Program PWSCF v.5.4.0 starts on 20Mar2017 at 23:52:59 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: ./Al4CN3O.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 31 18 5 2080 894 133 Max 32 19 6 2090 920 142 Sum 2273 1309 375 150051 65447 9943 bravais-lattice index = 14 lattice parameter (alat) = 9.7149 a.u. unit-cell volume = 1502.9504 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 4 number of electrons = 74.00 number of Kohn-Sham states= 88 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)= 9.714878 celldm(2)= 1.000000 celldm(3)= 1.769012 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.375998 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.375998 0.926620 0.000000 ) a(3) = ( 0.000000 0.000000 1.769012 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.405774 -0.000000 ) b(2) = ( 0.000000 1.079191 -0.000000 ) b(3) = ( 0.000000 0.000000 0.565287 ) 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 Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for 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 PseudoPot. # 4 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Al 3.00 26.98150 Al( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 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 [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8845060 ) 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 [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 314 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 2) = ( 0.0090843 0.0134899 -0.0000000), wk = 0.0031847 k( 3) = ( 0.0181686 0.0269798 -0.0000000), wk = 0.0031847 k( 4) = ( 0.0272529 0.0404697 -0.0000000), wk = 0.0031847 k( 5) = ( 0.0363373 0.0539595 -0.0000000), wk = 0.0031847 k( 6) = ( 0.0454216 0.0674494 -0.0000000), wk = 0.0031847 k( 7) = ( 0.0545059 0.0809393 -0.0000000), wk = 0.0031847 k( 8) = ( 0.0635902 0.0944292 -0.0000000), wk = 0.0031847 k( 9) = ( 0.0726745 0.1079191 -0.0000000), wk = 0.0031847 k( 10) = ( 0.0817588 0.1214090 -0.0000000), wk = 0.0031847 k( 11) = ( 0.0908431 0.1348988 -0.0000000), wk = 0.0031847 k( 12) = ( 0.0999274 0.1483887 -0.0000000), wk = 0.0031847 k( 13) = ( 0.1090118 0.1618786 -0.0000000), wk = 0.0031847 k( 14) = ( 0.1180961 0.1753685 -0.0000000), wk = 0.0031847 k( 15) = ( 0.1271804 0.1888584 -0.0000000), wk = 0.0031847 k( 16) = ( 0.1362647 0.2023483 -0.0000000), wk = 0.0031847 k( 17) = ( 0.1453490 0.2158381 -0.0000000), wk = 0.0031847 k( 18) = ( 0.1544333 0.2293280 -0.0000000), wk = 0.0031847 k( 19) = ( 0.1635176 0.2428179 -0.0000000), wk = 0.0031847 k( 20) = ( 0.1726020 0.2563078 -0.0000000), wk = 0.0031847 k( 21) = ( 0.1816863 0.2697977 -0.0000000), wk = 0.0031847 k( 22) = ( 0.1907706 0.2832876 -0.0000000), wk = 0.0031847 k( 23) = ( 0.1998549 0.2967774 -0.0000000), wk = 0.0031847 k( 24) = ( 0.2089392 0.3102673 -0.0000000), wk = 0.0031847 k( 25) = ( 0.2180235 0.3237572 -0.0000000), wk = 0.0031847 k( 26) = ( 0.2271078 0.3372471 -0.0000000), wk = 0.0031847 k( 27) = ( 0.2361921 0.3507370 -0.0000000), wk = 0.0031847 k( 28) = ( 0.2452765 0.3642269 -0.0000000), wk = 0.0031847 k( 29) = ( 0.2543608 0.3777167 -0.0000000), wk = 0.0031847 k( 30) = ( 0.2634451 0.3912066 -0.0000000), wk = 0.0031847 k( 31) = ( 0.2725294 0.4046965 -0.0000000), wk = 0.0031847 k( 32) = ( 0.2816137 0.4181864 -0.0000000), wk = 0.0031847 k( 33) = ( 0.2906980 0.4316763 -0.0000000), wk = 0.0031847 k( 34) = ( 0.2997823 0.4451661 -0.0000000), wk = 0.0031847 k( 35) = ( 0.3088667 0.4586560 -0.0000000), wk = 0.0031847 k( 36) = ( 0.3179510 0.4721459 -0.0000000), wk = 0.0031847 k( 37) = ( 0.3270353 0.4856358 -0.0000000), wk = 0.0031847 k( 38) = ( 0.3361196 0.4991257 -0.0000000), wk = 0.0031847 k( 39) = ( 0.3452039 0.5126156 -0.0000000), wk = 0.0031847 k( 40) = ( 0.3542882 0.5261054 -0.0000000), wk = 0.0031847 k( 41) = ( 0.3633725 0.5395953 -0.0000000), wk = 0.0031847 k( 42) = ( 0.3633725 0.5395953 -0.0000000), wk = 0.0031847 k( 43) = ( 0.3475737 0.5395953 -0.0000000), wk = 0.0031847 k( 44) = ( 0.3317749 0.5395953 -0.0000000), wk = 0.0031847 k( 45) = ( 0.3159761 0.5395953 -0.0000000), wk = 0.0031847 k( 46) = ( 0.3001773 0.5395953 -0.0000000), wk = 0.0031847 k( 47) = ( 0.2843785 0.5395953 -0.0000000), wk = 0.0031847 k( 48) = ( 0.2685797 0.5395953 -0.0000000), wk = 0.0031847 k( 49) = ( 0.2527809 0.5395953 -0.0000000), wk = 0.0031847 k( 50) = ( 0.2369821 0.5395953 -0.0000000), wk = 0.0031847 k( 51) = ( 0.2211833 0.5395953 -0.0000000), wk = 0.0031847 k( 52) = ( 0.2053845 0.5395953 -0.0000000), wk = 0.0031847 k( 53) = ( 0.1895857 0.5395953 -0.0000000), wk = 0.0031847 k( 54) = ( 0.1737869 0.5395953 -0.0000000), wk = 0.0031847 k( 55) = ( 0.1579881 0.5395953 -0.0000000), wk = 0.0031847 k( 56) = ( 0.1421892 0.5395953 -0.0000000), wk = 0.0031847 k( 57) = ( 0.1263904 0.5395953 -0.0000000), wk = 0.0031847 k( 58) = ( 0.1105916 0.5395953 -0.0000000), wk = 0.0031847 k( 59) = ( 0.0947928 0.5395953 -0.0000000), wk = 0.0031847 k( 60) = ( 0.0789940 0.5395953 -0.0000000), wk = 0.0031847 k( 61) = ( 0.0631952 0.5395953 -0.0000000), wk = 0.0031847 k( 62) = ( 0.0473964 0.5395953 -0.0000000), wk = 0.0031847 k( 63) = ( 0.0315976 0.5395953 -0.0000000), wk = 0.0031847 k( 64) = ( 0.0157988 0.5395953 -0.0000000), wk = 0.0031847 k( 65) = ( 0.0000000 0.5395953 -0.0000000), wk = 0.0031847 k( 66) = ( 0.0000000 0.5395953 -0.0000000), wk = 0.0031847 k( 67) = ( 0.0000000 0.5395953 0.0157024), wk = 0.0031847 k( 68) = ( 0.0000000 0.5395953 0.0314049), wk = 0.0031847 k( 69) = ( 0.0000000 0.5395953 0.0471073), wk = 0.0031847 k( 70) = ( 0.0000000 0.5395953 0.0628097), wk = 0.0031847 k( 71) = ( 0.0000000 0.5395953 0.0785121), wk = 0.0031847 k( 72) = ( 0.0000000 0.5395953 0.0942146), wk = 0.0031847 k( 73) = ( 0.0000000 0.5395953 0.1099170), wk = 0.0031847 k( 74) = ( 0.0000000 0.5395953 0.1256194), wk = 0.0031847 k( 75) = ( 0.0000000 0.5395953 0.1413218), wk = 0.0031847 k( 76) = ( 0.0000000 0.5395953 0.1570243), wk = 0.0031847 k( 77) = ( 0.0000000 0.5395953 0.1727267), wk = 0.0031847 k( 78) = ( 0.0000000 0.5395953 0.1884291), wk = 0.0031847 k( 79) = ( 0.0000000 0.5395953 0.2041315), wk = 0.0031847 k( 80) = ( 0.0000000 0.5395953 0.2198340), wk = 0.0031847 k( 81) = ( 0.0000000 0.5395953 0.2355364), wk = 0.0031847 k( 82) = ( 0.0000000 0.5395953 0.2512388), wk = 0.0031847 k( 83) = ( 0.0000000 0.5395953 0.2669412), wk = 0.0031847 k( 84) = ( 0.0000000 0.5395953 0.2826437), wk = 0.0031847 k( 85) = ( 0.0000000 0.5395953 0.2826437), wk = 0.0031847 k( 86) = ( 0.0157988 0.5395953 0.2826437), wk = 0.0031847 k( 87) = ( 0.0315976 0.5395953 0.2826437), wk = 0.0031847 k( 88) = ( 0.0473964 0.5395953 0.2826437), wk = 0.0031847 k( 89) = ( 0.0631952 0.5395953 0.2826437), wk = 0.0031847 k( 90) = ( 0.0789940 0.5395953 0.2826437), wk = 0.0031847 k( 91) = ( 0.0947928 0.5395953 0.2826437), wk = 0.0031847 k( 92) = ( 0.1105916 0.5395953 0.2826437), wk = 0.0031847 k( 93) = ( 0.1263904 0.5395953 0.2826437), wk = 0.0031847 k( 94) = ( 0.1421892 0.5395953 0.2826437), wk = 0.0031847 k( 95) = ( 0.1579881 0.5395953 0.2826437), wk = 0.0031847 k( 96) = ( 0.1737869 0.5395953 0.2826437), wk = 0.0031847 k( 97) = ( 0.1895857 0.5395953 0.2826437), wk = 0.0031847 k( 98) = ( 0.2053845 0.5395953 0.2826437), wk = 0.0031847 k( 99) = ( 0.2211833 0.5395953 0.2826437), wk = 0.0031847 k( 100) = ( 0.2369821 0.5395953 0.2826437), wk = 0.0031847 k( 101) = ( 0.2527809 0.5395953 0.2826437), wk = 0.0031847 k( 102) = ( 0.2685797 0.5395953 0.2826437), wk = 0.0031847 k( 103) = ( 0.2843785 0.5395953 0.2826437), wk = 0.0031847 k( 104) = ( 0.3001773 0.5395953 0.2826437), wk = 0.0031847 k( 105) = ( 0.3159761 0.5395953 0.2826437), wk = 0.0031847 k( 106) = ( 0.3317749 0.5395953 0.2826437), wk = 0.0031847 k( 107) = ( 0.3475737 0.5395953 0.2826437), wk = 0.0031847 k( 108) = ( 0.3633725 0.5395953 0.2826437), wk = 0.0031847 k( 109) = ( 0.3633725 0.5395953 0.2826437), wk = 0.0031847 k( 110) = ( 0.3542882 0.5261054 0.2826437), wk = 0.0031847 k( 111) = ( 0.3452039 0.5126156 0.2826437), wk = 0.0031847 k( 112) = ( 0.3361196 0.4991257 0.2826437), wk = 0.0031847 k( 113) = ( 0.3270353 0.4856358 0.2826437), wk = 0.0031847 k( 114) = ( 0.3179510 0.4721459 0.2826437), wk = 0.0031847 k( 115) = ( 0.3088667 0.4586560 0.2826437), wk = 0.0031847 k( 116) = ( 0.2997823 0.4451661 0.2826437), wk = 0.0031847 k( 117) = ( 0.2906980 0.4316763 0.2826437), wk = 0.0031847 k( 118) = ( 0.2816137 0.4181864 0.2826437), wk = 0.0031847 k( 119) = ( 0.2725294 0.4046965 0.2826437), wk = 0.0031847 k( 120) = ( 0.2634451 0.3912066 0.2826437), wk = 0.0031847 k( 121) = ( 0.2543608 0.3777167 0.2826437), wk = 0.0031847 k( 122) = ( 0.2452765 0.3642269 0.2826437), wk = 0.0031847 k( 123) = ( 0.2361921 0.3507370 0.2826437), wk = 0.0031847 k( 124) = ( 0.2271078 0.3372471 0.2826437), wk = 0.0031847 k( 125) = ( 0.2180235 0.3237572 0.2826437), wk = 0.0031847 k( 126) = ( 0.2089392 0.3102673 0.2826437), wk = 0.0031847 k( 127) = ( 0.1998549 0.2967774 0.2826437), wk = 0.0031847 k( 128) = ( 0.1907706 0.2832876 0.2826437), wk = 0.0031847 k( 129) = ( 0.1816863 0.2697977 0.2826437), wk = 0.0031847 k( 130) = ( 0.1726020 0.2563078 0.2826437), wk = 0.0031847 k( 131) = ( 0.1635176 0.2428179 0.2826437), wk = 0.0031847 k( 132) = ( 0.1544333 0.2293280 0.2826437), wk = 0.0031847 k( 133) = ( 0.1453490 0.2158381 0.2826437), wk = 0.0031847 k( 134) = ( 0.1362647 0.2023483 0.2826437), wk = 0.0031847 k( 135) = ( 0.1271804 0.1888584 0.2826437), wk = 0.0031847 k( 136) = ( 0.1180961 0.1753685 0.2826437), wk = 0.0031847 k( 137) = ( 0.1090118 0.1618786 0.2826437), wk = 0.0031847 k( 138) = ( 0.0999274 0.1483887 0.2826437), wk = 0.0031847 k( 139) = ( 0.0908431 0.1348988 0.2826437), wk = 0.0031847 k( 140) = ( 0.0817588 0.1214090 0.2826437), wk = 0.0031847 k( 141) = ( 0.0726745 0.1079191 0.2826437), wk = 0.0031847 k( 142) = ( 0.0635902 0.0944292 0.2826437), wk = 0.0031847 k( 143) = ( 0.0545059 0.0809393 0.2826437), wk = 0.0031847 k( 144) = ( 0.0454216 0.0674494 0.2826437), wk = 0.0031847 k( 145) = ( 0.0363373 0.0539595 0.2826437), wk = 0.0031847 k( 146) = ( 0.0272529 0.0404697 0.2826437), wk = 0.0031847 k( 147) = ( 0.0181686 0.0269798 0.2826437), wk = 0.0031847 k( 148) = ( 0.0090843 0.0134899 0.2826437), wk = 0.0031847 k( 149) = ( 0.0000000 0.0000000 0.2826437), wk = 0.0031847 k( 150) = ( 0.0000000 0.0000000 0.2826437), wk = 0.0031847 k( 151) = ( 0.0000000 0.0000000 0.2669412), wk = 0.0031847 k( 152) = ( 0.0000000 0.0000000 0.2512388), wk = 0.0031847 k( 153) = ( 0.0000000 0.0000000 0.2355364), wk = 0.0031847 k( 154) = ( 0.0000000 0.0000000 0.2198340), wk = 0.0031847 k( 155) = ( 0.0000000 0.0000000 0.2041315), wk = 0.0031847 k( 156) = ( 0.0000000 0.0000000 0.1884291), wk = 0.0031847 k( 157) = ( 0.0000000 0.0000000 0.1727267), wk = 0.0031847 k( 158) = ( 0.0000000 0.0000000 0.1570243), wk = 0.0031847 k( 159) = ( 0.0000000 0.0000000 0.1413218), wk = 0.0031847 k( 160) = ( 0.0000000 0.0000000 0.1256194), wk = 0.0031847 k( 161) = ( 0.0000000 0.0000000 0.1099170), wk = 0.0031847 k( 162) = ( 0.0000000 0.0000000 0.0942146), wk = 0.0031847 k( 163) = ( 0.0000000 0.0000000 0.0785121), wk = 0.0031847 k( 164) = ( 0.0000000 0.0000000 0.0628097), wk = 0.0031847 k( 165) = ( 0.0000000 0.0000000 0.0471073), wk = 0.0031847 k( 166) = ( 0.0000000 0.0000000 0.0314049), wk = 0.0031847 k( 167) = ( 0.0000000 0.0000000 0.0157024), wk = 0.0031847 k( 168) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 169) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 170) = ( -0.0135135 0.0091002 0.0000000), wk = 0.0031847 k( 171) = ( -0.0270270 0.0182005 0.0000000), wk = 0.0031847 k( 172) = ( -0.0405405 0.0273007 0.0000000), wk = 0.0031847 k( 173) = ( -0.0540540 0.0364009 0.0000000), wk = 0.0031847 k( 174) = ( -0.0675676 0.0455011 0.0000000), wk = 0.0031847 k( 175) = ( -0.0810811 0.0546014 0.0000000), wk = 0.0031847 k( 176) = ( -0.0945946 0.0637016 0.0000000), wk = 0.0031847 k( 177) = ( -0.1081081 0.0728018 0.0000000), wk = 0.0031847 k( 178) = ( -0.1216216 0.0819020 0.0000000), wk = 0.0031847 k( 179) = ( -0.1351351 0.0910023 0.0000000), wk = 0.0031847 k( 180) = ( -0.1486486 0.1001025 0.0000000), wk = 0.0031847 k( 181) = ( -0.1621622 0.1092027 0.0000000), wk = 0.0031847 k( 182) = ( -0.1756757 0.1183029 0.0000000), wk = 0.0031847 k( 183) = ( -0.1891892 0.1274032 0.0000000), wk = 0.0031847 k( 184) = ( -0.2027027 0.1365034 0.0000000), wk = 0.0031847 k( 185) = ( -0.2162162 0.1456036 0.0000000), wk = 0.0031847 k( 186) = ( -0.2297297 0.1547038 0.0000000), wk = 0.0031847 k( 187) = ( -0.2432432 0.1638041 0.0000000), wk = 0.0031847 k( 188) = ( -0.2567568 0.1729043 0.0000000), wk = 0.0031847 k( 189) = ( -0.2702703 0.1820045 0.0000000), wk = 0.0031847 k( 190) = ( -0.2837838 0.1911047 0.0000000), wk = 0.0031847 k( 191) = ( -0.2972973 0.2002050 0.0000000), wk = 0.0031847 k( 192) = ( -0.3108108 0.2093052 0.0000000), wk = 0.0031847 k( 193) = ( -0.3243243 0.2184054 0.0000000), wk = 0.0031847 k( 194) = ( -0.3378378 0.2275057 0.0000000), wk = 0.0031847 k( 195) = ( -0.3513514 0.2366059 0.0000000), wk = 0.0031847 k( 196) = ( -0.3648649 0.2457061 0.0000000), wk = 0.0031847 k( 197) = ( -0.3783784 0.2548063 0.0000000), wk = 0.0031847 k( 198) = ( -0.3918919 0.2639066 0.0000000), wk = 0.0031847 k( 199) = ( -0.4054054 0.2730068 0.0000000), wk = 0.0031847 k( 200) = ( -0.4189189 0.2821070 0.0000000), wk = 0.0031847 k( 201) = ( -0.4324324 0.2912072 0.0000000), wk = 0.0031847 k( 202) = ( -0.4459459 0.3003075 0.0000000), wk = 0.0031847 k( 203) = ( -0.4594595 0.3094077 0.0000000), wk = 0.0031847 k( 204) = ( -0.4729730 0.3185079 0.0000000), wk = 0.0031847 k( 205) = ( -0.4864865 0.3276081 0.0000000), wk = 0.0031847 k( 206) = ( -0.5000000 0.3367084 0.0000000), wk = 0.0031847 k( 207) = ( -0.5000000 0.3367084 0.0000000), wk = 0.0031847 k( 208) = ( -0.4908915 0.3502342 -0.0000000), wk = 0.0031847 k( 209) = ( -0.4817830 0.3637600 -0.0000000), wk = 0.0031847 k( 210) = ( -0.4726745 0.3772858 -0.0000000), wk = 0.0031847 k( 211) = ( -0.4635660 0.3908116 -0.0000000), wk = 0.0031847 k( 212) = ( -0.4544575 0.4043374 -0.0000000), wk = 0.0031847 k( 213) = ( -0.4453490 0.4178632 -0.0000000), wk = 0.0031847 k( 214) = ( -0.4362405 0.4313890 -0.0000000), wk = 0.0031847 k( 215) = ( -0.4271320 0.4449148 -0.0000000), wk = 0.0031847 k( 216) = ( -0.4180235 0.4584405 -0.0000000), wk = 0.0031847 k( 217) = ( -0.4089150 0.4719663 -0.0000000), wk = 0.0031847 k( 218) = ( -0.3998065 0.4854921 -0.0000000), wk = 0.0031847 k( 219) = ( -0.3906980 0.4990179 -0.0000000), wk = 0.0031847 k( 220) = ( -0.3815895 0.5125437 -0.0000000), wk = 0.0031847 k( 221) = ( -0.3724810 0.5260695 -0.0000000), wk = 0.0031847 k( 222) = ( -0.3633725 0.5395953 -0.0000000), wk = 0.0031847 k( 223) = ( -0.3633725 0.5395953 -0.0000000), wk = 0.0031847 k( 224) = ( -0.3633725 0.5395953 0.0157024), wk = 0.0031847 k( 225) = ( -0.3633725 0.5395953 0.0314049), wk = 0.0031847 k( 226) = ( -0.3633725 0.5395953 0.0471073), wk = 0.0031847 k( 227) = ( -0.3633725 0.5395953 0.0628097), wk = 0.0031847 k( 228) = ( -0.3633725 0.5395953 0.0785121), wk = 0.0031847 k( 229) = ( -0.3633725 0.5395953 0.0942146), wk = 0.0031847 k( 230) = ( -0.3633725 0.5395953 0.1099170), wk = 0.0031847 k( 231) = ( -0.3633725 0.5395953 0.1256194), wk = 0.0031847 k( 232) = ( -0.3633725 0.5395953 0.1413218), wk = 0.0031847 k( 233) = ( -0.3633725 0.5395953 0.1570243), wk = 0.0031847 k( 234) = ( -0.3633725 0.5395953 0.1727267), wk = 0.0031847 k( 235) = ( -0.3633725 0.5395953 0.1884291), wk = 0.0031847 k( 236) = ( -0.3633725 0.5395953 0.2041315), wk = 0.0031847 k( 237) = ( -0.3633725 0.5395953 0.2198340), wk = 0.0031847 k( 238) = ( -0.3633725 0.5395953 0.2355364), wk = 0.0031847 k( 239) = ( -0.3633725 0.5395953 0.2512388), wk = 0.0031847 k( 240) = ( -0.3633725 0.5395953 0.2669412), wk = 0.0031847 k( 241) = ( -0.3633725 0.5395953 0.2826437), wk = 0.0031847 k( 242) = ( -0.3633725 0.5395953 0.2826437), wk = 0.0031847 k( 243) = ( -0.3724810 0.5260695 0.2826437), wk = 0.0031847 k( 244) = ( -0.3815895 0.5125437 0.2826437), wk = 0.0031847 k( 245) = ( -0.3906980 0.4990179 0.2826437), wk = 0.0031847 k( 246) = ( -0.3998065 0.4854921 0.2826437), wk = 0.0031847 k( 247) = ( -0.4089150 0.4719663 0.2826437), wk = 0.0031847 k( 248) = ( -0.4180235 0.4584405 0.2826437), wk = 0.0031847 k( 249) = ( -0.4271320 0.4449148 0.2826437), wk = 0.0031847 k( 250) = ( -0.4362405 0.4313890 0.2826437), wk = 0.0031847 k( 251) = ( -0.4453490 0.4178632 0.2826437), wk = 0.0031847 k( 252) = ( -0.4544575 0.4043374 0.2826437), wk = 0.0031847 k( 253) = ( -0.4635660 0.3908116 0.2826437), wk = 0.0031847 k( 254) = ( -0.4726745 0.3772858 0.2826437), wk = 0.0031847 k( 255) = ( -0.4817830 0.3637600 0.2826437), wk = 0.0031847 k( 256) = ( -0.4908915 0.3502342 0.2826437), wk = 0.0031847 k( 257) = ( -0.5000000 0.3367084 0.2826437), wk = 0.0031847 k( 258) = ( -0.5000000 0.3367084 0.2826437), wk = 0.0031847 k( 259) = ( -0.5000000 0.3367084 0.2669412), wk = 0.0031847 k( 260) = ( -0.5000000 0.3367084 0.2512388), wk = 0.0031847 k( 261) = ( -0.5000000 0.3367084 0.2355364), wk = 0.0031847 k( 262) = ( -0.5000000 0.3367084 0.2198340), wk = 0.0031847 k( 263) = ( -0.5000000 0.3367084 0.2041315), wk = 0.0031847 k( 264) = ( -0.5000000 0.3367084 0.1884291), wk = 0.0031847 k( 265) = ( -0.5000000 0.3367084 0.1727267), wk = 0.0031847 k( 266) = ( -0.5000000 0.3367084 0.1570243), wk = 0.0031847 k( 267) = ( -0.5000000 0.3367084 0.1413218), wk = 0.0031847 k( 268) = ( -0.5000000 0.3367084 0.1256194), wk = 0.0031847 k( 269) = ( -0.5000000 0.3367084 0.1099170), wk = 0.0031847 k( 270) = ( -0.5000000 0.3367084 0.0942146), wk = 0.0031847 k( 271) = ( -0.5000000 0.3367084 0.0785121), wk = 0.0031847 k( 272) = ( -0.5000000 0.3367084 0.0628097), wk = 0.0031847 k( 273) = ( -0.5000000 0.3367084 0.0471073), wk = 0.0031847 k( 274) = ( -0.5000000 0.3367084 0.0314049), wk = 0.0031847 k( 275) = ( -0.5000000 0.3367084 0.0157024), wk = 0.0031847 k( 276) = ( -0.5000000 0.3367084 0.0000000), wk = 0.0031847 k( 277) = ( 0.0000000 0.0000000 0.2826437), wk = 0.0031847 k( 278) = ( -0.0135135 0.0091002 0.2826437), wk = 0.0031847 k( 279) = ( -0.0270270 0.0182005 0.2826437), wk = 0.0031847 k( 280) = ( -0.0405405 0.0273007 0.2826437), wk = 0.0031847 k( 281) = ( -0.0540540 0.0364009 0.2826437), wk = 0.0031847 k( 282) = ( -0.0675676 0.0455011 0.2826437), wk = 0.0031847 k( 283) = ( -0.0810811 0.0546014 0.2826437), wk = 0.0031847 k( 284) = ( -0.0945946 0.0637016 0.2826437), wk = 0.0031847 k( 285) = ( -0.1081081 0.0728018 0.2826437), wk = 0.0031847 k( 286) = ( -0.1216216 0.0819020 0.2826437), wk = 0.0031847 k( 287) = ( -0.1351351 0.0910023 0.2826437), wk = 0.0031847 k( 288) = ( -0.1486486 0.1001025 0.2826437), wk = 0.0031847 k( 289) = ( -0.1621622 0.1092027 0.2826437), wk = 0.0031847 k( 290) = ( -0.1756757 0.1183029 0.2826437), wk = 0.0031847 k( 291) = ( -0.1891892 0.1274032 0.2826437), wk = 0.0031847 k( 292) = ( -0.2027027 0.1365034 0.2826437), wk = 0.0031847 k( 293) = ( -0.2162162 0.1456036 0.2826437), wk = 0.0031847 k( 294) = ( -0.2297297 0.1547038 0.2826437), wk = 0.0031847 k( 295) = ( -0.2432432 0.1638041 0.2826437), wk = 0.0031847 k( 296) = ( -0.2567568 0.1729043 0.2826437), wk = 0.0031847 k( 297) = ( -0.2702703 0.1820045 0.2826437), wk = 0.0031847 k( 298) = ( -0.2837838 0.1911047 0.2826437), wk = 0.0031847 k( 299) = ( -0.2972973 0.2002050 0.2826437), wk = 0.0031847 k( 300) = ( -0.3108108 0.2093052 0.2826437), wk = 0.0031847 k( 301) = ( -0.3243243 0.2184054 0.2826437), wk = 0.0031847 k( 302) = ( -0.3378378 0.2275057 0.2826437), wk = 0.0031847 k( 303) = ( -0.3513514 0.2366059 0.2826437), wk = 0.0031847 k( 304) = ( -0.3648649 0.2457061 0.2826437), wk = 0.0031847 k( 305) = ( -0.3783784 0.2548063 0.2826437), wk = 0.0031847 k( 306) = ( -0.3918919 0.2639066 0.2826437), wk = 0.0031847 k( 307) = ( -0.4054054 0.2730068 0.2826437), wk = 0.0031847 k( 308) = ( -0.4189189 0.2821070 0.2826437), wk = 0.0031847 k( 309) = ( -0.4324324 0.2912072 0.2826437), wk = 0.0031847 k( 310) = ( -0.4459459 0.3003075 0.2826437), wk = 0.0031847 k( 311) = ( -0.4594595 0.3094077 0.2826437), wk = 0.0031847 k( 312) = ( -0.4729730 0.3185079 0.2826437), wk = 0.0031847 k( 313) = ( -0.4864865 0.3276081 0.2826437), wk = 0.0031847 k( 314) = ( -0.5000000 0.3367084 0.2826437), wk = 0.0031847 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 2) = ( 0.0090843 0.0090843 -0.0000000), wk = 0.0031847 k( 3) = ( 0.0181686 0.0181686 -0.0000000), wk = 0.0031847 k( 4) = ( 0.0272529 0.0272529 -0.0000000), wk = 0.0031847 k( 5) = ( 0.0363373 0.0363373 -0.0000000), wk = 0.0031847 k( 6) = ( 0.0454216 0.0454216 -0.0000000), wk = 0.0031847 k( 7) = ( 0.0545059 0.0545059 -0.0000000), wk = 0.0031847 k( 8) = ( 0.0635902 0.0635902 0.0000000), wk = 0.0031847 k( 9) = ( 0.0726745 0.0726745 0.0000000), wk = 0.0031847 k( 10) = ( 0.0817588 0.0817588 -0.0000000), wk = 0.0031847 k( 11) = ( 0.0908431 0.0908431 0.0000000), wk = 0.0031847 k( 12) = ( 0.0999274 0.0999274 0.0000000), wk = 0.0031847 k( 13) = ( 0.1090118 0.1090118 -0.0000000), wk = 0.0031847 k( 14) = ( 0.1180961 0.1180961 -0.0000000), wk = 0.0031847 k( 15) = ( 0.1271804 0.1271804 0.0000000), wk = 0.0031847 k( 16) = ( 0.1362647 0.1362647 -0.0000000), wk = 0.0031847 k( 17) = ( 0.1453490 0.1453490 0.0000000), wk = 0.0031847 k( 18) = ( 0.1544333 0.1544333 -0.0000000), wk = 0.0031847 k( 19) = ( 0.1635176 0.1635176 -0.0000000), wk = 0.0031847 k( 20) = ( 0.1726020 0.1726020 0.0000000), wk = 0.0031847 k( 21) = ( 0.1816863 0.1816863 0.0000000), wk = 0.0031847 k( 22) = ( 0.1907706 0.1907706 -0.0000000), wk = 0.0031847 k( 23) = ( 0.1998549 0.1998549 -0.0000000), wk = 0.0031847 k( 24) = ( 0.2089392 0.2089392 -0.0000000), wk = 0.0031847 k( 25) = ( 0.2180235 0.2180235 -0.0000000), wk = 0.0031847 k( 26) = ( 0.2271078 0.2271078 0.0000000), wk = 0.0031847 k( 27) = ( 0.2361921 0.2361921 -0.0000000), wk = 0.0031847 k( 28) = ( 0.2452765 0.2452765 0.0000000), wk = 0.0031847 k( 29) = ( 0.2543608 0.2543608 -0.0000000), wk = 0.0031847 k( 30) = ( 0.2634451 0.2634451 -0.0000000), wk = 0.0031847 k( 31) = ( 0.2725294 0.2725294 -0.0000000), wk = 0.0031847 k( 32) = ( 0.2816137 0.2816137 0.0000000), wk = 0.0031847 k( 33) = ( 0.2906980 0.2906980 0.0000000), wk = 0.0031847 k( 34) = ( 0.2997823 0.2997823 -0.0000000), wk = 0.0031847 k( 35) = ( 0.3088667 0.3088667 -0.0000000), wk = 0.0031847 k( 36) = ( 0.3179510 0.3179510 -0.0000000), wk = 0.0031847 k( 37) = ( 0.3270353 0.3270353 0.0000000), wk = 0.0031847 k( 38) = ( 0.3361196 0.3361196 -0.0000000), wk = 0.0031847 k( 39) = ( 0.3452039 0.3452039 0.0000000), wk = 0.0031847 k( 40) = ( 0.3542882 0.3542882 -0.0000000), wk = 0.0031847 k( 41) = ( 0.3633725 0.3633725 -0.0000000), wk = 0.0031847 k( 42) = ( 0.3633725 0.3633725 -0.0000000), wk = 0.0031847 k( 43) = ( 0.3475737 0.3693129 -0.0000000), wk = 0.0031847 k( 44) = ( 0.3317749 0.3752532 -0.0000000), wk = 0.0031847 k( 45) = ( 0.3159761 0.3811935 -0.0000000), wk = 0.0031847 k( 46) = ( 0.3001773 0.3871338 -0.0000000), wk = 0.0031847 k( 47) = ( 0.2843785 0.3930742 -0.0000000), wk = 0.0031847 k( 48) = ( 0.2685797 0.3990145 -0.0000000), wk = 0.0031847 k( 49) = ( 0.2527809 0.4049548 -0.0000000), wk = 0.0031847 k( 50) = ( 0.2369821 0.4108951 0.0000000), wk = 0.0031847 k( 51) = ( 0.2211833 0.4168355 0.0000000), wk = 0.0031847 k( 52) = ( 0.2053845 0.4227758 0.0000000), wk = 0.0031847 k( 53) = ( 0.1895857 0.4287161 -0.0000000), wk = 0.0031847 k( 54) = ( 0.1737869 0.4346564 -0.0000000), wk = 0.0031847 k( 55) = ( 0.1579881 0.4405967 -0.0000000), wk = 0.0031847 k( 56) = ( 0.1421892 0.4465371 0.0000000), wk = 0.0031847 k( 57) = ( 0.1263904 0.4524774 0.0000000), wk = 0.0031847 k( 58) = ( 0.1105916 0.4584177 -0.0000000), wk = 0.0031847 k( 59) = ( 0.0947928 0.4643580 -0.0000000), wk = 0.0031847 k( 60) = ( 0.0789940 0.4702984 -0.0000000), wk = 0.0031847 k( 61) = ( 0.0631952 0.4762387 -0.0000000), wk = 0.0031847 k( 62) = ( 0.0473964 0.4821790 -0.0000000), wk = 0.0031847 k( 63) = ( 0.0315976 0.4881193 -0.0000000), wk = 0.0031847 k( 64) = ( 0.0157988 0.4940597 0.0000000), wk = 0.0031847 k( 65) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031847 k( 66) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0031847 k( 67) = ( 0.0000000 0.5000000 0.0277778), wk = 0.0031847 k( 68) = ( 0.0000000 0.5000000 0.0555556), wk = 0.0031847 k( 69) = ( 0.0000000 0.5000000 0.0833333), wk = 0.0031847 k( 70) = ( 0.0000000 0.5000000 0.1111111), wk = 0.0031847 k( 71) = ( 0.0000000 0.5000000 0.1388889), wk = 0.0031847 k( 72) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0031847 k( 73) = ( 0.0000000 0.5000000 0.1944444), wk = 0.0031847 k( 74) = ( 0.0000000 0.5000000 0.2222222), wk = 0.0031847 k( 75) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0031847 k( 76) = ( 0.0000000 0.5000000 0.2777778), wk = 0.0031847 k( 77) = ( 0.0000000 0.5000000 0.3055556), wk = 0.0031847 k( 78) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0031847 k( 79) = ( 0.0000000 0.5000000 0.3611111), wk = 0.0031847 k( 80) = ( 0.0000000 0.5000000 0.3888889), wk = 0.0031847 k( 81) = ( 0.0000000 0.5000000 0.4166667), wk = 0.0031847 k( 82) = ( 0.0000000 0.5000000 0.4444444), wk = 0.0031847 k( 83) = ( 0.0000000 0.5000000 0.4722222), wk = 0.0031847 k( 84) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031847 k( 85) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031847 k( 86) = ( 0.0157988 0.4940597 0.5000000), wk = 0.0031847 k( 87) = ( 0.0315976 0.4881193 0.5000000), wk = 0.0031847 k( 88) = ( 0.0473964 0.4821790 0.5000000), wk = 0.0031847 k( 89) = ( 0.0631952 0.4762387 0.5000000), wk = 0.0031847 k( 90) = ( 0.0789940 0.4702984 0.5000000), wk = 0.0031847 k( 91) = ( 0.0947928 0.4643580 0.5000000), wk = 0.0031847 k( 92) = ( 0.1105916 0.4584177 0.5000000), wk = 0.0031847 k( 93) = ( 0.1263904 0.4524774 0.5000000), wk = 0.0031847 k( 94) = ( 0.1421892 0.4465371 0.5000000), wk = 0.0031847 k( 95) = ( 0.1579881 0.4405967 0.5000000), wk = 0.0031847 k( 96) = ( 0.1737869 0.4346564 0.5000000), wk = 0.0031847 k( 97) = ( 0.1895857 0.4287161 0.5000000), wk = 0.0031847 k( 98) = ( 0.2053845 0.4227758 0.5000000), wk = 0.0031847 k( 99) = ( 0.2211833 0.4168355 0.5000000), wk = 0.0031847 k( 100) = ( 0.2369821 0.4108951 0.5000000), wk = 0.0031847 k( 101) = ( 0.2527809 0.4049548 0.5000000), wk = 0.0031847 k( 102) = ( 0.2685797 0.3990145 0.5000000), wk = 0.0031847 k( 103) = ( 0.2843785 0.3930742 0.5000000), wk = 0.0031847 k( 104) = ( 0.3001773 0.3871338 0.5000000), wk = 0.0031847 k( 105) = ( 0.3159761 0.3811935 0.5000000), wk = 0.0031847 k( 106) = ( 0.3317749 0.3752532 0.5000000), wk = 0.0031847 k( 107) = ( 0.3475737 0.3693129 0.5000000), wk = 0.0031847 k( 108) = ( 0.3633725 0.3633725 0.5000000), wk = 0.0031847 k( 109) = ( 0.3633725 0.3633725 0.5000000), wk = 0.0031847 k( 110) = ( 0.3542882 0.3542882 0.5000000), wk = 0.0031847 k( 111) = ( 0.3452039 0.3452039 0.5000000), wk = 0.0031847 k( 112) = ( 0.3361196 0.3361196 0.5000000), wk = 0.0031847 k( 113) = ( 0.3270353 0.3270353 0.5000000), wk = 0.0031847 k( 114) = ( 0.3179510 0.3179510 0.5000000), wk = 0.0031847 k( 115) = ( 0.3088667 0.3088667 0.5000000), wk = 0.0031847 k( 116) = ( 0.2997823 0.2997823 0.5000000), wk = 0.0031847 k( 117) = ( 0.2906980 0.2906980 0.5000000), wk = 0.0031847 k( 118) = ( 0.2816137 0.2816137 0.5000000), wk = 0.0031847 k( 119) = ( 0.2725294 0.2725294 0.5000000), wk = 0.0031847 k( 120) = ( 0.2634451 0.2634451 0.5000000), wk = 0.0031847 k( 121) = ( 0.2543608 0.2543608 0.5000000), wk = 0.0031847 k( 122) = ( 0.2452765 0.2452765 0.5000000), wk = 0.0031847 k( 123) = ( 0.2361921 0.2361921 0.5000000), wk = 0.0031847 k( 124) = ( 0.2271078 0.2271078 0.5000000), wk = 0.0031847 k( 125) = ( 0.2180235 0.2180235 0.5000000), wk = 0.0031847 k( 126) = ( 0.2089392 0.2089392 0.5000000), wk = 0.0031847 k( 127) = ( 0.1998549 0.1998549 0.5000000), wk = 0.0031847 k( 128) = ( 0.1907706 0.1907706 0.5000000), wk = 0.0031847 k( 129) = ( 0.1816863 0.1816863 0.5000000), wk = 0.0031847 k( 130) = ( 0.1726020 0.1726020 0.5000000), wk = 0.0031847 k( 131) = ( 0.1635176 0.1635176 0.5000000), wk = 0.0031847 k( 132) = ( 0.1544333 0.1544333 0.5000000), wk = 0.0031847 k( 133) = ( 0.1453490 0.1453490 0.5000000), wk = 0.0031847 k( 134) = ( 0.1362647 0.1362647 0.5000000), wk = 0.0031847 k( 135) = ( 0.1271804 0.1271804 0.5000000), wk = 0.0031847 k( 136) = ( 0.1180961 0.1180961 0.5000000), wk = 0.0031847 k( 137) = ( 0.1090118 0.1090118 0.5000000), wk = 0.0031847 k( 138) = ( 0.0999274 0.0999274 0.5000000), wk = 0.0031847 k( 139) = ( 0.0908431 0.0908431 0.5000000), wk = 0.0031847 k( 140) = ( 0.0817588 0.0817588 0.5000000), wk = 0.0031847 k( 141) = ( 0.0726745 0.0726745 0.5000000), wk = 0.0031847 k( 142) = ( 0.0635902 0.0635902 0.5000000), wk = 0.0031847 k( 143) = ( 0.0545059 0.0545059 0.5000000), wk = 0.0031847 k( 144) = ( 0.0454216 0.0454216 0.5000000), wk = 0.0031847 k( 145) = ( 0.0363373 0.0363373 0.5000000), wk = 0.0031847 k( 146) = ( 0.0272529 0.0272529 0.5000000), wk = 0.0031847 k( 147) = ( 0.0181686 0.0181686 0.5000000), wk = 0.0031847 k( 148) = ( 0.0090843 0.0090843 0.5000000), wk = 0.0031847 k( 149) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031847 k( 150) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031847 k( 151) = ( 0.0000000 0.0000000 0.4722222), wk = 0.0031847 k( 152) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0031847 k( 153) = ( 0.0000000 0.0000000 0.4166667), wk = 0.0031847 k( 154) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0031847 k( 155) = ( 0.0000000 0.0000000 0.3611111), wk = 0.0031847 k( 156) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0031847 k( 157) = ( 0.0000000 0.0000000 0.3055556), wk = 0.0031847 k( 158) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0031847 k( 159) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0031847 k( 160) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0031847 k( 161) = ( 0.0000000 0.0000000 0.1944444), wk = 0.0031847 k( 162) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0031847 k( 163) = ( 0.0000000 0.0000000 0.1388889), wk = 0.0031847 k( 164) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0031847 k( 165) = ( 0.0000000 0.0000000 0.0833333), wk = 0.0031847 k( 166) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0031847 k( 167) = ( 0.0000000 0.0000000 0.0277778), wk = 0.0031847 k( 168) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 169) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031847 k( 170) = ( -0.0135135 0.0135135 0.0000000), wk = 0.0031847 k( 171) = ( -0.0270270 0.0270270 0.0000000), wk = 0.0031847 k( 172) = ( -0.0405405 0.0405405 -0.0000000), wk = 0.0031847 k( 173) = ( -0.0540540 0.0540540 0.0000000), wk = 0.0031847 k( 174) = ( -0.0675676 0.0675676 0.0000000), wk = 0.0031847 k( 175) = ( -0.0810811 0.0810811 -0.0000000), wk = 0.0031847 k( 176) = ( -0.0945946 0.0945946 0.0000000), wk = 0.0031847 k( 177) = ( -0.1081081 0.1081081 0.0000000), wk = 0.0031847 k( 178) = ( -0.1216216 0.1216216 0.0000000), wk = 0.0031847 k( 179) = ( -0.1351351 0.1351351 0.0000000), wk = 0.0031847 k( 180) = ( -0.1486486 0.1486486 0.0000000), wk = 0.0031847 k( 181) = ( -0.1621622 0.1621622 -0.0000000), wk = 0.0031847 k( 182) = ( -0.1756757 0.1756757 -0.0000000), wk = 0.0031847 k( 183) = ( -0.1891892 0.1891892 0.0000000), wk = 0.0031847 k( 184) = ( -0.2027027 0.2027027 -0.0000000), wk = 0.0031847 k( 185) = ( -0.2162162 0.2162162 0.0000000), wk = 0.0031847 k( 186) = ( -0.2297297 0.2297297 0.0000000), wk = 0.0031847 k( 187) = ( -0.2432432 0.2432432 0.0000000), wk = 0.0031847 k( 188) = ( -0.2567568 0.2567568 -0.0000000), wk = 0.0031847 k( 189) = ( -0.2702703 0.2702703 0.0000000), wk = 0.0031847 k( 190) = ( -0.2837838 0.2837838 0.0000000), wk = 0.0031847 k( 191) = ( -0.2972973 0.2972973 0.0000000), wk = 0.0031847 k( 192) = ( -0.3108108 0.3108108 -0.0000000), wk = 0.0031847 k( 193) = ( -0.3243243 0.3243243 -0.0000000), wk = 0.0031847 k( 194) = ( -0.3378378 0.3378378 -0.0000000), wk = 0.0031847 k( 195) = ( -0.3513514 0.3513513 -0.0000000), wk = 0.0031847 k( 196) = ( -0.3648649 0.3648649 0.0000000), wk = 0.0031847 k( 197) = ( -0.3783784 0.3783784 0.0000000), wk = 0.0031847 k( 198) = ( -0.3918919 0.3918919 -0.0000000), wk = 0.0031847 k( 199) = ( -0.4054054 0.4054054 0.0000000), wk = 0.0031847 k( 200) = ( -0.4189189 0.4189189 0.0000000), wk = 0.0031847 k( 201) = ( -0.4324324 0.4324324 0.0000000), wk = 0.0031847 k( 202) = ( -0.4459459 0.4459459 -0.0000000), wk = 0.0031847 k( 203) = ( -0.4594595 0.4594595 0.0000000), wk = 0.0031847 k( 204) = ( -0.4729730 0.4729730 0.0000000), wk = 0.0031847 k( 205) = ( -0.4864865 0.4864865 0.0000000), wk = 0.0031847 k( 206) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0031847 k( 207) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0031847 k( 208) = ( -0.4908915 0.5091085 0.0000000), wk = 0.0031847 k( 209) = ( -0.4817830 0.5182170 -0.0000000), wk = 0.0031847 k( 210) = ( -0.4726745 0.5273255 -0.0000000), wk = 0.0031847 k( 211) = ( -0.4635660 0.5364340 0.0000000), wk = 0.0031847 k( 212) = ( -0.4544575 0.5455425 0.0000000), wk = 0.0031847 k( 213) = ( -0.4453490 0.5546510 -0.0000000), wk = 0.0031847 k( 214) = ( -0.4362405 0.5637595 0.0000000), wk = 0.0031847 k( 215) = ( -0.4271320 0.5728680 0.0000000), wk = 0.0031847 k( 216) = ( -0.4180235 0.5819765 0.0000000), wk = 0.0031847 k( 217) = ( -0.4089150 0.5910850 0.0000000), wk = 0.0031847 k( 218) = ( -0.3998065 0.6001935 0.0000000), wk = 0.0031847 k( 219) = ( -0.3906980 0.6093020 0.0000000), wk = 0.0031847 k( 220) = ( -0.3815895 0.6184105 -0.0000000), wk = 0.0031847 k( 221) = ( -0.3724810 0.6275190 -0.0000000), wk = 0.0031847 k( 222) = ( -0.3633725 0.6366275 -0.0000000), wk = 0.0031847 k( 223) = ( -0.3633725 0.6366275 -0.0000000), wk = 0.0031847 k( 224) = ( -0.3633725 0.6366275 0.0277778), wk = 0.0031847 k( 225) = ( -0.3633725 0.6366275 0.0555556), wk = 0.0031847 k( 226) = ( -0.3633725 0.6366275 0.0833333), wk = 0.0031847 k( 227) = ( -0.3633725 0.6366275 0.1111111), wk = 0.0031847 k( 228) = ( -0.3633725 0.6366275 0.1388889), wk = 0.0031847 k( 229) = ( -0.3633725 0.6366275 0.1666667), wk = 0.0031847 k( 230) = ( -0.3633725 0.6366275 0.1944444), wk = 0.0031847 k( 231) = ( -0.3633725 0.6366275 0.2222222), wk = 0.0031847 k( 232) = ( -0.3633725 0.6366275 0.2500000), wk = 0.0031847 k( 233) = ( -0.3633725 0.6366275 0.2777778), wk = 0.0031847 k( 234) = ( -0.3633725 0.6366275 0.3055556), wk = 0.0031847 k( 235) = ( -0.3633725 0.6366275 0.3333333), wk = 0.0031847 k( 236) = ( -0.3633725 0.6366275 0.3611111), wk = 0.0031847 k( 237) = ( -0.3633725 0.6366275 0.3888889), wk = 0.0031847 k( 238) = ( -0.3633725 0.6366275 0.4166667), wk = 0.0031847 k( 239) = ( -0.3633725 0.6366275 0.4444444), wk = 0.0031847 k( 240) = ( -0.3633725 0.6366275 0.4722222), wk = 0.0031847 k( 241) = ( -0.3633725 0.6366275 0.5000000), wk = 0.0031847 k( 242) = ( -0.3633725 0.6366275 0.5000000), wk = 0.0031847 k( 243) = ( -0.3724810 0.6275190 0.5000000), wk = 0.0031847 k( 244) = ( -0.3815895 0.6184105 0.5000000), wk = 0.0031847 k( 245) = ( -0.3906980 0.6093020 0.5000000), wk = 0.0031847 k( 246) = ( -0.3998065 0.6001935 0.5000000), wk = 0.0031847 k( 247) = ( -0.4089150 0.5910850 0.5000000), wk = 0.0031847 k( 248) = ( -0.4180235 0.5819765 0.5000000), wk = 0.0031847 k( 249) = ( -0.4271320 0.5728680 0.5000000), wk = 0.0031847 k( 250) = ( -0.4362405 0.5637595 0.5000000), wk = 0.0031847 k( 251) = ( -0.4453490 0.5546510 0.5000000), wk = 0.0031847 k( 252) = ( -0.4544575 0.5455425 0.5000000), wk = 0.0031847 k( 253) = ( -0.4635660 0.5364340 0.5000000), wk = 0.0031847 k( 254) = ( -0.4726745 0.5273255 0.5000000), wk = 0.0031847 k( 255) = ( -0.4817830 0.5182170 0.5000000), wk = 0.0031847 k( 256) = ( -0.4908915 0.5091085 0.5000000), wk = 0.0031847 k( 257) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0031847 k( 258) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0031847 k( 259) = ( -0.5000000 0.5000000 0.4722222), wk = 0.0031847 k( 260) = ( -0.5000000 0.5000000 0.4444444), wk = 0.0031847 k( 261) = ( -0.5000000 0.5000000 0.4166667), wk = 0.0031847 k( 262) = ( -0.5000000 0.5000000 0.3888889), wk = 0.0031847 k( 263) = ( -0.5000000 0.5000000 0.3611111), wk = 0.0031847 k( 264) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0031847 k( 265) = ( -0.5000000 0.5000000 0.3055556), wk = 0.0031847 k( 266) = ( -0.5000000 0.5000000 0.2777778), wk = 0.0031847 k( 267) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0031847 k( 268) = ( -0.5000000 0.5000000 0.2222222), wk = 0.0031847 k( 269) = ( -0.5000000 0.5000000 0.1944444), wk = 0.0031847 k( 270) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0031847 k( 271) = ( -0.5000000 0.5000000 0.1388889), wk = 0.0031847 k( 272) = ( -0.5000000 0.5000000 0.1111111), wk = 0.0031847 k( 273) = ( -0.5000000 0.5000000 0.0833333), wk = 0.0031847 k( 274) = ( -0.5000000 0.5000000 0.0555556), wk = 0.0031847 k( 275) = ( -0.5000000 0.5000000 0.0277778), wk = 0.0031847 k( 276) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0031847 k( 277) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031847 k( 278) = ( -0.0135135 0.0135135 0.5000000), wk = 0.0031847 k( 279) = ( -0.0270270 0.0270270 0.5000000), wk = 0.0031847 k( 280) = ( -0.0405405 0.0405405 0.5000000), wk = 0.0031847 k( 281) = ( -0.0540540 0.0540540 0.5000000), wk = 0.0031847 k( 282) = ( -0.0675676 0.0675676 0.5000000), wk = 0.0031847 k( 283) = ( -0.0810811 0.0810811 0.5000000), wk = 0.0031847 k( 284) = ( -0.0945946 0.0945946 0.5000000), wk = 0.0031847 k( 285) = ( -0.1081081 0.1081081 0.5000000), wk = 0.0031847 k( 286) = ( -0.1216216 0.1216216 0.5000000), wk = 0.0031847 k( 287) = ( -0.1351351 0.1351351 0.5000000), wk = 0.0031847 k( 288) = ( -0.1486486 0.1486486 0.5000000), wk = 0.0031847 k( 289) = ( -0.1621622 0.1621622 0.5000000), wk = 0.0031847 k( 290) = ( -0.1756757 0.1756757 0.5000000), wk = 0.0031847 k( 291) = ( -0.1891892 0.1891892 0.5000000), wk = 0.0031847 k( 292) = ( -0.2027027 0.2027027 0.5000000), wk = 0.0031847 k( 293) = ( -0.2162162 0.2162162 0.5000000), wk = 0.0031847 k( 294) = ( -0.2297297 0.2297297 0.5000000), wk = 0.0031847 k( 295) = ( -0.2432432 0.2432432 0.5000000), wk = 0.0031847 k( 296) = ( -0.2567568 0.2567568 0.5000000), wk = 0.0031847 k( 297) = ( -0.2702703 0.2702703 0.5000000), wk = 0.0031847 k( 298) = ( -0.2837838 0.2837838 0.5000000), wk = 0.0031847 k( 299) = ( -0.2972973 0.2972973 0.5000000), wk = 0.0031847 k( 300) = ( -0.3108108 0.3108108 0.5000000), wk = 0.0031847 k( 301) = ( -0.3243243 0.3243243 0.5000000), wk = 0.0031847 k( 302) = ( -0.3378378 0.3378378 0.5000000), wk = 0.0031847 k( 303) = ( -0.3513514 0.3513513 0.5000000), wk = 0.0031847 k( 304) = ( -0.3648649 0.3648649 0.5000000), wk = 0.0031847 k( 305) = ( -0.3783784 0.3783784 0.5000000), wk = 0.0031847 k( 306) = ( -0.3918919 0.3918919 0.5000000), wk = 0.0031847 k( 307) = ( -0.4054054 0.4054054 0.5000000), wk = 0.0031847 k( 308) = ( -0.4189189 0.4189189 0.5000000), wk = 0.0031847 k( 309) = ( -0.4324324 0.4324324 0.5000000), wk = 0.0031847 k( 310) = ( -0.4459459 0.4459459 0.5000000), wk = 0.0031847 k( 311) = ( -0.4594595 0.4594595 0.5000000), wk = 0.0031847 k( 312) = ( -0.4729730 0.4729730 0.5000000), wk = 0.0031847 k( 313) = ( -0.4864865 0.4864865 0.5000000), wk = 0.0031847 k( 314) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0031847 Dense grid: 150051 G-vectors FFT dimensions: ( 60, 60, 100) Smooth grid: 65447 G-vectors FFT dimensions: ( 45, 45, 75) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.33 Mb ( 248, 88) NL pseudopotentials 0.78 Mb ( 124, 412) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2090) G-vector shells 0.01 Mb ( 1032) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.33 Mb ( 248, 352) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 1.11 Mb ( 412, 2, 88) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./Al4CN3O.save/charge-density.dat Starting wfc are 144 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.3 secs Computing kpt #: 2 total cpu time spent up to now is 7.6 secs Computing kpt #: 3 total cpu time spent up to now is 9.9 secs Computing kpt #: 4 total cpu time spent up to now is 12.0 secs Computing kpt #: 5 total cpu time spent up to now is 14.2 secs Computing kpt #: 6 total cpu time spent up to now is 16.2 secs Computing kpt #: 7 total cpu time spent up to now is 18.3 secs Computing kpt #: 8 total cpu time spent up to now is 20.5 secs Computing kpt #: 9 total cpu time spent up to now is 22.5 secs Computing kpt #: 10 total cpu time spent up to now is 24.6 secs Computing kpt #: 11 total cpu time spent up to now is 26.6 secs Computing kpt #: 12 total cpu time spent up to now is 28.4 secs Computing kpt #: 13 total cpu time spent up to now is 30.4 secs Computing kpt #: 14 total cpu time spent up to now is 32.3 secs Computing kpt #: 15 total cpu time spent up to now is 34.2 secs Computing kpt #: 16 total cpu time spent up to now is 36.1 secs Computing kpt #: 17 total cpu time spent up to now is 38.1 secs Computing kpt #: 18 total cpu time spent up to now is 40.0 secs Computing kpt #: 19 total cpu time spent up to now is 42.1 secs Computing kpt #: 20 total cpu time spent up to now is 44.0 secs Computing kpt #: 21 total cpu time spent up to now is 46.1 secs Computing kpt #: 22 total cpu time spent up to now is 48.2 secs Computing kpt #: 23 total cpu time spent up to now is 50.3 secs Computing kpt #: 24 total cpu time spent up to now is 52.4 secs Computing kpt #: 25 total cpu time spent up to now is 54.3 secs Computing kpt #: 26 total cpu time spent up to now is 56.2 secs Computing kpt #: 27 total cpu time spent up to now is 58.2 secs Computing kpt #: 28 total cpu time spent up to now is 60.1 secs Computing kpt #: 29 total cpu time spent up to now is 62.2 secs Computing kpt #: 30 total cpu time spent up to now is 64.2 secs Computing kpt #: 31 total cpu time spent up to now is 66.1 secs Computing kpt #: 32 total cpu time spent up to now is 68.7 secs Computing kpt #: 33 total cpu time spent up to now is 70.7 secs Computing kpt #: 34 total cpu time spent up to now is 72.9 secs Computing kpt #: 35 total cpu time spent up to now is 75.2 secs Computing kpt #: 36 total cpu time spent up to now is 77.4 secs Computing kpt #: 37 total cpu time spent up to now is 79.7 secs Computing kpt #: 38 total cpu time spent up to now is 82.0 secs Computing kpt #: 39 total cpu time spent up to now is 84.2 secs Computing kpt #: 40 total cpu time spent up to now is 86.5 secs Computing kpt #: 41 total cpu time spent up to now is 88.8 secs Computing kpt #: 42 total cpu time spent up to now is 91.1 secs Computing kpt #: 43 total cpu time spent up to now is 93.4 secs Computing kpt #: 44 total cpu time spent up to now is 95.6 secs Computing kpt #: 45 total cpu time spent up to now is 97.9 secs Computing kpt #: 46 total cpu time spent up to now is 100.1 secs Computing kpt #: 47 total cpu time spent up to now is 102.4 secs Computing kpt #: 48 total cpu time spent up to now is 104.8 secs Computing kpt #: 49 total cpu time spent up to now is 107.2 secs Computing kpt #: 50 total cpu time spent up to now is 109.5 secs Computing kpt #: 51 total cpu time spent up to now is 111.9 secs Computing kpt #: 52 total cpu time spent up to now is 114.2 secs Computing kpt #: 53 total cpu time spent up to now is 116.6 secs Computing kpt #: 54 total cpu time spent up to now is 118.9 secs Computing kpt #: 55 total cpu time spent up to now is 121.2 secs Computing kpt #: 56 total cpu time spent up to now is 123.6 secs Computing kpt #: 57 total cpu time spent up to now is 126.0 secs Computing kpt #: 58 total cpu time spent up to now is 128.4 secs Computing kpt #: 59 total cpu time spent up to now is 130.6 secs Computing kpt #: 60 total cpu time spent up to now is 133.0 secs Computing kpt #: 61 total cpu time spent up to now is 135.3 secs Computing kpt #: 62 total cpu time spent up to now is 137.5 secs Computing kpt #: 63 total cpu time spent up to now is 139.8 secs Computing kpt #: 64 total cpu time spent up to now is 142.2 secs Computing kpt #: 65 total cpu time spent up to now is 144.4 secs Computing kpt #: 66 total cpu time spent up to now is 146.6 secs Computing kpt #: 67 total cpu time spent up to now is 148.9 secs Computing kpt #: 68 total cpu time spent up to now is 151.5 secs Computing kpt #: 69 total cpu time spent up to now is 153.7 secs Computing kpt #: 70 total cpu time spent up to now is 156.1 secs Computing kpt #: 71 total cpu time spent up to now is 158.4 secs Computing kpt #: 72 total cpu time spent up to now is 160.9 secs Computing kpt #: 73 total cpu time spent up to now is 163.3 secs Computing kpt #: 74 total cpu time spent up to now is 165.8 secs Computing kpt #: 75 total cpu time spent up to now is 168.2 secs Computing kpt #: 76 total cpu time spent up to now is 170.6 secs Computing kpt #: 77 total cpu time spent up to now is 172.9 secs Computing kpt #: 78 total cpu time spent up to now is 175.4 secs Computing kpt #: 79 total cpu time spent up to now is 177.7 secs Computing kpt #: 80 total cpu time spent up to now is 180.2 secs Computing kpt #: 81 total cpu time spent up to now is 182.5 secs Computing kpt #: 82 total cpu time spent up to now is 184.9 secs Computing kpt #: 83 total cpu time spent up to now is 187.3 secs Computing kpt #: 84 total cpu time spent up to now is 189.7 secs Computing kpt #: 85 total cpu time spent up to now is 192.1 secs Computing kpt #: 86 total cpu time spent up to now is 194.4 secs Computing kpt #: 87 total cpu time spent up to now is 196.9 secs Computing kpt #: 88 total cpu time spent up to now is 199.2 secs Computing kpt #: 89 total cpu time spent up to now is 201.7 secs Computing kpt #: 90 total cpu time spent up to now is 204.1 secs Computing kpt #: 91 total cpu time spent up to now is 206.6 secs Computing kpt #: 92 total cpu time spent up to now is 209.4 secs Computing kpt #: 93 total cpu time spent up to now is 212.3 secs Computing kpt #: 94 total cpu time spent up to now is 214.7 secs Computing kpt #: 95 total cpu time spent up to now is 217.1 secs Computing kpt #: 96 total cpu time spent up to now is 219.4 secs Computing kpt #: 97 total cpu time spent up to now is 221.5 secs Computing kpt #: 98 total cpu time spent up to now is 223.7 secs Computing kpt #: 99 total cpu time spent up to now is 225.8 secs Computing kpt #: 100 total cpu time spent up to now is 227.9 secs Computing kpt #: 101 total cpu time spent up to now is 230.0 secs Computing kpt #: 102 total cpu time spent up to now is 232.0 secs Computing kpt #: 103 total cpu time spent up to now is 234.0 secs Computing kpt #: 104 total cpu time spent up to now is 236.0 secs Computing kpt #: 105 total cpu time spent up to now is 238.0 secs Computing kpt #: 106 total cpu time spent up to now is 239.9 secs Computing kpt #: 107 total cpu time spent up to now is 242.0 secs Computing kpt #: 108 total cpu time spent up to now is 244.0 secs Computing kpt #: 109 total cpu time spent up to now is 246.0 secs Computing kpt #: 110 total cpu time spent up to now is 248.5 secs Computing kpt #: 111 total cpu time spent up to now is 250.4 secs Computing kpt #: 112 total cpu time spent up to now is 252.4 secs Computing kpt #: 113 total cpu time spent up to now is 254.3 secs Computing kpt #: 114 total cpu time spent up to now is 256.3 secs Computing kpt #: 115 total cpu time spent up to now is 258.4 secs Computing kpt #: 116 total cpu time spent up to now is 260.4 secs Computing kpt #: 117 total cpu time spent up to now is 262.3 secs Computing kpt #: 118 total cpu time spent up to now is 264.4 secs Computing kpt #: 119 total cpu time spent up to now is 266.5 secs Computing kpt #: 120 total cpu time spent up to now is 268.7 secs Computing kpt #: 121 total cpu time spent up to now is 270.8 secs Computing kpt #: 122 total cpu time spent up to now is 272.8 secs Computing kpt #: 123 total cpu time spent up to now is 275.0 secs Computing kpt #: 124 total cpu time spent up to now is 277.5 secs Computing kpt #: 125 total cpu time spent up to now is 279.9 secs Computing kpt #: 126 total cpu time spent up to now is 282.1 secs Computing kpt #: 127 total cpu time spent up to now is 284.2 secs Computing kpt #: 128 total cpu time spent up to now is 286.2 secs Computing kpt #: 129 total cpu time spent up to now is 288.3 secs Computing kpt #: 130 total cpu time spent up to now is 290.4 secs Computing kpt #: 131 total cpu time spent up to now is 292.4 secs Computing kpt #: 132 total cpu time spent up to now is 294.5 secs Computing kpt #: 133 total cpu time spent up to now is 296.6 secs Computing kpt #: 134 total cpu time spent up to now is 298.5 secs Computing kpt #: 135 total cpu time spent up to now is 300.5 secs Computing kpt #: 136 total cpu time spent up to now is 302.5 secs Computing kpt #: 137 total cpu time spent up to now is 304.3 secs Computing kpt #: 138 total cpu time spent up to now is 306.3 secs Computing kpt #: 139 total cpu time spent up to now is 308.2 secs Computing kpt #: 140 total cpu time spent up to now is 310.1 secs Computing kpt #: 141 total cpu time spent up to now is 312.1 secs Computing kpt #: 142 total cpu time spent up to now is 314.0 secs Computing kpt #: 143 total cpu time spent up to now is 315.9 secs Computing kpt #: 144 total cpu time spent up to now is 317.8 secs Computing kpt #: 145 total cpu time spent up to now is 319.7 secs Computing kpt #: 146 total cpu time spent up to now is 321.6 secs Computing kpt #: 147 total cpu time spent up to now is 323.6 secs Computing kpt #: 148 total cpu time spent up to now is 325.5 secs Computing kpt #: 149 total cpu time spent up to now is 327.5 secs Computing kpt #: 150 total cpu time spent up to now is 329.5 secs Computing kpt #: 151 total cpu time spent up to now is 331.4 secs Computing kpt #: 152 total cpu time spent up to now is 333.3 secs Computing kpt #: 153 total cpu time spent up to now is 335.4 secs Computing kpt #: 154 total cpu time spent up to now is 337.3 secs Computing kpt #: 155 total cpu time spent up to now is 339.4 secs Computing kpt #: 156 total cpu time spent up to now is 341.6 secs Computing kpt #: 157 total cpu time spent up to now is 343.9 secs Computing kpt #: 158 total cpu time spent up to now is 346.1 secs Computing kpt #: 159 total cpu time spent up to now is 349.1 secs Computing kpt #: 160 total cpu time spent up to now is 351.3 secs Computing kpt #: 161 total cpu time spent up to now is 353.5 secs Computing kpt #: 162 total cpu time spent up to now is 355.8 secs Computing kpt #: 163 total cpu time spent up to now is 358.2 secs Computing kpt #: 164 total cpu time spent up to now is 360.4 secs Computing kpt #: 165 total cpu time spent up to now is 362.8 secs Computing kpt #: 166 total cpu time spent up to now is 365.1 secs Computing kpt #: 167 total cpu time spent up to now is 367.5 secs Computing kpt #: 168 total cpu time spent up to now is 370.1 secs Computing kpt #: 169 total cpu time spent up to now is 372.4 secs Computing kpt #: 170 total cpu time spent up to now is 374.7 secs Computing kpt #: 171 total cpu time spent up to now is 377.0 secs Computing kpt #: 172 total cpu time spent up to now is 379.6 secs Computing kpt #: 173 total cpu time spent up to now is 382.0 secs Computing kpt #: 174 total cpu time spent up to now is 384.4 secs Computing kpt #: 175 total cpu time spent up to now is 386.7 secs Computing kpt #: 176 total cpu time spent up to now is 389.1 secs Computing kpt #: 177 total cpu time spent up to now is 391.4 secs Computing kpt #: 178 total cpu time spent up to now is 393.8 secs Computing kpt #: 179 total cpu time spent up to now is 396.2 secs Computing kpt #: 180 total cpu time spent up to now is 398.7 secs Computing kpt #: 181 total cpu time spent up to now is 401.0 secs Computing kpt #: 182 total cpu time spent up to now is 403.4 secs Computing kpt #: 183 total cpu time spent up to now is 405.7 secs Computing kpt #: 184 total cpu time spent up to now is 408.1 secs Computing kpt #: 185 total cpu time spent up to now is 410.8 secs Computing kpt #: 186 total cpu time spent up to now is 413.4 secs Computing kpt #: 187 total cpu time spent up to now is 415.7 secs Computing kpt #: 188 total cpu time spent up to now is 417.9 secs Computing kpt #: 189 total cpu time spent up to now is 420.2 secs Computing kpt #: 190 total cpu time spent up to now is 422.6 secs Computing kpt #: 191 total cpu time spent up to now is 425.2 secs Computing kpt #: 192 total cpu time spent up to now is 427.7 secs Computing kpt #: 193 total cpu time spent up to now is 430.7 secs Computing kpt #: 194 total cpu time spent up to now is 433.8 secs Computing kpt #: 195 total cpu time spent up to now is 437.8 secs Computing kpt #: 196 total cpu time spent up to now is 441.8 secs Computing kpt #: 197 total cpu time spent up to now is 445.0 secs Computing kpt #: 198 total cpu time spent up to now is 448.0 secs Computing kpt #: 199 total cpu time spent up to now is 450.8 secs Computing kpt #: 200 total cpu time spent up to now is 453.5 secs Computing kpt #: 201 total cpu time spent up to now is 456.2 secs Computing kpt #: 202 total cpu time spent up to now is 458.6 secs Computing kpt #: 203 total cpu time spent up to now is 461.1 secs Computing kpt #: 204 total cpu time spent up to now is 463.6 secs Computing kpt #: 205 total cpu time spent up to now is 466.2 secs Computing kpt #: 206 total cpu time spent up to now is 468.8 secs Computing kpt #: 207 total cpu time spent up to now is 471.4 secs Computing kpt #: 208 total cpu time spent up to now is 474.0 secs Computing kpt #: 209 total cpu time spent up to now is 476.4 secs Computing kpt #: 210 total cpu time spent up to now is 478.9 secs Computing kpt #: 211 total cpu time spent up to now is 481.3 secs Computing kpt #: 212 total cpu time spent up to now is 483.8 secs Computing kpt #: 213 total cpu time spent up to now is 486.3 secs Computing kpt #: 214 total cpu time spent up to now is 488.9 secs Computing kpt #: 215 total cpu time spent up to now is 491.2 secs Computing kpt #: 216 total cpu time spent up to now is 493.7 secs Computing kpt #: 217 total cpu time spent up to now is 496.4 secs Computing kpt #: 218 total cpu time spent up to now is 498.8 secs Computing kpt #: 219 total cpu time spent up to now is 501.3 secs Computing kpt #: 220 total cpu time spent up to now is 503.7 secs Computing kpt #: 221 total cpu time spent up to now is 506.2 secs Computing kpt #: 222 total cpu time spent up to now is 508.6 secs Computing kpt #: 223 total cpu time spent up to now is 511.0 secs Computing kpt #: 224 total cpu time spent up to now is 513.5 secs Computing kpt #: 225 total cpu time spent up to now is 515.7 secs Computing kpt #: 226 total cpu time spent up to now is 518.0 secs Computing kpt #: 227 total cpu time spent up to now is 520.3 secs Computing kpt #: 228 total cpu time spent up to now is 522.5 secs Computing kpt #: 229 total cpu time spent up to now is 524.8 secs Computing kpt #: 230 total cpu time spent up to now is 527.2 secs Computing kpt #: 231 total cpu time spent up to now is 529.6 secs Computing kpt #: 232 total cpu time spent up to now is 531.9 secs Computing kpt #: 233 total cpu time spent up to now is 534.1 secs Computing kpt #: 234 total cpu time spent up to now is 536.1 secs Computing kpt #: 235 total cpu time spent up to now is 538.1 secs Computing kpt #: 236 total cpu time spent up to now is 540.3 secs Computing kpt #: 237 total cpu time spent up to now is 542.4 secs Computing kpt #: 238 total cpu time spent up to now is 544.4 secs Computing kpt #: 239 total cpu time spent up to now is 546.5 secs Computing kpt #: 240 total cpu time spent up to now is 548.6 secs Computing kpt #: 241 total cpu time spent up to now is 550.8 secs Computing kpt #: 242 total cpu time spent up to now is 552.9 secs Computing kpt #: 243 total cpu time spent up to now is 555.0 secs Computing kpt #: 244 total cpu time spent up to now is 557.3 secs Computing kpt #: 245 total cpu time spent up to now is 559.6 secs Computing kpt #: 246 total cpu time spent up to now is 561.9 secs Computing kpt #: 247 total cpu time spent up to now is 564.2 secs Computing kpt #: 248 total cpu time spent up to now is 566.7 secs Computing kpt #: 249 total cpu time spent up to now is 569.0 secs Computing kpt #: 250 total cpu time spent up to now is 571.3 secs Computing kpt #: 251 total cpu time spent up to now is 573.5 secs Computing kpt #: 252 total cpu time spent up to now is 576.1 secs Computing kpt #: 253 total cpu time spent up to now is 578.5 secs Computing kpt #: 254 total cpu time spent up to now is 580.9 secs Computing kpt #: 255 total cpu time spent up to now is 583.3 secs Computing kpt #: 256 total cpu time spent up to now is 585.7 secs Computing kpt #: 257 total cpu time spent up to now is 588.1 secs Computing kpt #: 258 total cpu time spent up to now is 590.6 secs Computing kpt #: 259 total cpu time spent up to now is 592.9 secs Computing kpt #: 260 total cpu time spent up to now is 595.3 secs Computing kpt #: 261 total cpu time spent up to now is 597.7 secs Computing kpt #: 262 total cpu time spent up to now is 600.2 secs Computing kpt #: 263 total cpu time spent up to now is 602.7 secs Computing kpt #: 264 total cpu time spent up to now is 605.4 secs Computing kpt #: 265 total cpu time spent up to now is 608.1 secs Computing kpt #: 266 total cpu time spent up to now is 610.8 secs Computing kpt #: 267 total cpu time spent up to now is 613.3 secs Computing kpt #: 268 total cpu time spent up to now is 615.9 secs Computing kpt #: 269 total cpu time spent up to now is 618.5 secs Computing kpt #: 270 total cpu time spent up to now is 621.6 secs Computing kpt #: 271 total cpu time spent up to now is 624.3 secs Computing kpt #: 272 total cpu time spent up to now is 626.8 secs Computing kpt #: 273 total cpu time spent up to now is 629.4 secs Computing kpt #: 274 total cpu time spent up to now is 632.0 secs Computing kpt #: 275 total cpu time spent up to now is 634.6 secs Computing kpt #: 276 total cpu time spent up to now is 637.1 secs Computing kpt #: 277 total cpu time spent up to now is 639.0 secs Computing kpt #: 278 total cpu time spent up to now is 641.0 secs Computing kpt #: 279 total cpu time spent up to now is 642.9 secs Computing kpt #: 280 total cpu time spent up to now is 644.8 secs Computing kpt #: 281 total cpu time spent up to now is 646.7 secs Computing kpt #: 282 total cpu time spent up to now is 648.6 secs Computing kpt #: 283 total cpu time spent up to now is 650.4 secs Computing kpt #: 284 total cpu time spent up to now is 652.2 secs Computing kpt #: 285 total cpu time spent up to now is 654.1 secs Computing kpt #: 286 total cpu time spent up to now is 655.9 secs Computing kpt #: 287 total cpu time spent up to now is 657.9 secs Computing kpt #: 288 total cpu time spent up to now is 659.8 secs Computing kpt #: 289 total cpu time spent up to now is 661.6 secs Computing kpt #: 290 total cpu time spent up to now is 663.6 secs Computing kpt #: 291 total cpu time spent up to now is 665.5 secs Computing kpt #: 292 total cpu time spent up to now is 667.6 secs Computing kpt #: 293 total cpu time spent up to now is 670.0 secs Computing kpt #: 294 total cpu time spent up to now is 672.3 secs Computing kpt #: 295 total cpu time spent up to now is 674.6 secs Computing kpt #: 296 total cpu time spent up to now is 676.8 secs Computing kpt #: 297 total cpu time spent up to now is 679.2 secs Computing kpt #: 298 total cpu time spent up to now is 681.4 secs Computing kpt #: 299 total cpu time spent up to now is 683.6 secs Computing kpt #: 300 total cpu time spent up to now is 686.0 secs Computing kpt #: 301 total cpu time spent up to now is 688.2 secs Computing kpt #: 302 total cpu time spent up to now is 690.5 secs Computing kpt #: 303 total cpu time spent up to now is 692.7 secs Computing kpt #: 304 total cpu time spent up to now is 695.1 secs Computing kpt #: 305 total cpu time spent up to now is 697.4 secs Computing kpt #: 306 total cpu time spent up to now is 699.9 secs Computing kpt #: 307 total cpu time spent up to now is 702.2 secs Computing kpt #: 308 total cpu time spent up to now is 704.8 secs Computing kpt #: 309 total cpu time spent up to now is 707.2 secs Computing kpt #: 310 total cpu time spent up to now is 709.7 secs Computing kpt #: 311 total cpu time spent up to now is 712.1 secs Computing kpt #: 312 total cpu time spent up to now is 714.5 secs Computing kpt #: 313 total cpu time spent up to now is 717.0 secs Computing kpt #: 314 total cpu time spent up to now is 719.4 secs ethr = 1.35E-08, avg # of iterations = 22.9 total cpu time spent up to now is 719.4 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8207 PWs) bands (ev): -13.5193 -13.5193 -13.4546 -13.4546 -9.7812 -9.7812 -9.6890 -9.6890 -8.1316 -8.1316 -8.0985 -8.0985 -8.0392 -8.0392 -8.0214 -8.0214 -5.0281 -5.0281 -4.6735 -4.6735 -1.5834 -1.5834 -1.3403 -1.3403 -0.7780 -0.7780 -0.5854 -0.5854 0.1631 0.1631 0.4099 0.4099 0.7893 0.7893 0.9074 0.9074 0.9171 0.9171 1.3151 1.3151 1.5402 1.5402 1.6593 1.6593 1.9858 1.9858 2.2437 2.2437 2.4459 2.4459 2.6025 2.6025 2.7550 2.7550 2.9649 2.9649 2.9878 2.9878 3.6607 3.6607 3.6658 3.6658 3.7320 3.7320 3.8768 3.8768 3.9107 3.9107 4.4309 4.4309 4.4827 4.4827 4.7596 4.7596 4.8498 4.8498 4.9003 4.9003 4.9719 4.9719 9.2883 9.2883 10.5200 10.5200 10.8595 10.8595 10.9519 10.9519 k = 0.0091 0.0135-0.0000 ( 8201 PWs) bands (ev): -13.5193 -13.5193 -13.4546 -13.4546 -9.7806 -9.7806 -9.6885 -9.6884 -8.1331 -8.1329 -8.1004 -8.1002 -8.0390 -8.0388 -8.0209 -8.0206 -5.0285 -5.0285 -4.6740 -4.6740 -1.5819 -1.5819 -1.3400 -1.3399 -0.7759 -0.7758 -0.5842 -0.5841 0.1641 0.1642 0.4106 0.4107 0.7814 0.7828 0.9058 0.9062 0.9221 0.9230 1.3161 1.3165 1.5415 1.5417 1.6591 1.6595 1.9847 1.9848 2.2419 2.2427 2.4458 2.4460 2.6040 2.6045 2.7519 2.7533 2.9648 2.9650 2.9905 2.9919 3.6605 3.6612 3.6645 3.6654 3.7247 3.7256 3.8719 3.8739 3.9209 3.9238 4.4264 4.4277 4.4818 4.4829 4.7589 4.7594 4.8496 4.8496 4.8985 4.8986 4.9701 4.9702 9.2918 9.2918 10.5205 10.5206 10.8609 10.8609 10.9524 10.9525 k = 0.0182 0.0270-0.0000 ( 8191 PWs) bands (ev): -13.5191 -13.5191 -13.4545 -13.4545 -9.7787 -9.7786 -9.6869 -9.6868 -8.1371 -8.1369 -8.1058 -8.1054 -8.0383 -8.0380 -8.0193 -8.0189 -5.0296 -5.0295 -4.6754 -4.6753 -1.5775 -1.5775 -1.3390 -1.3390 -0.7695 -0.7692 -0.5802 -0.5801 0.1672 0.1673 0.4128 0.4129 0.7625 0.7648 0.9014 0.9022 0.9353 0.9366 1.3196 1.3203 1.5454 1.5459 1.6589 1.6596 1.9815 1.9816 2.2374 2.2390 2.4455 2.4459 2.6088 2.6097 2.7445 2.7472 2.9645 2.9649 2.9998 3.0023 3.6577 3.6580 3.6639 3.6647 3.7075 3.7092 3.8685 3.8705 3.9449 3.9486 4.4145 4.4167 4.4802 4.4819 4.7574 4.7583 4.8488 4.8489 4.8933 4.8935 4.9650 4.9651 9.3021 9.3021 10.5220 10.5222 10.8650 10.8651 10.9537 10.9540 k = 0.0273 0.0405-0.0000 ( 8195 PWs) bands (ev): -13.5188 -13.5188 -13.4543 -13.4543 -9.7755 -9.7754 -9.6842 -9.6841 -8.1436 -8.1433 -8.1142 -8.1137 -8.0373 -8.0368 -8.0171 -8.0164 -5.0314 -5.0313 -4.6776 -4.6776 -1.5702 -1.5701 -1.3375 -1.3374 -0.7587 -0.7582 -0.5737 -0.5736 0.1723 0.1724 0.4163 0.4165 0.7373 0.7400 0.8945 0.8956 0.9517 0.9531 1.3252 1.3263 1.5522 1.5530 1.6587 1.6597 1.9762 1.9764 2.2305 2.2328 2.4450 2.4456 2.6166 2.6179 2.7343 2.7379 2.9641 2.9647 3.0145 3.0179 3.6433 3.6435 3.6664 3.6665 3.6909 3.6929 3.8694 3.8711 3.9736 3.9776 4.3955 4.3983 4.4775 4.4797 4.7549 4.7562 4.8476 4.8476 4.8847 4.8850 4.9566 4.9568 9.3193 9.3194 10.5245 10.5248 10.8720 10.8722 10.9560 10.9565 k = 0.0363 0.0540-0.0000 ( 8191 PWs) bands (ev): -13.5184 -13.5184 -13.4541 -13.4541 -9.7710 -9.7709 -9.6805 -9.6804 -8.1524 -8.1520 -8.1252 -8.1246 -8.0361 -8.0355 -8.0145 -8.0137 -5.0339 -5.0338 -4.6808 -4.6807 -1.5600 -1.5600 -1.3354 -1.3353 -0.7436 -0.7430 -0.5647 -0.5645 0.1794 0.1795 0.4212 0.4215 0.7088 0.7118 0.8855 0.8869 0.9680 0.9692 1.3327 1.3341 1.5621 1.5631 1.6583 1.6597 1.9690 1.9693 2.2216 2.2245 2.4442 2.4450 2.6270 2.6287 2.7226 2.7269 2.9638 2.9646 3.0332 3.0371 3.6147 3.6149 3.6699 3.6700 3.6829 3.6844 3.8737 3.8751 4.0038 4.0079 4.3696 4.3728 4.4737 4.4760 4.7514 4.7532 4.8458 4.8459 4.8730 4.8734 4.9454 4.9457 9.3432 9.3433 10.5278 10.5282 10.8818 10.8820 10.9590 10.9596 k = 0.0454 0.0674-0.0000 ( 8191 PWs) bands (ev): -13.5179 -13.5179 -13.4539 -13.4539 -9.7653 -9.7652 -9.6757 -9.6755 -8.1632 -8.1628 -8.1384 -8.1377 -8.0348 -8.0342 -8.0119 -8.0111 -5.0370 -5.0368 -4.6848 -4.6847 -1.5471 -1.5470 -1.3328 -1.3326 -0.7242 -0.7235 -0.5533 -0.5530 0.1885 0.1886 0.4274 0.4278 0.6785 0.6816 0.8750 0.8766 0.9822 0.9831 1.3416 1.3431 1.5751 1.5765 1.6577 1.6594 1.9598 1.9602 2.2110 2.2144 2.4429 2.4439 2.6397 2.6416 2.7109 2.7156 2.9638 2.9648 3.0545 3.0588 3.5776 3.5780 3.6743 3.6745 3.6799 3.6811 3.8805 3.8816 4.0340 4.0381 4.3372 4.3406 4.4684 4.4707 4.7468 4.7489 4.8435 4.8438 4.8585 4.8591 4.9317 4.9320 9.3737 9.3737 10.5319 10.5323 10.8944 10.8947 10.9626 10.9634 k = 0.0545 0.0809-0.0000 ( 8191 PWs) bands (ev): -13.5173 -13.5173 -13.4536 -13.4536 -9.7583 -9.7582 -9.6698 -9.6696 -8.1758 -8.1755 -8.1536 -8.1530 -8.0337 -8.0331 -8.0095 -8.0087 -5.0406 -5.0405 -4.6896 -4.6895 -1.5316 -1.5315 -1.3296 -1.3294 -0.7006 -0.6998 -0.5395 -0.5391 0.1994 0.1995 0.4348 0.4353 0.6472 0.6505 0.8634 0.8652 0.9935 0.9939 1.3513 1.3530 1.5916 1.5934 1.6568 1.6588 1.9490 1.9495 2.1991 2.2029 2.4409 2.4422 2.6541 2.6561 2.7001 2.7051 2.9643 2.9656 3.0775 3.0821 3.5366 3.5373 3.6780 3.6786 3.6796 3.6816 3.8889 3.8899 4.0634 4.0676 4.2983 4.3018 4.4614 4.4638 4.7409 4.7434 4.8392 4.8408 4.8417 4.8438 4.9160 4.9164 9.4104 9.4104 10.5365 10.5371 10.9097 10.9102 10.9665 10.9674 k = 0.0636 0.0944-0.0000 ( 8189 PWs) bands (ev): -13.5166 -13.5165 -13.4532 -13.4532 -9.7501 -9.7500 -9.6629 -9.6627 -8.1901 -8.1898 -8.1706 -8.1700 -8.0329 -8.0322 -8.0074 -8.0066 -5.0449 -5.0447 -4.6952 -4.6951 -1.5136 -1.5136 -1.3260 -1.3258 -0.6729 -0.6720 -0.5236 -0.5231 0.2120 0.2121 0.4433 0.4438 0.6156 0.6188 0.8514 0.8533 1.0010 1.0010 1.3613 1.3631 1.6116 1.6138 1.6555 1.6578 1.9367 1.9374 2.1860 2.1902 2.4380 2.4397 2.6693 2.6714 2.6915 2.6967 2.9654 2.9670 3.1013 3.1061 3.4939 3.4945 3.6781 3.6781 3.6857 3.6872 3.8986 3.8993 4.0917 4.0959 4.2533 4.2570 4.4528 4.4550 4.7335 4.7364 4.8224 4.8226 4.8380 4.8383 4.8989 4.8995 9.4531 9.4531 10.5417 10.5423 10.9279 10.9284 10.9703 10.9714 k = 0.0727 0.1079-0.0000 ( 8195 PWs) bands (ev): -13.5157 -13.5157 -13.4528 -13.4528 -9.7406 -9.7405 -9.6549 -9.6547 -8.2060 -8.2057 -8.1893 -8.1888 -8.0323 -8.0316 -8.0057 -8.0049 -5.0495 -5.0493 -4.7016 -4.7014 -1.4935 -1.4934 -1.3220 -1.3217 -0.6411 -0.6400 -0.5056 -0.5051 0.2263 0.2264 0.4527 0.4532 0.5839 0.5871 0.8397 0.8417 1.0042 1.0046 1.3709 1.3728 1.6351 1.6378 1.6537 1.6562 1.9233 1.9242 2.1720 2.1764 2.4342 2.4362 2.6790 2.6824 2.6918 2.6959 2.9672 2.9692 3.1255 3.1302 3.4504 3.4510 3.6780 3.6780 3.6926 3.6941 3.9091 3.9097 4.1185 4.1226 4.2027 4.2064 4.4422 4.4444 4.7245 4.7279 4.8018 4.8022 4.8343 4.8345 4.8812 4.8819 9.5016 9.5016 10.5471 10.5478 10.9487 10.9493 10.9738 10.9750 k = 0.0818 0.1214-0.0000 ( 8200 PWs) bands (ev): -13.5148 -13.5148 -13.4524 -13.4524 -9.7300 -9.7299 -9.6459 -9.6457 -8.2234 -8.2231 -8.2096 -8.2091 -8.0321 -8.0314 -8.0044 -8.0036 -5.0546 -5.0544 -4.7086 -4.7085 -1.4712 -1.4711 -1.3176 -1.3173 -0.6053 -0.6042 -0.4859 -0.4854 0.2420 0.2421 0.4627 0.4632 0.5524 0.5556 0.8288 0.8308 1.0034 1.0042 1.3795 1.3813 1.6504 1.6536 1.6628 1.6653 1.9093 1.9104 2.1572 2.1616 2.4293 2.4317 2.6767 2.6811 2.7078 2.7108 2.9698 2.9722 3.1493 3.1541 3.4069 3.4075 3.6781 3.6782 3.7001 3.7018 3.9201 3.9204 4.1436 4.1464 4.1480 4.1505 4.4296 4.4317 4.7138 4.7175 4.7801 4.7807 4.8302 4.8303 4.8634 4.8642 9.5556 9.5556 10.5528 10.5535 10.9719 10.9727 10.9767 10.9781 k = 0.0908 0.1349-0.0000 ( 8200 PWs) bands (ev): -13.5138 -13.5138 -13.4519 -13.4519 -9.7182 -9.7181 -9.6358 -9.6356 -8.2420 -8.2418 -8.2313 -8.2308 -8.0322 -8.0315 -8.0034 -8.0026 -5.0599 -5.0597 -4.7163 -4.7162 -1.4472 -1.4470 -1.3129 -1.3126 -0.5657 -0.5645 -0.4646 -0.4640 0.2590 0.2590 0.4732 0.4737 0.5215 0.5246 0.8194 0.8214 0.9990 1.0001 1.3860 1.3878 1.6473 1.6506 1.6927 1.6958 1.8952 1.8967 2.1415 2.1460 2.4234 2.4262 2.6750 2.6795 2.7269 2.7297 2.9730 2.9758 3.1724 3.1771 3.3641 3.3646 3.6783 3.6785 3.7082 3.7101 3.9313 3.9314 4.0859 4.0896 4.1670 4.1710 4.4147 4.4167 4.7014 4.7054 4.7578 4.7586 4.8255 4.8256 4.8462 4.8472 9.6146 9.6146 10.5585 10.5593 10.9785 10.9798 10.9980 10.9987 k = 0.0999 0.1484-0.0000 ( 8188 PWs) bands (ev): -13.5128 -13.5128 -13.4514 -13.4514 -9.7053 -9.7051 -9.6248 -9.6245 -8.2619 -8.2618 -8.2543 -8.2539 -8.0327 -8.0320 -8.0028 -8.0021 -5.0654 -5.0652 -4.7247 -4.7245 -1.4215 -1.4214 -1.3079 -1.3075 -0.5224 -0.5211 -0.4420 -0.4414 0.2766 0.2768 0.4839 0.4844 0.4916 0.4946 0.8121 0.8140 0.9912 0.9926 1.3897 1.3913 1.6431 1.6466 1.7258 1.7292 1.8818 1.8835 2.1250 2.1295 2.4166 2.4198 2.6757 2.6801 2.7472 2.7501 2.9763 2.9796 3.1944 3.1990 3.3229 3.3234 3.6786 3.6788 3.7168 3.7188 3.9424 3.9424 4.0208 4.0246 4.1885 4.1924 4.3975 4.3994 4.6874 4.6917 4.7355 4.7364 4.8200 4.8203 4.8301 4.8313 9.6783 9.6783 10.5644 10.5652 10.9793 10.9806 11.0260 11.0268 k = 0.1090 0.1619-0.0000 ( 8188 PWs) bands (ev): -13.5116 -13.5116 -13.4509 -13.4508 -9.6912 -9.6910 -9.6127 -9.6124 -8.2830 -8.2829 -8.2786 -8.2783 -8.0335 -8.0329 -8.0026 -8.0019 -5.0711 -5.0709 -4.7335 -4.7334 -1.3946 -1.3944 -1.3026 -1.3023 -0.4755 -0.4742 -0.4185 -0.4179 0.2944 0.2949 0.4629 0.4656 0.4948 0.4952 0.8075 0.8094 0.9807 0.9823 1.3892 1.3906 1.6383 1.6420 1.7614 1.7650 1.8695 1.8716 2.1078 2.1122 2.4090 2.4127 2.6789 2.6831 2.7689 2.7718 2.9790 2.9828 3.2147 3.2192 3.2841 3.2846 3.6789 3.6791 3.7257 3.7279 3.9505 3.9524 3.9549 3.9566 4.2082 4.2119 4.3780 4.3798 4.6720 4.6766 4.7137 4.7147 4.8119 4.8126 4.8170 4.8185 9.7463 9.7464 10.5704 10.5712 10.9790 10.9804 11.0559 11.0569 k = 0.1181 0.1754-0.0000 ( 8188 PWs) bands (ev): -13.5104 -13.5104 -13.4503 -13.4503 -9.6761 -9.6759 -9.5996 -9.5993 -8.3052 -8.3052 -8.3040 -8.3036 -8.0346 -8.0341 -8.0028 -8.0021 -5.0768 -5.0766 -4.7429 -4.7428 -1.3666 -1.3663 -1.2972 -1.2968 -0.4253 -0.4239 -0.3944 -0.3937 0.3109 0.3118 0.4371 0.4394 0.5054 0.5056 0.8063 0.8080 0.9680 0.9697 1.3834 1.3845 1.6330 1.6368 1.7991 1.8027 1.8592 1.8616 2.0899 2.0943 2.4011 2.4052 2.6842 2.6881 2.7919 2.7948 2.9802 2.9846 3.2327 3.2373 3.2491 3.2495 3.6791 3.6793 3.7348 3.7371 3.8802 3.8842 3.9638 3.9643 4.2259 4.2294 4.3564 4.3580 4.6557 4.6605 4.6927 4.6938 4.7994 4.7995 4.8099 4.8107 9.8182 9.8183 10.5765 10.5774 10.9780 10.9792 11.0876 11.0887 k = 0.1272 0.1889-0.0000 ( 8202 PWs) bands (ev): -13.5092 -13.5092 -13.4497 -13.4497 -9.6600 -9.6598 -9.5855 -9.5852 -8.3305 -8.3304 -8.3281 -8.3280 -8.0362 -8.0356 -8.0033 -8.0027 -5.0824 -5.0822 -4.7527 -4.7526 -1.3378 -1.3375 -1.2916 -1.2912 -0.3724 -0.3720 -0.3691 -0.3687 0.3227 0.3245 0.4172 0.4188 0.5157 0.5158 0.8088 0.8103 0.9539 0.9556 1.3713 1.3721 1.6274 1.6312 1.8383 1.8409 1.8520 1.8537 2.0715 2.0758 2.3932 2.3978 2.6911 2.6946 2.8164 2.8195 2.9787 2.9836 3.2185 3.2194 3.2488 3.2528 3.6792 3.6795 3.7424 3.7449 3.8081 3.8120 3.9740 3.9747 4.2419 4.2451 4.3328 4.3342 4.6387 4.6437 4.6729 4.6740 4.7861 4.7861 4.8034 4.8040 9.8936 9.8938 10.5829 10.5839 10.9765 10.9777 11.1206 11.1218 k = 0.1363 0.2023-0.0000 ( 8200 PWs) bands (ev): -13.5079 -13.5079 -13.4491 -13.4490 -9.6428 -9.6426 -9.5705 -9.5701 -8.3578 -8.3577 -8.3521 -8.3519 -8.0380 -8.0375 -8.0041 -8.0035 -5.0878 -5.0876 -4.7629 -4.7628 -1.3086 -1.3082 -1.2859 -1.2855 -0.3464 -0.3456 -0.3156 -0.3141 0.3230 0.3259 0.4099 0.4103 0.5260 0.5261 0.8153 0.8166 0.9390 0.9407 1.3523 1.3528 1.6213 1.6252 1.8444 1.8483 1.8784 1.8828 2.0531 2.0573 2.3859 2.3909 2.6990 2.7022 2.8428 2.8460 2.9732 2.9785 3.1948 3.1956 3.2613 3.2651 3.6793 3.6795 3.7201 3.7238 3.7649 3.7678 3.9839 3.9849 4.2560 4.2589 4.3078 4.3090 4.6214 4.6266 4.6545 4.6556 4.7732 4.7732 4.7966 4.7971 9.9720 9.9722 10.5898 10.5908 10.9753 10.9763 11.1545 11.1558 k = 0.1453 0.2158-0.0000 ( 8188 PWs) bands (ev): -13.5066 -13.5066 -13.4484 -13.4484 -9.6248 -9.6245 -9.5545 -9.5541 -8.3858 -8.3858 -8.3768 -8.3765 -8.0402 -8.0398 -8.0052 -8.0047 -5.0930 -5.0928 -4.7734 -4.7734 -1.2802 -1.2797 -1.2791 -1.2786 -0.3232 -0.3224 -0.2568 -0.2553 0.3091 0.3126 0.4173 0.4173 0.5365 0.5367 0.8256 0.8267 0.9242 0.9258 1.3263 1.3266 1.6143 1.6183 1.8411 1.8454 1.9178 1.9219 2.0357 2.0399 2.3797 2.3852 2.7073 2.7101 2.8709 2.8743 2.9630 2.9686 3.1781 3.1788 3.2698 3.2735 3.6485 3.6527 3.6793 3.6796 3.7711 3.7738 3.9936 3.9949 4.2682 4.2709 4.2819 4.2829 4.6038 4.6092 4.6376 4.6386 4.7605 4.7606 4.7895 4.7900 10.0529 10.0531 10.5973 10.5984 10.9747 10.9756 11.1890 11.1903 k = 0.1544 0.2293-0.0000 ( 8196 PWs) bands (ev): -13.5053 -13.5053 -13.4478 -13.4477 -9.6058 -9.6056 -9.5375 -9.5372 -8.4145 -8.4145 -8.4021 -8.4018 -8.0427 -8.0423 -8.0067 -8.0062 -5.0978 -5.0976 -4.7842 -4.7842 -1.2744 -1.2738 -1.2497 -1.2492 -0.3015 -0.3006 -0.1955 -0.1941 0.2872 0.2908 0.4330 0.4331 0.5479 0.5482 0.8396 0.8405 0.9103 0.9117 1.2937 1.2938 1.6058 1.6099 1.8400 1.8446 1.9520 1.9555 2.0238 2.0285 2.3754 2.3812 2.7154 2.7179 2.9006 2.9042 2.9483 2.9540 3.1682 3.1687 3.2733 3.2766 3.5745 3.5790 3.6793 3.6797 3.7819 3.7846 4.0033 4.0048 4.2551 4.2563 4.2793 4.2812 4.5860 4.5916 4.6222 4.6232 4.7480 4.7482 4.7820 4.7825 10.1356 10.1359 10.6057 10.6068 10.9756 10.9764 11.2236 11.2249 k = 0.1635 0.2428-0.0000 ( 8198 PWs) bands (ev): -13.5039 -13.5039 -13.4471 -13.4471 -9.5861 -9.5858 -9.5197 -9.5193 -8.4437 -8.4436 -8.4279 -8.4276 -8.0455 -8.0451 -8.0084 -8.0080 -5.1022 -5.1020 -4.7953 -4.7952 -1.2686 -1.2680 -1.2205 -1.2200 -0.2817 -0.2807 -0.1323 -0.1309 0.2623 0.2659 0.4515 0.4520 0.5608 0.5613 0.8569 0.8576 0.8983 0.8993 1.2551 1.2553 1.5952 1.5992 1.8408 1.8457 1.9642 1.9670 2.0337 2.0390 2.3735 2.3797 2.7228 2.7248 2.9306 2.9312 2.9346 2.9367 3.1638 3.1641 3.2698 3.2727 3.5048 3.5096 3.6796 3.6801 3.7938 3.7965 4.0132 4.0149 4.2290 4.2299 4.2883 4.2897 4.5680 4.5737 4.6082 4.6090 4.7356 4.7358 4.7742 4.7747 10.2195 10.2199 10.6152 10.6163 10.9785 10.9791 11.2578 11.2592 k = 0.1726 0.2563-0.0000 ( 8194 PWs) bands (ev): -13.5026 -13.5026 -13.4464 -13.4464 -9.5656 -9.5653 -9.5010 -9.5006 -8.4732 -8.4731 -8.4542 -8.4538 -8.0486 -8.0483 -8.0105 -8.0101 -5.1061 -5.1059 -4.8065 -4.8065 -1.2628 -1.2622 -1.1919 -1.1913 -0.2643 -0.2633 -0.0676 -0.0663 0.2364 0.2399 0.4705 0.4715 0.5760 0.5766 0.8765 0.8772 0.8891 0.8898 1.2115 1.2118 1.5818 1.5858 1.8431 1.8484 1.9525 1.9551 2.0671 2.0724 2.3745 2.3810 2.7291 2.7307 2.9116 2.9173 2.9604 2.9644 3.1631 3.1631 3.2566 3.2590 3.4450 3.4501 3.6804 3.6810 3.8065 3.8091 4.0235 4.0253 4.2035 4.2042 4.2957 4.2966 4.5496 4.5554 4.5956 4.5962 4.7231 4.7234 4.7661 4.7666 10.3038 10.3043 10.6260 10.6271 10.9840 10.9845 11.2912 11.2926 k = 0.1817 0.2698-0.0000 ( 8204 PWs) bands (ev): -13.5012 -13.5012 -13.4458 -13.4458 -9.5444 -9.5441 -9.4814 -9.4810 -8.5029 -8.5027 -8.4808 -8.4804 -8.0520 -8.0517 -8.0128 -8.0125 -5.1094 -5.1092 -4.8178 -4.8178 -1.2571 -1.2565 -1.1641 -1.1634 -0.2499 -0.2488 -0.0021 -0.0008 0.2104 0.2138 0.4888 0.4903 0.5940 0.5946 0.8830 0.8831 0.8988 0.8990 1.1640 1.1645 1.5653 1.5693 1.8467 1.8521 1.9336 1.9361 2.1069 2.1121 2.3788 2.3856 2.7340 2.7352 2.8928 2.8983 2.9837 2.9877 3.1644 3.1646 3.2336 3.2354 3.4007 3.4061 3.6817 3.6824 3.8197 3.8222 4.0342 4.0361 4.1793 4.1798 4.3012 4.3016 4.5307 4.5366 4.5841 4.5844 4.7105 4.7109 4.7577 4.7583 10.3875 10.3881 10.6384 10.6396 10.9928 10.9933 11.3235 11.3249 k = 0.1908 0.2833-0.0000 ( 8192 PWs) bands (ev): -13.4999 -13.4999 -13.4451 -13.4451 -9.5226 -9.5224 -9.4610 -9.4606 -8.5327 -8.5324 -8.5077 -8.5072 -8.0556 -8.0554 -8.0154 -8.0152 -5.1120 -5.1117 -4.8293 -4.8292 -1.2515 -1.2508 -1.1371 -1.1364 -0.2387 -0.2376 0.0628 0.0641 0.1854 0.1886 0.5059 0.5080 0.6150 0.6155 0.8813 0.8820 0.9208 0.9209 1.1140 1.1146 1.5459 1.5497 1.8512 1.8567 1.9125 1.9149 2.1476 2.1527 2.3867 2.3937 2.7373 2.7381 2.8751 2.8806 2.9905 2.9938 3.1671 3.1674 3.2122 3.2131 3.3722 3.3776 3.6838 3.6847 3.8334 3.8358 4.0455 4.0475 4.1569 4.1570 4.3047 4.3049 4.5111 4.5172 4.5736 4.5737 4.6979 4.6983 4.7491 4.7497 10.4695 10.4703 10.6527 10.6538 11.0056 11.0061 11.3543 11.3557 k = 0.1999 0.2968-0.0000 ( 8186 PWs) bands (ev): -13.4986 -13.4986 -13.4445 -13.4445 -9.5004 -9.5001 -9.4398 -9.4394 -8.5623 -8.5620 -8.5347 -8.5341 -8.0595 -8.0594 -8.0182 -8.0181 -5.1138 -5.1136 -4.8408 -4.8407 -1.2460 -1.2453 -1.1113 -1.1105 -0.2310 -0.2298 0.1183 0.1203 0.1696 0.1718 0.5218 0.5246 0.6389 0.6394 0.8845 0.8857 0.9403 0.9406 1.0646 1.0656 1.5238 1.5275 1.8563 1.8618 1.8904 1.8926 2.1874 2.1924 2.3980 2.4051 2.7391 2.7393 2.8594 2.8647 2.9678 2.9699 3.1708 3.1711 3.2113 3.2119 3.3538 3.3590 3.6868 3.6878 3.8475 3.8496 4.0575 4.0595 4.1363 4.1364 4.3057 4.3064 4.4909 4.4971 4.5639 4.5642 4.6852 4.6857 4.7402 4.7408 10.5483 10.5493 10.6690 10.6701 11.0233 11.0238 11.3835 11.3849 k = 0.2089 0.3103-0.0000 ( 8188 PWs) bands (ev): -13.4973 -13.4973 -13.4438 -13.4438 -9.4778 -9.4775 -9.4179 -9.4175 -8.5917 -8.5914 -8.5617 -8.5612 -8.0637 -8.0636 -8.0214 -8.0213 -5.1149 -5.1147 -4.8523 -4.8522 -1.2407 -1.2400 -1.0867 -1.0859 -0.2269 -0.2256 0.1192 0.1227 0.2068 0.2072 0.5373 0.5408 0.6650 0.6654 0.8928 0.8946 0.9460 0.9467 1.0275 1.0289 1.5000 1.5036 1.8619 1.8673 1.8678 1.8697 2.2252 2.2300 2.4124 2.4196 2.7385 2.7390 2.8460 2.8512 2.9186 2.9198 3.1753 3.1756 3.2331 3.2351 3.3404 3.3454 3.6906 3.6918 3.8617 3.8635 4.0702 4.0722 4.1179 4.1184 4.3043 4.3056 4.4700 4.4763 4.5551 4.5557 4.6724 4.6729 4.7311 4.7317 10.6225 10.6236 10.6876 10.6887 11.0466 11.0471 11.4109 11.4122 k = 0.2180 0.3238-0.0000 ( 8190 PWs) bands (ev): -13.4960 -13.4960 -13.4432 -13.4432 -9.4550 -9.4546 -9.3952 -9.3948 -8.6207 -8.6203 -8.5887 -8.5881 -8.0681 -8.0681 -8.0247 -8.0247 -5.1151 -5.1149 -4.8639 -4.8637 -1.2355 -1.2348 -1.0635 -1.0626 -0.2264 -0.2249 0.0957 0.0992 0.2652 0.2653 0.5543 0.5584 0.6911 0.6914 0.9061 0.9084 0.9183 0.9190 1.0240 1.0253 1.4760 1.4794 1.8442 1.8461 1.8680 1.8734 2.2598 2.2644 2.4295 2.4366 2.7345 2.7362 2.8351 2.8401 2.8575 2.8588 3.1808 3.1811 3.2684 3.2714 3.3296 3.3345 3.6952 3.6965 3.8759 3.8774 4.0834 4.0856 4.1022 4.1032 4.3003 4.3021 4.4484 4.4547 4.5473 4.5484 4.6596 4.6601 4.7218 4.7225 10.6903 10.6916 10.7085 10.7097 11.0763 11.0768 11.4365 11.4377 k = 0.2271 0.3372-0.0000 ( 8186 PWs) bands (ev): -13.4948 -13.4948 -13.4426 -13.4426 -9.4320 -9.4317 -9.3720 -9.3716 -8.6490 -8.6486 -8.6156 -8.6150 -8.0728 -8.0727 -8.0284 -8.0283 -5.1144 -5.1143 -4.8754 -4.8752 -1.2306 -1.2298 -1.0417 -1.0407 -0.2291 -0.2276 0.0697 0.0731 0.3198 0.3201 0.5758 0.5803 0.7112 0.7114 0.8768 0.8774 0.9238 0.9266 1.0385 1.0396 1.4537 1.4569 1.8202 1.8219 1.8744 1.8798 2.2900 2.2944 2.4485 2.4555 2.7203 2.7241 2.8010 2.8034 2.8269 2.8317 3.1878 3.1880 3.3052 3.3075 3.3264 3.3298 3.7004 3.7018 3.8900 3.8913 4.0892 4.0896 4.0985 4.0997 4.2934 4.2957 4.4261 4.4325 4.5408 4.5422 4.6467 4.6472 4.7122 4.7130 10.7320 10.7332 10.7507 10.7521 11.1124 11.1128 11.4603 11.4615 k = 0.2362 0.3507-0.0000 ( 8180 PWs) bands (ev): -13.4937 -13.4937 -13.4420 -13.4420 -9.4091 -9.4088 -9.3481 -9.3477 -8.6765 -8.6760 -8.6422 -8.6416 -8.0776 -8.0776 -8.0322 -8.0322 -5.1129 -5.1128 -4.8869 -4.8866 -1.2257 -1.2249 -1.0214 -1.0204 -0.2350 -0.2334 0.0432 0.0466 0.3655 0.3660 0.6056 0.6103 0.7094 0.7095 0.8518 0.8523 0.9452 0.9483 1.0540 1.0552 1.4360 1.4390 1.7953 1.7968 1.8813 1.8866 2.3143 2.3183 2.4688 2.4755 2.6795 2.6841 2.7734 2.7759 2.8213 2.8258 3.1967 3.1968 3.3066 3.3095 3.3611 3.3634 3.7059 3.7075 3.9042 3.9052 4.0793 4.0805 4.1125 4.1141 4.2834 4.2861 4.4034 4.4097 4.5356 4.5373 4.6338 4.6343 4.7025 4.7033 10.7581 10.7593 10.8033 10.8048 11.1539 11.1542 11.4827 11.4837 k = 0.2453 0.3642-0.0000 ( 8192 PWs) bands (ev): -13.4926 -13.4926 -13.4415 -13.4415 -9.3865 -9.3862 -9.3236 -9.3232 -8.7030 -8.7025 -8.6686 -8.6680 -8.0827 -8.0827 -8.0363 -8.0363 -5.1104 -5.1103 -4.8983 -4.8980 -1.2211 -1.2203 -1.0027 -1.0015 -0.2437 -0.2420 0.0166 0.0201 0.3998 0.4002 0.6463 0.6508 0.6734 0.6735 0.8575 0.8582 0.9695 0.9729 1.0658 1.0669 1.4259 1.4289 1.7694 1.7706 1.8888 1.8940 2.3310 2.3345 2.4895 2.4959 2.6208 2.6250 2.7705 2.7717 2.8184 2.8224 3.2081 3.2081 3.2989 3.3022 3.4050 3.4083 3.7115 3.7131 3.9187 3.9195 4.0727 4.0741 4.1275 4.1291 4.2703 4.2734 4.3804 4.3866 4.5318 4.5339 4.6208 4.6214 4.6925 4.6933 10.7869 10.7879 10.8488 10.8503 11.1988 11.1988 11.5036 11.5045 k = 0.2544 0.3777-0.0000 ( 8200 PWs) bands (ev): -13.4915 -13.4915 -13.4410 -13.4410 -9.3644 -9.3640 -9.2987 -9.2983 -8.7282 -8.7276 -8.6946 -8.6939 -8.0880 -8.0879 -8.0407 -8.0405 -5.1070 -5.1069 -4.9097 -4.9094 -1.2166 -1.2158 -0.9855 -0.9843 -0.2550 -0.2531 -0.0097 -0.0063 0.4231 0.4233 0.6171 0.6173 0.6977 0.7016 0.8781 0.8789 0.9959 0.9994 1.0731 1.0743 1.4264 1.4292 1.7419 1.7429 1.8968 1.9019 2.3382 2.3410 2.5099 2.5158 2.5616 2.5657 2.7767 2.7769 2.8180 2.8215 3.2222 3.2223 3.2919 3.2950 3.4477 3.4515 3.7168 3.7186 3.9344 3.9351 4.0691 4.0707 4.1428 4.1443 4.2541 4.2574 4.3574 4.3635 4.5296 4.5319 4.6079 4.6084 4.6823 4.6832 10.8182 10.8192 10.8887 10.8902 11.2437 11.2439 11.5234 11.5242 k = 0.2634 0.3912-0.0000 ( 8200 PWs) bands (ev): -13.4905 -13.4905 -13.4405 -13.4405 -9.3430 -9.3427 -9.2733 -9.2729 -8.7518 -8.7512 -8.7202 -8.7195 -8.0934 -8.0933 -8.0452 -8.0450 -5.1027 -5.1026 -4.9210 -4.9206 -1.2123 -1.2115 -0.9699 -0.9686 -0.2685 -0.2665 -0.0357 -0.0323 0.4383 0.4384 0.5533 0.5536 0.7562 0.7595 0.8965 0.8973 1.0238 1.0274 1.0799 1.0810 1.4385 1.4412 1.7125 1.7133 1.9054 1.9105 2.3341 2.3361 2.5090 2.5134 2.5294 2.5347 2.7875 2.7880 2.8203 2.8231 3.2395 3.2397 3.2862 3.2892 3.4865 3.4907 3.7217 3.7234 3.9526 3.9532 4.0684 4.0698 4.1582 4.1596 4.2350 4.2385 4.3348 4.3407 4.5289 4.5315 4.5949 4.5954 4.6719 4.6728 10.8520 10.8530 10.9247 10.9260 11.2860 11.2865 11.5422 11.5430 k = 0.2725 0.4047-0.0000 ( 8198 PWs) bands (ev): -13.4896 -13.4896 -13.4400 -13.4400 -9.3228 -9.3224 -9.2476 -9.2472 -8.7736 -8.7730 -8.7453 -8.7446 -8.0990 -8.0988 -8.0498 -8.0496 -5.0974 -5.0973 -4.9322 -4.9318 -1.2082 -1.2073 -0.9558 -0.9544 -0.2841 -0.2820 -0.0612 -0.0578 0.4484 0.4486 0.4864 0.4867 0.8185 0.8211 0.9022 0.9028 1.0528 1.0562 1.0934 1.0943 1.4616 1.4642 1.6807 1.6812 1.9147 1.9198 2.3184 2.3196 2.4667 2.4712 2.5473 2.5520 2.8017 2.8028 2.8250 2.8270 3.2601 3.2603 3.2823 3.2851 3.5193 3.5237 3.7257 3.7275 3.9748 3.9754 4.0697 4.0708 4.1728 4.1741 4.2139 4.2177 4.3132 4.3187 4.5297 4.5325 4.5820 4.5826 4.6613 4.6622 10.8881 10.8891 10.9580 10.9593 11.3234 11.3243 11.5605 11.5611 k = 0.2816 0.4182-0.0000 ( 8196 PWs) bands (ev): -13.4887 -13.4887 -13.4396 -13.4396 -9.3039 -9.3035 -9.2216 -9.2212 -8.7932 -8.7925 -8.7698 -8.7690 -8.1046 -8.1045 -8.0547 -8.0544 -5.0913 -5.0912 -4.9433 -4.9429 -1.2042 -1.2032 -0.9432 -0.9417 -0.3014 -0.2993 -0.0860 -0.0826 0.4180 0.4183 0.4557 0.4560 0.8813 0.8836 0.8912 0.8914 1.0827 1.0859 1.1182 1.1186 1.4936 1.4961 1.6460 1.6463 1.9248 1.9299 2.2936 2.2944 2.4343 2.4389 2.5635 2.5673 2.8178 2.8194 2.8321 2.8332 3.2806 3.2831 3.2841 3.2844 3.5443 3.5488 3.7289 3.7306 4.0024 4.0030 4.0724 4.0730 4.1781 4.1788 4.2008 4.2028 4.2932 4.2981 4.5320 4.5349 4.5693 4.5698 4.6504 4.6514 10.9263 10.9272 10.9897 10.9908 11.3547 11.3559 11.5783 11.5788 k = 0.2907 0.4317-0.0000 ( 8192 PWs) bands (ev): -13.4879 -13.4879 -13.4391 -13.4391 -9.2869 -9.2865 -9.1954 -9.1951 -8.8102 -8.8094 -8.7936 -8.7929 -8.1104 -8.1102 -8.0596 -8.0593 -5.0843 -5.0842 -4.9543 -4.9540 -1.2002 -1.1993 -0.9320 -0.9305 -0.3204 -0.3182 -0.1099 -0.1065 0.3492 0.3496 0.4613 0.4616 0.8659 0.8660 0.9436 0.9445 1.1138 1.1166 1.1519 1.1519 1.5327 1.5352 1.6084 1.6085 1.9356 1.9407 2.2657 2.2664 2.4085 2.4129 2.5777 2.5807 2.8340 2.8359 2.8415 2.8416 3.2820 3.2844 3.3105 3.3108 3.5608 3.5652 3.7309 3.7325 4.0354 4.0357 4.0759 4.0762 4.1555 4.1583 4.2119 4.2121 4.2758 4.2797 4.5357 4.5387 4.5567 4.5572 4.6394 4.6403 10.9663 10.9671 11.0204 11.0214 11.3797 11.3811 11.5959 11.5964 k = 0.2998 0.4452-0.0000 ( 8198 PWs) bands (ev): -13.4872 -13.4872 -13.4388 -13.4388 -9.2722 -9.2718 -9.1691 -9.1688 -8.8242 -8.8234 -8.8168 -8.8160 -8.1163 -8.1160 -8.0647 -8.0643 -5.0765 -5.0764 -4.9653 -4.9649 -1.1964 -1.1954 -0.9223 -0.9207 -0.3409 -0.3386 -0.1327 -0.1294 0.2805 0.2810 0.4658 0.4660 0.8325 0.8325 1.0010 1.0010 1.1469 1.1492 1.1905 1.1907 1.5682 1.5683 1.5772 1.5796 1.9473 1.9523 2.2402 2.2407 2.3859 2.3900 2.5901 2.5921 2.8486 2.8504 2.8519 2.8530 3.2866 3.2888 3.3393 3.3396 3.5691 3.5734 3.7317 3.7332 4.0638 4.0645 4.0876 4.0883 4.1262 4.1295 4.2275 4.2276 4.2621 4.2648 4.5406 4.5432 4.5445 4.5456 4.6281 4.6291 11.0077 11.0083 11.0505 11.0514 11.3987 11.4004 11.6136 11.6140 k = 0.3089 0.4587-0.0000 ( 8198 PWs) bands (ev): -13.4865 -13.4865 -13.4384 -13.4384 -9.2602 -9.2597 -9.1429 -9.1425 -8.8392 -8.8384 -8.8347 -8.8339 -8.1222 -8.1219 -8.0699 -8.0695 -5.0679 -5.0679 -4.9761 -4.9757 -1.1926 -1.1916 -0.9139 -0.9123 -0.3627 -0.3604 -0.1543 -0.1510 0.2125 0.2132 0.4695 0.4695 0.7944 0.7945 1.0503 1.0513 1.1827 1.1842 1.2313 1.2317 1.5270 1.5275 1.6258 1.6280 1.9600 1.9649 2.2199 2.2204 2.3647 2.3686 2.6008 2.6020 2.8601 2.8621 2.8638 2.8657 3.2947 3.2966 3.3695 3.3697 3.5706 3.5747 3.7315 3.7327 4.0671 4.0693 4.0944 4.0973 4.1255 4.1262 4.2439 4.2440 4.2541 4.2550 4.5327 4.5331 4.5470 4.5504 4.6168 4.6177 11.0498 11.0504 11.0801 11.0808 11.4128 11.4148 11.6318 11.6321 k = 0.3180 0.4721-0.0000 ( 8190 PWs) bands (ev): -13.4859 -13.4859 -13.4381 -13.4381 -9.2512 -9.2507 -9.1167 -9.1164 -8.8607 -8.8600 -8.8416 -8.8408 -8.1282 -8.1279 -8.0751 -8.0747 -5.0586 -5.0586 -4.9869 -4.9864 -1.1888 -1.1878 -0.9067 -0.9051 -0.3858 -0.3833 -0.1745 -0.1712 0.1456 0.1463 0.4720 0.4722 0.7540 0.7543 1.0904 1.0923 1.2189 1.2200 1.2729 1.2733 1.4890 1.4898 1.6775 1.6794 1.9737 1.9784 2.2060 2.2064 2.3445 2.3483 2.6102 2.6106 2.8671 2.8693 2.8773 2.8798 3.3057 3.3074 3.4000 3.4000 3.5672 3.5709 3.7304 3.7313 4.0605 4.0621 4.0637 4.0659 4.1662 4.1684 4.2540 4.2556 4.2607 4.2609 4.5219 4.5223 4.5544 4.5579 4.6055 4.6063 11.0922 11.0926 11.1092 11.1098 11.4234 11.4255 11.6505 11.6508 k = 0.3270 0.4856-0.0000 ( 8186 PWs) bands (ev): -13.4854 -13.4854 -13.4378 -13.4378 -9.2454 -9.2450 -9.0908 -9.0905 -8.8813 -8.8806 -8.8447 -8.8438 -8.1341 -8.1338 -8.0804 -8.0800 -5.0488 -5.0488 -4.9975 -4.9970 -1.1849 -1.1840 -0.9008 -0.8990 -0.4099 -0.4074 -0.1931 -0.1897 0.0802 0.0809 0.4734 0.4738 0.7129 0.7132 1.1219 1.1243 1.2464 1.2476 1.3144 1.3148 1.4635 1.4649 1.7311 1.7327 1.9888 1.9932 2.1980 2.1984 2.3259 2.3297 2.6183 2.6187 2.8691 2.8712 2.8919 2.8951 3.3186 3.3200 3.4293 3.4295 3.5614 3.5647 3.7291 3.7295 4.0253 4.0284 4.0534 4.0580 4.1956 4.1990 4.2712 4.2752 4.2777 4.2780 4.5124 4.5130 4.5627 4.5661 4.5947 4.5951 11.1340 11.1342 11.1377 11.1381 11.4317 11.4340 11.6703 11.6705 k = 0.3361 0.4991-0.0000 ( 8170 PWs) bands (ev): -13.4849 -13.4849 -13.4376 -13.4376 -9.2428 -9.2424 -9.0654 -9.0650 -8.9009 -8.9001 -8.8439 -8.8431 -8.1401 -8.1397 -8.0858 -8.0853 -5.0384 -5.0384 -5.0080 -5.0075 -1.1811 -1.1802 -0.8959 -0.8941 -0.4350 -0.4324 -0.2098 -0.2065 0.0165 0.0174 0.4731 0.4738 0.6721 0.6724 1.1467 1.1491 1.2498 1.2512 1.3553 1.3556 1.4657 1.4675 1.7857 1.7867 2.0057 2.0097 2.1940 2.1945 2.3101 2.3138 2.6256 2.6267 2.8662 2.8681 2.9074 2.9112 3.3307 3.3318 3.4558 3.4565 3.5563 3.5590 3.7280 3.7281 3.9889 3.9919 4.0418 4.0472 4.2087 4.2115 4.2943 4.2952 4.3104 4.3141 4.5057 4.5065 4.5705 4.5722 4.5858 4.5872 11.1651 11.1652 11.1743 11.1746 11.4391 11.4414 11.6915 11.6915 k = 0.3452 0.5126-0.0000 ( 8172 PWs) bands (ev): -13.4845 -13.4845 -13.4373 -13.4373 -9.2432 -9.2429 -9.0408 -9.0404 -8.9192 -8.9184 -8.8397 -8.8389 -8.1460 -8.1456 -8.0911 -8.0906 -5.0276 -5.0275 -5.0183 -5.0178 -1.1773 -1.1763 -0.8920 -0.8902 -0.4609 -0.4583 -0.2246 -0.2213 -0.0450 -0.0441 0.4708 0.4718 0.6322 0.6325 1.1653 1.1672 1.2274 1.2290 1.3952 1.3954 1.4981 1.4998 1.8397 1.8398 2.0253 2.0286 2.1912 2.1919 2.2993 2.3028 2.6328 2.6344 2.8588 2.8603 2.9235 2.9277 3.3383 3.3389 3.4779 3.4790 3.5556 3.5576 3.7278 3.7287 3.9517 3.9546 4.0282 4.0341 4.2148 4.2166 4.3113 4.3124 4.3547 4.3583 4.5044 4.5055 4.5674 4.5684 4.5879 4.5921 11.1911 11.1912 11.2123 11.2124 11.4466 11.4490 11.7144 11.7145 k = 0.3543 0.5261-0.0000 ( 8156 PWs) bands (ev): -13.4841 -13.4841 -13.4371 -13.4371 -9.2463 -9.2460 -9.0176 -9.0172 -8.9356 -8.9347 -8.8324 -8.8316 -8.1518 -8.1514 -8.0964 -8.0958 -5.0284 -5.0280 -5.0164 -5.0164 -1.1733 -1.1725 -0.8891 -0.8872 -0.4876 -0.4849 -0.2372 -0.2340 -0.1042 -0.1032 0.4658 0.4672 0.5938 0.5941 1.1646 1.1655 1.2067 1.2089 1.4341 1.4341 1.5477 1.5491 1.8899 1.8910 2.0494 2.0514 2.1859 2.1869 2.2961 2.2994 2.6402 2.6423 2.8477 2.8488 2.9398 2.9445 3.3378 3.3378 3.4935 3.4952 3.5629 3.5641 3.7301 3.7317 3.9141 3.9170 4.0135 4.0197 4.2186 4.2198 4.3280 4.3292 4.3914 4.3948 4.5149 4.5163 4.5579 4.5591 4.5987 4.6034 11.2152 11.2152 11.2469 11.2470 11.4554 11.4578 11.7392 11.7396 k = 0.3634 0.5396-0.0000 ( 8154 PWs) bands (ev): -13.4838 -13.4838 -13.4370 -13.4370 -9.2515 -9.2512 -8.9983 -8.9978 -8.9477 -8.9468 -8.8226 -8.8218 -8.1576 -8.1572 -8.1016 -8.1011 -5.0383 -5.0379 -5.0051 -5.0050 -1.1694 -1.1685 -0.8870 -0.8851 -0.5149 -0.5121 -0.2475 -0.2443 -0.1606 -0.1595 0.4577 0.4594 0.5571 0.5575 1.1276 1.1282 1.2159 1.2179 1.4715 1.4716 1.6047 1.6057 1.9341 1.9369 2.0800 2.0805 2.1757 2.1772 2.3018 2.3048 2.6478 2.6504 2.8336 2.8342 2.9563 2.9613 3.3266 3.3272 3.5015 3.5037 3.5794 3.5799 3.7355 3.7378 3.8768 3.8796 3.9983 4.0046 4.2215 4.2222 4.3439 4.3453 4.4115 4.4144 4.5440 4.5452 4.5485 4.5499 4.6117 4.6164 11.2368 11.2369 11.2772 11.2774 11.4664 11.4687 11.7661 11.7669 k = 0.3634 0.5396-0.0000 ( 8154 PWs) bands (ev): -13.4838 -13.4838 -13.4370 -13.4370 -9.2515 -9.2512 -8.9983 -8.9978 -8.9477 -8.9468 -8.8226 -8.8218 -8.1576 -8.1572 -8.1016 -8.1011 -5.0383 -5.0379 -5.0051 -5.0050 -1.1694 -1.1685 -0.8870 -0.8851 -0.5149 -0.5121 -0.2475 -0.2443 -0.1606 -0.1595 0.4577 0.4594 0.5571 0.5575 1.1276 1.1282 1.2159 1.2179 1.4715 1.4716 1.6047 1.6057 1.9341 1.9369 2.0800 2.0805 2.1757 2.1772 2.3018 2.3048 2.6478 2.6504 2.8336 2.8342 2.9563 2.9613 3.3266 3.3272 3.5015 3.5037 3.5794 3.5799 3.7355 3.7378 3.8768 3.8796 3.9983 4.0046 4.2215 4.2222 4.3439 4.3453 4.4115 4.4144 4.5440 4.5452 4.5485 4.5499 4.6117 4.6164 11.2368 11.2369 11.2772 11.2774 11.4664 11.4687 11.7661 11.7669 k = 0.3476 0.5396-0.0000 ( 8156 PWs) bands (ev): -13.4840 -13.4840 -13.4371 -13.4371 -9.2500 -9.2497 -9.0085 -9.0080 -8.9423 -8.9414 -8.8257 -8.8249 -8.1543 -8.1540 -8.0986 -8.0980 -5.0352 -5.0348 -5.0088 -5.0087 -1.1726 -1.1717 -0.8885 -0.8867 -0.4994 -0.4967 -0.2427 -0.2395 -0.1286 -0.1276 0.4627 0.4642 0.5777 0.5780 1.1490 1.1496 1.2066 1.2088 1.4450 1.4453 1.5829 1.5841 1.9081 1.9100 2.0549 2.0569 2.1879 2.1897 2.3011 2.3041 2.6414 2.6439 2.8424 2.8436 2.9477 2.9525 3.3329 3.3333 3.4980 3.4999 3.5678 3.5686 3.7336 3.7354 3.8899 3.8932 4.0143 4.0203 4.2193 4.2202 4.3342 4.3355 4.4041 4.4073 4.5205 4.5218 4.5588 4.5601 4.6051 4.6098 11.2219 11.2222 11.2641 11.2642 11.4596 11.4620 11.7513 11.7518 k = 0.3318 0.5396-0.0000 ( 8154 PWs) bands (ev): -13.4843 -13.4843 -13.4372 -13.4372 -9.2521 -9.2517 -9.0206 -9.0201 -8.9366 -8.9357 -8.8235 -8.8227 -8.1509 -8.1505 -8.0951 -8.0945 -5.0377 -5.0374 -5.0063 -5.0060 -1.1776 -1.1768 -0.8914 -0.8896 -0.4829 -0.4802 -0.2370 -0.2339 -0.0935 -0.0926 0.4670 0.4683 0.6004 0.6008 1.1617 1.1626 1.1976 1.1999 1.4102 1.4109 1.5776 1.5788 1.8759 1.8771 2.0234 2.0264 2.2056 2.2081 2.3083 2.3114 2.6309 2.6337 2.8521 2.8538 2.9396 2.9443 3.3351 3.3352 3.4913 3.4929 3.5558 3.5569 3.7353 3.7367 3.8901 3.8942 4.0440 4.0494 4.2152 4.2163 4.3213 4.3225 4.3950 4.3981 4.5000 4.5015 4.5708 4.5722 4.6008 4.6052 11.2002 11.2008 11.2551 11.2551 11.4523 11.4547 11.7368 11.7371 k = 0.3160 0.5396-0.0000 ( 8158 PWs) bands (ev): -13.4846 -13.4846 -13.4374 -13.4374 -9.2574 -9.2571 -9.0333 -9.0329 -8.9309 -8.9300 -8.8171 -8.8164 -8.1473 -8.1469 -8.0911 -8.0905 -5.0438 -5.0435 -4.9997 -4.9994 -1.1843 -1.1834 -0.8956 -0.8939 -0.4652 -0.4626 -0.2300 -0.2269 -0.0565 -0.0555 0.4706 0.4718 0.6251 0.6255 1.1556 1.1574 1.1973 1.1988 1.3755 1.3765 1.5816 1.5827 1.8408 1.8415 1.9895 1.9933 2.2251 2.2280 2.3216 2.3245 2.6174 2.6204 2.8619 2.8641 2.9321 2.9366 3.3338 3.3340 3.4812 3.4825 3.5434 3.5449 3.7408 3.7417 3.8826 3.8872 4.0814 4.0864 4.2092 4.2105 4.3046 4.3058 4.3853 4.3879 4.4837 4.4853 4.5804 4.5815 4.6024 4.6052 11.1746 11.1754 11.2487 11.2488 11.4444 11.4468 11.7222 11.7223 k = 0.3002 0.5396-0.0000 ( 8167 PWs) bands (ev): -13.4849 -13.4849 -13.4376 -13.4376 -9.2654 -9.2651 -9.0467 -9.0463 -8.9245 -8.9236 -8.8080 -8.8073 -8.1435 -8.1431 -8.0866 -8.0860 -5.0509 -5.0507 -4.9915 -4.9912 -1.1921 -1.1912 -0.9013 -0.8997 -0.4464 -0.4439 -0.2213 -0.2182 -0.0179 -0.0170 0.4736 0.4747 0.6513 0.6518 1.1331 1.1355 1.2017 1.2031 1.3459 1.3470 1.5900 1.5911 1.8059 1.8062 1.9547 1.9590 2.2448 2.2481 2.3390 2.3418 2.6015 2.6048 2.8712 2.8736 2.9252 2.9296 3.3303 3.3308 3.4681 3.4690 3.5307 3.5325 3.7493 3.7500 3.8712 3.8761 4.1216 4.1261 4.2013 4.2028 4.2838 4.2852 4.3764 4.3784 4.4716 4.4733 4.5819 4.5845 4.6134 4.6142 11.1472 11.1481 11.2439 11.2440 11.4359 11.4382 11.7070 11.7073 k = 0.2844 0.5396-0.0000 ( 8172 PWs) bands (ev): -13.4853 -13.4853 -13.4378 -13.4378 -9.2755 -9.2752 -9.0606 -9.0602 -8.9169 -8.9160 -8.7974 -8.7968 -8.1396 -8.1392 -8.0816 -8.0811 -5.0581 -5.0579 -4.9828 -4.9825 -1.2007 -1.1998 -0.9085 -0.9069 -0.4265 -0.4241 -0.2110 -0.2080 0.0216 0.0226 0.4762 0.4771 0.6786 0.6792 1.1025 1.1052 1.2031 1.2048 1.3219 1.3228 1.6008 1.6019 1.7735 1.7735 1.9201 1.9248 2.2643 2.2678 2.3590 2.3617 2.5843 2.5878 2.8790 2.8815 2.9191 2.9233 3.3259 3.3265 3.4520 3.4528 3.5177 3.5198 3.7596 3.7606 3.8580 3.8629 4.1614 4.1652 4.1916 4.1935 4.2598 4.2614 4.3695 4.3710 4.4630 4.4648 4.5803 4.5835 4.6286 4.6290 11.1192 11.1203 11.2401 11.2402 11.4266 11.4289 11.6910 11.6916 k = 0.2686 0.5396-0.0000 ( 8176 PWs) bands (ev): -13.4858 -13.4858 -13.4380 -13.4380 -9.2870 -9.2868 -9.0747 -9.0743 -8.9081 -8.9072 -8.7863 -8.7858 -8.1356 -8.1353 -8.0761 -8.0756 -5.0651 -5.0648 -4.9739 -4.9736 -1.2099 -1.2090 -0.9170 -0.9156 -0.4057 -0.4034 -0.1991 -0.1962 0.0618 0.0630 0.4783 0.4791 0.7067 0.7074 1.0674 1.0701 1.2007 1.2027 1.3014 1.3020 1.6127 1.6137 1.7448 1.7452 1.8867 1.8917 2.2832 2.2868 2.3803 2.3829 2.5667 2.5703 2.8844 2.8867 2.9141 2.9180 3.3215 3.3223 3.4335 3.4343 3.5047 3.5071 3.7704 3.7720 3.8441 3.8490 4.1798 4.1806 4.1982 4.2031 4.2344 4.2360 4.3656 4.3665 4.4576 4.4594 4.5787 4.5820 4.6448 4.6454 11.0914 11.0925 11.2370 11.2371 11.4168 11.4190 11.6742 11.6751 k = 0.2528 0.5396-0.0000 ( 8179 PWs) bands (ev): -13.4862 -13.4862 -13.4383 -13.4383 -9.2994 -9.2992 -9.0889 -9.0885 -8.8982 -8.8974 -8.7753 -8.7748 -8.1316 -8.1313 -8.0702 -8.0698 -5.0716 -5.0714 -4.9651 -4.9647 -1.2192 -1.2184 -0.9269 -0.9256 -0.3841 -0.3820 -0.1858 -0.1830 0.1026 0.1039 0.4802 0.4808 0.7350 0.7358 1.0299 1.0325 1.1953 1.1976 1.2814 1.2816 1.6248 1.6257 1.7201 1.7208 1.8563 1.8615 2.3009 2.3046 2.4018 2.4043 2.5501 2.5538 2.8864 2.8882 2.9106 2.9143 3.3182 3.3191 3.4129 3.4138 3.4916 3.4942 3.7796 3.7816 3.8315 3.8359 4.1667 4.1677 4.2058 4.2082 4.2322 4.2354 4.3654 4.3660 4.4552 4.4571 4.5781 4.5811 4.6611 4.6618 11.0642 11.0654 11.2342 11.2343 11.4065 11.4087 11.6568 11.6579 k = 0.2370 0.5396-0.0000 ( 8168 PWs) bands (ev): -13.4867 -13.4867 -13.4385 -13.4385 -9.3122 -9.3120 -9.1029 -9.1026 -8.8876 -8.8869 -8.7647 -8.7642 -8.1276 -8.1272 -8.0640 -8.0636 -5.0778 -5.0775 -4.9564 -4.9560 -1.2285 -1.2277 -0.9380 -0.9367 -0.3623 -0.3602 -0.1711 -0.1684 0.1435 0.1450 0.4819 0.4824 0.7629 0.7638 0.9917 0.9942 1.1880 1.1906 1.2601 1.2605 1.6365 1.6371 1.6980 1.6990 1.8310 1.8362 2.3170 2.3206 2.4220 2.4246 2.5364 2.5400 2.8845 2.8861 2.9084 2.9120 3.3166 3.3175 3.3912 3.3921 3.4783 3.4811 3.7818 3.7842 3.8251 3.8281 4.1519 4.1529 4.1809 4.1833 4.2551 4.2578 4.3695 4.3707 4.4566 4.4583 4.5788 4.5814 4.6771 4.6778 11.0380 11.0393 11.2312 11.2313 11.3959 11.3981 11.6389 11.6402 k = 0.2212 0.5396-0.0000 ( 8167 PWs) bands (ev): -13.4872 -13.4872 -13.4388 -13.4388 -9.3252 -9.3250 -9.1165 -9.1163 -8.8766 -8.8760 -8.7547 -8.7542 -8.1236 -8.1232 -8.0575 -8.0571 -5.0834 -5.0832 -4.9479 -4.9476 -1.2375 -1.2367 -0.9501 -0.9489 -0.3404 -0.3384 -0.1549 -0.1524 0.1845 0.1862 0.4836 0.4840 0.7893 0.7904 0.9536 0.9560 1.1795 1.1822 1.2375 1.2384 1.6464 1.6466 1.6767 1.6781 1.8132 1.8181 2.3303 2.3337 2.4390 2.4415 2.5290 2.5322 2.8798 2.8817 2.9061 2.9096 3.3167 3.3177 3.3693 3.3702 3.4647 3.4675 3.7720 3.7751 3.8286 3.8305 4.1358 4.1367 4.1573 4.1596 4.2691 4.2711 4.3773 4.3793 4.4628 4.4641 4.5813 4.5833 4.6923 4.6932 11.0131 11.0145 11.2273 11.2274 11.3856 11.3877 11.6209 11.6223 k = 0.2054 0.5396-0.0000 ( 8171 PWs) bands (ev): -13.4877 -13.4877 -13.4391 -13.4391 -9.3379 -9.3377 -9.1297 -9.1294 -8.8656 -8.8649 -8.7454 -8.7450 -8.1196 -8.1193 -8.0507 -8.0504 -5.0886 -5.0884 -4.9398 -4.9395 -1.2460 -1.2452 -0.9631 -0.9620 -0.3192 -0.3172 -0.1371 -0.1349 0.2251 0.2271 0.4854 0.4857 0.8129 0.8142 0.9165 0.9188 1.1702 1.1728 1.2155 1.2168 1.6417 1.6421 1.6666 1.6682 1.8038 1.8082 2.3391 2.3423 2.4507 2.4532 2.5316 2.5340 2.8737 2.8758 2.9024 2.9059 3.3171 3.3181 3.3496 3.3504 3.4505 3.4533 3.7549 3.7582 3.8367 3.8388 4.1186 4.1194 4.1361 4.1385 4.2750 4.2765 4.3858 4.3882 4.4741 4.4749 4.5862 4.5875 4.7067 4.7076 10.9899 10.9913 11.2216 11.2217 11.3759 11.3780 11.6032 11.6049 k = 0.1896 0.5396-0.0000 ( 8175 PWs) bands (ev): -13.4882 -13.4882 -13.4393 -13.4393 -9.3501 -9.3500 -9.1421 -9.1419 -8.8547 -8.8541 -8.7370 -8.7366 -8.1157 -8.1154 -8.0439 -8.0436 -5.0932 -5.0930 -4.9321 -4.9317 -1.2538 -1.2530 -0.9766 -0.9756 -0.2990 -0.2970 -0.1175 -0.1156 0.2653 0.2675 0.4875 0.4878 0.8308 0.8323 0.8819 0.8840 1.1604 1.1624 1.1962 1.1979 1.6157 1.6164 1.6749 1.6758 1.8016 1.8053 2.3417 2.3446 2.4586 2.4615 2.5444 2.5458 2.8668 2.8692 2.8968 2.9004 3.3099 3.3109 3.3403 3.3411 3.4356 3.4384 3.7347 3.7380 3.8455 3.8479 4.1006 4.1015 4.1180 4.1203 4.2758 4.2768 4.3922 4.3948 4.4884 4.4894 4.5940 4.5952 4.7200 4.7211 10.9684 10.9699 11.2131 11.2133 11.3676 11.3696 11.5864 11.5882 k = 0.1738 0.5396-0.0000 ( 8184 PWs) bands (ev): -13.4887 -13.4887 -13.4396 -13.4396 -9.3618 -9.3617 -9.1538 -9.1536 -8.8441 -8.8436 -8.7294 -8.7290 -8.1120 -8.1117 -8.0372 -8.0369 -5.0974 -5.0972 -4.9248 -4.9244 -1.2608 -1.2601 -0.9906 -0.9897 -0.2804 -0.2783 -0.0959 -0.0944 0.3044 0.3069 0.4902 0.4906 0.8285 0.8302 0.8632 0.8641 1.1502 1.1510 1.1824 1.1841 1.5850 1.5861 1.6855 1.6861 1.8041 1.8073 2.3375 2.3401 2.4675 2.4706 2.5632 2.5640 2.8593 2.8619 2.8897 2.8932 3.2921 3.2930 3.3444 3.3454 3.4201 3.4228 3.7131 3.7162 3.8534 3.8560 4.0821 4.0832 4.1033 4.1055 4.2735 4.2743 4.3964 4.3990 4.5024 4.5044 4.6054 4.6074 4.7322 4.7334 10.9488 10.9503 11.2013 11.2015 11.3612 11.3631 11.5706 11.5725 k = 0.1580 0.5396-0.0000 ( 8189 PWs) bands (ev): -13.4892 -13.4892 -13.4398 -13.4398 -9.3728 -9.3727 -9.1647 -9.1645 -8.8340 -8.8335 -8.7227 -8.7223 -8.1084 -8.1081 -8.0305 -8.0302 -5.1011 -5.1009 -4.9179 -4.9176 -1.2669 -1.2663 -1.0047 -1.0039 -0.2637 -0.2617 -0.0722 -0.0710 0.3420 0.3448 0.4939 0.4946 0.7977 0.7998 0.8662 0.8670 1.1384 1.1393 1.1760 1.1778 1.5532 1.5547 1.6964 1.6969 1.8091 1.8118 2.3279 2.3303 2.4793 2.4826 2.5848 2.5852 2.8511 2.8539 2.8813 2.8848 3.2721 3.2728 3.3529 3.3540 3.4048 3.4074 3.6909 3.6938 3.8597 3.8623 4.0632 4.0646 4.0924 4.0944 4.2696 4.2702 4.3990 4.4016 4.5140 4.5168 4.6209 4.6239 4.7432 4.7446 10.9314 10.9329 11.1859 11.1861 11.3570 11.3589 11.5560 11.5579 k = 0.1422 0.5396-0.0000 ( 8185 PWs) bands (ev): -13.4896 -13.4896 -13.4401 -13.4401 -9.3830 -9.3829 -9.1746 -9.1745 -8.8245 -8.8241 -8.7168 -8.7165 -8.1049 -8.1047 -8.0241 -8.0239 -5.1044 -5.1042 -4.9117 -4.9114 -1.2721 -1.2715 -1.0188 -1.0180 -0.2493 -0.2472 -0.0465 -0.0457 0.3769 0.3800 0.4997 0.5007 0.7618 0.7641 0.8678 0.8686 1.1255 1.1271 1.1778 1.1794 1.5217 1.5234 1.7072 1.7076 1.8149 1.8172 2.3150 2.3172 2.4940 2.4973 2.6070 2.6074 2.8422 2.8452 2.8723 2.8758 3.2527 3.2533 3.3589 3.3601 3.3936 3.3956 3.6689 3.6714 3.8642 3.8666 4.0442 4.0458 4.0853 4.0869 4.2645 4.2652 4.4008 4.4032 4.5226 4.5258 4.6396 4.6433 4.7529 4.7545 10.9160 10.9176 11.1673 11.1677 11.3550 11.3568 11.5421 11.5442 k = 0.1264 0.5396-0.0000 ( 8191 PWs) bands (ev): -13.4900 -13.4900 -13.4403 -13.4403 -9.3923 -9.3922 -9.1837 -9.1835 -8.8158 -8.8154 -8.7117 -8.7114 -8.1017 -8.1015 -8.0180 -8.0178 -5.1072 -5.1070 -4.9059 -4.9057 -1.2764 -1.2758 -1.0325 -1.0318 -0.2370 -0.2350 -0.0190 -0.0186 0.4074 0.4106 0.5091 0.5101 0.7253 0.7276 0.8644 0.8651 1.1121 1.1139 1.1870 1.1883 1.4915 1.4934 1.7177 1.7180 1.8205 1.8225 2.3008 2.3028 2.5105 2.5137 2.6288 2.6293 2.8326 2.8357 2.8637 2.8670 3.2348 3.2354 3.3520 3.3534 3.3962 3.3969 3.6476 3.6499 3.8667 3.8689 4.0256 4.0272 4.0815 4.0828 4.2590 4.2598 4.4021 4.4044 4.5289 4.5321 4.6600 4.6641 4.7613 4.7631 10.9029 10.9044 11.1467 11.1472 11.3549 11.3567 11.5288 11.5308 k = 0.1106 0.5396-0.0000 ( 8191 PWs) bands (ev): -13.4904 -13.4904 -13.4405 -13.4405 -9.4006 -9.4005 -9.1917 -9.1916 -8.8079 -8.8076 -8.7074 -8.7072 -8.0988 -8.0986 -8.0124 -8.0122 -5.1096 -5.1095 -4.9008 -4.9006 -1.2797 -1.2792 -1.0457 -1.0450 -0.2267 -0.2249 0.0098 0.0099 0.4311 0.4341 0.5240 0.5246 0.6893 0.6919 0.8570 0.8575 1.0983 1.1001 1.2015 1.2025 1.4632 1.4652 1.7276 1.7279 1.8253 1.8270 2.2866 2.2884 2.5281 2.5312 2.6492 2.6498 2.8225 2.8256 2.8557 2.8589 3.2189 3.2194 3.3351 3.3366 3.4084 3.4085 3.6278 3.6298 3.8675 3.8694 4.0076 4.0093 4.0805 4.0814 4.2531 4.2540 4.4032 4.4053 4.5335 4.5366 4.6804 4.6847 4.7683 4.7705 10.8920 10.8935 11.1251 11.1257 11.3563 11.3581 11.5157 11.5177 k = 0.0948 0.5396-0.0000 ( 8189 PWs) bands (ev): -13.4908 -13.4908 -13.4407 -13.4407 -9.4078 -9.4078 -9.1987 -9.1986 -8.8008 -8.8006 -8.7038 -8.7036 -8.0961 -8.0960 -8.0074 -8.0072 -5.1116 -5.1115 -4.8964 -4.8962 -1.2822 -1.2817 -1.0579 -1.0573 -0.2184 -0.2167 0.0391 0.0393 0.4470 0.4493 0.5435 0.5440 0.6560 0.6591 0.8465 0.8470 1.0842 1.0858 1.2191 1.2201 1.4373 1.4394 1.7368 1.7371 1.8288 1.8303 2.2733 2.2749 2.5464 2.5494 2.6670 2.6676 2.8128 2.8158 2.8489 2.8518 3.2053 3.2059 3.3152 3.3167 3.4229 3.4230 3.6100 3.6117 3.8668 3.8684 3.9908 3.9925 4.0816 4.0821 4.2473 4.2482 4.4042 4.4060 4.5370 4.5398 4.6998 4.7042 4.7739 4.7764 10.8833 10.8846 11.1037 11.1043 11.3589 11.3606 11.5028 11.5048 k = 0.0790 0.5396-0.0000 ( 8182 PWs) bands (ev): -13.4911 -13.4911 -13.4409 -13.4409 -9.4141 -9.4140 -9.2047 -9.2046 -8.7948 -8.7945 -8.7009 -8.7007 -8.0938 -8.0937 -8.0029 -8.0028 -5.1133 -5.1132 -4.8925 -4.8924 -1.2838 -1.2834 -1.0690 -1.0685 -0.2117 -0.2102 0.0683 0.0686 0.4566 0.4583 0.5594 0.5609 0.6321 0.6357 0.8337 0.8344 1.0702 1.0717 1.2380 1.2392 1.4141 1.4163 1.7452 1.7456 1.8309 1.8323 2.2613 2.2627 2.5649 2.5678 2.6806 2.6813 2.8047 2.8076 2.8431 2.8458 3.1943 3.1950 3.2947 3.2961 3.4375 3.4377 3.5944 3.5959 3.8650 3.8664 3.9757 3.9772 4.0841 4.0842 4.2418 4.2427 4.4050 4.4066 4.5397 4.5421 4.7176 4.7220 4.7782 4.7809 10.8766 10.8778 11.0836 11.0842 11.3623 11.3640 11.4903 11.4921 k = 0.0632 0.5396-0.0000 ( 8176 PWs) bands (ev): -13.4913 -13.4913 -13.4410 -13.4410 -9.4192 -9.4191 -9.2096 -9.2095 -8.7897 -8.7895 -8.6986 -8.6985 -8.0919 -8.0918 -7.9992 -7.9991 -5.1146 -5.1145 -4.8894 -4.8892 -1.2849 -1.2845 -1.0786 -1.0782 -0.2064 -0.2052 0.0964 0.0968 0.4620 0.4635 0.5553 0.5566 0.6342 0.6368 0.8190 0.8200 1.0570 1.0583 1.2568 1.2583 1.3937 1.3959 1.7526 1.7530 1.8319 1.8330 2.2512 2.2523 2.5835 2.5862 2.6881 2.6889 2.7999 2.8027 2.8384 2.8408 3.1861 3.1870 3.2747 3.2760 3.4511 3.4514 3.5815 3.5826 3.8624 3.8636 3.9627 3.9641 4.0871 4.0872 4.2367 4.2376 4.4057 4.4070 4.5419 4.5438 4.7333 4.7377 4.7809 4.7839 10.8717 10.8728 11.0656 11.0662 11.3664 11.3680 11.4784 11.4802 k = 0.0474 0.5396-0.0000 ( 8178 PWs) bands (ev): -13.4915 -13.4915 -13.4411 -13.4411 -9.4232 -9.4232 -9.2134 -9.2134 -8.7857 -8.7856 -8.6969 -8.6968 -8.0903 -8.0902 -7.9962 -7.9962 -5.1156 -5.1155 -4.8869 -4.8868 -1.2854 -1.2851 -1.0865 -1.0862 -0.2025 -0.2015 0.1221 0.1225 0.4648 0.4666 0.5349 0.5365 0.6568 0.6584 0.8023 0.8035 1.0455 1.0464 1.2745 1.2761 1.3761 1.3783 1.7589 1.7592 1.8318 1.8328 2.2432 2.2440 2.6017 2.6043 2.6883 2.6893 2.7992 2.8016 2.8347 2.8368 3.1808 3.1818 3.2563 3.2576 3.4628 3.4631 3.5713 3.5722 3.8596 3.8605 3.9523 3.9535 4.0901 4.0903 4.2324 4.2331 4.4063 4.4073 4.5436 4.5450 4.7467 4.7510 4.7820 4.7853 10.8685 10.8694 11.0506 11.0511 11.3708 11.3722 11.4679 11.4694 k = 0.0316 0.5396-0.0000 ( 8179 PWs) bands (ev): -13.4917 -13.4917 -13.4412 -13.4412 -9.4261 -9.4261 -9.2162 -9.2162 -8.7828 -8.7827 -8.6957 -8.6956 -8.0892 -8.0891 -7.9941 -7.9940 -5.1163 -5.1163 -4.8851 -4.8851 -1.2856 -1.2855 -1.0923 -1.0921 -0.1997 -0.1990 0.1432 0.1436 0.4658 0.4678 0.5145 0.5164 0.6842 0.6855 0.7834 0.7847 1.0364 1.0371 1.2902 1.2919 1.3613 1.3634 1.7638 1.7640 1.8313 1.8320 2.2373 2.2379 2.6193 2.6216 2.6821 2.6834 2.8015 2.8033 2.8321 2.8338 3.1783 3.1792 3.2410 3.2421 3.4719 3.4721 3.5641 3.5647 3.8570 3.8577 3.9449 3.9457 4.0927 4.0929 4.2291 4.2296 4.4068 4.4075 4.5448 4.5458 4.7577 4.7619 4.7816 4.7851 10.8666 10.8673 11.0393 11.0396 11.3750 11.3761 11.4593 11.4605 k = 0.0158 0.5396-0.0000 ( 8175 PWs) bands (ev): -13.4917 -13.4917 -13.4412 -13.4412 -9.4278 -9.4278 -9.2178 -9.2178 -8.7810 -8.7810 -8.6950 -8.6949 -8.0885 -8.0885 -7.9928 -7.9927 -5.1167 -5.1167 -4.8841 -4.8840 -1.2857 -1.2856 -1.0959 -1.0958 -0.1980 -0.1976 0.1576 0.1578 0.4658 0.4673 0.5011 0.5027 0.7116 0.7129 0.7621 0.7635 1.0307 1.0310 1.3028 1.3041 1.3501 1.3516 1.7669 1.7670 1.8308 1.8311 2.2339 2.2342 2.6353 2.6372 2.6723 2.6736 2.8043 2.8054 2.8308 2.8317 3.1779 3.1784 3.2306 3.2312 3.4777 3.4778 3.5598 3.5601 3.8553 3.8556 3.9405 3.9409 4.0945 4.0946 4.2271 4.2274 4.4072 4.4075 4.5457 4.5462 4.7662 4.7697 4.7800 4.7832 10.8657 10.8661 11.0323 11.0325 11.3782 11.3788 11.4537 11.4543 k = 0.0000 0.5396-0.0000 ( 8172 PWs) bands (ev): -13.4918 -13.4918 -13.4412 -13.4412 -9.4284 -9.4284 -9.2184 -9.2184 -8.7804 -8.7804 -8.6947 -8.6947 -8.0883 -8.0883 -7.9923 -7.9923 -5.1168 -5.1168 -4.8837 -4.8837 -1.2857 -1.2857 -1.0971 -1.0971 -0.1973 -0.1973 0.1628 0.1628 0.4661 0.4661 0.4974 0.4974 0.7348 0.7348 0.7425 0.7425 1.0288 1.0288 1.3088 1.3088 1.3457 1.3457 1.7680 1.7680 1.8306 1.8306 2.2328 2.2328 2.6451 2.6451 2.6659 2.6659 2.8059 2.8059 2.8307 2.8307 3.1782 3.1782 3.2270 3.2270 3.4797 3.4797 3.5585 3.5585 3.8548 3.8548 3.9392 3.9392 4.0952 4.0952 4.2265 4.2265 4.4074 4.4074 4.5461 4.5461 4.7715 4.7715 4.7802 4.7802 10.8656 10.8656 11.0299 11.0299 11.3797 11.3797 11.4519 11.4519 k = 0.0000 0.5396-0.0000 ( 8172 PWs) bands (ev): -13.4918 -13.4918 -13.4412 -13.4412 -9.4284 -9.4284 -9.2184 -9.2184 -8.7804 -8.7804 -8.6947 -8.6947 -8.0883 -8.0883 -7.9923 -7.9923 -5.1168 -5.1168 -4.8837 -4.8837 -1.2857 -1.2857 -1.0971 -1.0971 -0.1973 -0.1973 0.1628 0.1628 0.4661 0.4661 0.4974 0.4974 0.7348 0.7348 0.7425 0.7425 1.0288 1.0288 1.3088 1.3088 1.3457 1.3457 1.7680 1.7680 1.8306 1.8306 2.2328 2.2328 2.6451 2.6451 2.6659 2.6659 2.8059 2.8059 2.8307 2.8307 3.1782 3.1782 3.2270 3.2270 3.4797 3.4797 3.5585 3.5585 3.8548 3.8548 3.9392 3.9392 4.0952 4.0952 4.2265 4.2265 4.4074 4.4074 4.5461 4.5461 4.7715 4.7715 4.7802 4.7802 10.8656 10.8656 11.0299 11.0299 11.3797 11.3797 11.4519 11.4519 k = 0.0000 0.5396 0.0157 ( 8176 PWs) bands (ev): -13.4917 -13.4917 -13.4413 -13.4413 -9.4280 -9.4280 -9.2188 -9.2188 -8.7803 -8.7803 -8.6949 -8.6949 -8.0881 -8.0880 -7.9925 -7.9925 -5.1164 -5.1164 -4.8841 -4.8841 -1.2852 -1.2852 -1.0972 -1.0972 -0.1978 -0.1977 0.1580 0.1581 0.4666 0.4668 0.5004 0.5006 0.7344 0.7348 0.7425 0.7427 1.0308 1.0310 1.3106 1.3109 1.3457 1.3460 1.7675 1.7678 1.8294 1.8296 2.2318 2.2318 2.6437 2.6443 2.6648 2.6651 2.8064 2.8068 2.8310 2.8311 3.1781 3.1788 3.2278 3.2278 3.4735 3.4736 3.5652 3.5653 3.8517 3.8520 3.9384 3.9385 4.0981 4.0986 4.2257 4.2259 4.4083 4.4086 4.5457 4.5458 4.7711 4.7712 4.7798 4.7799 10.8652 10.8653 11.0302 11.0302 11.3815 11.3815 11.4522 11.4523 k = 0.0000 0.5396 0.0314 ( 8182 PWs) bands (ev): -13.4914 -13.4914 -13.4416 -13.4416 -9.4269 -9.4269 -9.2201 -9.2201 -8.7798 -8.7798 -8.6954 -8.6954 -8.0874 -8.0874 -7.9930 -7.9929 -5.1150 -5.1150 -4.8854 -4.8853 -1.2838 -1.2838 -1.0976 -1.0976 -0.1992 -0.1991 0.1444 0.1445 0.4683 0.4687 0.5088 0.5092 0.7338 0.7347 0.7429 0.7434 1.0370 1.0374 1.3161 1.3167 1.3459 1.3465 1.7663 1.7669 1.8259 1.8263 2.2287 2.2287 2.6402 2.6413 2.6620 2.6626 2.8082 2.8091 2.8321 2.8322 3.1786 3.1798 3.2301 3.2301 3.4593 3.4593 3.5812 3.5815 3.8431 3.8437 3.9364 3.9365 4.1068 4.1078 4.2236 4.2239 4.4111 4.4117 4.5446 4.5447 4.7701 4.7705 4.7788 4.7789 10.8642 10.8644 11.0308 11.0308 11.3868 11.3868 11.4533 11.4534 k = 0.0000 0.5396 0.0471 ( 8182 PWs) bands (ev): -13.4909 -13.4909 -13.4421 -13.4421 -9.4251 -9.4251 -9.2223 -9.2223 -8.7790 -8.7790 -8.6962 -8.6962 -8.0864 -8.0864 -7.9938 -7.9937 -5.1127 -5.1126 -4.8875 -4.8874 -1.2815 -1.2815 -1.0983 -1.0982 -0.2014 -0.2012 0.1239 0.1241 0.4711 0.4717 0.5207 0.5212 0.7333 0.7345 0.7437 0.7443 1.0473 1.0479 1.3251 1.3259 1.3464 1.3473 1.7646 1.7654 1.8201 1.8208 2.2236 2.2238 2.6347 2.6363 2.6574 2.6582 2.8113 2.8126 2.8337 2.8338 3.1795 3.1813 3.2340 3.2340 3.4422 3.4422 3.6013 3.6016 3.8299 3.8307 3.9333 3.9335 4.1200 4.1213 4.2206 4.2210 4.4156 4.4166 4.5428 4.5430 4.7685 4.7691 4.7770 4.7772 10.8628 10.8630 11.0317 11.0317 11.3955 11.3955 11.4551 11.4552 k = 0.0000 0.5396 0.0628 ( 8186 PWs) bands (ev): -13.4903 -13.4903 -13.4428 -13.4428 -9.4226 -9.4226 -9.2254 -9.2253 -8.7778 -8.7778 -8.6973 -8.6973 -8.0849 -8.0849 -7.9949 -7.9949 -5.1095 -5.1094 -4.8904 -4.8903 -1.2783 -1.2783 -1.0993 -1.0992 -0.2044 -0.2042 0.0986 0.0988 0.4749 0.4756 0.5337 0.5343 0.7333 0.7346 0.7448 0.7456 1.0617 1.0624 1.3372 1.3379 1.3474 1.3484 1.7627 1.7637 1.8121 1.8130 2.2169 2.2170 2.6275 2.6296 2.6509 2.6520 2.8154 2.8170 2.8355 2.8357 3.1811 3.1833 3.2396 3.2396 3.4248 3.4249 3.6226 3.6229 3.8134 3.8144 3.9295 3.9298 4.1363 4.1378 4.2171 4.2176 4.4215 4.4227 4.5405 4.5406 4.7663 4.7671 4.7746 4.7748 10.8612 10.8614 11.0326 11.0326 11.4071 11.4073 11.4577 11.4579 k = 0.0000 0.5396 0.0785 ( 8180 PWs) bands (ev): -13.4895 -13.4895 -13.4437 -13.4437 -9.4193 -9.4193 -9.2292 -9.2292 -8.7764 -8.7764 -8.6987 -8.6987 -8.0831 -8.0831 -7.9963 -7.9963 -5.1055 -5.1053 -4.8941 -4.8939 -1.2742 -1.2742 -1.1006 -1.1005 -0.2080 -0.2077 0.0704 0.0706 0.4795 0.4804 0.5459 0.5465 0.7342 0.7356 0.7463 0.7472 1.0801 1.0808 1.3474 1.3493 1.3523 1.3538 1.7608 1.7620 1.8019 1.8029 2.2087 2.2088 2.6191 2.6216 2.6426 2.6439 2.8202 2.8221 2.8374 2.8376 3.1833 3.1859 3.2469 3.2469 3.4082 3.4083 3.6441 3.6444 3.7946 3.7956 3.9250 3.9254 4.1542 4.1559 4.2138 4.2143 4.4284 4.4298 4.5376 4.5378 4.7636 4.7645 4.7716 4.7719 10.8595 10.8599 11.0332 11.0333 11.4214 11.4216 11.4612 11.4614 k = 0.0000 0.5396 0.0942 ( 8180 PWs) bands (ev): -13.4885 -13.4885 -13.4447 -13.4447 -9.4154 -9.4154 -9.2338 -9.2338 -8.7747 -8.7746 -8.7004 -8.7004 -8.0809 -8.0809 -7.9981 -7.9980 -5.1006 -5.1004 -4.8986 -4.8984 -1.2693 -1.2692 -1.1024 -1.1022 -0.2119 -0.2116 0.0407 0.0409 0.4848 0.4858 0.5560 0.5565 0.7363 0.7376 0.7482 0.7491 1.1022 1.1028 1.3494 1.3516 1.3683 1.3698 1.7595 1.7608 1.7894 1.7907 2.1991 2.1992 2.6097 2.6125 2.6325 2.6340 2.8253 2.8274 2.8391 2.8392 3.1863 3.1892 3.2558 3.2558 3.3928 3.3929 3.6649 3.6651 3.7742 3.7752 3.9198 3.9204 4.1729 4.1746 4.2112 4.2116 4.4360 4.4375 4.5345 4.5347 4.7602 4.7613 4.7680 4.7683 10.8582 10.8586 11.0332 11.0333 11.4378 11.4380 11.4657 11.4660 k = 0.0000 0.5396 0.1099 ( 8182 PWs) bands (ev): -13.4873 -13.4873 -13.4459 -13.4459 -9.4109 -9.4108 -9.2391 -9.2391 -8.7726 -8.7726 -8.7024 -8.7024 -8.0784 -8.0783 -8.0001 -8.0000 -5.0949 -5.0947 -4.9039 -4.9036 -1.2635 -1.2635 -1.1046 -1.1044 -0.2161 -0.2158 0.0106 0.0108 0.4906 0.4916 0.5633 0.5636 0.7397 0.7408 0.7504 0.7513 1.1276 1.1281 1.3515 1.3539 1.3854 1.3869 1.7594 1.7609 1.7749 1.7764 2.1884 2.1884 2.5996 2.6026 2.6209 2.6226 2.8303 2.8326 2.8405 2.8406 3.1901 3.1930 3.2663 3.2663 3.3791 3.3792 3.6846 3.6848 3.7529 3.7537 3.9140 3.9147 4.1914 4.1932 4.2097 4.2101 4.4439 4.4455 4.5312 4.5315 4.7564 4.7576 4.7638 4.7642 10.8575 10.8579 11.0322 11.0323 11.4557 11.4559 11.4714 11.4718 k = 0.0000 0.5396 0.1256 ( 8186 PWs) bands (ev): -13.4860 -13.4860 -13.4473 -13.4473 -9.4057 -9.4056 -9.2452 -9.2451 -8.7703 -8.7703 -8.7047 -8.7046 -8.0756 -8.0755 -8.0024 -8.0023 -5.0885 -5.0882 -4.9098 -4.9095 -1.2570 -1.2570 -1.1073 -1.1071 -0.2204 -0.2200 -0.0191 -0.0190 0.4966 0.4975 0.5677 0.5678 0.7442 0.7450 0.7530 0.7538 1.1559 1.1562 1.3541 1.3569 1.4024 1.4037 1.7582 1.7592 1.7616 1.7636 2.1765 2.1765 2.5891 2.5922 2.6080 2.6099 2.8349 2.8374 2.8417 2.8418 3.1945 3.1975 3.2777 3.2778 3.3675 3.3676 3.7030 3.7032 3.7309 3.7316 3.9076 3.9084 4.2089 4.2092 4.2100 4.2118 4.4519 4.4536 4.5279 4.5282 4.7520 4.7534 4.7592 4.7596 10.8576 10.8581 11.0298 11.0299 11.4744 11.4747 11.4787 11.4790 k = 0.0000 0.5396 0.1413 ( 8182 PWs) bands (ev): -13.4845 -13.4845 -13.4488 -13.4488 -9.3999 -9.3998 -9.2518 -9.2518 -8.7678 -8.7678 -8.7072 -8.7071 -8.0724 -8.0724 -8.0050 -8.0049 -5.0813 -5.0811 -4.9164 -4.9161 -1.2499 -1.2498 -1.1105 -1.1103 -0.2244 -0.2240 -0.0478 -0.0477 0.5026 0.5036 0.5695 0.5696 0.7494 0.7497 0.7558 0.7565 1.1866 1.1867 1.3574 1.3604 1.4181 1.4192 1.7397 1.7411 1.7666 1.7681 2.1635 2.1636 2.5784 2.5816 2.5943 2.5962 2.8385 2.8406 2.8430 2.8435 3.1997 3.2026 3.2892 3.2895 3.3588 3.3590 3.7083 3.7090 3.7200 3.7200 3.9006 3.9015 4.2111 4.2115 4.2257 4.2277 4.4600 4.4617 4.5249 4.5252 4.7473 4.7487 4.7542 4.7547 10.8587 10.8593 11.0257 11.0259 11.4865 11.4871 11.4943 11.4946 k = 0.0000 0.5396 0.1570 ( 8168 PWs) bands (ev): -13.4829 -13.4829 -13.4504 -13.4504 -9.3935 -9.3935 -9.2590 -9.2589 -8.7650 -8.7650 -8.7099 -8.7099 -8.0691 -8.0690 -8.0078 -8.0077 -5.0736 -5.0733 -4.9237 -4.9233 -1.2421 -1.2420 -1.1144 -1.1142 -0.2280 -0.2276 -0.0751 -0.0751 0.5086 0.5094 0.5692 0.5696 0.7548 0.7548 0.7590 0.7594 1.2191 1.2191 1.3614 1.3647 1.4314 1.4320 1.7191 1.7207 1.7755 1.7766 2.1493 2.1495 2.5677 2.5709 2.5801 2.5820 2.8403 2.8417 2.8451 2.8465 3.2054 3.2082 3.2982 3.2989 3.3552 3.3557 3.6858 3.6862 3.7352 3.7352 3.8930 3.8940 4.2145 4.2147 4.2404 4.2424 4.4679 4.4696 4.5223 4.5226 4.7422 4.7438 4.7489 4.7494 10.8611 10.8617 11.0199 11.0202 11.4964 11.4971 11.5133 11.5136 k = 0.0000 0.5396 0.1727 ( 8172 PWs) bands (ev): -13.4812 -13.4812 -13.4522 -13.4522 -9.3867 -9.3866 -9.2667 -9.2666 -8.7620 -8.7620 -8.7129 -8.7128 -8.0655 -8.0654 -8.0108 -8.0107 -5.0653 -5.0650 -4.9315 -4.9311 -1.2338 -1.2337 -1.1189 -1.1187 -0.2310 -0.2305 -0.1006 -0.1006 0.5143 0.5151 0.5675 0.5681 0.7595 0.7598 0.7624 0.7625 1.2527 1.2529 1.3661 1.3696 1.4414 1.4415 1.6967 1.6984 1.7888 1.7896 2.1336 2.1340 2.5573 2.5604 2.5661 2.5679 2.8410 2.8422 2.8473 2.8491 3.2117 3.2142 3.3018 3.3027 3.3595 3.3604 3.6629 3.6632 3.7489 3.7490 3.8849 3.8859 4.2195 4.2195 4.2530 4.2549 4.4756 4.4772 4.5201 4.5206 4.7371 4.7387 4.7434 4.7440 10.8648 10.8655 11.0123 11.0126 11.5076 11.5083 11.5314 11.5319 k = 0.0000 0.5396 0.1884 ( 8170 PWs) bands (ev): -13.4794 -13.4794 -13.4541 -13.4541 -9.3793 -9.3793 -9.2748 -9.2747 -8.7589 -8.7588 -8.7160 -8.7159 -8.0617 -8.0616 -8.0141 -8.0140 -5.0565 -5.0562 -4.9398 -4.9394 -1.2250 -1.2249 -1.1241 -1.1239 -0.2331 -0.2327 -0.1241 -0.1240 0.5198 0.5203 0.5650 0.5657 0.7637 0.7641 0.7658 0.7662 1.2872 1.2875 1.3716 1.3753 1.4470 1.4478 1.6726 1.6743 1.8067 1.8070 2.1164 2.1169 2.5473 2.5503 2.5528 2.5545 2.8413 2.8425 2.8491 2.8510 3.2183 3.2205 3.2996 3.3005 3.3720 3.3730 3.6400 3.6400 3.7613 3.7615 3.8765 3.8775 4.2257 4.2259 4.2631 4.2650 4.4829 4.4844 4.5186 4.5191 4.7319 4.7336 4.7379 4.7386 10.8700 10.8706 11.0030 11.0034 11.5198 11.5207 11.5479 11.5485 k = 0.0000 0.5396 0.2041 ( 8174 PWs) bands (ev): -13.4774 -13.4774 -13.4561 -13.4561 -9.3716 -9.3715 -9.2832 -9.2832 -8.7555 -8.7555 -8.7193 -8.7192 -8.0578 -8.0577 -8.0176 -8.0175 -5.0472 -5.0469 -4.9486 -4.9482 -1.2159 -1.2157 -1.1301 -1.1298 -0.2342 -0.2337 -0.1453 -0.1453 0.5248 0.5252 0.5619 0.5627 0.7672 0.7677 0.7692 0.7700 1.3221 1.3225 1.3778 1.3817 1.4489 1.4504 1.6469 1.6486 1.8287 1.8288 2.0973 2.0979 2.5380 2.5406 2.5411 2.5423 2.8417 2.8429 2.8501 2.8520 3.2252 3.2271 3.2944 3.2952 3.3894 3.3904 3.6168 3.6169 3.7726 3.7730 3.8677 3.8687 4.2329 4.2333 4.2706 4.2724 4.4897 4.4912 4.5177 4.5182 4.7271 4.7287 4.7325 4.7333 10.8765 10.8772 10.9923 10.9927 11.5327 11.5336 11.5623 11.5629 k = 0.0000 0.5396 0.2198 ( 8170 PWs) bands (ev): -13.4754 -13.4754 -13.4581 -13.4581 -9.3634 -9.3634 -9.2919 -9.2919 -8.7521 -8.7520 -8.7227 -8.7227 -8.0537 -8.0536 -8.0212 -8.0211 -5.0377 -5.0373 -4.9579 -4.9575 -1.2065 -1.2064 -1.1366 -1.1364 -0.2339 -0.2335 -0.1643 -0.1641 0.5295 0.5297 0.5586 0.5594 0.7701 0.7708 0.7722 0.7733 1.3569 1.3572 1.3848 1.3888 1.4477 1.4500 1.6196 1.6213 1.8540 1.8544 2.0761 2.0769 2.5297 2.5306 2.5319 2.5324 2.8422 2.8435 2.8504 2.8523 3.2322 3.2338 3.2881 3.2887 3.4094 3.4104 3.5934 3.5937 3.7831 3.7836 3.8586 3.8596 4.2408 4.2414 4.2753 4.2770 4.4960 4.4974 4.5171 4.5177 4.7228 4.7243 4.7275 4.7284 10.8845 10.8852 10.9803 10.9809 11.5456 11.5466 11.5737 11.5744 k = 0.0000 0.5396 0.2355 ( 8168 PWs) bands (ev): -13.4733 -13.4733 -13.4602 -13.4602 -9.3550 -9.3549 -9.3009 -9.3008 -8.7485 -8.7484 -8.7263 -8.7262 -8.0496 -8.0495 -8.0250 -8.0249 -5.0278 -5.0274 -4.9674 -4.9670 -1.1970 -1.1968 -1.1439 -1.1437 -0.2322 -0.2318 -0.1808 -0.1806 0.5338 0.5338 0.5551 0.5559 0.7726 0.7735 0.7745 0.7758 1.3905 1.3906 1.3925 1.3966 1.4447 1.4478 1.5909 1.5926 1.8818 1.8826 2.0527 2.0537 2.5224 2.5226 2.5238 2.5251 2.8430 2.8444 2.8500 2.8519 3.2393 3.2406 3.2814 3.2818 3.4309 3.4319 3.5700 3.5704 3.7930 3.7936 3.8494 3.8504 4.2488 4.2496 4.2773 4.2790 4.5016 4.5028 4.5167 4.5173 4.7192 4.7208 4.7231 4.7240 10.8939 10.8945 10.9676 10.9682 11.5579 11.5589 11.5818 11.5826 k = 0.0000 0.5396 0.2512 ( 8170 PWs) bands (ev): -13.4712 -13.4712 -13.4624 -13.4624 -9.3462 -9.3462 -9.3100 -9.3099 -8.7448 -8.7448 -8.7299 -8.7299 -8.0455 -8.0454 -8.0290 -8.0289 -5.0178 -5.0174 -4.9772 -4.9768 -1.1875 -1.1873 -1.1517 -1.1515 -0.2288 -0.2284 -0.1949 -0.1947 0.5376 0.5379 0.5517 0.5524 0.7746 0.7757 0.7761 0.7774 1.4005 1.4042 1.4185 1.4189 1.4451 1.4489 1.5610 1.5627 1.9112 1.9122 2.0273 2.0283 2.5169 2.5170 2.5180 2.5193 2.8440 2.8456 2.8492 2.8510 3.2464 3.2474 3.2746 3.2748 3.4533 3.4543 3.5465 3.5471 3.8026 3.8033 3.8401 3.8410 4.2567 4.2576 4.2769 4.2785 4.5063 4.5075 4.5160 4.5168 4.7167 4.7182 4.7194 4.7205 10.9044 10.9051 10.9545 10.9551 11.5689 11.5699 11.5863 11.5872 k = 0.0000 0.5396 0.2669 ( 8182 PWs) bands (ev): -13.4690 -13.4690 -13.4646 -13.4646 -9.3373 -9.3372 -9.3191 -9.3190 -8.7411 -8.7411 -8.7336 -8.7336 -8.0413 -8.0412 -8.0330 -8.0329 -5.0076 -5.0072 -4.9873 -4.9869 -1.1781 -1.1779 -1.1601 -1.1599 -0.2235 -0.2231 -0.2067 -0.2064 0.5413 0.5417 0.5482 0.5489 0.7760 0.7768 0.7773 0.7782 1.4088 1.4123 1.4231 1.4253 1.4670 1.4694 1.5300 1.5317 1.9412 1.9424 1.9999 2.0011 2.5136 2.5140 2.5143 2.5153 2.8453 2.8469 2.8480 2.8497 3.2536 3.2542 3.2677 3.2678 3.4763 3.4772 3.5230 3.5237 3.8121 3.8128 3.8307 3.8316 4.2638 4.2649 4.2743 4.2757 4.5101 4.5112 4.5149 4.5158 4.7154 4.7168 4.7169 4.7180 10.9159 10.9166 10.9413 10.9419 11.5778 11.5789 11.5870 11.5879 k = 0.0000 0.5396 0.2826 ( 8188 PWs) bands (ev): -13.4668 -13.4668 -13.4668 -13.4668 -9.3282 -9.3282 -9.3282 -9.3282 -8.7374 -8.7374 -8.7373 -8.7373 -8.0371 -8.0371 -8.0370 -8.0370 -4.9974 -4.9974 -4.9970 -4.9970 -1.1689 -1.1689 -1.1687 -1.1687 -0.2162 -0.2162 -0.2159 -0.2159 0.5448 0.5448 0.5453 0.5453 0.7768 0.7768 0.7781 0.7781 1.4168 1.4168 1.4198 1.4198 1.4982 1.4982 1.5002 1.5002 1.9711 1.9711 1.9722 1.9722 2.5128 2.5128 2.5135 2.5135 2.8466 2.8466 2.8483 2.8483 3.2607 3.2607 3.2610 3.2610 3.4996 3.4996 3.5004 3.5004 3.8214 3.8214 3.8222 3.8222 4.2698 4.2698 4.2711 4.2711 4.5130 4.5130 4.5139 4.5139 4.7155 4.7155 4.7167 4.7167 10.9283 10.9283 10.9290 10.9290 11.5841 11.5841 11.5850 11.5850 k = 0.0000 0.5396 0.2826 ( 8188 PWs) bands (ev): -13.4668 -13.4668 -13.4668 -13.4668 -9.3282 -9.3282 -9.3282 -9.3282 -8.7374 -8.7374 -8.7373 -8.7373 -8.0371 -8.0371 -8.0370 -8.0370 -4.9974 -4.9974 -4.9970 -4.9970 -1.1689 -1.1689 -1.1687 -1.1687 -0.2162 -0.2162 -0.2159 -0.2159 0.5448 0.5448 0.5453 0.5453 0.7768 0.7768 0.7781 0.7781 1.4168 1.4168 1.4198 1.4198 1.4982 1.4982 1.5002 1.5002 1.9711 1.9711 1.9722 1.9722 2.5128 2.5128 2.5135 2.5135 2.8466 2.8466 2.8483 2.8483 3.2607 3.2607 3.2610 3.2610 3.4996 3.4996 3.5004 3.5004 3.8214 3.8214 3.8222 3.8222 4.2698 4.2698 4.2711 4.2711 4.5130 4.5130 4.5139 4.5139 4.7155 4.7155 4.7167 4.7167 10.9283 10.9283 10.9290 10.9290 11.5841 11.5841 11.5850 11.5850 k = 0.0158 0.5396 0.2826 ( 8184 PWs) bands (ev): -13.4668 -13.4668 -13.4668 -13.4668 -9.3277 -9.3277 -9.3276 -9.3276 -8.7378 -8.7378 -8.7377 -8.7377 -8.0375 -8.0375 -8.0373 -8.0373 -4.9975 -4.9975 -4.9971 -4.9971 -1.1686 -1.1686 -1.1684 -1.1684 -0.2175 -0.2175 -0.2171 -0.2171 0.5448 0.5448 0.5458 0.5458 0.7784 0.7784 0.7800 0.7800 1.4132 1.4132 1.4162 1.4162 1.5002 1.5002 1.5022 1.5022 1.9710 1.9710 1.9721 1.9721 2.5140 2.5140 2.5148 2.5148 2.8464 2.8464 2.8481 2.8481 3.2606 3.2606 3.2611 3.2611 3.5001 3.5001 3.5010 3.5010 3.8223 3.8223 3.8232 3.8232 4.2699 4.2699 4.2712 4.2712 4.5122 4.5122 4.5132 4.5132 4.7152 4.7152 4.7165 4.7165 10.9294 10.9294 10.9300 10.9300 11.5842 11.5842 11.5852 11.5852 k = 0.0316 0.5396 0.2826 ( 8184 PWs) bands (ev): -13.4667 -13.4667 -13.4667 -13.4667 -9.3260 -9.3260 -9.3259 -9.3259 -8.7391 -8.7391 -8.7390 -8.7390 -8.0384 -8.0384 -8.0383 -8.0383 -4.9977 -4.9977 -4.9973 -4.9973 -1.1678 -1.1678 -1.1675 -1.1675 -0.2215 -0.2215 -0.2209 -0.2209 0.5449 0.5449 0.5466 0.5466 0.7832 0.7832 0.7854 0.7854 1.4032 1.4032 1.4061 1.4061 1.5051 1.5051 1.5072 1.5072 1.9707 1.9707 1.9720 1.9720 2.5175 2.5175 2.5186 2.5186 2.8455 2.8455 2.8474 2.8474 3.2607 3.2607 3.2616 3.2616 3.5019 3.5019 3.5030 3.5030 3.8248 3.8248 3.8260 3.8260 4.2703 4.2703 4.2717 4.2717 4.5098 4.5098 4.5109 4.5109 4.7144 4.7144 4.7157 4.7157 10.9324 10.9324 10.9331 10.9331 11.5847 11.5847 11.5857 11.5857 k = 0.0474 0.5396 0.2826 ( 8184 PWs) bands (ev): -13.4666 -13.4666 -13.4666 -13.4666 -9.3231 -9.3231 -9.3230 -9.3230 -8.7413 -8.7413 -8.7411 -8.7411 -8.0400 -8.0400 -8.0398 -8.0398 -4.9980 -4.9980 -4.9976 -4.9976 -1.1663 -1.1663 -1.1660 -1.1660 -0.2278 -0.2278 -0.2270 -0.2270 0.5449 0.5449 0.5472 0.5472 0.7915 0.7915 0.7943 0.7943 1.3887 1.3887 1.3916 1.3916 1.5114 1.5114 1.5135 1.5135 1.9704 1.9704 1.9718 1.9718 2.5231 2.5231 2.5245 2.5245 2.8443 2.8443 2.8464 2.8464 3.2610 3.2610 3.2622 3.2622 3.5049 3.5049 3.5062 3.5062 3.8291 3.8291 3.8305 3.8305 4.2710 4.2710 4.2725 4.2725 4.5060 4.5060 4.5072 4.5072 4.7129 4.7129 4.7144 4.7144 10.9374 10.9374 10.9381 10.9381 11.5854 11.5854 11.5865 11.5865 k = 0.0632 0.5396 0.2826 ( 8182 PWs) bands (ev): -13.4665 -13.4665 -13.4664 -13.4664 -9.3192 -9.3192 -9.3190 -9.3190 -8.7443 -8.7443 -8.7441 -8.7441 -8.0422 -8.0422 -8.0419 -8.0419 -4.9985 -4.9985 -4.9981 -4.9981 -1.1645 -1.1645 -1.1640 -1.1640 -0.2359 -0.2359 -0.2349 -0.2349 0.5442 0.5442 0.5470 0.5470 0.8036 0.8036 0.8068 0.8068 1.3711 1.3711 1.3740 1.3740 1.5179 1.5179 1.5200 1.5200 1.9703 1.9703 1.9717 1.9717 2.5304 2.5304 2.5321 2.5321 2.8427 2.8427 2.8452 2.8452 3.2615 3.2615 3.2630 3.2630 3.5091 3.5091 3.5107 3.5107 3.8349 3.8349 3.8367 3.8367 4.2718 4.2718 4.2734 4.2734 4.5009 4.5009 4.5022 4.5022 4.7109 4.7109 4.7125 4.7125 10.9443 10.9443 10.9450 10.9450 11.5864 11.5864 11.5875 11.5875 k = 0.0790 0.5396 0.2826 ( 8186 PWs) bands (ev): -13.4663 -13.4663 -13.4663 -13.4663 -9.3141 -9.3141 -9.3139 -9.3139 -8.7481 -8.7481 -8.7479 -8.7479 -8.0450 -8.0450 -8.0446 -8.0446 -4.9990 -4.9990 -4.9986 -4.9986 -1.1622 -1.1622 -1.1616 -1.1616 -0.2454 -0.2454 -0.2442 -0.2442 0.5425 0.5425 0.5454 0.5454 0.8192 0.8192 0.8227 0.8227 1.3515 1.3515 1.3543 1.3543 1.5240 1.5240 1.5261 1.5261 1.9705 1.9705 1.9720 1.9720 2.5388 2.5388 2.5408 2.5408 2.8412 2.8412 2.8440 2.8440 3.2622 3.2622 3.2640 3.2640 3.5146 3.5146 3.5164 3.5164 3.8421 3.8421 3.8442 3.8442 4.2726 4.2726 4.2745 4.2745 4.4947 4.4947 4.4961 4.4961 4.7083 4.7083 4.7100 4.7100 10.9529 10.9529 10.9536 10.9536 11.5877 11.5877 11.5888 11.5888 k = 0.0948 0.5396 0.2826 ( 8188 PWs) bands (ev): -13.4660 -13.4660 -13.4660 -13.4660 -9.3079 -9.3079 -9.3077 -9.3077 -8.7529 -8.7529 -8.7526 -8.7526 -8.0483 -8.0483 -8.0478 -8.0478 -4.9997 -4.9997 -4.9993 -4.9993 -1.1598 -1.1598 -1.1591 -1.1591 -0.2558 -0.2558 -0.2544 -0.2544 0.5392 0.5392 0.5422 0.5422 0.8379 0.8379 0.8416 0.8416 1.3305 1.3305 1.3332 1.3332 1.5296 1.5296 1.5318 1.5318 1.9712 1.9712 1.9727 1.9727 2.5476 2.5476 2.5499 2.5499 2.8401 2.8401 2.8433 2.8433 3.2632 3.2632 3.2653 3.2653 3.5213 3.5213 3.5234 3.5234 3.8504 3.8504 3.8529 3.8529 4.2735 4.2735 4.2756 4.2756 4.4877 4.4877 4.4891 4.4891 4.7051 4.7051 4.7069 4.7069 10.9631 10.9631 10.9639 10.9639 11.5891 11.5891 11.5903 11.5903 k = 0.1106 0.5396 0.2826 ( 8184 PWs) bands (ev): -13.4658 -13.4658 -13.4658 -13.4658 -9.3007 -9.3007 -9.3004 -9.3004 -8.7585 -8.7585 -8.7582 -8.7582 -8.0520 -8.0520 -8.0515 -8.0515 -5.0004 -5.0004 -5.0000 -5.0000 -1.1573 -1.1573 -1.1565 -1.1565 -0.2666 -0.2666 -0.2650 -0.2650 0.5344 0.5344 0.5372 0.5372 0.8589 0.8589 0.8627 0.8627 1.3086 1.3086 1.3112 1.3112 1.5351 1.5351 1.5372 1.5372 1.9725 1.9725 1.9742 1.9742 2.5559 2.5559 2.5586 2.5586 2.8399 2.8399 2.8433 2.8433 3.2646 3.2646 3.2669 3.2669 3.5293 3.5293 3.5316 3.5316 3.8597 3.8597 3.8625 3.8625 4.2741 4.2741 4.2765 4.2765 4.4800 4.4800 4.4816 4.4816 4.7013 4.7013 4.7032 4.7032 10.9747 10.9747 10.9756 10.9756 11.5908 11.5908 11.5920 11.5920 k = 0.1264 0.5396 0.2826 ( 8180 PWs) bands (ev): -13.4655 -13.4655 -13.4655 -13.4655 -9.2924 -9.2924 -9.2921 -9.2921 -8.7649 -8.7649 -8.7645 -8.7645 -8.0561 -8.0561 -8.0556 -8.0556 -5.0013 -5.0013 -5.0008 -5.0008 -1.1549 -1.1549 -1.1540 -1.1540 -0.2774 -0.2774 -0.2757 -0.2757 0.5280 0.5280 0.5306 0.5306 0.8813 0.8813 0.8849 0.8849 1.2865 1.2865 1.2889 1.2889 1.5407 1.5407 1.5429 1.5429 1.9746 1.9746 1.9763 1.9763 2.5630 2.5630 2.5659 2.5659 2.8411 2.8411 2.8448 2.8448 3.2664 3.2664 3.2689 3.2689 3.5385 3.5385 3.5409 3.5409 3.8694 3.8694 3.8726 3.8726 4.2744 4.2744 4.2770 4.2770 4.4722 4.4722 4.4738 4.4738 4.6969 4.6969 4.6988 4.6988 10.9876 10.9876 10.9885 10.9885 11.5927 11.5927 11.5939 11.5939 k = 0.1422 0.5396 0.2826 ( 8174 PWs) bands (ev): -13.4651 -13.4651 -13.4651 -13.4651 -9.2831 -9.2831 -9.2828 -9.2828 -8.7721 -8.7721 -8.7718 -8.7718 -8.0606 -8.0606 -8.0600 -8.0600 -5.0021 -5.0021 -5.0017 -5.0017 -1.1528 -1.1528 -1.1518 -1.1518 -0.2879 -0.2879 -0.2859 -0.2859 0.5202 0.5202 0.5226 0.5226 0.9035 0.9035 0.9071 0.9071 1.2647 1.2647 1.2671 1.2671 1.5472 1.5472 1.5494 1.5494 1.9775 1.9775 1.9793 1.9793 2.5679 2.5679 2.5710 2.5710 2.8442 2.8442 2.8480 2.8480 3.2686 3.2686 3.2712 3.2712 3.5488 3.5488 3.5514 3.5514 3.8794 3.8794 3.8828 3.8828 4.2741 4.2741 4.2770 4.2770 4.4645 4.4645 4.4661 4.4661 4.6920 4.6920 4.6939 4.6939 11.0015 11.0015 11.0024 11.0024 11.5948 11.5948 11.5960 11.5960 k = 0.1580 0.5396 0.2826 ( 8174 PWs) bands (ev): -13.4648 -13.4648 -13.4648 -13.4648 -9.2729 -9.2729 -9.2726 -9.2726 -8.7802 -8.7802 -8.7798 -8.7798 -8.0653 -8.0653 -8.0647 -8.0647 -5.0030 -5.0030 -5.0025 -5.0025 -1.1510 -1.1510 -1.1500 -1.1500 -0.2977 -0.2977 -0.2955 -0.2955 0.5113 0.5113 0.5135 0.5135 0.9240 0.9240 0.9275 0.9275 1.2442 1.2442 1.2463 1.2463 1.5551 1.5551 1.5575 1.5575 1.9812 1.9812 1.9830 1.9830 2.5700 2.5700 2.5732 2.5732 2.8496 2.8496 2.8536 2.8536 3.2714 3.2714 3.2741 3.2741 3.5602 3.5602 3.5630 3.5630 3.8891 3.8891 3.8927 3.8927 4.2730 4.2730 4.2762 4.2762 4.4575 4.4575 4.4590 4.4590 4.6866 4.6866 4.6886 4.6886 11.0163 11.0163 11.0172 11.0172 11.5971 11.5971 11.5983 11.5983 k = 0.1738 0.5396 0.2826 ( 8174 PWs) bands (ev): -13.4644 -13.4644 -13.4644 -13.4644 -9.2619 -9.2619 -9.2615 -9.2615 -8.7890 -8.7890 -8.7885 -8.7885 -8.0703 -8.0703 -8.0696 -8.0696 -5.0039 -5.0039 -5.0034 -5.0034 -1.1498 -1.1498 -1.1486 -1.1486 -0.3068 -0.3068 -0.3045 -0.3045 0.5015 0.5015 0.5036 0.5036 0.9411 0.9411 0.9446 0.9446 1.2257 1.2257 1.2276 1.2276 1.5655 1.5655 1.5680 1.5680 1.9856 1.9856 1.9875 1.9875 2.5687 2.5687 2.5720 2.5720 2.8575 2.8575 2.8615 2.8615 3.2748 3.2748 3.2776 3.2776 3.5726 3.5726 3.5754 3.5754 3.8980 3.8980 3.9019 3.9019 4.2708 4.2708 4.2743 4.2743 4.4514 4.4514 4.4530 4.4530 4.6809 4.6809 4.6830 4.6830 11.0316 11.0316 11.0326 11.0326 11.5996 11.5996 11.6009 11.6009 k = 0.1896 0.5396 0.2826 ( 8182 PWs) bands (ev): -13.4641 -13.4641 -13.4640 -13.4640 -9.2500 -9.2500 -9.2496 -9.2496 -8.7985 -8.7985 -8.7980 -8.7980 -8.0754 -8.0754 -8.0746 -8.0746 -5.0047 -5.0047 -5.0043 -5.0043 -1.1491 -1.1491 -1.1478 -1.1478 -0.3151 -0.3151 -0.3126 -0.3126 0.4912 0.4912 0.4933 0.4933 0.9531 0.9531 0.9565 0.9565 1.2104 1.2104 1.2120 1.2120 1.5790 1.5790 1.5815 1.5815 1.9907 1.9907 1.9927 1.9927 2.5640 2.5640 2.5674 2.5674 2.8678 2.8678 2.8717 2.8717 3.2789 3.2789 3.2818 3.2818 3.5858 3.5858 3.5887 3.5887 3.9058 3.9058 3.9099 3.9099 4.2675 4.2675 4.2713 4.2713 4.4469 4.4469 4.4485 4.4485 4.6750 4.6750 4.6771 4.6771 11.0475 11.0475 11.0486 11.0486 11.6025 11.6025 11.6038 11.6038 k = 0.2054 0.5396 0.2826 ( 8180 PWs) bands (ev): -13.4637 -13.4637 -13.4637 -13.4637 -9.2374 -9.2374 -9.2370 -9.2370 -8.8086 -8.8086 -8.8081 -8.8081 -8.0806 -8.0806 -8.0798 -8.0798 -5.0055 -5.0055 -5.0051 -5.0051 -1.1490 -1.1490 -1.1477 -1.1477 -0.3227 -0.3227 -0.3200 -0.3200 0.4805 0.4805 0.4826 0.4826 0.9587 0.9587 0.9620 0.9620 1.1988 1.1988 1.2002 1.2002 1.5963 1.5963 1.5989 1.5989 1.9964 1.9964 1.9985 1.9985 2.5560 2.5560 2.5596 2.5596 2.8801 2.8801 2.8839 2.8839 3.2838 3.2838 3.2867 3.2867 3.5996 3.5996 3.6026 3.6026 3.9119 3.9119 3.9162 3.9162 4.2629 4.2629 4.2669 4.2669 4.4442 4.4442 4.4460 4.4460 4.6691 4.6691 4.6712 4.6712 11.0637 11.0637 11.0649 11.0649 11.6055 11.6055 11.6069 11.6069 k = 0.2212 0.5396 0.2826 ( 8170 PWs) bands (ev): -13.4633 -13.4633 -13.4633 -13.4633 -9.2243 -9.2243 -9.2238 -9.2238 -8.8192 -8.8192 -8.8186 -8.8186 -8.0857 -8.0857 -8.0849 -8.0849 -5.0063 -5.0063 -5.0059 -5.0059 -1.1495 -1.1495 -1.1481 -1.1481 -0.3298 -0.3298 -0.3269 -0.3269 0.4696 0.4696 0.4719 0.4719 0.9576 0.9576 0.9608 0.9608 1.1910 1.1910 1.1925 1.1925 1.6178 1.6178 1.6204 1.6204 2.0027 2.0027 2.0048 2.0048 2.5453 2.5453 2.5489 2.5489 2.8936 2.8936 2.8973 2.8973 3.2895 3.2895 3.2924 3.2924 3.6138 3.6138 3.6170 3.6170 3.9160 3.9160 3.9203 3.9203 4.2571 4.2571 4.2614 4.2614 4.4437 4.4437 4.4455 4.4455 4.6633 4.6633 4.6655 4.6655 11.0802 11.0802 11.0814 11.0814 11.6089 11.6089 11.6102 11.6102 k = 0.2370 0.5396 0.2826 ( 8178 PWs) bands (ev): -13.4629 -13.4629 -13.4629 -13.4629 -9.2108 -9.2108 -9.2103 -9.2103 -8.8301 -8.8301 -8.8295 -8.8295 -8.0909 -8.0909 -8.0900 -8.0900 -5.0070 -5.0070 -5.0066 -5.0066 -1.1506 -1.1506 -1.1491 -1.1491 -0.3365 -0.3365 -0.3334 -0.3334 0.4586 0.4586 0.4611 0.4611 0.9504 0.9504 0.9536 0.9536 1.1866 1.1866 1.1883 1.1883 1.6435 1.6435 1.6461 1.6461 2.0095 2.0095 2.0116 2.0116 2.5322 2.5322 2.5361 2.5361 2.9079 2.9079 2.9115 2.9115 3.2962 3.2962 3.2991 3.2991 3.6283 3.6283 3.6315 3.6315 3.9175 3.9175 3.9219 3.9219 4.2503 4.2503 4.2547 4.2547 4.4454 4.4454 4.4474 4.4474 4.6579 4.6579 4.6601 4.6601 11.0968 11.0968 11.0981 11.0981 11.6124 11.6124 11.6137 11.6137 k = 0.2528 0.5396 0.2826 ( 8178 PWs) bands (ev): -13.4625 -13.4625 -13.4625 -13.4625 -9.1972 -9.1972 -9.1966 -9.1966 -8.8411 -8.8411 -8.8405 -8.8405 -8.0959 -8.0959 -8.0950 -8.0950 -5.0076 -5.0076 -5.0072 -5.0072 -1.1521 -1.1521 -1.1505 -1.1505 -0.3431 -0.3431 -0.3399 -0.3399 0.4474 0.4474 0.4501 0.4501 0.9388 0.9388 0.9419 0.9419 1.1844 1.1844 1.1864 1.1864 1.6731 1.6731 1.6757 1.6757 2.0168 2.0168 2.0189 2.0189 2.5173 2.5173 2.5215 2.5215 2.9222 2.9222 2.9257 2.9257 3.3039 3.3039 3.3067 3.3067 3.6426 3.6426 3.6459 3.6459 3.9163 3.9163 3.9207 3.9207 4.2428 4.2428 4.2474 4.2474 4.4492 4.4492 4.4514 4.4514 4.6529 4.6529 4.6552 4.6552 11.1135 11.1135 11.1149 11.1149 11.6160 11.6160 11.6174 11.6174 k = 0.2686 0.5396 0.2826 ( 8182 PWs) bands (ev): -13.4622 -13.4622 -13.4621 -13.4621 -9.1837 -9.1837 -9.1830 -9.1830 -8.8520 -8.8520 -8.8513 -8.8513 -8.1008 -8.1008 -8.0999 -8.0999 -5.0081 -5.0081 -5.0077 -5.0077 -1.1540 -1.1540 -1.1523 -1.1523 -0.3498 -0.3498 -0.3465 -0.3465 0.4360 0.4360 0.4389 0.4389 0.9246 0.9246 0.9276 0.9276 1.1838 1.1838 1.1861 1.1861 1.7058 1.7058 1.7083 1.7083 2.0247 2.0247 2.0268 2.0268 2.5014 2.5014 2.5059 2.5059 2.9359 2.9359 2.9395 2.9395 3.3126 3.3126 3.3153 3.3153 3.6565 3.6565 3.6598 3.6598 3.9123 3.9123 3.9166 3.9166 4.2351 4.2351 4.2397 4.2397 4.4552 4.4552 4.4574 4.4574 4.6487 4.6487 4.6510 4.6510 11.1303 11.1303 11.1317 11.1317 11.6197 11.6197 11.6211 11.6211 k = 0.2844 0.5396 0.2826 ( 8178 PWs) bands (ev): -13.4618 -13.4618 -13.4618 -13.4618 -9.1707 -9.1707 -9.1700 -9.1700 -8.8622 -8.8622 -8.8615 -8.8615 -8.1054 -8.1054 -8.1045 -8.1045 -5.0085 -5.0085 -5.0081 -5.0081 -1.1561 -1.1561 -1.1544 -1.1544 -0.3569 -0.3569 -0.3535 -0.3535 0.4239 0.4239 0.4270 0.4270 0.9093 0.9093 0.9124 0.9124 1.1841 1.1841 1.1866 1.1866 1.7404 1.7404 1.7429 1.7429 2.0334 2.0334 2.0354 2.0354 2.4849 2.4849 2.4898 2.4898 2.9486 2.9486 2.9522 2.9522 3.3221 3.3221 3.3247 3.3247 3.6695 3.6695 3.6727 3.6727 3.9057 3.9057 3.9098 3.9098 4.2276 4.2276 4.2321 4.2321 4.4628 4.4628 4.4651 4.4651 4.6453 4.6453 4.6477 4.6477 11.1471 11.1471 11.1486 11.1486 11.6234 11.6234 11.6247 11.6247 k = 0.3002 0.5396 0.2826 ( 8182 PWs) bands (ev): -13.4615 -13.4615 -13.4615 -13.4615 -9.1589 -9.1589 -9.1582 -9.1582 -8.8712 -8.8712 -8.8704 -8.8704 -8.1099 -8.1099 -8.1089 -8.1089 -5.0087 -5.0087 -5.0083 -5.0083 -1.1583 -1.1583 -1.1566 -1.1566 -0.3646 -0.3646 -0.3612 -0.3612 0.4109 0.4109 0.4141 0.4141 0.8944 0.8944 0.8974 0.8974 1.1853 1.1853 1.1879 1.1879 1.7755 1.7755 1.7780 1.7780 2.0433 2.0433 2.0452 2.0452 2.4685 2.4685 2.4738 2.4738 2.9600 2.9600 2.9637 2.9637 3.3322 3.3322 3.3349 3.3349 3.6810 3.6810 3.6841 3.6841 3.8970 3.8970 3.9007 3.9007 4.2206 4.2206 4.2251 4.2251 4.4719 4.4719 4.4742 4.4742 4.6429 4.6429 4.6454 4.6454 11.1639 11.1639 11.1654 11.1654 11.6269 11.6269 11.6282 11.6282 k = 0.3160 0.5396 0.2826 ( 8192 PWs) bands (ev): -13.4612 -13.4612 -13.4612 -13.4612 -9.1489 -9.1489 -9.1481 -9.1481 -8.8783 -8.8783 -8.8775 -8.8775 -8.1140 -8.1140 -8.1131 -8.1131 -5.0088 -5.0088 -5.0084 -5.0084 -1.1606 -1.1606 -1.1589 -1.1589 -0.3730 -0.3730 -0.3695 -0.3695 0.3964 0.3964 0.3997 0.3997 0.8808 0.8808 0.8837 0.8837 1.1875 1.1875 1.1903 1.1903 1.8094 1.8094 1.8121 1.8121 2.0549 2.0549 2.0566 2.0566 2.4529 2.4529 2.4586 2.4586 2.9698 2.9698 2.9735 2.9735 3.3428 3.3428 3.3455 3.3455 3.6901 3.6901 3.6932 3.6932 3.8869 3.8869 3.8903 3.8903 4.2145 4.2145 4.2189 4.2189 4.4820 4.4820 4.4844 4.4844 4.6417 4.6417 4.6443 4.6443 11.1806 11.1806 11.1821 11.1821 11.6304 11.6304 11.6316 11.6316 k = 0.3318 0.5396 0.2826 ( 8196 PWs) bands (ev): -13.4610 -13.4610 -13.4610 -13.4610 -9.1414 -9.1414 -9.1406 -9.1406 -8.8827 -8.8827 -8.8819 -8.8819 -8.1179 -8.1179 -8.1170 -8.1170 -5.0087 -5.0087 -5.0083 -5.0083 -1.1627 -1.1627 -1.1610 -1.1610 -0.3822 -0.3822 -0.3787 -0.3787 0.3801 0.3801 0.3834 0.3834 0.8692 0.8692 0.8719 0.8719 1.1911 1.1911 1.1940 1.1940 1.8401 1.8401 1.8431 1.8431 2.0690 2.0690 2.0705 2.0705 2.4387 2.4387 2.4448 2.4448 2.9778 2.9778 2.9817 2.9817 3.3533 3.3533 3.3561 3.3561 3.6960 3.6960 3.6989 3.6989 3.8768 3.8768 3.8798 3.8798 4.2096 4.2096 4.2138 4.2138 4.4927 4.4927 4.4951 4.4951 4.6419 4.6419 4.6446 4.6446 11.1969 11.1969 11.1985 11.1985 11.6336 11.6336 11.6348 11.6348 k = 0.3476 0.5396 0.2826 ( 8202 PWs) bands (ev): -13.4608 -13.4608 -13.4608 -13.4608 -9.1374 -9.1374 -9.1366 -9.1366 -8.8836 -8.8836 -8.8828 -8.8828 -8.1215 -8.1215 -8.1206 -8.1206 -5.0085 -5.0085 -5.0081 -5.0081 -1.1646 -1.1646 -1.1629 -1.1629 -0.3921 -0.3921 -0.3886 -0.3886 0.3616 0.3616 0.3649 0.3649 0.8599 0.8599 0.8625 0.8625 1.1965 1.1965 1.1995 1.1995 1.8656 1.8656 1.8690 1.8690 2.0862 2.0862 2.0877 2.0877 2.4269 2.4269 2.4334 2.4334 2.9841 2.9841 2.9880 2.9880 3.3633 3.3633 3.3662 3.3662 3.6976 3.6976 3.7004 3.7004 3.8680 3.8680 3.8707 3.8707 4.2061 4.2061 4.2102 4.2102 4.5036 4.5036 4.5059 4.5059 4.6437 4.6437 4.6465 4.6465 11.2129 11.2129 11.2145 11.2145 11.6366 11.6366 11.6378 11.6378 k = 0.3634 0.5396 0.2826 ( 8190 PWs) bands (ev): -13.4607 -13.4607 -13.4606 -13.4606 -9.1373 -9.1373 -9.1365 -9.1365 -8.8803 -8.8803 -8.8795 -8.8795 -8.1248 -8.1248 -8.1239 -8.1239 -5.0081 -5.0081 -5.0076 -5.0076 -1.1663 -1.1663 -1.1645 -1.1645 -0.4027 -0.4027 -0.3992 -0.3992 0.3406 0.3406 0.3439 0.3439 0.8529 0.8529 0.8553 0.8553 1.2041 1.2041 1.2072 1.2072 1.8845 1.8845 1.8884 1.8884 2.1064 2.1064 2.1080 2.1080 2.4185 2.4185 2.4251 2.4251 2.9886 2.9886 2.9926 2.9926 3.3722 3.3722 3.3753 3.3753 3.6940 3.6940 3.6968 3.6968 3.8619 3.8619 3.8644 3.8644 4.2042 4.2042 4.2081 4.2081 4.5141 4.5141 4.5164 4.5164 4.6472 4.6472 4.6502 4.6502 11.2281 11.2281 11.2297 11.2297 11.6396 11.6396 11.6406 11.6406 k = 0.3634 0.5396 0.2826 ( 8190 PWs) bands (ev): -13.4607 -13.4607 -13.4606 -13.4606 -9.1373 -9.1373 -9.1365 -9.1365 -8.8803 -8.8803 -8.8795 -8.8795 -8.1248 -8.1248 -8.1239 -8.1239 -5.0081 -5.0081 -5.0076 -5.0076 -1.1663 -1.1663 -1.1645 -1.1645 -0.4027 -0.4027 -0.3992 -0.3992 0.3406 0.3406 0.3439 0.3439 0.8529 0.8529 0.8553 0.8553 1.2041 1.2041 1.2072 1.2072 1.8845 1.8845 1.8884 1.8884 2.1064 2.1064 2.1080 2.1080 2.4185 2.4185 2.4251 2.4251 2.9886 2.9886 2.9926 2.9926 3.3722 3.3722 3.3753 3.3753 3.6940 3.6940 3.6968 3.6968 3.8619 3.8619 3.8644 3.8644 4.2042 4.2042 4.2081 4.2081 4.5141 4.5141 4.5164 4.5164 4.6472 4.6472 4.6502 4.6502 11.2281 11.2281 11.2297 11.2297 11.6396 11.6396 11.6406 11.6406 k = 0.3543 0.5261 0.2826 ( 8214 PWs) bands (ev): -13.4609 -13.4609 -13.4609 -13.4609 -9.1352 -9.1352 -9.1344 -9.1344 -8.8885 -8.8885 -8.8877 -8.8877 -8.1190 -8.1190 -8.1181 -8.1181 -5.0090 -5.0090 -5.0086 -5.0086 -1.1633 -1.1633 -1.1616 -1.1616 -0.3821 -0.3821 -0.3785 -0.3785 0.3789 0.3789 0.3823 0.3823 0.8650 0.8650 0.8677 0.8677 1.1888 1.1888 1.1918 1.1918 1.8539 1.8539 1.8570 1.8570 2.0690 2.0690 2.0707 2.0707 2.4311 2.4311 2.4376 2.4376 2.9808 2.9808 2.9846 2.9846 3.3548 3.3548 3.3575 3.3575 3.7052 3.7052 3.7080 3.7080 3.8714 3.8714 3.8740 3.8740 4.2060 4.2060 4.2101 4.2101 4.4946 4.4946 4.4969 4.4969 4.6408 4.6408 4.6436 4.6436 11.2004 11.2004 11.2020 11.2020 11.6341 11.6341 11.6352 11.6352 k = 0.3452 0.5126 0.2826 ( 8202 PWs) bands (ev): -13.4612 -13.4612 -13.4612 -13.4612 -9.1370 -9.1370 -9.1361 -9.1361 -8.8926 -8.8926 -8.8917 -8.8917 -8.1132 -8.1132 -8.1122 -8.1122 -5.0098 -5.0098 -5.0094 -5.0094 -1.1600 -1.1600 -1.1582 -1.1582 -0.3605 -0.3605 -0.3569 -0.3569 0.4115 0.4115 0.4149 0.4149 0.8794 0.8794 0.8825 0.8825 1.1758 1.1758 1.1786 1.1786 1.8201 1.8201 1.8226 1.8226 2.0363 2.0363 2.0386 2.0386 2.4453 2.4453 2.4515 2.4515 2.9708 2.9708 2.9744 2.9744 3.3332 3.3332 3.3356 3.3356 3.7145 3.7145 3.7175 3.7175 3.8834 3.8834 3.8861 3.8861 4.2070 4.2070 4.2114 4.2114 4.4755 4.4755 4.4778 4.4778 4.6371 4.6371 4.6396 4.6396 11.1717 11.1717 11.1733 11.1733 11.6282 11.6282 11.6294 11.6294 k = 0.3361 0.4991 0.2826 ( 8188 PWs) bands (ev): -13.4615 -13.4615 -13.4615 -13.4615 -9.1431 -9.1431 -9.1422 -9.1422 -8.8918 -8.8918 -8.8909 -8.8909 -8.1073 -8.1073 -8.1063 -8.1063 -5.0104 -5.0104 -5.0100 -5.0100 -1.1563 -1.1563 -1.1546 -1.1546 -0.3382 -0.3382 -0.3346 -0.3346 0.4375 0.4375 0.4409 0.4409 0.8951 0.8951 0.8985 0.8985 1.1654 1.1654 1.1679 1.1679 1.7851 1.7851 1.7872 1.7872 2.0085 2.0085 2.0117 2.0117 2.4603 2.4603 2.4663 2.4663 2.9588 2.9588 2.9622 2.9622 3.3085 3.3085 3.3106 3.3106 3.7207 3.7207 3.7241 3.7241 3.8981 3.8981 3.9010 3.9010 4.2071 4.2071 4.2116 4.2116 4.4586 4.4586 4.4610 4.4610 4.6348 4.6348 4.6372 4.6372 11.1423 11.1423 11.1438 11.1438 11.6215 11.6215 11.6228 11.6228 k = 0.3270 0.4856 0.2826 ( 8194 PWs) bands (ev): -13.4619 -13.4619 -13.4619 -13.4619 -9.1535 -9.1535 -9.1527 -9.1527 -8.8860 -8.8860 -8.8852 -8.8852 -8.1015 -8.1015 -8.1005 -8.1005 -5.0109 -5.0109 -5.0104 -5.0104 -1.1524 -1.1524 -1.1507 -1.1507 -0.3154 -0.3154 -0.3118 -0.3118 0.4569 0.4569 0.4602 0.4602 0.9102 0.9102 0.9138 0.9138 1.1577 1.1577 1.1600 1.1600 1.7516 1.7516 1.7537 1.7537 1.9853 1.9853 1.9894 1.9894 2.4757 2.4757 2.4814 2.4814 2.9453 2.9453 2.9484 2.9484 3.2814 3.2814 3.2831 3.2831 3.7232 3.7232 3.7269 3.7269 3.9154 3.9154 3.9184 3.9184 4.2058 4.2058 4.2104 4.2104 4.4451 4.4451 4.4476 4.4476 4.6334 4.6334 4.6357 4.6357 11.1123 11.1123 11.1137 11.1137 11.6139 11.6139 11.6152 11.6152 k = 0.3180 0.4721 0.2826 ( 8196 PWs) bands (ev): -13.4623 -13.4623 -13.4623 -13.4623 -9.1679 -9.1679 -9.1671 -9.1671 -8.8758 -8.8758 -8.8749 -8.8749 -8.0956 -8.0956 -8.0947 -8.0947 -5.0111 -5.0111 -5.0107 -5.0107 -1.1485 -1.1485 -1.1469 -1.1469 -0.2924 -0.2924 -0.2888 -0.2888 0.4702 0.4702 0.4732 0.4732 0.9221 0.9221 0.9259 0.9259 1.1523 1.1523 1.1545 1.1545 1.7228 1.7228 1.7250 1.7250 1.9666 1.9666 1.9713 1.9713 2.4910 2.4910 2.4965 2.4965 2.9305 2.9305 2.9335 2.9335 3.2524 3.2524 3.2539 3.2539 3.7222 3.7222 3.7260 3.7260 3.9347 3.9347 3.9377 3.9377 4.2030 4.2030 4.2075 4.2075 4.4357 4.4357 4.4383 4.4383 4.6327 4.6327 4.6350 4.6350 11.0820 11.0820 11.0833 11.0833 11.6048 11.6048 11.6062 11.6062 k = 0.3089 0.4587 0.2826 ( 8192 PWs) bands (ev): -13.4628 -13.4628 -13.4627 -13.4627 -9.1854 -9.1854 -9.1847 -9.1847 -8.8617 -8.8617 -8.8608 -8.8608 -8.0899 -8.0899 -8.0890 -8.0890 -5.0110 -5.0110 -5.0106 -5.0106 -1.1447 -1.1447 -1.1431 -1.1431 -0.2694 -0.2694 -0.2658 -0.2658 0.4780 0.4780 0.4808 0.4808 0.9286 0.9286 0.9325 0.9325 1.1481 1.1481 1.1502 1.1502 1.7022 1.7022 1.7044 1.7044 1.9521 1.9521 1.9572 1.9572 2.5057 2.5057 2.5110 2.5110 2.9152 2.9152 2.9179 2.9179 3.2220 3.2220 3.2232 3.2232 3.7181 3.7181 3.7220 3.7220 3.9550 3.9550 3.9580 3.9580 4.1991 4.1991 4.2034 4.2034 4.4301 4.4301 4.4328 4.4328 4.6327 4.6327 4.6350 4.6350 11.0515 11.0515 11.0527 11.0527 11.5939 11.5939 11.5953 11.5953 k = 0.2998 0.4452 0.2826 ( 8196 PWs) bands (ev): -13.4633 -13.4633 -13.4632 -13.4632 -9.2053 -9.2053 -9.2046 -9.2046 -8.8445 -8.8445 -8.8437 -8.8437 -8.0842 -8.0842 -8.0833 -8.0833 -5.0106 -5.0106 -5.0102 -5.0102 -1.1412 -1.1412 -1.1397 -1.1397 -0.2467 -0.2467 -0.2431 -0.2431 0.4813 0.4813 0.4839 0.4839 0.9284 0.9284 0.9322 0.9322 1.1424 1.1424 1.1447 1.1447 1.6928 1.6928 1.6950 1.6950 1.9418 1.9418 1.9470 1.9470 2.5192 2.5192 2.5242 2.5242 2.8998 2.8998 2.9023 2.9023 3.1904 3.1904 3.1914 3.1914 3.7117 3.7117 3.7156 3.7156 3.9753 3.9753 3.9782 3.9782 4.1947 4.1947 4.1988 4.1988 4.4276 4.4276 4.4304 4.4304 4.6336 4.6336 4.6359 4.6359 11.0208 11.0208 11.0219 11.0219 11.5809 11.5809 11.5822 11.5822 k = 0.2907 0.4317 0.2826 ( 8188 PWs) bands (ev): -13.4638 -13.4638 -13.4638 -13.4638 -9.2269 -9.2269 -9.2263 -9.2263 -8.8248 -8.8248 -8.8240 -8.8240 -8.0787 -8.0787 -8.0778 -8.0778 -5.0099 -5.0099 -5.0094 -5.0094 -1.1381 -1.1381 -1.1366 -1.1366 -0.2246 -0.2246 -0.2209 -0.2209 0.4810 0.4810 0.4832 0.4832 0.9214 0.9214 0.9252 0.9252 1.1326 1.1326 1.1352 1.1352 1.6967 1.6967 1.6987 1.6987 1.9358 1.9358 1.9410 1.9410 2.5309 2.5309 2.5357 2.5357 2.8852 2.8852 2.8875 2.8875 3.1580 3.1580 3.1588 3.1588 3.7038 3.7038 3.7076 3.7076 3.9945 3.9945 3.9973 3.9973 4.1911 4.1911 4.1947 4.1947 4.4272 4.4272 4.4300 4.4300 4.6357 4.6357 4.6379 4.6379 10.9902 10.9902 10.9912 10.9912 11.5652 11.5652 11.5664 11.5664 k = 0.2816 0.4182 0.2826 ( 8172 PWs) bands (ev): -13.4644 -13.4644 -13.4644 -13.4644 -9.2498 -9.2498 -9.2492 -9.2492 -8.8030 -8.8030 -8.8022 -8.8022 -8.0733 -8.0733 -8.0724 -8.0724 -5.0087 -5.0087 -5.0083 -5.0083 -1.1355 -1.1355 -1.1342 -1.1342 -0.2032 -0.2032 -0.1997 -0.1997 0.4776 0.4776 0.4796 0.4796 0.9086 0.9086 0.9123 0.9123 1.1171 1.1171 1.1201 1.1201 1.7133 1.7133 1.7153 1.7153 1.9345 1.9345 1.9394 1.9394 2.5401 2.5401 2.5447 2.5447 2.8721 2.8721 2.8742 2.8742 3.1251 3.1251 3.1257 3.1257 3.6950 3.6950 3.6987 3.6987 4.0112 4.0112 4.0138 4.0138 4.1895 4.1895 4.1926 4.1926 4.4277 4.4277 4.4306 4.4306 4.6392 4.6392 4.6415 4.6415 10.9597 10.9597 10.9606 10.9606 11.5466 11.5466 11.5478 11.5478 k = 0.2725 0.4047 0.2826 ( 8190 PWs) bands (ev): -13.4651 -13.4651 -13.4651 -13.4651 -9.2735 -9.2735 -9.2730 -9.2730 -8.7797 -8.7797 -8.7789 -8.7789 -8.0680 -8.0680 -8.0671 -8.0671 -5.0072 -5.0072 -5.0067 -5.0067 -1.1338 -1.1338 -1.1324 -1.1324 -0.1830 -0.1830 -0.1795 -0.1795 0.4716 0.4716 0.4734 0.4734 0.8910 0.8910 0.8946 0.8946 1.0965 1.0965 1.0999 1.0999 1.7397 1.7397 1.7421 1.7421 1.9389 1.9389 1.9433 1.9433 2.5463 2.5463 2.5506 2.5506 2.8613 2.8613 2.8633 2.8633 3.0920 3.0920 3.0927 3.0927 3.6860 3.6860 3.6895 3.6895 4.0242 4.0242 4.0267 4.0267 4.1914 4.1914 4.1939 4.1939 4.4281 4.4281 4.4310 4.4310 4.6444 4.6444 4.6467 4.6467 10.9292 10.9292 10.9301 10.9301 11.5249 11.5249 11.5261 11.5261 k = 0.2634 0.3912 0.2826 ( 8194 PWs) bands (ev): -13.4658 -13.4658 -13.4658 -13.4658 -9.2977 -9.2977 -9.2972 -9.2972 -8.7550 -8.7550 -8.7542 -8.7542 -8.0629 -8.0629 -8.0620 -8.0620 -5.0052 -5.0052 -5.0047 -5.0047 -1.1329 -1.1329 -1.1316 -1.1316 -0.1643 -0.1643 -0.1609 -0.1609 0.4633 0.4633 0.4648 0.4648 0.8698 0.8698 0.8734 0.8734 1.0722 1.0722 1.0759 1.0759 1.7712 1.7712 1.7743 1.7743 1.9509 1.9509 1.9543 1.9543 2.5490 2.5490 2.5531 2.5531 2.8534 2.8534 2.8552 2.8552 3.0593 3.0593 3.0602 3.0602 3.6771 3.6771 3.6806 3.6806 4.0324 4.0324 4.0348 4.0348 4.1977 4.1977 4.1995 4.1995 4.4278 4.4278 4.4305 4.4305 4.6515 4.6515 4.6539 4.6539 10.8988 10.8988 10.8997 10.8997 11.5000 11.5000 11.5012 11.5012 k = 0.2544 0.3777 0.2826 ( 8198 PWs) bands (ev): -13.4665 -13.4665 -13.4665 -13.4665 -9.3221 -9.3221 -9.3217 -9.3217 -8.7292 -8.7292 -8.7284 -8.7284 -8.0580 -8.0580 -8.0571 -8.0571 -5.0027 -5.0027 -5.0022 -5.0022 -1.1330 -1.1330 -1.1319 -1.1319 -0.1472 -0.1472 -0.1439 -0.1439 0.4524 0.4524 0.4537 0.4537 0.8463 0.8463 0.8499 0.8499 1.0462 1.0462 1.0500 1.0500 1.8019 1.8019 1.8060 1.8060 1.9730 1.9730 1.9752 1.9752 2.5480 2.5480 2.5518 2.5518 2.8484 2.8484 2.8501 2.8501 3.0277 3.0277 3.0289 3.0289 3.6688 3.6688 3.6722 3.6722 4.0357 4.0357 4.0381 4.0381 4.2086 4.2086 4.2100 4.2100 4.4263 4.4263 4.4289 4.4289 4.6604 4.6604 4.6629 4.6629 10.8684 10.8684 10.8693 10.8693 11.4721 11.4721 11.4732 11.4732 k = 0.2453 0.3642 0.2826 ( 8194 PWs) bands (ev): -13.4673 -13.4673 -13.4673 -13.4673 -9.3466 -9.3466 -9.3462 -9.3462 -8.7025 -8.7025 -8.7017 -8.7017 -8.0533 -8.0533 -8.0523 -8.0523 -4.9998 -4.9998 -4.9993 -4.9993 -1.1344 -1.1344 -1.1333 -1.1333 -0.1322 -0.1322 -0.1291 -0.1291 0.4389 0.4389 0.4399 0.4399 0.8220 0.8220 0.8256 0.8256 1.0200 1.0200 1.0239 1.0239 1.8268 1.8268 1.8319 1.8319 2.0073 2.0073 2.0082 2.0082 2.5435 2.5435 2.5470 2.5470 2.8459 2.8459 2.8475 2.8475 2.9984 2.9984 2.9999 2.9999 3.6613 3.6613 3.6647 3.6647 4.0346 4.0346 4.0372 4.0372 4.2233 4.2233 4.2246 4.2246 4.4236 4.4236 4.4260 4.4260 4.6709 4.6709 4.6735 4.6735 10.8379 10.8379 10.8389 10.8389 11.4413 11.4413 11.4425 11.4425 k = 0.2362 0.3507 0.2826 ( 8206 PWs) bands (ev): -13.4682 -13.4682 -13.4681 -13.4681 -9.3710 -9.3710 -9.3706 -9.3706 -8.6750 -8.6750 -8.6743 -8.6743 -8.0487 -8.0487 -8.0478 -8.0478 -4.9964 -4.9964 -4.9959 -4.9959 -1.1370 -1.1370 -1.1360 -1.1360 -0.1195 -0.1195 -0.1165 -0.1165 0.4223 0.4223 0.4230 0.4230 0.7985 0.7985 0.8021 0.8021 0.9948 0.9948 0.9987 0.9987 1.8444 1.8444 1.8501 1.8501 2.0523 2.0523 2.0526 2.0526 2.5360 2.5360 2.5393 2.5393 2.8444 2.8444 2.8457 2.8457 2.9730 2.9730 2.9749 2.9749 3.6548 3.6548 3.6582 3.6582 4.0303 4.0303 4.0329 4.0329 4.2407 4.2407 4.2422 4.2422 4.4200 4.4200 4.4222 4.4222 4.6828 4.6828 4.6855 4.6855 10.8072 10.8072 10.8082 10.8082 11.4081 11.4081 11.4093 11.4093 k = 0.2271 0.3372 0.2826 ( 8214 PWs) bands (ev): -13.4690 -13.4690 -13.4690 -13.4690 -9.3952 -9.3952 -9.3948 -9.3948 -8.6470 -8.6470 -8.6462 -8.6462 -8.0445 -8.0445 -8.0435 -8.0435 -4.9925 -4.9925 -4.9920 -4.9920 -1.1410 -1.1410 -1.1401 -1.1401 -0.1094 -0.1094 -0.1065 -0.1065 0.4020 0.4020 0.4027 0.4027 0.7773 0.7773 0.7808 0.7808 0.9712 0.9712 0.9751 0.9751 1.8562 1.8562 1.8620 1.8620 2.1040 2.1040 2.1050 2.1050 2.5265 2.5265 2.5296 2.5296 2.8412 2.8412 2.8422 2.8422 2.9543 2.9543 2.9567 2.9567 3.6494 3.6494 3.6528 3.6528 4.0236 4.0236 4.0263 4.0263 4.2597 4.2597 4.2615 4.2615 4.4159 4.4159 4.4179 4.4179 4.6955 4.6955 4.6983 4.6983 10.7761 10.7761 10.7771 10.7771 11.3729 11.3729 11.3743 11.3743 k = 0.2180 0.3238 0.2826 ( 8206 PWs) bands (ev): -13.4700 -13.4700 -13.4699 -13.4699 -9.4190 -9.4190 -9.4186 -9.4186 -8.6185 -8.6185 -8.6178 -8.6178 -8.0404 -8.0404 -8.0395 -8.0395 -4.9882 -4.9882 -4.9877 -4.9877 -1.1465 -1.1465 -1.1456 -1.1456 -0.1020 -0.1020 -0.0992 -0.0992 0.3779 0.3779 0.3789 0.3789 0.7597 0.7597 0.7632 0.7632 0.9496 0.9496 0.9535 0.9535 1.8638 1.8638 1.8694 1.8694 2.1591 2.1591 2.1606 2.1606 2.5158 2.5158 2.5187 2.5187 2.8332 2.8332 2.8343 2.8343 2.9453 2.9453 2.9480 2.9480 3.6452 3.6452 3.6486 3.6486 4.0153 4.0153 4.0180 4.0180 4.2793 4.2793 4.2815 4.2815 4.4122 4.4122 4.4141 4.4141 4.7088 4.7088 4.7118 4.7118 10.7444 10.7444 10.7455 10.7455 11.3365 11.3365 11.3380 11.3380 k = 0.2089 0.3103 0.2826 ( 8214 PWs) bands (ev): -13.4709 -13.4709 -13.4709 -13.4709 -9.4424 -9.4424 -9.4420 -9.4420 -8.5898 -8.5898 -8.5890 -8.5890 -8.0366 -8.0366 -8.0357 -8.0357 -4.9834 -4.9834 -4.9829 -4.9829 -1.1535 -1.1535 -1.1527 -1.1527 -0.0976 -0.0976 -0.0949 -0.0949 0.3502 0.3502 0.3516 0.3516 0.7464 0.7464 0.7498 0.7498 0.9304 0.9304 0.9342 0.9342 1.8683 1.8683 1.8736 1.8736 2.2143 2.2143 2.2164 2.2164 2.5048 2.5048 2.5076 2.5076 2.8200 2.8200 2.8217 2.8217 2.9467 2.9467 2.9495 2.9495 3.6420 3.6420 3.6455 3.6455 4.0058 4.0058 4.0084 4.0084 4.2981 4.2981 4.3006 4.3006 4.4102 4.4102 4.4121 4.4121 4.7223 4.7223 4.7254 4.7254 10.7119 10.7119 10.7130 10.7130 11.2994 11.2994 11.3010 11.3010 k = 0.1999 0.2968 0.2826 ( 8202 PWs) bands (ev): -13.4719 -13.4719 -13.4718 -13.4718 -9.4652 -9.4652 -9.4648 -9.4648 -8.5608 -8.5608 -8.5601 -8.5601 -8.0331 -8.0331 -8.0322 -8.0322 -4.9782 -4.9782 -4.9777 -4.9777 -1.1621 -1.1621 -1.1613 -1.1613 -0.0962 -0.0962 -0.0936 -0.0936 0.3195 0.3195 0.3213 0.3213 0.7374 0.7374 0.7408 0.7408 0.9137 0.9137 0.9176 0.9176 1.8701 1.8701 1.8752 1.8752 2.2670 2.2670 2.2697 2.2697 2.4943 2.4943 2.4970 2.4970 2.8046 2.8046 2.8069 2.8069 2.9563 2.9563 2.9591 2.9591 3.6398 3.6398 3.6435 3.6435 3.9953 3.9953 3.9980 3.9980 4.3142 4.3142 4.3171 4.3171 4.4120 4.4120 4.4139 4.4139 4.7357 4.7357 4.7388 4.7388 10.6784 10.6784 10.6795 10.6795 11.2623 11.2623 11.2639 11.2639 k = 0.1908 0.2833 0.2826 ( 8198 PWs) bands (ev): -13.4728 -13.4728 -13.4728 -13.4728 -9.4874 -9.4874 -9.4870 -9.4870 -8.5318 -8.5318 -8.5310 -8.5310 -8.0298 -8.0298 -8.0289 -8.0289 -4.9726 -4.9726 -4.9721 -4.9721 -1.1723 -1.1723 -1.1715 -1.1715 -0.0979 -0.0979 -0.0953 -0.0953 0.2866 0.2866 0.2888 0.2888 0.7323 0.7323 0.7358 0.7358 0.8999 0.8999 0.9038 0.9038 1.8695 1.8695 1.8743 1.8743 2.3145 2.3145 2.3179 2.3179 2.4848 2.4848 2.4875 2.4875 2.7903 2.7903 2.7933 2.7933 2.9716 2.9716 2.9744 2.9744 3.6385 3.6385 3.6423 3.6423 3.9843 3.9843 3.9869 3.9869 4.3256 4.3256 4.3287 4.3287 4.4198 4.4198 4.4217 4.4217 4.7488 4.7488 4.7520 4.7520 10.6437 10.6437 10.6447 10.6447 11.2257 11.2257 11.2274 11.2274 k = 0.1817 0.2698 0.2826 ( 8178 PWs) bands (ev): -13.4738 -13.4738 -13.4738 -13.4738 -9.5089 -9.5089 -9.5085 -9.5085 -8.5028 -8.5028 -8.5021 -8.5021 -8.0268 -8.0268 -8.0259 -8.0259 -4.9666 -4.9666 -4.9661 -4.9661 -1.1839 -1.1839 -1.1833 -1.1833 -0.1026 -0.1026 -0.0999 -0.0999 0.2524 0.2524 0.2550 0.2550 0.7305 0.7305 0.7340 0.7340 0.8892 0.8892 0.8932 0.8932 1.8668 1.8668 1.8713 1.8713 2.3545 2.3545 2.3585 2.3585 2.4768 2.4768 2.4795 2.4795 2.7799 2.7799 2.7835 2.7835 2.9911 2.9911 2.9938 2.9938 3.6378 3.6378 3.6418 3.6418 3.9728 3.9728 3.9753 3.9753 4.3312 4.3312 4.3345 4.3345 4.4349 4.4349 4.4368 4.4368 4.7613 4.7613 4.7645 4.7645 10.6076 10.6076 10.6086 10.6086 11.1903 11.1903 11.1921 11.1921 k = 0.1726 0.2563 0.2826 ( 8178 PWs) bands (ev): -13.4749 -13.4749 -13.4748 -13.4748 -9.5296 -9.5296 -9.5293 -9.5293 -8.4740 -8.4740 -8.4733 -8.4733 -8.0242 -8.0242 -8.0232 -8.0232 -4.9604 -4.9604 -4.9599 -4.9599 -1.1971 -1.1971 -1.1965 -1.1965 -0.1100 -0.1100 -0.1073 -0.1073 0.2178 0.2178 0.2206 0.2206 0.7311 0.7311 0.7345 0.7345 0.8818 0.8818 0.8859 0.8859 1.8622 1.8622 1.8663 1.8663 2.3846 2.3846 2.3891 2.3891 2.4706 2.4706 2.4734 2.4734 2.7755 2.7755 2.7798 2.7798 3.0139 3.0139 3.0165 3.0165 3.6376 3.6376 3.6417 3.6417 3.9612 3.9612 3.9637 3.9637 4.3323 4.3323 4.3358 4.3358 4.4560 4.4560 4.4579 4.4579 4.7731 4.7731 4.7763 4.7763 10.5702 10.5702 10.5711 10.5711 11.1564 11.1564 11.1583 11.1583 k = 0.1635 0.2428 0.2826 ( 8178 PWs) bands (ev): -13.4759 -13.4759 -13.4758 -13.4758 -9.5496 -9.5496 -9.5493 -9.5493 -8.4455 -8.4455 -8.4447 -8.4447 -8.0218 -8.0218 -8.0208 -8.0208 -4.9539 -4.9539 -4.9534 -4.9534 -1.2116 -1.2116 -1.2110 -1.2110 -0.1200 -0.1200 -0.1172 -0.1172 0.1834 0.1834 0.1864 0.1864 0.7333 0.7333 0.7367 0.7367 0.8779 0.8779 0.8821 0.8821 1.8558 1.8558 1.8596 1.8596 2.4042 2.4042 2.4088 2.4088 2.4659 2.4659 2.4687 2.4687 2.7784 2.7784 2.7832 2.7832 3.0394 3.0394 3.0418 3.0418 3.6377 3.6377 3.6419 3.6419 3.9498 3.9498 3.9524 3.9524 4.3310 4.3310 4.3345 4.3345 4.4812 4.4812 4.4832 4.4832 4.7842 4.7842 4.7874 4.7874 10.5314 10.5314 10.5323 10.5323 11.1245 11.1245 11.1264 11.1264 k = 0.1544 0.2293 0.2826 ( 8186 PWs) bands (ev): -13.4769 -13.4769 -13.4769 -13.4769 -9.5687 -9.5687 -9.5684 -9.5684 -8.4174 -8.4174 -8.4166 -8.4166 -8.0197 -8.0197 -8.0187 -8.0187 -4.9472 -4.9472 -4.9467 -4.9467 -1.2274 -1.2274 -1.2268 -1.2268 -0.1322 -0.1322 -0.1292 -0.1292 0.1498 0.1498 0.1529 0.1529 0.7364 0.7364 0.7396 0.7396 0.8775 0.8775 0.8817 0.8817 1.8481 1.8481 1.8516 1.8516 2.4145 2.4145 2.4187 2.4187 2.4613 2.4613 2.4638 2.4638 2.7884 2.7884 2.7935 2.7935 3.0669 3.0669 3.0691 3.0691 3.6378 3.6378 3.6421 3.6421 3.9392 3.9392 3.9417 3.9417 4.3285 4.3285 4.3322 4.3322 4.5091 4.5091 4.5112 4.5112 4.7945 4.7945 4.7976 4.7976 10.4914 10.4914 10.4923 10.4923 11.0946 11.0946 11.0965 11.0965 k = 0.1453 0.2158 0.2826 ( 8190 PWs) bands (ev): -13.4779 -13.4779 -13.4779 -13.4779 -9.5869 -9.5869 -9.5866 -9.5866 -8.3898 -8.3898 -8.3890 -8.3890 -8.0179 -8.0179 -8.0169 -8.0169 -4.9404 -4.9404 -4.9398 -4.9398 -1.2442 -1.2442 -1.2436 -1.2436 -0.1461 -0.1461 -0.1429 -0.1429 0.1173 0.1173 0.1206 0.1206 0.7399 0.7399 0.7430 0.7430 0.8804 0.8804 0.8845 0.8845 1.8393 1.8393 1.8425 1.8425 2.4188 2.4188 2.4223 2.4223 2.4550 2.4550 2.4573 2.4573 2.8039 2.8039 2.8091 2.8091 3.0956 3.0956 3.0975 3.0975 3.6379 3.6379 3.6421 3.6421 3.9298 3.9298 3.9324 3.9324 4.3255 4.3255 4.3294 4.3294 4.5388 4.5388 4.5410 4.5410 4.8039 4.8039 4.8069 4.8069 10.4506 10.4506 10.4514 10.4514 11.0670 11.0670 11.0689 11.0689 k = 0.1363 0.2023 0.2826 ( 8166 PWs) bands (ev): -13.4789 -13.4789 -13.4788 -13.4788 -9.6042 -9.6042 -9.6039 -9.6039 -8.3628 -8.3628 -8.3621 -8.3621 -8.0165 -8.0165 -8.0155 -8.0155 -4.9334 -4.9334 -4.9329 -4.9329 -1.2619 -1.2619 -1.2613 -1.2613 -0.1613 -0.1613 -0.1580 -0.1580 0.0863 0.0863 0.0896 0.0896 0.7437 0.7437 0.7465 0.7465 0.8862 0.8862 0.8900 0.8900 1.8299 1.8299 1.8329 1.8329 2.4191 2.4191 2.4219 2.4219 2.4469 2.4469 2.4491 2.4491 2.8226 2.8226 2.8278 2.8278 3.1246 3.1246 3.1263 3.1263 3.6377 3.6377 3.6418 3.6418 3.9223 3.9223 3.9249 3.9249 4.3224 4.3224 4.3265 4.3265 4.5695 4.5695 4.5719 4.5719 4.8127 4.8127 4.8155 4.8155 10.4092 10.4092 10.4100 10.4100 11.0416 11.0416 11.0435 11.0435 k = 0.1272 0.1889 0.2826 ( 8160 PWs) bands (ev): -13.4798 -13.4798 -13.4798 -13.4798 -9.6205 -9.6205 -9.6202 -9.6202 -8.3367 -8.3367 -8.3359 -8.3359 -8.0154 -8.0154 -8.0144 -8.0144 -4.9265 -4.9265 -4.9261 -4.9261 -1.2802 -1.2802 -1.2797 -1.2797 -0.1773 -0.1773 -0.1739 -0.1739 0.0568 0.0568 0.0601 0.0601 0.7475 0.7475 0.7501 0.7501 0.8942 0.8942 0.8978 0.8978 1.8202 1.8202 1.8229 1.8229 2.4148 2.4148 2.4176 2.4176 2.4391 2.4391 2.4420 2.4420 2.8426 2.8426 2.8478 2.8478 3.1526 3.1526 3.1541 3.1541 3.6373 3.6373 3.6413 3.6413 3.9171 3.9171 3.9199 3.9199 4.3194 4.3194 4.3237 4.3237 4.6008 4.6008 4.6033 4.6033 4.8208 4.8208 4.8233 4.8233 10.3677 10.3677 10.3685 10.3685 11.0183 11.0183 11.0201 11.0201 k = 0.1181 0.1754 0.2826 ( 8166 PWs) bands (ev): -13.4808 -13.4808 -13.4807 -13.4807 -9.6358 -9.6358 -9.6356 -9.6356 -8.3113 -8.3113 -8.3106 -8.3106 -8.0147 -8.0147 -8.0136 -8.0136 -4.9197 -4.9197 -4.9192 -4.9192 -1.2989 -1.2989 -1.2984 -1.2984 -0.1936 -0.1936 -0.1901 -0.1901 0.0289 0.0289 0.0322 0.0322 0.7516 0.7516 0.7539 0.7539 0.9038 0.9038 0.9072 0.9072 1.8105 1.8105 1.8131 1.8131 2.4044 2.4044 2.4076 2.4076 2.4355 2.4355 2.4390 2.4390 2.8625 2.8625 2.8676 2.8676 3.1786 3.1786 3.1799 3.1799 3.6368 3.6368 3.6405 3.6405 3.9148 3.9148 3.9178 3.9178 4.3164 4.3164 4.3208 4.3208 4.6321 4.6321 4.6348 4.6348 4.8286 4.8286 4.8308 4.8308 10.3266 10.3266 10.3274 10.3274 10.9971 10.9971 10.9988 10.9988 k = 0.1090 0.1619 0.2826 ( 8172 PWs) bands (ev): -13.4816 -13.4816 -13.4816 -13.4816 -9.6501 -9.6501 -9.6499 -9.6499 -8.2870 -8.2870 -8.2862 -8.2862 -8.0144 -8.0144 -8.0132 -8.0132 -4.9130 -4.9130 -4.9126 -4.9126 -1.3176 -1.3176 -1.3172 -1.3172 -0.2099 -0.2099 -0.2063 -0.2063 0.0027 0.0027 0.0060 0.0060 0.7558 0.7558 0.7579 0.7579 0.9143 0.9143 0.9175 0.9175 1.8011 1.8011 1.8035 1.8035 2.3901 2.3901 2.3933 2.3933 2.4357 2.4357 2.4393 2.4393 2.8811 2.8811 2.8861 2.8861 3.2015 3.2015 3.2026 3.2026 3.6362 3.6362 3.6396 3.6396 3.9158 3.9158 3.9190 3.9190 4.3134 4.3134 4.3180 4.3180 4.6625 4.6625 4.6655 4.6655 4.8362 4.8362 4.8380 4.8380 10.2864 10.2864 10.2872 10.2872 10.9777 10.9777 10.9794 10.9794 k = 0.0999 0.1484 0.2826 ( 8178 PWs) bands (ev): -13.4825 -13.4825 -13.4825 -13.4825 -9.6633 -9.6633 -9.6631 -9.6631 -8.2637 -8.2637 -8.2629 -8.2629 -8.0144 -8.0144 -8.0132 -8.0132 -4.9065 -4.9065 -4.9061 -4.9061 -1.3363 -1.3363 -1.3358 -1.3358 -0.2256 -0.2256 -0.2220 -0.2220 -0.0218 -0.0218 -0.0186 -0.0186 0.7603 0.7603 0.7622 0.7622 0.9253 0.9253 0.9282 0.9282 1.7922 1.7922 1.7945 1.7945 2.3742 2.3742 2.3772 2.3772 2.4381 2.4381 2.4415 2.4415 2.8981 2.8981 2.9030 2.9030 3.2205 3.2205 3.2215 3.2215 3.6359 3.6359 3.6390 3.6390 3.9201 3.9201 3.9235 3.9235 4.3103 4.3103 4.3150 4.3150 4.6914 4.6914 4.6946 4.6946 4.8442 4.8442 4.8456 4.8456 10.2476 10.2476 10.2483 10.2483 10.9601 10.9601 10.9617 10.9617 k = 0.0908 0.1349 0.2826 ( 8174 PWs) bands (ev): -13.4833 -13.4833 -13.4833 -13.4833 -9.6754 -9.6754 -9.6753 -9.6753 -8.2416 -8.2416 -8.2408 -8.2408 -8.0148 -8.0148 -8.0136 -8.0136 -4.9003 -4.9003 -4.8999 -4.8999 -1.3544 -1.3544 -1.3540 -1.3540 -0.2406 -0.2406 -0.2371 -0.2371 -0.0446 -0.0446 -0.0414 -0.0414 0.7650 0.7650 0.7667 0.7667 0.9362 0.9362 0.9388 0.9388 1.7841 1.7841 1.7862 1.7862 2.3578 2.3578 2.3606 2.3606 2.4419 2.4419 2.4452 2.4452 2.9129 2.9129 2.9177 2.9177 3.2353 3.2353 3.2362 3.2362 3.6360 3.6360 3.6388 3.6388 3.9278 3.9278 3.9313 3.9313 4.3072 4.3072 4.3120 4.3120 4.7176 4.7176 4.7212 4.7212 4.8533 4.8533 4.8541 4.8541 10.2105 10.2105 10.2112 10.2112 10.9442 10.9442 10.9456 10.9456 k = 0.0818 0.1214 0.2826 ( 8170 PWs) bands (ev): -13.4840 -13.4840 -13.4840 -13.4840 -9.6865 -9.6865 -9.6863 -9.6863 -8.2209 -8.2209 -8.2200 -8.2200 -8.0155 -8.0155 -8.0144 -8.0144 -4.8945 -4.8945 -4.8941 -4.8941 -1.3718 -1.3718 -1.3714 -1.3714 -0.2546 -0.2546 -0.2511 -0.2511 -0.0655 -0.0655 -0.0624 -0.0624 0.7698 0.7698 0.7714 0.7714 0.9467 0.9467 0.9490 0.9490 1.7768 1.7768 1.7787 1.7787 2.3417 2.3417 2.3443 2.3443 2.4468 2.4468 2.4499 2.4499 2.9254 2.9254 2.9301 2.9301 3.2458 3.2458 3.2468 3.2468 3.6366 3.6366 3.6391 3.6391 3.9383 3.9383 3.9419 3.9419 4.3039 4.3039 4.3087 4.3087 4.7401 4.7401 4.7441 4.7441 4.8639 4.8639 4.8644 4.8644 10.1757 10.1757 10.1763 10.1763 10.9299 10.9299 10.9312 10.9312 k = 0.0727 0.1079 0.2826 ( 8164 PWs) bands (ev): -13.4847 -13.4847 -13.4847 -13.4847 -9.6964 -9.6964 -9.6963 -9.6963 -8.2015 -8.2015 -8.2006 -8.2006 -8.0167 -8.0167 -8.0156 -8.0156 -4.8891 -4.8891 -4.8887 -4.8887 -1.3882 -1.3882 -1.3878 -1.3878 -0.2674 -0.2674 -0.2640 -0.2640 -0.0846 -0.0846 -0.0816 -0.0816 0.7747 0.7747 0.7761 0.7761 0.9565 0.9565 0.9585 0.9585 1.7704 1.7704 1.7722 1.7722 2.3263 2.3263 2.3287 2.3287 2.4526 2.4526 2.4555 2.4555 2.9354 2.9354 2.9399 2.9399 3.2527 3.2527 3.2538 3.2538 3.6377 3.6377 3.6400 3.6400 3.9512 3.9512 3.9548 3.9548 4.3004 4.3004 4.3052 4.3052 4.7581 4.7581 4.7623 4.7623 4.8764 4.8764 4.8771 4.8771 10.1435 10.1435 10.1441 10.1441 10.9171 10.9171 10.9182 10.9182 k = 0.0636 0.0944 0.2826 ( 8180 PWs) bands (ev): -13.4853 -13.4853 -13.4853 -13.4853 -9.7052 -9.7052 -9.7051 -9.7051 -8.1836 -8.1836 -8.1827 -8.1827 -8.0183 -8.0183 -8.0171 -8.0171 -4.8841 -4.8841 -4.8838 -4.8838 -1.4033 -1.4033 -1.4029 -1.4029 -0.2788 -0.2788 -0.2756 -0.2756 -0.1017 -0.1017 -0.0989 -0.0989 0.7794 0.7794 0.7807 0.7807 0.9653 0.9653 0.9672 0.9672 1.7649 1.7649 1.7665 1.7665 2.3120 2.3120 2.3142 2.3142 2.4591 2.4591 2.4618 2.4618 2.9429 2.9429 2.9472 2.9472 3.2565 3.2565 3.2577 3.2577 3.6391 3.6391 3.6412 3.6412 3.9657 3.9657 3.9691 3.9691 4.2969 4.2969 4.3015 4.3015 4.7715 4.7715 4.7757 4.7757 4.8910 4.8910 4.8920 4.8920 10.1142 10.1142 10.1148 10.1148 10.9058 10.9058 10.9068 10.9068 k = 0.0545 0.0809 0.2826 ( 8184 PWs) bands (ev): -13.4859 -13.4859 -13.4859 -13.4859 -9.7129 -9.7129 -9.7128 -9.7128 -8.1673 -8.1673 -8.1665 -8.1665 -8.0202 -8.0202 -8.0191 -8.0191 -4.8797 -4.8797 -4.8795 -4.8795 -1.4169 -1.4169 -1.4166 -1.4166 -0.2887 -0.2887 -0.2859 -0.2859 -0.1167 -0.1167 -0.1142 -0.1142 0.7839 0.7839 0.7850 0.7850 0.9732 0.9732 0.9748 0.9748 1.7603 1.7603 1.7617 1.7617 2.2991 2.2991 2.3010 2.3010 2.4660 2.4660 2.4684 2.4684 2.9481 2.9481 2.9521 2.9521 3.2583 3.2583 3.2595 3.2595 3.6407 3.6407 3.6425 3.6425 3.9810 3.9810 3.9842 3.9842 4.2932 4.2932 4.2976 4.2976 4.7808 4.7808 4.7847 4.7847 4.9069 4.9069 4.9078 4.9078 10.0883 10.0883 10.0888 10.0888 10.8959 10.8959 10.8968 10.8968 k = 0.0454 0.0674 0.2826 ( 8196 PWs) bands (ev): -13.4863 -13.4863 -13.4863 -13.4863 -9.7194 -9.7194 -9.7193 -9.7193 -8.1528 -8.1528 -8.1520 -8.1520 -8.0223 -8.0223 -8.0213 -8.0213 -4.8759 -4.8759 -4.8757 -4.8757 -1.4288 -1.4288 -1.4285 -1.4285 -0.2971 -0.2971 -0.2946 -0.2946 -0.1296 -0.1296 -0.1273 -0.1273 0.7880 0.7880 0.7890 0.7890 0.9799 0.9799 0.9812 0.9812 1.7566 1.7566 1.7578 1.7578 2.2878 2.2878 2.2894 2.2894 2.4729 2.4729 2.4750 2.4750 2.9512 2.9512 2.9548 2.9548 3.2588 3.2588 3.2600 3.2600 3.6423 3.6423 3.6439 3.6439 3.9960 3.9960 3.9989 3.9989 4.2896 4.2896 4.2937 4.2937 4.7870 4.7870 4.7904 4.7904 4.9226 4.9226 4.9234 4.9234 10.0659 10.0659 10.0663 10.0663 10.8876 10.8876 10.8883 10.8883 k = 0.0363 0.0540 0.2826 ( 8188 PWs) bands (ev): -13.4867 -13.4867 -13.4867 -13.4867 -9.7247 -9.7247 -9.7246 -9.7246 -8.1403 -8.1403 -8.1395 -8.1395 -8.0247 -8.0247 -8.0237 -8.0237 -4.8727 -4.8727 -4.8725 -4.8725 -1.4388 -1.4388 -1.4385 -1.4385 -0.3040 -0.3040 -0.3019 -0.3019 -0.1401 -0.1401 -0.1383 -0.1383 0.7916 0.7916 0.7924 0.7924 0.9855 0.9855 0.9865 0.9865 1.7537 1.7537 1.7546 1.7546 2.2783 2.2783 2.2796 2.2796 2.4794 2.4794 2.4813 2.4813 2.9527 2.9527 2.9557 2.9557 3.2586 3.2586 3.2597 3.2597 3.6439 3.6439 3.6452 3.6452 4.0101 4.0101 4.0126 4.0126 4.2863 4.2863 4.2898 4.2898 4.7911 4.7911 4.7939 4.7939 4.9369 4.9369 4.9376 4.9376 10.0472 10.0472 10.0476 10.0476 10.8807 10.8807 10.8813 10.8813 k = 0.0273 0.0405 0.2826 ( 8194 PWs) bands (ev): -13.4870 -13.4870 -13.4870 -13.4870 -9.7288 -9.7288 -9.7288 -9.7288 -8.1299 -8.1299 -8.1292 -8.1292 -8.0269 -8.0269 -8.0262 -8.0262 -4.8702 -4.8702 -4.8700 -4.8700 -1.4467 -1.4467 -1.4465 -1.4465 -0.3093 -0.3093 -0.3076 -0.3076 -0.1484 -0.1484 -0.1470 -0.1470 0.7946 0.7946 0.7952 0.7952 0.9898 0.9898 0.9906 0.9906 1.7515 1.7515 1.7522 1.7522 2.2707 2.2707 2.2717 2.2717 2.4852 2.4852 2.4867 2.4867 2.9531 2.9531 2.9555 2.9555 3.2582 3.2582 3.2591 3.2591 3.6452 3.6452 3.6462 3.6462 4.0222 4.0222 4.0242 4.0242 4.2834 4.2834 4.2862 4.2862 4.7937 4.7937 4.7959 4.7959 4.9490 4.9490 4.9495 4.9495 10.0326 10.0326 10.0328 10.0328 10.8754 10.8754 10.8758 10.8758 k = 0.0182 0.0270 0.2826 ( 8194 PWs) bands (ev): -13.4872 -13.4872 -13.4872 -13.4872 -9.7318 -9.7318 -9.7317 -9.7317 -8.1220 -8.1220 -8.1215 -8.1215 -8.0289 -8.0289 -8.0284 -8.0284 -4.8683 -4.8683 -4.8682 -4.8682 -1.4524 -1.4524 -1.4523 -1.4523 -0.3130 -0.3130 -0.3118 -0.3118 -0.1543 -0.1543 -0.1533 -0.1533 0.7968 0.7968 0.7972 0.7972 0.9930 0.9930 0.9935 0.9935 1.7501 1.7501 1.7505 1.7505 2.2653 2.2653 2.2660 2.2660 2.4898 2.4898 2.4908 2.4908 2.9530 2.9530 2.9546 2.9546 3.2579 3.2579 3.2586 3.2586 3.6462 3.6462 3.6468 3.6468 4.0316 4.0316 4.0330 4.0330 4.2812 4.2812 4.2832 4.2832 4.7954 4.7954 4.7968 4.7968 4.9580 4.9580 4.9584 4.9584 10.0220 10.0220 10.0222 10.0222 10.8716 10.8716 10.8719 10.8719 k = 0.0091 0.0135 0.2826 ( 8198 PWs) bands (ev): -13.4874 -13.4874 -13.4874 -13.4874 -9.7336 -9.7336 -9.7335 -9.7335 -8.1170 -8.1170 -8.1167 -8.1167 -8.0302 -8.0302 -8.0299 -8.0299 -4.8672 -4.8672 -4.8672 -4.8672 -1.4558 -1.4558 -1.4558 -1.4558 -0.3151 -0.3151 -0.3145 -0.3145 -0.1577 -0.1577 -0.1572 -0.1572 0.7982 0.7982 0.7984 0.7984 0.9949 0.9949 0.9952 0.9952 1.7493 1.7493 1.7495 1.7495 2.2621 2.2621 2.2624 2.2624 2.4928 2.4928 2.4933 2.4933 2.9528 2.9528 2.9537 2.9537 3.2578 3.2578 3.2581 3.2581 3.6469 3.6469 3.6472 3.6472 4.0377 4.0377 4.0384 4.0384 4.2800 4.2800 4.2810 4.2810 4.7965 4.7965 4.7972 4.7972 4.9636 4.9636 4.9638 4.9638 10.0156 10.0156 10.0157 10.0157 10.8693 10.8693 10.8695 10.8695 k = 0.0000 0.0000 0.2826 ( 8206 PWs) bands (ev): -13.4874 -13.4874 -13.4874 -13.4874 -9.7341 -9.7341 -9.7341 -9.7341 -8.1152 -8.1152 -8.1152 -8.1152 -8.0306 -8.0306 -8.0306 -8.0306 -4.8668 -4.8668 -4.8668 -4.8668 -1.4570 -1.4570 -1.4570 -1.4570 -0.3156 -0.3156 -0.3156 -0.3156 -0.1587 -0.1587 -0.1587 -0.1587 0.7987 0.7987 0.7987 0.7987 0.9957 0.9957 0.9957 0.9957 1.7491 1.7491 1.7491 1.7491 2.2611 2.2611 2.2611 2.2611 2.4941 2.4941 2.4941 2.4941 2.9530 2.9530 2.9530 2.9530 3.2578 3.2578 3.2578 3.2578 3.6472 3.6472 3.6472 3.6472 4.0400 4.0400 4.0400 4.0400 4.2799 4.2799 4.2799 4.2799 4.7970 4.7970 4.7970 4.7970 4.9656 4.9656 4.9656 4.9656 10.0135 10.0135 10.0135 10.0135 10.8686 10.8686 10.8686 10.8686 k = 0.0000 0.0000 0.2826 ( 8206 PWs) bands (ev): -13.4874 -13.4874 -13.4874 -13.4874 -9.7341 -9.7341 -9.7341 -9.7341 -8.1152 -8.1152 -8.1152 -8.1152 -8.0306 -8.0306 -8.0306 -8.0306 -4.8668 -4.8668 -4.8668 -4.8668 -1.4570 -1.4570 -1.4570 -1.4570 -0.3156 -0.3156 -0.3156 -0.3156 -0.1587 -0.1587 -0.1587 -0.1587 0.7987 0.7987 0.7987 0.7987 0.9957 0.9957 0.9957 0.9957 1.7491 1.7491 1.7491 1.7491 2.2611 2.2611 2.2611 2.2611 2.4941 2.4941 2.4941 2.4941 2.9530 2.9530 2.9530 2.9530 3.2578 3.2578 3.2578 3.2578 3.6472 3.6472 3.6472 3.6472 4.0400 4.0400 4.0400 4.0400 4.2799 4.2799 4.2799 4.2799 4.7970 4.7970 4.7970 4.7970 4.9656 4.9656 4.9656 4.9656 10.0135 10.0135 10.0135 10.0135 10.8686 10.8686 10.8686 10.8686 k = 0.0000 0.0000 0.2669 ( 8188 PWs) bands (ev): -13.4902 -13.4902 -13.4846 -13.4846 -9.7382 -9.7382 -9.7301 -9.7301 -8.1166 -8.1166 -8.1137 -8.1137 -8.0314 -8.0314 -8.0298 -8.0298 -4.8820 -4.8820 -4.8514 -4.8514 -1.4676 -1.4676 -1.4465 -1.4465 -0.3433 -0.3433 -0.2867 -0.2867 -0.2138 -0.2138 -0.1035 -0.1035 0.7923 0.7923 0.8085 0.8085 0.9931 0.9931 0.9965 0.9965 1.7293 1.7293 1.7668 1.7668 2.2412 2.2412 2.2816 2.2816 2.4601 2.4601 2.5295 2.5295 2.9288 2.9288 2.9743 2.9743 3.2352 3.2352 3.2808 3.2808 3.6226 3.6226 3.6669 3.6669 4.0324 4.0324 4.0542 4.0542 4.2626 4.2626 4.2963 4.2963 4.7901 4.7901 4.8037 4.8037 4.9625 4.9625 4.9683 4.9683 9.9540 9.9540 10.0723 10.0723 10.8516 10.8516 10.8853 10.8853 k = 0.0000 0.0000 0.2512 ( 8184 PWs) bands (ev): -13.4930 -13.4930 -13.4818 -13.4818 -9.7422 -9.7422 -9.7262 -9.7262 -8.1180 -8.1180 -8.1123 -8.1123 -8.0322 -8.0322 -8.0291 -8.0291 -4.8968 -4.8968 -4.8359 -4.8359 -1.4782 -1.4782 -1.4361 -1.4361 -0.3698 -0.3698 -0.2686 -0.2686 -0.2564 -0.2564 -0.0489 -0.0489 0.7889 0.7889 0.8219 0.8219 0.9892 0.9892 0.9953 0.9953 1.7086 1.7086 1.7813 1.7813 2.2239 2.2239 2.3011 2.3011 2.4282 2.4282 2.5661 2.5661 2.9015 2.9015 2.9925 2.9925 3.2130 3.2130 3.3040 3.3040 3.5957 3.5957 3.6798 3.6798 4.0294 4.0294 4.0760 4.0760 4.2442 4.2442 4.3118 4.3118 4.7829 4.7829 4.8099 4.8099 4.9589 4.9589 4.9705 4.9705 9.8943 9.8943 10.1299 10.1299 10.8349 10.8349 10.9011 10.9011 k = 0.0000 0.0000 0.2355 ( 8186 PWs) bands (ev): -13.4958 -13.4958 -13.4790 -13.4790 -9.7461 -9.7461 -9.7223 -9.7223 -8.1194 -8.1194 -8.1109 -8.1109 -8.0329 -8.0329 -8.0283 -8.0283 -4.9112 -4.9112 -4.8204 -4.8204 -1.4887 -1.4887 -1.4260 -1.4260 -0.3950 -0.3950 -0.3218 -0.3218 -0.2257 -0.2257 0.0047 0.0047 0.7883 0.7883 0.8392 0.8392 0.9841 0.9841 0.9921 0.9921 1.6877 1.6877 1.7908 1.7908 2.2112 2.2112 2.3184 2.3184 2.3985 2.3985 2.6034 2.6034 2.8709 2.8709 3.0074 3.0074 3.1912 3.1912 3.3277 3.3277 3.5693 3.5693 3.6859 3.6859 4.0293 4.0293 4.1050 4.1050 4.2250 4.2250 4.3262 4.3262 4.7757 4.7757 4.8157 4.8157 4.9550 4.9550 4.9723 4.9723 9.8349 9.8349 10.1856 10.1856 10.8191 10.8191 10.9156 10.9156 k = 0.0000 0.0000 0.2198 ( 8198 PWs) bands (ev): -13.4984 -13.4984 -13.4763 -13.4763 -9.7500 -9.7500 -9.7185 -9.7185 -8.1208 -8.1208 -8.1095 -8.1095 -8.0336 -8.0336 -8.0275 -8.0275 -4.9250 -4.9250 -4.8050 -4.8050 -1.4991 -1.4991 -1.4162 -1.4162 -0.4189 -0.4189 -0.3738 -0.3738 -0.1940 -0.1940 0.0565 0.0565 0.7903 0.7903 0.8605 0.8605 0.9781 0.9781 0.9864 0.9864 1.6672 1.6672 1.7939 1.7939 2.2052 2.2052 2.3322 2.3322 2.3713 2.3713 2.6409 2.6409 2.8367 2.8367 3.0186 3.0186 3.1699 3.1699 3.3516 3.3516 3.5463 3.5463 3.6863 3.6863 4.0302 4.0302 4.1398 4.1398 4.2048 4.2048 4.3398 4.3398 4.7686 4.7686 4.8210 4.8210 4.9507 4.9507 4.9737 4.9737 9.7763 9.7763 10.2389 10.2389 10.8048 10.8048 10.9283 10.9283 k = 0.0000 0.0000 0.2041 ( 8190 PWs) bands (ev): -13.5010 -13.5010 -13.4737 -13.4737 -9.7538 -9.7538 -9.7148 -9.7148 -8.1222 -8.1222 -8.1081 -8.1081 -8.0343 -8.0343 -8.0268 -8.0268 -4.9382 -4.9382 -4.7898 -4.7898 -1.5092 -1.5092 -1.4068 -1.4068 -0.4414 -0.4414 -0.4237 -0.4237 -0.1616 -0.1616 0.1060 0.1060 0.7946 0.7946 0.8862 0.8862 0.9715 0.9715 0.9784 0.9784 1.6476 1.6476 1.7896 1.7896 2.2072 2.2072 2.3418 2.3418 2.3471 2.3472 2.6782 2.6782 2.7988 2.7988 3.0256 3.0256 3.1490 3.1490 3.3760 3.3760 3.5286 3.5286 3.6826 3.6826 4.0310 4.0310 4.1782 4.1782 4.1841 4.1841 4.3524 4.3524 4.7618 4.7618 4.8257 4.8257 4.9461 4.9461 4.9747 4.9747 9.7189 9.7189 10.2890 10.2890 10.7926 10.7926 10.9391 10.9391 k = 0.0000 0.0000 0.1884 ( 8190 PWs) bands (ev): -13.5035 -13.5035 -13.4711 -13.4711 -9.7574 -9.7574 -9.7113 -9.7113 -8.1234 -8.1234 -8.1069 -8.1069 -8.0350 -8.0350 -8.0261 -8.0261 -4.9508 -4.9508 -4.7750 -4.7750 -1.5190 -1.5190 -1.3978 -1.3978 -0.4724 -0.4724 -0.4615 -0.4615 -0.1287 -0.1287 0.1525 0.1525 0.8011 0.8011 0.9164 0.9164 0.9644 0.9644 0.9678 0.9679 1.6292 1.6292 1.7780 1.7780 2.2176 2.2176 2.3255 2.3255 2.3468 2.3468 2.7148 2.7148 2.7574 2.7574 3.0278 3.0278 3.1289 3.1289 3.4008 3.4008 3.5177 3.5177 3.6767 3.6767 4.0306 4.0306 4.1616 4.1616 4.2192 4.2192 4.3641 4.3641 4.7555 4.7555 4.8299 4.8299 4.9413 4.9413 4.9753 4.9753 9.6634 9.6634 10.3351 10.3351 10.7833 10.7833 10.9476 10.9476 k = 0.0000 0.0000 0.1727 ( 8182 PWs) bands (ev): -13.5058 -13.5058 -13.4687 -13.4687 -9.7609 -9.7609 -9.7080 -9.7080 -8.1246 -8.1246 -8.1056 -8.1056 -8.0356 -8.0356 -8.0254 -8.0254 -4.9625 -4.9625 -4.7607 -4.7607 -1.5283 -1.5283 -1.3893 -1.3893 -0.5174 -0.5174 -0.4813 -0.4813 -0.0955 -0.0955 0.1955 0.1955 0.8095 0.8095 0.9508 0.9508 0.9548 0.9548 0.9574 0.9574 1.6126 1.6126 1.7601 1.7601 2.2358 2.2358 2.3070 2.3070 2.3461 2.3461 2.7131 2.7131 2.7504 2.7504 3.0249 3.0249 3.1094 3.1094 3.4260 3.4260 3.5142 3.5142 3.6702 3.6702 4.0284 4.0284 4.1387 4.1387 4.2599 4.2599 4.3749 4.3749 4.7500 4.7500 4.8336 4.8336 4.9364 4.9364 4.9756 4.9756 9.6100 9.6100 10.3766 10.3766 10.7775 10.7775 10.9540 10.9540 k = 0.0000 0.0000 0.1570 ( 8186 PWs) bands (ev): -13.5080 -13.5080 -13.4664 -13.4664 -9.7642 -9.7642 -9.7049 -9.7049 -8.1258 -8.1258 -8.1045 -8.1045 -8.0362 -8.0362 -8.0248 -8.0248 -4.9735 -4.9735 -4.7471 -4.7471 -1.5371 -1.5371 -1.3813 -1.3813 -0.5599 -0.5599 -0.4991 -0.4991 -0.0623 -0.0623 0.2347 0.2347 0.8195 0.8195 0.9397 0.9397 0.9499 0.9499 0.9898 0.9898 1.5980 1.5980 1.7374 1.7374 2.2605 2.2605 2.2914 2.2914 2.3392 2.3392 2.6673 2.6673 2.7843 2.7843 3.0166 3.0166 3.0908 3.0908 3.4516 3.4516 3.5182 3.5182 3.6643 3.6643 4.0238 4.0238 4.1151 4.1151 4.2993 4.2993 4.3847 4.3847 4.7456 4.7456 4.8368 4.8368 4.9314 4.9314 4.9756 4.9756 9.5592 9.5592 10.4126 10.4126 10.7757 10.7757 10.9584 10.9584 k = 0.0000 0.0000 0.1413 ( 8188 PWs) bands (ev): -13.5101 -13.5101 -13.4643 -13.4643 -9.7672 -9.7672 -9.7020 -9.7020 -8.1268 -8.1268 -8.1034 -8.1034 -8.0368 -8.0368 -8.0242 -8.0242 -4.9835 -4.9835 -4.7343 -4.7343 -1.5454 -1.5454 -1.3740 -1.3740 -0.5993 -0.5993 -0.5154 -0.5154 -0.0293 -0.0293 0.2698 0.2698 0.8309 0.8309 0.9226 0.9226 0.9429 0.9429 1.0321 1.0321 1.5858 1.5858 1.7116 1.7116 2.2786 2.2786 2.2905 2.2905 2.3251 2.3251 2.6219 2.6219 2.8163 2.8163 3.0027 3.0027 3.0732 3.0732 3.4776 3.4777 3.5291 3.5291 3.6597 3.6597 4.0166 4.0166 4.0907 4.0907 4.3360 4.3360 4.3937 4.3937 4.7424 4.7424 4.8396 4.8396 4.9265 4.9265 4.9754 4.9754 9.5116 9.5116 10.4425 10.4425 10.7782 10.7782 10.9608 10.9608 k = 0.0000 0.0000 0.1256 ( 8183 PWs) bands (ev): -13.5120 -13.5120 -13.4624 -13.4624 -9.7700 -9.7700 -9.6994 -9.6994 -8.1278 -8.1278 -8.1024 -8.1024 -8.0373 -8.0373 -8.0236 -8.0236 -4.9927 -4.9927 -4.7224 -4.7224 -1.5530 -1.5530 -1.3672 -1.3672 -0.6353 -0.6353 -0.5299 -0.5299 0.0029 0.0029 0.3006 0.3006 0.8432 0.8432 0.9040 0.9040 0.9361 0.9361 1.0770 1.0770 1.5767 1.5767 1.6843 1.6843 2.2684 2.2684 2.3025 2.3026 2.3246 2.3246 2.5795 2.5795 2.8459 2.8459 2.9835 2.9835 3.0568 3.0568 3.5040 3.5040 3.5459 3.5459 3.6566 3.6566 4.0066 4.0066 4.0658 4.0658 4.3692 4.3692 4.4018 4.4018 4.7408 4.7408 4.8419 4.8419 4.9218 4.9218 4.9750 4.9750 9.4676 9.4676 10.4663 10.4663 10.7848 10.7848 10.9617 10.9617 k = 0.0000 0.0000 0.1099 ( 8177 PWs) bands (ev): -13.5136 -13.5136 -13.4606 -13.4606 -9.7726 -9.7726 -9.6970 -9.6970 -8.1287 -8.1287 -8.1015 -8.1015 -8.0377 -8.0377 -8.0231 -8.0231 -5.0008 -5.0008 -4.7115 -4.7115 -1.5598 -1.5598 -1.3611 -1.3611 -0.6677 -0.6677 -0.5429 -0.5429 0.0341 0.0341 0.3273 0.3273 0.8560 0.8560 0.8844 0.8844 0.9299 0.9299 1.1233 1.1233 1.5714 1.5714 1.6567 1.6567 2.2604 2.2604 2.2711 2.2711 2.3614 2.3614 2.5425 2.5425 2.8727 2.8727 2.9594 2.9594 3.0417 3.0417 3.5305 3.5305 3.5677 3.5677 3.6552 3.6552 3.9937 3.9937 4.0406 4.0406 4.3973 4.3973 4.4099 4.4099 4.7408 4.7408 4.8439 4.8439 4.9173 4.9173 4.9746 4.9746 9.4276 9.4276 10.4842 10.4842 10.7949 10.7949 10.9614 10.9614 k = 0.0000 0.0000 0.0942 ( 8171 PWs) bands (ev): -13.5151 -13.5151 -13.4590 -13.4590 -9.7748 -9.7748 -9.6949 -9.6949 -8.1294 -8.1294 -8.1007 -8.1007 -8.0381 -8.0381 -8.0227 -8.0227 -5.0080 -5.0080 -4.7018 -4.7018 -1.5659 -1.5659 -1.3557 -1.3557 -0.6963 -0.6963 -0.5541 -0.5541 0.0637 0.0637 0.3500 0.3500 0.8642 0.8642 0.8692 0.8692 0.9243 0.9243 1.1691 1.1691 1.5709 1.5709 1.6300 1.6300 2.2303 2.2303 2.2547 2.2547 2.4005 2.4005 2.5125 2.5125 2.8966 2.8966 2.9310 2.9310 3.0281 3.0281 3.5569 3.5569 3.5931 3.5931 3.6551 3.6551 3.9781 3.9781 4.0153 4.0153 4.4128 4.4128 4.4250 4.4250 4.7424 4.7424 4.8456 4.8456 4.9131 4.9131 4.9740 4.9740 9.3919 9.3919 10.4971 10.4971 10.8072 10.8072 10.9601 10.9601 k = 0.0000 0.0000 0.0785 ( 8185 PWs) bands (ev): -13.5164 -13.5164 -13.4577 -13.4577 -9.7767 -9.7767 -9.6931 -9.6931 -8.1301 -8.1301 -8.1001 -8.1001 -8.0384 -8.0384 -8.0223 -8.0223 -5.0141 -5.0141 -4.6934 -4.6934 -1.5712 -1.5712 -1.3511 -1.3511 -0.7208 -0.7208 -0.5636 -0.5636 0.0909 0.0909 0.3687 0.3687 0.8450 0.8450 0.8815 0.8815 0.9193 0.9193 1.2119 1.2119 1.5764 1.5764 1.6053 1.6053 2.1826 2.1826 2.2504 2.2504 2.4410 2.4410 2.4895 2.4895 2.8991 2.8991 2.9172 2.9172 3.0162 3.0162 3.5828 3.5828 3.6209 3.6209 3.6561 3.6561 3.9601 3.9601 3.9904 3.9904 4.4188 4.4188 4.4439 4.4439 4.7453 4.7453 4.8469 4.8469 4.9094 4.9094 4.9735 4.9735 9.3610 9.3610 10.5061 10.5061 10.8203 10.8203 10.9584 10.9584 k = 0.0000 0.0000 0.0628 ( 8185 PWs) bands (ev): -13.5174 -13.5174 -13.4566 -13.4566 -9.7783 -9.7783 -9.6916 -9.6916 -8.1307 -8.1307 -8.0995 -8.0995 -8.0387 -8.0387 -8.0220 -8.0220 -5.0191 -5.0191 -4.6864 -4.6864 -1.5755 -1.5755 -1.3473 -1.3473 -0.7412 -0.7412 -0.5715 -0.5715 0.1150 0.1150 0.3838 0.3838 0.8271 0.8271 0.8930 0.8930 0.9152 0.9152 1.2492 1.2492 1.5831 1.5831 1.5891 1.5891 2.1309 2.1309 2.2475 2.2475 2.4725 2.4725 2.4820 2.4820 2.8648 2.8648 2.9342 2.9342 3.0062 3.0062 3.6074 3.6074 3.6493 3.6493 3.6582 3.6582 3.9401 3.9401 3.9667 3.9667 4.4232 4.4232 4.4588 4.4588 4.7491 4.7491 4.8480 4.8480 4.9063 4.9063 4.9729 4.9729 9.3353 9.3353 10.5121 10.5121 10.8330 10.8330 10.9565 10.9565 k = 0.0000 0.0000 0.0471 ( 8197 PWs) bands (ev): -13.5183 -13.5183 -13.4557 -13.4557 -9.7796 -9.7796 -9.6905 -9.6905 -8.1311 -8.1311 -8.0991 -8.0991 -8.0389 -8.0389 -8.0217 -8.0217 -5.0230 -5.0230 -4.6808 -4.6808 -1.5790 -1.5790 -1.3442 -1.3442 -0.7572 -0.7572 -0.5776 -0.5776 0.1351 0.1351 0.3953 0.3953 0.8116 0.8116 0.9027 0.9027 0.9120 0.9120 1.2787 1.2787 1.5652 1.5652 1.6080 1.6080 2.0792 2.0792 2.2456 2.2456 2.4603 2.4603 2.5223 2.5223 2.8293 2.8293 2.9476 2.9476 2.9982 2.9982 3.6296 3.6296 3.6586 3.6586 3.6791 3.6791 3.9192 3.9192 3.9451 3.9451 4.4266 4.4266 4.4698 4.4698 4.7530 4.7530 4.8488 4.8488 4.9037 4.9037 4.9725 4.9725 9.3149 9.3149 10.5159 10.5159 10.8440 10.8440 10.9547 10.9547 k = 0.0000 0.0000 0.0314 ( 8201 PWs) bands (ev): -13.5189 -13.5189 -13.4551 -13.4551 -9.7805 -9.7805 -9.6896 -9.6896 -8.1314 -8.1314 -8.0988 -8.0988 -8.0391 -8.0391 -8.0215 -8.0215 -5.0258 -5.0258 -4.6768 -4.6768 -1.5814 -1.5814 -1.3420 -1.3420 -0.7687 -0.7687 -0.5819 -0.5819 0.1503 0.1503 0.4035 0.4035 0.7996 0.7996 0.9086 0.9086 0.9113 0.9113 1.2994 1.2994 1.5516 1.5516 1.6309 1.6309 2.0327 2.0327 2.2445 2.2445 2.4522 2.4522 2.5599 2.5599 2.7951 2.7951 2.9572 2.9572 2.9924 2.9924 3.6479 3.6479 3.6603 3.6603 3.7049 3.7049 3.8991 3.8991 3.9272 3.9272 4.4290 4.4290 4.4772 4.4772 4.7564 4.7564 4.8494 4.8494 4.9018 4.9018 4.9722 4.9722 9.3002 9.3002 10.5183 10.5183 10.8524 10.8524 10.9532 10.9532 k = 0.0000 0.0000 0.0157 ( 8207 PWs) bands (ev): -13.5192 -13.5192 -13.4547 -13.4547 -9.7810 -9.7810 -9.6891 -9.6891 -8.1316 -8.1316 -8.0986 -8.0986 -8.0392 -8.0392 -8.0214 -8.0214 -5.0275 -5.0275 -4.6744 -4.6744 -1.5829 -1.5829 -1.3407 -1.3407 -0.7757 -0.7757 -0.5846 -0.5846 0.1599 0.1599 0.4083 0.4083 0.7919 0.7919 0.9078 0.9078 0.9155 0.9155 1.3112 1.3112 1.5431 1.5431 1.6510 1.6510 1.9987 1.9987 2.2438 2.2438 2.4475 2.4475 2.5899 2.5899 2.7670 2.7670 2.9630 2.9630 2.9889 2.9889 3.6590 3.6590 3.6627 3.6627 3.7244 3.7244 3.8832 3.8832 3.9150 3.9150 4.4304 4.4304 4.4814 4.4814 4.7588 4.7588 4.8497 4.8497 4.9007 4.9007 4.9719 4.9719 9.2913 9.2913 10.5196 10.5196 10.8577 10.8577 10.9523 10.9523 k = 0.0000 0.0000 0.0000 ( 8207 PWs) bands (ev): -13.5193 -13.5193 -13.4546 -13.4546 -9.7812 -9.7812 -9.6890 -9.6890 -8.1316 -8.1316 -8.0985 -8.0985 -8.0392 -8.0392 -8.0214 -8.0214 -5.0281 -5.0281 -4.6735 -4.6735 -1.5834 -1.5834 -1.3403 -1.3403 -0.7780 -0.7780 -0.5854 -0.5854 0.1631 0.1631 0.4099 0.4099 0.7893 0.7893 0.9074 0.9074 0.9171 0.9171 1.3151 1.3151 1.5402 1.5402 1.6593 1.6593 1.9858 1.9858 2.2437 2.2437 2.4459 2.4459 2.6025 2.6025 2.7550 2.7550 2.9649 2.9649 2.9878 2.9878 3.6607 3.6607 3.6658 3.6658 3.7320 3.7320 3.8768 3.8768 3.9107 3.9107 4.4309 4.4309 4.4827 4.4827 4.7596 4.7596 4.8498 4.8498 4.9003 4.9003 4.9719 4.9719 9.2883 9.2883 10.5200 10.5200 10.8595 10.8595 10.9519 10.9519 k = 0.0000 0.0000 0.0000 ( 8207 PWs) bands (ev): -13.5193 -13.5193 -13.4546 -13.4546 -9.7812 -9.7812 -9.6890 -9.6890 -8.1316 -8.1316 -8.0985 -8.0985 -8.0392 -8.0392 -8.0214 -8.0214 -5.0281 -5.0281 -4.6735 -4.6735 -1.5834 -1.5834 -1.3403 -1.3403 -0.7780 -0.7780 -0.5854 -0.5854 0.1631 0.1631 0.4099 0.4099 0.7893 0.7893 0.9074 0.9074 0.9171 0.9171 1.3151 1.3151 1.5402 1.5402 1.6593 1.6593 1.9858 1.9858 2.2437 2.2437 2.4459 2.4459 2.6025 2.6025 2.7550 2.7550 2.9649 2.9649 2.9878 2.9878 3.6607 3.6607 3.6658 3.6658 3.7320 3.7320 3.8768 3.8768 3.9107 3.9107 4.4309 4.4309 4.4827 4.4827 4.7596 4.7596 4.8498 4.8498 4.9003 4.9003 4.9719 4.9719 9.2883 9.2883 10.5200 10.5200 10.8595 10.8595 10.9519 10.9519 k =-0.0135 0.0091 0.0000 ( 8205 PWs) bands (ev): -13.5193 -13.5193 -13.4546 -13.4546 -9.7809 -9.7809 -9.6882 -9.6882 -8.1318 -8.1318 -8.0986 -8.0986 -8.0411 -8.0411 -8.0213 -8.0212 -5.0284 -5.0284 -4.6739 -4.6739 -1.5837 -1.5837 -1.3399 -1.3398 -0.7754 -0.7752 -0.5857 -0.5857 0.1617 0.1619 0.4074 0.4075 0.7891 0.7892 0.9108 0.9109 0.9170 0.9172 1.3143 1.3144 1.5418 1.5426 1.6577 1.6580 1.9835 1.9838 2.2442 2.2442 2.4451 2.4454 2.6048 2.6051 2.7563 2.7565 2.9537 2.9581 2.9948 2.9989 3.6520 3.6556 3.6649 3.6650 3.7387 3.7419 3.8779 3.8784 3.9107 3.9110 4.4303 4.4303 4.4824 4.4826 4.7577 4.7592 4.8474 4.8485 4.8996 4.8996 4.9722 4.9722 9.2916 9.2916 10.5220 10.5220 10.8602 10.8605 10.9536 10.9537 k =-0.0270 0.0182 0.0000 ( 8193 PWs) bands (ev): -13.5191 -13.5191 -13.4545 -13.4545 -9.7798 -9.7798 -9.6860 -9.6860 -8.1323 -8.1322 -8.0989 -8.0988 -8.0463 -8.0462 -8.0214 -8.0213 -5.0292 -5.0292 -4.6748 -4.6748 -1.5844 -1.5844 -1.3386 -1.3384 -0.7673 -0.7670 -0.5864 -0.5864 0.1577 0.1580 0.3999 0.4002 0.7890 0.7892 0.9160 0.9164 0.9218 0.9219 1.3123 1.3125 1.5471 1.5486 1.6534 1.6538 1.9772 1.9778 2.2457 2.2457 2.4432 2.4439 2.6115 2.6121 2.7604 2.7606 2.9380 2.9431 3.0103 3.0148 3.6358 3.6411 3.6634 3.6635 3.7566 3.7608 3.8819 3.8831 3.9111 3.9115 4.4284 4.4285 4.4814 4.4819 4.7533 4.7562 4.8416 4.8438 4.8974 4.8976 4.9732 4.9733 9.3015 9.3016 10.5279 10.5279 10.8626 10.8631 10.9587 10.9590 k =-0.0405 0.0273 0.0000 ( 8189 PWs) bands (ev): -13.5188 -13.5188 -13.4543 -13.4543 -9.7779 -9.7779 -9.6823 -9.6823 -8.1330 -8.1330 -8.0993 -8.0993 -8.0540 -8.0539 -8.0224 -8.0223 -5.0306 -5.0306 -4.6764 -4.6764 -1.5854 -1.5854 -1.3363 -1.3362 -0.7540 -0.7535 -0.5877 -0.5877 0.1512 0.1517 0.3878 0.3883 0.7898 0.7901 0.9155 0.9162 0.9377 0.9379 1.3089 1.3092 1.5548 1.5572 1.6472 1.6478 1.9673 1.9681 2.2482 2.2482 2.4413 2.4423 2.6215 2.6223 2.7670 2.7673 2.9217 2.9271 3.0270 3.0314 3.6188 3.6246 3.6612 3.6613 3.7775 3.7814 3.8893 3.8914 3.9117 3.9125 4.4254 4.4256 4.4800 4.4807 4.7456 4.7501 4.8332 4.8365 4.8941 4.8943 4.9748 4.9748 9.3180 9.3181 10.5376 10.5377 10.8667 10.8674 10.9673 10.9677 k =-0.0541 0.0364 0.0000 ( 8203 PWs) bands (ev): -13.5183 -13.5183 -13.4540 -13.4540 -9.7753 -9.7753 -9.6771 -9.6771 -8.1341 -8.1340 -8.0999 -8.0999 -8.0637 -8.0636 -8.0248 -8.0247 -5.0325 -5.0325 -4.6786 -4.6785 -1.5866 -1.5866 -1.3332 -1.3330 -0.7358 -0.7352 -0.5895 -0.5895 0.1425 0.1432 0.3714 0.3720 0.7923 0.7926 0.9143 0.9153 0.9586 0.9589 1.3044 1.3047 1.5621 1.5654 1.6417 1.6423 1.9546 1.9556 2.2517 2.2517 2.4402 2.4416 2.6335 2.6343 2.7759 2.7761 2.9054 2.9110 3.0439 3.0483 3.6036 3.6096 3.6580 3.6581 3.7974 3.8005 3.9006 3.9042 3.9127 3.9140 4.4211 4.4213 4.4779 4.4789 4.7339 4.7396 4.8236 4.8278 4.8898 4.8901 4.9767 4.9768 9.3408 9.3409 10.5512 10.5513 10.8724 10.8733 10.9794 10.9799 k =-0.0676 0.0455 0.0000 ( 8203 PWs) bands (ev): -13.5177 -13.5177 -13.4538 -13.4537 -9.7718 -9.7718 -9.6706 -9.6705 -8.1354 -8.1354 -8.1007 -8.1007 -8.0753 -8.0751 -8.0288 -8.0287 -5.0349 -5.0349 -4.6814 -4.6813 -1.5878 -1.5877 -1.3291 -1.3288 -0.7131 -0.7123 -0.5919 -0.5918 0.1321 0.1329 0.3512 0.3520 0.7970 0.7974 0.9126 0.9138 0.9834 0.9837 1.2987 1.2990 1.5633 1.5674 1.6420 1.6427 1.9401 1.9413 2.2561 2.2561 2.4407 2.4423 2.6464 2.6472 2.7866 2.7866 2.8894 2.8951 3.0609 3.0651 3.5914 3.5973 3.6539 3.6540 3.8143 3.8162 3.9125 3.9139 3.9200 3.9218 4.4154 4.4156 4.4751 4.4764 4.7170 4.7237 4.8144 4.8191 4.8848 4.8851 4.9788 4.9789 9.3698 9.3699 10.5686 10.5687 10.8795 10.8806 10.9950 10.9956 k =-0.0811 0.0546 0.0000 ( 8203 PWs) bands (ev): -13.5170 -13.5170 -13.4534 -13.4534 -9.7676 -9.7676 -9.6626 -9.6626 -8.1370 -8.1370 -8.1017 -8.1016 -8.0886 -8.0884 -8.0344 -8.0343 -5.0378 -5.0378 -4.6848 -4.6847 -1.5887 -1.5886 -1.3239 -1.3236 -0.6862 -0.6853 -0.5949 -0.5948 0.1201 0.1210 0.3278 0.3287 0.8043 0.8047 0.9101 0.9115 1.0115 1.0118 1.2917 1.2921 1.5536 1.5579 1.6524 1.6536 1.9251 1.9264 2.2613 2.2614 2.4428 2.4448 2.6596 2.6601 2.7983 2.7986 2.8737 2.8795 3.0778 3.0818 3.5829 3.5887 3.6488 3.6490 3.8275 3.8285 3.9155 3.9158 3.9390 3.9432 4.4082 4.4085 4.4716 4.4732 4.6948 4.7019 4.8067 4.8113 4.8793 4.8797 4.9810 4.9811 9.4047 9.4048 10.5895 10.5896 10.8880 10.8894 11.0142 11.0148 k =-0.0946 0.0637 0.0000 ( 8195 PWs) bands (ev): -13.5162 -13.5162 -13.4530 -13.4530 -9.7624 -9.7624 -9.6534 -9.6533 -8.1389 -8.1388 -8.1040 -8.1033 -8.1027 -8.1022 -8.0416 -8.0415 -5.0412 -5.0412 -4.6887 -4.6886 -1.5891 -1.5890 -1.3175 -1.3172 -0.6558 -0.6548 -0.5985 -0.5984 0.1071 0.1081 0.3016 0.3027 0.8142 0.8148 0.9067 0.9082 1.0422 1.0425 1.2835 1.2839 1.5344 1.5387 1.6709 1.6728 1.9112 1.9126 2.2673 2.2675 2.4465 2.4488 2.6726 2.6728 2.8106 2.8113 2.8585 2.8643 3.0945 3.0983 3.5784 3.5840 3.6427 3.6430 3.8375 3.8378 3.9174 3.9181 3.9620 3.9672 4.3995 4.3998 4.4673 4.4692 4.6677 4.6748 4.8005 4.8047 4.8736 4.8740 4.9832 4.9833 9.4452 9.4454 10.6139 10.6140 10.8979 10.8993 11.0368 11.0375 k =-0.1081 0.0728 0.0000 ( 8203 PWs) bands (ev): -13.5153 -13.5153 -13.4525 -13.4525 -9.7564 -9.7564 -9.6428 -9.6428 -8.1409 -8.1409 -8.1200 -8.1197 -8.1040 -8.1039 -8.0506 -8.0505 -5.0450 -5.0450 -4.6931 -4.6930 -1.5887 -1.5886 -1.3100 -1.3096 -0.6225 -0.6212 -0.6028 -0.6027 0.0934 0.0944 0.2734 0.2745 0.8269 0.8275 0.9021 0.9038 1.0753 1.0756 1.2736 1.2741 1.5091 1.5134 1.6932 1.6959 1.9004 1.9017 2.2741 2.2743 2.4515 2.4540 2.6850 2.6852 2.8232 2.8241 2.8442 2.8497 3.1109 3.1145 3.5782 3.5835 3.6356 3.6359 3.8448 3.8450 3.9196 3.9205 3.9863 3.9919 4.3892 4.3895 4.4622 4.4644 4.6367 4.6438 4.7953 4.7990 4.8678 4.8682 4.9853 4.9854 9.4911 9.4913 10.6416 10.6417 10.9088 10.9105 11.0630 11.0638 k =-0.1216 0.0819 0.0000 ( 8205 PWs) bands (ev): -13.5143 -13.5143 -13.4520 -13.4520 -9.7495 -9.7495 -9.6310 -9.6310 -8.1433 -8.1433 -8.1378 -8.1375 -8.1054 -8.1054 -8.0611 -8.0611 -5.0492 -5.0491 -4.6981 -4.6979 -1.5875 -1.5873 -1.3013 -1.3008 -0.6082 -0.6081 -0.5861 -0.5850 0.0793 0.0804 0.2436 0.2448 0.8421 0.8428 0.8963 0.8981 1.1103 1.1105 1.2617 1.2621 1.4801 1.4845 1.7157 1.7191 1.8951 1.8962 2.2815 2.2818 2.4574 2.4602 2.6966 2.6973 2.8281 2.8353 2.8360 2.8391 3.1270 3.1303 3.5822 3.5872 3.6274 3.6277 3.8498 3.8504 3.9221 3.9231 4.0102 4.0161 4.3771 4.3774 4.4562 4.4588 4.6036 4.6105 4.7906 4.7937 4.8620 4.8625 4.9874 4.9875 9.5419 9.5421 10.6723 10.6724 10.9210 10.9227 11.0927 11.0935 k =-0.1351 0.0910 0.0000 ( 8197 PWs) bands (ev): -13.5131 -13.5131 -13.4514 -13.4514 -9.7417 -9.7417 -9.6181 -9.6180 -8.1571 -8.1570 -8.1458 -8.1456 -8.1069 -8.1069 -8.0734 -8.0733 -5.0537 -5.0537 -4.7035 -4.7033 -1.5852 -1.5850 -1.2912 -1.2907 -0.6139 -0.6139 -0.5484 -0.5471 0.0652 0.0664 0.2127 0.2140 0.8599 0.8607 0.8892 0.8910 1.1471 1.1472 1.2469 1.2473 1.4495 1.4540 1.7351 1.7390 1.8982 1.8991 2.2894 2.2898 2.4637 2.4667 2.7076 2.7088 2.8156 2.8222 2.8482 2.8513 3.1426 3.1457 3.5903 3.5949 3.6181 3.6186 3.8527 3.8535 3.9249 3.9260 4.0325 4.0385 4.3632 4.3635 4.4491 4.4520 4.5700 4.5769 4.7861 4.7886 4.8565 4.8570 4.9894 4.9895 9.5974 9.5975 10.7057 10.7058 10.9342 10.9361 11.1258 11.1267 k =-0.1486 0.1001 0.0000 ( 8177 PWs) bands (ev): -13.5119 -13.5119 -13.4508 -13.4508 -9.7329 -9.7329 -9.6039 -9.6039 -8.1777 -8.1775 -8.1485 -8.1484 -8.1086 -8.1086 -8.0872 -8.0871 -5.0585 -5.0585 -4.7093 -4.7091 -1.5816 -1.5814 -1.2797 -1.2791 -0.6206 -0.6206 -0.5093 -0.5079 0.0513 0.0525 0.1814 0.1828 0.8781 0.8808 0.8826 0.8827 1.1853 1.1854 1.2281 1.2284 1.4195 1.4240 1.7487 1.7530 1.9122 1.9130 2.2978 2.2983 2.4699 2.4730 2.7181 2.7199 2.8031 2.8096 2.8604 2.8641 3.1576 3.1605 3.6018 3.6062 3.6080 3.6083 3.8529 3.8539 3.9279 3.9291 4.0521 4.0582 4.3474 4.3478 4.4406 4.4438 4.5384 4.5451 4.7813 4.7834 4.8514 4.8519 4.9912 4.9913 9.6571 9.6573 10.7413 10.7414 10.9486 10.9507 11.1624 11.1633 k =-0.1622 0.1092 0.0000 ( 8177 PWs) bands (ev): -13.5107 -13.5106 -13.4501 -13.4501 -9.7232 -9.7232 -9.5887 -9.5886 -8.1996 -8.1994 -8.1513 -8.1512 -8.1105 -8.1104 -8.1025 -8.1024 -5.0635 -5.0635 -4.7156 -4.7154 -1.5768 -1.5765 -1.2669 -1.2662 -0.6280 -0.6280 -0.4698 -0.4683 0.0379 0.0391 0.1502 0.1517 0.8701 0.8724 0.9029 0.9037 1.2039 1.2041 1.2249 1.2249 1.3921 1.3966 1.7565 1.7609 1.9370 1.9379 2.3064 2.3071 2.4756 2.4788 2.7283 2.7306 2.7914 2.7978 2.8725 2.8768 3.1719 3.1746 3.5962 3.5971 3.6171 3.6207 3.8496 3.8508 3.9311 3.9324 4.0681 4.0742 4.3297 4.3301 4.4302 4.4333 4.5117 4.5178 4.7760 4.7776 4.8466 4.8472 4.9931 4.9932 9.7207 9.7209 10.7787 10.7788 10.9644 10.9666 11.2024 11.2033 k =-0.1757 0.1183 0.0000 ( 8185 PWs) bands (ev): -13.5093 -13.5093 -13.4494 -13.4494 -9.7126 -9.7125 -9.5723 -9.5723 -8.2227 -8.2224 -8.1543 -8.1542 -8.1196 -8.1193 -8.1123 -8.1122 -5.0688 -5.0687 -4.7222 -4.7220 -1.5705 -1.5702 -1.2526 -1.2519 -0.6363 -0.6363 -0.4305 -0.4290 0.0251 0.0263 0.1196 0.1212 0.8587 0.8609 0.9275 0.9284 1.1733 1.1733 1.2656 1.2657 1.3694 1.3737 1.7605 1.7649 1.9701 1.9713 2.3153 2.3161 2.4804 2.4837 2.7384 2.7413 2.7807 2.7870 2.8846 2.8895 3.1852 3.1877 3.5839 3.5850 3.6344 3.6376 3.8418 3.8431 3.9345 3.9358 4.0798 4.0858 4.3101 4.3105 4.4177 4.4200 4.4924 4.4974 4.7699 4.7712 4.8424 4.8430 4.9949 4.9950 9.7878 9.7880 10.8170 10.8170 10.9821 10.9845 11.2457 11.2467 k =-0.1892 0.1274 0.0000 ( 8189 PWs) bands (ev): -13.5079 -13.5079 -13.4487 -13.4487 -9.7010 -9.7009 -9.5550 -9.5549 -8.2468 -8.2466 -8.1574 -8.1573 -8.1378 -8.1376 -8.1143 -8.1142 -5.0741 -5.0741 -4.7292 -4.7290 -1.5628 -1.5624 -1.2370 -1.2363 -0.6453 -0.6453 -0.3925 -0.3909 0.0131 0.0143 0.0904 0.0922 0.8459 0.8481 0.9540 0.9550 1.1360 1.1363 1.3073 1.3074 1.3520 1.3560 1.7632 1.7674 2.0090 2.0104 2.3242 2.3253 2.4839 2.4874 2.7487 2.7520 2.7710 2.7772 2.8967 2.9020 3.1975 3.1997 3.5707 3.5720 3.6533 3.6560 3.8284 3.8300 3.9379 3.9393 4.0872 4.0930 4.2887 4.2891 4.4042 4.4055 4.4810 4.4846 4.7629 4.7638 4.8387 4.8393 4.9967 4.9968 9.8582 9.8583 10.8551 10.8551 11.0025 11.0049 11.2923 11.2932 k =-0.2027 0.1365 0.0000 ( 8173 PWs) bands (ev): -13.5064 -13.5064 -13.4479 -13.4479 -9.6884 -9.6884 -9.5366 -9.5366 -8.2720 -8.2717 -8.1607 -8.1605 -8.1574 -8.1572 -8.1164 -8.1163 -5.0794 -5.0794 -4.7366 -4.7364 -1.5535 -1.5531 -1.2201 -1.2193 -0.6550 -0.6550 -0.3569 -0.3553 0.0019 0.0032 0.0635 0.0653 0.8320 0.8342 0.9823 0.9835 1.0931 1.0937 1.3389 1.3431 1.3504 1.3511 1.7662 1.7703 2.0515 2.0532 2.3331 2.3344 2.4861 2.4896 2.7588 2.7631 2.7632 2.7686 2.9086 2.9144 3.2083 3.2102 3.5569 3.5584 3.6726 3.6747 3.8094 3.8111 3.9415 3.9429 4.0906 4.0960 4.2655 4.2659 4.3920 4.3924 4.4757 4.4781 4.7547 4.7554 4.8355 4.8361 4.9986 4.9987 9.9313 9.9314 10.8914 10.8915 11.0266 11.0292 11.3419 11.3430 k =-0.2162 0.1456 0.0000 ( 8172 PWs) bands (ev): -13.5049 -13.5049 -13.4472 -13.4472 -9.6750 -9.6749 -9.5173 -9.5173 -8.2981 -8.2978 -8.1784 -8.1783 -8.1638 -8.1637 -8.1185 -8.1185 -5.0847 -5.0847 -4.7443 -4.7441 -1.5426 -1.5423 -1.2019 -1.2011 -0.6653 -0.6653 -0.3251 -0.3237 -0.0083 -0.0071 0.0399 0.0418 0.8174 0.8196 1.0121 1.0135 1.0462 1.0470 1.3314 1.3352 1.3937 1.3943 1.7704 1.7744 2.0963 2.0982 2.3419 2.3435 2.4868 2.4903 2.7547 2.7610 2.7712 2.7747 2.9204 2.9265 3.2172 3.2188 3.5426 3.5444 3.6892 3.6906 3.7864 3.7886 3.9450 3.9465 4.0908 4.0958 4.2408 4.2412 4.3827 4.3828 4.4747 4.4761 4.7453 4.7458 4.8328 4.8335 5.0005 5.0006 10.0068 10.0070 10.9246 10.9247 11.0557 11.0584 11.3947 11.3957 k =-0.2297 0.1547 0.0000 ( 8170 PWs) bands (ev): -13.5034 -13.5034 -13.4464 -13.4464 -9.6606 -9.6606 -9.4971 -9.4971 -8.3250 -8.3248 -8.2006 -8.2005 -8.1671 -8.1670 -8.1207 -8.1207 -5.0900 -5.0899 -4.7522 -4.7521 -1.5302 -1.5298 -1.1826 -1.1817 -0.6762 -0.6762 -0.2991 -0.2978 -0.0177 -0.0164 0.0209 0.0230 0.8024 0.8045 0.9965 0.9973 1.0436 1.0449 1.3272 1.3309 1.4381 1.4388 1.7761 1.7801 2.1426 2.1447 2.3505 2.3524 2.4862 2.4897 2.7488 2.7548 2.7829 2.7865 2.9320 2.9382 3.2239 3.2252 3.5280 3.5302 3.6940 3.6942 3.7686 3.7717 3.9485 3.9500 4.0889 4.0934 4.2147 4.2151 4.3768 4.3771 4.4766 4.4774 4.7345 4.7348 4.8306 4.8313 5.0025 5.0026 10.0844 10.0845 10.9536 10.9536 11.0904 11.0932 11.4503 11.4514 k =-0.2432 0.1638 0.0000 ( 8182 PWs) bands (ev): -13.5018 -13.5018 -13.4456 -13.4456 -9.6454 -9.6454 -9.4761 -9.4761 -8.3527 -8.3524 -8.2239 -8.2239 -8.1704 -8.1703 -8.1229 -8.1229 -5.0950 -5.0950 -4.7605 -4.7603 -1.5162 -1.5158 -1.1624 -1.1614 -0.6875 -0.6874 -0.2808 -0.2796 -0.0260 -0.0249 0.0081 0.0104 0.7874 0.7895 0.9451 0.9460 1.0760 1.0775 1.3263 1.3298 1.4832 1.4839 1.7837 1.7875 2.1896 2.1919 2.3589 2.3611 2.4844 2.4879 2.7441 2.7499 2.7948 2.7983 2.9435 2.9496 3.2279 3.2288 3.5137 3.5162 3.6724 3.6726 3.7710 3.7742 3.9519 3.9533 4.0857 4.0898 4.1874 4.1879 4.3744 4.3748 4.4802 4.4807 4.7223 4.7226 4.8289 4.8296 5.0047 5.0048 10.1637 10.1638 10.9786 10.9786 11.1302 11.1329 11.5086 11.5098 k =-0.2568 0.1729 0.0000 ( 8174 PWs) bands (ev): -13.5003 -13.5002 -13.4448 -13.4448 -9.6293 -9.6293 -9.4542 -9.4542 -8.3809 -8.3807 -8.2483 -8.2483 -8.1737 -8.1736 -8.1252 -8.1251 -5.0998 -5.0998 -4.7689 -4.7688 -1.5006 -1.5001 -1.1413 -1.1403 -0.6991 -0.6990 -0.2717 -0.2707 -0.0335 -0.0324 0.0025 0.0050 0.7728 0.7749 0.8929 0.8940 1.1095 1.1111 1.3283 1.3318 1.5288 1.5297 1.7929 1.7966 2.2367 2.2393 2.3670 2.3696 2.4816 2.4852 2.7408 2.7464 2.8063 2.8093 2.9552 2.9609 3.2284 3.2291 3.4998 3.5028 3.6328 3.6329 3.7867 3.7894 3.9550 3.9564 4.0821 4.0858 4.1595 4.1600 4.3747 4.3751 4.4847 4.4850 4.7089 4.7091 4.8275 4.8283 5.0070 5.0071 10.2443 10.2443 11.0008 11.0008 11.1736 11.1763 11.5695 11.5707 k =-0.2703 0.1820 0.0000 ( 8162 PWs) bands (ev): -13.4987 -13.4987 -13.4441 -13.4440 -9.6125 -9.6124 -9.4317 -9.4316 -8.4097 -8.4095 -8.2737 -8.2736 -8.1770 -8.1769 -8.1274 -8.1274 -5.1043 -5.1043 -4.7776 -4.7775 -1.4833 -1.4829 -1.1195 -1.1185 -0.7109 -0.7108 -0.2721 -0.2712 -0.0401 -0.0391 0.0037 0.0064 0.7589 0.7611 0.8410 0.8422 1.1437 1.1454 1.3332 1.3366 1.5749 1.5760 1.8038 1.8074 2.2832 2.2861 2.3748 2.3778 2.4782 2.4819 2.7389 2.7443 2.8162 2.8185 2.9674 2.9725 3.2251 3.2254 3.4868 3.4901 3.5861 3.5862 3.8057 3.8080 3.9578 3.9591 4.0786 4.0819 4.1313 4.1317 4.3770 4.3775 4.4892 4.4894 4.6944 4.6947 4.8265 4.8272 5.0094 5.0095 10.3258 10.3258 11.0212 11.0212 11.2191 11.2218 11.6327 11.6339 k =-0.2838 0.1911 0.0000 ( 8162 PWs) bands (ev): -13.4972 -13.4971 -13.4433 -13.4433 -9.5949 -9.5948 -9.4084 -9.4084 -8.4389 -8.4387 -8.2999 -8.2999 -8.1802 -8.1801 -8.1296 -8.1296 -5.1085 -5.1085 -4.7865 -4.7863 -1.4646 -1.4641 -1.0974 -1.0963 -0.7228 -0.7227 -0.2805 -0.2797 -0.0459 -0.0450 0.0099 0.0126 0.7447 0.7471 0.7913 0.7927 1.1784 1.1802 1.3409 1.3442 1.6214 1.6226 1.8161 1.8195 2.3284 2.3318 2.3825 2.3858 2.4748 2.4788 2.7384 2.7435 2.8230 2.8243 2.9810 2.9852 3.2174 3.2175 3.4747 3.4784 3.5370 3.5371 3.8246 3.8266 3.9602 3.9614 4.0758 4.0787 4.1033 4.1037 4.3806 4.3811 4.4928 4.4931 4.6792 4.6796 4.8258 4.8265 5.0120 5.0121 10.4077 10.4078 11.0409 11.0410 11.2654 11.2682 11.6977 11.6989 k =-0.2973 0.2002 0.0000 ( 8160 PWs) bands (ev): -13.4957 -13.4956 -13.4425 -13.4425 -9.5766 -9.5766 -9.3845 -9.3845 -8.4684 -8.4681 -8.3269 -8.3269 -8.1833 -8.1833 -8.1318 -8.1318 -5.1123 -5.1122 -4.7954 -4.7953 -1.4443 -1.4438 -1.0750 -1.0739 -0.7346 -0.7345 -0.2948 -0.2941 -0.0510 -0.0502 0.0185 0.0212 0.7217 0.7234 0.7542 0.7551 1.2133 1.2153 1.3514 1.3546 1.6681 1.6694 1.8295 1.8328 2.3710 2.3752 2.3901 2.3938 2.4723 2.4769 2.7393 2.7442 2.8249 2.8250 2.9969 2.9998 3.2051 3.2052 3.4635 3.4675 3.4881 3.4882 3.8421 3.8437 3.9620 3.9629 4.0743 4.0763 4.0764 4.0770 4.3849 4.3854 4.4948 4.4953 4.6638 4.6644 4.8252 4.8259 5.0147 5.0148 10.4896 10.4898 11.0605 11.0606 11.3116 11.3145 11.7640 11.7652 k =-0.3108 0.2093 0.0000 ( 8156 PWs) bands (ev): -13.4942 -13.4942 -13.4418 -13.4418 -9.5577 -9.5577 -9.3602 -9.3602 -8.4979 -8.4977 -8.3545 -8.3545 -8.1864 -8.1863 -8.1339 -8.1339 -5.1156 -5.1156 -4.8045 -4.8043 -1.4226 -1.4221 -1.0527 -1.0516 -0.7462 -0.7462 -0.3131 -0.3124 -0.0556 -0.0548 0.0272 0.0299 0.6795 0.6799 0.7404 0.7408 1.2483 1.2503 1.3648 1.3679 1.7147 1.7162 1.8438 1.8470 2.3977 2.4019 2.4078 2.4133 2.4733 2.4792 2.7416 2.7461 2.8192 2.8205 3.0158 3.0172 3.1882 3.1886 3.4410 3.4411 3.4530 3.4573 3.8573 3.8586 3.9627 3.9632 4.0509 4.0510 4.0750 4.0771 4.3890 4.3896 4.4944 4.4951 4.6490 4.6498 4.8249 4.8256 5.0176 5.0177 10.5712 10.5714 11.0805 11.0807 11.3569 11.3599 11.8309 11.8320 k =-0.3243 0.2184 0.0000 ( 8162 PWs) bands (ev): -13.4927 -13.4927 -13.4411 -13.4411 -9.5384 -9.5383 -9.3354 -9.3354 -8.5274 -8.5272 -8.3827 -8.3826 -8.1893 -8.1893 -8.1360 -8.1360 -5.1186 -5.1185 -4.8135 -4.8134 -1.3996 -1.3991 -1.0306 -1.0295 -0.7576 -0.7575 -0.3339 -0.3333 -0.0595 -0.0588 0.0343 0.0369 0.6327 0.6328 0.7347 0.7355 1.2829 1.2850 1.3810 1.3841 1.7611 1.7627 1.8585 1.8616 2.4057 2.4102 2.4312 2.4370 2.4870 2.4929 2.7451 2.7493 2.8062 2.8086 3.0377 3.0378 3.1673 3.1677 3.3977 3.3978 3.4422 3.4467 3.8698 3.8707 3.9617 3.9617 4.0284 4.0289 4.0783 4.0799 4.3923 4.3931 4.4910 4.4920 4.6354 4.6366 4.8247 4.8253 5.0205 5.0206 10.6518 10.6522 11.1012 11.1016 11.4007 11.4038 11.8967 11.8975 k =-0.3378 0.2275 0.0000 ( 8156 PWs) bands (ev): -13.4914 -13.4914 -13.4404 -13.4404 -9.5186 -9.5185 -9.3103 -9.3103 -8.5566 -8.5564 -8.4112 -8.4112 -8.1921 -8.1921 -8.1380 -8.1379 -5.1210 -5.1210 -4.8225 -4.8224 -1.3755 -1.3750 -1.0090 -1.0079 -0.7685 -0.7684 -0.3562 -0.3556 -0.0630 -0.0623 0.0390 0.0414 0.5868 0.5868 0.7329 0.7338 1.3168 1.3190 1.4001 1.4031 1.8069 1.8087 1.8733 1.8762 2.4143 2.4190 2.4387 2.4427 2.5163 2.5202 2.7498 2.7535 2.7861 2.7892 3.0613 3.0623 3.1427 3.1431 3.3590 3.3591 3.4307 3.4353 3.8791 3.8798 3.9569 3.9578 4.0106 4.0117 4.0842 4.0855 4.3941 4.3951 4.4846 4.4857 4.6238 4.6253 4.8245 4.8252 5.0235 5.0236 10.7311 10.7316 11.1228 11.1234 11.4425 11.4457 11.9572 11.9573 k =-0.3514 0.2366 0.0000 ( 8140 PWs) bands (ev): -13.4901 -13.4901 -13.4398 -13.4398 -9.4986 -9.4985 -9.2851 -9.2851 -8.5853 -8.5851 -8.4399 -8.4399 -8.1948 -8.1947 -8.1398 -8.1398 -5.1230 -5.1230 -4.8313 -4.8312 -1.3503 -1.3498 -0.9882 -0.9871 -0.7789 -0.7789 -0.3793 -0.3788 -0.0659 -0.0654 0.0408 0.0431 0.5429 0.5429 0.7340 0.7349 1.3499 1.3520 1.4220 1.4250 1.8518 1.8538 1.8875 1.8904 2.4237 2.4286 2.4391 2.4422 2.5493 2.5520 2.7555 2.7556 2.7630 2.7632 3.0869 3.0887 3.1149 3.1154 3.3258 3.3259 3.4179 3.4226 3.8855 3.8860 3.9480 3.9497 3.9991 4.0009 4.0927 4.0936 4.3938 4.3951 4.4756 4.4767 4.6145 4.6163 4.8245 4.8251 5.0265 5.0265 10.8084 10.8090 11.1455 11.1462 11.4820 11.4852 11.9907 11.9923 k =-0.3649 0.2457 0.0000 ( 8132 PWs) bands (ev): -13.4889 -13.4888 -13.4392 -13.4392 -9.4784 -9.4784 -9.2599 -9.2599 -8.6133 -8.6131 -8.4687 -8.4687 -8.1973 -8.1972 -8.1416 -8.1416 -5.1246 -5.1245 -4.8399 -4.8398 -1.3243 -1.3239 -0.9684 -0.9672 -0.7888 -0.7887 -0.4029 -0.4024 -0.0685 -0.0680 0.0399 0.0420 0.5016 0.5017 0.7374 0.7383 1.3816 1.3838 1.4468 1.4498 1.8942 1.8973 1.9009 1.9046 2.4339 2.4373 2.4378 2.4422 2.5804 2.5828 2.7274 2.7322 2.7623 2.7663 3.0842 3.0845 3.1135 3.1162 3.2990 3.2990 3.4033 3.4080 3.8890 3.8894 3.9364 3.9384 3.9932 3.9952 4.1032 4.1038 4.3908 4.3926 4.4651 4.4661 4.6073 4.6091 4.8245 4.8251 5.0294 5.0295 10.8831 10.8839 11.1691 11.1701 11.5188 11.5220 11.9740 11.9759 k =-0.3784 0.2548 0.0000 ( 8128 PWs) bands (ev): -13.4877 -13.4877 -13.4386 -13.4386 -9.4584 -9.4584 -9.2350 -9.2349 -8.6403 -8.6401 -8.4974 -8.4973 -8.1996 -8.1995 -8.1432 -8.1432 -5.1257 -5.1257 -4.8481 -4.8481 -1.2979 -1.2974 -0.9498 -0.9487 -0.7979 -0.7978 -0.4266 -0.4262 -0.0707 -0.0703 0.0367 0.0385 0.4634 0.4634 0.7425 0.7434 1.4116 1.4138 1.4744 1.4773 1.9118 1.9132 1.9385 1.9397 2.4345 2.4365 2.4470 2.4528 2.6072 2.6098 2.6946 2.6989 2.7699 2.7734 3.0515 3.0517 3.1382 3.1412 3.2802 3.2802 3.3868 3.3914 3.8898 3.8903 3.9246 3.9267 3.9905 3.9925 4.1150 4.1154 4.3850 4.3871 4.4546 4.4551 4.6015 4.6034 4.8245 4.8251 5.0323 5.0323 10.9547 10.9557 11.1937 11.1949 11.5527 11.5559 11.9416 11.9432 k =-0.3919 0.2639 0.0000 ( 8140 PWs) bands (ev): -13.4867 -13.4867 -13.4381 -13.4381 -9.4388 -9.4387 -9.2105 -9.2105 -8.6659 -8.6657 -8.5256 -8.5255 -8.2017 -8.2016 -8.1447 -8.1447 -5.1265 -5.1264 -4.8560 -4.8559 -1.2713 -1.2709 -0.9327 -0.9316 -0.8063 -0.8062 -0.4501 -0.4497 -0.0726 -0.0722 0.0316 0.0333 0.4284 0.4285 0.7488 0.7496 1.4397 1.4418 1.5046 1.5074 1.9204 1.9218 1.9778 1.9793 2.4312 2.4335 2.4612 2.4670 2.6232 2.6278 2.6680 2.6703 2.7782 2.7813 3.0169 3.0171 3.1565 3.1595 3.2731 3.2734 3.3685 3.3729 3.8880 3.8886 3.9142 3.9163 3.9892 3.9910 4.1274 4.1276 4.3768 4.3794 4.4447 4.4447 4.5968 4.5987 4.8246 4.8251 5.0350 5.0351 11.0224 11.0237 11.2188 11.2203 11.5836 11.5868 11.9092 11.9106 k =-0.4054 0.2730 0.0000 ( 8148 PWs) bands (ev): -13.4857 -13.4857 -13.4377 -13.4377 -9.4198 -9.4197 -9.1869 -9.1869 -8.6897 -8.6896 -8.5531 -8.5530 -8.2036 -8.2035 -8.1461 -8.1461 -5.1269 -5.1268 -4.8633 -4.8632 -1.2450 -1.2446 -0.9172 -0.9163 -0.8138 -0.8137 -0.4730 -0.4727 -0.0742 -0.0738 0.0254 0.0268 0.3971 0.3972 0.7556 0.7564 1.4655 1.4675 1.5372 1.5399 1.9253 1.9265 2.0143 2.0159 2.4266 2.4291 2.4780 2.4837 2.6102 2.6166 2.6687 2.6690 2.7869 2.7895 2.9809 2.9811 3.1634 3.1657 3.2816 3.2827 3.3488 3.3530 3.8834 3.8842 3.9059 3.9078 3.9884 3.9901 4.1398 4.1399 4.3678 4.3706 4.4352 4.4355 4.5927 4.5944 4.8246 4.8251 5.0375 5.0376 11.0856 11.0872 11.2440 11.2459 11.6115 11.6146 11.8795 11.8808 k =-0.4189 0.2821 0.0000 ( 8154 PWs) bands (ev): -13.4849 -13.4849 -13.4373 -13.4373 -9.4018 -9.4017 -9.1646 -9.1646 -8.7113 -8.7112 -8.5795 -8.5794 -8.2052 -8.2052 -8.1473 -8.1473 -5.1270 -5.1270 -4.8699 -4.8699 -1.2196 -1.2192 -0.9037 -0.9029 -0.8204 -0.8204 -0.4950 -0.4947 -0.0756 -0.0752 0.0186 0.0198 0.3696 0.3697 0.7626 0.7633 1.4886 1.4904 1.5721 1.5746 1.9257 1.9266 2.0473 2.0488 2.4200 2.4225 2.4976 2.5030 2.5853 2.5911 2.6820 2.6825 2.7955 2.7975 2.9442 2.9444 3.1601 3.1617 3.3033 3.3052 3.3285 3.3324 3.8760 3.8769 3.8996 3.9013 3.9880 3.9894 4.1516 4.1516 4.3596 4.3624 4.4260 4.4266 4.5888 4.5904 4.8247 4.8251 5.0398 5.0399 11.1436 11.1454 11.2686 11.2709 11.6363 11.6393 11.8534 11.8547 k =-0.4324 0.2912 0.0000 ( 8164 PWs) bands (ev): -13.4842 -13.4842 -13.4370 -13.4370 -9.3853 -9.3852 -9.1441 -9.1441 -8.7302 -8.7301 -8.6042 -8.6042 -8.2066 -8.2066 -8.1483 -8.1483 -5.1270 -5.1270 -4.8758 -4.8758 -1.1956 -1.1952 -0.8923 -0.8915 -0.8261 -0.8261 -0.5154 -0.5152 -0.0766 -0.0764 0.0118 0.0128 0.3460 0.3462 0.7692 0.7698 1.5088 1.5104 1.6088 1.6112 1.9206 1.9212 2.0761 2.0774 2.4108 2.4131 2.5201 2.5252 2.5649 2.5698 2.6942 2.6948 2.8033 2.8045 2.9075 2.9081 3.1524 3.1535 3.3084 3.3119 3.3318 3.3338 3.8657 3.8669 3.8951 3.8966 3.9876 3.9888 4.1624 4.1625 4.3534 4.3562 4.4168 4.4176 4.5853 4.5867 4.8248 4.8251 5.0419 5.0419 11.1955 11.1977 11.2918 11.2944 11.6582 11.6609 11.8313 11.8325 k =-0.4459 0.3003 0.0000 ( 8162 PWs) bands (ev): -13.4836 -13.4836 -13.4367 -13.4367 -9.3706 -9.3706 -9.1260 -9.1260 -8.7460 -8.7458 -8.6267 -8.6267 -8.2078 -8.2078 -8.1491 -8.1491 -5.1268 -5.1268 -4.8808 -4.8808 -1.1740 -1.1736 -0.8831 -0.8824 -0.8309 -0.8308 -0.5337 -0.5335 -0.0775 -0.0773 0.0056 0.0064 0.3266 0.3267 0.7751 0.7756 1.5257 1.5271 1.6470 1.6492 1.9095 1.9096 2.1002 2.1013 2.3994 2.4011 2.5452 2.5476 2.5542 2.5557 2.7035 2.7041 2.8077 2.8081 2.8733 2.8748 3.1439 3.1448 3.2898 3.2928 3.3615 3.3636 3.8533 3.8546 3.8921 3.8933 3.9873 3.9883 4.1721 4.1722 4.3500 4.3526 4.4076 4.4085 4.5821 4.5832 4.8249 4.8251 5.0436 5.0436 11.2408 11.2433 11.3124 11.3152 11.6772 11.6796 11.8132 11.8143 k =-0.4595 0.3094 0.0000 ( 8158 PWs) bands (ev): -13.4832 -13.4831 -13.4365 -13.4365 -9.3585 -9.3584 -9.1110 -9.1109 -8.7581 -8.7580 -8.6461 -8.6461 -8.2087 -8.2087 -8.1498 -8.1498 -5.1266 -5.1266 -4.8849 -4.8848 -1.1555 -1.1553 -0.8761 -0.8756 -0.8345 -0.8345 -0.5490 -0.5489 -0.0781 -0.0780 0.0003 0.0009 0.3114 0.3115 0.7800 0.7804 1.5392 1.5403 1.6859 1.6879 1.8917 1.8920 2.1191 2.1200 2.3875 2.3887 2.5439 2.5469 2.5737 2.5782 2.7099 2.7105 2.7997 2.8023 2.8494 2.8523 3.1365 3.1371 3.2737 3.2761 3.3893 3.3913 3.8401 3.8412 3.8903 3.8912 3.9870 3.9878 4.1802 4.1803 4.3494 4.3518 4.3984 4.3994 4.5793 4.5802 4.8249 4.8251 5.0450 5.0450 11.2786 11.2813 11.3290 11.3321 11.6932 11.6952 11.7990 11.8000 k =-0.4730 0.3185 0.0000 ( 8146 PWs) bands (ev): -13.4828 -13.4828 -13.4363 -13.4363 -9.3493 -9.3493 -9.0996 -9.0996 -8.7665 -8.7664 -8.6614 -8.6613 -8.2094 -8.2094 -8.1503 -8.1503 -5.1264 -5.1264 -4.8878 -4.8878 -1.1413 -1.1412 -0.8712 -0.8709 -0.8372 -0.8372 -0.5607 -0.5606 -0.0786 -0.0785 -0.0037 -0.0033 0.3005 0.3006 0.7836 0.7839 1.5490 1.5498 1.7247 1.7265 1.8680 1.8687 2.1328 2.1333 2.3775 2.3782 2.5412 2.5431 2.6026 2.6063 2.7139 2.7144 2.7758 2.7787 2.8436 2.8460 3.1309 3.1313 3.2613 3.2630 3.4124 3.4139 3.8279 3.8289 3.8892 3.8899 3.9868 3.9873 4.1864 4.1865 4.3512 4.3532 4.3898 4.3909 4.5772 4.5778 4.8250 4.8251 5.0460 5.0460 11.3082 11.3112 11.3403 11.3435 11.7059 11.7072 11.7888 11.7897 k =-0.4865 0.3276 0.0000 ( 8146 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3435 -9.3435 -9.0926 -9.0926 -8.7713 -8.7712 -8.6712 -8.6712 -8.2098 -8.2098 -8.1506 -8.1506 -5.1262 -5.1262 -4.8896 -4.8896 -1.1323 -1.1322 -0.8684 -0.8682 -0.8388 -0.8388 -0.5680 -0.5680 -0.0788 -0.0788 -0.0061 -0.0059 0.2940 0.2940 0.7859 0.7861 1.5551 1.5554 1.7616 1.7631 1.8401 1.8411 2.1410 2.1413 2.3709 2.3712 2.5406 2.5414 2.6290 2.6316 2.7160 2.7163 2.7495 2.7515 2.8447 2.8459 3.1275 3.1277 3.2535 3.2544 3.4280 3.4288 3.8193 3.8198 3.8888 3.8891 3.9867 3.9870 4.1903 4.1904 4.3543 4.3556 4.3830 4.3838 4.5760 4.5763 4.8250 4.8251 5.0466 5.0466 11.3290 11.3321 11.3449 11.3481 11.7144 11.7150 11.7827 11.7832 k =-0.5000 0.3367 0.0000 ( 8142 PWs) bands (ev): -13.4825 -13.4825 -13.4362 -13.4362 -9.3416 -9.3416 -9.0902 -9.0902 -8.7728 -8.7728 -8.6746 -8.6746 -8.2099 -8.2099 -8.1507 -8.1507 -5.1262 -5.1262 -4.8902 -4.8902 -1.1292 -1.1292 -0.8674 -0.8674 -0.8393 -0.8393 -0.5705 -0.5705 -0.0789 -0.0789 -0.0069 -0.0069 0.2918 0.2918 0.7867 0.7867 1.5572 1.5572 1.7862 1.7862 1.8198 1.8198 2.1439 2.1439 2.3687 2.3687 2.5408 2.5408 2.6427 2.6427 2.7168 2.7168 2.7375 2.7375 2.8459 2.8459 3.1264 3.1264 3.2512 3.2512 3.4338 3.4338 3.8163 3.8163 3.8888 3.8888 3.9868 3.9868 4.1917 4.1917 4.3565 4.3565 4.3805 4.3805 4.5756 4.5756 4.8251 4.8251 5.0468 5.0468 11.3404 11.3404 11.3454 11.3454 11.7176 11.7176 11.7807 11.7807 k =-0.5000 0.3367 0.0000 ( 8142 PWs) bands (ev): -13.4825 -13.4825 -13.4362 -13.4362 -9.3416 -9.3416 -9.0902 -9.0902 -8.7728 -8.7728 -8.6746 -8.6746 -8.2099 -8.2099 -8.1507 -8.1507 -5.1262 -5.1262 -4.8902 -4.8902 -1.1292 -1.1292 -0.8674 -0.8674 -0.8393 -0.8393 -0.5705 -0.5705 -0.0789 -0.0789 -0.0069 -0.0069 0.2918 0.2918 0.7867 0.7867 1.5572 1.5572 1.7862 1.7862 1.8198 1.8198 2.1439 2.1439 2.3687 2.3687 2.5408 2.5408 2.6427 2.6427 2.7168 2.7168 2.7375 2.7375 2.8459 2.8459 3.1264 3.1264 3.2512 3.2512 3.4338 3.4338 3.8163 3.8163 3.8888 3.8888 3.9868 3.9868 4.1917 4.1917 4.3565 4.3565 4.3805 4.3805 4.5756 4.5756 4.8251 4.8251 5.0468 5.0468 11.3404 11.3404 11.3454 11.3454 11.7176 11.7176 11.7807 11.7807 k =-0.4909 0.3502-0.0000 ( 8158 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3410 -9.3410 -9.0896 -9.0896 -8.7739 -8.7739 -8.6756 -8.6755 -8.2097 -8.2096 -8.1504 -8.1504 -5.1257 -5.1257 -4.8909 -4.8908 -1.1295 -1.1294 -0.8703 -0.8688 -0.8360 -0.8343 -0.5689 -0.5687 -0.0935 -0.0915 0.0081 0.0101 0.2929 0.2930 0.7879 0.7879 1.5512 1.5520 1.7845 1.7847 1.8246 1.8256 2.1424 2.1432 2.3632 2.3635 2.5300 2.5334 2.6491 2.6524 2.7062 2.7079 2.7404 2.7423 2.8508 2.8508 3.1241 3.1252 3.2544 3.2551 3.4370 3.4372 3.8170 3.8170 3.8879 3.8884 3.9841 3.9845 4.1922 4.1922 4.3570 4.3571 4.3810 4.3810 4.5750 4.5752 4.8231 4.8236 5.0440 5.0440 11.3408 11.3408 11.3450 11.3451 11.7156 11.7156 11.7816 11.7817 k =-0.4818 0.3638-0.0000 ( 8164 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3394 -9.3394 -9.0879 -9.0878 -8.7772 -8.7772 -8.6784 -8.6782 -8.2088 -8.2087 -8.1496 -8.1495 -5.1243 -5.1243 -4.8928 -4.8928 -1.1302 -1.1300 -0.8749 -0.8727 -0.8259 -0.8235 -0.5639 -0.5636 -0.1194 -0.1170 0.0404 0.0429 0.2963 0.2964 0.7913 0.7914 1.5354 1.5367 1.7797 1.7802 1.8387 1.8406 2.1388 2.1404 2.3464 2.3471 2.5109 2.5159 2.6643 2.6689 2.6847 2.6866 2.7441 2.7465 2.8656 2.8656 3.1190 3.1209 3.2644 3.2654 3.4468 3.4471 3.8189 3.8189 3.8859 3.8868 3.9766 3.9775 4.1936 4.1937 4.3588 4.3588 4.3823 4.3823 4.5732 4.5736 4.8179 4.8188 5.0356 5.0356 11.3414 11.3414 11.3447 11.3447 11.7096 11.7098 11.7842 11.7843 k =-0.4727 0.3773-0.0000 ( 8160 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3367 -9.3367 -9.0849 -9.0849 -8.7827 -8.7827 -8.6830 -8.6827 -8.2074 -8.2072 -8.1483 -8.1480 -5.1220 -5.1219 -4.8961 -4.8961 -1.1313 -1.1311 -0.8789 -0.8766 -0.8120 -0.8093 -0.5556 -0.5550 -0.1461 -0.1435 0.0783 0.0810 0.3019 0.3020 0.7972 0.7974 1.5127 1.5144 1.7718 1.7725 1.8591 1.8616 2.1332 2.1356 2.3181 2.3188 2.4934 2.4989 2.6556 2.6579 2.6783 2.6835 2.7446 2.7474 2.8900 2.8903 3.1117 3.1144 3.2795 3.2809 3.4625 3.4629 3.8216 3.8216 3.8827 3.8840 3.9649 3.9663 4.1958 4.1961 4.3616 4.3617 4.3843 4.3844 4.5703 4.5709 4.8095 4.8108 5.0217 5.0217 11.3403 11.3404 11.3461 11.3461 11.7000 11.7002 11.7885 11.7887 k =-0.4636 0.3908-0.0000 ( 8160 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3329 -9.3329 -9.0809 -9.0807 -8.7903 -8.7902 -8.6893 -8.6890 -8.2054 -8.2052 -8.1464 -8.1461 -5.1188 -5.1186 -4.9006 -4.9006 -1.1329 -1.1326 -0.8820 -0.8796 -0.7953 -0.7924 -0.5437 -0.5430 -0.1710 -0.1683 0.1186 0.1214 0.3098 0.3100 0.8056 0.8058 1.4860 1.4877 1.7608 1.7617 1.8829 1.8858 2.1259 2.1290 2.2799 2.2805 2.4800 2.4856 2.6206 2.6230 2.6883 2.6934 2.7420 2.7452 2.9225 2.9231 3.1032 3.1066 3.2986 3.3002 3.4834 3.4839 3.8242 3.8246 3.8782 3.8799 3.9501 3.9522 4.1988 4.1990 4.3654 4.3656 4.3869 4.3871 4.5663 4.5672 4.7981 4.7999 5.0025 5.0025 11.3376 11.3378 11.3488 11.3490 11.6868 11.6871 11.7943 11.7946 k =-0.4545 0.4043-0.0000 ( 8162 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3282 -9.3281 -9.0756 -9.0755 -8.7999 -8.7998 -8.6972 -8.6969 -8.2029 -8.2027 -8.1440 -8.1437 -5.1147 -5.1145 -4.9063 -4.9062 -1.1349 -1.1346 -0.8841 -0.8817 -0.7761 -0.7731 -0.5282 -0.5274 -0.1934 -0.1906 0.1600 0.1629 0.3201 0.3203 0.8167 0.8169 1.4572 1.4589 1.7468 1.7478 1.9076 1.9107 2.1171 2.1208 2.2350 2.2355 2.4691 2.4746 2.5802 2.5827 2.6954 2.7004 2.7370 2.7405 2.9606 2.9615 3.0937 3.0976 3.3204 3.3221 3.5085 3.5092 3.8252 3.8261 3.8722 3.8743 3.9341 3.9372 4.2022 4.2025 4.3700 4.3702 4.3899 4.3902 4.5614 4.5624 4.7843 4.7865 4.9781 4.9781 11.3341 11.3343 11.3521 11.3523 11.6706 11.6710 11.8017 11.8021 k =-0.4453 0.4179-0.0000 ( 8162 PWs) bands (ev): -13.4826 -13.4826 -13.4362 -13.4362 -9.3225 -9.3224 -9.0692 -9.0691 -8.8115 -8.8114 -8.7066 -8.7062 -8.1999 -8.1996 -8.1412 -8.1408 -5.1098 -5.1096 -4.9130 -4.9130 -1.1373 -1.1369 -0.8852 -0.8829 -0.7549 -0.7518 -0.5090 -0.5080 -0.2128 -0.2100 0.2018 0.2047 0.3327 0.3329 0.8307 0.8310 1.4277 1.4293 1.7299 1.7310 1.9308 1.9341 2.1069 2.1112 2.1870 2.1875 2.4584 2.4638 2.5352 2.5379 2.7019 2.7064 2.7302 2.7339 3.0018 3.0030 3.0833 3.0878 3.3440 3.3459 3.5370 3.5378 3.8216 3.8233 3.8648 3.8672 3.9202 3.9244 4.2060 4.2062 4.3750 4.3754 4.3931 4.3935 4.5556 4.5568 4.7683 4.7710 4.9488 4.9488 11.3298 11.3300 11.3553 11.3556 11.6517 11.6523 11.8104 11.8109 k =-0.4362 0.4314-0.0000 ( 8162 PWs) bands (ev): -13.4827 -13.4827 -13.4363 -13.4363 -9.3159 -9.3158 -9.0617 -9.0615 -8.8249 -8.8248 -8.7174 -8.7170 -8.1965 -8.1962 -8.1380 -8.1375 -5.1042 -5.1039 -4.9208 -4.9207 -1.1400 -1.1396 -0.8857 -0.8834 -0.7318 -0.7287 -0.4859 -0.4849 -0.2290 -0.2262 0.2428 0.2458 0.3477 0.3480 0.8480 0.8483 1.3985 1.3999 1.7101 1.7113 1.9491 1.9525 2.0955 2.1003 2.1405 2.1409 2.4464 2.4514 2.4866 2.4894 2.7093 2.7133 2.7220 2.7260 3.0444 3.0459 3.0722 3.0772 3.3687 3.3707 3.5681 3.5690 3.8102 3.8125 3.8558 3.8586 3.9124 3.9176 4.2099 4.2101 4.3801 4.3806 4.3965 4.3969 4.5492 4.5506 4.7508 4.7540 4.9148 4.9148 11.3248 11.3251 11.3580 11.3583 11.6307 11.6314 11.8201 11.8208 k =-0.4271 0.4449-0.0000 ( 8156 PWs) bands (ev): -13.4827 -13.4827 -13.4363 -13.4363 -9.3086 -9.3085 -9.0531 -9.0529 -8.8399 -8.8398 -8.7294 -8.7289 -8.1926 -8.1923 -8.1343 -8.1338 -5.0978 -5.0975 -4.9295 -4.9294 -1.1431 -1.1426 -0.8856 -0.8834 -0.7071 -0.7041 -0.4589 -0.4578 -0.2421 -0.2393 0.2824 0.2853 0.3652 0.3655 0.8690 0.8693 1.3702 1.3713 1.6877 1.6889 1.9553 1.9582 2.0829 2.0880 2.1038 2.1040 2.4313 2.4356 2.4362 2.4382 2.7126 2.7160 2.7192 2.7235 3.0602 3.0650 3.0879 3.0891 3.3937 3.3958 3.6012 3.6023 3.7901 3.7924 3.8454 3.8485 3.9125 3.9182 4.2138 4.2139 4.3846 4.3853 4.3999 4.4005 4.5427 4.5441 4.7322 4.7359 4.8766 4.8766 11.3192 11.3194 11.3594 11.3598 11.6082 11.6091 11.8305 11.8315 k =-0.4180 0.4584-0.0000 ( 8160 PWs) bands (ev): -13.4828 -13.4828 -13.4364 -13.4364 -9.3006 -9.3005 -9.0435 -9.0432 -8.8565 -8.8564 -8.7423 -8.7417 -8.1884 -8.1881 -8.1304 -8.1298 -5.0907 -5.0904 -4.9389 -4.9389 -1.1464 -1.1458 -0.8853 -0.8831 -0.6812 -0.6782 -0.4279 -0.4267 -0.2520 -0.2491 0.3196 0.3224 0.3851 0.3855 0.8939 0.8942 1.3432 1.3440 1.6629 1.6640 1.9377 1.9396 2.0692 2.0748 2.0879 2.0888 2.3811 2.3841 2.4150 2.4192 2.7031 2.7068 2.7315 2.7347 3.0474 3.0527 3.1301 3.1315 3.4182 3.4205 3.6356 3.6368 3.7632 3.7653 3.8335 3.8369 3.9186 3.9245 4.2173 4.2174 4.3878 4.3886 4.4034 4.4041 4.5366 4.5381 4.7133 4.7173 4.8344 4.8344 11.3126 11.3128 11.3590 11.3593 11.5847 11.5858 11.8411 11.8426 k =-0.4089 0.4720-0.0000 ( 8148 PWs) bands (ev): -13.4829 -13.4829 -13.4364 -13.4364 -9.2921 -9.2920 -9.0328 -9.0326 -8.8745 -8.8744 -8.7559 -8.7553 -8.1839 -8.1835 -8.1261 -8.1255 -5.0831 -5.0828 -4.9490 -4.9490 -1.1499 -1.1493 -0.8849 -0.8828 -0.6543 -0.6513 -0.3929 -0.3916 -0.2587 -0.2558 0.3535 0.3563 0.4076 0.4079 0.9232 0.9235 1.3179 1.3183 1.6357 1.6367 1.8967 1.8977 2.0549 2.0610 2.0924 2.0942 2.3260 2.3290 2.3957 2.3994 2.6932 2.6970 2.7462 2.7487 3.0338 3.0393 3.1711 3.1726 3.4415 3.4440 3.6706 3.6719 3.7323 3.7340 3.8209 3.8244 3.9284 3.9343 4.2203 4.2204 4.3887 4.3898 4.4069 4.4079 4.5320 4.5334 4.6943 4.6986 4.7888 4.7889 11.3050 11.3052 11.3558 11.3563 11.5611 11.5624 11.8504 11.8527 k =-0.3998 0.4855-0.0000 ( 8156 PWs) bands (ev): -13.4830 -13.4830 -13.4365 -13.4365 -9.2834 -9.2832 -9.0213 -9.0211 -8.8936 -8.8934 -8.7699 -8.7693 -8.1791 -8.1787 -8.1216 -8.1210 -5.0750 -5.0746 -4.9597 -4.9596 -1.1537 -1.1530 -0.8846 -0.8825 -0.6268 -0.6238 -0.3539 -0.3526 -0.2623 -0.2593 0.3834 0.3861 0.4326 0.4329 0.9570 0.9573 1.2943 1.2943 1.6064 1.6073 1.8438 1.8443 2.0389 2.0451 2.1072 2.1092 2.2705 2.2734 2.3748 2.3782 2.6834 2.6871 2.7630 2.7647 3.0195 3.0250 3.2101 3.2116 3.4627 3.4653 3.6982 3.6997 3.7059 3.7074 3.8086 3.8123 3.9404 3.9464 4.2225 4.2227 4.3865 4.3878 4.4106 4.4118 4.5297 4.5310 4.6759 4.6804 4.7404 4.7405 11.2960 11.2961 11.3493 11.3498 11.5381 11.5396 11.8547 11.8583 k =-0.3907 0.4990-0.0000 ( 8152 PWs) bands (ev): -13.4831 -13.4831 -13.4366 -13.4366 -9.2746 -9.2744 -9.0093 -9.0091 -8.9133 -8.9131 -8.7840 -8.7834 -8.1740 -8.1736 -8.1168 -8.1162 -5.0664 -5.0660 -4.9708 -4.9707 -1.1575 -1.1568 -0.8845 -0.8824 -0.5988 -0.5959 -0.3110 -0.3097 -0.2629 -0.2598 0.4088 0.4113 0.4601 0.4604 0.9952 0.9956 1.2721 1.2726 1.5752 1.5759 1.7859 1.7859 2.0205 2.0265 2.1252 2.1272 2.2159 2.2187 2.3535 2.3566 2.6738 2.6773 2.7810 2.7821 3.0044 3.0099 3.2463 3.2478 3.4806 3.4833 3.6655 3.6666 3.7345 3.7363 3.8015 3.8051 3.9538 3.9599 4.2239 4.2241 4.3806 4.3820 4.4141 4.4156 4.5303 4.5316 4.6582 4.6629 4.6899 4.6901 11.2851 11.2851 11.3387 11.3391 11.5164 11.5182 11.8460 11.8499 k =-0.3816 0.5125-0.0000 ( 8150 PWs) bands (ev): -13.4833 -13.4833 -13.4367 -13.4367 -9.2661 -9.2659 -8.9976 -8.9976 -8.9327 -8.9323 -8.7978 -8.7971 -8.1687 -8.1683 -8.1119 -8.1113 -5.0574 -5.0569 -4.9821 -4.9820 -1.1615 -1.1607 -0.8848 -0.8828 -0.5707 -0.5678 -0.2643 -0.2631 -0.2605 -0.2574 0.4296 0.4319 0.4901 0.4904 1.0373 1.0377 1.2517 1.2526 1.5422 1.5427 1.7256 1.7260 1.9983 2.0037 2.1437 2.1453 2.1642 2.1668 2.3329 2.3359 2.6647 2.6679 2.7994 2.7999 2.9888 2.9942 3.2788 3.2802 3.4940 3.4967 3.6331 3.6338 3.7472 3.7496 3.8119 3.8149 3.9681 3.9743 4.2241 4.2245 4.3710 4.3725 4.4170 4.4188 4.5340 4.5352 4.6385 4.6388 4.6416 4.6464 11.2718 11.2719 11.3233 11.3237 11.4969 11.4990 11.8230 11.8256 k =-0.3725 0.5261-0.0000 ( 8154 PWs) bands (ev): -13.4835 -13.4835 -13.4368 -13.4368 -9.2582 -9.2580 -8.9907 -8.9904 -8.9476 -8.9469 -8.8109 -8.8101 -8.1632 -8.1628 -8.1068 -8.1062 -5.0480 -5.0476 -4.9936 -4.9935 -1.1654 -1.1646 -0.8856 -0.8836 -0.5427 -0.5398 -0.2554 -0.2522 -0.2141 -0.2129 0.4458 0.4478 0.5225 0.5228 1.0822 1.0827 1.2328 1.2342 1.5076 1.5079 1.6647 1.6654 1.9702 1.9746 2.1182 2.1191 2.1611 2.1631 2.3150 2.3178 2.6560 2.6589 2.8173 2.8174 2.9727 2.9779 3.3062 3.3073 3.5014 3.5040 3.6038 3.6040 3.7430 3.7456 3.8411 3.8439 3.9831 3.9893 4.2233 4.2238 4.3585 4.3600 4.4175 4.4198 4.5403 4.5414 4.5884 4.5889 4.6260 4.6308 11.2557 11.2559 11.3028 11.3031 11.4802 11.4824 11.7947 11.7962 k =-0.3634 0.5396-0.0000 ( 8154 PWs) bands (ev): -13.4838 -13.4838 -13.4370 -13.4370 -9.2515 -9.2512 -8.9983 -8.9978 -8.9477 -8.9468 -8.8226 -8.8218 -8.1576 -8.1572 -8.1016 -8.1011 -5.0383 -5.0379 -5.0051 -5.0050 -1.1694 -1.1685 -0.8870 -0.8851 -0.5149 -0.5121 -0.2475 -0.2443 -0.1606 -0.1595 0.4577 0.4594 0.5571 0.5575 1.1276 1.1282 1.2159 1.2179 1.4715 1.4716 1.6047 1.6057 1.9341 1.9369 2.0800 2.0805 2.1757 2.1772 2.3018 2.3048 2.6478 2.6504 2.8336 2.8342 2.9563 2.9613 3.3266 3.3272 3.5015 3.5037 3.5794 3.5799 3.7355 3.7378 3.8768 3.8796 3.9983 4.0046 4.2215 4.2222 4.3439 4.3453 4.4115 4.4144 4.5440 4.5452 4.5485 4.5499 4.6117 4.6164 11.2368 11.2369 11.2772 11.2774 11.4664 11.4687 11.7661 11.7669 k =-0.3634 0.5396-0.0000 ( 8154 PWs) bands (ev): -13.4838 -13.4838 -13.4370 -13.4370 -9.2515 -9.2512 -8.9983 -8.9978 -8.9477 -8.9468 -8.8226 -8.8218 -8.1576 -8.1572 -8.1016 -8.1011 -5.0383 -5.0379 -5.0051 -5.0050 -1.1694 -1.1685 -0.8870 -0.8851 -0.5149 -0.5121 -0.2475 -0.2443 -0.1606 -0.1595 0.4577 0.4594 0.5571 0.5575 1.1276 1.1282 1.2159 1.2179 1.4715 1.4716 1.6047 1.6057 1.9341 1.9369 2.0800 2.0805 2.1757 2.1772 2.3018 2.3048 2.6478 2.6504 2.8336 2.8342 2.9563 2.9613 3.3266 3.3272 3.5015 3.5037 3.5794 3.5799 3.7355 3.7378 3.8768 3.8796 3.9983 4.0046 4.2215 4.2222 4.3439 4.3453 4.4115 4.4144 4.5440 4.5452 4.5485 4.5499 4.6117 4.6164 11.2368 11.2369 11.2772 11.2774 11.4664 11.4687 11.7661 11.7669 k =-0.3634 0.5396 0.0157 ( 8159 PWs) bands (ev): -13.4837 -13.4837 -13.4371 -13.4371 -9.2510 -9.2507 -8.9991 -8.9986 -8.9473 -8.9463 -8.8228 -8.8220 -8.1574 -8.1570 -8.1017 -8.1011 -5.0381 -5.0377 -5.0050 -5.0050 -1.1698 -1.1689 -0.8894 -0.8875 -0.5143 -0.5116 -0.2481 -0.2449 -0.1576 -0.1565 0.4579 0.4595 0.5584 0.5587 1.1266 1.1271 1.2155 1.2174 1.4699 1.4701 1.6057 1.6068 1.9345 1.9373 2.0801 2.0806 2.1761 2.1776 2.3017 2.3046 2.6467 2.6493 2.8343 2.8350 2.9563 2.9613 3.3263 3.3269 3.5020 3.5042 3.5803 3.5808 3.7350 3.7372 3.8763 3.8791 3.9991 4.0053 4.2180 4.2187 4.3429 4.3443 4.4143 4.4171 4.5442 4.5454 4.5485 4.5499 4.6123 4.6170 11.2365 11.2366 11.2769 11.2771 11.4675 11.4698 11.7655 11.7663 k =-0.3634 0.5396 0.0314 ( 8161 PWs) bands (ev): -13.4835 -13.4835 -13.4373 -13.4373 -9.2498 -9.2495 -9.0013 -9.0008 -8.9459 -8.9450 -8.8235 -8.8227 -8.1570 -8.1566 -8.1019 -8.1014 -5.0377 -5.0372 -5.0049 -5.0048 -1.1708 -1.1699 -0.8965 -0.8946 -0.5128 -0.5100 -0.2499 -0.2467 -0.1486 -0.1475 0.4583 0.4600 0.5622 0.5626 1.1233 1.1238 1.2143 1.2161 1.4653 1.4655 1.6090 1.6099 1.9359 1.9387 2.0804 2.0809 2.1775 2.1789 2.3012 2.3042 2.6434 2.6460 2.8366 2.8372 2.9564 2.9614 3.3255 3.3261 3.5035 3.5057 3.5829 3.5833 3.7333 3.7354 3.8747 3.8774 4.0012 4.0074 4.2081 4.2086 4.3400 4.3414 4.4222 4.4246 4.5447 4.5459 4.5484 4.5497 4.6143 4.6188 11.2357 11.2358 11.2761 11.2763 11.4706 11.4729 11.7637 11.7644 k =-0.3634 0.5396 0.0471 ( 8166 PWs) bands (ev): -13.4830 -13.4830 -13.4378 -13.4378 -9.2477 -9.2474 -9.0049 -9.0044 -8.9438 -8.9430 -8.8246 -8.8238 -8.1562 -8.1558 -8.1023 -8.1017 -5.0368 -5.0364 -5.0047 -5.0047 -1.1725 -1.1716 -0.9078 -0.9059 -0.5104 -0.5075 -0.2529 -0.2497 -0.1342 -0.1330 0.4589 0.4606 0.5685 0.5689 1.1176 1.1182 1.2125 1.2142 1.4577 1.4579 1.6143 1.6151 1.9381 1.9409 2.0807 2.0811 2.1795 2.1810 2.3006 2.3034 2.6379 2.6406 2.8404 2.8410 2.9565 2.9615 3.3241 3.3247 3.5059 3.5079 3.5870 3.5875 3.7306 3.7324 3.8720 3.8748 4.0047 4.0109 4.1934 4.1936 4.3355 4.3369 4.4337 4.4356 4.5457 4.5466 4.5481 4.5492 4.6175 4.6218 11.2345 11.2345 11.2747 11.2749 11.4757 11.4779 11.7608 11.7613 k =-0.3634 0.5396 0.0628 ( 8154 PWs) bands (ev): -13.4824 -13.4824 -13.4384 -13.4384 -9.2449 -9.2446 -9.0096 -9.0092 -8.9412 -8.9404 -8.8261 -8.8253 -8.1552 -8.1548 -8.1028 -8.1023 -5.0357 -5.0353 -5.0045 -5.0044 -1.1747 -1.1738 -0.9226 -0.9207 -0.5072 -0.5043 -0.2570 -0.2539 -0.1148 -0.1134 0.4597 0.4615 0.5773 0.5776 1.1097 1.1103 1.2103 1.2117 1.4474 1.4477 1.6218 1.6224 1.9412 1.9441 2.0808 2.0810 2.1822 2.1837 2.2998 2.3026 2.6304 2.6332 2.8458 2.8463 2.9569 2.9619 3.3224 3.3229 3.5088 3.5107 3.5926 3.5930 3.7267 3.7283 3.8685 3.8714 4.0095 4.0155 4.1753 4.1754 4.3298 4.3312 4.4471 4.4485 4.5467 4.5468 4.5482 4.5487 4.6218 4.6258 11.2328 11.2329 11.2728 11.2730 11.4826 11.4846 11.7569 11.7572 k =-0.3634 0.5396 0.0785 ( 8152 PWs) bands (ev): -13.4817 -13.4817 -13.4392 -13.4392 -9.2412 -9.2409 -9.0152 -9.0149 -8.9382 -8.9374 -8.8280 -8.8273 -8.1539 -8.1535 -8.1035 -8.1029 -5.0343 -5.0339 -5.0042 -5.0041 -1.1773 -1.1764 -0.9400 -0.9382 -0.5034 -0.5005 -0.2624 -0.2592 -0.0910 -0.0896 0.4606 0.4624 0.5883 0.5886 1.0993 1.1000 1.2076 1.2088 1.4347 1.4350 1.6313 1.6317 1.9451 1.9482 2.0803 2.0804 2.1852 2.1867 2.2992 2.3019 2.6211 2.6239 2.8528 2.8531 2.9575 2.9625 3.3205 3.3209 3.5120 3.5137 3.5994 3.5998 3.7219 3.7231 3.8643 3.8672 4.0152 4.0212 4.1551 4.1554 4.3232 4.3247 4.4613 4.4620 4.5453 4.5458 4.5499 4.5500 4.6269 4.6307 11.2310 11.2311 11.2704 11.2707 11.4909 11.4927 11.7520 11.7521 k =-0.3634 0.5396 0.0942 ( 8152 PWs) bands (ev): -13.4807 -13.4807 -13.4402 -13.4402 -9.2368 -9.2365 -9.0218 -9.0214 -8.9348 -8.9340 -8.8304 -8.8296 -8.1524 -8.1520 -8.1043 -8.1037 -5.0327 -5.0323 -5.0039 -5.0038 -1.1801 -1.1792 -0.9594 -0.9576 -0.4991 -0.4961 -0.2690 -0.2658 -0.0635 -0.0620 0.4614 0.4633 0.6015 0.6018 1.0867 1.0874 1.2046 1.2056 1.4198 1.4201 1.6428 1.6430 1.9499 1.9532 2.0789 2.0791 2.1882 2.1896 2.2990 2.3017 2.6101 2.6131 2.8613 2.8615 2.9586 2.9635 3.3184 3.3187 3.5150 3.5164 3.6071 3.6074 3.7163 3.7169 3.8596 3.8626 4.0215 4.0273 4.1343 4.1347 4.3161 4.3177 4.4752 4.4753 4.5429 4.5434 4.5523 4.5529 4.6326 4.6360 11.2291 11.2293 11.2676 11.2679 11.5005 11.5021 11.7462 11.7463 k =-0.3634 0.5396 0.1099 ( 8149 PWs) bands (ev): -13.4797 -13.4797 -13.4413 -13.4413 -9.2316 -9.2313 -9.0290 -9.0287 -8.9311 -8.9304 -8.8331 -8.8323 -8.1506 -8.1502 -8.1052 -8.1047 -5.0308 -5.0304 -5.0035 -5.0035 -1.1830 -1.1821 -0.9799 -0.9782 -0.4943 -0.4913 -0.2766 -0.2735 -0.0331 -0.0315 0.4620 0.4639 0.6167 0.6170 1.0721 1.0728 1.2013 1.2020 1.4030 1.4034 1.6561 1.6562 1.9553 1.9588 2.0764 2.0768 2.1905 2.1918 2.2997 2.3024 2.5977 2.6008 2.8713 2.8713 2.9602 2.9650 3.3164 3.3166 3.5170 3.5181 3.6155 3.6158 3.7102 3.7102 3.8546 3.8577 4.0270 4.0325 4.1147 4.1152 4.3088 4.3104 4.4871 4.4881 4.5399 4.5403 4.5559 4.5571 4.6385 4.6416 11.2274 11.2276 11.2645 11.2648 11.5110 11.5125 11.7397 11.7399 k =-0.3634 0.5396 0.1256 ( 8153 PWs) bands (ev): -13.4784 -13.4784 -13.4426 -13.4426 -9.2257 -9.2254 -9.0370 -9.0367 -8.9272 -8.9265 -8.8361 -8.8354 -8.1487 -8.1483 -8.1063 -8.1058 -5.0288 -5.0284 -5.0033 -5.0032 -1.1858 -1.1849 -1.0010 -0.9994 -0.4890 -0.4860 -0.2854 -0.2822 -0.0004 0.0013 0.4620 0.4640 0.6338 0.6340 1.0558 1.0565 1.1978 1.1982 1.3849 1.3853 1.6711 1.6714 1.9612 1.9651 2.0726 2.0734 2.1916 2.1928 2.3018 2.3045 2.5841 2.5873 2.8825 2.8827 2.9623 2.9671 3.3145 3.3147 3.5175 3.5181 3.6243 3.6246 3.7035 3.7042 3.8497 3.8528 4.0292 4.0339 4.0998 4.0998 4.3014 4.3032 4.4971 4.4990 4.5364 4.5368 4.5608 4.5628 4.6442 4.6470 11.2257 11.2261 11.2611 11.2614 11.5223 11.5235 11.7325 11.7329 k =-0.3634 0.5396 0.1413 ( 8158 PWs) bands (ev): -13.4771 -13.4771 -13.4440 -13.4440 -9.2191 -9.2189 -9.0455 -9.0452 -8.9231 -8.9224 -8.8395 -8.8388 -8.1465 -8.1461 -8.1076 -8.1070 -5.0266 -5.0263 -5.0030 -5.0029 -1.1883 -1.1874 -1.0222 -1.0206 -0.4832 -0.4801 -0.2951 -0.2920 0.0341 0.0358 0.4610 0.4630 0.6524 0.6526 1.0381 1.0388 1.1940 1.1942 1.3656 1.3661 1.6879 1.6884 1.9671 1.9714 2.0677 2.0690 2.1909 2.1920 2.3058 2.3086 2.5695 2.5728 2.8948 2.8953 2.9650 2.9698 3.3132 3.3132 3.5154 3.5156 3.6334 3.6336 3.6975 3.6989 3.8449 3.8481 4.0236 4.0269 4.0931 4.0944 4.2940 4.2959 4.5048 4.5075 4.5327 4.5331 4.5675 4.5702 4.6493 4.6520 11.2244 11.2248 11.2576 11.2579 11.5341 11.5351 11.7248 11.7253 k =-0.3634 0.5396 0.1570 ( 8157 PWs) bands (ev): -13.4756 -13.4756 -13.4455 -13.4455 -9.2119 -9.2116 -9.0546 -9.0543 -8.9189 -8.9181 -8.8433 -8.8425 -8.1443 -8.1439 -8.1090 -8.1084 -5.0244 -5.0240 -5.0029 -5.0028 -1.1902 -1.1893 -1.0430 -1.0415 -0.4768 -0.4737 -0.3057 -0.3025 0.0697 0.0715 0.4586 0.4607 0.6724 0.6726 1.0195 1.0202 1.1902 1.1903 1.3456 1.3462 1.7062 1.7070 1.9724 1.9773 2.0621 2.0641 2.1881 2.1889 2.3121 2.3149 2.5542 2.5575 2.9080 2.9088 2.9683 2.9730 3.3124 3.3125 3.5098 3.5100 3.6425 3.6426 3.6929 3.6950 3.8407 3.8439 4.0094 4.0113 4.0964 4.0988 4.2864 4.2884 4.5101 4.5133 4.5289 4.5293 4.5759 4.5790 4.6538 4.6563 11.2234 11.2238 11.2539 11.2542 11.5462 11.5470 11.7166 11.7172 k =-0.3634 0.5396 0.1727 ( 8164 PWs) bands (ev): -13.4740 -13.4740 -13.4471 -13.4471 -9.2041 -9.2038 -9.0640 -9.0638 -8.9144 -8.9137 -8.8472 -8.8465 -8.1419 -8.1415 -8.1105 -8.1100 -5.0221 -5.0217 -5.0029 -5.0028 -1.1914 -1.1905 -1.0631 -1.0616 -0.4698 -0.4667 -0.3170 -0.3138 0.1059 0.1079 0.4543 0.4564 0.6936 0.6937 1.0002 1.0009 1.1866 1.1869 1.3253 1.3259 1.7260 1.7271 1.9758 1.9814 2.0570 2.0598 2.1830 2.1836 2.3207 2.3235 2.5383 2.5416 2.9218 2.9228 2.9721 2.9766 3.3127 3.3128 3.5004 3.5008 3.6514 3.6515 3.6902 3.6930 3.8371 3.8404 3.9903 3.9916 4.1057 4.1086 4.2786 4.2808 4.5135 4.5169 4.5252 4.5258 4.5856 4.5888 4.6572 4.6596 11.2227 11.2232 11.2502 11.2505 11.5584 11.5590 11.7081 11.7088 k =-0.3634 0.5396 0.1884 ( 8167 PWs) bands (ev): -13.4723 -13.4723 -13.4489 -13.4489 -9.1957 -9.1955 -9.0739 -9.0736 -8.9098 -8.9091 -8.8515 -8.8507 -8.1395 -8.1391 -8.1121 -8.1116 -5.0197 -5.0194 -5.0031 -5.0029 -1.1917 -1.1907 -1.0822 -1.0808 -0.4622 -0.4591 -0.3288 -0.3257 0.1424 0.1444 0.4476 0.4498 0.7158 0.7158 0.9803 0.9810 1.1837 1.1841 1.3050 1.3057 1.7471 1.7484 1.9756 1.9816 2.0543 2.0576 2.1758 2.1762 2.3312 2.3342 2.5219 2.5252 2.9355 2.9369 2.9762 2.9805 3.3144 3.3146 3.4872 3.4879 3.6599 3.6602 3.6895 3.6927 3.8347 3.8380 3.9696 3.9705 4.1180 4.1211 4.2705 4.2727 4.5153 4.5188 4.5219 4.5226 4.5958 4.5989 4.6596 4.6619 11.2224 11.2229 11.2465 11.2469 11.5706 11.5710 11.6992 11.7000 k =-0.3634 0.5396 0.2041 ( 8189 PWs) bands (ev): -13.4705 -13.4705 -13.4507 -13.4507 -9.1869 -9.1866 -9.0841 -9.0838 -8.9051 -8.9044 -8.8559 -8.8552 -8.1370 -8.1366 -8.1139 -8.1134 -5.0175 -5.0172 -5.0034 -5.0032 -1.1909 -1.1899 -1.1000 -1.0986 -0.4538 -0.4507 -0.3410 -0.3379 0.1786 0.1807 0.4380 0.4403 0.7385 0.7385 0.9602 0.9609 1.1819 1.1826 1.2851 1.2859 1.7691 1.7707 1.9704 1.9762 2.0558 2.0591 2.1669 2.1671 2.3435 2.3465 2.5052 2.5085 2.9487 2.9505 2.9803 2.9845 3.3178 3.3181 3.4710 3.4717 3.6679 3.6684 3.6904 3.6940 3.8336 3.8369 3.9487 3.9496 4.1319 4.1350 4.2617 4.2641 4.5161 4.5190 4.5196 4.5201 4.6061 4.6091 4.6608 4.6630 11.2225 11.2230 11.2430 11.2434 11.5828 11.5830 11.6901 11.6908 k =-0.3634 0.5396 0.2198 ( 8183 PWs) bands (ev): -13.4686 -13.4686 -13.4526 -13.4526 -9.1776 -9.1773 -9.0945 -9.0942 -8.9003 -8.8996 -8.8606 -8.8598 -8.1345 -8.1340 -8.1158 -8.1153 -5.0153 -5.0150 -5.0039 -5.0037 -1.1889 -1.1879 -1.1164 -1.1151 -0.4448 -0.4417 -0.3535 -0.3504 0.2142 0.2163 0.4253 0.4276 0.7616 0.7618 0.9397 0.9404 1.1819 1.1827 1.2660 1.2668 1.7919 1.7938 1.9598 1.9652 2.0617 2.0645 2.1565 2.1565 2.3572 2.3602 2.4883 2.4915 2.9608 2.9629 2.9842 2.9882 3.3236 3.3239 3.4524 3.4530 3.6752 3.6760 3.6923 3.6959 3.8344 3.8376 3.9284 3.9293 4.1465 4.1496 4.2522 4.2546 4.5160 4.5168 4.5182 4.5194 4.6160 4.6188 4.6607 4.6629 11.2229 11.2235 11.2396 11.2400 11.5948 11.5948 11.6806 11.6813 k =-0.3634 0.5396 0.2355 ( 8187 PWs) bands (ev): -13.4667 -13.4667 -13.4546 -13.4546 -9.1679 -9.1676 -9.1051 -9.1048 -8.8953 -8.8946 -8.8653 -8.8646 -8.1320 -8.1315 -8.1179 -8.1174 -5.0132 -5.0129 -5.0046 -5.0044 -1.1855 -1.1845 -1.1313 -1.1300 -0.4351 -0.4321 -0.3660 -0.3629 0.2486 0.2508 0.4093 0.4115 0.7849 0.7851 0.9189 0.9196 1.1839 1.1848 1.2481 1.2490 1.8153 1.8175 1.9450 1.9496 2.0708 2.0730 2.1449 2.1451 2.3719 2.3749 2.4712 2.4745 2.9712 2.9736 2.9875 2.9913 3.3319 3.3322 3.4325 3.4329 3.6817 3.6827 3.6942 3.6977 3.8373 3.8403 3.9092 3.9103 4.1614 4.1644 4.2417 4.2443 4.5153 4.5154 4.5171 4.5188 4.6252 4.6279 4.6594 4.6615 11.2238 11.2244 11.2364 11.2369 11.6065 11.6066 11.6708 11.6715 k =-0.3634 0.5396 0.2512 ( 8190 PWs) bands (ev): -13.4647 -13.4647 -13.4566 -13.4566 -9.1578 -9.1576 -9.1158 -9.1155 -8.8903 -8.8896 -8.8702 -8.8695 -8.1295 -8.1290 -8.1200 -8.1195 -5.0113 -5.0110 -5.0055 -5.0053 -1.1806 -1.1795 -1.1445 -1.1433 -0.4248 -0.4218 -0.3784 -0.3753 0.2815 0.2837 0.3898 0.3921 0.8082 0.8085 0.8977 0.8983 1.1884 1.1893 1.2318 1.2327 1.8388 1.8412 1.9270 1.9310 2.0818 2.0835 2.1325 2.1329 2.3874 2.3905 2.4542 2.4574 2.9795 2.9821 2.9897 2.9933 3.3431 3.3434 3.4121 3.4124 3.6871 3.6885 3.6956 3.6987 3.8429 3.8455 3.8916 3.8928 4.1762 4.1792 4.2304 4.2330 4.5143 4.5149 4.5164 4.5180 4.6336 4.6362 4.6567 4.6589 11.2250 11.2256 11.2336 11.2341 11.6178 11.6181 11.6608 11.6615 k =-0.3634 0.5396 0.2669 ( 8180 PWs) bands (ev): -13.4627 -13.4627 -13.4586 -13.4586 -9.1476 -9.1473 -9.1264 -9.1262 -8.8853 -8.8846 -8.8752 -8.8745 -8.1270 -8.1266 -8.1222 -8.1218 -5.0095 -5.0093 -5.0066 -5.0064 -1.1741 -1.1730 -1.1561 -1.1549 -0.4140 -0.4109 -0.3906 -0.3875 0.3125 0.3147 0.3670 0.3693 0.8312 0.8316 0.8761 0.8766 1.1954 1.1964 1.2174 1.2184 1.8621 1.8649 1.9067 1.9103 2.0940 2.0952 2.1197 2.1203 2.4034 2.4065 2.4373 2.4405 2.9853 2.9879 2.9909 2.9939 3.3570 3.3573 3.3923 3.3924 3.6913 3.6930 3.6958 3.6985 3.8512 3.8535 3.8758 3.8774 4.1907 4.1936 4.2181 4.2208 4.5140 4.5144 4.5161 4.5171 4.6411 4.6435 4.6528 4.6550 11.2265 11.2271 11.2310 11.2315 11.6290 11.6294 11.6505 11.6511 k =-0.3634 0.5396 0.2826 ( 8190 PWs) bands (ev): -13.4607 -13.4607 -13.4606 -13.4606 -9.1373 -9.1373 -9.1365 -9.1365 -8.8803 -8.8803 -8.8795 -8.8795 -8.1248 -8.1248 -8.1239 -8.1239 -5.0081 -5.0081 -5.0076 -5.0076 -1.1663 -1.1663 -1.1645 -1.1645 -0.4027 -0.4027 -0.3992 -0.3992 0.3406 0.3406 0.3439 0.3439 0.8529 0.8529 0.8553 0.8553 1.2041 1.2041 1.2072 1.2072 1.8845 1.8845 1.8884 1.8884 2.1064 2.1064 2.1080 2.1080 2.4185 2.4185 2.4251 2.4251 2.9886 2.9886 2.9926 2.9926 3.3722 3.3722 3.3753 3.3753 3.6940 3.6940 3.6968 3.6968 3.8619 3.8619 3.8644 3.8644 4.2042 4.2042 4.2081 4.2081 4.5141 4.5141 4.5164 4.5164 4.6472 4.6472 4.6502 4.6502 11.2281 11.2281 11.2297 11.2297 11.6396 11.6396 11.6406 11.6406 k =-0.3634 0.5396 0.2826 ( 8190 PWs) bands (ev): -13.4607 -13.4607 -13.4606 -13.4606 -9.1373 -9.1373 -9.1365 -9.1365 -8.8803 -8.8803 -8.8795 -8.8795 -8.1248 -8.1248 -8.1239 -8.1239 -5.0081 -5.0081 -5.0076 -5.0076 -1.1663 -1.1663 -1.1645 -1.1645 -0.4027 -0.4027 -0.3992 -0.3992 0.3406 0.3406 0.3439 0.3439 0.8529 0.8529 0.8553 0.8553 1.2041 1.2041 1.2072 1.2072 1.8845 1.8845 1.8884 1.8884 2.1064 2.1064 2.1080 2.1080 2.4185 2.4185 2.4251 2.4251 2.9886 2.9886 2.9926 2.9926 3.3722 3.3722 3.3753 3.3753 3.6940 3.6940 3.6968 3.6968 3.8619 3.8619 3.8644 3.8644 4.2042 4.2042 4.2081 4.2081 4.5141 4.5141 4.5164 4.5164 4.6472 4.6472 4.6502 4.6502 11.2281 11.2281 11.2297 11.2297 11.6396 11.6396 11.6406 11.6406 k =-0.3725 0.5261 0.2826 ( 8190 PWs) bands (ev): -13.4605 -13.4605 -13.4604 -13.4604 -9.1424 -9.1424 -9.1416 -9.1416 -8.8686 -8.8686 -8.8680 -8.8680 -8.1306 -8.1306 -8.1297 -8.1297 -5.0070 -5.0070 -5.0066 -5.0066 -1.1687 -1.1687 -1.1669 -1.1669 -0.4222 -0.4222 -0.4188 -0.4188 0.2975 0.2975 0.3006 0.3006 0.8433 0.8433 0.8453 0.8453 1.2215 1.2215 1.2247 1.2247 1.9109 1.9109 1.9154 1.9154 2.1480 2.1480 2.1502 2.1502 2.4080 2.4080 2.4147 2.4147 2.9941 2.9941 2.9984 2.9984 3.3842 3.3842 3.3876 3.3876 3.6827 3.6827 3.6859 3.6859 3.8546 3.8546 3.8572 3.8572 4.2021 4.2021 4.2058 4.2058 4.5315 4.5315 4.5339 4.5339 4.6577 4.6577 4.6609 4.6609 11.2546 11.2546 11.2562 11.2562 11.6449 11.6449 11.6459 11.6459 k =-0.3816 0.5125 0.2826 ( 8186 PWs) bands (ev): -13.4603 -13.4603 -13.4603 -13.4603 -9.1495 -9.1495 -9.1488 -9.1488 -8.8548 -8.8548 -8.8542 -8.8542 -8.1363 -8.1363 -8.1353 -8.1353 -5.0060 -5.0060 -5.0056 -5.0056 -1.1706 -1.1706 -1.1688 -1.1688 -0.4404 -0.4404 -0.4370 -0.4370 0.2509 0.2509 0.2539 0.2539 0.8359 0.8359 0.8376 0.8376 1.2407 1.2407 1.2441 1.2441 1.9323 1.9323 1.9371 1.9371 2.1931 2.1931 2.1957 2.1957 2.4004 2.4004 2.4072 2.4072 2.9974 2.9974 3.0018 3.0018 3.3894 3.3894 3.3931 3.3931 3.6731 3.6731 3.6770 3.6770 3.8494 3.8494 3.8521 3.8521 4.1999 4.1999 4.2033 4.2033 4.5446 4.5446 4.5469 4.5469 4.6738 4.6738 4.6771 4.6771 11.2796 11.2796 11.2812 11.2812 11.6501 11.6501 11.6511 11.6511 k =-0.3907 0.4990 0.2826 ( 8170 PWs) bands (ev): -13.4601 -13.4601 -13.4601 -13.4601 -9.1578 -9.1578 -9.1572 -9.1572 -8.8396 -8.8396 -8.8390 -8.8390 -8.1418 -8.1418 -8.1409 -8.1409 -5.0049 -5.0049 -5.0045 -5.0045 -1.1718 -1.1718 -1.1701 -1.1701 -0.4569 -0.4569 -0.4537 -0.4537 0.2022 0.2022 0.2051 0.2051 0.8303 0.8303 0.8318 0.8318 1.2615 1.2615 1.2649 1.2649 1.9485 1.9485 1.9533 1.9533 2.2401 2.2401 2.2428 2.2428 2.3969 2.3969 2.4036 2.4036 2.9984 2.9984 3.0030 3.0030 3.3868 3.3868 3.3908 3.3908 3.6667 3.6667 3.6711 3.6711 3.8465 3.8465 3.8493 3.8493 4.1977 4.1977 4.2009 4.2009 4.5526 4.5526 4.5548 4.5548 4.6957 4.6957 4.6990 4.6990 11.3029 11.3029 11.3044 11.3044 11.6554 11.6554 11.6564 11.6564 k =-0.3998 0.4855 0.2826 ( 8162 PWs) bands (ev): -13.4600 -13.4600 -13.4600 -13.4600 -9.1667 -9.1667 -9.1661 -9.1661 -8.8238 -8.8238 -8.8232 -8.8232 -8.1471 -8.1471 -8.1462 -8.1462 -5.0038 -5.0038 -5.0035 -5.0035 -1.1724 -1.1724 -1.1707 -1.1707 -0.4718 -0.4718 -0.4686 -0.4686 0.1526 0.1526 0.1553 0.1553 0.8261 0.8261 0.8274 0.8274 1.2837 1.2837 1.2872 1.2872 1.9594 1.9594 1.9641 1.9641 2.2864 2.2864 2.2886 2.2886 2.3998 2.3998 2.4055 2.4055 2.9974 2.9974 3.0021 3.0021 3.3763 3.3763 3.3803 3.3803 3.6636 3.6636 3.6683 3.6683 3.8460 3.8460 3.8491 3.8491 4.1956 4.1956 4.1985 4.1985 4.5560 4.5560 4.5580 4.5580 4.7220 4.7220 4.7250 4.7250 11.3241 11.3241 11.3255 11.3255 11.6608 11.6608 11.6619 11.6619 k =-0.4089 0.4720 0.2826 ( 8162 PWs) bands (ev): -13.4599 -13.4599 -13.4599 -13.4599 -9.1756 -9.1756 -9.1751 -9.1751 -8.8079 -8.8079 -8.8075 -8.8075 -8.1522 -8.1522 -8.1514 -8.1514 -5.0028 -5.0028 -5.0025 -5.0025 -1.1724 -1.1724 -1.1708 -1.1708 -0.4847 -0.4847 -0.4817 -0.4817 0.1031 0.1031 0.1056 0.1056 0.8229 0.8229 0.8241 0.8241 1.3070 1.3070 1.3104 1.3104 1.9653 1.9653 1.9696 1.9696 2.3267 2.3267 2.3285 2.3285 2.4134 2.4134 2.4170 2.4170 2.9946 2.9946 2.9994 2.9994 3.3586 3.3586 3.3626 3.3626 3.6629 3.6629 3.6678 3.6678 3.8484 3.8484 3.8517 3.8517 4.1935 4.1935 4.1961 4.1961 4.5561 4.5561 4.5578 4.5578 4.7507 4.7507 4.7534 4.7534 11.3430 11.3430 11.3443 11.3443 11.6664 11.6664 11.6676 11.6676 k =-0.4180 0.4584 0.2826 ( 8160 PWs) bands (ev): -13.4598 -13.4598 -13.4598 -13.4598 -9.1844 -9.1844 -9.1839 -9.1839 -8.7925 -8.7925 -8.7921 -8.7921 -8.1571 -8.1571 -8.1563 -8.1563 -5.0019 -5.0019 -5.0016 -5.0016 -1.1718 -1.1718 -1.1703 -1.1703 -0.4957 -0.4957 -0.4928 -0.4928 0.0546 0.0546 0.0570 0.0570 0.8204 0.8204 0.8214 0.8214 1.3310 1.3310 1.3344 1.3344 1.9665 1.9665 1.9704 1.9704 2.3531 2.3531 2.3573 2.3573 2.4429 2.4429 2.4441 2.4441 2.9905 2.9905 2.9952 2.9952 3.3351 3.3351 3.3389 3.3389 3.6635 3.6635 3.6682 3.6682 3.8539 3.8539 3.8571 3.8571 4.1913 4.1913 4.1938 4.1938 4.5539 4.5539 4.5555 4.5555 4.7801 4.7801 4.7825 4.7825 11.3596 11.3596 11.3607 11.3607 11.6721 11.6721 11.6735 11.6735 k =-0.4271 0.4449 0.2826 ( 8166 PWs) bands (ev): -13.4598 -13.4598 -13.4598 -13.4598 -9.1926 -9.1926 -9.1922 -9.1922 -8.7779 -8.7779 -8.7775 -8.7775 -8.1616 -8.1616 -8.1609 -8.1609 -5.0010 -5.0010 -5.0007 -5.0007 -1.1707 -1.1707 -1.1693 -1.1693 -0.5045 -0.5045 -0.5018 -0.5018 0.0079 0.0079 0.0101 0.0101 0.8185 0.8185 0.8194 0.8194 1.3553 1.3553 1.3586 1.3586 1.9635 1.9635 1.9670 1.9670 2.3689 2.3689 2.3748 2.3748 2.4838 2.4838 2.4862 2.4862 2.9853 2.9853 2.9900 2.9900 3.3070 3.3070 3.3106 3.3106 3.6642 3.6642 3.6686 3.6686 3.8620 3.8620 3.8653 3.8653 4.1892 4.1892 4.1915 4.1915 4.5504 4.5504 4.5518 4.5518 4.8090 4.8090 4.8111 4.8111 11.3736 11.3736 11.3747 11.3747 11.6780 11.6780 11.6794 11.6794 k =-0.4362 0.4314 0.2826 ( 8174 PWs) bands (ev): -13.4597 -13.4597 -13.4597 -13.4597 -9.2002 -9.2002 -9.1998 -9.1998 -8.7644 -8.7644 -8.7640 -8.7640 -8.1658 -8.1658 -8.1651 -8.1651 -5.0002 -5.0002 -4.9999 -4.9999 -1.1693 -1.1693 -1.1680 -1.1680 -0.5112 -0.5112 -0.5087 -0.5087 -0.0362 -0.0362 -0.0341 -0.0341 0.8169 0.8169 0.8177 0.8177 1.3796 1.3796 1.3827 1.3827 1.9571 1.9571 1.9602 1.9602 2.3808 2.3808 2.3870 2.3870 2.5305 2.5305 2.5335 2.5335 2.9796 2.9796 2.9842 2.9842 3.2754 3.2754 3.2790 3.2790 3.6645 3.6645 3.6685 3.6685 3.8724 3.8724 3.8754 3.8754 4.1871 4.1871 4.1892 4.1892 4.5461 4.5461 4.5473 4.5473 4.8363 4.8363 4.8381 4.8381 11.3852 11.3852 11.3861 11.3861 11.6839 11.6839 11.6853 11.6853 k =-0.4453 0.4179 0.2826 ( 8178 PWs) bands (ev): -13.4597 -13.4597 -13.4597 -13.4597 -9.2069 -9.2069 -9.2066 -9.2066 -8.7522 -8.7522 -8.7519 -8.7519 -8.1696 -8.1696 -8.1690 -8.1690 -4.9995 -4.9995 -4.9992 -4.9992 -1.1676 -1.1676 -1.1665 -1.1665 -0.5159 -0.5159 -0.5135 -0.5135 -0.0770 -0.0770 -0.0751 -0.0751 0.8156 0.8156 0.8163 0.8163 1.4031 1.4031 1.4060 1.4060 1.9483 1.9483 1.9511 1.9511 2.3914 2.3914 2.3974 2.3974 2.5786 2.5786 2.5818 2.5818 2.9739 2.9739 2.9783 2.9783 3.2416 3.2416 3.2449 3.2449 3.6643 3.6643 3.6677 3.6677 3.8841 3.8841 3.8868 3.8868 4.1850 4.1850 4.1869 4.1869 4.5413 4.5413 4.5425 4.5425 4.8614 4.8614 4.8629 4.8629 11.3944 11.3944 11.3953 11.3953 11.6895 11.6895 11.6910 11.6910 k =-0.4545 0.4043 0.2826 ( 8184 PWs) bands (ev): -13.4597 -13.4597 -13.4597 -13.4597 -9.2128 -9.2128 -9.2125 -9.2125 -8.7415 -8.7415 -8.7413 -8.7413 -8.1729 -8.1729 -8.1724 -8.1724 -4.9989 -4.9989 -4.9987 -4.9987 -1.1658 -1.1658 -1.1648 -1.1648 -0.5186 -0.5186 -0.5165 -0.5165 -0.1137 -0.1137 -0.1120 -0.1120 0.8146 0.8146 0.8152 0.8152 1.4254 1.4254 1.4280 1.4280 1.9381 1.9381 1.9404 1.9404 2.4014 2.4014 2.4068 2.4068 2.6256 2.6256 2.6288 2.6288 2.9690 2.9690 2.9730 2.9730 3.2063 3.2063 3.2095 3.2095 3.6636 3.6636 3.6665 3.6665 3.8960 3.8960 3.8985 3.8985 4.1829 4.1829 4.1846 4.1846 4.5367 4.5367 4.5376 4.5376 4.8836 4.8836 4.8849 4.8849 11.4015 11.4015 11.4023 11.4023 11.6948 11.6948 11.6961 11.6961 k =-0.4636 0.3908 0.2826 ( 8188 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2176 -9.2176 -9.2174 -9.2174 -8.7326 -8.7326 -8.7323 -8.7323 -8.1756 -8.1756 -8.1752 -8.1752 -4.9984 -4.9984 -4.9982 -4.9982 -1.1640 -1.1640 -1.1632 -1.1632 -0.5197 -0.5197 -0.5179 -0.5179 -0.1455 -0.1455 -0.1440 -0.1440 0.8138 0.8138 0.8143 0.8143 1.4455 1.4455 1.4477 1.4477 1.9275 1.9275 1.9295 1.9295 2.4104 2.4104 2.4150 2.4150 2.6699 2.6699 2.6729 2.6729 2.9655 2.9655 2.9692 2.9692 3.1706 3.1706 3.1737 3.1737 3.6628 3.6628 3.6650 3.6650 3.9074 3.9074 3.9094 3.9094 4.1810 4.1810 4.1824 4.1824 4.5323 4.5323 4.5331 4.5331 4.9024 4.9024 4.9034 4.9034 11.4068 11.4068 11.4074 11.4074 11.6995 11.6995 11.7006 11.7006 k =-0.4727 0.3773 0.2826 ( 8180 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2215 -9.2215 -9.2213 -9.2213 -8.7254 -8.7254 -8.7253 -8.7253 -8.1778 -8.1778 -8.1775 -8.1775 -4.9980 -4.9980 -4.9978 -4.9978 -1.1625 -1.1625 -1.1618 -1.1618 -0.5196 -0.5196 -0.5181 -0.5181 -0.1715 -0.1715 -0.1703 -0.1703 0.8132 0.8132 0.8136 0.8136 1.4626 1.4626 1.4644 1.4644 1.9176 1.9176 1.9192 1.9192 2.4182 2.4182 2.4218 2.4218 2.7095 2.7095 2.7121 2.7121 2.9642 2.9642 2.9675 2.9675 3.1359 3.1359 3.1388 3.1388 3.6620 3.6620 3.6636 3.6636 3.9173 3.9173 3.9189 3.9189 4.1794 4.1794 4.1805 4.1805 4.5286 4.5286 4.5292 4.5292 4.9175 4.9175 4.9182 4.9182 11.4106 11.4106 11.4110 11.4110 11.7033 11.7033 11.7043 11.7043 k =-0.4818 0.3638 0.2826 ( 8180 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2242 -9.2242 -9.2241 -9.2241 -8.7202 -8.7202 -8.7201 -8.7201 -8.1794 -8.1794 -8.1792 -8.1792 -4.9977 -4.9977 -4.9976 -4.9976 -1.1612 -1.1612 -1.1608 -1.1608 -0.5188 -0.5188 -0.5178 -0.5178 -0.1909 -0.1909 -0.1901 -0.1901 0.8128 0.8128 0.8131 0.8131 1.4759 1.4759 1.4772 1.4772 1.9097 1.9097 1.9108 1.9108 2.4242 2.4242 2.4267 2.4267 2.7418 2.7418 2.7439 2.7439 2.9659 2.9659 2.9686 2.9686 3.1047 3.1047 3.1072 3.1072 3.6613 3.6613 3.6624 3.6624 3.9250 3.9250 3.9261 3.9261 4.1781 4.1781 4.1789 4.1789 4.5258 4.5258 4.5262 4.5262 4.9285 4.9285 4.9290 4.9290 11.4131 11.4131 11.4134 11.4134 11.7062 11.7062 11.7069 11.7069 k =-0.4909 0.3502 0.2826 ( 8172 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2259 -9.2259 -9.2258 -9.2258 -8.7171 -8.7171 -8.7170 -8.7170 -8.1803 -8.1803 -8.1802 -8.1802 -4.9975 -4.9975 -4.9975 -4.9975 -1.1604 -1.1604 -1.1602 -1.1602 -0.5179 -0.5179 -0.5173 -0.5173 -0.2029 -0.2029 -0.2025 -0.2025 0.8126 0.8126 0.8127 0.8127 1.4845 1.4845 1.4851 1.4851 1.9046 1.9046 1.9051 1.9051 2.4283 2.4283 2.4296 2.4296 2.7636 2.7636 2.7648 2.7648 2.9700 2.9700 2.9717 2.9717 3.0813 3.0813 3.0829 3.0829 3.6610 3.6610 3.6615 3.6615 3.9300 3.9300 3.9306 3.9306 4.1774 4.1774 4.1778 4.1778 4.5241 4.5241 4.5243 4.5243 4.9352 4.9352 4.9355 4.9355 11.4145 11.4145 11.4147 11.4147 11.7081 11.7081 11.7084 11.7084 k =-0.5000 0.3367 0.2826 ( 8172 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2264 -9.2264 -9.2264 -9.2264 -8.7160 -8.7160 -8.7160 -8.7160 -8.1806 -8.1806 -8.1806 -8.1806 -4.9974 -4.9974 -4.9974 -4.9974 -1.1600 -1.1600 -1.1600 -1.1600 -0.5173 -0.5173 -0.5173 -0.5173 -0.2068 -0.2068 -0.2068 -0.2068 0.8126 0.8126 0.8126 0.8126 1.4876 1.4876 1.4876 1.4876 1.9030 1.9030 1.9030 1.9030 2.4301 2.4301 2.4301 2.4301 2.7717 2.7717 2.7717 2.7717 2.9731 2.9731 2.9731 2.9731 3.0727 3.0727 3.0727 3.0727 3.6611 3.6611 3.6611 3.6611 3.9319 3.9319 3.9319 3.9319 4.1773 4.1773 4.1773 4.1773 4.5236 4.5236 4.5236 4.5236 4.9376 4.9376 4.9376 4.9376 11.4150 11.4150 11.4150 11.4150 11.7088 11.7088 11.7088 11.7088 k =-0.5000 0.3367 0.2826 ( 8172 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2264 -9.2264 -9.2264 -9.2264 -8.7160 -8.7160 -8.7160 -8.7160 -8.1806 -8.1806 -8.1806 -8.1806 -4.9974 -4.9974 -4.9974 -4.9974 -1.1600 -1.1600 -1.1600 -1.1600 -0.5173 -0.5173 -0.5173 -0.5173 -0.2068 -0.2068 -0.2068 -0.2068 0.8126 0.8126 0.8126 0.8126 1.4876 1.4876 1.4876 1.4876 1.9030 1.9030 1.9030 1.9030 2.4301 2.4301 2.4301 2.4301 2.7717 2.7717 2.7717 2.7717 2.9731 2.9731 2.9731 2.9731 3.0727 3.0727 3.0727 3.0727 3.6611 3.6611 3.6611 3.6611 3.9319 3.9319 3.9319 3.9319 4.1773 4.1773 4.1773 4.1773 4.5236 4.5236 4.5236 4.5236 4.9376 4.9376 4.9376 4.9376 11.4150 11.4150 11.4150 11.4150 11.7088 11.7088 11.7088 11.7088 k =-0.5000 0.3367 0.2669 ( 8170 PWs) bands (ev): -13.4616 -13.4616 -13.4576 -13.4576 -9.2370 -9.2370 -9.2156 -9.2156 -8.7201 -8.7201 -8.7120 -8.7120 -8.1832 -8.1832 -8.1780 -8.1780 -5.0078 -5.0078 -4.9872 -4.9872 -1.1663 -1.1663 -1.1518 -1.1518 -0.5486 -0.5486 -0.4853 -0.4853 -0.2301 -0.2301 -0.1841 -0.1841 0.7828 0.7828 0.8374 0.8374 1.4798 1.4798 1.5007 1.5007 1.8791 1.8791 1.9261 1.9261 2.4151 2.4151 2.4459 2.4459 2.7710 2.7710 2.7715 2.7715 2.9510 2.9510 2.9959 2.9959 3.0424 3.0424 3.1023 3.1023 3.6236 3.6236 3.6981 3.6981 3.9275 3.9275 3.9363 3.9363 4.1551 4.1551 4.1987 4.1987 4.5171 4.5171 4.5298 4.5298 4.9279 4.9279 4.9473 4.9473 11.4130 11.4130 11.4156 11.4156 11.7036 11.7036 11.7153 11.7153 k =-0.5000 0.3367 0.2512 ( 8182 PWs) bands (ev): -13.4636 -13.4636 -13.4556 -13.4556 -9.2474 -9.2474 -9.2048 -9.2048 -8.7243 -8.7243 -8.7082 -8.7082 -8.1858 -8.1858 -8.1755 -8.1755 -5.0183 -5.0183 -4.9772 -4.9772 -1.1708 -1.1708 -1.1418 -1.1418 -0.5789 -0.5789 -0.4527 -0.4527 -0.2539 -0.2539 -0.1622 -0.1622 0.7491 0.7491 0.8563 0.8563 1.4782 1.4782 1.5180 1.5180 1.8547 1.8547 1.9484 1.9484 2.4011 2.4011 2.4626 2.4626 2.7693 2.7693 2.7704 2.7704 2.9303 2.9303 3.0105 3.0105 3.0199 3.0199 3.1311 3.1311 3.5861 3.5861 3.7345 3.7345 3.9233 3.9233 3.9408 3.9408 4.1324 4.1324 4.2192 4.2192 4.5102 4.5102 4.5357 4.5357 4.9182 4.9182 4.9568 4.9568 11.4097 11.4097 11.4147 11.4147 11.7001 11.7001 11.7226 11.7226 k =-0.5000 0.3367 0.2355 ( 8182 PWs) bands (ev): -13.4656 -13.4656 -13.4536 -13.4536 -9.2576 -9.2576 -9.1940 -9.1940 -8.7285 -8.7285 -8.7044 -8.7044 -8.1883 -8.1883 -8.1729 -8.1729 -5.0288 -5.0288 -4.9675 -4.9675 -1.1735 -1.1735 -1.1298 -1.1298 -0.6080 -0.6080 -0.4196 -0.4196 -0.2780 -0.2780 -0.1413 -0.1413 0.7123 0.7123 0.8690 0.8690 1.4834 1.4834 1.5385 1.5385 1.8298 1.8298 1.9699 1.9699 2.3882 2.3882 2.4800 2.4800 2.7660 2.7660 2.7687 2.7687 2.9115 2.9115 2.9791 2.9791 3.0428 3.0428 3.1588 3.1588 3.5488 3.5488 3.7699 3.7699 3.9192 3.9192 3.9453 3.9453 4.1098 4.1098 4.2384 4.2384 4.5030 4.5030 4.5411 4.5411 4.9087 4.9087 4.9662 4.9662 11.4054 11.4054 11.4122 11.4122 11.6985 11.6985 11.7301 11.7301 k =-0.5000 0.3367 0.2198 ( 8178 PWs) bands (ev): -13.4675 -13.4675 -13.4517 -13.4517 -9.2673 -9.2673 -9.1832 -9.1832 -8.7327 -8.7327 -8.7009 -8.7009 -8.1907 -8.1907 -8.1705 -8.1705 -5.0391 -5.0391 -4.9582 -4.9582 -1.1746 -1.1746 -1.1160 -1.1160 -0.6359 -0.6359 -0.3865 -0.3865 -0.3022 -0.3022 -0.1215 -0.1215 0.6736 0.6736 0.8754 0.8754 1.4953 1.4953 1.5610 1.5610 1.8046 1.8046 1.9904 1.9904 2.3764 2.3764 2.4980 2.4980 2.7609 2.7609 2.7665 2.7665 2.8951 2.8951 2.9465 2.9465 3.0660 3.0660 3.1855 3.1855 3.5119 3.5119 3.8036 3.8036 3.9153 3.9153 3.9497 3.9497 4.0879 4.0879 4.2562 4.2562 4.4954 4.4954 4.5462 4.5462 4.8994 4.8994 4.9754 4.9754 11.4004 11.4004 11.4084 11.4084 11.6989 11.6989 11.7372 11.7372 k =-0.5000 0.3367 0.2041 ( 8154 PWs) bands (ev): -13.4694 -13.4694 -13.4498 -13.4498 -9.2767 -9.2767 -9.1726 -9.1726 -8.7369 -8.7369 -8.6975 -8.6975 -8.1931 -8.1931 -8.1680 -8.1680 -5.0493 -5.0493 -4.9494 -4.9494 -1.1743 -1.1743 -1.1003 -1.1003 -0.6624 -0.6624 -0.3534 -0.3534 -0.3265 -0.3265 -0.1031 -0.1031 0.6338 0.6338 0.8762 0.8762 1.5136 1.5136 1.5848 1.5848 1.7792 1.7792 2.0099 2.0099 2.3659 2.3659 2.5166 2.5166 2.7536 2.7536 2.7641 2.7641 2.8815 2.8815 2.9133 2.9133 3.0885 3.0886 3.2108 3.2108 3.4759 3.4759 3.8348 3.8348 3.9117 3.9117 3.9541 3.9541 4.0678 4.0678 4.2725 4.2725 4.4876 4.4876 4.5508 4.5508 4.8903 4.8903 4.9842 4.9842 11.3949 11.3949 11.4033 11.4033 11.7012 11.7012 11.7433 11.7433 k =-0.5000 0.3367 0.1884 ( 8170 PWs) bands (ev): -13.4711 -13.4711 -13.4480 -13.4480 -9.2857 -9.2857 -9.1623 -9.1623 -8.7411 -8.7411 -8.6943 -8.6943 -8.1954 -8.1954 -8.1657 -8.1657 -5.0592 -5.0592 -4.9410 -4.9410 -1.1726 -1.1726 -1.0830 -1.0830 -0.6874 -0.6874 -0.3508 -0.3508 -0.3206 -0.3206 -0.0862 -0.0862 0.5936 0.5936 0.8724 0.8724 1.5371 1.5371 1.6090 1.6090 1.7538 1.7538 2.0284 2.0284 2.3567 2.3567 2.5356 2.5356 2.7442 2.7442 2.7614 2.7614 2.8707 2.8707 2.8796 2.8796 3.1104 3.1104 3.2343 3.2343 3.4413 3.4413 3.8619 3.8619 3.9083 3.9083 3.9583 3.9583 4.0510 4.0510 4.2873 4.2873 4.4794 4.4794 4.5550 4.5550 4.8816 4.8816 4.9927 4.9927 11.3890 11.3890 11.3973 11.3973 11.7054 11.7054 11.7481 11.7481 k =-0.5000 0.3367 0.1727 ( 8172 PWs) bands (ev): -13.4728 -13.4728 -13.4462 -13.4462 -9.2941 -9.2941 -9.1523 -9.1523 -8.7453 -8.7453 -8.6913 -8.6913 -8.1975 -8.1975 -8.1635 -8.1635 -5.0688 -5.0688 -4.9332 -4.9332 -1.1698 -1.1698 -1.0641 -1.0641 -0.7108 -0.7108 -0.3748 -0.3748 -0.2886 -0.2886 -0.0709 -0.0709 0.5537 0.5537 0.8653 0.8653 1.5647 1.5647 1.6332 1.6332 1.7287 1.7287 2.0457 2.0457 2.3490 2.3490 2.5549 2.5549 2.7332 2.7332 2.7586 2.7586 2.8451 2.8451 2.8631 2.8631 3.1311 3.1311 3.2547 3.2547 3.4094 3.4094 3.8823 3.8823 3.9052 3.9052 3.9624 3.9624 4.0404 4.0404 4.3005 4.3005 4.4708 4.4708 4.5587 4.5587 4.8733 4.8733 5.0007 5.0007 11.3831 11.3831 11.3907 11.3907 11.7110 11.7110 11.7510 11.7510 k =-0.5000 0.3367 0.1570 ( 8154 PWs) bands (ev): -13.4744 -13.4744 -13.4446 -13.4446 -9.3019 -9.3019 -9.1428 -9.1428 -8.7493 -8.7493 -8.6885 -8.6885 -8.1995 -8.1995 -8.1615 -8.1615 -5.0778 -5.0778 -4.9259 -4.9259 -1.1661 -1.1661 -1.0438 -1.0438 -0.7324 -0.7324 -0.3987 -0.3987 -0.2575 -0.2575 -0.0574 -0.0574 0.5148 0.5148 0.8559 0.8559 1.5952 1.5952 1.6566 1.6566 1.7041 1.7041 2.0619 2.0619 2.3429 2.3429 2.5745 2.5745 2.7210 2.7210 2.7558 2.7558 2.8105 2.8105 2.8574 2.8574 3.1507 3.1507 3.2696 3.2696 3.3827 3.3827 3.8927 3.8927 3.9025 3.9025 3.9663 3.9663 4.0393 4.0393 4.3120 4.3120 4.4619 4.4619 4.5620 4.5620 4.8655 4.8655 5.0082 5.0082 11.3772 11.3772 11.3838 11.3838 11.7179 11.7179 11.7520 11.7520 k =-0.5000 0.3367 0.1413 ( 8154 PWs) bands (ev): -13.4759 -13.4759 -13.4431 -13.4431 -9.3092 -9.3092 -9.1337 -9.1337 -8.7532 -8.7532 -8.6859 -8.6859 -8.2014 -8.2014 -8.1595 -8.1595 -5.0864 -5.0864 -4.9193 -4.9193 -1.1617 -1.1617 -1.0224 -1.0224 -0.7522 -0.7522 -0.4223 -0.4223 -0.2277 -0.2277 -0.0457 -0.0457 0.4774 0.4774 0.8454 0.8454 1.6272 1.6272 1.6773 1.6773 1.6821 1.6821 2.0767 2.0767 2.3385 2.3385 2.5941 2.5941 2.7085 2.7085 2.7529 2.7529 2.7757 2.7757 2.8535 2.8535 3.1689 3.1689 3.2734 3.2734 3.3670 3.3670 3.8925 3.8925 3.8999 3.9000 3.9699 3.9699 4.0488 4.0488 4.3220 4.3220 4.4526 4.4526 4.5649 4.5649 4.8582 4.8582 5.0152 5.0152 11.3715 11.3715 11.3770 11.3770 11.7256 11.7256 11.7511 11.7511 k =-0.5000 0.3367 0.1256 ( 8162 PWs) bands (ev): -13.4772 -13.4772 -13.4417 -13.4417 -9.3158 -9.3158 -9.1253 -9.1253 -8.7568 -8.7568 -8.6836 -8.6836 -8.2031 -8.2031 -8.1577 -8.1577 -5.0942 -5.0942 -4.9132 -4.9132 -1.1568 -1.1568 -1.0002 -1.0002 -0.7702 -0.7702 -0.4454 -0.4454 -0.1996 -0.1996 -0.0358 -0.0358 0.4421 0.4421 0.8346 0.8346 1.6567 1.6567 1.6603 1.6603 1.7003 1.7003 2.0903 2.0903 2.3360 2.3360 2.6136 2.6136 2.6962 2.6962 2.7408 2.7408 2.7502 2.7503 2.8508 2.8508 3.1855 3.1855 3.2618 3.2618 3.3665 3.3665 3.8848 3.8848 3.8974 3.8974 3.9733 3.9733 4.0659 4.0659 4.3305 4.3305 4.4430 4.4430 4.5673 4.5673 4.8516 4.8516 5.0216 5.0216 11.3660 11.3660 11.3704 11.3704 11.7339 11.7339 11.7485 11.7485 k =-0.5000 0.3367 0.1099 ( 8156 PWs) bands (ev): -13.4784 -13.4784 -13.4405 -13.4405 -9.3217 -9.3217 -9.1176 -9.1176 -8.7602 -8.7602 -8.6815 -8.6815 -8.2047 -8.2047 -8.1561 -8.1561 -5.1014 -5.1014 -4.9079 -4.9079 -1.1517 -1.1517 -0.9775 -0.9775 -0.7862 -0.7862 -0.4679 -0.4679 -0.1736 -0.1736 -0.0276 -0.0276 0.4094 0.4094 0.8242 0.8242 1.6361 1.6361 1.6915 1.6915 1.7194 1.7194 2.1025 2.1025 2.3355 2.3355 2.6328 2.6328 2.6844 2.6844 2.7065 2.7065 2.7475 2.7475 2.8490 2.8490 3.2005 3.2005 3.2405 3.2405 3.3759 3.3759 3.8732 3.8732 3.8952 3.8952 3.9763 3.9763 4.0868 4.0868 4.3375 4.3375 4.4331 4.4331 4.5694 4.5694 4.8456 4.8456 5.0273 5.0273 11.3609 11.3609 11.3645 11.3645 11.7418 11.7418 11.7451 11.7451 k =-0.5000 0.3367 0.0942 ( 8162 PWs) bands (ev): -13.4795 -13.4795 -13.4393 -13.4393 -9.3269 -9.3269 -9.1106 -9.1106 -8.7633 -8.7633 -8.6797 -8.6797 -8.2060 -8.2060 -8.1547 -8.1547 -5.1078 -5.1078 -4.9032 -4.9032 -1.1467 -1.1467 -0.9549 -0.9549 -0.8001 -0.8001 -0.4897 -0.4897 -0.1500 -0.1500 -0.0211 -0.0211 0.3799 0.3799 0.8146 0.8146 1.6167 1.6167 1.7216 1.7216 1.7365 1.7365 2.1132 2.1132 2.3370 2.3370 2.6511 2.6511 2.6709 2.6709 2.6758 2.6758 2.7451 2.7451 2.8478 2.8478 3.2130 3.2130 3.2169 3.2169 3.3884 3.3884 3.8604 3.8605 3.8935 3.8935 3.9790 3.9790 4.1089 4.1089 4.3432 4.3432 4.4230 4.4230 4.5711 4.5711 4.8402 4.8402 5.0324 5.0324 11.3560 11.3560 11.3592 11.3592 11.7392 11.7392 11.7513 11.7513 k =-0.5000 0.3367 0.0785 ( 8160 PWs) bands (ev): -13.4804 -13.4804 -13.4384 -13.4384 -9.3313 -9.3313 -9.1046 -9.1046 -8.7661 -8.7661 -8.6782 -8.6782 -8.2072 -8.2072 -8.1535 -8.1535 -5.1133 -5.1133 -4.8993 -4.8993 -1.1419 -1.1419 -0.9329 -0.9329 -0.8120 -0.8120 -0.5103 -0.5103 -0.1292 -0.1292 -0.0161 -0.0161 0.3541 0.3541 0.8062 0.8062 1.5994 1.5994 1.7489 1.7489 1.7516 1.7516 2.1224 2.1224 2.3407 2.3407 2.6400 2.6400 2.6644 2.6644 2.6692 2.6692 2.7429 2.7429 2.8470 2.8470 3.1923 3.1923 3.2251 3.2251 3.4009 3.4009 3.8482 3.8482 3.8920 3.8920 3.9813 3.9813 4.1303 4.1303 4.3477 4.3477 4.4129 4.4129 4.5725 4.5725 4.8357 4.8357 5.0367 5.0367 11.3516 11.3516 11.3549 11.3549 11.7340 11.7340 11.7592 11.7592 k =-0.5000 0.3367 0.0628 ( 8170 PWs) bands (ev): -13.4812 -13.4812 -13.4376 -13.4376 -9.3350 -9.3350 -9.0995 -9.0995 -8.7684 -8.7684 -8.6769 -8.6769 -8.2082 -8.2082 -8.1525 -8.1525 -5.1179 -5.1179 -4.8960 -4.8960 -1.1376 -1.1376 -0.9124 -0.9124 -0.8218 -0.8218 -0.5293 -0.5293 -0.1116 -0.1116 -0.0124 -0.0124 0.3322 0.3322 0.7993 0.7993 1.5848 1.5848 1.7636 1.7636 1.7734 1.7734 2.1301 2.1301 2.3463 2.3463 2.6098 2.6098 2.6570 2.6570 2.6844 2.6844 2.7410 2.7410 2.8465 2.8465 3.1706 3.1706 3.2344 3.2344 3.4121 3.4121 3.8373 3.8373 3.8908 3.8908 3.9833 3.9833 4.1500 4.1500 4.3511 4.3511 4.4032 4.4032 4.5737 4.5737 4.8319 4.8319 5.0403 5.0403 11.3478 11.3478 11.3514 11.3514 11.7288 11.7288 11.7663 11.7663 k =-0.5000 0.3367 0.0471 ( 8164 PWs) bands (ev): -13.4818 -13.4818 -13.4370 -13.4370 -9.3379 -9.3379 -9.0955 -9.0955 -8.7703 -8.7703 -8.6759 -8.6759 -8.2089 -8.2089 -8.1517 -8.1517 -5.1215 -5.1215 -4.8935 -4.8935 -1.1341 -1.1341 -0.8943 -0.8943 -0.8295 -0.8295 -0.5458 -0.5458 -0.0975 -0.0975 -0.0098 -0.0098 0.3148 0.3148 0.7938 0.7938 1.5729 1.5729 1.7734 1.7734 1.7931 1.7931 2.1360 2.1360 2.3533 2.3533 2.5829 2.5829 2.6508 2.6508 2.6977 2.6977 2.7395 2.7395 2.8462 2.8462 3.1522 3.1522 3.2417 3.2417 3.4213 3.4213 3.8283 3.8283 3.8899 3.8899 3.9848 3.9848 4.1669 4.1669 4.3535 4.3535 4.3944 4.3944 4.5745 4.5745 4.8289 4.8289 5.0431 5.0431 11.3446 11.3446 11.3487 11.3487 11.7242 11.7242 11.7723 11.7723 k =-0.5000 0.3367 0.0314 ( 8162 PWs) bands (ev): -13.4822 -13.4822 -13.4365 -13.4365 -9.3399 -9.3399 -9.0926 -9.0926 -8.7717 -8.7717 -8.6752 -8.6752 -8.2095 -8.2095 -8.1511 -8.1511 -5.1241 -5.1241 -4.8916 -4.8916 -1.1314 -1.1314 -0.8800 -0.8800 -0.8350 -0.8350 -0.5590 -0.5590 -0.0873 -0.0873 -0.0081 -0.0081 0.3021 0.3021 0.7899 0.7899 1.5643 1.5643 1.7805 1.7805 1.8077 1.8077 2.1404 2.1404 2.3606 2.3606 2.5609 2.5609 2.6463 2.6463 2.7080 2.7080 2.7384 2.7384 2.8460 2.8460 3.1382 3.1382 3.2469 3.2469 3.4281 3.4281 3.8217 3.8217 3.8893 3.8893 3.9859 3.9859 4.1802 4.1802 4.3552 4.3552 4.3871 4.3871 4.5751 4.5751 4.8268 4.8268 5.0451 5.0451 11.3423 11.3423 11.3469 11.3469 11.7206 11.7206 11.7769 11.7769 k =-0.5000 0.3367 0.0157 ( 8154 PWs) bands (ev): -13.4825 -13.4825 -13.4363 -13.4363 -9.3412 -9.3412 -9.0908 -9.0908 -8.7725 -8.7725 -8.6747 -8.6747 -8.2098 -8.2098 -8.1508 -8.1508 -5.1257 -5.1257 -4.8906 -4.8906 -1.1298 -1.1298 -0.8707 -0.8707 -0.8382 -0.8382 -0.5675 -0.5675 -0.0810 -0.0810 -0.0072 -0.0072 0.2944 0.2944 0.7875 0.7875 1.5590 1.5590 1.7848 1.7848 1.8168 1.8168 2.1430 2.1430 2.3664 2.3664 2.5461 2.5461 2.6436 2.6436 2.7145 2.7145 2.7378 2.7378 2.8459 2.8459 3.1294 3.1294 3.2501 3.2501 3.4323 3.4323 3.8177 3.8177 3.8889 3.8889 3.9866 3.9866 4.1887 4.1887 4.3561 4.3561 4.3823 4.3823 4.5755 4.5755 4.8255 4.8255 5.0464 5.0464 11.3409 11.3409 11.3457 11.3457 11.7184 11.7184 11.7798 11.7798 k =-0.5000 0.3367 0.0000 ( 8142 PWs) bands (ev): -13.4825 -13.4825 -13.4362 -13.4362 -9.3416 -9.3416 -9.0902 -9.0902 -8.7728 -8.7728 -8.6746 -8.6746 -8.2099 -8.2099 -8.1507 -8.1507 -5.1262 -5.1262 -4.8902 -4.8902 -1.1292 -1.1292 -0.8674 -0.8674 -0.8393 -0.8393 -0.5705 -0.5705 -0.0789 -0.0789 -0.0069 -0.0069 0.2918 0.2918 0.7867 0.7867 1.5572 1.5572 1.7862 1.7862 1.8198 1.8198 2.1439 2.1439 2.3687 2.3687 2.5408 2.5408 2.6427 2.6427 2.7168 2.7168 2.7375 2.7375 2.8459 2.8459 3.1264 3.1264 3.2512 3.2512 3.4338 3.4338 3.8163 3.8163 3.8888 3.8888 3.9868 3.9868 4.1917 4.1917 4.3565 4.3565 4.3805 4.3805 4.5756 4.5756 4.8251 4.8251 5.0468 5.0468 11.3404 11.3404 11.3454 11.3454 11.7176 11.7176 11.7807 11.7807 k = 0.0000 0.0000 0.2826 ( 8206 PWs) bands (ev): -13.4874 -13.4874 -13.4874 -13.4874 -9.7341 -9.7341 -9.7341 -9.7341 -8.1152 -8.1152 -8.1152 -8.1152 -8.0306 -8.0306 -8.0306 -8.0306 -4.8668 -4.8668 -4.8668 -4.8668 -1.4570 -1.4570 -1.4570 -1.4570 -0.3156 -0.3156 -0.3156 -0.3156 -0.1587 -0.1587 -0.1587 -0.1587 0.7987 0.7987 0.7987 0.7987 0.9957 0.9957 0.9957 0.9957 1.7491 1.7491 1.7491 1.7491 2.2611 2.2611 2.2611 2.2611 2.4941 2.4941 2.4941 2.4941 2.9530 2.9530 2.9530 2.9530 3.2578 3.2578 3.2578 3.2578 3.6472 3.6472 3.6472 3.6472 4.0400 4.0400 4.0400 4.0400 4.2799 4.2799 4.2799 4.2799 4.7970 4.7970 4.7970 4.7970 4.9656 4.9656 4.9656 4.9656 10.0135 10.0135 10.0135 10.0135 10.8686 10.8686 10.8686 10.8686 k =-0.0135 0.0091 0.2826 ( 8186 PWs) bands (ev): -13.4874 -13.4874 -13.4874 -13.4874 -9.7336 -9.7336 -9.7336 -9.7336 -8.1153 -8.1153 -8.1153 -8.1153 -8.0315 -8.0315 -8.0315 -8.0315 -4.8671 -4.8671 -4.8671 -4.8671 -1.4563 -1.4563 -1.4563 -1.4563 -0.3159 -0.3159 -0.3159 -0.3159 -0.1590 -0.1590 -0.1590 -0.1590 0.7987 0.7987 0.7987 0.7987 0.9966 0.9966 0.9967 0.9967 1.7486 1.7486 1.7487 1.7487 2.2618 2.2618 2.2618 2.2618 2.4944 2.4944 2.4946 2.4946 2.9531 2.9531 2.9532 2.9532 3.2581 3.2581 3.2582 3.2582 3.6458 3.6458 3.6460 3.6460 4.0410 4.0410 4.0412 4.0412 4.2793 4.2793 4.2793 4.2793 4.7969 4.7969 4.7969 4.7969 4.9653 4.9653 4.9654 4.9654 10.0156 10.0156 10.0156 10.0156 10.8705 10.8705 10.8705 10.8705 k =-0.0270 0.0182 0.2826 ( 8190 PWs) bands (ev): -13.4872 -13.4872 -13.4872 -13.4872 -9.7320 -9.7320 -9.7320 -9.7320 -8.1156 -8.1156 -8.1156 -8.1156 -8.0341 -8.0341 -8.0341 -8.0341 -4.8680 -4.8680 -4.8679 -4.8679 -1.4543 -1.4543 -1.4542 -1.4542 -0.3169 -0.3169 -0.3168 -0.3168 -0.1598 -0.1598 -0.1597 -0.1597 0.7985 0.7985 0.7986 0.7986 0.9997 0.9997 0.9998 0.9998 1.7474 1.7474 1.7476 1.7476 2.2638 2.2638 2.2639 2.2639 2.4956 2.4956 2.4961 2.4961 2.9532 2.9532 2.9534 2.9534 3.2590 3.2590 3.2592 3.2592 3.6417 3.6417 3.6420 3.6420 4.0442 4.0442 4.0445 4.0445 4.2774 4.2774 4.2774 4.2774 4.7966 4.7966 4.7966 4.7966 4.9646 4.9646 4.9646 4.9646 10.0220 10.0220 10.0220 10.0220 10.8760 10.8760 10.8760 10.8760 k =-0.0405 0.0273 0.2826 ( 8186 PWs) bands (ev): -13.4870 -13.4870 -13.4870 -13.4870 -9.7292 -9.7292 -9.7292 -9.7292 -8.1162 -8.1162 -8.1162 -8.1162 -8.0384 -8.0384 -8.0384 -8.0384 -4.8694 -4.8694 -4.8693 -4.8693 -1.4510 -1.4510 -1.4508 -1.4508 -0.3186 -0.3186 -0.3185 -0.3185 -0.1611 -0.1611 -0.1611 -0.1611 0.7984 0.7984 0.7984 0.7984 1.0048 1.0048 1.0050 1.0050 1.7456 1.7456 1.7458 1.7458 2.2672 2.2672 2.2673 2.2673 2.4976 2.4976 2.4984 2.4984 2.9534 2.9534 2.9537 2.9537 3.2605 3.2605 3.2608 3.2608 3.6352 3.6352 3.6357 3.6357 4.0495 4.0495 4.0499 4.0499 4.2743 4.2743 4.2743 4.2743 4.7959 4.7959 4.7959 4.7959 4.9634 4.9634 4.9635 4.9635 10.0325 10.0325 10.0326 10.0326 10.8852 10.8852 10.8852 10.8852 k =-0.0541 0.0364 0.2826 ( 8188 PWs) bands (ev): -13.4866 -13.4866 -13.4866 -13.4866 -9.7254 -9.7254 -9.7254 -9.7254 -8.1171 -8.1171 -8.1171 -8.1171 -8.0444 -8.0444 -8.0444 -8.0444 -4.8713 -4.8713 -4.8713 -4.8713 -1.4463 -1.4463 -1.4461 -1.4461 -0.3210 -0.3210 -0.3208 -0.3208 -0.1632 -0.1632 -0.1631 -0.1631 0.7982 0.7982 0.7983 0.7983 1.0120 1.0120 1.0123 1.0123 1.7433 1.7433 1.7436 1.7436 2.2717 2.2717 2.2718 2.2718 2.5005 2.5005 2.5015 2.5015 2.9533 2.9533 2.9537 2.9537 3.2625 3.2625 3.2630 3.2630 3.6267 3.6267 3.6273 3.6273 4.0569 4.0569 4.0574 4.0574 4.2699 4.2699 4.2700 4.2700 4.7949 4.7949 4.7949 4.7949 4.9617 4.9617 4.9618 4.9618 10.0473 10.0473 10.0473 10.0473 10.8979 10.8979 10.8979 10.8979 k =-0.0676 0.0455 0.2826 ( 8200 PWs) bands (ev): -13.4862 -13.4862 -13.4862 -13.4862 -9.7205 -9.7205 -9.7205 -9.7205 -8.1181 -8.1181 -8.1181 -8.1181 -8.0521 -8.0521 -8.0521 -8.0521 -4.8738 -4.8738 -4.8737 -4.8737 -1.4403 -1.4403 -1.4400 -1.4400 -0.3240 -0.3240 -0.3238 -0.3238 -0.1660 -0.1660 -0.1659 -0.1659 0.7982 0.7982 0.7983 0.7983 1.0213 1.0213 1.0216 1.0216 1.7407 1.7407 1.7411 1.7411 2.2772 2.2772 2.2773 2.2773 2.5042 2.5042 2.5054 2.5054 2.9527 2.9527 2.9531 2.9531 3.2652 3.2652 3.2657 3.2657 3.6165 3.6165 3.6172 3.6172 4.0662 4.0662 4.0667 4.0667 4.2643 4.2643 4.2644 4.2644 4.7934 4.7934 4.7934 4.7934 4.9597 4.9597 4.9598 4.9598 10.0661 10.0661 10.0662 10.0662 10.9141 10.9141 10.9142 10.9142 k =-0.0811 0.0546 0.2826 ( 8196 PWs) bands (ev): -13.4856 -13.4856 -13.4856 -13.4856 -9.7145 -9.7145 -9.7145 -9.7145 -8.1194 -8.1194 -8.1194 -8.1194 -8.0614 -8.0614 -8.0614 -8.0614 -4.8767 -4.8767 -4.8767 -4.8767 -1.4330 -1.4330 -1.4327 -1.4327 -0.3276 -0.3276 -0.3274 -0.3274 -0.1696 -0.1696 -0.1696 -0.1696 0.7985 0.7985 0.7986 0.7986 1.0326 1.0326 1.0331 1.0331 1.7383 1.7383 1.7388 1.7388 2.2834 2.2834 2.2835 2.2835 2.5086 2.5086 2.5100 2.5100 2.9511 2.9511 2.9516 2.9516 3.2683 3.2683 3.2690 3.2690 3.6053 3.6053 3.6060 3.6060 4.0773 4.0773 4.0779 4.0779 4.2574 4.2574 4.2575 4.2575 4.7912 4.7912 4.7912 4.7912 4.9573 4.9573 4.9575 4.9575 10.0890 10.0890 10.0891 10.0891 10.9338 10.9338 10.9338 10.9338 k =-0.0946 0.0637 0.2826 ( 8200 PWs) bands (ev): -13.4850 -13.4850 -13.4850 -13.4850 -9.7075 -9.7075 -9.7075 -9.7075 -8.1209 -8.1209 -8.1209 -8.1209 -8.0724 -8.0724 -8.0724 -8.0724 -4.8801 -4.8801 -4.8801 -4.8801 -1.4244 -1.4244 -1.4240 -1.4240 -0.3319 -0.3319 -0.3316 -0.3316 -0.1743 -0.1743 -0.1743 -0.1743 0.7990 0.7990 0.7992 0.7992 1.0461 1.0461 1.0466 1.0466 1.7363 1.7363 1.7369 1.7369 2.2901 2.2901 2.2901 2.2901 2.5136 2.5136 2.5153 2.5153 2.9484 2.9484 2.9490 2.9490 3.2719 3.2719 3.2727 3.2727 3.5936 3.5936 3.5942 3.5942 4.0902 4.0902 4.0908 4.0908 4.2492 4.2492 4.2493 4.2493 4.7882 4.7882 4.7882 4.7882 4.9547 4.9547 4.9549 4.9549 10.1159 10.1159 10.1159 10.1159 10.9566 10.9566 10.9566 10.9566 k =-0.1081 0.0728 0.2826 ( 8198 PWs) bands (ev): -13.4843 -13.4843 -13.4843 -13.4843 -9.6994 -9.6994 -9.6994 -9.6994 -8.1226 -8.1226 -8.1226 -8.1226 -8.0850 -8.0850 -8.0849 -8.0849 -4.8840 -4.8840 -4.8839 -4.8839 -1.4145 -1.4145 -1.4141 -1.4141 -0.3368 -0.3368 -0.3365 -0.3365 -0.1800 -0.1800 -0.1800 -0.1800 0.8000 0.8000 0.8001 0.8001 1.0617 1.0617 1.0622 1.0622 1.7350 1.7350 1.7358 1.7358 2.2968 2.2968 2.2968 2.2968 2.5192 2.5192 2.5211 2.5211 2.9443 2.9443 2.9449 2.9449 3.2759 3.2759 3.2768 3.2768 3.5819 3.5819 3.5825 3.5825 4.1046 4.1046 4.1051 4.1051 4.2397 4.2397 4.2399 4.2399 4.7842 4.7842 4.7842 4.7842 4.9519 4.9519 4.9521 4.9521 10.1466 10.1466 10.1466 10.1466 10.9826 10.9826 10.9826 10.9826 k =-0.1216 0.0819 0.2826 ( 8182 PWs) bands (ev): -13.4835 -13.4835 -13.4835 -13.4835 -9.6902 -9.6902 -9.6902 -9.6902 -8.1245 -8.1245 -8.1244 -8.1244 -8.0991 -8.0991 -8.0990 -8.0990 -4.8882 -4.8882 -4.8881 -4.8881 -1.4035 -1.4035 -1.4031 -1.4031 -0.3422 -0.3422 -0.3419 -0.3419 -0.1868 -0.1868 -0.1868 -0.1868 0.8013 0.8013 0.8015 0.8015 1.0793 1.0793 1.0800 1.0800 1.7348 1.7348 1.7357 1.7357 2.3032 2.3032 2.3032 2.3032 2.5253 2.5253 2.5275 2.5275 2.9386 2.9386 2.9392 2.9392 3.2802 3.2802 3.2811 3.2811 3.5708 3.5708 3.5713 3.5713 4.1204 4.1204 4.1208 4.1208 4.2290 4.2290 4.2291 4.2291 4.7792 4.7792 4.7792 4.7792 4.9489 4.9489 4.9492 4.9492 10.1809 10.1809 10.1811 10.1811 11.0114 11.0114 11.0114 11.0114 k =-0.1351 0.0910 0.2826 ( 8166 PWs) bands (ev): -13.4827 -13.4827 -13.4827 -13.4827 -9.6800 -9.6800 -9.6800 -9.6800 -8.1265 -8.1265 -8.1265 -8.1265 -8.1147 -8.1147 -8.1146 -8.1146 -4.8928 -4.8928 -4.8927 -4.8927 -1.3913 -1.3913 -1.3909 -1.3909 -0.3482 -0.3482 -0.3479 -0.3479 -0.1948 -0.1948 -0.1948 -0.1948 0.8031 0.8031 0.8033 0.8033 1.0991 1.0991 1.0998 1.0998 1.7360 1.7360 1.7371 1.7371 2.3087 2.3087 2.3087 2.3087 2.5318 2.5318 2.5342 2.5342 2.9314 2.9314 2.9320 2.9320 3.2847 3.2847 3.2857 3.2857 3.5608 3.5608 3.5612 3.5612 4.1374 4.1374 4.1376 4.1376 4.2170 4.2170 4.2172 4.2172 4.7729 4.7729 4.7730 4.7730 4.9459 4.9459 4.9462 4.9462 10.2189 10.2189 10.2190 10.2190 11.0429 11.0429 11.0429 11.0429 k =-0.1486 0.1001 0.2826 ( 8174 PWs) bands (ev): -13.4818 -13.4818 -13.4818 -13.4818 -9.6688 -9.6688 -9.6688 -9.6688 -8.1320 -8.1320 -8.1320 -8.1320 -8.1285 -8.1285 -8.1283 -8.1283 -4.8977 -4.8977 -4.8976 -4.8976 -1.3780 -1.3780 -1.3776 -1.3776 -0.3548 -0.3548 -0.3544 -0.3544 -0.2038 -0.2038 -0.2037 -0.2037 0.8051 0.8051 0.8054 0.8054 1.1209 1.1209 1.1217 1.1217 1.7390 1.7390 1.7403 1.7403 2.3128 2.3128 2.3129 2.3129 2.5387 2.5387 2.5413 2.5413 2.9230 2.9230 2.9236 2.9236 3.2892 3.2892 3.2903 3.2903 3.5521 3.5521 3.5524 3.5524 4.1552 4.1552 4.1553 4.1553 4.2038 4.2038 4.2041 4.2041 4.7655 4.7655 4.7656 4.7656 4.9430 4.9430 4.9432 4.9432 10.2602 10.2602 10.2603 10.2603 11.0769 11.0769 11.0769 11.0769 k =-0.1622 0.1092 0.2826 ( 8176 PWs) bands (ev): -13.4808 -13.4808 -13.4808 -13.4808 -9.6566 -9.6566 -9.6566 -9.6566 -8.1503 -8.1503 -8.1502 -8.1502 -8.1310 -8.1310 -8.1309 -8.1309 -4.9028 -4.9028 -4.9027 -4.9027 -1.3639 -1.3639 -1.3635 -1.3635 -0.3618 -0.3618 -0.3614 -0.3614 -0.2138 -0.2138 -0.2137 -0.2137 0.8074 0.8074 0.8077 0.8077 1.1448 1.1448 1.1456 1.1456 1.7439 1.7439 1.7454 1.7454 2.3148 2.3148 2.3150 2.3150 2.5459 2.5459 2.5487 2.5487 2.9139 2.9139 2.9146 2.9146 3.2936 3.2936 3.2948 3.2948 3.5450 3.5450 3.5452 3.5452 4.1731 4.1731 4.1733 4.1733 4.1898 4.1898 4.1903 4.1903 4.7567 4.7567 4.7568 4.7568 4.9401 4.9401 4.9404 4.9404 10.3046 10.3046 10.3048 10.3048 11.1132 11.1132 11.1132 11.1132 k =-0.1757 0.1183 0.2826 ( 8170 PWs) bands (ev): -13.4797 -13.4797 -13.4797 -13.4797 -9.6434 -9.6434 -9.6433 -9.6433 -8.1700 -8.1700 -8.1700 -8.1700 -8.1334 -8.1334 -8.1334 -8.1334 -4.9081 -4.9081 -4.9080 -4.9080 -1.3489 -1.3489 -1.3485 -1.3485 -0.3692 -0.3692 -0.3688 -0.3688 -0.2245 -0.2245 -0.2243 -0.2243 0.8098 0.8098 0.8101 0.8101 1.1706 1.1706 1.1716 1.1716 1.7509 1.7509 1.7526 1.7526 2.3141 2.3141 2.3145 2.3145 2.5532 2.5532 2.5563 2.5563 2.9048 2.9048 2.9055 2.9055 3.2978 3.2978 3.2991 3.2991 3.5396 3.5396 3.5397 3.5397 4.1733 4.1733 4.1734 4.1734 4.1930 4.1930 4.1933 4.1933 4.7466 4.7466 4.7468 4.7468 4.9374 4.9374 4.9377 4.9377 10.3520 10.3520 10.3523 10.3523 11.1514 11.1514 11.1514 11.1514 k =-0.1892 0.1274 0.2826 ( 8156 PWs) bands (ev): -13.4787 -13.4787 -13.4787 -13.4787 -9.6292 -9.6292 -9.6291 -9.6291 -8.1911 -8.1911 -8.1910 -8.1910 -8.1360 -8.1360 -8.1359 -8.1359 -4.9136 -4.9136 -4.9135 -4.9135 -1.3333 -1.3333 -1.3329 -1.3329 -0.3770 -0.3770 -0.3766 -0.3766 -0.2357 -0.2357 -0.2355 -0.2355 0.8121 0.8121 0.8124 0.8124 1.1984 1.1984 1.1994 1.1994 1.7602 1.7602 1.7620 1.7620 2.3101 2.3101 2.3106 2.3106 2.5607 2.5607 2.5640 2.5640 2.8966 2.8966 2.8973 2.8973 3.3015 3.3015 3.3029 3.3029 3.5359 3.5359 3.5359 3.5359 4.1573 4.1573 4.1574 4.1574 4.2114 4.2114 4.2115 4.2115 4.7353 4.7353 4.7356 4.7356 4.9349 4.9349 4.9352 4.9352 10.4021 10.4021 10.4023 10.4023 11.1913 11.1913 11.1913 11.1913 k =-0.2027 0.1365 0.2826 ( 8160 PWs) bands (ev): -13.4776 -13.4776 -13.4775 -13.4775 -9.6140 -9.6140 -9.6140 -9.6140 -8.2133 -8.2133 -8.2132 -8.2132 -8.1386 -8.1386 -8.1386 -8.1386 -4.9192 -4.9192 -4.9191 -4.9191 -1.3172 -1.3172 -1.3168 -1.3168 -0.3851 -0.3851 -0.3847 -0.3847 -0.2471 -0.2471 -0.2468 -0.2468 0.8142 0.8142 0.8145 0.8145 1.2280 1.2280 1.2291 1.2291 1.7716 1.7716 1.7736 1.7736 2.3023 2.3023 2.3029 2.3029 2.5683 2.5683 2.5718 2.5718 2.8901 2.8901 2.8908 2.8908 3.3045 3.3045 3.3061 3.3061 3.5337 3.5337 3.5339 3.5339 4.1402 4.1402 4.1403 4.1403 4.2295 4.2295 4.2297 4.2297 4.7228 4.7228 4.7231 4.7231 4.9327 4.9327 4.9330 4.9330 10.4545 10.4545 10.4548 10.4548 11.2326 11.2326 11.2326 11.2326 k =-0.2162 0.1456 0.2826 ( 8162 PWs) bands (ev): -13.4764 -13.4764 -13.4764 -13.4764 -9.5980 -9.5980 -9.5980 -9.5980 -8.2366 -8.2366 -8.2366 -8.2366 -8.1413 -8.1413 -8.1413 -8.1413 -4.9248 -4.9248 -4.9247 -4.9247 -1.3008 -1.3008 -1.3005 -1.3005 -0.3934 -0.3934 -0.3930 -0.3930 -0.2584 -0.2584 -0.2581 -0.2581 0.8159 0.8159 0.8163 0.8163 1.2594 1.2594 1.2606 1.2606 1.7849 1.7849 1.7872 1.7872 2.2903 2.2903 2.2911 2.2911 2.5760 2.5760 2.5796 2.5796 2.8862 2.8862 2.8868 2.8868 3.3066 3.3066 3.3083 3.3083 3.5331 3.5331 3.5333 3.5333 4.1224 4.1224 4.1226 4.1226 4.2467 4.2467 4.2471 4.2471 4.7093 4.7093 4.7097 4.7097 4.9308 4.9308 4.9311 4.9311 10.5090 10.5090 10.5093 10.5093 11.2749 11.2749 11.2750 11.2750 k =-0.2297 0.1547 0.2826 ( 8162 PWs) bands (ev): -13.4752 -13.4752 -13.4752 -13.4752 -9.5810 -9.5810 -9.5810 -9.5810 -8.2610 -8.2610 -8.2609 -8.2609 -8.1441 -8.1441 -8.1440 -8.1440 -4.9305 -4.9305 -4.9304 -4.9304 -1.2844 -1.2844 -1.2841 -1.2841 -0.4020 -0.4020 -0.4015 -0.4015 -0.2693 -0.2693 -0.2689 -0.2689 0.8173 0.8173 0.8176 0.8176 1.2924 1.2924 1.2937 1.2937 1.7998 1.7998 1.8023 1.8023 2.2744 2.2744 2.2754 2.2754 2.5836 2.5836 2.5875 2.5875 2.8853 2.8853 2.8859 2.8859 3.3075 3.3075 3.3093 3.3093 3.5338 3.5338 3.5340 3.5340 4.1043 4.1043 4.1044 4.1044 4.2627 4.2627 4.2633 4.2633 4.6950 4.6950 4.6955 4.6955 4.9292 4.9292 4.9295 4.9295 10.5651 10.5651 10.5655 10.5655 11.3180 11.3180 11.3181 11.3181 k =-0.2432 0.1638 0.2826 ( 8172 PWs) bands (ev): -13.4741 -13.4741 -13.4741 -13.4741 -9.5633 -9.5633 -9.5632 -9.5632 -8.2863 -8.2863 -8.2862 -8.2862 -8.1469 -8.1469 -8.1468 -8.1468 -4.9361 -4.9361 -4.9360 -4.9360 -1.2682 -1.2682 -1.2680 -1.2680 -0.4106 -0.4106 -0.4102 -0.4102 -0.2794 -0.2794 -0.2789 -0.2789 0.8180 0.8180 0.8184 0.8184 1.3270 1.3270 1.3283 1.3283 1.8154 1.8154 1.8182 1.8182 2.2553 2.2553 2.2566 2.2566 2.5913 2.5913 2.5954 2.5954 2.8877 2.8877 2.8883 2.8883 3.3070 3.3070 3.3088 3.3088 3.5357 3.5357 3.5360 3.5360 4.0860 4.0860 4.0862 4.0862 4.2771 4.2771 4.2777 4.2777 4.6802 4.6802 4.6807 4.6807 4.9279 4.9279 4.9283 4.9283 10.6226 10.6226 10.6231 10.6231 11.3615 11.3615 11.3616 11.3616 k =-0.2568 0.1729 0.2826 ( 8170 PWs) bands (ev): -13.4729 -13.4729 -13.4729 -13.4729 -9.5447 -9.5447 -9.5447 -9.5447 -8.3124 -8.3124 -8.3123 -8.3123 -8.1496 -8.1496 -8.1496 -8.1496 -4.9416 -4.9416 -4.9415 -4.9415 -1.2525 -1.2525 -1.2523 -1.2523 -0.4193 -0.4193 -0.4189 -0.4189 -0.2883 -0.2883 -0.2877 -0.2877 0.8183 0.8183 0.8186 0.8186 1.3629 1.3629 1.3643 1.3643 1.8308 1.8308 1.8338 1.8338 2.2342 2.2342 2.2359 2.2359 2.5990 2.5990 2.6033 2.6033 2.8933 2.8933 2.8938 2.8938 3.3046 3.3046 3.3066 3.3066 3.5387 3.5387 3.5391 3.5391 4.0679 4.0679 4.0681 4.0681 4.2892 4.2892 4.2900 4.2900 4.6650 4.6650 4.6656 4.6656 4.9270 4.9270 4.9274 4.9274 10.6811 10.6811 10.6816 10.6816 11.4050 11.4050 11.4050 11.4050 k =-0.2703 0.1820 0.2826 ( 8174 PWs) bands (ev): -13.4717 -13.4717 -13.4717 -13.4717 -9.5254 -9.5254 -9.5253 -9.5253 -8.3392 -8.3392 -8.3391 -8.3391 -8.1524 -8.1524 -8.1524 -8.1524 -4.9470 -4.9470 -4.9470 -4.9470 -1.2375 -1.2375 -1.2373 -1.2373 -0.4280 -0.4280 -0.4276 -0.4276 -0.2956 -0.2956 -0.2950 -0.2950 0.8181 0.8181 0.8183 0.8183 1.4000 1.4000 1.4015 1.4015 1.8441 1.8441 1.8474 1.8474 2.2132 2.2132 2.2152 2.2152 2.6067 2.6067 2.6111 2.6111 2.9018 2.9018 2.9023 2.9023 3.3002 3.3002 3.3023 3.3023 3.5427 3.5427 3.5432 3.5432 4.0502 4.0502 4.0504 4.0504 4.2987 4.2987 4.2997 4.2997 4.6500 4.6500 4.6507 4.6507 4.9265 4.9265 4.9268 4.9268 10.7401 10.7401 10.7406 10.7406 11.4480 11.4480 11.4481 11.4481 k =-0.2838 0.1911 0.2826 ( 8166 PWs) bands (ev): -13.4706 -13.4706 -13.4705 -13.4705 -9.5054 -9.5054 -9.5053 -9.5053 -8.3667 -8.3667 -8.3666 -8.3666 -8.1551 -8.1551 -8.1551 -8.1551 -4.9523 -4.9523 -4.9522 -4.9522 -1.2235 -1.2235 -1.2233 -1.2233 -0.4366 -0.4366 -0.4362 -0.4362 -0.3011 -0.3011 -0.3004 -0.3004 0.8173 0.8173 0.8176 0.8176 1.4381 1.4381 1.4397 1.4397 1.8531 1.8531 1.8567 1.8567 2.1951 2.1951 2.1973 2.1973 2.6144 2.6144 2.6191 2.6191 2.9128 2.9128 2.9133 2.9133 3.2935 3.2935 3.2957 3.2957 3.5476 3.5476 3.5481 3.5481 4.0332 4.0332 4.0334 4.0334 4.3052 4.3052 4.3063 4.3063 4.6354 4.6354 4.6362 4.6362 4.9262 4.9262 4.9266 4.9266 10.7991 10.7991 10.7997 10.7997 11.4901 11.4901 11.4901 11.4901 k =-0.2973 0.2002 0.2826 ( 8182 PWs) bands (ev): -13.4694 -13.4694 -13.4694 -13.4694 -9.4847 -9.4847 -9.4847 -9.4847 -8.3946 -8.3946 -8.3945 -8.3945 -8.1578 -8.1578 -8.1578 -8.1578 -4.9574 -4.9574 -4.9573 -4.9573 -1.2106 -1.2106 -1.2105 -1.2105 -0.4450 -0.4450 -0.4447 -0.4447 -0.3045 -0.3045 -0.3038 -0.3038 0.8163 0.8163 0.8165 0.8165 1.4770 1.4770 1.4786 1.4786 1.8551 1.8551 1.8588 1.8588 2.1829 2.1829 2.1853 2.1853 2.6222 2.6222 2.6270 2.6270 2.9258 2.9258 2.9261 2.9261 3.2841 3.2841 3.2865 3.2865 3.5534 3.5534 3.5539 3.5539 4.0173 4.0173 4.0175 4.0175 4.3084 4.3084 4.3097 4.3097 4.6216 4.6216 4.6225 4.6225 4.9263 4.9263 4.9266 4.9266 10.8578 10.8578 10.8584 10.8584 11.5307 11.5307 11.5307 11.5307 k =-0.3108 0.2093 0.2826 ( 8186 PWs) bands (ev): -13.4683 -13.4683 -13.4683 -13.4683 -9.4636 -9.4636 -9.4635 -9.4635 -8.4229 -8.4229 -8.4228 -8.4228 -8.1604 -8.1604 -8.1604 -8.1604 -4.9623 -4.9623 -4.9622 -4.9622 -1.1992 -1.1992 -1.1991 -1.1991 -0.4533 -0.4533 -0.4529 -0.4529 -0.3056 -0.3056 -0.3048 -0.3048 0.8149 0.8149 0.8151 0.8151 1.5164 1.5164 1.5181 1.5181 1.8479 1.8479 1.8515 1.8515 2.1794 2.1794 2.1818 2.1818 2.6302 2.6302 2.6352 2.6352 2.9401 2.9401 2.9404 2.9404 3.2720 3.2720 3.2745 3.2745 3.5600 3.5600 3.5605 3.5605 4.0026 4.0026 4.0028 4.0028 4.3081 4.3081 4.3095 4.3095 4.6089 4.6089 4.6099 4.6099 4.9266 4.9266 4.9269 4.9269 10.9156 10.9156 10.9163 10.9163 11.5692 11.5692 11.5692 11.5692 k =-0.3243 0.2184 0.2826 ( 8186 PWs) bands (ev): -13.4672 -13.4672 -13.4672 -13.4672 -9.4420 -9.4420 -9.4419 -9.4419 -8.4514 -8.4514 -8.4513 -8.4513 -8.1629 -8.1629 -8.1629 -8.1629 -4.9669 -4.9669 -4.9668 -4.9668 -1.1892 -1.1892 -1.1892 -1.1892 -0.4612 -0.4612 -0.4609 -0.4609 -0.3044 -0.3044 -0.3036 -0.3036 0.8135 0.8135 0.8136 0.8136 1.5560 1.5560 1.5578 1.5578 1.8309 1.8309 1.8342 1.8342 2.1855 2.1855 2.1877 2.1877 2.6383 2.6383 2.6435 2.6435 2.9552 2.9552 2.9554 2.9554 3.2571 3.2571 3.2598 3.2598 3.5672 3.5672 3.5679 3.5679 3.9894 3.9894 3.9896 3.9896 4.3044 4.3044 4.3058 4.3058 4.5974 4.5974 4.5984 4.5984 4.9272 4.9272 4.9275 4.9275 10.9722 10.9722 10.9729 10.9729 11.6049 11.6049 11.6050 11.6050 k =-0.3378 0.2275 0.2826 ( 8182 PWs) bands (ev): -13.4662 -13.4662 -13.4662 -13.4662 -9.4201 -9.4201 -9.4200 -9.4200 -8.4799 -8.4799 -8.4798 -8.4798 -8.1653 -8.1653 -8.1653 -8.1653 -4.9712 -4.9712 -4.9712 -4.9712 -1.1809 -1.1809 -1.1809 -1.1809 -0.4688 -0.4688 -0.4685 -0.4685 -0.3008 -0.3008 -0.3000 -0.3000 0.8120 0.8120 0.8120 0.8120 1.5956 1.5956 1.5974 1.5974 1.8053 1.8053 1.8083 1.8083 2.2000 2.2000 2.2020 2.2020 2.6467 2.6467 2.6520 2.6520 2.9706 2.9706 2.9707 2.9707 3.2394 3.2394 3.2422 3.2422 3.5752 3.5752 3.5759 3.5759 3.9777 3.9777 3.9779 3.9779 4.2974 4.2974 4.2989 4.2989 4.5872 4.5872 4.5883 4.5883 4.9280 4.9280 4.9282 4.9282 11.0271 11.0271 11.0278 11.0278 11.6370 11.6370 11.6371 11.6371 k =-0.3514 0.2366 0.2826 ( 8198 PWs) bands (ev): -13.4652 -13.4652 -13.4652 -13.4652 -9.3980 -9.3980 -9.3979 -9.3979 -8.5083 -8.5083 -8.5082 -8.5082 -8.1676 -8.1676 -8.1676 -8.1676 -4.9753 -4.9753 -4.9752 -4.9752 -1.1742 -1.1742 -1.1741 -1.1741 -0.4760 -0.4760 -0.4758 -0.4758 -0.2951 -0.2951 -0.2942 -0.2942 0.8106 0.8106 0.8106 0.8106 1.6348 1.6348 1.6366 1.6366 1.7737 1.7737 1.7762 1.7762 2.2207 2.2207 2.2223 2.2223 2.6555 2.6555 2.6610 2.6610 2.9858 2.9858 2.9858 2.9858 3.2189 3.2189 3.2219 3.2219 3.5838 3.5838 3.5845 3.5845 3.9677 3.9677 3.9678 3.9678 4.2877 4.2877 4.2892 4.2892 4.5782 4.5782 4.5792 4.5792 4.9289 4.9289 4.9291 4.9291 11.0799 11.0799 11.0806 11.0806 11.6648 11.6648 11.6650 11.6650 k =-0.3649 0.2457 0.2826 ( 8204 PWs) bands (ev): -13.4643 -13.4643 -13.4643 -13.4643 -9.3758 -9.3758 -9.3758 -9.3758 -8.5363 -8.5363 -8.5362 -8.5362 -8.1697 -8.1697 -8.1697 -8.1697 -4.9791 -4.9791 -4.9790 -4.9790 -1.1689 -1.1689 -1.1688 -1.1688 -0.4828 -0.4828 -0.4825 -0.4825 -0.2874 -0.2874 -0.2866 -0.2866 0.8095 0.8095 0.8095 0.8095 1.6731 1.6731 1.6749 1.6749 1.7384 1.7384 1.7405 1.7405 2.2452 2.2452 2.2466 2.2466 2.6647 2.6647 2.6703 2.6703 3.0004 3.0004 3.0004 3.0004 3.1960 3.1960 3.1991 3.1991 3.5928 3.5928 3.5936 3.5936 3.9592 3.9592 3.9593 3.9593 4.2758 4.2758 4.2773 4.2773 4.5700 4.5700 4.5711 4.5711 4.9299 4.9299 4.9301 4.9301 11.1302 11.1302 11.1309 11.1309 11.6875 11.6875 11.6877 11.6877 k =-0.3784 0.2548 0.2826 ( 8188 PWs) bands (ev): -13.4635 -13.4635 -13.4635 -13.4635 -9.3539 -9.3539 -9.3539 -9.3539 -8.5637 -8.5637 -8.5636 -8.5636 -8.1717 -8.1717 -8.1717 -8.1717 -4.9825 -4.9825 -4.9824 -4.9824 -1.1650 -1.1650 -1.1649 -1.1649 -0.4891 -0.4891 -0.4888 -0.4888 -0.2782 -0.2782 -0.2774 -0.2774 0.8086 0.8086 0.8087 0.8087 1.7007 1.7007 1.7025 1.7025 1.7108 1.7108 1.7126 1.7126 2.2718 2.2718 2.2730 2.2730 2.6746 2.6746 2.6803 2.6803 3.0140 3.0140 3.0141 3.0141 3.1709 3.1709 3.1742 3.1742 3.6022 3.6022 3.6030 3.6030 3.9523 3.9523 3.9524 3.9524 4.2624 4.2624 4.2639 4.2639 4.5626 4.5626 4.5636 4.5636 4.9310 4.9310 4.9312 4.9312 11.1777 11.1777 11.1783 11.1783 11.7046 11.7046 11.7049 11.7049 k =-0.3919 0.2639 0.2826 ( 8184 PWs) bands (ev): -13.4627 -13.4627 -13.4627 -13.4627 -9.3324 -9.3324 -9.3324 -9.3324 -8.5902 -8.5902 -8.5901 -8.5901 -8.1735 -8.1735 -8.1735 -8.1735 -4.9856 -4.9856 -4.9855 -4.9855 -1.1623 -1.1623 -1.1622 -1.1622 -0.4948 -0.4948 -0.4946 -0.4946 -0.2679 -0.2679 -0.2671 -0.2671 0.8082 0.8082 0.8083 0.8083 1.6640 1.6640 1.6655 1.6655 1.7457 1.7457 1.7475 1.7475 2.2990 2.2990 2.3000 2.3000 2.6851 2.6851 2.6909 2.6909 3.0265 3.0265 3.0266 3.0266 3.1441 3.1441 3.1475 3.1475 3.6117 3.6117 3.6126 3.6126 3.9467 3.9467 3.9467 3.9467 4.2483 4.2483 4.2498 4.2498 4.5557 4.5557 4.5567 4.5567 4.9321 4.9321 4.9323 4.9323 11.2219 11.2219 11.2225 11.2225 11.7162 11.7162 11.7165 11.7165 k =-0.4054 0.2730 0.2826 ( 8172 PWs) bands (ev): -13.4620 -13.4620 -13.4620 -13.4620 -9.3117 -9.3117 -9.3117 -9.3117 -8.6154 -8.6154 -8.6154 -8.6154 -8.1751 -8.1751 -8.1751 -8.1751 -4.9883 -4.9883 -4.9883 -4.9883 -1.1606 -1.1606 -1.1605 -1.1605 -0.4999 -0.4999 -0.4998 -0.4998 -0.2569 -0.2569 -0.2562 -0.2562 0.8081 0.8081 0.8082 0.8082 1.6280 1.6280 1.6293 1.6293 1.7788 1.7788 1.7805 1.7805 2.3255 2.3255 2.3263 2.3263 2.6965 2.6965 2.7022 2.7022 3.0375 3.0375 3.0377 3.0377 3.1162 3.1162 3.1198 3.1198 3.6212 3.6212 3.6220 3.6220 3.9423 3.9423 3.9423 3.9423 4.2342 4.2342 4.2356 4.2356 4.5493 4.5493 4.5502 4.5502 4.9332 4.9332 4.9334 4.9334 11.2627 11.2627 11.2633 11.2633 11.7226 11.7226 11.7230 11.7230 k =-0.4189 0.2821 0.2826 ( 8174 PWs) bands (ev): -13.4614 -13.4614 -13.4614 -13.4614 -9.2921 -9.2921 -9.2921 -9.2921 -8.6390 -8.6390 -8.6389 -8.6389 -8.1766 -8.1766 -8.1765 -8.1765 -4.9907 -4.9907 -4.9907 -4.9907 -1.1597 -1.1597 -1.1596 -1.1596 -0.5045 -0.5045 -0.5043 -0.5043 -0.2459 -0.2459 -0.2452 -0.2452 0.8085 0.8085 0.8086 0.8086 1.5943 1.5943 1.5954 1.5954 1.8091 1.8091 1.8107 1.8107 2.3505 2.3505 2.3512 2.3512 2.7086 2.7086 2.7142 2.7142 3.0471 3.0471 3.0473 3.0473 3.0879 3.0879 3.0915 3.0915 3.6303 3.6303 3.6311 3.6311 3.9389 3.9389 3.9390 3.9390 4.2206 4.2206 4.2219 4.2219 4.5433 4.5433 4.5441 4.5441 4.9342 4.9342 4.9344 4.9344 11.2997 11.2997 11.3002 11.3002 11.7248 11.7248 11.7252 11.7252 k =-0.4324 0.2912 0.2826 ( 8186 PWs) bands (ev): -13.4608 -13.4608 -13.4608 -13.4608 -9.2741 -9.2741 -9.2740 -9.2740 -8.6604 -8.6604 -8.6604 -8.6604 -8.1778 -8.1778 -8.1778 -8.1778 -4.9928 -4.9928 -4.9927 -4.9927 -1.1594 -1.1594 -1.1593 -1.1593 -0.5084 -0.5084 -0.5082 -0.5082 -0.2354 -0.2354 -0.2348 -0.2348 0.8091 0.8091 0.8093 0.8093 1.5639 1.5639 1.5647 1.5647 1.8361 1.8361 1.8376 1.8376 2.3732 2.3732 2.3737 2.3737 2.7214 2.7214 2.7268 2.7268 3.0546 3.0546 3.0548 3.0548 3.0605 3.0605 3.0638 3.0638 3.6387 3.6387 3.6395 3.6395 3.9364 3.9364 3.9364 3.9364 4.2082 4.2082 4.2094 4.2094 4.5378 4.5378 4.5385 4.5385 4.9352 4.9352 4.9353 4.9353 11.3325 11.3325 11.3329 11.3329 11.7237 11.7237 11.7241 11.7241 k =-0.4459 0.3003 0.2826 ( 8172 PWs) bands (ev): -13.4604 -13.4604 -13.4604 -13.4604 -9.2581 -9.2581 -9.2581 -9.2581 -8.6792 -8.6792 -8.6792 -8.6792 -8.1788 -8.1788 -8.1788 -8.1788 -4.9944 -4.9944 -4.9944 -4.9944 -1.1594 -1.1594 -1.1593 -1.1593 -0.5116 -0.5116 -0.5115 -0.5115 -0.2259 -0.2259 -0.2254 -0.2254 0.8100 0.8100 0.8101 0.8101 1.5376 1.5376 1.5383 1.5383 1.8592 1.8592 1.8604 1.8604 2.3927 2.3927 2.3932 2.3932 2.7346 2.7346 2.7396 2.7396 3.0330 3.0330 3.0365 3.0365 3.0617 3.0617 3.0619 3.0619 3.6462 3.6462 3.6469 3.6469 3.9346 3.9346 3.9346 3.9346 4.1975 4.1975 4.1985 4.1985 4.5330 4.5330 4.5336 4.5336 4.9360 4.9360 4.9361 4.9361 11.3607 11.3607 11.3610 11.3610 11.7206 11.7206 11.7209 11.7209 k =-0.4595 0.3094 0.2826 ( 8174 PWs) bands (ev): -13.4601 -13.4601 -13.4601 -13.4601 -9.2448 -9.2448 -9.2448 -9.2448 -8.6947 -8.6947 -8.6947 -8.6947 -8.1796 -8.1796 -8.1796 -8.1796 -4.9957 -4.9957 -4.9957 -4.9957 -1.1595 -1.1595 -1.1595 -1.1595 -0.5141 -0.5141 -0.5140 -0.5140 -0.2180 -0.2180 -0.2176 -0.2176 0.8109 0.8109 0.8111 0.8111 1.5162 1.5162 1.5167 1.5167 1.8778 1.8778 1.8788 1.8788 2.4086 2.4086 2.4090 2.4090 2.7475 2.7475 2.7519 2.7519 3.0092 3.0092 3.0124 3.0124 3.0665 3.0665 3.0667 3.0667 3.6524 3.6524 3.6529 3.6529 3.9333 3.9333 3.9333 3.9333 4.1887 4.1887 4.1895 4.1895 4.5290 4.5290 4.5295 4.5295 4.9367 4.9367 4.9367 4.9367 11.3836 11.3836 11.3838 11.3838 11.7165 11.7165 11.7168 11.7168 k =-0.4730 0.3185 0.2826 ( 8180 PWs) bands (ev): -13.4598 -13.4598 -13.4598 -13.4598 -9.2348 -9.2348 -9.2348 -9.2348 -8.7063 -8.7063 -8.7063 -8.7063 -8.1802 -8.1802 -8.1802 -8.1802 -4.9967 -4.9967 -4.9967 -4.9967 -1.1598 -1.1598 -1.1597 -1.1597 -0.5159 -0.5159 -0.5158 -0.5158 -0.2119 -0.2119 -0.2117 -0.2117 0.8118 0.8118 0.8119 0.8119 1.5005 1.5005 1.5008 1.5008 1.8915 1.8915 1.8922 1.8922 2.4204 2.4204 2.4206 2.4206 2.7592 2.7592 2.7625 2.7625 2.9898 2.9898 2.9923 2.9923 3.0700 3.0700 3.0701 3.0701 3.6571 3.6571 3.6574 3.6574 3.9325 3.9325 3.9325 3.9325 4.1823 4.1823 4.1829 4.1829 4.5260 4.5260 4.5263 4.5263 4.9372 4.9372 4.9372 4.9372 11.4007 11.4007 11.4009 11.4009 11.7126 11.7126 11.7128 11.7128 k =-0.4865 0.3276 0.2826 ( 8184 PWs) bands (ev): -13.4597 -13.4597 -13.4597 -13.4597 -9.2285 -9.2285 -9.2285 -9.2285 -8.7136 -8.7136 -8.7136 -8.7136 -8.1805 -8.1805 -8.1805 -8.1805 -4.9972 -4.9972 -4.9972 -4.9972 -1.1600 -1.1600 -1.1599 -1.1599 -0.5170 -0.5170 -0.5169 -0.5169 -0.2082 -0.2082 -0.2080 -0.2080 0.8124 0.8124 0.8124 0.8124 1.4908 1.4908 1.4910 1.4910 1.9000 1.9000 1.9003 1.9003 2.4276 2.4276 2.4277 2.4277 2.7679 2.7679 2.7697 2.7697 2.9771 2.9771 2.9785 2.9785 3.0720 3.0720 3.0721 3.0721 3.6600 3.6600 3.6602 3.6602 3.9320 3.9320 3.9320 3.9320 4.1785 4.1785 4.1788 4.1788 4.5242 4.5242 4.5243 4.5243 4.9375 4.9375 4.9375 4.9375 11.4114 11.4114 11.4115 11.4115 11.7098 11.7098 11.7099 11.7099 k =-0.5000 0.3367 0.2826 ( 8172 PWs) bands (ev): -13.4596 -13.4596 -13.4596 -13.4596 -9.2264 -9.2264 -9.2264 -9.2264 -8.7160 -8.7160 -8.7160 -8.7160 -8.1806 -8.1806 -8.1806 -8.1806 -4.9974 -4.9974 -4.9974 -4.9974 -1.1600 -1.1600 -1.1600 -1.1600 -0.5173 -0.5173 -0.5173 -0.5173 -0.2068 -0.2068 -0.2068 -0.2068 0.8126 0.8126 0.8126 0.8126 1.4876 1.4876 1.4876 1.4876 1.9030 1.9030 1.9030 1.9030 2.4301 2.4301 2.4301 2.4301 2.7717 2.7717 2.7717 2.7717 2.9731 2.9731 2.9731 2.9731 3.0727 3.0727 3.0727 3.0727 3.6611 3.6611 3.6611 3.6611 3.9319 3.9319 3.9319 3.9319 4.1773 4.1773 4.1773 4.1773 4.5236 4.5236 4.5236 4.5236 4.9376 4.9376 4.9376 4.9376 11.4150 11.4150 11.4150 11.4150 11.7088 11.7088 11.7088 11.7088 Writing output data file Al4CN3O.save init_run : 1.60s CPU 0.98s WALL ( 1 calls) electrons : 846.94s CPU 716.46s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.01s WALL ( 1 calls) potinit : 0.27s CPU 0.21s WALL ( 1 calls) Called by electrons: c_bands : 846.92s CPU 716.44s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.03s CPU 0.01s WALL ( 1 calls) newd : 0.45s CPU 0.24s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.59s CPU 0.58s WALL ( 314 calls) cegterg : 680.43s CPU 624.29s WALL ( 526 calls) Called by sum_band: Called by *egterg: h_psi : 503.07s CPU 387.00s WALL ( 8026 calls) s_psi : 32.31s CPU 27.17s WALL ( 8026 calls) g_psi : 0.37s CPU 0.39s WALL ( 7186 calls) cdiaghg : 238.86s CPU 233.75s WALL ( 7500 calls) cegterg:over : 23.98s CPU 24.03s WALL ( 7186 calls) cegterg:upda : 14.57s CPU 14.92s WALL ( 7186 calls) cegterg:last : 7.83s CPU 7.92s WALL ( 1154 calls) cdiaghg:chol : 9.42s CPU 9.19s WALL ( 7500 calls) cdiaghg:inve : 7.31s CPU 7.12s WALL ( 7500 calls) cdiaghg:para : 15.28s CPU 15.27s WALL ( 15000 calls) Called by h_psi: h_psi:vloc : 428.17s CPU 322.85s WALL ( 8026 calls) h_psi:vnl : 74.41s CPU 63.72s WALL ( 8026 calls) add_vuspsi : 39.23s CPU 33.20s WALL ( 8026 calls) General routines calbec : 35.10s CPU 30.49s WALL ( 8026 calls) fft : 0.16s CPU 0.08s WALL ( 19 calls) ffts : 0.03s CPU 0.02s WALL ( 4 calls) fftw : 416.06s CPU 312.33s WALL ( 1349228 calls) interpolate : 0.04s CPU 0.02s WALL ( 4 calls) davcio : 0.30s CPU 1.41s WALL ( 628 calls) Parallel routines fft_scatter : 256.65s CPU 221.40s WALL ( 1349251 calls) PWSCF : 15m19.35s CPU 13m52.33s WALL This run was terminated on: 0: 6:51 21Mar2017 =------------------------------------------------------------------------------= JOB DONE. 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