5215 10.5215 k = 0.0000 0.0000 0.3753 ( 5777 PWs) bands (ev): -46.0456 -46.0456 -46.0293 -46.0293 -25.6951 -25.6951 -18.1415 -18.1415 -18.0980 -18.0980 -17.9750 -17.9750 -17.9369 -17.9369 -17.9348 -17.9348 -17.8661 -17.8661 -9.5648 -9.5648 -9.3426 -9.3426 -9.1426 -9.1426 -8.7333 -8.7333 -8.3932 -8.3932 0.6515 0.6515 1.9439 1.9439 2.2446 2.2446 2.3312 2.3312 3.9438 3.9438 4.3259 4.3259 7.5973 7.5973 9.7901 9.7901 10.1018 10.1018 10.5366 10.5366 k = 0.0000 0.0000 0.3941 ( 5773 PWs) bands (ev): -46.0452 -46.0452 -46.0296 -46.0296 -25.6948 -25.6948 -18.1412 -18.1412 -18.0987 -18.0987 -17.9744 -17.9744 -17.9371 -17.9371 -17.9354 -17.9354 -17.8665 -17.8665 -9.5711 -9.5711 -9.3418 -9.3418 -9.1443 -9.1443 -8.7226 -8.7226 -8.3957 -8.3957 0.6661 0.6661 1.9154 1.9154 2.2376 2.2376 2.3181 2.3181 3.9195 3.9195 4.3302 4.3302 7.6744 7.6744 9.8574 9.8574 10.0803 10.0803 10.5531 10.5531 k = 0.0000 0.0000 0.4129 ( 5781 PWs) bands (ev): -46.0449 -46.0449 -46.0300 -46.0300 -25.6944 -25.6944 -18.1409 -18.1409 -18.0996 -18.0996 -17.9739 -17.9739 -17.9395 -17.9395 -17.9336 -17.9336 -17.8669 -17.8669 -9.5764 -9.5764 -9.3409 -9.3409 -9.1460 -9.1460 -8.7133 -8.7133 -8.3981 -8.3981 0.6809 0.6809 1.8889 1.8889 2.2306 2.2306 2.3051 2.3051 3.8948 3.8948 4.3339 4.3339 7.7505 7.7505 9.9254 9.9254 10.0625 10.0625 10.5710 10.5710 k = 0.0000 0.0000 0.4316 ( 5781 PWs) bands (ev): -46.0445 -46.0445 -46.0303 -46.0303 -25.6941 -25.6941 -18.1407 -18.1407 -18.1006 -18.1006 -17.9736 -17.9736 -17.9419 -17.9419 -17.9316 -17.9316 -17.8672 -17.8672 -9.5807 -9.5807 -9.3398 -9.3398 -9.1477 -9.1477 -8.7055 -8.7055 -8.4004 -8.4004 0.6958 0.6958 1.8645 1.8645 2.2236 2.2236 2.2921 2.2921 3.8699 3.8699 4.3368 4.3368 7.8252 7.8252 9.9938 9.9938 10.0486 10.0486 10.5903 10.5903 k = 0.0000 0.0000 0.4504 ( 5787 PWs) bands (ev): -46.0442 -46.0442 -46.0306 -46.0306 -25.6937 -25.6937 -18.1405 -18.1405 -18.1017 -18.1017 -17.9733 -17.9733 -17.9444 -17.9444 -17.9294 -17.9294 -17.8675 -17.8675 -9.5840 -9.5840 -9.3386 -9.3386 -9.1495 -9.1495 -8.6993 -8.6993 -8.4026 -8.4026 0.7108 0.7108 1.8424 1.8424 2.2165 2.2165 2.2793 2.2793 3.8448 3.8448 4.3389 4.3389 7.8982 7.8982 10.0385 10.0385 10.0623 10.0623 10.6111 10.6111 k = 0.0000 0.0000 0.4692 ( 5779 PWs) bands (ev): -46.0438 -46.0438 -46.0310 -46.0310 -25.6934 -25.6934 -18.1403 -18.1403 -18.1028 -18.1028 -17.9732 -17.9732 -17.9469 -17.9469 -17.9269 -17.9269 -17.8677 -17.8677 -9.5862 -9.5862 -9.3374 -9.3374 -9.1512 -9.1512 -8.6946 -8.6946 -8.4046 -8.4046 0.7258 0.7258 1.8224 1.8224 2.2095 2.2095 2.2666 2.2666 3.8196 3.8196 4.3403 4.3403 7.9693 7.9693 10.0324 10.0324 10.1305 10.1305 10.6332 10.6332 k = 0.0000 0.0000 0.4879 ( 5783 PWs) bands (ev): -46.0435 -46.0435 -46.0313 -46.0313 -25.6930 -25.6930 -18.1402 -18.1402 -18.1041 -18.1041 -17.9732 -17.9732 -17.9493 -17.9493 -17.9243 -17.9243 -17.8677 -17.8677 -9.5873 -9.5873 -9.3361 -9.3361 -9.1530 -9.1530 -8.6915 -8.6915 -8.4065 -8.4065 0.7409 0.7409 1.8046 1.8046 2.2026 2.2026 2.2541 2.2541 3.7944 3.7944 4.3407 4.3407 8.0381 8.0381 10.0299 10.0299 10.1981 10.1981 10.6568 10.6568 k = 0.0000 0.0000 0.5067 ( 5775 PWs) bands (ev): -46.0431 -46.0431 -46.0316 -46.0316 -25.6926 -25.6926 -18.1402 -18.1402 -18.1054 -18.1054 -17.9733 -17.9733 -17.9516 -17.9516 -17.9215 -17.9215 -17.8677 -17.8677 -9.5874 -9.5874 -9.3348 -9.3348 -9.1547 -9.1547 -8.6900 -8.6900 -8.4082 -8.4082 0.7561 0.7561 1.7890 1.7890 2.1957 2.1957 2.2419 2.2419 3.7693 3.7693 4.3404 4.3404 8.1047 8.1047 10.0311 10.0311 10.2647 10.2647 10.6816 10.6816 k = 0.0000 0.0000 0.5255 ( 5781 PWs) bands (ev): -46.0428 -46.0428 -46.0320 -46.0320 -25.6923 -25.6923 -18.1401 -18.1401 -18.1069 -18.1069 -17.9735 -17.9735 -17.9540 -17.9540 -17.9186 -17.9186 -17.8677 -17.8677 -9.5864 -9.5864 -9.3334 -9.3334 -9.1564 -9.1564 -8.6901 -8.6901 -8.4098 -8.4098 0.7715 0.7715 1.7754 1.7754 2.1889 2.1889 2.2300 2.2300 3.7444 3.7444 4.3392 4.3392 8.1688 8.1688 10.0354 10.0354 10.3301 10.3301 10.7076 10.7076 k = 0.0000 0.0000 0.5442 ( 5781 PWs) bands (ev): -46.0424 -46.0424 -46.0323 -46.0323 -25.6919 -25.6919 -18.1402 -18.1402 -18.1085 -18.1085 -17.9737 -17.9737 -17.9562 -17.9562 -17.9156 -17.9156 -17.8677 -17.8677 -9.5844 -9.5844 -9.3319 -9.3319 -9.1581 -9.1581 -8.6919 -8.6919 -8.4112 -8.4112 0.7869 0.7869 1.7636 1.7636 2.1822 2.1822 2.2184 2.2184 3.7197 3.7197 4.3372 4.3372 8.2304 8.2304 10.0426 10.0426 10.3940 10.3940 10.7347 10.7347 k = 0.0000 0.0000 0.5630 ( 5773 PWs) bands (ev): -46.0421 -46.0421 -46.0327 -46.0327 -25.6916 -25.6916 -18.1402 -18.1402 -18.1101 -18.1101 -17.9740 -17.9740 -17.9583 -17.9583 -17.9125 -17.9125 -17.8676 -17.8676 -9.5813 -9.5813 -9.3304 -9.3304 -9.1598 -9.1598 -8.6952 -8.6952 -8.4124 -8.4124 0.8025 0.8025 1.7537 1.7537 2.1756 2.1756 2.2071 2.2071 3.6954 3.6954 4.3345 4.3345 8.2894 8.2894 10.0520 10.0520 10.4561 10.4561 10.7627 10.7627 k = 0.0000 0.0000 0.5818 ( 5783 PWs) bands (ev): -46.0417 -46.0417 -46.0330 -46.0330 -25.6912 -25.6912 -18.1404 -18.1404 -18.1119 -18.1119 -17.9744 -17.9744 -17.9604 -17.9604 -17.9095 -17.9095 -17.8674 -17.8674 -9.5773 -9.5773 -9.3288 -9.3288 -9.1614 -9.1614 -8.7001 -8.7001 -8.4135 -8.4135 0.8183 0.8183 1.7453 1.7453 2.1692 2.1692 2.1962 2.1962 3.6715 3.6715 4.3309 4.3309 8.3460 8.3460 10.0629 10.0629 10.5162 10.5162 10.7915 10.7915 k = 0.0000 0.0000 0.6005 ( 5791 PWs) bands (ev): -46.0414 -46.0414 -46.0333 -46.0333 -25.6909 -25.6909 -18.1405 -18.1405 -18.1137 -18.1137 -17.9748 -17.9748 -17.9623 -17.9623 -17.9063 -17.9063 -17.8673 -17.8673 -9.5723 -9.5723 -9.3270 -9.3270 -9.1630 -9.1630 -8.7065 -8.7065 -8.4143 -8.4143 0.8342 0.8342 1.7384 1.7384 2.1630 2.1630 2.1858 2.1858 3.6481 3.6481 4.3266 4.3266 8.4002 8.4002 10.0744 10.0744 10.5739 10.5739 10.8207 10.8207 k = 0.0000 0.0000 0.6193 ( 5789 PWs) bands (ev): -46.0410 -46.0410 -46.0337 -46.0337 -25.6906 -25.6906 -18.1407 -18.1407 -18.1156 -18.1156 -17.9753 -17.9753 -17.9641 -17.9641 -17.9032 -17.9032 -17.8671 -17.8671 -9.5664 -9.5664 -9.3251 -9.3251 -9.1646 -9.1646 -8.7145 -8.7145 -8.4150 -8.4150 0.8504 0.8504 1.7328 1.7328 2.1569 2.1569 2.1757 2.1757 3.6253 3.6253 4.3218 4.3218 8.4520 8.4520 10.0856 10.0856 10.6292 10.6292 10.8501 10.8501 k = 0.0000 0.0000 0.6381 ( 5779 PWs) bands (ev): -46.0407 -46.0407 -46.0340 -46.0340 -25.6902 -25.6902 -18.1409 -18.1409 -18.1175 -18.1175 -17.9757 -17.9757 -17.9658 -17.9658 -17.9000 -17.9000 -17.8668 -17.8668 -9.5597 -9.5597 -9.3229 -9.3229 -9.1661 -9.1661 -8.7239 -8.7239 -8.4156 -8.4156 0.8669 0.8669 1.7282 1.7282 2.1509 2.1509 2.1662 2.1662 3.6032 3.6032 4.3163 4.3163 8.5015 8.5015 10.0954 10.0954 10.6819 10.6819 10.8794 10.8794 k = 0.0000 0.0000 0.6568 ( 5771 PWs) bands (ev): -46.0404 -46.0404 -46.0343 -46.0343 -25.6899 -25.6899 -18.1410 -18.1410 -18.1194 -18.1194 -17.9761 -17.9761 -17.9673 -17.9673 -17.8969 -17.8969 -17.8666 -17.8666 -9.5523 -9.5523 -9.3205 -9.3205 -9.1676 -9.1676 -8.7346 -8.7346 -8.4159 -8.4159 0.8835 0.8835 1.7245 1.7245 2.1451 2.1451 2.1572 2.1572 3.5817 3.5817 4.3104 4.3104 8.5489 8.5489 10.1029 10.1029 10.7319 10.7319 10.9081 10.9081 k = 0.0000 0.0000 0.6756 ( 5781 PWs) bands (ev): -46.0401 -46.0401 -46.0346 -46.0346 -25.6896 -25.6896 -18.1413 -18.1413 -18.1215 -18.1215 -17.9766 -17.9766 -17.9688 -17.9688 -17.8938 -17.8938 -17.8664 -17.8664 -9.5443 -9.5443 -9.3176 -9.3176 -9.1691 -9.1691 -8.7468 -8.7468 -8.4162 -8.4162 0.9003 0.9003 1.7214 1.7214 2.1394 2.1394 2.1488 2.1488 3.5611 3.5611 4.3041 4.3041 8.5941 8.5941 10.1073 10.1073 10.7790 10.7790 10.9360 10.9360 k = 0.0000 0.0000 0.6944 ( 5785 PWs) bands (ev): -46.0398 -46.0398 -46.0349 -46.0349 -25.6893 -25.6893 -18.1415 -18.1415 -18.1234 -18.1234 -17.9771 -17.9771 -17.9701 -17.9701 -17.8909 -17.8909 -17.8662 -17.8662 -9.5358 -9.5358 -9.3144 -9.3144 -9.1705 -9.1705 -8.7601 -8.7601 -8.4163 -8.4163 0.9173 0.9173 1.7189 1.7189 2.1337 2.1337 2.1412 2.1412 3.5412 3.5412 4.2974 4.2974 8.6373 8.6373 10.1082 10.1082 10.8233 10.8233 10.9623 10.9623 k = 0.0000 0.0000 0.7131 ( 5775 PWs) bands (ev): -46.0395 -46.0395 -46.0351 -46.0351 -25.6890 -25.6890 -18.1418 -18.1418 -18.1254 -18.1254 -17.9775 -17.9775 -17.9713 -17.9713 -17.8880 -17.8880 -17.8659 -17.8659 -9.5268 -9.5268 -9.3106 -9.3106 -9.1718 -9.1718 -8.7747 -8.7747 -8.4162 -8.4162 0.9345 0.9345 1.7168 1.7168 2.1277 2.1277 2.1345 2.1345 3.5223 3.5223 4.2906 4.2906 8.6784 8.6784 10.1056 10.1056 10.8646 10.8646 10.9644 10.9644 k = 0.0000 0.0000 0.7319 ( 5779 PWs) bands (ev): -46.0392 -46.0392 -46.0354 -46.0354 -25.6888 -25.6888 -18.1420 -18.1420 -18.1273 -18.1273 -17.9780 -17.9780 -17.9725 -17.9725 -17.8852 -17.8852 -17.8657 -17.8657 -9.5177 -9.5177 -9.3062 -9.3062 -9.1731 -9.1731 -8.7903 -8.7903 -8.4161 -8.4161 0.9516 0.9516 1.7149 1.7149 2.1216 2.1216 2.1288 2.1288 3.5044 3.5044 4.2836 4.2836 8.7173 8.7173 10.1002 10.1002 10.9029 10.9029 10.9569 10.9569 k = 0.0000 0.0000 0.7507 ( 5774 PWs) bands (ev): -46.0389 -46.0389 -46.0356 -46.0356 -25.6885 -25.6885 -18.1423 -18.1423 -18.1292 -18.1292 -17.9784 -17.9784 -17.9735 -17.9735 -17.8825 -17.8825 -17.8655 -17.8655 -9.5085 -9.5085 -9.3010 -9.3010 -9.1743 -9.1743 -8.8069 -8.8069 -8.4159 -8.4159 0.9686 0.9686 1.7132 1.7132 2.1154 2.1154 2.1238 2.1238 3.4874 3.4874 4.2766 4.2766 8.7539 8.7539 10.0929 10.0929 10.9379 10.9379 10.9553 10.9553 k = 0.0000 0.0000 0.7694 ( 5764 PWs) bands (ev): -46.0387 -46.0387 -46.0358 -46.0358 -25.6883 -25.6883 -18.1425 -18.1425 -18.1310 -18.1310 -17.9788 -17.9788 -17.9744 -17.9744 -17.8798 -17.8798 -17.8653 -17.8653 -9.4995 -9.4995 -9.2949 -9.2949 -9.1755 -9.1755 -8.8243 -8.8243 -8.4156 -8.4156 0.9855 0.9855 1.7115 1.7115 2.1094 2.1094 2.1195 2.1195 3.4716 3.4716 4.2696 4.2696 8.7880 8.7880 10.0849 10.0849 10.9556 10.9556 10.9721 10.9721 k = 0.0000 0.0000 0.7882 ( 5760 PWs) bands (ev): -46.0385 -46.0385 -46.0361 -46.0361 -25.6880 -25.6880 -18.1427 -18.1427 -18.1328 -18.1328 -17.9792 -17.9792 -17.9752 -17.9752 -17.8774 -17.8774 -17.8650 -17.8650 -9.4907 -9.4907 -9.2878 -9.2878 -9.1765 -9.1765 -8.8425 -8.8425 -8.4153 -8.4153 1.0020 1.0020 1.7098 1.7098 2.1038 2.1038 2.1156 2.1156 3.4568 3.4568 4.2628 4.2628 8.8194 8.8194 10.0776 10.0776 10.9601 10.9601 11.0014 11.0014 k = 0.0000 0.0000 0.8070 ( 5756 PWs) bands (ev): -46.0383 -46.0383 -46.0363 -46.0363 -25.6878 -25.6878 -18.1429 -18.1429 -18.1344 -18.1344 -17.9795 -17.9795 -17.9759 -17.9759 -17.8752 -17.8752 -17.8648 -17.8648 -9.4825 -9.4825 -9.2796 -9.2796 -9.1775 -9.1775 -8.8613 -8.8613 -8.4149 -8.4149 1.0181 1.0181 1.7080 1.7080 2.0986 2.0986 2.1121 2.1121 3.4432 3.4432 4.2563 4.2563 8.8478 8.8478 10.0722 10.0722 10.9645 10.9645 11.0281 11.0281 k = 0.0000 0.0000 0.8257 ( 5752 PWs) bands (ev): -46.0381 -46.0381 -46.0364 -46.0364 -25.6876 -25.6876 -18.1431 -18.1431 -18.1360 -18.1360 -17.9798 -17.9798 -17.9765 -17.9765 -17.8732 -17.8732 -17.8646 -17.8646 -9.4748 -9.4748 -9.2704 -9.2704 -9.1784 -9.1784 -8.8805 -8.8805 -8.4145 -8.4145 1.0334 1.0334 1.7061 1.7061 2.0939 2.0939 2.1089 2.1089 3.4307 3.4307 4.2500 4.2500 8.8732 8.8732 10.0694 10.0694 10.9678 10.9678 11.0518 11.0518 k = 0.0000 0.0000 0.8445 ( 5746 PWs) bands (ev): -46.0379 -46.0379 -46.0366 -46.0366 -25.6875 -25.6875 -18.1433 -18.1433 -18.1373 -18.1373 -17.9800 -17.9800 -17.9771 -17.9771 -17.8713 -17.8713 -17.8645 -17.8645 -9.4680 -9.4680 -9.2601 -9.2601 -9.1791 -9.1791 -8.9000 -8.9000 -8.4141 -8.4141 1.0480 1.0480 1.7041 1.7041 2.0896 2.0896 2.1061 2.1061 3.4195 3.4195 4.2443 4.2443 8.8953 8.8953 10.0699 10.0699 10.9685 10.9685 11.0721 11.0721 k = 0.0000 0.0000 0.8633 ( 5746 PWs) bands (ev): -46.0377 -46.0377 -46.0367 -46.0367 -25.6873 -25.6873 -18.1435 -18.1435 -18.1387 -18.1387 -17.9802 -17.9802 -17.9777 -17.9777 -17.8696 -17.8696 -17.8643 -17.8643 -9.4619 -9.4619 -9.2488 -9.2488 -9.1797 -9.1797 -8.9195 -8.9195 -8.4137 -8.4137 1.0615 1.0615 1.7022 1.7022 2.0859 2.0859 2.1036 2.1036 3.4095 3.4095 4.2389 4.2389 8.9141 8.9141 10.0739 10.0739 10.9661 10.9661 11.0881 11.0881 k = 0.0000 0.0000 0.8820 ( 5746 PWs) bands (ev): -46.0376 -46.0376 -46.0369 -46.0369 -25.6872 -25.6872 -18.1436 -18.1436 -18.1398 -18.1398 -17.9804 -17.9804 -17.9781 -17.9781 -17.8681 -17.8681 -17.8642 -17.8642 -9.4567 -9.4567 -9.2369 -9.2369 -9.1801 -9.1801 -8.9387 -8.9387 -8.4133 -8.4133 1.0737 1.0737 1.7002 1.7002 2.0826 2.0826 2.1014 2.1014 3.4008 3.4008 4.2342 4.2342 8.9296 8.9296 10.0810 10.0810 10.9602 10.9602 11.0986 11.0986 k = 0.0000 0.0000 0.9008 ( 5746 PWs) bands (ev): -46.0375 -46.0375 -46.0370 -46.0370 -25.6871 -25.6871 -18.1438 -18.1438 -18.1408 -18.1408 -17.9805 -17.9805 -17.9785 -17.9785 -17.8669 -17.8669 -17.8641 -17.8641 -9.4524 -9.4524 -9.2246 -9.2246 -9.1802 -9.1802 -8.9573 -8.9573 -8.4130 -8.4130 1.0845 1.0845 1.6984 1.6984 2.0798 2.0798 2.0995 2.0995 3.3934 3.3934 4.2301 4.2301 8.9421 8.9421 10.0905 10.0905 10.9514 10.9514 11.1047 11.1047 k = 0.0000 0.0000 0.9196 ( 5746 PWs) bands (ev): -46.0374 -46.0374 -46.0371 -46.0371 -25.6870 -25.6870 -18.1439 -18.1439 -18.1416 -18.1416 -17.9806 -17.9806 -17.9789 -17.9789 -17.8658 -17.8658 -17.8640 -17.8640 -9.4490 -9.4490 -9.2129 -9.2129 -9.1798 -9.1798 -8.9748 -8.9748 -8.4127 -8.4127 1.0936 1.0936 1.6967 1.6967 2.0776 2.0776 2.0980 2.0980 3.3873 3.3873 4.2266 4.2266 8.9518 8.9518 10.1013 10.1013 10.9408 10.9408 11.1086 11.1086 k = 0.0000 0.0000 0.9383 ( 5748 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6869 -25.6869 -18.1439 -18.1439 -18.1423 -18.1423 -17.9807 -17.9807 -17.9792 -17.9792 -17.8650 -17.8650 -17.8639 -17.8639 -9.4464 -9.4464 -9.2026 -9.2026 -9.1785 -9.1785 -8.9904 -8.9904 -8.4125 -8.4125 1.1009 1.1009 1.6953 1.6953 2.0758 2.0758 2.0969 2.0969 3.3826 3.3826 4.2239 4.2239 8.9589 8.9589 10.1121 10.1121 10.9298 10.9298 11.1111 11.1111 k = 0.0000 0.0000 0.9571 ( 5748 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1427 -18.1427 -17.9807 -17.9807 -17.9794 -17.9794 -17.8644 -17.8644 -17.8639 -17.8639 -9.4445 -9.4445 -9.1955 -9.1955 -9.1758 -9.1758 -9.0031 -9.0031 -8.4123 -8.4123 1.1063 1.1063 1.6942 1.6942 2.0746 2.0746 2.0960 2.0960 3.3791 3.3791 4.2219 4.2219 8.9637 8.9637 10.1213 10.1213 10.9202 10.9202 11.1128 11.1128 k = 0.0000 0.0000 0.9759 ( 5744 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1430 -18.1430 -17.9807 -17.9807 -17.9795 -17.9795 -17.8641 -17.8641 -17.8638 -17.8638 -9.4434 -9.4434 -9.1921 -9.1921 -9.1725 -9.1725 -9.0115 -9.0115 -8.4122 -8.4122 1.1095 1.1095 1.6936 1.6936 2.0738 2.0738 2.0955 2.0955 3.3771 3.3771 4.2207 4.2207 8.9665 8.9665 10.1275 10.1275 10.9136 10.9136 11.1137 11.1137 k = 0.0000 0.0000 0.9946 ( 5746 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1911 -9.1911 -9.1711 -9.1711 -9.0145 -9.0145 -8.4121 -8.4121 1.1106 1.1106 1.6934 1.6934 2.0736 2.0736 2.0954 2.0954 3.3764 3.3764 4.2203 4.2203 8.9674 8.9674 10.1297 10.1297 10.9112 10.9112 11.1140 11.1140 k = 0.0000 0.0000 0.9946 ( 5746 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1911 -9.1911 -9.1711 -9.1711 -9.0145 -9.0145 -8.4121 -8.4121 1.1106 1.1106 1.6934 1.6934 2.0736 2.0736 2.0954 2.0954 3.3764 3.3764 4.2203 4.2203 8.9674 8.9674 10.1297 10.1297 10.9112 10.9112 11.1140 11.1140 k =-0.0094 0.0162 0.9946 ( 5746 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1439 -18.1439 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8639 -17.8639 -9.4434 -9.4434 -9.1916 -9.1916 -9.1730 -9.1730 -9.0116 -9.0116 -8.4123 -8.4123 1.1108 1.1108 1.6938 1.6938 2.0727 2.0727 2.0943 2.0943 3.3782 3.3782 4.2206 4.2206 8.9693 8.9693 10.1302 10.1302 10.9089 10.9089 11.1138 11.1138 k =-0.0188 0.0323 0.9946 ( 5742 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1437 -18.1437 -18.1430 -18.1430 -17.9807 -17.9807 -17.9794 -17.9794 -17.8643 -17.8643 -17.8640 -17.8640 -9.4444 -9.4444 -9.1936 -9.1936 -9.1776 -9.1776 -9.0032 -9.0032 -8.4126 -8.4126 1.1112 1.1112 1.6951 1.6951 2.0702 2.0702 2.0910 2.0910 3.3833 3.3833 4.2216 4.2216 8.9750 8.9750 10.1317 10.1317 10.9018 10.9018 11.1132 11.1132 k =-0.0282 0.0485 0.9946 ( 5750 PWs) bands (ev): -46.0373 -46.0373 -46.0371 -46.0371 -25.6869 -25.6869 -18.1435 -18.1435 -18.1427 -18.1427 -17.9807 -17.9807 -17.9792 -17.9792 -17.8649 -17.8649 -17.8640 -17.8640 -9.4460 -9.4460 -9.1989 -9.1989 -9.1818 -9.1818 -8.9907 -8.9907 -8.4132 -8.4132 1.1120 1.1120 1.6973 1.6973 2.0661 2.0661 2.0857 2.0857 3.3919 3.3919 4.2231 4.2231 8.9843 8.9843 10.1342 10.1342 10.8895 10.8895 11.1102 11.1102 k =-0.0376 0.0646 0.9946 ( 5756 PWs) bands (ev): -46.0374 -46.0374 -46.0371 -46.0371 -25.6870 -25.6870 -18.1433 -18.1433 -18.1422 -18.1422 -17.9806 -17.9806 -17.9789 -17.9789 -17.8658 -17.8658 -17.8641 -17.8641 -9.4484 -9.4484 -9.2082 -9.2082 -9.1838 -9.1838 -8.9752 -8.9752 -8.4140 -8.4140 1.1130 1.1130 1.7003 1.7003 2.0605 2.0605 2.0784 2.0784 3.4037 3.4037 4.2253 4.2253 8.9971 8.9971 10.1377 10.1377 10.8716 10.8716 11.0977 11.0977 k =-0.0470 0.0808 0.9946 ( 5764 PWs) bands (ev): -46.0375 -46.0375 -46.0370 -46.0370 -25.6871 -25.6871 -18.1431 -18.1431 -18.1415 -18.1415 -17.9805 -17.9805 -17.9786 -17.9786 -17.8668 -17.8668 -17.8642 -17.8642 -9.4514 -9.4514 -9.2196 -9.2196 -9.1845 -9.1845 -8.9578 -8.9578 -8.4150 -8.4150 1.1142 1.1142 1.7042 1.7042 2.0535 2.0535 2.0693 2.0693 3.4187 3.4187 4.2280 4.2280 9.0130 9.0130 10.1421 10.1421 10.8474 10.8474 11.0755 11.0755 k =-0.0564 0.0969 0.9946 ( 5760 PWs) bands (ev): -46.0376 -46.0376 -46.0369 -46.0369 -25.6872 -25.6872 -18.1430 -18.1430 -18.1405 -18.1405 -17.9804 -17.9804 -17.9782 -17.9782 -17.8680 -17.8680 -17.8643 -17.8643 -9.4552 -9.4552 -9.2316 -9.2316 -9.1846 -9.1846 -8.9392 -8.9392 -8.4163 -8.4163 1.1157 1.1157 1.7089 1.7089 2.0451 2.0451 2.0584 2.0584 3.4367 3.4367 4.2314 4.2314 9.0319 9.0319 10.1475 10.1475 10.8160 10.8160 11.0512 11.0512 k =-0.0658 0.1131 0.9946 ( 5758 PWs) bands (ev): -46.0378 -46.0378 -46.0367 -46.0367 -25.6873 -25.6873 -18.1428 -18.1428 -18.1394 -18.1394 -17.9802 -17.9802 -17.9778 -17.9778 -17.8695 -17.8695 -17.8645 -17.8645 -9.4598 -9.4598 -9.2435 -9.2435 -9.1844 -9.1844 -8.9199 -8.9199 -8.4177 -8.4177 1.1174 1.1174 1.7145 1.7145 2.0356 2.0356 2.0461 2.0461 3.4575 3.4575 4.2354 4.2354 9.0532 9.0532 10.1537 10.1537 10.7769 10.7769 11.0279 11.0279 k =-0.0751 0.1292 0.9946 ( 5750 PWs) bands (ev): -46.0379 -46.0379 -46.0366 -46.0366 -25.6875 -25.6875 -18.1426 -18.1426 -18.1381 -18.1381 -17.9799 -17.9799 -17.9773 -17.9773 -17.8711 -17.8711 -17.8646 -17.8646 -9.4650 -9.4650 -9.2548 -9.2548 -9.1841 -9.1841 -8.9002 -8.9002 -8.4192 -8.4192 1.1193 1.1193 1.7210 1.7210 2.0249 2.0249 2.0326 2.0326 3.4808 3.4808 4.2399 4.2399 9.0765 9.0765 10.1608 10.1608 10.7301 10.7301 11.0073 11.0073 k =-0.0845 0.1454 0.9946 ( 5742 PWs) bands (ev): -46.0381 -46.0381 -46.0364 -46.0364 -25.6876 -25.6876 -18.1424 -18.1424 -18.1366 -18.1366 -17.9796 -17.9796 -17.9767 -17.9767 -17.8729 -17.8729 -17.8648 -17.8648 -9.4710 -9.4710 -9.2653 -9.2653 -9.1836 -9.1836 -8.8805 -8.8805 -8.4209 -8.4209 1.1213 1.1213 1.7282 1.7282 2.0124 2.0124 2.0190 2.0190 3.5066 3.5066 4.2450 4.2450 9.1014 9.1014 10.1687 10.1687 10.6763 10.6763 10.9901 10.9901 k =-0.0845 0.1454 0.9946 ( 5742 PWs) bands (ev): -46.0381 -46.0381 -46.0364 -46.0364 -25.6876 -25.6876 -18.1424 -18.1424 -18.1366 -18.1366 -17.9796 -17.9796 -17.9767 -17.9767 -17.8729 -17.8729 -17.8648 -17.8648 -9.4710 -9.4710 -9.2653 -9.2653 -9.1836 -9.1836 -8.8805 -8.8805 -8.4209 -8.4209 1.1213 1.1213 1.7282 1.7282 2.0124 2.0124 2.0190 2.0190 3.5066 3.5066 4.2450 4.2450 9.1014 9.1014 10.1687 10.1687 10.6763 10.6763 10.9901 10.9901 k =-0.0912 0.1569 0.9813 ( 5751 PWs) bands (ev): -46.0382 -46.0382 -46.0363 -46.0363 -25.6878 -25.6878 -18.1423 -18.1423 -18.1355 -18.1355 -17.9793 -17.9793 -17.9762 -17.9762 -17.8744 -17.8744 -17.8650 -17.8650 -9.4759 -9.4759 -9.2726 -9.2726 -9.1830 -9.1830 -8.8659 -8.8659 -8.4222 -8.4222 1.1223 1.1223 1.7338 1.7338 2.0021 2.0021 2.0100 2.0100 3.5265 3.5265 4.2491 4.2491 9.1193 9.1193 10.1720 10.1720 10.6374 10.6374 10.9792 10.9792 k =-0.0979 0.1684 0.9680 ( 5751 PWs) bands (ev): -46.0383 -46.0383 -46.0362 -46.0362 -25.6879 -25.6879 -18.1420 -18.1420 -18.1344 -18.1344 -17.9790 -17.9790 -17.9757 -17.9757 -17.8760 -17.8760 -17.8653 -17.8653 -9.4818 -9.4818 -9.2799 -9.2799 -9.1818 -9.1818 -8.8504 -8.8504 -8.4236 -8.4236 1.1222 1.1222 1.7393 1.7393 1.9910 1.9910 2.0024 2.0024 3.5480 3.5480 4.2540 4.2540 9.1366 9.1366 10.1688 10.1688 10.6038 10.6038 10.9679 10.9679 k =-0.1046 0.1799 0.9546 ( 5753 PWs) bands (ev): -46.0384 -46.0384 -46.0361 -46.0361 -25.6881 -25.6881 -18.1416 -18.1416 -18.1331 -18.1331 -17.9787 -17.9787 -17.9751 -17.9751 -17.8776 -17.8776 -17.8657 -17.8657 -9.4886 -9.4886 -9.2871 -9.2871 -9.1803 -9.1803 -8.8344 -8.8344 -8.4250 -8.4250 1.1211 1.1211 1.7446 1.7446 1.9793 1.9793 1.9961 1.9961 3.5708 3.5708 4.2596 4.2596 9.1531 9.1531 10.1575 10.1575 10.5776 10.5776 10.9557 10.9557 k =-0.1113 0.1915 0.9413 ( 5751 PWs) bands (ev): -46.0386 -46.0386 -46.0360 -46.0360 -25.6883 -25.6883 -18.1412 -18.1412 -18.1318 -18.1318 -17.9783 -17.9783 -17.9744 -17.9744 -17.8794 -17.8794 -17.8663 -17.8663 -9.4964 -9.4964 -9.2938 -9.2938 -9.1783 -9.1783 -8.8180 -8.8180 -8.4266 -8.4266 1.1191 1.1191 1.7491 1.7491 1.9673 1.9673 1.9914 1.9914 3.5948 3.5948 4.2660 4.2660 9.1686 9.1686 10.1374 10.1374 10.5598 10.5598 10.9420 10.9420 k =-0.1180 0.2030 0.9280 ( 5753 PWs) bands (ev): -46.0387 -46.0387 -46.0359 -46.0359 -25.6885 -25.6885 -18.1406 -18.1406 -18.1305 -18.1305 -17.9779 -17.9779 -17.9737 -17.9737 -17.8812 -17.8812 -17.8670 -17.8670 -9.5050 -9.5050 -9.2999 -9.2999 -9.1760 -9.1760 -8.8013 -8.8013 -8.4282 -8.4282 1.1160 1.1160 1.7527 1.7527 1.9552 1.9552 1.9886 1.9886 3.6198 3.6198 4.2730 4.2730 9.1827 9.1827 10.1090 10.1090 10.5499 10.5499 10.9263 10.9263 k =-0.1247 0.2145 0.9146 ( 5753 PWs) bands (ev): -46.0388 -46.0388 -46.0357 -46.0357 -25.6887 -25.6887 -18.1400 -18.1400 -18.1291 -18.1291 -17.9774 -17.9774 -17.9729 -17.9729 -17.8831 -17.8831 -17.8678 -17.8678 -9.5145 -9.5145 -9.3054 -9.3054 -9.1734 -9.1734 -8.7845 -8.7845 -8.4298 -8.4298 1.1121 1.1121 1.7549 1.7549 1.9430 1.9430 1.9879 1.9879 3.6457 3.6457 4.2808 4.2808 9.1951 9.1951 10.0743 10.0743 10.5464 10.5464 10.9080 10.9080 k =-0.1314 0.2260 0.9013 ( 5754 PWs) bands (ev): -46.0389 -46.0389 -46.0356 -46.0356 -25.6889 -25.6889 -18.1393 -18.1393 -18.1277 -18.1277 -17.9769 -17.9769 -17.9720 -17.9720 -17.8851 -17.8851 -17.8687 -17.8687 -9.5247 -9.5247 -9.3103 -9.3103 -9.1704 -9.1704 -8.7678 -8.7678 -8.4315 -8.4315 1.1073 1.1073 1.7555 1.7555 1.9309 1.9309 1.9896 1.9896 3.6722 3.6722 4.2894 4.2894 9.2054 9.2054 10.0356 10.0356 10.5468 10.5468 10.8870 10.8870 k =-0.1381 0.2376 0.8880 ( 5752 PWs) bands (ev): -46.0390 -46.0390 -46.0355 -46.0355 -25.6892 -25.6892 -18.1385 -18.1385 -18.1263 -18.1263 -17.9763 -17.9763 -17.9710 -17.9710 -17.8871 -17.8871 -17.8698 -17.8698 -9.5355 -9.5355 -9.3145 -9.3145 -9.1672 -9.1672 -8.7512 -8.7512 -8.4333 -8.4333 1.1017 1.1017 1.7545 1.7545 1.9188 1.9188 1.9937 1.9937 3.6991 3.6991 4.2988 4.2988 9.2132 9.2132 9.9953 9.9953 10.5488 10.5488 10.8409 10.8409 k =-0.1448 0.2491 0.8747 ( 5754 PWs) bands (ev): -46.0392 -46.0392 -46.0354 -46.0354 -25.6894 -25.6894 -18.1377 -18.1377 -18.1249 -18.1249 -17.9757 -17.9757 -17.9700 -17.9700 -17.8893 -17.8893 -17.8709 -17.8709 -9.5467 -9.5467 -9.3182 -9.3182 -9.1637 -9.1637 -8.7349 -8.7349 -8.4350 -8.4350 1.0953 1.0953 1.7518 1.7518 1.9069 1.9069 2.0001 2.0001 3.7263 3.7263 4.3089 4.3089 9.2180 9.2180 9.9551 9.9551 10.5503 10.5503 10.7829 10.7829 k =-0.1516 0.2606 0.8613 ( 5764 PWs) bands (ev): -46.0393 -46.0393 -46.0353 -46.0353 -25.6897 -25.6897 -18.1369 -18.1369 -18.1234 -18.1234 -17.9750 -17.9750 -17.9689 -17.9689 -17.8915 -17.8915 -17.8723 -17.8723 -9.5582 -9.5582 -9.3214 -9.3214 -9.1600 -9.1600 -8.7188 -8.7188 -8.4368 -8.4368 1.0883 1.0883 1.7478 1.7478 1.8952 1.8952 2.0088 2.0088 3.7534 3.7534 4.3198 4.3198 9.2192 9.2192 9.9168 9.9168 10.5489 10.5489 10.7235 10.7235 k =-0.1583 0.2721 0.8480 ( 5760 PWs) bands (ev): -46.0394 -46.0394 -46.0352 -46.0352 -25.6899 -25.6899 -18.1360 -18.1360 -18.1220 -18.1220 -17.9742 -17.9742 -17.9677 -17.9677 -17.8938 -17.8938 -17.8736 -17.8736 -9.5699 -9.5699 -9.3242 -9.3242 -9.1561 -9.1561 -8.7032 -8.7032 -8.4385 -8.4385 1.0807 1.0807 1.7425 1.7425 1.8838 1.8838 2.0192 2.0192 3.7805 3.7805 4.3316 4.3316 9.2165 9.2165 9.8814 9.8814 10.5426 10.5426 10.6630 10.6630 k =-0.1650 0.2837 0.8347 ( 5754 PWs) bands (ev): -46.0395 -46.0395 -46.0352 -46.0352 -25.6902 -25.6902 -18.1350 -18.1350 -18.1205 -18.1205 -17.9734 -17.9734 -17.9664 -17.9664 -17.8962 -17.8962 -17.8750 -17.8750 -9.5816 -9.5816 -9.3266 -9.3266 -9.1521 -9.1521 -8.6879 -8.6879 -8.4403 -8.4403 1.0725 1.0725 1.7365 1.7365 1.8727 1.8727 2.0312 2.0312 3.8071 3.8071 4.3441 4.3441 9.2096 9.2096 9.8500 9.8500 10.5295 10.5295 10.6021 10.6021 k =-0.1717 0.2952 0.8213 ( 5760 PWs) bands (ev): -46.0396 -46.0396 -46.0351 -46.0351 -25.6904 -25.6904 -18.1340 -18.1340 -18.1191 -18.1191 -17.9726 -17.9726 -17.9650 -17.9650 -17.8986 -17.8986 -17.8766 -17.8766 -9.5932 -9.5932 -9.3287 -9.3287 -9.1479 -9.1479 -8.6732 -8.6732 -8.4420 -8.4420 1.0639 1.0639 1.7298 1.7298 1.8619 1.8619 2.0443 2.0443 3.8331 3.8331 4.3574 4.3574 9.1983 9.1983 9.8229 9.8229 10.5085 10.5085 10.5411 10.5411 k =-0.1784 0.3067 0.8080 ( 5758 PWs) bands (ev): -46.0397 -46.0397 -46.0350 -46.0350 -25.6907 -25.6907 -18.1330 -18.1330 -18.1178 -18.1178 -17.9716 -17.9716 -17.9635 -17.9635 -17.9010 -17.9010 -17.8783 -17.8783 -9.6046 -9.6046 -9.3306 -9.3306 -9.1437 -9.1437 -8.6591 -8.6591 -8.4437 -8.4437 1.0550 1.0550 1.7227 1.7227 1.8515 1.8515 2.0583 2.0583 3.8582 3.8582 4.3714 4.3714 9.1828 9.1828 9.8005 9.8005 10.4785 10.4785 10.4822 10.4822 k =-0.1851 0.3182 0.7947 ( 5754 PWs) bands (ev): -46.0397 -46.0397 -46.0349 -46.0349 -25.6909 -25.6909 -18.1320 -18.1320 -18.1164 -18.1164 -17.9706 -17.9706 -17.9620 -17.9620 -17.9035 -17.9035 -17.8800 -17.8800 -9.6157 -9.6157 -9.3322 -9.3322 -9.1394 -9.1394 -8.6455 -8.6455 -8.4453 -8.4453 1.0459 1.0459 1.7156 1.7156 1.8415 1.8415 2.0729 2.0729 3.8824 3.8824 4.3862 4.3862 9.1635 9.1635 9.7826 9.7826 10.4200 10.4200 10.4470 10.4470 k =-0.1918 0.3298 0.7813 ( 5754 PWs) bands (ev): -46.0398 -46.0398 -46.0348 -46.0348 -25.6912 -25.6912 -18.1309 -18.1309 -18.1151 -18.1151 -17.9695 -17.9695 -17.9604 -17.9604 -17.9060 -17.9060 -17.8819 -17.8819 -9.6265 -9.6265 -9.3337 -9.3337 -9.1351 -9.1351 -8.6326 -8.6326 -8.4469 -8.4469 1.0366 1.0366 1.7084 1.7084 1.8319 1.8319 2.0877 2.0877 3.9054 3.9054 4.4015 4.4015 9.1409 9.1409 9.7688 9.7688 10.3611 10.3611 10.4098 10.4098 k =-0.1985 0.3413 0.7680 ( 5755 PWs) bands (ev): -46.0399 -46.0399 -46.0348 -46.0348 -25.6914 -25.6914 -18.1299 -18.1299 -18.1139 -18.1139 -17.9684 -17.9684 -17.9587 -17.9587 -17.9085 -17.9085 -17.8838 -17.8838 -9.6368 -9.6368 -9.3350 -9.3350 -9.1309 -9.1309 -8.6204 -8.6204 -8.4485 -8.4485 1.0273 1.0273 1.7015 1.7015 1.8229 1.8229 2.1027 2.1027 3.9272 3.9272 4.4173 4.4173 9.1158 9.1158 9.7585 9.7585 10.3037 10.3037 10.3711 10.3711 k =-0.2052 0.3528 0.7547 ( 5757 PWs) bands (ev): -46.0400 -46.0400 -46.0347 -46.0347 -25.6916 -25.6916 -18.1289 -18.1289 -18.1127 -18.1127 -17.9672 -17.9672 -17.9570 -17.9570 -17.9111 -17.9111 -17.8858 -17.8858 -9.6467 -9.6467 -9.3361 -9.3361 -9.1267 -9.1267 -8.6088 -8.6088 -8.4499 -8.4499 1.0180 1.0180 1.6948 1.6948 1.8143 1.8143 2.1175 2.1175 3.9474 3.9474 4.4335 4.4335 9.0891 9.0891 9.7510 9.7510 10.2482 10.2482 10.3321 10.3321 k =-0.2119 0.3643 0.7414 ( 5763 PWs) bands (ev): -46.0401 -46.0401 -46.0346 -46.0346 -25.6919 -25.6919 -18.1279 -18.1279 -18.1116 -18.1116 -17.9659 -17.9659 -17.9552 -17.9552 -17.9137 -17.9137 -17.8878 -17.8878 -9.6560 -9.6560 -9.3372 -9.3372 -9.1227 -9.1227 -8.5981 -8.5981 -8.4513 -8.4513 1.0090 1.0090 1.6884 1.6884 1.8063 1.8063 2.1319 2.1319 3.9662 3.9662 4.4499 4.4499 9.0616 9.0616 9.7456 9.7456 10.1949 10.1949 10.2940 10.2940 k =-0.2186 0.3758 0.7280 ( 5764 PWs) bands (ev): -46.0401 -46.0401 -46.0346 -46.0346 -25.6921 -25.6921 -18.1270 -18.1270 -18.1106 -18.1106 -17.9646 -17.9646 -17.9533 -17.9533 -17.9163 -17.9163 -17.8899 -17.8899 -9.6647 -9.6647 -9.3382 -9.3382 -9.1188 -9.1188 -8.5881 -8.5881 -8.4526 -8.4526 1.0002 1.0002 1.6825 1.6825 1.7989 1.7989 2.1459 2.1459 3.9834 3.9834 4.4662 4.4662 9.0340 9.0340 9.7418 9.7418 10.1443 10.1443 10.2576 10.2576 k =-0.2253 0.3874 0.7147 ( 5763 PWs) bands (ev): -46.0402 -46.0402 -46.0345 -46.0345 -25.6923 -25.6923 -18.1261 -18.1261 -18.1096 -18.1096 -17.9631 -17.9631 -17.9514 -17.9514 -17.9188 -17.9188 -17.8920 -17.8920 -9.6728 -9.6728 -9.3390 -9.3390 -9.1151 -9.1151 -8.5789 -8.5789 -8.4538 -8.4538 0.9918 0.9918 1.6770 1.6770 1.7920 1.7920 2.1592 2.1592 3.9990 3.9990 4.4823 4.4823 9.0070 9.0070 9.7390 9.7390 10.0967 10.0967 10.2234 10.2234 k =-0.2320 0.3989 0.7014 ( 5767 PWs) bands (ev): -46.0403 -46.0403 -46.0345 -46.0345 -25.6925 -25.6925 -18.1252 -18.1252 -18.1088 -18.1088 -17.9616 -17.9616 -17.9496 -17.9496 -17.9214 -17.9214 -17.8942 -17.8942 -9.6802 -9.6802 -9.3398 -9.3398 -9.1116 -9.1116 -8.5705 -8.5705 -8.4549 -8.4549 0.9839 0.9839 1.6720 1.6720 1.7857 1.7857 2.1716 2.1716 4.0130 4.0130 4.4979 4.4979 8.9811 8.9811 9.7368 9.7368 10.0524 10.0524 10.1920 10.1920 k =-0.2387 0.4104 0.6880 ( 5771 PWs) bands (ev): -46.0403 -46.0403 -46.0344 -46.0344 -25.6926 -25.6926 -18.1244 -18.1244 -18.1080 -18.1080 -17.9600 -17.9600 -17.9476 -17.9476 -17.9239 -17.9239 -17.8963 -17.8963 -9.6869 -9.6869 -9.3405 -9.3405 -9.1084 -9.1084 -8.5629 -8.5629 -8.4559 -8.4559 0.9765 0.9765 1.6675 1.6675 1.7801 1.7801 2.1832 2.1832 4.0254 4.0254 4.5127 4.5127 8.9568 8.9568 9.7350 9.7350 10.0118 10.0118 10.1637 10.1637 k =-0.2454 0.4219 0.6747 ( 5768 PWs) bands (ev): -46.0403 -46.0403 -46.0344 -46.0344 -25.6928 -25.6928 -18.1237 -18.1237 -18.1073 -18.1073 -17.9584 -17.9584 -17.9457 -17.9457 -17.9264 -17.9264 -17.8983 -17.8983 -9.6929 -9.6929 -9.3411 -9.3411 -9.1055 -9.1055 -8.5563 -8.5563 -8.4568 -8.4568 0.9698 0.9698 1.6635 1.6635 1.7750 1.7750 2.1937 2.1937 4.0362 4.0362 4.5266 4.5266 8.9346 8.9346 9.7333 9.7333 9.9752 9.9752 10.1387 10.1387 k =-0.2521 0.4335 0.6614 ( 5763 PWs) bands (ev): -46.0404 -46.0404 -46.0344 -46.0344 -25.6929 -25.6929 -18.1231 -18.1231 -18.1066 -18.1066 -17.9566 -17.9566 -17.9439 -17.9439 -17.9289 -17.9289 -17.9003 -17.9003 -9.6981 -9.6981 -9.3416 -9.3416 -9.1030 -9.1030 -8.5504 -8.5504 -8.4576 -8.4576 0.9638 0.9638 1.6601 1.6601 1.7706 1.7706 2.2030 2.2030 4.0455 4.0455 4.5391 4.5391 8.9147 8.9147 9.7317 9.7317 9.9429 9.9429 10.1171 10.1171 k =-0.2588 0.4450 0.6481 ( 5768 PWs) bands (ev): -46.0404 -46.0404 -46.0343 -46.0343 -25.6930 -25.6930 -18.1225 -18.1225 -18.1061 -18.1061 -17.9549 -17.9549 -17.9422 -17.9422 -17.9313 -17.9313 -17.9022 -17.9022 -9.7026 -9.7026 -9.3421 -9.3421 -9.1007 -9.1007 -8.5455 -8.5455 -8.4582 -8.4582 0.9586 0.9586 1.6571 1.6571 1.7669 1.7669 2.2110 2.2110 4.0533 4.0533 4.5502 4.5502 8.8974 8.8974 9.7301 9.7301 9.9150 9.9150 10.0990 10.0990 k =-0.2655 0.4565 0.6347 ( 5762 PWs) bands (ev): -46.0404 -46.0404 -46.0343 -46.0343 -25.6931 -25.6931 -18.1220 -18.1220 -18.1057 -18.1057 -17.9531 -17.9531 -17.9407 -17.9407 -17.9335 -17.9335 -17.9039 -17.9039 -9.7063 -9.7063 -9.3424 -9.3424 -9.0989 -9.0989 -8.5415 -8.5415 -8.4587 -8.4587 0.9543 0.9543 1.6547 1.6547 1.7638 1.7638 2.2177 2.2177 4.0597 4.0597 4.5596 4.5596 8.8829 8.8829 9.7286 9.7286 9.8920 9.8920 10.0844 10.0844 k =-0.2722 0.4680 0.6214 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6932 -25.6932 -18.1217 -18.1217 -18.1053 -18.1053 -17.9513 -17.9513 -17.9396 -17.9396 -17.9354 -17.9354 -17.9054 -17.9054 -9.7091 -9.7091 -9.3427 -9.3427 -9.0974 -9.0974 -8.5383 -8.5383 -8.4592 -8.4592 0.9509 0.9509 1.6529 1.6529 1.7614 1.7614 2.2230 2.2230 4.0645 4.0645 4.5671 4.5671 8.8715 8.8715 9.7272 9.7272 9.8738 9.8738 10.0732 10.0732 k =-0.2789 0.4796 0.6081 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6932 -25.6932 -18.1214 -18.1214 -18.1051 -18.1051 -17.9495 -17.9495 -17.9396 -17.9396 -17.9364 -17.9364 -17.9065 -17.9065 -9.7112 -9.7112 -9.3429 -9.3429 -9.0964 -9.0964 -8.5361 -8.5361 -8.4595 -8.4595 0.9484 0.9484 1.6516 1.6516 1.7597 1.7597 2.2268 2.2268 4.0680 4.0680 4.5726 4.5726 8.8633 8.8633 9.7262 9.7262 9.8607 9.8607 10.0653 10.0653 k =-0.2856 0.4911 0.5947 ( 5770 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6933 -25.6933 -18.1212 -18.1212 -18.1050 -18.1050 -17.9481 -17.9481 -17.9405 -17.9405 -17.9364 -17.9364 -17.9073 -17.9073 -9.7124 -9.7124 -9.3431 -9.3431 -9.0957 -9.0957 -8.5347 -8.5347 -8.4596 -8.4596 0.9469 0.9469 1.6508 1.6508 1.7587 1.7587 2.2291 2.2291 4.0701 4.0701 4.5759 4.5759 8.8583 8.8583 9.7255 9.7255 9.8528 9.8528 10.0606 10.0606 k =-0.2923 0.5026 0.5814 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6933 -25.6933 -18.1212 -18.1212 -18.1050 -18.1050 -17.9474 -17.9474 -17.9411 -17.9411 -17.9363 -17.9363 -17.9075 -17.9075 -9.7128 -9.7128 -9.3431 -9.3431 -9.0955 -9.0955 -8.5343 -8.5343 -8.4597 -8.4597 0.9464 0.9464 1.6505 1.6505 1.7584 1.7584 2.2299 2.2299 4.0708 4.0708 4.5770 4.5770 8.8566 8.8566 9.7252 9.7252 9.8502 9.8502 10.0590 10.0590 k =-0.2923 0.5026 0.5814 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6933 -25.6933 -18.1212 -18.1212 -18.1050 -18.1050 -17.9474 -17.9474 -17.9411 -17.9411 -17.9363 -17.9363 -17.9075 -17.9075 -9.7128 -9.7128 -9.3431 -9.3431 -9.0955 -9.0955 -8.5343 -8.5343 -8.4597 -8.4597 0.9464 0.9464 1.6505 1.6505 1.7584 1.7584 2.2299 2.2299 4.0708 4.0708 4.5770 4.5770 8.8566 8.8566 9.7252 9.7252 9.8502 9.8502 10.0590 10.0590 k =-0.2856 0.4912 0.5682 ( 5762 PWs) bands (ev): -46.0400 -46.0400 -46.0347 -46.0347 -25.6931 -25.6931 -18.1197 -18.1197 -18.1060 -18.1060 -17.9460 -17.9460 -17.9405 -17.9405 -17.9362 -17.9362 -17.9104 -17.9104 -9.7194 -9.7194 -9.3406 -9.3406 -9.0945 -9.0945 -8.5290 -8.5290 -8.4598 -8.4598 0.9337 0.9337 1.6350 1.6350 1.7792 1.7792 2.2288 2.2288 4.0549 4.0549 4.5717 4.5717 8.8363 8.8363 9.8051 9.8051 9.8643 9.8643 10.0593 10.0593 k =-0.2790 0.4798 0.5550 ( 5754 PWs) bands (ev): -46.0395 -46.0395 -46.0352 -46.0352 -25.6930 -25.6930 -18.1183 -18.1183 -18.1071 -18.1071 -17.9450 -17.9450 -17.9403 -17.9403 -17.9351 -17.9351 -17.9132 -17.9132 -9.7250 -9.7250 -9.3383 -9.3383 -9.0937 -9.0937 -8.5249 -8.5249 -8.4597 -8.4597 0.9215 0.9215 1.6208 1.6208 1.8002 1.8002 2.2284 2.2284 4.0401 4.0401 4.5658 4.5658 8.8146 8.8146 9.8783 9.8783 9.8840 9.8840 10.0541 10.0541 k =-0.2723 0.4683 0.5418 ( 5758 PWs) bands (ev): -46.0390 -46.0390 -46.0357 -46.0357 -25.6929 -25.6929 -18.1169 -18.1169 -18.1083 -18.1083 -17.9442 -17.9442 -17.9406 -17.9406 -17.9334 -17.9334 -17.9160 -17.9160 -9.7297 -9.7297 -9.3363 -9.3363 -9.0929 -9.0929 -8.5218 -8.5218 -8.4593 -8.4593 0.9097 0.9097 1.6081 1.6081 1.8214 1.8214 2.2286 2.2286 4.0263 4.0263 4.5595 4.5595 8.7918 8.7918 9.8934 9.8934 9.9551 9.9551 10.0482 10.0482 k =-0.2657 0.4569 0.5285 ( 5766 PWs) bands (ev): -46.0386 -46.0386 -46.0362 -46.0362 -25.6929 -25.6929 -18.1156 -18.1156 -18.1095 -18.1095 -17.9436 -17.9436 -17.9411 -17.9411 -17.9312 -17.9312 -17.9188 -17.9188 -9.7335 -9.7335 -9.3345 -9.3345 -9.0923 -9.0923 -8.5198 -8.5198 -8.4586 -8.4586 0.8984 0.8984 1.5969 1.5969 1.8427 1.8427 2.2295 2.2295 4.0136 4.0136 4.5526 4.5526 8.7679 8.7679 9.9087 9.9087 9.9913 9.9913 10.0698 10.0698 k =-0.2591 0.4455 0.5153 ( 5768 PWs) bands (ev): -46.0381 -46.0381 -46.0367 -46.0367 -25.6928 -25.6928 -18.1142 -18.1142 -18.1108 -18.1108 -17.9431 -17.9431 -17.9415 -17.9415 -17.9287 -17.9287 -17.9216 -17.9216 -9.7364 -9.7364 -9.3330 -9.3330 -9.0918 -9.0918 -8.5189 -8.5189 -8.4577 -8.4577 0.8875 0.8875 1.5874 1.5874 1.8640 1.8640 2.2310 2.2310 4.0021 4.0021 4.5453 4.5453 8.7426 8.7426 9.9244 9.9244 9.9796 9.9796 10.1315 10.1315 k =-0.2524 0.4341 0.5021 ( 5772 PWs) bands (ev): -46.0376 -46.0376 -46.0372 -46.0372 -25.6928 -25.6928 -18.1130 -18.1130 -18.1120 -18.1120 -17.9428 -17.9428 -17.9419 -17.9419 -17.9261 -17.9261 -17.9244 -17.9244 -9.7383 -9.7383 -9.3317 -9.3317 -9.0914 -9.0914 -8.5191 -8.5191 -8.4564 -8.4564 0.8769 0.8769 1.5797 1.5797 1.8854 1.8854 2.2331 2.2331 3.9918 3.9918 4.5374 4.5374 8.7157 8.7157 9.9408 9.9408 9.9548 9.9548 10.1984 10.1984 k =-0.2458 0.4226 0.4889 ( 5772 PWs) bands (ev): -46.0377 -46.0377 -46.0371 -46.0371 -25.6928 -25.6928 -18.1135 -18.1135 -18.1115 -18.1115 -17.9430 -17.9430 -17.9417 -17.9417 -17.9270 -17.9270 -17.9234 -17.9234 -9.7393 -9.7393 -9.3307 -9.3307 -9.0911 -9.0911 -8.5205 -8.5205 -8.4549 -8.4549 0.8666 0.8666 1.5740 1.5740 1.9067 1.9067 2.2359 2.2359 3.9827 3.9827 4.5291 4.5291 8.6867 8.6867 9.9255 9.9255 9.9578 9.9578 10.2621 10.2621 k =-0.2391 0.4112 0.4757 ( 5776 PWs) bands (ev): -46.0382 -46.0382 -46.0366 -46.0366 -25.6928 -25.6928 -18.1148 -18.1148 -18.1103 -18.1103 -17.9434 -17.9434 -17.9413 -17.9413 -17.9296 -17.9296 -17.9207 -17.9207 -9.7393 -9.7393 -9.3300 -9.3300 -9.0910 -9.0910 -8.5230 -8.5230 -8.4531 -8.4531 0.8564 0.8564 1.5703 1.5703 1.9279 1.9279 2.2394 2.2394 3.9749 3.9749 4.5204 4.5204 8.6552 8.6552 9.8940 9.8940 9.9755 9.9755 10.3203 10.3203 k =-0.2325 0.3998 0.4625 ( 5780 PWs) bands (ev): -46.0387 -46.0387 -46.0361 -46.0361 -25.6929 -25.6929 -18.1162 -18.1162 -18.1091 -18.1091 -17.9440 -17.9440 -17.9409 -17.9409 -17.9320 -17.9320 -17.9179 -17.9179 -9.7383 -9.7383 -9.3296 -9.3296 -9.0911 -9.0911 -8.5266 -8.5266 -8.4510 -8.4510 0.8463 0.8463 1.5690 1.5690 1.9490 1.9490 2.2435 2.2435 3.9684 3.9684 4.5112 4.5112 8.6207 8.6207 9.8619 9.8619 9.9939 9.9939 10.3716 10.3716 k =-0.2258 0.3884 0.4493 ( 5780 PWs) bands (ev): -46.0392 -46.0392 -46.0356 -46.0356 -25.6929 -25.6929 -18.1176 -18.1176 -18.1079 -18.1079 -17.9447 -17.9447 -17.9405 -17.9405 -17.9341 -17.9341 -17.9151 -17.9151 -9.7364 -9.7364 -9.3294 -9.3294 -9.0913 -9.0913 -8.5313 -8.5313 -8.4486 -8.4486 0.8361 0.8361 1.5701 1.5701 1.9699 1.9699 2.2482 2.2482 3.9632 3.9632 4.5017 4.5017 8.5827 8.5827 9.8305 9.8305 10.0130 10.0130 10.4150 10.4150 k =-0.2192 0.3769 0.4361 ( 5780 PWs) bands (ev): -46.0397 -46.0397 -46.0351 -46.0351 -25.6930 -25.6930 -18.1190 -18.1190 -18.1067 -18.1067 -17.9455 -17.9455 -17.9404 -17.9404 -17.9357 -17.9357 -17.9123 -17.9123 -9.7336 -9.7336 -9.3294 -9.3294 -9.0916 -9.0916 -8.5371 -8.5371 -8.4460 -8.4460 0.8257 0.8257 1.5737 1.5737 1.9905 1.9905 2.2536 2.2536 3.9593 3.9593 4.4918 4.4918 8.5407 8.5407 9.8006 9.8006 10.0327 10.0327 10.4497 10.4497 k =-0.2126 0.3655 0.4228 ( 5781 PWs) bands (ev): -46.0402 -46.0402 -46.0346 -46.0346 -25.6931 -25.6931 -18.1204 -18.1204 -18.1057 -18.1057 -17.9465 -17.9465 -17.9409 -17.9409 -17.9364 -17.9364 -17.9095 -17.9095 -9.7298 -9.7298 -9.3297 -9.3297 -9.0920 -9.0920 -8.5439 -8.5439 -8.4431 -8.4431 0.8149 0.8149 1.5800 1.5800 2.0108 2.0108 2.2595 2.2595 3.9568 3.9568 4.4816 4.4816 8.4943 8.4943 9.7732 9.7732 10.0532 10.0532 10.4750 10.4750 k =-0.2059 0.3541 0.4096 ( 5779 PWs) bands (ev): -46.0406 -46.0406 -46.0342 -46.0342 -25.6932 -25.6932 -18.1218 -18.1218 -18.1046 -18.1046 -17.9479 -17.9479 -17.9417 -17.9417 -17.9363 -17.9363 -17.9066 -17.9066 -9.7250 -9.7250 -9.3303 -9.3303 -9.0926 -9.0926 -8.5519 -8.5519 -8.4401 -8.4401 0.8039 0.8039 1.5892 1.5892 2.0307 2.0307 2.2661 2.2661 3.9557 3.9557 4.4711 4.4711 8.4434 8.4434 9.7489 9.7489 10.0743 10.0743 10.4907 10.4907 k =-0.1993 0.3427 0.3964 ( 5781 PWs) bands (ev): -46.0411 -46.0411 -46.0337 -46.0337 -25.6934 -25.6934 -18.1233 -18.1233 -18.1036 -18.1036 -17.9497 -17.9497 -17.9424 -17.9424 -17.9357 -17.9357 -17.9038 -17.9038 -9.7194 -9.7194 -9.3310 -9.3310 -9.0933 -9.0933 -8.5608 -8.5608 -8.4369 -8.4369 0.7923 0.7923 1.6012 1.6012 2.0501 2.0501 2.2732 2.2732 3.9559 3.9559 4.4603 4.4603 8.3877 8.3877 9.7281 9.7281 10.0959 10.0959 10.4968 10.4968 k =-0.1926 0.3313 0.3832 ( 5785 PWs) bands (ev): -46.0416 -46.0416 -46.0332 -46.0332 -25.6935 -25.6935 -18.1247 -18.1247 -18.1027 -18.1027 -17.9518 -17.9518 -17.9429 -17.9429 -17.9350 -17.9350 -17.9010 -17.9010 -9.7128 -9.7128 -9.3319 -9.3319 -9.0941 -9.0941 -8.5708 -8.5708 -8.4335 -8.4335 0.7803 0.7803 1.6161 1.6161 2.0692 2.0692 2.2808 2.2808 3.9574 3.9574 4.4494 4.4494 8.3274 8.3274 9.7108 9.7108 10.1180 10.1180 10.4938 10.4938 k =-0.1860 0.3198 0.3700 ( 5789 PWs) bands (ev): -46.0421 -46.0421 -46.0328 -46.0328 -25.6937 -25.6937 -18.1261 -18.1261 -18.1018 -18.1018 -17.9539 -17.9539 -17.9432 -17.9432 -17.9343 -17.9343 -17.8982 -17.8982 -9.7053 -9.7053 -9.3330 -9.3330 -9.0950 -9.0950 -8.5817 -8.5817 -8.4300 -8.4300 0.7677 0.7677 1.6339 1.6339 2.0877 2.0877 2.2889 2.2889 3.9603 3.9603 4.4383 4.4383 8.2626 8.2626 9.6969 9.6969 10.1405 10.1405 10.4825 10.4825 k =-0.1793 0.3084 0.3568 ( 5787 PWs) bands (ev): -46.0425 -46.0425 -46.0323 -46.0323 -25.6939 -25.6939 -18.1275 -18.1275 -18.1009 -18.1009 -17.9561 -17.9561 -17.9435 -17.9435 -17.9334 -17.9334 -17.8954 -17.8954 -9.6970 -9.6970 -9.3342 -9.3342 -9.0960 -9.0960 -8.5936 -8.5936 -8.4264 -8.4264 0.7547 0.7547 1.6546 1.6546 2.1056 2.1056 2.2974 2.2974 3.9645 3.9645 4.4270 4.4270 8.1937 8.1937 9.6859 9.6859 10.1632 10.1632 10.4641 10.4641 k =-0.1727 0.2970 0.3436 ( 5783 PWs) bands (ev): -46.0429 -46.0429 -46.0319 -46.0319 -25.6941 -25.6941 -18.1289 -18.1289 -18.1001 -18.1001 -17.9583 -17.9583 -17.9437 -17.9437 -17.9324 -17.9324 -17.8926 -17.8926 -9.6878 -9.6878 -9.3355 -9.3355 -9.0971 -9.0971 -8.6063 -8.6063 -8.4227 -8.4227 0.7412 0.7412 1.6781 1.6781 2.1229 2.1229 2.3063 2.3063 3.9699 3.9699 4.4158 4.4158 8.1211 8.1211 9.6772 9.6772 10.1861 10.1861 10.4401 10.4401 k =-0.1661 0.2856 0.3303 ( 5783 PWs) bands (ev): -46.0434 -46.0434 -46.0315 -46.0315 -25.6943 -25.6943 -18.1303 -18.1303 -18.0994 -18.0994 -17.9605 -17.9605 -17.9438 -17.9438 -17.9315 -17.9315 -17.8899 -17.8899 -9.6778 -9.6778 -9.3369 -9.3369 -9.0982 -9.0982 -8.6200 -8.6200 -8.4189 -8.4189 0.7273 0.7273 1.7043 1.7043 2.1396 2.1396 2.3156 2.3156 3.9765 3.9765 4.4044 4.4044 8.0453 8.0453 9.6699 9.6699 10.2088 10.2088 10.4124 10.4124 k =-0.1594 0.2741 0.3171 ( 5775 PWs) bands (ev): -46.0438 -46.0438 -46.0310 -46.0310 -25.6946 -25.6946 -18.1316 -18.1316 -18.0988 -18.0988 -17.9625 -17.9625 -17.9439 -17.9439 -17.9305 -17.9305 -17.8873 -17.8873 -9.6671 -9.6671 -9.3384 -9.3384 -9.0994 -9.0994 -8.6345 -8.6345 -8.4151 -8.4151 0.7130 0.7130 1.7331 1.7331 2.1556 2.1556 2.3252 2.3252 3.9843 3.9843 4.3931 4.3931 7.9668 7.9668 9.6628 9.6628 10.2313 10.2313 10.3829 10.3829 k =-0.1528 0.2627 0.3039 ( 5767 PWs) bands (ev): -46.0442 -46.0442 -46.0306 -46.0306 -25.6948 -25.6948 -18.1329 -18.1329 -18.0981 -18.0981 -17.9646 -17.9646 -17.9439 -17.9439 -17.9295 -17.9295 -17.8847 -17.8847 -9.6556 -9.6556 -9.3399 -9.3399 -9.1007 -9.1007 -8.6499 -8.6499 -8.4113 -8.4113 0.6985 0.6985 1.7644 1.7644 2.1709 2.1709 2.3351 2.3351 3.9932 3.9932 4.3819 4.3819 7.8861 7.8861 9.6545 9.6545 10.2533 10.2533 10.3539 10.3539 k =-0.1461 0.2513 0.2907 ( 5765 PWs) bands (ev): -46.0446 -46.0446 -46.0302 -46.0302 -25.6951 -25.6951 -18.1342 -18.1342 -18.0975 -18.0975 -17.9666 -17.9666 -17.9439 -17.9439 -17.9284 -17.9284 -17.8821 -17.8821 -9.6434 -9.6434 -9.3413 -9.3413 -9.1020 -9.1020 -8.6660 -8.6660 -8.4075 -8.4075 0.6838 0.6838 1.7978 1.7978 2.1855 2.1855 2.3451 2.3451 4.0030 4.0030 4.3707 4.3707 7.8037 7.8037 9.6435 9.6435 10.2746 10.2746 10.3276 10.3276 k =-0.1395 0.2399 0.2775 ( 5761 PWs) bands (ev): -46.0450 -46.0450 -46.0299 -46.0299 -25.6953 -25.6953 -18.1354 -18.1354 -18.0970 -18.0970 -17.9685 -17.9685 -17.9439 -17.9439 -17.9274 -17.9274 -17.8797 -17.8797 -9.6305 -9.6305 -9.3427 -9.3427 -9.1034 -9.1034 -8.6828 -8.6828 -8.4037 -8.4037 0.6689 0.6689 1.8334 1.8334 2.1994 2.1994 2.3553 2.3553 4.0138 4.0138 4.3597 4.3597 7.7202 7.7202 9.6286 9.6286 10.2948 10.2948 10.3063 10.3063 k =-0.1329 0.2285 0.2643 ( 5775 PWs) bands (ev): -46.0454 -46.0454 -46.0295 -46.0295 -25.6956 -25.6956 -18.1366 -18.1366 -18.0966 -18.0966 -17.9704 -17.9704 -17.9439 -17.9439 -17.9264 -17.9264 -17.8773 -17.8773 -9.6171 -9.6171 -9.3439 -9.3439 -9.1048 -9.1048 -8.7004 -8.7004 -8.4000 -8.4000 0.6541 0.6541 1.8707 1.8707 2.2124 2.2124 2.3656 2.3656 4.0254 4.0254 4.3489 4.3489 7.6360 7.6360 9.6085 9.6085 10.2907 10.2907 10.3147 10.3147 k =-0.1262 0.2170 0.2511 ( 5779 PWs) bands (ev): -46.0458 -46.0458 -46.0291 -46.0291 -25.6958 -25.6958 -18.1378 -18.1378 -18.0962 -18.0962 -17.9722 -17.9722 -17.9439 -17.9439 -17.9254 -17.9254 -17.8750 -17.8750 -9.6031 -9.6031 -9.3450 -9.3450 -9.1062 -9.1062 -8.7186 -8.7186 -8.3963 -8.3963 0.6393 0.6393 1.9096 1.9096 2.2248 2.2248 2.3758 2.3758 4.0377 4.0377 4.3383 4.3383 7.5515 7.5515 9.5826 9.5826 10.2833 10.2833 10.3327 10.3327 k =-0.1196 0.2056 0.2378 ( 5771 PWs) bands (ev): -46.0461 -46.0461 -46.0288 -46.0288 -25.6961 -25.6961 -18.1389 -18.1389 -18.0958 -18.0958 -17.9739 -17.9739 -17.9438 -17.9438 -17.9244 -17.9244 -17.8728 -17.8728 -9.5887 -9.5887 -9.3457 -9.3457 -9.1076 -9.1076 -8.7374 -8.7374 -8.3927 -8.3927 0.6248 0.6248 1.9498 1.9498 2.2364 2.2364 2.3861 2.3861 4.0506 4.0506 4.3280 4.3280 7.4674 7.4674 9.5512 9.5512 10.2838 10.2838 10.3493 10.3493 k =-0.1129 0.1942 0.2246 ( 5777 PWs) bands (ev): -46.0465 -46.0465 -46.0285 -46.0285 -25.6964 -25.6964 -18.1400 -18.1400 -18.0955 -18.0955 -17.9756 -17.9756 -17.9437 -17.9437 -17.9234 -17.9234 -17.8707 -17.8707 -9.5740 -9.5740 -9.3462 -9.3462 -9.1090 -9.1090 -8.7568 -8.7568 -8.3892 -8.3892 0.6104 0.6104 1.9911 1.9911 2.2472 2.2472 2.3962 2.3962 4.0640 4.0640 4.3181 4.3181 7.3839 7.3839 9.5148 9.5148 10.2920 10.2920 10.3642 10.3642 k =-0.1063 0.1828 0.2114 ( 5789 PWs) bands (ev): -46.0468 -46.0468 -46.0282 -46.0282 -25.6966 -25.6966 -18.1410 -18.1410 -18.0952 -18.0952 -17.9772 -17.9772 -17.9436 -17.9436 -17.9225 -17.9225 -17.8686 -17.8686 -9.5591 -9.5591 -9.3461 -9.3461 -9.1104 -9.1104 -8.7766 -8.7766 -8.3858 -8.3858 0.5965 0.5965 2.0331 2.0331 2.2573 2.2573 2.4062 2.4062 4.0776 4.0776 4.3084 4.3084 7.3016 7.3016 9.4745 9.4745 10.3070 10.3070 10.3774 10.3774 k =-0.0996 0.1713 0.1982 ( 5797 PWs) bands (ev): -46.0471 -46.0471 -46.0279 -46.0279 -25.6969 -25.6969 -18.1420 -18.1420 -18.0950 -18.0950 -17.9786 -17.9786 -17.9436 -17.9436 -17.9216 -17.9216 -17.8667 -17.8667 -9.5442 -9.5442 -9.3455 -9.3455 -9.1118 -9.1118 -8.7970 -8.7970 -8.3825 -8.3825 0.5829 0.5829 2.0755 2.0755 2.2666 2.2666 2.4160 2.4160 4.0915 4.0915 4.2992 4.2992 7.2209 7.2209 9.4316 9.4316 10.3280 10.3280 10.3888 10.3888 k =-0.0930 0.1599 0.1850 ( 5797 PWs) bands (ev): -46.0474 -46.0474 -46.0276 -46.0276 -25.6971 -25.6971 -18.1430 -18.1430 -18.0947 -18.0947 -17.9801 -17.9801 -17.9435 -17.9435 -17.9206 -17.9206 -17.8648 -17.8648 -9.5294 -9.5294 -9.3440 -9.3440 -9.1132 -9.1132 -8.8177 -8.8177 -8.3794 -8.3794 0.5699 0.5699 2.1179 2.1179 2.2752 2.2752 2.4254 2.4254 4.1054 4.1054 4.2904 4.2904 7.1422 7.1422 9.3873 9.3873 10.3537 10.3537 10.3983 10.3983 k =-0.0864 0.1485 0.1718 ( 5801 PWs) bands (ev): -46.0476 -46.0476 -46.0274 -46.0274 -25.6974 -25.6974 -18.1439 -18.1439 -18.0945 -18.0945 -17.9814 -17.9814 -17.9434 -17.9434 -17.9197 -17.9197 -17.8630 -17.8630 -9.5150 -9.5150 -9.3416 -9.3416 -9.1146 -9.1146 -8.8388 -8.8388 -8.3765 -8.3765 0.5575 0.5575 2.1601 2.1601 2.2832 2.2832 2.4346 2.4346 4.1191 4.1191 4.2821 4.2821 7.0661 7.0661 9.3426 9.3426 10.3832 10.3832 10.4060 10.4060 k =-0.0797 0.1371 0.1586 ( 5805 PWs) bands (ev): -46.0479 -46.0479 -46.0271 -46.0271 -25.6976 -25.6976 -18.1447 -18.1447 -18.0944 -18.0944 -17.9827 -17.9827 -17.9433 -17.9433 -17.9189 -17.9189 -17.8614 -17.8614 -9.5013 -9.5013 -9.3379 -9.3379 -9.1160 -9.1160 -8.8602 -8.8602 -8.3737 -8.3737 0.5457 0.5457 2.2016 2.2016 2.2904 2.2904 2.4433 2.4433 4.1326 4.1326 4.2742 4.2742 6.9928 6.9928 9.2986 9.2986 10.4119 10.4119 10.4155 10.4155 k =-0.0731 0.1256 0.1454 ( 5811 PWs) bands (ev): -46.0481 -46.0481 -46.0269 -46.0269 -25.6978 -25.6978 -18.1455 -18.1455 -18.0942 -18.0942 -17.9838 -17.9838 -17.9432 -17.9432 -17.9181 -17.9181 -17.8599 -17.8599 -9.4885 -9.4885 -9.3327 -9.3327 -9.1175 -9.1175 -8.8818 -8.8818 -8.3711 -8.3711 0.5346 0.5346 2.2419 2.2419 2.2971 2.2971 2.4516 2.4516 4.1457 4.1457 4.2669 4.2669 6.9230 6.9230 9.2559 9.2559 10.4163 10.4163 10.4497 10.4497 k =-0.0664 0.1142 0.1321 ( 5807 PWs) bands (ev): -46.0484 -46.0484 -46.0267 -46.0267 -25.6980 -25.6980 -18.1462 -18.1462 -18.0941 -18.0941 -17.9848 -17.9848 -17.9431 -17.9431 -17.9174 -17.9174 -17.8585 -17.8585 -9.4771 -9.4771 -9.3257 -9.3257 -9.1190 -9.1190 -8.9034 -8.9034 -8.3687 -8.3687 0.5243 0.5243 2.2805 2.2805 2.3034 2.3034 2.4593 2.4593 4.1583 4.1583 4.2601 4.2601 6.8571 6.8571 9.2153 9.2153 10.4192 10.4192 10.4851 10.4851 k =-0.0598 0.1028 0.1189 ( 5809 PWs) bands (ev): -46.0485 -46.0485 -46.0265 -46.0265 -25.6982 -25.6982 -18.1468 -18.1468 -18.0940 -18.0940 -17.9857 -17.9857 -17.9431 -17.9431 -17.9167 -17.9167 -17.8572 -17.8572 -9.4672 -9.4672 -9.3168 -9.3168 -9.1205 -9.1205 -8.9251 -8.9251 -8.3665 -8.3665 0.5148 0.5148 2.3067 2.3067 2.3195 2.3195 2.4665 2.4665 4.1701 4.1701 4.2539 4.2539 6.7955 6.7955 9.1773 9.1773 10.4209 10.4209 10.5208 10.5208 k =-0.0531 0.0914 0.1057 ( 5809 PWs) bands (ev): -46.0487 -46.0487 -46.0263 -46.0263 -25.6984 -25.6984 -18.1473 -18.1473 -18.0939 -18.0939 -17.9865 -17.9865 -17.9429 -17.9429 -17.9162 -17.9162 -17.8561 -17.8561 -9.4589 -9.4589 -9.3058 -9.3058 -9.1223 -9.1223 -8.9465 -8.9465 -8.3645 -8.3645 0.5062 0.5062 2.3122 2.3122 2.3532 2.3532 2.4731 2.4731 4.1811 4.1811 4.2483 4.2483 6.7387 6.7387 9.1423 9.1423 10.4216 10.4216 10.5561 10.5561 k =-0.0465 0.0800 0.0925 ( 5809 PWs) bands (ev): -46.0489 -46.0489 -46.0262 -46.0262 -25.6985 -25.6985 -18.1478 -18.1478 -18.0939 -18.0939 -17.9872 -17.9872 -17.9428 -17.9428 -17.9156 -17.9156 -17.8551 -17.8551 -9.4522 -9.4522 -9.2929 -9.2929 -9.1242 -9.1242 -8.9677 -8.9677 -8.3628 -8.3628 0.4985 0.4985 2.3165 2.3165 2.3849 2.3849 2.4791 2.4791 4.1911 4.1911 4.2433 4.2433 6.6873 6.6873 9.1107 9.1107 10.4215 10.4215 10.5902 10.5902 k =-0.0399 0.0685 0.0793 ( 5815 PWs) bands (ev): -46.0491 -46.0491 -46.0260 -46.0260 -25.6986 -25.6986 -18.1482 -18.1482 -18.0939 -18.0939 -17.9878 -17.9878 -17.9428 -17.9428 -17.9152 -17.9152 -17.8542 -17.8542 -9.4470 -9.4470 -9.2782 -9.2782 -9.1267 -9.1267 -8.9881 -8.9881 -8.3612 -8.3612 0.4918 0.4918 2.3200 2.3200 2.4134 2.4134 2.4844 2.4844 4.2000 4.2000 4.2390 4.2390 6.6416 6.6416 9.0828 9.0828 10.4209 10.4209 10.6221 10.6221 k =-0.0332 0.0571 0.0661 ( 5803 PWs) bands (ev): -46.0492 -46.0492 -46.0259 -46.0259 -25.6988 -25.6988 -18.1486 -18.1486 -18.0938 -18.0938 -17.9883 -17.9883 -17.9427 -17.9427 -17.9148 -17.9148 -17.8534 -17.8534 -9.4431 -9.4431 -9.2623 -9.2623 -9.1298 -9.1298 -9.0075 -9.0075 -8.3599 -8.3599 0.4860 0.4860 2.3229 2.3229 2.4383 2.4383 2.4890 2.4890 4.2077 4.2077 4.2354 4.2354 6.6020 6.6020 9.0588 9.0588 10.4200 10.4200 10.6512 10.6512 k =-0.0266 0.0457 0.0529 ( 5803 PWs) bands (ev): -46.0493 -46.0493 -46.0258 -46.0258 -25.6989 -25.6989 -18.1489 -18.1489 -18.0938 -18.0938 -17.9888 -17.9888 -17.9426 -17.9426 -17.9144 -17.9144 -17.8528 -17.8528 -9.4402 -9.4402 -9.2453 -9.2453 -9.1341 -9.1341 -9.0253 -9.0253 -8.3588 -8.3588 0.4812 0.4812 2.3253 2.3253 2.4591 2.4591 2.4930 2.4930 4.2140 4.2140 4.2325 4.2325 6.5691 6.5691 9.0390 9.0390 10.4190 10.4190 10.6765 10.6765 k =-0.0199 0.0343 0.0396 ( 5797 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6989 -25.6989 -18.1491 -18.1491 -18.0937 -18.0937 -17.9891 -17.9891 -17.9426 -17.9426 -17.9141 -17.9141 -17.8523 -17.8523 -9.4382 -9.4382 -9.2279 -9.2279 -9.1401 -9.1401 -9.0404 -9.0404 -8.3580 -8.3580 0.4775 0.4775 2.3271 2.3271 2.4752 2.4752 2.4965 2.4965 4.2187 4.2187 4.2305 4.2305 6.5431 6.5431 9.0234 9.0234 10.4180 10.4180 10.6973 10.6973 k =-0.0133 0.0228 0.0264 ( 5793 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6990 -25.6990 -18.1492 -18.1492 -18.0937 -18.0937 -17.9893 -17.9893 -17.9425 -17.9425 -17.9139 -17.9139 -17.8520 -17.8520 -9.4368 -9.4368 -9.2105 -9.2105 -9.1484 -9.1484 -9.0521 -9.0521 -8.3574 -8.3574 0.4749 0.4749 2.3285 2.3285 2.4862 2.4862 2.4999 2.4999 4.2217 4.2217 4.2295 4.2295 6.5243 6.5243 9.0122 9.0122 10.4172 10.4172 10.7127 10.7127 k =-0.0066 0.0114 0.0132 ( 5789 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4361 -9.4361 -9.1943 -9.1943 -9.1589 -9.1589 -9.0593 -9.0593 -8.3570 -8.3570 0.4733 0.4733 2.3292 2.3292 2.4917 2.4917 2.5029 2.5029 4.2230 4.2230 4.2295 4.2295 6.5130 6.5130 9.0054 9.0054 10.4167 10.4167 10.7222 10.7222 k = 0.0000 0.0000 0.0000 ( 5793 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4358 -9.4358 -9.1847 -9.1847 -9.1666 -9.1666 -9.0617 -9.0617 -8.3569 -8.3569 0.4727 0.4727 2.3295 2.3295 2.4933 2.4933 2.5043 2.5043 4.2232 4.2232 4.2297 4.2297 6.5092 6.5092 9.0032 9.0032 10.4165 10.4165 10.7255 10.7255 k = 0.0000 0.0000 0.0000 ( 5793 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4358 -9.4358 -9.1847 -9.1847 -9.1666 -9.1666 -9.0617 -9.0617 -8.3569 -8.3569 0.4727 0.4727 2.3295 2.3295 2.4933 2.4933 2.5043 2.5043 4.2232 4.2232 4.2297 4.2297 6.5092 6.5092 9.0032 9.0032 10.4165 10.4165 10.7255 10.7255 k = 0.0161 0.0094 0.0000 ( 5789 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4360 -9.4360 -9.1850 -9.1850 -9.1659 -9.1659 -9.0617 -9.0617 -8.3571 -8.3571 0.4738 0.4738 2.3277 2.3277 2.4928 2.4928 2.5039 2.5039 4.2242 4.2242 4.2306 4.2306 6.5118 6.5118 9.0024 9.0024 10.4137 10.4137 10.7242 10.7242 k = 0.0323 0.0188 0.0000 ( 5789 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9894 -17.9894 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4367 -9.4367 -9.1857 -9.1857 -9.1642 -9.1642 -9.0617 -9.0617 -8.3576 -8.3576 0.4771 0.4771 2.3223 2.3223 2.4916 2.4916 2.5026 2.5026 4.2270 4.2270 4.2335 4.2335 6.5197 6.5197 9.0002 9.0002 10.4056 10.4056 10.7206 10.7206 k = 0.0484 0.0281 0.0000 ( 5789 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0937 -18.0937 -17.9895 -17.9895 -17.9425 -17.9425 -17.9138 -17.9138 -17.8517 -17.8517 -9.4378 -9.4378 -9.1866 -9.1866 -9.1616 -9.1616 -9.0617 -9.0617 -8.3584 -8.3584 0.4826 0.4826 2.3133 2.3133 2.4894 2.4894 2.5004 2.5004 4.2317 4.2317 4.2383 4.2383 6.5329 6.5329 8.9965 8.9965 10.3921 10.3921 10.7145 10.7145 k = 0.0645 0.0375 0.0000 ( 5781 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1493 -18.1493 -18.0936 -18.0936 -17.9895 -17.9895 -17.9425 -17.9425 -17.9137 -17.9137 -17.8517 -17.8517 -9.4393 -9.4393 -9.1876 -9.1876 -9.1584 -9.1584 -9.0617 -9.0617 -8.3596 -8.3596 0.4903 0.4903 2.3009 2.3009 2.4865 2.4865 2.4975 2.4975 4.2382 4.2382 4.2449 4.2449 6.5511 6.5511 8.9914 8.9914 10.3735 10.3735 10.7059 10.7059 k = 0.0806 0.0469 0.0000 ( 5781 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6990 -25.6990 -18.1494 -18.1494 -18.0936 -18.0936 -17.9895 -17.9895 -17.9425 -17.9425 -17.9137 -17.9137 -17.8517 -17.8517 -9.4411 -9.4411 -9.1886 -9.1886 -9.1546 -9.1546 -9.0617 -9.0617 -8.3610 -8.3610 0.5001 0.5001 2.2852 2.2852 2.4829 2.4829 2.4938 2.4938 4.2465 4.2465 4.2532 4.2532 6.5742 6.5742 8.9850 8.9850 10.3501 10.3501 10.6949 10.6949 k = 0.0968 0.0563 0.0000 ( 5769 PWs) bands (ev): -46.0494 -46.0494 -46.0256 -46.0256 -25.6991 -25.6991 -18.1494 -18.1494 -18.0934 -18.0934 -17.9895 -17.9895 -17.9425 -17.9425 -17.9136 -17.9136 -17.8516 -17.8516 -9.4433 -9.4433 -9.1895 -9.1895 -9.1504 -9.1504 -9.0617 -9.0617 -8.3628 -8.3628 0.5121 0.5121 2.2663 2.2663 2.4785 2.4785 2.4894 2.4894 4.2564 4.2564 4.2633 4.2633 6.6020 6.6020 8.9773 8.9773 10.3222 10.3222 10.6814 10.6814 k = 0.1129 0.0657 0.0000 ( 5789 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6991 -25.6991 -18.1495 -18.1495 -18.0933 -18.0933 -17.9896 -17.9896 -17.9426 -17.9426 -17.9136 -17.9136 -17.8516 -17.8516 -9.4457 -9.4457 -9.1902 -9.1902 -9.1459 -9.1459 -9.0617 -9.0617 -8.3648 -8.3648 0.5260 0.5260 2.2445 2.2445 2.4735 2.4735 2.4843 2.4843 4.2678 4.2678 4.2748 4.2748 6.6343 6.6343 8.9685 8.9685 10.2902 10.2902 10.6655 10.6655 k = 0.1290 0.0750 0.0000 ( 5801 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6991 -25.6991 -18.1496 -18.1496 -18.0933 -18.0933 -17.9897 -17.9897 -17.9427 -17.9427 -17.9136 -17.9136 -17.8516 -17.8516 -9.4484 -9.4484 -9.1908 -9.1908 -9.1411 -9.1411 -9.0617 -9.0617 -8.3671 -8.3671 0.5420 0.5420 2.2198 2.2198 2.4679 2.4679 2.4787 2.4787 4.2806 4.2806 4.2878 4.2878 6.6706 6.6706 8.9587 8.9587 10.2545 10.2545 10.6471 10.6471 k = 0.1452 0.0844 0.0000 ( 5797 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6991 -25.6991 -18.1496 -18.1496 -18.0932 -18.0932 -17.9897 -17.9897 -17.9427 -17.9427 -17.9135 -17.9135 -17.8516 -17.8516 -9.4512 -9.4512 -9.1913 -9.1913 -9.1361 -9.1361 -9.0617 -9.0617 -8.3696 -8.3696 0.5600 0.5600 2.1926 2.1926 2.4619 2.4619 2.4726 2.4726 4.2947 4.2947 4.3020 4.3020 6.7108 6.7108 8.9480 8.9480 10.2156 10.2156 10.6264 10.6264 k = 0.1613 0.0938 0.0000 ( 5781 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6991 -25.6991 -18.1495 -18.1495 -18.0931 -18.0931 -17.9897 -17.9897 -17.9426 -17.9426 -17.9135 -17.9135 -17.8516 -17.8516 -9.4542 -9.4542 -9.1917 -9.1917 -9.1310 -9.1310 -9.0617 -9.0617 -8.3723 -8.3723 0.5798 0.5798 2.1631 2.1631 2.4554 2.4554 2.4660 2.4660 4.3099 4.3099 4.3174 4.3174 6.7545 6.7545 8.9364 8.9364 10.1740 10.1740 10.6034 10.6034 k = 0.1774 0.1032 0.0000 ( 5773 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6991 -25.6991 -18.1496 -18.1496 -18.0930 -18.0930 -17.9897 -17.9897 -17.9425 -17.9425 -17.9134 -17.9134 -17.8515 -17.8515 -9.4572 -9.4572 -9.1920 -9.1920 -9.1258 -9.1258 -9.0617 -9.0617 -8.3751 -8.3751 0.6015 0.6015 2.1314 2.1314 2.4486 2.4486 2.4592 2.4592 4.3260 4.3260 4.3337 4.3337 6.8013 6.8013 8.9243 8.9243 10.1301 10.1301 10.5781 10.5781 k = 0.1935 0.1126 0.0000 ( 5773 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6991 -25.6991 -18.1496 -18.1496 -18.0930 -18.0930 -17.9897 -17.9897 -17.9425 -17.9425 -17.9134 -17.9134 -17.8515 -17.8515 -9.4603 -9.4603 -9.1921 -9.1921 -9.1206 -9.1206 -9.0616 -9.0616 -8.3781 -8.3781 0.6249 0.6249 2.0978 2.0978 2.4416 2.4416 2.4521 2.4521 4.3430 4.3430 4.3509 4.3509 6.8508 6.8508 8.9117 8.9117 10.0844 10.0844 10.5508 10.5508 k = 0.2097 0.1219 0.0000 ( 5769 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6991 -25.6991 -18.1496 -18.1496 -18.0929 -18.0929 -17.9897 -17.9897 -17.9425 -17.9425 -17.9133 -17.9133 -17.8515 -17.8515 -9.4634 -9.4634 -9.1922 -9.1922 -9.1154 -9.1154 -9.0616 -9.0616 -8.3811 -8.3811 0.6499 0.6499 2.0625 2.0625 2.4344 2.4344 2.4448 2.4448 4.3605 4.3605 4.3686 4.3686 6.9027 6.9027 8.8987 8.8987 10.0374 10.0374 10.5215 10.5215 k = 0.2258 0.1313 0.0000 ( 5769 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6992 -25.6992 -18.1496 -18.1496 -18.0928 -18.0928 -17.9898 -17.9898 -17.9425 -17.9425 -17.9133 -17.9133 -17.8515 -17.8515 -9.4664 -9.4664 -9.1923 -9.1923 -9.1103 -9.1103 -9.0616 -9.0616 -8.3842 -8.3842 0.6765 0.6765 2.0257 2.0257 2.4271 2.4271 2.4374 2.4374 4.3785 4.3785 4.3868 4.3868 6.9565 6.9565 8.8855 8.8855 9.9896 9.9896 10.4904 10.4904 k = 0.2419 0.1407 0.0000 ( 5785 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6992 -25.6992 -18.1496 -18.1496 -18.0928 -18.0928 -17.9898 -17.9898 -17.9425 -17.9425 -17.9133 -17.9133 -17.8515 -17.8515 -9.4694 -9.4694 -9.1922 -9.1922 -9.1053 -9.1053 -9.0616 -9.0616 -8.3874 -8.3874 0.7046 0.7046 1.9877 1.9877 2.4198 2.4198 2.4300 2.4300 4.3967 4.3967 4.4052 4.4052 7.0118 7.0118 8.8723 8.8723 9.9415 9.9415 10.4578 10.4578 k = 0.2581 0.1501 0.0000 ( 5785 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6992 -25.6992 -18.1496 -18.1496 -18.0928 -18.0928 -17.9898 -17.9898 -17.9425 -17.9425 -17.9133 -17.9133 -17.8515 -17.8515 -9.4723 -9.4723 -9.1921 -9.1921 -9.1004 -9.1004 -9.0616 -9.0616 -8.3905 -8.3905 0.7342 0.7342 1.9486 1.9486 2.4126 2.4126 2.4227 2.4227 4.4149 4.4149 4.4237 4.4237 7.0681 7.0681 8.8591 8.8591 9.8935 9.8935 10.4238 10.4238 k = 0.2742 0.1594 0.0000 ( 5777 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6992 -25.6992 -18.1496 -18.1496 -18.0927 -18.0927 -17.9899 -17.9899 -17.9425 -17.9425 -17.9132 -17.9132 -17.8515 -17.8515 -9.4750 -9.4750 -9.1920 -9.1920 -9.0958 -9.0958 -9.0616 -9.0616 -8.3936 -8.3936 0.7650 0.7650 1.9086 1.9086 2.4055 2.4055 2.4156 2.4156 4.4331 4.4331 4.4420 4.4420 7.1250 7.1250 8.8462 8.8462 9.8460 9.8460 10.3889 10.3889 k = 0.2903 0.1688 0.0000 ( 5773 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6992 -25.6992 -18.1496 -18.1496 -18.0926 -18.0926 -17.9899 -17.9899 -17.9425 -17.9425 -17.9131 -17.9131 -17.8514 -17.8514 -9.4777 -9.4777 -9.1919 -9.1919 -9.0913 -9.0913 -9.0616 -9.0616 -8.3966 -8.3966 0.7970 0.7970 1.8679 1.8679 2.3986 2.3986 2.4086 2.4086 4.4509 4.4509 4.4601 4.4601 7.1819 7.1819 8.8336 8.8336 9.7994 9.7994 10.3533 10.3533 k = 0.3065 0.1782 0.0000 ( 5773 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6992 -25.6992 -18.1497 -18.1497 -18.0926 -18.0926 -17.9899 -17.9899 -17.9425 -17.9425 -17.9131 -17.9131 -17.8514 -17.8514 -9.4801 -9.4801 -9.1917 -9.1917 -9.0871 -9.0871 -9.0616 -9.0616 -8.3995 -8.3995 0.8302 0.8302 1.8266 1.8266 2.3920 2.3920 2.4019 2.4019 4.4683 4.4683 4.4776 4.4776 7.2384 7.2384 8.8214 8.8214 9.7543 9.7543 10.3174 10.3174 k = 0.3226 0.1876 0.0000 ( 5762 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0925 -18.0925 -17.9899 -17.9899 -17.9425 -17.9425 -17.9130 -17.9130 -17.8514 -17.8514 -9.4825 -9.4825 -9.1915 -9.1915 -9.0832 -9.0832 -9.0615 -9.0615 -8.4022 -8.4022 0.8643 0.8643 1.7848 1.7848 2.3857 2.3857 2.3956 2.3956 4.4850 4.4850 4.4946 4.4946 7.2939 7.2939 8.8098 8.8098 9.7108 9.7108 10.2816 10.2816 k = 0.3387 0.1970 0.0000 ( 5778 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0925 -18.0925 -17.9900 -17.9900 -17.9425 -17.9425 -17.9131 -17.9131 -17.8514 -17.8514 -9.4846 -9.4846 -9.1912 -9.1912 -9.0796 -9.0796 -9.0615 -9.0615 -8.4049 -8.4049 0.8994 0.8994 1.7428 1.7428 2.3798 2.3798 2.3896 2.3896 4.5009 4.5009 4.5106 4.5106 7.3479 7.3479 8.7988 8.7988 9.6694 9.6694 10.2463 10.2463 k = 0.3548 0.2063 0.0000 ( 5790 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0925 -18.0925 -17.9900 -17.9900 -17.9425 -17.9425 -17.9131 -17.9131 -17.8515 -17.8515 -9.4865 -9.4865 -9.1910 -9.1910 -9.0763 -9.0763 -9.0615 -9.0615 -8.4073 -8.4073 0.9352 0.9352 1.7006 1.7006 2.3743 2.3743 2.3840 2.3840 4.5158 4.5158 4.5257 4.5257 7.3996 7.3996 8.7886 8.7886 9.6305 9.6305 10.2122 10.2122 k = 0.3710 0.2157 0.0000 ( 5778 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0924 -18.0924 -17.9900 -17.9900 -17.9424 -17.9424 -17.9130 -17.9130 -17.8514 -17.8514 -9.4883 -9.4883 -9.1908 -9.1908 -9.0733 -9.0733 -9.0615 -9.0615 -8.4095 -8.4095 0.9717 0.9717 1.6585 1.6585 2.3693 2.3693 2.3790 2.3790 4.5296 4.5296 4.5396 4.5396 7.4486 7.4486 8.7793 8.7793 9.5944 9.5944 10.1796 10.1796 k = 0.3871 0.2251 0.0000 ( 5790 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1498 -18.1498 -18.0924 -18.0924 -17.9900 -17.9900 -17.9425 -17.9425 -17.9130 -17.9130 -17.8514 -17.8514 -9.4899 -9.4899 -9.1906 -9.1906 -9.0707 -9.0707 -9.0615 -9.0615 -8.4115 -8.4115 1.0087 1.0087 1.6165 1.6165 2.3648 2.3648 2.3744 2.3744 4.5421 4.5421 4.5523 4.5523 7.4941 7.4941 8.7709 8.7709 9.5614 9.5614 10.1491 10.1491 k = 0.4032 0.2345 0.0000 ( 5782 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0923 -18.0923 -17.9900 -17.9900 -17.9424 -17.9424 -17.9130 -17.9130 -17.8514 -17.8514 -9.4912 -9.4912 -9.1904 -9.1904 -9.0683 -9.0683 -9.0615 -9.0615 -8.4133 -8.4133 1.0460 1.0460 1.5749 1.5749 2.3608 2.3608 2.3704 2.3704 4.5532 4.5532 4.5636 4.5636 7.5354 7.5354 8.7634 8.7634 9.5319 9.5319 10.1213 10.1213 k = 0.4194 0.2439 0.0000 ( 5798 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0924 -18.0924 -17.9900 -17.9900 -17.9424 -17.9424 -17.9131 -17.9131 -17.8515 -17.8515 -9.4924 -9.4924 -9.1902 -9.1902 -9.0664 -9.0664 -9.0615 -9.0615 -8.4148 -8.4148 1.0833 1.0833 1.5339 1.5339 2.3574 2.3574 2.3669 2.3669 4.5628 4.5628 4.5733 4.5733 7.5718 7.5718 8.7570 8.7570 9.5062 9.5062 10.0967 10.0967 k = 0.4355 0.2532 0.0000 ( 5790 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0923 -18.0923 -17.9900 -17.9900 -17.9424 -17.9424 -17.9131 -17.9131 -17.8515 -17.8515 -9.4933 -9.4933 -9.1901 -9.1901 -9.0648 -9.0648 -9.0615 -9.0615 -8.4161 -8.4161 1.1201 1.1201 1.4941 1.4941 2.3545 2.3545 2.3640 2.3640 4.5708 4.5708 4.5814 4.5814 7.6028 7.6028 8.7517 8.7517 9.4847 9.4847 10.0758 10.0758 k = 0.4516 0.2626 0.0000 ( 5790 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0923 -18.0923 -17.9900 -17.9900 -17.9424 -17.9424 -17.9130 -17.9130 -17.8515 -17.8515 -9.4941 -9.4941 -9.1900 -9.1900 -9.0635 -9.0635 -9.0615 -9.0615 -8.4171 -8.4171 1.1557 1.1557 1.4563 1.4563 2.3523 2.3523 2.3618 2.3618 4.5771 4.5771 4.5878 4.5878 7.6276 7.6276 8.7475 8.7475 9.4675 9.4675 10.0590 10.0590 k = 0.4677 0.2720 0.0000 ( 5798 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1498 -18.1498 -18.0922 -18.0922 -17.9900 -17.9900 -17.9425 -17.9425 -17.9130 -17.9130 -17.8515 -17.8515 -9.4946 -9.4946 -9.1899 -9.1899 -9.0626 -9.0626 -9.0615 -9.0615 -8.4178 -8.4178 1.1880 1.1880 1.4223 1.4223 2.3507 2.3507 2.3602 2.3602 4.5817 4.5817 4.5924 4.5924 7.6458 7.6458 8.7445 8.7445 9.4551 9.4551 10.0467 10.0467 k = 0.4839 0.2814 0.0000 ( 5806 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6994 -25.6994 -18.1498 -18.1498 -18.0923 -18.0923 -17.9901 -17.9901 -17.9425 -17.9425 -17.9130 -17.9130 -17.8516 -17.8516 -9.4949 -9.4949 -9.1898 -9.1898 -9.0621 -9.0621 -9.0615 -9.0615 -8.4182 -8.4182 1.2131 1.2131 1.3963 1.3963 2.3497 2.3497 2.3592 2.3592 4.5844 4.5844 4.5951 4.5951 7.6569 7.6569 8.7427 8.7427 9.4475 9.4475 10.0392 10.0392 k = 0.5000 0.2908 0.0000 ( 5822 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6994 -25.6994 -18.1498 -18.1498 -18.0923 -18.0923 -17.9901 -17.9901 -17.9426 -17.9426 -17.9131 -17.9131 -17.8516 -17.8516 -9.4950 -9.4950 -9.1898 -9.1898 -9.0619 -9.0619 -9.0615 -9.0615 -8.4183 -8.4183 1.2232 1.2232 1.3858 1.3858 2.3494 2.3494 2.3589 2.3589 4.5853 4.5853 4.5961 4.5961 7.6606 7.6606 8.7421 8.7421 9.4450 9.4450 10.0367 10.0367 k = 0.5000 0.2908 0.0000 ( 5822 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6994 -25.6994 -18.1498 -18.1498 -18.0923 -18.0923 -17.9901 -17.9901 -17.9426 -17.9426 -17.9131 -17.9131 -17.8516 -17.8516 -9.4950 -9.4950 -9.1898 -9.1898 -9.0619 -9.0619 -9.0615 -9.0615 -8.4183 -8.4183 1.2232 1.2232 1.3858 1.3858 2.3494 2.3494 2.3589 2.3589 4.5853 4.5853 4.5961 4.5961 7.6606 7.6606 8.7421 8.7421 9.4450 9.4450 10.0367 10.0367 k = 0.4933 0.3023 0.0133 ( 5816 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1498 -18.1498 -18.0923 -18.0923 -17.9900 -17.9900 -17.9426 -17.9426 -17.9131 -17.9131 -17.8516 -17.8516 -9.4950 -9.4950 -9.1917 -9.1917 -9.0779 -9.0779 -9.0433 -9.0433 -8.4184 -8.4184 1.2229 1.2229 1.3862 1.3862 2.3484 2.3484 2.3579 2.3579 4.5849 4.5849 4.5956 4.5956 7.6635 7.6635 8.7448 8.7448 9.4459 9.4459 10.0336 10.0336 k = 0.4866 0.3138 0.0267 ( 5798 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0923 -18.0923 -17.9899 -17.9899 -17.9425 -17.9425 -17.9131 -17.9131 -17.8518 -17.8518 -9.4948 -9.4948 -9.1975 -9.1975 -9.0914 -9.0914 -9.0235 -9.0235 -8.4187 -8.4187 1.2222 1.2222 1.3876 1.3876 2.3447 2.3447 2.3557 2.3557 4.5832 4.5832 4.5947 4.5947 7.6724 7.6724 8.7527 8.7527 9.4486 9.4486 10.0245 10.0245 k = 0.4799 0.3253 0.0400 ( 5782 PWs) bands (ev): -46.0492 -46.0492 -46.0258 -46.0258 -25.6992 -25.6992 -18.1495 -18.1495 -18.0922 -18.0922 -17.9896 -17.9896 -17.9425 -17.9425 -17.9133 -17.9133 -17.8520 -17.8520 -9.4946 -9.4946 -9.2070 -9.2070 -9.1018 -9.1018 -9.0027 -9.0027 -8.4191 -8.4191 1.2210 1.2210 1.3897 1.3897 2.3373 2.3373 2.3533 2.3533 4.5797 4.5797 4.5939 4.5939 7.6871 7.6871 8.7658 8.7658 9.4530 9.4530 10.0097 10.0097 k = 0.4732 0.3369 0.0533 ( 5792 PWs) bands (ev): -46.0491 -46.0491 -46.0259 -46.0259 -25.6992 -25.6992 -18.1493 -18.1493 -18.0923 -18.0923 -17.9893 -17.9893 -17.9426 -17.9426 -17.9136 -17.9136 -17.8526 -17.8526 -9.4944 -9.4944 -9.2197 -9.2197 -9.1092 -9.1092 -8.9812 -8.9812 -8.4198 -8.4198 1.2192 1.2192 1.3928 1.3928 2.3262 2.3262 2.3508 2.3508 4.5740 4.5740 4.5935 4.5935 7.7074 7.7074 8.7841 8.7841 9.4591 9.4591 9.9896 9.9896 k = 0.4665 0.3484 0.0666 ( 5788 PWs) bands (ev): -46.0491 -46.0491 -46.0260 -46.0260 -25.6991 -25.6991 -18.1489 -18.1489 -18.0924 -18.0924 -17.9888 -17.9888 -17.9426 -17.9426 -17.9139 -17.9139 -17.8532 -17.8532 -9.4943 -9.4943 -9.2347 -9.2347 -9.1142 -9.1142 -8.9593 -8.9593 -8.4205 -8.4205 1.2169 1.2169 1.3967 1.3967 2.3118 2.3118 2.3481 2.3481 4.5661 4.5661 4.5937 4.5937 7.7333 7.7333 8.8075 8.8075 9.4669 9.4669 9.9649 9.9649 k = 0.4598 0.3599 0.0800 ( 5780 PWs) bands (ev): -46.0489 -46.0489 -46.0261 -46.0261 -25.6989 -25.6989 -18.1485 -18.1485 -18.0924 -18.0924 -17.9882 -17.9882 -17.9426 -17.9426 -17.9143 -17.9143 -17.8540 -17.8540 -9.4942 -9.4942 -9.2512 -9.2512 -9.1173 -9.1173 -8.9373 -8.9373 -8.4215 -8.4215 1.2140 1.2140 1.4015 1.4015 2.2943 2.2943 2.3451 2.3451 4.5563 4.5563 4.5942 4.5942 7.7645 7.7645 8.8358 8.8358 9.4761 9.4761 9.9361 9.9361 k = 0.4531 0.3714 0.0933 ( 5784 PWs) bands (ev): -46.0488 -46.0488 -46.0262 -46.0262 -25.6988 -25.6988 -18.1480 -18.1480 -18.0926 -18.0926 -17.9876 -17.9876 -17.9427 -17.9427 -17.9149 -17.9149 -17.8549 -17.8549 -9.4944 -9.4944 -9.2683 -9.2683 -9.1193 -9.1193 -8.9152 -8.9152 -8.4226 -8.4226 1.2105 1.2105 1.4071 1.4071 2.2742 2.2742 2.3416 2.3416 4.5448 4.5448 4.5948 4.5948 7.8008 7.8008 8.8689 8.8689 9.4868 9.4868 9.9040 9.9040 k = 0.4464 0.3829 0.1066 ( 5792 PWs) bands (ev): -46.0487 -46.0487 -46.0263 -46.0263 -25.6986 -25.6986 -18.1475 -18.1475 -18.0927 -18.0927 -17.9868 -17.9868 -17.9427 -17.9427 -17.9155 -17.9155 -17.8560 -17.8560 -9.4950 -9.4950 -9.2854 -9.2854 -9.1203 -9.1203 -8.8931 -8.8931 -8.4238 -8.4238 1.2064 1.2064 1.4136 1.4136 2.2517 2.2517 2.3378 2.3378 4.5316 4.5316 4.5957 4.5957 7.8419 7.8419 8.9066 8.9066 9.4987 9.4987 9.8692 9.8692 k = 0.4397 0.3945 0.1200 ( 5792 PWs) bands (ev): -46.0485 -46.0485 -46.0265 -46.0265 -25.6985 -25.6985 -18.1469 -18.1469 -18.0929 -18.0929 -17.9859 -17.9859 -17.9428 -17.9428 -17.9162 -17.9162 -17.8573 -17.8573 -9.4962 -9.4962 -9.3021 -9.3021 -9.1208 -9.1208 -8.8712 -8.8712 -8.4252 -8.4252 1.2017 1.2017 1.4209 1.4209 2.2271 2.2271 2.3336 2.3336 4.5170 4.5170 4.5966 4.5966 7.8875 7.8875 8.9487 8.9487 9.5118 9.5118 9.8323 9.8323 k = 0.4330 0.4060 0.1333 ( 5780 PWs) bands (ev): -46.0483 -46.0483 -46.0267 -46.0267 -25.6983 -25.6983 -18.1462 -18.1462 -18.0930 -18.0930 -17.9849 -17.9849 -17.9429 -17.9429 -17.9168 -17.9168 -17.8585 -17.8585 -9.4982 -9.4982 -9.3178 -9.3178 -9.1208 -9.1208 -8.8495 -8.8495 -8.4267 -8.4267 1.1963 1.1963 1.4290 1.4290 2.2007 2.2007 2.3291 2.3291 4.5010 4.5010 4.5977 4.5977 7.9374 7.9374 8.9948 8.9948 9.5260 9.5260 9.7938 9.7938 k = 0.4263 0.4175 0.1466 ( 5776 PWs) bands (ev): -46.0481 -46.0481 -46.0269 -46.0269 -25.6981 -25.6981 -18.1455 -18.1455 -18.0932 -18.0932 -17.9839 -17.9839 -17.9429 -17.9429 -17.9176 -17.9176 -17.8599 -17.8599 -9.5012 -9.5012 -9.3321 -9.3321 -9.1205 -9.1205 -8.8281 -8.8281 -8.4283 -8.4283 1.1902 1.1902 1.4380 1.4380 2.1729 2.1729 2.3242 2.3242 4.4838 4.4838 4.5987 4.5987 7.9912 7.9912 9.0446 9.0446 9.5409 9.5409 9.7543 9.7543 k = 0.4196 0.4290 0.1600 ( 5794 PWs) bands (ev): -46.0478 -46.0478 -46.0272 -46.0272 -25.6978 -25.6978 -18.1448 -18.1448 -18.0934 -18.0934 -17.9829 -17.9829 -17.9431 -17.9431 -17.9184 -17.9184 -17.8615 -17.8615 -9.5057 -9.5057 -9.3447 -9.3447 -9.1200 -9.1200 -8.8071 -8.8071 -8.4300 -8.4300 1.1834 1.1834 1.4477 1.4477 2.1438 2.1438 2.3190 2.3190 4.4655 4.4655 4.5997 4.5997 8.0486 8.0486 9.0977 9.0977 9.5566 9.5566 9.7144 9.7144 k = 0.4129 0.4406 0.1733 ( 5786 PWs) bands (ev): -46.0476 -46.0476 -46.0274 -46.0274 -25.6976 -25.6976 -18.1440 -18.1440 -18.0936 -18.0936 -17.9816 -17.9816 -17.9431 -17.9431 -17.9192 -17.9192 -17.8631 -17.8631 -9.5117 -9.5117 -9.3552 -9.3552 -9.1192 -9.1192 -8.7864 -8.7864 -8.4319 -8.4319 1.1758 1.1758 1.4582 1.4582 2.1139 2.1139 2.3136 2.3136 4.4462 4.4462 4.6007 4.6007 8.1093 8.1093 9.1533 9.1533 9.5727 9.5727 9.6747 9.6747 k = 0.4062 0.4521 0.1866 ( 5786 PWs) bands (ev): -46.0473 -46.0473 -46.0276 -46.0276 -25.6973 -25.6973 -18.1430 -18.1430 -18.0939 -18.0939 -17.9802 -17.9802 -17.9432 -17.9432 -17.9202 -17.9202 -17.8650 -17.8650 -9.5195 -9.5195 -9.3635 -9.3635 -9.1183 -9.1183 -8.7663 -8.7663 -8.4338 -8.4338 1.1675 1.1675 1.4695 1.4695 2.0834 2.0834 2.3080 2.3080 4.4261 4.4261 4.6017 4.6017 8.1729 8.1729 9.2107 9.2107 9.5893 9.5893 9.6361 9.6361 k = 0.3995 0.4636 0.1999 ( 5786 PWs) bands (ev): -46.0470 -46.0470 -46.0279 -46.0279 -25.6971 -25.6971 -18.1420 -18.1420 -18.0942 -18.0942 -17.9788 -17.9788 -17.9432 -17.9432 -17.9212 -17.9212 -17.8669 -17.8669 -9.5289 -9.5289 -9.3695 -9.3695 -9.1172 -9.1172 -8.7466 -8.7466 -8.4357 -8.4357 1.1584 1.1584 1.4816 1.4816 2.0525 2.0525 2.3023 2.3023 4.4052 4.4052 4.6026 4.6026 8.2392 8.2392 9.2683 9.2683 9.5996 9.5996 9.6063 9.6063 k = 0.3928 0.4751 0.2133 ( 5786 PWs) bands (ev): -46.0467 -46.0467 -46.0282 -46.0282 -25.6968 -25.6968 -18.1410 -18.1410 -18.0945 -18.0945 -17.9772 -17.9772 -17.9433 -17.9433 -17.9221 -17.9221 -17.8689 -17.8689 -9.5397 -9.5397 -9.3735 -9.3735 -9.1161 -9.1161 -8.7275 -8.7275 -8.4377 -8.4377 1.1485 1.1485 1.4944 1.4944 2.0216 2.0216 2.2965 2.2965 4.3838 4.3838 4.6033 4.6033 8.3078 8.3078 9.3235 9.3235 9.5685 9.5685 9.6231 9.6231 k = 0.3861 0.4867 0.2266 ( 5776 PWs) bands (ev): -46.0464 -46.0464 -46.0285 -46.0285 -25.6966 -25.6966 -18.1399 -18.1399 -18.0949 -18.0949 -17.9756 -17.9756 -17.9434 -17.9434 -17.9231 -17.9231 -17.8710 -17.8710 -9.5518 -9.5518 -9.3757 -9.3757 -9.1148 -9.1148 -8.7090 -8.7090 -8.4397 -8.4397 1.1378 1.1378 1.5079 1.5079 1.9909 1.9909 2.2905 2.2905 4.3619 4.3619 4.6039 4.6039 8.3782 8.3782 9.3694 9.3694 9.5490 9.5490 9.6400 9.6400 k = 0.3794 0.4982 0.2399 ( 5780 PWs) bands (ev): -46.0460 -46.0460 -46.0289 -46.0289 -25.6963 -25.6963 -18.1388 -18.1388 -18.0953 -18.0953 -17.9739 -17.9739 -17.9434 -17.9434 -17.9242 -17.9242 -17.8732 -17.8732 -9.5646 -9.5646 -9.3764 -9.3764 -9.1135 -9.1135 -8.6911 -8.6911 -8.4417 -8.4417 1.1264 1.1264 1.5221 1.5221 1.9606 1.9606 2.2846 2.2846 4.3397 4.3397 4.6042 4.6042 8.4499 8.4499 9.3922 9.3922 9.5547 9.5547 9.6568 9.6568 k = 0.3727 0.5097 0.2533 ( 5776 PWs) bands (ev): -46.0457 -46.0457 -46.0292 -46.0292 -25.6960 -25.6960 -18.1376 -18.1376 -18.0958 -18.0958 -17.9721 -17.9721 -17.9434 -17.9434 -17.9253 -17.9253 -17.8755 -17.8755 -9.5779 -9.5779 -9.3760 -9.3760 -9.1121 -9.1121 -8.6739 -8.6739 -8.4437 -8.4437 1.1143 1.1143 1.5370 1.5370 1.9308 1.9308 2.2788 2.2788 4.3173 4.3173 4.6044 4.6044 8.5223 8.5223 9.3871 9.3871 9.5906 9.5906 9.6734 9.6734 k = 0.3660 0.5212 0.2666 ( 5774 PWs) bands (ev): -46.0453 -46.0453 -46.0296 -46.0296 -25.6957 -25.6957 -18.1364 -18.1364 -18.0963 -18.0963 -17.9702 -17.9702 -17.9435 -17.9435 -17.9263 -17.9263 -17.8778 -17.8778 -9.5915 -9.5915 -9.3747 -9.3747 -9.1107 -9.1107 -8.6575 -8.6575 -8.4457 -8.4457 1.1016 1.1016 1.5525 1.5525 1.9017 1.9017 2.2730 2.2730 4.2948 4.2948 4.6043 4.6043 8.5944 8.5944 9.3686 9.3686 9.6421 9.6421 9.6897 9.6897 k = 0.3593 0.5327 0.2799 ( 5764 PWs) bands (ev): -46.0449 -46.0449 -46.0299 -46.0299 -25.6955 -25.6955 -18.1351 -18.1351 -18.0968 -18.0968 -17.9683 -17.9683 -17.9435 -17.9435 -17.9274 -17.9274 -17.8802 -17.8802 -9.6050 -9.6050 -9.3728 -9.3728 -9.1092 -9.1092 -8.6418 -8.6418 -8.4476 -8.4476 1.0883 1.0883 1.5687 1.5687 1.8735 1.8735 2.2674 2.2674 4.2723 4.2723 4.6039 4.6039 8.6649 8.6649 9.3481 9.3481 9.6985 9.6985 9.7059 9.7059 k = 0.3526 0.5443 0.2933 ( 5776 PWs) bands (ev): -46.0445 -46.0445 -46.0303 -46.0303 -25.6952 -25.6952 -18.1339 -18.1339 -18.0974 -18.0974 -17.9664 -17.9664 -17.9435 -17.9435 -17.9284 -17.9284 -17.8827 -17.8827 -9.6183 -9.6183 -9.3703 -9.3703 -9.1077 -9.1077 -8.6269 -8.6269 -8.4495 -8.4495 1.0745 1.0745 1.5854 1.5854 1.8462 1.8462 2.2620 2.2620 4.2500 4.2500 4.6031 4.6031 8.7319 8.7319 9.3310 9.3310 9.7213 9.7213 9.7556 9.7556 k = 0.3459 0.5558 0.3066 ( 5774 PWs) bands (ev): -46.0441 -46.0441 -46.0307 -46.0307 -25.6949 -25.6949 -18.1326 -18.1326 -18.0980 -18.0980 -17.9643 -17.9643 -17.9435 -17.9435 -17.9295 -17.9295 -17.8853 -17.8853 -9.6313 -9.6313 -9.3676 -9.3676 -9.1062 -9.1062 -8.6129 -8.6129 -8.4513 -8.4513 1.0603 1.0603 1.6028 1.6028 1.8199 1.8199 2.2568 2.2568 4.2279 4.2279 4.6020 4.6020 8.7925 8.7925 9.3217 9.3217 9.7366 9.7366 9.8105 9.8105 k = 0.3392 0.5673 0.3199 ( 5784 PWs) bands (ev): -46.0437 -46.0437 -46.0311 -46.0311 -25.6947 -25.6947 -18.1312 -18.1312 -18.0987 -18.0987 -17.9622 -17.9622 -17.9434 -17.9434 -17.9306 -17.9306 -17.8880 -17.8880 -9.6439 -9.6439 -9.3645 -9.3645 -9.1047 -9.1047 -8.5997 -8.5997 -8.4529 -8.4529 1.0459 1.0459 1.6206 1.6206 1.7947 1.7947 2.2520 2.2520 4.2061 4.2061 4.6005 4.6005 8.8430 8.8430 9.3244 9.3244 9.7515 9.7515 9.8621 9.8621 k = 0.3325 0.5788 0.3332 ( 5788 PWs) bands (ev): -46.0433 -46.0433 -46.0316 -46.0316 -25.6944 -25.6944 -18.1299 -18.1299 -18.0994 -18.0994 -17.9601 -17.9601 -17.9434 -17.9434 -17.9316 -17.9316 -17.8907 -17.8907 -9.6559 -9.6559 -9.3614 -9.3614 -9.1033 -9.1033 -8.5875 -8.5875 -8.4544 -8.4544 1.0313 1.0313 1.6390 1.6390 1.7706 1.7706 2.2475 2.2475 4.1848 4.1848 4.5985 4.5985 8.8796 8.8796 9.3429 9.3429 9.7661 9.7661 9.9092 9.9092 k = 0.3258 0.5904 0.3466 ( 5782 PWs) bands (ev): -46.0428 -46.0428 -46.0320 -46.0320 -25.6942 -25.6942 -18.1285 -18.1285 -18.1002 -18.1002 -17.9578 -17.9578 -17.9432 -17.9432 -17.9326 -17.9326 -17.8934 -17.8934 -9.6672 -9.6672 -9.3582 -9.3582 -9.1018 -9.1018 -8.5761 -8.5761 -8.4558 -8.4558 1.0166 1.0166 1.6579 1.6579 1.7476 1.7476 2.2433 2.2433 4.1640 4.1640 4.5962 4.5962 8.9003 8.9003 9.3791 9.3791 9.7804 9.7804 9.9510 9.9510 k = 0.3191 0.6019 0.3599 ( 5780 PWs) bands (ev): -46.0424 -46.0424 -46.0324 -46.0324 -25.6940 -25.6940 -18.1270 -18.1270 -18.1011 -18.1011 -17.9556 -17.9556 -17.9430 -17.9430 -17.9335 -17.9335 -17.8962 -17.8962 -9.6779 -9.6779 -9.3549 -9.3549 -9.1004 -9.1004 -8.5657 -8.5657 -8.4569 -8.4569 1.0021 1.0021 1.6772 1.6772 1.7259 1.7259 2.2396 2.2396 4.1438 4.1438 4.5933 4.5933 8.9068 8.9068 9.4313 9.4313 9.7945 9.7945 9.9867 9.9867 k = 0.3124 0.6134 0.3732 ( 5774 PWs) bands (ev): -46.0419 -46.0419 -46.0329 -46.0329 -25.6938 -25.6938 -18.1256 -18.1256 -18.1020 -18.1020 -17.9533 -17.9533 -17.9427 -17.9427 -17.9344 -17.9344 -17.8990 -17.8990 -9.6879 -9.6879 -9.3518 -9.3518 -9.0991 -9.0991 -8.5564 -8.5564 -8.4579 -8.4579 0.9877 0.9877 1.6967 1.6967 1.7055 1.7055 2.2364 2.2364 4.1243 4.1243 4.5900 4.5900 8.9026 8.9026 9.4955 9.4955 9.8084 9.8084 10.0156 10.0156 k = 0.3057 0.6249 0.3866 ( 5776 PWs) bands (ev): -46.0415 -46.0415 -46.0333 -46.0333 -25.6936 -25.6936 -18.1241 -18.1241 -18.1029 -18.1029 -17.9512 -17.9512 -17.9423 -17.9423 -17.9352 -17.9352 -17.9018 -17.9018 -9.6970 -9.6970 -9.3487 -9.3487 -9.0978 -9.0978 -8.5480 -8.5480 -8.4587 -8.4587 0.9735 0.9735 1.6856 1.6856 1.7172 1.7172 2.2337 2.2337 4.1056 4.1056 4.5862 4.5862 8.8912 8.8912 9.5679 9.5679 9.8223 9.8223 10.0374 10.0374 k = 0.2990 0.6365 0.3999 ( 5774 PWs) bands (ev): -46.0410 -46.0410 -46.0338 -46.0338 -25.6934 -25.6934 -18.1227 -18.1227 -18.1039 -18.1039 -17.9492 -17.9492 -17.9418 -17.9418 -17.9359 -17.9359 -17.9047 -17.9047 -9.7054 -9.7054 -9.3458 -9.3458 -9.0966 -9.0966 -8.5406 -8.5406 -8.4593 -8.4593 0.9598 0.9598 1.6674 1.6674 1.7376 1.7376 2.2315 2.2315 4.0877 4.0877 4.5819 4.5819 8.8753 8.8753 9.6453 9.6453 9.8362 9.8362 10.0519 10.0519 k = 0.2923 0.6480 0.4132 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6933 -25.6933 -18.1212 -18.1212 -18.1050 -18.1050 -17.9474 -17.9474 -17.9411 -17.9411 -17.9363 -17.9363 -17.9075 -17.9075 -9.7128 -9.7128 -9.3431 -9.3431 -9.0955 -9.0955 -8.5343 -8.5343 -8.4597 -8.4597 0.9464 0.9464 1.6505 1.6505 1.7584 1.7584 2.2299 2.2299 4.0708 4.0708 4.5770 4.5770 8.8566 8.8566 9.7252 9.7252 9.8502 9.8502 10.0590 10.0590 k = 0.2923 0.6480 0.4132 ( 5768 PWs) bands (ev): -46.0405 -46.0405 -46.0343 -46.0343 -25.6933 -25.6933 -18.1212 -18.1212 -18.1050 -18.1050 -17.9474 -17.9474 -17.9411 -17.9411 -17.9363 -17.9363 -17.9075 -17.9075 -9.7128 -9.7128 -9.3431 -9.3431 -9.0955 -9.0955 -8.5343 -8.5343 -8.4597 -8.4597 0.9464 0.9464 1.6505 1.6505 1.7584 1.7584 2.2299 2.2299 4.0708 4.0708 4.5770 4.5770 8.8566 8.8566 9.7252 9.7252 9.8502 9.8502 10.0590 10.0590 k = 0.2751 0.6437 0.4182 ( 5766 PWs) bands (ev): -46.0403 -46.0403 -46.0345 -46.0345 -25.6932 -25.6932 -18.1207 -18.1207 -18.1053 -18.1053 -17.9469 -17.9469 -17.9408 -17.9408 -17.9363 -17.9363 -17.9086 -17.9086 -9.7154 -9.7154 -9.3421 -9.3421 -9.0951 -9.0951 -8.5322 -8.5322 -8.4597 -8.4597 0.9422 0.9422 1.6355 1.6355 1.7749 1.7749 2.2295 2.2295 4.0640 4.0640 4.5749 4.5749 8.8510 8.8510 9.7485 9.7485 9.8586 9.8586 10.0615 10.0615 k = 0.2579 0.6394 0.4231 ( 5769 PWs) bands (ev): -46.0401 -46.0401 -46.0346 -46.0346 -25.6932 -25.6932 -18.1201 -18.1201 -18.1057 -18.1057 -17.9464 -17.9464 -17.9406 -17.9406 -17.9363 -17.9363 -17.9096 -17.9096 -9.7179 -9.7179 -9.3410 -9.3410 -9.0947 -9.0947 -8.5303 -8.5303 -8.4597 -8.4597 0.9394 0.9394 1.6099 1.6099 1.8018 1.8018 2.2293 2.2293 4.0562 4.0562 4.5723 4.5723 8.8489 8.8489 9.7584 9.7584 9.8730 9.8730 10.0665 10.0665 k = 0.2407 0.6352 0.4281 ( 5770 PWs) bands (ev): -46.0400 -46.0400 -46.0348 -46.0348 -25.6931 -25.6931 -18.1196 -18.1196 -18.1062 -18.1062 -17.9459 -17.9459 -17.9405 -17.9405 -17.9361 -17.9361 -17.9107 -17.9107 -9.7204 -9.7204 -9.3399 -9.3399 -9.0944 -9.0944 -8.5286 -8.5286 -8.4597 -8.4597 0.9379 0.9379 1.5803 1.5803 1.8322 1.8322 2.2293 2.2293 4.0472 4.0472 4.5694 4.5694 8.8502 8.8502 9.7574 9.7574 9.8906 9.8906 10.0741 10.0741 k = 0.2235 0.6309 0.4330 ( 5766 PWs) bands (ev): -46.0398 -46.0398 -46.0350 -46.0350 -25.6931 -25.6931 -18.1191 -18.1191 -18.1065 -18.1065 -17.9455 -17.9455 -17.9404 -17.9404 -17.9358 -17.9358 -17.9117 -17.9117 -9.7228 -9.7228 -9.3388 -9.3388 -9.0940 -9.0940 -8.5271 -8.5271 -8.4596 -8.4596 0.9379 0.9379 1.5493 1.5493 1.8635 1.8635 2.2294 2.2294 4.0374 4.0374 4.5663 4.5663 8.8548 8.8548 9.7493 9.7493 9.9080 9.9080 10.0839 10.0839 k = 0.2063 0.6266 0.4380 ( 5770 PWs) bands (ev): -46.0396 -46.0396 -46.0352 -46.0352 -25.6930 -25.6930 -18.1186 -18.1186 -18.1070 -18.1070 -17.9452 -17.9452 -17.9404 -17.9404 -17.9354 -17.9354 -17.9128 -17.9128 -9.7251 -9.7251 -9.3377 -9.3377 -9.0936 -9.0936 -8.5257 -8.5257 -8.4595 -8.4595 0.9393 0.9393 1.5178 1.5178 1.8947 1.8947 2.2297 2.2297 4.0268 4.0268 4.5629 4.5629 8.8626 8.8626 9.7364 9.7364 9.9237 9.9237 10.0951 10.0951 k = 0.1891 0.6223 0.4429 ( 5780 PWs) bands (ev): -46.0394 -46.0394 -46.0354 -46.0354 -25.6930 -25.6930 -18.1181 -18.1181 -18.1074 -18.1074 -17.9449 -17.9449 -17.9404 -17.9404 -17.9348 -17.9348 -17.9139 -17.9139 -9.7273 -9.7273 -9.3366 -9.3366 -9.0932 -9.0932 -8.5244 -8.5244 -8.4594 -8.4594 0.9421 0.9421 1.4865 1.4865 1.9250 1.9250 2.2300 2.2300 4.0157 4.0157 4.5595 4.5595 8.8733 8.8733 9.7200 9.7200 9.9372 9.9372 10.1067 10.1067 k = 0.1719 0.6180 0.4479 ( 5778 PWs) bands (ev): -46.0392 -46.0392 -46.0355 -46.0355 -25.6930 -25.6930 -18.1176 -18.1176 -18.1079 -18.1079 -17.9446 -17.9446 -17.9405 -17.9405 -17.9342 -17.9342 -17.9149 -17.9149 -9.7293 -9.7293 -9.3356 -9.3356 -9.0928 -9.0928 -8.5233 -8.5233 -8.4592 -8.4592 0.9462 0.9462 1.4557 1.4557 1.9541 1.9541 2.2305 2.2305 4.0043 4.0043 4.5561 4.5561 8.8866 8.8866 9.7010 9.7010 9.9488 9.9488 10.1180 10.1180 k = 0.1547 0.6138 0.4528 ( 5774 PWs) bands (ev): -46.0390 -46.0390 -46.0357 -46.0357 -25.6929 -25.6929 -18.1170 -18.1170 -18.1083 -18.1083 -17.9443 -17.9443 -17.9406 -17.9406 -17.9335 -17.9335 -17.9159 -17.9159 -9.7312 -9.7312 -9.3345 -9.3345 -9.0925 -9.0925 -8.5223 -8.5223 -8.4591 -8.4591 0.9517 0.9517 1.4257 1.4257 1.9816 1.9816 2.2309 2.2309 3.9929 3.9929 4.5527 4.5527 8.9021 8.9021 9.6801 9.6801 9.9589 9.9589 10.1282 10.1282 k = 0.1375 0.6095 0.4577 ( 5775 PWs) bands (ev): -46.0389 -46.0389 -46.0359 -46.0359 -25.6929 -25.6929 -18.1165 -18.1165 -18.1088 -18.1088 -17.9441 -17.9441 -17.9408 -17.9408 -17.9326 -17.9326 -17.9170 -17.9170 -9.7330 -9.7330 -9.3336 -9.3336 -9.0922 -9.0922 -8.5214 -8.5214 -8.4590 -8.4590 0.9583 0.9583 1.3968 1.3968 2.0071 2.0071 2.2314 2.2314 3.9816 3.9816 4.5495 4.5495 8.9195 8.9195 9.6579 9.6579 9.9677 9.9677 10.1370 10.1370 k = 0.1203 0.6052 0.4627 ( 5786 PWs) bands (ev): -46.0387 -46.0387 -46.0361 -46.0361 -25.6929 -25.6929 -18.1160 -18.1160 -18.1092 -18.1092 -17.9439 -17.9439 -17.9410 -17.9410 -17.9318 -17.9318 -17.9181 -17.9181 -9.7345 -9.7345 -9.3327 -9.3327 -9.0919 -9.0919 -8.5206 -8.5206 -8.4589 -8.4589 0.9658 0.9658 1.3693 1.3693 2.0304 2.0304 2.2319 2.2319 3.9708 3.9708 4.5464 4.5464 8.9381 8.9381 9.6351 9.6351 9.9753 9.9753 10.1444 10.1444 k = 0.1032 0.6009 0.4676 ( 5782 PWs) bands (ev): -46.0385 -46.0385 -46.0363 -46.0363 -25.6929 -25.6929 -18.1155 -18.1155 -18.1097 -18.1097 -17.9437 -17.9437 -17.9412 -17.9412 -17.9309 -17.9309 -17.9191 -17.9191 -9.7359 -9.7359 -9.3319 -9.3319 -9.0916 -9.0916 -8.5199 -8.5199 -8.4588 -8.4588 0.9741 0.9741 1.3435 1.3435 2.0513 2.0513 2.2324 2.2324 3.9608 3.9608 4.5437 4.5437 8.9573 8.9573 9.6123 9.6123 9.9817 9.9817 10.1503 10.1503 k = 0.0860 0.5967 0.4726 ( 5781 PWs) bands (ev): -46.0383 -46.0383 -46.0365 -46.0365 -25.6928 -25.6928 -18.1150 -18.1150 -18.1101 -18.1101 -17.9435 -17.9435 -17.9413 -17.9413 -17.9301 -17.9301 -17.9202 -17.9202 -9.7371 -9.7371 -9.3312 -9.3312 -9.0914 -9.0914 -8.5194 -8.5194 -8.4587 -8.4587 0.9828 0.9828 1.3199 1.3199 2.0695 2.0695 2.2329 2.2329 3.9518 3.9518 4.5412 4.5412 8.9763 8.9763 9.5903 9.5903 9.9871 9.9871 10.1549 10.1549 k = 0.0688 0.5924 0.4775 ( 5784 PWs) bands (ev): -46.0381 -46.0381 -46.0367 -46.0367 -25.6928 -25.6928 -18.1145 -18.1145 -18.1106 -18.1106 -17.9433 -17.9433 -17.9415 -17.9415 -17.9291 -17.9291 -17.9212 -17.9212 -9.7381 -9.7381 -9.3306 -9.3306 -9.0912 -9.0912 -8.5189 -8.5189 -8.4587 -8.4587 0.9914 0.9914 1.2991 1.2991 2.0846 2.0846 2.2332 2.2332 3.9440 3.9440 4.5392 4.5392 8.9942 8.9942 9.5700 9.5700 9.9915 9.9915 10.1584 10.1584 k = 0.0516 0.5881 0.4825 ( 5786 PWs) bands (ev): -46.0379 -46.0379 -46.0368 -46.0368 -25.6928 -25.6928 -18.1140 -18.1140 -18.1111 -18.1111 -17.9431 -17.9431 -17.9417 -17.9417 -17.9282 -17.9282 -17.9222 -17.9222 -9.7389 -9.7389 -9.3301 -9.3301 -9.0910 -9.0910 -8.5185 -8.5185 -8.4587 -8.4587 0.9993 0.9993 1.2815 1.2815 2.0967 2.0967 2.2336 2.2336 3.9378 3.9378 4.5375 4.5375 9.0098 9.0098 9.5526 9.5526 9.9949 9.9949 10.1609 10.1609 k = 0.0344 0.5838 0.4874 ( 5785 PWs) bands (ev): -46.0378 -46.0378 -46.0370 -46.0370 -25.6928 -25.6928 -18.1135 -18.1135 -18.1115 -18.1115 -17.9430 -17.9430 -17.9418 -17.9418 -17.9272 -17.9272 -17.9233 -17.9233 -9.7395 -9.7395 -9.3298 -9.3298 -9.0909 -9.0909 -8.5183 -8.5183 -8.4586 -8.4586 1.0058 1.0058 1.2681 1.2681 2.1054 2.1054 2.2338 2.2338 3.9331 3.9331 4.5363 4.5363 9.0222 9.0222 9.5390 9.5390 9.9973 9.9973 10.1626 10.1626 k = 0.0172 0.5796 0.4924 ( 5783 PWs) bands (ev): -46.0376 -46.0376 -46.0372 -46.0372 -25.6928 -25.6928 -18.1131 -18.1131 -18.1119 -18.1119 -17.9428 -17.9428 -17.9419 -17.9419 -17.9263 -17.9263 -17.9242 -17.9242 -9.7398 -9.7398 -9.3296 -9.3296 -9.0908 -9.0908 -8.5181 -8.5181 -8.4586 -8.4586 1.0101 1.0101 1.2597 1.2597 2.1107 2.1107 2.2339 2.2339 3.9303 3.9303 4.5356 4.5356 9.0301 9.0301 9.5303 9.5303 9.9987 9.9987 10.1636 10.1636 k = 0.0000 0.5753 0.4973 ( 5782 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6928 -25.6928 -18.1128 -18.1128 -18.1122 -18.1122 -17.9428 -17.9428 -17.9419 -17.9419 -17.9254 -17.9254 -17.9251 -17.9251 -9.7399 -9.7399 -9.3295 -9.3295 -9.0908 -9.0908 -8.5181 -8.5181 -8.4586 -8.4586 1.0116 1.0116 1.2568 1.2568 2.1124 2.1124 2.2340 2.2340 3.9293 3.9293 4.5353 4.5353 9.0328 9.0328 9.5273 9.5273 9.9992 9.9992 10.1639 10.1639 k = 0.0000 0.5753 0.4973 ( 5782 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6928 -25.6928 -18.1128 -18.1128 -18.1122 -18.1122 -17.9428 -17.9428 -17.9419 -17.9419 -17.9254 -17.9254 -17.9251 -17.9251 -9.7399 -9.7399 -9.3295 -9.3295 -9.0908 -9.0908 -8.5181 -8.5181 -8.4586 -8.4586 1.0116 1.0116 1.2568 1.2568 2.1124 2.1124 2.2340 2.2340 3.9293 3.9293 4.5353 4.5353 9.0328 9.0328 9.5273 9.5273 9.9992 9.9992 10.1639 10.1639 k = 0.0066 0.5640 0.5104 ( 5776 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6928 -25.6928 -18.1129 -18.1129 -18.1122 -18.1122 -17.9436 -17.9436 -17.9418 -17.9418 -17.9255 -17.9255 -17.9242 -17.9242 -9.7395 -9.7395 -9.3295 -9.3295 -9.0910 -9.0910 -8.5186 -8.5186 -8.4585 -8.4585 1.0118 1.0118 1.2576 1.2576 2.1126 2.1126 2.2333 2.2333 3.9292 3.9292 4.5339 4.5339 9.0342 9.0342 9.5290 9.5290 9.9991 9.9991 10.1661 10.1661 k = 0.0132 0.5527 0.5235 ( 5770 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6928 -25.6928 -18.1131 -18.1131 -18.1123 -18.1123 -17.9450 -17.9450 -17.9421 -17.9421 -17.9250 -17.9250 -17.9227 -17.9227 -9.7382 -9.7382 -9.3295 -9.3295 -9.0916 -9.0916 -8.5201 -8.5201 -8.4583 -8.4583 1.0122 1.0122 1.2600 1.2600 2.1129 2.1129 2.2313 2.2313 3.9286 3.9286 4.5294 4.5294 9.0385 9.0385 9.5342 9.5342 9.9987 9.9987 10.1727 10.1727 k = 0.0197 0.5413 0.5366 ( 5774 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6927 -25.6927 -18.1135 -18.1135 -18.1124 -18.1124 -17.9468 -17.9468 -17.9430 -17.9430 -17.9237 -17.9237 -17.9208 -17.9208 -9.7360 -9.7360 -9.3294 -9.3294 -9.0925 -9.0925 -8.5226 -8.5226 -8.4579 -8.4579 1.0130 1.0130 1.2640 1.2640 2.1135 2.1135 2.2279 2.2279 3.9278 3.9278 4.5221 4.5221 9.0455 9.0455 9.5427 9.5427 9.9981 9.9981 10.1836 10.1836 k = 0.0263 0.5300 0.5497 ( 5784 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6926 -25.6926 -18.1140 -18.1140 -18.1127 -18.1127 -17.9488 -17.9488 -17.9444 -17.9444 -17.9220 -17.9220 -17.9188 -17.9188 -9.7330 -9.7330 -9.3293 -9.3293 -9.0938 -9.0938 -8.5261 -8.5261 -8.4574 -8.4574 1.0140 1.0140 1.2695 1.2695 2.1143 2.1143 2.2232 2.2232 3.9266 3.9266 4.5119 4.5119 9.0551 9.0551 9.5545 9.5545 9.9972 9.9972 10.1989 10.1989 k = 0.0329 0.5187 0.5627 ( 5784 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6926 -25.6926 -18.1146 -18.1146 -18.1131 -18.1131 -17.9508 -17.9508 -17.9460 -17.9460 -17.9199 -17.9199 -17.9166 -17.9166 -9.7291 -9.7291 -9.3292 -9.3292 -9.0955 -9.0955 -8.5306 -8.5306 -8.4567 -8.4567 1.0153 1.0153 1.2766 1.2766 2.1154 2.1154 2.2172 2.2172 3.9250 3.9250 4.4991 4.4991 9.0672 9.0672 9.5695 9.5695 9.9961 9.9961 10.2185 10.2185 k = 0.0395 0.5074 0.5758 ( 5782 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6924 -25.6924 -18.1153 -18.1153 -18.1135 -18.1135 -17.9528 -17.9528 -17.9477 -17.9477 -17.9176 -17.9176 -17.9142 -17.9142 -9.7244 -9.7244 -9.3290 -9.3290 -9.0975 -9.0975 -8.5361 -8.5361 -8.4559 -8.4559 1.0169 1.0169 1.2853 1.2853 2.1166 2.1166 2.2100 2.2100 3.9231 3.9231 4.4837 4.4837 9.0815 9.0815 9.5875 9.5875 9.9948 9.9948 10.2423 10.2423 k = 0.0461 0.4961 0.5889 ( 5784 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6923 -25.6923 -18.1161 -18.1161 -18.1141 -18.1141 -17.9548 -17.9548 -17.9496 -17.9496 -17.9152 -17.9152 -17.9118 -17.9118 -9.7188 -9.7188 -9.3288 -9.3288 -9.0998 -9.0998 -8.5426 -8.5426 -8.4549 -8.4549 1.0188 1.0188 1.2954 1.2954 2.1180 2.1180 2.2017 2.2017 3.9209 3.9209 4.4659 4.4659 9.0979 9.0979 9.6083 9.6083 9.9935 9.9935 10.2701 10.2701 k = 0.0526 0.4848 0.6020 ( 5778 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6922 -25.6922 -18.1169 -18.1169 -18.1148 -18.1148 -17.9568 -17.9568 -17.9514 -17.9514 -17.9127 -17.9127 -17.9094 -17.9094 -9.7124 -9.7124 -9.3286 -9.3286 -9.1024 -9.1024 -8.5500 -8.5500 -8.4538 -8.4538 1.0210 1.0210 1.3069 1.3069 2.1195 2.1195 2.1922 2.1922 3.9184 3.9184 4.4458 4.4458 9.1161 9.1161 9.6316 9.6316 9.9921 9.9921 10.3020 10.3020 k = 0.0592 0.4735 0.6151 ( 5776 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6920 -25.6920 -18.1179 -18.1179 -18.1155 -18.1155 -17.9587 -17.9587 -17.9531 -17.9531 -17.9101 -17.9101 -17.9070 -17.9070 -9.7053 -9.7053 -9.3283 -9.3283 -9.1053 -9.1053 -8.5583 -8.5583 -8.4526 -8.4526 1.0234 1.0234 1.3197 1.3197 2.1212 2.1212 2.1818 2.1818 3.9156 3.9156 4.4238 4.4238 9.1356 9.1356 9.6572 9.6572 9.9909 9.9909 10.3376 10.3376 k = 0.0658 0.4622 0.6282 ( 5768 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6918 -25.6918 -18.1188 -18.1188 -18.1163 -18.1163 -17.9605 -17.9605 -17.9549 -17.9549 -17.9075 -17.9075 -17.9045 -17.9045 -9.6973 -9.6973 -9.3280 -9.3280 -9.1084 -9.1084 -8.5676 -8.5676 -8.4513 -8.4513 1.0261 1.0261 1.3339 1.3339 2.1229 2.1229 2.1704 2.1704 3.9125 3.9125 4.4000 4.4000 9.1562 9.1562 9.6849 9.6849 9.9901 9.9901 10.3768 10.3768 k = 0.0724 0.4508 0.6413 ( 5772 PWs) bands (ev): -46.0374 -46.0374 -46.0374 -46.0374 -25.6916 -25.6916 -18.1199 -18.1199 -18.1172 -18.1172 -17.9622 -17.9622 -17.9566 -17.9566 -17.9050 -17.9050 -17.9021 -17.9021 -9.6886 -9.6886 -9.3276 -9.3276 -9.1118 -9.1118 -8.5778 -8.5778 -8.4499 -8.4499 1.0291 1.0291 1.3493 1.3493 2.1246 2.1246 2.1582 2.1582 3.9091 3.9091 4.3747 4.3747 9.1775 9.1775 9.7143 9.7143 9.9900 9.9900 10.4193 10.4193 k = 0.0789 0.4395 0.6544 ( 5766 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6914 -25.6914 -18.1210 -18.1210 -18.1182 -18.1182 -17.9639 -17.9639 -17.9583 -17.9583 -17.9024 -17.9024 -17.8997 -17.8997 -9.6792 -9.6792 -9.3271 -9.3271 -9.1153 -9.1153 -8.5889 -8.5889 -8.4484 -8.4484 1.0323 1.0323 1.3659 1.3659 2.1262 2.1262 2.1454 2.1454 3.9055 3.9055 4.3480 4.3480 9.1988 9.1988 9.7450 9.7450 9.9908 9.9908 10.4650 10.4650 k = 0.0855 0.4282 0.6674 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6912 -25.6912 -18.1222 -18.1222 -18.1193 -18.1193 -17.9655 -17.9655 -17.9599 -17.9599 -17.9000 -17.9000 -17.8973 -17.8973 -9.6691 -9.6691 -9.3266 -9.3266 -9.1190 -9.1190 -8.6008 -8.6008 -8.4468 -8.4468 1.0357 1.0357 1.3836 1.3836 2.1264 2.1264 2.1333 2.1333 3.9016 3.9016 4.3202 4.3202 9.2198 9.2198 9.7768 9.7768 9.9929 9.9929 10.5135 10.5135 k = 0.0921 0.4169 0.6805 ( 5758 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6910 -25.6910 -18.1234 -18.1234 -18.1204 -18.1204 -17.9669 -17.9669 -17.9614 -17.9614 -17.8975 -17.8975 -17.8950 -17.8950 -9.6584 -9.6584 -9.3260 -9.3260 -9.1228 -9.1228 -8.6136 -8.6136 -8.4451 -8.4451 1.0394 1.0394 1.4022 1.4022 2.1162 2.1162 2.1310 2.1310 3.8976 3.8976 4.2915 4.2915 9.2399 9.2399 9.8092 9.8092 9.9968 9.9968 10.5647 10.5647 k = 0.0987 0.4056 0.6936 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6908 -25.6908 -18.1246 -18.1246 -18.1216 -18.1216 -17.9684 -17.9684 -17.9629 -17.9629 -17.8950 -17.8950 -17.8927 -17.8927 -9.6471 -9.6471 -9.3253 -9.3253 -9.1267 -9.1267 -8.6272 -8.6272 -8.4434 -8.4434 1.0433 1.0433 1.4218 1.4218 2.1018 2.1018 2.1322 2.1322 3.8933 3.8933 4.2622 4.2622 9.2584 9.2584 9.8419 9.8419 10.0029 10.0029 10.6180 10.6180 k = 0.1053 0.3943 0.7067 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6905 -25.6905 -18.1259 -18.1259 -18.1228 -18.1228 -17.9697 -17.9697 -17.9643 -17.9643 -17.8927 -17.8927 -17.8905 -17.8905 -9.6353 -9.6353 -9.3244 -9.3244 -9.1307 -9.1307 -8.6415 -8.6415 -8.4416 -8.4416 1.0473 1.0473 1.4422 1.4422 2.0868 2.0868 2.1334 2.1334 3.8889 3.8889 4.2326 4.2326 9.2750 9.2750 9.8745 9.8745 10.0117 10.0117 10.6732 10.6732 k = 0.1118 0.3830 0.7198 ( 5758 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6903 -25.6903 -18.1272 -18.1272 -18.1241 -18.1241 -17.9709 -17.9709 -17.9657 -17.9657 -17.8903 -17.8903 -17.8883 -17.8883 -9.6229 -9.6229 -9.3234 -9.3234 -9.1346 -9.1346 -8.6566 -8.6566 -8.4397 -8.4397 1.0516 1.0516 1.4634 1.4634 2.0714 2.0714 2.1345 2.1345 3.8844 3.8844 4.2027 4.2027 9.2890 9.2890 9.9068 9.9068 10.0236 10.0236 10.6827 10.6827 k = 0.1184 0.3716 0.7329 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6901 -25.6901 -18.1285 -18.1285 -18.1254 -18.1254 -17.9721 -17.9721 -17.9669 -17.9669 -17.8881 -17.8881 -17.8862 -17.8862 -9.6102 -9.6102 -9.3221 -9.3221 -9.1386 -9.1386 -8.6724 -8.6724 -8.4379 -8.4379 1.0560 1.0560 1.4851 1.4851 2.0559 2.0559 2.1354 2.1354 3.8798 3.8798 4.1729 4.1729 9.3001 9.3001 9.9382 9.9382 10.0390 10.0390 10.6789 10.6789 k = 0.1250 0.3603 0.7460 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6898 -25.6898 -18.1297 -18.1297 -18.1267 -18.1267 -17.9731 -17.9731 -17.9682 -17.9682 -17.8859 -17.8859 -17.8841 -17.8841 -9.5971 -9.5971 -9.3206 -9.3206 -9.1425 -9.1425 -8.6889 -8.6889 -8.4360 -8.4360 1.0605 1.0605 1.5074 1.5074 2.0403 2.0403 2.1359 2.1359 3.8751 3.8751 4.1433 4.1433 9.3080 9.3080 9.9687 9.9687 10.0581 10.0581 10.6750 10.6750 k = 0.1316 0.3490 0.7591 ( 5762 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6896 -25.6896 -18.1310 -18.1310 -18.1280 -18.1280 -17.9741 -17.9741 -17.9693 -17.9693 -17.8838 -17.8838 -17.8822 -17.8822 -9.5838 -9.5838 -9.3188 -9.3188 -9.1464 -9.1464 -8.7059 -8.7059 -8.4342 -8.4342 1.0651 1.0651 1.5301 1.5301 2.0247 2.0247 2.1360 2.1360 3.8704 3.8704 4.1141 4.1141 9.3126 9.3126 9.9979 9.9979 10.0809 10.0809 10.6712 10.6712 k = 0.1382 0.3377 0.7721 ( 5766 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6893 -25.6893 -18.1323 -18.1323 -18.1293 -18.1293 -17.9750 -17.9750 -17.9704 -17.9704 -17.8818 -17.8818 -17.8803 -17.8803 -9.5703 -9.5703 -9.3165 -9.3165 -9.1502 -9.1502 -8.7236 -8.7236 -8.4323 -8.4323 1.0699 1.0699 1.5532 1.5532 2.0092 2.0092 2.1357 2.1357 3.8657 3.8657 4.0855 4.0855 9.3139 9.3139 10.0256 10.0256 10.1074 10.1074 10.6673 10.6673 k = 0.1447 0.3264 0.7852 ( 5766 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6891 -25.6891 -18.1335 -18.1335 -18.1306 -18.1306 -17.9758 -17.9758 -17.9714 -17.9714 -17.8799 -17.8799 -17.8785 -17.8785 -9.5569 -9.5569 -9.3137 -9.3137 -9.1538 -9.1538 -8.7418 -8.7418 -8.4305 -8.4305 1.0746 1.0746 1.5764 1.5764 1.9939 1.9939 2.1349 2.1349 3.8610 3.8610 4.0578 4.0578 9.3123 9.3123 10.0518 10.0518 10.1374 10.1374 10.6634 10.6634 k = 0.1513 0.3151 0.7983 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6888 -25.6888 -18.1347 -18.1347 -18.1319 -18.1319 -17.9766 -17.9766 -17.9724 -17.9724 -17.8781 -17.8781 -17.8768 -17.8768 -9.5436 -9.5436 -9.3104 -9.3104 -9.1573 -9.1573 -8.7605 -8.7605 -8.4287 -8.4287 1.0794 1.0794 1.5997 1.5997 1.9790 1.9790 2.1336 2.1336 3.8564 3.8564 4.0310 4.0310 9.3080 9.3080 10.0763 10.0763 10.1703 10.1703 10.6594 10.6594 k = 0.1579 0.3038 0.8114 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6886 -25.6886 -18.1358 -18.1358 -18.1331 -18.1331 -17.9772 -17.9772 -17.9733 -17.9733 -17.8764 -17.8764 -17.8751 -17.8751 -9.5307 -9.5307 -9.3062 -9.3062 -9.1606 -9.1606 -8.7796 -8.7796 -8.4269 -8.4269 1.0842 1.0842 1.6230 1.6230 1.9644 1.9644 2.1317 2.1317 3.8519 3.8519 4.0052 4.0052 9.3014 9.3014 10.0991 10.0991 10.2057 10.2057 10.6553 10.6553 k = 0.1645 0.2925 0.8245 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6884 -25.6884 -18.1369 -18.1369 -18.1343 -18.1343 -17.9778 -17.9778 -17.9741 -17.9741 -17.8747 -17.8747 -17.8736 -17.8736 -9.5182 -9.5182 -9.3013 -9.3013 -9.1637 -9.1637 -8.7991 -8.7991 -8.4253 -8.4253 1.0890 1.0890 1.6462 1.6462 1.9504 1.9504 2.1291 2.1291 3.8475 3.8475 3.9808 3.9808 9.2930 9.2930 10.1203 10.1203 10.2431 10.2431 10.6510 10.6510 k = 0.1711 0.2811 0.8376 ( 5762 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6882 -25.6882 -18.1379 -18.1379 -18.1355 -18.1355 -17.9784 -17.9784 -17.9749 -17.9749 -17.8732 -17.8732 -17.8722 -17.8722 -9.5064 -9.5064 -9.2953 -9.2953 -9.1666 -9.1666 -8.8189 -8.8189 -8.4237 -8.4237 1.0936 1.0936 1.6691 1.6691 1.9369 1.9369 2.1260 2.1260 3.8433 3.8433 3.9576 3.9576 9.2833 9.2833 10.1397 10.1397 10.2818 10.2818 10.6466 10.6466 k = 0.1776 0.2698 0.8507 ( 5770 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6880 -25.6880 -18.1389 -18.1389 -18.1366 -18.1366 -17.9789 -17.9789 -17.9756 -17.9756 -17.8718 -17.8718 -17.8709 -17.8709 -9.4954 -9.4954 -9.2883 -9.2883 -9.1693 -9.1693 -8.8389 -8.8389 -8.4221 -8.4221 1.0981 1.0981 1.6916 1.6916 1.9241 1.9241 2.1222 2.1222 3.8393 3.8393 3.9360 3.9360 9.2727 9.2727 10.1576 10.1576 10.3212 10.3212 10.6421 10.6421 k = 0.1842 0.2585 0.8638 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6878 -25.6878 -18.1398 -18.1398 -18.1376 -18.1376 -17.9793 -17.9793 -17.9763 -17.9763 -17.8705 -17.8705 -17.8697 -17.8697 -9.4855 -9.4855 -9.2801 -9.2801 -9.1718 -9.1718 -8.8591 -8.8591 -8.4207 -8.4207 1.1024 1.1024 1.7135 1.7135 1.9121 1.9121 2.1179 2.1179 3.8355 3.8355 3.9160 3.9160 9.2616 9.2616 10.1738 10.1738 10.3606 10.3606 10.6374 10.6374 k = 0.1908 0.2472 0.8768 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6876 -25.6876 -18.1406 -18.1406 -18.1386 -18.1386 -17.9796 -17.9796 -17.9769 -17.9769 -17.8693 -17.8693 -17.8685 -17.8685 -9.4766 -9.4766 -9.2707 -9.2707 -9.1739 -9.1739 -8.8792 -8.8792 -8.4194 -8.4194 1.1065 1.1065 1.7347 1.7347 1.9010 1.9010 2.1129 2.1129 3.8320 3.8320 3.8976 3.8976 9.2504 9.2504 10.1886 10.1886 10.3994 10.3994 10.6328 10.6328 k = 0.1974 0.2359 0.8899 ( 5766 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6874 -25.6874 -18.1414 -18.1414 -18.1395 -18.1395 -17.9799 -17.9799 -17.9775 -17.9775 -17.8682 -17.8682 -17.8676 -17.8676 -9.4688 -9.4688 -9.2602 -9.2602 -9.1758 -9.1758 -8.8992 -8.8992 -8.4182 -8.4182 1.1104 1.1104 1.7550 1.7550 1.8907 1.8907 2.1075 2.1075 3.8288 3.8288 3.8810 3.8810 9.2395 9.2395 10.2018 10.2018 10.4368 10.4368 10.6282 10.6282 k = 0.2039 0.2246 0.9030 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6873 -25.6873 -18.1420 -18.1420 -18.1403 -18.1403 -17.9801 -17.9801 -17.9780 -17.9780 -17.8672 -17.8672 -17.8667 -17.8667 -9.4623 -9.4623 -9.2487 -9.2487 -9.1774 -9.1774 -8.9190 -8.9190 -8.4171 -8.4171 1.1139 1.1139 1.7742 1.7742 1.8815 1.8815 2.1017 2.1017 3.8258 3.8258 3.8662 3.8662 9.2292 9.2292 10.2137 10.2137 10.4721 10.4721 10.6237 10.6237 k = 0.2105 0.2133 0.9161 ( 5762 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6872 -25.6872 -18.1426 -18.1426 -18.1410 -18.1410 -17.9803 -17.9803 -17.9784 -17.9784 -17.8664 -17.8664 -17.8659 -17.8659 -9.4568 -9.4568 -9.2367 -9.2367 -9.1787 -9.1787 -8.9382 -8.9382 -8.4161 -8.4161 1.1171 1.1171 1.7919 1.7919 1.8733 1.8733 2.0956 2.0956 3.8231 3.8231 3.8534 3.8534 9.2197 9.2197 10.2240 10.2240 10.5047 10.5047 10.6194 10.6194 k = 0.2171 0.2019 0.9292 ( 5764 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6871 -25.6871 -18.1430 -18.1430 -18.1417 -18.1417 -17.9804 -17.9804 -17.9788 -17.9788 -17.8657 -17.8657 -17.8653 -17.8653 -9.4524 -9.4524 -9.2245 -9.2245 -9.1795 -9.1795 -8.9565 -8.9565 -8.4153 -8.4153 1.1198 1.1198 1.8080 1.8080 1.8663 1.8663 2.0896 2.0896 3.8207 3.8207 3.8425 3.8425 9.2113 9.2113 10.2329 10.2329 10.5337 10.5337 10.6156 10.6156 k = 0.2237 0.1906 0.9423 ( 5770 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6870 -25.6870 -18.1434 -18.1434 -18.1422 -18.1422 -17.9805 -17.9805 -17.9792 -17.9792 -17.8651 -17.8651 -17.8648 -17.8648 -9.4490 -9.4490 -9.2129 -9.2129 -9.1795 -9.1795 -8.9735 -8.9735 -8.4146 -8.4146 1.1221 1.1221 1.8221 1.8221 1.8605 1.8605 2.0839 2.0839 3.8185 3.8185 3.8338 3.8338 9.2041 9.2041 10.2403 10.2403 10.5585 10.5585 10.6121 10.6121 k = 0.2303 0.1793 0.9554 ( 5778 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6869 -25.6869 -18.1437 -18.1437 -18.1426 -18.1426 -17.9805 -17.9805 -17.9795 -17.9795 -17.8647 -17.8647 -17.8644 -17.8644 -9.4464 -9.4464 -9.2030 -9.2030 -9.1785 -9.1785 -8.9886 -8.9886 -8.4141 -8.4141 1.1240 1.1240 1.8337 1.8337 1.8559 1.8559 2.0788 2.0788 3.8165 3.8165 3.8273 3.8273 9.1984 9.1984 10.2461 10.2461 10.5786 10.5786 10.6094 10.6094 k = 0.2368 0.1680 0.9685 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6869 -25.6869 -18.1439 -18.1439 -18.1429 -18.1429 -17.9805 -17.9805 -17.9798 -17.9798 -17.8643 -17.8643 -17.8642 -17.8642 -9.4447 -9.4447 -9.1964 -9.1964 -9.1759 -9.1759 -9.0007 -9.0007 -8.4137 -8.4137 1.1253 1.1253 1.8423 1.8423 1.8527 1.8527 2.0747 2.0747 3.8146 3.8146 3.8231 3.8231 9.1942 9.1942 10.2503 10.2503 10.5932 10.5932 10.6073 10.6073 k = 0.2434 0.1567 0.9815 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9805 -17.9805 -17.9800 -17.9800 -17.8641 -17.8641 -17.8640 -17.8640 -9.4436 -9.4436 -9.1933 -9.1933 -9.1727 -9.1727 -9.0088 -9.0088 -8.4135 -8.4135 1.1261 1.1261 1.8473 1.8473 1.8512 1.8512 2.0721 2.0721 3.8130 3.8130 3.8209 3.8209 9.1917 9.1917 10.2529 10.2529 10.6019 10.6019 10.6064 10.6064 k = 0.2500 0.1454 0.9946 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9805 -17.9805 -17.9800 -17.9800 -17.8640 -17.8640 -17.8640 -17.8640 -9.4433 -9.4433 -9.1925 -9.1925 -9.1713 -9.1713 -9.0116 -9.0116 -8.4134 -8.4134 1.1264 1.1264 1.8483 1.8483 1.8514 1.8514 2.0712 2.0712 3.8124 3.8124 3.8203 3.8203 9.1908 9.1908 10.2537 10.2537 10.6040 10.6040 10.6069 10.6069 k = 0.2500 0.1454 0.9946 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9805 -17.9805 -17.9800 -17.9800 -17.8640 -17.8640 -17.8640 -17.8640 -9.4433 -9.4433 -9.1925 -9.1925 -9.1713 -9.1713 -9.0116 -9.0116 -8.4134 -8.4134 1.1264 1.1264 1.8483 1.8483 1.8514 1.8514 2.0712 2.0712 3.8124 3.8124 3.8203 3.8203 9.1908 9.1908 10.2537 10.2537 10.6040 10.6040 10.6069 10.6069 k = 0.2639 0.1535 0.9853 ( 5776 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9805 -17.9805 -17.9800 -17.9800 -17.8641 -17.8641 -17.8640 -17.8640 -9.4434 -9.4434 -9.1927 -9.1927 -9.1717 -9.1717 -9.0109 -9.0109 -8.4134 -8.4134 1.1262 1.1262 1.8344 1.8344 1.8655 1.8655 2.0717 2.0717 3.7805 3.7805 3.8524 3.8524 9.1889 9.1889 10.2575 10.2575 10.5651 10.5651 10.6451 10.6451 k = 0.2778 0.1615 0.9759 ( 5770 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9805 -17.9805 -17.9799 -17.9799 -17.8641 -17.8641 -17.8640 -17.8640 -9.4436 -9.4436 -9.1933 -9.1933 -9.1728 -9.1728 -9.0088 -9.0088 -8.4134 -8.4134 1.1257 1.1257 1.8197 1.8197 1.8803 1.8803 2.0730 2.0730 3.7454 3.7454 3.8878 3.8878 9.1833 9.1833 10.2686 10.2686 10.5252 10.5252 10.6831 10.6831 k = 0.2917 0.1696 0.9666 ( 5766 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1430 -18.1430 -17.9805 -17.9805 -17.9798 -17.9798 -17.8642 -17.8642 -17.8640 -17.8640 -9.4440 -9.4440 -9.1943 -9.1943 -9.1745 -9.1745 -9.0054 -9.0054 -8.4135 -8.4135 1.1250 1.1250 1.8059 1.8059 1.8943 1.8943 2.0753 2.0753 3.7110 3.7110 3.9228 3.9228 9.1746 9.1746 10.2864 10.2864 10.4859 10.4859 10.7190 10.7190 k = 0.3056 0.1777 0.9573 ( 5756 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6869 -25.6869 -18.1439 -18.1439 -18.1429 -18.1429 -17.9805 -17.9805 -17.9797 -17.9797 -17.8644 -17.8644 -17.8640 -17.8640 -9.4446 -9.4446 -9.1959 -9.1959 -9.1764 -9.1764 -9.0008 -9.0008 -8.4136 -8.4136 1.1242 1.1242 1.7929 1.7929 1.9071 1.9071 2.0784 2.0784 3.6777 3.6777 3.9571 3.9571 9.1636 9.1636 10.3103 10.3103 10.4476 10.4476 10.7527 10.7527 k = 0.3194 0.1858 0.9479 ( 5754 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6869 -25.6869 -18.1438 -18.1438 -18.1428 -18.1428 -17.9805 -17.9805 -17.9795 -17.9795 -17.8647 -17.8647 -17.8640 -17.8640 -9.4454 -9.4454 -9.1983 -9.1983 -9.1784 -9.1784 -8.9953 -8.9953 -8.4138 -8.4138 1.1232 1.1232 1.7809 1.7809 1.9188 1.9188 2.0823 2.0823 3.6459 3.6459 3.9904 3.9904 9.1511 9.1511 10.3394 10.3394 10.4106 10.4106 10.7840 10.7840 k = 0.3333 0.1938 0.9386 ( 5746 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6869 -25.6869 -18.1436 -18.1436 -18.1426 -18.1426 -17.9805 -17.9805 -17.9794 -17.9794 -17.8650 -17.8650 -17.8640 -17.8640 -9.4463 -9.4463 -9.2015 -9.2015 -9.1801 -9.1801 -8.9888 -8.9888 -8.4140 -8.4140 1.1222 1.1222 1.7699 1.7699 1.9292 1.9292 2.0865 2.0865 3.6160 3.6160 4.0226 4.0226 9.1378 9.1378 10.3714 10.3714 10.3766 10.3766 10.8128 10.8128 k = 0.3472 0.2019 0.9292 ( 5751 PWs) bands (ev): -46.0374 -46.0374 -46.0371 -46.0371 -25.6869 -25.6869 -18.1436 -18.1436 -18.1423 -18.1423 -17.9805 -17.9805 -17.9792 -17.9792 -17.8653 -17.8653 -17.8640 -17.8640 -9.4474 -9.4474 -9.2055 -9.2055 -9.1814 -9.1814 -8.9817 -8.9817 -8.4142 -8.4142 1.1213 1.1213 1.7600 1.7600 1.9384 1.9384 2.0906 2.0906 3.5882 3.5882 4.0533 4.0533 9.1245 9.1245 10.3412 10.3412 10.4101 10.4101 10.8389 10.8389 k = 0.3611 0.2100 0.9199 ( 5752 PWs) bands (ev): -46.0374 -46.0374 -46.0371 -46.0371 -25.6870 -25.6870 -18.1435 -18.1435 -18.1421 -18.1421 -17.9805 -17.9805 -17.9791 -17.9791 -17.8658 -17.8658 -17.8641 -17.8641 -9.4487 -9.4487 -9.2102 -9.2102 -9.1823 -9.1823 -8.9739 -8.9739 -8.4145 -8.4145 1.1204 1.1204 1.7512 1.7512 1.9467 1.9467 2.0943 2.0943 3.5630 3.5630 4.0823 4.0823 9.1117 9.1117 10.3098 10.3098 10.4495 10.4495 10.8625 10.8625 k = 0.3750 0.2181 0.9105 ( 5747 PWs) bands (ev): -46.0374 -46.0374 -46.0370 -46.0370 -25.6870 -25.6870 -18.1433 -18.1433 -18.1417 -18.1417 -17.9804 -17.9804 -17.9789 -17.9789 -17.8662 -17.8662 -17.8641 -17.8641 -9.4501 -9.4501 -9.2154 -9.2154 -9.1830 -9.1830 -8.9656 -8.9656 -8.4149 -8.4149 1.1196 1.1196 1.7434 1.7434 1.9543 1.9543 2.0969 2.0969 3.5407 3.5407 4.1095 4.1095 9.1001 9.1001 10.2809 10.2809 10.4907 10.4907 10.8835 10.8835 k = 0.3889 0.2261 0.9012 ( 5749 PWs) bands (ev): -46.0375 -46.0375 -46.0370 -46.0370 -25.6871 -25.6871 -18.1432 -18.1432 -18.1413 -18.1413 -17.9804 -17.9804 -17.9787 -17.9787 -17.8668 -17.8668 -17.8642 -17.8642 -9.4517 -9.4517 -9.2209 -9.2209 -9.1835 -9.1835 -8.9570 -8.9570 -8.4153 -8.4153 1.1190 1.1190 1.7369 1.7369 1.9613 1.9613 2.0979 2.0979 3.5217 3.5217 4.1347 4.1347 9.0902 9.0902 10.2547 10.2547 10.5326 10.5326 10.9018 10.9018 k = 0.4028 0.2342 0.8919 ( 5746 PWs) bands (ev): -46.0375 -46.0375 -46.0369 -46.0369 -25.6871 -25.6871 -18.1431 -18.1431 -18.1409 -18.1409 -17.9803 -17.9803 -17.9785 -17.9785 -17.8674 -17.8674 -17.8642 -17.8642 -9.4535 -9.4535 -9.2265 -9.2265 -9.1838 -9.1838 -8.9480 -8.9480 -8.4158 -8.4158 1.1186 1.1186 1.7315 1.7315 1.9681 1.9681 2.0970 2.0970 3.5061 3.5061 4.1576 4.1576 9.0823 9.0823 10.2315 10.2315 10.5741 10.5741 10.9177 10.9177 k = 0.4167 0.2423 0.8825 ( 5742 PWs) bands (ev): -46.0376 -46.0376 -46.0369 -46.0369 -25.6872 -25.6872 -18.1430 -18.1430 -18.1404 -18.1404 -17.9803 -17.9803 -17.9782 -17.9782 -17.8680 -17.8680 -17.8643 -17.8643 -9.4554 -9.4554 -9.2323 -9.2323 -9.1840 -9.1840 -8.9387 -8.9387 -8.4164 -8.4164 1.1183 1.1183 1.7274 1.7274 1.9746 1.9746 2.0936 2.0936 3.4943 3.4943 4.1781 4.1781 9.0767 9.0767 10.2116 10.2116 10.6138 10.6138 10.9313 10.9313 k = 0.4306 0.2504 0.8732 ( 5738 PWs) bands (ev): -46.0377 -46.0377 -46.0368 -46.0368 -25.6872 -25.6872 -18.1429 -18.1429 -18.1399 -18.1399 -17.9802 -17.9802 -17.9780 -17.9780 -17.8687 -17.8687 -17.8644 -17.8644 -9.4576 -9.4576 -9.2380 -9.2380 -9.1841 -9.1841 -8.9293 -8.9293 -8.4170 -8.4170 1.1183 1.1183 1.7244 1.7244 1.9811 1.9811 2.0877 2.0877 3.4864 3.4864 4.1961 4.1961 9.0737 9.0737 10.1952 10.1952 10.6498 10.6498 10.9430 10.9430 k = 0.4444 0.2585 0.8638 ( 5748 PWs) bands (ev): -46.0377 -46.0377 -46.0368 -46.0368 -25.6873 -25.6873 -18.1428 -18.1428 -18.1393 -18.1393 -17.9801 -17.9801 -17.9778 -17.9778 -17.8695 -17.8695 -17.8644 -17.8644 -9.4599 -9.4599 -9.2437 -9.2437 -9.1842 -9.1842 -8.9197 -8.9197 -8.4177 -8.4177 1.1185 1.1185 1.7227 1.7227 1.9877 1.9877 2.0789 2.0789 3.4826 3.4826 4.2115 4.2115 9.0734 9.0734 10.1824 10.1824 10.6795 10.6795 10.9538 10.9538 k = 0.4583 0.2665 0.8545 ( 5752 PWs) bands (ev): -46.0378 -46.0378 -46.0367 -46.0367 -25.6874 -25.6874 -18.1428 -18.1428 -18.1387 -18.1387 -17.9800 -17.9800 -17.9775 -17.9775 -17.8703 -17.8703 -17.8645 -17.8645 -9.4624 -9.4624 -9.2494 -9.2494 -9.1841 -9.1841 -8.9100 -8.9100 -8.4184 -8.4184 1.1189 1.1189 1.7222 1.7222 1.9944 1.9944 2.0672 2.0672 3.4827 3.4827 4.2241 4.2241 9.0761 9.0761 10.1732 10.1732 10.6995 10.6995 10.9650 10.9650 k = 0.4722 0.2746 0.8451 ( 5750 PWs) bands (ev): -46.0379 -46.0379 -46.0366 -46.0366 -25.6875 -25.6875 -18.1426 -18.1426 -18.1381 -18.1381 -17.9799 -17.9799 -17.9773 -17.9773 -17.8711 -17.8711 -17.8646 -17.8646 -9.4651 -9.4651 -9.2548 -9.2548 -9.1840 -9.1840 -8.9002 -8.9002 -8.4192 -8.4192 1.1196 1.1196 1.7230 1.7230 2.0012 2.0012 2.0528 2.0528 3.4869 3.4869 4.2339 4.2339 9.0816 9.0816 10.1679 10.1679 10.7065 10.7065 10.9775 10.9775 k = 0.4861 0.2827 0.8358 ( 5744 PWs) bands (ev): -46.0380 -46.0380 -46.0365 -46.0365 -25.6876 -25.6876 -18.1425 -18.1425 -18.1374 -18.1374 -17.9797 -17.9797 -17.9770 -17.9770 -17.8720 -17.8720 -17.8647 -17.8647 -9.4679 -9.4679 -9.2601 -9.2601 -9.1838 -9.1838 -8.8903 -8.8903 -8.4200 -8.4200 1.1204 1.1204 1.7250 1.7250 2.0080 2.0080 2.0357 2.0357 3.4949 3.4949 4.2409 4.2409 9.0901 9.0901 10.1664 10.1664 10.6985 10.6985 10.9888 10.9888 k = 0.5000 0.2908 0.8265 ( 5742 PWs) bands (ev): -46.0381 -46.0381 -46.0364 -46.0364 -25.6876 -25.6876 -18.1424 -18.1424 -18.1366 -18.1366 -17.9796 -17.9796 -17.9767 -17.9767 -17.8729 -17.8729 -17.8648 -17.8648 -9.4710 -9.4710 -9.2653 -9.2653 -9.1836 -9.1836 -8.8805 -8.8805 -8.4209 -8.4209 1.1213 1.1213 1.7282 1.7282 2.0124 2.0124 2.0190 2.0190 3.5066 3.5066 4.2450 4.2450 9.1014 9.1014 10.1687 10.1687 10.6763 10.6763 10.9901 10.9901 k = 0.5000 0.2908 0.8265 ( 5742 PWs) bands (ev): -46.0381 -46.0381 -46.0364 -46.0364 -25.6876 -25.6876 -18.1424 -18.1424 -18.1366 -18.1366 -17.9796 -17.9796 -17.9767 -17.9767 -17.8729 -17.8729 -17.8648 -17.8648 -9.4710 -9.4710 -9.2653 -9.2653 -9.1836 -9.1836 -8.8805 -8.8805 -8.4209 -8.4209 1.1213 1.1213 1.7282 1.7282 2.0124 2.0124 2.0190 2.0190 3.5066 3.5066 4.2450 4.2450 9.1014 9.1014 10.1687 10.1687 10.6763 10.6763 10.9901 10.9901 k = 0.5000 0.2908 0.8077 ( 5756 PWs) bands (ev): -46.0383 -46.0383 -46.0363 -46.0363 -25.6878 -25.6878 -18.1423 -18.1423 -18.1351 -18.1351 -17.9793 -17.9793 -17.9761 -17.9761 -17.8750 -17.8750 -17.8650 -17.8650 -9.4775 -9.4775 -9.2749 -9.2749 -9.1830 -9.1830 -8.8607 -8.8607 -8.4227 -8.4227 1.1235 1.1235 1.7364 1.7364 1.9974 1.9974 2.0061 2.0061 3.5346 3.5346 4.2506 4.2506 9.1273 9.1273 10.1773 10.1773 10.6160 10.6160 10.9768 10.9768 k = 0.5000 0.2908 0.7889 ( 5748 PWs) bands (ev): -46.0385 -46.0385 -46.0361 -46.0361 -25.6880 -25.6880 -18.1420 -18.1420 -18.1334 -18.1334 -17.9788 -17.9788 -17.9753 -17.9753 -17.8773 -17.8773 -17.8652 -17.8652 -9.4846 -9.4846 -9.2836 -9.2836 -9.1824 -9.1824 -8.8413 -8.8413 -8.4246 -8.4246 1.1256 1.1256 1.7453 1.7453 1.9804 1.9804 1.9941 1.9941 3.5646 3.5646 4.2568 4.2568 9.1536 9.1536 10.1865 10.1865 10.5506 10.5506 10.9676 10.9676 k = 0.5000 0.2908 0.7701 ( 5752 PWs) bands (ev): -46.0387 -46.0387 -46.0358 -46.0358 -25.6883 -25.6883 -18.1418 -18.1418 -18.1316 -18.1316 -17.9784 -17.9784 -17.9745 -17.9745 -17.8796 -17.8796 -17.8654 -17.8654 -9.4921 -9.4921 -9.2913 -9.2913 -9.1817 -9.1817 -8.8224 -8.8224 -8.4266 -8.4266 1.1278 1.1278 1.7551 1.7551 1.9623 1.9623 1.9824 1.9824 3.5964 3.5964 4.2635 4.2635 9.1798 9.1798 10.1962 10.1962 10.4809 10.4809 10.9625 10.9625 k = 0.5000 0.2908 0.7513 ( 5752 PWs) bands (ev): -46.0389 -46.0389 -46.0356 -46.0356 -25.6885 -25.6885 -18.1416 -18.1416 -18.1298 -18.1298 -17.9780 -17.9780 -17.9736 -17.9736 -17.8822 -17.8822 -17.8656 -17.8656 -9.4998 -9.4998 -9.2981 -9.2981 -9.1809 -9.1809 -8.8041 -8.8041 -8.4286 -8.4286 1.1300 1.1300 1.7657 1.7657 1.9433 1.9433 1.9712 1.9712 3.6297 3.6297 4.2707 4.2707 9.2052 9.2052 10.2063 10.2063 10.4078 10.4078 10.9617 10.9617 k = 0.5000 0.2908 0.7325 ( 5756 PWs) bands (ev): -46.0392 -46.0392 -46.0354 -46.0354 -25.6888 -25.6888 -18.1414 -18.1414 -18.1279 -18.1279 -17.9776 -17.9776 -17.9727 -17.9727 -17.8848 -17.8848 -17.8658 -17.8658 -9.5076 -9.5076 -9.3042 -9.3042 -9.1800 -9.1800 -8.7866 -8.7866 -8.4305 -8.4305 1.1321 1.1321 1.7770 1.7770 1.9237 1.9237 1.9607 1.9607 3.6644 3.6644 4.2783 4.2783 9.2293 9.2293 10.2164 10.2164 10.3318 10.3318 10.9472 10.9472 k = 0.5000 0.2908 0.7138 ( 5758 PWs) bands (ev): -46.0395 -46.0395 -46.0351 -46.0351 -25.6891 -25.6891 -18.1412 -18.1412 -18.1259 -18.1259 -17.9771 -17.9771 -17.9716 -17.9716 -17.8876 -17.8876 -17.8661 -17.8661 -9.5153 -9.5153 -9.3096 -9.3096 -9.1791 -9.1791 -8.7699 -8.7699 -8.4325 -8.4325 1.1340 1.1340 1.7892 1.7892 1.9036 1.9036 1.9509 1.9509 3.7002 3.7002 4.2864 4.2864 9.2517 9.2517 10.2264 10.2264 10.2536 10.2536 10.8870 10.8870 k = 0.5000 0.2908 0.6950 ( 5752 PWs) bands (ev): -46.0398 -46.0398 -46.0348 -46.0348 -25.6893 -25.6893 -18.1409 -18.1409 -18.1239 -18.1239 -17.9766 -17.9766 -17.9704 -17.9704 -17.8904 -17.8904 -17.8663 -17.8663 -9.5228 -9.5228 -9.3144 -9.3144 -9.1782 -9.1782 -8.7541 -8.7541 -8.4344 -8.4344 1.1359 1.1359 1.8020 1.8020 1.8831 1.8831 1.9422 1.9422 3.7369 3.7369 4.2949 4.2949 9.2719 9.2719 10.1734 10.1734 10.2361 10.2361 10.8250 10.8250 k = 0.5000 0.2908 0.6762 ( 5758 PWs) bands (ev): -46.0401 -46.0401 -46.0345 -46.0345 -25.6897 -25.6897 -18.1407 -18.1407 -18.1219 -18.1219 -17.9761 -17.9761 -17.9691 -17.9691 -17.8934 -17.8934 -17.8665 -17.8665 -9.5299 -9.5299 -9.3188 -9.3188 -9.1771 -9.1771 -8.7395 -8.7395 -8.4362 -8.4362 1.1376 1.1376 1.8156 1.8156 1.8624 1.8624 1.9348 1.9348 3.7744 3.7744 4.3039 4.3039 9.2897 9.2897 10.0921 10.0921 10.2447 10.2447 10.7618 10.7618 k = 0.5000 0.2908 0.6574 ( 5776 PWs) bands (ev): -46.0404 -46.0404 -46.0343 -46.0343 -25.6900 -25.6900 -18.1406 -18.1406 -18.1200 -18.1200 -17.9757 -17.9757 -17.9677 -17.9677 -17.8966 -17.8966 -17.8668 -17.8668 -9.5366 -9.5366 -9.3227 -9.3227 -9.1760 -9.1760 -8.7259 -8.7259 -8.4379 -8.4379 1.1391 1.1391 1.8297 1.8297 1.8416 1.8416 1.9287 1.9287 3.8124 3.8124 4.3131 4.3131 9.3047 9.3047 10.0099 10.0099 10.2518 10.2518 10.6978 10.6978 k = 0.5000 0.2908 0.6386 ( 5774 PWs) bands (ev): -46.0407 -46.0407 -46.0340 -46.0340 -25.6903 -25.6903 -18.1404 -18.1404 -18.1180 -18.1180 -17.9752 -17.9752 -17.9661 -17.9661 -17.8997 -17.8997 -17.8670 -17.8670 -9.5426 -9.5426 -9.3264 -9.3264 -9.1749 -9.1749 -8.7136 -8.7136 -8.4395 -8.4395 1.1404 1.1404 1.8203 1.8203 1.8450 1.8450 1.9242 1.9242 3.8507 3.8507 4.3227 4.3227 9.3166 9.3166 9.9275 9.9275 10.2566 10.2566 10.6335 10.6335 k = 0.5000 0.2908 0.6198 ( 5774 PWs) bands (ev): -46.0410 -46.0410 -46.0337 -46.0337 -25.6906 -25.6906 -18.1403 -18.1403 -18.1160 -18.1160 -17.9747 -17.9747 -17.9644 -17.9644 -17.9029 -17.9029 -17.8671 -17.8671 -9.5479 -9.5479 -9.3299 -9.3299 -9.1737 -9.1737 -8.7027 -8.7027 -8.4409 -8.4409 1.1416 1.1416 1.7994 1.7994 1.8606 1.8606 1.9214 1.9214 3.8893 3.8893 4.3326 4.3326 9.3250 9.3250 9.8456 9.8456 10.2582 10.2582 10.5692 10.5692 k = 0.5000 0.2908 0.6011 ( 5774 PWs) bands (ev): -46.0414 -46.0414 -46.0333 -46.0333 -25.6910 -25.6910 -18.1401 -18.1401 -18.1141 -18.1141 -17.9743 -17.9743 -17.9626 -17.9626 -17.9060 -17.9060 -17.8673 -17.8673 -9.5525 -9.5525 -9.3331 -9.3331 -9.1724 -9.1724 -8.6930 -8.6930 -8.4421 -8.4421 1.1426 1.1426 1.7785 1.7785 1.8768 1.8768 1.9204 1.9204 3.9279 3.9279 4.3428 4.3428 9.3292 9.3292 9.7656 9.7656 10.2553 10.2553 10.5051 10.5051 k = 0.5000 0.2908 0.5823 ( 5782 PWs) bands (ev): -46.0417 -46.0417 -46.0330 -46.0330 -25.6913 -25.6913 -18.1400 -18.1400 -18.1123 -18.1123 -17.9739 -17.9739 -17.9607 -17.9607 -17.9092 -17.9092 -17.8675 -17.8675 -9.5563 -9.5563 -9.3363 -9.3363 -9.1710 -9.1710 -8.6848 -8.6848 -8.4432 -8.4432 1.1436 1.1436 1.7577 1.7577 1.8935 1.8935 1.9212 1.9212 3.9664 3.9664 4.3532 4.3532 9.3276 9.3276 9.6893 9.6893 10.2466 10.2466 10.4417 10.4417 k = 0.5000 0.2908 0.5635 ( 5782 PWs) bands (ev): -46.0421 -46.0421 -46.0327 -46.0327 -25.6917 -25.6917 -18.1399 -18.1399 -18.1105 -18.1105 -17.9736 -17.9736 -17.9586 -17.9586 -17.9123 -17.9123 -17.8676 -17.8676 -9.5592 -9.5592 -9.3394 -9.3394 -9.1696 -9.1696 -8.6781 -8.6781 -8.4440 -8.4440 1.1445 1.1445 1.7371 1.7371 1.9108 1.9108 1.9240 1.9240 4.0045 4.0045 4.3637 4.3637 9.3172 9.3172 9.6204 9.6204 10.2304 10.2304 10.3791 10.3791 k = 0.5000 0.2908 0.5447 ( 5788 PWs) bands (ev): -46.0424 -46.0424 -46.0323 -46.0323 -25.6921 -25.6921 -18.1399 -18.1399 -18.1088 -18.1088 -17.9733 -17.9733 -17.9565 -17.9565 -17.9154 -17.9154 -17.8678 -17.8678 -9.5612 -9.5612 -9.3424 -9.3424 -9.1681 -9.1681 -8.6729 -8.6729 -8.4446 -8.4446 1.1454 1.1454 1.7167 1.7167 1.9268 1.9268 1.9304 1.9304 4.0422 4.0422 4.3745 4.3745 9.2934 9.2934 9.5640 9.5640 10.2053 10.2053 10.3176 10.3176 k = 0.5000 0.2908 0.5259 ( 5780 PWs) bands (ev): -46.0428 -46.0428 -46.0320 -46.0320 -25.6924 -25.6924 -18.1399 -18.1399 -18.1071 -18.1071 -17.9731 -17.9731 -17.9541 -17.9541 -17.9184 -17.9184 -17.8678 -17.8678 -9.5622 -9.5622 -9.3454 -9.3454 -9.1665 -9.1665 -8.6693 -8.6693 -8.4450 -8.4450 1.1464 1.1464 1.6967 1.6967 1.9344 1.9344 1.9474 1.9474 4.0793 4.0793 4.3853 4.3853 9.2519 9.2519 9.5250 9.5250 10.1705 10.1705 10.2575 10.2575 k = 0.5000 0.2908 0.5071 ( 5784 PWs) bands (ev): -46.0431 -46.0431 -46.0317 -46.0317 -25.6928 -25.6928 -18.1400 -18.1400 -18.1055 -18.1055 -17.9729 -17.9729 -17.9518 -17.9518 -17.9213 -17.9213 -17.8678 -17.8678 -9.5624 -9.5624 -9.3483 -9.3483 -9.1649 -9.1649 -8.6672 -8.6672 -8.4452 -8.4452 1.1474 1.1474 1.6770 1.6770 1.9428 1.9428 1.9660 1.9660 4.1156 4.1156 4.3963 4.3963 9.1932 9.1932 9.5032 9.5032 10.1259 10.1259 10.1989 10.1989 k = 0.5000 0.2908 0.4884 ( 5788 PWs) bands (ev): -46.0435 -46.0435 -46.0313 -46.0313 -25.6932 -25.6932 -18.1401 -18.1401 -18.1041 -18.1041 -17.9729 -17.9729 -17.9494 -17.9494 -17.9240 -17.9240 -17.8677 -17.8677 -9.5616 -9.5616 -9.3511 -9.3511 -9.1632 -9.1632 -8.6667 -8.6667 -8.4452 -8.4452 1.1487 1.1487 1.6577 1.6577 1.9528 1.9528 1.9850 1.9850 4.1511 4.1511 4.4073 4.4073 9.1228 9.1228 9.4940 9.4940 10.0724 10.0724 10.1421 10.1421 k = 0.5000 0.2908 0.4696 ( 5790 PWs) bands (ev): -46.0438 -46.0438 -46.0310 -46.0310 -25.6935 -25.6935 -18.1402 -18.1402 -18.1028 -18.1028 -17.9729 -17.9729 -17.9470 -17.9470 -17.9266 -17.9266 -17.8676 -17.8676 -9.5599 -9.5599 -9.3538 -9.3538 -9.1614 -9.1614 -8.6677 -8.6677 -8.4450 -8.4450 1.1501 1.1501 1.6388 1.6388 1.9644 1.9644 2.0044 2.0044 4.1855 4.1855 4.4183 4.4183 9.0456 9.0456 9.4927 9.4927 10.0113 10.0113 10.0871 10.0871 k = 0.5000 0.2908 0.4508 ( 5784 PWs) bands (ev): -46.0442 -46.0442 -46.0306 -46.0306 -25.6939 -25.6939 -18.1404 -18.1404 -18.1016 -18.1016 -17.9731 -17.9731 -17.9445 -17.9445 -17.9290 -17.9290 -17.8674 -17.8674 -9.5574 -9.5574 -9.3563 -9.3563 -9.1596 -9.1596 -8.6704 -8.6704 -8.4445 -8.4445 1.1518 1.1518 1.6204 1.6204 1.9776 1.9776 2.0240 2.0240 4.2188 4.2188 4.4293 4.4293 8.9650 8.9650 9.4966 9.4966 9.9443 9.9443 10.0341 10.0341 k = 0.5000 0.2908 0.4320 ( 5784 PWs) bands (ev): -46.0445 -46.0445 -46.0303 -46.0303 -25.6943 -25.6943 -18.1405 -18.1405 -18.1005 -18.1005 -17.9733 -17.9733 -17.9420 -17.9420 -17.9312 -17.9312 -17.8672 -17.8672 -9.5540 -9.5540 -9.3586 -9.3586 -9.1578 -9.1578 -8.6746 -8.6746 -8.4439 -8.4439 1.1538 1.1538 1.6025 1.6025 1.9923 1.9923 2.0437 2.0437 4.2509 4.2509 4.4402 4.4402 8.8827 8.8827 9.5042 9.5042 9.8732 9.8732 9.9833 9.9833 k = 0.5000 0.2908 0.4132 ( 5792 PWs) bands (ev): -46.0449 -46.0449 -46.0300 -46.0300 -25.6946 -25.6946 -18.1408 -18.1408 -18.0995 -18.0995 -17.9738 -17.9738 -17.9396 -17.9396 -17.9333 -17.9333 -17.8670 -17.8670 -9.5499 -9.5499 -9.3606 -9.3606 -9.1559 -9.1559 -8.6804 -8.6804 -8.4431 -8.4431 1.1561 1.1561 1.5852 1.5852 2.0083 2.0083 2.0636 2.0636 4.2817 4.2817 4.4510 4.4510 8.8000 8.8000 9.5148 9.5148 9.7995 9.7995 9.9347 9.9347 k = 0.5000 0.2908 0.3944 ( 5792 PWs) bands (ev): -46.0452 -46.0452 -46.0296 -46.0296 -25.6950 -25.6950 -18.1412 -18.1412 -18.0986 -18.0986 -17.9743 -17.9743 -17.9372 -17.9372 -17.9351 -17.9351 -17.8666 -17.8666 -9.5451 -9.5451 -9.3622 -9.3622 -9.1540 -9.1540 -8.6877 -8.6877 -8.4421 -8.4421 1.1588 1.1588 1.5684 1.5684 2.0255 2.0255 2.0835 2.0835 4.3111 4.3111 4.4616 4.4616 8.7175 8.7175 9.5281 9.5281 9.7242 9.7242 9.8884 9.8884 k = 0.5000 0.2908 0.3757 ( 5784 PWs) bands (ev): -46.0456 -46.0456 -46.0293 -46.0293 -25.6953 -25.6953 -18.1415 -18.1415 -18.0977 -18.0977 -17.9750 -17.9750 -17.9366 -17.9366 -17.9347 -17.9347 -17.8661 -17.8661 -9.5398 -9.5398 -9.3632 -9.3632 -9.1520 -9.1520 -8.6964 -8.6964 -8.4410 -8.4410 1.1617 1.1617 1.5522 1.5522 2.0438 2.0438 2.1034 2.1034 4.3391 4.3391 4.4721 4.4721 8.6358 8.6358 9.5438 9.5438 9.6485 9.6485 9.8445 9.8445 k = 0.5000 0.2908 0.3569 ( 5792 PWs) bands (ev): -46.0459 -46.0459 -46.0290 -46.0290 -25.6957 -25.6957 -18.1419 -18.1419 -18.0969 -18.0969 -17.9758 -17.9758 -17.9380 -17.9380 -17.9325 -17.9325 -17.8656 -17.8656 -9.5342 -9.5342 -9.3636 -9.3636 -9.1500 -9.1500 -8.7066 -8.7066 -8.4398 -8.4398 1.1649 1.1649 1.5367 1.5367 2.0630 2.0630 2.1231 2.1231 4.3655 4.3655 4.4823 4.4823 8.5553 8.5553 9.5618 9.5618 9.5732 9.5732 9.8030 9.8030 k = 0.5000 0.2908 0.3381 ( 5780 PWs) bands (ev): -46.0462 -46.0462 -46.0287 -46.0287 -25.6960 -25.6960 -18.1423 -18.1423 -18.0962 -18.0962 -17.9767 -17.9767 -17.9390 -17.9390 -17.9302 -17.9302 -17.8649 -17.8649 -9.5283 -9.5283 -9.3630 -9.3630 -9.1481 -9.1481 -8.7182 -8.7182 -8.4384 -8.4384 1.1685 1.1685 1.5218 1.5218 2.0829 2.0829 2.1427 2.1427 4.3904 4.3904 4.4923 4.4923 8.4763 8.4763 9.4987 9.4987 9.5824 9.5824 9.7639 9.7639 k = 0.5000 0.2908 0.3193 ( 5776 PWs) bands (ev): -46.0465 -46.0465 -46.0284 -46.0284 -25.6963 -25.6963 -18.1428 -18.1428 -18.0956 -18.0956 -17.9777 -17.9777 -17.9399 -17.9399 -17.9282 -17.9282 -17.8642 -17.8642 -9.5224 -9.5224 -9.3615 -9.3615 -9.1461 -9.1461 -8.7311 -8.7311 -8.4370 -8.4370 1.1722 1.1722 1.5076 1.5076 2.1035 2.1035 2.1619 2.1619 4.4137 4.4137 4.5020 4.5020 8.3993 8.3993 9.4260 9.4260 9.6049 9.6049 9.7273 9.7273 k = 0.5000 0.2908 0.3005 ( 5772 PWs) bands (ev): -46.0468 -46.0468 -46.0281 -46.0281 -25.6967 -25.6967 -18.1433 -18.1433 -18.0951 -18.0951 -17.9787 -17.9787 -17.9406 -17.9406 -17.9262 -17.9262 -17.8634 -17.8634 -9.5167 -9.5167 -9.3586 -9.3586 -9.1441 -9.1441 -8.7453 -8.7453 -8.4355 -8.4355 1.1762 1.1762 1.4941 1.4941 2.1244 2.1244 2.1807 2.1807 4.4355 4.4355 4.5114 4.5114 8.3246 8.3246 9.3553 9.3553 9.6296 9.6296 9.6931 9.6931 k = 0.5000 0.2908 0.2817 ( 5758 PWs) bands (ev): -46.0471 -46.0471 -46.0278 -46.0278 -25.6970 -25.6970 -18.1438 -18.1438 -18.0946 -18.0946 -17.9798 -17.9798 -17.9412 -17.9412 -17.9243 -17.9243 -17.8625 -17.8625 -9.5115 -9.5115 -9.3543 -9.3543 -9.1421 -9.1421 -8.7607 -8.7607 -8.4339 -8.4339 1.1803 1.1803 1.4813 1.4813 2.1456 2.1456 2.1991 2.1991 4.4556 4.4556 4.5204 4.5204 8.2524 8.2524 9.2872 9.2872 9.6561 9.6561 9.6616 9.6616 k = 0.5000 0.2908 0.2630 ( 5768 PWs) bands (ev): -46.0474 -46.0474 -46.0276 -46.0276 -25.6972 -25.6972 -18.1444 -18.1444 -18.0942 -18.0942 -17.9809 -17.9809 -17.9416 -17.9416 -17.9227 -17.9227 -17.8616 -17.8616 -9.5068 -9.5068 -9.3483 -9.3483 -9.1401 -9.1401 -8.7772 -8.7772 -8.4324 -8.4324 1.1845 1.1845 1.4692 1.4692 2.1668 2.1668 2.2169 2.2169 4.4741 4.4741 4.5290 4.5290 8.1830 8.1830 9.2219 9.2219 9.6319 9.6319 9.6849 9.6849 k = 0.5000 0.2908 0.2442 ( 5768 PWs) bands (ev): -46.0476 -46.0476 -46.0273 -46.0273 -25.6975 -25.6975 -18.1449 -18.1449 -18.0938 -18.0938 -17.9820 -17.9820 -17.9419 -17.9419 -17.9212 -17.9212 -17.8606 -17.8606 -9.5029 -9.5029 -9.3406 -9.3406 -9.1381 -9.1381 -8.7947 -8.7947 -8.4308 -8.4308 1.1887 1.1887 1.4579 1.4579 2.1878 2.1878 2.2340 2.2340 4.4911 4.4911 4.5372 4.5372 8.1167 8.1167 9.1597 9.1597 9.6049 9.6049 9.7149 9.7149 k = 0.5000 0.2908 0.2254 ( 5762 PWs) bands (ev): -46.0479 -46.0479 -46.0271 -46.0271 -25.6978 -25.6978 -18.1455 -18.1455 -18.0935 -18.0935 -17.9830 -17.9830 -17.9422 -17.9422 -17.9198 -17.9198 -17.8596 -17.8596 -9.4998 -9.4998 -9.3312 -9.3312 -9.1361 -9.1361 -8.8131 -8.8131 -8.4292 -8.4292 1.1930 1.1930 1.4474 1.4474 2.2084 2.2084 2.2504 2.2504 4.5065 4.5065 4.5450 4.5450 8.0539 8.0539 9.1011 9.1011 9.5802 9.5802 9.7464 9.7464 k = 0.5000 0.2908 0.2066 ( 5770 PWs) bands (ev): -46.0481 -46.0481 -46.0269 -46.0269 -25.6980 -25.6980 -18.1461 -18.1461 -18.0933 -18.0933 -17.9841 -17.9841 -17.9424 -17.9424 -17.9186 -17.9186 -17.8585 -17.8585 -9.4975 -9.4975 -9.3201 -9.3201 -9.1340 -9.1340 -8.8324 -8.8324 -8.4277 -8.4277 1.1971 1.1971 1.4377 1.4377 2.2285 2.2285 2.2659 2.2659 4.5205 4.5205 4.5523 4.5523 7.9948 7.9948 9.0462 9.0462 9.5578 9.5578 9.7789 9.7789 k = 0.5000 0.2908 0.1878 ( 5770 PWs) bands (ev): -46.0483 -46.0483 -46.0267 -46.0267 -25.6982 -25.6982 -18.1466 -18.1466 -18.0931 -18.0931 -17.9851 -17.9851 -17.9425 -17.9425 -17.9175 -17.9175 -17.8575 -17.8575 -9.4959 -9.4959 -9.3075 -9.3075 -9.1319 -9.1319 -8.8524 -8.8524 -8.4263 -8.4263 1.2011 1.2011 1.4288 1.4288 2.2477 2.2477 2.2804 2.2804 4.5329 4.5329 4.5591 4.5591 7.9397 7.9397 8.9952 8.9952 9.5376 9.5376 9.8119 9.8119 k = 0.5000 0.2908 0.1690 ( 5788 PWs) bands (ev): -46.0485 -46.0485 -46.0265 -46.0265 -25.6985 -25.6985 -18.1472 -18.1472 -18.0929 -18.0929 -17.9861 -17.9861 -17.9426 -17.9426 -17.9166 -17.9166 -17.8565 -17.8565 -9.4948 -9.4948 -9.2937 -9.2937 -9.1296 -9.1296 -8.8731 -8.8731 -8.4249 -8.4249 1.2049 1.2049 1.4207 1.4207 2.2658 2.2658 2.2940 2.2940 4.5438 4.5438 4.5654 4.5654 7.8888 7.8888 8.9485 8.9485 9.5195 9.5195 9.8451 9.8451 k = 0.5000 0.2908 0.1503 ( 5788 PWs) bands (ev): -46.0487 -46.0487 -46.0263 -46.0263 -25.6986 -25.6986 -18.1477 -18.1477 -18.0927 -18.0927 -17.9869 -17.9869 -17.9426 -17.9426 -17.9158 -17.9158 -17.8556 -17.8556 -9.4943 -9.4943 -9.2789 -9.2789 -9.1271 -9.1271 -8.8943 -8.8943 -8.4236 -8.4236 1.2085 1.2085 1.4134 1.4134 2.2827 2.2827 2.3064 2.3064 4.5534 4.5534 4.5713 4.5713 7.8425 7.8425 8.9061 8.9061 9.5035 9.5035 9.8779 9.8779 k = 0.5000 0.2908 0.1315 ( 5788 PWs) bands (ev): -46.0488 -46.0488 -46.0262 -46.0262 -25.6988 -25.6988 -18.1482 -18.1482 -18.0926 -18.0926 -17.9876 -17.9876 -17.9426 -17.9426 -17.9150 -17.9150 -17.8547 -17.8547 -9.4940 -9.4940 -9.2635 -9.2635 -9.1242 -9.1242 -8.9158 -8.9158 -8.4224 -8.4224 1.2117 1.2117 1.4070 1.4070 2.2981 2.2981 2.3177 2.3177 4.5615 4.5615 4.5766 4.5766 7.8010 7.8010 8.8684 8.8684 9.4895 9.4895 9.9096 9.9096 k = 0.5000 0.2908 0.1127 ( 5784 PWs) bands (ev): -46.0489 -46.0489 -46.0261 -46.0261 -25.6989 -25.6989 -18.1486 -18.1486 -18.0924 -18.0924 -17.9883 -17.9883 -17.9426 -17.9426 -17.9144 -17.9144 -17.8538 -17.8538 -9.4940 -9.4940 -9.2479 -9.2479 -9.1207 -9.1207 -8.9377 -8.9377 -8.4214 -8.4214 1.2147 1.2147 1.4014 1.4014 2.3117 2.3117 2.3278 2.3278 4.5683 4.5683 4.5814 4.5814 7.7644 7.7644 8.8353 8.8353 9.4775 9.4775 9.9394 9.9394 k = 0.5000 0.2908 0.0939 ( 5786 PWs) bands (ev): -46.0490 -46.0490 -46.0260 -46.0260 -25.6991 -25.6991 -18.1490 -18.1490 -18.0923 -18.0923 -17.9889 -17.9889 -17.9426 -17.9426 -17.9139 -17.9139 -17.8531 -17.8531 -9.4942 -9.4942 -9.2327 -9.2327 -9.1162 -9.1162 -8.9595 -8.9595 -8.4205 -8.4205 1.2172 1.2172 1.3966 1.3966 2.3234 2.3234 2.3366 2.3366 4.5738 4.5738 4.5857 4.5857 7.7331 7.7331 8.8071 8.8071 9.4675 9.4675 9.9667 9.9667 k = 0.5000 0.2908 0.0751 ( 5790 PWs) bands (ev): -46.0492 -46.0492 -46.0259 -46.0259 -25.6992 -25.6992 -18.1493 -18.1493 -18.0923 -18.0923 -17.9893 -17.9893 -17.9426 -17.9426 -17.9136 -17.9136 -17.8525 -17.8525 -9.4944 -9.4944 -9.2186 -9.2186 -9.1103 -9.1103 -8.9813 -8.9813 -8.4197 -8.4197 1.2193 1.2193 1.3927 1.3927 2.3330 2.3330 2.3441 2.3441 4.5781 4.5781 4.5893 4.5893 7.7072 7.7072 8.7838 8.7838 9.4593 9.4593 9.9905 9.9905 k = 0.5000 0.2908 0.0563 ( 5798 PWs) bands (ev): -46.0492 -46.0492 -46.0258 -46.0258 -25.6992 -25.6992 -18.1495 -18.1495 -18.0923 -18.0923 -17.9897 -17.9897 -17.9426 -17.9426 -17.9133 -17.9133 -17.8521 -17.8521 -9.4946 -9.4946 -9.2065 -9.2065 -9.1022 -9.1022 -9.0028 -9.0028 -8.4191 -8.4191 1.2210 1.2210 1.3897 1.3897 2.3403 2.3403 2.3503 2.3503 4.5814 4.5814 4.5922 4.5922 7.6869 7.6869 8.7656 8.7656 9.4530 9.4530 10.0100 10.0100 k = 0.5000 0.2908 0.0376 ( 5810 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1497 -18.1497 -18.0923 -18.0923 -17.9899 -17.9899 -17.9426 -17.9426 -17.9132 -17.9132 -17.8518 -17.8518 -9.4948 -9.4948 -9.1974 -9.1974 -9.0915 -9.0915 -9.0236 -9.0236 -8.4187 -8.4187 1.2222 1.2222 1.3875 1.3875 2.3454 2.3454 2.3550 2.3550 4.5836 4.5836 4.5943 4.5943 7.6723 7.6723 8.7526 8.7526 9.4485 9.4485 10.0246 10.0246 k = 0.5000 0.2908 0.0188 ( 5814 PWs) bands (ev): -46.0493 -46.0493 -46.0257 -46.0257 -25.6993 -25.6993 -18.1498 -18.1498 -18.0923 -18.0923 -17.9900 -17.9900 -17.9426 -17.9426 -17.9131 -17.9131 -17.8516 -17.8516 -9.4950 -9.4950 -9.1917 -9.1917 -9.0779 -9.0779 -9.0434 -9.0434 -8.4184 -8.4184 1.2229 1.2229 1.3862 1.3862 2.3484 2.3484 2.3579 2.3579 4.5849 4.5849 4.5956 4.5956 7.6635 7.6635 8.7448 8.7448 9.4459 9.4459 10.0336 10.0336 k = 0.5000 0.2908 0.0000 ( 5822 PWs) bands (ev): -46.0494 -46.0494 -46.0257 -46.0257 -25.6994 -25.6994 -18.1498 -18.1498 -18.0923 -18.0923 -17.9901 -17.9901 -17.9426 -17.9426 -17.9131 -17.9131 -17.8516 -17.8516 -9.4950 -9.4950 -9.1898 -9.1898 -9.0619 -9.0619 -9.0615 -9.0615 -8.4183 -8.4183 1.2232 1.2232 1.3858 1.3858 2.3494 2.3494 2.3589 2.3589 4.5853 4.5853 4.5961 4.5961 7.6606 7.6606 8.7421 8.7421 9.4450 9.4450 10.0367 10.0367 k = 0.0000 0.0000 0.9946 ( 5746 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1911 -9.1911 -9.1711 -9.1711 -9.0145 -9.0145 -8.4121 -8.4121 1.1106 1.1106 1.6934 1.6934 2.0736 2.0736 2.0954 2.0954 3.3764 3.3764 4.2203 4.2203 8.9674 8.9674 10.1297 10.1297 10.9112 10.9112 11.1140 11.1140 k = 0.0156 0.0091 0.9946 ( 5752 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9807 -17.9807 -17.9796 -17.9796 -17.8640 -17.8640 -17.8639 -17.8639 -9.4431 -9.4431 -9.1911 -9.1911 -9.1711 -9.1711 -9.0145 -9.0145 -8.4122 -8.4122 1.1108 1.1108 1.6940 1.6940 2.0722 2.0722 2.0951 2.0951 3.3788 3.3788 4.2184 4.2184 8.9691 8.9691 10.1321 10.1321 10.8948 10.8948 11.1273 11.1273 k = 0.0312 0.0182 0.9946 ( 5748 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8639 -17.8639 -9.4431 -9.4431 -9.1912 -9.1912 -9.1711 -9.1711 -9.0144 -9.0144 -8.4122 -8.4122 1.1112 1.1112 1.6960 1.6960 2.0681 2.0681 2.0944 2.0944 3.3858 3.3858 4.2126 4.2126 8.9742 8.9742 10.1393 10.1393 10.8548 10.8548 11.1353 11.1353 k = 0.0469 0.0273 0.9946 ( 5738 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1912 -9.1912 -9.1711 -9.1711 -9.0143 -9.0143 -8.4122 -8.4122 1.1119 1.1119 1.6993 1.6993 2.0615 2.0615 2.0932 2.0932 3.3974 3.3974 4.2029 4.2029 8.9827 8.9827 10.1512 10.1512 10.8039 10.8039 11.1165 11.1165 k = 0.0625 0.0363 0.9946 ( 5740 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1431 -18.1431 -17.9807 -17.9807 -17.9795 -17.9795 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1913 -9.1913 -9.1711 -9.1711 -9.0141 -9.0141 -8.4123 -8.4123 1.1129 1.1129 1.7039 1.7039 2.0524 2.0524 2.0917 2.0917 3.4134 3.4134 4.1896 4.1896 8.9942 8.9942 10.1676 10.1676 10.7480 10.7480 11.0905 11.0905 k = 0.0781 0.0454 0.9946 ( 5750 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1441 -18.1441 -18.1431 -18.1431 -17.9807 -17.9807 -17.9796 -17.9796 -17.8640 -17.8640 -17.8638 -17.8638 -9.4431 -9.4431 -9.1914 -9.1914 -9.1711 -9.1711 -9.0139 -9.0139 -8.4124 -8.4124 1.1141 1.1141 1.7098 1.7098 2.0411 2.0411 2.0899 2.0899 3.4333 3.4333 4.1727 4.1727 9.0087 9.0087 10.1884 10.1884 10.6901 10.6901 11.0602 11.0602 k = 0.0938 0.0545 0.9946 ( 5752 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1441 -18.1441 -18.1431 -18.1431 -17.9807 -17.9807 -17.9796 -17.9796 -17.8640 -17.8640 -17.8639 -17.8639 -9.4431 -9.4431 -9.1915 -9.1915 -9.1711 -9.1711 -9.0136 -9.0136 -8.4125 -8.4125 1.1154 1.1154 1.7169 1.7169 2.0278 2.0278 2.0878 2.0878 3.4570 3.4570 4.1523 4.1523 9.0257 9.0257 10.2132 10.2132 10.6317 10.6317 11.0266 11.0266 k = 0.1094 0.0636 0.9946 ( 5776 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9807 -17.9807 -17.9798 -17.9798 -17.8640 -17.8640 -17.8640 -17.8640 -9.4431 -9.4431 -9.1917 -9.1917 -9.1711 -9.1711 -9.0134 -9.0134 -8.4126 -8.4126 1.1169 1.1169 1.7253 1.7253 2.0129 2.0129 2.0855 2.0855 3.4841 3.4841 4.1288 4.1288 9.0448 9.0448 10.2417 10.2417 10.5740 10.5740 10.9904 10.9904 k = 0.1250 0.0727 0.9946 ( 5760 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9805 -17.9805 -17.9798 -17.9798 -17.8640 -17.8640 -17.8639 -17.8639 -9.4432 -9.4432 -9.1918 -9.1918 -9.1712 -9.1712 -9.0131 -9.0131 -8.4128 -8.4128 1.1184 1.1184 1.7350 1.7350 1.9967 1.9967 2.0832 2.0832 3.5142 3.5142 4.1023 4.1023 9.0656 9.0656 10.2737 10.2737 10.5179 10.5179 10.9522 10.9522 k = 0.1406 0.0818 0.9946 ( 5760 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9805 -17.9805 -17.9798 -17.9798 -17.8640 -17.8640 -17.8639 -17.8639 -9.4432 -9.4432 -9.1919 -9.1919 -9.1712 -9.1712 -9.0128 -9.0128 -8.4129 -8.4129 1.1200 1.1200 1.7458 1.7458 1.9794 1.9794 2.0809 2.0809 3.5468 3.5468 4.0731 4.0731 9.0873 9.0873 10.3087 10.3087 10.4644 10.4644 10.9124 10.9124 k = 0.1562 0.0909 0.9946 ( 5758 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9805 -17.9805 -17.9799 -17.9799 -17.8640 -17.8640 -17.8639 -17.8639 -9.4432 -9.4432 -9.1921 -9.1921 -9.1712 -9.1712 -9.0125 -9.0125 -8.4130 -8.4130 1.1215 1.1215 1.7577 1.7577 1.9614 1.9614 2.0786 2.0786 3.5816 3.5816 4.0414 4.0414 9.1093 9.1093 10.3462 10.3462 10.4146 10.4146 10.8711 10.8711 k = 0.1719 0.0999 0.9946 ( 5760 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9805 -17.9805 -17.9799 -17.9799 -17.8640 -17.8640 -17.8639 -17.8639 -9.4432 -9.4432 -9.1922 -9.1922 -9.1712 -9.1712 -9.0123 -9.0123 -8.4131 -8.4131 1.1228 1.1228 1.7707 1.7707 1.9428 1.9428 2.0766 2.0766 3.6183 3.6183 4.0076 4.0076 9.1305 9.1305 10.3690 10.3690 10.3865 10.3865 10.8286 10.8286 k = 0.1875 0.1090 0.9946 ( 5760 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9804 -17.9804 -17.9799 -17.9799 -17.8640 -17.8640 -17.8639 -17.8639 -9.4433 -9.4433 -9.1923 -9.1923 -9.1713 -9.1713 -9.0120 -9.0120 -8.4132 -8.4132 1.1241 1.1241 1.7848 1.7848 1.9240 1.9240 2.0748 2.0748 3.6564 3.6564 3.9718 3.9718 9.1501 9.1501 10.3300 10.3300 10.4279 10.4279 10.7852 10.7852 k = 0.2031 0.1181 0.9946 ( 5760 PWs) bands (ev): -46.0372 -46.0372 -46.0372 -46.0372 -25.6868 -25.6868 -18.1440 -18.1440 -18.1432 -18.1432 -17.9804 -17.9804 -17.9799 -17.9799 -17.8640 -17.8640 -17.8639 -17.8639 -9.4433 -9.4433 -9.1924 -9.1924 -9.1713 -9.1713 -9.0119 -9.0119 -8.4133 -8.4133 1.1251 1.1251 1.7998 1.7998 1.9051 1.9051 2.0733 2.0733 3.6956 3.6956 3.9346 3.9346 9.1669 9.1669 10.2977 10.2977 10.4710 10.4710 10.7409 10.7409 k = 0.2188 0.1272 0.9946 ( 5768 PWs) bands (ev): -46.0373 -46.0373 -46.0372 -46.0372 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9804 -17.9804 -17.9800 -17.9800 -17.8640 -17.8640 -17.8639 -17.8639 -9.4433 -9.4433 -9.1924 -9.1924 -9.1713 -9.1713 -9.0117 -9.0117 -8.4133 -8.4133 1.1258 1.1258 1.8157 1.8157 1.8863 1.8863 2.0721 2.0721 3.7356 3.7356 3.8961 3.8961 9.1798 9.1798 10.2737 10.2737 10.5152 10.5152 10.6961 10.6961 k = 0.2344 0.1363 0.9946 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9805 -17.9805 -17.9800 -17.9800 -17.8640 -17.8640 -17.8640 -17.8640 -9.4433 -9.4433 -9.1925 -9.1925 -9.1713 -9.1713 -9.0116 -9.0116 -8.4134 -8.4134 1.1262 1.1262 1.8324 1.8324 1.8679 1.8679 2.0714 2.0714 3.7758 3.7758 3.8567 3.8567 9.1880 9.1880 10.2588 10.2588 10.5601 10.5601 10.6509 10.6509 k = 0.2500 0.1454 0.9946 ( 5780 PWs) bands (ev): -46.0373 -46.0373 -46.0373 -46.0373 -25.6868 -25.6868 -18.1441 -18.1441 -18.1432 -18.1432 -17.9805 -17.9805 -17.9800 -17.9800 -17.8640 -17.8640 -17.8640 -17.8640 -9.4433 -9.4433 -9.1925 -9.1925 -9.1713 -9.1713 -9.0116 -9.0116 -8.4134 -8.4134 1.1264 1.1264 1.8483 1.8483 1.8514 1.8514 2.0712 2.0712 3.8124 3.8124 3.8203 3.8203 9.1908 9.1908 10.2537 10.2537 10.6040 10.6040 10.6069 10.6069 Writing output data file KNa2BN2.save init_run : 0.30s CPU 0.43s WALL ( 1 calls) electrons : 206.37s CPU 208.73s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 206.36s CPU 208.72s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.02s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.09s WALL ( 343 calls) cegterg : 186.70s CPU 188.45s WALL ( 436 calls) Called by sum_band: Called by *egterg: h_psi : 139.08s CPU 140.44s WALL ( 7480 calls) s_psi : 3.08s CPU 3.05s WALL ( 7480 calls) g_psi : 0.27s CPU 0.28s WALL ( 6701 calls) cdiaghg : 43.91s CPU 44.64s WALL ( 7044 calls) cegterg:over : 6.26s CPU 6.17s WALL ( 6701 calls) cegterg:upda : 6.03s CPU 5.95s WALL ( 6701 calls) cegterg:last : 2.95s CPU 2.94s WALL ( 1122 calls) cdiaghg:chol : 2.65s CPU 2.56s WALL ( 7044 calls) cdiaghg:inve : 1.55s CPU 1.62s WALL ( 7044 calls) cdiaghg:para : 2.40s CPU 2.56s WALL ( 14088 calls) Called by h_psi: h_psi:vloc : 131.07s CPU 132.30s WALL ( 7480 calls) h_psi:vnl : 7.74s CPU 7.85s WALL ( 7480 calls) add_vuspsi : 3.46s CPU 3.50s WALL ( 7480 calls) General routines calbec : 4.25s CPU 4.33s WALL ( 7480 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 123.39s CPU 124.62s WALL ( 703040 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.17s CPU 0.25s WALL ( 686 calls) Parallel routines fft_scatter : 39.32s CPU 40.00s WALL ( 703063 calls) PWSCF : 3m46.16s CPU 4m 3.98s WALL This run was terminated on: 14:37:30 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=