Program PWSCF v.5.4.0 starts on 20Mar2017 at 21:36:58 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./H2C2O.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 36 20 5 2013 869 129 Max 37 21 6 2018 892 139 Sum 2595 1491 427 145157 63289 9827 bravais-lattice index = 14 lattice parameter (alat) = 13.4367 a.u. unit-cell volume = 1453.7177 (a.u.)^3 number of atoms/cell = 20 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.436708 celldm(2)= 0.550714 celldm(3)= 1.106970 celldm(4)= 0.183780 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 0.550714 0.000000 ) a(3) = ( 0.000000 0.203439 1.088116 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.815823 -0.339494 ) b(3) = ( 0.000000 0.000000 0.919020 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) H 1.00 1.00790 H( 1.00) C 4.00 12.01070 C( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [1,0,0] cryst. s( 2) = ( 1 0 0 ) f =( -0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.5000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2 (2) there are 4 classes and 2 irreducible representations the character table: E -E C2 -C2 G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E C2 -C2 G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,0,0] -C2 -2 180 deg rotation - cart. axis [1,0,0] E Cartesian axes number of k points= 242 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 2) = ( 0.0000000 0.0000000 0.0218814), wk = 0.0041322 k( 3) = ( 0.0000000 0.0000000 0.0437629), wk = 0.0041322 k( 4) = ( 0.0000000 0.0000000 0.0656443), wk = 0.0041322 k( 5) = ( 0.0000000 0.0000000 0.0875257), wk = 0.0041322 k( 6) = ( 0.0000000 0.0000000 0.1094072), wk = 0.0041322 k( 7) = ( 0.0000000 0.0000000 0.1312886), wk = 0.0041322 k( 8) = ( 0.0000000 0.0000000 0.1531700), wk = 0.0041322 k( 9) = ( 0.0000000 0.0000000 0.1750514), wk = 0.0041322 k( 10) = ( 0.0000000 0.0000000 0.1969329), wk = 0.0041322 k( 11) = ( 0.0000000 0.0000000 0.2188143), wk = 0.0041322 k( 12) = ( 0.0000000 0.0000000 0.2406957), wk = 0.0041322 k( 13) = ( 0.0000000 0.0000000 0.2625772), wk = 0.0041322 k( 14) = ( 0.0000000 0.0000000 0.2844586), wk = 0.0041322 k( 15) = ( 0.0000000 0.0000000 0.3063400), wk = 0.0041322 k( 16) = ( 0.0000000 0.0000000 0.3282215), wk = 0.0041322 k( 17) = ( 0.0000000 0.0000000 0.3501029), wk = 0.0041322 k( 18) = ( 0.0000000 0.0000000 0.3719843), wk = 0.0041322 k( 19) = ( 0.0000000 0.0000000 0.3938657), wk = 0.0041322 k( 20) = ( 0.0000000 0.0000000 0.4157472), wk = 0.0041322 k( 21) = ( 0.0000000 0.0000000 0.4376286), wk = 0.0041322 k( 22) = ( 0.0000000 0.0000000 0.4595100), wk = 0.0041322 k( 23) = ( 0.0000000 0.0000000 0.4595100), wk = 0.0041322 k( 24) = ( 0.0000000 0.0224667 0.4595100), wk = 0.0041322 k( 25) = ( 0.0000000 0.0449335 0.4595100), wk = 0.0041322 k( 26) = ( 0.0000000 0.0674002 0.4595100), wk = 0.0041322 k( 27) = ( 0.0000000 0.0898670 0.4595100), wk = 0.0041322 k( 28) = ( 0.0000000 0.1123337 0.4595100), wk = 0.0041322 k( 29) = ( 0.0000000 0.1348005 0.4595100), wk = 0.0041322 k( 30) = ( 0.0000000 0.1572672 0.4595100), wk = 0.0041322 k( 31) = ( 0.0000000 0.1797339 0.4595100), wk = 0.0041322 k( 32) = ( 0.0000000 0.2022007 0.4595100), wk = 0.0041322 k( 33) = ( 0.0000000 0.2246674 0.4595100), wk = 0.0041322 k( 34) = ( 0.0000000 0.2471342 0.4595100), wk = 0.0041322 k( 35) = ( 0.0000000 0.2696009 0.4595100), wk = 0.0041322 k( 36) = ( 0.0000000 0.2920676 0.4595100), wk = 0.0041322 k( 37) = ( 0.0000000 0.3145344 0.4595100), wk = 0.0041322 k( 38) = ( 0.0000000 0.3370011 0.4595100), wk = 0.0041322 k( 39) = ( 0.0000000 0.3594679 0.4595100), wk = 0.0041322 k( 40) = ( 0.0000000 0.3819346 0.4595100), wk = 0.0041322 k( 41) = ( 0.0000000 0.4044014 0.4595100), wk = 0.0041322 k( 42) = ( 0.0000000 0.4268681 0.4595100), wk = 0.0041322 k( 43) = ( 0.0000000 0.4493348 0.4595100), wk = 0.0041322 k( 44) = ( 0.0000000 0.4718016 0.4595100), wk = 0.0041322 k( 45) = ( 0.0000000 0.4942683 0.4595100), wk = 0.0041322 k( 46) = ( 0.0000000 0.5167351 0.4595100), wk = 0.0041322 k( 47) = ( 0.0000000 0.5392018 0.4595100), wk = 0.0041322 k( 48) = ( 0.0000000 0.5616686 0.4595100), wk = 0.0041322 k( 49) = ( 0.0000000 0.5841353 0.4595100), wk = 0.0041322 k( 50) = ( 0.0000000 0.6066020 0.4595100), wk = 0.0041322 k( 51) = ( 0.0000000 0.6290688 0.4595100), wk = 0.0041322 k( 52) = ( 0.0000000 0.6515355 0.4595100), wk = 0.0041322 k( 53) = ( 0.0000000 0.6740023 0.4595100), wk = 0.0041322 k( 54) = ( 0.0000000 0.6964690 0.4595100), wk = 0.0041322 k( 55) = ( 0.0000000 0.7189358 0.4595100), wk = 0.0041322 k( 56) = ( 0.0000000 0.7414025 0.4595100), wk = 0.0041322 k( 57) = ( 0.0000000 0.7638692 0.4595100), wk = 0.0041322 k( 58) = ( 0.0000000 0.7863360 0.4595100), wk = 0.0041322 k( 59) = ( 0.0000000 0.8088027 0.4595100), wk = 0.0041322 k( 60) = ( 0.0000000 0.8312695 0.4595100), wk = 0.0041322 k( 61) = ( 0.0000000 0.8537362 0.4595100), wk = 0.0041322 k( 62) = ( 0.0000000 0.8537362 0.4595100), wk = 0.0041322 k( 63) = ( 0.0000000 0.8605081 0.4382916), wk = 0.0041322 k( 64) = ( 0.0000000 0.8672800 0.4170733), wk = 0.0041322 k( 65) = ( 0.0000000 0.8740520 0.3958549), wk = 0.0041322 k( 66) = ( 0.0000000 0.8808239 0.3746365), wk = 0.0041322 k( 67) = ( 0.0000000 0.8875958 0.3534181), wk = 0.0041322 k( 68) = ( 0.0000000 0.8943677 0.3321998), wk = 0.0041322 k( 69) = ( 0.0000000 0.9011396 0.3109814), wk = 0.0041322 k( 70) = ( 0.0000000 0.9079115 0.2897630), wk = 0.0041322 k( 71) = ( 0.0000000 0.9079115 0.2897630), wk = 0.0041322 k( 72) = ( 0.0217391 0.9079115 0.2897630), wk = 0.0041322 k( 73) = ( 0.0434783 0.9079115 0.2897630), wk = 0.0041322 k( 74) = ( 0.0652174 0.9079115 0.2897630), wk = 0.0041322 k( 75) = ( 0.0869565 0.9079115 0.2897630), wk = 0.0041322 k( 76) = ( 0.1086957 0.9079115 0.2897630), wk = 0.0041322 k( 77) = ( 0.1304348 0.9079115 0.2897630), wk = 0.0041322 k( 78) = ( 0.1521739 0.9079115 0.2897630), wk = 0.0041322 k( 79) = ( 0.1739130 0.9079115 0.2897630), wk = 0.0041322 k( 80) = ( 0.1956522 0.9079115 0.2897630), wk = 0.0041322 k( 81) = ( 0.2173913 0.9079115 0.2897630), wk = 0.0041322 k( 82) = ( 0.2391304 0.9079115 0.2897630), wk = 0.0041322 k( 83) = ( 0.2608696 0.9079115 0.2897630), wk = 0.0041322 k( 84) = ( 0.2826087 0.9079115 0.2897630), wk = 0.0041322 k( 85) = ( 0.3043478 0.9079115 0.2897630), wk = 0.0041322 k( 86) = ( 0.3260870 0.9079115 0.2897630), wk = 0.0041322 k( 87) = ( 0.3478261 0.9079115 0.2897630), wk = 0.0041322 k( 88) = ( 0.3695652 0.9079115 0.2897630), wk = 0.0041322 k( 89) = ( 0.3913044 0.9079115 0.2897630), wk = 0.0041322 k( 90) = ( 0.4130435 0.9079115 0.2897630), wk = 0.0041322 k( 91) = ( 0.4347826 0.9079115 0.2897630), wk = 0.0041322 k( 92) = ( 0.4565217 0.9079115 0.2897630), wk = 0.0041322 k( 93) = ( 0.4782609 0.9079115 0.2897630), wk = 0.0041322 k( 94) = ( 0.5000000 0.9079115 0.2897630), wk = 0.0041322 k( 95) = ( 0.5000000 0.9079115 0.2897630), wk = 0.0041322 k( 96) = ( 0.5000000 0.9146835 0.2685446), wk = 0.0041322 k( 97) = ( 0.5000000 0.9214554 0.2473263), wk = 0.0041322 k( 98) = ( 0.5000000 0.9282273 0.2261079), wk = 0.0041322 k( 99) = ( 0.5000000 0.9349992 0.2048895), wk = 0.0041322 k( 100) = ( 0.5000000 0.9417711 0.1836711), wk = 0.0041322 k( 101) = ( 0.5000000 0.9485430 0.1624527), wk = 0.0041322 k( 102) = ( 0.5000000 0.9553149 0.1412344), wk = 0.0041322 k( 103) = ( 0.5000000 0.9620869 0.1200160), wk = 0.0041322 k( 104) = ( 0.5000000 0.9620869 0.1200160), wk = 0.0041322 k( 105) = ( 0.5000000 0.9582172 0.0993186), wk = 0.0041322 k( 106) = ( 0.5000000 0.9543475 0.0786213), wk = 0.0041322 k( 107) = ( 0.5000000 0.9504779 0.0579239), wk = 0.0041322 k( 108) = ( 0.5000000 0.9466082 0.0372266), wk = 0.0041322 k( 109) = ( 0.5000000 0.9427385 0.0165292), wk = 0.0041322 k( 110) = ( 0.5000000 0.9388689 -0.0041682), wk = 0.0041322 k( 111) = ( 0.5000000 0.9349992 -0.0248655), wk = 0.0041322 k( 112) = ( 0.5000000 0.9311295 -0.0455629), wk = 0.0041322 k( 113) = ( 0.5000000 0.9272599 -0.0662602), wk = 0.0041322 k( 114) = ( 0.5000000 0.9233902 -0.0869576), wk = 0.0041322 k( 115) = ( 0.5000000 0.9195205 -0.1076549), wk = 0.0041322 k( 116) = ( 0.5000000 0.9156509 -0.1283523), wk = 0.0041322 k( 117) = ( 0.5000000 0.9117812 -0.1490497), wk = 0.0041322 k( 118) = ( 0.5000000 0.9079115 -0.1697470), wk = 0.0041322 k( 119) = ( 0.5000000 0.9079115 -0.1697470), wk = 0.0041322 k( 120) = ( 0.4782609 0.9079115 -0.1697470), wk = 0.0041322 k( 121) = ( 0.4565217 0.9079115 -0.1697470), wk = 0.0041322 k( 122) = ( 0.4347826 0.9079115 -0.1697470), wk = 0.0041322 k( 123) = ( 0.4130435 0.9079115 -0.1697470), wk = 0.0041322 k( 124) = ( 0.3913044 0.9079115 -0.1697470), wk = 0.0041322 k( 125) = ( 0.3695652 0.9079115 -0.1697470), wk = 0.0041322 k( 126) = ( 0.3478261 0.9079115 -0.1697470), wk = 0.0041322 k( 127) = ( 0.3260870 0.9079115 -0.1697470), wk = 0.0041322 k( 128) = ( 0.3043478 0.9079115 -0.1697470), wk = 0.0041322 k( 129) = ( 0.2826087 0.9079115 -0.1697470), wk = 0.0041322 k( 130) = ( 0.2608696 0.9079115 -0.1697470), wk = 0.0041322 k( 131) = ( 0.2391304 0.9079115 -0.1697470), wk = 0.0041322 k( 132) = ( 0.2173913 0.9079115 -0.1697470), wk = 0.0041322 k( 133) = ( 0.1956522 0.9079115 -0.1697470), wk = 0.0041322 k( 134) = ( 0.1739130 0.9079115 -0.1697470), wk = 0.0041322 k( 135) = ( 0.1521739 0.9079115 -0.1697470), wk = 0.0041322 k( 136) = ( 0.1304348 0.9079115 -0.1697470), wk = 0.0041322 k( 137) = ( 0.1086957 0.9079115 -0.1697470), wk = 0.0041322 k( 138) = ( 0.0869565 0.9079115 -0.1697470), wk = 0.0041322 k( 139) = ( 0.0652174 0.9079115 -0.1697470), wk = 0.0041322 k( 140) = ( 0.0434783 0.9079115 -0.1697470), wk = 0.0041322 k( 141) = ( 0.0217391 0.9079115 -0.1697470), wk = 0.0041322 k( 142) = ( 0.0000000 0.9079115 -0.1697470), wk = 0.0041322 k( 143) = ( 0.0000000 0.9079115 -0.1697470), wk = 0.0041322 k( 144) = ( 0.0000000 0.9117812 -0.1490497), wk = 0.0041322 k( 145) = ( 0.0000000 0.9156509 -0.1283523), wk = 0.0041322 k( 146) = ( 0.0000000 0.9195205 -0.1076549), wk = 0.0041322 k( 147) = ( 0.0000000 0.9233902 -0.0869576), wk = 0.0041322 k( 148) = ( 0.0000000 0.9272599 -0.0662602), wk = 0.0041322 k( 149) = ( 0.0000000 0.9311295 -0.0455629), wk = 0.0041322 k( 150) = ( 0.0000000 0.9349992 -0.0248655), wk = 0.0041322 k( 151) = ( 0.0000000 0.9388689 -0.0041682), wk = 0.0041322 k( 152) = ( 0.0000000 0.9427385 0.0165292), wk = 0.0041322 k( 153) = ( 0.0000000 0.9466082 0.0372266), wk = 0.0041322 k( 154) = ( 0.0000000 0.9504779 0.0579239), wk = 0.0041322 k( 155) = ( 0.0000000 0.9543475 0.0786213), wk = 0.0041322 k( 156) = ( 0.0000000 0.9582172 0.0993186), wk = 0.0041322 k( 157) = ( 0.0000000 0.9620869 0.1200160), wk = 0.0041322 k( 158) = ( 0.5000000 0.8537362 0.4595100), wk = 0.0041322 k( 159) = ( 0.5000000 0.8312695 0.4595100), wk = 0.0041322 k( 160) = ( 0.5000000 0.8088027 0.4595100), wk = 0.0041322 k( 161) = ( 0.5000000 0.7863360 0.4595100), wk = 0.0041322 k( 162) = ( 0.5000000 0.7638692 0.4595100), wk = 0.0041322 k( 163) = ( 0.5000000 0.7414025 0.4595100), wk = 0.0041322 k( 164) = ( 0.5000000 0.7189358 0.4595100), wk = 0.0041322 k( 165) = ( 0.5000000 0.6964690 0.4595100), wk = 0.0041322 k( 166) = ( 0.5000000 0.6740023 0.4595100), wk = 0.0041322 k( 167) = ( 0.5000000 0.6515355 0.4595100), wk = 0.0041322 k( 168) = ( 0.5000000 0.6290688 0.4595100), wk = 0.0041322 k( 169) = ( 0.5000000 0.6066020 0.4595100), wk = 0.0041322 k( 170) = ( 0.5000000 0.5841353 0.4595100), wk = 0.0041322 k( 171) = ( 0.5000000 0.5616686 0.4595100), wk = 0.0041322 k( 172) = ( 0.5000000 0.5392018 0.4595100), wk = 0.0041322 k( 173) = ( 0.5000000 0.5167351 0.4595100), wk = 0.0041322 k( 174) = ( 0.5000000 0.4942683 0.4595100), wk = 0.0041322 k( 175) = ( 0.5000000 0.4718016 0.4595100), wk = 0.0041322 k( 176) = ( 0.5000000 0.4493348 0.4595100), wk = 0.0041322 k( 177) = ( 0.5000000 0.4268681 0.4595100), wk = 0.0041322 k( 178) = ( 0.5000000 0.4044014 0.4595100), wk = 0.0041322 k( 179) = ( 0.5000000 0.3819346 0.4595100), wk = 0.0041322 k( 180) = ( 0.5000000 0.3594679 0.4595100), wk = 0.0041322 k( 181) = ( 0.5000000 0.3370011 0.4595100), wk = 0.0041322 k( 182) = ( 0.5000000 0.3145344 0.4595100), wk = 0.0041322 k( 183) = ( 0.5000000 0.2920676 0.4595100), wk = 0.0041322 k( 184) = ( 0.5000000 0.2696009 0.4595100), wk = 0.0041322 k( 185) = ( 0.5000000 0.2471342 0.4595100), wk = 0.0041322 k( 186) = ( 0.5000000 0.2246674 0.4595100), wk = 0.0041322 k( 187) = ( 0.5000000 0.2022007 0.4595100), wk = 0.0041322 k( 188) = ( 0.5000000 0.1797339 0.4595100), wk = 0.0041322 k( 189) = ( 0.5000000 0.1572672 0.4595100), wk = 0.0041322 k( 190) = ( 0.5000000 0.1348005 0.4595100), wk = 0.0041322 k( 191) = ( 0.5000000 0.1123337 0.4595100), wk = 0.0041322 k( 192) = ( 0.5000000 0.0898670 0.4595100), wk = 0.0041322 k( 193) = ( 0.5000000 0.0674002 0.4595100), wk = 0.0041322 k( 194) = ( 0.5000000 0.0449335 0.4595100), wk = 0.0041322 k( 195) = ( 0.5000000 0.0224667 0.4595100), wk = 0.0041322 k( 196) = ( 0.5000000 -0.0000000 0.4595100), wk = 0.0041322 k( 197) = ( 0.5000000 -0.0000000 0.4595100), wk = 0.0041322 k( 198) = ( 0.5000000 -0.0000000 0.4376286), wk = 0.0041322 k( 199) = ( 0.5000000 -0.0000000 0.4157472), wk = 0.0041322 k( 200) = ( 0.5000000 -0.0000000 0.3938657), wk = 0.0041322 k( 201) = ( 0.5000000 -0.0000000 0.3719843), wk = 0.0041322 k( 202) = ( 0.5000000 -0.0000000 0.3501029), wk = 0.0041322 k( 203) = ( 0.5000000 -0.0000000 0.3282215), wk = 0.0041322 k( 204) = ( 0.5000000 -0.0000000 0.3063400), wk = 0.0041322 k( 205) = ( 0.5000000 -0.0000000 0.2844586), wk = 0.0041322 k( 206) = ( 0.5000000 -0.0000000 0.2625772), wk = 0.0041322 k( 207) = ( 0.5000000 -0.0000000 0.2406957), wk = 0.0041322 k( 208) = ( 0.5000000 -0.0000000 0.2188143), wk = 0.0041322 k( 209) = ( 0.5000000 -0.0000000 0.1969329), wk = 0.0041322 k( 210) = ( 0.5000000 -0.0000000 0.1750514), wk = 0.0041322 k( 211) = ( 0.5000000 -0.0000000 0.1531700), wk = 0.0041322 k( 212) = ( 0.5000000 -0.0000000 0.1312886), wk = 0.0041322 k( 213) = ( 0.5000000 -0.0000000 0.1094072), wk = 0.0041322 k( 214) = ( 0.5000000 -0.0000000 0.0875257), wk = 0.0041322 k( 215) = ( 0.5000000 -0.0000000 0.0656443), wk = 0.0041322 k( 216) = ( 0.5000000 -0.0000000 0.0437629), wk = 0.0041322 k( 217) = ( 0.5000000 -0.0000000 0.0218814), wk = 0.0041322 k( 218) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0041322 k( 219) = ( 0.0000000 0.0000000 0.4595100), wk = 0.0041322 k( 220) = ( 0.0217391 -0.0000000 0.4595100), wk = 0.0041322 k( 221) = ( 0.0434783 -0.0000000 0.4595100), wk = 0.0041322 k( 222) = ( 0.0652174 -0.0000000 0.4595100), wk = 0.0041322 k( 223) = ( 0.0869565 -0.0000000 0.4595100), wk = 0.0041322 k( 224) = ( 0.1086957 -0.0000000 0.4595100), wk = 0.0041322 k( 225) = ( 0.1304348 -0.0000000 0.4595100), wk = 0.0041322 k( 226) = ( 0.1521739 -0.0000000 0.4595100), wk = 0.0041322 k( 227) = ( 0.1739130 -0.0000000 0.4595100), wk = 0.0041322 k( 228) = ( 0.1956522 -0.0000000 0.4595100), wk = 0.0041322 k( 229) = ( 0.2173913 -0.0000000 0.4595100), wk = 0.0041322 k( 230) = ( 0.2391304 -0.0000000 0.4595100), wk = 0.0041322 k( 231) = ( 0.2608696 -0.0000000 0.4595100), wk = 0.0041322 k( 232) = ( 0.2826087 -0.0000000 0.4595100), wk = 0.0041322 k( 233) = ( 0.3043478 -0.0000000 0.4595100), wk = 0.0041322 k( 234) = ( 0.3260870 -0.0000000 0.4595100), wk = 0.0041322 k( 235) = ( 0.3478261 -0.0000000 0.4595100), wk = 0.0041322 k( 236) = ( 0.3695652 -0.0000000 0.4595100), wk = 0.0041322 k( 237) = ( 0.3913044 -0.0000000 0.4595100), wk = 0.0041322 k( 238) = ( 0.4130435 -0.0000000 0.4595100), wk = 0.0041322 k( 239) = ( 0.4347826 -0.0000000 0.4595100), wk = 0.0041322 k( 240) = ( 0.4565217 -0.0000000 0.4595100), wk = 0.0041322 k( 241) = ( 0.4782609 -0.0000000 0.4595100), wk = 0.0041322 k( 242) = ( 0.5000000 -0.0000000 0.4595100), wk = 0.0041322 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041322 k( 2) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0041322 k( 3) = ( 0.0000000 0.0000000 0.0476191), wk = 0.0041322 k( 4) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0041322 k( 5) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0041322 k( 6) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0041322 k( 7) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0041322 k( 8) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0041322 k( 9) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0041322 k( 10) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0041322 k( 11) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0041322 k( 12) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0041322 k( 13) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0041322 k( 14) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0041322 k( 15) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0041322 k( 16) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0041322 k( 17) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0041322 k( 18) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0041322 k( 19) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0041322 k( 20) = ( 0.0000000 0.0000000 0.4523810), wk = 0.0041322 k( 21) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0041322 k( 22) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0041322 k( 23) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0041322 k( 24) = ( 0.0000000 0.0123728 0.5045706), wk = 0.0041322 k( 25) = ( 0.0000000 0.0247455 0.5091412), wk = 0.0041322 k( 26) = ( 0.0000000 0.0371183 0.5137118), wk = 0.0041322 k( 27) = ( 0.0000000 0.0494910 0.5182824), wk = 0.0041322 k( 28) = ( 0.0000000 0.0618638 0.5228530), wk = 0.0041322 k( 29) = ( 0.0000000 0.0742366 0.5274236), wk = 0.0041322 k( 30) = ( 0.0000000 0.0866093 0.5319942), wk = 0.0041322 k( 31) = ( 0.0000000 0.0989821 0.5365648), wk = 0.0041322 k( 32) = ( 0.0000000 0.1113548 0.5411354), wk = 0.0041322 k( 33) = ( 0.0000000 0.1237276 0.5457061), wk = 0.0041322 k( 34) = ( 0.0000000 0.1361004 0.5502767), wk = 0.0041322 k( 35) = ( 0.0000000 0.1484731 0.5548473), wk = 0.0041322 k( 36) = ( 0.0000000 0.1608459 0.5594179), wk = 0.0041322 k( 37) = ( 0.0000000 0.1732186 0.5639885), wk = 0.0041322 k( 38) = ( 0.0000000 0.1855914 0.5685591), wk = 0.0041322 k( 39) = ( 0.0000000 0.1979641 0.5731297), wk = 0.0041322 k( 40) = ( 0.0000000 0.2103369 0.5777003), wk = 0.0041322 k( 41) = ( 0.0000000 0.2227097 0.5822709), wk = 0.0041322 k( 42) = ( 0.0000000 0.2350824 0.5868415), wk = 0.0041322 k( 43) = ( 0.0000000 0.2474552 0.5914121), wk = 0.0041322 k( 44) = ( 0.0000000 0.2598279 0.5959827), wk = 0.0041322 k( 45) = ( 0.0000000 0.2722007 0.6005533), wk = 0.0041322 k( 46) = ( 0.0000000 0.2845735 0.6051239), wk = 0.0041322 k( 47) = ( 0.0000000 0.2969462 0.6096945), wk = 0.0041322 k( 48) = ( 0.0000000 0.3093190 0.6142651), wk = 0.0041322 k( 49) = ( 0.0000000 0.3216917 0.6188357), wk = 0.0041322 k( 50) = ( 0.0000000 0.3340645 0.6234063), wk = 0.0041322 k( 51) = ( 0.0000000 0.3464373 0.6279770), wk = 0.0041322 k( 52) = ( 0.0000000 0.3588100 0.6325476), wk = 0.0041322 k( 53) = ( 0.0000000 0.3711828 0.6371182), wk = 0.0041322 k( 54) = ( 0.0000000 0.3835556 0.6416888), wk = 0.0041322 k( 55) = ( 0.0000000 0.3959283 0.6462594), wk = 0.0041322 k( 56) = ( 0.0000000 0.4083011 0.6508300), wk = 0.0041322 k( 57) = ( 0.0000000 0.4206738 0.6554006), wk = 0.0041322 k( 58) = ( 0.0000000 0.4330466 0.6599712), wk = 0.0041322 k( 59) = ( 0.0000000 0.4454193 0.6645418), wk = 0.0041322 k( 60) = ( 0.0000000 0.4577921 0.6691124), wk = 0.0041322 k( 61) = ( 0.0000000 0.4701649 0.6736830), wk = 0.0041322 k( 62) = ( 0.0000000 0.4701649 0.6736830), wk = 0.0041322 k( 63) = ( 0.0000000 0.4738943 0.6519726), wk = 0.0041322 k( 64) = ( 0.0000000 0.4776237 0.6302623), wk = 0.0041322 k( 65) = ( 0.0000000 0.4813530 0.6085519), wk = 0.0041322 k( 66) = ( 0.0000000 0.4850824 0.5868415), wk = 0.0041322 k( 67) = ( 0.0000000 0.4888118 0.5651311), wk = 0.0041322 k( 68) = ( 0.0000000 0.4925412 0.5434208), wk = 0.0041322 k( 69) = ( 0.0000000 0.4962706 0.5217104), wk = 0.0041322 k( 70) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0041322 k( 71) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0041322 k( 72) = ( 0.0217391 0.5000000 0.5000000), wk = 0.0041322 k( 73) = ( 0.0434783 0.5000000 0.5000000), wk = 0.0041322 k( 74) = ( 0.0652174 0.5000000 0.5000000), wk = 0.0041322 k( 75) = ( 0.0869565 0.5000000 0.5000000), wk = 0.0041322 k( 76) = ( 0.1086957 0.5000000 0.5000000), wk = 0.0041322 k( 77) = ( 0.1304348 0.5000000 0.5000000), wk = 0.0041322 k( 78) = ( 0.1521739 0.5000000 0.5000000), wk = 0.0041322 k( 79) = ( 0.1739130 0.5000000 0.5000000), wk = 0.0041322 k( 80) = ( 0.1956522 0.5000000 0.5000000), wk = 0.0041322 k( 81) = ( 0.2173913 0.5000000 0.5000000), wk = 0.0041322 k( 82) = ( 0.2391304 0.5000000 0.5000000), wk = 0.0041322 k( 83) = ( 0.2608696 0.5000000 0.5000000), wk = 0.0041322 k( 84) = ( 0.2826087 0.5000000 0.5000000), wk = 0.0041322 k( 85) = ( 0.3043478 0.5000000 0.5000000), wk = 0.0041322 k( 86) = ( 0.3260870 0.5000000 0.5000000), wk = 0.0041322 k( 87) = ( 0.3478261 0.5000000 0.5000000), wk = 0.0041322 k( 88) = ( 0.3695652 0.5000000 0.5000000), wk = 0.0041322 k( 89) = ( 0.3913044 0.5000000 0.5000000), wk = 0.0041322 k( 90) = ( 0.4130435 0.5000000 0.5000000), wk = 0.0041322 k( 91) = ( 0.4347826 0.5000000 0.5000000), wk = 0.0041322 k( 92) = ( 0.4565217 0.5000000 0.5000000), wk = 0.0041322 k( 93) = ( 0.4782609 0.5000000 0.5000000), wk = 0.0041322 k( 94) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041322 k( 95) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041322 k( 96) = ( 0.5000000 0.5037294 0.4782896), wk = 0.0041322 k( 97) = ( 0.5000000 0.5074588 0.4565792), wk = 0.0041322 k( 98) = ( 0.5000000 0.5111882 0.4348689), wk = 0.0041322 k( 99) = ( 0.5000000 0.5149176 0.4131585), wk = 0.0041322 k( 100) = ( 0.5000000 0.5186470 0.3914481), wk = 0.0041322 k( 101) = ( 0.5000000 0.5223764 0.3697377), wk = 0.0041322 k( 102) = ( 0.5000000 0.5261057 0.3480274), wk = 0.0041322 k( 103) = ( 0.5000000 0.5298351 0.3263170), wk = 0.0041322 k( 104) = ( 0.5000000 0.5298351 0.3263170), wk = 0.0041322 k( 105) = ( 0.5000000 0.5277041 0.3030086), wk = 0.0041322 k( 106) = ( 0.5000000 0.5255730 0.2797003), wk = 0.0041322 k( 107) = ( 0.5000000 0.5234419 0.2563919), wk = 0.0041322 k( 108) = ( 0.5000000 0.5213108 0.2330836), wk = 0.0041322 k( 109) = ( 0.5000000 0.5191797 0.2097752), wk = 0.0041322 k( 110) = ( 0.5000000 0.5170486 0.1864668), wk = 0.0041322 k( 111) = ( 0.5000000 0.5149176 0.1631585), wk = 0.0041322 k( 112) = ( 0.5000000 0.5127865 0.1398501), wk = 0.0041322 k( 113) = ( 0.5000000 0.5106554 0.1165418), wk = 0.0041322 k( 114) = ( 0.5000000 0.5085243 0.0932334), wk = 0.0041322 k( 115) = ( 0.5000000 0.5063932 0.0699251), wk = 0.0041322 k( 116) = ( 0.5000000 0.5042622 0.0466167), wk = 0.0041322 k( 117) = ( 0.5000000 0.5021311 0.0233084), wk = 0.0041322 k( 118) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0041322 k( 119) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0041322 k( 120) = ( 0.4782609 0.5000000 0.0000000), wk = 0.0041322 k( 121) = ( 0.4565217 0.5000000 0.0000000), wk = 0.0041322 k( 122) = ( 0.4347826 0.5000000 0.0000000), wk = 0.0041322 k( 123) = ( 0.4130435 0.5000000 0.0000000), wk = 0.0041322 k( 124) = ( 0.3913044 0.5000000 0.0000000), wk = 0.0041322 k( 125) = ( 0.3695652 0.5000000 0.0000000), wk = 0.0041322 k( 126) = ( 0.3478261 0.5000000 0.0000000), wk = 0.0041322 k( 127) = ( 0.3260870 0.5000000 0.0000000), wk = 0.0041322 k( 128) = ( 0.3043478 0.5000000 0.0000000), wk = 0.0041322 k( 129) = ( 0.2826087 0.5000000 0.0000000), wk = 0.0041322 k( 130) = ( 0.2608696 0.5000000 0.0000000), wk = 0.0041322 k( 131) = ( 0.2391304 0.5000000 0.0000000), wk = 0.0041322 k( 132) = ( 0.2173913 0.5000000 0.0000000), wk = 0.0041322 k( 133) = ( 0.1956522 0.5000000 0.0000000), wk = 0.0041322 k( 134) = ( 0.1739130 0.5000000 0.0000000), wk = 0.0041322 k( 135) = ( 0.1521739 0.5000000 0.0000000), wk = 0.0041322 k( 136) = ( 0.1304348 0.5000000 0.0000000), wk = 0.0041322 k( 137) = ( 0.1086957 0.5000000 0.0000000), wk = 0.0041322 k( 138) = ( 0.0869565 0.5000000 0.0000000), wk = 0.0041322 k( 139) = ( 0.0652174 0.5000000 0.0000000), wk = 0.0041322 k( 140) = ( 0.0434783 0.5000000 0.0000000), wk = 0.0041322 k( 141) = ( 0.0217391 0.5000000 0.0000000), wk = 0.0041322 k( 142) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0041322 k( 143) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0041322 k( 144) = ( 0.0000000 0.5021311 0.0233084), wk = 0.0041322 k( 145) = ( 0.0000000 0.5042622 0.0466167), wk = 0.0041322 k( 146) = ( 0.0000000 0.5063932 0.0699251), wk = 0.0041322 k( 147) = ( 0.0000000 0.5085243 0.0932334), wk = 0.0041322 k( 148) = ( 0.0000000 0.5106554 0.1165418), wk = 0.0041322 k( 149) = ( 0.0000000 0.5127865 0.1398501), wk = 0.0041322 k( 150) = ( 0.0000000 0.5149176 0.1631585), wk = 0.0041322 k( 151) = ( 0.0000000 0.5170486 0.1864668), wk = 0.0041322 k( 152) = ( 0.0000000 0.5191797 0.2097752), wk = 0.0041322 k( 153) = ( 0.0000000 0.5213108 0.2330836), wk = 0.0041322 k( 154) = ( 0.0000000 0.5234419 0.2563919), wk = 0.0041322 k( 155) = ( 0.0000000 0.5255730 0.2797003), wk = 0.0041322 k( 156) = ( 0.0000000 0.5277041 0.3030086), wk = 0.0041322 k( 157) = ( 0.0000000 0.5298351 0.3263170), wk = 0.0041322 k( 158) = ( 0.5000000 0.4701649 0.6736830), wk = 0.0041322 k( 159) = ( 0.5000000 0.4577921 0.6691124), wk = 0.0041322 k( 160) = ( 0.5000000 0.4454193 0.6645418), wk = 0.0041322 k( 161) = ( 0.5000000 0.4330466 0.6599712), wk = 0.0041322 k( 162) = ( 0.5000000 0.4206738 0.6554006), wk = 0.0041322 k( 163) = ( 0.5000000 0.4083011 0.6508300), wk = 0.0041322 k( 164) = ( 0.5000000 0.3959283 0.6462594), wk = 0.0041322 k( 165) = ( 0.5000000 0.3835556 0.6416888), wk = 0.0041322 k( 166) = ( 0.5000000 0.3711828 0.6371182), wk = 0.0041322 k( 167) = ( 0.5000000 0.3588100 0.6325476), wk = 0.0041322 k( 168) = ( 0.5000000 0.3464373 0.6279770), wk = 0.0041322 k( 169) = ( 0.5000000 0.3340645 0.6234063), wk = 0.0041322 k( 170) = ( 0.5000000 0.3216917 0.6188357), wk = 0.0041322 k( 171) = ( 0.5000000 0.3093190 0.6142651), wk = 0.0041322 k( 172) = ( 0.5000000 0.2969462 0.6096945), wk = 0.0041322 k( 173) = ( 0.5000000 0.2845735 0.6051239), wk = 0.0041322 k( 174) = ( 0.5000000 0.2722007 0.6005533), wk = 0.0041322 k( 175) = ( 0.5000000 0.2598279 0.5959827), wk = 0.0041322 k( 176) = ( 0.5000000 0.2474552 0.5914121), wk = 0.0041322 k( 177) = ( 0.5000000 0.2350824 0.5868415), wk = 0.0041322 k( 178) = ( 0.5000000 0.2227097 0.5822709), wk = 0.0041322 k( 179) = ( 0.5000000 0.2103369 0.5777003), wk = 0.0041322 k( 180) = ( 0.5000000 0.1979641 0.5731297), wk = 0.0041322 k( 181) = ( 0.5000000 0.1855914 0.5685591), wk = 0.0041322 k( 182) = ( 0.5000000 0.1732186 0.5639885), wk = 0.0041322 k( 183) = ( 0.5000000 0.1608459 0.5594179), wk = 0.0041322 k( 184) = ( 0.5000000 0.1484731 0.5548473), wk = 0.0041322 k( 185) = ( 0.5000000 0.1361004 0.5502767), wk = 0.0041322 k( 186) = ( 0.5000000 0.1237276 0.5457061), wk = 0.0041322 k( 187) = ( 0.5000000 0.1113548 0.5411354), wk = 0.0041322 k( 188) = ( 0.5000000 0.0989821 0.5365648), wk = 0.0041322 k( 189) = ( 0.5000000 0.0866093 0.5319942), wk = 0.0041322 k( 190) = ( 0.5000000 0.0742366 0.5274236), wk = 0.0041322 k( 191) = ( 0.5000000 0.0618638 0.5228530), wk = 0.0041322 k( 192) = ( 0.5000000 0.0494910 0.5182824), wk = 0.0041322 k( 193) = ( 0.5000000 0.0371183 0.5137118), wk = 0.0041322 k( 194) = ( 0.5000000 0.0247455 0.5091412), wk = 0.0041322 k( 195) = ( 0.5000000 0.0123728 0.5045706), wk = 0.0041322 k( 196) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041322 k( 197) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041322 k( 198) = ( 0.5000000 0.0000000 0.4761905), wk = 0.0041322 k( 199) = ( 0.5000000 0.0000000 0.4523810), wk = 0.0041322 k( 200) = ( 0.5000000 0.0000000 0.4285714), wk = 0.0041322 k( 201) = ( 0.5000000 0.0000000 0.4047619), wk = 0.0041322 k( 202) = ( 0.5000000 0.0000000 0.3809524), wk = 0.0041322 k( 203) = ( 0.5000000 0.0000000 0.3571429), wk = 0.0041322 k( 204) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0041322 k( 205) = ( 0.5000000 0.0000000 0.3095238), wk = 0.0041322 k( 206) = ( 0.5000000 0.0000000 0.2857143), wk = 0.0041322 k( 207) = ( 0.5000000 0.0000000 0.2619048), wk = 0.0041322 k( 208) = ( 0.5000000 0.0000000 0.2380952), wk = 0.0041322 k( 209) = ( 0.5000000 0.0000000 0.2142857), wk = 0.0041322 k( 210) = ( 0.5000000 0.0000000 0.1904762), wk = 0.0041322 k( 211) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0041322 k( 212) = ( 0.5000000 0.0000000 0.1428571), wk = 0.0041322 k( 213) = ( 0.5000000 0.0000000 0.1190476), wk = 0.0041322 k( 214) = ( 0.5000000 0.0000000 0.0952381), wk = 0.0041322 k( 215) = ( 0.5000000 0.0000000 0.0714286), wk = 0.0041322 k( 216) = ( 0.5000000 0.0000000 0.0476191), wk = 0.0041322 k( 217) = ( 0.5000000 0.0000000 0.0238095), wk = 0.0041322 k( 218) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0041322 k( 219) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0041322 k( 220) = ( 0.0217391 0.0000000 0.5000000), wk = 0.0041322 k( 221) = ( 0.0434783 0.0000000 0.5000000), wk = 0.0041322 k( 222) = ( 0.0652174 0.0000000 0.5000000), wk = 0.0041322 k( 223) = ( 0.0869565 0.0000000 0.5000000), wk = 0.0041322 k( 224) = ( 0.1086957 0.0000000 0.5000000), wk = 0.0041322 k( 225) = ( 0.1304348 0.0000000 0.5000000), wk = 0.0041322 k( 226) = ( 0.1521739 0.0000000 0.5000000), wk = 0.0041322 k( 227) = ( 0.1739130 0.0000000 0.5000000), wk = 0.0041322 k( 228) = ( 0.1956522 0.0000000 0.5000000), wk = 0.0041322 k( 229) = ( 0.2173913 0.0000000 0.5000000), wk = 0.0041322 k( 230) = ( 0.2391304 -0.0000000 0.5000000), wk = 0.0041322 k( 231) = ( 0.2608696 0.0000000 0.5000000), wk = 0.0041322 k( 232) = ( 0.2826087 0.0000000 0.5000000), wk = 0.0041322 k( 233) = ( 0.3043478 0.0000000 0.5000000), wk = 0.0041322 k( 234) = ( 0.3260870 0.0000000 0.5000000), wk = 0.0041322 k( 235) = ( 0.3478261 -0.0000000 0.5000000), wk = 0.0041322 k( 236) = ( 0.3695652 0.0000000 0.5000000), wk = 0.0041322 k( 237) = ( 0.3913044 0.0000000 0.5000000), wk = 0.0041322 k( 238) = ( 0.4130435 0.0000000 0.5000000), wk = 0.0041322 k( 239) = ( 0.4347826 0.0000000 0.5000000), wk = 0.0041322 k( 240) = ( 0.4565217 -0.0000000 0.5000000), wk = 0.0041322 k( 241) = ( 0.4782609 0.0000000 0.5000000), wk = 0.0041322 k( 242) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0041322 Dense grid: 145157 G-vectors FFT dimensions: ( 80, 45, 90) Smooth grid: 63289 G-vectors FFT dimensions: ( 60, 36, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 224, 76) NL pseudopotentials 0.31 Mb ( 112, 184) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2018) G-vector shells 0.01 Mb ( 1904) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.04 Mb ( 224, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.43 Mb ( 184, 2, 76) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./H2C2O.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.6 secs Computing kpt #: 2 total cpu time spent up to now is 5.3 secs Computing kpt #: 3 total cpu time spent up to now is 7.0 secs Computing kpt #: 4 total cpu time spent up to now is 9.0 secs Computing kpt #: 5 total cpu time spent up to now is 11.2 secs Computing kpt #: 6 total cpu time spent up to now is 12.9 secs Computing kpt #: 7 total cpu time spent up to now is 14.7 secs Computing kpt #: 8 total cpu time spent up to now is 16.4 secs Computing kpt #: 9 total cpu time spent up to now is 18.3 secs Computing kpt #: 10 total cpu time spent up to now is 20.0 secs Computing kpt #: 11 total cpu time spent up to now is 21.9 secs Computing kpt #: 12 total cpu time spent up to now is 23.7 secs Computing kpt #: 13 total cpu time spent up to now is 25.6 secs Computing kpt #: 14 total cpu time spent up to now is 27.5 secs Computing kpt #: 15 total cpu time spent up to now is 29.3 secs Computing kpt #: 16 total cpu time spent up to now is 31.2 secs Computing kpt #: 17 total cpu time spent up to now is 33.1 secs Computing kpt #: 18 total cpu time spent up to now is 34.9 secs Computing kpt #: 19 total cpu time spent up to now is 36.8 secs Computing kpt #: 20 total cpu time spent up to now is 38.6 secs Computing kpt #: 21 total cpu time spent up to now is 40.6 secs Computing kpt #: 22 total cpu time spent up to now is 42.5 secs Computing kpt #: 23 total cpu time spent up to now is 44.8 secs Computing kpt #: 24 total cpu time spent up to now is 46.6 secs Computing kpt #: 25 total cpu time spent up to now is 48.4 secs Computing kpt #: 26 total cpu time spent up to now is 50.3 secs Computing kpt #: 27 total cpu time spent up to now is 51.9 secs Computing kpt #: 28 total cpu time spent up to now is 54.0 secs Computing kpt #: 29 total cpu time spent up to now is 55.7 secs Computing kpt #: 30 total cpu time spent up to now is 57.7 secs Computing kpt #: 31 total cpu time spent up to now is 59.6 secs Computing kpt #: 32 total cpu time spent up to now is 61.6 secs Computing kpt #: 33 total cpu time spent up to now is 63.6 secs Computing kpt #: 34 total cpu time spent up to now is 65.5 secs Computing kpt #: 35 total cpu time spent up to now is 67.2 secs Computing kpt #: 36 total cpu time spent up to now is 69.0 secs Computing kpt #: 37 total cpu time spent up to now is 71.0 secs Computing kpt #: 38 total cpu time spent up to now is 72.9 secs Computing kpt #: 39 total cpu time spent up to now is 75.0 secs Computing kpt #: 40 total cpu time spent up to now is 76.7 secs Computing kpt #: 41 total cpu time spent up to now is 78.5 secs Computing kpt #: 42 total cpu time spent up to now is 80.2 secs Computing kpt #: 43 total cpu time spent up to now is 81.9 secs Computing kpt #: 44 total cpu time spent up to now is 83.7 secs Computing kpt #: 45 total cpu time spent up to now is 85.4 secs Computing kpt #: 46 total cpu time spent up to now is 87.1 secs Computing kpt #: 47 total cpu time spent up to now is 88.9 secs Computing kpt #: 48 total cpu time spent up to now is 90.6 secs Computing kpt #: 49 total cpu time spent up to now is 92.3 secs Computing kpt #: 50 total cpu time spent up to now is 94.1 secs Computing kpt #: 51 total cpu time spent up to now is 95.9 secs Computing kpt #: 52 total cpu time spent up to now is 98.6 secs Computing kpt #: 53 total cpu time spent up to now is 100.5 secs Computing kpt #: 54 total cpu time spent up to now is 102.3 secs Computing kpt #: 55 total cpu time spent up to now is 104.2 secs Computing kpt #: 56 total cpu time spent up to now is 106.2 secs Computing kpt #: 57 total cpu time spent up to now is 108.2 secs Computing kpt #: 58 total cpu time spent up to now is 110.5 secs Computing kpt #: 59 total cpu time spent up to now is 113.0 secs Computing kpt #: 60 total cpu time spent up to now is 114.9 secs Computing kpt #: 61 total cpu time spent up to now is 116.8 secs Computing kpt #: 62 total cpu time spent up to now is 118.7 secs Computing kpt #: 63 total cpu time spent up to now is 120.7 secs Computing kpt #: 64 total cpu time spent up to now is 122.7 secs Computing kpt #: 65 total cpu time spent up to now is 124.6 secs Computing kpt #: 66 total cpu time spent up to now is 126.6 secs Computing kpt #: 67 total cpu time spent up to now is 128.8 secs Computing kpt #: 68 total cpu time spent up to now is 130.8 secs Computing kpt #: 69 total cpu time spent up to now is 132.8 secs Computing kpt #: 70 total cpu time spent up to now is 134.8 secs Computing kpt #: 71 total cpu time spent up to now is 136.6 secs Computing kpt #: 72 total cpu time spent up to now is 138.5 secs Computing kpt #: 73 total cpu time spent up to now is 140.5 secs Computing kpt #: 74 total cpu time spent up to now is 142.3 secs Computing kpt #: 75 total cpu time spent up to now is 144.8 secs Computing kpt #: 76 total cpu time spent up to now is 146.8 secs Computing kpt #: 77 total cpu time spent up to now is 148.8 secs Computing kpt #: 78 total cpu time spent up to now is 150.6 secs Computing kpt #: 79 total cpu time spent up to now is 152.6 secs Computing kpt #: 80 total cpu time spent up to now is 154.7 secs Computing kpt #: 81 total cpu time spent up to now is 157.0 secs Computing kpt #: 82 total cpu time spent up to now is 159.9 secs Computing kpt #: 83 total cpu time spent up to now is 162.2 secs Computing kpt #: 84 total cpu time spent up to now is 164.3 secs Computing kpt #: 85 total cpu time spent up to now is 166.4 secs Computing kpt #: 86 total cpu time spent up to now is 168.8 secs Computing kpt #: 87 total cpu time spent up to now is 170.9 secs Computing kpt #: 88 total cpu time spent up to now is 173.0 secs Computing kpt #: 89 total cpu time spent up to now is 175.3 secs Computing kpt #: 90 total cpu time spent up to now is 177.4 secs Computing kpt #: 91 total cpu time spent up to now is 179.6 secs Computing kpt #: 92 total cpu time spent up to now is 181.8 secs Computing kpt #: 93 total cpu time spent up to now is 184.2 secs Computing kpt #: 94 total cpu time spent up to now is 186.4 secs Computing kpt #: 95 total cpu time spent up to now is 188.5 secs Computing kpt #: 96 total cpu time spent up to now is 190.6 secs Computing kpt #: 97 total cpu time spent up to now is 192.8 secs Computing kpt #: 98 total cpu time spent up to now is 194.9 secs Computing kpt #: 99 total cpu time spent up to now is 196.9 secs Computing kpt #: 100 total cpu time spent up to now is 199.0 secs Computing kpt #: 101 total cpu time spent up to now is 200.8 secs Computing kpt #: 102 total cpu time spent up to now is 202.9 secs Computing kpt #: 103 total cpu time spent up to now is 205.0 secs Computing kpt #: 104 total cpu time spent up to now is 206.9 secs Computing kpt #: 105 total cpu time spent up to now is 208.7 secs Computing kpt #: 106 total cpu time spent up to now is 210.6 secs Computing kpt #: 107 total cpu time spent up to now is 212.7 secs Computing kpt #: 108 total cpu time spent up to now is 214.6 secs Computing kpt #: 109 total cpu time spent up to now is 216.5 secs Computing kpt #: 110 total cpu time spent up to now is 218.2 secs Computing kpt #: 111 total cpu time spent up to now is 220.0 secs Computing kpt #: 112 total cpu time spent up to now is 221.8 secs Computing kpt #: 113 total cpu time spent up to now is 223.6 secs Computing kpt #: 114 total cpu time spent up to now is 225.4 secs Computing kpt #: 115 total cpu time spent up to now is 227.1 secs Computing kpt #: 116 total cpu time spent up to now is 228.9 secs Computing kpt #: 117 total cpu time spent up to now is 230.5 secs Computing kpt #: 118 total cpu time spent up to now is 232.2 secs Computing kpt #: 119 total cpu time spent up to now is 234.0 secs Computing kpt #: 120 total cpu time spent up to now is 235.7 secs Computing kpt #: 121 total cpu time spent up to now is 237.7 secs Computing kpt #: 122 total cpu time spent up to now is 239.6 secs Computing kpt #: 123 total cpu time spent up to now is 241.4 secs Computing kpt #: 124 total cpu time spent up to now is 243.3 secs Computing kpt #: 125 total cpu time spent up to now is 245.1 secs Computing kpt #: 126 total cpu time spent up to now is 247.2 secs Computing kpt #: 127 total cpu time spent up to now is 249.7 secs Computing kpt #: 128 total cpu time spent up to now is 252.9 secs Computing kpt #: 129 total cpu time spent up to now is 254.9 secs Computing kpt #: 130 total cpu time spent up to now is 256.9 secs Computing kpt #: 131 total cpu time spent up to now is 259.0 secs Computing kpt #: 132 total cpu time spent up to now is 261.1 secs Computing kpt #: 133 total cpu time spent up to now is 263.2 secs Computing kpt #: 134 total cpu time spent up to now is 265.0 secs Computing kpt #: 135 total cpu time spent up to now is 267.1 secs Computing kpt #: 136 total cpu time spent up to now is 268.9 secs Computing kpt #: 137 total cpu time spent up to now is 270.7 secs Computing kpt #: 138 total cpu time spent up to now is 272.6 secs Computing kpt #: 139 total cpu time spent up to now is 274.4 secs Computing kpt #: 140 total cpu time spent up to now is 276.2 secs Computing kpt #: 141 total cpu time spent up to now is 278.0 secs Computing kpt #: 142 total cpu time spent up to now is 280.0 secs Computing kpt #: 143 total cpu time spent up to now is 281.8 secs Computing kpt #: 144 total cpu time spent up to now is 283.7 secs Computing kpt #: 145 total cpu time spent up to now is 285.4 secs Computing kpt #: 146 total cpu time spent up to now is 287.2 secs Computing kpt #: 147 total cpu time spent up to now is 289.2 secs Computing kpt #: 148 total cpu time spent up to now is 291.0 secs Computing kpt #: 149 total cpu time spent up to now is 292.9 secs Computing kpt #: 150 total cpu time spent up to now is 294.8 secs Computing kpt #: 151 total cpu time spent up to now is 296.8 secs Computing kpt #: 152 total cpu time spent up to now is 298.6 secs Computing kpt #: 153 total cpu time spent up to now is 300.4 secs Computing kpt #: 154 total cpu time spent up to now is 302.3 secs Computing kpt #: 155 total cpu time spent up to now is 304.2 secs Computing kpt #: 156 total cpu time spent up to now is 306.2 secs Computing kpt #: 157 total cpu time spent up to now is 308.1 secs Computing kpt #: 158 total cpu time spent up to now is 310.4 secs Computing kpt #: 159 total cpu time spent up to now is 312.5 secs Computing kpt #: 160 total cpu time spent up to now is 314.6 secs Computing kpt #: 161 total cpu time spent up to now is 316.6 secs Computing kpt #: 162 total cpu time spent up to now is 319.7 secs Computing kpt #: 163 total cpu time spent up to now is 322.0 secs Computing kpt #: 164 total cpu time spent up to now is 324.3 secs Computing kpt #: 165 total cpu time spent up to now is 326.4 secs Computing kpt #: 166 total cpu time spent up to now is 328.6 secs Computing kpt #: 167 total cpu time spent up to now is 330.8 secs Computing kpt #: 168 total cpu time spent up to now is 333.1 secs Computing kpt #: 169 total cpu time spent up to now is 335.1 secs Computing kpt #: 170 total cpu time spent up to now is 337.2 secs Computing kpt #: 171 total cpu time spent up to now is 339.1 secs Computing kpt #: 172 total cpu time spent up to now is 341.0 secs Computing kpt #: 173 total cpu time spent up to now is 342.9 secs Computing kpt #: 174 total cpu time spent up to now is 345.6 secs Computing kpt #: 175 total cpu time spent up to now is 347.4 secs Computing kpt #: 176 total cpu time spent up to now is 349.1 secs Computing kpt #: 177 total cpu time spent up to now is 350.9 secs Computing kpt #: 178 total cpu time spent up to now is 352.8 secs Computing kpt #: 179 total cpu time spent up to now is 355.0 secs Computing kpt #: 180 total cpu time spent up to now is 356.9 secs Computing kpt #: 181 total cpu time spent up to now is 358.7 secs Computing kpt #: 182 total cpu time spent up to now is 360.6 secs Computing kpt #: 183 total cpu time spent up to now is 362.4 secs Computing kpt #: 184 total cpu time spent up to now is 364.5 secs Computing kpt #: 185 total cpu time spent up to now is 366.3 secs Computing kpt #: 186 total cpu time spent up to now is 368.0 secs Computing kpt #: 187 total cpu time spent up to now is 369.8 secs Computing kpt #: 188 total cpu time spent up to now is 371.7 secs Computing kpt #: 189 total cpu time spent up to now is 373.3 secs Computing kpt #: 190 total cpu time spent up to now is 375.8 secs Computing kpt #: 191 total cpu time spent up to now is 377.5 secs Computing kpt #: 192 total cpu time spent up to now is 379.3 secs Computing kpt #: 193 total cpu time spent up to now is 381.1 secs Computing kpt #: 194 total cpu time spent up to now is 383.0 secs Computing kpt #: 195 total cpu time spent up to now is 384.9 secs Computing kpt #: 196 total cpu time spent up to now is 386.7 secs Computing kpt #: 197 total cpu time spent up to now is 388.6 secs Computing kpt #: 198 total cpu time spent up to now is 390.6 secs Computing kpt #: 199 total cpu time spent up to now is 392.4 secs Computing kpt #: 200 total cpu time spent up to now is 394.3 secs Computing kpt #: 201 total cpu time spent up to now is 396.4 secs Computing kpt #: 202 total cpu time spent up to now is 398.5 secs Computing kpt #: 203 total cpu time spent up to now is 400.5 secs Computing kpt #: 204 total cpu time spent up to now is 402.6 secs Computing kpt #: 205 total cpu time spent up to now is 404.6 secs Computing kpt #: 206 total cpu time spent up to now is 406.6 secs Computing kpt #: 207 total cpu time spent up to now is 408.4 secs Computing kpt #: 208 total cpu time spent up to now is 410.5 secs Computing kpt #: 209 total cpu time spent up to now is 412.4 secs Computing kpt #: 210 total cpu time spent up to now is 414.0 secs Computing kpt #: 211 total cpu time spent up to now is 415.7 secs Computing kpt #: 212 total cpu time spent up to now is 417.5 secs Computing kpt #: 213 total cpu time spent up to now is 419.3 secs Computing kpt #: 214 total cpu time spent up to now is 421.0 secs Computing kpt #: 215 total cpu time spent up to now is 422.7 secs Computing kpt #: 216 total cpu time spent up to now is 424.8 secs Computing kpt #: 217 total cpu time spent up to now is 426.4 secs Computing kpt #: 218 total cpu time spent up to now is 428.0 secs Computing kpt #: 219 total cpu time spent up to now is 429.7 secs Computing kpt #: 220 total cpu time spent up to now is 431.5 secs Computing kpt #: 221 total cpu time spent up to now is 433.1 secs Computing kpt #: 222 total cpu time spent up to now is 434.7 secs Computing kpt #: 223 total cpu time spent up to now is 436.4 secs Computing kpt #: 224 total cpu time spent up to now is 437.9 secs Computing kpt #: 225 total cpu time spent up to now is 439.5 secs Computing kpt #: 226 total cpu time spent up to now is 441.1 secs Computing kpt #: 227 total cpu time spent up to now is 442.7 secs Computing kpt #: 228 total cpu time spent up to now is 444.3 secs Computing kpt #: 229 total cpu time spent up to now is 446.0 secs Computing kpt #: 230 total cpu time spent up to now is 447.6 secs Computing kpt #: 231 total cpu time spent up to now is 449.4 secs Computing kpt #: 232 total cpu time spent up to now is 451.1 secs Computing kpt #: 233 total cpu time spent up to now is 453.2 secs Computing kpt #: 234 total cpu time spent up to now is 455.2 secs Computing kpt #: 235 total cpu time spent up to now is 457.3 secs Computing kpt #: 236 total cpu time spent up to now is 459.9 secs Computing kpt #: 237 total cpu time spent up to now is 462.1 secs Computing kpt #: 238 total cpu time spent up to now is 464.1 secs Computing kpt #: 239 total cpu time spent up to now is 466.3 secs Computing kpt #: 240 total cpu time spent up to now is 469.4 secs Computing kpt #: 241 total cpu time spent up to now is 471.4 secs Computing kpt #: 242 total cpu time spent up to now is 473.2 secs ethr = 1.56E-08, avg # of iterations = 23.2 total cpu time spent up to now is 473.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7905 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6579 -14.6579 -14.5442 -14.5442 -13.1605 -13.1605 -13.1471 -13.1471 -11.4870 -11.4870 -11.2782 -11.2782 -8.5201 -8.5201 -8.4941 -8.4941 -6.5709 -6.5709 -6.2472 -6.2472 -6.0111 -6.0111 -5.9568 -5.9568 -5.8763 -5.8763 -5.7484 -5.7484 -5.4840 -5.4840 -5.4033 -5.4033 -5.3056 -5.3056 -5.1750 -5.1750 -4.3286 -4.3286 -3.9430 -3.9430 -2.3434 -2.3434 -2.2603 -2.2603 -2.2409 -2.2409 -1.5295 -1.5295 -1.4581 -1.4581 -1.3904 -1.3904 -0.9930 -0.9930 -0.7131 -0.7131 3.3677 3.3677 3.4010 3.4010 5.3775 5.3775 5.8949 5.8949 6.0523 6.0523 7.5364 7.5364 k = 0.0000 0.0000 0.0219 ( 7905 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6581 -14.6581 -14.5441 -14.5441 -13.1623 -13.1622 -13.1453 -13.1453 -11.4871 -11.4871 -11.2782 -11.2782 -8.5203 -8.5202 -8.4940 -8.4938 -6.5713 -6.5712 -6.2474 -6.2473 -6.0111 -6.0110 -5.9571 -5.9570 -5.8755 -5.8751 -5.7481 -5.7480 -5.4845 -5.4845 -5.4036 -5.4035 -5.3056 -5.3056 -5.1754 -5.1753 -4.3285 -4.3284 -3.9433 -3.9432 -2.3434 -2.3433 -2.2601 -2.2600 -2.2405 -2.2404 -1.5296 -1.5295 -1.4585 -1.4585 -1.3907 -1.3907 -0.9931 -0.9931 -0.7127 -0.7127 3.3645 3.3646 3.4042 3.4043 5.3792 5.3792 5.8934 5.8935 6.0540 6.0541 7.5307 7.5308 k = 0.0000 0.0000 0.0438 ( 7908 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6584 -14.6584 -14.5437 -14.5437 -13.1660 -13.1660 -13.1415 -13.1414 -11.4872 -11.4872 -11.2782 -11.2782 -8.5209 -8.5206 -8.4934 -8.4931 -6.5722 -6.5721 -6.2479 -6.2476 -6.0109 -6.0108 -5.9579 -5.9575 -5.8726 -5.8719 -5.7469 -5.7469 -5.4859 -5.4858 -5.4043 -5.4041 -5.3056 -5.3056 -5.1763 -5.1762 -4.3283 -4.3281 -3.9440 -3.9440 -2.3432 -2.3431 -2.2592 -2.2590 -2.2392 -2.2390 -1.5297 -1.5295 -1.4598 -1.4597 -1.3918 -1.3917 -0.9934 -0.9933 -0.7116 -0.7116 3.3572 3.3573 3.4117 3.4118 5.3841 5.3842 5.8892 5.8894 6.0589 6.0592 7.5131 7.5134 k = 0.0000 0.0000 0.0656 ( 7902 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6590 -14.6590 -14.5431 -14.5431 -13.1705 -13.1704 -13.1369 -13.1369 -11.4874 -11.4873 -11.2782 -11.2782 -8.5217 -8.5212 -8.4925 -8.4921 -6.5737 -6.5736 -6.2486 -6.2481 -6.0107 -6.0106 -5.9588 -5.9583 -5.8678 -5.8669 -5.7449 -5.7449 -5.4881 -5.4881 -5.4056 -5.4053 -5.3056 -5.3055 -5.1778 -5.1777 -4.3279 -4.3277 -3.9453 -3.9452 -2.3430 -2.3427 -2.2580 -2.2578 -2.2368 -2.2364 -1.5299 -1.5296 -1.4619 -1.4617 -1.3935 -1.3933 -0.9938 -0.9937 -0.7098 -0.7097 3.3484 3.3484 3.4209 3.4210 5.3923 5.3925 5.8829 5.8831 6.0666 6.0670 7.4823 7.4826 k = 0.0000 0.0000 0.0875 ( 7901 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6597 -14.6597 -14.5423 -14.5423 -13.1750 -13.1750 -13.1322 -13.1321 -11.4876 -11.4876 -11.2782 -11.2781 -8.5227 -8.5221 -8.4913 -8.4908 -6.5758 -6.5756 -6.2495 -6.2489 -6.0105 -6.0103 -5.9597 -5.9592 -5.8615 -5.8604 -5.7421 -5.7420 -5.4912 -5.4912 -5.4074 -5.4070 -5.3056 -5.3055 -5.1799 -5.1797 -4.3274 -4.3270 -3.9470 -3.9469 -2.3426 -2.3423 -2.2567 -2.2565 -2.2330 -2.2325 -1.5304 -1.5300 -1.4647 -1.4645 -1.3957 -1.3955 -0.9943 -0.9942 -0.7074 -0.7073 3.3390 3.3391 3.4306 3.4307 5.4037 5.4040 5.8751 5.8753 6.0763 6.0767 7.4378 7.4382 k = 0.0000 0.0000 0.1094 ( 7899 PWs) bands (ev): -23.1661 -23.1661 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6607 -14.6607 -14.5414 -14.5414 -13.1796 -13.1795 -13.1274 -13.1273 -11.4879 -11.4879 -11.2781 -11.2781 -8.5238 -8.5232 -8.4899 -8.4893 -6.5783 -6.5781 -6.2506 -6.2499 -6.0103 -6.0101 -5.9604 -5.9599 -5.8539 -5.8526 -5.7384 -5.7382 -5.4952 -5.4951 -5.4098 -5.4093 -5.3055 -5.3053 -5.1825 -5.1822 -4.3266 -4.3262 -3.9492 -3.9491 -2.3421 -2.3418 -2.2555 -2.2553 -2.2277 -2.2270 -1.5312 -1.5306 -1.4683 -1.4680 -1.3983 -1.3980 -0.9949 -0.9947 -0.7044 -0.7042 3.3296 3.3297 3.4406 3.4407 5.4183 5.4187 5.8665 5.8667 6.0874 6.0879 7.3815 7.3820 k = 0.0000 0.0000 0.1313 ( 7903 PWs) bands (ev): -23.1660 -23.1660 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6618 -14.6618 -14.5402 -14.5402 -13.1841 -13.1840 -13.1227 -13.1226 -11.4883 -11.4883 -11.2781 -11.2780 -8.5249 -8.5243 -8.4883 -8.4877 -6.5812 -6.5811 -6.2519 -6.2511 -6.0101 -6.0100 -5.9609 -5.9604 -5.8452 -5.8438 -5.7338 -5.7335 -5.5000 -5.4999 -5.4128 -5.4122 -5.3054 -5.3052 -5.1855 -5.1852 -4.3257 -4.3252 -3.9518 -3.9516 -2.3415 -2.3412 -2.2545 -2.2544 -2.2209 -2.2201 -1.5326 -1.5319 -1.4723 -1.4721 -1.4010 -1.4007 -0.9955 -0.9954 -0.7009 -0.7007 3.3204 3.3204 3.4505 3.4506 5.4360 5.4364 5.8576 5.8578 6.0994 6.0999 7.3165 7.3169 k = 0.0000 0.0000 0.1532 ( 7905 PWs) bands (ev): -23.1660 -23.1660 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6629 -14.6629 -14.5390 -14.5390 -13.1884 -13.1883 -13.1180 -13.1180 -11.4887 -11.4887 -11.2781 -11.2780 -8.5261 -8.5255 -8.4867 -8.4860 -6.5845 -6.5843 -6.2533 -6.2524 -6.0100 -6.0099 -5.9612 -5.9607 -5.8357 -5.8342 -5.7281 -5.7278 -5.5056 -5.5054 -5.4166 -5.4159 -5.3052 -5.3049 -5.1889 -5.1886 -4.3246 -4.3241 -3.9547 -3.9546 -2.3409 -2.3405 -2.2538 -2.2536 -2.2127 -2.2118 -1.5348 -1.5340 -1.4766 -1.4763 -1.4039 -1.4035 -0.9962 -0.9960 -0.6971 -0.6969 3.3114 3.3115 3.4601 3.4602 5.4567 5.4571 5.8489 5.8491 6.1117 6.1123 7.2456 7.2460 k = 0.0000 0.0000 0.1751 ( 7905 PWs) bands (ev): -23.1660 -23.1660 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6642 -14.6642 -14.5377 -14.5377 -13.1925 -13.1925 -13.1136 -13.1135 -11.4892 -11.4891 -11.2780 -11.2780 -8.5273 -8.5266 -8.4849 -8.4843 -6.5880 -6.5878 -6.2547 -6.2538 -6.0100 -6.0098 -5.9613 -5.9608 -5.8254 -5.8239 -5.7215 -5.7211 -5.5118 -5.5116 -5.4211 -5.4203 -5.3049 -5.3046 -5.1926 -5.1922 -4.3233 -4.3227 -3.9580 -3.9578 -2.3401 -2.3398 -2.2532 -2.2530 -2.2033 -2.2024 -1.5383 -1.5373 -1.4807 -1.4804 -1.4068 -1.4064 -0.9968 -0.9966 -0.6930 -0.6928 3.3028 3.3028 3.4695 3.4696 5.4801 5.4806 5.8407 5.8409 6.1241 6.1248 7.1711 7.1715 k = 0.0000 0.0000 0.1969 ( 7904 PWs) bands (ev): -23.1660 -23.1660 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6656 -14.6655 -14.5363 -14.5363 -13.1965 -13.1964 -13.1093 -13.1092 -11.4896 -11.4896 -11.2780 -11.2779 -8.5284 -8.5277 -8.4832 -8.4825 -6.5916 -6.5915 -6.2563 -6.2553 -6.0099 -6.0098 -5.9612 -5.9609 -5.8145 -5.8131 -5.7138 -5.7133 -5.5188 -5.5185 -5.4264 -5.4255 -5.3046 -5.3042 -5.1965 -5.1961 -4.3219 -4.3213 -3.9615 -3.9613 -2.3393 -2.3390 -2.2527 -2.2526 -2.1929 -2.1919 -1.5433 -1.5423 -1.4841 -1.4838 -1.4096 -1.4092 -0.9974 -0.9972 -0.6888 -0.6886 3.2946 3.2946 3.4786 3.4786 5.5061 5.5067 5.8335 5.8337 6.1363 6.1370 7.0947 7.0951 k = 0.0000 0.0000 0.2188 ( 7888 PWs) bands (ev): -23.1660 -23.1660 -23.0157 -23.0157 -20.5030 -20.5030 -20.2569 -20.2569 -14.6669 -14.6669 -14.5349 -14.5349 -13.2001 -13.2001 -13.1052 -13.1052 -11.4901 -11.4900 -11.2779 -11.2779 -8.5294 -8.5288 -8.4815 -8.4809 -6.5954 -6.5952 -6.2578 -6.2569 -6.0097 -6.0096 -5.9612 -5.9609 -5.8032 -5.8018 -5.7051 -5.7045 -5.5264 -5.5260 -5.4326 -5.4316 -5.3041 -5.3037 -5.2006 -5.2001 -4.3203 -4.3197 -3.9652 -3.9650 -2.3385 -2.3381 -2.2523 -2.2522 -2.1817 -2.1807 -1.5500 -1.5489 -1.4866 -1.4864 -1.4123 -1.4119 -0.9980 -0.9978 -0.6845 -0.6843 3.2869 3.2869 3.4871 3.4872 5.5342 5.5348 5.8276 5.8278 6.1480 6.1487 7.0173 7.0177 k = 0.0000 0.0000 0.2407 ( 7886 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6682 -14.6682 -14.5335 -14.5335 -13.2036 -13.2035 -13.1014 -13.1014 -11.4906 -11.4905 -11.2779 -11.2778 -8.5304 -8.5298 -8.4799 -8.4793 -6.5991 -6.5989 -6.2593 -6.2584 -6.0095 -6.0094 -5.9613 -5.9609 -5.7915 -5.7902 -5.6955 -5.6948 -5.5345 -5.5341 -5.4397 -5.4386 -5.3035 -5.3032 -5.2046 -5.2041 -4.3187 -4.3180 -3.9690 -3.9688 -2.3376 -2.3373 -2.2520 -2.2519 -2.1699 -2.1689 -1.5584 -1.5573 -1.4882 -1.4880 -1.4149 -1.4145 -0.9985 -0.9983 -0.6803 -0.6800 3.2797 3.2797 3.4952 3.4953 5.5639 5.5646 5.8237 5.8239 6.1590 6.1598 6.9400 6.9403 k = 0.0000 0.0000 0.2626 ( 7885 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6695 -14.6695 -14.5322 -14.5322 -13.2068 -13.2067 -13.0979 -13.0978 -11.4911 -11.4910 -11.2778 -11.2778 -8.5313 -8.5307 -8.4783 -8.4778 -6.6027 -6.6026 -6.2607 -6.2599 -6.0092 -6.0091 -5.9616 -5.9612 -5.7795 -5.7782 -5.6851 -5.6843 -5.5430 -5.5426 -5.4476 -5.4465 -5.3029 -5.3025 -5.2086 -5.2081 -4.3169 -4.3163 -3.9728 -3.9726 -2.3368 -2.3365 -2.2517 -2.2516 -2.1577 -2.1567 -1.5680 -1.5669 -1.4888 -1.4886 -1.4173 -1.4169 -0.9989 -0.9987 -0.6762 -0.6759 3.2731 3.2731 3.5027 3.5028 5.5942 5.5950 5.8226 5.8228 6.1689 6.1698 6.8633 6.8636 k = 0.0000 0.0000 0.2845 ( 7890 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6707 -14.6707 -14.5309 -14.5309 -13.2096 -13.2096 -13.0946 -13.0946 -11.4916 -11.4915 -11.2778 -11.2777 -8.5321 -8.5316 -8.4769 -8.4764 -6.6062 -6.6060 -6.2621 -6.2613 -6.0087 -6.0086 -5.9620 -5.9616 -5.7673 -5.7661 -5.6740 -5.6731 -5.5519 -5.5514 -5.4565 -5.4553 -5.3022 -5.3018 -5.2124 -5.2119 -4.3152 -4.3146 -3.9766 -3.9764 -2.3360 -2.3356 -2.2514 -2.2514 -2.1455 -2.1445 -1.5784 -1.5773 -1.4888 -1.4887 -1.4196 -1.4192 -0.9993 -0.9991 -0.6723 -0.6721 3.2671 3.2671 3.5096 3.5096 5.6239 5.6246 5.8257 5.8260 6.1776 6.1785 6.7879 6.7882 k = 0.0000 0.0000 0.3063 ( 7893 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6718 -14.6718 -14.5297 -14.5297 -13.2122 -13.2122 -13.0917 -13.0917 -11.4920 -11.4920 -11.2778 -11.2777 -8.5328 -8.5324 -8.4756 -8.4751 -6.6094 -6.6093 -6.2633 -6.2626 -6.0081 -6.0080 -5.9626 -5.9622 -5.7549 -5.7538 -5.6626 -5.6616 -5.5609 -5.5603 -5.4661 -5.4650 -5.3015 -5.3011 -5.2160 -5.2155 -4.3134 -4.3129 -3.9802 -3.9800 -2.3352 -2.3349 -2.2512 -2.2512 -2.1334 -2.1325 -1.5892 -1.5882 -1.4884 -1.4882 -1.4217 -1.4213 -0.9996 -0.9994 -0.6687 -0.6685 3.2617 3.2617 3.5158 3.5158 5.6508 5.6514 5.8347 5.8351 6.1847 6.1857 6.7146 6.7149 k = 0.0000 0.0000 0.3282 ( 7894 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6728 -14.6728 -14.5286 -14.5286 -13.2145 -13.2145 -13.0892 -13.0891 -11.4924 -11.4924 -11.2777 -11.2777 -8.5334 -8.5330 -8.4744 -8.4740 -6.6123 -6.6122 -6.2645 -6.2638 -6.0075 -6.0073 -5.9634 -5.9629 -5.7425 -5.7415 -5.6512 -5.6501 -5.5696 -5.5688 -5.4766 -5.4754 -5.3008 -5.3004 -5.2192 -5.2188 -4.3117 -4.3112 -3.9836 -3.9834 -2.3344 -2.3342 -2.2511 -2.2510 -2.1219 -2.1210 -1.5998 -1.5989 -1.4876 -1.4875 -1.4236 -1.4233 -0.9998 -0.9996 -0.6654 -0.6653 3.2569 3.2569 3.5212 3.5213 5.6727 5.6732 5.8517 5.8522 6.1897 6.1908 6.6442 6.6445 k = 0.0000 0.0000 0.3501 ( 7885 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6737 -14.6737 -14.5277 -14.5277 -13.2164 -13.2164 -13.0870 -13.0869 -11.4928 -11.4927 -11.2777 -11.2776 -8.5339 -8.5336 -8.4734 -8.4730 -6.6149 -6.6148 -6.2654 -6.2649 -6.0067 -6.0065 -5.9642 -5.9637 -5.7301 -5.7292 -5.6407 -5.6395 -5.5771 -5.5763 -5.4879 -5.4867 -5.3000 -5.2997 -5.2221 -5.2217 -4.3102 -4.3097 -3.9867 -3.9865 -2.3338 -2.3336 -2.2509 -2.2509 -2.1112 -2.1104 -1.6099 -1.6090 -1.4867 -1.4866 -1.4254 -1.4250 -0.9999 -0.9998 -0.6626 -0.6624 3.2529 3.2529 3.5259 3.5260 5.6883 5.6888 5.8776 5.8782 6.1920 6.1932 6.5780 6.5781 k = 0.0000 0.0000 0.3720 ( 7879 PWs) bands (ev): -23.1659 -23.1659 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6745 -14.6745 -14.5269 -14.5269 -13.2180 -13.2180 -13.0851 -13.0851 -11.4931 -11.4930 -11.2776 -11.2776 -8.5343 -8.5341 -8.4725 -8.4722 -6.6170 -6.6170 -6.2662 -6.2658 -6.0059 -6.0057 -5.9650 -5.9646 -5.7180 -5.7173 -5.6328 -5.6316 -5.5818 -5.5808 -5.4997 -5.4985 -5.2994 -5.2991 -5.2246 -5.2242 -4.3088 -4.3084 -3.9893 -3.9891 -2.3332 -2.3330 -2.2508 -2.2508 -2.1017 -2.1011 -1.6189 -1.6182 -1.4858 -1.4857 -1.4268 -1.4266 -1.0001 -1.0000 -0.6602 -0.6601 3.2496 3.2496 3.5298 3.5298 5.6983 5.6986 5.9112 5.9120 6.1904 6.1917 6.5175 6.5177 k = 0.0000 0.0000 0.3939 ( 7889 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6751 -14.6751 -14.5263 -14.5263 -13.2192 -13.2192 -13.0837 -13.0837 -11.4933 -11.4933 -11.2776 -11.2776 -8.5346 -8.5344 -8.4718 -8.4716 -6.6188 -6.6187 -6.2669 -6.2665 -6.0052 -6.0051 -5.9658 -5.9655 -5.7066 -5.7059 -5.6298 -5.6290 -5.5808 -5.5799 -5.5121 -5.5109 -5.2988 -5.2986 -5.2265 -5.2262 -4.3076 -4.3073 -3.9914 -3.9913 -2.3328 -2.3326 -2.2507 -2.2507 -2.0939 -2.0933 -1.6264 -1.6258 -1.4850 -1.4849 -1.4280 -1.4278 -1.0002 -1.0001 -0.6583 -0.6582 3.2469 3.2470 3.5329 3.5329 5.7041 5.7043 5.9498 5.9507 6.1836 6.1850 6.4654 6.4656 k = 0.0000 0.0000 0.4157 ( 7895 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6755 -14.6755 -14.5258 -14.5258 -13.2201 -13.2201 -13.0827 -13.0827 -11.4935 -11.4935 -11.2776 -11.2776 -8.5349 -8.5347 -8.4713 -8.4712 -6.6200 -6.6200 -6.2673 -6.2671 -6.0046 -6.0045 -5.9664 -5.9662 -5.6963 -5.6958 -5.6320 -5.6316 -5.5738 -5.5729 -5.5249 -5.5237 -5.2984 -5.2982 -5.2279 -5.2277 -4.3068 -4.3066 -3.9930 -3.9929 -2.3324 -2.3323 -2.2507 -2.2507 -2.0879 -2.0875 -1.6320 -1.6317 -1.4843 -1.4842 -1.4289 -1.4288 -1.0002 -1.0002 -0.6569 -0.6569 3.2451 3.2451 3.5351 3.5351 5.7072 5.7073 5.9898 5.9908 6.1703 6.1717 6.4252 6.4254 k = 0.0000 0.0000 0.4376 ( 7898 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6758 -14.6758 -14.5256 -14.5256 -13.2207 -13.2207 -13.0821 -13.0821 -11.4936 -11.4936 -11.2776 -11.2776 -8.5350 -8.5349 -8.4710 -8.4709 -6.6207 -6.6207 -6.2676 -6.2674 -6.0042 -6.0042 -5.9668 -5.9666 -5.6885 -5.6882 -5.6361 -5.6360 -5.5632 -5.5622 -5.5378 -5.5367 -5.2981 -5.2980 -5.2288 -5.2287 -4.3062 -4.3061 -3.9939 -3.9939 -2.3322 -2.3322 -2.2506 -2.2506 -2.0842 -2.0840 -1.6355 -1.6353 -1.4839 -1.4838 -1.4295 -1.4294 -1.0002 -1.0002 -0.6561 -0.6560 3.2439 3.2439 3.5364 3.5364 5.7088 5.7088 6.0254 6.0262 6.1524 6.1535 6.4001 6.4003 k = 0.0000 0.0000 0.4595 ( 7898 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6759 -14.6759 -14.5255 -14.5255 -13.2208 -13.2208 -13.0818 -13.0818 -11.4937 -11.4937 -11.2776 -11.2776 -8.5350 -8.5350 -8.4708 -8.4708 -6.6210 -6.6210 -6.2676 -6.2676 -6.0041 -6.0041 -5.9669 -5.9669 -5.6853 -5.6853 -5.6381 -5.6381 -5.5521 -5.5521 -5.5485 -5.5485 -5.2980 -5.2980 -5.2290 -5.2290 -4.3060 -4.3060 -3.9942 -3.9942 -2.3321 -2.3321 -2.2506 -2.2506 -2.0828 -2.0828 -1.6367 -1.6367 -1.4837 -1.4837 -1.4296 -1.4296 -1.0002 -1.0002 -0.6558 -0.6558 3.2436 3.2436 3.5368 3.5368 5.7092 5.7092 6.0424 6.0424 6.1423 6.1423 6.3917 6.3917 k = 0.0000 0.0000 0.4595 ( 7898 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6759 -14.6759 -14.5255 -14.5255 -13.2208 -13.2208 -13.0818 -13.0818 -11.4937 -11.4937 -11.2776 -11.2776 -8.5350 -8.5350 -8.4708 -8.4708 -6.6210 -6.6210 -6.2676 -6.2676 -6.0041 -6.0041 -5.9669 -5.9669 -5.6853 -5.6853 -5.6381 -5.6381 -5.5521 -5.5521 -5.5485 -5.5485 -5.2980 -5.2980 -5.2290 -5.2290 -4.3060 -4.3060 -3.9942 -3.9942 -2.3321 -2.3321 -2.2506 -2.2506 -2.0828 -2.0828 -1.6367 -1.6367 -1.4837 -1.4837 -1.4296 -1.4296 -1.0002 -1.0002 -0.6558 -0.6558 3.2436 3.2436 3.5368 3.5368 5.7092 5.7092 6.0424 6.0424 6.1423 6.1423 6.3917 6.3917 k = 0.0000 0.0225 0.4595 ( 7907 PWs) bands (ev): -23.1659 -23.1659 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6756 -14.6756 -14.5253 -14.5253 -13.2207 -13.2207 -13.0818 -13.0818 -11.4936 -11.4936 -11.2777 -11.2777 -8.5351 -8.5350 -8.4709 -8.4708 -6.6210 -6.6210 -6.2677 -6.2676 -6.0041 -6.0041 -5.9669 -5.9669 -5.6868 -5.6867 -5.6380 -5.6378 -5.5529 -5.5522 -5.5486 -5.5479 -5.2990 -5.2989 -5.2301 -5.2301 -4.3061 -4.3061 -3.9943 -3.9942 -2.3333 -2.3332 -2.2502 -2.2501 -2.0830 -2.0827 -1.6365 -1.6363 -1.4836 -1.4834 -1.4293 -1.4293 -1.0002 -1.0002 -0.6559 -0.6559 3.2444 3.2444 3.5375 3.5376 5.7096 5.7096 6.0437 6.0438 6.1435 6.1435 6.3928 6.3928 k = 0.0000 0.0449 0.4595 ( 7899 PWs) bands (ev): -23.1658 -23.1658 -23.0157 -23.0157 -20.5029 -20.5029 -20.2569 -20.2569 -14.6748 -14.6748 -14.5248 -14.5248 -13.2205 -13.2205 -13.0818 -13.0818 -11.4935 -11.4935 -11.2779 -11.2779 -8.5352 -8.5350 -8.4711 -8.4709 -6.6210 -6.6210 -6.2678 -6.2677 -6.0040 -6.0040 -5.9670 -5.9669 -5.6910 -5.6908 -5.6376 -5.6373 -5.5542 -5.5531 -5.5482 -5.5473 -5.3019 -5.3017 -5.2333 -5.2332 -4.3066 -4.3066 -3.9943 -3.9942 -2.3367 -2.3364 -2.2491 -2.2489 -2.0831 -2.0827 -1.6357 -1.6355 -1.4830 -1.4828 -1.4283 -1.4282 -1.0001 -1.0000 -0.6564 -0.6563 3.2468 3.2468 3.5397 3.5398 5.7107 5.7107 6.0476 6.0477 6.1469 6.1470 6.3962 6.3963 k = 0.0000 0.0674 0.4595 ( 7899 PWs) bands (ev): -23.1656 -23.1656 -23.0156 -23.0156 -20.5027 -20.5027 -20.2569 -20.2569 -14.6735 -14.6735 -14.5239 -14.5239 -13.2200 -13.2200 -13.0818 -13.0818 -11.4934 -11.4934 -11.2783 -11.2783 -8.5355 -8.5351 -8.4713 -8.4710 -6.6211 -6.6211 -6.2680 -6.2678 -6.0040 -6.0040 -5.9671 -5.9670 -5.6977 -5.6974 -5.6372 -5.6368 -5.5557 -5.5546 -5.5478 -5.5468 -5.3067 -5.3065 -5.2385 -5.2384 -4.3074 -4.3073 -3.9943 -3.9942 -2.3420 -2.3415 -2.2474 -2.2471 -2.0833 -2.0826 -1.6345 -1.6341 -1.4821 -1.4817 -1.4267 -1.4265 -0.9999 -0.9997 -0.6570 -0.6570 3.2508 3.2508 3.5434 3.5435 5.7126 5.7127 6.0540 6.0541 6.1527 6.1528 6.4020 6.4020 k = 0.0000 0.0899 0.4595 ( 7913 PWs) bands (ev): -23.1653 -23.1653 -23.0155 -23.0155 -20.5025 -20.5025 -20.2569 -20.2569 -14.6717 -14.6717 -14.5227 -14.5227 -13.2193 -13.2193 -13.0818 -13.0818 -11.4932 -11.4931 -11.2788 -11.2788 -8.5358 -8.5353 -8.4716 -8.4712 -6.6212 -6.6212 -6.2684 -6.2680 -6.0039 -6.0039 -5.9673 -5.9672 -5.7065 -5.7061 -5.6372 -5.6366 -5.5574 -5.5562 -5.5476 -5.5466 -5.3133 -5.3130 -5.2457 -5.2457 -4.3084 -4.3083 -3.9943 -3.9942 -2.3488 -2.3483 -2.2456 -2.2452 -2.0834 -2.0825 -1.6328 -1.6323 -1.4808 -1.4803 -1.4244 -1.4243 -0.9995 -0.9993 -0.6580 -0.6579 3.2564 3.2564 3.5485 3.5485 5.7154 5.7155 6.0623 6.0625 6.1608 6.1609 6.4102 6.4103 k = 0.0000 0.1123 0.4595 ( 7905 PWs) bands (ev): -23.1649 -23.1649 -23.0153 -23.0153 -20.5023 -20.5023 -20.2569 -20.2569 -14.6694 -14.6694 -14.5211 -14.5211 -13.2185 -13.2185 -13.0817 -13.0817 -11.4929 -11.4929 -11.2795 -11.2794 -8.5361 -8.5356 -8.4720 -8.4715 -6.6213 -6.6213 -6.2688 -6.2684 -6.0038 -6.0038 -5.9677 -5.9675 -5.7171 -5.7167 -5.6377 -5.6370 -5.5593 -5.5582 -5.5475 -5.5466 -5.3215 -5.3211 -5.2549 -5.2548 -4.3097 -4.3096 -3.9944 -3.9941 -2.3569 -2.3563 -2.2440 -2.2435 -2.0833 -2.0823 -1.6306 -1.6300 -1.4792 -1.4786 -1.4216 -1.4214 -0.9991 -0.9989 -0.6593 -0.6591 3.2634 3.2634 3.5549 3.5550 5.7192 5.7194 6.0724 6.0726 6.1712 6.1713 6.4212 6.4213 k = 0.0000 0.1348 0.4595 ( 7901 PWs) bands (ev): -23.1644 -23.1644 -23.0151 -23.0151 -20.5019 -20.5019 -20.2569 -20.2569 -14.6665 -14.6665 -14.5192 -14.5192 -13.2175 -13.2175 -13.0817 -13.0817 -11.4925 -11.4925 -11.2802 -11.2802 -8.5365 -8.5359 -8.4724 -8.4718 -6.6214 -6.6214 -6.2693 -6.2688 -6.0037 -6.0036 -5.9681 -5.9679 -5.7293 -5.7288 -5.6389 -5.6381 -5.5613 -5.5603 -5.5478 -5.5470 -5.3313 -5.3309 -5.2658 -5.2657 -4.3112 -4.3111 -3.9944 -3.9941 -2.3660 -2.3653 -2.2429 -2.2423 -2.0831 -2.0819 -1.6280 -1.6273 -1.4774 -1.4766 -1.4182 -1.4180 -0.9986 -0.9983 -0.6608 -0.6606 3.2719 3.2719 3.5627 3.5628 5.7241 5.7243 6.0836 6.0839 6.1838 6.1840 6.4351 6.4352 k = 0.0000 0.1573 0.4595 ( 7902 PWs) bands (ev): -23.1639 -23.1639 -23.0148 -23.0148 -20.5015 -20.5015 -20.2570 -20.2570 -14.6632 -14.6632 -14.5171 -14.5170 -13.2163 -13.2163 -13.0816 -13.0816 -11.4921 -11.4921 -11.2812 -11.2812 -8.5370 -8.5362 -8.4729 -8.4722 -6.6215 -6.6215 -6.2699 -6.2693 -6.0036 -6.0035 -5.9688 -5.9685 -5.7429 -5.7423 -5.6410 -5.6401 -5.5636 -5.5626 -5.5482 -5.5475 -5.3425 -5.3420 -5.2784 -5.2783 -4.3129 -4.3128 -3.9944 -3.9941 -2.3759 -2.3751 -2.2425 -2.2417 -2.0825 -2.0812 -1.6250 -1.6242 -1.4752 -1.4744 -1.4144 -1.4142 -0.9979 -0.9976 -0.6626 -0.6624 3.2817 3.2817 3.5718 3.5719 5.7302 5.7304 6.0956 6.0959 6.1988 6.1990 6.4520 6.4521 k = 0.0000 0.1797 0.4595 ( 7904 PWs) bands (ev): -23.1632 -23.1632 -23.0145 -23.0145 -20.5011 -20.5011 -20.2570 -20.2570 -14.6595 -14.6595 -14.5146 -14.5146 -13.2150 -13.2149 -13.0816 -13.0816 -11.4917 -11.4917 -11.2823 -11.2823 -8.5375 -8.5367 -8.4734 -8.4726 -6.6217 -6.6217 -6.2707 -6.2700 -6.0034 -6.0033 -5.9696 -5.9694 -5.7578 -5.7571 -5.6442 -5.6432 -5.5661 -5.5652 -5.5488 -5.5483 -5.3549 -5.3543 -5.2925 -5.2923 -4.3149 -4.3147 -3.9945 -3.9942 -2.3864 -2.3856 -2.2428 -2.2420 -2.0816 -2.0802 -1.6217 -1.6208 -1.4729 -1.4720 -1.4102 -1.4099 -0.9972 -0.9968 -0.6646 -0.6644 3.2927 3.2927 3.5821 3.5822 5.7374 5.7377 6.1079 6.1081 6.2162 6.2163 6.4722 6.4723 k = 0.0000 0.2022 0.4595 ( 7917 PWs) bands (ev): -23.1625 -23.1625 -23.0142 -23.0142 -20.5006 -20.5006 -20.2570 -20.2570 -14.6552 -14.6552 -14.5118 -14.5118 -13.2135 -13.2135 -13.0815 -13.0815 -11.4912 -11.4912 -11.2835 -11.2834 -8.5381 -8.5372 -8.4740 -8.4732 -6.6219 -6.6219 -6.2716 -6.2709 -6.0032 -6.0031 -5.9708 -5.9705 -5.7737 -5.7730 -5.6486 -5.6474 -5.5687 -5.5679 -5.5495 -5.5491 -5.3684 -5.3677 -5.3077 -5.3075 -4.3169 -4.3167 -3.9945 -3.9942 -2.3975 -2.3966 -2.2440 -2.2432 -2.0804 -2.0789 -1.6182 -1.6171 -1.4704 -1.4694 -1.4057 -1.4054 -0.9963 -0.9959 -0.6669 -0.6667 3.3048 3.3048 3.5935 3.5937 5.7458 5.7462 6.1199 6.1201 6.2361 6.2361 6.4958 6.4959 k = 0.0000 0.2247 0.4595 ( 7919 PWs) bands (ev): -23.1618 -23.1618 -23.0139 -23.0139 -20.5001 -20.5001 -20.2570 -20.2570 -14.6506 -14.6506 -14.5087 -14.5087 -13.2118 -13.2118 -13.0814 -13.0814 -11.4907 -11.4907 -11.2848 -11.2848 -8.5387 -8.5377 -8.4747 -8.4737 -6.6221 -6.6221 -6.2727 -6.2719 -6.0031 -6.0029 -5.9724 -5.9720 -5.7905 -5.7897 -5.6542 -5.6530 -5.5715 -5.5707 -5.5504 -5.5501 -5.3828 -5.3821 -5.3239 -5.3236 -4.3191 -4.3189 -3.9946 -3.9942 -2.4090 -2.4081 -2.2462 -2.2453 -2.0787 -2.0771 -1.6144 -1.6133 -1.4679 -1.4667 -1.4009 -1.4006 -0.9954 -0.9949 -0.6695 -0.6692 3.3179 3.3179 3.6060 3.6062 5.7553 5.7557 6.1312 6.1314 6.2586 6.2587 6.5226 6.5227 k = 0.0000 0.2471 0.4595 ( 7924 PWs) bands (ev): -23.1610 -23.1610 -23.0135 -23.0135 -20.4995 -20.4995 -20.2570 -20.2570 -14.6455 -14.6455 -14.5054 -14.5054 -13.2101 -13.2101 -13.0813 -13.0813 -11.4902 -11.4902 -11.2862 -11.2862 -8.5394 -8.5383 -8.4754 -8.4744 -6.6224 -6.6223 -6.2740 -6.2731 -6.0029 -6.0027 -5.9745 -5.9741 -5.8080 -5.8071 -5.6612 -5.6600 -5.5744 -5.5737 -5.5513 -5.5511 -5.3979 -5.3972 -5.3408 -5.3403 -4.3214 -4.3212 -3.9947 -3.9943 -2.4209 -2.4200 -2.2492 -2.2483 -2.0767 -2.0751 -1.6106 -1.6093 -1.4652 -1.4640 -1.3959 -1.3955 -0.9943 -0.9938 -0.6723 -0.6720 3.3319 3.3319 3.6194 3.6196 5.7658 5.7662 6.1415 6.1417 6.2841 6.2842 6.5527 6.5528 k = 0.0000 0.2696 0.4595 ( 7928 PWs) bands (ev): -23.1601 -23.1601 -23.0131 -23.0131 -20.4989 -20.4989 -20.2570 -20.2570 -14.6401 -14.6401 -14.5019 -14.5019 -13.2082 -13.2082 -13.0813 -13.0813 -11.4896 -11.4896 -11.2877 -11.2877 -8.5401 -8.5389 -8.4762 -8.4751 -6.6227 -6.6226 -6.2756 -6.2746 -6.0026 -6.0025 -5.9773 -5.9768 -5.8259 -5.8250 -5.6697 -5.6684 -5.5775 -5.5768 -5.5523 -5.5522 -5.4139 -5.4132 -5.3578 -5.3572 -4.3237 -4.3235 -3.9948 -3.9944 -2.4331 -2.4322 -2.2532 -2.2522 -2.0743 -2.0727 -1.6066 -1.6053 -1.4625 -1.4612 -1.3908 -1.3904 -0.9931 -0.9926 -0.6754 -0.6751 3.3465 3.3465 3.6338 3.6340 5.7771 5.7775 6.1506 6.1508 6.3127 6.3129 6.5858 6.5859 k = 0.0000 0.2921 0.4595 ( 7927 PWs) bands (ev): -23.1591 -23.1591 -23.0126 -23.0126 -20.4983 -20.4983 -20.2570 -20.2570 -14.6342 -14.6342 -14.4982 -14.4982 -13.2062 -13.2062 -13.0812 -13.0812 -11.4891 -11.4890 -11.2893 -11.2893 -8.5408 -8.5396 -8.4769 -8.4758 -6.6230 -6.6229 -6.2774 -6.2763 -6.0025 -6.0023 -5.9810 -5.9803 -5.8440 -5.8431 -5.6796 -5.6782 -5.5807 -5.5799 -5.5534 -5.5533 -5.4306 -5.4300 -5.3746 -5.3738 -4.3261 -4.3258 -3.9949 -3.9945 -2.4455 -2.4445 -2.2578 -2.2569 -2.0715 -2.0700 -1.6028 -1.6013 -1.4598 -1.4584 -1.3855 -1.3851 -0.9919 -0.9913 -0.6787 -0.6784 3.3617 3.3617 3.6489 3.6491 5.7891 5.7895 6.1584 6.1585 6.3446 6.3449 6.6216 6.6216 k = 0.0000 0.3145 0.4595 ( 7918 PWs) bands (ev): -23.1581 -23.1581 -23.0122 -23.0122 -20.4976 -20.4976 -20.2570 -20.2570 -14.6281 -14.6281 -14.4943 -14.4943 -13.2041 -13.2041 -13.0811 -13.0810 -11.4885 -11.4885 -11.2910 -11.2910 -8.5415 -8.5403 -8.4778 -8.4766 -6.6233 -6.6232 -6.2796 -6.2784 -6.0023 -6.0021 -5.9858 -5.9850 -5.8619 -5.8610 -5.6907 -5.6894 -5.5842 -5.5834 -5.5545 -5.5544 -5.4481 -5.4477 -5.3905 -5.3895 -4.3284 -4.3282 -3.9950 -3.9946 -2.4580 -2.4571 -2.2632 -2.2623 -2.0685 -2.0670 -1.5990 -1.5975 -1.4570 -1.4557 -1.3803 -1.3799 -0.9904 -0.9898 -0.6823 -0.6819 3.3773 3.3773 3.6646 3.6648 5.8015 5.8021 6.1647 6.1650 6.3800 6.3804 6.6598 6.6598 k = 0.0000 0.3370 0.4595 ( 7909 PWs) bands (ev): -23.1571 -23.1571 -23.0117 -23.0117 -20.4969 -20.4969 -20.2571 -20.2571 -14.6216 -14.6216 -14.4902 -14.4902 -13.2019 -13.2019 -13.0810 -13.0809 -11.4879 -11.4879 -11.2928 -11.2927 -8.5423 -8.5410 -8.4786 -8.4774 -6.6236 -6.6236 -6.2821 -6.2808 -6.0021 -6.0019 -5.9920 -5.9910 -5.8794 -5.8785 -5.7029 -5.7017 -5.5882 -5.5872 -5.5557 -5.5555 -5.4665 -5.4663 -5.4052 -5.4040 -4.3307 -4.3305 -3.9952 -3.9948 -2.4706 -2.4697 -2.2692 -2.2683 -2.0653 -2.0639 -1.5955 -1.5939 -1.4543 -1.4529 -1.3751 -1.3746 -0.9889 -0.9883 -0.6860 -0.6856 3.3932 3.3932 3.6810 3.6812 5.8143 5.8149 6.1699 6.1701 6.4188 6.4193 6.7000 6.7001 k = 0.0000 0.3595 0.4595 ( 7911 PWs) bands (ev): -23.1560 -23.1560 -23.0112 -23.0112 -20.4961 -20.4961 -20.2571 -20.2571 -14.6149 -14.6149 -14.4860 -14.4860 -13.1997 -13.1997 -13.0809 -13.0808 -11.4874 -11.4873 -11.2946 -11.2946 -8.5430 -8.5417 -8.4795 -8.4783 -6.6240 -6.6239 -6.2850 -6.2836 -6.0023 -6.0021 -5.9996 -5.9986 -5.8959 -5.8951 -5.7160 -5.7148 -5.5928 -5.5917 -5.5568 -5.5566 -5.4857 -5.4856 -5.4183 -5.4168 -4.3329 -4.3327 -3.9954 -3.9950 -2.4834 -2.4824 -2.2757 -2.2749 -2.0620 -2.0606 -1.5924 -1.5907 -1.4515 -1.4501 -1.3699 -1.3695 -0.9873 -0.9866 -0.6900 -0.6896 3.4092 3.4092 3.6978 3.6980 5.8273 5.8278 6.1738 6.1740 6.4611 6.4616 6.7421 6.7422 k = 0.0000 0.3819 0.4595 ( 7919 PWs) bands (ev): -23.1550 -23.1550 -23.0107 -23.0107 -20.4954 -20.4954 -20.2571 -20.2571 -14.6080 -14.6079 -14.4818 -14.4818 -13.1975 -13.1974 -13.0807 -13.0807 -11.4868 -11.4868 -11.2964 -11.2964 -8.5438 -8.5425 -8.4804 -8.4792 -6.6244 -6.6243 -6.2884 -6.2869 -6.0103 -6.0089 -6.0017 -6.0014 -5.9112 -5.9104 -5.7296 -5.7286 -5.5981 -5.5969 -5.5581 -5.5577 -5.5055 -5.5051 -5.4296 -5.4279 -4.3351 -4.3348 -3.9957 -3.9953 -2.4961 -2.4952 -2.2827 -2.2819 -2.0585 -2.0572 -1.5896 -1.5879 -1.4487 -1.4473 -1.3648 -1.3644 -0.9856 -0.9849 -0.6941 -0.6937 3.4251 3.4251 3.7149 3.7151 5.8402 5.8408 6.1766 6.1769 6.5067 6.5072 6.7857 6.7857 k = 0.0000 0.4044 0.4595 ( 7921 PWs) bands (ev): -23.1538 -23.1538 -23.0102 -23.0102 -20.4946 -20.4946 -20.2571 -20.2571 -14.6008 -14.6008 -14.4774 -14.4774 -13.1952 -13.1951 -13.0806 -13.0806 -11.4863 -11.4863 -11.2983 -11.2983 -8.5446 -8.5432 -8.4814 -8.4801 -6.6249 -6.6248 -6.2923 -6.2907 -6.0223 -6.0207 -6.0018 -6.0014 -5.9251 -5.9244 -5.7435 -5.7426 -5.6044 -5.6030 -5.5600 -5.5593 -5.5250 -5.5242 -5.4391 -5.4373 -4.3371 -4.3369 -3.9960 -3.9955 -2.5087 -2.5078 -2.2900 -2.2892 -2.0549 -2.0537 -1.5873 -1.5856 -1.4458 -1.4445 -1.3599 -1.3594 -0.9838 -0.9831 -0.6984 -0.6979 3.4408 3.4408 3.7323 3.7325 5.8530 5.8536 6.1786 6.1789 6.5555 6.5561 6.8305 6.8306 k = 0.0000 0.4269 0.4595 ( 7918 PWs) bands (ev): -23.1527 -23.1527 -23.0097 -23.0097 -20.4938 -20.4938 -20.2572 -20.2572 -14.5934 -14.5934 -14.4730 -14.4730 -13.1928 -13.1928 -13.0805 -13.0805 -11.4859 -11.4858 -11.3001 -11.3001 -8.5454 -8.5440 -8.4823 -8.4810 -6.6253 -6.6252 -6.2969 -6.2952 -6.0363 -6.0344 -6.0019 -6.0015 -5.9378 -5.9372 -5.7574 -5.7566 -5.6115 -5.6102 -5.5646 -5.5634 -5.5419 -5.5404 -5.4469 -5.4450 -4.3391 -4.3388 -3.9963 -3.9959 -2.5213 -2.5204 -2.2975 -2.2968 -2.0512 -2.0501 -1.5856 -1.5839 -1.4430 -1.4418 -1.3551 -1.3546 -0.9818 -0.9811 -0.7028 -0.7023 3.4562 3.4562 3.7498 3.7500 5.8656 5.8662 6.1797 6.1800 6.6074 6.6079 6.8763 6.8764 k = 0.0000 0.4493 0.4595 ( 7924 PWs) bands (ev): -23.1516 -23.1516 -23.0092 -23.0092 -20.4930 -20.4930 -20.2572 -20.2572 -14.5860 -14.5860 -14.4686 -14.4686 -13.1905 -13.1905 -13.0804 -13.0803 -11.4855 -11.4854 -11.3020 -11.3020 -8.5461 -8.5448 -8.4833 -8.4820 -6.6258 -6.6257 -6.3020 -6.3002 -6.0518 -6.0497 -6.0021 -6.0017 -5.9495 -5.9489 -5.7709 -5.7703 -5.6196 -5.6183 -5.5765 -5.5755 -5.5502 -5.5489 -5.4531 -5.4511 -4.3408 -4.3406 -3.9966 -3.9962 -2.5337 -2.5328 -2.3052 -2.3046 -2.0475 -2.0465 -1.5845 -1.5828 -1.4401 -1.4390 -1.3505 -1.3500 -0.9798 -0.9791 -0.7073 -0.7068 3.4712 3.4712 3.7673 3.7675 5.8777 5.8783 6.1800 6.1803 6.6619 6.6625 6.9230 6.9231 k = 0.0000 0.4718 0.4595 ( 7932 PWs) bands (ev): -23.1504 -23.1504 -23.0087 -23.0087 -20.4922 -20.4922 -20.2572 -20.2572 -14.5784 -14.5784 -14.4642 -14.4642 -13.1882 -13.1882 -13.0802 -13.0802 -11.4852 -11.4851 -11.3038 -11.3038 -8.5469 -8.5456 -8.4842 -8.4829 -6.6263 -6.6262 -6.3079 -6.3060 -6.0682 -6.0660 -6.0025 -6.0021 -5.9607 -5.9601 -5.7838 -5.7833 -5.6286 -5.6274 -5.5937 -5.5933 -5.5520 -5.5512 -5.4580 -5.4560 -4.3424 -4.3422 -3.9970 -3.9966 -2.5458 -2.5451 -2.3130 -2.3124 -2.0438 -2.0429 -1.5841 -1.5824 -1.4372 -1.4362 -1.3461 -1.3455 -0.9777 -0.9770 -0.7119 -0.7113 3.4857 3.4857 3.7847 3.7849 5.8895 5.8901 6.1798 6.1801 6.7190 6.7196 6.9703 6.9705 k = 0.0000 0.4943 0.4595 ( 7939 PWs) bands (ev): -23.1493 -23.1493 -23.0082 -23.0082 -20.4914 -20.4914 -20.2573 -20.2572 -14.5708 -14.5708 -14.4599 -14.4599 -13.1860 -13.1860 -13.0800 -13.0800 -11.4849 -11.4849 -11.3056 -11.3056 -8.5476 -8.5463 -8.4852 -8.4839 -6.6269 -6.6268 -6.3145 -6.3126 -6.0851 -6.0828 -6.0031 -6.0027 -5.9716 -5.9710 -5.7958 -5.7954 -5.6385 -5.6375 -5.6120 -5.6115 -5.5520 -5.5513 -5.4617 -5.4597 -4.3439 -4.3437 -3.9975 -3.9971 -2.5578 -2.5570 -2.3209 -2.3203 -2.0401 -2.0392 -1.5842 -1.5826 -1.4344 -1.4335 -1.3418 -1.3413 -0.9755 -0.9748 -0.7164 -0.7159 3.4995 3.4996 3.8019 3.8021 5.9007 5.9013 6.1790 6.1793 6.7782 6.7788 7.0184 7.0186 k = 0.0000 0.5167 0.4595 ( 7940 PWs) bands (ev): -23.1481 -23.1481 -23.0076 -23.0076 -20.4906 -20.4906 -20.2573 -20.2573 -14.5632 -14.5632 -14.4557 -14.4557 -13.1838 -13.1838 -13.0798 -13.0798 -11.4847 -11.4847 -11.3073 -11.3073 -8.5483 -8.5470 -8.4861 -8.4849 -6.6275 -6.6274 -6.3219 -6.3199 -6.1020 -6.0995 -6.0040 -6.0036 -5.9825 -5.9819 -5.8069 -5.8065 -5.6495 -5.6489 -5.6296 -5.6285 -5.5512 -5.5507 -5.4643 -5.4625 -4.3452 -4.3449 -3.9979 -3.9976 -2.5694 -2.5687 -2.3286 -2.3281 -2.0363 -2.0356 -1.5850 -1.5834 -1.4316 -1.4308 -1.3378 -1.3372 -0.9733 -0.9726 -0.7209 -0.7203 3.5127 3.5127 3.8189 3.8191 5.9113 5.9119 6.1777 6.1780 6.8391 6.8397 7.0671 7.0674 k = 0.0000 0.5392 0.4595 ( 7933 PWs) bands (ev): -23.1470 -23.1470 -23.0072 -23.0072 -20.4898 -20.4898 -20.2573 -20.2573 -14.5556 -14.5556 -14.4516 -14.4515 -13.1816 -13.1816 -13.0796 -13.0796 -11.4846 -11.4846 -11.3089 -11.3089 -8.5490 -8.5477 -8.4870 -8.4858 -6.6281 -6.6280 -6.3301 -6.3281 -6.1185 -6.1160 -6.0055 -6.0050 -5.9932 -5.9924 -5.8169 -5.8165 -5.6622 -5.6617 -5.6452 -5.6434 -5.5500 -5.5495 -5.4662 -5.4644 -4.3463 -4.3460 -3.9985 -3.9981 -2.5807 -2.5801 -2.3363 -2.3359 -2.0326 -2.0319 -1.5864 -1.5848 -1.4290 -1.4283 -1.3339 -1.3333 -0.9710 -0.9703 -0.7253 -0.7247 3.5250 3.5251 3.8354 3.8356 5.9213 5.9219 6.1761 6.1764 6.9013 6.9018 7.1167 7.1170 k = 0.0000 0.5617 0.4595 ( 7934 PWs) bands (ev): -23.1459 -23.1459 -23.0067 -23.0067 -20.4891 -20.4891 -20.2573 -20.2573 -14.5481 -14.5481 -14.4476 -14.4476 -13.1796 -13.1796 -13.0794 -13.0794 -11.4846 -11.4846 -11.3104 -11.3104 -8.5496 -8.5484 -8.4879 -8.4868 -6.6288 -6.6286 -6.3391 -6.3370 -6.1345 -6.1319 -6.0097 -6.0086 -6.0020 -6.0007 -5.8258 -5.8253 -5.6764 -5.6757 -5.6584 -5.6563 -5.5485 -5.5481 -5.4674 -5.4657 -4.3472 -4.3470 -3.9990 -3.9987 -2.5917 -2.5910 -2.3439 -2.3434 -2.0288 -2.0282 -1.5883 -1.5868 -1.4266 -1.4260 -1.3303 -1.3297 -0.9687 -0.9681 -0.7296 -0.7290 3.5366 3.5366 3.8514 3.8516 5.9308 5.9313 6.1741 6.1744 6.9640 6.9644 7.1672 7.1676 k = 0.0000 0.5841 0.4595 ( 7940 PWs) bands (ev): -23.1449 -23.1449 -23.0062 -23.0062 -20.4883 -20.4883 -20.2574 -20.2574 -14.5408 -14.5408 -14.4438 -14.4438 -13.1776 -13.1776 -13.0792 -13.0792 -11.4848 -11.4848 -11.3118 -11.3118 -8.5502 -8.5490 -8.4888 -8.4877 -6.6295 -6.6293 -6.3487 -6.3466 -6.1497 -6.1470 -6.0187 -6.0177 -6.0056 -6.0044 -5.8337 -5.8331 -5.6910 -5.6903 -5.6699 -5.6677 -5.5467 -5.5464 -5.4681 -5.4665 -4.3479 -4.3477 -3.9997 -3.9994 -2.6022 -2.6015 -2.3512 -2.3508 -2.0250 -2.0244 -1.5906 -1.5892 -1.4245 -1.4240 -1.3269 -1.3262 -0.9665 -0.9659 -0.7336 -0.7331 3.5473 3.5473 3.8668 3.8670 5.9395 5.9401 6.1719 6.1721 7.0265 7.0270 7.2191 7.2196 k = 0.0000 0.6066 0.4595 ( 7932 PWs) bands (ev): -23.1438 -23.1438 -23.0057 -23.0057 -20.4876 -20.4876 -20.2574 -20.2574 -14.5336 -14.5335 -14.4402 -14.4401 -13.1758 -13.1758 -13.0789 -13.0789 -11.4850 -11.4850 -11.3131 -11.3131 -8.5507 -8.5496 -8.4896 -8.4886 -6.6303 -6.6301 -6.3588 -6.3567 -6.1641 -6.1614 -6.0292 -6.0285 -6.0077 -6.0066 -5.8406 -5.8399 -5.7052 -5.7046 -5.6803 -5.6782 -5.5448 -5.5445 -5.4683 -5.4667 -4.3485 -4.3483 -4.0003 -4.0001 -2.6122 -2.6116 -2.3583 -2.3579 -2.0212 -2.0207 -1.5934 -1.5921 -1.4228 -1.4223 -1.3236 -1.3229 -0.9643 -0.9638 -0.7374 -0.7368 3.5571 3.5572 3.8816 3.8817 5.9477 5.9482 6.1694 6.1697 7.0880 7.0884 7.2729 7.2734 k = 0.0000 0.6291 0.4595 ( 7930 PWs) bands (ev): -23.1429 -23.1429 -23.0053 -23.0053 -20.4869 -20.4869 -20.2574 -20.2574 -14.5266 -14.5265 -14.4368 -14.4368 -13.1740 -13.1740 -13.0786 -13.0786 -11.4854 -11.4853 -11.3142 -11.3142 -8.5512 -8.5502 -8.4904 -8.4895 -6.6311 -6.6309 -6.3693 -6.3672 -6.1776 -6.1749 -6.0398 -6.0391 -6.0097 -6.0088 -5.8466 -5.8459 -5.7184 -5.7180 -5.6900 -5.6880 -5.5428 -5.5424 -5.4682 -5.4667 -4.3489 -4.3487 -4.0011 -4.0008 -2.6217 -2.6211 -2.3650 -2.3647 -2.0174 -2.0169 -1.5965 -1.5953 -1.4214 -1.4210 -1.3205 -1.3198 -0.9622 -0.9618 -0.7409 -0.7403 3.5661 3.5662 3.8956 3.8957 5.9552 5.9557 6.1668 6.1671 7.1476 7.1480 7.3290 7.3297 k = 0.0000 0.6515 0.4595 ( 7922 PWs) bands (ev): -23.1419 -23.1419 -23.0049 -23.0049 -20.4863 -20.4863 -20.2575 -20.2575 -14.5198 -14.5198 -14.4336 -14.4336 -13.1724 -13.1724 -13.0783 -13.0783 -11.4858 -11.4858 -11.3152 -11.3151 -8.5516 -8.5507 -8.4912 -8.4903 -6.6320 -6.6317 -6.3799 -6.3779 -6.1902 -6.1876 -6.0499 -6.0494 -6.0119 -6.0110 -5.8517 -5.8510 -5.7307 -5.7303 -5.6992 -5.6973 -5.5406 -5.5402 -5.4678 -5.4663 -4.3491 -4.3489 -4.0018 -4.0016 -2.6306 -2.6301 -2.3715 -2.3711 -2.0135 -2.0130 -1.5999 -1.5987 -1.4206 -1.4202 -1.3177 -1.3169 -0.9603 -0.9599 -0.7439 -0.7434 3.5742 3.5743 3.9088 3.9089 5.9621 5.9625 6.1641 6.1644 7.2044 7.2047 7.3880 7.3887 k = 0.0000 0.6740 0.4595 ( 7921 PWs) bands (ev): -23.1410 -23.1410 -23.0045 -23.0045 -20.4857 -20.4857 -20.2575 -20.2575 -14.5134 -14.5134 -14.4308 -14.4308 -13.1709 -13.1709 -13.0780 -13.0780 -11.4864 -11.4864 -11.3160 -11.3159 -8.5519 -8.5511 -8.4919 -8.4911 -6.6329 -6.6327 -6.3904 -6.3885 -6.2020 -6.1994 -6.0594 -6.0590 -6.0143 -6.0135 -5.8561 -5.8553 -5.7418 -5.7415 -5.7077 -5.7059 -5.5384 -5.5380 -5.4671 -5.4658 -4.3492 -4.3490 -4.0026 -4.0024 -2.6390 -2.6385 -2.3775 -2.3772 -2.0095 -2.0091 -1.6034 -1.6023 -1.4203 -1.4199 -1.3149 -1.3141 -0.9585 -0.9583 -0.7465 -0.7460 3.5814 3.5815 3.9211 3.9212 5.9683 5.9687 6.1614 6.1616 7.2577 7.2581 7.4501 7.4508 k = 0.0000 0.6965 0.4595 ( 7905 PWs) bands (ev): -23.1402 -23.1402 -23.0042 -23.0042 -20.4851 -20.4851 -20.2575 -20.2575 -14.5073 -14.5073 -14.4282 -14.4282 -13.1696 -13.1696 -13.0776 -13.0776 -11.4871 -11.4871 -11.3165 -11.3165 -8.5522 -8.5515 -8.4925 -8.4918 -6.6339 -6.6337 -6.4007 -6.3988 -6.2130 -6.2105 -6.0681 -6.0677 -6.0168 -6.0160 -5.8598 -5.8589 -5.7517 -5.7515 -5.7157 -5.7140 -5.5361 -5.5357 -5.4663 -5.4650 -4.3491 -4.3489 -4.0035 -4.0033 -2.6467 -2.6463 -2.3831 -2.3828 -2.0056 -2.0051 -1.6071 -1.6060 -1.4206 -1.4201 -1.3124 -1.3115 -0.9570 -0.9568 -0.7486 -0.7481 3.5878 3.5878 3.9325 3.9325 5.9740 5.9744 6.1586 6.1589 7.3076 7.3079 7.5149 7.5157 k = 0.0000 0.7189 0.4595 ( 7912 PWs) bands (ev): -23.1395 -23.1395 -23.0038 -23.0038 -20.4846 -20.4846 -20.2576 -20.2576 -14.5016 -14.5016 -14.4259 -14.4259 -13.1684 -13.1684 -13.0773 -13.0773 -11.4879 -11.4879 -11.3170 -11.3170 -8.5525 -8.5518 -8.4931 -8.4925 -6.6350 -6.6347 -6.4105 -6.4086 -6.2233 -6.2207 -6.0759 -6.0756 -6.0194 -6.0187 -5.8629 -5.8619 -5.7607 -5.7605 -5.7230 -5.7214 -5.5338 -5.5333 -5.4653 -5.4640 -4.3489 -4.3487 -4.0043 -4.0042 -2.6538 -2.6534 -2.3882 -2.3880 -2.0015 -2.0011 -1.6107 -1.6097 -1.4214 -1.4209 -1.3100 -1.3091 -0.9558 -0.9557 -0.7501 -0.7496 3.5933 3.5934 3.9429 3.9429 5.9791 5.9794 6.1559 6.1561 7.3539 7.3542 7.5821 7.5829 k = 0.0000 0.7414 0.4595 ( 7917 PWs) bands (ev): -23.1388 -23.1388 -23.0036 -23.0036 -20.4841 -20.4841 -20.2576 -20.2576 -14.4964 -14.4964 -14.4240 -14.4240 -13.1674 -13.1674 -13.0769 -13.0769 -11.4888 -11.4888 -11.3172 -11.3172 -8.5526 -8.5521 -8.4937 -8.4932 -6.6361 -6.6358 -6.4195 -6.4177 -6.2327 -6.2302 -6.0829 -6.0826 -6.0221 -6.0214 -5.8652 -5.8642 -5.7686 -5.7684 -5.7296 -5.7282 -5.5315 -5.5310 -5.4641 -5.4629 -4.3485 -4.3483 -4.0053 -4.0051 -2.6602 -2.6599 -2.3929 -2.3927 -1.9974 -1.9970 -1.6144 -1.6134 -1.4230 -1.4224 -1.3078 -1.3068 -0.9549 -0.9548 -0.7511 -0.7505 3.5980 3.5981 3.9522 3.9523 5.9836 5.9839 6.1532 6.1534 7.3970 7.3973 7.6509 7.6517 k = 0.0000 0.7639 0.4595 ( 7922 PWs) bands (ev): -23.1382 -23.1382 -23.0033 -23.0033 -20.4837 -20.4837 -20.2576 -20.2576 -14.4916 -14.4916 -14.4223 -14.4223 -13.1665 -13.1665 -13.0766 -13.0765 -11.4898 -11.4898 -11.3173 -11.3173 -8.5527 -8.5523 -8.4942 -8.4938 -6.6373 -6.6370 -6.4277 -6.4259 -6.2414 -6.2389 -6.0888 -6.0886 -6.0246 -6.0240 -5.8670 -5.8658 -5.7756 -5.7755 -5.7355 -5.7342 -5.5292 -5.5287 -5.4629 -5.4617 -4.3480 -4.3478 -4.0062 -4.0061 -2.6659 -2.6656 -2.3971 -2.3968 -1.9933 -1.9929 -1.6179 -1.6170 -1.4251 -1.4245 -1.3057 -1.3047 -0.9544 -0.9542 -0.7514 -0.7509 3.6020 3.6021 3.9605 3.9606 5.9876 5.9878 6.1506 6.1509 7.4371 7.4373 7.7205 7.7213 k = 0.0000 0.7863 0.4595 ( 7925 PWs) bands (ev): -23.1377 -23.1377 -23.0031 -23.0031 -20.4834 -20.4833 -20.2576 -20.2576 -14.4874 -14.4874 -14.4210 -14.4210 -13.1657 -13.1657 -13.0762 -13.0762 -11.4909 -11.4908 -11.3172 -11.3172 -8.5528 -8.5524 -8.4946 -8.4943 -6.6385 -6.6382 -6.4348 -6.4331 -6.2492 -6.2468 -6.0939 -6.0935 -6.0269 -6.0265 -5.8681 -5.8669 -5.7818 -5.7816 -5.7407 -5.7396 -5.5270 -5.5264 -5.4615 -5.4604 -4.3474 -4.3472 -4.0071 -4.0070 -2.6708 -2.6706 -2.4007 -2.4005 -1.9891 -1.9887 -1.6213 -1.6204 -1.4279 -1.4273 -1.3037 -1.3027 -0.9542 -0.9539 -0.7511 -0.7506 3.6052 3.6053 3.9678 3.9678 5.9910 5.9912 6.1481 6.1484 7.4742 7.4745 7.7898 7.7906 k = 0.0000 0.8088 0.4595 ( 7927 PWs) bands (ev): -23.1373 -23.1373 -23.0029 -23.0029 -20.4830 -20.4830 -20.2576 -20.2576 -14.4837 -14.4837 -14.4199 -14.4199 -13.1651 -13.1651 -13.0758 -13.0758 -11.4920 -11.4920 -11.3169 -11.3169 -8.5527 -8.5525 -8.4950 -8.4948 -6.6398 -6.6394 -6.4407 -6.4391 -6.2561 -6.2538 -6.0980 -6.0976 -6.0290 -6.0286 -5.8686 -5.8673 -5.7872 -5.7870 -5.7452 -5.7441 -5.5249 -5.5242 -5.4601 -5.4590 -4.3467 -4.3465 -4.0081 -4.0080 -2.6750 -2.6748 -2.4037 -2.4036 -1.9849 -1.9844 -1.6245 -1.6236 -1.4314 -1.4307 -1.3020 -1.3009 -0.9543 -0.9539 -0.7502 -0.7497 3.6077 3.6078 3.9739 3.9740 5.9939 5.9941 6.1459 6.1462 7.5085 7.5087 7.8539 7.8547 k = 0.0000 0.8313 0.4595 ( 7935 PWs) bands (ev): -23.1369 -23.1369 -23.0028 -23.0028 -20.4828 -20.4828 -20.2576 -20.2576 -14.4807 -14.4807 -14.4192 -14.4192 -13.1647 -13.1647 -13.0755 -13.0755 -11.4932 -11.4931 -11.3164 -11.3164 -8.5526 -8.5525 -8.4953 -8.4953 -6.6410 -6.6406 -6.4454 -6.4438 -6.2622 -6.2599 -6.1012 -6.1006 -6.0307 -6.0304 -5.8685 -5.8672 -5.7918 -5.7917 -5.7489 -5.7480 -5.5228 -5.5221 -5.4586 -5.4576 -4.3459 -4.3457 -4.0091 -4.0090 -2.6785 -2.6783 -2.4063 -2.4061 -1.9806 -1.9801 -1.6275 -1.6266 -1.4354 -1.4347 -1.3004 -1.2993 -0.9547 -0.9542 -0.7487 -0.7482 3.6095 3.6095 3.9789 3.9790 5.9963 5.9965 6.1438 6.1441 7.5398 7.5400 7.8412 7.8416 k = 0.0000 0.8537 0.4595 ( 7932 PWs) bands (ev): -23.1366 -23.1366 -23.0027 -23.0027 -20.4826 -20.4826 -20.2577 -20.2577 -14.4783 -14.4783 -14.4188 -14.4188 -13.1644 -13.1644 -13.0752 -13.0751 -11.4944 -11.4943 -11.3158 -11.3158 -8.5525 -8.5524 -8.4956 -8.4956 -6.6422 -6.6418 -6.4487 -6.4472 -6.2675 -6.2651 -6.1034 -6.1028 -6.0320 -6.0317 -5.8678 -5.8664 -5.7958 -5.7956 -5.7519 -5.7512 -5.5208 -5.5200 -5.4571 -5.4561 -4.3449 -4.3448 -4.0100 -4.0100 -2.6811 -2.6810 -2.4082 -2.4080 -1.9763 -1.9758 -1.6301 -1.6293 -1.4401 -1.4393 -1.2989 -1.2978 -0.9554 -0.9548 -0.7466 -0.7462 3.6106 3.6107 3.9828 3.9829 5.9981 5.9984 6.1420 6.1423 7.5677 7.5680 7.8079 7.8084 k = 0.0000 0.8537 0.4595 ( 7932 PWs) bands (ev): -23.1366 -23.1366 -23.0027 -23.0027 -20.4826 -20.4826 -20.2577 -20.2577 -14.4783 -14.4783 -14.4188 -14.4188 -13.1644 -13.1644 -13.0752 -13.0751 -11.4944 -11.4943 -11.3158 -11.3158 -8.5525 -8.5524 -8.4956 -8.4956 -6.6422 -6.6418 -6.4487 -6.4472 -6.2675 -6.2651 -6.1034 -6.1028 -6.0320 -6.0317 -5.8678 -5.8664 -5.7958 -5.7956 -5.7519 -5.7512 -5.5208 -5.5200 -5.4571 -5.4561 -4.3449 -4.3448 -4.0100 -4.0100 -2.6811 -2.6810 -2.4082 -2.4080 -1.9763 -1.9758 -1.6301 -1.6293 -1.4401 -1.4393 -1.2989 -1.2978 -0.9554 -0.9548 -0.7466 -0.7462 3.6106 3.6107 3.9828 3.9829 5.9981 5.9984 6.1420 6.1423 7.5677 7.5680 7.8079 7.8084 k = 0.0000 0.8605 0.4383 ( 7936 PWs) bands (ev): -23.1366 -23.1366 -23.0026 -23.0026 -20.4826 -20.4826 -20.2577 -20.2577 -14.4782 -14.4782 -14.4181 -14.4181 -13.1661 -13.1661 -13.0734 -13.0734 -11.4929 -11.4929 -11.3175 -11.3175 -8.5530 -8.5530 -8.4949 -8.4949 -6.6432 -6.6428 -6.4480 -6.4465 -6.2698 -6.2676 -6.1089 -6.1083 -6.0330 -6.0328 -5.8602 -5.8589 -5.8009 -5.8006 -5.7582 -5.7574 -5.5122 -5.5115 -5.4548 -5.4538 -4.3432 -4.3430 -4.0096 -4.0095 -2.6817 -2.6817 -2.4114 -2.4113 -1.9798 -1.9793 -1.6384 -1.6377 -1.4342 -1.4336 -1.2925 -1.2914 -0.9544 -0.9538 -0.7495 -0.7490 3.6056 3.6057 3.9872 3.9873 5.9975 5.9978 6.1459 6.1462 7.5892 7.5895 7.8065 7.8070 k = 0.0000 0.8673 0.4171 ( 7930 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4781 -14.4781 -14.4175 -14.4175 -13.1676 -13.1676 -13.0719 -13.0719 -11.4916 -11.4916 -11.3191 -11.3190 -8.5535 -8.5535 -8.4942 -8.4942 -6.6442 -6.6439 -6.4470 -6.4457 -6.2722 -6.2702 -6.1137 -6.1132 -6.0338 -6.0337 -5.8529 -5.8515 -5.8055 -5.8051 -5.7644 -5.7637 -5.5040 -5.5032 -5.4533 -5.4523 -4.3416 -4.3414 -4.0092 -4.0091 -2.6823 -2.6823 -2.4144 -2.4142 -1.9828 -1.9824 -1.6459 -1.6452 -1.4291 -1.4285 -1.2867 -1.2858 -0.9535 -0.9529 -0.7520 -0.7516 3.6011 3.6012 3.9912 3.9913 5.9970 5.9972 6.1495 6.1497 7.6089 7.6091 7.8045 7.8049 k = 0.0000 0.8741 0.3959 ( 7938 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4780 -14.4780 -14.4170 -14.4170 -13.1689 -13.1689 -13.0706 -13.0706 -11.4905 -11.4905 -11.3205 -11.3204 -8.5540 -8.5539 -8.4937 -8.4936 -6.6451 -6.6448 -6.4459 -6.4448 -6.2744 -6.2726 -6.1177 -6.1173 -6.0346 -6.0344 -5.8457 -5.8444 -5.8095 -5.8089 -5.7706 -5.7700 -5.4961 -5.4954 -5.4525 -5.4516 -4.3401 -4.3400 -4.0088 -4.0088 -2.6828 -2.6828 -2.4170 -2.4169 -1.9854 -1.9850 -1.6523 -1.6518 -1.4246 -1.4241 -1.2818 -1.2810 -0.9527 -0.9522 -0.7542 -0.7539 3.5972 3.5972 3.9946 3.9946 5.9966 5.9968 6.1526 6.1528 7.6265 7.6267 7.8020 7.8023 k = 0.0000 0.8808 0.3746 ( 7939 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4779 -14.4779 -14.4166 -14.4166 -13.1700 -13.1700 -13.0695 -13.0695 -11.4895 -11.4895 -11.3216 -11.3216 -8.5543 -8.5543 -8.4932 -8.4931 -6.6460 -6.6457 -6.4448 -6.4438 -6.2763 -6.2749 -6.1211 -6.1207 -6.0351 -6.0350 -5.8389 -5.8375 -5.8129 -5.8121 -5.7767 -5.7761 -5.4889 -5.4881 -5.4525 -5.4516 -4.3389 -4.3388 -4.0085 -4.0085 -2.6832 -2.6832 -2.4192 -2.4191 -1.9875 -1.9873 -1.6576 -1.6572 -1.4209 -1.4205 -1.2777 -1.2771 -0.9519 -0.9515 -0.7561 -0.7558 3.5939 3.5939 3.9973 3.9974 5.9963 5.9964 6.1553 6.1554 7.6417 7.6419 7.7991 7.7993 k = 0.0000 0.8876 0.3534 ( 7933 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4779 -14.4779 -14.4163 -14.4162 -13.1708 -13.1708 -13.0687 -13.0687 -11.4887 -11.4887 -11.3226 -11.3225 -8.5546 -8.5546 -8.4928 -8.4928 -6.6467 -6.6465 -6.4437 -6.4430 -6.2780 -6.2768 -6.1236 -6.1233 -6.0356 -6.0355 -5.8325 -5.8310 -5.8156 -5.8146 -5.7826 -5.7821 -5.4823 -5.4816 -5.4533 -5.4525 -4.3379 -4.3378 -4.0082 -4.0082 -2.6836 -2.6835 -2.4210 -2.4209 -1.9892 -1.9890 -1.6619 -1.6615 -1.4180 -1.4177 -1.2745 -1.2740 -0.9513 -0.9510 -0.7576 -0.7574 3.5913 3.5913 3.9995 3.9996 5.9960 5.9961 6.1574 6.1575 7.6543 7.6545 7.7963 7.7964 k = 0.0000 0.8944 0.3322 ( 7930 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4779 -14.4778 -14.4160 -14.4160 -13.1714 -13.1714 -13.0681 -13.0681 -11.4881 -11.4881 -11.3232 -11.3232 -8.5548 -8.5548 -8.4925 -8.4925 -6.6472 -6.6470 -6.4428 -6.4423 -6.2792 -6.2784 -6.1254 -6.1252 -6.0359 -6.0359 -5.8269 -5.8251 -5.8175 -5.8162 -5.7880 -5.7876 -5.4767 -5.4760 -5.4546 -5.4539 -4.3371 -4.3371 -4.0081 -4.0080 -2.6838 -2.6838 -2.4223 -2.4222 -1.9904 -1.9902 -1.6649 -1.6647 -1.4158 -1.4156 -1.2721 -1.2718 -0.9509 -0.9506 -0.7587 -0.7585 3.5894 3.5894 4.0011 4.0012 5.9959 5.9959 6.1589 6.1590 7.6638 7.6639 7.7939 7.7940 k = 0.0000 0.9011 0.3110 ( 7932 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4824 -20.4824 -20.2577 -20.2577 -14.4778 -14.4778 -14.4159 -14.4159 -13.1718 -13.1718 -13.0677 -13.0677 -11.4878 -11.4878 -11.3237 -11.3236 -8.5549 -8.5549 -8.4923 -8.4923 -6.6475 -6.6474 -6.4422 -6.4419 -6.2798 -6.2794 -6.1265 -6.1264 -6.0361 -6.0361 -5.8229 -5.8211 -5.8182 -5.8167 -5.7922 -5.7919 -5.4724 -5.4720 -5.4561 -5.4556 -4.3366 -4.3366 -4.0080 -4.0079 -2.6839 -2.6839 -2.4231 -2.4230 -1.9911 -1.9910 -1.6667 -1.6666 -1.4145 -1.4144 -1.2707 -1.2705 -0.9506 -0.9505 -0.7593 -0.7592 3.5882 3.5882 4.0021 4.0021 5.9958 5.9958 6.1599 6.1599 7.6697 7.6698 7.7924 7.7924 k = 0.0000 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4824 -20.4824 -20.2577 -20.2577 -14.4778 -14.4778 -14.4158 -14.4158 -13.1719 -13.1719 -13.0676 -13.0676 -11.4877 -11.4877 -11.3238 -11.3238 -8.5549 -8.5549 -8.4923 -8.4923 -6.6475 -6.6475 -6.4419 -6.4419 -6.2799 -6.2799 -6.1268 -6.1268 -6.0361 -6.0361 -5.8211 -5.8211 -5.8170 -5.8170 -5.7938 -5.7938 -5.4706 -5.4706 -5.4566 -5.4566 -4.3365 -4.3365 -4.0079 -4.0079 -2.6840 -2.6840 -2.4233 -2.4233 -1.9913 -1.9913 -1.6673 -1.6673 -1.4140 -1.4140 -1.2701 -1.2701 -0.9504 -0.9504 -0.7595 -0.7595 3.5879 3.5879 4.0024 4.0024 5.9957 5.9957 6.1602 6.1602 7.6717 7.6717 7.7918 7.7918 k = 0.0000 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.1364 -23.1364 -23.0026 -23.0026 -20.4824 -20.4824 -20.2577 -20.2577 -14.4778 -14.4778 -14.4158 -14.4158 -13.1719 -13.1719 -13.0676 -13.0676 -11.4877 -11.4877 -11.3238 -11.3238 -8.5549 -8.5549 -8.4923 -8.4923 -6.6475 -6.6475 -6.4419 -6.4419 -6.2799 -6.2799 -6.1268 -6.1268 -6.0361 -6.0361 -5.8211 -5.8211 -5.8170 -5.8170 -5.7938 -5.7938 -5.4706 -5.4706 -5.4566 -5.4566 -4.3365 -4.3365 -4.0079 -4.0079 -2.6840 -2.6840 -2.4233 -2.4233 -1.9913 -1.9913 -1.6673 -1.6673 -1.4140 -1.4140 -1.2701 -1.2701 -0.9504 -0.9504 -0.7595 -0.7595 3.5879 3.5879 4.0024 4.0024 5.9957 5.9957 6.1602 6.1602 7.6717 7.6717 7.7918 7.7918 k = 0.0217 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.1362 -23.1362 -23.0027 -23.0027 -20.4822 -20.4822 -20.2579 -20.2579 -14.4778 -14.4778 -14.4159 -14.4159 -13.1717 -13.1717 -13.0676 -13.0676 -11.4876 -11.4876 -11.3240 -11.3240 -8.5548 -8.5548 -8.4923 -8.4923 -6.6471 -6.6471 -6.4414 -6.4413 -6.2803 -6.2802 -6.1271 -6.1271 -6.0366 -6.0366 -5.8246 -5.8238 -5.8168 -5.8168 -5.7918 -5.7910 -5.4705 -5.4705 -5.4564 -5.4564 -4.3361 -4.3361 -4.0084 -4.0084 -2.6835 -2.6835 -2.4233 -2.4232 -1.9907 -1.9906 -1.6669 -1.6668 -1.4145 -1.4144 -1.2705 -1.2705 -0.9505 -0.9505 -0.7600 -0.7599 3.5883 3.5883 4.0019 4.0019 5.9954 5.9954 6.1597 6.1597 7.6708 7.6709 7.7926 7.7926 k = 0.0435 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.1358 -23.1358 -23.0032 -23.0032 -20.4814 -20.4814 -20.2587 -20.2587 -14.4776 -14.4776 -14.4162 -14.4162 -13.1711 -13.1711 -13.0678 -13.0678 -11.4872 -11.4872 -11.3248 -11.3248 -8.5546 -8.5546 -8.4925 -8.4925 -6.6458 -6.6456 -6.4397 -6.4397 -6.2813 -6.2812 -6.1280 -6.1279 -6.0379 -6.0379 -5.8324 -5.8312 -5.8161 -5.8161 -5.7868 -5.7856 -5.4702 -5.4701 -5.4559 -5.4558 -4.3351 -4.3351 -4.0097 -4.0097 -2.6819 -2.6819 -2.4231 -2.4230 -1.9887 -1.9886 -1.6657 -1.6656 -1.4156 -1.4154 -1.2719 -1.2719 -0.9508 -0.9508 -0.7613 -0.7612 3.5898 3.5898 4.0005 4.0005 5.9945 5.9946 6.1582 6.1582 7.6683 7.6686 7.7948 7.7948 k = 0.0652 0.9079 0.2898 ( 7938 PWs) bands (ev): -23.1351 -23.1351 -23.0041 -23.0041 -20.4800 -20.4800 -20.2600 -20.2600 -14.4774 -14.4774 -14.4167 -14.4167 -13.1701 -13.1701 -13.0680 -13.0680 -11.4865 -11.4865 -11.3260 -11.3260 -8.5542 -8.5541 -8.4927 -8.4927 -6.6435 -6.6433 -6.4370 -6.4369 -6.2829 -6.2828 -6.1295 -6.1294 -6.0400 -6.0399 -5.8421 -5.8408 -5.8149 -5.8149 -5.7811 -5.7799 -5.4698 -5.4696 -5.4550 -5.4549 -4.3334 -4.3334 -4.0120 -4.0120 -2.6794 -2.6794 -2.4228 -2.4227 -1.9853 -1.9852 -1.6637 -1.6635 -1.4175 -1.4171 -1.2741 -1.2740 -0.9512 -0.9512 -0.7634 -0.7633 3.5923 3.5923 3.9981 3.9982 5.9931 5.9931 6.1557 6.1558 7.6646 7.6649 7.7983 7.7984 k = 0.0870 0.9079 0.2898 ( 7948 PWs) bands (ev): -23.1340 -23.1340 -23.0052 -23.0052 -20.4782 -20.4782 -20.2617 -20.2617 -14.4771 -14.4771 -14.4174 -14.4174 -13.1687 -13.1687 -13.0684 -13.0684 -11.4857 -11.4856 -11.3278 -11.3278 -8.5535 -8.5535 -8.4930 -8.4930 -6.6404 -6.6401 -6.4333 -6.4331 -6.2853 -6.2852 -6.1314 -6.1313 -6.0428 -6.0427 -5.8530 -5.8517 -5.8133 -5.8132 -5.7758 -5.7745 -5.4691 -5.4688 -5.4538 -5.4537 -4.3310 -4.3309 -4.0151 -4.0151 -2.6759 -2.6758 -2.4225 -2.4223 -1.9806 -1.9804 -1.6608 -1.6606 -1.4201 -1.4197 -1.2771 -1.2771 -0.9518 -0.9518 -0.7664 -0.7663 3.5957 3.5957 3.9948 3.9949 5.9911 5.9912 6.1523 6.1523 7.6600 7.6604 7.8029 7.8030 k = 0.1087 0.9079 0.2898 ( 7946 PWs) bands (ev): -23.1327 -23.1327 -23.0067 -23.0067 -20.4758 -20.4758 -20.2640 -20.2640 -14.4767 -14.4767 -14.4182 -14.4182 -13.1670 -13.1670 -13.0689 -13.0689 -11.4845 -11.4845 -11.3299 -11.3299 -8.5528 -8.5527 -8.4934 -8.4934 -6.6364 -6.6361 -6.4285 -6.4283 -6.2884 -6.2883 -6.1339 -6.1338 -6.0462 -6.0461 -5.8647 -5.8633 -5.8113 -5.8112 -5.7712 -5.7699 -5.4682 -5.4679 -5.4523 -5.4522 -4.3279 -4.3279 -4.0191 -4.0191 -2.6714 -2.6713 -2.4222 -2.4220 -1.9745 -1.9742 -1.6572 -1.6569 -1.4236 -1.4230 -1.2810 -1.2810 -0.9524 -0.9524 -0.7701 -0.7700 3.6000 3.6000 3.9906 3.9907 5.9888 5.9889 6.1480 6.1480 7.6551 7.6555 7.8083 7.8084 k = 0.1304 0.9079 0.2898 ( 7944 PWs) bands (ev): -23.1312 -23.1312 -23.0085 -23.0085 -20.4729 -20.4729 -20.2668 -20.2667 -14.4762 -14.4762 -14.4192 -14.4192 -13.1649 -13.1649 -13.0695 -13.0695 -11.4831 -11.4831 -11.3326 -11.3326 -8.5518 -8.5518 -8.4939 -8.4939 -6.6315 -6.6311 -6.4227 -6.4225 -6.2923 -6.2921 -6.1369 -6.1367 -6.0501 -6.0500 -5.8768 -5.8754 -5.8091 -5.8089 -5.7672 -5.7660 -5.4672 -5.4668 -5.4507 -5.4505 -4.3242 -4.3241 -4.0239 -4.0239 -2.6660 -2.6659 -2.4220 -2.4218 -1.9669 -1.9666 -1.6528 -1.6525 -1.4278 -1.4270 -1.2858 -1.2858 -0.9530 -0.9530 -0.7747 -0.7745 3.6053 3.6053 3.9855 3.9856 5.9862 5.9862 6.1428 6.1428 7.6502 7.6507 7.8140 7.8141 k = 0.1522 0.9079 0.2898 ( 7942 PWs) bands (ev): -23.1293 -23.1293 -23.0106 -23.0106 -20.4695 -20.4695 -20.2700 -20.2700 -14.4756 -14.4756 -14.4204 -14.4204 -13.1625 -13.1625 -13.0702 -13.0702 -11.4814 -11.4814 -11.3356 -11.3356 -8.5507 -8.5507 -8.4945 -8.4945 -6.6259 -6.6254 -6.4160 -6.4158 -6.2970 -6.2967 -6.1402 -6.1401 -6.0542 -6.0541 -5.8892 -5.8878 -5.8066 -5.8065 -5.7641 -5.7629 -5.4659 -5.4655 -5.4490 -5.4487 -4.3198 -4.3197 -4.0295 -4.0295 -2.6598 -2.6597 -2.4221 -2.4218 -1.9579 -1.9575 -1.6477 -1.6472 -1.4328 -1.4319 -1.2913 -1.2913 -0.9537 -0.9537 -0.7799 -0.7797 3.6114 3.6115 3.9795 3.9797 5.9833 5.9834 6.1367 6.1368 7.6457 7.6462 7.8197 7.8198 k = 0.1739 0.9079 0.2898 ( 7942 PWs) bands (ev): -23.1272 -23.1272 -23.0130 -23.0130 -20.4656 -20.4656 -20.2737 -20.2736 -14.4749 -14.4749 -14.4218 -14.4218 -13.1597 -13.1597 -13.0710 -13.0710 -11.4795 -11.4795 -11.3391 -11.3391 -8.5494 -8.5494 -8.4952 -8.4952 -6.6194 -6.6189 -6.4084 -6.4082 -6.3025 -6.3022 -6.1440 -6.1438 -6.0585 -6.0584 -5.9018 -5.9005 -5.8041 -5.8039 -5.7617 -5.7605 -5.4646 -5.4641 -5.4471 -5.4469 -4.3148 -4.3147 -4.0358 -4.0358 -2.6527 -2.6526 -2.4226 -2.4222 -1.9474 -1.9470 -1.6418 -1.6413 -1.4387 -1.4377 -1.2977 -1.2977 -0.9542 -0.9542 -0.7858 -0.7856 3.6185 3.6185 3.9726 3.9728 5.9804 5.9805 6.1300 6.1300 7.6419 7.6425 7.8249 7.8250 k = 0.1957 0.9079 0.2898 ( 7952 PWs) bands (ev): -23.1249 -23.1248 -23.0156 -23.0156 -20.4613 -20.4613 -20.2778 -20.2778 -14.4741 -14.4741 -14.4233 -14.4233 -13.1567 -13.1567 -13.0720 -13.0720 -11.4773 -11.4773 -11.3430 -11.3430 -8.5480 -8.5480 -8.4960 -8.4960 -6.6122 -6.6117 -6.4000 -6.3998 -6.3088 -6.3085 -6.1481 -6.1479 -6.0628 -6.0627 -5.9145 -5.9132 -5.8016 -5.8013 -5.7601 -5.7590 -5.4631 -5.4626 -5.4454 -5.4451 -4.3091 -4.3090 -4.0428 -4.0427 -2.6450 -2.6448 -2.4234 -2.4231 -1.9355 -1.9351 -1.6353 -1.6347 -1.4455 -1.4443 -1.3049 -1.3049 -0.9546 -0.9546 -0.7924 -0.7922 3.6264 3.6264 3.9650 3.9652 5.9776 5.9777 6.1225 6.1225 7.6391 7.6396 7.8293 7.8294 k = 0.2174 0.9079 0.2898 ( 7946 PWs) bands (ev): -23.1222 -23.1222 -23.0185 -23.0185 -20.4566 -20.4566 -20.2823 -20.2823 -14.4732 -14.4732 -14.4249 -14.4249 -13.1535 -13.1535 -13.0731 -13.0731 -11.4748 -11.4748 -11.3472 -11.3472 -8.5464 -8.5464 -8.4969 -8.4969 -6.6044 -6.6038 -6.3909 -6.3906 -6.3160 -6.3156 -6.1526 -6.1524 -6.0669 -6.0668 -5.9271 -5.9258 -5.7990 -5.7988 -5.7592 -5.7581 -5.4615 -5.4609 -5.4436 -5.4433 -4.3029 -4.3028 -4.0504 -4.0503 -2.6365 -2.6364 -2.4248 -2.4244 -1.9222 -1.9217 -1.6282 -1.6275 -1.4531 -1.4518 -1.3128 -1.3128 -0.9547 -0.9547 -0.7995 -0.7993 3.6350 3.6351 3.9566 3.9568 5.9749 5.9750 6.1144 6.1145 7.6374 7.6379 7.8325 7.8326 k = 0.2391 0.9079 0.2898 ( 7942 PWs) bands (ev): -23.1194 -23.1194 -23.0217 -23.0217 -20.4514 -20.4514 -20.2873 -20.2873 -14.4722 -14.4722 -14.4266 -14.4266 -13.1500 -13.1500 -13.0744 -13.0744 -11.4720 -11.4720 -11.3518 -11.3518 -8.5447 -8.5446 -8.4979 -8.4979 -6.5958 -6.5952 -6.3811 -6.3809 -6.3239 -6.3235 -6.1575 -6.1573 -6.0708 -6.0706 -5.9395 -5.9384 -5.7966 -5.7963 -5.7588 -5.7578 -5.4597 -5.4592 -5.4420 -5.4417 -4.2960 -4.2960 -4.0585 -4.0585 -2.6275 -2.6273 -2.4268 -2.4264 -1.9076 -1.9070 -1.6206 -1.6198 -1.4616 -1.4601 -1.3215 -1.3214 -0.9545 -0.9545 -0.8071 -0.8068 3.6445 3.6445 3.9474 3.9477 5.9726 5.9726 6.1059 6.1059 7.6369 7.6375 7.8343 7.8344 k = 0.2609 0.9079 0.2898 ( 7944 PWs) bands (ev): -23.1163 -23.1163 -23.0251 -23.0251 -20.4459 -20.4459 -20.2926 -20.2926 -14.4711 -14.4711 -14.4285 -14.4285 -13.1464 -13.1464 -13.0759 -13.0758 -11.4690 -11.4690 -11.3566 -11.3566 -8.5429 -8.5428 -8.4990 -8.4990 -6.5867 -6.5860 -6.3708 -6.3706 -6.3326 -6.3322 -6.1628 -6.1625 -6.0741 -6.0740 -5.9518 -5.9507 -5.7942 -5.7940 -5.7590 -5.7580 -5.4580 -5.4574 -5.4406 -5.4402 -4.2887 -4.2886 -4.0672 -4.0672 -2.6180 -2.6178 -2.4295 -2.4290 -1.8916 -1.8910 -1.6127 -1.6117 -1.4709 -1.4692 -1.3308 -1.3308 -0.9539 -0.9539 -0.8151 -0.8148 3.6546 3.6547 3.9376 3.9378 5.9706 5.9707 6.0968 6.0969 7.6378 7.6383 7.8344 7.8344 k = 0.2826 0.9079 0.2898 ( 7942 PWs) bands (ev): -23.1130 -23.1130 -23.0287 -23.0287 -20.4400 -20.4400 -20.2983 -20.2983 -14.4699 -14.4699 -14.4305 -14.4305 -13.1426 -13.1426 -13.0775 -13.0775 -11.4657 -11.4657 -11.3617 -11.3617 -8.5409 -8.5408 -8.5002 -8.5002 -6.5770 -6.5763 -6.3601 -6.3598 -6.3420 -6.3416 -6.1685 -6.1682 -6.0769 -6.0768 -5.9637 -5.9627 -5.7920 -5.7918 -5.7596 -5.7587 -5.4561 -5.4555 -5.4394 -5.4390 -4.2808 -4.2807 -4.0764 -4.0764 -2.6081 -2.6078 -2.4328 -2.4323 -1.8745 -1.8739 -1.6046 -1.6034 -1.4809 -1.4789 -1.3408 -1.3407 -0.9528 -0.9528 -0.8234 -0.8232 3.6654 3.6655 3.9270 3.9273 5.9692 5.9693 6.0875 6.0875 7.6400 7.6405 7.8326 7.8327 k = 0.3043 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.1095 -23.1095 -23.0325 -23.0325 -20.4338 -20.4338 -20.3043 -20.3043 -14.4685 -14.4685 -14.4325 -14.4325 -13.1387 -13.1386 -13.0792 -13.0792 -11.4621 -11.4621 -11.3670 -11.3670 -8.5389 -8.5388 -8.5016 -8.5015 -6.5668 -6.5661 -6.3525 -6.3520 -6.3486 -6.3484 -6.1745 -6.1743 -6.0791 -6.0789 -5.9752 -5.9743 -5.7898 -5.7897 -5.7606 -5.7598 -5.4543 -5.4536 -5.4384 -5.4379 -4.2725 -4.2724 -4.0860 -4.0859 -2.5978 -2.5975 -2.4368 -2.4363 -1.8563 -1.8556 -1.5968 -1.5954 -1.4911 -1.4888 -1.3514 -1.3513 -0.9512 -0.9512 -0.8321 -0.8318 3.6768 3.6769 3.9159 3.9162 5.9685 5.9686 6.0779 6.0779 7.6436 7.6441 7.8289 7.8289 k = 0.3261 0.9079 0.2898 ( 7922 PWs) bands (ev): -23.1058 -23.1058 -23.0364 -23.0364 -20.4273 -20.4273 -20.3106 -20.3106 -14.4671 -14.4671 -14.4346 -14.4346 -13.1347 -13.1346 -13.0812 -13.0812 -11.4583 -11.4583 -11.3726 -11.3726 -8.5367 -8.5366 -8.5030 -8.5029 -6.5562 -6.5554 -6.3629 -6.3623 -6.3376 -6.3373 -6.1811 -6.1808 -6.0804 -6.0802 -5.9864 -5.9856 -5.7879 -5.7877 -5.7619 -5.7611 -5.4524 -5.4517 -5.4376 -5.4371 -4.2637 -4.2636 -4.0959 -4.0959 -2.5872 -2.5869 -2.4416 -2.4410 -1.8371 -1.8365 -1.5900 -1.5882 -1.5010 -1.4983 -1.3625 -1.3624 -0.9491 -0.9491 -0.8409 -0.8407 3.6888 3.6889 3.9042 3.9045 5.9684 5.9685 6.0682 6.0682 7.6486 7.6491 7.8232 7.8233 k = 0.3478 0.9079 0.2898 ( 7918 PWs) bands (ev): -23.1020 -23.1020 -23.0405 -23.0405 -20.4205 -20.4205 -20.3172 -20.3172 -14.4656 -14.4656 -14.4368 -14.4368 -13.1306 -13.1306 -13.0833 -13.0833 -11.4542 -11.4542 -11.3782 -11.3782 -8.5345 -8.5344 -8.5046 -8.5045 -6.5451 -6.5443 -6.3740 -6.3734 -6.3261 -6.3258 -6.1881 -6.1878 -6.0809 -6.0807 -5.9971 -5.9964 -5.7860 -5.7859 -5.7633 -5.7627 -5.4506 -5.4499 -5.4370 -5.4365 -4.2545 -4.2544 -4.1062 -4.1061 -2.5765 -2.5761 -2.4471 -2.4465 -1.8172 -1.8165 -1.5853 -1.5833 -1.5093 -1.5063 -1.3742 -1.3739 -0.9463 -0.9463 -0.8499 -0.8496 3.7013 3.7014 3.8920 3.8923 5.9691 5.9692 6.0584 6.0584 7.6550 7.6555 7.8157 7.8157 k = 0.3696 0.9079 0.2898 ( 7932 PWs) bands (ev): -23.0980 -23.0980 -23.0448 -23.0448 -20.4135 -20.4135 -20.3240 -20.3240 -14.4640 -14.4640 -14.4390 -14.4390 -13.1266 -13.1266 -13.0857 -13.0857 -11.4498 -11.4498 -11.3840 -11.3840 -8.5322 -8.5321 -8.5062 -8.5062 -6.5336 -6.5328 -6.3856 -6.3850 -6.3146 -6.3144 -6.1955 -6.1953 -6.0804 -6.0803 -6.0074 -6.0067 -5.7843 -5.7842 -5.7650 -5.7644 -5.4488 -5.4480 -5.4368 -5.4362 -4.2449 -4.2449 -4.1167 -4.1166 -2.5657 -2.5653 -2.4532 -2.4526 -1.7966 -1.7960 -1.5849 -1.5828 -1.5137 -1.5107 -1.3862 -1.3859 -0.9429 -0.9429 -0.8589 -0.8586 3.7141 3.7143 3.8794 3.8796 5.9706 5.9707 6.0487 6.0487 7.6627 7.6632 7.8064 7.8065 k = 0.3913 0.9079 0.2898 ( 7930 PWs) bands (ev): -23.0939 -23.0939 -23.0491 -23.0491 -20.4063 -20.4063 -20.3311 -20.3311 -14.4622 -14.4622 -14.4412 -14.4412 -13.1225 -13.1225 -13.0882 -13.0882 -11.4452 -11.4452 -11.3899 -11.3899 -8.5299 -8.5298 -8.5080 -8.5079 -6.5219 -6.5211 -6.3975 -6.3969 -6.3032 -6.3029 -6.2034 -6.2032 -6.0790 -6.0789 -6.0171 -6.0166 -5.7826 -5.7826 -5.7667 -5.7661 -5.4470 -5.4463 -5.4367 -5.4361 -4.2350 -4.2350 -4.1274 -4.1273 -2.5548 -2.5544 -2.4600 -2.4594 -1.7756 -1.7750 -1.5901 -1.5883 -1.5127 -1.5100 -1.3986 -1.3983 -0.9388 -0.9388 -0.8678 -0.8676 3.7274 3.7276 3.8663 3.8666 5.9730 5.9731 6.0392 6.0392 7.6717 7.6721 7.7958 7.7958 k = 0.4130 0.9079 0.2898 ( 7926 PWs) bands (ev): -23.0896 -23.0896 -23.0536 -23.0536 -20.3989 -20.3989 -20.3383 -20.3383 -14.4604 -14.4604 -14.4435 -14.4435 -13.1186 -13.1185 -13.0909 -13.0909 -11.4404 -11.4403 -11.3958 -11.3958 -8.5275 -8.5275 -8.5099 -8.5098 -6.5098 -6.5090 -6.4097 -6.4090 -6.2919 -6.2916 -6.2118 -6.2115 -6.0766 -6.0765 -6.0264 -6.0260 -5.7811 -5.7810 -5.7684 -5.7679 -5.4453 -5.4446 -5.4369 -5.4363 -4.2248 -4.2248 -4.1382 -4.1382 -2.5440 -2.5436 -2.4675 -2.4669 -1.7543 -1.7537 -1.6006 -1.5994 -1.5068 -1.5047 -1.4113 -1.4109 -0.9341 -0.9340 -0.8766 -0.8764 3.7410 3.7412 3.8529 3.8532 5.9762 5.9763 6.0299 6.0299 7.6818 7.6822 7.7839 7.7840 k = 0.4348 0.9079 0.2898 ( 7922 PWs) bands (ev): -23.0853 -23.0852 -23.0581 -23.0581 -20.3914 -20.3914 -20.3457 -20.3457 -14.4585 -14.4585 -14.4457 -14.4457 -13.1146 -13.1146 -13.0938 -13.0938 -11.4353 -11.4353 -11.4017 -11.4017 -8.5252 -8.5251 -8.5119 -8.5118 -6.4976 -6.4968 -6.4221 -6.4214 -6.2808 -6.2805 -6.2205 -6.2203 -6.0732 -6.0731 -6.0351 -6.0348 -5.7795 -5.7795 -5.7701 -5.7697 -5.4437 -5.4430 -5.4373 -5.4367 -4.2144 -4.2144 -4.1491 -4.1491 -2.5333 -2.5328 -2.4755 -2.4749 -1.7328 -1.7324 -1.6149 -1.6142 -1.4978 -1.4961 -1.4241 -1.4236 -0.9287 -0.9287 -0.8852 -0.8850 3.7548 3.7550 3.8392 3.8395 5.9803 5.9804 6.0210 6.0211 7.6929 7.6933 7.7712 7.7713 k = 0.4565 0.9079 0.2898 ( 7924 PWs) bands (ev): -23.0808 -23.0808 -23.0626 -23.0626 -20.3838 -20.3838 -20.3533 -20.3533 -14.4565 -14.4565 -14.4480 -14.4480 -13.1108 -13.1108 -13.0969 -13.0969 -11.4300 -11.4300 -11.4075 -11.4075 -8.5229 -8.5228 -8.5139 -8.5139 -6.4851 -6.4843 -6.4347 -6.4339 -6.2699 -6.2696 -6.2297 -6.2294 -6.0688 -6.0688 -6.0433 -6.0430 -5.7780 -5.7780 -5.7718 -5.7715 -5.4423 -5.4416 -5.4379 -5.4373 -4.2038 -4.2038 -4.1601 -4.1601 -2.5228 -2.5223 -2.4841 -2.4835 -1.7115 -1.7111 -1.6317 -1.6314 -1.4870 -1.4857 -1.4371 -1.4365 -0.9228 -0.9227 -0.8936 -0.8934 3.7688 3.7691 3.8253 3.8256 5.9853 5.9854 6.0126 6.0127 7.7049 7.7052 7.7579 7.7580 k = 0.4783 0.9079 0.2898 ( 7918 PWs) bands (ev): -23.0763 -23.0763 -23.0672 -23.0672 -20.3762 -20.3762 -20.3609 -20.3609 -14.4545 -14.4544 -14.4502 -14.4502 -13.1071 -13.1071 -13.1001 -13.1001 -11.4246 -11.4246 -11.4133 -11.4133 -8.5205 -8.5205 -8.5161 -8.5160 -6.4726 -6.4718 -6.4473 -6.4465 -6.2593 -6.2591 -6.2392 -6.2390 -6.0636 -6.0636 -6.0508 -6.0506 -5.7765 -5.7764 -5.7734 -5.7732 -5.4410 -5.4403 -5.4388 -5.4381 -4.1930 -4.1930 -4.1711 -4.1711 -2.5126 -2.5121 -2.4932 -2.4926 -1.6905 -1.6902 -1.6502 -1.6501 -1.4752 -1.4741 -1.4500 -1.4493 -0.9162 -0.9161 -0.9015 -0.9014 3.7830 3.7832 3.8113 3.8115 5.9910 5.9911 6.0048 6.0048 7.7177 7.7179 7.7444 7.7446 k = 0.5000 0.9079 0.2898 ( 7908 PWs) bands (ev): -23.0718 -23.0718 -23.0717 -23.0717 -20.3685 -20.3685 -20.3685 -20.3685 -14.4523 -14.4523 -14.4523 -14.4523 -13.1035 -13.1035 -13.1035 -13.1035 -11.4190 -11.4190 -11.4190 -11.4190 -8.5183 -8.5183 -8.5182 -8.5182 -6.4599 -6.4599 -6.4592 -6.4592 -6.2491 -6.2491 -6.2489 -6.2489 -6.0576 -6.0576 -6.0575 -6.0575 -5.7750 -5.7750 -5.7748 -5.7748 -5.4398 -5.4398 -5.4391 -5.4391 -4.1821 -4.1821 -4.1821 -4.1821 -2.5027 -2.5027 -2.5021 -2.5021 -1.6699 -1.6699 -1.6698 -1.6698 -1.4628 -1.4628 -1.4619 -1.4619 -0.9091 -0.9091 -0.9090 -0.9090 3.7971 3.7971 3.7974 3.7974 5.9976 5.9976 5.9976 5.9976 7.7309 7.7309 7.7311 7.7311 k = 0.5000 0.9079 0.2898 ( 7908 PWs) bands (ev): -23.0718 -23.0718 -23.0717 -23.0717 -20.3685 -20.3685 -20.3685 -20.3685 -14.4523 -14.4523 -14.4523 -14.4523 -13.1035 -13.1035 -13.1035 -13.1035 -11.4190 -11.4190 -11.4190 -11.4190 -8.5183 -8.5183 -8.5182 -8.5182 -6.4599 -6.4599 -6.4592 -6.4592 -6.2491 -6.2491 -6.2489 -6.2489 -6.0576 -6.0576 -6.0575 -6.0575 -5.7750 -5.7750 -5.7748 -5.7748 -5.4398 -5.4398 -5.4391 -5.4391 -4.1821 -4.1821 -4.1821 -4.1821 -2.5027 -2.5027 -2.5021 -2.5021 -1.6699 -1.6699 -1.6698 -1.6698 -1.4628 -1.4628 -1.4619 -1.4619 -0.9091 -0.9091 -0.9090 -0.9090 3.7971 3.7971 3.7974 3.7974 5.9976 5.9976 5.9976 5.9976 7.7309 7.7309 7.7311 7.7311 k = 0.5000 0.9147 0.2685 ( 7916 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4524 -14.4524 -14.4524 -14.4524 -13.1035 -13.1035 -13.1035 -13.1035 -11.4190 -11.4190 -11.4190 -11.4190 -8.5183 -8.5183 -8.5182 -8.5182 -6.4601 -6.4601 -6.4593 -6.4593 -6.2489 -6.2489 -6.2486 -6.2486 -6.0571 -6.0571 -6.0570 -6.0570 -5.7750 -5.7750 -5.7748 -5.7748 -5.4404 -5.4404 -5.4397 -5.4397 -4.1822 -4.1822 -4.1821 -4.1821 -2.5026 -2.5026 -2.5020 -2.5020 -1.6698 -1.6698 -1.6696 -1.6696 -1.4627 -1.4627 -1.4618 -1.4618 -0.9091 -0.9091 -0.9090 -0.9090 3.7970 3.7970 3.7973 3.7973 5.9974 5.9974 5.9974 5.9974 7.7317 7.7317 7.7319 7.7319 k = 0.5000 0.9215 0.2473 ( 7912 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4524 -14.4524 -14.4524 -14.4524 -13.1035 -13.1035 -13.1035 -13.1035 -11.4190 -11.4190 -11.4190 -11.4190 -8.5182 -8.5182 -8.5182 -8.5182 -6.4605 -6.4605 -6.4597 -6.4597 -6.2481 -6.2481 -6.2478 -6.2478 -6.0559 -6.0559 -6.0557 -6.0557 -5.7749 -5.7749 -5.7747 -5.7747 -5.4421 -5.4421 -5.4414 -5.4414 -4.1823 -4.1823 -4.1822 -4.1822 -2.5022 -2.5022 -2.5016 -2.5016 -1.6696 -1.6696 -1.6692 -1.6692 -1.4626 -1.4626 -1.4617 -1.4617 -0.9091 -0.9091 -0.9090 -0.9090 3.7968 3.7968 3.7971 3.7971 5.9968 5.9968 5.9969 5.9969 7.7341 7.7341 7.7344 7.7344 k = 0.5000 0.9282 0.2261 ( 7920 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4526 -14.4526 -14.4526 -14.4526 -13.1035 -13.1035 -13.1035 -13.1035 -11.4190 -11.4190 -11.4190 -11.4190 -8.5182 -8.5182 -8.5181 -8.5181 -6.4612 -6.4612 -6.4604 -6.4604 -6.2470 -6.2470 -6.2465 -6.2465 -6.0538 -6.0538 -6.0536 -6.0536 -5.7747 -5.7747 -5.7745 -5.7745 -5.4449 -5.4449 -5.4442 -5.4442 -4.1826 -4.1826 -4.1823 -4.1823 -2.5015 -2.5015 -2.5010 -2.5010 -1.6691 -1.6691 -1.6686 -1.6686 -1.4624 -1.4624 -1.4615 -1.4615 -0.9091 -0.9091 -0.9089 -0.9089 3.7964 3.7964 3.7967 3.7967 5.9958 5.9958 5.9960 5.9960 7.7380 7.7380 7.7383 7.7383 k = 0.5000 0.9350 0.2049 ( 7918 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1035 -13.1035 -13.1035 -13.1035 -11.4191 -11.4191 -11.4190 -11.4190 -8.5182 -8.5182 -8.5181 -8.5181 -6.4620 -6.4620 -6.4612 -6.4612 -6.2453 -6.2453 -6.2448 -6.2448 -6.0510 -6.0510 -6.0507 -6.0507 -5.7745 -5.7745 -5.7742 -5.7742 -5.4489 -5.4489 -5.4482 -5.4482 -4.1828 -4.1828 -4.1826 -4.1826 -2.5007 -2.5007 -2.5001 -2.5001 -1.6684 -1.6684 -1.6678 -1.6678 -1.4622 -1.4622 -1.4613 -1.4613 -0.9091 -0.9091 -0.9089 -0.9089 3.7959 3.7959 3.7961 3.7961 5.9945 5.9945 5.9947 5.9947 7.7431 7.7431 7.7435 7.7435 k = 0.5000 0.9418 0.1837 ( 7920 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3686 -20.3686 -20.3685 -20.3685 -14.4530 -14.4530 -14.4530 -14.4530 -13.1035 -13.1035 -13.1035 -13.1035 -11.4191 -11.4191 -11.4191 -11.4191 -8.5181 -8.5181 -8.5181 -8.5181 -6.4631 -6.4631 -6.4623 -6.4623 -6.2432 -6.2432 -6.2426 -6.2426 -6.0474 -6.0474 -6.0471 -6.0471 -5.7741 -5.7741 -5.7738 -5.7738 -5.4538 -5.4538 -5.4531 -5.4531 -4.1832 -4.1832 -4.1829 -4.1829 -2.4996 -2.4996 -2.4991 -2.4991 -1.6675 -1.6675 -1.6668 -1.6668 -1.4619 -1.4619 -1.4610 -1.4610 -0.9091 -0.9091 -0.9089 -0.9089 3.7952 3.7952 3.7954 3.7954 5.9929 5.9929 5.9931 5.9931 7.7492 7.7492 7.7497 7.7497 k = 0.5000 0.9485 0.1625 ( 7914 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4533 -14.4533 -14.4533 -14.4533 -13.1034 -13.1034 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5181 -8.5181 -8.5180 -8.5180 -6.4643 -6.4643 -6.4635 -6.4635 -6.2407 -6.2407 -6.2401 -6.2401 -6.0433 -6.0433 -6.0429 -6.0429 -5.7736 -5.7736 -5.7733 -5.7733 -5.4597 -5.4597 -5.4590 -5.4590 -4.1836 -4.1836 -4.1832 -4.1832 -2.4983 -2.4983 -2.4978 -2.4978 -1.6665 -1.6665 -1.6656 -1.6656 -1.4615 -1.4615 -1.4606 -1.4606 -0.9091 -0.9091 -0.9088 -0.9088 3.7944 3.7944 3.7946 3.7946 5.9910 5.9910 5.9913 5.9913 7.7559 7.7559 7.7565 7.7565 k = 0.5000 0.9553 0.1412 ( 7908 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4536 -14.4536 -14.4536 -14.4536 -13.1034 -13.1034 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5180 -8.5180 -8.5179 -8.5179 -6.4656 -6.4656 -6.4648 -6.4648 -6.2379 -6.2379 -6.2372 -6.2372 -6.0386 -6.0386 -6.0382 -6.0382 -5.7729 -5.7729 -5.7726 -5.7726 -5.4664 -5.4664 -5.4657 -5.4657 -4.1840 -4.1840 -4.1836 -4.1836 -2.4969 -2.4969 -2.4963 -2.4963 -1.6653 -1.6653 -1.6643 -1.6643 -1.4611 -1.4611 -1.4603 -1.4603 -0.9091 -0.9091 -0.9088 -0.9088 3.7934 3.7934 3.7937 3.7937 5.9889 5.9889 5.9892 5.9892 7.7627 7.7627 7.7634 7.7634 k = 0.5000 0.9621 0.1200 ( 7920 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4540 -14.4540 -14.4540 -14.4540 -13.1034 -13.1034 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5179 -8.5179 -8.5178 -8.5178 -6.4670 -6.4670 -6.4661 -6.4661 -6.2347 -6.2347 -6.2340 -6.2340 -6.0335 -6.0335 -6.0331 -6.0331 -5.7720 -5.7720 -5.7717 -5.7717 -5.4739 -5.4739 -5.4732 -5.4732 -4.1845 -4.1845 -4.1840 -4.1840 -2.4953 -2.4953 -2.4948 -2.4948 -1.6639 -1.6639 -1.6628 -1.6628 -1.4607 -1.4607 -1.4599 -1.4599 -0.9091 -0.9091 -0.9088 -0.9088 3.7924 3.7924 3.7926 3.7926 5.9867 5.9867 5.9870 5.9870 7.7692 7.7692 7.7699 7.7699 k = 0.5000 0.9621 0.1200 ( 7920 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4540 -14.4540 -14.4540 -14.4540 -13.1034 -13.1034 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5179 -8.5179 -8.5178 -8.5178 -6.4670 -6.4670 -6.4661 -6.4661 -6.2347 -6.2347 -6.2340 -6.2340 -6.0335 -6.0335 -6.0331 -6.0331 -5.7720 -5.7720 -5.7717 -5.7717 -5.4739 -5.4739 -5.4732 -5.4732 -4.1845 -4.1845 -4.1840 -4.1840 -2.4953 -2.4953 -2.4948 -2.4948 -1.6639 -1.6639 -1.6628 -1.6628 -1.4607 -1.4607 -1.4599 -1.4599 -0.9091 -0.9091 -0.9088 -0.9088 3.7924 3.7924 3.7926 3.7926 5.9867 5.9867 5.9870 5.9870 7.7692 7.7692 7.7699 7.7699 k = 0.5000 0.9582 0.0993 ( 7924 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4538 -14.4538 -14.4538 -14.4538 -13.1033 -13.1033 -13.1033 -13.1033 -11.4191 -11.4191 -11.4191 -11.4191 -8.5181 -8.5181 -8.5180 -8.5180 -6.4680 -6.4680 -6.4671 -6.4671 -6.2336 -6.2336 -6.2328 -6.2328 -6.0292 -6.0292 -6.0288 -6.0288 -5.7720 -5.7720 -5.7716 -5.7716 -5.4807 -5.4807 -5.4800 -5.4800 -4.1851 -4.1851 -4.1846 -4.1846 -2.4945 -2.4945 -2.4940 -2.4940 -1.6620 -1.6620 -1.6608 -1.6608 -1.4606 -1.4606 -1.4597 -1.4597 -0.9095 -0.9095 -0.9092 -0.9092 3.7921 3.7921 3.7924 3.7924 5.9849 5.9849 5.9852 5.9852 7.7779 7.7779 7.7787 7.7787 k = 0.5000 0.9543 0.0786 ( 7924 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4537 -14.4537 -14.4537 -14.4537 -13.1033 -13.1033 -13.1033 -13.1033 -11.4191 -11.4191 -11.4191 -11.4191 -8.5182 -8.5182 -8.5181 -8.5181 -6.4690 -6.4690 -6.4682 -6.4682 -6.2323 -6.2323 -6.2316 -6.2316 -6.0248 -6.0248 -6.0244 -6.0244 -5.7719 -5.7719 -5.7714 -5.7714 -5.4878 -5.4878 -5.4871 -5.4871 -4.1858 -4.1858 -4.1853 -4.1853 -2.4936 -2.4936 -2.4932 -2.4932 -1.6598 -1.6598 -1.6586 -1.6586 -1.4604 -1.4604 -1.4596 -1.4596 -0.9100 -0.9100 -0.9097 -0.9097 3.7919 3.7919 3.7922 3.7922 5.9830 5.9830 5.9833 5.9833 7.7854 7.7854 7.7864 7.7864 k = 0.5000 0.9505 0.0579 ( 7934 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4535 -14.4535 -14.4535 -14.4535 -13.1032 -13.1032 -13.1032 -13.1032 -11.4192 -11.4192 -11.4191 -11.4191 -8.5184 -8.5184 -8.5183 -8.5183 -6.4700 -6.4700 -6.4692 -6.4692 -6.2309 -6.2309 -6.2301 -6.2301 -6.0205 -6.0205 -6.0200 -6.0200 -5.7716 -5.7716 -5.7711 -5.7711 -5.4951 -5.4951 -5.4944 -5.4944 -4.1866 -4.1866 -4.1860 -4.1860 -2.4928 -2.4928 -2.4923 -2.4923 -1.6576 -1.6576 -1.6563 -1.6563 -1.4603 -1.4603 -1.4595 -1.4595 -0.9105 -0.9105 -0.9102 -0.9102 3.7916 3.7916 3.7919 3.7919 5.9811 5.9811 5.9814 5.9814 7.7918 7.7918 7.7927 7.7927 k = 0.5000 0.9466 0.0372 ( 7926 PWs) bands (ev): -23.0719 -23.0719 -23.0718 -23.0718 -20.3686 -20.3686 -20.3685 -20.3685 -14.4534 -14.4534 -14.4534 -14.4534 -13.1032 -13.1032 -13.1032 -13.1032 -11.4192 -11.4192 -11.4191 -11.4191 -8.5185 -8.5185 -8.5185 -8.5185 -6.4709 -6.4709 -6.4701 -6.4701 -6.2294 -6.2294 -6.2287 -6.2287 -6.0161 -6.0161 -6.0157 -6.0157 -5.7711 -5.7711 -5.7706 -5.7706 -5.5025 -5.5025 -5.5018 -5.5018 -4.1873 -4.1873 -4.1867 -4.1867 -2.4919 -2.4919 -2.4915 -2.4915 -1.6554 -1.6554 -1.6539 -1.6539 -1.4602 -1.4602 -1.4594 -1.4594 -0.9110 -0.9110 -0.9107 -0.9107 3.7913 3.7913 3.7916 3.7916 5.9791 5.9791 5.9795 5.9795 7.7969 7.7969 7.7979 7.7979 k = 0.5000 0.9427 0.0165 ( 7926 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3686 -20.3686 -20.3685 -20.3685 -14.4533 -14.4533 -14.4533 -14.4533 -13.1032 -13.1032 -13.1031 -13.1031 -11.4192 -11.4192 -11.4191 -11.4191 -8.5187 -8.5187 -8.5186 -8.5186 -6.4718 -6.4718 -6.4710 -6.4710 -6.2278 -6.2278 -6.2271 -6.2271 -6.0120 -6.0120 -6.0115 -6.0115 -5.7704 -5.7704 -5.7699 -5.7699 -5.5099 -5.5099 -5.5092 -5.5092 -4.1881 -4.1881 -4.1874 -4.1874 -2.4911 -2.4911 -2.4907 -2.4907 -1.6531 -1.6531 -1.6516 -1.6516 -1.4601 -1.4601 -1.4594 -1.4594 -0.9116 -0.9116 -0.9113 -0.9113 3.7909 3.7909 3.7913 3.7913 5.9772 5.9772 5.9776 5.9776 7.8010 7.8010 7.8021 7.8021 k = 0.5000 0.9389-0.0042 ( 7922 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4532 -14.4532 -14.4531 -14.4531 -13.1031 -13.1031 -13.1031 -13.1031 -11.4192 -11.4192 -11.4191 -11.4191 -8.5189 -8.5189 -8.5188 -8.5188 -6.4726 -6.4726 -6.4719 -6.4719 -6.2262 -6.2262 -6.2256 -6.2256 -6.0081 -6.0081 -6.0077 -6.0077 -5.7696 -5.7696 -5.7690 -5.7690 -5.5171 -5.5171 -5.5165 -5.5165 -4.1888 -4.1888 -4.1881 -4.1881 -2.4903 -2.4903 -2.4899 -2.4899 -1.6509 -1.6509 -1.6493 -1.6493 -1.4600 -1.4600 -1.4593 -1.4593 -0.9121 -0.9121 -0.9119 -0.9119 3.7906 3.7906 3.7909 3.7909 5.9754 5.9754 5.9758 5.9758 7.8042 7.8042 7.8053 7.8053 k = 0.5000 0.9350-0.0249 ( 7920 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4531 -14.4531 -14.4530 -14.4530 -13.1031 -13.1031 -13.1031 -13.1031 -11.4192 -11.4192 -11.4192 -11.4192 -8.5190 -8.5190 -8.5190 -8.5190 -6.4733 -6.4733 -6.4726 -6.4726 -6.2247 -6.2247 -6.2241 -6.2241 -6.0045 -6.0045 -6.0041 -6.0041 -5.7686 -5.7686 -5.7681 -5.7681 -5.5240 -5.5240 -5.5234 -5.5234 -4.1895 -4.1895 -4.1888 -4.1888 -2.4895 -2.4895 -2.4891 -2.4891 -1.6489 -1.6489 -1.6472 -1.6472 -1.4600 -1.4600 -1.4593 -1.4593 -0.9127 -0.9127 -0.9124 -0.9124 3.7903 3.7903 3.7906 3.7906 5.9737 5.9737 5.9741 5.9741 7.8066 7.8066 7.8077 7.8077 k = 0.5000 0.9311-0.0456 ( 7922 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4530 -14.4530 -14.4530 -14.4530 -13.1031 -13.1031 -13.1030 -13.1030 -11.4192 -11.4192 -11.4192 -11.4192 -8.5192 -8.5192 -8.5191 -8.5191 -6.4740 -6.4740 -6.4733 -6.4733 -6.2232 -6.2232 -6.2226 -6.2226 -6.0013 -6.0013 -6.0009 -6.0009 -5.7675 -5.7675 -5.7670 -5.7670 -5.5304 -5.5304 -5.5299 -5.5299 -4.1901 -4.1901 -4.1894 -4.1894 -2.4888 -2.4888 -2.4885 -2.4885 -1.6469 -1.6469 -1.6452 -1.6452 -1.4599 -1.4599 -1.4593 -1.4593 -0.9132 -0.9132 -0.9129 -0.9129 3.7900 3.7900 3.7903 3.7903 5.9721 5.9721 5.9725 5.9725 7.8084 7.8084 7.8096 7.8096 k = 0.5000 0.9273-0.0663 ( 7920 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4529 -14.4529 -14.4529 -14.4529 -13.1030 -13.1030 -13.1030 -13.1030 -11.4192 -11.4192 -11.4191 -11.4191 -8.5193 -8.5193 -8.5193 -8.5193 -6.4745 -6.4745 -6.4739 -6.4739 -6.2219 -6.2219 -6.2213 -6.2213 -5.9985 -5.9985 -5.9982 -5.9982 -5.7664 -5.7664 -5.7658 -5.7658 -5.5362 -5.5362 -5.5357 -5.5357 -4.1907 -4.1907 -4.1899 -4.1899 -2.4882 -2.4882 -2.4879 -2.4879 -1.6452 -1.6452 -1.6435 -1.6435 -1.4599 -1.4599 -1.4594 -1.4594 -0.9136 -0.9136 -0.9134 -0.9134 3.7898 3.7898 3.7901 3.7901 5.9708 5.9708 5.9711 5.9711 7.8097 7.8097 7.8109 7.8109 k = 0.5000 0.9234-0.0870 ( 7916 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4529 -14.4529 -14.4528 -14.4528 -13.1030 -13.1030 -13.1030 -13.1030 -11.4192 -11.4192 -11.4191 -11.4191 -8.5195 -8.5195 -8.5194 -8.5194 -6.4750 -6.4750 -6.4744 -6.4744 -6.2207 -6.2207 -6.2202 -6.2202 -5.9962 -5.9962 -5.9959 -5.9959 -5.7653 -5.7653 -5.7647 -5.7647 -5.5412 -5.5412 -5.5408 -5.5408 -4.1912 -4.1912 -4.1904 -4.1904 -2.4877 -2.4877 -2.4874 -2.4874 -1.6437 -1.6437 -1.6419 -1.6419 -1.4598 -1.4598 -1.4594 -1.4594 -0.9140 -0.9140 -0.9138 -0.9138 3.7895 3.7895 3.7899 3.7899 5.9696 5.9696 5.9700 5.9700 7.8107 7.8107 7.8118 7.8118 k = 0.5000 0.9195-0.1077 ( 7920 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1030 -13.1030 -13.1030 -13.1030 -11.4192 -11.4192 -11.4191 -11.4191 -8.5196 -8.5196 -8.5195 -8.5195 -6.4753 -6.4753 -6.4748 -6.4748 -6.2198 -6.2198 -6.2193 -6.2193 -5.9944 -5.9944 -5.9942 -5.9942 -5.7643 -5.7643 -5.7638 -5.7638 -5.5452 -5.5452 -5.5449 -5.5449 -4.1916 -4.1916 -4.1908 -4.1908 -2.4873 -2.4873 -2.4870 -2.4870 -1.6425 -1.6425 -1.6407 -1.6407 -1.4598 -1.4598 -1.4595 -1.4595 -0.9143 -0.9143 -0.9141 -0.9141 3.7893 3.7893 3.7897 3.7897 5.9686 5.9686 5.9690 5.9690 7.8113 7.8113 7.8125 7.8125 k = 0.5000 0.9157-0.1284 ( 7922 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1030 -13.1030 -13.1029 -13.1029 -11.4192 -11.4192 -11.4191 -11.4191 -8.5196 -8.5196 -8.5195 -8.5195 -6.4756 -6.4756 -6.4751 -6.4751 -6.2191 -6.2191 -6.2186 -6.2186 -5.9931 -5.9931 -5.9929 -5.9929 -5.7635 -5.7635 -5.7630 -5.7630 -5.5483 -5.5483 -5.5480 -5.5480 -4.1919 -4.1919 -4.1911 -4.1911 -2.4870 -2.4870 -2.4867 -2.4867 -1.6417 -1.6417 -1.6398 -1.6398 -1.4598 -1.4598 -1.4595 -1.4595 -0.9146 -0.9146 -0.9143 -0.9143 3.7892 3.7892 3.7896 3.7896 5.9680 5.9680 5.9684 5.9684 7.8118 7.8118 7.8129 7.8129 k = 0.5000 0.9118-0.1490 ( 7928 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1030 -13.1030 -13.1029 -13.1029 -11.4192 -11.4192 -11.4192 -11.4192 -8.5197 -8.5197 -8.5196 -8.5196 -6.4758 -6.4758 -6.4752 -6.4752 -6.2186 -6.2186 -6.2182 -6.2182 -5.9923 -5.9923 -5.9921 -5.9921 -5.7630 -5.7630 -5.7625 -5.7625 -5.5501 -5.5501 -5.5499 -5.5499 -4.1921 -4.1921 -4.1913 -4.1913 -2.4868 -2.4868 -2.4865 -2.4865 -1.6411 -1.6411 -1.6393 -1.6393 -1.4598 -1.4598 -1.4595 -1.4595 -0.9147 -0.9147 -0.9145 -0.9145 3.7891 3.7891 3.7895 3.7895 5.9675 5.9675 5.9679 5.9679 7.8120 7.8120 7.8132 7.8132 k = 0.5000 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1030 -13.1030 -13.1029 -13.1029 -11.4192 -11.4192 -11.4192 -11.4192 -8.5197 -8.5197 -8.5196 -8.5196 -6.4758 -6.4758 -6.4753 -6.4753 -6.2185 -6.2185 -6.2181 -6.2181 -5.9921 -5.9921 -5.9919 -5.9919 -5.7628 -5.7628 -5.7624 -5.7624 -5.5507 -5.5507 -5.5505 -5.5505 -4.1921 -4.1921 -4.1913 -4.1913 -2.4867 -2.4867 -2.4864 -2.4864 -1.6410 -1.6410 -1.6391 -1.6391 -1.4598 -1.4598 -1.4596 -1.4596 -0.9148 -0.9148 -0.9145 -0.9145 3.7891 3.7891 3.7894 3.7894 5.9674 5.9674 5.9678 5.9678 7.8121 7.8121 7.8132 7.8132 k = 0.5000 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.0718 -23.0718 -23.0718 -23.0718 -20.3685 -20.3685 -20.3685 -20.3685 -14.4528 -14.4528 -14.4528 -14.4528 -13.1030 -13.1030 -13.1029 -13.1029 -11.4192 -11.4192 -11.4192 -11.4192 -8.5197 -8.5197 -8.5196 -8.5196 -6.4758 -6.4758 -6.4753 -6.4753 -6.2185 -6.2185 -6.2181 -6.2181 -5.9921 -5.9921 -5.9919 -5.9919 -5.7628 -5.7628 -5.7624 -5.7624 -5.5507 -5.5507 -5.5505 -5.5505 -4.1921 -4.1921 -4.1913 -4.1913 -2.4867 -2.4867 -2.4864 -2.4864 -1.6410 -1.6410 -1.6391 -1.6391 -1.4598 -1.4598 -1.4596 -1.4596 -0.9148 -0.9148 -0.9145 -0.9145 3.7891 3.7891 3.7894 3.7894 5.9674 5.9674 5.9678 5.9678 7.8121 7.8121 7.8132 7.8132 k = 0.4783 0.9079-0.1697 ( 7934 PWs) bands (ev): -23.0763 -23.0763 -23.0672 -23.0672 -20.3762 -20.3762 -20.3609 -20.3608 -14.4541 -14.4541 -14.4514 -14.4514 -13.1042 -13.1042 -13.1019 -13.1019 -11.4270 -11.4269 -11.4113 -11.4112 -8.5214 -8.5213 -8.5180 -8.5179 -6.4836 -6.4831 -6.4689 -6.4684 -6.2233 -6.2228 -6.2129 -6.2125 -5.9951 -5.9949 -5.9890 -5.9888 -5.7679 -5.7675 -5.7573 -5.7568 -5.5512 -5.5509 -5.5501 -5.5499 -4.2043 -4.2035 -4.1800 -4.1792 -2.4981 -2.4978 -2.4757 -2.4754 -1.6540 -1.6522 -1.6288 -1.6269 -1.4642 -1.4640 -1.4553 -1.4550 -0.9242 -0.9240 -0.9045 -0.9043 3.7802 3.7805 3.7982 3.7985 5.9643 5.9647 5.9712 5.9716 7.8091 7.8104 7.8116 7.8127 k = 0.4565 0.9079-0.1697 ( 7926 PWs) bands (ev): -23.0808 -23.0808 -23.0626 -23.0626 -20.3838 -20.3838 -20.3533 -20.3532 -14.4554 -14.4554 -14.4500 -14.4499 -13.1055 -13.1055 -13.1010 -13.1010 -11.4345 -11.4345 -11.4033 -11.4032 -8.5231 -8.5231 -8.5164 -8.5163 -6.4921 -6.4916 -6.4629 -6.4625 -6.2274 -6.2270 -6.2065 -6.2061 -5.9981 -5.9979 -5.9861 -5.9859 -5.7725 -5.7722 -5.7516 -5.7510 -5.5516 -5.5513 -5.5492 -5.5491 -4.2165 -4.2156 -4.1679 -4.1672 -2.5097 -2.5095 -2.4652 -2.4649 -1.6678 -1.6660 -1.6176 -1.6157 -1.4685 -1.4684 -1.4507 -1.4504 -0.9329 -0.9327 -0.8936 -0.8934 3.7715 3.7718 3.8074 3.8077 5.9620 5.9625 5.9757 5.9761 7.8034 7.8047 7.8074 7.8084 k = 0.4348 0.9079-0.1697 ( 7926 PWs) bands (ev): -23.0853 -23.0853 -23.0581 -23.0581 -20.3914 -20.3914 -20.3457 -20.3457 -14.4566 -14.4566 -14.4485 -14.4485 -13.1070 -13.1070 -13.1002 -13.1002 -11.4419 -11.4419 -11.3952 -11.3952 -8.5249 -8.5248 -8.5149 -8.5148 -6.5013 -6.5008 -6.4579 -6.4575 -6.2310 -6.2306 -6.1991 -6.1987 -6.0009 -6.0008 -5.9834 -5.9831 -5.7766 -5.7762 -5.7456 -5.7451 -5.5520 -5.5517 -5.5481 -5.5479 -4.2285 -4.2276 -4.1560 -4.1553 -2.5216 -2.5215 -2.4552 -2.4548 -1.6822 -1.6805 -1.6075 -1.6056 -1.4727 -1.4727 -1.4461 -1.4457 -0.9407 -0.9405 -0.8822 -0.8820 3.7631 3.7634 3.8167 3.8170 5.9606 5.9610 5.9809 5.9813 7.7954 7.7968 7.7993 7.8002 k = 0.4130 0.9079-0.1697 ( 7934 PWs) bands (ev): -23.0896 -23.0896 -23.0536 -23.0536 -20.3989 -20.3989 -20.3383 -20.3383 -14.4578 -14.4578 -14.4470 -14.4470 -13.1086 -13.1086 -13.0996 -13.0996 -11.4491 -11.4491 -11.3872 -11.3872 -8.5266 -8.5265 -8.5135 -8.5134 -6.5110 -6.5105 -6.4539 -6.4535 -6.2342 -6.2339 -6.1908 -6.1905 -6.0036 -6.0034 -5.9809 -5.9806 -5.7799 -5.7796 -5.7397 -5.7390 -5.5525 -5.5521 -5.5465 -5.5465 -4.2403 -4.2394 -4.1443 -4.1437 -2.5337 -2.5336 -2.4458 -2.4453 -1.6970 -1.6954 -1.5985 -1.5965 -1.4769 -1.4768 -1.4414 -1.4410 -0.9476 -0.9474 -0.8702 -0.8701 3.7550 3.7552 3.8260 3.8264 5.9600 5.9604 5.9866 5.9869 7.7858 7.7872 7.7875 7.7883 k = 0.3913 0.9079-0.1697 ( 7942 PWs) bands (ev): -23.0939 -23.0939 -23.0491 -23.0491 -20.4063 -20.4063 -20.3311 -20.3311 -14.4589 -14.4589 -14.4455 -14.4455 -13.1103 -13.1103 -13.0991 -13.0990 -11.4559 -11.4559 -11.3792 -11.3792 -8.5283 -8.5282 -8.5122 -8.5121 -6.5211 -6.5205 -6.4507 -6.4504 -6.2373 -6.2369 -6.1816 -6.1813 -6.0059 -6.0058 -5.9789 -5.9785 -5.7824 -5.7822 -5.7337 -5.7331 -5.5532 -5.5528 -5.5446 -5.5446 -4.2518 -4.2509 -4.1330 -4.1324 -2.5458 -2.5457 -2.4369 -2.4365 -1.7122 -1.7106 -1.5906 -1.5886 -1.4809 -1.4809 -1.4368 -1.4363 -0.9536 -0.9534 -0.8579 -0.8578 3.7471 3.7474 3.8353 3.8357 5.9602 5.9607 5.9927 5.9930 7.7723 7.7730 7.7752 7.7766 k = 0.3696 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.0980 -23.0980 -23.0448 -23.0448 -20.4135 -20.4135 -20.3240 -20.3240 -14.4600 -14.4600 -14.4440 -14.4440 -13.1122 -13.1122 -13.0987 -13.0986 -11.4625 -11.4625 -11.3713 -11.3713 -8.5299 -8.5299 -8.5110 -8.5110 -6.5314 -6.5308 -6.4483 -6.4481 -6.2401 -6.2398 -6.1715 -6.1713 -6.0080 -6.0079 -5.9772 -5.9769 -5.7841 -5.7839 -5.7279 -5.7272 -5.5541 -5.5537 -5.5423 -5.5423 -4.2629 -4.2620 -4.1220 -4.1214 -2.5579 -2.5578 -2.4287 -2.4283 -1.7275 -1.7260 -1.5838 -1.5818 -1.4848 -1.4848 -1.4322 -1.4316 -0.9587 -0.9585 -0.8453 -0.8452 3.7397 3.7399 3.8446 3.8449 5.9613 5.9618 5.9992 5.9995 7.7544 7.7549 7.7639 7.7654 k = 0.3478 0.9079-0.1697 ( 7928 PWs) bands (ev): -23.1020 -23.1020 -23.0405 -23.0405 -20.4205 -20.4205 -20.3172 -20.3172 -14.4610 -14.4610 -14.4425 -14.4425 -13.1141 -13.1141 -13.0984 -13.0983 -11.4687 -11.4687 -11.3636 -11.3636 -8.5315 -8.5314 -8.5100 -8.5100 -6.5418 -6.5412 -6.4467 -6.4465 -6.2429 -6.2427 -6.1607 -6.1605 -6.0097 -6.0096 -5.9761 -5.9757 -5.7849 -5.7847 -5.7223 -5.7216 -5.5554 -5.5550 -5.5396 -5.5395 -4.2736 -4.2727 -4.1114 -4.1109 -2.5698 -2.5698 -2.4213 -2.4208 -1.7428 -1.7413 -1.5781 -1.5761 -1.4886 -1.4885 -1.4278 -1.4271 -0.9629 -0.9628 -0.8326 -0.8325 3.7325 3.7327 3.8537 3.8541 5.9632 5.9637 6.0059 6.0063 7.7342 7.7347 7.7524 7.7538 k = 0.3261 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.1059 -23.1059 -23.0364 -23.0364 -20.4273 -20.4273 -20.3106 -20.3106 -14.4619 -14.4619 -14.4409 -14.4409 -13.1161 -13.1161 -13.0982 -13.0981 -11.4746 -11.4745 -11.3561 -11.3560 -8.5329 -8.5329 -8.5092 -8.5091 -6.5521 -6.5516 -6.4456 -6.4454 -6.2458 -6.2456 -6.1493 -6.1492 -6.0110 -6.0110 -5.9754 -5.9750 -5.7849 -5.7848 -5.7170 -5.7164 -5.5570 -5.5567 -5.5365 -5.5365 -4.2838 -4.2828 -4.1013 -4.1008 -2.5817 -2.5816 -2.4145 -2.4140 -1.7580 -1.7566 -1.5734 -1.5715 -1.4922 -1.4922 -1.4235 -1.4227 -0.9663 -0.9662 -0.8198 -0.8198 3.7258 3.7260 3.8626 3.8630 5.9659 5.9663 6.0128 6.0131 7.7123 7.7128 7.7409 7.7423 k = 0.3043 0.9079-0.1697 ( 7914 PWs) bands (ev): -23.1095 -23.1095 -23.0324 -23.0324 -20.4338 -20.4338 -20.3043 -20.3042 -14.4628 -14.4628 -14.4395 -14.4394 -13.1182 -13.1182 -13.0980 -13.0980 -11.4800 -11.4800 -11.3488 -11.3487 -8.5343 -8.5342 -8.5085 -8.5084 -6.5623 -6.5618 -6.4450 -6.4449 -6.2487 -6.2485 -6.1375 -6.1374 -6.0119 -6.0119 -5.9752 -5.9748 -5.7841 -5.7840 -5.7122 -5.7116 -5.5590 -5.5587 -5.5331 -5.5330 -4.2933 -4.2924 -4.0917 -4.0912 -2.5932 -2.5931 -2.4084 -2.4079 -1.7728 -1.7714 -1.5696 -1.5677 -1.4957 -1.4957 -1.4193 -1.4186 -0.9689 -0.9688 -0.8072 -0.8071 3.7194 3.7196 3.8714 3.8717 5.9693 5.9697 6.0198 6.0201 7.6894 7.6898 7.7296 7.7310 k = 0.2826 0.9079-0.1697 ( 7912 PWs) bands (ev): -23.1130 -23.1130 -23.0286 -23.0286 -20.4400 -20.4400 -20.2982 -20.2982 -14.4636 -14.4636 -14.4380 -14.4380 -13.1203 -13.1203 -13.0980 -13.0980 -11.4851 -11.4851 -11.3418 -11.3418 -8.5355 -8.5354 -8.5079 -8.5079 -6.5723 -6.5718 -6.4448 -6.4447 -6.2517 -6.2516 -6.1254 -6.1254 -6.0123 -6.0123 -5.9754 -5.9750 -5.7827 -5.7826 -5.7079 -5.7073 -5.5614 -5.5611 -5.5293 -5.5293 -4.3023 -4.3014 -4.0826 -4.0822 -2.6044 -2.6043 -2.4030 -2.4025 -1.7872 -1.7859 -1.5667 -1.5649 -1.4990 -1.4990 -1.4155 -1.4147 -0.9708 -0.9706 -0.7947 -0.7947 3.7135 3.7137 3.8798 3.8801 5.9732 5.9737 6.0267 6.0270 7.6660 7.6664 7.7188 7.7201 k = 0.2609 0.9079-0.1697 ( 7910 PWs) bands (ev): -23.1163 -23.1163 -23.0250 -23.0250 -20.4459 -20.4459 -20.2926 -20.2926 -14.4644 -14.4644 -14.4366 -14.4366 -13.1224 -13.1224 -13.0980 -13.0980 -11.4898 -11.4898 -11.3351 -11.3351 -8.5366 -8.5366 -8.5075 -8.5075 -6.5819 -6.5814 -6.4448 -6.4448 -6.2548 -6.2547 -6.1133 -6.1132 -6.0122 -6.0122 -5.9760 -5.9756 -5.7806 -5.7805 -5.7042 -5.7036 -5.5641 -5.5638 -5.5254 -5.5253 -4.3105 -4.3096 -4.0741 -4.0737 -2.6151 -2.6150 -2.3984 -2.3979 -1.8009 -1.7997 -1.5645 -1.5627 -1.5022 -1.5022 -1.4118 -1.4111 -0.9720 -0.9719 -0.7826 -0.7826 3.7080 3.7081 3.8879 3.8882 5.9777 5.9781 6.0335 6.0338 7.6424 7.6428 7.7085 7.7098 k = 0.2391 0.9079-0.1697 ( 7904 PWs) bands (ev): -23.1194 -23.1194 -23.0216 -23.0216 -20.4514 -20.4514 -20.2872 -20.2872 -14.4650 -14.4650 -14.4352 -14.4352 -13.1244 -13.1244 -13.0981 -13.0981 -11.4941 -11.4941 -11.3288 -11.3288 -8.5376 -8.5376 -8.5072 -8.5072 -6.5910 -6.5906 -6.4451 -6.4451 -6.2579 -6.2578 -6.1013 -6.1013 -6.0115 -6.0115 -5.9769 -5.9765 -5.7781 -5.7781 -5.7012 -5.7007 -5.5670 -5.5667 -5.5213 -5.5212 -4.3181 -4.3172 -4.0661 -4.0658 -2.6252 -2.6251 -2.3944 -2.3939 -1.8140 -1.8128 -1.5629 -1.5613 -1.5052 -1.5051 -1.4085 -1.4077 -0.9727 -0.9726 -0.7709 -0.7709 3.7029 3.7030 3.8955 3.8959 5.9826 5.9830 6.0401 6.0404 7.6192 7.6196 7.6988 7.7000 k = 0.2174 0.9079-0.1697 ( 7910 PWs) bands (ev): -23.1223 -23.1223 -23.0185 -23.0185 -20.4566 -20.4566 -20.2823 -20.2823 -14.4657 -14.4657 -14.4339 -14.4339 -13.1265 -13.1264 -13.0982 -13.0982 -11.4981 -11.4980 -11.3230 -11.3230 -8.5385 -8.5384 -8.5071 -8.5070 -6.5996 -6.5993 -6.4455 -6.4455 -6.2610 -6.2609 -6.0898 -6.0897 -6.0101 -6.0100 -5.9780 -5.9776 -5.7753 -5.7753 -5.6991 -5.6987 -5.5700 -5.5698 -5.5171 -5.5170 -4.3249 -4.3241 -4.0588 -4.0585 -2.6348 -2.6347 -2.3911 -2.3906 -1.8262 -1.8251 -1.5619 -1.5604 -1.5080 -1.5079 -1.4055 -1.4047 -0.9730 -0.9729 -0.7599 -0.7599 3.6982 3.6983 3.9027 3.9030 5.9877 5.9881 6.0464 6.0466 7.5967 7.5970 7.6899 7.6910 k = 0.1957 0.9079-0.1697 ( 7910 PWs) bands (ev): -23.1249 -23.1249 -23.0155 -23.0155 -20.4613 -20.4613 -20.2778 -20.2777 -14.4662 -14.4662 -14.4327 -14.4327 -13.1284 -13.1284 -13.0983 -13.0983 -11.5016 -11.5016 -11.3176 -11.3175 -8.5393 -8.5392 -8.5070 -8.5070 -6.6076 -6.6073 -6.4460 -6.4460 -6.2640 -6.2640 -6.0790 -6.0789 -6.0079 -6.0078 -5.9792 -5.9788 -5.7723 -5.7723 -5.6979 -5.6976 -5.5730 -5.5728 -5.5130 -5.5129 -4.3311 -4.3303 -4.0521 -4.0518 -2.6437 -2.6436 -2.3884 -2.3879 -1.8374 -1.8365 -1.5613 -1.5599 -1.5105 -1.5105 -1.4027 -1.4020 -0.9728 -0.9728 -0.7495 -0.7495 3.6940 3.6941 3.9094 3.9097 5.9930 5.9934 6.0523 6.0525 7.5752 7.5755 7.6817 7.6827 k = 0.1739 0.9079-0.1697 ( 7918 PWs) bands (ev): -23.1273 -23.1273 -23.0129 -23.0129 -20.4656 -20.4656 -20.2736 -20.2736 -14.4667 -14.4667 -14.4316 -14.4315 -13.1302 -13.1302 -13.0984 -13.0984 -11.5047 -11.5047 -11.3126 -11.3126 -8.5399 -8.5399 -8.5070 -8.5070 -6.6150 -6.6147 -6.4465 -6.4465 -6.2670 -6.2670 -6.0693 -6.0692 -6.0048 -6.0046 -5.9805 -5.9801 -5.7694 -5.7693 -5.6977 -5.6974 -5.5758 -5.5757 -5.5090 -5.5089 -4.3365 -4.3358 -4.0460 -4.0458 -2.6518 -2.6517 -2.3862 -2.3858 -1.8477 -1.8468 -1.5610 -1.5597 -1.5129 -1.5128 -1.4003 -1.3997 -0.9725 -0.9724 -0.7399 -0.7398 3.6902 3.6903 3.9156 3.9158 5.9983 5.9986 6.0578 6.0580 7.5551 7.5554 7.6742 7.6752 k = 0.1522 0.9079-0.1697 ( 7920 PWs) bands (ev): -23.1294 -23.1294 -23.0105 -23.0105 -20.4695 -20.4695 -20.2700 -20.2700 -14.4672 -14.4672 -14.4305 -14.4305 -13.1319 -13.1319 -13.0986 -13.0986 -11.5075 -11.5075 -11.3082 -11.3082 -8.5405 -8.5405 -8.5071 -8.5070 -6.6216 -6.6214 -6.4470 -6.4470 -6.2697 -6.2697 -6.0611 -6.0609 -6.0006 -6.0004 -5.9817 -5.9814 -5.7664 -5.7664 -5.6983 -5.6981 -5.5783 -5.5783 -5.5052 -5.5051 -4.3412 -4.3405 -4.0407 -4.0404 -2.6592 -2.6590 -2.3845 -2.3841 -1.8568 -1.8560 -1.5610 -1.5599 -1.5150 -1.5149 -1.3982 -1.3976 -0.9719 -0.9719 -0.7311 -0.7311 3.6869 3.6869 3.9211 3.9213 6.0034 6.0037 6.0627 6.0629 7.5367 7.5370 7.6677 7.6685 k = 0.1304 0.9079-0.1697 ( 7928 PWs) bands (ev): -23.1312 -23.1312 -23.0084 -23.0084 -20.4729 -20.4729 -20.2667 -20.2667 -14.4675 -14.4675 -14.4296 -14.4296 -13.1334 -13.1334 -13.0987 -13.0987 -11.5098 -11.5098 -11.3043 -11.3043 -8.5410 -8.5409 -8.5072 -8.5071 -6.6275 -6.6272 -6.4475 -6.4475 -6.2723 -6.2723 -6.0544 -6.0542 -5.9956 -5.9953 -5.9829 -5.9827 -5.7637 -5.7637 -5.6998 -5.6997 -5.5805 -5.5805 -5.5016 -5.5016 -4.3452 -4.3446 -4.0360 -4.0358 -2.6656 -2.6655 -2.3832 -2.3829 -1.8648 -1.8641 -1.5611 -1.5602 -1.5168 -1.5168 -1.3964 -1.3958 -0.9713 -0.9712 -0.7234 -0.7234 3.6840 3.6840 3.9260 3.9262 6.0082 6.0085 6.0671 6.0673 7.5202 7.5204 7.6619 7.6626 k = 0.1087 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.1328 -23.1328 -23.0067 -23.0067 -20.4758 -20.4758 -20.2640 -20.2640 -14.4679 -14.4679 -14.4288 -14.4288 -13.1348 -13.1348 -13.0989 -13.0989 -11.5118 -11.5118 -11.3010 -11.3010 -8.5413 -8.5413 -8.5073 -8.5073 -6.6325 -6.6323 -6.4479 -6.4479 -6.2745 -6.2745 -6.0492 -6.0491 -5.9900 -5.9898 -5.9839 -5.9837 -5.7613 -5.7613 -5.7019 -5.7018 -5.5822 -5.5822 -5.4985 -5.4984 -4.3485 -4.3480 -4.0320 -4.0318 -2.6712 -2.6711 -2.3822 -2.3820 -1.8716 -1.8710 -1.5614 -1.5605 -1.5184 -1.5184 -1.3948 -1.3944 -0.9706 -0.9706 -0.7167 -0.7167 3.6815 3.6816 3.9302 3.9304 6.0126 6.0128 6.0709 6.0711 7.5058 7.5060 7.6571 7.6577 k = 0.0870 0.9079-0.1697 ( 7932 PWs) bands (ev): -23.1341 -23.1341 -23.0052 -23.0052 -20.4781 -20.4781 -20.2617 -20.2617 -14.4681 -14.4681 -14.4282 -14.4282 -13.1359 -13.1359 -13.0990 -13.0990 -11.5134 -11.5134 -11.2983 -11.2983 -8.5416 -8.5416 -8.5074 -8.5074 -6.6366 -6.6365 -6.4483 -6.4483 -6.2765 -6.2765 -6.0455 -6.0453 -5.9856 -5.9854 -5.9836 -5.9833 -5.7592 -5.7592 -5.7043 -5.7043 -5.5836 -5.5836 -5.4958 -5.4957 -4.3512 -4.3508 -4.0287 -4.0286 -2.6758 -2.6757 -2.3816 -2.3814 -1.8772 -1.8767 -1.5616 -1.5610 -1.5197 -1.5197 -1.3936 -1.3932 -0.9699 -0.9699 -0.7111 -0.7111 3.6795 3.6796 3.9337 3.9338 6.0164 6.0166 6.0741 6.0742 7.4937 7.4939 7.6531 7.6536 k = 0.0652 0.9079-0.1697 ( 7936 PWs) bands (ev): -23.1351 -23.1351 -23.0040 -23.0040 -20.4800 -20.4800 -20.2600 -20.2600 -14.4683 -14.4683 -14.4276 -14.4276 -13.1368 -13.1368 -13.0991 -13.0991 -11.5147 -11.5147 -11.2961 -11.2961 -8.5419 -8.5418 -8.5075 -8.5075 -6.6399 -6.6398 -6.4486 -6.4486 -6.2780 -6.2780 -6.0428 -6.0427 -5.9859 -5.9857 -5.9787 -5.9785 -5.7575 -5.7575 -5.7067 -5.7067 -5.5845 -5.5845 -5.4936 -5.4936 -4.3532 -4.3529 -4.0261 -4.0260 -2.6794 -2.6793 -2.3811 -2.3810 -1.8815 -1.8812 -1.5619 -1.5614 -1.5207 -1.5207 -1.3926 -1.3923 -0.9694 -0.9694 -0.7067 -0.7067 3.6780 3.6780 3.9365 3.9366 6.0195 6.0196 6.0766 6.0767 7.4841 7.4842 7.6500 7.6504 k = 0.0435 0.9079-0.1697 ( 7936 PWs) bands (ev): -23.1358 -23.1358 -23.0032 -23.0032 -20.4814 -20.4814 -20.2587 -20.2587 -14.4685 -14.4685 -14.4273 -14.4273 -13.1374 -13.1374 -13.0992 -13.0992 -11.5156 -11.5156 -11.2946 -11.2946 -8.5420 -8.5420 -8.5076 -8.5076 -6.6422 -6.6422 -6.4488 -6.4488 -6.2791 -6.2791 -6.0411 -6.0410 -5.9864 -5.9863 -5.9746 -5.9744 -5.7562 -5.7562 -5.7088 -5.7088 -5.5852 -5.5852 -5.4920 -5.4920 -4.3546 -4.3544 -4.0243 -4.0242 -2.6819 -2.6819 -2.3808 -2.3807 -1.8847 -1.8844 -1.5621 -1.5617 -1.5214 -1.5214 -1.3919 -1.3917 -0.9690 -0.9690 -0.7035 -0.7035 3.6769 3.6769 3.9384 3.9385 6.0218 6.0219 6.0784 6.0785 7.4772 7.4773 7.6478 7.6480 k = 0.0217 0.9079-0.1697 ( 7944 PWs) bands (ev): -23.1363 -23.1363 -23.0027 -23.0027 -20.4822 -20.4822 -20.2579 -20.2579 -14.4686 -14.4686 -14.4270 -14.4270 -13.1378 -13.1378 -13.0992 -13.0992 -11.5161 -11.5161 -11.2937 -11.2937 -8.5421 -8.5421 -8.5077 -8.5077 -6.6436 -6.6436 -6.4489 -6.4489 -6.2798 -6.2798 -6.0401 -6.0400 -5.9867 -5.9867 -5.9718 -5.9718 -5.7555 -5.7555 -5.7102 -5.7102 -5.5855 -5.5855 -5.4911 -5.4911 -4.3555 -4.3554 -4.0231 -4.0231 -2.6835 -2.6835 -2.3807 -2.3806 -1.8865 -1.8864 -1.5622 -1.5620 -1.5219 -1.5219 -1.3914 -1.3913 -0.9687 -0.9687 -0.7016 -0.7016 3.6762 3.6762 3.9396 3.9397 6.0232 6.0233 6.0795 6.0795 7.4730 7.4730 7.6465 7.6466 k = 0.0000 0.9079-0.1697 ( 7944 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4824 -20.4824 -20.2577 -20.2577 -14.4686 -14.4686 -14.4270 -14.4270 -13.1380 -13.1380 -13.0992 -13.0992 -11.5163 -11.5163 -11.2933 -11.2933 -8.5421 -8.5421 -8.5077 -8.5077 -6.6441 -6.6441 -6.4490 -6.4490 -6.2801 -6.2801 -6.0397 -6.0397 -5.9868 -5.9868 -5.9709 -5.9709 -5.7552 -5.7552 -5.7107 -5.7107 -5.5857 -5.5857 -5.4907 -5.4907 -4.3557 -4.3557 -4.0228 -4.0228 -2.6840 -2.6840 -2.3806 -2.3806 -1.8871 -1.8871 -1.5621 -1.5621 -1.5220 -1.5220 -1.3912 -1.3912 -0.9686 -0.9686 -0.7009 -0.7009 3.6760 3.6760 3.9400 3.9400 6.0237 6.0237 6.0799 6.0799 7.4716 7.4716 7.6461 7.6461 k = 0.0000 0.9079-0.1697 ( 7944 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4824 -20.4824 -20.2577 -20.2577 -14.4686 -14.4686 -14.4270 -14.4270 -13.1380 -13.1380 -13.0992 -13.0992 -11.5163 -11.5163 -11.2933 -11.2933 -8.5421 -8.5421 -8.5077 -8.5077 -6.6441 -6.6441 -6.4490 -6.4490 -6.2801 -6.2801 -6.0397 -6.0397 -5.9868 -5.9868 -5.9709 -5.9709 -5.7552 -5.7552 -5.7107 -5.7107 -5.5857 -5.5857 -5.4907 -5.4907 -4.3557 -4.3557 -4.0228 -4.0228 -2.6840 -2.6840 -2.3806 -2.3806 -1.8871 -1.8871 -1.5621 -1.5621 -1.5220 -1.5220 -1.3912 -1.3912 -0.9686 -0.9686 -0.7009 -0.7009 3.6760 3.6760 3.9400 3.9400 6.0237 6.0237 6.0799 6.0799 7.4716 7.4716 7.6461 7.6461 k = 0.0000 0.9118-0.1490 ( 7940 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4824 -20.4824 -20.2577 -20.2577 -14.4687 -14.4687 -14.4269 -14.4269 -13.1383 -13.1383 -13.0989 -13.0989 -11.5161 -11.5161 -11.2935 -11.2935 -8.5422 -8.5422 -8.5076 -8.5075 -6.6441 -6.6440 -6.4492 -6.4489 -6.2801 -6.2797 -6.0400 -6.0400 -5.9910 -5.9897 -5.9678 -5.9665 -5.7556 -5.7555 -5.7110 -5.7109 -5.5853 -5.5852 -5.4905 -5.4903 -4.3557 -4.3556 -4.0227 -4.0227 -2.6840 -2.6840 -2.3808 -2.3808 -1.8881 -1.8879 -1.5610 -1.5608 -1.5234 -1.5231 -1.3902 -1.3899 -0.9686 -0.9685 -0.7013 -0.7012 3.6754 3.6754 3.9404 3.9405 6.0233 6.0234 6.0805 6.0806 7.4722 7.4723 7.6470 7.6470 k = 0.0000 0.9157-0.1284 ( 7940 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4824 -20.4824 -20.2577 -20.2577 -14.4689 -14.4689 -14.4267 -14.4267 -13.1391 -13.1391 -13.0981 -13.0981 -11.5157 -11.5157 -11.2940 -11.2940 -8.5426 -8.5425 -8.5073 -8.5072 -6.6439 -6.6438 -6.4496 -6.4491 -6.2797 -6.2789 -6.0409 -6.0409 -5.9978 -5.9961 -5.9608 -5.9591 -5.7566 -5.7565 -5.7118 -5.7116 -5.5842 -5.5839 -5.4895 -5.4892 -4.3555 -4.3554 -4.0224 -4.0223 -2.6840 -2.6839 -2.3814 -2.3814 -1.8909 -1.8906 -1.5577 -1.5573 -1.5272 -1.5267 -1.3870 -1.3863 -0.9684 -0.9682 -0.7023 -0.7022 3.6738 3.6738 3.9416 3.9417 6.0222 6.0224 6.0823 6.0825 7.4740 7.4741 7.6497 7.6498 k = 0.0000 0.9195-0.1077 ( 7940 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4824 -20.4824 -20.2577 -20.2577 -14.4693 -14.4693 -14.4263 -14.4263 -13.1405 -13.1405 -13.0969 -13.0968 -11.5149 -11.5149 -11.2947 -11.2947 -8.5431 -8.5429 -8.5068 -8.5066 -6.6437 -6.6436 -6.4502 -6.4495 -6.2790 -6.2779 -6.0426 -6.0425 -6.0046 -6.0030 -5.9528 -5.9511 -5.7581 -5.7580 -5.7131 -5.7129 -5.5824 -5.5819 -5.4880 -5.4876 -4.3552 -4.3551 -4.0218 -4.0218 -2.6839 -2.6839 -2.3824 -2.3823 -1.8953 -1.8949 -1.5523 -1.5517 -1.5329 -1.5322 -1.3819 -1.3809 -0.9681 -0.9678 -0.7039 -0.7037 3.6712 3.6712 3.9435 3.9436 6.0205 6.0208 6.0851 6.0854 7.4771 7.4772 7.6542 7.6543 k = 0.0000 0.9234-0.0870 ( 7929 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4825 -20.4825 -20.2577 -20.2577 -14.4698 -14.4698 -14.4258 -14.4258 -13.1422 -13.1422 -13.0953 -13.0952 -11.5139 -11.5139 -11.2958 -11.2958 -8.5438 -8.5436 -8.5061 -8.5059 -6.6434 -6.6432 -6.4509 -6.4499 -6.2780 -6.2766 -6.0452 -6.0451 -6.0109 -6.0094 -5.9445 -5.9428 -5.7603 -5.7601 -5.7149 -5.7146 -5.5797 -5.5792 -5.4858 -5.4853 -4.3547 -4.3546 -4.0211 -4.0211 -2.6838 -2.6837 -2.3837 -2.3836 -1.9012 -1.9007 -1.5460 -1.5450 -1.5391 -1.5387 -1.3754 -1.3743 -0.9675 -0.9671 -0.7061 -0.7059 3.6676 3.6677 3.9460 3.9461 6.0185 6.0188 6.0889 6.0892 7.4813 7.4815 7.6605 7.6607 k = 0.0000 0.9273-0.0663 ( 7934 PWs) bands (ev): -23.1364 -23.1364 -23.0025 -23.0025 -20.4825 -20.4825 -20.2577 -20.2577 -14.4705 -14.4705 -14.4252 -14.4252 -13.1442 -13.1442 -13.0934 -13.0933 -11.5126 -11.5126 -11.2971 -11.2971 -8.5446 -8.5443 -8.5052 -8.5050 -6.6430 -6.6428 -6.4517 -6.4505 -6.2768 -6.2751 -6.0489 -6.0487 -6.0161 -6.0148 -5.9363 -5.9346 -5.7629 -5.7627 -5.7172 -5.7168 -5.5763 -5.5757 -5.4832 -5.4826 -4.3542 -4.3541 -4.0203 -4.0203 -2.6836 -2.6836 -2.3854 -2.3853 -1.9081 -1.9075 -1.5496 -1.5484 -1.5351 -1.5345 -1.3680 -1.3667 -0.9669 -0.9664 -0.7088 -0.7086 3.6633 3.6634 3.9491 3.9492 6.0162 6.0166 6.0933 6.0937 7.4867 7.4869 7.6685 7.6687 k = 0.0000 0.9311-0.0456 ( 7929 PWs) bands (ev): -23.1365 -23.1365 -23.0025 -23.0025 -20.4825 -20.4825 -20.2577 -20.2577 -14.4712 -14.4712 -14.4245 -14.4245 -13.1464 -13.1464 -13.0913 -13.0913 -11.5110 -11.5110 -11.2987 -11.2987 -8.5454 -8.5452 -8.5042 -8.5040 -6.6426 -6.6424 -6.4523 -6.4510 -6.2754 -6.2734 -6.0539 -6.0535 -6.0202 -6.0191 -5.9281 -5.9265 -5.7659 -5.7658 -5.7199 -5.7194 -5.5722 -5.5715 -5.4803 -5.4796 -4.3535 -4.3534 -4.0193 -4.0193 -2.6834 -2.6834 -2.3873 -2.3872 -1.9157 -1.9151 -1.5583 -1.5571 -1.5253 -1.5246 -1.3599 -1.3586 -0.9660 -0.9655 -0.7121 -0.7118 3.6583 3.6584 3.9526 3.9527 6.0139 6.0143 6.0983 6.0987 7.4931 7.4934 7.6783 7.6785 k = 0.0000 0.9350-0.0249 ( 7929 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4720 -14.4720 -14.4238 -14.4238 -13.1488 -13.1488 -13.0892 -13.0892 -11.5093 -11.5092 -11.3005 -11.3004 -8.5464 -8.5461 -8.5032 -8.5030 -6.6423 -6.6420 -6.4529 -6.4515 -6.2740 -6.2718 -6.0598 -6.0592 -6.0232 -6.0223 -5.9201 -5.9185 -5.7693 -5.7691 -5.7229 -5.7224 -5.5674 -5.5667 -5.4771 -5.4764 -4.3528 -4.3526 -4.0182 -4.0182 -2.6832 -2.6832 -2.3896 -2.3894 -1.9239 -1.9232 -1.5677 -1.5665 -1.5145 -1.5137 -1.3516 -1.3502 -0.9650 -0.9644 -0.7158 -0.7155 3.6528 3.6529 3.9563 3.9565 6.0115 6.0119 6.1036 6.1040 7.5005 7.5009 7.6897 7.6900 k = 0.0000 0.9389-0.0042 ( 7927 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4729 -14.4729 -14.4230 -14.4230 -13.1512 -13.1511 -13.0870 -13.0870 -11.5074 -11.5073 -11.3025 -11.3024 -8.5473 -8.5471 -8.5021 -8.5019 -6.6419 -6.6416 -6.4533 -6.4517 -6.2725 -6.2701 -6.0662 -6.0655 -6.0255 -6.0248 -5.9122 -5.9106 -5.7729 -5.7728 -5.7263 -5.7257 -5.5620 -5.5612 -5.4738 -5.4730 -4.3519 -4.3517 -4.0170 -4.0170 -2.6830 -2.6830 -2.3920 -2.3919 -1.9322 -1.9316 -1.5773 -1.5762 -1.5032 -1.5023 -1.3433 -1.3418 -0.9639 -0.9632 -0.7199 -0.7195 3.6469 3.6470 3.9603 3.9605 6.0092 6.0096 6.1092 6.1096 7.5088 7.5092 7.7028 7.7032 k = 0.0000 0.9427 0.0165 ( 7927 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2577 -20.2577 -14.4738 -14.4738 -14.4223 -14.4222 -13.1536 -13.1535 -13.0849 -13.0848 -11.5053 -11.5052 -11.3046 -11.3046 -8.5483 -8.5481 -8.5009 -8.5007 -6.6417 -6.6413 -6.4534 -6.4518 -6.2711 -6.2686 -6.0730 -6.0722 -6.0272 -6.0266 -5.9045 -5.9029 -5.7767 -5.7766 -5.7300 -5.7294 -5.5560 -5.5553 -5.4705 -5.4696 -4.3509 -4.3507 -4.0158 -4.0157 -2.6827 -2.6827 -2.3946 -2.3945 -1.9406 -1.9399 -1.5869 -1.5858 -1.4917 -1.4907 -1.3350 -1.3335 -0.9627 -0.9619 -0.7242 -0.7238 3.6407 3.6408 3.9644 3.9645 6.0070 6.0074 6.1148 6.1153 7.5179 7.5182 7.7176 7.7180 k = 0.0000 0.9466 0.0372 ( 7909 PWs) bands (ev): -23.1365 -23.1365 -23.0026 -23.0026 -20.4825 -20.4825 -20.2576 -20.2576 -14.4747 -14.4747 -14.4215 -14.4215 -13.1559 -13.1559 -13.0827 -13.0827 -11.5031 -11.5030 -11.3068 -11.3068 -8.5492 -8.5491 -8.4998 -8.4996 -6.6415 -6.6412 -6.4531 -6.4515 -6.2698 -6.2673 -6.0797 -6.0789 -6.0285 -6.0281 -5.8968 -5.8953 -5.7807 -5.7806 -5.7340 -5.7333 -5.5496 -5.5488 -5.4673 -5.4664 -4.3498 -4.3496 -4.0145 -4.0145 -2.6825 -2.6824 -2.3973 -2.3972 -1.9488 -1.9481 -1.5963 -1.5952 -1.4802 -1.4793 -1.3270 -1.3255 -0.9613 -0.9605 -0.7288 -0.7284 3.6345 3.6346 3.9684 3.9685 6.0049 6.0053 6.1206 6.1210 7.5275 7.5278 7.7339 7.7343 k = 0.0000 0.9505 0.0579 ( 7926 PWs) bands (ev): -23.1366 -23.1366 -23.0026 -23.0026 -20.4826 -20.4825 -20.2576 -20.2576 -14.4757 -14.4757 -14.4207 -14.4207 -13.1582 -13.1582 -13.0807 -13.0806 -11.5008 -11.5008 -11.3091 -11.3091 -8.5501 -8.5500 -8.4987 -8.4985 -6.6415 -6.6411 -6.4526 -6.4509 -6.2688 -6.2662 -6.0863 -6.0855 -6.0296 -6.0293 -5.8894 -5.8879 -5.7846 -5.7845 -5.7382 -5.7375 -5.5428 -5.5420 -5.4643 -5.4633 -4.3487 -4.3485 -4.0133 -4.0133 -2.6821 -2.6821 -2.4001 -2.3999 -1.9565 -1.9559 -1.6055 -1.6044 -1.4691 -1.4682 -1.3193 -1.3178 -0.9598 -0.9591 -0.7334 -0.7330 3.6283 3.6283 3.9723 3.9724 6.0030 6.0034 6.1262 6.1266 7.5375 7.5378 7.7515 7.7520 k = 0.0000 0.9543 0.0786 ( 7921 PWs) bands (ev): -23.1366 -23.1366 -23.0026 -23.0026 -20.4826 -20.4826 -20.2577 -20.2577 -14.4766 -14.4766 -14.4200 -14.4200 -13.1604 -13.1604 -13.0787 -13.0787 -11.4986 -11.4986 -11.3114 -11.3114 -8.5510 -8.5509 -8.4976 -8.4975 -6.6416 -6.6412 -6.4516 -6.4500 -6.2680 -6.2655 -6.0925 -6.0917 -6.0306 -6.0303 -5.8821 -5.8806 -5.7885 -5.7884 -5.7426 -5.7419 -5.5356 -5.5348 -5.4615 -5.4605 -4.3475 -4.3473 -4.0121 -4.0121 -2.6818 -2.6817 -2.4029 -2.4027 -1.9638 -1.9632 -1.6142 -1.6132 -1.4586 -1.4577 -1.3120 -1.3106 -0.9584 -0.9576 -0.7381 -0.7376 3.6221 3.6222 3.9760 3.9762 6.0012 6.0016 6.1318 6.1321 7.5476 7.5479 7.7703 7.7708 k = 0.0000 0.9582 0.0993 ( 7927 PWs) bands (ev): -23.1366 -23.1366 -23.0026 -23.0026 -20.4826 -20.4826 -20.2577 -20.2577 -14.4775 -14.4775 -14.4193 -14.4193 -13.1625 -13.1625 -13.0769 -13.0768 -11.4964 -11.4964 -11.3137 -11.3136 -8.5518 -8.5517 -8.4966 -8.4965 -6.6419 -6.6415 -6.4503 -6.4487 -6.2676 -6.2651 -6.0982 -6.0975 -6.0313 -6.0311 -5.8749 -5.8735 -5.7923 -5.7921 -5.7472 -5.7464 -5.5282 -5.5275 -5.4591 -5.4581 -4.3462 -4.3460 -4.0110 -4.0110 -2.6815 -2.6814 -2.4056 -2.4054 -1.9704 -1.9699 -1.6224 -1.6215 -1.4488 -1.4480 -1.3052 -1.3039 -0.9569 -0.9561 -0.7425 -0.7420 3.6162 3.6163 3.9796 3.9797 5.9996 5.9999 6.1370 6.1374 7.5578 7.5581 7.7895 7.7900 k = 0.0000 0.9621 0.1200 ( 7932 PWs) bands (ev): -23.1366 -23.1366 -23.0027 -23.0027 -20.4826 -20.4826 -20.2577 -20.2577 -14.4783 -14.4783 -14.4188 -14.4188 -13.1644 -13.1644 -13.0752 -13.0751 -11.4944 -11.4943 -11.3158 -11.3158 -8.5525 -8.5524 -8.4956 -8.4956 -6.6422 -6.6418 -6.4487 -6.4472 -6.2675 -6.2651 -6.1034 -6.1028 -6.0320 -6.0317 -5.8678 -5.8664 -5.7958 -5.7956 -5.7519 -5.7512 -5.5208 -5.5200 -5.4571 -5.4561 -4.3449 -4.3448 -4.0100 -4.0100 -2.6811 -2.6810 -2.4082 -2.4080 -1.9763 -1.9758 -1.6301 -1.6293 -1.4401 -1.4393 -1.2989 -1.2978 -0.9554 -0.9548 -0.7466 -0.7462 3.6106 3.6107 3.9828 3.9829 5.9981 5.9984 6.1420 6.1423 7.5677 7.5680 7.8079 7.8084 k = 0.5000 0.8537 0.4595 ( 7920 PWs) bands (ev): -23.0719 -23.0719 -23.0719 -23.0719 -20.3686 -20.3686 -20.3686 -20.3686 -14.4540 -14.4540 -14.4540 -14.4540 -13.1034 -13.1034 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5179 -8.5179 -8.5178 -8.5178 -6.4670 -6.4670 -6.4661 -6.4661 -6.2347 -6.2347 -6.2340 -6.2340 -6.0335 -6.0335 -6.0331 -6.0331 -5.7720 -5.7720 -5.7717 -5.7717 -5.4739 -5.4739 -5.4732 -5.4732 -4.1845 -4.1845 -4.1840 -4.1840 -2.4953 -2.4953 -2.4948 -2.4948 -1.6639 -1.6639 -1.6628 -1.6628 -1.4607 -1.4607 -1.4599 -1.4599 -0.9091 -0.9091 -0.9088 -0.9088 3.7924 3.7924 3.7926 3.7926 5.9867 5.9867 5.9870 5.9870 7.7692 7.7692 7.7699 7.7699 k = 0.5000 0.8313 0.4595 ( 7916 PWs) bands (ev): -23.0721 -23.0721 -23.0721 -23.0721 -20.3687 -20.3687 -20.3687 -20.3687 -14.4555 -14.4555 -14.4555 -14.4555 -13.1035 -13.1035 -13.1034 -13.1034 -11.4191 -11.4191 -11.4191 -11.4191 -8.5174 -8.5174 -8.5174 -8.5174 -6.4675 -6.4675 -6.4666 -6.4666 -6.2294 -6.2294 -6.2285 -6.2285 -6.0311 -6.0311 -6.0307 -6.0307 -5.7695 -5.7695 -5.7692 -5.7692 -5.4760 -5.4760 -5.4752 -5.4752 -4.1842 -4.1842 -4.1836 -4.1836 -2.4932 -2.4932 -2.4927 -2.4927 -1.6652 -1.6652 -1.6641 -1.6641 -1.4601 -1.4601 -1.4592 -1.4592 -0.9083 -0.9083 -0.9080 -0.9080 3.7900 3.7900 3.7903 3.7903 5.9852 5.9852 5.9855 5.9855 7.7591 7.7591 7.7599 7.7599 k = 0.5000 0.8088 0.4595 ( 7910 PWs) bands (ev): -23.0724 -23.0724 -23.0724 -23.0724 -20.3688 -20.3688 -20.3688 -20.3688 -14.4575 -14.4575 -14.4575 -14.4575 -13.1036 -13.1036 -13.1035 -13.1035 -11.4191 -11.4191 -11.4191 -11.4191 -8.5169 -8.5169 -8.5168 -8.5168 -6.4679 -6.4679 -6.4669 -6.4669 -6.2225 -6.2225 -6.2216 -6.2216 -6.0282 -6.0282 -6.0278 -6.0278 -5.7664 -5.7664 -5.7661 -5.7661 -5.4781 -5.4781 -5.4773 -5.4773 -4.1839 -4.1839 -4.1833 -4.1833 -2.4906 -2.4906 -2.4900 -2.4900 -1.6666 -1.6666 -1.6655 -1.6655 -1.4593 -1.4593 -1.4584 -1.4584 -0.9075 -0.9075 -0.9072 -0.9072 3.7869 3.7869 3.7872 3.7872 5.9832 5.9832 5.9836 5.9836 7.7440 7.7440 7.7449 7.7449 k = 0.5000 0.7863 0.4595 ( 7908 PWs) bands (ev): -23.0727 -23.0727 -23.0727 -23.0727 -20.3689 -20.3689 -20.3689 -20.3689 -14.4599 -14.4599 -14.4599 -14.4599 -13.1037 -13.1037 -13.1037 -13.1037 -11.4191 -11.4191 -11.4190 -11.4190 -8.5162 -8.5162 -8.5161 -8.5161 -6.4680 -6.4680 -6.4670 -6.4670 -6.2142 -6.2142 -6.2132 -6.2132 -6.0248 -6.0248 -6.0243 -6.0243 -5.7626 -5.7626 -5.7622 -5.7622 -5.4803 -5.4803 -5.4795 -5.4795 -4.1835 -4.1835 -4.1829 -4.1829 -2.4874 -2.4874 -2.4868 -2.4868 -1.6682 -1.6682 -1.6671 -1.6671 -1.4584 -1.4584 -1.4575 -1.4575 -0.9068 -0.9068 -0.9063 -0.9063 3.7830 3.7830 3.7832 3.7832 5.9808 5.9808 5.9812 5.9812 7.7245 7.7245 7.7254 7.7254 k = 0.5000 0.7639 0.4595 ( 7902 PWs) bands (ev): -23.0731 -23.0731 -23.0731 -23.0731 -20.3691 -20.3691 -20.3691 -20.3691 -14.4628 -14.4628 -14.4628 -14.4628 -13.1039 -13.1039 -13.1039 -13.1039 -11.4190 -11.4190 -11.4190 -11.4190 -8.5154 -8.5154 -8.5154 -8.5154 -6.4680 -6.4680 -6.4670 -6.4670 -6.2046 -6.2046 -6.2036 -6.2036 -6.0208 -6.0208 -6.0203 -6.0203 -5.7581 -5.7581 -5.7576 -5.7576 -5.4825 -5.4825 -5.4817 -5.4817 -4.1832 -4.1832 -4.1825 -4.1825 -2.4836 -2.4836 -2.4830 -2.4830 -1.6700 -1.6700 -1.6688 -1.6688 -1.4573 -1.4573 -1.4565 -1.4565 -0.9060 -0.9060 -0.9055 -0.9055 3.7782 3.7782 3.7785 3.7785 5.9779 5.9779 5.9783 5.9783 7.7013 7.7013 7.7023 7.7023 k = 0.5000 0.7414 0.4595 ( 7900 PWs) bands (ev): -23.0735 -23.0735 -23.0735 -23.0735 -20.3693 -20.3693 -20.3693 -20.3693 -14.4662 -14.4662 -14.4662 -14.4662 -13.1041 -13.1041 -13.1041 -13.1041 -11.4190 -11.4190 -11.4190 -11.4190 -8.5146 -8.5146 -8.5145 -8.5145 -6.4677 -6.4677 -6.4667 -6.4667 -6.1939 -6.1939 -6.1928 -6.1928 -6.0163 -6.0163 -6.0157 -6.0157 -5.7527 -5.7527 -5.7522 -5.7522 -5.4848 -5.4848 -5.4840 -5.4840 -4.1828 -4.1828 -4.1821 -4.1821 -2.4793 -2.4793 -2.4788 -2.4788 -1.6719 -1.6719 -1.6707 -1.6707 -1.4562 -1.4562 -1.4553 -1.4553 -0.9053 -0.9053 -0.9047 -0.9047 3.7726 3.7726 3.7729 3.7729 5.9746 5.9746 5.9750 5.9750 7.6749 7.6749 7.6759 7.6759 k = 0.5000 0.7189 0.4595 ( 7906 PWs) bands (ev): -23.0740 -23.0740 -23.0740 -23.0740 -20.3695 -20.3695 -20.3695 -20.3695 -14.4699 -14.4699 -14.4699 -14.4699 -13.1044 -13.1044 -13.1044 -13.1044 -11.4189 -11.4189 -11.4189 -11.4189 -8.5137 -8.5137 -8.5136 -8.5136 -6.4673 -6.4673 -6.4663 -6.4663 -6.1821 -6.1821 -6.1810 -6.1810 -6.0112 -6.0112 -6.0105 -6.0105 -5.7466 -5.7466 -5.7459 -5.7459 -5.4871 -5.4871 -5.4862 -5.4862 -4.1825 -4.1825 -4.1817 -4.1817 -2.4746 -2.4746 -2.4740 -2.4740 -1.6740 -1.6740 -1.6728 -1.6728 -1.4550 -1.4550 -1.4541 -1.4541 -0.9045 -0.9045 -0.9040 -0.9040 3.7662 3.7662 3.7665 3.7665 5.9708 5.9708 5.9712 5.9712 7.6455 7.6455 7.6465 7.6465 k = 0.5000 0.6965 0.4595 ( 7910 PWs) bands (ev): -23.0746 -23.0746 -23.0746 -23.0746 -20.3697 -20.3697 -20.3697 -20.3697 -14.4741 -14.4741 -14.4741 -14.4741 -13.1047 -13.1047 -13.1047 -13.1047 -11.4189 -11.4189 -11.4189 -11.4189 -8.5128 -8.5128 -8.5127 -8.5127 -6.4667 -6.4667 -6.4656 -6.4656 -6.1695 -6.1695 -6.1683 -6.1683 -6.0055 -6.0055 -6.0048 -6.0048 -5.7395 -5.7395 -5.7388 -5.7388 -5.4894 -5.4894 -5.4884 -5.4884 -4.1821 -4.1821 -4.1813 -4.1813 -2.4693 -2.4693 -2.4687 -2.4687 -1.6762 -1.6762 -1.6750 -1.6750 -1.4538 -1.4538 -1.4528 -1.4528 -0.9039 -0.9039 -0.9032 -0.9032 3.7590 3.7590 3.7593 3.7593 5.9665 5.9665 5.9670 5.9670 7.6134 7.6134 7.6144 7.6144 k = 0.5000 0.6740 0.4595 ( 7916 PWs) bands (ev): -23.0752 -23.0752 -23.0752 -23.0752 -20.3700 -20.3700 -20.3700 -20.3700 -14.4786 -14.4786 -14.4786 -14.4786 -13.1050 -13.1050 -13.1050 -13.1050 -11.4188 -11.4188 -11.4188 -11.4188 -8.5118 -8.5118 -8.5117 -8.5117 -6.4659 -6.4659 -6.4648 -6.4648 -6.1562 -6.1562 -6.1550 -6.1550 -5.9992 -5.9992 -5.9984 -5.9984 -5.7316 -5.7316 -5.7308 -5.7308 -5.4917 -5.4917 -5.4906 -5.4906 -4.1818 -4.1818 -4.1809 -4.1809 -2.4637 -2.4637 -2.4630 -2.4630 -1.6786 -1.6786 -1.6774 -1.6774 -1.4524 -1.4524 -1.4515 -1.4515 -0.9033 -0.9033 -0.9026 -0.9026 3.7510 3.7510 3.7513 3.7513 5.9619 5.9619 5.9624 5.9624 7.5789 7.5789 7.5799 7.5799 k = 0.5000 0.6515 0.4595 ( 7902 PWs) bands (ev): -23.0758 -23.0758 -23.0758 -23.0758 -20.3703 -20.3703 -20.3702 -20.3702 -14.4834 -14.4834 -14.4834 -14.4834 -13.1054 -13.1054 -13.1054 -13.1054 -11.4187 -11.4187 -11.4187 -11.4187 -8.5107 -8.5107 -8.5106 -8.5106 -6.4650 -6.4650 -6.4639 -6.4639 -6.1426 -6.1426 -6.1413 -6.1413 -5.9921 -5.9921 -5.9912 -5.9912 -5.7227 -5.7227 -5.7218 -5.7218 -5.4939 -5.4939 -5.4928 -5.4928 -4.1814 -4.1814 -4.1805 -4.1805 -2.4576 -2.4576 -2.4569 -2.4569 -1.6811 -1.6811 -1.6798 -1.6798 -1.4511 -1.4511 -1.4501 -1.4501 -0.9027 -0.9027 -0.9020 -0.9020 3.7422 3.7422 3.7424 3.7424 5.9568 5.9568 5.9573 5.9573 7.5421 7.5421 7.5430 7.5430 k = 0.5000 0.6291 0.4595 ( 7890 PWs) bands (ev): -23.0765 -23.0765 -23.0765 -23.0765 -20.3705 -20.3705 -20.3705 -20.3705 -14.4885 -14.4885 -14.4885 -14.4885 -13.1058 -13.1058 -13.1058 -13.1058 -11.4187 -11.4187 -11.4186 -11.4186 -8.5096 -8.5096 -8.5095 -8.5095 -6.4639 -6.4639 -6.4628 -6.4628 -6.1288 -6.1288 -6.1276 -6.1276 -5.9843 -5.9843 -5.9833 -5.9833 -5.7128 -5.7128 -5.7119 -5.7119 -5.4960 -5.4960 -5.4948 -5.4948 -4.1810 -4.1810 -4.1800 -4.1800 -2.4512 -2.4512 -2.4505 -2.4505 -1.6837 -1.6837 -1.6824 -1.6824 -1.4498 -1.4498 -1.4488 -1.4488 -0.9022 -0.9022 -0.9015 -0.9015 3.7325 3.7325 3.7328 3.7328 5.9513 5.9513 5.9518 5.9518 7.5031 7.5031 7.5040 7.5040 k = 0.5000 0.6066 0.4595 ( 7898 PWs) bands (ev): -23.0772 -23.0772 -23.0772 -23.0772 -20.3709 -20.3709 -20.3708 -20.3708 -14.4939 -14.4939 -14.4939 -14.4939 -13.1063 -13.1063 -13.1063 -13.1063 -11.4186 -11.4186 -11.4186 -11.4186 -8.5084 -8.5084 -8.5083 -8.5083 -6.4627 -6.4627 -6.4616 -6.4616 -6.1152 -6.1152 -6.1140 -6.1140 -5.9754 -5.9754 -5.9743 -5.9743 -5.7020 -5.7020 -5.7010 -5.7010 -5.4980 -5.4980 -5.4967 -5.4967 -4.1806 -4.1806 -4.1796 -4.1796 -2.4445 -2.4445 -2.4437 -2.4437 -1.6864 -1.6864 -1.6851 -1.6851 -1.4485 -1.4485 -1.4475 -1.4475 -0.9018 -0.9018 -0.9010 -0.9010 3.7221 3.7221 3.7224 3.7224 5.9453 5.9453 5.9459 5.9459 7.4621 7.4621 7.4629 7.4629 k = 0.5000 0.5841 0.4595 ( 7904 PWs) bands (ev): -23.0780 -23.0780 -23.0780 -23.0780 -20.3712 -20.3712 -20.3712 -20.3712 -14.4995 -14.4995 -14.4995 -14.4995 -13.1068 -13.1068 -13.1068 -13.1068 -11.4185 -11.4185 -11.4185 -11.4185 -8.5073 -8.5073 -8.5072 -8.5072 -6.4613 -6.4613 -6.4603 -6.4603 -6.1022 -6.1022 -6.1011 -6.1011 -5.9654 -5.9654 -5.9643 -5.9643 -5.6903 -5.6903 -5.6891 -5.6891 -5.4999 -5.4999 -5.4984 -5.4984 -4.1802 -4.1802 -4.1792 -4.1792 -2.4374 -2.4374 -2.4367 -2.4367 -1.6892 -1.6892 -1.6879 -1.6879 -1.4473 -1.4473 -1.4462 -1.4462 -0.9015 -0.9015 -0.9007 -0.9007 3.7110 3.7110 3.7113 3.7113 5.9391 5.9391 5.9396 5.9396 7.4194 7.4194 7.4201 7.4201 k = 0.5000 0.5617 0.4595 ( 7904 PWs) bands (ev): -23.0788 -23.0788 -23.0787 -23.0787 -20.3715 -20.3715 -20.3715 -20.3715 -14.5053 -14.5053 -14.5053 -14.5053 -13.1073 -13.1073 -13.1073 -13.1073 -11.4184 -11.4184 -11.4184 -11.4184 -8.5061 -8.5061 -8.5060 -8.5060 -6.4599 -6.4599 -6.4589 -6.4589 -6.0900 -6.0900 -6.0889 -6.0889 -5.9542 -5.9542 -5.9529 -5.9529 -5.6777 -5.6777 -5.6764 -5.6764 -5.5014 -5.5014 -5.4999 -5.4999 -4.1799 -4.1799 -4.1788 -4.1788 -2.4302 -2.4302 -2.4294 -2.4294 -1.6921 -1.6921 -1.6908 -1.6908 -1.4462 -1.4462 -1.4451 -1.4451 -0.9013 -0.9013 -0.9005 -0.9005 3.6991 3.6991 3.6994 3.6994 5.9325 5.9325 5.9330 5.9330 7.3751 7.3751 7.3758 7.3758 k = 0.5000 0.5392 0.4595 ( 7902 PWs) bands (ev): -23.0796 -23.0796 -23.0796 -23.0796 -20.3719 -20.3719 -20.3719 -20.3719 -14.5112 -14.5112 -14.5112 -14.5112 -13.1079 -13.1079 -13.1079 -13.1079 -11.4184 -11.4184 -11.4183 -11.4183 -8.5049 -8.5049 -8.5048 -8.5048 -6.4584 -6.4584 -6.4574 -6.4574 -6.0790 -6.0790 -6.0780 -6.0780 -5.9415 -5.9415 -5.9402 -5.9402 -5.6643 -5.6643 -5.6629 -5.6629 -5.5027 -5.5027 -5.5010 -5.5010 -4.1795 -4.1795 -4.1783 -4.1783 -2.4227 -2.4227 -2.4219 -2.4219 -1.6950 -1.6950 -1.6937 -1.6937 -1.4452 -1.4452 -1.4441 -1.4441 -0.9012 -0.9012 -0.9003 -0.9003 3.6866 3.6866 3.6869 3.6869 5.9256 5.9256 5.9261 5.9261 7.3295 7.3295 7.3302 7.3302 k = 0.5000 0.5167 0.4595 ( 7896 PWs) bands (ev): -23.0804 -23.0804 -23.0804 -23.0804 -20.3722 -20.3722 -20.3722 -20.3722 -14.5173 -14.5173 -14.5173 -14.5173 -13.1085 -13.1085 -13.1085 -13.1085 -11.4183 -11.4183 -11.4183 -11.4183 -8.5037 -8.5037 -8.5036 -8.5036 -6.4569 -6.4569 -6.4559 -6.4559 -6.0692 -6.0692 -6.0683 -6.0683 -5.9275 -5.9275 -5.9261 -5.9261 -5.6503 -5.6503 -5.6487 -5.6487 -5.5034 -5.5034 -5.5015 -5.5015 -4.1790 -4.1790 -4.1779 -4.1779 -2.4152 -2.4152 -2.4143 -2.4143 -1.6980 -1.6980 -1.6967 -1.6967 -1.4444 -1.4444 -1.4432 -1.4432 -0.9011 -0.9011 -0.9003 -0.9003 3.6735 3.6735 3.6738 3.6738 5.9184 5.9184 5.9190 5.9190 7.2831 7.2831 7.2837 7.2837 k = 0.5000 0.4943 0.4595 ( 7894 PWs) bands (ev): -23.0812 -23.0812 -23.0812 -23.0812 -20.3726 -20.3726 -20.3726 -20.3726 -14.5234 -14.5234 -14.5234 -14.5234 -13.1091 -13.1091 -13.1091 -13.1091 -11.4182 -11.4182 -11.4182 -11.4182 -8.5025 -8.5025 -8.5024 -8.5024 -6.4553 -6.4553 -6.4543 -6.4543 -6.0607 -6.0607 -6.0599 -6.0599 -5.9123 -5.9123 -5.9107 -5.9107 -5.6360 -5.6360 -5.6342 -5.6342 -5.5034 -5.5034 -5.5014 -5.5014 -4.1786 -4.1786 -4.1774 -4.1774 -2.4075 -2.4075 -2.4066 -2.4066 -1.7010 -1.7010 -1.6997 -1.6997 -1.4437 -1.4437 -1.4426 -1.4426 -0.9012 -0.9012 -0.9003 -0.9003 3.6599 3.6599 3.6601 3.6601 5.9110 5.9110 5.9115 5.9115 7.2361 7.2361 7.2367 7.2367 k = 0.5000 0.4718 0.4595 ( 7888 PWs) bands (ev): -23.0821 -23.0821 -23.0821 -23.0821 -20.3729 -20.3729 -20.3729 -20.3729 -14.5296 -14.5296 -14.5296 -14.5296 -13.1098 -13.1098 -13.1097 -13.1097 -11.4181 -11.4181 -11.4181 -11.4181 -8.5013 -8.5013 -8.5011 -8.5011 -6.4537 -6.4537 -6.4527 -6.4527 -6.0535 -6.0535 -6.0527 -6.0527 -5.8959 -5.8959 -5.8943 -5.8943 -5.6216 -5.6216 -5.6197 -5.6197 -5.5025 -5.5025 -5.5002 -5.5002 -4.1782 -4.1782 -4.1770 -4.1770 -2.3998 -2.3998 -2.3989 -2.3989 -1.7040 -1.7040 -1.7027 -1.7027 -1.4433 -1.4433 -1.4421 -1.4421 -0.9013 -0.9013 -0.9004 -0.9004 3.6458 3.6458 3.6460 3.6460 5.9034 5.9034 5.9040 5.9040 7.1888 7.1888 7.1894 7.1894 k = 0.5000 0.4493 0.4595 ( 7882 PWs) bands (ev): -23.0829 -23.0829 -23.0829 -23.0829 -20.3733 -20.3733 -20.3733 -20.3733 -14.5357 -14.5357 -14.5357 -14.5357 -13.1104 -13.1104 -13.1104 -13.1104 -11.4181 -11.4181 -11.4181 -11.4181 -8.5001 -8.5001 -8.5000 -8.5000 -6.4520 -6.4520 -6.4511 -6.4511 -6.0475 -6.0475 -6.0468 -6.0468 -5.8788 -5.8788 -5.8771 -5.8771 -5.6078 -5.6078 -5.6056 -5.6056 -5.5001 -5.5001 -5.4976 -5.4976 -4.1778 -4.1778 -4.1765 -4.1765 -2.3920 -2.3920 -2.3911 -2.3911 -1.7070 -1.7070 -1.7057 -1.7057 -1.4431 -1.4431 -1.4419 -1.4419 -0.9016 -0.9016 -0.9007 -0.9007 3.6312 3.6312 3.6315 3.6315 5.8957 5.8957 5.8963 5.8963 7.1417 7.1417 7.1423 7.1423 k = 0.5000 0.4269 0.4595 ( 7882 PWs) bands (ev): -23.0838 -23.0838 -23.0838 -23.0838 -20.3737 -20.3737 -20.3737 -20.3737 -14.5419 -14.5419 -14.5418 -14.5418 -13.1111 -13.1111 -13.1111 -13.1111 -11.4180 -11.4180 -11.4180 -11.4180 -8.4989 -8.4989 -8.4988 -8.4988 -6.4504 -6.4504 -6.4495 -6.4495 -6.0424 -6.0424 -6.0418 -6.0418 -5.8611 -5.8611 -5.8594 -5.8594 -5.5950 -5.5950 -5.5927 -5.5927 -5.4957 -5.4957 -5.4930 -5.4930 -4.1773 -4.1773 -4.1761 -4.1761 -2.3844 -2.3844 -2.3834 -2.3834 -1.7100 -1.7100 -1.7087 -1.7087 -1.4432 -1.4432 -1.4420 -1.4420 -0.9019 -0.9019 -0.9010 -0.9010 3.6164 3.6164 3.6167 3.6167 5.8879 5.8879 5.8885 5.8885 7.0951 7.0951 7.0956 7.0956 k = 0.5000 0.4044 0.4595 ( 7886 PWs) bands (ev): -23.0846 -23.0846 -23.0846 -23.0846 -20.3740 -20.3740 -20.3740 -20.3740 -14.5479 -14.5479 -14.5479 -14.5479 -13.1118 -13.1118 -13.1118 -13.1118 -11.4180 -11.4180 -11.4179 -11.4179 -8.4977 -8.4977 -8.4976 -8.4976 -6.4488 -6.4488 -6.4479 -6.4479 -6.0383 -6.0383 -6.0377 -6.0377 -5.8432 -5.8432 -5.8415 -5.8415 -5.5841 -5.5841 -5.5817 -5.5817 -5.4887 -5.4887 -5.4860 -5.4860 -4.1768 -4.1768 -4.1756 -4.1756 -2.3768 -2.3768 -2.3758 -2.3758 -1.7129 -1.7129 -1.7116 -1.7116 -1.4435 -1.4435 -1.4423 -1.4423 -0.9023 -0.9023 -0.9014 -0.9014 3.6014 3.6014 3.6017 3.6017 5.8802 5.8802 5.8807 5.8807 7.0493 7.0493 7.0498 7.0498 k = 0.5000 0.3819 0.4595 ( 7904 PWs) bands (ev): -23.0855 -23.0855 -23.0855 -23.0855 -20.3744 -20.3744 -20.3744 -20.3744 -14.5539 -14.5539 -14.5539 -14.5539 -13.1125 -13.1125 -13.1125 -13.1125 -11.4179 -11.4179 -11.4179 -11.4179 -8.4966 -8.4966 -8.4965 -8.4965 -6.4472 -6.4472 -6.4463 -6.4463 -6.0349 -6.0349 -6.0343 -6.0343 -5.8253 -5.8253 -5.8235 -5.8235 -5.5755 -5.5755 -5.5731 -5.5731 -5.4786 -5.4786 -5.4760 -5.4760 -4.1764 -4.1764 -4.1752 -4.1752 -2.3694 -2.3694 -2.3684 -2.3684 -1.7157 -1.7157 -1.7145 -1.7145 -1.4441 -1.4441 -1.4429 -1.4429 -0.9028 -0.9028 -0.9019 -0.9019 3.5863 3.5863 3.5865 3.5865 5.8725 5.8725 5.8731 5.8731 7.0045 7.0045 7.0050 7.0050 k = 0.5000 0.3595 0.4595 ( 7898 PWs) bands (ev): -23.0863 -23.0863 -23.0863 -23.0863 -20.3748 -20.3748 -20.3747 -20.3747 -14.5597 -14.5597 -14.5597 -14.5597 -13.1132 -13.1132 -13.1132 -13.1132 -11.4179 -11.4179 -11.4178 -11.4178 -8.4956 -8.4956 -8.4955 -8.4955 -6.4456 -6.4456 -6.4448 -6.4448 -6.0320 -6.0320 -6.0315 -6.0315 -5.8076 -5.8076 -5.8058 -5.8058 -5.5692 -5.5692 -5.5670 -5.5670 -5.4656 -5.4656 -5.4632 -5.4632 -4.1759 -4.1759 -4.1747 -4.1747 -2.3622 -2.3622 -2.3612 -2.3612 -1.7185 -1.7185 -1.7173 -1.7173 -1.4449 -1.4449 -1.4437 -1.4437 -0.9033 -0.9033 -0.9024 -0.9024 3.5712 3.5712 3.5714 3.5714 5.8650 5.8650 5.8655 5.8655 6.9612 6.9612 6.9616 6.9616 k = 0.5000 0.3370 0.4595 ( 7912 PWs) bands (ev): -23.0871 -23.0871 -23.0871 -23.0871 -20.3751 -20.3751 -20.3751 -20.3751 -14.5653 -14.5653 -14.5653 -14.5653 -13.1139 -13.1139 -13.1139 -13.1139 -11.4178 -11.4178 -11.4178 -11.4178 -8.4945 -8.4945 -8.4944 -8.4944 -6.4441 -6.4441 -6.4433 -6.4433 -6.0297 -6.0297 -6.0293 -6.0293 -5.7903 -5.7903 -5.7884 -5.7884 -5.5649 -5.5649 -5.5630 -5.5630 -5.4503 -5.4503 -5.4482 -5.4482 -4.1754 -4.1754 -4.1742 -4.1742 -2.3553 -2.3553 -2.3542 -2.3542 -1.7211 -1.7211 -1.7199 -1.7199 -1.4460 -1.4460 -1.4448 -1.4448 -0.9039 -0.9039 -0.9030 -0.9030 3.5562 3.5562 3.5565 3.5565 5.8577 5.8577 5.8582 5.8582 6.9194 6.9194 6.9199 6.9199 k = 0.5000 0.3145 0.4595 ( 7904 PWs) bands (ev): -23.0879 -23.0879 -23.0879 -23.0879 -20.3754 -20.3754 -20.3754 -20.3754 -14.5707 -14.5707 -14.5707 -14.5707 -13.1146 -13.1146 -13.1146 -13.1146 -11.4178 -11.4178 -11.4178 -11.4178 -8.4935 -8.4935 -8.4934 -8.4934 -6.4427 -6.4427 -6.4419 -6.4419 -6.0278 -6.0278 -6.0274 -6.0274 -5.7735 -5.7735 -5.7717 -5.7717 -5.5621 -5.5621 -5.5605 -5.5605 -5.4334 -5.4334 -5.4315 -5.4315 -4.1749 -4.1749 -4.1738 -4.1738 -2.3486 -2.3486 -2.3475 -2.3475 -1.7236 -1.7236 -1.7225 -1.7225 -1.4474 -1.4474 -1.4462 -1.4462 -0.9045 -0.9045 -0.9036 -0.9036 3.5415 3.5415 3.5417 3.5417 5.8508 5.8508 5.8512 5.8512 6.8795 6.8795 6.8800 6.8800 k = 0.5000 0.2921 0.4595 ( 7904 PWs) bands (ev): -23.0886 -23.0886 -23.0886 -23.0886 -20.3757 -20.3757 -20.3757 -20.3757 -14.5759 -14.5759 -14.5759 -14.5759 -13.1153 -13.1153 -13.1153 -13.1153 -11.4178 -11.4178 -11.4177 -11.4177 -8.4926 -8.4926 -8.4925 -8.4925 -6.4413 -6.4413 -6.4406 -6.4406 -6.0263 -6.0263 -6.0259 -6.0259 -5.7575 -5.7575 -5.7557 -5.7557 -5.5604 -5.5604 -5.5590 -5.5590 -5.4155 -5.4155 -5.4139 -5.4139 -4.1744 -4.1744 -4.1733 -4.1733 -2.3422 -2.3422 -2.3411 -2.3411 -1.7260 -1.7260 -1.7249 -1.7249 -1.4489 -1.4489 -1.4478 -1.4478 -0.9052 -0.9052 -0.9043 -0.9043 3.5271 3.5271 3.5274 3.5274 5.8441 5.8441 5.8446 5.8446 6.8416 6.8416 6.8421 6.8421 k = 0.5000 0.2696 0.4595 ( 7898 PWs) bands (ev): -23.0893 -23.0893 -23.0893 -23.0893 -20.3760 -20.3760 -20.3760 -20.3760 -14.5808 -14.5808 -14.5808 -14.5808 -13.1159 -13.1159 -13.1159 -13.1159 -11.4177 -11.4177 -11.4177 -11.4177 -8.4917 -8.4917 -8.4916 -8.4916 -6.4400 -6.4400 -6.4393 -6.4393 -6.0251 -6.0251 -6.0246 -6.0246 -5.7423 -5.7423 -5.7405 -5.7405 -5.5593 -5.5593 -5.5581 -5.5581 -5.3973 -5.3973 -5.3959 -5.3959 -4.1739 -4.1739 -4.1729 -4.1729 -2.3362 -2.3362 -2.3351 -2.3351 -1.7282 -1.7282 -1.7271 -1.7271 -1.4507 -1.4507 -1.4496 -1.4496 -0.9059 -0.9059 -0.9050 -0.9050 3.5132 3.5132 3.5135 3.5135 5.8379 5.8379 5.8383 5.8383 6.8059 6.8059 6.8064 6.8064 k = 0.5000 0.2471 0.4595 ( 7900 PWs) bands (ev): -23.0900 -23.0900 -23.0900 -23.0900 -20.3763 -20.3763 -20.3763 -20.3763 -14.5854 -14.5854 -14.5854 -14.5854 -13.1166 -13.1166 -13.1165 -13.1165 -11.4177 -11.4177 -11.4177 -11.4177 -8.4909 -8.4909 -8.4908 -8.4908 -6.4388 -6.4388 -6.4381 -6.4381 -6.0241 -6.0241 -6.0236 -6.0236 -5.7281 -5.7281 -5.7263 -5.7263 -5.5587 -5.5587 -5.5577 -5.5577 -5.3791 -5.3791 -5.3780 -5.3780 -4.1734 -4.1734 -4.1724 -4.1724 -2.3305 -2.3305 -2.3294 -2.3294 -1.7302 -1.7302 -1.7292 -1.7292 -1.4526 -1.4526 -1.4515 -1.4515 -0.9066 -0.9066 -0.9057 -0.9057 3.4999 3.4999 3.5002 3.5002 5.8322 5.8322 5.8326 5.8326 6.7725 6.7725 6.7730 6.7730 k = 0.5000 0.2247 0.4595 ( 7896 PWs) bands (ev): -23.0906 -23.0906 -23.0906 -23.0906 -20.3766 -20.3766 -20.3766 -20.3766 -14.5897 -14.5897 -14.5897 -14.5897 -13.1171 -13.1171 -13.1171 -13.1171 -11.4177 -11.4177 -11.4177 -11.4177 -8.4901 -8.4901 -8.4900 -8.4900 -6.4376 -6.4376 -6.4370 -6.4370 -6.0233 -6.0233 -6.0229 -6.0229 -5.7148 -5.7148 -5.7132 -5.7132 -5.5583 -5.5583 -5.5574 -5.5574 -5.3615 -5.3615 -5.3605 -5.3605 -4.1730 -4.1730 -4.1720 -4.1720 -2.3253 -2.3253 -2.3242 -2.3242 -1.7321 -1.7321 -1.7311 -1.7311 -1.4545 -1.4545 -1.4535 -1.4535 -0.9073 -0.9073 -0.9064 -0.9064 3.4874 3.4874 3.4876 3.4876 5.8270 5.8270 5.8273 5.8273 6.7416 6.7416 6.7421 6.7421 k = 0.5000 0.2022 0.4595 ( 7900 PWs) bands (ev): -23.0912 -23.0912 -23.0911 -23.0911 -20.3769 -20.3769 -20.3768 -20.3768 -14.5937 -14.5937 -14.5937 -14.5937 -13.1177 -13.1177 -13.1177 -13.1177 -11.4177 -11.4177 -11.4177 -11.4177 -8.4894 -8.4894 -8.4893 -8.4893 -6.4366 -6.4366 -6.4360 -6.4360 -6.0226 -6.0226 -6.0222 -6.0222 -5.7027 -5.7027 -5.7011 -5.7011 -5.5581 -5.5581 -5.5572 -5.5572 -5.3446 -5.3446 -5.3438 -5.3438 -4.1725 -4.1725 -4.1717 -4.1717 -2.3206 -2.3206 -2.3194 -2.3194 -1.7338 -1.7338 -1.7329 -1.7329 -1.4565 -1.4565 -1.4556 -1.4556 -0.9079 -0.9079 -0.9071 -0.9071 3.4756 3.4756 3.4759 3.4759 5.8223 5.8223 5.8227 5.8227 6.7133 6.7133 6.7137 6.7137 k = 0.5000 0.1797 0.4595 ( 7908 PWs) bands (ev): -23.0917 -23.0917 -23.0917 -23.0917 -20.3771 -20.3771 -20.3771 -20.3771 -14.5973 -14.5973 -14.5973 -14.5973 -13.1182 -13.1182 -13.1182 -13.1182 -11.4177 -11.4177 -11.4176 -11.4176 -8.4888 -8.4888 -8.4887 -8.4887 -6.4356 -6.4356 -6.4350 -6.4350 -6.0221 -6.0221 -6.0217 -6.0217 -5.6918 -5.6918 -5.6903 -5.6903 -5.5579 -5.5579 -5.5571 -5.5571 -5.3288 -5.3288 -5.3281 -5.3281 -4.1721 -4.1721 -4.1713 -4.1713 -2.3163 -2.3163 -2.3151 -2.3151 -1.7352 -1.7352 -1.7344 -1.7344 -1.4585 -1.4585 -1.4576 -1.4576 -0.9086 -0.9086 -0.9078 -0.9078 3.4648 3.4648 3.4651 3.4651 5.8182 5.8182 5.8185 5.8185 6.6876 6.6876 6.6881 6.6881 k = 0.5000 0.1573 0.4595 ( 7902 PWs) bands (ev): -23.0921 -23.0921 -23.0921 -23.0921 -20.3773 -20.3773 -20.3773 -20.3773 -14.6005 -14.6005 -14.6005 -14.6005 -13.1187 -13.1187 -13.1186 -13.1186 -11.4176 -11.4176 -11.4176 -11.4176 -8.4882 -8.4882 -8.4881 -8.4881 -6.4348 -6.4348 -6.4342 -6.4342 -6.0217 -6.0217 -6.0214 -6.0214 -5.6822 -5.6822 -5.6808 -5.6808 -5.5577 -5.5577 -5.5570 -5.5570 -5.3143 -5.3143 -5.3137 -5.3137 -4.1717 -4.1717 -4.1710 -4.1710 -2.3124 -2.3124 -2.3112 -2.3112 -1.7365 -1.7365 -1.7358 -1.7358 -1.4605 -1.4605 -1.4596 -1.4596 -0.9092 -0.9092 -0.9084 -0.9084 3.4550 3.4550 3.4553 3.4553 5.8147 5.8147 5.8150 5.8150 6.6646 6.6646 6.6651 6.6651 k = 0.5000 0.1348 0.4595 ( 7890 PWs) bands (ev): -23.0925 -23.0925 -23.0925 -23.0925 -20.3774 -20.3774 -20.3774 -20.3774 -14.6034 -14.6034 -14.6033 -14.6033 -13.1191 -13.1191 -13.1190 -13.1190 -11.4176 -11.4176 -11.4176 -11.4176 -8.4877 -8.4877 -8.4876 -8.4876 -6.4340 -6.4340 -6.4335 -6.4335 -6.0214 -6.0214 -6.0211 -6.0211 -5.6737 -5.6737 -5.6725 -5.6725 -5.5575 -5.5575 -5.5568 -5.5568 -5.3012 -5.3012 -5.3007 -5.3007 -4.1713 -4.1713 -4.1707 -4.1707 -2.3091 -2.3091 -2.3079 -2.3079 -1.7376 -1.7376 -1.7369 -1.7369 -1.4623 -1.4623 -1.4615 -1.4615 -0.9097 -0.9097 -0.9089 -0.9089 3.4464 3.4464 3.4466 3.4466 5.8117 5.8117 5.8120 5.8120 6.6445 6.6445 6.6451 6.6451 k = 0.5000 0.1123 0.4595 ( 7876 PWs) bands (ev): -23.0929 -23.0929 -23.0929 -23.0929 -20.3776 -20.3776 -20.3776 -20.3776 -14.6058 -14.6058 -14.6058 -14.6058 -13.1194 -13.1194 -13.1194 -13.1194 -11.4176 -11.4176 -11.4176 -11.4176 -8.4873 -8.4873 -8.4872 -8.4872 -6.4334 -6.4334 -6.4329 -6.4329 -6.0212 -6.0212 -6.0208 -6.0208 -5.6666 -5.6666 -5.6656 -5.6656 -5.5572 -5.5572 -5.5566 -5.5566 -5.2899 -5.2899 -5.2894 -5.2894 -4.1710 -4.1710 -4.1704 -4.1704 -2.3062 -2.3062 -2.3050 -2.3050 -1.7385 -1.7385 -1.7379 -1.7379 -1.4639 -1.4639 -1.4633 -1.4633 -0.9102 -0.9102 -0.9094 -0.9094 3.4389 3.4389 3.4392 3.4392 5.8093 5.8093 5.8095 5.8095 6.6274 6.6274 6.6279 6.6279 k = 0.5000 0.0899 0.4595 ( 7874 PWs) bands (ev): -23.0932 -23.0932 -23.0932 -23.0932 -20.3777 -20.3777 -20.3777 -20.3777 -14.6078 -14.6078 -14.6078 -14.6078 -13.1197 -13.1197 -13.1197 -13.1197 -11.4176 -11.4176 -11.4176 -11.4176 -8.4870 -8.4870 -8.4869 -8.4869 -6.4328 -6.4328 -6.4324 -6.4324 -6.0210 -6.0210 -6.0207 -6.0207 -5.6608 -5.6608 -5.6599 -5.6599 -5.5570 -5.5570 -5.5565 -5.5565 -5.2804 -5.2804 -5.2800 -5.2800 -4.1707 -4.1707 -4.1703 -4.1703 -2.3039 -2.3039 -2.3027 -2.3027 -1.7392 -1.7392 -1.7387 -1.7387 -1.4654 -1.4654 -1.4647 -1.4647 -0.9106 -0.9106 -0.9098 -0.9098 3.4327 3.4327 3.4330 3.4330 5.8074 5.8074 5.8076 5.8076 6.6132 6.6132 6.6138 6.6138 k = 0.5000 0.0674 0.4595 ( 7872 PWs) bands (ev): -23.0934 -23.0934 -23.0934 -23.0934 -20.3778 -20.3778 -20.3778 -20.3778 -14.6093 -14.6093 -14.6093 -14.6093 -13.1199 -13.1199 -13.1199 -13.1199 -11.4176 -11.4176 -11.4176 -11.4176 -8.4867 -8.4867 -8.4866 -8.4866 -6.4324 -6.4324 -6.4320 -6.4320 -6.0209 -6.0209 -6.0205 -6.0205 -5.6562 -5.6562 -5.6556 -5.6556 -5.5567 -5.5567 -5.5563 -5.5563 -5.2729 -5.2729 -5.2725 -5.2725 -4.1704 -4.1704 -4.1701 -4.1701 -2.3021 -2.3021 -2.3009 -2.3009 -1.7397 -1.7397 -1.7393 -1.7393 -1.4665 -1.4665 -1.4660 -1.4660 -0.9109 -0.9109 -0.9101 -0.9101 3.4278 3.4278 3.4281 3.4281 5.8059 5.8059 5.8061 5.8061 6.6021 6.6021 6.6027 6.6027 k = 0.5000 0.0449 0.4595 ( 7872 PWs) bands (ev): -23.0936 -23.0936 -23.0936 -23.0936 -20.3779 -20.3779 -20.3779 -20.3779 -14.6104 -14.6104 -14.6104 -14.6104 -13.1201 -13.1201 -13.1201 -13.1201 -11.4176 -11.4176 -11.4176 -11.4176 -8.4865 -8.4865 -8.4864 -8.4864 -6.4321 -6.4321 -6.4317 -6.4317 -6.0208 -6.0208 -6.0205 -6.0205 -5.6530 -5.6530 -5.6525 -5.6525 -5.5565 -5.5565 -5.5561 -5.5561 -5.2674 -5.2674 -5.2671 -5.2671 -4.1703 -4.1703 -4.1700 -4.1700 -2.3008 -2.3008 -2.2996 -2.2996 -1.7400 -1.7400 -1.7398 -1.7398 -1.4674 -1.4674 -1.4669 -1.4669 -0.9111 -0.9111 -0.9104 -0.9104 3.4243 3.4243 3.4246 3.4246 5.8049 5.8049 5.8051 5.8051 6.5941 6.5941 6.5947 6.5947 k = 0.5000 0.0225 0.4595 ( 7878 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6111 -14.6111 -14.6111 -14.6111 -13.1202 -13.1202 -13.1202 -13.1202 -11.4176 -11.4176 -11.4176 -11.4176 -8.4864 -8.4864 -8.4863 -8.4863 -6.4320 -6.4320 -6.4315 -6.4315 -6.0208 -6.0208 -6.0204 -6.0204 -5.6510 -5.6510 -5.6508 -5.6508 -5.5564 -5.5564 -5.5560 -5.5560 -5.2641 -5.2641 -5.2638 -5.2638 -4.1701 -4.1701 -4.1700 -4.1700 -2.3000 -2.3000 -2.2988 -2.2988 -1.7402 -1.7402 -1.7401 -1.7401 -1.4679 -1.4679 -1.4674 -1.4674 -0.9113 -0.9113 -0.9105 -0.9105 3.4221 3.4221 3.4224 3.4224 5.8043 5.8043 5.8045 5.8045 6.5893 6.5893 6.5899 6.5899 k = 0.5000-0.0000 0.4595 ( 7868 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1202 -13.1202 -13.1202 -13.1202 -11.4176 -11.4176 -11.4176 -11.4176 -8.4863 -8.4863 -8.4862 -8.4862 -6.4319 -6.4319 -6.4315 -6.4315 -6.0207 -6.0207 -6.0204 -6.0204 -5.6502 -5.6502 -5.6502 -5.6502 -5.5563 -5.5563 -5.5560 -5.5560 -5.2630 -5.2630 -5.2627 -5.2627 -4.1701 -4.1701 -4.1700 -4.1700 -2.2997 -2.2997 -2.2985 -2.2985 -1.7403 -1.7403 -1.7402 -1.7402 -1.4680 -1.4680 -1.4676 -1.4676 -0.9113 -0.9113 -0.9106 -0.9106 3.4214 3.4214 3.4217 3.4217 5.8041 5.8041 5.8043 5.8043 6.5877 6.5877 6.5883 6.5883 k = 0.5000-0.0000 0.4595 ( 7868 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1202 -13.1202 -13.1202 -13.1202 -11.4176 -11.4176 -11.4176 -11.4176 -8.4863 -8.4863 -8.4862 -8.4862 -6.4319 -6.4319 -6.4315 -6.4315 -6.0207 -6.0207 -6.0204 -6.0204 -5.6502 -5.6502 -5.6502 -5.6502 -5.5563 -5.5563 -5.5560 -5.5560 -5.2630 -5.2630 -5.2627 -5.2627 -4.1701 -4.1701 -4.1700 -4.1700 -2.2997 -2.2997 -2.2985 -2.2985 -1.7403 -1.7403 -1.7402 -1.7402 -1.4680 -1.4680 -1.4676 -1.4676 -0.9113 -0.9113 -0.9106 -0.9106 3.4214 3.4214 3.4217 3.4217 5.8041 5.8041 5.8043 5.8043 6.5877 6.5877 6.5883 6.5883 k = 0.5000-0.0000 0.4376 ( 7876 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1202 -13.1202 -13.1202 -13.1202 -11.4176 -11.4176 -11.4176 -11.4176 -8.4863 -8.4863 -8.4862 -8.4862 -6.4318 -6.4318 -6.4314 -6.4314 -6.0208 -6.0208 -6.0205 -6.0205 -5.6524 -5.6524 -5.6519 -5.6519 -5.5548 -5.5548 -5.5542 -5.5542 -5.2629 -5.2629 -5.2626 -5.2626 -4.1699 -4.1699 -4.1698 -4.1698 -2.2998 -2.2998 -2.2986 -2.2986 -1.7406 -1.7406 -1.7405 -1.7405 -1.4680 -1.4680 -1.4676 -1.4676 -0.9112 -0.9112 -0.9105 -0.9105 3.4214 3.4214 3.4217 3.4217 5.8042 5.8042 5.8044 5.8044 6.5834 6.5834 6.5840 6.5840 k = 0.5000-0.0000 0.4157 ( 7874 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1203 -13.1203 -13.1203 -13.1203 -11.4176 -11.4176 -11.4176 -11.4176 -8.4862 -8.4862 -8.4861 -8.4861 -6.4315 -6.4315 -6.4311 -6.4311 -6.0211 -6.0211 -6.0208 -6.0208 -5.6579 -5.6579 -5.6569 -5.6569 -5.5503 -5.5503 -5.5493 -5.5493 -5.2625 -5.2625 -5.2621 -5.2621 -4.1693 -4.1693 -4.1693 -4.1693 -2.2999 -2.2999 -2.2987 -2.2987 -1.7414 -1.7414 -1.7412 -1.7412 -1.4680 -1.4680 -1.4675 -1.4675 -0.9109 -0.9109 -0.9102 -0.9102 3.4214 3.4214 3.4217 3.4217 5.8045 5.8045 5.8047 5.8047 6.5711 6.5711 6.5717 6.5717 k = 0.5000-0.0000 0.3939 ( 7890 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1203 -13.1203 -13.1203 -13.1203 -11.4176 -11.4176 -11.4176 -11.4176 -8.4860 -8.4860 -8.4859 -8.4859 -6.4310 -6.4310 -6.4306 -6.4306 -6.0216 -6.0216 -6.0213 -6.0213 -5.6658 -5.6658 -5.6645 -5.6645 -5.5437 -5.5437 -5.5424 -5.5424 -5.2618 -5.2618 -5.2614 -5.2614 -4.1684 -4.1684 -4.1684 -4.1684 -2.3001 -2.3001 -2.2989 -2.2989 -1.7428 -1.7428 -1.7425 -1.7425 -1.4679 -1.4679 -1.4674 -1.4674 -0.9104 -0.9104 -0.9097 -0.9097 3.4213 3.4213 3.4216 3.4216 5.8050 5.8050 5.8052 5.8052 6.5524 6.5524 6.5530 6.5530 k = 0.5000-0.0000 0.3720 ( 7892 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6112 -14.6112 -13.1204 -13.1204 -13.1204 -13.1204 -11.4177 -11.4177 -11.4177 -11.4177 -8.4857 -8.4857 -8.4856 -8.4856 -6.4304 -6.4304 -6.4299 -6.4299 -6.0223 -6.0223 -6.0220 -6.0220 -5.6752 -5.6752 -5.6737 -5.6737 -5.5358 -5.5358 -5.5343 -5.5343 -5.2608 -5.2608 -5.2603 -5.2603 -4.1672 -4.1672 -4.1671 -4.1671 -2.3004 -2.3004 -2.2992 -2.2992 -1.7447 -1.7447 -1.7443 -1.7443 -1.4678 -1.4678 -1.4673 -1.4673 -0.9098 -0.9098 -0.9091 -0.9091 3.4213 3.4213 3.4216 3.4216 5.8056 5.8056 5.8058 5.8058 6.5291 6.5291 6.5296 6.5296 k = 0.5000-0.0000 0.3501 ( 7894 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6112 -14.6112 -14.6112 -14.6112 -13.1205 -13.1205 -13.1205 -13.1205 -11.4177 -11.4177 -11.4177 -11.4177 -8.4854 -8.4854 -8.4853 -8.4853 -6.4295 -6.4295 -6.4291 -6.4291 -6.0232 -6.0232 -6.0228 -6.0228 -5.6855 -5.6855 -5.6839 -5.6839 -5.5273 -5.5273 -5.5257 -5.5257 -5.2595 -5.2595 -5.2590 -5.2590 -4.1657 -4.1657 -4.1656 -4.1656 -2.3007 -2.3007 -2.2995 -2.2995 -1.7470 -1.7470 -1.7466 -1.7466 -1.4676 -1.4676 -1.4671 -1.4671 -0.9090 -0.9090 -0.9082 -0.9082 3.4212 3.4212 3.4215 3.4215 5.8065 5.8065 5.8067 5.8067 6.5029 6.5029 6.5034 6.5034 k = 0.5000-0.0000 0.3282 ( 7908 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3780 -20.3780 -20.3779 -20.3779 -14.6111 -14.6111 -14.6111 -14.6111 -13.1207 -13.1207 -13.1207 -13.1207 -11.4178 -11.4178 -11.4178 -11.4178 -8.4850 -8.4850 -8.4849 -8.4849 -6.4285 -6.4285 -6.4281 -6.4281 -6.0242 -6.0242 -6.0239 -6.0239 -5.6962 -5.6962 -5.6945 -5.6945 -5.5186 -5.5186 -5.5170 -5.5170 -5.2580 -5.2580 -5.2574 -5.2574 -4.1638 -4.1638 -4.1637 -4.1637 -2.3011 -2.3011 -2.2999 -2.2999 -1.7497 -1.7497 -1.7492 -1.7492 -1.4675 -1.4675 -1.4670 -1.4670 -0.9080 -0.9080 -0.9073 -0.9073 3.4211 3.4211 3.4214 3.4214 5.8075 5.8075 5.8077 5.8077 6.4751 6.4751 6.4755 6.4755 k = 0.5000-0.0000 0.3063 ( 7902 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6111 -14.6111 -14.6111 -14.6111 -13.1208 -13.1208 -13.1208 -13.1208 -11.4178 -11.4178 -11.4178 -11.4178 -8.4845 -8.4845 -8.4844 -8.4844 -6.4274 -6.4274 -6.4269 -6.4269 -6.0255 -6.0255 -6.0251 -6.0251 -5.7069 -5.7069 -5.7052 -5.7052 -5.5101 -5.5101 -5.5085 -5.5085 -5.2563 -5.2563 -5.2556 -5.2556 -4.1618 -4.1618 -4.1617 -4.1617 -2.3016 -2.3016 -2.3004 -2.3004 -1.7527 -1.7527 -1.7521 -1.7521 -1.4673 -1.4673 -1.4668 -1.4668 -0.9069 -0.9069 -0.9062 -0.9062 3.4211 3.4211 3.4213 3.4213 5.8088 5.8088 5.8090 5.8090 6.4467 6.4467 6.4471 6.4471 k = 0.5000-0.0000 0.2845 ( 7900 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6110 -14.6110 -14.6110 -14.6110 -13.1210 -13.1210 -13.1210 -13.1210 -11.4179 -11.4179 -11.4179 -11.4179 -8.4840 -8.4840 -8.4840 -8.4840 -6.4261 -6.4261 -6.4256 -6.4256 -6.0269 -6.0269 -6.0265 -6.0265 -5.7175 -5.7175 -5.7159 -5.7159 -5.5019 -5.5019 -5.5003 -5.5003 -5.2543 -5.2543 -5.2536 -5.2536 -4.1595 -4.1595 -4.1594 -4.1594 -2.3020 -2.3020 -2.3009 -2.3009 -1.7559 -1.7559 -1.7553 -1.7553 -1.4672 -1.4672 -1.4666 -1.4666 -0.9057 -0.9057 -0.9051 -0.9051 3.4210 3.4210 3.4212 3.4212 5.8102 5.8102 5.8104 5.8104 6.4185 6.4185 6.4189 6.4189 k = 0.5000-0.0000 0.2626 ( 7894 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6109 -14.6109 -14.6109 -14.6109 -13.1211 -13.1211 -13.1211 -13.1211 -11.4179 -11.4179 -11.4179 -11.4179 -8.4835 -8.4835 -8.4834 -8.4834 -6.4247 -6.4247 -6.4243 -6.4243 -6.0284 -6.0284 -6.0280 -6.0280 -5.7278 -5.7278 -5.7262 -5.7262 -5.4943 -5.4943 -5.4926 -5.4926 -5.2522 -5.2522 -5.2514 -5.2514 -4.1571 -4.1571 -4.1570 -4.1570 -2.3026 -2.3026 -2.3014 -2.3014 -1.7594 -1.7594 -1.7587 -1.7587 -1.4670 -1.4670 -1.4665 -1.4665 -0.9045 -0.9045 -0.9038 -0.9038 3.4209 3.4209 3.4211 3.4211 5.8118 5.8118 5.8120 5.8120 6.3910 6.3910 6.3913 6.3913 k = 0.5000-0.0000 0.2407 ( 7892 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6108 -14.6108 -14.6108 -14.6108 -13.1213 -13.1213 -13.1213 -13.1213 -11.4180 -11.4180 -11.4180 -11.4180 -8.4830 -8.4830 -8.4829 -8.4829 -6.4233 -6.4233 -6.4228 -6.4228 -6.0301 -6.0301 -6.0296 -6.0296 -5.7376 -5.7376 -5.7360 -5.7360 -5.4872 -5.4872 -5.4855 -5.4855 -5.2499 -5.2499 -5.2491 -5.2491 -4.1547 -4.1547 -4.1545 -4.1545 -2.3031 -2.3031 -2.3020 -2.3020 -1.7629 -1.7629 -1.7621 -1.7621 -1.4668 -1.4668 -1.4663 -1.4663 -0.9032 -0.9032 -0.9026 -0.9026 3.4208 3.4208 3.4210 3.4210 5.8135 5.8135 5.8137 5.8137 6.3646 6.3646 6.3648 6.3648 k = 0.5000-0.0000 0.2188 ( 7890 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6107 -14.6107 -14.6107 -14.6107 -13.1215 -13.1215 -13.1215 -13.1215 -11.4180 -11.4180 -11.4180 -11.4180 -8.4824 -8.4824 -8.4824 -8.4824 -6.4218 -6.4218 -6.4213 -6.4213 -6.0318 -6.0318 -6.0314 -6.0314 -5.7468 -5.7468 -5.7452 -5.7452 -5.4807 -5.4807 -5.4791 -5.4791 -5.2476 -5.2476 -5.2468 -5.2468 -4.1521 -4.1521 -4.1520 -4.1520 -2.3037 -2.3037 -2.3025 -2.3025 -1.7664 -1.7664 -1.7656 -1.7656 -1.4667 -1.4667 -1.4662 -1.4662 -0.9019 -0.9019 -0.9013 -0.9013 3.4207 3.4207 3.4209 3.4209 5.8154 5.8154 5.8156 5.8156 6.3395 6.3395 6.3397 6.3397 k = 0.5000-0.0000 0.1969 ( 7894 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6106 -14.6106 -14.6106 -14.6106 -13.1217 -13.1217 -13.1217 -13.1217 -11.4181 -11.4181 -11.4181 -11.4181 -8.4819 -8.4819 -8.4818 -8.4818 -6.4203 -6.4203 -6.4198 -6.4198 -6.0336 -6.0336 -6.0332 -6.0332 -5.7553 -5.7553 -5.7538 -5.7538 -5.4749 -5.4749 -5.4733 -5.4733 -5.2452 -5.2452 -5.2444 -5.2444 -4.1497 -4.1497 -4.1494 -4.1494 -2.3043 -2.3043 -2.3031 -2.3031 -1.7698 -1.7698 -1.7690 -1.7690 -1.4666 -1.4666 -1.4661 -1.4661 -0.9006 -0.9006 -0.9001 -0.9001 3.4206 3.4206 3.4208 3.4208 5.8174 5.8174 5.8176 5.8176 6.3161 6.3161 6.3163 6.3163 k = 0.5000-0.0000 0.1751 ( 7894 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6106 -14.6106 -14.6106 -14.6106 -13.1218 -13.1218 -13.1218 -13.1218 -11.4181 -11.4181 -11.4181 -11.4181 -8.4814 -8.4814 -8.4813 -8.4813 -6.4188 -6.4188 -6.4183 -6.4183 -6.0355 -6.0355 -6.0351 -6.0351 -5.7630 -5.7630 -5.7616 -5.7616 -5.4697 -5.4697 -5.4682 -5.4682 -5.2429 -5.2429 -5.2420 -5.2420 -4.1472 -4.1472 -4.1470 -4.1470 -2.3048 -2.3048 -2.3037 -2.3037 -1.7732 -1.7732 -1.7723 -1.7723 -1.4665 -1.4665 -1.4661 -1.4661 -0.8994 -0.8994 -0.8989 -0.8989 3.4205 3.4205 3.4207 3.4207 5.8194 5.8194 5.8196 5.8196 6.2946 6.2946 6.2948 6.2948 k = 0.5000-0.0000 0.1532 ( 7898 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6105 -14.6105 -14.6105 -14.6105 -13.1220 -13.1220 -13.1220 -13.1220 -11.4182 -11.4182 -11.4182 -11.4182 -8.4809 -8.4809 -8.4808 -8.4808 -6.4173 -6.4173 -6.4169 -6.4169 -6.0373 -6.0373 -6.0369 -6.0369 -5.7699 -5.7699 -5.7686 -5.7686 -5.4652 -5.4652 -5.4637 -5.4637 -5.2407 -5.2407 -5.2398 -5.2398 -4.1450 -4.1450 -4.1447 -4.1447 -2.3054 -2.3054 -2.3042 -2.3042 -1.7763 -1.7763 -1.7754 -1.7754 -1.4664 -1.4664 -1.4660 -1.4660 -0.8983 -0.8983 -0.8977 -0.8977 3.4204 3.4204 3.4206 3.4206 5.8215 5.8215 5.8216 5.8216 6.2751 6.2751 6.2753 6.2753 k = 0.5000-0.0000 0.1313 ( 7896 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6104 -14.6104 -14.6104 -14.6104 -13.1221 -13.1221 -13.1221 -13.1221 -11.4182 -11.4182 -11.4182 -11.4182 -8.4804 -8.4804 -8.4804 -8.4804 -6.4160 -6.4160 -6.4156 -6.4156 -6.0390 -6.0390 -6.0386 -6.0386 -5.7759 -5.7759 -5.7747 -5.7747 -5.4614 -5.4614 -5.4599 -5.4599 -5.2386 -5.2386 -5.2377 -5.2377 -4.1429 -4.1429 -4.1426 -4.1426 -2.3058 -2.3058 -2.3047 -2.3047 -1.7791 -1.7791 -1.7782 -1.7782 -1.4663 -1.4663 -1.4660 -1.4660 -0.8972 -0.8972 -0.8967 -0.8967 3.4203 3.4203 3.4205 3.4205 5.8235 5.8235 5.8236 5.8236 6.2579 6.2579 6.2580 6.2580 k = 0.5000-0.0000 0.1094 ( 7896 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6103 -14.6103 -14.6103 -14.6103 -13.1223 -13.1223 -13.1223 -13.1223 -11.4183 -11.4183 -11.4183 -11.4183 -8.4800 -8.4800 -8.4800 -8.4800 -6.4148 -6.4148 -6.4144 -6.4144 -6.0405 -6.0405 -6.0402 -6.0402 -5.7811 -5.7811 -5.7800 -5.7800 -5.4582 -5.4582 -5.4567 -5.4567 -5.2367 -5.2367 -5.2358 -5.2358 -4.1410 -4.1410 -4.1407 -4.1407 -2.3063 -2.3063 -2.3052 -2.3052 -1.7816 -1.7816 -1.7807 -1.7807 -1.4663 -1.4663 -1.4660 -1.4660 -0.8963 -0.8963 -0.8958 -0.8958 3.4203 3.4203 3.4204 3.4204 5.8254 5.8254 5.8255 5.8255 6.2430 6.2430 6.2431 6.2431 k = 0.5000-0.0000 0.0875 ( 7902 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6103 -14.6103 -14.6103 -14.6103 -13.1224 -13.1224 -13.1224 -13.1224 -11.4183 -11.4183 -11.4183 -11.4183 -8.4797 -8.4797 -8.4796 -8.4796 -6.4137 -6.4137 -6.4134 -6.4134 -6.0419 -6.0419 -6.0416 -6.0416 -5.7853 -5.7853 -5.7843 -5.7843 -5.4556 -5.4556 -5.4541 -5.4541 -5.2352 -5.2352 -5.2342 -5.2342 -4.1394 -4.1394 -4.1391 -4.1391 -2.3067 -2.3067 -2.3055 -2.3055 -1.7837 -1.7837 -1.7828 -1.7828 -1.4662 -1.4662 -1.4660 -1.4660 -0.8955 -0.8955 -0.8950 -0.8950 3.4202 3.4202 3.4203 3.4203 5.8270 5.8270 5.8272 5.8272 6.2306 6.2306 6.2306 6.2306 k = 0.5000-0.0000 0.0656 ( 7902 PWs) bands (ev): -23.0938 -23.0938 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6103 -14.6103 -14.6102 -14.6102 -13.1225 -13.1225 -13.1224 -13.1224 -11.4183 -11.4183 -11.4183 -11.4183 -8.4794 -8.4794 -8.4794 -8.4794 -6.4129 -6.4129 -6.4125 -6.4125 -6.0430 -6.0430 -6.0427 -6.0427 -5.7885 -5.7885 -5.7877 -5.7877 -5.4536 -5.4536 -5.4521 -5.4521 -5.2339 -5.2339 -5.2329 -5.2329 -4.1381 -4.1381 -4.1378 -4.1378 -2.3070 -2.3070 -2.3058 -2.3058 -1.7854 -1.7854 -1.7844 -1.7844 -1.4662 -1.4662 -1.4660 -1.4660 -0.8949 -0.8949 -0.8944 -0.8944 3.4202 3.4202 3.4203 3.4203 5.8285 5.8285 5.8286 5.8286 6.2208 6.2208 6.2208 6.2208 k = 0.5000-0.0000 0.0438 ( 7908 PWs) bands (ev): -23.0938 -23.0938 -23.0938 -23.0938 -20.3779 -20.3779 -20.3779 -20.3779 -14.6102 -14.6102 -14.6102 -14.6102 -13.1225 -13.1225 -13.1225 -13.1225 -11.4184 -11.4184 -11.4184 -11.4184 -8.4792 -8.4792 -8.4792 -8.4792 -6.4122 -6.4122 -6.4119 -6.4119 -6.0439 -6.0439 -6.0435 -6.0435 -5.7909 -5.7909 -5.7901 -5.7901 -5.4522 -5.4522 -5.4507 -5.4507 -5.2329 -5.2329 -5.2319 -5.2319 -4.1372 -4.1372 -4.1369 -4.1369 -2.3072 -2.3072 -2.3061 -2.3061 -1.7866 -1.7866 -1.7857 -1.7857 -1.4661 -1.4661 -1.4660 -1.4660 -0.8944 -0.8944 -0.8940 -0.8940 3.4201 3.4201 3.4202 3.4202 5.8295 5.8295 5.8296 5.8296 6.2137 6.2137 6.2137 6.2137 k = 0.5000-0.0000 0.0219 ( 7908 PWs) bands (ev): -23.0938 -23.0938 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6102 -14.6102 -14.6102 -14.6102 -13.1226 -13.1226 -13.1226 -13.1226 -11.4184 -11.4184 -11.4184 -11.4184 -8.4791 -8.4791 -8.4790 -8.4790 -6.4118 -6.4118 -6.4115 -6.4115 -6.0444 -6.0444 -6.0441 -6.0441 -5.7923 -5.7923 -5.7915 -5.7915 -5.4513 -5.4513 -5.4499 -5.4499 -5.2323 -5.2323 -5.2313 -5.2313 -4.1366 -4.1366 -4.1363 -4.1363 -2.3073 -2.3073 -2.3062 -2.3062 -1.7874 -1.7874 -1.7864 -1.7864 -1.4661 -1.4661 -1.4660 -1.4660 -0.8941 -0.8941 -0.8937 -0.8937 3.4201 3.4201 3.4202 3.4202 5.8302 5.8302 5.8303 5.8303 6.2094 6.2094 6.2094 6.2094 k = 0.5000-0.0000-0.0000 ( 7902 PWs) bands (ev): -23.0938 -23.0938 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6102 -14.6102 -14.6102 -14.6102 -13.1226 -13.1226 -13.1226 -13.1226 -11.4184 -11.4184 -11.4184 -11.4184 -8.4791 -8.4791 -8.4790 -8.4790 -6.4117 -6.4117 -6.4114 -6.4114 -6.0446 -6.0446 -6.0442 -6.0442 -5.7928 -5.7928 -5.7920 -5.7920 -5.4510 -5.4510 -5.4496 -5.4496 -5.2321 -5.2321 -5.2311 -5.2311 -4.1364 -4.1364 -4.1361 -4.1361 -2.3074 -2.3074 -2.3063 -2.3063 -1.7876 -1.7876 -1.7867 -1.7867 -1.4661 -1.4661 -1.4660 -1.4660 -0.8940 -0.8940 -0.8936 -0.8936 3.4201 3.4201 3.4202 3.4202 5.8304 5.8304 5.8305 5.8305 6.2080 6.2080 6.2080 6.2080 k = 0.0000 0.0000 0.4595 ( 7898 PWs) bands (ev): -23.1660 -23.1660 -23.0158 -23.0158 -20.5030 -20.5030 -20.2569 -20.2569 -14.6759 -14.6759 -14.5255 -14.5255 -13.2208 -13.2208 -13.0818 -13.0818 -11.4937 -11.4937 -11.2776 -11.2776 -8.5350 -8.5350 -8.4708 -8.4708 -6.6210 -6.6210 -6.2676 -6.2676 -6.0041 -6.0041 -5.9669 -5.9669 -5.6853 -5.6853 -5.6381 -5.6381 -5.5521 -5.5521 -5.5485 -5.5485 -5.2980 -5.2980 -5.2290 -5.2290 -4.3060 -4.3060 -3.9942 -3.9942 -2.3321 -2.3321 -2.2506 -2.2506 -2.0828 -2.0828 -1.6367 -1.6367 -1.4837 -1.4837 -1.4296 -1.4296 -1.0002 -1.0002 -0.6558 -0.6558 3.2436 3.2436 3.5368 3.5368 5.7092 5.7092 6.0424 6.0424 6.1423 6.1423 6.3917 6.3917 k = 0.0217-0.0000 0.4595 ( 7898 PWs) bands (ev): -23.1658 -23.1658 -23.0160 -23.0160 -20.5027 -20.5027 -20.2572 -20.2572 -14.6757 -14.6757 -14.5257 -14.5257 -13.2205 -13.2205 -13.0819 -13.0819 -11.4936 -11.4936 -11.2780 -11.2780 -8.5348 -8.5348 -8.4709 -8.4709 -6.6204 -6.6204 -6.2683 -6.2683 -6.0041 -6.0041 -5.9669 -5.9669 -5.6853 -5.6853 -5.6378 -5.6377 -5.5523 -5.5522 -5.5487 -5.5485 -5.2979 -5.2978 -5.2291 -5.2291 -4.3058 -4.3058 -3.9947 -3.9947 -2.3321 -2.3320 -2.2509 -2.2507 -2.0819 -2.0817 -1.6366 -1.6365 -1.4837 -1.4837 -1.4297 -1.4296 -1.0004 -1.0003 -0.6565 -0.6565 3.2440 3.2441 3.5366 3.5366 5.7090 5.7090 6.0413 6.0413 6.1438 6.1439 6.3935 6.3935 k = 0.0435-0.0000 0.4595 ( 7898 PWs) bands (ev): -23.1653 -23.1653 -23.0165 -23.0165 -20.5018 -20.5018 -20.2580 -20.2580 -14.6753 -14.6753 -14.5264 -14.5264 -13.2195 -13.2195 -13.0820 -13.0820 -11.4933 -11.4933 -11.2791 -11.2791 -8.5342 -8.5342 -8.4711 -8.4710 -6.6188 -6.6187 -6.2704 -6.2704 -6.0043 -6.0041 -5.9670 -5.9669 -5.6855 -5.6854 -5.6368 -5.6367 -5.5527 -5.5526 -5.5489 -5.5487 -5.2975 -5.2975 -5.2295 -5.2294 -4.3053 -4.3053 -3.9959 -3.9959 -2.3319 -2.3318 -2.2515 -2.2511 -2.0789 -2.0785 -1.6364 -1.6362 -1.4837 -1.4836 -1.4299 -1.4297 -1.0007 -1.0006 -0.6586 -0.6585 3.2455 3.2455 3.5361 3.5361 5.7082 5.7082 6.0381 6.0382 6.1484 6.1485 6.3989 6.3989 k = 0.0652-0.0000 0.4595 ( 7894 PWs) bands (ev): -23.1645 -23.1645 -23.0175 -23.0175 -20.5003 -20.5003 -20.2594 -20.2594 -14.6747 -14.6747 -14.5276 -14.5276 -13.2179 -13.2179 -13.0822 -13.0822 -11.4929 -11.4929 -11.2810 -11.2810 -8.5332 -8.5332 -8.4713 -8.4713 -6.6160 -6.6159 -6.2738 -6.2738 -6.0045 -6.0043 -5.9671 -5.9670 -5.6857 -5.6856 -5.6353 -5.6351 -5.5534 -5.5533 -5.5493 -5.5489 -5.2970 -5.2969 -5.2301 -5.2299 -4.3045 -4.3044 -3.9979 -3.9979 -2.3316 -2.3314 -2.2524 -2.2518 -2.0739 -2.0733 -1.6361 -1.6358 -1.4836 -1.4836 -1.4301 -1.4298 -1.0012 -1.0010 -0.6621 -0.6620 3.2478 3.2479 3.5351 3.5351 5.7069 5.7070 6.0330 6.0331 6.1559 6.1560 6.4076 6.4077 k = 0.0870-0.0000 0.4595 ( 7896 PWs) bands (ev): -23.1634 -23.1634 -23.0188 -23.0188 -20.4983 -20.4983 -20.2614 -20.2614 -14.6737 -14.6737 -14.5292 -14.5292 -13.2156 -13.2156 -13.0825 -13.0825 -11.4923 -11.4923 -11.2836 -11.2836 -8.5318 -8.5318 -8.4716 -8.4716 -6.6121 -6.6120 -6.2784 -6.2784 -6.0048 -6.0046 -5.9673 -5.9672 -5.6860 -5.6859 -5.6333 -5.6330 -5.5544 -5.5542 -5.5498 -5.5493 -5.2962 -5.2961 -5.2308 -5.2307 -4.3033 -4.3032 -4.0007 -4.0007 -2.3312 -2.3309 -2.2536 -2.2528 -2.0669 -2.0662 -1.6357 -1.6353 -1.4835 -1.4835 -1.4304 -1.4301 -1.0019 -1.0016 -0.6670 -0.6668 3.2511 3.2513 3.5337 3.5338 5.7055 5.7055 6.0263 6.0265 6.1660 6.1662 6.4193 6.4194 k = 0.1087-0.0000 0.4595 ( 7888 PWs) bands (ev): -23.1619 -23.1619 -23.0205 -23.0205 -20.4957 -20.4956 -20.2638 -20.2638 -14.6725 -14.6725 -14.5313 -14.5313 -13.2128 -13.2128 -13.0829 -13.0829 -11.4915 -11.4915 -11.2869 -11.2869 -8.5301 -8.5301 -8.4721 -8.4720 -6.6072 -6.6071 -6.2841 -6.2840 -6.0053 -6.0051 -5.9677 -5.9675 -5.6863 -5.6862 -5.6309 -5.6306 -5.5555 -5.5553 -5.5503 -5.5497 -5.2952 -5.2952 -5.2318 -5.2316 -4.3016 -4.3016 -4.0043 -4.0043 -2.3306 -2.3303 -2.2551 -2.2541 -2.0580 -2.0572 -1.6353 -1.6348 -1.4834 -1.4833 -1.4309 -1.4305 -1.0026 -1.0023 -0.6731 -0.6729 3.2553 3.2555 3.5320 3.5320 5.7039 5.7039 6.0182 6.0185 6.1787 6.1790 6.4336 6.4337 k = 0.1304-0.0000 0.4595 ( 7888 PWs) bands (ev): -23.1602 -23.1602 -23.0225 -23.0225 -20.4925 -20.4925 -20.2668 -20.2668 -14.6711 -14.6711 -14.5338 -14.5338 -13.2094 -13.2094 -13.0834 -13.0834 -11.4904 -11.4904 -11.2909 -11.2909 -8.5281 -8.5281 -8.4725 -8.4725 -6.6013 -6.6011 -6.2906 -6.2905 -6.0061 -6.0058 -5.9682 -5.9680 -5.6866 -5.6865 -5.6283 -5.6280 -5.5568 -5.5565 -5.5508 -5.5501 -5.2941 -5.2940 -5.2329 -5.2327 -4.2995 -4.2995 -4.0087 -4.0087 -2.3299 -2.3295 -2.2568 -2.2557 -2.0474 -2.0465 -1.6349 -1.6343 -1.4832 -1.4832 -1.4315 -1.4310 -1.0033 -1.0029 -0.6806 -0.6803 3.2604 3.2606 3.5298 3.5299 5.7024 5.7025 6.0092 6.0095 6.1937 6.1940 6.4501 6.4503 k = 0.1522-0.0000 0.4595 ( 7888 PWs) bands (ev): -23.1581 -23.1581 -23.0249 -23.0249 -20.4887 -20.4887 -20.2703 -20.2703 -14.6693 -14.6693 -14.5367 -14.5367 -13.2055 -13.2055 -13.0840 -13.0840 -11.4891 -11.4891 -11.2956 -11.2956 -8.5258 -8.5258 -8.4731 -8.4730 -6.5945 -6.5943 -6.2978 -6.2977 -6.0070 -6.0067 -5.9690 -5.9687 -5.6868 -5.6867 -5.6258 -5.6253 -5.5581 -5.5578 -5.5514 -5.5505 -5.2928 -5.2927 -5.2342 -5.2340 -4.2970 -4.2969 -4.0138 -4.0138 -2.3290 -2.3286 -2.2586 -2.2575 -2.0352 -2.0342 -1.6346 -1.6340 -1.4830 -1.4830 -1.4323 -1.4317 -1.0038 -1.0034 -0.6892 -0.6889 3.2663 3.2665 3.5272 3.5273 5.7013 5.7013 5.9995 5.9998 6.2106 6.2109 6.4685 6.4686 k = 0.1739-0.0000 0.4595 ( 7888 PWs) bands (ev): -23.1557 -23.1557 -23.0275 -23.0275 -20.4845 -20.4845 -20.2743 -20.2743 -14.6674 -14.6674 -14.5399 -14.5399 -13.2011 -13.2011 -13.0847 -13.0847 -11.4876 -11.4876 -11.3008 -11.3008 -8.5233 -8.5233 -8.4737 -8.4736 -6.5868 -6.5866 -6.3055 -6.3054 -6.0083 -6.0079 -5.9701 -5.9698 -5.6870 -5.6868 -5.6234 -5.6228 -5.5594 -5.5591 -5.5518 -5.5508 -5.2913 -5.2912 -5.2356 -5.2354 -4.2938 -4.2937 -4.0197 -4.0197 -2.3281 -2.3275 -2.2607 -2.2594 -2.0214 -2.0204 -1.6346 -1.6339 -1.4828 -1.4827 -1.4332 -1.4326 -1.0041 -1.0037 -0.6989 -0.6986 3.2730 3.2732 3.5242 3.5243 5.7006 5.7007 5.9891 5.9895 6.2292 6.2296 6.4883 6.4885 k = 0.1957-0.0000 0.4595 ( 7880 PWs) bands (ev): -23.1531 -23.1531 -23.0305 -23.0305 -20.4798 -20.4797 -20.2788 -20.2788 -14.6651 -14.6651 -14.5435 -14.5435 -13.1964 -13.1963 -13.0855 -13.0855 -11.4857 -11.4857 -11.3067 -11.3067 -8.5206 -8.5206 -8.4743 -8.4742 -6.5783 -6.5781 -6.3135 -6.3134 -6.0097 -6.0094 -5.9715 -5.9712 -5.6870 -5.6868 -5.6213 -5.6207 -5.5606 -5.5604 -5.5521 -5.5510 -5.2897 -5.2896 -5.2372 -5.2369 -4.2901 -4.2900 -4.0263 -4.0262 -2.3270 -2.3264 -2.2629 -2.2616 -2.0062 -2.0052 -1.6349 -1.6341 -1.4825 -1.4824 -1.4344 -1.4337 -1.0041 -1.0036 -0.7097 -0.7094 3.2804 3.2806 3.5207 3.5208 5.7007 5.7007 5.9784 5.9788 6.2493 6.2497 6.5093 6.5094 k = 0.2174-0.0000 0.4595 ( 7876 PWs) bands (ev): -23.1502 -23.1502 -23.0338 -23.0338 -20.4745 -20.4745 -20.2838 -20.2838 -14.6626 -14.6626 -14.5474 -14.5474 -13.1913 -13.1912 -13.0865 -13.0865 -11.4835 -11.4835 -11.3131 -11.3131 -8.5178 -8.5178 -8.4750 -8.4749 -6.5692 -6.5690 -6.3218 -6.3217 -6.0114 -6.0111 -5.9734 -5.9730 -5.6867 -5.6866 -5.6197 -5.6191 -5.5617 -5.5615 -5.5522 -5.5511 -5.2880 -5.2879 -5.2388 -5.2385 -4.2857 -4.2856 -4.0335 -4.0334 -2.3258 -2.3251 -2.2652 -2.2638 -1.9899 -1.9888 -1.6357 -1.6349 -1.4821 -1.4821 -1.4358 -1.4350 -1.0036 -1.0030 -0.7215 -0.7211 3.2884 3.2887 3.5168 3.5169 5.7015 5.7016 5.9674 5.9678 6.2706 6.2711 6.5311 6.5312 k = 0.2391-0.0000 0.4595 ( 7886 PWs) bands (ev): -23.1470 -23.1470 -23.0374 -23.0374 -20.4689 -20.4689 -20.2892 -20.2892 -14.6599 -14.6599 -14.5516 -14.5516 -13.1859 -13.1859 -13.0877 -13.0877 -11.4810 -11.4810 -11.3199 -11.3199 -8.5149 -8.5149 -8.4756 -8.4756 -6.5595 -6.5593 -6.3302 -6.3300 -6.0133 -6.0130 -5.9757 -5.9753 -5.6862 -5.6861 -5.6188 -5.6181 -5.5627 -5.5624 -5.5522 -5.5510 -5.2861 -5.2861 -5.2405 -5.2402 -4.2806 -4.2805 -4.0414 -4.0413 -2.3244 -2.3237 -2.2676 -2.2662 -1.9724 -1.9714 -1.6370 -1.6362 -1.4817 -1.4817 -1.4375 -1.4367 -1.0024 -1.0018 -0.7341 -0.7337 3.2971 3.2974 3.5124 3.5125 5.7033 5.7033 5.9561 5.9565 6.2929 6.2934 6.5534 6.5535 k = 0.2609-0.0000 0.4595 ( 7884 PWs) bands (ev): -23.1436 -23.1436 -23.0412 -23.0412 -20.4628 -20.4628 -20.2950 -20.2950 -14.6570 -14.6570 -14.5560 -14.5560 -13.1803 -13.1803 -13.0891 -13.0891 -11.4781 -11.4781 -11.3272 -11.3272 -8.5119 -8.5119 -8.4763 -8.4762 -6.5493 -6.5490 -6.3386 -6.3384 -6.0153 -6.0150 -5.9784 -5.9781 -5.6853 -5.6852 -5.6185 -5.6179 -5.5634 -5.5631 -5.5520 -5.5509 -5.2843 -5.2843 -5.2423 -5.2419 -4.2749 -4.2748 -4.0498 -4.0498 -2.3229 -2.3222 -2.2701 -2.2687 -1.9540 -1.9531 -1.6391 -1.6383 -1.4812 -1.4812 -1.4394 -1.4386 -1.0005 -0.9999 -0.7475 -0.7470 3.3063 3.3066 3.5074 3.5076 5.7061 5.7061 5.9446 5.9450 6.3160 6.3165 6.5758 6.5758 k = 0.2826-0.0000 0.4595 ( 7882 PWs) bands (ev): -23.1399 -23.1399 -23.0453 -23.0453 -20.4563 -20.4563 -20.3012 -20.3012 -14.6538 -14.6538 -14.5606 -14.5606 -13.1745 -13.1745 -13.0906 -13.0906 -11.4747 -11.4747 -11.3349 -11.3349 -8.5090 -8.5090 -8.4770 -8.4769 -6.5387 -6.5384 -6.3470 -6.3468 -6.0173 -6.0170 -5.9817 -5.9813 -5.6840 -5.6840 -5.6189 -5.6183 -5.5639 -5.5636 -5.5517 -5.5506 -5.2824 -5.2823 -5.2441 -5.2437 -4.2684 -4.2683 -4.0589 -4.0589 -2.3213 -2.3205 -2.2727 -2.2713 -1.9349 -1.9340 -1.6420 -1.6412 -1.4806 -1.4806 -1.4416 -1.4408 -0.9977 -0.9971 -0.7615 -0.7610 3.3159 3.3162 3.5020 3.5022 5.7100 5.7100 5.9329 5.9332 6.3398 6.3403 6.5977 6.5978 k = 0.3043-0.0000 0.4595 ( 7890 PWs) bands (ev): -23.1360 -23.1360 -23.0496 -23.0495 -20.4495 -20.4495 -20.3078 -20.3077 -14.6504 -14.6504 -14.5654 -14.5654 -13.1687 -13.1687 -13.0924 -13.0924 -11.4710 -11.4710 -11.3428 -11.3428 -8.5061 -8.5061 -8.4777 -8.4776 -6.5278 -6.5275 -6.3554 -6.3551 -6.0193 -6.0190 -5.9853 -5.9849 -5.6823 -5.6823 -5.6200 -5.6195 -5.5641 -5.5638 -5.5515 -5.5504 -5.2804 -5.2804 -5.2459 -5.2456 -4.2612 -4.2611 -4.0685 -4.0685 -2.3196 -2.3188 -2.2754 -2.2740 -1.9152 -1.9143 -1.6459 -1.6451 -1.4800 -1.4799 -1.4441 -1.4432 -0.9940 -0.9933 -0.7761 -0.7756 3.3259 3.3263 3.4961 3.4963 5.7149 5.7150 5.9209 5.9213 6.3640 6.3645 6.6186 6.6187 k = 0.3261-0.0000 0.4595 ( 7890 PWs) bands (ev): -23.1319 -23.1319 -23.0540 -23.0540 -20.4423 -20.4423 -20.3146 -20.3146 -14.6468 -14.6468 -14.5704 -14.5704 -13.1628 -13.1628 -13.0944 -13.0944 -11.4668 -11.4668 -11.3510 -11.3510 -8.5033 -8.5032 -8.4785 -8.4784 -6.5167 -6.5164 -6.3636 -6.3633 -6.0212 -6.0209 -5.9893 -5.9889 -5.6801 -5.6801 -5.6217 -5.6212 -5.5640 -5.5638 -5.5512 -5.5503 -5.2785 -5.2784 -5.2478 -5.2474 -4.2533 -4.2532 -4.0786 -4.0786 -2.3178 -2.3169 -2.2780 -2.2767 -1.8951 -1.8943 -1.6510 -1.6502 -1.4792 -1.4791 -1.4467 -1.4459 -0.9892 -0.9885 -0.7911 -0.7905 3.3363 3.3366 3.4897 3.4899 5.7211 5.7212 5.9087 5.9090 6.3885 6.3892 6.6375 6.6375 k = 0.3478-0.0000 0.4595 ( 7888 PWs) bands (ev): -23.1276 -23.1276 -23.0586 -23.0586 -20.4349 -20.4349 -20.3219 -20.3218 -14.6429 -14.6429 -14.5754 -14.5754 -13.1569 -13.1569 -13.0966 -13.0966 -11.4622 -11.4622 -11.3594 -11.3594 -8.5006 -8.5005 -8.4792 -8.4791 -6.5056 -6.5052 -6.3718 -6.3714 -6.0228 -6.0225 -5.9936 -5.9932 -5.6775 -5.6775 -5.6240 -5.6236 -5.5637 -5.5635 -5.5511 -5.5503 -5.2765 -5.2764 -5.2497 -5.2493 -4.2447 -4.2446 -4.0891 -4.0891 -2.3159 -2.3150 -2.2808 -2.2794 -1.8747 -1.8740 -1.6573 -1.6566 -1.4783 -1.4783 -1.4495 -1.4487 -0.9833 -0.9825 -0.8064 -0.8058 3.3469 3.3472 3.4828 3.4829 5.7283 5.7284 5.8962 5.8965 6.4134 6.4140 6.6528 6.6529 k = 0.3696-0.0000 0.4595 ( 7884 PWs) bands (ev): -23.1231 -23.1231 -23.0634 -23.0634 -20.4272 -20.4272 -20.3293 -20.3293 -14.6389 -14.6389 -14.5805 -14.5805 -13.1511 -13.1511 -13.0991 -13.0991 -11.4571 -11.4571 -11.3679 -11.3679 -8.4980 -8.4980 -8.4800 -8.4799 -6.4944 -6.4941 -6.3799 -6.3796 -6.0241 -6.0238 -5.9980 -5.9976 -5.6745 -5.6744 -5.6268 -5.6265 -5.5631 -5.5629 -5.5512 -5.5505 -5.2746 -5.2744 -5.2516 -5.2512 -4.2355 -4.2354 -4.1000 -4.1000 -2.3139 -2.3129 -2.2835 -2.2822 -1.8543 -1.8536 -1.6649 -1.6643 -1.4773 -1.4772 -1.4524 -1.4516 -0.9762 -0.9754 -0.8219 -0.8213 3.3576 3.3579 3.4753 3.4755 5.7366 5.7367 5.8834 5.8838 6.4384 6.4390 6.6629 6.6630 k = 0.3913-0.0000 0.4595 ( 7878 PWs) bands (ev): -23.1185 -23.1185 -23.0683 -23.0683 -20.4193 -20.4193 -20.3370 -20.3370 -14.6347 -14.6347 -14.5857 -14.5857 -13.1455 -13.1455 -13.1019 -13.1019 -11.4516 -11.4515 -11.3764 -11.3764 -8.4956 -8.4956 -8.4808 -8.4807 -6.4834 -6.4830 -6.3881 -6.3878 -6.0250 -6.0247 -6.0025 -6.0021 -5.6710 -5.6710 -5.6300 -5.6298 -5.5623 -5.5621 -5.5516 -5.5509 -5.2727 -5.2725 -5.2535 -5.2531 -4.2257 -4.2256 -4.1113 -4.1113 -2.3117 -2.3107 -2.2863 -2.2850 -1.8340 -1.8334 -1.6739 -1.6734 -1.4762 -1.4761 -1.4553 -1.4545 -0.9680 -0.9672 -0.8374 -0.8368 3.3684 3.3688 3.4674 3.4676 5.7459 5.7460 5.8705 5.8707 6.4635 6.4642 6.6659 6.6661 k = 0.4130-0.0000 0.4595 ( 7880 PWs) bands (ev): -23.1137 -23.1137 -23.0733 -23.0733 -20.4112 -20.4112 -20.3450 -20.3449 -14.6303 -14.6303 -14.5909 -14.5909 -13.1400 -13.1400 -13.1050 -13.1050 -11.4456 -11.4456 -11.3849 -11.3849 -8.4934 -8.4933 -8.4817 -8.4816 -6.4725 -6.4721 -6.3965 -6.3960 -6.0254 -6.0251 -6.0068 -6.0064 -5.6673 -5.6672 -5.6336 -5.6334 -5.5613 -5.5611 -5.5521 -5.5515 -5.2707 -5.2705 -5.2554 -5.2550 -4.2153 -4.2152 -4.1228 -4.1228 -2.3095 -2.3084 -2.2890 -2.2877 -1.8140 -1.8135 -1.6844 -1.6840 -1.4749 -1.4747 -1.4581 -1.4574 -0.9586 -0.9579 -0.8529 -0.8522 3.3793 3.3796 3.4591 3.4593 5.7561 5.7563 5.8573 5.8575 6.4887 6.4893 6.6611 6.6613 k = 0.4348-0.0000 0.4595 ( 7878 PWs) bands (ev): -23.1088 -23.1088 -23.0784 -23.0784 -20.4030 -20.4030 -20.3530 -20.3530 -14.6258 -14.6258 -14.5961 -14.5961 -13.1347 -13.1346 -13.1083 -13.1083 -11.4392 -11.4391 -11.3934 -11.3934 -8.4914 -8.4913 -8.4827 -8.4826 -6.4619 -6.4615 -6.4049 -6.4045 -6.0252 -6.0249 -6.0109 -6.0106 -5.6633 -5.6632 -5.6375 -5.6374 -5.5602 -5.5600 -5.5529 -5.5524 -5.2688 -5.2685 -5.2573 -5.2570 -4.2045 -4.2044 -4.1345 -4.1345 -2.3072 -2.3061 -2.2918 -2.2905 -1.7944 -1.7940 -1.6963 -1.6960 -1.4735 -1.4732 -1.4608 -1.4602 -0.9482 -0.9475 -0.8681 -0.8674 3.3900 3.3904 3.4502 3.4505 5.7672 5.7673 5.8440 5.8442 6.5138 6.5145 6.6490 6.6494 k = 0.4565-0.0000 0.4595 ( 7876 PWs) bands (ev): -23.1039 -23.1039 -23.0835 -23.0835 -20.3947 -20.3947 -20.3613 -20.3613 -14.6211 -14.6211 -14.6012 -14.6012 -13.1296 -13.1296 -13.1120 -13.1120 -11.4323 -11.4323 -11.4017 -11.4017 -8.4895 -8.4894 -8.4838 -8.4837 -6.4515 -6.4511 -6.4136 -6.4132 -6.0243 -6.0240 -6.0147 -6.0143 -5.6590 -5.6590 -5.6416 -5.6415 -5.5589 -5.5587 -5.5539 -5.5535 -5.2669 -5.2666 -5.2592 -5.2589 -4.1933 -4.1932 -4.1464 -4.1463 -2.3048 -2.3036 -2.2945 -2.2932 -1.7755 -1.7752 -1.7097 -1.7095 -1.4719 -1.4716 -1.4634 -1.4629 -0.9368 -0.9361 -0.8830 -0.8823 3.4007 3.4010 3.4410 3.4413 5.7790 5.7791 5.8306 5.8308 6.5388 6.5395 6.6316 6.6321 k = 0.4783-0.0000 0.4595 ( 7874 PWs) bands (ev): -23.0988 -23.0988 -23.0886 -23.0886 -20.3863 -20.3863 -20.3696 -20.3696 -14.6163 -14.6163 -14.6063 -14.6063 -13.1248 -13.1248 -13.1160 -13.1159 -11.4251 -11.4251 -11.4098 -11.4098 -8.4878 -8.4878 -8.4850 -8.4849 -6.4415 -6.4411 -6.4226 -6.4222 -6.0229 -6.0225 -6.0180 -6.0176 -5.6547 -5.6546 -5.6459 -5.6458 -5.5576 -5.5573 -5.5550 -5.5547 -5.2649 -5.2646 -5.2611 -5.2608 -4.1818 -4.1817 -4.1582 -4.1582 -2.3023 -2.3011 -2.2971 -2.2959 -1.7574 -1.7572 -1.7243 -1.7242 -1.4701 -1.4697 -1.4658 -1.4653 -0.9245 -0.9237 -0.8974 -0.8967 3.4112 3.4115 3.4314 3.4317 5.7913 5.7915 5.8173 5.8175 6.5636 6.5642 6.6107 6.6113 k = 0.5000-0.0000 0.4595 ( 7868 PWs) bands (ev): -23.0937 -23.0937 -23.0937 -23.0937 -20.3779 -20.3779 -20.3779 -20.3779 -14.6113 -14.6113 -14.6113 -14.6113 -13.1202 -13.1202 -13.1202 -13.1202 -11.4176 -11.4176 -11.4176 -11.4176 -8.4863 -8.4863 -8.4862 -8.4862 -6.4319 -6.4319 -6.4315 -6.4315 -6.0207 -6.0207 -6.0204 -6.0204 -5.6502 -5.6502 -5.6502 -5.6502 -5.5563 -5.5563 -5.5560 -5.5560 -5.2630 -5.2630 -5.2627 -5.2627 -4.1701 -4.1701 -4.1700 -4.1700 -2.2997 -2.2997 -2.2985 -2.2985 -1.7403 -1.7403 -1.7402 -1.7402 -1.4680 -1.4680 -1.4676 -1.4676 -0.9113 -0.9113 -0.9106 -0.9106 3.4214 3.4214 3.4217 3.4217 5.8041 5.8041 5.8043 5.8043 6.5877 6.5877 6.5883 6.5883 Writing output data file H2C2O.save init_run : 0.87s CPU 0.64s WALL ( 1 calls) electrons : 540.65s CPU 471.58s WALL ( 1 calls) Called by init_run: wfcinit : 0.01s CPU 0.01s WALL ( 1 calls) potinit : 0.28s CPU 0.27s WALL ( 1 calls) Called by electrons: c_bands : 540.64s CPU 471.56s WALL ( 1 calls) v_of_rho : 0.02s 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 : 0.05s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.23s CPU 0.31s WALL ( 242 calls) cegterg : 452.88s CPU 418.77s WALL ( 451 calls) Called by sum_band: Called by *egterg: h_psi : 280.28s CPU 221.30s WALL ( 6310 calls) s_psi : 7.16s CPU 5.78s WALL ( 6310 calls) g_psi : 0.27s CPU 0.25s WALL ( 5617 calls) cdiaghg : 196.10s CPU 190.97s WALL ( 5859 calls) cegterg:over : 17.60s CPU 17.38s WALL ( 5617 calls) cegterg:upda : 10.45s CPU 10.28s WALL ( 5617 calls) cegterg:last : 5.34s CPU 5.34s WALL ( 935 calls) cdiaghg:chol : 6.72s CPU 6.61s WALL ( 5859 calls) cdiaghg:inve : 4.99s CPU 5.13s WALL ( 5859 calls) cdiaghg:para : 12.08s CPU 12.09s WALL ( 11718 calls) Called by h_psi: h_psi:vloc : 260.38s CPU 204.50s WALL ( 6310 calls) h_psi:vnl : 19.54s CPU 16.51s WALL ( 6310 calls) add_vuspsi : 8.44s CPU 6.83s WALL ( 6310 calls) General routines calbec : 11.08s CPU 9.66s WALL ( 6310 calls) fft : 0.13s CPU 0.07s WALL ( 19 calls) ffts : 0.03s CPU 0.02s WALL ( 4 calls) fftw : 253.26s CPU 198.47s WALL ( 947688 calls) interpolate : 0.04s CPU 0.03s WALL ( 4 calls) davcio : 0.30s CPU 0.94s WALL ( 484 calls) Parallel routines fft_scatter : 169.98s CPU 145.40s WALL ( 947711 calls) PWSCF : 9m54.04s CPU 9m16.83s WALL This run was terminated on: 21:46:15 20Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=