Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:11:34 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: ./ZrPt.save/ file Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 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 60 27 8 2144 668 108 Max 61 28 9 2147 678 113 Sum 2169 997 295 77213 24241 3965 bravais-lattice index = 14 lattice parameter (alat) = 10.2647 a.u. unit-cell volume = 507.4602 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 28.00 number of Kohn-Sham states= 36 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 433.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.264731 celldm(2)= 1.000000 celldm(3)= 0.787391 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.803063 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.803063 0.595894 0.000000 ) a(3) = ( 0.000000 0.000000 0.787391 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.347662 -0.000000 ) b(2) = ( 0.000000 1.678152 -0.000000 ) b(3) = ( 0.000000 0.000000 1.270017 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Pt read from file: /users/gautes/Pseudo/Pt.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5a767c0d250ba2b616d7addddc548ecc Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1277 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Pt 10.00 195.08400 Pt( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3936956 ) 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 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3936956 ) 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= 444 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 2) = ( 0.0053328 0.0161361 -0.0000000), wk = 0.0022523 k( 3) = ( 0.0106656 0.0322722 -0.0000000), wk = 0.0022523 k( 4) = ( 0.0159984 0.0484082 -0.0000000), wk = 0.0022523 k( 5) = ( 0.0213312 0.0645443 -0.0000000), wk = 0.0022523 k( 6) = ( 0.0266640 0.0806804 -0.0000000), wk = 0.0022523 k( 7) = ( 0.0319968 0.0968165 -0.0000000), wk = 0.0022523 k( 8) = ( 0.0373296 0.1129525 -0.0000000), wk = 0.0022523 k( 9) = ( 0.0426624 0.1290886 -0.0000000), wk = 0.0022523 k( 10) = ( 0.0479952 0.1452247 -0.0000000), wk = 0.0022523 k( 11) = ( 0.0533281 0.1613608 -0.0000000), wk = 0.0022523 k( 12) = ( 0.0586609 0.1774968 -0.0000000), wk = 0.0022523 k( 13) = ( 0.0639937 0.1936329 -0.0000000), wk = 0.0022523 k( 14) = ( 0.0693265 0.2097690 -0.0000000), wk = 0.0022523 k( 15) = ( 0.0746593 0.2259050 -0.0000000), wk = 0.0022523 k( 16) = ( 0.0799921 0.2420411 -0.0000000), wk = 0.0022523 k( 17) = ( 0.0853249 0.2581772 -0.0000000), wk = 0.0022523 k( 18) = ( 0.0906577 0.2743133 -0.0000000), wk = 0.0022523 k( 19) = ( 0.0959905 0.2904493 -0.0000000), wk = 0.0022523 k( 20) = ( 0.1013233 0.3065854 -0.0000000), wk = 0.0022523 k( 21) = ( 0.1066561 0.3227215 -0.0000000), wk = 0.0022523 k( 22) = ( 0.1119889 0.3388576 -0.0000000), wk = 0.0022523 k( 23) = ( 0.1173217 0.3549936 -0.0000000), wk = 0.0022523 k( 24) = ( 0.1226545 0.3711297 -0.0000000), wk = 0.0022523 k( 25) = ( 0.1279873 0.3872658 -0.0000000), wk = 0.0022523 k( 26) = ( 0.1333201 0.4034019 -0.0000000), wk = 0.0022523 k( 27) = ( 0.1386529 0.4195379 -0.0000000), wk = 0.0022523 k( 28) = ( 0.1439857 0.4356740 -0.0000000), wk = 0.0022523 k( 29) = ( 0.1493185 0.4518101 -0.0000000), wk = 0.0022523 k( 30) = ( 0.1546513 0.4679462 -0.0000000), wk = 0.0022523 k( 31) = ( 0.1599841 0.4840823 -0.0000000), wk = 0.0022523 k( 32) = ( 0.1653169 0.5002183 -0.0000000), wk = 0.0022523 k( 33) = ( 0.1706497 0.5163544 -0.0000000), wk = 0.0022523 k( 34) = ( 0.1759825 0.5324905 -0.0000000), wk = 0.0022523 k( 35) = ( 0.1813154 0.5486266 -0.0000000), wk = 0.0022523 k( 36) = ( 0.1866482 0.5647626 -0.0000000), wk = 0.0022523 k( 37) = ( 0.1919810 0.5808987 -0.0000000), wk = 0.0022523 k( 38) = ( 0.1973138 0.5970348 -0.0000000), wk = 0.0022523 k( 39) = ( 0.2026466 0.6131709 -0.0000000), wk = 0.0022523 k( 40) = ( 0.2079794 0.6293069 -0.0000000), wk = 0.0022523 k( 41) = ( 0.2133122 0.6454430 -0.0000000), wk = 0.0022523 k( 42) = ( 0.2186450 0.6615791 -0.0000000), wk = 0.0022523 k( 43) = ( 0.2239778 0.6777151 -0.0000000), wk = 0.0022523 k( 44) = ( 0.2293106 0.6938512 -0.0000000), wk = 0.0022523 k( 45) = ( 0.2346434 0.7099873 -0.0000000), wk = 0.0022523 k( 46) = ( 0.2399762 0.7261234 -0.0000000), wk = 0.0022523 k( 47) = ( 0.2453090 0.7422594 -0.0000000), wk = 0.0022523 k( 48) = ( 0.2506418 0.7583955 -0.0000000), wk = 0.0022523 k( 49) = ( 0.2559746 0.7745316 -0.0000000), wk = 0.0022523 k( 50) = ( 0.2613074 0.7906677 -0.0000000), wk = 0.0022523 k( 51) = ( 0.2666402 0.8068037 -0.0000000), wk = 0.0022523 k( 52) = ( 0.2719730 0.8229398 -0.0000000), wk = 0.0022523 k( 53) = ( 0.2773058 0.8390759 -0.0000000), wk = 0.0022523 k( 54) = ( 0.2773058 0.8390759 -0.0000000), wk = 0.0022523 k( 55) = ( 0.2609937 0.8390759 -0.0000000), wk = 0.0022523 k( 56) = ( 0.2446816 0.8390759 -0.0000000), wk = 0.0022523 k( 57) = ( 0.2283695 0.8390759 -0.0000000), wk = 0.0022523 k( 58) = ( 0.2120574 0.8390759 -0.0000000), wk = 0.0022523 k( 59) = ( 0.1957453 0.8390759 -0.0000000), wk = 0.0022523 k( 60) = ( 0.1794332 0.8390759 -0.0000000), wk = 0.0022523 k( 61) = ( 0.1631211 0.8390759 -0.0000000), wk = 0.0022523 k( 62) = ( 0.1468090 0.8390759 -0.0000000), wk = 0.0022523 k( 63) = ( 0.1304969 0.8390759 -0.0000000), wk = 0.0022523 k( 64) = ( 0.1141848 0.8390759 -0.0000000), wk = 0.0022523 k( 65) = ( 0.0978727 0.8390759 -0.0000000), wk = 0.0022523 k( 66) = ( 0.0815605 0.8390759 -0.0000000), wk = 0.0022523 k( 67) = ( 0.0652484 0.8390759 -0.0000000), wk = 0.0022523 k( 68) = ( 0.0489363 0.8390759 -0.0000000), wk = 0.0022523 k( 69) = ( 0.0326242 0.8390759 -0.0000000), wk = 0.0022523 k( 70) = ( 0.0163121 0.8390759 -0.0000000), wk = 0.0022523 k( 71) = ( 0.0000000 0.8390759 -0.0000000), wk = 0.0022523 k( 72) = ( 0.0000000 0.8390759 -0.0000000), wk = 0.0022523 k( 73) = ( 0.0000000 0.8390759 0.0171624), wk = 0.0022523 k( 74) = ( 0.0000000 0.8390759 0.0343248), wk = 0.0022523 k( 75) = ( 0.0000000 0.8390759 0.0514872), wk = 0.0022523 k( 76) = ( 0.0000000 0.8390759 0.0686496), wk = 0.0022523 k( 77) = ( 0.0000000 0.8390759 0.0858120), wk = 0.0022523 k( 78) = ( 0.0000000 0.8390759 0.1029743), wk = 0.0022523 k( 79) = ( 0.0000000 0.8390759 0.1201367), wk = 0.0022523 k( 80) = ( 0.0000000 0.8390759 0.1372991), wk = 0.0022523 k( 81) = ( 0.0000000 0.8390759 0.1544615), wk = 0.0022523 k( 82) = ( 0.0000000 0.8390759 0.1716239), wk = 0.0022523 k( 83) = ( 0.0000000 0.8390759 0.1887863), wk = 0.0022523 k( 84) = ( 0.0000000 0.8390759 0.2059487), wk = 0.0022523 k( 85) = ( 0.0000000 0.8390759 0.2231111), wk = 0.0022523 k( 86) = ( 0.0000000 0.8390759 0.2402735), wk = 0.0022523 k( 87) = ( 0.0000000 0.8390759 0.2574358), wk = 0.0022523 k( 88) = ( 0.0000000 0.8390759 0.2745982), wk = 0.0022523 k( 89) = ( 0.0000000 0.8390759 0.2917606), wk = 0.0022523 k( 90) = ( 0.0000000 0.8390759 0.3089230), wk = 0.0022523 k( 91) = ( 0.0000000 0.8390759 0.3260854), wk = 0.0022523 k( 92) = ( 0.0000000 0.8390759 0.3432478), wk = 0.0022523 k( 93) = ( 0.0000000 0.8390759 0.3604102), wk = 0.0022523 k( 94) = ( 0.0000000 0.8390759 0.3775726), wk = 0.0022523 k( 95) = ( 0.0000000 0.8390759 0.3947350), wk = 0.0022523 k( 96) = ( 0.0000000 0.8390759 0.4118974), wk = 0.0022523 k( 97) = ( 0.0000000 0.8390759 0.4290598), wk = 0.0022523 k( 98) = ( 0.0000000 0.8390759 0.4462221), wk = 0.0022523 k( 99) = ( 0.0000000 0.8390759 0.4633845), wk = 0.0022523 k( 100) = ( 0.0000000 0.8390759 0.4805469), wk = 0.0022523 k( 101) = ( 0.0000000 0.8390759 0.4977093), wk = 0.0022523 k( 102) = ( 0.0000000 0.8390759 0.5148717), wk = 0.0022523 k( 103) = ( 0.0000000 0.8390759 0.5320341), wk = 0.0022523 k( 104) = ( 0.0000000 0.8390759 0.5491965), wk = 0.0022523 k( 105) = ( 0.0000000 0.8390759 0.5663589), wk = 0.0022523 k( 106) = ( 0.0000000 0.8390759 0.5835213), wk = 0.0022523 k( 107) = ( 0.0000000 0.8390759 0.6006837), wk = 0.0022523 k( 108) = ( 0.0000000 0.8390759 0.6178460), wk = 0.0022523 k( 109) = ( 0.0000000 0.8390759 0.6350084), wk = 0.0022523 k( 110) = ( 0.0000000 0.8390759 0.6350084), wk = 0.0022523 k( 111) = ( 0.0163121 0.8390759 0.6350084), wk = 0.0022523 k( 112) = ( 0.0326242 0.8390759 0.6350084), wk = 0.0022523 k( 113) = ( 0.0489363 0.8390759 0.6350084), wk = 0.0022523 k( 114) = ( 0.0652484 0.8390759 0.6350084), wk = 0.0022523 k( 115) = ( 0.0815605 0.8390759 0.6350084), wk = 0.0022523 k( 116) = ( 0.0978727 0.8390759 0.6350084), wk = 0.0022523 k( 117) = ( 0.1141848 0.8390759 0.6350084), wk = 0.0022523 k( 118) = ( 0.1304969 0.8390759 0.6350084), wk = 0.0022523 k( 119) = ( 0.1468090 0.8390759 0.6350084), wk = 0.0022523 k( 120) = ( 0.1631211 0.8390759 0.6350084), wk = 0.0022523 k( 121) = ( 0.1794332 0.8390759 0.6350084), wk = 0.0022523 k( 122) = ( 0.1957453 0.8390759 0.6350084), wk = 0.0022523 k( 123) = ( 0.2120574 0.8390759 0.6350084), wk = 0.0022523 k( 124) = ( 0.2283695 0.8390759 0.6350084), wk = 0.0022523 k( 125) = ( 0.2446816 0.8390759 0.6350084), wk = 0.0022523 k( 126) = ( 0.2609937 0.8390759 0.6350084), wk = 0.0022523 k( 127) = ( 0.2773058 0.8390759 0.6350084), wk = 0.0022523 k( 128) = ( 0.2773058 0.8390759 0.6350084), wk = 0.0022523 k( 129) = ( 0.2719730 0.8229398 0.6350084), wk = 0.0022523 k( 130) = ( 0.2666402 0.8068037 0.6350084), wk = 0.0022523 k( 131) = ( 0.2613074 0.7906677 0.6350084), wk = 0.0022523 k( 132) = ( 0.2559746 0.7745316 0.6350084), wk = 0.0022523 k( 133) = ( 0.2506418 0.7583955 0.6350084), wk = 0.0022523 k( 134) = ( 0.2453090 0.7422594 0.6350084), wk = 0.0022523 k( 135) = ( 0.2399762 0.7261234 0.6350084), wk = 0.0022523 k( 136) = ( 0.2346434 0.7099873 0.6350084), wk = 0.0022523 k( 137) = ( 0.2293106 0.6938512 0.6350084), wk = 0.0022523 k( 138) = ( 0.2239778 0.6777151 0.6350084), wk = 0.0022523 k( 139) = ( 0.2186450 0.6615791 0.6350084), wk = 0.0022523 k( 140) = ( 0.2133122 0.6454430 0.6350084), wk = 0.0022523 k( 141) = ( 0.2079794 0.6293069 0.6350084), wk = 0.0022523 k( 142) = ( 0.2026466 0.6131709 0.6350084), wk = 0.0022523 k( 143) = ( 0.1973138 0.5970348 0.6350084), wk = 0.0022523 k( 144) = ( 0.1919810 0.5808987 0.6350084), wk = 0.0022523 k( 145) = ( 0.1866482 0.5647626 0.6350084), wk = 0.0022523 k( 146) = ( 0.1813154 0.5486266 0.6350084), wk = 0.0022523 k( 147) = ( 0.1759825 0.5324905 0.6350084), wk = 0.0022523 k( 148) = ( 0.1706497 0.5163544 0.6350084), wk = 0.0022523 k( 149) = ( 0.1653169 0.5002183 0.6350084), wk = 0.0022523 k( 150) = ( 0.1599841 0.4840823 0.6350084), wk = 0.0022523 k( 151) = ( 0.1546513 0.4679462 0.6350084), wk = 0.0022523 k( 152) = ( 0.1493185 0.4518101 0.6350084), wk = 0.0022523 k( 153) = ( 0.1439857 0.4356740 0.6350084), wk = 0.0022523 k( 154) = ( 0.1386529 0.4195379 0.6350084), wk = 0.0022523 k( 155) = ( 0.1333201 0.4034019 0.6350084), wk = 0.0022523 k( 156) = ( 0.1279873 0.3872658 0.6350084), wk = 0.0022523 k( 157) = ( 0.1226545 0.3711297 0.6350084), wk = 0.0022523 k( 158) = ( 0.1173217 0.3549936 0.6350084), wk = 0.0022523 k( 159) = ( 0.1119889 0.3388576 0.6350084), wk = 0.0022523 k( 160) = ( 0.1066561 0.3227215 0.6350084), wk = 0.0022523 k( 161) = ( 0.1013233 0.3065854 0.6350084), wk = 0.0022523 k( 162) = ( 0.0959905 0.2904493 0.6350084), wk = 0.0022523 k( 163) = ( 0.0906577 0.2743133 0.6350084), wk = 0.0022523 k( 164) = ( 0.0853249 0.2581772 0.6350084), wk = 0.0022523 k( 165) = ( 0.0799921 0.2420411 0.6350084), wk = 0.0022523 k( 166) = ( 0.0746593 0.2259050 0.6350084), wk = 0.0022523 k( 167) = ( 0.0693265 0.2097690 0.6350084), wk = 0.0022523 k( 168) = ( 0.0639937 0.1936329 0.6350084), wk = 0.0022523 k( 169) = ( 0.0586609 0.1774968 0.6350084), wk = 0.0022523 k( 170) = ( 0.0533281 0.1613608 0.6350084), wk = 0.0022523 k( 171) = ( 0.0479952 0.1452247 0.6350084), wk = 0.0022523 k( 172) = ( 0.0426624 0.1290886 0.6350084), wk = 0.0022523 k( 173) = ( 0.0373296 0.1129525 0.6350084), wk = 0.0022523 k( 174) = ( 0.0319968 0.0968165 0.6350084), wk = 0.0022523 k( 175) = ( 0.0266640 0.0806804 0.6350084), wk = 0.0022523 k( 176) = ( 0.0213312 0.0645443 0.6350084), wk = 0.0022523 k( 177) = ( 0.0159984 0.0484082 0.6350084), wk = 0.0022523 k( 178) = ( 0.0106656 0.0322722 0.6350084), wk = 0.0022523 k( 179) = ( 0.0053328 0.0161361 0.6350084), wk = 0.0022523 k( 180) = ( 0.0000000 0.0000000 0.6350084), wk = 0.0022523 k( 181) = ( 0.0000000 0.0000000 0.6350084), wk = 0.0022523 k( 182) = ( 0.0000000 0.0000000 0.6178460), wk = 0.0022523 k( 183) = ( 0.0000000 0.0000000 0.6006837), wk = 0.0022523 k( 184) = ( 0.0000000 0.0000000 0.5835213), wk = 0.0022523 k( 185) = ( 0.0000000 0.0000000 0.5663589), wk = 0.0022523 k( 186) = ( 0.0000000 0.0000000 0.5491965), wk = 0.0022523 k( 187) = ( 0.0000000 0.0000000 0.5320341), wk = 0.0022523 k( 188) = ( 0.0000000 0.0000000 0.5148717), wk = 0.0022523 k( 189) = ( 0.0000000 0.0000000 0.4977093), wk = 0.0022523 k( 190) = ( 0.0000000 0.0000000 0.4805469), wk = 0.0022523 k( 191) = ( 0.0000000 0.0000000 0.4633845), wk = 0.0022523 k( 192) = ( 0.0000000 0.0000000 0.4462221), wk = 0.0022523 k( 193) = ( 0.0000000 0.0000000 0.4290598), wk = 0.0022523 k( 194) = ( 0.0000000 0.0000000 0.4118974), wk = 0.0022523 k( 195) = ( 0.0000000 0.0000000 0.3947350), wk = 0.0022523 k( 196) = ( 0.0000000 0.0000000 0.3775726), wk = 0.0022523 k( 197) = ( 0.0000000 0.0000000 0.3604102), wk = 0.0022523 k( 198) = ( 0.0000000 0.0000000 0.3432478), wk = 0.0022523 k( 199) = ( 0.0000000 0.0000000 0.3260854), wk = 0.0022523 k( 200) = ( 0.0000000 0.0000000 0.3089230), wk = 0.0022523 k( 201) = ( 0.0000000 0.0000000 0.2917606), wk = 0.0022523 k( 202) = ( 0.0000000 0.0000000 0.2745982), wk = 0.0022523 k( 203) = ( 0.0000000 0.0000000 0.2574358), wk = 0.0022523 k( 204) = ( 0.0000000 0.0000000 0.2402735), wk = 0.0022523 k( 205) = ( 0.0000000 0.0000000 0.2231111), wk = 0.0022523 k( 206) = ( 0.0000000 0.0000000 0.2059487), wk = 0.0022523 k( 207) = ( 0.0000000 0.0000000 0.1887863), wk = 0.0022523 k( 208) = ( 0.0000000 0.0000000 0.1716239), wk = 0.0022523 k( 209) = ( 0.0000000 0.0000000 0.1544615), wk = 0.0022523 k( 210) = ( 0.0000000 0.0000000 0.1372991), wk = 0.0022523 k( 211) = ( 0.0000000 0.0000000 0.1201367), wk = 0.0022523 k( 212) = ( 0.0000000 0.0000000 0.1029743), wk = 0.0022523 k( 213) = ( 0.0000000 0.0000000 0.0858120), wk = 0.0022523 k( 214) = ( 0.0000000 0.0000000 0.0686496), wk = 0.0022523 k( 215) = ( 0.0000000 0.0000000 0.0514872), wk = 0.0022523 k( 216) = ( 0.0000000 0.0000000 0.0343248), wk = 0.0022523 k( 217) = ( 0.0000000 0.0000000 0.0171624), wk = 0.0022523 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 220) = ( -0.0161290 0.0053305 0.0000000), wk = 0.0022523 k( 221) = ( -0.0322581 0.0106610 0.0000000), wk = 0.0022523 k( 222) = ( -0.0483871 0.0159914 0.0000000), wk = 0.0022523 k( 223) = ( -0.0645161 0.0213219 0.0000000), wk = 0.0022523 k( 224) = ( -0.0806452 0.0266524 0.0000000), wk = 0.0022523 k( 225) = ( -0.0967742 0.0319829 0.0000000), wk = 0.0022523 k( 226) = ( -0.1129032 0.0373133 0.0000000), wk = 0.0022523 k( 227) = ( -0.1290323 0.0426438 0.0000000), wk = 0.0022523 k( 228) = ( -0.1451613 0.0479743 0.0000000), wk = 0.0022523 k( 229) = ( -0.1612903 0.0533048 0.0000000), wk = 0.0022523 k( 230) = ( -0.1774194 0.0586352 0.0000000), wk = 0.0022523 k( 231) = ( -0.1935484 0.0639657 0.0000000), wk = 0.0022523 k( 232) = ( -0.2096774 0.0692962 0.0000000), wk = 0.0022523 k( 233) = ( -0.2258064 0.0746267 0.0000000), wk = 0.0022523 k( 234) = ( -0.2419355 0.0799572 0.0000000), wk = 0.0022523 k( 235) = ( -0.2580645 0.0852876 0.0000000), wk = 0.0022523 k( 236) = ( -0.2741936 0.0906181 0.0000000), wk = 0.0022523 k( 237) = ( -0.2903226 0.0959486 0.0000000), wk = 0.0022523 k( 238) = ( -0.3064516 0.1012791 0.0000000), wk = 0.0022523 k( 239) = ( -0.3225807 0.1066095 0.0000000), wk = 0.0022523 k( 240) = ( -0.3387097 0.1119400 0.0000000), wk = 0.0022523 k( 241) = ( -0.3548387 0.1172705 0.0000000), wk = 0.0022523 k( 242) = ( -0.3709677 0.1226010 0.0000000), wk = 0.0022523 k( 243) = ( -0.3870968 0.1279314 0.0000000), wk = 0.0022523 k( 244) = ( -0.4032258 0.1332619 0.0000000), wk = 0.0022523 k( 245) = ( -0.4193548 0.1385924 0.0000000), wk = 0.0022523 k( 246) = ( -0.4354839 0.1439229 0.0000000), wk = 0.0022523 k( 247) = ( -0.4516129 0.1492534 0.0000000), wk = 0.0022523 k( 248) = ( -0.4677419 0.1545838 0.0000000), wk = 0.0022523 k( 249) = ( -0.4838710 0.1599143 0.0000000), wk = 0.0022523 k( 250) = ( -0.5000000 0.1652448 0.0000000), wk = 0.0022523 k( 251) = ( -0.5000000 0.1652448 0.0000000), wk = 0.0022523 k( 252) = ( -0.4946978 0.1812884 -0.0000000), wk = 0.0022523 k( 253) = ( -0.4893955 0.1973320 -0.0000000), wk = 0.0022523 k( 254) = ( -0.4840933 0.2133756 -0.0000000), wk = 0.0022523 k( 255) = ( -0.4787910 0.2294192 -0.0000000), wk = 0.0022523 k( 256) = ( -0.4734888 0.2454628 -0.0000000), wk = 0.0022523 k( 257) = ( -0.4681865 0.2615064 -0.0000000), wk = 0.0022523 k( 258) = ( -0.4628843 0.2775500 -0.0000000), wk = 0.0022523 k( 259) = ( -0.4575821 0.2935936 -0.0000000), wk = 0.0022523 k( 260) = ( -0.4522798 0.3096372 -0.0000000), wk = 0.0022523 k( 261) = ( -0.4469776 0.3256808 -0.0000000), wk = 0.0022523 k( 262) = ( -0.4416753 0.3417244 -0.0000000), wk = 0.0022523 k( 263) = ( -0.4363731 0.3577680 -0.0000000), wk = 0.0022523 k( 264) = ( -0.4310709 0.3738115 -0.0000000), wk = 0.0022523 k( 265) = ( -0.4257686 0.3898552 -0.0000000), wk = 0.0022523 k( 266) = ( -0.4204664 0.4058988 -0.0000000), wk = 0.0022523 k( 267) = ( -0.4151641 0.4219424 -0.0000000), wk = 0.0022523 k( 268) = ( -0.4098619 0.4379859 -0.0000000), wk = 0.0022523 k( 269) = ( -0.4045596 0.4540295 -0.0000000), wk = 0.0022523 k( 270) = ( -0.3992574 0.4700732 -0.0000000), wk = 0.0022523 k( 271) = ( -0.3939552 0.4861168 -0.0000000), wk = 0.0022523 k( 272) = ( -0.3886529 0.5021603 -0.0000000), wk = 0.0022523 k( 273) = ( -0.3833507 0.5182039 -0.0000000), wk = 0.0022523 k( 274) = ( -0.3780484 0.5342475 -0.0000000), wk = 0.0022523 k( 275) = ( -0.3727462 0.5502912 -0.0000000), wk = 0.0022523 k( 276) = ( -0.3674440 0.5663347 -0.0000000), wk = 0.0022523 k( 277) = ( -0.3621417 0.5823783 -0.0000000), wk = 0.0022523 k( 278) = ( -0.3568395 0.5984219 -0.0000000), wk = 0.0022523 k( 279) = ( -0.3515372 0.6144655 -0.0000000), wk = 0.0022523 k( 280) = ( -0.3462350 0.6305091 -0.0000000), wk = 0.0022523 k( 281) = ( -0.3409327 0.6465527 -0.0000000), wk = 0.0022523 k( 282) = ( -0.3356305 0.6625963 -0.0000000), wk = 0.0022523 k( 283) = ( -0.3303283 0.6786399 -0.0000000), wk = 0.0022523 k( 284) = ( -0.3250260 0.6946835 -0.0000000), wk = 0.0022523 k( 285) = ( -0.3197238 0.7107271 -0.0000000), wk = 0.0022523 k( 286) = ( -0.3144215 0.7267707 -0.0000000), wk = 0.0022523 k( 287) = ( -0.3091193 0.7428143 -0.0000000), wk = 0.0022523 k( 288) = ( -0.3038170 0.7588579 -0.0000000), wk = 0.0022523 k( 289) = ( -0.2985148 0.7749015 -0.0000000), wk = 0.0022523 k( 290) = ( -0.2932126 0.7909451 -0.0000000), wk = 0.0022523 k( 291) = ( -0.2879103 0.8069887 -0.0000000), wk = 0.0022523 k( 292) = ( -0.2826081 0.8230323 -0.0000000), wk = 0.0022523 k( 293) = ( -0.2773058 0.8390759 -0.0000000), wk = 0.0022523 k( 294) = ( -0.2773058 0.8390759 -0.0000000), wk = 0.0022523 k( 295) = ( -0.2773058 0.8390759 0.0171624), wk = 0.0022523 k( 296) = ( -0.2773058 0.8390759 0.0343248), wk = 0.0022523 k( 297) = ( -0.2773058 0.8390759 0.0514872), wk = 0.0022523 k( 298) = ( -0.2773058 0.8390759 0.0686496), wk = 0.0022523 k( 299) = ( -0.2773058 0.8390759 0.0858120), wk = 0.0022523 k( 300) = ( -0.2773058 0.8390759 0.1029743), wk = 0.0022523 k( 301) = ( -0.2773058 0.8390759 0.1201367), wk = 0.0022523 k( 302) = ( -0.2773058 0.8390759 0.1372991), wk = 0.0022523 k( 303) = ( -0.2773058 0.8390759 0.1544615), wk = 0.0022523 k( 304) = ( -0.2773058 0.8390759 0.1716239), wk = 0.0022523 k( 305) = ( -0.2773058 0.8390759 0.1887863), wk = 0.0022523 k( 306) = ( -0.2773058 0.8390759 0.2059487), wk = 0.0022523 k( 307) = ( -0.2773058 0.8390759 0.2231111), wk = 0.0022523 k( 308) = ( -0.2773058 0.8390759 0.2402735), wk = 0.0022523 k( 309) = ( -0.2773058 0.8390759 0.2574358), wk = 0.0022523 k( 310) = ( -0.2773058 0.8390759 0.2745982), wk = 0.0022523 k( 311) = ( -0.2773058 0.8390759 0.2917606), wk = 0.0022523 k( 312) = ( -0.2773058 0.8390759 0.3089230), wk = 0.0022523 k( 313) = ( -0.2773058 0.8390759 0.3260854), wk = 0.0022523 k( 314) = ( -0.2773058 0.8390759 0.3432478), wk = 0.0022523 k( 315) = ( -0.2773058 0.8390759 0.3604102), wk = 0.0022523 k( 316) = ( -0.2773058 0.8390759 0.3775726), wk = 0.0022523 k( 317) = ( -0.2773058 0.8390759 0.3947350), wk = 0.0022523 k( 318) = ( -0.2773058 0.8390759 0.4118974), wk = 0.0022523 k( 319) = ( -0.2773058 0.8390759 0.4290598), wk = 0.0022523 k( 320) = ( -0.2773058 0.8390759 0.4462221), wk = 0.0022523 k( 321) = ( -0.2773058 0.8390759 0.4633845), wk = 0.0022523 k( 322) = ( -0.2773058 0.8390759 0.4805469), wk = 0.0022523 k( 323) = ( -0.2773058 0.8390759 0.4977093), wk = 0.0022523 k( 324) = ( -0.2773058 0.8390759 0.5148717), wk = 0.0022523 k( 325) = ( -0.2773058 0.8390759 0.5320341), wk = 0.0022523 k( 326) = ( -0.2773058 0.8390759 0.5491965), wk = 0.0022523 k( 327) = ( -0.2773058 0.8390759 0.5663589), wk = 0.0022523 k( 328) = ( -0.2773058 0.8390759 0.5835213), wk = 0.0022523 k( 329) = ( -0.2773058 0.8390759 0.6006837), wk = 0.0022523 k( 330) = ( -0.2773058 0.8390759 0.6178460), wk = 0.0022523 k( 331) = ( -0.2773058 0.8390759 0.6350084), wk = 0.0022523 k( 332) = ( -0.2773058 0.8390759 0.6350084), wk = 0.0022523 k( 333) = ( -0.2826081 0.8230323 0.6350084), wk = 0.0022523 k( 334) = ( -0.2879103 0.8069887 0.6350084), wk = 0.0022523 k( 335) = ( -0.2932126 0.7909451 0.6350084), wk = 0.0022523 k( 336) = ( -0.2985148 0.7749015 0.6350084), wk = 0.0022523 k( 337) = ( -0.3038170 0.7588579 0.6350084), wk = 0.0022523 k( 338) = ( -0.3091193 0.7428143 0.6350084), wk = 0.0022523 k( 339) = ( -0.3144215 0.7267707 0.6350084), wk = 0.0022523 k( 340) = ( -0.3197238 0.7107271 0.6350084), wk = 0.0022523 k( 341) = ( -0.3250260 0.6946835 0.6350084), wk = 0.0022523 k( 342) = ( -0.3303283 0.6786399 0.6350084), wk = 0.0022523 k( 343) = ( -0.3356305 0.6625963 0.6350084), wk = 0.0022523 k( 344) = ( -0.3409327 0.6465527 0.6350084), wk = 0.0022523 k( 345) = ( -0.3462350 0.6305091 0.6350084), wk = 0.0022523 k( 346) = ( -0.3515372 0.6144655 0.6350084), wk = 0.0022523 k( 347) = ( -0.3568395 0.5984219 0.6350084), wk = 0.0022523 k( 348) = ( -0.3621417 0.5823783 0.6350084), wk = 0.0022523 k( 349) = ( -0.3674440 0.5663347 0.6350084), wk = 0.0022523 k( 350) = ( -0.3727462 0.5502912 0.6350084), wk = 0.0022523 k( 351) = ( -0.3780484 0.5342475 0.6350084), wk = 0.0022523 k( 352) = ( -0.3833507 0.5182039 0.6350084), wk = 0.0022523 k( 353) = ( -0.3886529 0.5021603 0.6350084), wk = 0.0022523 k( 354) = ( -0.3939552 0.4861168 0.6350084), wk = 0.0022523 k( 355) = ( -0.3992574 0.4700732 0.6350084), wk = 0.0022523 k( 356) = ( -0.4045596 0.4540295 0.6350084), wk = 0.0022523 k( 357) = ( -0.4098619 0.4379859 0.6350084), wk = 0.0022523 k( 358) = ( -0.4151641 0.4219424 0.6350084), wk = 0.0022523 k( 359) = ( -0.4204664 0.4058988 0.6350084), wk = 0.0022523 k( 360) = ( -0.4257686 0.3898552 0.6350084), wk = 0.0022523 k( 361) = ( -0.4310709 0.3738115 0.6350084), wk = 0.0022523 k( 362) = ( -0.4363731 0.3577680 0.6350084), wk = 0.0022523 k( 363) = ( -0.4416753 0.3417244 0.6350084), wk = 0.0022523 k( 364) = ( -0.4469776 0.3256808 0.6350084), wk = 0.0022523 k( 365) = ( -0.4522798 0.3096372 0.6350084), wk = 0.0022523 k( 366) = ( -0.4575821 0.2935936 0.6350084), wk = 0.0022523 k( 367) = ( -0.4628843 0.2775500 0.6350084), wk = 0.0022523 k( 368) = ( -0.4681865 0.2615064 0.6350084), wk = 0.0022523 k( 369) = ( -0.4734888 0.2454628 0.6350084), wk = 0.0022523 k( 370) = ( -0.4787910 0.2294192 0.6350084), wk = 0.0022523 k( 371) = ( -0.4840933 0.2133756 0.6350084), wk = 0.0022523 k( 372) = ( -0.4893955 0.1973320 0.6350084), wk = 0.0022523 k( 373) = ( -0.4946978 0.1812884 0.6350084), wk = 0.0022523 k( 374) = ( -0.5000000 0.1652448 0.6350084), wk = 0.0022523 k( 375) = ( -0.5000000 0.1652448 0.6350084), wk = 0.0022523 k( 376) = ( -0.5000000 0.1652448 0.6178460), wk = 0.0022523 k( 377) = ( -0.5000000 0.1652448 0.6006837), wk = 0.0022523 k( 378) = ( -0.5000000 0.1652448 0.5835213), wk = 0.0022523 k( 379) = ( -0.5000000 0.1652448 0.5663589), wk = 0.0022523 k( 380) = ( -0.5000000 0.1652448 0.5491965), wk = 0.0022523 k( 381) = ( -0.5000000 0.1652448 0.5320341), wk = 0.0022523 k( 382) = ( -0.5000000 0.1652448 0.5148717), wk = 0.0022523 k( 383) = ( -0.5000000 0.1652448 0.4977093), wk = 0.0022523 k( 384) = ( -0.5000000 0.1652448 0.4805469), wk = 0.0022523 k( 385) = ( -0.5000000 0.1652448 0.4633845), wk = 0.0022523 k( 386) = ( -0.5000000 0.1652448 0.4462221), wk = 0.0022523 k( 387) = ( -0.5000000 0.1652448 0.4290598), wk = 0.0022523 k( 388) = ( -0.5000000 0.1652448 0.4118974), wk = 0.0022523 k( 389) = ( -0.5000000 0.1652448 0.3947350), wk = 0.0022523 k( 390) = ( -0.5000000 0.1652448 0.3775726), wk = 0.0022523 k( 391) = ( -0.5000000 0.1652448 0.3604102), wk = 0.0022523 k( 392) = ( -0.5000000 0.1652448 0.3432478), wk = 0.0022523 k( 393) = ( -0.5000000 0.1652448 0.3260854), wk = 0.0022523 k( 394) = ( -0.5000000 0.1652448 0.3089230), wk = 0.0022523 k( 395) = ( -0.5000000 0.1652448 0.2917606), wk = 0.0022523 k( 396) = ( -0.5000000 0.1652448 0.2745982), wk = 0.0022523 k( 397) = ( -0.5000000 0.1652448 0.2574358), wk = 0.0022523 k( 398) = ( -0.5000000 0.1652448 0.2402735), wk = 0.0022523 k( 399) = ( -0.5000000 0.1652448 0.2231111), wk = 0.0022523 k( 400) = ( -0.5000000 0.1652448 0.2059487), wk = 0.0022523 k( 401) = ( -0.5000000 0.1652448 0.1887863), wk = 0.0022523 k( 402) = ( -0.5000000 0.1652448 0.1716239), wk = 0.0022523 k( 403) = ( -0.5000000 0.1652448 0.1544615), wk = 0.0022523 k( 404) = ( -0.5000000 0.1652448 0.1372991), wk = 0.0022523 k( 405) = ( -0.5000000 0.1652448 0.1201367), wk = 0.0022523 k( 406) = ( -0.5000000 0.1652448 0.1029743), wk = 0.0022523 k( 407) = ( -0.5000000 0.1652448 0.0858120), wk = 0.0022523 k( 408) = ( -0.5000000 0.1652448 0.0686496), wk = 0.0022523 k( 409) = ( -0.5000000 0.1652448 0.0514872), wk = 0.0022523 k( 410) = ( -0.5000000 0.1652448 0.0343248), wk = 0.0022523 k( 411) = ( -0.5000000 0.1652448 0.0171624), wk = 0.0022523 k( 412) = ( -0.5000000 0.1652448 0.0000000), wk = 0.0022523 k( 413) = ( 0.0000000 0.0000000 0.6350084), wk = 0.0022523 k( 414) = ( -0.0161290 0.0053305 0.6350084), wk = 0.0022523 k( 415) = ( -0.0322581 0.0106610 0.6350084), wk = 0.0022523 k( 416) = ( -0.0483871 0.0159914 0.6350084), wk = 0.0022523 k( 417) = ( -0.0645161 0.0213219 0.6350084), wk = 0.0022523 k( 418) = ( -0.0806452 0.0266524 0.6350084), wk = 0.0022523 k( 419) = ( -0.0967742 0.0319829 0.6350084), wk = 0.0022523 k( 420) = ( -0.1129032 0.0373133 0.6350084), wk = 0.0022523 k( 421) = ( -0.1290323 0.0426438 0.6350084), wk = 0.0022523 k( 422) = ( -0.1451613 0.0479743 0.6350084), wk = 0.0022523 k( 423) = ( -0.1612903 0.0533048 0.6350084), wk = 0.0022523 k( 424) = ( -0.1774194 0.0586352 0.6350084), wk = 0.0022523 k( 425) = ( -0.1935484 0.0639657 0.6350084), wk = 0.0022523 k( 426) = ( -0.2096774 0.0692962 0.6350084), wk = 0.0022523 k( 427) = ( -0.2258064 0.0746267 0.6350084), wk = 0.0022523 k( 428) = ( -0.2419355 0.0799572 0.6350084), wk = 0.0022523 k( 429) = ( -0.2580645 0.0852876 0.6350084), wk = 0.0022523 k( 430) = ( -0.2741936 0.0906181 0.6350084), wk = 0.0022523 k( 431) = ( -0.2903226 0.0959486 0.6350084), wk = 0.0022523 k( 432) = ( -0.3064516 0.1012791 0.6350084), wk = 0.0022523 k( 433) = ( -0.3225807 0.1066095 0.6350084), wk = 0.0022523 k( 434) = ( -0.3387097 0.1119400 0.6350084), wk = 0.0022523 k( 435) = ( -0.3548387 0.1172705 0.6350084), wk = 0.0022523 k( 436) = ( -0.3709677 0.1226010 0.6350084), wk = 0.0022523 k( 437) = ( -0.3870968 0.1279314 0.6350084), wk = 0.0022523 k( 438) = ( -0.4032258 0.1332619 0.6350084), wk = 0.0022523 k( 439) = ( -0.4193548 0.1385924 0.6350084), wk = 0.0022523 k( 440) = ( -0.4354839 0.1439229 0.6350084), wk = 0.0022523 k( 441) = ( -0.4516129 0.1492534 0.6350084), wk = 0.0022523 k( 442) = ( -0.4677419 0.1545838 0.6350084), wk = 0.0022523 k( 443) = ( -0.4838710 0.1599143 0.6350084), wk = 0.0022523 k( 444) = ( -0.5000000 0.1652448 0.6350084), wk = 0.0022523 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 2) = ( 0.0053328 0.0053328 -0.0000000), wk = 0.0022523 k( 3) = ( 0.0106656 0.0106656 -0.0000000), wk = 0.0022523 k( 4) = ( 0.0159984 0.0159984 -0.0000000), wk = 0.0022523 k( 5) = ( 0.0213312 0.0213312 -0.0000000), wk = 0.0022523 k( 6) = ( 0.0266640 0.0266640 0.0000000), wk = 0.0022523 k( 7) = ( 0.0319968 0.0319968 -0.0000000), wk = 0.0022523 k( 8) = ( 0.0373296 0.0373296 -0.0000000), wk = 0.0022523 k( 9) = ( 0.0426624 0.0426624 -0.0000000), wk = 0.0022523 k( 10) = ( 0.0479952 0.0479952 -0.0000000), wk = 0.0022523 k( 11) = ( 0.0533281 0.0533281 -0.0000000), wk = 0.0022523 k( 12) = ( 0.0586609 0.0586608 0.0000000), wk = 0.0022523 k( 13) = ( 0.0639937 0.0639937 -0.0000000), wk = 0.0022523 k( 14) = ( 0.0693265 0.0693265 0.0000000), wk = 0.0022523 k( 15) = ( 0.0746593 0.0746593 -0.0000000), wk = 0.0022523 k( 16) = ( 0.0799921 0.0799921 0.0000000), wk = 0.0022523 k( 17) = ( 0.0853249 0.0853249 -0.0000000), wk = 0.0022523 k( 18) = ( 0.0906577 0.0906577 0.0000000), wk = 0.0022523 k( 19) = ( 0.0959905 0.0959905 -0.0000000), wk = 0.0022523 k( 20) = ( 0.1013233 0.1013233 -0.0000000), wk = 0.0022523 k( 21) = ( 0.1066561 0.1066561 -0.0000000), wk = 0.0022523 k( 22) = ( 0.1119889 0.1119889 0.0000000), wk = 0.0022523 k( 23) = ( 0.1173217 0.1173217 0.0000000), wk = 0.0022523 k( 24) = ( 0.1226545 0.1226545 -0.0000000), wk = 0.0022523 k( 25) = ( 0.1279873 0.1279873 0.0000000), wk = 0.0022523 k( 26) = ( 0.1333201 0.1333201 0.0000000), wk = 0.0022523 k( 27) = ( 0.1386529 0.1386529 0.0000000), wk = 0.0022523 k( 28) = ( 0.1439857 0.1439857 0.0000000), wk = 0.0022523 k( 29) = ( 0.1493185 0.1493185 0.0000000), wk = 0.0022523 k( 30) = ( 0.1546513 0.1546513 -0.0000000), wk = 0.0022523 k( 31) = ( 0.1599841 0.1599841 0.0000000), wk = 0.0022523 k( 32) = ( 0.1653169 0.1653169 -0.0000000), wk = 0.0022523 k( 33) = ( 0.1706497 0.1706497 -0.0000000), wk = 0.0022523 k( 34) = ( 0.1759825 0.1759825 -0.0000000), wk = 0.0022523 k( 35) = ( 0.1813154 0.1813154 0.0000000), wk = 0.0022523 k( 36) = ( 0.1866482 0.1866482 -0.0000000), wk = 0.0022523 k( 37) = ( 0.1919810 0.1919810 -0.0000000), wk = 0.0022523 k( 38) = ( 0.1973138 0.1973138 0.0000000), wk = 0.0022523 k( 39) = ( 0.2026466 0.2026466 -0.0000000), wk = 0.0022523 k( 40) = ( 0.2079794 0.2079794 0.0000000), wk = 0.0022523 k( 41) = ( 0.2133122 0.2133122 -0.0000000), wk = 0.0022523 k( 42) = ( 0.2186450 0.2186450 -0.0000000), wk = 0.0022523 k( 43) = ( 0.2239778 0.2239778 -0.0000000), wk = 0.0022523 k( 44) = ( 0.2293106 0.2293106 0.0000000), wk = 0.0022523 k( 45) = ( 0.2346434 0.2346434 0.0000000), wk = 0.0022523 k( 46) = ( 0.2399762 0.2399762 0.0000000), wk = 0.0022523 k( 47) = ( 0.2453090 0.2453090 0.0000000), wk = 0.0022523 k( 48) = ( 0.2506418 0.2506418 -0.0000000), wk = 0.0022523 k( 49) = ( 0.2559746 0.2559746 0.0000000), wk = 0.0022523 k( 50) = ( 0.2613074 0.2613074 -0.0000000), wk = 0.0022523 k( 51) = ( 0.2666402 0.2666402 0.0000000), wk = 0.0022523 k( 52) = ( 0.2719730 0.2719730 -0.0000000), wk = 0.0022523 k( 53) = ( 0.2773058 0.2773058 0.0000000), wk = 0.0022523 k( 54) = ( 0.2773058 0.2773058 0.0000000), wk = 0.0022523 k( 55) = ( 0.2609937 0.2904055 -0.0000000), wk = 0.0022523 k( 56) = ( 0.2446816 0.3035051 0.0000000), wk = 0.0022523 k( 57) = ( 0.2283695 0.3166048 0.0000000), wk = 0.0022523 k( 58) = ( 0.2120574 0.3297045 -0.0000000), wk = 0.0022523 k( 59) = ( 0.1957453 0.3428041 0.0000000), wk = 0.0022523 k( 60) = ( 0.1794332 0.3559038 0.0000000), wk = 0.0022523 k( 61) = ( 0.1631211 0.3690034 -0.0000000), wk = 0.0022523 k( 62) = ( 0.1468090 0.3821031 0.0000000), wk = 0.0022523 k( 63) = ( 0.1304969 0.3952027 -0.0000000), wk = 0.0022523 k( 64) = ( 0.1141848 0.4083024 -0.0000000), wk = 0.0022523 k( 65) = ( 0.0978727 0.4214021 0.0000000), wk = 0.0022523 k( 66) = ( 0.0815605 0.4345017 -0.0000000), wk = 0.0022523 k( 67) = ( 0.0652484 0.4476014 -0.0000000), wk = 0.0022523 k( 68) = ( 0.0489363 0.4607010 -0.0000000), wk = 0.0022523 k( 69) = ( 0.0326242 0.4738007 0.0000000), wk = 0.0022523 k( 70) = ( 0.0163121 0.4869003 -0.0000000), wk = 0.0022523 k( 71) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022523 k( 72) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022523 k( 73) = ( 0.0000000 0.5000000 0.0135135), wk = 0.0022523 k( 74) = ( 0.0000000 0.5000000 0.0270270), wk = 0.0022523 k( 75) = ( 0.0000000 0.5000000 0.0405405), wk = 0.0022523 k( 76) = ( 0.0000000 0.5000000 0.0540540), wk = 0.0022523 k( 77) = ( 0.0000000 0.5000000 0.0675676), wk = 0.0022523 k( 78) = ( 0.0000000 0.5000000 0.0810811), wk = 0.0022523 k( 79) = ( 0.0000000 0.5000000 0.0945946), wk = 0.0022523 k( 80) = ( 0.0000000 0.5000000 0.1081081), wk = 0.0022523 k( 81) = ( 0.0000000 0.5000000 0.1216216), wk = 0.0022523 k( 82) = ( 0.0000000 0.5000000 0.1351351), wk = 0.0022523 k( 83) = ( 0.0000000 0.5000000 0.1486486), wk = 0.0022523 k( 84) = ( 0.0000000 0.5000000 0.1621622), wk = 0.0022523 k( 85) = ( 0.0000000 0.5000000 0.1756757), wk = 0.0022523 k( 86) = ( 0.0000000 0.5000000 0.1891892), wk = 0.0022523 k( 87) = ( 0.0000000 0.5000000 0.2027027), wk = 0.0022523 k( 88) = ( 0.0000000 0.5000000 0.2162162), wk = 0.0022523 k( 89) = ( 0.0000000 0.5000000 0.2297297), wk = 0.0022523 k( 90) = ( 0.0000000 0.5000000 0.2432432), wk = 0.0022523 k( 91) = ( 0.0000000 0.5000000 0.2567568), wk = 0.0022523 k( 92) = ( 0.0000000 0.5000000 0.2702703), wk = 0.0022523 k( 93) = ( 0.0000000 0.5000000 0.2837838), wk = 0.0022523 k( 94) = ( 0.0000000 0.5000000 0.2972973), wk = 0.0022523 k( 95) = ( 0.0000000 0.5000000 0.3108108), wk = 0.0022523 k( 96) = ( 0.0000000 0.5000000 0.3243243), wk = 0.0022523 k( 97) = ( 0.0000000 0.5000000 0.3378378), wk = 0.0022523 k( 98) = ( 0.0000000 0.5000000 0.3513514), wk = 0.0022523 k( 99) = ( 0.0000000 0.5000000 0.3648649), wk = 0.0022523 k( 100) = ( 0.0000000 0.5000000 0.3783784), wk = 0.0022523 k( 101) = ( 0.0000000 0.5000000 0.3918919), wk = 0.0022523 k( 102) = ( 0.0000000 0.5000000 0.4054054), wk = 0.0022523 k( 103) = ( 0.0000000 0.5000000 0.4189189), wk = 0.0022523 k( 104) = ( 0.0000000 0.5000000 0.4324324), wk = 0.0022523 k( 105) = ( 0.0000000 0.5000000 0.4459459), wk = 0.0022523 k( 106) = ( 0.0000000 0.5000000 0.4594595), wk = 0.0022523 k( 107) = ( 0.0000000 0.5000000 0.4729730), wk = 0.0022523 k( 108) = ( 0.0000000 0.5000000 0.4864865), wk = 0.0022523 k( 109) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022523 k( 110) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022523 k( 111) = ( 0.0163121 0.4869003 0.5000000), wk = 0.0022523 k( 112) = ( 0.0326242 0.4738007 0.5000000), wk = 0.0022523 k( 113) = ( 0.0489363 0.4607010 0.5000000), wk = 0.0022523 k( 114) = ( 0.0652484 0.4476014 0.5000000), wk = 0.0022523 k( 115) = ( 0.0815605 0.4345017 0.5000000), wk = 0.0022523 k( 116) = ( 0.0978727 0.4214021 0.5000000), wk = 0.0022523 k( 117) = ( 0.1141848 0.4083024 0.5000000), wk = 0.0022523 k( 118) = ( 0.1304969 0.3952027 0.5000000), wk = 0.0022523 k( 119) = ( 0.1468090 0.3821031 0.5000000), wk = 0.0022523 k( 120) = ( 0.1631211 0.3690034 0.5000000), wk = 0.0022523 k( 121) = ( 0.1794332 0.3559038 0.5000000), wk = 0.0022523 k( 122) = ( 0.1957453 0.3428041 0.5000000), wk = 0.0022523 k( 123) = ( 0.2120574 0.3297045 0.5000000), wk = 0.0022523 k( 124) = ( 0.2283695 0.3166048 0.5000000), wk = 0.0022523 k( 125) = ( 0.2446816 0.3035051 0.5000000), wk = 0.0022523 k( 126) = ( 0.2609937 0.2904055 0.5000000), wk = 0.0022523 k( 127) = ( 0.2773058 0.2773058 0.5000000), wk = 0.0022523 k( 128) = ( 0.2773058 0.2773058 0.5000000), wk = 0.0022523 k( 129) = ( 0.2719730 0.2719730 0.5000000), wk = 0.0022523 k( 130) = ( 0.2666402 0.2666402 0.5000000), wk = 0.0022523 k( 131) = ( 0.2613074 0.2613074 0.5000000), wk = 0.0022523 k( 132) = ( 0.2559746 0.2559746 0.5000000), wk = 0.0022523 k( 133) = ( 0.2506418 0.2506418 0.5000000), wk = 0.0022523 k( 134) = ( 0.2453090 0.2453090 0.5000000), wk = 0.0022523 k( 135) = ( 0.2399762 0.2399762 0.5000000), wk = 0.0022523 k( 136) = ( 0.2346434 0.2346434 0.5000000), wk = 0.0022523 k( 137) = ( 0.2293106 0.2293106 0.5000000), wk = 0.0022523 k( 138) = ( 0.2239778 0.2239778 0.5000000), wk = 0.0022523 k( 139) = ( 0.2186450 0.2186450 0.5000000), wk = 0.0022523 k( 140) = ( 0.2133122 0.2133122 0.5000000), wk = 0.0022523 k( 141) = ( 0.2079794 0.2079794 0.5000000), wk = 0.0022523 k( 142) = ( 0.2026466 0.2026466 0.5000000), wk = 0.0022523 k( 143) = ( 0.1973138 0.1973138 0.5000000), wk = 0.0022523 k( 144) = ( 0.1919810 0.1919810 0.5000000), wk = 0.0022523 k( 145) = ( 0.1866482 0.1866482 0.5000000), wk = 0.0022523 k( 146) = ( 0.1813154 0.1813154 0.5000000), wk = 0.0022523 k( 147) = ( 0.1759825 0.1759825 0.5000000), wk = 0.0022523 k( 148) = ( 0.1706497 0.1706497 0.5000000), wk = 0.0022523 k( 149) = ( 0.1653169 0.1653169 0.5000000), wk = 0.0022523 k( 150) = ( 0.1599841 0.1599841 0.5000000), wk = 0.0022523 k( 151) = ( 0.1546513 0.1546513 0.5000000), wk = 0.0022523 k( 152) = ( 0.1493185 0.1493185 0.5000000), wk = 0.0022523 k( 153) = ( 0.1439857 0.1439857 0.5000000), wk = 0.0022523 k( 154) = ( 0.1386529 0.1386529 0.5000000), wk = 0.0022523 k( 155) = ( 0.1333201 0.1333201 0.5000000), wk = 0.0022523 k( 156) = ( 0.1279873 0.1279873 0.5000000), wk = 0.0022523 k( 157) = ( 0.1226545 0.1226545 0.5000000), wk = 0.0022523 k( 158) = ( 0.1173217 0.1173217 0.5000000), wk = 0.0022523 k( 159) = ( 0.1119889 0.1119889 0.5000000), wk = 0.0022523 k( 160) = ( 0.1066561 0.1066561 0.5000000), wk = 0.0022523 k( 161) = ( 0.1013233 0.1013233 0.5000000), wk = 0.0022523 k( 162) = ( 0.0959905 0.0959905 0.5000000), wk = 0.0022523 k( 163) = ( 0.0906577 0.0906577 0.5000000), wk = 0.0022523 k( 164) = ( 0.0853249 0.0853249 0.5000000), wk = 0.0022523 k( 165) = ( 0.0799921 0.0799921 0.5000000), wk = 0.0022523 k( 166) = ( 0.0746593 0.0746593 0.5000000), wk = 0.0022523 k( 167) = ( 0.0693265 0.0693265 0.5000000), wk = 0.0022523 k( 168) = ( 0.0639937 0.0639937 0.5000000), wk = 0.0022523 k( 169) = ( 0.0586609 0.0586608 0.5000000), wk = 0.0022523 k( 170) = ( 0.0533281 0.0533281 0.5000000), wk = 0.0022523 k( 171) = ( 0.0479952 0.0479952 0.5000000), wk = 0.0022523 k( 172) = ( 0.0426624 0.0426624 0.5000000), wk = 0.0022523 k( 173) = ( 0.0373296 0.0373296 0.5000000), wk = 0.0022523 k( 174) = ( 0.0319968 0.0319968 0.5000000), wk = 0.0022523 k( 175) = ( 0.0266640 0.0266640 0.5000000), wk = 0.0022523 k( 176) = ( 0.0213312 0.0213312 0.5000000), wk = 0.0022523 k( 177) = ( 0.0159984 0.0159984 0.5000000), wk = 0.0022523 k( 178) = ( 0.0106656 0.0106656 0.5000000), wk = 0.0022523 k( 179) = ( 0.0053328 0.0053328 0.5000000), wk = 0.0022523 k( 180) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022523 k( 181) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022523 k( 182) = ( 0.0000000 0.0000000 0.4864865), wk = 0.0022523 k( 183) = ( 0.0000000 0.0000000 0.4729730), wk = 0.0022523 k( 184) = ( 0.0000000 0.0000000 0.4594595), wk = 0.0022523 k( 185) = ( 0.0000000 0.0000000 0.4459459), wk = 0.0022523 k( 186) = ( 0.0000000 0.0000000 0.4324324), wk = 0.0022523 k( 187) = ( 0.0000000 0.0000000 0.4189189), wk = 0.0022523 k( 188) = ( 0.0000000 0.0000000 0.4054054), wk = 0.0022523 k( 189) = ( 0.0000000 0.0000000 0.3918919), wk = 0.0022523 k( 190) = ( 0.0000000 0.0000000 0.3783784), wk = 0.0022523 k( 191) = ( 0.0000000 0.0000000 0.3648649), wk = 0.0022523 k( 192) = ( 0.0000000 0.0000000 0.3513513), wk = 0.0022523 k( 193) = ( 0.0000000 0.0000000 0.3378378), wk = 0.0022523 k( 194) = ( 0.0000000 0.0000000 0.3243243), wk = 0.0022523 k( 195) = ( 0.0000000 0.0000000 0.3108108), wk = 0.0022523 k( 196) = ( 0.0000000 0.0000000 0.2972973), wk = 0.0022523 k( 197) = ( 0.0000000 0.0000000 0.2837838), wk = 0.0022523 k( 198) = ( 0.0000000 0.0000000 0.2702703), wk = 0.0022523 k( 199) = ( 0.0000000 0.0000000 0.2567568), wk = 0.0022523 k( 200) = ( 0.0000000 0.0000000 0.2432432), wk = 0.0022523 k( 201) = ( 0.0000000 0.0000000 0.2297297), wk = 0.0022523 k( 202) = ( 0.0000000 0.0000000 0.2162162), wk = 0.0022523 k( 203) = ( 0.0000000 0.0000000 0.2027027), wk = 0.0022523 k( 204) = ( 0.0000000 0.0000000 0.1891892), wk = 0.0022523 k( 205) = ( 0.0000000 0.0000000 0.1756757), wk = 0.0022523 k( 206) = ( 0.0000000 0.0000000 0.1621622), wk = 0.0022523 k( 207) = ( 0.0000000 0.0000000 0.1486486), wk = 0.0022523 k( 208) = ( 0.0000000 0.0000000 0.1351351), wk = 0.0022523 k( 209) = ( 0.0000000 0.0000000 0.1216216), wk = 0.0022523 k( 210) = ( 0.0000000 0.0000000 0.1081081), wk = 0.0022523 k( 211) = ( 0.0000000 0.0000000 0.0945946), wk = 0.0022523 k( 212) = ( 0.0000000 0.0000000 0.0810811), wk = 0.0022523 k( 213) = ( 0.0000000 0.0000000 0.0675676), wk = 0.0022523 k( 214) = ( 0.0000000 0.0000000 0.0540540), wk = 0.0022523 k( 215) = ( 0.0000000 0.0000000 0.0405405), wk = 0.0022523 k( 216) = ( 0.0000000 0.0000000 0.0270270), wk = 0.0022523 k( 217) = ( 0.0000000 0.0000000 0.0135135), wk = 0.0022523 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022523 k( 220) = ( -0.0161290 0.0161290 0.0000000), wk = 0.0022523 k( 221) = ( -0.0322581 0.0322581 0.0000000), wk = 0.0022523 k( 222) = ( -0.0483871 0.0483871 0.0000000), wk = 0.0022523 k( 223) = ( -0.0645161 0.0645161 0.0000000), wk = 0.0022523 k( 224) = ( -0.0806452 0.0806452 0.0000000), wk = 0.0022523 k( 225) = ( -0.0967742 0.0967742 0.0000000), wk = 0.0022523 k( 226) = ( -0.1129032 0.1129032 0.0000000), wk = 0.0022523 k( 227) = ( -0.1290323 0.1290323 0.0000000), wk = 0.0022523 k( 228) = ( -0.1451613 0.1451613 0.0000000), wk = 0.0022523 k( 229) = ( -0.1612903 0.1612903 0.0000000), wk = 0.0022523 k( 230) = ( -0.1774194 0.1774194 0.0000000), wk = 0.0022523 k( 231) = ( -0.1935484 0.1935484 0.0000000), wk = 0.0022523 k( 232) = ( -0.2096774 0.2096774 0.0000000), wk = 0.0022523 k( 233) = ( -0.2258064 0.2258064 0.0000000), wk = 0.0022523 k( 234) = ( -0.2419355 0.2419355 0.0000000), wk = 0.0022523 k( 235) = ( -0.2580645 0.2580645 0.0000000), wk = 0.0022523 k( 236) = ( -0.2741936 0.2741936 0.0000000), wk = 0.0022523 k( 237) = ( -0.2903226 0.2903226 0.0000000), wk = 0.0022523 k( 238) = ( -0.3064516 0.3064516 0.0000000), wk = 0.0022523 k( 239) = ( -0.3225807 0.3225807 0.0000000), wk = 0.0022523 k( 240) = ( -0.3387097 0.3387097 -0.0000000), wk = 0.0022523 k( 241) = ( -0.3548387 0.3548387 0.0000000), wk = 0.0022523 k( 242) = ( -0.3709677 0.3709677 0.0000000), wk = 0.0022523 k( 243) = ( -0.3870968 0.3870968 0.0000000), wk = 0.0022523 k( 244) = ( -0.4032258 0.4032258 0.0000000), wk = 0.0022523 k( 245) = ( -0.4193548 0.4193548 0.0000000), wk = 0.0022523 k( 246) = ( -0.4354839 0.4354839 0.0000000), wk = 0.0022523 k( 247) = ( -0.4516129 0.4516129 0.0000000), wk = 0.0022523 k( 248) = ( -0.4677419 0.4677419 0.0000000), wk = 0.0022523 k( 249) = ( -0.4838710 0.4838710 0.0000000), wk = 0.0022523 k( 250) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022523 k( 251) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022523 k( 252) = ( -0.4946978 0.5053022 0.0000000), wk = 0.0022523 k( 253) = ( -0.4893955 0.5106045 0.0000000), wk = 0.0022523 k( 254) = ( -0.4840933 0.5159067 0.0000000), wk = 0.0022523 k( 255) = ( -0.4787910 0.5212090 0.0000000), wk = 0.0022523 k( 256) = ( -0.4734888 0.5265112 0.0000000), wk = 0.0022523 k( 257) = ( -0.4681865 0.5318135 0.0000000), wk = 0.0022523 k( 258) = ( -0.4628843 0.5371157 0.0000000), wk = 0.0022523 k( 259) = ( -0.4575821 0.5424179 0.0000000), wk = 0.0022523 k( 260) = ( -0.4522798 0.5477202 0.0000000), wk = 0.0022523 k( 261) = ( -0.4469776 0.5530224 0.0000000), wk = 0.0022523 k( 262) = ( -0.4416753 0.5583247 0.0000000), wk = 0.0022523 k( 263) = ( -0.4363731 0.5636269 -0.0000000), wk = 0.0022523 k( 264) = ( -0.4310709 0.5689291 0.0000000), wk = 0.0022523 k( 265) = ( -0.4257686 0.5742314 0.0000000), wk = 0.0022523 k( 266) = ( -0.4204664 0.5795336 0.0000000), wk = 0.0022523 k( 267) = ( -0.4151641 0.5848359 0.0000000), wk = 0.0022523 k( 268) = ( -0.4098619 0.5901381 0.0000000), wk = 0.0022523 k( 269) = ( -0.4045596 0.5954403 0.0000000), wk = 0.0022523 k( 270) = ( -0.3992574 0.6007426 0.0000000), wk = 0.0022523 k( 271) = ( -0.3939552 0.6060448 0.0000000), wk = 0.0022523 k( 272) = ( -0.3886529 0.6113471 -0.0000000), wk = 0.0022523 k( 273) = ( -0.3833507 0.6166493 -0.0000000), wk = 0.0022523 k( 274) = ( -0.3780484 0.6219516 0.0000000), wk = 0.0022523 k( 275) = ( -0.3727462 0.6272538 0.0000000), wk = 0.0022523 k( 276) = ( -0.3674440 0.6325560 0.0000000), wk = 0.0022523 k( 277) = ( -0.3621417 0.6378583 0.0000000), wk = 0.0022523 k( 278) = ( -0.3568395 0.6431605 -0.0000000), wk = 0.0022523 k( 279) = ( -0.3515372 0.6484628 0.0000000), wk = 0.0022523 k( 280) = ( -0.3462350 0.6537650 0.0000000), wk = 0.0022523 k( 281) = ( -0.3409327 0.6590673 0.0000000), wk = 0.0022523 k( 282) = ( -0.3356305 0.6643695 -0.0000000), wk = 0.0022523 k( 283) = ( -0.3303283 0.6696717 0.0000000), wk = 0.0022523 k( 284) = ( -0.3250260 0.6749740 -0.0000000), wk = 0.0022523 k( 285) = ( -0.3197238 0.6802762 0.0000000), wk = 0.0022523 k( 286) = ( -0.3144215 0.6855785 0.0000000), wk = 0.0022523 k( 287) = ( -0.3091193 0.6908807 0.0000000), wk = 0.0022523 k( 288) = ( -0.3038170 0.6961829 0.0000000), wk = 0.0022523 k( 289) = ( -0.2985148 0.7014852 0.0000000), wk = 0.0022523 k( 290) = ( -0.2932126 0.7067874 0.0000000), wk = 0.0022523 k( 291) = ( -0.2879103 0.7120897 0.0000000), wk = 0.0022523 k( 292) = ( -0.2826081 0.7173919 -0.0000000), wk = 0.0022523 k( 293) = ( -0.2773058 0.7226942 0.0000000), wk = 0.0022523 k( 294) = ( -0.2773058 0.7226942 0.0000000), wk = 0.0022523 k( 295) = ( -0.2773058 0.7226942 0.0135135), wk = 0.0022523 k( 296) = ( -0.2773058 0.7226942 0.0270270), wk = 0.0022523 k( 297) = ( -0.2773058 0.7226942 0.0405405), wk = 0.0022523 k( 298) = ( -0.2773058 0.7226942 0.0540540), wk = 0.0022523 k( 299) = ( -0.2773058 0.7226942 0.0675676), wk = 0.0022523 k( 300) = ( -0.2773058 0.7226942 0.0810811), wk = 0.0022523 k( 301) = ( -0.2773058 0.7226942 0.0945946), wk = 0.0022523 k( 302) = ( -0.2773058 0.7226942 0.1081081), wk = 0.0022523 k( 303) = ( -0.2773058 0.7226942 0.1216216), wk = 0.0022523 k( 304) = ( -0.2773058 0.7226942 0.1351351), wk = 0.0022523 k( 305) = ( -0.2773058 0.7226942 0.1486486), wk = 0.0022523 k( 306) = ( -0.2773058 0.7226942 0.1621622), wk = 0.0022523 k( 307) = ( -0.2773058 0.7226942 0.1756757), wk = 0.0022523 k( 308) = ( -0.2773058 0.7226942 0.1891892), wk = 0.0022523 k( 309) = ( -0.2773058 0.7226942 0.2027027), wk = 0.0022523 k( 310) = ( -0.2773058 0.7226942 0.2162162), wk = 0.0022523 k( 311) = ( -0.2773058 0.7226942 0.2297297), wk = 0.0022523 k( 312) = ( -0.2773058 0.7226942 0.2432432), wk = 0.0022523 k( 313) = ( -0.2773058 0.7226942 0.2567568), wk = 0.0022523 k( 314) = ( -0.2773058 0.7226942 0.2702703), wk = 0.0022523 k( 315) = ( -0.2773058 0.7226942 0.2837838), wk = 0.0022523 k( 316) = ( -0.2773058 0.7226942 0.2972973), wk = 0.0022523 k( 317) = ( -0.2773058 0.7226942 0.3108108), wk = 0.0022523 k( 318) = ( -0.2773058 0.7226942 0.3243243), wk = 0.0022523 k( 319) = ( -0.2773058 0.7226942 0.3378378), wk = 0.0022523 k( 320) = ( -0.2773058 0.7226942 0.3513513), wk = 0.0022523 k( 321) = ( -0.2773058 0.7226942 0.3648649), wk = 0.0022523 k( 322) = ( -0.2773058 0.7226942 0.3783784), wk = 0.0022523 k( 323) = ( -0.2773058 0.7226942 0.3918919), wk = 0.0022523 k( 324) = ( -0.2773058 0.7226942 0.4054054), wk = 0.0022523 k( 325) = ( -0.2773058 0.7226942 0.4189189), wk = 0.0022523 k( 326) = ( -0.2773058 0.7226942 0.4324324), wk = 0.0022523 k( 327) = ( -0.2773058 0.7226942 0.4459459), wk = 0.0022523 k( 328) = ( -0.2773058 0.7226942 0.4594595), wk = 0.0022523 k( 329) = ( -0.2773058 0.7226942 0.4729730), wk = 0.0022523 k( 330) = ( -0.2773058 0.7226942 0.4864865), wk = 0.0022523 k( 331) = ( -0.2773058 0.7226942 0.5000000), wk = 0.0022523 k( 332) = ( -0.2773058 0.7226942 0.5000000), wk = 0.0022523 k( 333) = ( -0.2826081 0.7173919 0.5000000), wk = 0.0022523 k( 334) = ( -0.2879103 0.7120897 0.5000000), wk = 0.0022523 k( 335) = ( -0.2932126 0.7067874 0.5000000), wk = 0.0022523 k( 336) = ( -0.2985148 0.7014852 0.5000000), wk = 0.0022523 k( 337) = ( -0.3038170 0.6961829 0.5000000), wk = 0.0022523 k( 338) = ( -0.3091193 0.6908807 0.5000000), wk = 0.0022523 k( 339) = ( -0.3144215 0.6855785 0.5000000), wk = 0.0022523 k( 340) = ( -0.3197238 0.6802762 0.5000000), wk = 0.0022523 k( 341) = ( -0.3250260 0.6749740 0.5000000), wk = 0.0022523 k( 342) = ( -0.3303283 0.6696717 0.5000000), wk = 0.0022523 k( 343) = ( -0.3356305 0.6643695 0.5000000), wk = 0.0022523 k( 344) = ( -0.3409327 0.6590673 0.5000000), wk = 0.0022523 k( 345) = ( -0.3462350 0.6537650 0.5000000), wk = 0.0022523 k( 346) = ( -0.3515372 0.6484628 0.5000000), wk = 0.0022523 k( 347) = ( -0.3568395 0.6431605 0.5000000), wk = 0.0022523 k( 348) = ( -0.3621417 0.6378583 0.5000000), wk = 0.0022523 k( 349) = ( -0.3674440 0.6325560 0.5000000), wk = 0.0022523 k( 350) = ( -0.3727462 0.6272538 0.5000000), wk = 0.0022523 k( 351) = ( -0.3780484 0.6219516 0.5000000), wk = 0.0022523 k( 352) = ( -0.3833507 0.6166493 0.5000000), wk = 0.0022523 k( 353) = ( -0.3886529 0.6113471 0.5000000), wk = 0.0022523 k( 354) = ( -0.3939552 0.6060448 0.5000000), wk = 0.0022523 k( 355) = ( -0.3992574 0.6007426 0.5000000), wk = 0.0022523 k( 356) = ( -0.4045596 0.5954403 0.5000000), wk = 0.0022523 k( 357) = ( -0.4098619 0.5901381 0.5000000), wk = 0.0022523 k( 358) = ( -0.4151641 0.5848359 0.5000000), wk = 0.0022523 k( 359) = ( -0.4204664 0.5795336 0.5000000), wk = 0.0022523 k( 360) = ( -0.4257686 0.5742314 0.5000000), wk = 0.0022523 k( 361) = ( -0.4310709 0.5689291 0.5000000), wk = 0.0022523 k( 362) = ( -0.4363731 0.5636269 0.5000000), wk = 0.0022523 k( 363) = ( -0.4416753 0.5583247 0.5000000), wk = 0.0022523 k( 364) = ( -0.4469776 0.5530224 0.5000000), wk = 0.0022523 k( 365) = ( -0.4522798 0.5477202 0.5000000), wk = 0.0022523 k( 366) = ( -0.4575821 0.5424179 0.5000000), wk = 0.0022523 k( 367) = ( -0.4628843 0.5371157 0.5000000), wk = 0.0022523 k( 368) = ( -0.4681865 0.5318135 0.5000000), wk = 0.0022523 k( 369) = ( -0.4734888 0.5265112 0.5000000), wk = 0.0022523 k( 370) = ( -0.4787910 0.5212090 0.5000000), wk = 0.0022523 k( 371) = ( -0.4840933 0.5159067 0.5000000), wk = 0.0022523 k( 372) = ( -0.4893955 0.5106045 0.5000000), wk = 0.0022523 k( 373) = ( -0.4946978 0.5053022 0.5000000), wk = 0.0022523 k( 374) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022523 k( 375) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022523 k( 376) = ( -0.5000000 0.5000000 0.4864865), wk = 0.0022523 k( 377) = ( -0.5000000 0.5000000 0.4729730), wk = 0.0022523 k( 378) = ( -0.5000000 0.5000000 0.4594595), wk = 0.0022523 k( 379) = ( -0.5000000 0.5000000 0.4459459), wk = 0.0022523 k( 380) = ( -0.5000000 0.5000000 0.4324324), wk = 0.0022523 k( 381) = ( -0.5000000 0.5000000 0.4189189), wk = 0.0022523 k( 382) = ( -0.5000000 0.5000000 0.4054054), wk = 0.0022523 k( 383) = ( -0.5000000 0.5000000 0.3918919), wk = 0.0022523 k( 384) = ( -0.5000000 0.5000000 0.3783784), wk = 0.0022523 k( 385) = ( -0.5000000 0.5000000 0.3648649), wk = 0.0022523 k( 386) = ( -0.5000000 0.5000000 0.3513513), wk = 0.0022523 k( 387) = ( -0.5000000 0.5000000 0.3378378), wk = 0.0022523 k( 388) = ( -0.5000000 0.5000000 0.3243243), wk = 0.0022523 k( 389) = ( -0.5000000 0.5000000 0.3108108), wk = 0.0022523 k( 390) = ( -0.5000000 0.5000000 0.2972973), wk = 0.0022523 k( 391) = ( -0.5000000 0.5000000 0.2837838), wk = 0.0022523 k( 392) = ( -0.5000000 0.5000000 0.2702703), wk = 0.0022523 k( 393) = ( -0.5000000 0.5000000 0.2567568), wk = 0.0022523 k( 394) = ( -0.5000000 0.5000000 0.2432432), wk = 0.0022523 k( 395) = ( -0.5000000 0.5000000 0.2297297), wk = 0.0022523 k( 396) = ( -0.5000000 0.5000000 0.2162162), wk = 0.0022523 k( 397) = ( -0.5000000 0.5000000 0.2027027), wk = 0.0022523 k( 398) = ( -0.5000000 0.5000000 0.1891892), wk = 0.0022523 k( 399) = ( -0.5000000 0.5000000 0.1756757), wk = 0.0022523 k( 400) = ( -0.5000000 0.5000000 0.1621622), wk = 0.0022523 k( 401) = ( -0.5000000 0.5000000 0.1486486), wk = 0.0022523 k( 402) = ( -0.5000000 0.5000000 0.1351351), wk = 0.0022523 k( 403) = ( -0.5000000 0.5000000 0.1216216), wk = 0.0022523 k( 404) = ( -0.5000000 0.5000000 0.1081081), wk = 0.0022523 k( 405) = ( -0.5000000 0.5000000 0.0945946), wk = 0.0022523 k( 406) = ( -0.5000000 0.5000000 0.0810811), wk = 0.0022523 k( 407) = ( -0.5000000 0.5000000 0.0675676), wk = 0.0022523 k( 408) = ( -0.5000000 0.5000000 0.0540540), wk = 0.0022523 k( 409) = ( -0.5000000 0.5000000 0.0405405), wk = 0.0022523 k( 410) = ( -0.5000000 0.5000000 0.0270270), wk = 0.0022523 k( 411) = ( -0.5000000 0.5000000 0.0135135), wk = 0.0022523 k( 412) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022523 k( 413) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022523 k( 414) = ( -0.0161290 0.0161290 0.5000000), wk = 0.0022523 k( 415) = ( -0.0322581 0.0322581 0.5000000), wk = 0.0022523 k( 416) = ( -0.0483871 0.0483871 0.5000000), wk = 0.0022523 k( 417) = ( -0.0645161 0.0645161 0.5000000), wk = 0.0022523 k( 418) = ( -0.0806452 0.0806452 0.5000000), wk = 0.0022523 k( 419) = ( -0.0967742 0.0967742 0.5000000), wk = 0.0022523 k( 420) = ( -0.1129032 0.1129032 0.5000000), wk = 0.0022523 k( 421) = ( -0.1290323 0.1290323 0.5000000), wk = 0.0022523 k( 422) = ( -0.1451613 0.1451613 0.5000000), wk = 0.0022523 k( 423) = ( -0.1612903 0.1612903 0.5000000), wk = 0.0022523 k( 424) = ( -0.1774194 0.1774194 0.5000000), wk = 0.0022523 k( 425) = ( -0.1935484 0.1935484 0.5000000), wk = 0.0022523 k( 426) = ( -0.2096774 0.2096774 0.5000000), wk = 0.0022523 k( 427) = ( -0.2258064 0.2258064 0.5000000), wk = 0.0022523 k( 428) = ( -0.2419355 0.2419355 0.5000000), wk = 0.0022523 k( 429) = ( -0.2580645 0.2580645 0.5000000), wk = 0.0022523 k( 430) = ( -0.2741936 0.2741936 0.5000000), wk = 0.0022523 k( 431) = ( -0.2903226 0.2903226 0.5000000), wk = 0.0022523 k( 432) = ( -0.3064516 0.3064516 0.5000000), wk = 0.0022523 k( 433) = ( -0.3225807 0.3225807 0.5000000), wk = 0.0022523 k( 434) = ( -0.3387097 0.3387097 0.5000000), wk = 0.0022523 k( 435) = ( -0.3548387 0.3548387 0.5000000), wk = 0.0022523 k( 436) = ( -0.3709677 0.3709677 0.5000000), wk = 0.0022523 k( 437) = ( -0.3870968 0.3870968 0.5000000), wk = 0.0022523 k( 438) = ( -0.4032258 0.4032258 0.5000000), wk = 0.0022523 k( 439) = ( -0.4193548 0.4193548 0.5000000), wk = 0.0022523 k( 440) = ( -0.4354839 0.4354839 0.5000000), wk = 0.0022523 k( 441) = ( -0.4516129 0.4516129 0.5000000), wk = 0.0022523 k( 442) = ( -0.4677419 0.4677419 0.5000000), wk = 0.0022523 k( 443) = ( -0.4838710 0.4838710 0.5000000), wk = 0.0022523 k( 444) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022523 Dense grid: 77213 G-vectors FFT dimensions: ( 72, 72, 54) Smooth grid: 24241 G-vectors FFT dimensions: ( 48, 48, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 188, 36) NL pseudopotentials 0.14 Mb ( 94, 100) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.02 Mb ( 2147) G-vector shells 0.01 Mb ( 1091) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.41 Mb ( 188, 144) Each subspace H/S matrix 0.02 Mb ( 36, 36) Each matrix 0.11 Mb ( 100, 2, 36) The potential is recalculated from file : ./ZrPt.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.4 secs Computing kpt #: 2 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3.5 secs Computing kpt #: 3 total cpu time spent up to now is 4.3 secs Computing kpt #: 4 total cpu time spent up to now is 5.0 secs Computing kpt #: 5 total cpu time spent up to now is 5.6 secs Computing kpt #: 6 total cpu time spent up to now is 6.2 secs Computing kpt #: 7 total cpu time spent up to now is 6.8 secs Computing kpt #: 8 total cpu time spent up to now is 7.3 secs Computing kpt #: 9 total cpu time spent up to now is 7.9 secs Computing kpt #: 10 total cpu time spent up to now is 8.3 secs Computing kpt #: 11 total cpu time spent up to now is 8.8 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 9.6 secs Computing kpt #: 14 total cpu time spent up to now is 10.1 secs Computing kpt #: 15 total cpu time spent up to now is 10.6 secs Computing kpt #: 16 total cpu time spent up to now is 11.1 secs Computing kpt #: 17 total cpu time spent up to now is 11.7 secs Computing kpt #: 18 total cpu time spent up to now is 12.2 secs Computing kpt #: 19 total cpu time spent up to now is 12.8 secs Computing kpt #: 20 total cpu time spent up to now is 13.4 secs Computing kpt #: 21 total cpu time spent up to now is 13.9 secs Computing kpt #: 22 total cpu time spent up to now is 14.5 secs Computing kpt #: 23 total cpu time spent up to now is 15.3 secs Computing kpt #: 24 total cpu time spent up to now is 15.8 secs Computing kpt #: 25 total cpu time spent up to now is 16.3 secs Computing kpt #: 26 total cpu time spent up to now is 16.8 secs Computing kpt #: 27 total cpu time spent up to now is 17.2 secs Computing kpt #: 28 total cpu time spent up to now is 17.7 secs Computing kpt #: 29 total cpu time spent up to now is 18.1 secs Computing kpt #: 30 total cpu time spent up to now is 18.6 secs Computing kpt #: 31 total cpu time spent up to now is 19.0 secs Computing kpt #: 32 total cpu time spent up to now is 19.5 secs Computing kpt #: 33 total cpu time spent up to now is 19.9 secs Computing kpt #: 34 total cpu time spent up to now is 20.4 secs Computing kpt #: 35 total cpu time spent up to now is 20.8 secs Computing kpt #: 36 total cpu time spent up to now is 21.3 secs Computing kpt #: 37 total cpu time spent up to now is 21.8 secs Computing kpt #: 38 total cpu time spent up to now is 22.2 secs Computing kpt #: 39 total cpu time spent up to now is 22.6 secs Computing kpt #: 40 total cpu time spent up to now is 23.1 secs Computing kpt #: 41 total cpu time spent up to now is 23.5 secs Computing kpt #: 42 total cpu time spent up to now is 24.0 secs Computing kpt #: 43 total cpu time spent up to now is 24.4 secs Computing kpt #: 44 total cpu time spent up to now is 24.9 secs Computing kpt #: 45 total cpu time spent up to now is 25.3 secs Computing kpt #: 46 total cpu time spent up to now is 25.8 secs Computing kpt #: 47 total cpu time spent up to now is 26.3 secs Computing kpt #: 48 total cpu time spent up to now is 26.7 secs Computing kpt #: 49 total cpu time spent up to now is 27.2 secs Computing kpt #: 50 total cpu time spent up to now is 27.7 secs Computing kpt #: 51 total cpu time spent up to now is 28.2 secs Computing kpt #: 52 total cpu time spent up to now is 28.7 secs Computing kpt #: 53 total cpu time spent up to now is 29.2 secs Computing kpt #: 54 total cpu time spent up to now is 29.8 secs Computing kpt #: 55 total cpu time spent up to now is 30.3 secs Computing kpt #: 56 total cpu time spent up to now is 30.8 secs Computing kpt #: 57 total cpu time spent up to now is 31.3 secs Computing kpt #: 58 total cpu time spent up to now is 31.8 secs Computing kpt #: 59 total cpu time spent up to now is 32.4 secs Computing kpt #: 60 total cpu time spent up to now is 32.9 secs Computing kpt #: 61 total cpu time spent up to now is 33.5 secs Computing kpt #: 62 total cpu time spent up to now is 34.0 secs Computing kpt #: 63 total cpu time spent up to now is 34.6 secs Computing kpt #: 64 total cpu time spent up to now is 35.2 secs Computing kpt #: 65 total cpu time spent up to now is 35.8 secs Computing kpt #: 66 total cpu time spent up to now is 36.4 secs Computing kpt #: 67 total cpu time spent up to now is 37.0 secs Computing kpt #: 68 total cpu time spent up to now is 37.7 secs Computing kpt #: 69 total cpu time spent up to now is 38.3 secs Computing kpt #: 70 total cpu time spent up to now is 39.0 secs Computing kpt #: 71 total cpu time spent up to now is 39.6 secs Computing kpt #: 72 total cpu time spent up to now is 40.3 secs Computing kpt #: 73 total cpu time spent up to now is 40.9 secs Computing kpt #: 74 total cpu time spent up to now is 41.5 secs Computing kpt #: 75 total cpu time spent up to now is 42.2 secs Computing kpt #: 76 total cpu time spent up to now is 42.8 secs Computing kpt #: 77 total cpu time spent up to now is 43.3 secs Computing kpt #: 78 total cpu time spent up to now is 43.8 secs Computing kpt #: 79 total cpu time spent up to now is 44.3 secs Computing kpt #: 80 total cpu time spent up to now is 44.8 secs Computing kpt #: 81 total cpu time spent up to now is 45.3 secs Computing kpt #: 82 total cpu time spent up to now is 45.7 secs Computing kpt #: 83 total cpu time spent up to now is 46.1 secs Computing kpt #: 84 total cpu time spent up to now is 46.6 secs Computing kpt #: 85 total cpu time spent up to now is 47.0 secs Computing kpt #: 86 total cpu time spent up to now is 47.4 secs Computing kpt #: 87 total cpu time spent up to now is 47.9 secs Computing kpt #: 88 total cpu time spent up to now is 48.3 secs Computing kpt #: 89 total cpu time spent up to now is 48.7 secs Computing kpt #: 90 total cpu time spent up to now is 49.1 secs Computing kpt #: 91 total cpu time spent up to now is 49.6 secs Computing kpt #: 92 total cpu time spent up to now is 50.0 secs Computing kpt #: 93 total cpu time spent up to now is 50.4 secs Computing kpt #: 94 total cpu time spent up to now is 50.7 secs Computing kpt #: 95 total cpu time spent up to now is 51.1 secs Computing kpt #: 96 total cpu time spent up to now is 51.5 secs Computing kpt #: 97 total cpu time spent up to now is 51.9 secs Computing kpt #: 98 total cpu time spent up to now is 52.3 secs Computing kpt #: 99 total cpu time spent up to now is 52.6 secs Computing kpt #: 100 total cpu time spent up to now is 53.0 secs Computing kpt #: 101 total cpu time spent up to now is 53.4 secs Computing kpt #: 102 total cpu time spent up to now is 53.8 secs Computing kpt #: 103 total cpu time spent up to now is 54.1 secs Computing kpt #: 104 total cpu time spent up to now is 54.5 secs Computing kpt #: 105 total cpu time spent up to now is 54.9 secs Computing kpt #: 106 total cpu time spent up to now is 55.2 secs Computing kpt #: 107 total cpu time spent up to now is 55.6 secs Computing kpt #: 108 total cpu time spent up to now is 55.9 secs Computing kpt #: 109 total cpu time spent up to now is 56.3 secs Computing kpt #: 110 total cpu time spent up to now is 56.7 secs Computing kpt #: 111 total cpu time spent up to now is 57.0 secs Computing kpt #: 112 total cpu time spent up to now is 57.4 secs Computing kpt #: 113 total cpu time spent up to now is 57.8 secs Computing kpt #: 114 total cpu time spent up to now is 58.1 secs Computing kpt #: 115 total cpu time spent up to now is 58.5 secs Computing kpt #: 116 total cpu time spent up to now is 58.9 secs Computing kpt #: 117 total cpu time spent up to now is 59.2 secs Computing kpt #: 118 total cpu time spent up to now is 59.6 secs Computing kpt #: 119 total cpu time spent up to now is 60.0 secs Computing kpt #: 120 total cpu time spent up to now is 60.3 secs Computing kpt #: 121 total cpu time spent up to now is 60.7 secs Computing kpt #: 122 total cpu time spent up to now is 61.1 secs Computing kpt #: 123 total cpu time spent up to now is 61.4 secs Computing kpt #: 124 total cpu time spent up to now is 61.8 secs Computing kpt #: 125 total cpu time spent up to now is 62.2 secs Computing kpt #: 126 total cpu time spent up to now is 62.5 secs Computing kpt #: 127 total cpu time spent up to now is 62.9 secs Computing kpt #: 128 total cpu time spent up to now is 63.3 secs Computing kpt #: 129 total cpu time spent up to now is 63.7 secs Computing kpt #: 130 total cpu time spent up to now is 64.0 secs Computing kpt #: 131 total cpu time spent up to now is 64.4 secs Computing kpt #: 132 total cpu time spent up to now is 64.8 secs Computing kpt #: 133 total cpu time spent up to now is 65.1 secs Computing kpt #: 134 total cpu time spent up to now is 65.5 secs Computing kpt #: 135 total cpu time spent up to now is 65.9 secs Computing kpt #: 136 total cpu time spent up to now is 66.3 secs Computing kpt #: 137 total cpu time spent up to now is 66.7 secs Computing kpt #: 138 total cpu time spent up to now is 67.1 secs Computing kpt #: 139 total cpu time spent up to now is 67.5 secs Computing kpt #: 140 total cpu time spent up to now is 68.0 secs Computing kpt #: 141 total cpu time spent up to now is 68.4 secs Computing kpt #: 142 total cpu time spent up to now is 68.8 secs Computing kpt #: 143 total cpu time spent up to now is 69.3 secs Computing kpt #: 144 total cpu time spent up to now is 69.7 secs Computing kpt #: 145 total cpu time spent up to now is 70.1 secs Computing kpt #: 146 total cpu time spent up to now is 70.5 secs Computing kpt #: 147 total cpu time spent up to now is 71.0 secs Computing kpt #: 148 total cpu time spent up to now is 71.4 secs Computing kpt #: 149 total cpu time spent up to now is 71.8 secs Computing kpt #: 150 total cpu time spent up to now is 72.2 secs Computing kpt #: 151 total cpu time spent up to now is 72.6 secs Computing kpt #: 152 total cpu time spent up to now is 73.0 secs Computing kpt #: 153 total cpu time spent up to now is 73.4 secs Computing kpt #: 154 total cpu time spent up to now is 73.7 secs Computing kpt #: 155 total cpu time spent up to now is 74.1 secs Computing kpt #: 156 total cpu time spent up to now is 74.5 secs Computing kpt #: 157 total cpu time spent up to now is 74.9 secs Computing kpt #: 158 total cpu time spent up to now is 75.2 secs Computing kpt #: 159 total cpu time spent up to now is 75.6 secs Computing kpt #: 160 total cpu time spent up to now is 76.0 secs Computing kpt #: 161 total cpu time spent up to now is 76.4 secs Computing kpt #: 162 total cpu time spent up to now is 76.7 secs Computing kpt #: 163 total cpu time spent up to now is 77.1 secs Computing kpt #: 164 total cpu time spent up to now is 77.5 secs Computing kpt #: 165 total cpu time spent up to now is 77.9 secs Computing kpt #: 166 total cpu time spent up to now is 78.2 secs Computing kpt #: 167 total cpu time spent up to now is 78.6 secs Computing kpt #: 168 total cpu time spent up to now is 79.0 secs Computing kpt #: 169 total cpu time spent up to now is 79.4 secs Computing kpt #: 170 total cpu time spent up to now is 79.7 secs Computing kpt #: 171 total cpu time spent up to now is 80.1 secs Computing kpt #: 172 total cpu time spent up to now is 80.5 secs Computing kpt #: 173 total cpu time spent up to now is 80.9 secs Computing kpt #: 174 total cpu time spent up to now is 81.3 secs Computing kpt #: 175 total cpu time spent up to now is 81.6 secs Computing kpt #: 176 total cpu time spent up to now is 82.0 secs Computing kpt #: 177 total cpu time spent up to now is 82.4 secs Computing kpt #: 178 total cpu time spent up to now is 82.8 secs Computing kpt #: 179 total cpu time spent up to now is 83.1 secs Computing kpt #: 180 total cpu time spent up to now is 83.5 secs Computing kpt #: 181 total cpu time spent up to now is 83.9 secs Computing kpt #: 182 total cpu time spent up to now is 84.3 secs Computing kpt #: 183 total cpu time spent up to now is 84.7 secs Computing kpt #: 184 total cpu time spent up to now is 85.0 secs Computing kpt #: 185 total cpu time spent up to now is 85.5 secs Computing kpt #: 186 total cpu time spent up to now is 85.9 secs Computing kpt #: 187 total cpu time spent up to now is 86.3 secs Computing kpt #: 188 total cpu time spent up to now is 86.8 secs Computing kpt #: 189 total cpu time spent up to now is 87.2 secs Computing kpt #: 190 total cpu time spent up to now is 87.7 secs Computing kpt #: 191 total cpu time spent up to now is 88.1 secs Computing kpt #: 192 total cpu time spent up to now is 88.6 secs Computing kpt #: 193 total cpu time spent up to now is 89.0 secs Computing kpt #: 194 total cpu time spent up to now is 89.5 secs Computing kpt #: 195 total cpu time spent up to now is 89.9 secs Computing kpt #: 196 total cpu time spent up to now is 90.4 secs Computing kpt #: 197 total cpu time spent up to now is 90.8 secs Computing kpt #: 198 total cpu time spent up to now is 91.3 secs Computing kpt #: 199 total cpu time spent up to now is 91.7 secs Computing kpt #: 200 total cpu time spent up to now is 92.2 secs Computing kpt #: 201 total cpu time spent up to now is 92.6 secs Computing kpt #: 202 total cpu time spent up to now is 93.0 secs Computing kpt #: 203 total cpu time spent up to now is 93.4 secs Computing kpt #: 204 total cpu time spent up to now is 93.9 secs Computing kpt #: 205 total cpu time spent up to now is 94.3 secs Computing kpt #: 206 total cpu time spent up to now is 94.8 secs Computing kpt #: 207 total cpu time spent up to now is 95.3 secs Computing kpt #: 208 total cpu time spent up to now is 95.7 secs Computing kpt #: 209 total cpu time spent up to now is 96.2 secs Computing kpt #: 210 total cpu time spent up to now is 96.7 secs Computing kpt #: 211 total cpu time spent up to now is 97.2 secs Computing kpt #: 212 total cpu time spent up to now is 97.7 secs Computing kpt #: 213 total cpu time spent up to now is 98.2 secs Computing kpt #: 214 total cpu time spent up to now is 98.8 secs Computing kpt #: 215 total cpu time spent up to now is 99.4 secs Computing kpt #: 216 total cpu time spent up to now is 100.2 secs Computing kpt #: 217 total cpu time spent up to now is 101.1 secs Computing kpt #: 218 total cpu time spent up to now is 101.5 secs Computing kpt #: 219 total cpu time spent up to now is 101.9 secs Computing kpt #: 220 total cpu time spent up to now is 102.8 secs Computing kpt #: 221 total cpu time spent up to now is 103.7 secs Computing kpt #: 222 total cpu time spent up to now is 104.3 secs Computing kpt #: 223 total cpu time spent up to now is 105.0 secs Computing kpt #: 224 total cpu time spent up to now is 105.7 secs Computing kpt #: 225 total cpu time spent up to now is 106.4 secs Computing kpt #: 226 total cpu time spent up to now is 107.0 secs Computing kpt #: 227 total cpu time spent up to now is 107.5 secs Computing kpt #: 228 total cpu time spent up to now is 108.0 secs Computing kpt #: 229 total cpu time spent up to now is 108.5 secs Computing kpt #: 230 total cpu time spent up to now is 109.0 secs Computing kpt #: 231 total cpu time spent up to now is 109.6 secs Computing kpt #: 232 total cpu time spent up to now is 110.1 secs Computing kpt #: 233 total cpu time spent up to now is 110.7 secs Computing kpt #: 234 total cpu time spent up to now is 111.3 secs Computing kpt #: 235 total cpu time spent up to now is 111.8 secs Computing kpt #: 236 total cpu time spent up to now is 112.3 secs Computing kpt #: 237 total cpu time spent up to now is 112.9 secs Computing kpt #: 238 total cpu time spent up to now is 113.6 secs Computing kpt #: 239 total cpu time spent up to now is 114.3 secs Computing kpt #: 240 total cpu time spent up to now is 114.9 secs Computing kpt #: 241 total cpu time spent up to now is 115.5 secs Computing kpt #: 242 total cpu time spent up to now is 116.0 secs Computing kpt #: 243 total cpu time spent up to now is 116.4 secs Computing kpt #: 244 total cpu time spent up to now is 116.9 secs Computing kpt #: 245 total cpu time spent up to now is 117.4 secs Computing kpt #: 246 total cpu time spent up to now is 117.8 secs Computing kpt #: 247 total cpu time spent up to now is 118.2 secs Computing kpt #: 248 total cpu time spent up to now is 118.6 secs Computing kpt #: 249 total cpu time spent up to now is 119.0 secs Computing kpt #: 250 total cpu time spent up to now is 119.4 secs Computing kpt #: 251 total cpu time spent up to now is 119.8 secs Computing kpt #: 252 total cpu time spent up to now is 120.3 secs Computing kpt #: 253 total cpu time spent up to now is 120.7 secs Computing kpt #: 254 total cpu time spent up to now is 121.0 secs Computing kpt #: 255 total cpu time spent up to now is 121.4 secs Computing kpt #: 256 total cpu time spent up to now is 121.8 secs Computing kpt #: 257 total cpu time spent up to now is 122.3 secs Computing kpt #: 258 total cpu time spent up to now is 122.7 secs Computing kpt #: 259 total cpu time spent up to now is 123.1 secs Computing kpt #: 260 total cpu time spent up to now is 123.5 secs Computing kpt #: 261 total cpu time spent up to now is 124.0 secs Computing kpt #: 262 total cpu time spent up to now is 124.5 secs Computing kpt #: 263 total cpu time spent up to now is 124.9 secs Computing kpt #: 264 total cpu time spent up to now is 125.4 secs Computing kpt #: 265 total cpu time spent up to now is 125.9 secs Computing kpt #: 266 total cpu time spent up to now is 126.4 secs Computing kpt #: 267 total cpu time spent up to now is 126.9 secs Computing kpt #: 268 total cpu time spent up to now is 127.4 secs Computing kpt #: 269 total cpu time spent up to now is 127.9 secs Computing kpt #: 270 total cpu time spent up to now is 128.4 secs Computing kpt #: 271 total cpu time spent up to now is 128.9 secs Computing kpt #: 272 total cpu time spent up to now is 129.5 secs Computing kpt #: 273 total cpu time spent up to now is 130.1 secs Computing kpt #: 274 total cpu time spent up to now is 130.6 secs Computing kpt #: 275 total cpu time spent up to now is 131.2 secs Computing kpt #: 276 total cpu time spent up to now is 131.9 secs Computing kpt #: 277 total cpu time spent up to now is 132.5 secs Computing kpt #: 278 total cpu time spent up to now is 133.2 secs Computing kpt #: 279 total cpu time spent up to now is 133.8 secs Computing kpt #: 280 total cpu time spent up to now is 134.5 secs Computing kpt #: 281 total cpu time spent up to now is 135.1 secs Computing kpt #: 282 total cpu time spent up to now is 135.7 secs Computing kpt #: 283 total cpu time spent up to now is 136.3 secs Computing kpt #: 284 total cpu time spent up to now is 136.8 secs Computing kpt #: 285 total cpu time spent up to now is 137.4 secs Computing kpt #: 286 total cpu time spent up to now is 137.9 secs Computing kpt #: 287 total cpu time spent up to now is 138.5 secs Computing kpt #: 288 total cpu time spent up to now is 139.0 secs Computing kpt #: 289 total cpu time spent up to now is 139.6 secs Computing kpt #: 290 total cpu time spent up to now is 140.4 secs Computing kpt #: 291 total cpu time spent up to now is 141.6 secs Computing kpt #: 292 total cpu time spent up to now is 142.2 secs Computing kpt #: 293 total cpu time spent up to now is 142.7 secs Computing kpt #: 294 total cpu time spent up to now is 143.3 secs Computing kpt #: 295 total cpu time spent up to now is 143.8 secs Computing kpt #: 296 total cpu time spent up to now is 144.3 secs Computing kpt #: 297 total cpu time spent up to now is 144.8 secs Computing kpt #: 298 total cpu time spent up to now is 145.3 secs Computing kpt #: 299 total cpu time spent up to now is 145.9 secs Computing kpt #: 300 total cpu time spent up to now is 146.4 secs Computing kpt #: 301 total cpu time spent up to now is 146.9 secs Computing kpt #: 302 total cpu time spent up to now is 147.4 secs Computing kpt #: 303 total cpu time spent up to now is 147.9 secs Computing kpt #: 304 total cpu time spent up to now is 148.4 secs Computing kpt #: 305 total cpu time spent up to now is 148.9 secs Computing kpt #: 306 total cpu time spent up to now is 149.4 secs Computing kpt #: 307 total cpu time spent up to now is 149.9 secs Computing kpt #: 308 total cpu time spent up to now is 150.4 secs Computing kpt #: 309 total cpu time spent up to now is 150.9 secs Computing kpt #: 310 total cpu time spent up to now is 151.4 secs Computing kpt #: 311 total cpu time spent up to now is 151.8 secs Computing kpt #: 312 total cpu time spent up to now is 152.3 secs Computing kpt #: 313 total cpu time spent up to now is 152.8 secs Computing kpt #: 314 total cpu time spent up to now is 153.2 secs Computing kpt #: 315 total cpu time spent up to now is 153.7 secs Computing kpt #: 316 total cpu time spent up to now is 154.2 secs Computing kpt #: 317 total cpu time spent up to now is 154.6 secs Computing kpt #: 318 total cpu time spent up to now is 155.1 secs Computing kpt #: 319 total cpu time spent up to now is 155.5 secs Computing kpt #: 320 total cpu time spent up to now is 156.0 secs Computing kpt #: 321 total cpu time spent up to now is 156.4 secs Computing kpt #: 322 total cpu time spent up to now is 156.9 secs Computing kpt #: 323 total cpu time spent up to now is 157.3 secs Computing kpt #: 324 total cpu time spent up to now is 157.7 secs Computing kpt #: 325 total cpu time spent up to now is 158.1 secs Computing kpt #: 326 total cpu time spent up to now is 158.5 secs Computing kpt #: 327 total cpu time spent up to now is 158.9 secs Computing kpt #: 328 total cpu time spent up to now is 159.3 secs Computing kpt #: 329 total cpu time spent up to now is 159.6 secs Computing kpt #: 330 total cpu time spent up to now is 160.0 secs Computing kpt #: 331 total cpu time spent up to now is 160.4 secs Computing kpt #: 332 total cpu time spent up to now is 160.8 secs Computing kpt #: 333 total cpu time spent up to now is 161.1 secs Computing kpt #: 334 total cpu time spent up to now is 161.5 secs Computing kpt #: 335 total cpu time spent up to now is 161.9 secs Computing kpt #: 336 total cpu time spent up to now is 162.3 secs Computing kpt #: 337 total cpu time spent up to now is 162.8 secs Computing kpt #: 338 total cpu time spent up to now is 163.2 secs Computing kpt #: 339 total cpu time spent up to now is 163.6 secs Computing kpt #: 340 total cpu time spent up to now is 164.1 secs Computing kpt #: 341 total cpu time spent up to now is 164.6 secs Computing kpt #: 342 total cpu time spent up to now is 165.1 secs Computing kpt #: 343 total cpu time spent up to now is 165.6 secs Computing kpt #: 344 total cpu time spent up to now is 166.2 secs Computing kpt #: 345 total cpu time spent up to now is 166.7 secs Computing kpt #: 346 total cpu time spent up to now is 167.2 secs Computing kpt #: 347 total cpu time spent up to now is 167.8 secs Computing kpt #: 348 total cpu time spent up to now is 168.3 secs Computing kpt #: 349 total cpu time spent up to now is 168.8 secs Computing kpt #: 350 total cpu time spent up to now is 169.4 secs Computing kpt #: 351 total cpu time spent up to now is 169.9 secs Computing kpt #: 352 total cpu time spent up to now is 170.6 secs Computing kpt #: 353 total cpu time spent up to now is 171.2 secs Computing kpt #: 354 total cpu time spent up to now is 171.9 secs Computing kpt #: 355 total cpu time spent up to now is 172.5 secs Computing kpt #: 356 total cpu time spent up to now is 173.1 secs Computing kpt #: 357 total cpu time spent up to now is 173.7 secs Computing kpt #: 358 total cpu time spent up to now is 174.3 secs Computing kpt #: 359 total cpu time spent up to now is 174.8 secs Computing kpt #: 360 total cpu time spent up to now is 175.4 secs Computing kpt #: 361 total cpu time spent up to now is 175.9 secs Computing kpt #: 362 total cpu time spent up to now is 176.4 secs Computing kpt #: 363 total cpu time spent up to now is 176.9 secs Computing kpt #: 364 total cpu time spent up to now is 177.3 secs Computing kpt #: 365 total cpu time spent up to now is 177.8 secs Computing kpt #: 366 total cpu time spent up to now is 178.3 secs Computing kpt #: 367 total cpu time spent up to now is 178.7 secs Computing kpt #: 368 total cpu time spent up to now is 179.1 secs Computing kpt #: 369 total cpu time spent up to now is 179.6 secs Computing kpt #: 370 total cpu time spent up to now is 180.0 secs Computing kpt #: 371 total cpu time spent up to now is 180.4 secs Computing kpt #: 372 total cpu time spent up to now is 180.9 secs Computing kpt #: 373 total cpu time spent up to now is 181.3 secs Computing kpt #: 374 total cpu time spent up to now is 181.7 secs Computing kpt #: 375 total cpu time spent up to now is 182.1 secs Computing kpt #: 376 total cpu time spent up to now is 182.5 secs Computing kpt #: 377 total cpu time spent up to now is 182.8 secs Computing kpt #: 378 total cpu time spent up to now is 183.2 secs Computing kpt #: 379 total cpu time spent up to now is 183.6 secs Computing kpt #: 380 total cpu time spent up to now is 184.1 secs Computing kpt #: 381 total cpu time spent up to now is 184.5 secs Computing kpt #: 382 total cpu time spent up to now is 185.0 secs Computing kpt #: 383 total cpu time spent up to now is 185.4 secs Computing kpt #: 384 total cpu time spent up to now is 186.1 secs Computing kpt #: 385 total cpu time spent up to now is 187.0 secs Computing kpt #: 386 total cpu time spent up to now is 187.9 secs Computing kpt #: 387 total cpu time spent up to now is 188.6 secs Computing kpt #: 388 total cpu time spent up to now is 189.2 secs Computing kpt #: 389 total cpu time spent up to now is 189.8 secs Computing kpt #: 390 total cpu time spent up to now is 190.4 secs Computing kpt #: 391 total cpu time spent up to now is 191.1 secs Computing kpt #: 392 total cpu time spent up to now is 191.7 secs Computing kpt #: 393 total cpu time spent up to now is 192.4 secs Computing kpt #: 394 total cpu time spent up to now is 193.1 secs Computing kpt #: 395 total cpu time spent up to now is 193.7 secs Computing kpt #: 396 total cpu time spent up to now is 194.3 secs Computing kpt #: 397 total cpu time spent up to now is 194.8 secs Computing kpt #: 398 total cpu time spent up to now is 195.3 secs Computing kpt #: 399 total cpu time spent up to now is 195.8 secs Computing kpt #: 400 total cpu time spent up to now is 196.2 secs Computing kpt #: 401 total cpu time spent up to now is 196.7 secs Computing kpt #: 402 total cpu time spent up to now is 197.2 secs Computing kpt #: 403 total cpu time spent up to now is 197.6 secs Computing kpt #: 404 total cpu time spent up to now is 198.1 secs Computing kpt #: 405 total cpu time spent up to now is 198.5 secs Computing kpt #: 406 total cpu time spent up to now is 199.0 secs Computing kpt #: 407 total cpu time spent up to now is 199.4 secs Computing kpt #: 408 total cpu time spent up to now is 199.8 secs Computing kpt #: 409 total cpu time spent up to now is 200.1 secs Computing kpt #: 410 total cpu time spent up to now is 200.6 secs Computing kpt #: 411 total cpu time spent up to now is 201.0 secs Computing kpt #: 412 total cpu time spent up to now is 201.4 secs Computing kpt #: 413 total cpu time spent up to now is 201.8 secs Computing kpt #: 414 total cpu time spent up to now is 202.3 secs Computing kpt #: 415 total cpu time spent up to now is 202.6 secs Computing kpt #: 416 total cpu time spent up to now is 203.0 secs Computing kpt #: 417 total cpu time spent up to now is 203.4 secs Computing kpt #: 418 total cpu time spent up to now is 203.8 secs Computing kpt #: 419 total cpu time spent up to now is 204.2 secs Computing kpt #: 420 total cpu time spent up to now is 204.6 secs Computing kpt #: 421 total cpu time spent up to now is 204.9 secs Computing kpt #: 422 total cpu time spent up to now is 205.3 secs Computing kpt #: 423 total cpu time spent up to now is 205.7 secs Computing kpt #: 424 total cpu time spent up to now is 206.1 secs Computing kpt #: 425 total cpu time spent up to now is 206.4 secs Computing kpt #: 426 total cpu time spent up to now is 206.8 secs Computing kpt #: 427 total cpu time spent up to now is 207.2 secs Computing kpt #: 428 total cpu time spent up to now is 207.6 secs Computing kpt #: 429 total cpu time spent up to now is 208.0 secs Computing kpt #: 430 total cpu time spent up to now is 208.3 secs Computing kpt #: 431 total cpu time spent up to now is 208.7 secs Computing kpt #: 432 total cpu time spent up to now is 209.1 secs Computing kpt #: 433 total cpu time spent up to now is 209.4 secs Computing kpt #: 434 total cpu time spent up to now is 209.9 secs Computing kpt #: 435 total cpu time spent up to now is 210.2 secs Computing kpt #: 436 total cpu time spent up to now is 210.7 secs Computing kpt #: 437 total cpu time spent up to now is 211.1 secs Computing kpt #: 438 total cpu time spent up to now is 211.5 secs Computing kpt #: 439 total cpu time spent up to now is 211.9 secs Computing kpt #: 440 total cpu time spent up to now is 212.2 secs Computing kpt #: 441 total cpu time spent up to now is 212.6 secs Computing kpt #: 442 total cpu time spent up to now is 213.0 secs Computing kpt #: 443 total cpu time spent up to now is 213.5 secs Computing kpt #: 444 total cpu time spent up to now is 213.9 secs ethr = 3.57E-08, avg # of iterations = 30.0 total cpu time spent up to now is 213.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): 4.3895 4.3895 6.7194 6.7194 6.9431 6.9431 7.1579 7.1579 7.1598 7.1598 8.0315 8.0315 8.8888 8.8888 8.9900 8.9900 9.1909 9.1909 10.0035 10.0035 10.0613 10.0613 10.5693 10.5693 11.9667 11.9667 13.5771 13.5771 13.6746 13.6746 14.1565 14.1565 14.2112 14.2112 14.7374 14.7374 k = 0.0053 0.0161-0.0000 ( 3049 PWs) bands (ev): 4.3914 4.3914 6.7205 6.7205 6.9434 6.9434 7.1590 7.1590 7.1614 7.1614 8.0319 8.0319 8.8887 8.8887 8.9887 8.9887 9.1916 9.1916 10.0031 10.0031 10.0608 10.0608 10.5689 10.5689 11.9646 11.9646 13.5767 13.5767 13.6705 13.6705 14.1555 14.1555 14.2157 14.2157 14.7194 14.7194 k = 0.0107 0.0323-0.0000 ( 3037 PWs) bands (ev): 4.3972 4.3972 6.7237 6.7237 6.9442 6.9442 7.1624 7.1624 7.1661 7.1661 8.0331 8.0331 8.8886 8.8886 8.9848 8.9848 9.1937 9.1937 10.0016 10.0016 10.0594 10.0594 10.5677 10.5677 11.9586 11.9586 13.5753 13.5753 13.6589 13.6589 14.1523 14.1523 14.2290 14.2290 14.6921 14.6921 k = 0.0160 0.0484-0.0000 ( 3033 PWs) bands (ev): 4.4069 4.4069 6.7290 6.7290 6.9457 6.9457 7.1681 7.1681 7.1739 7.1739 8.0350 8.0350 8.8882 8.8882 8.9785 8.9785 9.1970 9.1970 9.9992 9.9992 10.0573 10.0573 10.5658 10.5658 11.9487 11.9487 13.5722 13.5722 13.6417 13.6417 14.1473 14.1473 14.2501 14.2501 14.6521 14.6521 k = 0.0213 0.0645-0.0000 ( 3033 PWs) bands (ev): 4.4204 4.4204 6.7363 6.7363 6.9478 6.9478 7.1760 7.1760 7.1849 7.1849 8.0377 8.0377 8.8873 8.8873 8.9704 8.9704 9.2011 9.2011 9.9956 9.9956 10.0546 10.0546 10.5630 10.5630 11.9351 11.9351 13.5657 13.5657 13.6222 13.6222 14.1411 14.1411 14.2770 14.2770 14.6007 14.6007 k = 0.0267 0.0807-0.0000 ( 3033 PWs) bands (ev): 4.4377 4.4377 6.7455 6.7455 6.9505 6.9505 7.1862 7.1862 7.1989 7.1989 8.0412 8.0412 8.8857 8.8857 8.9612 8.9612 9.2060 9.2060 9.9907 9.9907 10.0516 10.0516 10.5595 10.5595 11.9179 11.9179 13.5520 13.5520 13.6056 13.6056 14.1348 14.1348 14.3067 14.3067 14.5411 14.5411 k = 0.0320 0.0968-0.0000 ( 3029 PWs) bands (ev): 4.4588 4.4588 6.7564 6.7564 6.9539 6.9539 7.1986 7.1986 7.2160 7.2160 8.0454 8.0454 8.8827 8.8827 8.9516 8.9516 9.2113 9.2113 9.9844 9.9844 10.0486 10.0486 10.5552 10.5552 11.8975 11.8975 13.5288 13.5288 13.5952 13.5952 14.1289 14.1289 14.3317 14.3317 14.4817 14.4817 k = 0.0373 0.1130-0.0000 ( 3023 PWs) bands (ev): 4.4836 4.4836 6.7688 6.7688 6.9581 6.9581 7.2132 7.2132 7.2361 7.2361 8.0504 8.0504 8.8772 8.8772 8.9429 8.9429 9.2168 9.2168 9.9766 9.9766 10.0459 10.0459 10.5500 10.5500 11.8742 11.8742 13.4989 13.4989 13.5890 13.5890 14.1238 14.1238 14.3257 14.3257 14.4506 14.4506 k = 0.0427 0.1291-0.0000 ( 3023 PWs) bands (ev): 4.5122 4.5122 6.7825 6.7825 6.9631 6.9631 7.2299 7.2299 7.2591 7.2591 8.0561 8.0561 8.8684 8.8684 8.9363 8.9363 9.2224 9.2224 9.9674 9.9674 10.0437 10.0437 10.5440 10.5440 11.8482 11.8482 13.4656 13.4656 13.5840 13.5840 14.1181 14.1181 14.2709 14.2709 14.4686 14.4686 k = 0.0480 0.1452-0.0000 ( 3031 PWs) bands (ev): 4.5444 4.5444 6.7973 6.7973 6.9691 6.9691 7.2487 7.2487 7.2851 7.2851 8.0625 8.0625 8.8557 8.8557 8.9325 8.9325 9.2279 9.2279 9.9566 9.9566 10.0422 10.0422 10.5372 10.5372 11.8199 11.8199 13.4307 13.4307 13.5782 13.5782 14.1059 14.1059 14.2049 14.2049 14.5060 14.5060 k = 0.0533 0.1614-0.0000 ( 3031 PWs) bands (ev): 4.5801 4.5801 6.8128 6.8128 6.9761 6.9761 7.2696 7.2696 7.3138 7.3138 8.0696 8.0696 8.8396 8.8396 8.9312 8.9312 9.2331 9.2331 9.9447 9.9447 10.0414 10.0414 10.5295 10.5295 11.7897 11.7897 13.3949 13.3949 13.5701 13.5701 14.0656 14.0656 14.1652 14.1652 14.5491 14.5491 k = 0.0587 0.1775-0.0000 ( 3035 PWs) bands (ev): 4.6193 4.6193 6.8289 6.8289 6.9844 6.9844 7.2924 7.2924 7.3450 7.3450 8.0776 8.0776 8.8210 8.8210 8.9318 8.9318 9.2380 9.2380 9.9317 9.9317 10.0415 10.0415 10.5210 10.5210 11.7579 11.7579 13.3586 13.3586 13.5575 13.5575 13.9973 13.9973 14.1577 14.1577 14.5946 14.5946 k = 0.0640 0.1936-0.0000 ( 3039 PWs) bands (ev): 4.6620 4.6620 6.8450 6.8450 6.9939 6.9939 7.3171 7.3171 7.3788 7.3788 8.0863 8.0863 8.8004 8.8004 8.9339 8.9339 9.2426 9.2426 9.9180 9.9180 10.0424 10.0424 10.5117 10.5117 11.7249 11.7249 13.3218 13.3218 13.5374 13.5374 13.9266 13.9266 14.1619 14.1619 14.6412 14.6412 k = 0.0693 0.2098-0.0000 ( 3041 PWs) bands (ev): 4.7079 4.7079 6.8610 6.8610 7.0049 7.0049 7.3436 7.3436 7.4146 7.4146 8.0960 8.0960 8.7784 8.7784 8.9370 8.9370 9.2467 9.2467 9.9037 9.9037 10.0442 10.0442 10.5016 10.5016 11.6909 11.6909 13.2844 13.2844 13.5060 13.5060 13.8654 13.8654 14.1712 14.1712 14.6883 14.6883 k = 0.0747 0.2259-0.0000 ( 3043 PWs) bands (ev): 4.7571 4.7571 6.8767 6.8767 7.0173 7.0173 7.3719 7.3719 7.4523 7.4523 8.1066 8.1066 8.7554 8.7554 8.9410 8.9410 9.2504 9.2504 9.8893 9.8893 10.0467 10.0467 10.4907 10.4907 11.6563 11.6563 13.2455 13.2455 13.4608 13.4608 13.8194 13.8194 14.1838 14.1838 14.7352 14.7352 k = 0.0800 0.2420-0.0000 ( 3043 PWs) bands (ev): 4.8094 4.8094 6.8918 6.8918 7.0311 7.0311 7.4017 7.4017 7.4914 7.4914 8.1185 8.1185 8.7317 8.7317 8.9459 8.9459 9.2536 9.2536 9.8748 9.8748 10.0501 10.0501 10.4790 10.4790 11.6214 11.6214 13.2038 13.2038 13.4036 13.4036 13.7894 13.7894 14.1990 14.1990 14.7812 14.7812 k = 0.0853 0.2582-0.0000 ( 3047 PWs) bands (ev): 4.8646 4.8646 6.9064 6.9064 7.0461 7.0461 7.4331 7.4331 7.5313 7.5313 8.1316 8.1316 8.7077 8.7077 8.9515 8.9515 9.2565 9.2565 9.8608 9.8608 10.0542 10.0542 10.4667 10.4667 11.5863 11.5863 13.1566 13.1566 13.3408 13.3408 13.7726 13.7726 14.2163 14.2163 14.8249 14.8249 k = 0.0907 0.2743-0.0000 ( 3055 PWs) bands (ev): 4.9226 4.9226 6.9205 6.9205 7.0621 7.0621 7.4659 7.4659 7.5715 7.5715 8.1464 8.1464 8.6836 8.6836 8.9579 8.9579 9.2590 9.2590 9.8473 9.8473 10.0589 10.0589 10.4538 10.4538 11.5515 11.5515 13.1003 13.1003 13.2804 13.2804 13.7649 13.7649 14.2353 14.2353 14.8615 14.8615 k = 0.0960 0.2904-0.0000 ( 3049 PWs) bands (ev): 4.9833 4.9833 6.9342 6.9342 7.0789 7.0789 7.5001 7.5001 7.6111 7.6111 8.1631 8.1631 8.6597 8.6597 8.9650 8.9650 9.2614 9.2614 9.8346 9.8346 10.0641 10.0641 10.4406 10.4406 11.5169 11.5169 13.0327 13.0327 13.2279 13.2279 13.7635 13.7635 14.2555 14.2555 14.8740 14.8740 k = 0.1013 0.3066-0.0000 ( 3045 PWs) bands (ev): 5.0465 5.0465 6.9477 6.9477 7.0960 7.0960 7.5354 7.5354 7.6492 7.6492 8.1819 8.1819 8.6366 8.6366 8.9728 8.9728 9.2639 9.2639 9.8231 9.8231 10.0695 10.0695 10.4273 10.4273 11.4829 11.4829 12.9551 12.9551 13.1843 13.1843 13.7664 13.7664 14.2766 14.2766 14.8469 14.8469 k = 0.1067 0.3227-0.0000 ( 3045 PWs) bands (ev): 5.1119 5.1119 6.9611 6.9611 7.1132 7.1132 7.5719 7.5719 7.6849 7.6849 8.2027 8.2027 8.6147 8.6147 8.9815 8.9815 9.2668 9.2668 9.8130 9.8130 10.0747 10.0747 10.4141 10.4141 11.4496 11.4496 12.8710 12.8710 13.1474 13.1474 13.7724 13.7724 14.2980 14.2980 14.8027 14.8027 k = 0.1120 0.3389-0.0000 ( 3041 PWs) bands (ev): 5.1794 5.1794 6.9746 6.9746 7.1301 7.1301 7.6094 7.6094 7.7174 7.7174 8.2255 8.2255 8.5947 8.5947 8.9910 8.9910 9.2704 9.2704 9.8044 9.8044 10.0794 10.0794 10.4015 10.4015 11.4171 11.4171 12.7837 12.7837 13.1147 13.1147 13.7809 13.7809 14.3191 14.3191 14.7556 14.7556 k = 0.1173 0.3550-0.0000 ( 3045 PWs) bands (ev): 5.2488 5.2488 6.9883 6.9883 7.1465 7.1465 7.6478 7.6478 7.7459 7.7459 8.2495 8.2495 8.5775 8.5775 9.0014 9.0014 9.2754 9.2754 9.7976 9.7976 10.0829 10.0829 10.3901 10.3901 11.3854 11.3854 12.6951 12.6951 13.0846 13.0846 13.7914 13.7914 14.3390 14.3390 14.7095 14.7095 k = 0.1227 0.3711-0.0000 ( 3043 PWs) bands (ev): 5.3198 5.3198 7.0024 7.0024 7.1622 7.1622 7.6868 7.6868 7.7701 7.7701 8.2731 8.2731 8.5643 8.5643 9.0128 9.0128 9.2825 9.2825 9.7927 9.7927 10.0847 10.0847 10.3804 10.3804 11.3547 11.3547 12.6066 12.6066 13.0562 13.0562 13.8038 13.8038 14.3568 14.3568 14.6656 14.6656 k = 0.1280 0.3873-0.0000 ( 3035 PWs) bands (ev): 5.3920 5.3920 7.0169 7.0169 7.1769 7.1769 7.7262 7.7262 7.7899 7.7899 8.2943 8.2943 8.5568 8.5568 9.0252 9.0252 9.2923 9.2923 9.7899 9.7899 10.0840 10.0840 10.3732 10.3732 11.3250 11.3250 12.5190 12.5190 13.0287 13.0287 13.8178 13.8178 14.3714 14.3714 14.6247 14.6247 k = 0.1333 0.4034-0.0000 ( 3039 PWs) bands (ev): 5.4653 5.4653 7.0318 7.0318 7.1906 7.1906 7.7646 7.7646 7.8067 7.8067 8.3103 8.3103 8.5563 8.5563 9.0387 9.0387 9.3058 9.3058 9.7895 9.7895 10.0804 10.0804 10.3689 10.3689 11.2963 11.2963 12.4329 12.4329 13.0014 13.0014 13.8333 13.8333 14.3815 14.3815 14.5873 14.5873 k = 0.1387 0.4195-0.0000 ( 3039 PWs) bands (ev): 5.5393 5.5393 7.0473 7.0473 7.2031 7.2031 7.7961 7.7961 7.8263 7.8263 8.3194 8.3194 8.5634 8.5634 9.0533 9.0533 9.3241 9.3241 9.7914 9.7914 10.0736 10.0736 10.3682 10.3682 11.2686 11.2686 12.3486 12.3486 12.9740 12.9740 13.8504 13.8504 14.3856 14.3856 14.5537 14.5537 k = 0.1440 0.4357-0.0000 ( 3047 PWs) bands (ev): 5.6137 5.6137 7.0633 7.0633 7.2144 7.2144 7.8106 7.8106 7.8593 7.8593 8.3218 8.3218 8.5765 8.5765 9.0688 9.0688 9.3482 9.3482 9.7958 9.7958 10.0636 10.0636 10.3709 10.3709 11.2418 11.2418 12.2665 12.2665 12.9460 12.9460 13.8689 13.8689 14.3826 14.3826 14.5238 14.5238 k = 0.1493 0.4518-0.0000 ( 3041 PWs) bands (ev): 5.6880 5.6880 7.0798 7.0798 7.2245 7.2245 7.8150 7.8150 7.8987 7.8987 8.3190 8.3190 8.5931 8.5931 9.0851 9.0851 9.3787 9.3787 9.8028 9.8028 10.0514 10.0514 10.3770 10.3770 11.2159 11.2159 12.1867 12.1867 12.9170 12.9170 13.8889 13.8889 14.3725 14.3725 14.4964 14.4964 k = 0.1547 0.4679-0.0000 ( 3037 PWs) bands (ev): 5.7620 5.7620 7.0968 7.0968 7.2334 7.2334 7.8149 7.8149 7.9392 7.9392 8.3131 8.3131 8.6102 8.6102 9.1018 9.1018 9.4157 9.4157 9.8120 9.8120 10.0382 10.0382 10.3859 10.3859 11.1908 11.1908 12.1094 12.1094 12.8864 12.8864 13.9103 13.9103 14.3561 14.3561 14.4695 14.4695 k = 0.1600 0.4841-0.0000 ( 3037 PWs) bands (ev): 5.8352 5.8352 7.1142 7.1142 7.2412 7.2412 7.8117 7.8117 7.9791 7.9791 8.3063 8.3063 8.6259 8.6259 9.1187 9.1187 9.4588 9.4588 9.8225 9.8225 10.0265 10.0265 10.3972 10.3972 11.1664 11.1664 12.0347 12.0347 12.8539 12.8539 13.9330 13.9330 14.3345 14.3345 14.4411 14.4411 k = 0.1653 0.5002-0.0000 ( 3033 PWs) bands (ev): 5.9072 5.9072 7.1318 7.1318 7.2480 7.2480 7.8060 7.8060 8.0172 8.0172 8.3003 8.3003 8.6394 8.6394 9.1355 9.1355 9.5064 9.5064 9.8319 9.8319 10.0205 10.0205 10.4105 10.4105 11.1426 11.1426 11.9628 11.9628 12.8191 12.8191 13.9569 13.9569 14.3081 14.3081 14.4104 14.4104 k = 0.1706 0.5164-0.0000 ( 3029 PWs) bands (ev): 5.9775 5.9775 7.1495 7.1495 7.2542 7.2542 7.7984 7.7984 8.0517 8.0517 8.2970 8.2970 8.6505 8.6505 9.1521 9.1521 9.5561 9.5561 9.8363 9.8363 10.0264 10.0264 10.4254 10.4254 11.1195 11.1195 11.8936 11.8936 12.7814 12.7814 13.9817 13.9817 14.2751 14.2751 14.3793 14.3793 k = 0.1760 0.5325-0.0000 ( 3021 PWs) bands (ev): 6.0459 6.0459 7.1667 7.1667 7.2602 7.2602 7.7892 7.7892 8.0804 8.0804 8.2984 8.2984 8.6599 8.6599 9.1683 9.1683 9.6052 9.6052 9.8321 9.8321 10.0496 10.0496 10.4417 10.4417 11.0968 11.0968 11.8274 11.8274 12.7405 12.7405 14.0066 14.0066 14.2335 14.2335 14.3515 14.3515 k = 0.1813 0.5486-0.0000 ( 3017 PWs) bands (ev): 6.1117 6.1117 7.1829 7.1829 7.2665 7.2665 7.7789 7.7789 8.1009 8.1009 8.3063 8.3063 8.6686 8.6686 9.1841 9.1841 9.6506 9.6506 9.8203 9.8203 10.0911 10.0911 10.4597 10.4597 11.0747 11.0747 11.7641 11.7641 12.6961 12.6961 14.0289 14.0289 14.1843 14.1843 14.3293 14.3293 k = 0.1866 0.5648-0.0000 ( 3017 PWs) bands (ev): 6.1748 6.1748 7.1972 7.1972 7.2743 7.2743 7.7677 7.7677 8.1123 8.1123 8.3209 8.3209 8.6780 8.6780 9.1995 9.1995 9.6881 9.6881 9.8066 9.8066 10.1472 10.1472 10.4801 10.4801 11.0530 11.0530 11.7038 11.7038 12.6478 12.6478 14.0375 14.0375 14.1398 14.1398 14.3130 14.3130 k = 0.1920 0.5809-0.0000 ( 3017 PWs) bands (ev): 6.2347 6.2347 7.2086 7.2086 7.2844 7.2844 7.7559 7.7559 8.1153 8.1153 8.3399 8.3399 8.6896 8.6896 9.2143 9.2143 9.7080 9.7080 9.8035 9.8035 10.2124 10.2124 10.5049 10.5049 11.0320 11.0320 11.6468 11.6468 12.5954 12.5954 14.0030 14.0030 14.1311 14.1311 14.3022 14.3022 k = 0.1973 0.5970-0.0000 ( 3019 PWs) bands (ev): 6.2912 6.2912 7.2165 7.2165 7.2976 7.2976 7.7439 7.7439 8.1123 8.1123 8.3598 8.3598 8.7051 8.7051 9.2285 9.2285 9.7011 9.7011 9.8229 9.8229 10.2789 10.2789 10.5380 10.5380 11.0119 11.0119 11.5933 11.5933 12.5387 12.5387 13.9354 13.9354 14.1496 14.1496 14.2972 14.2972 k = 0.2026 0.6132-0.0000 ( 3011 PWs) bands (ev): 6.3439 6.3439 7.2212 7.2212 7.3134 7.3134 7.7319 7.7319 8.1052 8.1052 8.3771 8.3771 8.7256 8.7256 9.2418 9.2418 9.6781 9.6781 9.8561 9.8561 10.3374 10.3374 10.5853 10.5853 10.9931 10.9931 11.5436 11.5436 12.4779 12.4779 13.8570 13.8570 14.1731 14.1731 14.2991 14.2991 k = 0.2080 0.6293-0.0000 ( 3011 PWs) bands (ev): 6.3926 6.3926 7.2234 7.2234 7.3312 7.3312 7.7201 7.7201 8.0956 8.0956 8.3897 8.3897 8.7516 8.7516 9.2541 9.2541 9.6489 9.6489 9.8946 9.8946 10.3806 10.3806 10.6505 10.6505 10.9763 10.9763 11.4984 11.4984 12.4130 12.4130 13.7745 13.7745 14.1940 14.1940 14.3104 14.3104 k = 0.2133 0.6454-0.0000 ( 3019 PWs) bands (ev): 6.4373 6.4373 7.2239 7.2239 7.3500 7.3500 7.7087 7.7087 8.0845 8.0845 8.3967 8.3967 8.7827 8.7827 9.2651 9.2651 9.6173 9.6173 9.9359 9.9359 10.4082 10.4082 10.7298 10.7298 10.9634 10.9634 11.4589 11.4589 12.3445 12.3445 13.6903 13.6903 14.2092 14.2092 14.3324 14.3324 k = 0.2186 0.6616-0.0000 ( 3019 PWs) bands (ev): 6.4778 6.4778 7.2233 7.2233 7.3691 7.3691 7.6981 7.6981 8.0724 8.0724 8.3984 8.3984 8.8175 8.8175 9.2747 9.2747 9.5847 9.5847 9.9789 9.9789 10.4243 10.4243 10.8109 10.8109 10.9593 10.9593 11.4275 11.4275 12.2729 12.2729 13.6061 13.6061 14.2196 14.2196 14.3639 14.3639 k = 0.2240 0.6777-0.0000 ( 3019 PWs) bands (ev): 6.5141 6.5141 7.2220 7.2220 7.3879 7.3879 7.6884 7.6884 8.0599 8.0599 8.3955 8.3955 8.8542 8.8542 9.2825 9.2825 9.5519 9.5519 10.0227 10.0227 10.4324 10.4324 10.8708 10.8708 10.9788 10.9788 11.4084 11.4084 12.1993 12.1993 13.5231 13.5231 14.2276 14.2276 14.4021 14.4021 k = 0.2293 0.6939-0.0000 ( 3017 PWs) bands (ev): 6.5463 6.5463 7.2203 7.2203 7.4060 7.4060 7.6800 7.6800 8.0471 8.0471 8.3889 8.3889 8.8907 8.8907 9.2885 9.2885 9.5196 9.5196 10.0661 10.0661 10.4347 10.4347 10.8936 10.8936 11.0276 11.0276 11.4094 11.4094 12.1251 12.1251 13.4420 13.4420 14.2351 14.2351 14.4448 14.4448 k = 0.2346 0.7100-0.0000 ( 3017 PWs) bands (ev): 6.5743 6.5743 7.2183 7.2183 7.4228 7.4228 7.6730 7.6730 8.0345 8.0345 8.3793 8.3793 8.9250 8.9250 9.2925 9.2925 9.4887 9.4887 10.1072 10.1072 10.4322 10.4322 10.9040 10.9040 11.0706 11.0706 11.4394 11.4394 12.0531 12.0531 13.3635 13.3635 14.2432 14.2432 14.4909 14.4909 k = 0.2400 0.7261-0.0000 ( 3017 PWs) bands (ev): 6.5983 6.5983 7.2162 7.2162 7.4378 7.4378 7.6678 7.6678 8.0222 8.0222 8.3673 8.3673 8.9550 8.9550 9.2946 9.2946 9.4600 9.4600 10.1438 10.1438 10.4253 10.4253 10.9177 10.9177 11.0909 11.0909 11.4965 11.4965 11.9886 11.9886 13.2883 13.2883 14.2524 14.2524 14.5398 14.5398 k = 0.2453 0.7423-0.0000 ( 3021 PWs) bands (ev): 6.6185 6.6185 7.2141 7.2141 7.4505 7.4505 7.6646 7.6646 8.0105 8.0105 8.3534 8.3534 8.9782 8.9782 9.2947 9.2947 9.4350 9.4350 10.1734 10.1734 10.4144 10.4144 10.9390 10.9390 11.0949 11.0949 11.5601 11.5601 11.9439 11.9439 13.2168 13.2168 14.2632 14.2632 14.5909 14.5909 k = 0.2506 0.7584-0.0000 ( 3025 PWs) bands (ev): 6.6349 6.6349 7.2121 7.2121 7.4607 7.4607 7.6635 7.6635 7.9994 7.9994 8.3379 8.3379 8.9921 8.9921 9.2930 9.2930 9.4152 9.4152 10.1941 10.1941 10.3997 10.3997 10.9661 10.9661 11.0954 11.0954 11.5968 11.5968 11.9433 11.9433 13.1492 13.1492 14.2755 14.2755 14.6439 14.6439 k = 0.2560 0.7745-0.0000 ( 3023 PWs) bands (ev): 6.6477 6.6477 7.2102 7.2102 7.4681 7.4681 7.6644 7.6644 7.9894 7.9894 8.3211 8.3211 8.9944 8.9944 9.2895 9.2895 9.4025 9.4025 10.2049 10.2049 10.3813 10.3813 10.9891 10.9891 11.1081 11.1081 11.5871 11.5871 12.0019 12.0019 13.0858 13.0858 14.2896 14.2896 14.6988 14.6988 k = 0.2613 0.7907-0.0000 ( 3019 PWs) bands (ev): 6.6571 6.6571 7.2086 7.2086 7.4728 7.4728 7.6670 7.6670 7.9803 7.9803 8.3031 8.3031 8.9840 8.9840 9.2835 9.2835 9.3987 9.3987 10.2056 10.2056 10.3599 10.3599 10.9950 10.9950 11.1452 11.1452 11.5514 11.5514 12.0996 12.0996 13.0269 13.0269 14.3056 14.3056 14.7553 14.7553 k = 0.2666 0.8068-0.0000 ( 3019 PWs) bands (ev): 6.6632 6.6632 7.2072 7.2072 7.4751 7.4751 7.6707 7.6707 7.9724 7.9724 8.2841 8.2841 8.9612 8.9612 9.2742 9.2742 9.4037 9.4037 10.1967 10.1967 10.3360 10.3360 10.9869 10.9869 11.1961 11.1961 11.5175 11.5175 12.2149 12.2149 12.9727 12.9727 14.3233 14.3233 14.8132 14.8132 k = 0.2720 0.8229-0.0000 ( 3015 PWs) bands (ev): 6.6660 6.6660 7.2060 7.2060 7.4754 7.4754 7.6750 7.6750 7.9656 7.9656 8.2644 8.2644 8.9275 8.9275 9.2620 9.2620 9.4159 9.4159 10.1785 10.1785 10.3109 10.3109 10.9721 10.9721 11.2360 11.2360 11.5114 11.5114 12.3372 12.3372 12.9237 12.9237 14.3429 14.3429 14.8725 14.8725 k = 0.2773 0.8391-0.0000 ( 3015 PWs) bands (ev): 6.6658 6.6658 7.2052 7.2052 7.4741 7.4741 7.6793 7.6793 7.9597 7.9597 8.2441 8.2441 8.8849 8.8849 9.2474 9.2474 9.4330 9.4330 10.1512 10.1512 10.2860 10.2860 10.9530 10.9530 11.2443 11.2443 11.5539 11.5539 12.4611 12.4611 12.8808 12.8808 14.3644 14.3644 14.9329 14.9329 k = 0.2773 0.8391-0.0000 ( 3015 PWs) bands (ev): 6.6658 6.6658 7.2052 7.2052 7.4741 7.4741 7.6793 7.6793 7.9597 7.9597 8.2441 8.2441 8.8849 8.8849 9.2474 9.2474 9.4330 9.4330 10.1512 10.1512 10.2860 10.2860 10.9530 10.9530 11.2443 11.2443 11.5539 11.5539 12.4611 12.4611 12.8808 12.8808 14.3644 14.3644 14.9329 14.9329 k = 0.2610 0.8391-0.0000 ( 3019 PWs) bands (ev): 6.6661 6.6661 7.2054 7.2054 7.4747 7.4747 7.6777 7.6777 7.9616 7.9616 8.2500 8.2500 8.8986 8.8986 9.2519 9.2519 9.4276 9.4276 10.1555 10.1555 10.2980 10.2980 10.9584 10.9584 11.2446 11.2446 11.5381 11.5381 12.4258 12.4258 12.8912 12.8912 14.3551 14.3551 14.9153 14.9153 k = 0.2447 0.8391-0.0000 ( 3017 PWs) bands (ev): 6.6660 6.6660 7.2057 7.2057 7.4754 7.4754 7.6755 7.6755 7.9641 7.9641 8.2554 8.2554 8.9118 8.9118 9.2562 9.2562 9.4226 9.4226 10.1505 10.1505 10.3184 10.3184 10.9622 10.9622 11.2412 11.2412 11.5307 11.5307 12.3944 12.3944 12.8988 12.8988 14.3409 14.3409 14.9000 14.9000 k = 0.2284 0.8391-0.0000 ( 3017 PWs) bands (ev): 6.6656 6.6656 7.2060 7.2060 7.4762 7.4762 7.6727 7.6727 7.9671 7.9671 8.2601 8.2601 8.9244 8.9244 9.2601 9.2601 9.4180 9.4180 10.1391 10.1391 10.3443 10.3443 10.9643 10.9643 11.2343 11.2343 11.5312 11.5312 12.3670 12.3670 12.9035 12.9035 14.3222 14.3222 14.8876 14.8876 k = 0.2121 0.8391-0.0000 ( 3021 PWs) bands (ev): 6.6650 6.6650 7.2065 7.2065 7.4771 7.4771 7.6695 7.6695 7.9705 7.9705 8.2641 8.2641 8.9364 8.9364 9.2637 9.2637 9.4137 9.4137 10.1237 10.1237 10.3732 10.3732 10.9646 10.9646 11.2248 11.2248 11.5382 11.5382 12.3438 12.3438 12.9053 12.9053 14.2997 14.2997 14.8781 14.8781 k = 0.1957 0.8391-0.0000 ( 3017 PWs) bands (ev): 6.6644 6.6644 7.2069 7.2069 7.4781 7.4781 7.6658 7.6658 7.9743 7.9743 8.2672 8.2672 8.9479 8.9479 9.2671 9.2671 9.4098 9.4098 10.1062 10.1062 10.4036 10.4036 10.9630 10.9630 11.2141 11.2141 11.5502 11.5502 12.3246 12.3246 12.9045 12.9045 14.2743 14.2743 14.8710 14.8710 k = 0.1794 0.8391-0.0000 ( 3019 PWs) bands (ev): 6.6638 6.6638 7.2075 7.2075 7.4790 7.4790 7.6619 7.6619 7.9783 7.9783 8.2694 8.2694 8.9588 8.9588 9.2702 9.2702 9.4062 9.4062 10.0875 10.0875 10.4347 10.4347 10.9594 10.9594 11.2034 11.2034 11.5655 11.5655 12.3092 12.3092 12.9012 12.9012 14.2470 14.2470 14.8661 14.8661 k = 0.1631 0.8391-0.0000 ( 3015 PWs) bands (ev): 6.6631 6.6631 7.2081 7.2081 7.4801 7.4801 7.6577 7.6577 7.9826 7.9826 8.2707 8.2707 8.9690 8.9690 9.2730 9.2730 9.4029 9.4029 10.0684 10.0684 10.4657 10.4657 10.9537 10.9537 11.1936 11.1936 11.5828 11.5828 12.2975 12.2975 12.8959 12.8959 14.2188 14.2188 14.8626 14.8626 k = 0.1468 0.8391-0.0000 ( 3013 PWs) bands (ev): 6.6626 6.6626 7.2087 7.2087 7.4811 7.4811 7.6535 7.6535 7.9869 7.9869 8.2711 8.2711 8.9785 8.9785 9.2757 9.2757 9.3999 9.3999 10.0496 10.0496 10.4964 10.4964 10.9461 10.9461 11.1851 11.1851 11.6010 11.6010 12.2891 12.2891 12.8888 12.8888 14.1907 14.1907 14.8601 14.8601 k = 0.1305 0.8391-0.0000 ( 3014 PWs) bands (ev): 6.6621 6.6621 7.2094 7.2094 7.4821 7.4821 7.6493 7.6493 7.9914 7.9914 8.2709 8.2709 8.9874 8.9874 9.2782 9.2782 9.3973 9.3973 10.0314 10.0314 10.5262 10.5262 10.9367 10.9367 11.1782 11.1782 11.6193 11.6193 12.2837 12.2837 12.8805 12.8805 14.1633 14.1633 14.8581 14.8581 k = 0.1142 0.8391-0.0000 ( 3014 PWs) bands (ev): 6.6616 6.6616 7.2100 7.2100 7.4832 7.4832 7.6453 7.6453 7.9957 7.9957 8.2700 8.2700 8.9954 8.9954 9.2804 9.2804 9.3948 9.3948 10.0143 10.0143 10.5550 10.5550 10.9258 10.9258 11.1728 11.1728 11.6369 11.6369 12.2807 12.2807 12.8715 12.8715 14.1375 14.1375 14.8559 14.8559 k = 0.0979 0.8391-0.0000 ( 3010 PWs) bands (ev): 6.6613 6.6613 7.2107 7.2107 7.4841 7.4841 7.6414 7.6414 7.9999 7.9999 8.2686 8.2686 9.0025 9.0025 9.2825 9.2825 9.3927 9.3927 9.9986 9.9986 10.5824 10.5824 10.9138 10.9138 11.1687 11.1687 11.6534 11.6534 12.2796 12.2796 12.8621 12.8621 14.1139 14.1139 14.8533 14.8533 k = 0.0816 0.8391-0.0000 ( 3009 PWs) bands (ev): 6.6610 6.6610 7.2113 7.2113 7.4850 7.4850 7.6380 7.6380 8.0038 8.0038 8.2670 8.2670 9.0087 9.0087 9.2844 9.2844 9.3909 9.3909 9.9847 9.9847 10.6079 10.6079 10.9011 10.9011 11.1657 11.1657 11.6681 11.6681 12.2800 12.2800 12.8529 12.8529 14.0930 14.0930 14.8498 14.8498 k = 0.0652 0.8391-0.0000 ( 3006 PWs) bands (ev): 6.6608 6.6608 7.2118 7.2118 7.4858 7.4858 7.6350 7.6350 8.0072 8.0072 8.2652 8.2652 9.0139 9.0139 9.2860 9.2860 9.3894 9.3894 9.9729 9.9729 10.6311 10.6311 10.8884 10.8884 11.1635 11.1635 11.6807 11.6807 12.2813 12.2813 12.8445 12.8445 14.0753 14.0753 14.8454 14.8454 k = 0.0489 0.8391-0.0000 ( 3011 PWs) bands (ev): 6.6607 6.6607 7.2123 7.2123 7.4864 7.4864 7.6325 7.6325 8.0101 8.0101 8.2637 8.2637 9.0181 9.0181 9.2874 9.2874 9.3882 9.3882 9.9635 9.9635 10.6513 10.6513 10.8764 10.8764 11.1620 11.1620 11.6909 11.6909 12.2829 12.2829 12.8373 12.8373 14.0611 14.0611 14.8405 14.8405 k = 0.0326 0.8391-0.0000 ( 3011 PWs) bands (ev): 6.6606 6.6606 7.2126 7.2126 7.4869 7.4869 7.6307 7.6307 8.0122 8.0122 8.2624 8.2624 9.0210 9.0210 9.2883 9.2883 9.3873 9.3873 9.9566 9.9566 10.6673 10.6673 10.8662 10.8662 11.1611 11.1611 11.6984 11.6984 12.2845 12.2845 12.8318 12.8318 14.0508 14.0508 14.8359 14.8359 k = 0.0163 0.8391-0.0000 ( 3006 PWs) bands (ev): 6.6605 6.6605 7.2128 7.2128 7.4872 7.4872 7.6296 7.6296 8.0136 8.0136 8.2615 8.2615 9.0228 9.0228 9.2890 9.2890 9.3868 9.3868 9.9524 9.9524 10.6778 10.6778 10.8592 10.8592 11.1605 11.1605 11.7030 11.7030 12.2856 12.2856 12.8284 12.8284 14.0446 14.0446 14.8326 14.8326 k = 0.0000 0.8391-0.0000 ( 3008 PWs) bands (ev): 6.6605 6.6605 7.2129 7.2129 7.4873 7.4873 7.6293 7.6293 8.0140 8.0140 8.2612 8.2612 9.0234 9.0234 9.2892 9.2892 9.3866 9.3866 9.9510 9.9510 10.6815 10.6815 10.8566 10.8566 11.1604 11.1604 11.7045 11.7045 12.2860 12.2860 12.8272 12.8272 14.0424 14.0424 14.8314 14.8315 k = 0.0000 0.8391-0.0000 ( 3008 PWs) bands (ev): 6.6605 6.6605 7.2129 7.2129 7.4873 7.4873 7.6293 7.6293 8.0140 8.0140 8.2612 8.2612 9.0234 9.0234 9.2892 9.2892 9.3866 9.3866 9.9510 9.9510 10.6815 10.6815 10.8566 10.8566 11.1604 11.1604 11.7045 11.7045 12.2860 12.2860 12.8272 12.8272 14.0424 14.0424 14.8314 14.8315 k = 0.0000 0.8391 0.0172 ( 3008 PWs) bands (ev): 6.6599 6.6599 7.2135 7.2135 7.4854 7.4854 7.6299 7.6299 8.0091 8.0091 8.2680 8.2680 9.0202 9.0202 9.2851 9.2851 9.3941 9.3941 9.9522 9.9522 10.6816 10.6816 10.8569 10.8569 11.1571 11.1571 11.7012 11.7012 12.2942 12.2942 12.8217 12.8217 14.0424 14.0424 14.8334 14.8334 k = 0.0000 0.8391 0.0343 ( 3008 PWs) bands (ev): 6.6580 6.6580 7.2152 7.2152 7.4798 7.4798 7.6316 7.6316 7.9959 7.9959 8.2865 8.2865 9.0106 9.0106 9.2769 9.2769 9.4125 9.4125 9.9558 9.9558 10.6820 10.6820 10.8578 10.8578 11.1474 11.1474 11.6921 11.6921 12.3178 12.3178 12.8053 12.8053 14.0423 14.0423 14.8362 14.8362 k = 0.0000 0.8391 0.0515 ( 3014 PWs) bands (ev): 6.6548 6.6548 7.2181 7.2181 7.4710 7.4710 7.6338 7.6338 7.9782 7.9782 8.3131 8.3131 8.9949 8.9949 9.2702 9.2702 9.4354 9.4354 9.9618 9.9618 10.6827 10.6827 10.8593 10.8593 11.1322 11.1322 11.6790 11.6790 12.3541 12.3541 12.7793 12.7793 14.0419 14.0419 14.8323 14.8323 k = 0.0000 0.8391 0.0686 ( 3014 PWs) bands (ev): 6.6506 6.6506 7.2219 7.2219 7.4595 7.4595 7.6358 7.6358 7.9589 7.9589 8.3445 8.3445 8.9743 8.9743 9.2679 9.2679 9.4590 9.4590 9.9701 9.9701 10.6841 10.6841 10.8615 10.8615 11.1125 11.1125 11.6639 11.6639 12.3998 12.3998 12.7451 12.7451 14.0408 14.0408 14.8181 14.8181 k = 0.0000 0.8391 0.0858 ( 3016 PWs) bands (ev): 6.6453 6.6453 7.2266 7.2266 7.4459 7.4459 7.6370 7.6370 7.9404 7.9404 8.3781 8.3781 8.9501 8.9501 9.2706 9.2706 9.4810 9.4810 9.9804 9.9804 10.6866 10.6866 10.8644 10.8644 11.0899 11.0899 11.6484 11.6484 12.4506 12.4506 12.7055 12.7055 14.0389 14.0389 14.7960 14.7960 k = 0.0000 0.8391 0.1030 ( 3016 PWs) bands (ev): 6.6392 6.6392 7.2320 7.2320 7.4306 7.4306 7.6367 7.6367 7.9240 7.9240 8.4122 8.4122 8.9240 8.9240 9.2779 9.2779 9.5000 9.5000 9.9923 9.9923 10.6906 10.6906 10.8681 10.8681 11.0659 11.0659 11.6336 11.6336 12.4998 12.4998 12.6666 12.6666 14.0359 14.0359 14.7687 14.7687 k = 0.0000 0.8391 0.1201 ( 3014 PWs) bands (ev): 6.6324 6.6324 7.2379 7.2379 7.4143 7.4143 7.6347 7.6347 7.9103 7.9103 8.4451 8.4451 8.8978 8.8978 9.2892 9.2892 9.5149 9.5149 10.0055 10.0055 10.6970 10.6970 10.8727 10.8727 11.0419 11.0419 11.6198 11.6198 12.5260 12.5260 12.6493 12.6493 14.0317 14.0317 14.7383 14.7383 k = 0.0000 0.8391 0.1373 ( 3018 PWs) bands (ev): 6.6251 6.6251 7.2438 7.2438 7.3972 7.3972 7.6307 7.6307 7.8995 7.8995 8.4758 8.4758 8.8728 8.8728 9.3036 9.3036 9.5255 9.5255 10.0193 10.0193 10.7063 10.7063 10.8782 10.8782 11.0192 11.0192 11.6074 11.6074 12.5021 12.5021 12.6806 12.6806 14.0261 14.0261 14.7057 14.7057 k = 0.0000 0.8391 0.1545 ( 3020 PWs) bands (ev): 6.6175 6.6175 7.2492 7.2492 7.3803 7.3803 7.6249 7.6249 7.8913 7.8913 8.5029 8.5029 8.8507 8.8507 9.3200 9.3200 9.5318 9.5318 10.0332 10.0332 10.7193 10.7193 10.8847 10.8847 10.9988 10.9988 11.5966 11.5966 12.4529 12.4529 12.7359 12.7359 14.0193 14.0193 14.6716 14.6716 k = 0.0000 0.8391 0.1716 ( 3022 PWs) bands (ev): 6.6098 6.6098 7.2534 7.2534 7.3645 7.3645 7.6175 7.6175 7.8852 7.8852 8.5255 8.5255 8.8326 8.8326 9.3372 9.3372 9.5342 9.5342 10.0466 10.0466 10.7366 10.7366 10.8918 10.8918 10.9817 10.9817 11.5872 11.5872 12.3971 12.3971 12.7970 12.7970 14.0112 14.0112 14.6367 14.6367 k = 0.0000 0.8391 0.1888 ( 3016 PWs) bands (ev): 6.6022 6.6022 7.2551 7.2551 7.3510 7.3510 7.6087 7.6087 7.8807 7.8807 8.5429 8.5429 8.8194 8.8194 9.3536 9.3536 9.5339 9.5339 10.0592 10.0592 10.7582 10.7582 10.8990 10.8990 10.9693 10.9693 11.5795 11.5795 12.3398 12.3398 12.8590 12.8590 14.0018 14.0018 14.6010 14.6010 k = 0.0000 0.8391 0.2059 ( 3018 PWs) bands (ev): 6.5948 6.5948 7.2527 7.2527 7.3414 7.3414 7.5988 7.5988 7.8772 7.8772 8.5546 8.5546 8.8116 8.8116 9.3669 9.3669 9.5330 9.5330 10.0712 10.0712 10.7838 10.7838 10.9043 10.9043 10.9640 10.9640 11.5733 11.5733 12.2834 12.2834 12.9202 12.9202 13.9912 13.9912 14.5649 14.5649 k = 0.0000 0.8391 0.2231 ( 3020 PWs) bands (ev): 6.5878 6.5878 7.2456 7.2456 7.3365 7.3365 7.5878 7.5878 7.8745 7.8745 8.5613 8.5613 8.8088 8.8088 9.3746 9.3746 9.5337 9.5337 10.0824 10.0824 10.8123 10.8123 10.9051 10.9051 10.9689 10.9689 11.5689 11.5689 12.2295 12.2295 12.9796 12.9796 13.9795 13.9795 14.5283 14.5283 k = 0.0000 0.8391 0.2403 ( 3018 PWs) bands (ev): 6.5814 6.5814 7.2343 7.2343 7.3355 7.3355 7.5757 7.5757 7.8723 7.8723 8.5642 8.5642 8.8097 8.8097 9.3746 9.3746 9.5380 9.5380 10.0934 10.0934 10.8419 10.8419 10.9023 10.9023 10.9843 10.9843 11.5661 11.5661 12.1795 12.1795 13.0367 13.0367 13.9668 13.9668 14.4912 14.4912 k = 0.0000 0.8391 0.2574 ( 3018 PWs) bands (ev): 6.5758 6.5758 7.2206 7.2206 7.3366 7.3366 7.5627 7.5627 7.8706 7.8706 8.5647 8.5647 8.8127 8.8127 9.3669 9.3669 9.5462 9.5462 10.1043 10.1043 10.8687 10.8687 10.9000 10.9000 11.0086 11.0086 11.5653 11.5653 12.1344 12.1344 13.0911 13.0911 13.9530 13.9530 14.4537 14.4537 k = 0.0000 0.8391 0.2746 ( 3022 PWs) bands (ev): 6.5711 6.5711 7.2059 7.2059 7.3382 7.3382 7.5486 7.5486 7.8699 7.8699 8.5643 8.5643 8.8164 8.8164 9.3530 9.3530 9.5568 9.5568 10.1153 10.1153 10.8809 10.8809 10.9099 10.9099 11.0405 11.0405 11.5668 11.5668 12.0957 12.0957 13.1426 13.1426 13.9383 13.9383 14.4154 14.4154 k = 0.0000 0.8391 0.2918 ( 3024 PWs) bands (ev): 6.5674 6.5674 7.1911 7.1911 7.3389 7.3389 7.5333 7.5333 7.8704 7.8704 8.5639 8.5639 8.8194 8.8194 9.3353 9.3353 9.5680 9.5680 10.1264 10.1264 10.8787 10.8787 10.9312 10.9312 11.0789 11.0789 11.5709 11.5709 12.0643 12.0643 13.1910 13.1910 13.9227 13.9227 14.3764 14.3764 k = 0.0000 0.8391 0.3089 ( 3030 PWs) bands (ev): 6.5649 6.5649 7.1768 7.1768 7.3379 7.3379 7.5168 7.5168 7.8728 7.8728 8.5640 8.5640 8.8209 8.8209 9.3154 9.3154 9.5785 9.5785 10.1376 10.1376 10.8741 10.8741 10.9515 10.9515 11.1222 11.1222 11.5786 11.5786 12.0411 12.0411 13.2362 13.2362 13.9064 13.9064 14.3363 14.3363 k = 0.0000 0.8391 0.3261 ( 3036 PWs) bands (ev): 6.5637 6.5637 7.1633 7.1633 7.3343 7.3343 7.4994 7.4994 7.8775 7.8775 8.5651 8.5651 8.8201 8.8201 9.2946 9.2946 9.5878 9.5878 10.1484 10.1484 10.8691 10.8691 10.9680 10.9680 11.1689 11.1689 11.5910 11.5910 12.0267 12.0267 13.2782 13.2782 13.8893 13.8893 14.2949 14.2949 k = 0.0000 0.8391 0.3432 ( 3038 PWs) bands (ev): 6.5639 6.5639 7.1510 7.1510 7.3274 7.3274 7.4811 7.4811 7.8849 7.8849 8.5672 8.5672 8.8168 8.8168 9.2736 9.2736 9.5959 9.5959 10.1586 10.1586 10.8641 10.8641 10.9797 10.9797 11.2179 11.2179 11.6093 11.6093 12.0214 12.0214 13.3168 13.3168 13.8717 13.8717 14.2521 14.2521 k = 0.0000 0.8391 0.3604 ( 3040 PWs) bands (ev): 6.5655 6.5655 7.1400 7.1400 7.3168 7.3168 7.4625 7.4625 7.8954 7.8954 8.5702 8.5702 8.8108 8.8108 9.2526 9.2526 9.6032 9.6032 10.1675 10.1675 10.8591 10.8591 10.9856 10.9856 11.2687 11.2687 11.6342 11.6342 12.0250 12.0250 13.3522 13.3522 13.8535 13.8535 14.2076 14.2076 k = 0.0000 0.8391 0.3776 ( 3040 PWs) bands (ev): 6.5688 6.5688 7.1303 7.1303 7.3021 7.3021 7.4438 7.4438 7.9091 7.9091 8.5741 8.5741 8.8020 8.8020 9.2315 9.2315 9.6105 9.6105 10.1747 10.1747 10.8541 10.8541 10.9853 10.9853 11.3211 11.3211 11.6659 11.6659 12.0373 12.0373 13.3842 13.3842 13.8351 13.8351 14.1611 14.1611 k = 0.0000 0.8391 0.3947 ( 3044 PWs) bands (ev): 6.5737 6.5737 7.1220 7.1220 7.2833 7.2833 7.4253 7.4253 7.9260 7.9260 8.5788 8.5788 8.7906 8.7906 9.2100 9.2100 9.6186 9.6186 10.1798 10.1798 10.8491 10.8491 10.9791 10.9791 11.3751 11.3751 11.7035 11.7035 12.0577 12.0577 13.4128 13.4128 13.8163 13.8163 14.1126 14.1126 k = 0.0000 0.8391 0.4119 ( 3042 PWs) bands (ev): 6.5803 6.5803 7.1151 7.1151 7.2607 7.2607 7.4073 7.4073 7.9461 7.9461 8.5841 8.5841 8.7770 8.7770 9.1877 9.1877 9.6283 9.6283 10.1826 10.1826 10.8440 10.8440 10.9677 10.9677 11.4306 11.4306 11.7453 11.7453 12.0862 12.0862 13.4378 13.4378 13.7976 13.7976 14.0620 14.0620 k = 0.0000 0.8391 0.4291 ( 3044 PWs) bands (ev): 6.5887 6.5887 7.1094 7.1094 7.2350 7.2350 7.3894 7.3894 7.9691 7.9691 8.5898 8.5898 8.7618 8.7618 9.1641 9.1641 9.6402 9.6402 10.1826 10.1826 10.8389 10.8389 10.9526 10.9526 11.4871 11.4871 11.7893 11.7893 12.1226 12.1226 13.4591 13.4591 13.7789 13.7789 14.0093 14.0093 k = 0.0000 0.8391 0.4462 ( 3040 PWs) bands (ev): 6.5988 6.5988 7.1047 7.1047 7.2073 7.2073 7.3717 7.3717 7.9947 7.9947 8.5953 8.5953 8.7455 8.7455 9.1390 9.1390 9.6549 9.6549 10.1797 10.1797 10.8337 10.8337 10.9350 10.9350 11.5443 11.5443 11.8333 11.8333 12.1669 12.1669 13.4762 13.4762 13.7605 13.7605 13.9550 13.9550 k = 0.0000 0.8391 0.4634 ( 3040 PWs) bands (ev): 6.6109 6.6109 7.1001 7.1001 7.1791 7.1791 7.3540 7.3540 8.0228 8.0228 8.5998 8.5998 8.7294 8.7294 9.1124 9.1124 9.6725 9.6725 10.1738 10.1738 10.8285 10.8285 10.9161 10.9161 11.6014 11.6014 11.8753 11.8753 12.2192 12.2192 13.4884 13.4884 13.7425 13.7425 13.8997 13.8997 k = 0.0000 0.8391 0.4805 ( 3046 PWs) bands (ev): 6.6247 6.6247 7.0930 7.0930 7.1533 7.1533 7.3363 7.3363 8.0530 8.0530 8.6016 8.6016 8.7153 8.7153 9.0843 9.0843 9.6930 9.6930 10.1648 10.1648 10.8233 10.8233 10.8972 10.8972 11.6576 11.6576 11.9136 11.9136 12.2791 12.2791 13.4943 13.4943 13.7252 13.7252 13.8449 13.8449 k = 0.0000 0.8391 0.4977 ( 3046 PWs) bands (ev): 6.6404 6.6404 7.0781 7.0781 7.1361 7.1361 7.3184 7.3184 8.0851 8.0851 8.5978 8.5978 8.7063 8.7063 9.0551 9.0551 9.7162 9.7162 10.1525 10.1525 10.8183 10.8183 10.8789 10.8789 11.7121 11.7121 11.9474 11.9474 12.3460 12.3460 13.4915 13.4915 13.7085 13.7085 13.7932 13.7932 k = 0.0000 0.8391 0.5149 ( 3050 PWs) bands (ev): 6.6580 6.6580 7.0530 7.0530 7.1300 7.1300 7.3006 7.3006 8.1189 8.1189 8.5862 8.5862 8.7047 8.7047 9.0250 9.0250 9.7419 9.7419 10.1372 10.1372 10.8135 10.8135 10.8620 10.8620 11.7643 11.7643 11.9760 11.9760 12.4191 12.4191 13.4764 13.4764 13.6926 13.6926 13.7488 13.7488 k = 0.0000 0.8391 0.5320 ( 3042 PWs) bands (ev): 6.6774 6.6774 7.0224 7.0224 7.1309 7.1309 7.2829 7.2829 8.1539 8.1539 8.5670 8.5670 8.7104 8.7104 8.9945 8.9945 9.7698 9.7698 10.1188 10.1188 10.8090 10.8090 10.8470 10.8470 11.8133 11.8133 11.9991 11.9991 12.4972 12.4972 13.4451 13.4451 13.6779 13.6779 13.7153 13.7153 k = 0.0000 0.8391 0.5492 ( 3044 PWs) bands (ev): 6.6986 6.6986 6.9897 6.9897 7.1355 7.1355 7.2654 7.2654 8.1901 8.1901 8.5421 8.5421 8.7218 8.7218 8.9640 8.9640 9.7993 9.7993 10.0975 10.0975 10.8051 10.8051 10.8339 10.8339 11.8586 11.8586 12.0164 12.0164 12.5793 12.5793 13.3968 13.3968 13.6659 13.6659 13.6930 13.6930 k = 0.0000 0.8391 0.5664 ( 3048 PWs) bands (ev): 6.7215 6.7215 6.9566 6.9566 7.1424 7.1424 7.2483 7.2483 8.2270 8.2270 8.5133 8.5133 8.7370 8.7370 8.9338 8.9338 9.8301 9.8301 10.0736 10.0736 10.8019 10.8019 10.8230 10.8230 11.8996 11.8996 12.0278 12.0278 12.6644 12.6644 13.3346 13.3346 13.6578 13.6578 13.6782 13.6782 k = 0.0000 0.8391 0.5835 ( 3042 PWs) bands (ev): 6.7462 6.7462 6.9236 6.9236 7.1513 7.1513 7.2317 7.2317 8.2644 8.2644 8.4817 8.4817 8.7552 8.7552 8.9043 8.9043 9.8619 9.8619 10.0474 10.0474 10.7995 10.7995 10.8143 10.8143 11.9358 11.9358 12.0331 12.0331 12.7514 12.7514 13.2625 13.2625 13.6532 13.6532 13.6679 13.6679 k = 0.0000 0.8391 0.6007 ( 3042 PWs) bands (ev): 6.7724 6.7724 6.8912 6.8912 7.1617 7.1617 7.2157 7.2157 8.3020 8.3020 8.4480 8.4480 8.7757 8.7757 8.8758 8.8758 9.8941 9.8941 10.0191 10.0191 10.7982 10.7982 10.8076 10.8076 11.9668 11.9668 12.0322 12.0322 12.8395 12.8395 13.1840 13.1840 13.6511 13.6511 13.6606 13.6606 k = 0.0000 0.8391 0.6178 ( 3046 PWs) bands (ev): 6.8001 6.8001 6.8597 6.8597 7.1734 7.1734 7.2006 7.2006 8.3395 8.3395 8.4129 8.4129 8.7982 8.7982 8.8484 8.8484 9.9263 9.9263 9.9893 9.9893 10.7983 10.7983 10.8028 10.8028 11.9921 11.9921 12.0250 12.0250 12.9277 12.9277 13.1010 13.1010 13.6509 13.6509 13.6556 13.6556 k = 0.0000 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.8293 6.8293 6.8293 6.8293 7.1865 7.1865 7.1865 7.1865 8.3766 8.3766 8.3766 8.3766 8.8225 8.8225 8.8225 8.8225 9.9582 9.9582 9.9582 9.9582 10.7997 10.7997 10.7997 10.7997 12.0116 12.0116 12.0116 12.0116 13.0152 13.0152 13.0152 13.0152 13.6524 13.6524 13.6524 13.6524 k = 0.0000 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.8293 6.8293 6.8293 6.8293 7.1865 7.1865 7.1865 7.1865 8.3766 8.3766 8.3766 8.3766 8.8225 8.8225 8.8225 8.8225 9.9582 9.9582 9.9582 9.9582 10.7997 10.7997 10.7997 10.7997 12.0116 12.0116 12.0116 12.0116 13.0152 13.0152 13.0152 13.0152 13.6524 13.6524 13.6524 13.6524 k = 0.0163 0.8391 0.6350 ( 3046 PWs) bands (ev): 6.8267 6.8267 6.8292 6.8292 7.1816 7.1816 7.1951 7.1951 8.3652 8.3652 8.3878 8.3878 8.8029 8.8029 8.8437 8.8437 9.9498 9.9498 9.9638 9.9638 10.7962 10.7962 10.8010 10.8010 12.0012 12.0012 12.0224 12.0224 13.0007 13.0007 13.0335 13.0335 13.6503 13.6503 13.6559 13.6559 k = 0.0326 0.8391 0.6350 ( 3046 PWs) bands (ev): 6.8218 6.8218 6.8263 6.8263 7.1804 7.1804 7.2070 7.2070 8.3540 8.3540 8.3990 8.3990 8.7848 8.7848 8.8663 8.8663 9.9389 9.9389 9.9665 9.9665 10.7906 10.7906 10.8000 10.8000 11.9914 11.9914 12.0330 12.0330 12.9905 12.9905 13.0549 13.0549 13.6495 13.6495 13.6612 13.6612 k = 0.0489 0.8391 0.6350 ( 3036 PWs) bands (ev): 6.8149 6.8149 6.8209 6.8209 7.1827 7.1827 7.2218 7.2218 8.3430 8.3430 8.4098 8.4098 8.7685 8.7685 8.8902 8.8902 9.9257 9.9257 9.9662 9.9662 10.7833 10.7833 10.7967 10.7967 11.9827 11.9827 12.0432 12.0432 12.9849 12.9849 13.0785 13.0785 13.6499 13.6499 13.6683 13.6683 k = 0.0652 0.8391 0.6350 ( 3038 PWs) bands (ev): 6.8066 6.8066 6.8135 6.8135 7.1880 7.1880 7.2386 7.2386 8.3323 8.3323 8.4202 8.4202 8.7541 8.7541 8.9152 8.9152 9.9106 9.9106 9.9628 9.9628 10.7743 10.7743 10.7911 10.7911 11.9752 11.9752 12.0526 12.0526 12.9839 12.9839 13.1034 13.1034 13.6512 13.6512 13.6776 13.6776 k = 0.0816 0.8391 0.6350 ( 3040 PWs) bands (ev): 6.7974 6.7974 6.8045 6.8045 7.1957 7.1957 7.2570 7.2570 8.3220 8.3220 8.4299 8.4299 8.7417 8.7417 8.9413 8.9413 9.8938 9.8938 9.9564 9.9564 10.7640 10.7640 10.7835 10.7835 11.9691 11.9691 12.0609 12.0609 12.9875 12.9875 13.1287 13.1287 13.6535 13.6535 13.6893 13.6893 k = 0.0979 0.8391 0.6350 ( 3036 PWs) bands (ev): 6.7879 6.7879 6.7947 6.7947 7.2051 7.2051 7.2762 7.2762 8.3122 8.3122 8.4387 8.4387 8.7314 8.7314 8.9682 8.9682 9.8758 9.8758 9.9471 9.9471 10.7528 10.7528 10.7741 10.7741 11.9646 11.9646 12.0682 12.0682 12.9951 12.9951 13.1534 13.1534 13.6567 13.6567 13.7036 13.7036 k = 0.1142 0.8391 0.6350 ( 3038 PWs) bands (ev): 6.7783 6.7783 6.7845 6.7845 7.2155 7.2155 7.2956 7.2956 8.3029 8.3029 8.4466 8.4466 8.7234 8.7234 8.9958 8.9958 9.8570 9.8570 9.9351 9.9351 10.7408 10.7408 10.7630 10.7630 11.9615 11.9615 12.0744 12.0744 13.0062 13.0062 13.1767 13.1767 13.6607 13.6607 13.7206 13.7206 k = 0.1305 0.8391 0.6350 ( 3040 PWs) bands (ev): 6.7692 6.7692 6.7745 6.7745 7.2264 7.2264 7.3147 7.3147 8.2943 8.2943 8.4532 8.4532 8.7176 8.7176 9.0238 9.0238 9.8379 9.8379 9.9209 9.9209 10.7283 10.7283 10.7505 10.7505 11.9599 11.9599 12.0796 12.0796 13.0198 13.0198 13.1978 13.1978 13.6655 13.6655 13.7403 13.7403 k = 0.1468 0.8391 0.6350 ( 3042 PWs) bands (ev): 6.7608 6.7608 6.7650 6.7650 7.2371 7.2371 7.3329 7.3329 8.2864 8.2864 8.4586 8.4586 8.7141 8.7141 9.0519 9.0519 9.8189 9.8189 9.9048 9.9048 10.7154 10.7154 10.7368 10.7368 11.9596 11.9596 12.0842 12.0842 13.0352 13.0352 13.2161 13.2161 13.6710 13.6710 13.7623 13.7623 k = 0.1631 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7533 6.7533 6.7564 6.7564 7.2473 7.2473 7.3498 7.3498 8.2794 8.2794 8.4628 8.4628 8.7126 8.7126 9.0796 9.0796 9.8005 9.8005 9.8874 9.8874 10.7023 10.7023 10.7223 10.7223 11.9606 11.9606 12.0882 12.0882 13.0513 13.0513 13.2314 13.2314 13.6773 13.6773 13.7861 13.7861 k = 0.1794 0.8391 0.6350 ( 3046 PWs) bands (ev): 6.7470 6.7470 6.7491 6.7491 7.2565 7.2565 7.3650 7.3650 8.2732 8.2732 8.4658 8.4658 8.7130 8.7130 9.1065 9.1065 9.7833 9.7833 9.8695 9.8695 10.6889 10.6889 10.7071 10.7071 11.9625 11.9625 12.0920 12.0920 13.0672 13.0672 13.2436 13.2436 13.6842 13.6842 13.8112 13.8112 k = 0.1957 0.8391 0.6350 ( 3040 PWs) bands (ev): 6.7419 6.7419 6.7430 6.7430 7.2645 7.2645 7.3782 7.3782 8.2681 8.2681 8.4679 8.4679 8.7147 8.7147 9.1319 9.1319 9.7678 9.7678 9.8518 9.8518 10.6753 10.6753 10.6914 10.6914 11.9654 11.9654 12.0958 12.0958 13.0819 13.0819 13.2526 13.2526 13.6917 13.6917 13.8366 13.8366 k = 0.2121 0.8391 0.6350 ( 3042 PWs) bands (ev): 6.7382 6.7382 6.7386 6.7386 7.2709 7.2709 7.3890 7.3890 8.2639 8.2639 8.4693 8.4693 8.7174 8.7174 9.1551 9.1551 9.7544 9.7544 9.8353 9.8353 10.6614 10.6614 10.6752 10.6752 11.9692 11.9692 12.0999 12.0999 13.0947 13.0947 13.2587 13.2587 13.6996 13.6996 13.8615 13.8615 k = 0.2284 0.8391 0.6350 ( 3046 PWs) bands (ev): 6.7357 6.7357 6.7360 6.7360 7.2756 7.2756 7.3973 7.3973 8.2608 8.2608 8.4702 8.4702 8.7206 8.7206 9.1753 9.1753 9.7434 9.7434 9.8211 9.8211 10.6471 10.6471 10.6588 10.6588 11.9736 11.9736 12.1044 12.1044 13.1049 13.1049 13.2619 13.2619 13.7077 13.7077 13.8851 13.8851 k = 0.2447 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7347 6.7347 6.7353 6.7353 7.2784 7.2784 7.4028 7.4028 8.2589 8.2589 8.4709 8.4709 8.7238 8.7238 9.1916 9.1916 9.7354 9.7354 9.8100 9.8100 10.6324 10.6324 10.6422 10.6422 11.9786 11.9786 12.1096 12.1096 13.1120 13.1120 13.2626 13.2626 13.7158 13.7158 13.9068 13.9068 k = 0.2610 0.8391 0.6350 ( 3042 PWs) bands (ev): 6.7354 6.7354 6.7362 6.7362 7.2793 7.2793 7.4055 7.4055 8.2580 8.2580 8.4715 8.4715 8.7268 8.7268 9.2032 9.2032 9.7303 9.7303 9.8030 9.8030 10.6171 10.6171 10.6254 10.6254 11.9841 11.9841 12.1155 12.1155 13.1158 13.1158 13.2608 13.2608 13.7237 13.7237 13.9257 13.9257 k = 0.2773 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7379 6.7379 6.7387 6.7387 7.2781 7.2781 7.4053 7.4053 8.2583 8.2583 8.4722 8.4722 8.7292 8.7292 9.2096 9.2096 9.7284 9.7284 9.8007 9.8007 10.6012 10.6012 10.6084 10.6084 11.9902 11.9902 12.1223 12.1223 13.1161 13.1161 13.2568 13.2568 13.7312 13.7312 13.9417 13.9417 k = 0.2773 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7379 6.7379 6.7387 6.7387 7.2781 7.2781 7.4053 7.4053 8.2583 8.2583 8.4722 8.4722 8.7292 8.7292 9.2096 9.2096 9.7284 9.7284 9.8007 9.8007 10.6012 10.6012 10.6084 10.6084 11.9902 11.9902 12.1223 12.1223 13.1161 13.1161 13.2568 13.2568 13.7312 13.7312 13.9417 13.9417 k = 0.2720 0.8229 0.6350 ( 3040 PWs) bands (ev): 6.7270 6.7270 6.7283 6.7283 7.2857 7.2857 7.4111 7.4111 8.2563 8.2563 8.4699 8.4699 8.7224 8.7224 9.1969 9.1969 9.7278 9.7278 9.7993 9.7993 10.6527 10.6527 10.6644 10.6644 11.9647 11.9647 12.0930 12.0930 13.1252 13.1252 13.2769 13.2769 13.7099 13.7099 13.8951 13.8951 k = 0.2666 0.8068 0.6350 ( 3048 PWs) bands (ev): 6.7172 6.7172 6.7190 6.7190 7.2941 7.2941 7.4181 7.4181 8.2559 8.2559 8.4680 8.4680 8.7164 8.7164 9.1833 9.1833 9.7239 9.7239 9.7963 9.7963 10.6973 10.6973 10.7173 10.7173 11.9327 11.9327 12.0569 12.0569 13.1399 13.1399 13.3020 13.3020 13.6940 13.6940 13.8506 13.8506 k = 0.2613 0.7907 0.6350 ( 3052 PWs) bands (ev): 6.7085 6.7085 6.7107 6.7107 7.3036 7.3036 7.4261 7.4261 8.2570 8.2570 8.4663 8.4663 8.7113 8.7113 9.1687 9.1687 9.7170 9.7170 9.7921 9.7921 10.7322 10.7322 10.7647 10.7647 11.8978 11.8978 12.0192 12.0192 13.1564 13.1564 13.3297 13.3297 13.6840 13.6840 13.8087 13.8087 k = 0.2560 0.7745 0.6350 ( 3044 PWs) bands (ev): 6.7010 6.7010 6.7035 6.7035 7.3140 7.3140 7.4352 7.4352 8.2598 8.2598 8.4647 8.4647 8.7077 8.7077 9.1532 9.1532 9.7075 9.7075 9.7872 9.7872 10.7546 10.7546 10.8035 10.8035 11.8640 11.8640 11.9850 11.9850 13.1716 13.1716 13.3578 13.3578 13.6801 13.6801 13.7698 13.7698 k = 0.2506 0.7584 0.6350 ( 3040 PWs) bands (ev): 6.6946 6.6946 6.6975 6.6975 7.3252 7.3252 7.4454 7.4454 8.2641 8.2641 8.4628 8.4628 8.7057 8.7057 9.1368 9.1368 9.6957 9.6957 9.7818 9.7818 10.7619 10.7619 10.8307 10.8307 11.8356 11.8356 11.9587 11.9587 13.1835 13.1835 13.3842 13.3842 13.6821 13.6821 13.7344 13.7344 k = 0.2453 0.7423 0.6350 ( 3040 PWs) bands (ev): 6.6894 6.6894 6.6925 6.6925 7.3373 7.3373 7.4565 7.4565 8.2700 8.2700 8.4603 8.4603 8.7056 8.7056 9.1193 9.1193 9.6821 9.6821 9.7762 9.7762 10.7524 10.7524 10.8435 10.8435 11.8160 11.8160 11.9432 11.9432 13.1909 13.1909 13.4067 13.4067 13.6892 13.6892 13.7031 13.7031 k = 0.2400 0.7261 0.6350 ( 3036 PWs) bands (ev): 6.6853 6.6853 6.6886 6.6886 7.3503 7.3503 7.4687 7.4687 8.2775 8.2775 8.4569 8.4569 8.7079 8.7079 9.1008 9.1008 9.6666 9.6666 9.7706 9.7706 10.7258 10.7258 10.8402 10.8402 11.8079 11.8079 11.9399 11.9399 13.1935 13.1935 13.4235 13.4235 13.6767 13.6767 13.7002 13.7002 k = 0.2346 0.7100 0.6350 ( 3036 PWs) bands (ev): 6.6823 6.6823 6.6857 6.6857 7.3640 7.3640 7.4818 7.4818 8.2864 8.2864 8.4522 8.4522 8.7126 8.7126 9.0812 9.0812 9.6497 9.6497 9.7651 9.7651 10.6835 10.6835 10.8203 10.8203 11.8121 11.8121 11.9484 11.9484 13.1916 13.1916 13.4331 13.4331 13.6560 13.6560 13.7137 13.7137 k = 0.2293 0.6939 0.6350 ( 3036 PWs) bands (ev): 6.6804 6.6804 6.6838 6.6838 7.3784 7.3784 7.4958 7.4958 8.2968 8.2968 8.4460 8.4460 8.7200 8.7200 9.0607 9.0607 9.6314 9.6314 9.7596 9.7596 10.6278 10.6278 10.7854 10.7854 11.8278 11.8278 11.9670 11.9670 13.1860 13.1860 13.4343 13.4343 13.6410 13.6410 13.7281 13.7281 k = 0.2240 0.6777 0.6350 ( 3040 PWs) bands (ev): 6.6795 6.6795 6.6829 6.6829 7.3935 7.3935 7.5106 7.5106 8.3084 8.3084 8.4380 8.4380 8.7302 8.7302 9.0391 9.0391 9.6119 9.6119 9.7542 9.7542 10.5617 10.5617 10.7381 10.7381 11.8528 11.8528 11.9935 11.9935 13.1770 13.1770 13.4277 13.4277 13.6309 13.6309 13.7420 13.7420 k = 0.2186 0.6616 0.6350 ( 3040 PWs) bands (ev): 6.6797 6.6797 6.6829 6.6829 7.4092 7.4092 7.5263 7.5263 8.3212 8.3212 8.4282 8.4282 8.7430 8.7430 9.0167 9.0167 9.5914 9.5914 9.7486 9.7486 10.4882 10.4882 10.6814 10.6814 11.8845 11.8845 12.0255 12.0255 13.1652 13.1652 13.4146 13.4146 13.6239 13.6239 13.7545 13.7545 k = 0.2133 0.6454 0.6350 ( 3036 PWs) bands (ev): 6.6808 6.6808 6.6838 6.6838 7.4254 7.4254 7.5428 7.5428 8.3350 8.3350 8.4165 8.4165 8.7583 8.7583 8.9935 8.9935 9.5699 9.5699 9.7426 9.7426 10.4103 10.4103 10.6182 10.6182 11.9203 11.9203 12.0610 12.0610 13.1509 13.1509 13.3968 13.3968 13.6184 13.6184 13.7650 13.7650 k = 0.2080 0.6293 0.6350 ( 3036 PWs) bands (ev): 6.6828 6.6828 6.6855 6.6855 7.4420 7.4420 7.5599 7.5599 8.3493 8.3493 8.4027 8.4027 8.7761 8.7761 8.9698 8.9698 9.5477 9.5477 9.7354 9.7354 10.3308 10.3308 10.5511 10.5511 11.9582 11.9582 12.0984 12.0984 13.1342 13.1342 13.3753 13.3753 13.6129 13.6129 13.7730 13.7730 k = 0.2026 0.6132 0.6350 ( 3032 PWs) bands (ev): 6.6856 6.6856 6.6879 6.6879 7.4589 7.4589 7.5777 7.5777 8.3640 8.3640 8.3868 8.3868 8.7960 8.7960 8.9457 8.9457 9.5248 9.5248 9.7262 9.7262 10.2524 10.2524 10.4822 10.4822 11.9965 11.9965 12.1362 12.1362 13.1152 13.1152 13.3511 13.3511 13.6069 13.6069 13.7785 13.7785 k = 0.1973 0.5970 0.6350 ( 3028 PWs) bands (ev): 6.6892 6.6892 6.6909 6.6909 7.4760 7.4760 7.5961 7.5961 8.3689 8.3689 8.3786 8.3786 8.8177 8.8177 8.9218 8.9218 9.5014 9.5014 9.7134 9.7134 10.1780 10.1780 10.4131 10.4131 12.0338 12.0338 12.1734 12.1734 13.0938 13.0938 13.3244 13.3244 13.6004 13.6005 13.7816 13.7816 k = 0.1920 0.5809 0.6350 ( 3032 PWs) bands (ev): 6.6934 6.6934 6.6945 6.6945 7.4933 7.4933 7.6149 7.6149 8.3489 8.3489 8.3925 8.3925 8.8411 8.8411 8.8984 8.8984 9.4775 9.4775 9.6951 9.6951 10.1109 10.1109 10.3454 10.3454 12.0692 12.0692 12.2093 12.2093 13.0700 13.0700 13.2953 13.2953 13.5939 13.5939 13.7825 13.7825 k = 0.1866 0.5648 0.6350 ( 3024 PWs) bands (ev): 6.6982 6.6982 6.6985 6.6985 7.5105 7.5105 7.6341 7.6341 8.3268 8.3268 8.4050 8.4050 8.8655 8.8655 8.8759 8.8759 9.4535 9.4535 9.6690 9.6690 10.0545 10.0545 10.2802 10.2802 12.1018 12.1018 12.2432 12.2432 13.0440 13.0440 13.2640 13.2640 13.5877 13.5877 13.7817 13.7817 k = 0.1813 0.5486 0.6350 ( 3020 PWs) bands (ev): 6.7028 6.7028 6.7034 6.7034 7.5274 7.5274 7.6536 7.6536 8.3026 8.3026 8.4154 8.4154 8.8552 8.8552 8.8907 8.8907 9.4295 9.4295 9.6335 9.6335 10.0112 10.0112 10.2184 10.2184 12.1311 12.1311 12.2745 12.2745 13.0161 13.0161 13.2307 13.2307 13.5822 13.5822 13.7794 13.7794 k = 0.1760 0.5325 0.6350 ( 3020 PWs) bands (ev): 6.7073 6.7073 6.7089 6.7089 7.5440 7.5440 7.6733 7.6733 8.2765 8.2765 8.4228 8.4228 8.8366 8.8366 8.9160 8.9160 9.4061 9.4061 9.5892 9.5892 9.9816 9.9816 10.1609 10.1609 12.1565 12.1565 12.3027 12.3027 12.9867 12.9867 13.1959 13.1959 13.5778 13.5778 13.7762 13.7762 k = 0.1706 0.5164 0.6350 ( 3012 PWs) bands (ev): 6.7119 6.7119 6.7146 6.7146 7.5600 7.5600 7.6929 7.6929 8.2485 8.2485 8.4263 8.4263 8.8208 8.8208 8.9406 8.9406 9.3838 9.3838 9.5388 9.5388 9.9637 9.9637 10.1083 10.1083 12.1776 12.1776 12.3270 12.3270 12.9566 12.9566 13.1602 13.1602 13.5746 13.5746 13.7722 13.7722 k = 0.1653 0.5002 0.6350 ( 3020 PWs) bands (ev): 6.7164 6.7164 6.7204 6.7204 7.5751 7.5751 7.7124 7.7124 8.2188 8.2188 8.4254 8.4254 8.8077 8.8077 8.9635 8.9635 9.3637 9.3637 9.4863 9.4863 9.9549 9.9549 10.0610 10.0610 12.1939 12.1939 12.3466 12.3466 12.9270 12.9270 13.1247 13.1248 13.5727 13.5727 13.7676 13.7676 k = 0.1600 0.4841 0.6350 ( 3024 PWs) bands (ev): 6.7206 6.7206 6.7260 6.7260 7.5891 7.5891 7.7314 7.7314 8.1878 8.1878 8.4197 8.4197 8.7972 8.7972 8.9833 8.9833 9.3470 9.3470 9.4353 9.4353 9.9526 9.9526 10.0193 10.0193 12.2050 12.2050 12.3605 12.3605 12.8994 12.8994 13.0904 13.0904 13.5718 13.5718 13.7627 13.7627 k = 0.1547 0.4679 0.6350 ( 3024 PWs) bands (ev): 6.7245 6.7245 6.7313 6.7313 7.6018 7.6018 7.7498 7.7498 8.1556 8.1556 8.4095 8.4095 8.7882 8.7882 8.9984 8.9984 9.3355 9.3355 9.3889 9.3889 9.9549 9.9549 9.9835 9.9835 12.2105 12.2105 12.3675 12.3675 12.8754 12.8754 13.0583 13.0583 13.5718 13.5718 13.7575 13.7575 k = 0.1493 0.4518 0.6350 ( 3022 PWs) bands (ev): 6.7279 6.7279 6.7362 6.7362 7.6128 7.6128 7.7671 7.7671 8.1229 8.1229 8.3955 8.3955 8.7793 8.7793 9.0071 9.0071 9.3308 9.3308 9.3496 9.3496 9.9533 9.9533 9.9605 9.9605 12.2103 12.2103 12.3665 12.3665 12.8570 12.8570 13.0295 13.0295 13.5726 13.5726 13.7520 13.7520 k = 0.1440 0.4357 0.6350 ( 3026 PWs) bands (ev): 6.7306 6.7306 6.7404 6.7404 7.6219 7.6219 7.7828 7.7828 8.0903 8.0903 8.3785 8.3785 8.7691 8.7691 9.0086 9.0086 9.3192 9.3192 9.3339 9.3339 9.9288 9.9288 9.9686 9.9686 12.2041 12.2041 12.3567 12.3567 12.8455 12.8455 13.0050 13.0050 13.5739 13.5739 13.7462 13.7462 k = 0.1387 0.4195 0.6350 ( 3022 PWs) bands (ev): 6.7324 6.7324 6.7438 6.7438 7.6289 7.6289 7.7962 7.7962 8.0588 8.0588 8.3593 8.3593 8.7565 8.7565 9.0031 9.0031 9.2989 9.2989 9.3447 9.3447 9.9096 9.9096 9.9785 9.9785 12.1921 12.1921 12.3381 12.3381 12.8415 12.8415 12.9853 12.9853 13.5755 13.5755 13.7400 13.7400 k = 0.1333 0.4034 0.6350 ( 3026 PWs) bands (ev): 6.7331 6.7331 6.7461 6.7461 7.6335 7.6335 7.8061 7.8061 8.0298 8.0298 8.3389 8.3389 8.7414 8.7414 8.9920 8.9920 9.2888 9.2888 9.3621 9.3621 9.8954 9.8954 9.9898 9.9898 12.1748 12.1748 12.3119 12.3119 12.8447 12.8447 12.9708 12.9708 13.5773 13.5773 13.7334 13.7334 k = 0.1280 0.3873 0.6350 ( 3026 PWs) bands (ev): 6.7327 6.7327 6.7473 6.7473 7.6356 7.6356 7.8108 7.8108 8.0050 8.0050 8.3177 8.3177 8.7244 8.7244 8.9772 8.9772 9.2882 9.2882 9.3841 9.3841 9.8860 9.8860 10.0021 10.0021 12.1526 12.1526 12.2794 12.2794 12.8543 12.8543 12.9617 12.9617 13.5790 13.5790 13.7263 13.7263 k = 0.1227 0.3711 0.6350 ( 3026 PWs) bands (ev): 6.7310 6.7310 6.7470 6.7470 7.6353 7.6353 7.8086 7.8086 7.9865 7.9865 8.2962 8.2962 8.7067 8.7067 8.9603 8.9603 9.2956 9.2956 9.4093 9.4093 9.8809 9.8809 10.0152 10.0152 12.1266 12.1266 12.2426 12.2426 12.8689 12.8689 12.9575 12.9575 13.5805 13.5805 13.7186 13.7186 k = 0.1173 0.3550 0.6350 ( 3026 PWs) bands (ev): 6.7279 6.7279 6.7452 6.7452 7.6327 7.6327 7.7985 7.7985 7.9756 7.9756 8.2745 8.2745 8.6899 8.6899 8.9428 8.9428 9.3095 9.3095 9.4361 9.4361 9.8799 9.8799 10.0288 10.0288 12.0975 12.0975 12.2029 12.2029 12.8876 12.8876 12.9580 12.9580 13.5819 13.5819 13.7105 13.7105 k = 0.1120 0.3389 0.6350 ( 3020 PWs) bands (ev): 6.7233 6.7233 6.7417 6.7417 7.6279 7.6279 7.7813 7.7813 7.9715 7.9715 8.2526 8.2526 8.6752 8.6752 8.9257 8.9257 9.3283 9.3283 9.4636 9.4636 9.8825 9.8825 10.0426 10.0426 12.0665 12.0665 12.1618 12.1618 12.9094 12.9094 12.9627 12.9627 13.5829 13.5829 13.7018 13.7018 k = 0.1067 0.3227 0.6350 ( 3028 PWs) bands (ev): 6.7171 6.7171 6.7364 6.7364 7.6215 7.6215 7.7595 7.7595 7.9719 7.9719 8.2305 8.2305 8.6637 8.6637 8.9098 8.9098 9.3507 9.3507 9.4911 9.4911 9.8884 9.8884 10.0566 10.0566 12.0344 12.0344 12.1204 12.1204 12.9336 12.9336 12.9709 12.9709 13.5836 13.5836 13.6925 13.6925 k = 0.1013 0.3066 0.6350 ( 3024 PWs) bands (ev): 6.7094 6.7094 6.7294 6.7294 7.6137 7.6137 7.7353 7.7353 7.9748 7.9748 8.2082 8.2082 8.6561 8.6561 8.8955 8.8955 9.3756 9.3756 9.5178 9.5178 9.8973 9.8973 10.0706 10.0706 12.0022 12.0022 12.0796 12.0796 12.9596 12.9596 12.9822 12.9822 13.5840 13.5840 13.6827 13.6827 k = 0.0960 0.2904 0.6350 ( 3028 PWs) bands (ev): 6.7002 6.7002 6.7205 6.7205 7.6050 7.6050 7.7105 7.7105 7.9785 7.9785 8.1856 8.1856 8.6525 8.6525 8.8833 8.8833 9.4021 9.4021 9.5435 9.5435 9.9087 9.9087 10.0842 10.0842 11.9705 11.9705 12.0401 12.0401 12.9870 12.9870 12.9961 12.9961 13.5840 13.5840 13.6724 13.6724 k = 0.0907 0.2743 0.6350 ( 3024 PWs) bands (ev): 6.6895 6.6895 6.7100 6.7100 7.5959 7.5959 7.6862 7.6862 7.9820 7.9820 8.1631 8.1631 8.6531 8.6531 8.8733 8.8733 9.4294 9.4294 9.5679 9.5679 9.9221 9.9221 10.0975 10.0975 11.9400 11.9400 12.0024 12.0024 13.0122 13.0122 13.0154 13.0154 13.5838 13.5838 13.6617 13.6617 k = 0.0853 0.2582 0.6350 ( 3024 PWs) bands (ev): 6.6776 6.6776 6.6980 6.6980 7.5866 7.5866 7.6629 7.6629 7.9850 7.9850 8.1407 8.1407 8.6573 8.6573 8.8655 8.8655 9.4569 9.4569 9.5907 9.5907 9.9372 9.9372 10.1102 10.1102 11.9111 11.9111 11.9669 11.9669 13.0301 13.0301 13.0445 13.0445 13.5832 13.5832 13.6505 13.6505 k = 0.0800 0.2420 0.6350 ( 3028 PWs) bands (ev): 6.6647 6.6647 6.6846 6.6846 7.5774 7.5774 7.6411 7.6411 7.9870 7.9870 8.1187 8.1187 8.6648 8.6648 8.8599 8.8599 9.4842 9.4842 9.6120 9.6120 9.9534 9.9534 10.1223 10.1223 11.8841 11.8841 11.9340 11.9340 13.0495 13.0495 13.0741 13.0741 13.5824 13.5824 13.6391 13.6391 k = 0.0747 0.2259 0.6350 ( 3028 PWs) bands (ev): 6.6509 6.6509 6.6701 6.6701 7.5685 7.5685 7.6209 7.6209 7.9880 7.9880 8.0976 8.0976 8.6751 8.6751 8.8564 8.8564 9.5108 9.5108 9.6315 9.6315 9.9704 9.9704 10.1334 10.1334 11.8595 11.8595 11.9038 11.9038 13.0700 13.0700 13.1038 13.1038 13.5814 13.5814 13.6273 13.6273 k = 0.0693 0.2098 0.6350 ( 3036 PWs) bands (ev): 6.6365 6.6365 6.6548 6.6548 7.5600 7.5600 7.6024 7.6024 7.9880 7.9880 8.0775 8.0775 8.6876 8.6876 8.8548 8.8548 9.5365 9.5365 9.6494 9.6494 9.9878 9.9878 10.1436 10.1436 11.8373 11.8373 11.8764 11.8764 13.0915 13.0915 13.1334 13.1334 13.5801 13.5801 13.6155 13.6155 k = 0.0640 0.1936 0.6350 ( 3044 PWs) bands (ev): 6.6218 6.6218 6.6391 6.6391 7.5521 7.5521 7.5856 7.5856 7.9872 7.9872 8.0587 8.0587 8.7018 8.7018 8.8548 8.8548 9.5610 9.5610 9.6657 9.6657 10.0053 10.0053 10.1527 10.1527 11.8177 11.8177 11.8520 11.8520 13.1136 13.1136 13.1627 13.1627 13.5787 13.5787 13.6035 13.6035 k = 0.0587 0.1775 0.6350 ( 3048 PWs) bands (ev): 6.6070 6.6070 6.6232 6.6232 7.5446 7.5446 7.5705 7.5705 7.9855 7.9855 8.0414 8.0414 8.7171 8.7171 8.8560 8.8560 9.5841 9.5841 9.6802 9.6802 10.0224 10.0224 10.1607 10.1607 11.8005 11.8005 11.8304 11.8304 13.1361 13.1361 13.1913 13.1913 13.5771 13.5771 13.5916 13.5916 k = 0.0533 0.1614 0.6350 ( 3044 PWs) bands (ev): 6.5926 6.5926 6.6075 6.6075 7.5376 7.5376 7.5571 7.5571 7.9832 7.9832 8.0258 8.0258 8.7332 8.7332 8.8581 8.8581 9.6057 9.6057 9.6931 9.6931 10.0392 10.0392 10.1674 10.1674 11.7858 11.7858 11.8116 11.8116 13.1587 13.1587 13.2188 13.2188 13.5753 13.5753 13.5800 13.5800 k = 0.0480 0.1452 0.6350 ( 3042 PWs) bands (ev): 6.5787 6.5787 6.5922 6.5922 7.5311 7.5311 7.5452 7.5452 7.9804 7.9804 8.0119 8.0119 8.7495 8.7495 8.8609 8.8609 9.6256 9.6256 9.7043 9.7043 10.0552 10.0552 10.1728 10.1728 11.7734 11.7734 11.7955 11.7955 13.1811 13.1811 13.2451 13.2451 13.5687 13.5687 13.5733 13.5733 k = 0.0427 0.1291 0.6350 ( 3042 PWs) bands (ev): 6.5656 6.5656 6.5777 6.5777 7.5251 7.5251 7.5349 7.5349 7.9773 7.9773 7.9998 7.9998 8.7658 8.7658 8.8638 8.8638 9.6439 9.6439 9.7137 9.7137 10.0706 10.0706 10.1768 10.1768 11.7632 11.7632 11.7819 11.7819 13.2032 13.2032 13.2695 13.2695 13.5580 13.5580 13.5709 13.5709 k = 0.0373 0.1130 0.6350 ( 3054 PWs) bands (ev): 6.5535 6.5535 6.5641 6.5641 7.5196 7.5196 7.5259 7.5259 7.9741 7.9741 7.9894 7.9894 8.7816 8.7816 8.8667 8.8667 9.6604 9.6604 9.7215 9.7215 10.0851 10.0851 10.1795 10.1795 11.7550 11.7550 11.7706 11.7706 13.2247 13.2247 13.2917 13.2917 13.5482 13.5482 13.5682 13.5682 k = 0.0320 0.0968 0.6350 ( 3058 PWs) bands (ev): 6.5428 6.5428 6.5519 6.5519 7.5146 7.5146 7.5183 7.5183 7.9709 7.9709 7.9807 7.9807 8.7967 8.7967 8.8691 8.8691 9.6752 9.6752 9.7276 9.7276 10.0987 10.0987 10.1807 10.1807 11.7486 11.7486 11.7613 11.7613 13.2453 13.2453 13.3110 13.3110 13.5397 13.5397 13.5650 13.5650 k = 0.0267 0.0807 0.6350 ( 3066 PWs) bands (ev): 6.5334 6.5334 6.5410 6.5410 7.5101 7.5101 7.5121 7.5121 7.9679 7.9679 7.9737 7.9737 8.8108 8.8108 8.8707 8.8707 9.6883 9.6883 9.7320 9.7320 10.1115 10.1115 10.1806 10.1806 11.7437 11.7437 11.7538 11.7538 13.2648 13.2648 13.3268 13.3268 13.5330 13.5330 13.5613 13.5613 k = 0.0213 0.0645 0.6350 ( 3062 PWs) bands (ev): 6.5257 6.5257 6.5318 6.5318 7.5063 7.5063 7.5071 7.5071 7.9651 7.9651 7.9683 7.9683 8.8238 8.8238 8.8714 8.8714 9.6998 9.6998 9.7347 9.7347 10.1233 10.1233 10.1791 10.1791 11.7401 11.7401 11.7479 11.7479 13.2831 13.2831 13.3384 13.3384 13.5286 13.5286 13.5570 13.5570 k = 0.0160 0.0484 0.6350 ( 3050 PWs) bands (ev): 6.5198 6.5198 6.5243 6.5243 7.5032 7.5032 7.5033 7.5033 7.9628 7.9628 7.9643 7.9643 8.8353 8.8353 8.8709 8.8709 9.7096 9.7096 9.7358 9.7358 10.1341 10.1341 10.1763 10.1763 11.7377 11.7377 11.7434 11.7434 13.2999 13.2999 13.3452 13.3452 13.5268 13.5268 13.5521 13.5521 k = 0.0107 0.0323 0.6350 ( 3050 PWs) bands (ev): 6.5156 6.5156 6.5187 6.5187 7.5007 7.5007 7.5009 7.5009 7.9610 7.9610 7.9615 7.9615 8.8454 8.8454 8.8690 8.8690 9.7179 9.7179 9.7354 9.7354 10.1439 10.1439 10.1722 10.1722 11.7364 11.7364 11.7401 11.7401 13.3148 13.3148 13.3470 13.3470 13.5277 13.5277 13.5467 13.5467 k = 0.0053 0.0161 0.6350 ( 3046 PWs) bands (ev): 6.5134 6.5134 6.5150 6.5150 7.4993 7.4993 7.4994 7.4994 7.9598 7.9598 7.9600 7.9600 8.8538 8.8538 8.8656 8.8656 9.7245 9.7245 9.7333 9.7333 10.1527 10.1527 10.1669 10.1669 11.7360 11.7360 11.7378 11.7378 13.3275 13.3275 13.3443 13.3443 13.5309 13.5309 13.5411 13.5411 k = 0.0000 0.0000 0.6350 ( 3046 PWs) bands (ev): 6.5132 6.5132 6.5132 6.5132 7.4988 7.4988 7.4988 7.4988 7.9594 7.9594 7.9594 7.9594 8.8605 8.8605 8.8605 8.8605 9.7297 9.7297 9.7297 9.7297 10.1603 10.1603 10.1603 10.1603 11.7365 11.7365 11.7365 11.7365 13.3375 13.3375 13.3375 13.3376 13.5356 13.5356 13.5356 13.5356 k = 0.0000 0.0000 0.6350 ( 3046 PWs) bands (ev): 6.5132 6.5132 6.5132 6.5132 7.4988 7.4988 7.4988 7.4988 7.9594 7.9594 7.9594 7.9594 8.8605 8.8605 8.8605 8.8605 9.7297 9.7297 9.7297 9.7297 10.1603 10.1603 10.1603 10.1603 11.7365 11.7365 11.7365 11.7365 13.3375 13.3375 13.3375 13.3376 13.5356 13.5356 13.5356 13.5356 k = 0.0000 0.0000 0.6178 ( 3046 PWs) bands (ev): 6.4534 6.4534 6.5674 6.5674 7.4501 7.4501 7.5493 7.5493 7.9390 7.9390 7.9791 7.9791 8.8546 8.8546 8.8654 8.8654 9.6825 9.6825 9.7796 9.7796 10.1327 10.1327 10.1882 10.1882 11.6537 11.6537 11.8205 11.8205 13.2878 13.2878 13.3816 13.3816 13.5188 13.5188 13.5613 13.5613 k = 0.0000 0.0000 0.6007 ( 3042 PWs) bands (ev): 6.3885 6.3885 6.6155 6.6155 7.4036 7.4036 7.6008 7.6008 7.9177 7.9177 7.9983 7.9983 8.8478 8.8478 8.8691 8.8691 9.6385 9.6385 9.8312 9.8312 10.1071 10.1071 10.2149 10.2149 11.5731 11.5731 11.9053 11.9053 13.2396 13.2396 13.4043 13.4043 13.5228 13.5228 13.5928 13.5928 k = 0.0000 0.0000 0.5835 ( 3044 PWs) bands (ev): 6.3189 6.3189 6.6574 6.6574 7.3597 7.3597 7.6524 7.6524 7.8953 7.8953 8.0176 8.0176 8.8402 8.8402 8.8714 8.8714 9.5976 9.5976 9.8815 9.8815 10.0872 10.0872 10.2394 10.2394 11.4954 11.4954 11.9903 11.9903 13.1959 13.1959 13.3991 13.3991 13.5473 13.5473 13.6332 13.6332 k = 0.0000 0.0000 0.5664 ( 3036 PWs) bands (ev): 6.2454 6.2454 6.6928 6.6928 7.3187 7.3187 7.7029 7.7029 7.8718 7.8718 8.0376 8.0376 8.8319 8.8319 8.8723 8.8723 9.5599 9.5599 9.9226 9.9226 10.0808 10.0808 10.2607 10.2607 11.4219 11.4219 12.0752 12.0752 13.1585 13.1585 13.3818 13.3818 13.5712 13.5712 13.6863 13.6863 k = 0.0000 0.0000 0.5492 ( 3036 PWs) bands (ev): 6.1685 6.1685 6.7217 6.7217 7.2808 7.2808 7.7508 7.7508 7.8474 7.8474 8.0595 8.0595 8.8229 8.8229 8.8714 8.8714 9.5252 9.5252 9.9418 9.9418 10.1003 10.1003 10.2780 10.2780 11.3541 11.3541 12.1597 12.1597 13.1285 13.1285 13.3621 13.3621 13.5861 13.5861 13.7489 13.7490 k = 0.0000 0.0000 0.5320 ( 3036 PWs) bands (ev): 6.0888 6.0888 6.7442 6.7442 7.2461 7.2461 7.7929 7.7929 7.8233 7.8233 8.0845 8.0845 8.8134 8.8134 8.8687 8.8687 9.4934 9.4934 9.9393 9.9393 10.1442 10.1442 10.2907 10.2907 11.2943 11.2943 12.2433 12.2433 13.1069 13.1069 13.3434 13.3434 13.5929 13.5929 13.8162 13.8162 k = 0.0000 0.0000 0.5149 ( 3030 PWs) bands (ev): 6.0071 6.0071 6.7606 6.7606 7.2145 7.2145 7.7928 7.7928 7.8340 7.8340 8.1142 8.1142 8.8034 8.8034 8.8642 8.8642 9.4645 9.4645 9.9273 9.9273 10.1979 10.1979 10.2984 10.2984 11.2453 11.2453 12.3259 12.3259 13.0940 13.0940 13.3269 13.3269 13.5929 13.5929 13.8846 13.8846 k = 0.0000 0.0000 0.4977 ( 3038 PWs) bands (ev): 5.9239 5.9239 6.7713 6.7713 7.1858 7.1858 7.7660 7.7660 7.8625 7.8625 8.1494 8.1494 8.7933 8.7933 8.8578 8.8578 9.4384 9.4384 9.9132 9.9132 10.2491 10.2491 10.3024 10.3024 11.2109 11.2109 12.4069 12.4069 13.0904 13.0904 13.3132 13.3132 13.5873 13.5873 13.9518 13.9518 k = 0.0000 0.0000 0.4805 ( 3036 PWs) bands (ev): 5.8397 5.8397 6.7771 6.7771 7.1598 7.1598 7.7378 7.7378 7.8832 7.8832 8.1895 8.1895 8.7833 8.7833 8.8497 8.8497 9.4153 9.4153 9.8997 9.8997 10.2787 10.2787 10.3145 10.3145 11.1956 11.1956 12.4860 12.4860 13.0961 13.0961 13.3026 13.3026 13.5771 13.5771 14.0161 14.0161 k = 0.0000 0.0000 0.4634 ( 3040 PWs) bands (ev): 5.7552 5.7552 6.7785 6.7785 7.1360 7.1360 7.7087 7.7087 7.8963 7.8963 8.2329 8.2329 8.7741 8.7741 8.8403 8.8403 9.3951 9.3951 9.8877 9.8877 10.2747 10.2747 10.3420 10.3420 11.2033 11.2033 12.5626 12.5626 13.1108 13.1108 13.2953 13.2953 13.5635 13.5635 14.0759 14.0759 k = 0.0000 0.0000 0.4462 ( 3048 PWs) bands (ev): 5.6708 5.6708 6.7766 6.7766 7.1139 7.1139 7.6791 7.6791 7.9026 7.9026 8.2768 8.2768 8.7669 8.7669 8.8301 8.8301 9.3781 9.3781 9.8776 9.8776 10.2586 10.2586 10.3604 10.3604 11.2365 11.2365 12.6361 12.6361 13.1339 13.1339 13.2916 13.2916 13.5477 13.5477 14.1300 14.1300 k = 0.0000 0.0000 0.4291 ( 3052 PWs) bands (ev): 5.5869 5.5869 6.7722 6.7722 7.0931 7.0931 7.6489 7.6489 7.9032 7.9032 8.3178 8.3178 8.7627 8.7627 8.8201 8.8201 9.3641 9.3641 9.8692 9.8692 10.2361 10.2361 10.3654 10.3654 11.2944 11.2944 12.7054 12.7054 13.1638 13.1638 13.2923 13.2923 13.5312 13.5312 14.1774 14.1774 k = 0.0000 0.0000 0.4119 ( 3056 PWs) bands (ev): 5.5041 5.5041 6.7661 6.7661 7.0732 7.0732 7.6185 7.6185 7.8989 7.8989 8.3520 8.3520 8.7625 8.7625 8.8126 8.8126 9.3533 9.3533 9.8620 9.8620 10.2088 10.2088 10.3588 10.3588 11.3735 11.3735 12.7693 12.7693 13.1970 13.1970 13.3000 13.3000 13.5159 13.5159 14.2175 14.2175 k = 0.0000 0.0000 0.3947 ( 3056 PWs) bands (ev): 5.4225 5.4225 6.7591 6.7591 7.0536 7.0536 7.5879 7.5879 7.8902 7.8902 8.3760 8.3760 8.7633 8.7633 8.8135 8.8135 9.3457 9.3457 9.8557 9.8557 10.1782 10.1782 10.3441 10.3441 11.4694 11.4694 12.8258 12.8258 13.2262 13.2262 13.3210 13.3210 13.5038 13.5038 14.2501 14.2501 k = 0.0000 0.0000 0.3776 ( 3048 PWs) bands (ev): 5.3426 5.3426 6.7518 6.7518 7.0343 7.0343 7.5573 7.5573 7.8776 7.8776 8.3878 8.3878 8.7595 8.7595 8.8300 8.8300 9.3415 9.3415 9.8494 9.8494 10.1461 10.1461 10.3243 10.3243 11.5780 11.5780 12.8722 12.8722 13.2453 13.2453 13.3608 13.3608 13.4976 13.4976 14.2754 14.2754 k = 0.0000 0.0000 0.3604 ( 3048 PWs) bands (ev): 5.2647 5.2647 6.7449 6.7449 7.0151 7.0151 7.5269 7.5269 7.8613 7.8613 8.3877 8.3877 8.7515 8.7515 8.8610 8.8610 9.3408 9.3408 9.8424 9.8424 10.1145 10.1145 10.3019 10.3019 11.6958 11.6958 12.9052 12.9052 13.2585 13.2585 13.4157 13.4157 13.4994 13.4994 14.2938 14.2938 k = 0.0000 0.0000 0.3432 ( 3044 PWs) bands (ev): 5.1891 5.1891 6.7386 6.7386 6.9958 6.9958 7.4968 7.4968 7.8414 7.8414 8.3778 8.3778 8.7423 8.7423 8.9007 8.9007 9.3438 9.3438 9.8338 9.8338 10.0854 10.0854 10.2783 10.2783 11.8201 11.8201 12.9214 12.9214 13.2724 13.2724 13.4797 13.4797 13.5108 13.5108 14.3061 14.3061 k = 0.0000 0.0000 0.3261 ( 3044 PWs) bands (ev): 5.1159 5.1159 6.7334 6.7334 6.9766 6.9766 7.4671 7.4671 7.8181 7.8181 8.3609 8.3609 8.7333 8.7333 8.9441 8.9441 9.3506 9.3506 9.8231 9.8231 10.0605 10.0605 10.2548 10.2548 11.9489 11.9489 12.9195 12.9195 13.2903 13.2903 13.5317 13.5317 13.5499 13.5499 14.3132 14.3132 k = 0.0000 0.0000 0.3089 ( 3038 PWs) bands (ev): 5.0455 5.0455 6.7294 6.7294 6.9575 6.9575 7.4381 7.4381 7.7916 7.7916 8.3394 8.3394 8.7253 8.7253 8.9873 8.9873 9.3612 9.3612 9.8108 9.8108 10.0412 10.0412 10.2321 10.2321 12.0803 12.0803 12.9008 12.9008 13.3124 13.3124 13.5623 13.5623 13.6239 13.6239 14.3160 14.3160 k = 0.0000 0.0000 0.2918 ( 3026 PWs) bands (ev): 4.9779 4.9779 6.7269 6.7269 6.9387 6.9387 7.4098 7.4098 7.7620 7.7620 8.3150 8.3150 8.7188 8.7188 9.0271 9.0271 9.3745 9.3745 9.7988 9.7988 10.0278 10.0278 10.2107 10.2107 12.2128 12.2128 12.8687 12.8687 13.3371 13.3371 13.6005 13.6005 13.7008 13.7008 14.3153 14.3153 k = 0.0000 0.0000 0.2746 ( 3032 PWs) bands (ev): 4.9134 4.9134 6.7260 6.7260 6.9202 6.9202 7.3823 7.3823 7.7296 7.7296 8.2891 8.2891 8.7140 8.7140 9.0615 9.0615 9.3879 9.3879 9.7910 9.7910 10.0196 10.0196 10.1913 10.1913 12.3449 12.3449 12.8262 12.8262 13.3632 13.3632 13.6445 13.6445 13.7799 13.7799 14.3118 14.3118 k = 0.0000 0.0000 0.2574 ( 3028 PWs) bands (ev): 4.8522 4.8522 6.7267 6.7267 6.9024 6.9024 7.3559 7.3559 7.6946 7.6946 8.2626 8.2626 8.7112 8.7112 9.0895 9.0895 9.3972 9.3972 9.7921 9.7921 10.0156 10.0156 10.1742 10.1742 12.4751 12.4751 12.7764 12.7764 13.3901 13.3901 13.6920 13.6920 13.8602 13.8602 14.3063 14.3063 k = 0.0000 0.0000 0.2403 ( 3034 PWs) bands (ev): 4.7943 4.7943 6.7289 6.7289 6.8854 6.8854 7.3306 7.3306 7.6574 7.6574 8.2362 8.2362 8.7104 8.7104 9.1116 9.1116 9.3979 9.3979 9.8065 9.8065 10.0147 10.0147 10.1599 10.1599 12.6005 12.6005 12.7226 12.7226 13.4174 13.4174 13.7414 13.7414 13.9412 13.9412 14.2992 14.2992 k = 0.0000 0.0000 0.2231 ( 3038 PWs) bands (ev): 4.7399 4.7399 6.7325 6.7325 6.8696 6.8696 7.3066 7.3066 7.6183 7.6183 8.2105 8.2105 8.7117 8.7117 9.1287 9.1287 9.3878 9.3878 9.8349 9.8349 10.0158 10.0158 10.1493 10.1493 12.6510 12.6510 12.7350 12.7350 13.4451 13.4451 13.7911 13.7911 14.0221 14.0221 14.2911 14.2911 k = 0.0000 0.0000 0.2059 ( 3042 PWs) bands (ev): 4.6891 4.6891 6.7372 6.7372 6.8556 6.8556 7.2839 7.2839 7.5777 7.5777 8.1858 8.1858 8.7153 8.7153 9.1418 9.1418 9.3675 9.3675 9.8742 9.8742 10.0182 10.0182 10.1436 10.1436 12.5912 12.5912 12.8489 12.8489 13.4732 13.4732 13.8399 13.8399 14.1023 14.1023 14.2824 14.2824 k = 0.0000 0.0000 0.1888 ( 3042 PWs) bands (ev): 4.6421 4.6421 6.7424 6.7424 6.8440 6.8440 7.2626 7.2626 7.5360 7.5360 8.1625 8.1625 8.7211 8.7211 9.1520 9.1520 9.3399 9.3399 9.9182 9.9182 10.0215 10.0215 10.1455 10.1455 12.5252 12.5252 12.9597 12.9597 13.5014 13.5014 13.8869 13.8869 14.1810 14.1810 14.2733 14.2733 k = 0.0000 0.0000 0.1716 ( 3050 PWs) bands (ev): 4.5989 4.5989 6.7470 6.7470 6.8360 6.8360 7.2430 7.2430 7.4937 7.4937 8.1406 8.1406 8.7292 8.7292 9.1599 9.1599 9.3074 9.3074 9.9584 9.9584 10.0255 10.0255 10.1593 10.1593 12.4571 12.4571 13.0632 13.0632 13.5296 13.5296 13.9314 13.9314 14.2558 14.2558 14.2657 14.2657 k = 0.0000 0.0000 0.1545 ( 3050 PWs) bands (ev): 4.5595 4.5595 6.7495 6.7495 6.8332 6.8332 7.2249 7.2249 7.4511 7.4511 8.1205 8.1205 8.7396 8.7396 9.1660 9.1660 9.2722 9.2722 9.9868 9.9868 10.0306 10.0306 10.1894 10.1894 12.3883 12.3883 13.1580 13.1580 13.5572 13.5572 13.9728 13.9728 14.2545 14.2545 14.3316 14.3316 k = 0.0000 0.0000 0.1373 ( 3042 PWs) bands (ev): 4.5241 4.5241 6.7488 6.7488 6.8365 6.8365 7.2086 7.2086 7.4088 7.4088 8.1023 8.1023 8.7521 8.7521 9.1701 9.1701 9.2361 9.2361 10.0012 10.0012 10.0368 10.0368 10.2352 10.2352 12.3198 12.3198 13.2432 13.2432 13.5838 13.5838 14.0107 14.0107 14.2459 14.2459 14.4015 14.4015 k = 0.0000 0.0000 0.1201 ( 3047 PWs) bands (ev): 4.4928 4.4928 6.7453 6.7453 6.8457 6.8457 7.1941 7.1941 7.3671 7.3671 8.0860 8.0860 8.7667 8.7667 9.1700 9.1700 9.2027 9.2027 10.0064 10.0064 10.0429 10.0429 10.2907 10.2907 12.2527 12.2527 13.3185 13.3185 13.6083 13.6083 14.0447 14.0447 14.2377 14.2377 14.4669 14.4669 k = 0.0000 0.0000 0.1030 ( 3043 PWs) bands (ev): 4.4655 4.4655 6.7402 6.7402 6.8592 6.8592 7.1815 7.1815 7.3267 7.3267 8.0717 8.0717 8.7833 8.7833 9.1515 9.1515 9.1873 9.1873 10.0077 10.0077 10.0480 10.0480 10.3496 10.3496 12.1884 12.1884 13.3838 13.3838 13.6300 13.6300 14.0746 14.0746 14.2303 14.2303 14.5270 14.5270 k = 0.0000 0.0000 0.0858 ( 3039 PWs) bands (ev): 4.4424 4.4424 6.7347 6.7347 6.8756 6.8756 7.1709 7.1709 7.2881 7.2881 8.0595 8.0595 8.8018 8.8018 9.1183 9.1183 9.1867 9.1867 10.0073 10.0073 10.0522 10.0522 10.4072 10.4072 12.1286 12.1286 13.4395 13.4395 13.6478 13.6478 14.1001 14.1001 14.2240 14.2240 14.5810 14.5810 k = 0.0000 0.0000 0.0686 ( 3039 PWs) bands (ev): 4.4234 4.4234 6.7296 6.7296 6.8934 6.8934 7.1624 7.1624 7.2521 7.2521 8.0495 8.0495 8.8218 8.8218 9.0840 9.0840 9.1879 9.1879 10.0063 10.0063 10.0555 10.0555 10.4601 10.4601 12.0751 12.0751 13.4860 13.4860 13.6611 13.6611 14.1209 14.1209 14.2188 14.2188 14.6280 14.6280 k = 0.0000 0.0000 0.0515 ( 3039 PWs) bands (ev): 4.4085 4.4085 6.7253 6.7253 6.9113 6.9113 7.1562 7.1562 7.2197 7.2197 8.0416 8.0416 8.8428 8.8428 9.0514 9.0514 9.1892 9.1892 10.0052 10.0052 10.0580 10.0580 10.5052 10.5052 12.0300 12.0300 13.5237 13.5237 13.6695 13.6695 14.1369 14.1369 14.2151 14.2151 14.6674 14.6674 k = 0.0000 0.0000 0.0343 ( 3043 PWs) bands (ev): 4.3980 4.3980 6.7221 6.7221 6.9273 6.9273 7.1528 7.1528 7.1924 7.1924 8.0360 8.0360 8.8635 8.8635 9.0221 9.0221 9.1901 9.1901 10.0043 10.0043 10.0598 10.0598 10.5399 10.5399 11.9957 11.9957 13.5522 13.5522 13.6736 13.6736 14.1480 14.1480 14.2127 14.2127 14.6988 14.6988 k = 0.0000 0.0000 0.0172 ( 3047 PWs) bands (ev): 4.3916 4.3916 6.7201 6.7201 6.9388 6.9388 7.1531 7.1531 7.1717 7.1717 8.0326 8.0326 8.8811 8.8811 8.9994 8.9994 9.1907 9.1907 10.0037 10.0037 10.0609 10.0609 10.5618 10.5618 11.9741 11.9741 13.5706 13.5706 13.6746 13.6746 14.1544 14.1544 14.2115 14.2115 14.7218 14.7218 k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): 4.3895 4.3895 6.7194 6.7194 6.9431 6.9431 7.1579 7.1579 7.1598 7.1598 8.0315 8.0315 8.8888 8.8888 8.9900 8.9900 9.1909 9.1909 10.0035 10.0035 10.0613 10.0613 10.5693 10.5693 11.9667 11.9667 13.5771 13.5771 13.6746 13.6746 14.1565 14.1565 14.2112 14.2112 14.7374 14.7374 k = 0.0000 0.0000 0.0000 ( 3045 PWs) bands (ev): 4.3895 4.3895 6.7194 6.7194 6.9431 6.9431 7.1579 7.1579 7.1598 7.1598 8.0315 8.0315 8.8888 8.8888 8.9900 8.9900 9.1909 9.1909 10.0035 10.0035 10.0613 10.0613 10.5693 10.5693 11.9667 11.9667 13.5771 13.5771 13.6746 13.6746 14.1565 14.1565 14.2112 14.2112 14.7374 14.7374 k =-0.0161 0.0053 0.0000 ( 3043 PWs) bands (ev): 4.3913 4.3913 6.7203 6.7203 6.9441 6.9441 7.1572 7.1572 7.1587 7.1587 8.0311 8.0311 8.8892 8.8892 8.9875 8.9875 9.1918 9.1918 9.9973 9.9973 10.0669 10.0669 10.5677 10.5677 11.9658 11.9658 13.5776 13.5776 13.6738 13.6738 14.1575 14.1575 14.2136 14.2136 14.7196 14.7196 k =-0.0323 0.0107 0.0000 ( 3048 PWs) bands (ev): 4.3970 4.3970 6.7227 6.7227 6.9469 6.9469 7.1551 7.1551 7.1555 7.1555 8.0298 8.0298 8.8907 8.8907 8.9801 8.9801 9.1942 9.1942 9.9826 9.9826 10.0797 10.0797 10.5627 10.5627 11.9631 11.9631 13.5790 13.5790 13.6714 13.6714 14.1603 14.1603 14.2207 14.2207 14.6888 14.6888 k =-0.0484 0.0160 0.0000 ( 3044 PWs) bands (ev): 4.4063 4.4063 6.7266 6.7266 6.9515 6.9515 7.1501 7.1501 7.1520 7.1520 8.0278 8.0278 8.8931 8.8931 8.9683 8.9683 9.1978 9.1978 9.9643 9.9643 10.0947 10.0947 10.5545 10.5545 11.9589 11.9589 13.5813 13.5813 13.6675 13.6675 14.1645 14.1645 14.2327 14.2327 14.6448 14.6448 k =-0.0645 0.0213 0.0000 ( 3044 PWs) bands (ev): 4.4194 4.4194 6.7321 6.7321 6.9578 6.9578 7.1428 7.1428 7.1476 7.1476 8.0250 8.0250 8.8963 8.8963 8.9525 8.9525 9.2021 9.2021 9.9441 9.9441 10.1103 10.1103 10.5431 10.5431 11.9531 11.9531 13.5841 13.5841 13.6620 13.6620 14.1696 14.1696 14.2493 14.2493 14.5921 14.5921 k =-0.0806 0.0267 0.0000 ( 3032 PWs) bands (ev): 4.4361 4.4361 6.7390 6.7390 6.9657 6.9657 7.1335 7.1335 7.1424 7.1424 8.0214 8.0214 8.9004 8.9004 8.9334 8.9334 9.2065 9.2065 9.9226 9.9226 10.1256 10.1256 10.5287 10.5287 11.9461 11.9461 13.5869 13.5869 13.6550 13.6550 14.1752 14.1752 14.2688 14.2688 14.5368 14.5368 k =-0.0968 0.0320 0.0000 ( 3024 PWs) bands (ev): 4.4564 4.4564 6.7471 6.7471 6.9749 6.9749 7.1225 7.1225 7.1366 7.1366 8.0173 8.0173 8.9038 8.9038 8.9127 8.9127 9.2108 9.2108 9.8999 9.8999 10.1403 10.1403 10.5113 10.5113 11.9381 11.9381 13.5894 13.5894 13.6465 13.6465 14.1805 14.1805 14.2874 14.2874 14.4873 14.4873 k =-0.1129 0.0373 0.0000 ( 3030 PWs) bands (ev): 4.4803 4.4803 6.7562 6.7562 6.9849 6.9849 7.1100 7.1100 7.1308 7.1308 8.0125 8.0125 8.8852 8.8852 8.9121 8.9121 9.2143 9.2143 9.8761 9.8761 10.1541 10.1541 10.4912 10.4912 11.9293 11.9293 13.5905 13.5905 13.6367 13.6367 14.1834 14.1834 14.2956 14.2956 14.4580 14.4580 k =-0.1290 0.0426 0.0000 ( 3034 PWs) bands (ev): 4.5076 4.5076 6.7662 6.7662 6.9950 6.9950 7.0962 7.0962 7.1256 7.1256 8.0073 8.0073 8.8584 8.8584 8.9181 8.9181 9.2169 9.2169 9.8514 9.8514 10.1669 10.1669 10.4687 10.4687 11.9201 11.9201 13.5895 13.5895 13.6257 13.6257 14.1793 14.1793 14.2869 14.2869 14.4625 14.4625 k =-0.1452 0.0480 0.0000 ( 3034 PWs) bands (ev): 4.5383 4.5383 6.7766 6.7766 7.0038 7.0038 7.0818 7.0818 7.1222 7.1222 8.0017 8.0017 8.8295 8.8295 8.9250 8.9250 9.2181 9.2181 9.8259 9.8259 10.1783 10.1783 10.4440 10.4440 11.9107 11.9107 13.5848 13.5848 13.6138 13.6138 14.1612 14.1612 14.2770 14.2770 14.4942 14.4942 k =-0.1613 0.0533 0.0000 ( 3032 PWs) bands (ev): 4.5723 4.5723 6.7872 6.7872 7.0093 7.0093 7.0675 7.0675 7.1222 7.1222 7.9957 7.9957 8.7991 8.7991 8.9325 8.9325 9.2175 9.2175 9.7997 9.7997 10.1882 10.1882 10.4175 10.4175 11.9015 11.9015 13.5747 13.5747 13.6015 13.6015 14.1311 14.1311 14.2783 14.2783 14.5405 14.5405 k =-0.1774 0.0586 0.0000 ( 3042 PWs) bands (ev): 4.6094 4.6094 6.7972 6.7972 7.0089 7.0089 7.0552 7.0552 7.1272 7.1272 7.9895 7.9895 8.7673 8.7673 8.9403 8.9403 9.2149 9.2149 9.7732 9.7732 10.1959 10.1959 10.3900 10.3900 11.8925 11.8925 13.5579 13.5579 13.5893 13.5893 14.0991 14.0991 14.2880 14.2880 14.5955 14.5955 k =-0.1935 0.0640 0.0000 ( 3046 PWs) bands (ev): 4.6495 4.6495 6.8062 6.8062 7.0008 7.0008 7.0463 7.0463 7.1379 7.1379 7.9830 7.9830 8.7346 8.7346 8.9484 8.9484 9.2099 9.2099 9.7466 9.7466 10.2007 10.2007 10.3624 10.3624 11.8840 11.8840 13.5338 13.5338 13.5770 13.5770 14.0720 14.0720 14.3022 14.3022 14.6565 14.6565 k =-0.2097 0.0693 0.0000 ( 3046 PWs) bands (ev): 4.6924 4.6924 6.8131 6.8131 6.9869 6.9869 7.0406 7.0406 7.1536 7.1536 7.9765 7.9765 8.7012 8.7012 8.9568 8.9568 9.2023 9.2023 9.7206 9.7206 10.2008 10.2008 10.3366 10.3366 11.8762 11.8762 13.5028 13.5028 13.5647 13.5647 14.0527 14.0527 14.3190 14.3190 14.7219 14.7219 k =-0.2258 0.0746 0.0000 ( 3048 PWs) bands (ev): 4.7380 4.7380 6.8168 6.8168 6.9703 6.9703 7.0371 7.0371 7.1731 7.1731 7.9698 7.9698 8.6674 8.6674 8.9653 8.9653 9.1918 9.1918 9.6955 9.6955 10.1938 10.1938 10.3153 10.3153 11.8691 11.8691 13.4662 13.4662 13.5524 13.5524 14.0414 14.0414 14.3374 14.3374 14.7907 14.7907 k =-0.2419 0.0800 0.0000 ( 3048 PWs) bands (ev): 4.7860 4.7860 6.8163 6.8163 6.9530 6.9530 7.0359 7.0359 7.1953 7.1953 7.9631 7.9631 8.6334 8.6334 8.9739 8.9739 9.1783 9.1783 9.6719 9.6719 10.1773 10.1773 10.3012 10.3012 11.8628 11.8628 13.4253 13.4253 13.5405 13.5405 14.0372 14.0372 14.3568 14.3568 14.8615 14.8615 k =-0.2581 0.0853 0.0000 ( 3038 PWs) bands (ev): 4.8361 4.8361 6.8104 6.8104 6.9363 6.9363 7.0374 7.0374 7.2195 7.2195 7.9562 7.9562 8.5996 8.5996 8.9824 8.9824 9.1619 9.1619 9.6502 9.6502 10.1516 10.1516 10.2941 10.2941 11.8572 11.8572 13.3819 13.3819 13.5291 13.5291 14.0386 14.0386 14.3768 14.3768 14.9329 14.9329 k =-0.2742 0.0906 0.0000 ( 3034 PWs) bands (ev): 4.8882 4.8882 6.7988 6.7988 6.9209 6.9209 7.0416 7.0416 7.2450 7.2450 7.9493 7.9493 8.5662 8.5662 8.9908 8.9908 9.1428 9.1428 9.6309 9.6309 10.1195 10.1195 10.2916 10.2916 11.8522 11.8522 13.3376 13.3376 13.5185 13.5185 14.0442 14.0442 14.3969 14.3969 15.0029 15.0029 k =-0.2903 0.0959 0.0000 ( 3034 PWs) bands (ev): 4.9418 4.9418 6.7818 6.7818 6.9069 6.9069 7.0483 7.0483 7.2714 7.2714 7.9422 7.9422 8.5335 8.5335 8.9990 8.9990 9.1214 9.1214 9.6141 9.6141 10.0836 10.0836 10.2915 10.2915 11.8478 11.8478 13.2935 13.2935 13.5088 13.5088 14.0527 14.0527 14.4167 14.4167 15.0675 15.0675 k =-0.3065 0.1013 0.0000 ( 3032 PWs) bands (ev): 4.9966 4.9966 6.7603 6.7603 6.8942 6.8942 7.0570 7.0570 7.2983 7.2983 7.9350 7.9350 8.5019 8.5019 9.0069 9.0069 9.0983 9.0983 9.6000 9.6000 10.0454 10.0454 10.2923 10.2923 11.8440 11.8440 13.2508 13.2508 13.5001 13.5001 14.0631 14.0631 14.4358 14.4358 15.1136 15.1136 k =-0.3226 0.1066 0.0000 ( 3028 PWs) bands (ev): 5.0521 5.0521 6.7353 6.7353 6.8825 6.8825 7.0669 7.0669 7.3253 7.3253 7.9275 7.9275 8.4716 8.4716 9.0143 9.0143 9.0742 9.0742 9.5885 9.5885 10.0062 10.0062 10.2935 10.2935 11.8406 11.8406 13.2101 13.2101 13.4924 13.4924 14.0746 14.0746 14.4540 14.4540 15.1094 15.1094 k =-0.3387 0.1119 0.0000 ( 3036 PWs) bands (ev): 5.1079 5.1079 6.7078 6.7078 6.8716 6.8716 7.0775 7.0775 7.3521 7.3521 7.9198 7.9198 8.4431 8.4431 9.0212 9.0212 9.0500 9.0500 9.5798 9.5798 9.9666 9.9666 10.2946 10.2946 11.8376 11.8376 13.1719 13.1719 13.4858 13.4858 14.0866 14.0866 14.4708 14.4708 15.0731 15.0731 k =-0.3548 0.1173 0.0000 ( 3034 PWs) bands (ev): 5.1634 5.1634 6.6785 6.6785 6.8614 6.8614 7.0882 7.0882 7.3782 7.3782 7.9118 7.9118 8.4166 8.4166 9.0224 9.0224 9.0313 9.0313 9.5736 9.5736 9.9271 9.9271 10.2955 10.2955 11.8348 11.8348 13.1367 13.1367 13.4803 13.4803 14.0985 14.0985 14.4860 14.4860 15.0333 15.0333 k =-0.3710 0.1226 0.0000 ( 3030 PWs) bands (ev): 5.2178 5.2178 6.6483 6.6483 6.8521 6.8521 7.0987 7.0987 7.4034 7.4034 7.9035 7.9035 8.3924 8.3924 9.0016 9.0016 9.0352 9.0352 9.5701 9.5701 9.8884 9.8884 10.2960 10.2960 11.8324 11.8324 13.1047 13.1047 13.4758 13.4758 14.1099 14.1099 14.4992 14.4992 14.9967 14.9967 k =-0.3871 0.1279 0.0000 ( 3022 PWs) bands (ev): 5.2703 5.2703 6.6177 6.6177 6.8437 6.8437 7.1084 7.1084 7.4271 7.4271 7.8951 7.8951 8.3709 8.3709 8.9803 8.9803 9.0405 9.0405 9.5692 9.5692 9.8507 9.8507 10.2964 10.2964 11.8301 11.8301 13.0761 13.0761 13.4722 13.4722 14.1205 14.1205 14.5103 14.5103 14.9648 14.9648 k =-0.4032 0.1333 0.0000 ( 3026 PWs) bands (ev): 5.3200 5.3200 6.5877 6.5877 6.8362 6.8362 7.1173 7.1173 7.4489 7.4489 7.8868 7.8868 8.3521 8.3521 8.9609 8.9609 9.0454 9.0454 9.5709 9.5709 9.8145 9.8145 10.2964 10.2964 11.8282 11.8282 13.0512 13.0512 13.4694 13.4694 14.1301 14.1301 14.5191 14.5191 14.9381 14.9381 k =-0.4194 0.1386 0.0000 ( 3024 PWs) bands (ev): 5.3656 5.3656 6.5592 6.5592 6.8297 6.8297 7.1251 7.1251 7.4685 7.4685 7.8787 7.8787 8.3362 8.3362 8.9440 8.9440 9.0496 9.0496 9.5752 9.5752 9.7801 9.7801 10.2963 10.2963 11.8264 11.8264 13.0299 13.0299 13.4674 13.4674 14.1384 14.1384 14.5258 14.5258 14.9166 14.9166 k =-0.4355 0.1439 0.0000 ( 3028 PWs) bands (ev): 5.4059 5.4059 6.5332 6.5332 6.8243 6.8243 7.1316 7.1316 7.4853 7.4853 7.8714 7.8714 8.3232 8.3232 8.9298 8.9298 9.0532 9.0532 9.5823 9.5823 9.7478 9.7478 10.2961 10.2961 11.8249 11.8249 13.0125 13.0125 13.4659 13.4659 14.1453 14.1453 14.5305 14.5305 14.9000 14.9000 k =-0.4516 0.1493 0.0000 ( 3026 PWs) bands (ev): 5.4394 5.4394 6.5110 6.5110 6.8200 6.8200 7.1367 7.1367 7.4990 7.4990 7.8651 7.8651 8.3132 8.3132 8.9186 8.9186 9.0559 9.0559 9.5921 9.5921 9.7180 9.7180 10.2958 10.2958 11.8237 11.8237 12.9989 12.9989 13.4648 13.4648 14.1508 14.1508 14.5337 14.5337 14.8879 14.8879 k =-0.4677 0.1546 0.0000 ( 3028 PWs) bands (ev): 5.4648 5.4648 6.4939 6.4939 6.8169 6.8169 7.1405 7.1405 7.5092 7.5092 7.8602 7.8602 8.3061 8.3061 8.9104 8.9104 9.0579 9.0579 9.6045 9.6045 9.6912 9.6912 10.2956 10.2956 11.8229 11.8229 12.9891 12.9891 13.4642 13.4642 14.1547 14.1547 14.5355 14.5355 14.8797 14.8797 k =-0.4839 0.1599 0.0000 ( 3028 PWs) bands (ev): 5.4806 5.4806 6.4830 6.4830 6.8151 6.8151 7.1427 7.1427 7.5154 7.5154 7.8572 7.8572 8.3019 8.3019 8.9055 8.9055 9.0592 9.0592 9.6186 9.6186 9.6683 9.6683 10.2954 10.2954 11.8224 11.8224 12.9832 12.9832 13.4638 13.4638 14.1570 14.1570 14.5365 14.5365 14.8749 14.8750 k =-0.5000 0.1652 0.0000 ( 3022 PWs) bands (ev): 5.4860 5.4860 6.4793 6.4793 6.8145 6.8145 7.1435 7.1435 7.5175 7.5175 7.8561 7.8561 8.3005 8.3005 8.9039 8.9039 9.0596 9.0596 9.6280 9.6280 9.6559 9.6559 10.2954 10.2954 11.8222 11.8222 12.9813 12.9813 13.4637 13.4637 14.1578 14.1578 14.5368 14.5368 14.8734 14.8734 k =-0.5000 0.1652 0.0000 ( 3022 PWs) bands (ev): 5.4860 5.4860 6.4793 6.4793 6.8145 6.8145 7.1435 7.1435 7.5175 7.5175 7.8561 7.8561 8.3005 8.3005 8.9039 8.9039 9.0596 9.0596 9.6280 9.6280 9.6559 9.6559 10.2954 10.2954 11.8222 11.8222 12.9813 12.9813 13.4637 13.4637 14.1578 14.1578 14.5368 14.5368 14.8734 14.8734 k =-0.4947 0.1813-0.0000 ( 3022 PWs) bands (ev): 5.4875 5.4875 6.4811 6.4811 6.8158 6.8158 7.1441 7.1441 7.5176 7.5176 7.8559 7.8559 8.3004 8.3004 8.9027 8.9027 9.0592 9.0592 9.6288 9.6288 9.6566 9.6566 10.2960 10.2960 11.8236 11.8236 12.9778 12.9778 13.4641 13.4641 14.1584 14.1584 14.5373 14.5373 14.8734 14.8734 k =-0.4894 0.1973-0.0000 ( 3022 PWs) bands (ev): 5.4922 5.4922 6.4864 6.4864 6.8198 6.8198 7.1458 7.1458 7.5180 7.5180 7.8551 7.8551 8.3000 8.3000 8.8991 8.8991 9.0582 9.0582 9.6313 9.6313 9.6584 9.6584 10.2977 10.2977 11.8279 11.8279 12.9675 12.9675 13.4653 13.4653 14.1601 14.1601 14.5389 14.5389 14.8734 14.8734 k =-0.4841 0.2134-0.0000 ( 3030 PWs) bands (ev): 5.5000 5.5000 6.4951 6.4951 6.8264 6.8264 7.1486 7.1486 7.5187 7.5187 7.8538 7.8538 8.2994 8.2994 8.8934 8.8934 9.0564 9.0564 9.6354 9.6354 9.6615 9.6615 10.3005 10.3005 11.8349 11.8349 12.9504 12.9504 13.4674 13.4674 14.1629 14.1629 14.5415 14.5415 14.8734 14.8734 k =-0.4788 0.2294-0.0000 ( 3028 PWs) bands (ev): 5.5108 5.5108 6.5074 6.5074 6.8357 6.8357 7.1525 7.1525 7.5197 7.5197 7.8518 7.8518 8.2986 8.2986 8.8857 8.8857 9.0539 9.0539 9.6411 9.6411 9.6657 9.6657 10.3043 10.3043 11.8446 11.8446 12.9267 12.9267 13.4704 13.4704 14.1668 14.1668 14.5450 14.5450 14.8734 14.8734 k =-0.4735 0.2455-0.0000 ( 3026 PWs) bands (ev): 5.5247 5.5247 6.5230 6.5230 6.8476 6.8476 7.1573 7.1573 7.5212 7.5212 7.8490 7.8490 8.2978 8.2978 8.8765 8.8765 9.0508 9.0508 9.6483 9.6483 9.6709 9.6709 10.3091 10.3091 11.8567 11.8567 12.8968 12.8968 13.4745 13.4745 14.1718 14.1718 14.5494 14.5494 14.8735 14.8735 k =-0.4682 0.2615-0.0000 ( 3026 PWs) bands (ev): 5.5415 5.5415 6.5419 6.5419 6.8621 6.8621 7.1630 7.1630 7.5232 7.5232 7.8454 7.8454 8.2969 8.2969 8.8662 8.8662 9.0470 9.0470 9.6569 9.6569 9.6771 9.6771 10.3148 10.3148 11.8710 11.8710 12.8610 12.8610 13.4797 13.4797 14.1778 14.1778 14.5545 14.5545 14.8737 14.8737 k =-0.4629 0.2775-0.0000 ( 3024 PWs) bands (ev): 5.5612 5.5612 6.5642 6.5642 6.8792 6.8792 7.1694 7.1694 7.5258 7.5258 7.8409 7.8409 8.2961 8.2961 8.8552 8.8552 9.0427 9.0427 9.6666 9.6666 9.6840 9.6840 10.3213 10.3213 11.8872 11.8872 12.8197 12.8197 13.4862 13.4862 14.1849 14.1849 14.5602 14.5602 14.8741 14.8741 k =-0.4576 0.2936-0.0000 ( 3012 PWs) bands (ev): 5.5837 5.5837 6.5895 6.5895 6.8988 6.8988 7.1764 7.1764 7.5292 7.5292 7.8353 7.8353 8.2952 8.2952 8.8441 8.8441 9.0379 9.0379 9.6773 9.6773 9.6918 9.6918 10.3286 10.3286 11.9050 11.9050 12.7737 12.7737 13.4939 13.4939 14.1929 14.1929 14.5661 14.5661 14.8750 14.8750 k =-0.4523 0.3096-0.0000 ( 3012 PWs) bands (ev): 5.6090 5.6090 6.6179 6.6179 6.9210 6.9210 7.1838 7.1838 7.5335 7.5335 7.8286 7.8286 8.2944 8.2944 8.8334 8.8334 9.0329 9.0329 9.6885 9.6885 9.7006 9.7006 10.3364 10.3364 11.9241 11.9241 12.7234 12.7234 13.5028 13.5028 14.2020 14.2020 14.5719 14.5719 14.8764 14.8764 k =-0.4470 0.3257-0.0000 ( 3014 PWs) bands (ev): 5.6368 5.6368 6.6492 6.6492 6.9456 6.9456 7.1915 7.1915 7.5388 7.5388 7.8208 7.8208 8.2934 8.2934 8.8237 8.8237 9.0277 9.0277 9.6994 9.6994 9.7110 9.7110 10.3448 10.3448 11.9438 11.9438 12.6695 12.6695 13.5130 13.5130 14.2119 14.2119 14.5773 14.5773 14.8786 14.8786 k =-0.4417 0.3417-0.0000 ( 3014 PWs) bands (ev): 5.6672 5.6672 6.6831 6.6831 6.9726 6.9726 7.1993 7.1993 7.5450 7.5450 7.8120 7.8120 8.2920 8.2920 8.8156 8.8156 9.0224 9.0224 9.7091 9.7091 9.7234 9.7234 10.3537 10.3537 11.9638 11.9638 12.6128 12.6128 13.5243 13.5243 14.2228 14.2228 14.5817 14.5817 14.8820 14.8820 k =-0.4364 0.3578-0.0000 ( 3018 PWs) bands (ev): 5.6998 5.6998 6.7196 6.7196 7.0020 7.0020 7.2073 7.2073 7.5523 7.5523 7.8022 7.8022 8.2902 8.2902 8.8098 8.8098 9.0173 9.0173 9.7176 9.7176 9.7375 9.7375 10.3631 10.3631 11.9833 11.9833 12.5543 12.5543 13.5366 13.5366 14.2345 14.2345 14.5846 14.5846 14.8869 14.8869 k =-0.4311 0.3738-0.0000 ( 3016 PWs) bands (ev): 5.7347 5.7347 6.7583 6.7583 7.0336 7.0336 7.2152 7.2152 7.5607 7.5607 7.7917 7.7917 8.2875 8.2875 8.8067 8.8067 9.0126 9.0126 9.7254 9.7254 9.7529 9.7529 10.3728 10.3728 12.0015 12.0015 12.4950 12.4950 13.5496 13.5496 14.2470 14.2470 14.5854 14.5854 14.8938 14.8938 k =-0.4258 0.3899-0.0000 ( 3016 PWs) bands (ev): 5.7716 5.7716 6.7990 6.7990 7.0674 7.0674 7.2232 7.2232 7.5701 7.5701 7.7806 7.7806 8.2839 8.2839 8.8069 8.8069 9.0082 9.0082 9.7326 9.7326 9.7692 9.7692 10.3828 10.3828 12.0169 12.0169 12.4365 12.4365 13.5631 13.5631 14.2602 14.2602 14.5835 14.5835 14.9028 14.9028 k =-0.4205 0.4059-0.0000 ( 3018 PWs) bands (ev): 5.8102 5.8102 6.8413 6.8413 7.1030 7.1030 7.2314 7.2314 7.5805 7.5805 7.7693 7.7693 8.2791 8.2791 8.8109 8.8109 9.0045 9.0045 9.7390 9.7390 9.7861 9.7861 10.3932 10.3932 12.0277 12.0277 12.3812 12.3812 13.5765 13.5765 14.2739 14.2739 14.5785 14.5785 14.9143 14.9143 k =-0.4152 0.4219-0.0000 ( 3012 PWs) bands (ev): 5.8505 5.8505 6.8849 6.8849 7.1401 7.1401 7.2400 7.2400 7.5918 7.5918 7.7580 7.7580 8.2731 8.2731 8.8190 8.8190 9.0016 9.0016 9.7446 9.7446 9.8035 9.8035 10.4039 10.4039 12.0305 12.0305 12.3326 12.3326 13.5892 13.5892 14.2880 14.2880 14.5700 14.5700 14.9283 14.9283 k =-0.4099 0.4380-0.0000 ( 3016 PWs) bands (ev): 5.8922 5.8922 6.9292 6.9292 7.1777 7.1777 7.2500 7.2500 7.6039 7.6039 7.7471 7.7471 8.2659 8.2659 8.8313 8.8313 8.9996 8.9996 9.7493 9.7493 9.8214 9.8214 10.4149 10.4149 12.0208 12.0208 12.2954 12.2954 13.6004 13.6004 14.3022 14.3022 14.5581 14.5581 14.9447 14.9447 k =-0.4046 0.4540-0.0000 ( 3020 PWs) bands (ev): 5.9351 5.9351 6.9736 6.9736 7.2134 7.2134 7.2637 7.2637 7.6168 7.6168 7.7371 7.7371 8.2576 8.2576 8.8477 8.8477 8.9988 8.9988 9.7530 9.7530 9.8397 9.8397 10.4263 10.4263 11.9952 11.9952 12.2734 12.2734 13.6091 13.6091 14.3158 14.3158 14.5430 14.5430 14.9631 14.9631 k =-0.3993 0.4701-0.0000 ( 3024 PWs) bands (ev): 5.9788 5.9788 7.0172 7.0172 7.2413 7.2413 7.2870 7.2870 7.6308 7.6308 7.7283 7.7283 8.2484 8.2484 8.8682 8.8682 8.9995 8.9995 9.7557 9.7557 9.8582 9.8582 10.4380 10.4380 11.9548 11.9548 12.2658 12.2658 13.6140 13.6140 14.3278 14.3278 14.5256 14.5256 14.9832 14.9832 k =-0.3940 0.4861-0.0000 ( 3030 PWs) bands (ev): 6.0231 6.0231 7.0591 7.0591 7.2598 7.2598 7.3213 7.3213 7.6462 7.6462 7.7213 7.7213 8.2386 8.2386 8.8922 8.8922 9.0021 9.0021 9.7572 9.7572 9.8771 9.8771 10.4500 10.4500 11.9042 11.9042 12.2684 12.2684 13.6139 13.6139 14.3361 14.3361 14.5079 14.5079 15.0045 15.0045 k =-0.3887 0.5022-0.0000 ( 3024 PWs) bands (ev): 6.0679 6.0679 7.0976 7.0976 7.2757 7.2757 7.3599 7.3599 7.6638 7.6638 7.7164 7.7164 8.2285 8.2285 8.9185 8.9185 9.0078 9.0078 9.7575 9.7575 9.8961 9.8961 10.4626 10.4626 11.8480 11.8480 12.2769 12.2769 13.6071 13.6071 14.3369 14.3369 14.4936 14.4936 15.0264 15.0264 k =-0.3834 0.5182-0.0000 ( 3024 PWs) bands (ev): 6.1126 6.1126 7.1310 7.1310 7.2932 7.2932 7.3983 7.3983 7.6850 7.6850 7.7138 7.7138 8.2184 8.2184 8.9447 8.9447 9.0188 9.0188 9.7565 9.7565 9.9152 9.9152 10.4756 10.4756 11.7891 11.7891 12.2888 12.2888 13.5921 13.5921 14.3254 14.3254 14.4872 14.4872 15.0481 15.0481 k =-0.3780 0.5342-0.0000 ( 3024 PWs) bands (ev): 6.1572 6.1572 7.1578 7.1578 7.3140 7.3140 7.4344 7.4344 7.7113 7.7113 7.7138 7.7138 8.2085 8.2085 8.9669 8.9669 9.0393 9.0393 9.7543 9.7543 9.9344 9.9344 10.4893 10.4893 11.7296 11.7296 12.3024 12.3024 13.5673 13.5673 14.2991 14.2991 14.4908 14.4908 15.0688 15.0688 k =-0.3727 0.5503-0.0000 ( 3029 PWs) bands (ev): 6.2013 6.2013 7.1776 7.1776 7.3374 7.3374 7.4675 7.4675 7.7155 7.7155 7.7446 7.7446 8.1992 8.1992 8.9826 8.9826 9.0712 9.0712 9.7507 9.7507 9.9536 9.9536 10.5036 10.5036 11.6706 11.6706 12.3168 12.3168 13.5316 13.5316 14.2600 14.2600 14.5023 14.5023 15.0870 15.0870 k =-0.3674 0.5663-0.0000 ( 3021 PWs) bands (ev): 6.2445 6.2445 7.1914 7.1914 7.3609 7.3609 7.4983 7.4983 7.7192 7.7192 7.7850 7.7850 8.1907 8.1907 8.9943 8.9943 9.1121 9.1121 9.7459 9.7459 9.9727 9.9727 10.5188 10.5188 11.6130 11.6130 12.3317 12.3317 13.4841 13.4841 14.2108 14.2108 14.5187 14.5187 15.0998 15.0998 k =-0.3621 0.5824-0.0000 ( 3015 PWs) bands (ev): 6.2867 6.2867 7.2007 7.2007 7.3820 7.3820 7.5283 7.5283 7.7246 7.7246 7.8322 7.8322 8.1833 8.1833 9.0046 9.0046 9.1592 9.1592 9.7398 9.7398 9.9916 9.9916 10.5349 10.5349 11.5575 11.5575 12.3467 12.3467 13.4246 13.4246 14.1533 14.1533 14.5375 14.5375 15.1010 15.1010 k =-0.3568 0.5984-0.0000 ( 3023 PWs) bands (ev): 6.3276 6.3276 7.2067 7.2067 7.3987 7.3987 7.5585 7.5585 7.7318 7.7318 7.8845 7.8845 8.1775 8.1775 9.0148 9.0148 9.2107 9.2107 9.7326 9.7326 10.0104 10.0104 10.5520 10.5520 11.5044 11.5044 12.3616 12.3616 13.3535 13.3535 14.0884 14.0884 14.5571 14.5571 15.0843 15.0843 k =-0.3515 0.6145-0.0000 ( 3023 PWs) bands (ev): 6.3669 6.3669 7.2105 7.2105 7.4111 7.4111 7.5883 7.5883 7.7413 7.7413 7.9401 7.9401 8.1742 8.1742 9.0255 9.0255 9.2658 9.2658 9.7243 9.7243 10.0290 10.0290 10.5703 10.5703 11.4543 11.4543 12.3761 12.3761 13.2717 13.2717 14.0167 14.0167 14.5760 14.5760 15.0542 15.0542 k =-0.3462 0.6305-0.0000 ( 3023 PWs) bands (ev): 6.4044 6.4044 7.2127 7.2127 7.4200 7.4200 7.6159 7.6159 7.7542 7.7542 7.9960 7.9960 8.1752 8.1752 9.0371 9.0371 9.3235 9.3235 9.7155 9.7155 10.0472 10.0472 10.5899 10.5899 11.4074 11.4074 12.3896 12.3896 13.1807 13.1807 13.9387 13.9387 14.5924 14.5924 15.0213 15.0213 k =-0.3409 0.6466-0.0000 ( 3019 PWs) bands (ev): 6.4399 6.4399 7.2135 7.2135 7.4266 7.4266 7.6391 7.6391 7.7715 7.7715 8.0470 8.0470 8.1852 8.1852 9.0495 9.0495 9.3827 9.3827 9.7066 9.7066 10.0651 10.0651 10.6111 10.6111 11.3642 11.3642 12.4015 12.4015 13.0830 13.0830 13.8545 13.8545 14.6042 14.6042 14.9931 14.9931 k =-0.3356 0.6626-0.0000 ( 3015 PWs) bands (ev): 6.4732 6.4732 7.2135 7.2135 7.4318 7.4318 7.6566 7.6566 7.7933 7.7933 8.0839 8.0839 8.2125 8.2125 9.0630 9.0630 9.4416 9.4416 9.6992 9.6992 10.0826 10.0826 10.6339 10.6339 11.3248 11.3248 12.4100 12.4100 12.9815 12.9815 13.7644 13.7644 14.6090 14.6090 14.9742 14.9742 k =-0.3303 0.6786-0.0000 ( 3015 PWs) bands (ev): 6.5041 6.5041 7.2128 7.2128 7.4362 7.4362 7.6688 7.6688 7.8183 7.8183 8.1033 8.1033 8.2605 8.2605 9.0773 9.0773 9.4963 9.4963 9.6965 9.6965 10.0999 10.0999 10.6585 10.6585 11.2897 11.2897 12.4116 12.4116 12.8815 12.8815 13.6687 13.6687 14.6052 14.6052 14.9672 14.9672 k =-0.3250 0.6947-0.0000 ( 3007 PWs) bands (ev): 6.5326 6.5326 7.2117 7.2117 7.4404 7.4404 7.6769 7.6769 7.8442 7.8442 8.1130 8.1130 8.3209 8.3209 9.0925 9.0925 9.5391 9.5391 9.7059 9.7059 10.1169 10.1169 10.6850 10.6850 11.2591 11.2591 12.3994 12.3994 12.7915 12.7915 13.5678 13.5678 14.5925 14.5925 14.9725 14.9725 k =-0.3197 0.7107-0.0000 ( 3011 PWs) bands (ev): 6.5586 6.5586 7.2103 7.2103 7.4444 7.4444 7.6824 7.6824 7.8691 7.8691 8.1201 8.1201 8.3869 8.3869 9.1086 9.1086 9.5602 9.5602 9.7362 9.7362 10.1337 10.1337 10.7134 10.7134 11.2333 11.2333 12.3621 12.3621 12.7243 12.7243 13.4622 13.4622 14.5728 14.5728 14.9887 14.9887 k =-0.3144 0.7268-0.0000 ( 3013 PWs) bands (ev): 6.5818 6.5818 7.2089 7.2089 7.4485 7.4485 7.6859 7.6859 7.8912 7.8912 8.1279 8.1279 8.4549 8.4549 9.1254 9.1254 9.5611 9.5611 9.7853 9.7853 10.1504 10.1504 10.7436 10.7436 11.2129 11.2129 12.2923 12.2923 12.6888 12.6888 13.3522 13.3522 14.5484 14.5484 15.0134 15.0134 k =-0.3091 0.7428-0.0000 ( 3015 PWs) bands (ev): 6.6023 6.6023 7.2075 7.2075 7.4527 7.4527 7.6881 7.6881 7.9097 7.9097 8.1379 8.1379 8.5234 8.5234 9.1427 9.1427 9.5508 9.5508 9.8435 9.8435 10.1672 10.1672 10.7755 10.7755 11.1983 11.1983 12.1960 12.1960 12.6801 12.6801 13.2387 13.2387 14.5214 14.5214 15.0444 15.0444 k =-0.3038 0.7589-0.0000 ( 3011 PWs) bands (ev): 6.6201 6.6201 7.2063 7.2063 7.4568 7.4568 7.6891 7.6891 7.9241 7.9241 8.1508 8.1508 8.5910 8.5910 9.1605 9.1605 9.5348 9.5348 9.9042 9.9042 10.1844 10.1844 10.8085 10.8085 11.1902 11.1902 12.0852 12.0852 12.6873 12.6873 13.1228 13.1228 14.4933 14.4933 15.0799 15.0799 k =-0.2985 0.7749-0.0000 ( 3011 PWs) bands (ev): 6.6350 6.6350 7.2054 7.2054 7.4610 7.4610 7.6891 7.6891 7.9349 7.9349 8.1665 8.1665 8.6570 8.6570 9.1785 9.1785 9.5159 9.5159 9.9638 9.9638 10.2022 10.2022 10.8417 10.8417 11.1893 11.1893 11.9685 11.9685 12.7015 12.7015 13.0072 13.0072 14.4653 14.4653 15.1182 15.1182 k =-0.2932 0.7909-0.0000 ( 3011 PWs) bands (ev): 6.6470 6.6470 7.2048 7.2048 7.4650 7.4650 7.6880 7.6880 7.9428 7.9428 8.1843 8.1843 8.7203 8.7203 9.1966 9.1966 9.4953 9.4953 10.0200 10.0200 10.2209 10.2209 10.8739 10.8739 11.1962 11.1962 11.8514 11.8514 12.7105 12.7105 12.9011 12.9011 14.4381 14.4381 15.1171 15.1171 k =-0.2879 0.8070-0.0000 ( 3019 PWs) bands (ev): 6.6562 6.6562 7.2046 7.2046 7.4686 7.4686 7.6860 7.6860 7.9490 7.9490 8.2037 8.2037 8.7801 8.7801 9.2143 9.2143 9.4740 9.4740 10.0710 10.0710 10.2409 10.2409 10.9038 10.9038 11.2106 11.2106 11.7385 11.7385 12.6770 12.6770 12.8411 12.8411 14.4120 14.4120 15.0556 15.0556 k =-0.2826 0.8230-0.0000 ( 3019 PWs) bands (ev): 6.6625 6.6625 7.2047 7.2047 7.4718 7.4718 7.6830 7.6830 7.9543 7.9543 8.2238 8.2238 8.8353 8.8353 9.2314 9.2314 9.4529 9.4529 10.1151 10.1151 10.2626 10.2626 10.9303 10.9303 11.2297 11.2297 11.6358 11.6358 12.5799 12.5799 12.8481 12.8481 14.3874 14.3874 14.9939 14.9939 k =-0.2773 0.8391-0.0000 ( 3015 PWs) bands (ev): 6.6658 6.6658 7.2052 7.2052 7.4741 7.4741 7.6793 7.6793 7.9597 7.9597 8.2441 8.2441 8.8849 8.8849 9.2474 9.2474 9.4330 9.4330 10.1512 10.1512 10.2860 10.2860 10.9530 10.9530 11.2443 11.2443 11.5539 11.5539 12.4611 12.4611 12.8808 12.8808 14.3644 14.3644 14.9329 14.9329 k =-0.2773 0.8391-0.0000 ( 3015 PWs) bands (ev): 6.6658 6.6658 7.2052 7.2052 7.4741 7.4741 7.6793 7.6793 7.9597 7.9597 8.2441 8.2441 8.8849 8.8849 9.2474 9.2474 9.4330 9.4330 10.1512 10.1512 10.2860 10.2860 10.9530 10.9530 11.2443 11.2443 11.5539 11.5539 12.4611 12.4611 12.8808 12.8808 14.3644 14.3644 14.9329 14.9329 k =-0.2773 0.8391 0.0172 ( 3015 PWs) bands (ev): 6.6651 6.6651 7.2054 7.2054 7.4729 7.4729 7.6790 7.6790 7.9556 7.9556 8.2509 8.2509 8.8832 8.8832 9.2509 9.2509 9.4325 9.4325 10.1504 10.1504 10.2862 10.2862 10.9415 10.9415 11.2526 11.2526 11.5571 11.5571 12.4617 12.4617 12.8776 12.8776 14.3654 14.3654 14.9307 14.9307 k =-0.2773 0.8391 0.0343 ( 3019 PWs) bands (ev): 6.6632 6.6632 7.2061 7.2061 7.4690 7.4690 7.6784 7.6784 7.9449 7.9449 8.2696 8.2696 8.8786 8.8786 9.2607 9.2607 9.4314 9.4314 10.1480 10.1480 10.2866 10.2866 10.9110 10.9110 11.2735 11.2735 11.5668 11.5668 12.4636 12.4636 12.8681 12.8681 14.3682 14.3682 14.9245 14.9245 k =-0.2773 0.8391 0.0515 ( 3017 PWs) bands (ev): 6.6602 6.6602 7.2070 7.2070 7.4628 7.4628 7.6772 7.6772 7.9304 7.9304 8.2972 8.2972 8.8721 8.8721 9.2749 9.2749 9.4308 9.4308 10.1439 10.1439 10.2872 10.2872 10.8691 10.8691 11.2995 11.2995 11.5829 11.5829 12.4669 12.4669 12.8530 12.8530 14.3721 14.3721 14.9146 14.9146 k =-0.2773 0.8391 0.0686 ( 3019 PWs) bands (ev): 6.6560 6.6560 7.2079 7.2079 7.4543 7.4543 7.6756 7.6756 7.9150 7.9150 8.3302 8.3302 8.8648 8.8648 9.2902 9.2902 9.4332 9.4332 10.1377 10.1377 10.2879 10.2879 10.8218 10.8218 11.3252 11.3252 11.6048 11.6048 12.4718 12.4718 12.8335 12.8335 14.3762 14.3762 14.9015 14.9015 k =-0.2773 0.8391 0.0858 ( 3011 PWs) bands (ev): 6.6508 6.6508 7.2084 7.2084 7.4441 7.4441 7.6737 7.6737 7.9005 7.9005 8.3658 8.3658 8.8582 8.8582 9.3021 9.3021 9.4423 9.4423 10.1292 10.1292 10.2886 10.2886 10.7728 10.7728 11.3477 11.3477 11.6314 11.6314 12.4784 12.4784 12.8108 12.8108 14.3793 14.3793 14.8858 14.8858 k =-0.2773 0.8391 0.1030 ( 3005 PWs) bands (ev): 6.6449 6.6449 7.2080 7.2080 7.4328 7.4328 7.6714 7.6714 7.8881 7.8881 8.4017 8.4017 8.8537 8.8537 9.3068 9.3068 9.4611 9.4611 10.1182 10.1182 10.2890 10.2890 10.7249 10.7249 11.3660 11.3660 11.6613 11.6613 12.4870 12.4870 12.7867 12.7867 14.3803 14.3803 14.8677 14.8677 k =-0.2773 0.8391 0.1201 ( 3012 PWs) bands (ev): 6.6383 6.6383 7.2059 7.2059 7.4215 7.4215 7.6688 7.6688 7.8782 7.8782 8.4357 8.4357 8.8528 8.8528 9.3039 9.3039 9.4892 9.4892 10.1046 10.1046 10.2890 10.2890 10.6798 10.6798 11.3799 11.3799 11.6927 11.6927 12.4976 12.4976 12.7627 12.7627 14.3785 14.3785 14.8475 14.8475 k =-0.2773 0.8391 0.1373 ( 3010 PWs) bands (ev): 6.6312 6.6312 7.2015 7.2015 7.4112 7.4112 7.6659 7.6659 7.8709 7.8709 8.4659 8.4659 8.8569 8.8569 9.2956 9.2956 9.5238 9.5238 10.0889 10.0889 10.2885 10.2885 10.6388 10.6388 11.3894 11.3894 11.7242 11.7242 12.5102 12.5102 12.7407 12.7407 14.3731 14.3731 14.8255 14.8255 k =-0.2773 0.8391 0.1545 ( 3023 PWs) bands (ev): 6.6239 6.6239 7.1939 7.1939 7.4030 7.4030 7.6626 7.6626 7.8661 7.8661 8.4906 8.4906 8.8669 8.8669 9.2840 9.2840 9.5613 9.5613 10.0718 10.0718 10.2873 10.2873 10.6029 10.6029 11.3947 11.3947 11.7545 11.7545 12.5247 12.5247 12.7223 12.7223 14.3639 14.3639 14.8018 14.8018 k =-0.2773 0.8391 0.1716 ( 3029 PWs) bands (ev): 6.6165 6.6165 7.1829 7.1829 7.3977 7.3977 7.6588 7.6588 7.8634 7.8634 8.5090 8.5090 8.8831 8.8831 9.2710 9.2710 9.5985 9.5985 10.0553 10.0553 10.2856 10.2856 10.5724 10.5724 11.3955 11.3955 11.7831 11.7831 12.5407 12.5407 12.7092 12.7092 14.3509 14.3509 14.7763 14.7763 k =-0.2773 0.8391 0.1888 ( 3025 PWs) bands (ev): 6.6091 6.6091 7.1685 7.1685 7.3957 7.3957 7.6545 7.6545 7.8626 7.8626 8.5211 8.5211 8.9049 8.9049 9.2577 9.2577 9.6318 9.6318 10.0422 10.0422 10.2837 10.2837 10.5474 10.5474 11.3920 11.3920 11.8095 11.8095 12.5577 12.5577 12.7029 12.7029 14.3341 14.3341 14.7490 14.7490 k =-0.2773 0.8391 0.2059 ( 3033 PWs) bands (ev): 6.6020 6.6020 7.1511 7.1511 7.3966 7.3966 7.6495 7.6495 7.8633 7.8633 8.5277 8.5277 8.9302 8.9302 9.2453 9.2453 9.6571 9.6571 10.0360 10.0360 10.2822 10.2822 10.5275 10.5275 11.3840 11.3840 11.8339 11.8339 12.5752 12.5752 12.7045 12.7045 14.3138 14.3138 14.7200 14.7200 k =-0.2773 0.8391 0.2231 ( 3037 PWs) bands (ev): 6.5953 6.5953 7.1316 7.1316 7.3999 7.3999 7.6438 7.6438 7.8653 7.8653 8.5300 8.5300 8.9567 8.9567 9.2350 9.2350 9.6708 9.6708 10.0396 10.0396 10.2821 10.2821 10.5123 10.5123 11.3717 11.3717 11.8564 11.8564 12.5930 12.5930 12.7141 12.7141 14.2904 14.2904 14.6892 14.6892 k =-0.2773 0.8391 0.2403 ( 3037 PWs) bands (ev): 6.5892 6.5892 7.1107 7.1107 7.4050 7.4050 7.6372 7.6372 7.8685 7.8685 8.5294 8.5294 8.9811 8.9811 9.2286 9.2286 9.6718 9.6718 10.0527 10.0527 10.2857 10.2857 10.5014 10.5014 11.3554 11.3554 11.8775 11.8775 12.6116 12.6116 12.7312 12.7312 14.2644 14.2644 14.6565 14.6565 k =-0.2773 0.8391 0.2574 ( 3039 PWs) bands (ev): 6.5838 6.5838 7.0889 7.0889 7.4112 7.4112 7.6296 7.6296 7.8727 7.8727 8.5270 8.5270 9.0002 9.0002 9.2279 9.2279 9.6619 9.6619 10.0704 10.0704 10.2960 10.2960 10.4942 10.4942 11.3357 11.3357 11.8977 11.8977 12.6319 12.6319 12.7543 12.7543 14.2361 14.2361 14.6220 14.6220 k =-0.2773 0.8391 0.2746 ( 3041 PWs) bands (ev): 6.5792 6.5792 7.0670 7.0670 7.4177 7.4177 7.6211 7.6211 7.8778 7.8778 8.5237 8.5237 9.0112 9.0112 9.2346 9.2346 9.6448 9.6448 10.0856 10.0856 10.3170 10.3170 10.4906 10.4906 11.3134 11.3134 11.9177 11.9177 12.6541 12.6541 12.7820 12.7820 14.2058 14.2058 14.5857 14.5857 k =-0.2773 0.8391 0.2918 ( 3041 PWs) bands (ev): 6.5756 6.5756 7.0453 7.0453 7.4241 7.4241 7.6115 7.6115 7.8839 7.8839 8.5202 8.5202 9.0130 9.0130 9.2486 9.2486 9.6239 9.6239 10.0929 10.0929 10.3502 10.3502 10.4907 10.4907 11.2893 11.2893 11.9380 11.9380 12.6784 12.6784 12.8135 12.8135 14.1741 14.1741 14.5477 14.5477 k =-0.2773 0.8391 0.3089 ( 3047 PWs) bands (ev): 6.5730 6.5730 7.0240 7.0240 7.4296 7.4296 7.6011 7.6011 7.8910 7.8910 8.5170 8.5170 9.0068 9.0068 9.2682 9.2682 9.6018 9.6018 10.0914 10.0914 10.3920 10.3920 10.4960 10.4960 11.2644 11.2644 11.9592 11.9592 12.7042 12.7042 12.8480 12.8480 14.1412 14.1412 14.5080 14.5080 k =-0.2773 0.8391 0.3261 ( 3045 PWs) bands (ev): 6.5715 6.5715 7.0035 7.0035 7.4337 7.4337 7.5900 7.5900 7.8993 7.8993 8.5146 8.5146 8.9947 8.9947 9.2905 9.2905 9.5805 9.5805 10.0830 10.0830 10.4330 10.4330 10.5120 10.5120 11.2402 11.2402 11.9816 11.9816 12.7307 12.7307 12.8852 12.8852 14.1075 14.1075 14.4669 14.4669 k =-0.2773 0.8391 0.3432 ( 3041 PWs) bands (ev): 6.5712 6.5712 6.9838 6.9838 7.4357 7.4357 7.5783 7.5783 7.9090 7.9090 8.5132 8.5132 8.9784 8.9784 9.3129 9.3129 9.5613 9.5613 10.0697 10.0697 10.4596 10.4596 10.5479 10.5479 11.2181 11.2181 12.0055 12.0055 12.7572 12.7572 12.9248 12.9248 14.0733 14.0733 14.4244 14.4244 k =-0.2773 0.8391 0.3604 ( 3039 PWs) bands (ev): 6.5722 6.5722 6.9650 6.9650 7.4354 7.4354 7.5662 7.5662 7.9203 7.9203 8.5129 8.5129 8.9592 8.9592 9.3332 9.3332 9.5456 9.5456 10.0532 10.0532 10.4731 10.4731 10.5984 10.5984 11.2001 11.2001 12.0312 12.0312 12.7830 12.7830 12.9664 12.9664 14.0390 14.0390 14.3809 14.3809 k =-0.2773 0.8391 0.3776 ( 3043 PWs) bands (ev): 6.5745 6.5745 6.9472 6.9472 7.4322 7.4322 7.5540 7.5540 7.9334 7.9334 8.5139 8.5139 8.9381 8.9381 9.3492 9.3492 9.5347 9.5347 10.0347 10.0347 10.4819 10.4819 10.6511 10.6511 11.1892 11.1892 12.0584 12.0584 12.8076 12.8076 13.0093 13.0093 14.0047 14.0047 14.3366 14.3366 k =-0.2773 0.8391 0.3947 ( 3039 PWs) bands (ev): 6.5781 6.5781 6.9303 6.9303 7.4260 7.4260 7.5417 7.5417 7.9484 7.9484 8.5161 8.5161 8.9157 8.9157 9.3590 9.3590 9.5302 9.5302 10.0151 10.0151 10.4893 10.4893 10.6982 10.6982 11.1887 11.1887 12.0868 12.0868 12.8308 12.8308 13.0530 13.0530 13.9710 13.9710 14.2921 14.2921 k =-0.2773 0.8391 0.4119 ( 3039 PWs) bands (ev): 6.5830 6.5830 6.9144 6.9144 7.4171 7.4171 7.5294 7.5294 7.9656 7.9656 8.5194 8.5194 8.8925 8.8925 9.3614 9.3614 9.5328 9.5328 9.9950 9.9950 10.4962 10.4962 10.7346 10.7346 11.2024 11.2024 12.1160 12.1160 12.8526 12.8526 13.0964 13.0964 13.9380 13.9380 14.2477 14.2477 k =-0.2773 0.8391 0.4291 ( 3039 PWs) bands (ev): 6.5893 6.5893 6.8993 6.8993 7.4058 7.4058 7.5169 7.5169 7.9849 7.9849 8.5236 8.5236 8.8688 8.8688 9.3568 9.3568 9.5419 9.5419 9.9749 9.9749 10.5030 10.5030 10.7569 10.7569 11.2326 11.2326 12.1453 12.1453 12.8731 12.8731 13.1385 13.1385 13.9063 13.9063 14.2041 14.2041 k =-0.2773 0.8391 0.4462 ( 3039 PWs) bands (ev): 6.5968 6.5968 6.8850 6.8850 7.3927 7.3927 7.5043 7.5043 8.0063 8.0063 8.5283 8.5283 8.8451 8.8451 9.3470 9.3470 9.5557 9.5557 9.9551 9.9551 10.5096 10.5096 10.7655 10.7655 11.2787 11.2787 12.1735 12.1735 12.8926 12.8926 13.1783 13.1783 13.8761 13.8761 14.1619 14.1619 k =-0.2773 0.8391 0.4634 ( 3037 PWs) bands (ev): 6.6055 6.6055 6.8714 6.8714 7.3784 7.3784 7.4915 7.4915 8.0296 8.0296 8.5331 8.5331 8.8219 8.8219 9.3336 9.3336 9.5723 9.5723 9.9359 9.9359 10.5163 10.5163 10.7632 10.7632 11.3373 11.3373 12.1994 12.1994 12.9115 12.9115 13.2145 13.2145 13.8480 13.8480 14.1218 14.1218 k =-0.2773 0.8391 0.4805 ( 3041 PWs) bands (ev): 6.6155 6.6155 6.8582 6.8582 7.3635 7.3635 7.4786 7.4786 8.0547 8.0547 8.5371 8.5371 8.7998 8.7998 9.3181 9.3181 9.5904 9.5904 9.9176 9.9176 10.5230 10.5230 10.7534 10.7534 11.4045 11.4045 12.2217 12.2217 12.9305 12.9305 13.2457 13.2457 13.8225 13.8225 14.0845 14.0845 k =-0.2773 0.8391 0.4977 ( 3045 PWs) bands (ev): 6.6265 6.6265 6.8454 6.8454 7.3486 7.3486 7.4659 7.4659 8.0812 8.0812 8.5395 8.5395 8.7795 8.7795 9.3014 9.3014 9.6093 9.6093 9.9001 9.9001 10.5298 10.5298 10.7390 10.7390 11.4771 11.4771 12.2387 12.2387 12.9501 12.9501 13.2709 13.2709 13.8001 13.8001 14.0509 14.0509 k =-0.2773 0.8391 0.5149 ( 3045 PWs) bands (ev): 6.6385 6.6385 6.8327 6.8327 7.3341 7.3341 7.4536 7.4536 8.1087 8.1087 8.5392 8.5392 8.7620 8.7620 9.2844 9.2844 9.6284 9.6284 9.8835 9.8835 10.5368 10.5368 10.7221 10.7221 11.5526 11.5526 12.2489 12.2489 12.9709 12.9709 13.2888 13.2888 13.7812 13.7812 14.0215 14.0215 k =-0.2773 0.8391 0.5320 ( 3045 PWs) bands (ev): 6.6514 6.6514 6.8201 6.8201 7.3206 7.3206 7.4420 7.4420 8.1369 8.1369 8.5352 8.5352 8.7481 8.7481 9.2676 9.2676 9.6473 9.6473 9.8677 9.8677 10.5442 10.5442 10.7040 10.7040 11.6291 11.6291 12.2511 12.2511 12.9933 12.9933 13.2989 13.2989 13.7659 13.7659 13.9969 13.9969 k =-0.2773 0.8391 0.5492 ( 3049 PWs) bands (ev): 6.6650 6.6650 6.8073 6.8073 7.3084 7.3084 7.4316 7.4316 8.1650 8.1650 8.5270 8.5270 8.7384 8.7384 9.2519 9.2519 9.6658 9.6658 9.8527 9.8527 10.5521 10.5521 10.6857 10.6857 11.7050 11.7050 12.2444 12.2444 13.0173 13.0173 13.3011 13.3011 13.7540 13.7540 13.9774 13.9774 k =-0.2773 0.8391 0.5664 ( 3047 PWs) bands (ev): 6.6792 6.6792 6.7943 6.7943 7.2979 7.2979 7.4225 7.4225 8.1922 8.1922 8.5150 8.5150 8.7326 8.7326 9.2378 9.2378 9.6834 9.6834 9.8384 9.8384 10.5607 10.5607 10.6677 10.6677 11.7789 11.7789 12.2285 12.2285 13.0427 13.0427 13.2964 13.2964 13.7451 13.7451 13.9628 13.9628 k =-0.2773 0.8391 0.5835 ( 3051 PWs) bands (ev): 6.6938 6.6938 6.7809 6.7809 7.2894 7.2894 7.4152 7.4152 8.2172 8.2172 8.5008 8.5008 8.7299 8.7299 9.2260 9.2260 9.6997 9.6997 9.8250 9.8250 10.5701 10.5701 10.6504 10.6504 11.8492 11.8492 12.2040 12.2040 13.0681 13.0681 13.2862 13.2862 13.7388 13.7388 13.9526 13.9526 k =-0.2773 0.8391 0.6007 ( 3043 PWs) bands (ev): 6.7087 6.7087 6.7671 6.7671 7.2832 7.2832 7.4097 7.4097 8.2384 8.2384 8.4868 8.4868 8.7291 8.7291 9.2171 9.2171 9.7139 9.7139 9.8132 9.8132 10.5804 10.5804 10.6341 10.6341 11.9135 11.9135 12.1726 12.1726 13.0915 13.0915 13.2733 13.2733 13.7345 13.7345 13.9462 13.9462 k =-0.2773 0.8391 0.6178 ( 3041 PWs) bands (ev): 6.7235 6.7235 6.7529 6.7529 7.2794 7.2794 7.4064 7.4064 8.2530 8.2530 8.4763 8.4763 8.7291 8.7291 9.2115 9.2115 9.7244 9.7244 9.8042 9.8042 10.5916 10.5916 10.6192 10.6192 11.9662 11.9662 12.1397 12.1397 13.1092 13.1092 13.2617 13.2617 13.7320 13.7320 13.9428 13.9428 k =-0.2773 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7379 6.7379 6.7387 6.7387 7.2781 7.2781 7.4053 7.4053 8.2583 8.2583 8.4722 8.4722 8.7292 8.7292 9.2096 9.2096 9.7284 9.7284 9.8007 9.8007 10.6012 10.6012 10.6084 10.6084 11.9902 11.9902 12.1223 12.1223 13.1161 13.1161 13.2568 13.2568 13.7312 13.7312 13.9417 13.9417 k =-0.2773 0.8391 0.6350 ( 3044 PWs) bands (ev): 6.7379 6.7379 6.7387 6.7387 7.2781 7.2781 7.4053 7.4053 8.2583 8.2583 8.4722 8.4722 8.7292 8.7292 9.2096 9.2096 9.7284 9.7284 9.8007 9.8007 10.6012 10.6012 10.6084 10.6084 11.9902 11.9902 12.1223 12.1223 13.1161 13.1161 13.2568 13.2568 13.7312 13.7312 13.9417 13.9417 k =-0.2826 0.8230 0.6350 ( 3040 PWs) bands (ev): 6.7499 6.7499 6.7501 6.7501 7.2716 7.2716 7.4006 7.4006 8.2617 8.2617 8.4752 8.4752 8.7364 8.7364 9.2213 9.2213 9.7251 9.7251 9.7999 9.7999 10.5459 10.5459 10.5519 10.5519 12.0059 12.0059 12.1399 12.1399 13.1161 13.1161 13.2440 13.2440 13.7571 13.7571 13.9898 13.9898 k =-0.2879 0.8070 0.6350 ( 3044 PWs) bands (ev): 6.7625 6.7625 6.7628 6.7628 7.2661 7.2661 7.3970 7.3970 8.2665 8.2665 8.4788 8.4788 8.7436 8.7436 9.2320 9.2320 9.7175 9.7175 9.7963 9.7963 10.4889 10.4889 10.4965 10.4965 12.0096 12.0096 12.1423 12.1423 13.1281 13.1281 13.2399 13.2399 13.7872 13.7872 14.0392 14.0392 k =-0.2932 0.7909 0.6350 ( 3050 PWs) bands (ev): 6.7759 6.7759 6.7768 6.7768 7.2616 7.2616 7.3945 7.3945 8.2726 8.2726 8.4832 8.4832 8.7505 8.7505 9.2416 9.2416 9.7052 9.7052 9.7890 9.7890 10.4324 10.4324 10.4440 10.4440 11.9998 11.9998 12.1278 12.1278 13.1528 13.1528 13.2457 13.2457 13.8210 13.8210 14.0895 14.0895 k =-0.2985 0.7749 0.6350 ( 3050 PWs) bands (ev): 6.7901 6.7901 6.7917 6.7917 7.2581 7.2581 7.3932 7.3932 8.2799 8.2799 8.4883 8.4883 8.7566 8.7566 9.2499 9.2499 9.6880 9.6880 9.7772 9.7772 10.3787 10.3787 10.3957 10.3957 11.9764 11.9764 12.0971 12.0971 13.1895 13.1895 13.2613 13.2613 13.8581 13.8581 14.1404 14.1404 k =-0.3038 0.7589 0.6350 ( 3046 PWs) bands (ev): 6.8052 6.8052 6.8075 6.8075 7.2556 7.2556 7.3930 7.3930 8.2883 8.2883 8.4942 8.4942 8.7615 8.7615 9.2567 9.2567 9.6659 9.6659 9.7600 9.7600 10.3298 10.3298 10.3528 10.3528 11.9400 11.9400 12.0520 12.0520 13.2358 13.2358 13.2859 13.2859 13.8982 13.8982 14.1912 14.1912 k =-0.3091 0.7428 0.6350 ( 3050 PWs) bands (ev): 6.8210 6.8210 6.8240 6.8240 7.2541 7.2541 7.3940 7.3940 8.2976 8.2976 8.5007 8.5007 8.7646 8.7646 9.2614 9.2614 9.6397 9.6397 9.7370 9.7370 10.2873 10.2873 10.3156 10.3156 11.8921 11.8921 11.9952 11.9952 13.2889 13.2889 13.3181 13.3181 13.9408 13.9408 14.2416 14.2416 k =-0.3144 0.7268 0.6350 ( 3050 PWs) bands (ev): 6.8375 6.8375 6.8412 6.8412 7.2536 7.2536 7.3961 7.3961 8.3078 8.3078 8.5078 8.5078 8.7652 8.7652 9.2635 9.2635 9.6104 9.6104 9.7087 9.7087 10.2522 10.2522 10.2843 10.2843 11.8345 11.8345 11.9292 11.9292 13.3460 13.3460 13.3562 13.3562 13.9855 13.9855 14.2909 14.2909 k =-0.3197 0.7107 0.6350 ( 3050 PWs) bands (ev): 6.8545 6.8545 6.8590 6.8590 7.2542 7.2542 7.3995 7.3995 8.3187 8.3187 8.5155 8.5155 8.7626 8.7626 9.2619 9.2619 9.5796 9.5796 9.6762 9.6762 10.2247 10.2247 10.2584 10.2584 11.7692 11.7692 11.8563 11.8563 13.3984 13.3984 13.4048 13.4048 14.0322 14.0322 14.3387 14.3387 k =-0.3250 0.6947 0.6350 ( 3046 PWs) bands (ev): 6.8720 6.8720 6.8771 6.8771 7.2559 7.2559 7.4041 7.4041 8.3300 8.3300 8.5234 8.5234 8.7558 8.7558 9.2556 9.2556 9.5492 9.5492 9.6419 9.6419 10.2042 10.2042 10.2373 10.2373 11.6978 11.6978 11.7786 11.7786 13.4431 13.4431 13.4634 13.4634 14.0805 14.0805 14.3843 14.3843 k =-0.3303 0.6786 0.6350 ( 3042 PWs) bands (ev): 6.8897 6.8897 6.8956 6.8956 7.2586 7.2586 7.4099 7.4099 8.3416 8.3416 8.5315 8.5315 8.7443 8.7443 9.2432 9.2432 9.5212 9.5212 9.6086 9.6086 10.1898 10.1898 10.2200 10.2200 11.6220 11.6220 11.6975 11.6975 13.4891 13.4891 13.5202 13.5202 14.1300 14.1300 14.4273 14.4273 k =-0.3356 0.6626 0.6350 ( 3038 PWs) bands (ev): 6.9076 6.9076 6.9140 6.9140 7.2626 7.2626 7.4169 7.4169 8.3532 8.3532 8.5392 8.5392 8.7277 8.7277 9.2232 9.2232 9.4973 9.4973 9.5792 9.5792 10.1801 10.1801 10.2057 10.2057 11.5432 11.5432 11.6144 11.6144 13.5349 13.5349 13.5740 13.5740 14.1805 14.1805 14.4668 14.4668 k =-0.3409 0.6466 0.6350 ( 3038 PWs) bands (ev): 6.9254 6.9254 6.9323 6.9323 7.2677 7.2677 7.4253 7.4253 8.3645 8.3645 8.5461 8.5461 8.7061 8.7061 9.1953 9.1953 9.4789 9.4789 9.5558 9.5558 10.1741 10.1741 10.1933 10.1933 11.4629 11.4629 11.5306 11.5306 13.5797 13.5797 13.6239 13.6239 14.2318 14.2318 14.5025 14.5025 k =-0.3462 0.6305 0.6350 ( 3032 PWs) bands (ev): 6.9430 6.9430 6.9502 6.9502 7.2742 7.2742 7.4350 7.4350 8.3753 8.3753 8.5507 8.5507 8.6810 8.6810 9.1602 9.1602 9.4666 9.4666 9.5389 9.5389 10.1706 10.1706 10.1822 10.1822 11.3821 11.3821 11.4469 11.4469 13.6223 13.6223 13.6690 13.6690 14.2836 14.2836 14.5334 14.5334 k =-0.3515 0.6145 0.6350 ( 3036 PWs) bands (ev): 6.9601 6.9601 6.9673 6.9673 7.2821 7.2821 7.4462 7.4462 8.3853 8.3853 8.5500 8.5500 8.6560 8.6560 9.1196 9.1196 9.4606 9.4606 9.5279 9.5279 10.1687 10.1687 10.1713 10.1713 11.3021 11.3021 11.3645 11.3645 13.6618 13.6618 13.7086 13.7086 14.3360 14.3360 14.5590 14.5590 k =-0.3568 0.5984 0.6350 ( 3040 PWs) bands (ev): 6.9765 6.9765 6.9835 6.9835 7.2916 7.2916 7.4588 7.4588 8.3940 8.3940 8.5380 8.5380 8.6377 8.6377 9.0756 9.0756 9.4607 9.4607 9.5216 9.5216 10.1598 10.1598 10.1676 10.1676 11.2242 11.2242 11.2844 11.2844 13.6974 13.6974 13.7422 13.7422 14.3886 14.3886 14.5786 14.5786 k =-0.3621 0.5824 0.6350 ( 3036 PWs) bands (ev): 6.9920 6.9920 6.9982 6.9982 7.3027 7.3027 7.4729 7.4729 8.4011 8.4011 8.5110 8.5110 8.6308 8.6308 9.0306 9.0306 9.4661 9.4661 9.5187 9.5187 10.1468 10.1468 10.1664 10.1664 11.1495 11.1495 11.2076 11.2076 13.7282 13.7282 13.7693 13.7693 14.4413 14.4413 14.5917 14.5917 k =-0.3674 0.5663 0.6350 ( 3032 PWs) bands (ev): 7.0064 7.0064 7.0114 7.0114 7.3156 7.3156 7.4885 7.4885 8.4063 8.4063 8.4731 8.4731 8.6323 8.6323 8.9862 8.9862 9.4763 9.4763 9.5182 9.5182 10.1315 10.1315 10.1642 10.1642 11.0793 11.0793 11.1353 11.1353 13.7536 13.7536 13.7897 13.7897 14.4939 14.4939 14.5985 14.5985 k =-0.3727 0.5503 0.6350 ( 3028 PWs) bands (ev): 7.0193 7.0193 7.0227 7.0227 7.3303 7.3303 7.5057 7.5057 8.4091 8.4091 8.4299 8.4299 8.6378 8.6378 8.9438 8.9438 9.4904 9.4904 9.5191 9.5191 10.1126 10.1126 10.1602 10.1602 11.0149 11.0149 11.0685 11.0685 13.7728 13.7728 13.8032 13.8032 14.5455 14.5455 14.5994 14.5994 k =-0.3780 0.5342 0.6350 ( 3024 PWs) bands (ev): 7.0307 7.0307 7.0318 7.0318 7.3469 7.3469 7.5244 7.5244 8.3845 8.3845 8.4093 8.4093 8.6449 8.6449 8.9045 8.9045 9.5076 9.5076 9.5211 9.5211 10.0894 10.0894 10.1533 10.1533 10.9577 10.9577 11.0086 11.0086 13.7854 13.7854 13.8099 13.8099 14.5942 14.5942 14.5956 14.5956 k =-0.3834 0.5182 0.6350 ( 3022 PWs) bands (ev): 7.0388 7.0388 7.0402 7.0402 7.3651 7.3651 7.5447 7.5447 8.3387 8.3387 8.4068 8.4068 8.6528 8.6528 8.8689 8.8689 9.5234 9.5234 9.5273 9.5273 10.0609 10.0609 10.1428 10.1428 10.9086 10.9086 10.9567 10.9567 13.7912 13.7912 13.8103 13.8103 14.5884 14.5884 14.6358 14.6358 k =-0.3887 0.5022 0.6350 ( 3022 PWs) bands (ev): 7.0435 7.0435 7.0479 7.0479 7.3849 7.3849 7.5663 7.5663 8.2937 8.2937 8.4016 8.4016 8.6610 8.6610 8.8374 8.8374 9.5258 9.5258 9.5489 9.5489 10.0266 10.0266 10.1279 10.1279 10.8686 10.8686 10.9139 10.9139 13.7902 13.7902 13.8048 13.8048 14.5790 14.5790 14.6609 14.6609 k =-0.3940 0.4861 0.6350 ( 3030 PWs) bands (ev): 7.0461 7.0461 7.0534 7.0534 7.4060 7.4060 7.5893 7.5893 8.2505 8.2505 8.3941 8.3941 8.6692 8.6692 8.8100 8.8100 9.5277 9.5277 9.5716 9.5716 9.9865 9.9865 10.1083 10.1083 10.8379 10.8379 10.8807 10.8807 13.7829 13.7829 13.7940 13.7940 14.5682 14.5682 14.6623 14.6623 k =-0.3993 0.4701 0.6350 ( 3034 PWs) bands (ev): 7.0465 7.0465 7.0569 7.0569 7.4281 7.4281 7.6132 7.6132 8.2096 8.2096 8.3848 8.3848 8.6773 8.6773 8.7863 8.7863 9.5287 9.5287 9.5949 9.5949 9.9412 9.9412 10.0844 10.0844 10.8163 10.8163 10.8572 10.8572 13.7700 13.7700 13.7787 13.7787 14.5565 14.5565 14.6464 14.6464 k =-0.4046 0.4540 0.6350 ( 3034 PWs) bands (ev): 7.0449 7.0449 7.0582 7.0582 7.4510 7.4510 7.6380 7.6380 8.1718 8.1718 8.3745 8.3745 8.6853 8.6853 8.7658 8.7658 9.5281 9.5281 9.6177 9.6177 9.8919 9.8919 10.0572 10.0572 10.8033 10.8033 10.8430 10.8430 13.7521 13.7521 13.7596 13.7596 14.5440 14.5440 14.6220 14.6221 k =-0.4099 0.4380 0.6350 ( 3030 PWs) bands (ev): 7.0416 7.0416 7.0574 7.0574 7.4744 7.4744 7.6632 7.6632 8.1375 8.1375 8.3641 8.3641 8.6933 8.6933 8.7479 8.7479 9.5252 9.5252 9.6383 9.6383 9.8410 9.8410 10.0283 10.0283 10.7979 10.7979 10.8372 10.8372 13.7301 13.7301 13.7376 13.7376 14.5307 14.5307 14.5939 14.5939 k =-0.4152 0.4219 0.6350 ( 3026 PWs) bands (ev): 7.0367 7.0367 7.0547 7.0547 7.4979 7.4979 7.6883 7.6883 8.1073 8.1073 8.3542 8.3542 8.7012 8.7012 8.7319 8.7319 9.5191 9.5191 9.6519 9.6519 9.7941 9.7941 9.9994 9.9994 10.7991 10.7991 10.8386 10.8386 13.7052 13.7052 13.7133 13.7133 14.5163 14.5163 14.5635 14.5635 k =-0.4205 0.4059 0.6350 ( 3026 PWs) bands (ev): 7.0303 7.0303 7.0501 7.0501 7.5212 7.5212 7.7126 7.7126 8.0818 8.0818 8.3456 8.3456 8.7091 8.7091 8.7173 8.7173 9.5089 9.5089 9.6455 9.6455 9.7647 9.7647 9.9726 9.9726 10.8058 10.8058 10.8458 10.8458 13.6780 13.6780 13.6874 13.6874 14.5008 14.5008 14.5318 14.5318 k =-0.4258 0.3899 0.6350 ( 3028 PWs) bands (ev): 7.0229 7.0229 7.0438 7.0438 7.5440 7.5440 7.7354 7.7354 8.0615 8.0615 8.3389 8.3389 8.7038 8.7038 8.7173 8.7173 9.4936 9.4936 9.6089 9.6089 9.7637 9.7637 9.9496 9.9496 10.8169 10.8169 10.8576 10.8576 13.6494 13.6494 13.6604 13.6604 14.4838 14.4838 14.4991 14.4991 k =-0.4311 0.3738 0.6350 ( 3020 PWs) bands (ev): 7.0145 7.0145 7.0362 7.0362 7.5662 7.5662 7.7556 7.7556 8.0474 8.0474 8.3342 8.3342 8.6912 8.6912 8.7258 8.7258 9.4728 9.4728 9.5555 9.5555 9.7782 9.7782 9.9316 9.9316 10.8317 10.8317 10.8728 10.8728 13.6202 13.6202 13.6330 13.6330 14.4654 14.4654 14.4658 14.4658 k =-0.4364 0.3578 0.6350 ( 3024 PWs) bands (ev): 7.0056 7.0056 7.0274 7.0274 7.5874 7.5874 7.7721 7.7721 8.0401 8.0401 8.3317 8.3317 8.6795 8.6795 8.7347 8.7347 9.4466 9.4466 9.4964 9.4964 9.7975 9.7975 9.9191 9.9191 10.8492 10.8492 10.8905 10.8905 13.5911 13.5911 13.6056 13.6056 14.4322 14.4322 14.4454 14.4454 k =-0.4417 0.3417 0.6350 ( 3036 PWs) bands (ev): 6.9963 6.9963 7.0177 7.0177 7.6074 7.6074 7.7839 7.7839 8.0402 8.0402 8.3312 8.3312 8.6690 8.6690 8.7442 8.7442 9.4155 9.4155 9.4358 9.4358 9.8178 9.8178 9.9119 9.9119 10.8688 10.8688 10.9097 10.9097 13.5625 13.5625 13.5786 13.5786 14.3989 14.3989 14.4240 14.4240 k =-0.4470 0.3257 0.6350 ( 3036 PWs) bands (ev): 6.9868 6.9868 7.0075 7.0075 7.6262 7.6262 7.7910 7.7910 8.0475 8.0475 8.3324 8.3324 8.6600 8.6600 8.7545 8.7545 9.3751 9.3751 9.3805 9.3805 9.8378 9.8378 9.9091 9.9091 10.8896 10.8896 10.9297 10.9297 13.5350 13.5350 13.5524 13.5524 14.3664 14.3664 14.4011 14.4011 k =-0.4523 0.3096 0.6350 ( 3024 PWs) bands (ev): 6.9776 6.9776 6.9971 6.9971 7.6437 7.6437 7.7936 7.7936 8.0611 8.0611 8.3345 8.3345 8.6533 8.6533 8.7656 8.7656 9.3153 9.3153 9.3428 9.3428 9.8569 9.8569 9.9100 9.9100 10.9111 10.9111 10.9497 10.9497 13.5092 13.5092 13.5274 13.5274 14.3353 14.3353 14.3771 14.3771 k =-0.4576 0.2936 0.6350 ( 3028 PWs) bands (ev): 6.9687 6.9687 6.9868 6.9868 7.6597 7.6597 7.7929 7.7929 8.0795 8.0795 8.3367 8.3367 8.6496 8.6496 8.7777 8.7777 9.2570 9.2570 9.3034 9.3034 9.8745 9.8745 9.9133 9.9133 10.9326 10.9326 10.9691 10.9691 13.4853 13.4853 13.5037 13.5037 14.3061 14.3061 14.3525 14.3525 k =-0.4629 0.2775 0.6350 ( 3032 PWs) bands (ev): 6.9605 6.9605 6.9768 6.9768 7.6743 7.6743 7.7899 7.7899 8.1013 8.1013 8.3379 8.3379 8.6499 8.6499 8.7906 8.7906 9.2009 9.2009 9.2632 9.2632 9.8906 9.8906 9.9183 9.9183 10.9535 10.9535 10.9872 10.9872 13.4637 13.4637 13.4818 13.4818 14.2796 14.2796 14.3276 14.3276 k =-0.4682 0.2615 0.6350 ( 3038 PWs) bands (ev): 6.9531 6.9531 6.9675 6.9675 7.6876 7.6876 7.7853 7.7853 8.1251 8.1251 8.3371 8.3371 8.6551 8.6551 8.8040 8.8040 9.1478 9.1478 9.2230 9.2230 9.9048 9.9048 9.9242 9.9242 10.9734 10.9734 11.0037 11.0037 13.4447 13.4447 13.4618 13.4618 14.2562 14.2562 14.3032 14.3032 k =-0.4735 0.2455 0.6350 ( 3034 PWs) bands (ev): 6.9468 6.9468 6.9589 6.9589 7.6998 7.6998 7.7799 7.7799 8.1499 8.1499 8.3334 8.3334 8.6657 8.6657 8.8171 8.8171 9.0989 9.0989 9.1835 9.1835 9.9171 9.9171 9.9302 9.9302 10.9917 10.9917 11.0179 11.0179 13.4286 13.4286 13.4441 13.4441 14.2366 14.2366 14.2799 14.2799 k =-0.4788 0.2294 0.6350 ( 3034 PWs) bands (ev): 6.9416 6.9416 6.9515 6.9515 7.7107 7.7107 7.7739 7.7739 8.1749 8.1749 8.3263 8.3263 8.6818 8.6818 8.8283 8.8283 9.0563 9.0563 9.1454 9.1454 9.9273 9.9273 9.9358 9.9358 11.0079 11.0079 11.0296 11.0296 13.4156 13.4156 13.4289 13.4289 14.2210 14.2210 14.2585 14.2585 k =-0.4841 0.2134 0.6350 ( 3030 PWs) bands (ev): 6.9377 6.9377 6.9452 6.9452 7.7208 7.7208 7.7675 7.7675 8.1995 8.1995 8.3158 8.3158 8.7030 8.7030 8.8339 8.8339 9.0239 9.0239 9.1093 9.1093 9.9353 9.9353 9.9406 9.9406 11.0216 11.0216 11.0383 11.0383 13.4058 13.4058 13.4163 13.4163 14.2099 14.2099 14.2397 14.2397 k =-0.4894 0.1973 0.6350 ( 3036 PWs) bands (ev): 6.9352 6.9352 6.9402 6.9402 7.7299 7.7299 7.7608 7.7608 8.2233 8.2233 8.3022 8.3022 8.7284 8.7284 8.8290 8.8290 9.0069 9.0069 9.0759 9.0759 9.9411 9.9411 9.9442 9.9442 11.0326 11.0326 11.0439 11.0439 13.3993 13.3993 13.4065 13.4066 14.2035 14.2035 14.2242 14.2242 k =-0.4947 0.1813 0.6350 ( 3028 PWs) bands (ev): 6.9342 6.9342 6.9367 6.9367 7.7384 7.7384 7.7537 7.7537 8.2458 8.2458 8.2857 8.2857 8.7567 8.7567 8.8116 8.8116 9.0077 9.0077 9.0464 9.0464 9.9449 9.9449 9.9462 9.9462 11.0404 11.0404 11.0461 11.0461 13.3962 13.3962 13.3999 13.3999 14.2018 14.2018 14.2124 14.2124 k =-0.5000 0.1652 0.6350 ( 3024 PWs) bands (ev): 6.9347 6.9347 6.9347 6.9347 7.7463 7.7463 7.7463 7.7463 8.2668 8.2668 8.2668 8.2668 8.7856 8.7856 8.7856 8.7856 9.0226 9.0226 9.0226 9.0226 9.9465 9.9465 9.9465 9.9465 11.0450 11.0450 11.0450 11.0450 13.3964 13.3964 13.3964 13.3964 14.2049 14.2049 14.2049 14.2049 k =-0.5000 0.1652 0.6350 ( 3024 PWs) bands (ev): 6.9347 6.9347 6.9347 6.9347 7.7463 7.7463 7.7463 7.7463 8.2668 8.2668 8.2668 8.2668 8.7856 8.7856 8.7856 8.7856 9.0226 9.0226 9.0226 9.0226 9.9465 9.9465 9.9465 9.9465 11.0450 11.0450 11.0450 11.0450 13.3964 13.3964 13.3964 13.3964 14.2049 14.2049 14.2049 14.2049 k =-0.5000 0.1652 0.6178 ( 3024 PWs) bands (ev): 6.9225 6.9225 6.9422 6.9422 7.7339 7.7339 7.7567 7.7567 8.2213 8.2213 8.3095 8.3095 8.7709 8.7709 8.7958 8.7958 9.0193 9.0193 9.0329 9.0329 9.9043 9.9043 9.9868 9.9868 11.0155 11.0155 11.0795 11.0795 13.3923 13.3923 13.4027 13.4027 14.1654 14.1654 14.2504 14.2504 k =-0.5000 0.1652 0.6007 ( 3028 PWs) bands (ev): 6.9053 6.9053 6.9454 6.9454 7.7191 7.7191 7.7654 7.7654 8.1741 8.1741 8.3485 8.3485 8.7530 8.7530 8.8009 8.8009 9.0230 9.0230 9.0492 9.0492 9.8607 9.8607 10.0243 10.0243 10.9925 10.9925 11.1176 11.1176 13.3901 13.3901 13.4115 13.4115 14.1326 14.1326 14.3014 14.3014 k =-0.5000 0.1652 0.5835 ( 3024 PWs) bands (ev): 6.8829 6.8829 6.9446 6.9446 7.7018 7.7018 7.7724 7.7724 8.1261 8.1261 8.3831 8.3831 8.7338 8.7338 8.8018 8.8018 9.0318 9.0318 9.0702 9.0702 9.8168 9.8168 10.0586 10.0586 10.9774 10.9774 11.1583 11.1583 13.3897 13.3897 13.4227 13.4227 14.1072 14.1072 14.3570 14.3570 k =-0.5000 0.1652 0.5664 ( 3026 PWs) bands (ev): 6.8552 6.8552 6.9402 6.9402 7.6815 7.6815 7.7777 7.7777 8.0784 8.0784 8.4125 8.4125 8.7147 8.7147 8.7999 8.7999 9.0425 9.0425 9.0952 9.0952 9.7733 9.7733 10.0890 10.0890 10.9716 10.9716 11.2005 11.2005 13.3907 13.3907 13.4365 13.4365 14.0898 14.0898 14.4167 14.4167 k =-0.5000 0.1652 0.5492 ( 3026 PWs) bands (ev): 6.8224 6.8224 6.9326 6.9326 7.6582 7.6582 7.7813 7.7813 8.0319 8.0319 8.4362 8.4362 8.6971 8.6971 8.7966 8.7966 9.0520 9.0520 9.1236 9.1236 9.7312 9.7312 10.1150 10.1150 10.9762 10.9762 11.2432 11.2432 13.3927 13.3927 13.4528 13.4528 14.0807 14.0807 14.4795 14.4795 k =-0.5000 0.1652 0.5320 ( 3022 PWs) bands (ev): 6.7846 6.7846 6.9223 6.9223 7.6316 7.6316 7.7829 7.7829 7.9875 7.9875 8.4538 8.4538 8.6821 8.6821 8.7927 8.7927 9.0581 9.0581 9.1547 9.1547 9.6915 9.6915 10.1364 10.1364 10.9922 10.9922 11.2859 11.2859 13.3953 13.3953 13.4715 13.4715 14.0805 14.0805 14.5448 14.5448 k =-0.5000 0.1652 0.5149 ( 3012 PWs) bands (ev): 6.7420 6.7420 6.9097 6.9097 7.6020 7.6020 7.7819 7.7819 7.9461 7.9461 8.4648 8.4648 8.6703 8.6703 8.7885 8.7885 9.0598 9.0598 9.1875 9.1875 9.6555 9.6555 10.1529 10.1529 11.0200 11.0200 11.3279 11.3279 13.3981 13.3981 13.4927 13.4927 14.0895 14.0895 14.6117 14.6117 k =-0.5000 0.1652 0.4977 ( 3008 PWs) bands (ev): 6.6952 6.6952 6.8951 6.8951 7.5696 7.5696 7.7771 7.7771 7.9091 7.9091 8.4693 8.4693 8.6618 8.6618 8.7839 8.7839 9.0572 9.0572 9.2211 9.2211 9.6241 9.6241 10.1641 10.1641 11.0594 11.0594 11.3689 11.3689 13.4009 13.4009 13.5161 13.5161 14.1080 14.1080 14.6784 14.6784 k =-0.5000 0.1652 0.4805 ( 3002 PWs) bands (ev): 6.6445 6.6445 6.8789 6.8789 7.5349 7.5349 7.7666 7.7666 7.8783 7.8783 8.4675 8.4675 8.6560 8.6560 8.7786 8.7786 9.0510 9.0510 9.2543 9.2543 9.5985 9.5985 10.1703 10.1703 11.1100 11.1100 11.4086 11.4086 13.4033 13.4033 13.5417 13.5417 14.1360 14.1360 14.7413 14.7413 k =-0.5000 0.1652 0.4634 ( 3010 PWs) bands (ev): 6.5905 6.5905 6.8614 6.8614 7.4983 7.4983 7.7483 7.7483 7.8556 7.8556 8.4599 8.4599 8.6517 8.6517 8.7726 8.7726 9.0428 9.0428 9.2862 9.2862 9.5796 9.5796 10.1717 10.1717 11.1706 11.1706 11.4468 11.4468 13.4052 13.4052 13.5693 13.5693 14.1735 14.1735 14.7906 14.7906 k =-0.5000 0.1652 0.4462 ( 3008 PWs) bands (ev): 6.5339 6.5339 6.8429 6.8429 7.4605 7.4605 7.7224 7.7224 7.8405 7.8405 8.4471 8.4471 8.6471 8.6471 8.7660 8.7660 9.0342 9.0342 9.3158 9.3158 9.5680 9.5680 10.1688 10.1688 11.2401 11.2401 11.4836 11.4836 13.4066 13.4066 13.5988 13.5988 14.2201 14.2201 14.8219 14.8219 k =-0.5000 0.1652 0.4291 ( 3008 PWs) bands (ev): 6.4753 6.4753 6.8235 6.8235 7.4219 7.4219 7.6914 7.6914 7.8303 7.8303 8.4298 8.4298 8.6400 8.6400 8.7595 8.7595 9.0273 9.0273 9.3423 9.3423 9.5639 9.5639 10.1621 10.1621 11.3167 11.3167 11.5192 11.5192 13.4073 13.4073 13.6300 13.6300 14.2755 14.2755 14.8452 14.8452 k =-0.5000 0.1652 0.4119 ( 3006 PWs) bands (ev): 6.4151 6.4151 6.8036 6.8036 7.3829 7.3829 7.6578 7.6578 7.8226 7.8226 8.4083 8.4083 8.6289 8.6289 8.7539 8.7539 9.0238 9.0238 9.3657 9.3657 9.5665 9.5665 10.1528 10.1528 11.3980 11.3980 11.5543 11.5543 13.4075 13.4075 13.6629 13.6629 14.3389 14.3389 14.8656 14.8657 k =-0.5000 0.1652 0.3947 ( 3010 PWs) bands (ev): 6.3541 6.3541 6.7834 6.7834 7.3440 7.3440 7.6230 7.6230 7.8156 7.8156 8.3829 8.3829 8.6129 8.6129 8.7496 8.7496 9.0250 9.0250 9.3862 9.3862 9.5741 9.5741 10.1417 10.1417 11.4801 11.4801 11.5918 11.5918 13.4073 13.4073 13.6973 13.6973 14.4096 14.4096 14.8844 14.8844 k =-0.5000 0.1652 0.3776 ( 3006 PWs) bands (ev): 6.2928 6.2928 6.7629 6.7629 7.3054 7.3054 7.5880 7.5880 7.8086 7.8086 8.3541 8.3541 8.5922 8.5922 8.7469 8.7469 9.0315 9.0315 9.4046 9.4046 9.5841 9.5841 10.1303 10.1303 11.5524 11.5524 11.6406 11.6406 13.4069 13.4069 13.7332 13.7332 14.4864 14.4864 14.9018 14.9018 k =-0.5000 0.1652 0.3604 ( 3012 PWs) bands (ev): 6.2316 6.2316 6.7424 6.7424 7.2673 7.2673 7.5531 7.5531 7.8011 7.8011 8.3224 8.3224 8.5679 8.5679 8.7456 8.7456 9.0433 9.0433 9.4219 9.4219 9.5942 9.5942 10.1200 10.1200 11.6014 11.6014 11.7132 11.7132 13.4065 13.4065 13.7703 13.7703 14.5682 14.5682 14.9179 14.9179 k =-0.5000 0.1652 0.3432 ( 3014 PWs) bands (ev): 6.1711 6.1711 6.7221 6.7221 7.2300 7.2300 7.5186 7.5186 7.7926 7.7926 8.2885 8.2885 8.5412 8.5412 8.7456 8.7456 9.0598 9.0598 9.4384 9.4384 9.6018 9.6018 10.1121 10.1121 11.6337 11.6337 11.8019 11.8019 13.4061 13.4061 13.8087 13.8087 14.6529 14.6529 14.9319 14.9319 k =-0.5000 0.1652 0.3261 ( 3010 PWs) bands (ev): 6.1116 6.1116 6.7020 6.7020 7.1936 7.1936 7.4850 7.4850 7.7831 7.7831 8.2532 8.2532 8.5134 8.5134 8.7467 8.7467 9.0803 9.0803 9.4545 9.4545 9.6055 9.6055 10.1079 10.1079 11.6589 11.6589 11.8960 11.8960 13.4060 13.4060 13.8481 13.8481 14.7374 14.7374 14.9314 14.9314 k =-0.5000 0.1652 0.3089 ( 3012 PWs) bands (ev): 6.0535 6.0535 6.6822 6.6822 7.1582 7.1582 7.4523 7.4523 7.7723 7.7723 8.2171 8.2171 8.4855 8.4855 8.7489 8.7489 9.1039 9.1039 9.4697 9.4697 9.6043 9.6043 10.1082 10.1082 11.6803 11.6803 11.9913 11.9913 13.4063 13.4063 13.8884 13.8884 14.8151 14.8151 14.8942 14.8942 k =-0.5000 0.1652 0.2918 ( 3016 PWs) bands (ev): 5.9971 5.9971 6.6629 6.6629 7.1240 7.1240 7.4207 7.4207 7.7599 7.7599 8.1810 8.1810 8.4585 8.4585 8.7522 8.7522 9.1297 9.1297 9.4831 9.4831 9.5990 9.5990 10.1132 10.1132 11.6990 11.6990 12.0859 12.0859 13.4070 13.4070 13.9294 13.9294 14.8473 14.8473 14.8737 14.8737 k =-0.5000 0.1652 0.2746 ( 3020 PWs) bands (ev): 5.9427 5.9427 6.6441 6.6441 7.0912 7.0912 7.3904 7.3904 7.7461 7.7461 8.1456 8.1456 8.4328 8.4328 8.7565 8.7565 9.1568 9.1568 9.4930 9.4930 9.5917 9.5917 10.1225 10.1225 11.7155 11.7155 12.1787 12.1787 13.4083 13.4083 13.9708 13.9708 14.7981 14.7981 14.9055 14.9055 k =-0.5000 0.1652 0.2574 ( 3012 PWs) bands (ev): 5.8906 5.8906 6.6260 6.6260 7.0597 7.0597 7.3615 7.3615 7.7307 7.7307 8.1115 8.1115 8.4092 8.4092 8.7617 8.7617 9.1842 9.1842 9.4963 9.4963 9.5867 9.5867 10.1352 10.1352 11.7302 11.7302 12.2687 12.2687 13.4102 13.4102 14.0123 14.0123 14.7483 14.7483 14.9199 14.9199 k =-0.5000 0.1652 0.2403 ( 3012 PWs) bands (ev): 5.8410 5.8410 6.6087 6.6087 7.0298 7.0298 7.3342 7.3342 7.7138 7.7138 8.0790 8.0790 8.3878 8.3878 8.7679 8.7679 9.2106 9.2106 9.4908 9.4908 9.5877 9.5877 10.1505 10.1505 11.7431 11.7431 12.3551 12.3551 13.4127 13.4127 14.0533 14.0533 14.6990 14.6990 14.9257 14.9257 k =-0.5000 0.1652 0.2231 ( 3012 PWs) bands (ev): 5.7941 5.7941 6.5921 6.5921 7.0015 7.0015 7.3084 7.3084 7.6956 7.6956 8.0485 8.0485 8.3690 8.3690 8.7749 8.7749 9.2342 9.2342 9.4788 9.4788 9.5946 9.5946 10.1672 10.1672 11.7547 11.7547 12.4374 12.4374 13.4157 13.4157 14.0931 14.0931 14.6514 14.6514 14.9269 14.9269 k =-0.5000 0.1652 0.2059 ( 3020 PWs) bands (ev): 5.7500 5.7500 6.5764 6.5764 6.9749 6.9749 7.2844 7.2844 7.6765 7.6765 8.0202 8.0202 8.3529 8.3529 8.7827 8.7827 9.2522 9.2522 9.4661 9.4661 9.6048 9.6048 10.1844 10.1844 11.7649 11.7649 12.5150 12.5150 13.4193 13.4193 14.1307 14.1307 14.6065 14.6065 14.9252 14.9252 k =-0.5000 0.1652 0.1888 ( 3020 PWs) bands (ev): 5.7090 5.7090 6.5617 6.5617 6.9501 6.9501 7.2621 7.2621 7.6567 7.6567 7.9942 7.9942 8.3394 8.3394 8.7914 8.7914 9.2610 9.2610 9.4588 9.4588 9.6161 9.6161 10.2014 10.2014 11.7741 11.7741 12.5875 12.5875 13.4233 13.4233 14.1649 14.1649 14.5658 14.5658 14.9215 14.9215 k =-0.5000 0.1652 0.1716 ( 3018 PWs) bands (ev): 5.6712 5.6712 6.5480 6.5480 6.9272 6.9272 7.2417 7.2417 7.6369 7.6369 7.9704 7.9704 8.3284 8.3284 8.8007 8.8007 9.2580 9.2580 9.4610 9.4610 9.6273 9.6273 10.2178 10.2178 11.7822 11.7822 12.6544 12.6544 13.4278 13.4278 14.1937 14.1937 14.5312 14.5312 14.9164 14.9164 k =-0.5000 0.1652 0.1545 ( 3016 PWs) bands (ev): 5.6366 5.6366 6.5354 6.5354 6.9062 6.9062 7.2231 7.2231 7.6173 7.6173 7.9488 7.9488 8.3198 8.3198 8.8108 8.8108 9.2439 9.2439 9.4726 9.4726 9.6377 9.6377 10.2329 10.2329 11.7896 11.7896 12.7156 12.7156 13.4325 13.4325 14.2146 14.2146 14.5051 14.5051 14.9104 14.9104 k =-0.5000 0.1652 0.1373 ( 3020 PWs) bands (ev): 5.6054 5.6054 6.5240 6.5240 6.8873 6.8873 7.2064 7.2064 7.5986 7.5986 7.9295 7.9295 8.3132 8.3132 8.8216 8.8216 9.2224 9.2224 9.4907 9.4907 9.6468 9.6468 10.2465 10.2465 11.7961 11.7961 12.7708 12.7708 13.4374 13.4374 14.2255 14.2255 14.4898 14.4898 14.9041 14.9041 k =-0.5000 0.1652 0.1201 ( 3020 PWs) bands (ev): 5.5777 5.5777 6.5138 6.5138 6.8705 6.8705 7.1917 7.1917 7.5810 7.5810 7.9125 7.9125 8.3084 8.3084 8.8331 8.8331 9.1969 9.1969 9.5120 9.5120 9.6543 9.6543 10.2585 10.2585 11.8019 11.8019 12.8198 12.8198 13.4424 13.4424 14.2255 14.2255 14.4856 14.4856 14.8977 14.8977 k =-0.5000 0.1652 0.1030 ( 3022 PWs) bands (ev): 5.5536 5.5536 6.5048 6.5048 6.8557 6.8557 7.1789 7.1789 7.5651 7.5651 7.8976 7.8976 8.3051 8.3051 8.8452 8.8452 9.1699 9.1699 9.5343 9.5343 9.6601 9.6601 10.2687 10.2687 11.8071 11.8071 12.8625 12.8625 13.4472 13.4472 14.2171 14.2171 14.4903 14.4903 14.8916 14.8916 k =-0.5000 0.1652 0.0858 ( 3022 PWs) bands (ev): 5.5330 5.5330 6.4971 6.4971 6.8432 6.8432 7.1681 7.1681 7.5511 7.5511 7.8850 7.8850 8.3030 8.3030 8.8577 8.8577 9.1430 9.1430 9.5562 9.5562 9.6638 9.6638 10.2772 10.2772 11.8115 11.8115 12.8987 12.8987 13.4517 13.4517 14.2040 14.2040 14.5000 14.5000 14.8862 14.8862 k =-0.5000 0.1652 0.0686 ( 3026 PWs) bands (ev): 5.5161 5.5161 6.4907 6.4907 6.8329 6.8329 7.1592 7.1592 7.5393 7.5393 7.8746 7.8746 8.3017 8.3017 8.8704 8.8704 9.1177 9.1177 9.5767 9.5767 9.6653 9.6653 10.2839 10.2839 11.8153 11.8153 12.9284 12.9284 13.4557 13.4557 14.1897 14.1897 14.5113 14.5113 14.8816 14.8816 k =-0.5000 0.1652 0.0515 ( 3022 PWs) bands (ev): 5.5030 5.5030 6.4858 6.4858 6.8249 6.8249 7.1523 7.1523 7.5299 7.5299 7.8666 7.8666 8.3010 8.3010 8.8826 8.8826 9.0950 9.0950 9.5953 9.5953 9.6647 9.6647 10.2890 10.2890 11.8182 11.8182 12.9515 12.9515 13.4590 13.4590 14.1767 14.1767 14.5217 14.5217 14.8780 14.8780 k =-0.5000 0.1652 0.0343 ( 3018 PWs) bands (ev): 5.4935 5.4935 6.4822 6.4822 6.8191 6.8191 7.1474 7.1474 7.5230 7.5230 7.8608 7.8608 8.3007 8.3007 8.8933 8.8933 9.0765 9.0765 9.6111 9.6111 9.6620 9.6620 10.2926 10.2926 11.8204 11.8204 12.9680 12.9680 13.4616 13.4616 14.1665 14.1665 14.5299 14.5299 14.8755 14.8755 k =-0.5000 0.1652 0.0172 ( 3018 PWs) bands (ev): 5.4879 5.4879 6.4800 6.4800 6.8156 6.8156 7.1445 7.1445 7.5189 7.5189 7.8573 7.8573 8.3005 8.3005 8.9010 8.9010 9.0640 9.0640 9.6230 9.6230 9.6582 9.6582 10.2947 10.2947 11.8217 11.8217 12.9780 12.9780 13.4631 13.4631 14.1600 14.1600 14.5350 14.5350 14.8739 14.8739 k =-0.5000 0.1652 0.0000 ( 3022 PWs) bands (ev): 5.4860 5.4860 6.4793 6.4793 6.8145 6.8145 7.1435 7.1435 7.5175 7.5175 7.8561 7.8561 8.3005 8.3005 8.9039 8.9039 9.0596 9.0596 9.6280 9.6280 9.6559 9.6559 10.2954 10.2954 11.8222 11.8222 12.9813 12.9813 13.4637 13.4637 14.1578 14.1578 14.5368 14.5368 14.8734 14.8734 k = 0.0000 0.0000 0.6350 ( 3046 PWs) bands (ev): 6.5132 6.5132 6.5132 6.5132 7.4988 7.4988 7.4988 7.4988 7.9594 7.9594 7.9594 7.9594 8.8605 8.8605 8.8605 8.8605 9.7297 9.7297 9.7297 9.7297 10.1603 10.1603 10.1603 10.1603 11.7365 11.7365 11.7365 11.7365 13.3375 13.3375 13.3375 13.3376 13.5356 13.5356 13.5356 13.5356 k =-0.0161 0.0053 0.6350 ( 3046 PWs) bands (ev): 6.5144 6.5144 6.5144 6.5144 7.4995 7.4995 7.4995 7.4995 7.9591 7.9591 7.9591 7.9591 8.8600 8.8600 8.8600 8.8600 9.7289 9.7289 9.7289 9.7289 10.1598 10.1598 10.1598 10.1598 11.7353 11.7353 11.7353 11.7353 13.3391 13.3391 13.3391 13.3391 13.5350 13.5350 13.5350 13.5350 k =-0.0323 0.0107 0.6350 ( 3038 PWs) bands (ev): 6.5180 6.5180 6.5180 6.5180 7.5015 7.5015 7.5015 7.5015 7.9583 7.9583 7.9583 7.9583 8.8586 8.8586 8.8586 8.8586 9.7267 9.7267 9.7267 9.7267 10.1583 10.1583 10.1583 10.1583 11.7318 11.7318 11.7318 11.7318 13.3438 13.3438 13.3438 13.3438 13.5335 13.5335 13.5335 13.5335 k =-0.0484 0.0160 0.6350 ( 3044 PWs) bands (ev): 6.5239 6.5239 6.5239 6.5239 7.5048 7.5048 7.5048 7.5048 7.9568 7.9568 7.9568 7.9568 8.8562 8.8562 8.8562 8.8562 9.7230 9.7230 9.7230 9.7230 10.1557 10.1557 10.1557 10.1557 11.7259 11.7259 11.7259 11.7259 13.3511 13.3511 13.3511 13.3511 13.5315 13.5315 13.5315 13.5315 k =-0.0645 0.0213 0.6350 ( 3044 PWs) bands (ev): 6.5321 6.5321 6.5321 6.5321 7.5095 7.5095 7.5095 7.5095 7.9549 7.9549 7.9549 7.9549 8.8528 8.8528 8.8528 8.8528 9.7178 9.7178 9.7178 9.7178 10.1521 10.1521 10.1521 10.1521 11.7175 11.7175 11.7175 11.7175 13.3605 13.3605 13.3605 13.3605 13.5298 13.5298 13.5298 13.5298 k =-0.0806 0.0267 0.6350 ( 3044 PWs) bands (ev): 6.5425 6.5425 6.5425 6.5425 7.5155 7.5155 7.5155 7.5155 7.9525 7.9525 7.9525 7.9525 8.8486 8.8486 8.8486 8.8486 9.7111 9.7111 9.7111 9.7111 10.1476 10.1476 10.1476 10.1476 11.7066 11.7066 11.7066 11.7066 13.3709 13.3709 13.3709 13.3709 13.5298 13.5298 13.5298 13.5298 k =-0.0968 0.0320 0.6350 ( 3054 PWs) bands (ev): 6.5550 6.5550 6.5550 6.5550 7.5228 7.5228 7.5228 7.5228 7.9497 7.9497 7.9497 7.9497 8.8435 8.8435 8.8435 8.8435 9.7028 9.7028 9.7028 9.7028 10.1422 10.1422 10.1422 10.1422 11.6929 11.6929 11.6929 11.6929 13.3807 13.3807 13.3807 13.3807 13.5329 13.5329 13.5329 13.5329 k =-0.1129 0.0373 0.6350 ( 3042 PWs) bands (ev): 6.5694 6.5694 6.5694 6.5694 7.5316 7.5316 7.5316 7.5316 7.9466 7.9466 7.9466 7.9466 8.8376 8.8376 8.8376 8.8376 9.6932 9.6932 9.6932 9.6932 10.1360 10.1360 10.1360 10.1360 11.6765 11.6765 11.6765 11.6765 13.3884 13.3884 13.3884 13.3884 13.5411 13.5411 13.5411 13.5411 k =-0.1290 0.0426 0.6350 ( 3036 PWs) bands (ev): 6.5857 6.5857 6.5857 6.5857 7.5418 7.5418 7.5418 7.5418 7.9434 7.9434 7.9434 7.9434 8.8311 8.8311 8.8311 8.8311 9.6819 9.6819 9.6819 9.6819 10.1290 10.1290 10.1290 10.1290 11.6572 11.6572 11.6572 11.6572 13.3929 13.3929 13.3929 13.3929 13.5557 13.5557 13.5557 13.5557 k =-0.1452 0.0480 0.6350 ( 3040 PWs) bands (ev): 6.6035 6.6035 6.6035 6.6035 7.5533 7.5533 7.5533 7.5533 7.9402 7.9402 7.9402 7.9402 8.8239 8.8239 8.8239 8.8239 9.6692 9.6692 9.6692 9.6692 10.1213 10.1213 10.1213 10.1213 11.6350 11.6350 11.6350 11.6350 13.3941 13.3941 13.3941 13.3941 13.5766 13.5766 13.5766 13.5766 k =-0.1613 0.0533 0.6350 ( 3044 PWs) bands (ev): 6.6227 6.6227 6.6227 6.6227 7.5663 7.5663 7.5663 7.5663 7.9372 7.9372 7.9372 7.9372 8.8161 8.8161 8.8161 8.8161 9.6549 9.6549 9.6549 9.6549 10.1130 10.1130 10.1130 10.1130 11.6100 11.6100 11.6100 11.6100 13.3929 13.3929 13.3929 13.3929 13.6031 13.6031 13.6031 13.6031 k =-0.1774 0.0586 0.6350 ( 3044 PWs) bands (ev): 6.6430 6.6430 6.6430 6.6430 7.5805 7.5805 7.5805 7.5805 7.9345 7.9345 7.9345 7.9345 8.8079 8.8079 8.8079 8.8079 9.6389 9.6389 9.6389 9.6389 10.1041 10.1041 10.1041 10.1041 11.5821 11.5821 11.5821 11.5821 13.3903 13.3903 13.3903 13.3903 13.6340 13.6340 13.6340 13.6340 k =-0.1935 0.0640 0.6350 ( 3046 PWs) bands (ev): 6.6642 6.6642 6.6642 6.6642 7.5960 7.5960 7.5960 7.5960 7.9326 7.9326 7.9326 7.9326 8.7994 8.7994 8.7994 8.7994 9.6213 9.6213 9.6213 9.6213 10.0947 10.0947 10.0947 10.0947 11.5517 11.5517 11.5517 11.5517 13.3873 13.3873 13.3873 13.3873 13.6683 13.6683 13.6683 13.6683 k =-0.2097 0.0693 0.6350 ( 3040 PWs) bands (ev): 6.6861 6.6861 6.6861 6.6861 7.6125 7.6125 7.6125 7.6125 7.9316 7.9316 7.9316 7.9316 8.7907 8.7907 8.7907 8.7907 9.6020 9.6020 9.6020 9.6020 10.0848 10.0848 10.0848 10.0848 11.5189 11.5189 11.5189 11.5189 13.3845 13.3845 13.3845 13.3845 13.7049 13.7049 13.7049 13.7049 k =-0.2258 0.0746 0.6350 ( 3040 PWs) bands (ev): 6.7083 6.7083 6.7083 6.7083 7.6299 7.6299 7.6299 7.6299 7.9320 7.9320 7.9320 7.9320 8.7818 8.7818 8.7818 8.7818 9.5808 9.5808 9.5808 9.5808 10.0746 10.0746 10.0746 10.0746 11.4841 11.4841 11.4841 11.4841 13.3822 13.3822 13.3822 13.3822 13.7433 13.7433 13.7433 13.7433 k =-0.2419 0.0800 0.6350 ( 3032 PWs) bands (ev): 6.7305 6.7305 6.7305 6.7305 7.6476 7.6476 7.6476 7.6476 7.9344 7.9344 7.9344 7.9344 8.7731 8.7731 8.7731 8.7731 9.5577 9.5577 9.5577 9.5577 10.0642 10.0642 10.0642 10.0642 11.4478 11.4478 11.4478 11.4478 13.3807 13.3807 13.3807 13.3807 13.7826 13.7826 13.7826 13.7826 k =-0.2581 0.0853 0.6350 ( 3032 PWs) bands (ev): 6.7526 6.7526 6.7526 6.7526 7.6651 7.6651 7.6651 7.6651 7.9394 7.9394 7.9394 7.9394 8.7645 8.7645 8.7645 8.7645 9.5326 9.5326 9.5326 9.5326 10.0535 10.0535 10.0535 10.0535 11.4104 11.4104 11.4104 11.4104 13.3799 13.3799 13.3799 13.3799 13.8225 13.8225 13.8225 13.8225 k =-0.2742 0.0906 0.6350 ( 3038 PWs) bands (ev): 6.7741 6.7741 6.7741 6.7741 7.6819 7.6819 7.6819 7.6819 7.9476 7.9476 7.9476 7.9476 8.7564 8.7564 8.7564 8.7564 9.5053 9.5053 9.5053 9.5053 10.0427 10.0427 10.0427 10.0427 11.3725 11.3725 11.3725 11.3725 13.3799 13.3799 13.3799 13.3799 13.8624 13.8624 13.8624 13.8624 k =-0.2903 0.0959 0.6350 ( 3042 PWs) bands (ev): 6.7949 6.7949 6.7949 6.7949 7.6972 7.6972 7.6972 7.6972 7.9598 7.9598 7.9598 7.9598 8.7488 8.7488 8.7488 8.7488 9.4758 9.4758 9.4758 9.4758 10.0319 10.0319 10.0319 10.0319 11.3345 11.3345 11.3345 11.3345 13.3805 13.3805 13.3805 13.3805 13.9018 13.9018 13.9018 13.9018 k =-0.3065 0.1013 0.6350 ( 3034 PWs) bands (ev): 6.8147 6.8147 6.8147 6.8147 7.7104 7.7104 7.7104 7.7104 7.9765 7.9765 7.9765 7.9765 8.7419 8.7419 8.7419 8.7419 9.4439 9.4439 9.4439 9.4439 10.0213 10.0213 10.0213 10.0213 11.2972 11.2972 11.2972 11.2972 13.3817 13.3817 13.3817 13.3817 13.9404 13.9404 13.9404 13.9404 k =-0.3226 0.1066 0.6350 ( 3034 PWs) bands (ev): 6.8333 6.8333 6.8333 6.8333 7.7211 7.7211 7.7211 7.7211 7.9977 7.9977 7.9977 7.9977 8.7361 8.7361 8.7361 8.7361 9.4097 9.4097 9.4097 9.4097 10.0109 10.0109 10.0109 10.0109 11.2609 11.2609 11.2609 11.2609 13.3832 13.3832 13.3832 13.3832 13.9776 13.9776 13.9776 13.9776 k =-0.3387 0.1119 0.6350 ( 3036 PWs) bands (ev): 6.8506 6.8506 6.8506 6.8506 7.7294 7.7294 7.7294 7.7294 8.0232 8.0232 8.0232 8.0232 8.7315 8.7315 8.7315 8.7315 9.3731 9.3731 9.3731 9.3731 10.0009 10.0009 10.0009 10.0009 11.2263 11.2263 11.2263 11.2263 13.3849 13.3849 13.3849 13.3849 14.0131 14.0131 14.0131 14.0131 k =-0.3548 0.1173 0.6350 ( 3036 PWs) bands (ev): 6.8664 6.8664 6.8664 6.8664 7.7354 7.7354 7.7354 7.7354 8.0523 8.0523 8.0523 8.0523 8.7284 8.7284 8.7284 8.7284 9.3345 9.3345 9.3345 9.3345 9.9914 9.9914 9.9914 9.9914 11.1939 11.1939 11.1939 11.1939 13.3868 13.3868 13.3868 13.3868 14.0466 14.0466 14.0466 14.0466 k =-0.3710 0.1226 0.6350 ( 3032 PWs) bands (ev): 6.8807 6.8807 6.8807 6.8807 7.7397 7.7397 7.7397 7.7397 8.0839 8.0839 8.0839 8.0839 8.7272 8.7272 8.7272 8.7272 9.2939 9.2939 9.2939 9.2939 9.9826 9.9826 9.9826 9.9826 11.1639 11.1639 11.1639 11.1639 13.3886 13.3886 13.3886 13.3886 14.0777 14.0777 14.0777 14.0777 k =-0.3871 0.1279 0.6350 ( 3024 PWs) bands (ev): 6.8934 6.8934 6.8934 6.8934 7.7425 7.7425 7.7425 7.7425 8.1169 8.1169 8.1169 8.1169 8.7282 8.7282 8.7282 8.7282 9.2518 9.2518 9.2518 9.2518 9.9745 9.9745 9.9745 9.9745 11.1369 11.1369 11.1369 11.1369 13.3903 13.3903 13.3903 13.3903 14.1060 14.1060 14.1060 14.1060 k =-0.4032 0.1333 0.6350 ( 3024 PWs) bands (ev): 6.9044 6.9044 6.9044 6.9044 7.7442 7.7442 7.7442 7.7442 8.1499 8.1499 8.1499 8.1499 8.7318 8.7318 8.7318 8.7318 9.2088 9.2088 9.2088 9.2088 9.9673 9.9673 9.9673 9.9673 11.1130 11.1130 11.1130 11.1130 13.3919 13.3919 13.3919 13.3919 14.1312 14.1312 14.1312 14.1312 k =-0.4194 0.1386 0.6350 ( 3020 PWs) bands (ev): 6.9137 6.9137 6.9137 6.9137 7.7453 7.7453 7.7453 7.7453 8.1813 8.1813 8.1813 8.1813 8.7382 8.7382 8.7382 8.7382 9.1659 9.1659 9.1659 9.1659 9.9611 9.9611 9.9611 9.9611 11.0924 11.0924 11.0924 11.0924 13.3932 13.3932 13.3932 13.3932 14.1531 14.1531 14.1531 14.1531 k =-0.4355 0.1439 0.6350 ( 3016 PWs) bands (ev): 6.9213 6.9213 6.9213 6.9213 7.7459 7.7459 7.7459 7.7459 8.2097 8.2097 8.2097 8.2097 8.7475 8.7475 8.7475 8.7475 9.1243 9.1243 9.1243 9.1243 9.9559 9.9559 9.9559 9.9559 11.0755 11.0755 11.0755 11.0755 13.3944 13.3944 13.3944 13.3944 14.1714 14.1714 14.1714 14.1714 k =-0.4516 0.1493 0.6350 ( 3020 PWs) bands (ev): 6.9272 6.9272 6.9272 6.9272 7.7461 7.7461 7.7461 7.7461 8.2336 8.2336 8.2336 8.2336 8.7592 8.7592 8.7592 8.7592 9.0858 9.0858 9.0858 9.0858 9.9518 9.9518 9.9518 9.9518 11.0622 11.0622 11.0622 11.0622 13.3953 13.3953 13.3953 13.3953 14.1859 14.1859 14.1859 14.1859 k =-0.4677 0.1546 0.6350 ( 3018 PWs) bands (ev): 6.9314 6.9314 6.9314 6.9314 7.7463 7.7463 7.7463 7.7463 8.2517 8.2517 8.2517 8.2517 8.7715 8.7715 8.7715 8.7715 9.0534 9.0534 9.0534 9.0534 9.9489 9.9489 9.9489 9.9489 11.0526 11.0526 11.0526 11.0526 13.3959 13.3959 13.3959 13.3959 14.1964 14.1964 14.1964 14.1964 k =-0.4839 0.1599 0.6350 ( 3020 PWs) bands (ev): 6.9339 6.9339 6.9339 6.9339 7.7463 7.7463 7.7463 7.7463 8.2629 8.2629 8.2629 8.2629 8.7816 8.7816 8.7816 8.7816 9.0308 9.0308 9.0308 9.0308 9.9471 9.9471 9.9471 9.9471 11.0469 11.0469 11.0469 11.0469 13.3963 13.3963 13.3963 13.3963 14.2027 14.2027 14.2027 14.2027 k =-0.5000 0.1652 0.6350 ( 3024 PWs) bands (ev): 6.9347 6.9347 6.9347 6.9347 7.7463 7.7463 7.7463 7.7463 8.2668 8.2668 8.2668 8.2668 8.7856 8.7856 8.7856 8.7856 9.0226 9.0226 9.0226 9.0226 9.9465 9.9465 9.9465 9.9465 11.0450 11.0450 11.0450 11.0450 13.3964 13.3964 13.3964 13.3964 14.2049 14.2049 14.2049 14.2049 Writing output data file ZrPt.save init_run : 0.39s CPU 0.56s WALL ( 1 calls) electrons : 208.78s CPU 211.92s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 208.76s CPU 211.90s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.04s WALL ( 444 calls) cegterg : 189.89s CPU 192.40s WALL ( 860 calls) Called by sum_band: Called by *egterg: h_psi : 128.63s CPU 130.70s WALL ( 14634 calls) s_psi : 3.74s CPU 3.73s WALL ( 14634 calls) g_psi : 0.28s CPU 0.28s WALL ( 13330 calls) cdiaghg : 58.06s CPU 58.92s WALL ( 13774 calls) cegterg:over : 5.41s CPU 5.40s WALL ( 13330 calls) cegterg:upda : 4.21s CPU 4.08s WALL ( 13330 calls) cegterg:last : 2.63s CPU 2.68s WALL ( 2649 calls) cdiaghg:chol : 3.34s CPU 3.23s WALL ( 13774 calls) cdiaghg:inve : 1.59s CPU 1.58s WALL ( 13774 calls) cdiaghg:para : 3.25s CPU 3.48s WALL ( 27548 calls) Called by h_psi: h_psi:vloc : 118.12s CPU 120.04s WALL ( 14634 calls) h_psi:vnl : 10.30s CPU 10.45s WALL ( 14634 calls) add_vuspsi : 5.36s CPU 5.36s WALL ( 14634 calls) General routines calbec : 4.89s CPU 5.05s WALL ( 14634 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 108.33s CPU 110.09s WALL ( 1169396 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.21s WALL ( 888 calls) Parallel routines fft_scatter : 31.49s CPU 32.18s WALL ( 1169419 calls) PWSCF : 3m42.24s CPU 4m 4.13s WALL This run was terminated on: 21:15:38 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=