Program PWSCF v.5.4.0 starts on 3Aug2017 at 18:54:15 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 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./H4C3N4.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: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 81 45 12 4056 1702 252 Max 82 46 13 4060 1730 257 Sum 2933 1653 467 146075 61683 9199 bravais-lattice index = 14 lattice parameter (alat) = 9.8738 a.u. unit-cell volume = 1462.5546 (a.u.)^3 number of atoms/cell = 22 number of atomic types = 3 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.873818 celldm(2)= 1.180096 celldm(3)= 1.354833 celldm(4)= 0.104008 celldm(5)= 0.226991 celldm(6)= 0.211154 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.249182 1.153488 0.000000 ) a(3) = ( 0.307535 0.077728 1.317176 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.216025 -0.220733 ) b(2) = ( 0.000000 0.866936 -0.051159 ) b(3) = ( 0.000000 0.000000 0.759200 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 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. # 3 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 H 1.00 1.00790 H( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 234 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.5000000 -0.1080125 -0.1103664), wk = 0.0042735 k( 2) = ( 0.4843750 -0.1046371 -0.1069175), wk = 0.0042735 k( 3) = ( 0.4687500 -0.1012617 -0.1034685), wk = 0.0042735 k( 4) = ( 0.4531250 -0.0978863 -0.1000196), wk = 0.0042735 k( 5) = ( 0.4375000 -0.0945109 -0.0965706), wk = 0.0042735 k( 6) = ( 0.4218750 -0.0911355 -0.0931217), wk = 0.0042735 k( 7) = ( 0.4062500 -0.0877601 -0.0896727), wk = 0.0042735 k( 8) = ( 0.3906250 -0.0843848 -0.0862238), wk = 0.0042735 k( 9) = ( 0.3750000 -0.0810094 -0.0827748), wk = 0.0042735 k( 10) = ( 0.3593750 -0.0776340 -0.0793259), wk = 0.0042735 k( 11) = ( 0.3437500 -0.0742586 -0.0758769), wk = 0.0042735 k( 12) = ( 0.3281250 -0.0708832 -0.0724280), wk = 0.0042735 k( 13) = ( 0.3125000 -0.0675078 -0.0689790), wk = 0.0042735 k( 14) = ( 0.2968750 -0.0641324 -0.0655301), wk = 0.0042735 k( 15) = ( 0.2812500 -0.0607570 -0.0620811), wk = 0.0042735 k( 16) = ( 0.2656250 -0.0573816 -0.0586322), wk = 0.0042735 k( 17) = ( 0.2500000 -0.0540062 -0.0551832), wk = 0.0042735 k( 18) = ( 0.2343750 -0.0506309 -0.0517343), wk = 0.0042735 k( 19) = ( 0.2187500 -0.0472555 -0.0482853), wk = 0.0042735 k( 20) = ( 0.2031250 -0.0438801 -0.0448364), wk = 0.0042735 k( 21) = ( 0.1875000 -0.0405047 -0.0413874), wk = 0.0042735 k( 22) = ( 0.1718750 -0.0371293 -0.0379385), wk = 0.0042735 k( 23) = ( 0.1562500 -0.0337539 -0.0344895), wk = 0.0042735 k( 24) = ( 0.1406250 -0.0303785 -0.0310406), wk = 0.0042735 k( 25) = ( 0.1250000 -0.0270031 -0.0275916), wk = 0.0042735 k( 26) = ( 0.1093750 -0.0236277 -0.0241427), wk = 0.0042735 k( 27) = ( 0.0937500 -0.0202523 -0.0206937), wk = 0.0042735 k( 28) = ( 0.0781250 -0.0168770 -0.0172448), wk = 0.0042735 k( 29) = ( 0.0625000 -0.0135016 -0.0137958), wk = 0.0042735 k( 30) = ( 0.0468750 -0.0101262 -0.0103469), wk = 0.0042735 k( 31) = ( 0.0312500 -0.0067508 -0.0068979), wk = 0.0042735 k( 32) = ( 0.0156250 -0.0033754 -0.0034490), wk = 0.0042735 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 35) = ( 0.0000000 0.0160544 -0.0009474), wk = 0.0042735 k( 36) = ( 0.0000000 0.0321087 -0.0018948), wk = 0.0042735 k( 37) = ( 0.0000000 0.0481631 -0.0028422), wk = 0.0042735 k( 38) = ( 0.0000000 0.0642175 -0.0037896), wk = 0.0042735 k( 39) = ( 0.0000000 0.0802718 -0.0047369), wk = 0.0042735 k( 40) = ( 0.0000000 0.0963262 -0.0056843), wk = 0.0042735 k( 41) = ( 0.0000000 0.1123806 -0.0066317), wk = 0.0042735 k( 42) = ( 0.0000000 0.1284350 -0.0075791), wk = 0.0042735 k( 43) = ( 0.0000000 0.1444893 -0.0085265), wk = 0.0042735 k( 44) = ( 0.0000000 0.1605437 -0.0094739), wk = 0.0042735 k( 45) = ( 0.0000000 0.1765981 -0.0104213), wk = 0.0042735 k( 46) = ( 0.0000000 0.1926524 -0.0113687), wk = 0.0042735 k( 47) = ( 0.0000000 0.2087068 -0.0123161), wk = 0.0042735 k( 48) = ( 0.0000000 0.2247612 -0.0132635), wk = 0.0042735 k( 49) = ( 0.0000000 0.2408155 -0.0142108), wk = 0.0042735 k( 50) = ( 0.0000000 0.2568699 -0.0151582), wk = 0.0042735 k( 51) = ( 0.0000000 0.2729243 -0.0161056), wk = 0.0042735 k( 52) = ( 0.0000000 0.2889786 -0.0170530), wk = 0.0042735 k( 53) = ( 0.0000000 0.3050330 -0.0180004), wk = 0.0042735 k( 54) = ( 0.0000000 0.3210874 -0.0189478), wk = 0.0042735 k( 55) = ( 0.0000000 0.3371417 -0.0198952), wk = 0.0042735 k( 56) = ( 0.0000000 0.3531961 -0.0208426), wk = 0.0042735 k( 57) = ( 0.0000000 0.3692505 -0.0217900), wk = 0.0042735 k( 58) = ( 0.0000000 0.3853048 -0.0227373), wk = 0.0042735 k( 59) = ( 0.0000000 0.4013592 -0.0236847), wk = 0.0042735 k( 60) = ( 0.0000000 0.4174136 -0.0246321), wk = 0.0042735 k( 61) = ( 0.0000000 0.4334680 -0.0255795), wk = 0.0042735 k( 62) = ( 0.5000000 0.3254555 -0.1359459), wk = 0.0042735 k( 63) = ( 0.4864865 0.3166594 -0.1322717), wk = 0.0042735 k( 64) = ( 0.4729730 0.3078633 -0.1285975), wk = 0.0042735 k( 65) = ( 0.4594595 0.2990672 -0.1249233), wk = 0.0042735 k( 66) = ( 0.4459459 0.2902711 -0.1212491), wk = 0.0042735 k( 67) = ( 0.4324324 0.2814750 -0.1175749), wk = 0.0042735 k( 68) = ( 0.4189189 0.2726789 -0.1139006), wk = 0.0042735 k( 69) = ( 0.4054054 0.2638828 -0.1102264), wk = 0.0042735 k( 70) = ( 0.3918919 0.2550867 -0.1065522), wk = 0.0042735 k( 71) = ( 0.3783784 0.2462906 -0.1028780), wk = 0.0042735 k( 72) = ( 0.3648649 0.2374945 -0.0992038), wk = 0.0042735 k( 73) = ( 0.3513514 0.2286984 -0.0955296), wk = 0.0042735 k( 74) = ( 0.3378378 0.2199023 -0.0918554), wk = 0.0042735 k( 75) = ( 0.3243243 0.2111063 -0.0881811), wk = 0.0042735 k( 76) = ( 0.3108108 0.2023102 -0.0845069), wk = 0.0042735 k( 77) = ( 0.2972973 0.1935141 -0.0808327), wk = 0.0042735 k( 78) = ( 0.2837838 0.1847180 -0.0771585), wk = 0.0042735 k( 79) = ( 0.2702703 0.1759219 -0.0734843), wk = 0.0042735 k( 80) = ( 0.2567568 0.1671258 -0.0698101), wk = 0.0042735 k( 81) = ( 0.2432432 0.1583297 -0.0661359), wk = 0.0042735 k( 82) = ( 0.2297297 0.1495336 -0.0624616), wk = 0.0042735 k( 83) = ( 0.2162162 0.1407375 -0.0587874), wk = 0.0042735 k( 84) = ( 0.2027027 0.1319414 -0.0551132), wk = 0.0042735 k( 85) = ( 0.1891892 0.1231453 -0.0514390), wk = 0.0042735 k( 86) = ( 0.1756757 0.1143492 -0.0477648), wk = 0.0042735 k( 87) = ( 0.1621622 0.1055531 -0.0440906), wk = 0.0042735 k( 88) = ( 0.1486486 0.0967570 -0.0404164), wk = 0.0042735 k( 89) = ( 0.1351351 0.0879609 -0.0367421), wk = 0.0042735 k( 90) = ( 0.1216216 0.0791648 -0.0330679), wk = 0.0042735 k( 91) = ( 0.1081081 0.0703688 -0.0293937), wk = 0.0042735 k( 92) = ( 0.0945946 0.0615727 -0.0257195), wk = 0.0042735 k( 93) = ( 0.0810811 0.0527766 -0.0220453), wk = 0.0042735 k( 94) = ( 0.0675676 0.0439805 -0.0183711), wk = 0.0042735 k( 95) = ( 0.0540540 0.0351844 -0.0146969), wk = 0.0042735 k( 96) = ( 0.0405405 0.0263883 -0.0110226), wk = 0.0042735 k( 97) = ( 0.0270270 0.0175922 -0.0073484), wk = 0.0042735 k( 98) = ( 0.0135135 0.0087961 -0.0036742), wk = 0.0042735 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 101) = ( 0.0000000 0.0000000 0.0165044), wk = 0.0042735 k( 102) = ( 0.0000000 0.0000000 0.0330087), wk = 0.0042735 k( 103) = ( 0.0000000 0.0000000 0.0495131), wk = 0.0042735 k( 104) = ( 0.0000000 0.0000000 0.0660174), wk = 0.0042735 k( 105) = ( 0.0000000 0.0000000 0.0825218), wk = 0.0042735 k( 106) = ( 0.0000000 0.0000000 0.0990261), wk = 0.0042735 k( 107) = ( 0.0000000 0.0000000 0.1155305), wk = 0.0042735 k( 108) = ( 0.0000000 0.0000000 0.1320348), wk = 0.0042735 k( 109) = ( 0.0000000 0.0000000 0.1485392), wk = 0.0042735 k( 110) = ( 0.0000000 0.0000000 0.1650435), wk = 0.0042735 k( 111) = ( 0.0000000 0.0000000 0.1815479), wk = 0.0042735 k( 112) = ( 0.0000000 0.0000000 0.1980522), wk = 0.0042735 k( 113) = ( 0.0000000 0.0000000 0.2145566), wk = 0.0042735 k( 114) = ( 0.0000000 0.0000000 0.2310609), wk = 0.0042735 k( 115) = ( 0.0000000 0.0000000 0.2475653), wk = 0.0042735 k( 116) = ( 0.0000000 0.0000000 0.2640696), wk = 0.0042735 k( 117) = ( 0.0000000 0.0000000 0.2805740), wk = 0.0042735 k( 118) = ( 0.0000000 0.0000000 0.2970783), wk = 0.0042735 k( 119) = ( 0.0000000 0.0000000 0.3135827), wk = 0.0042735 k( 120) = ( 0.0000000 0.0000000 0.3300870), wk = 0.0042735 k( 121) = ( 0.0000000 0.0000000 0.3465914), wk = 0.0042735 k( 122) = ( 0.0000000 0.0000000 0.3630957), wk = 0.0042735 k( 123) = ( 0.0000000 0.0000000 0.3796001), wk = 0.0042735 k( 124) = ( 0.5000000 -0.1080125 0.2692337), wk = 0.0042735 k( 125) = ( 0.4857143 -0.1049264 0.2615413), wk = 0.0042735 k( 126) = ( 0.4714286 -0.1018403 0.2538489), wk = 0.0042735 k( 127) = ( 0.4571429 -0.0987543 0.2461565), wk = 0.0042735 k( 128) = ( 0.4428571 -0.0956682 0.2384641), wk = 0.0042735 k( 129) = ( 0.4285714 -0.0925821 0.2307717), wk = 0.0042735 k( 130) = ( 0.4142857 -0.0894961 0.2230793), wk = 0.0042735 k( 131) = ( 0.4000000 -0.0864100 0.2153869), wk = 0.0042735 k( 132) = ( 0.3857143 -0.0833239 0.2076946), wk = 0.0042735 k( 133) = ( 0.3714286 -0.0802378 0.2000022), wk = 0.0042735 k( 134) = ( 0.3571429 -0.0771518 0.1923098), wk = 0.0042735 k( 135) = ( 0.3428571 -0.0740657 0.1846174), wk = 0.0042735 k( 136) = ( 0.3285714 -0.0709796 0.1769250), wk = 0.0042735 k( 137) = ( 0.3142857 -0.0678936 0.1692326), wk = 0.0042735 k( 138) = ( 0.3000000 -0.0648075 0.1615402), wk = 0.0042735 k( 139) = ( 0.2857143 -0.0617214 0.1538478), wk = 0.0042735 k( 140) = ( 0.2714286 -0.0586353 0.1461554), wk = 0.0042735 k( 141) = ( 0.2571429 -0.0555493 0.1384630), wk = 0.0042735 k( 142) = ( 0.2428571 -0.0524632 0.1307706), wk = 0.0042735 k( 143) = ( 0.2285714 -0.0493771 0.1230783), wk = 0.0042735 k( 144) = ( 0.2142857 -0.0462911 0.1153859), wk = 0.0042735 k( 145) = ( 0.2000000 -0.0432050 0.1076935), wk = 0.0042735 k( 146) = ( 0.1857143 -0.0401189 0.1000011), wk = 0.0042735 k( 147) = ( 0.1714286 -0.0370329 0.0923087), wk = 0.0042735 k( 148) = ( 0.1571429 -0.0339468 0.0846163), wk = 0.0042735 k( 149) = ( 0.1428571 -0.0308607 0.0769239), wk = 0.0042735 k( 150) = ( 0.1285714 -0.0277746 0.0692315), wk = 0.0042735 k( 151) = ( 0.1142857 -0.0246886 0.0615391), wk = 0.0042735 k( 152) = ( 0.1000000 -0.0216025 0.0538467), wk = 0.0042735 k( 153) = ( 0.0857143 -0.0185164 0.0461543), wk = 0.0042735 k( 154) = ( 0.0714286 -0.0154304 0.0384620), wk = 0.0042735 k( 155) = ( 0.0571429 -0.0123443 0.0307696), wk = 0.0042735 k( 156) = ( 0.0428571 -0.0092582 0.0230772), wk = 0.0042735 k( 157) = ( 0.0285714 -0.0061721 0.0153848), wk = 0.0042735 k( 158) = ( 0.0142857 -0.0030861 0.0076924), wk = 0.0042735 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 161) = ( 0.0000000 0.0127491 0.0104124), wk = 0.0042735 k( 162) = ( 0.0000000 0.0254981 0.0208247), wk = 0.0042735 k( 163) = ( 0.0000000 0.0382472 0.0312371), wk = 0.0042735 k( 164) = ( 0.0000000 0.0509962 0.0416495), wk = 0.0042735 k( 165) = ( 0.0000000 0.0637453 0.0520618), wk = 0.0042735 k( 166) = ( 0.0000000 0.0764943 0.0624742), wk = 0.0042735 k( 167) = ( 0.0000000 0.0892434 0.0728866), wk = 0.0042735 k( 168) = ( 0.0000000 0.1019925 0.0832990), wk = 0.0042735 k( 169) = ( 0.0000000 0.1147415 0.0937113), wk = 0.0042735 k( 170) = ( 0.0000000 0.1274906 0.1041237), wk = 0.0042735 k( 171) = ( 0.0000000 0.1402396 0.1145361), wk = 0.0042735 k( 172) = ( 0.0000000 0.1529887 0.1249484), wk = 0.0042735 k( 173) = ( 0.0000000 0.1657377 0.1353608), wk = 0.0042735 k( 174) = ( 0.0000000 0.1784868 0.1457732), wk = 0.0042735 k( 175) = ( 0.0000000 0.1912359 0.1561856), wk = 0.0042735 k( 176) = ( 0.0000000 0.2039849 0.1665979), wk = 0.0042735 k( 177) = ( 0.0000000 0.2167340 0.1770103), wk = 0.0042735 k( 178) = ( 0.0000000 0.2294830 0.1874227), wk = 0.0042735 k( 179) = ( 0.0000000 0.2422321 0.1978350), wk = 0.0042735 k( 180) = ( 0.0000000 0.2549812 0.2082474), wk = 0.0042735 k( 181) = ( 0.0000000 0.2677302 0.2186598), wk = 0.0042735 k( 182) = ( 0.0000000 0.2804793 0.2290721), wk = 0.0042735 k( 183) = ( 0.0000000 0.2932283 0.2394845), wk = 0.0042735 k( 184) = ( 0.0000000 0.3059774 0.2498969), wk = 0.0042735 k( 185) = ( 0.0000000 0.3187264 0.2603093), wk = 0.0042735 k( 186) = ( 0.0000000 0.3314755 0.2707216), wk = 0.0042735 k( 187) = ( 0.0000000 0.3442246 0.2811340), wk = 0.0042735 k( 188) = ( 0.0000000 0.3569736 0.2915464), wk = 0.0042735 k( 189) = ( 0.0000000 0.3697227 0.3019587), wk = 0.0042735 k( 190) = ( 0.0000000 0.3824717 0.3123711), wk = 0.0042735 k( 191) = ( 0.0000000 0.3952208 0.3227835), wk = 0.0042735 k( 192) = ( 0.0000000 0.4079698 0.3331959), wk = 0.0042735 k( 193) = ( 0.0000000 0.4207189 0.3436082), wk = 0.0042735 k( 194) = ( 0.0000000 0.4334680 0.3540206), wk = 0.0042735 k( 195) = ( 0.5000000 0.3254555 0.2436542), wk = 0.0042735 k( 196) = ( 0.4871795 0.3171105 0.2374066), wk = 0.0042735 k( 197) = ( 0.4743590 0.3087654 0.2311591), wk = 0.0042735 k( 198) = ( 0.4615385 0.3004204 0.2249115), wk = 0.0042735 k( 199) = ( 0.4487179 0.2920754 0.2186640), wk = 0.0042735 k( 200) = ( 0.4358974 0.2837304 0.2124165), wk = 0.0042735 k( 201) = ( 0.4230769 0.2753854 0.2061689), wk = 0.0042735 k( 202) = ( 0.4102564 0.2670404 0.1999214), wk = 0.0042735 k( 203) = ( 0.3974359 0.2586954 0.1936738), wk = 0.0042735 k( 204) = ( 0.3846154 0.2503504 0.1874263), wk = 0.0042735 k( 205) = ( 0.3717949 0.2420054 0.1811787), wk = 0.0042735 k( 206) = ( 0.3589744 0.2336603 0.1749312), wk = 0.0042735 k( 207) = ( 0.3461538 0.2253153 0.1686837), wk = 0.0042735 k( 208) = ( 0.3333333 0.2169703 0.1624361), wk = 0.0042735 k( 209) = ( 0.3205128 0.2086253 0.1561886), wk = 0.0042735 k( 210) = ( 0.3076923 0.2002803 0.1499410), wk = 0.0042735 k( 211) = ( 0.2948718 0.1919353 0.1436935), wk = 0.0042735 k( 212) = ( 0.2820513 0.1835903 0.1374459), wk = 0.0042735 k( 213) = ( 0.2692308 0.1752453 0.1311984), wk = 0.0042735 k( 214) = ( 0.2564103 0.1669002 0.1249509), wk = 0.0042735 k( 215) = ( 0.2435897 0.1585552 0.1187033), wk = 0.0042735 k( 216) = ( 0.2307692 0.1502102 0.1124558), wk = 0.0042735 k( 217) = ( 0.2179487 0.1418652 0.1062082), wk = 0.0042735 k( 218) = ( 0.2051282 0.1335202 0.0999607), wk = 0.0042735 k( 219) = ( 0.1923077 0.1251752 0.0937131), wk = 0.0042735 k( 220) = ( 0.1794872 0.1168302 0.0874656), wk = 0.0042735 k( 221) = ( 0.1666667 0.1084852 0.0812181), wk = 0.0042735 k( 222) = ( 0.1538461 0.1001401 0.0749705), wk = 0.0042735 k( 223) = ( 0.1410256 0.0917951 0.0687230), wk = 0.0042735 k( 224) = ( 0.1282051 0.0834501 0.0624754), wk = 0.0042735 k( 225) = ( 0.1153846 0.0751051 0.0562279), wk = 0.0042735 k( 226) = ( 0.1025641 0.0667601 0.0499803), wk = 0.0042735 k( 227) = ( 0.0897436 0.0584151 0.0437328), wk = 0.0042735 k( 228) = ( 0.0769231 0.0500701 0.0374853), wk = 0.0042735 k( 229) = ( 0.0641026 0.0417251 0.0312377), wk = 0.0042735 k( 230) = ( 0.0512821 0.0333800 0.0249902), wk = 0.0042735 k( 231) = ( 0.0384615 0.0250350 0.0187426), wk = 0.0042735 k( 232) = ( 0.0256410 0.0166900 0.0124951), wk = 0.0042735 k( 233) = ( 0.0128205 0.0083450 0.0062475), wk = 0.0042735 k( 234) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 cryst. coord. k( 1) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0042735 k( 2) = ( 0.4843750 -0.0000000 0.0000000), wk = 0.0042735 k( 3) = ( 0.4687500 -0.0000000 -0.0000000), wk = 0.0042735 k( 4) = ( 0.4531250 -0.0000000 0.0000000), wk = 0.0042735 k( 5) = ( 0.4375000 0.0000000 -0.0000000), wk = 0.0042735 k( 6) = ( 0.4218750 -0.0000000 0.0000000), wk = 0.0042735 k( 7) = ( 0.4062500 0.0000000 -0.0000000), wk = 0.0042735 k( 8) = ( 0.3906250 -0.0000000 0.0000000), wk = 0.0042735 k( 9) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0042735 k( 10) = ( 0.3593750 -0.0000000 -0.0000000), wk = 0.0042735 k( 11) = ( 0.3437500 0.0000000 0.0000000), wk = 0.0042735 k( 12) = ( 0.3281250 -0.0000000 -0.0000000), wk = 0.0042735 k( 13) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0042735 k( 14) = ( 0.2968750 -0.0000000 -0.0000000), wk = 0.0042735 k( 15) = ( 0.2812500 -0.0000000 0.0000000), wk = 0.0042735 k( 16) = ( 0.2656250 -0.0000000 0.0000000), wk = 0.0042735 k( 17) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0042735 k( 18) = ( 0.2343750 -0.0000000 -0.0000000), wk = 0.0042735 k( 19) = ( 0.2187500 0.0000000 -0.0000000), wk = 0.0042735 k( 20) = ( 0.2031250 0.0000000 -0.0000000), wk = 0.0042735 k( 21) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0042735 k( 22) = ( 0.1718750 0.0000000 0.0000000), wk = 0.0042735 k( 23) = ( 0.1562500 0.0000000 0.0000000), wk = 0.0042735 k( 24) = ( 0.1406250 -0.0000000 0.0000000), wk = 0.0042735 k( 25) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0042735 k( 26) = ( 0.1093750 0.0000000 -0.0000000), wk = 0.0042735 k( 27) = ( 0.0937500 -0.0000000 -0.0000000), wk = 0.0042735 k( 28) = ( 0.0781250 0.0000000 0.0000000), wk = 0.0042735 k( 29) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0042735 k( 30) = ( 0.0468750 -0.0000000 -0.0000000), wk = 0.0042735 k( 31) = ( 0.0312500 0.0000000 0.0000000), wk = 0.0042735 k( 32) = ( 0.0156250 0.0000000 0.0000000), wk = 0.0042735 k( 33) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 34) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 35) = ( 0.0000000 0.0185185 0.0000000), wk = 0.0042735 k( 36) = ( 0.0000000 0.0370370 0.0000000), wk = 0.0042735 k( 37) = ( 0.0000000 0.0555556 0.0000000), wk = 0.0042735 k( 38) = ( 0.0000000 0.0740741 -0.0000000), wk = 0.0042735 k( 39) = ( 0.0000000 0.0925926 0.0000000), wk = 0.0042735 k( 40) = ( 0.0000000 0.1111111 -0.0000000), wk = 0.0042735 k( 41) = ( 0.0000000 0.1296296 -0.0000000), wk = 0.0042735 k( 42) = ( 0.0000000 0.1481482 0.0000000), wk = 0.0042735 k( 43) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0042735 k( 44) = ( 0.0000000 0.1851852 -0.0000000), wk = 0.0042735 k( 45) = ( 0.0000000 0.2037037 -0.0000000), wk = 0.0042735 k( 46) = ( 0.0000000 0.2222222 -0.0000000), wk = 0.0042735 k( 47) = ( 0.0000000 0.2407407 0.0000000), wk = 0.0042735 k( 48) = ( 0.0000000 0.2592593 -0.0000000), wk = 0.0042735 k( 49) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0042735 k( 50) = ( 0.0000000 0.2962963 0.0000000), wk = 0.0042735 k( 51) = ( 0.0000000 0.3148148 0.0000000), wk = 0.0042735 k( 52) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0042735 k( 53) = ( 0.0000000 0.3518519 0.0000000), wk = 0.0042735 k( 54) = ( 0.0000000 0.3703704 -0.0000000), wk = 0.0042735 k( 55) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0042735 k( 56) = ( 0.0000000 0.4074074 0.0000000), wk = 0.0042735 k( 57) = ( 0.0000000 0.4259259 -0.0000000), wk = 0.0042735 k( 58) = ( 0.0000000 0.4444444 -0.0000000), wk = 0.0042735 k( 59) = ( 0.0000000 0.4629630 0.0000000), wk = 0.0042735 k( 60) = ( 0.0000000 0.4814815 0.0000000), wk = 0.0042735 k( 61) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0042735 k( 62) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0042735 k( 63) = ( 0.4864865 0.4864865 -0.0000000), wk = 0.0042735 k( 64) = ( 0.4729730 0.4729730 0.0000000), wk = 0.0042735 k( 65) = ( 0.4594595 0.4594595 -0.0000000), wk = 0.0042735 k( 66) = ( 0.4459459 0.4459459 0.0000000), wk = 0.0042735 k( 67) = ( 0.4324324 0.4324324 0.0000000), wk = 0.0042735 k( 68) = ( 0.4189189 0.4189189 0.0000000), wk = 0.0042735 k( 69) = ( 0.4054054 0.4054054 0.0000000), wk = 0.0042735 k( 70) = ( 0.3918919 0.3918919 -0.0000000), wk = 0.0042735 k( 71) = ( 0.3783784 0.3783784 0.0000000), wk = 0.0042735 k( 72) = ( 0.3648649 0.3648649 0.0000000), wk = 0.0042735 k( 73) = ( 0.3513514 0.3513514 0.0000000), wk = 0.0042735 k( 74) = ( 0.3378378 0.3378378 -0.0000000), wk = 0.0042735 k( 75) = ( 0.3243243 0.3243243 -0.0000000), wk = 0.0042735 k( 76) = ( 0.3108108 0.3108108 0.0000000), wk = 0.0042735 k( 77) = ( 0.2972973 0.2972973 0.0000000), wk = 0.0042735 k( 78) = ( 0.2837838 0.2837838 0.0000000), wk = 0.0042735 k( 79) = ( 0.2702703 0.2702703 0.0000000), wk = 0.0042735 k( 80) = ( 0.2567568 0.2567568 -0.0000000), wk = 0.0042735 k( 81) = ( 0.2432432 0.2432432 -0.0000000), wk = 0.0042735 k( 82) = ( 0.2297297 0.2297297 -0.0000000), wk = 0.0042735 k( 83) = ( 0.2162162 0.2162162 0.0000000), wk = 0.0042735 k( 84) = ( 0.2027027 0.2027027 0.0000000), wk = 0.0042735 k( 85) = ( 0.1891892 0.1891892 0.0000000), wk = 0.0042735 k( 86) = ( 0.1756757 0.1756757 0.0000000), wk = 0.0042735 k( 87) = ( 0.1621622 0.1621622 -0.0000000), wk = 0.0042735 k( 88) = ( 0.1486486 0.1486486 0.0000000), wk = 0.0042735 k( 89) = ( 0.1351351 0.1351351 -0.0000000), wk = 0.0042735 k( 90) = ( 0.1216216 0.1216216 -0.0000000), wk = 0.0042735 k( 91) = ( 0.1081081 0.1081081 0.0000000), wk = 0.0042735 k( 92) = ( 0.0945946 0.0945946 0.0000000), wk = 0.0042735 k( 93) = ( 0.0810811 0.0810811 -0.0000000), wk = 0.0042735 k( 94) = ( 0.0675676 0.0675676 -0.0000000), wk = 0.0042735 k( 95) = ( 0.0540540 0.0540540 0.0000000), wk = 0.0042735 k( 96) = ( 0.0405405 0.0405405 -0.0000000), wk = 0.0042735 k( 97) = ( 0.0270270 0.0270270 0.0000000), wk = 0.0042735 k( 98) = ( 0.0135135 0.0135135 -0.0000000), wk = 0.0042735 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 100) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 101) = ( 0.0000000 0.0000000 0.0217391), wk = 0.0042735 k( 102) = ( 0.0000000 0.0000000 0.0434783), wk = 0.0042735 k( 103) = ( 0.0000000 0.0000000 0.0652174), wk = 0.0042735 k( 104) = ( 0.0000000 0.0000000 0.0869565), wk = 0.0042735 k( 105) = ( 0.0000000 0.0000000 0.1086957), wk = 0.0042735 k( 106) = ( 0.0000000 0.0000000 0.1304348), wk = 0.0042735 k( 107) = ( 0.0000000 0.0000000 0.1521739), wk = 0.0042735 k( 108) = ( 0.0000000 0.0000000 0.1739130), wk = 0.0042735 k( 109) = ( 0.0000000 0.0000000 0.1956522), wk = 0.0042735 k( 110) = ( 0.0000000 0.0000000 0.2173913), wk = 0.0042735 k( 111) = ( 0.0000000 0.0000000 0.2391304), wk = 0.0042735 k( 112) = ( 0.0000000 0.0000000 0.2608696), wk = 0.0042735 k( 113) = ( 0.0000000 0.0000000 0.2826087), wk = 0.0042735 k( 114) = ( 0.0000000 0.0000000 0.3043478), wk = 0.0042735 k( 115) = ( 0.0000000 0.0000000 0.3260870), wk = 0.0042735 k( 116) = ( 0.0000000 0.0000000 0.3478261), wk = 0.0042735 k( 117) = ( 0.0000000 0.0000000 0.3695652), wk = 0.0042735 k( 118) = ( 0.0000000 0.0000000 0.3913044), wk = 0.0042735 k( 119) = ( 0.0000000 0.0000000 0.4130435), wk = 0.0042735 k( 120) = ( 0.0000000 0.0000000 0.4347826), wk = 0.0042735 k( 121) = ( 0.0000000 0.0000000 0.4565217), wk = 0.0042735 k( 122) = ( 0.0000000 0.0000000 0.4782609), wk = 0.0042735 k( 123) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0042735 k( 124) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0042735 k( 125) = ( 0.4857143 -0.0000000 0.4857143), wk = 0.0042735 k( 126) = ( 0.4714286 -0.0000000 0.4714286), wk = 0.0042735 k( 127) = ( 0.4571429 0.0000000 0.4571429), wk = 0.0042735 k( 128) = ( 0.4428571 -0.0000000 0.4428571), wk = 0.0042735 k( 129) = ( 0.4285714 -0.0000000 0.4285714), wk = 0.0042735 k( 130) = ( 0.4142857 0.0000000 0.4142857), wk = 0.0042735 k( 131) = ( 0.4000000 -0.0000000 0.4000000), wk = 0.0042735 k( 132) = ( 0.3857143 0.0000000 0.3857143), wk = 0.0042735 k( 133) = ( 0.3714286 -0.0000000 0.3714286), wk = 0.0042735 k( 134) = ( 0.3571429 -0.0000000 0.3571429), wk = 0.0042735 k( 135) = ( 0.3428571 -0.0000000 0.3428571), wk = 0.0042735 k( 136) = ( 0.3285714 -0.0000000 0.3285714), wk = 0.0042735 k( 137) = ( 0.3142857 0.0000000 0.3142857), wk = 0.0042735 k( 138) = ( 0.3000000 0.0000000 0.3000000), wk = 0.0042735 k( 139) = ( 0.2857143 -0.0000000 0.2857143), wk = 0.0042735 k( 140) = ( 0.2714286 -0.0000000 0.2714286), wk = 0.0042735 k( 141) = ( 0.2571429 -0.0000000 0.2571429), wk = 0.0042735 k( 142) = ( 0.2428571 0.0000000 0.2428571), wk = 0.0042735 k( 143) = ( 0.2285714 0.0000000 0.2285714), wk = 0.0042735 k( 144) = ( 0.2142857 -0.0000000 0.2142857), wk = 0.0042735 k( 145) = ( 0.2000000 -0.0000000 0.2000000), wk = 0.0042735 k( 146) = ( 0.1857143 -0.0000000 0.1857143), wk = 0.0042735 k( 147) = ( 0.1714286 -0.0000000 0.1714286), wk = 0.0042735 k( 148) = ( 0.1571429 0.0000000 0.1571429), wk = 0.0042735 k( 149) = ( 0.1428571 -0.0000000 0.1428571), wk = 0.0042735 k( 150) = ( 0.1285714 -0.0000000 0.1285714), wk = 0.0042735 k( 151) = ( 0.1142857 0.0000000 0.1142857), wk = 0.0042735 k( 152) = ( 0.1000000 -0.0000000 0.1000000), wk = 0.0042735 k( 153) = ( 0.0857143 -0.0000000 0.0857143), wk = 0.0042735 k( 154) = ( 0.0714286 -0.0000000 0.0714286), wk = 0.0042735 k( 155) = ( 0.0571429 -0.0000000 0.0571429), wk = 0.0042735 k( 156) = ( 0.0428571 -0.0000000 0.0428571), wk = 0.0042735 k( 157) = ( 0.0285714 -0.0000000 0.0285714), wk = 0.0042735 k( 158) = ( 0.0142857 -0.0000000 0.0142857), wk = 0.0042735 k( 159) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 160) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 k( 161) = ( 0.0000000 0.0147059 0.0147059), wk = 0.0042735 k( 162) = ( 0.0000000 0.0294118 0.0294118), wk = 0.0042735 k( 163) = ( 0.0000000 0.0441177 0.0441177), wk = 0.0042735 k( 164) = ( 0.0000000 0.0588235 0.0588235), wk = 0.0042735 k( 165) = ( 0.0000000 0.0735294 0.0735294), wk = 0.0042735 k( 166) = ( 0.0000000 0.0882353 0.0882353), wk = 0.0042735 k( 167) = ( 0.0000000 0.1029412 0.1029412), wk = 0.0042735 k( 168) = ( 0.0000000 0.1176471 0.1176471), wk = 0.0042735 k( 169) = ( 0.0000000 0.1323529 0.1323529), wk = 0.0042735 k( 170) = ( 0.0000000 0.1470588 0.1470588), wk = 0.0042735 k( 171) = ( 0.0000000 0.1617647 0.1617647), wk = 0.0042735 k( 172) = ( 0.0000000 0.1764706 0.1764706), wk = 0.0042735 k( 173) = ( 0.0000000 0.1911765 0.1911765), wk = 0.0042735 k( 174) = ( 0.0000000 0.2058823 0.2058823), wk = 0.0042735 k( 175) = ( 0.0000000 0.2205882 0.2205882), wk = 0.0042735 k( 176) = ( 0.0000000 0.2352941 0.2352941), wk = 0.0042735 k( 177) = ( 0.0000000 0.2500000 0.2500000), wk = 0.0042735 k( 178) = ( 0.0000000 0.2647059 0.2647059), wk = 0.0042735 k( 179) = ( 0.0000000 0.2794118 0.2794118), wk = 0.0042735 k( 180) = ( 0.0000000 0.2941177 0.2941177), wk = 0.0042735 k( 181) = ( 0.0000000 0.3088235 0.3088235), wk = 0.0042735 k( 182) = ( 0.0000000 0.3235294 0.3235294), wk = 0.0042735 k( 183) = ( 0.0000000 0.3382353 0.3382353), wk = 0.0042735 k( 184) = ( 0.0000000 0.3529412 0.3529412), wk = 0.0042735 k( 185) = ( 0.0000000 0.3676471 0.3676471), wk = 0.0042735 k( 186) = ( 0.0000000 0.3823529 0.3823529), wk = 0.0042735 k( 187) = ( 0.0000000 0.3970588 0.3970588), wk = 0.0042735 k( 188) = ( 0.0000000 0.4117647 0.4117647), wk = 0.0042735 k( 189) = ( 0.0000000 0.4264706 0.4264706), wk = 0.0042735 k( 190) = ( 0.0000000 0.4411765 0.4411765), wk = 0.0042735 k( 191) = ( 0.0000000 0.4558823 0.4558824), wk = 0.0042735 k( 192) = ( 0.0000000 0.4705882 0.4705882), wk = 0.0042735 k( 193) = ( 0.0000000 0.4852941 0.4852941), wk = 0.0042735 k( 194) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0042735 k( 195) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0042735 k( 196) = ( 0.4871795 0.4871795 0.4871795), wk = 0.0042735 k( 197) = ( 0.4743590 0.4743590 0.4743590), wk = 0.0042735 k( 198) = ( 0.4615385 0.4615385 0.4615385), wk = 0.0042735 k( 199) = ( 0.4487179 0.4487179 0.4487180), wk = 0.0042735 k( 200) = ( 0.4358974 0.4358974 0.4358974), wk = 0.0042735 k( 201) = ( 0.4230769 0.4230769 0.4230769), wk = 0.0042735 k( 202) = ( 0.4102564 0.4102564 0.4102564), wk = 0.0042735 k( 203) = ( 0.3974359 0.3974359 0.3974359), wk = 0.0042735 k( 204) = ( 0.3846154 0.3846154 0.3846154), wk = 0.0042735 k( 205) = ( 0.3717949 0.3717949 0.3717949), wk = 0.0042735 k( 206) = ( 0.3589744 0.3589744 0.3589744), wk = 0.0042735 k( 207) = ( 0.3461538 0.3461538 0.3461538), wk = 0.0042735 k( 208) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0042735 k( 209) = ( 0.3205128 0.3205128 0.3205128), wk = 0.0042735 k( 210) = ( 0.3076923 0.3076923 0.3076923), wk = 0.0042735 k( 211) = ( 0.2948718 0.2948718 0.2948718), wk = 0.0042735 k( 212) = ( 0.2820513 0.2820513 0.2820513), wk = 0.0042735 k( 213) = ( 0.2692308 0.2692308 0.2692308), wk = 0.0042735 k( 214) = ( 0.2564103 0.2564103 0.2564103), wk = 0.0042735 k( 215) = ( 0.2435897 0.2435897 0.2435897), wk = 0.0042735 k( 216) = ( 0.2307692 0.2307692 0.2307692), wk = 0.0042735 k( 217) = ( 0.2179487 0.2179487 0.2179487), wk = 0.0042735 k( 218) = ( 0.2051282 0.2051282 0.2051282), wk = 0.0042735 k( 219) = ( 0.1923077 0.1923077 0.1923077), wk = 0.0042735 k( 220) = ( 0.1794872 0.1794872 0.1794872), wk = 0.0042735 k( 221) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0042735 k( 222) = ( 0.1538461 0.1538461 0.1538461), wk = 0.0042735 k( 223) = ( 0.1410256 0.1410256 0.1410256), wk = 0.0042735 k( 224) = ( 0.1282051 0.1282051 0.1282051), wk = 0.0042735 k( 225) = ( 0.1153846 0.1153846 0.1153846), wk = 0.0042735 k( 226) = ( 0.1025641 0.1025641 0.1025641), wk = 0.0042735 k( 227) = ( 0.0897436 0.0897436 0.0897436), wk = 0.0042735 k( 228) = ( 0.0769231 0.0769231 0.0769231), wk = 0.0042735 k( 229) = ( 0.0641026 0.0641026 0.0641026), wk = 0.0042735 k( 230) = ( 0.0512821 0.0512821 0.0512821), wk = 0.0042735 k( 231) = ( 0.0384615 0.0384615 0.0384615), wk = 0.0042735 k( 232) = ( 0.0256410 0.0256410 0.0256410), wk = 0.0042735 k( 233) = ( 0.0128205 0.0128205 0.0128205), wk = 0.0042735 k( 234) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0042735 Dense grid: 146075 G-vectors FFT dimensions: ( 60, 72, 80) Smooth grid: 61683 G-vectors FFT dimensions: ( 45, 54, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.58 Mb ( 440, 86) NL pseudopotentials 0.71 Mb ( 220, 212) Each V/rho on FFT grid 0.20 Mb ( 12960) Each G-vector array 0.03 Mb ( 4057) G-vector shells 0.03 Mb ( 3961) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.31 Mb ( 440, 344) Each subspace H/S matrix 0.11 Mb ( 86, 86) Each matrix 0.56 Mb ( 212, 2, 86) Check: negative/imaginary core charge= -0.000009 0.000000 The potential is recalculated from file : ./H4C3N4.save/charge-density.dat Starting wfc are 128 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.7 secs Computing kpt #: 3 total cpu time spent up to now is 6.2 secs Computing kpt #: 4 total cpu time spent up to now is 7.7 secs Computing kpt #: 5 total cpu time spent up to now is 9.2 secs Computing kpt #: 6 total cpu time spent up to now is 10.7 secs Computing kpt #: 7 total cpu time spent up to now is 12.1 secs Computing kpt #: 8 total cpu time spent up to now is 13.6 secs Computing kpt #: 9 total cpu time spent up to now is 15.1 secs Computing kpt #: 10 total cpu time spent up to now is 16.6 secs Computing kpt #: 11 total cpu time spent up to now is 18.1 secs Computing kpt #: 12 total cpu time spent up to now is 19.5 secs Computing kpt #: 13 total cpu time spent up to now is 21.1 secs Computing kpt #: 14 total cpu time spent up to now is 22.6 secs Computing kpt #: 15 total cpu time spent up to now is 24.1 secs Computing kpt #: 16 total cpu time spent up to now is 25.5 secs Computing kpt #: 17 total cpu time spent up to now is 27.1 secs Computing kpt #: 18 total cpu time spent up to now is 28.5 secs Computing kpt #: 19 total cpu time spent up to now is 30.0 secs Computing kpt #: 20 total cpu time spent up to now is 31.5 secs Computing kpt #: 21 total cpu time spent up to now is 32.9 secs Computing kpt #: 22 total cpu time spent up to now is 34.4 secs Computing kpt #: 23 total cpu time spent up to now is 35.8 secs Computing kpt #: 24 total cpu time spent up to now is 37.2 secs Computing kpt #: 25 total cpu time spent up to now is 38.6 secs Computing kpt #: 26 total cpu time spent up to now is 39.9 secs Computing kpt #: 27 total cpu time spent up to now is 41.1 secs Computing kpt #: 28 total cpu time spent up to now is 42.4 secs Computing kpt #: 29 total cpu time spent up to now is 43.7 secs Computing kpt #: 30 total cpu time spent up to now is 44.9 secs Computing kpt #: 31 total cpu time spent up to now is 46.2 secs Computing kpt #: 32 total cpu time spent up to now is 47.5 secs Computing kpt #: 33 total cpu time spent up to now is 49.0 secs Computing kpt #: 34 total cpu time spent up to now is 50.4 secs Computing kpt #: 35 total cpu time spent up to now is 51.8 secs Computing kpt #: 36 total cpu time spent up to now is 53.2 secs Computing kpt #: 37 total cpu time spent up to now is 54.6 secs Computing kpt #: 38 total cpu time spent up to now is 56.0 secs Computing kpt #: 39 total cpu time spent up to now is 57.4 secs Computing kpt #: 40 total cpu time spent up to now is 58.8 secs Computing kpt #: 41 total cpu time spent up to now is 60.2 secs Computing kpt #: 42 total cpu time spent up to now is 61.6 secs Computing kpt #: 43 total cpu time spent up to now is 63.0 secs Computing kpt #: 44 total cpu time spent up to now is 64.4 secs Computing kpt #: 45 total cpu time spent up to now is 65.9 secs Computing kpt #: 46 total cpu time spent up to now is 67.2 secs Computing kpt #: 47 total cpu time spent up to now is 68.6 secs Computing kpt #: 48 total cpu time spent up to now is 70.0 secs Computing kpt #: 49 total cpu time spent up to now is 71.4 secs Computing kpt #: 50 total cpu time spent up to now is 72.9 secs Computing kpt #: 51 total cpu time spent up to now is 74.3 secs Computing kpt #: 52 total cpu time spent up to now is 75.7 secs Computing kpt #: 53 total cpu time spent up to now is 77.1 secs Computing kpt #: 54 total cpu time spent up to now is 78.5 secs Computing kpt #: 55 total cpu time spent up to now is 79.9 secs Computing kpt #: 56 total cpu time spent up to now is 81.4 secs Computing kpt #: 57 total cpu time spent up to now is 82.8 secs Computing kpt #: 58 total cpu time spent up to now is 84.3 secs Computing kpt #: 59 total cpu time spent up to now is 85.7 secs Computing kpt #: 60 total cpu time spent up to now is 87.1 secs Computing kpt #: 61 total cpu time spent up to now is 88.5 secs Computing kpt #: 62 total cpu time spent up to now is 90.1 secs Computing kpt #: 63 total cpu time spent up to now is 91.6 secs Computing kpt #: 64 total cpu time spent up to now is 93.2 secs Computing kpt #: 65 total cpu time spent up to now is 94.7 secs Computing kpt #: 66 total cpu time spent up to now is 96.2 secs Computing kpt #: 67 total cpu time spent up to now is 97.7 secs Computing kpt #: 68 total cpu time spent up to now is 99.2 secs Computing kpt #: 69 total cpu time spent up to now is 100.7 secs Computing kpt #: 70 total cpu time spent up to now is 102.2 secs Computing kpt #: 71 total cpu time spent up to now is 103.7 secs Computing kpt #: 72 total cpu time spent up to now is 105.1 secs Computing kpt #: 73 total cpu time spent up to now is 106.6 secs Computing kpt #: 74 total cpu time spent up to now is 108.0 secs Computing kpt #: 75 total cpu time spent up to now is 109.5 secs Computing kpt #: 76 total cpu time spent up to now is 111.0 secs Computing kpt #: 77 total cpu time spent up to now is 112.5 secs Computing kpt #: 78 total cpu time spent up to now is 113.9 secs Computing kpt #: 79 total cpu time spent up to now is 115.3 secs Computing kpt #: 80 total cpu time spent up to now is 116.8 secs Computing kpt #: 81 total cpu time spent up to now is 118.3 secs Computing kpt #: 82 total cpu time spent up to now is 119.7 secs Computing kpt #: 83 total cpu time spent up to now is 121.1 secs Computing kpt #: 84 total cpu time spent up to now is 122.6 secs Computing kpt #: 85 total cpu time spent up to now is 124.0 secs Computing kpt #: 86 total cpu time spent up to now is 125.5 secs Computing kpt #: 87 total cpu time spent up to now is 126.9 secs Computing kpt #: 88 total cpu time spent up to now is 128.3 secs Computing kpt #: 89 total cpu time spent up to now is 129.7 secs Computing kpt #: 90 total cpu time spent up to now is 131.1 secs Computing kpt #: 91 total cpu time spent up to now is 132.5 secs Computing kpt #: 92 total cpu time spent up to now is 133.9 secs Computing kpt #: 93 total cpu time spent up to now is 135.3 secs Computing kpt #: 94 total cpu time spent up to now is 136.7 secs Computing kpt #: 95 total cpu time spent up to now is 138.1 secs Computing kpt #: 96 total cpu time spent up to now is 139.5 secs Computing kpt #: 97 total cpu time spent up to now is 140.9 secs Computing kpt #: 98 total cpu time spent up to now is 142.3 secs Computing kpt #: 99 total cpu time spent up to now is 143.7 secs Computing kpt #: 100 total cpu time spent up to now is 145.0 secs Computing kpt #: 101 total cpu time spent up to now is 146.4 secs Computing kpt #: 102 total cpu time spent up to now is 147.8 secs Computing kpt #: 103 total cpu time spent up to now is 149.2 secs Computing kpt #: 104 total cpu time spent up to now is 150.6 secs Computing kpt #: 105 total cpu time spent up to now is 152.0 secs Computing kpt #: 106 total cpu time spent up to now is 153.4 secs Computing kpt #: 107 total cpu time spent up to now is 154.8 secs Computing kpt #: 108 total cpu time spent up to now is 156.2 secs Computing kpt #: 109 total cpu time spent up to now is 157.7 secs Computing kpt #: 110 total cpu time spent up to now is 159.1 secs Computing kpt #: 111 total cpu time spent up to now is 160.5 secs Computing kpt #: 112 total cpu time spent up to now is 161.9 secs Computing kpt #: 113 total cpu time spent up to now is 163.3 secs Computing kpt #: 114 total cpu time spent up to now is 164.7 secs Computing kpt #: 115 total cpu time spent up to now is 166.1 secs Computing kpt #: 116 total cpu time spent up to now is 167.5 secs Computing kpt #: 117 total cpu time spent up to now is 169.0 secs Computing kpt #: 118 total cpu time spent up to now is 170.5 secs Computing kpt #: 119 total cpu time spent up to now is 171.9 secs Computing kpt #: 120 total cpu time spent up to now is 173.4 secs Computing kpt #: 121 total cpu time spent up to now is 174.8 secs Computing kpt #: 122 total cpu time spent up to now is 176.3 secs Computing kpt #: 123 total cpu time spent up to now is 177.8 secs Computing kpt #: 124 total cpu time spent up to now is 179.2 secs Computing kpt #: 125 total cpu time spent up to now is 180.7 secs Computing kpt #: 126 total cpu time spent up to now is 182.1 secs Computing kpt #: 127 total cpu time spent up to now is 183.5 secs Computing kpt #: 128 total cpu time spent up to now is 184.9 secs Computing kpt #: 129 total cpu time spent up to now is 186.3 secs Computing kpt #: 130 total cpu time spent up to now is 187.8 secs Computing kpt #: 131 total cpu time spent up to now is 189.2 secs Computing kpt #: 132 total cpu time spent up to now is 190.6 secs Computing kpt #: 133 total cpu time spent up to now is 192.1 secs Computing kpt #: 134 total cpu time spent up to now is 193.5 secs Computing kpt #: 135 total cpu time spent up to now is 195.0 secs Computing kpt #: 136 total cpu time spent up to now is 196.4 secs Computing kpt #: 137 total cpu time spent up to now is 197.9 secs Computing kpt #: 138 total cpu time spent up to now is 199.3 secs Computing kpt #: 139 total cpu time spent up to now is 200.8 secs Computing kpt #: 140 total cpu time spent up to now is 202.3 secs Computing kpt #: 141 total cpu time spent up to now is 203.7 secs Computing kpt #: 142 total cpu time spent up to now is 205.2 secs Computing kpt #: 143 total cpu time spent up to now is 206.6 secs Computing kpt #: 144 total cpu time spent up to now is 208.0 secs Computing kpt #: 145 total cpu time spent up to now is 209.5 secs Computing kpt #: 146 total cpu time spent up to now is 210.9 secs Computing kpt #: 147 total cpu time spent up to now is 212.3 secs Computing kpt #: 148 total cpu time spent up to now is 213.6 secs Computing kpt #: 149 total cpu time spent up to now is 214.8 secs Computing kpt #: 150 total cpu time spent up to now is 216.1 secs Computing kpt #: 151 total cpu time spent up to now is 217.3 secs Computing kpt #: 152 total cpu time spent up to now is 218.6 secs Computing kpt #: 153 total cpu time spent up to now is 219.8 secs Computing kpt #: 154 total cpu time spent up to now is 221.1 secs Computing kpt #: 155 total cpu time spent up to now is 222.4 secs Computing kpt #: 156 total cpu time spent up to now is 223.9 secs Computing kpt #: 157 total cpu time spent up to now is 225.3 secs Computing kpt #: 158 total cpu time spent up to now is 226.7 secs Computing kpt #: 159 total cpu time spent up to now is 227.9 secs Computing kpt #: 160 total cpu time spent up to now is 229.3 secs Computing kpt #: 161 total cpu time spent up to now is 230.7 secs Computing kpt #: 162 total cpu time spent up to now is 232.1 secs Computing kpt #: 163 total cpu time spent up to now is 233.5 secs Computing kpt #: 164 total cpu time spent up to now is 234.7 secs Computing kpt #: 165 total cpu time spent up to now is 236.1 secs Computing kpt #: 166 total cpu time spent up to now is 237.5 secs Computing kpt #: 167 total cpu time spent up to now is 238.9 secs Computing kpt #: 168 total cpu time spent up to now is 240.1 secs Computing kpt #: 169 total cpu time spent up to now is 241.4 secs Computing kpt #: 170 total cpu time spent up to now is 242.6 secs Computing kpt #: 171 total cpu time spent up to now is 243.9 secs Computing kpt #: 172 total cpu time spent up to now is 245.2 secs Computing kpt #: 173 total cpu time spent up to now is 246.6 secs Computing kpt #: 174 total cpu time spent up to now is 247.9 secs Computing kpt #: 175 total cpu time spent up to now is 249.2 secs Computing kpt #: 176 total cpu time spent up to now is 250.6 secs Computing kpt #: 177 total cpu time spent up to now is 251.9 secs Computing kpt #: 178 total cpu time spent up to now is 253.3 secs Computing kpt #: 179 total cpu time spent up to now is 254.7 secs Computing kpt #: 180 total cpu time spent up to now is 256.1 secs Computing kpt #: 181 total cpu time spent up to now is 257.5 secs Computing kpt #: 182 total cpu time spent up to now is 259.0 secs Computing kpt #: 183 total cpu time spent up to now is 260.8 secs Computing kpt #: 184 total cpu time spent up to now is 262.3 secs Computing kpt #: 185 total cpu time spent up to now is 263.8 secs Computing kpt #: 186 total cpu time spent up to now is 265.2 secs Computing kpt #: 187 total cpu time spent up to now is 266.6 secs Computing kpt #: 188 total cpu time spent up to now is 268.0 secs Computing kpt #: 189 total cpu time spent up to now is 269.5 secs Computing kpt #: 190 total cpu time spent up to now is 271.1 secs Computing kpt #: 191 total cpu time spent up to now is 272.6 secs Computing kpt #: 192 total cpu time spent up to now is 274.0 secs Computing kpt #: 193 total cpu time spent up to now is 275.5 secs Computing kpt #: 194 total cpu time spent up to now is 277.0 secs Computing kpt #: 195 total cpu time spent up to now is 278.5 secs Computing kpt #: 196 total cpu time spent up to now is 280.0 secs Computing kpt #: 197 total cpu time spent up to now is 281.5 secs Computing kpt #: 198 total cpu time spent up to now is 283.0 secs Computing kpt #: 199 total cpu time spent up to now is 284.5 secs Computing kpt #: 200 total cpu time spent up to now is 286.0 secs Computing kpt #: 201 total cpu time spent up to now is 287.6 secs Computing kpt #: 202 total cpu time spent up to now is 289.1 secs Computing kpt #: 203 total cpu time spent up to now is 290.6 secs Computing kpt #: 204 total cpu time spent up to now is 292.1 secs Computing kpt #: 205 total cpu time spent up to now is 293.6 secs Computing kpt #: 206 total cpu time spent up to now is 295.2 secs Computing kpt #: 207 total cpu time spent up to now is 296.7 secs Computing kpt #: 208 total cpu time spent up to now is 298.2 secs Computing kpt #: 209 total cpu time spent up to now is 299.7 secs Computing kpt #: 210 total cpu time spent up to now is 301.2 secs Computing kpt #: 211 total cpu time spent up to now is 302.6 secs Computing kpt #: 212 total cpu time spent up to now is 304.1 secs Computing kpt #: 213 total cpu time spent up to now is 305.5 secs Computing kpt #: 214 total cpu time spent up to now is 306.9 secs Computing kpt #: 215 total cpu time spent up to now is 308.4 secs Computing kpt #: 216 total cpu time spent up to now is 309.8 secs Computing kpt #: 217 total cpu time spent up to now is 311.2 secs Computing kpt #: 218 total cpu time spent up to now is 312.6 secs Computing kpt #: 219 total cpu time spent up to now is 314.0 secs Computing kpt #: 220 total cpu time spent up to now is 315.5 secs Computing kpt #: 221 total cpu time spent up to now is 317.7 secs Computing kpt #: 222 total cpu time spent up to now is 319.1 secs Computing kpt #: 223 total cpu time spent up to now is 320.5 secs Computing kpt #: 224 total cpu time spent up to now is 321.9 secs Computing kpt #: 225 total cpu time spent up to now is 323.3 secs Computing kpt #: 226 total cpu time spent up to now is 324.6 secs Computing kpt #: 227 total cpu time spent up to now is 325.8 secs Computing kpt #: 228 total cpu time spent up to now is 327.3 secs Computing kpt #: 229 total cpu time spent up to now is 328.7 secs Computing kpt #: 230 total cpu time spent up to now is 330.1 secs Computing kpt #: 231 total cpu time spent up to now is 331.5 secs Computing kpt #: 232 total cpu time spent up to now is 332.9 secs Computing kpt #: 233 total cpu time spent up to now is 334.3 secs Computing kpt #: 234 total cpu time spent up to now is 335.7 secs ethr = 1.39E-08, avg # of iterations = 22.7 total cpu time spent up to now is 335.7 secs End of band structure calculation k = 0.5000-0.1080-0.1104 ( 7730 PWs) bands (ev): -19.5826 -19.5826 -19.5245 -19.5245 -17.5060 -17.5060 -17.4747 -17.4747 -16.5005 -16.5005 -16.4045 -16.4045 -13.8159 -13.8159 -13.7582 -13.7582 -10.9239 -10.9239 -10.7397 -10.7397 -10.2589 -10.2589 -10.0895 -10.0895 -7.8636 -7.8636 -7.8402 -7.8402 -7.0942 -7.0942 -6.9501 -6.9501 -6.0983 -6.0983 -6.0679 -6.0679 -5.7649 -5.7649 -5.3910 -5.3910 -5.3285 -5.3285 -4.3928 -4.3928 -4.3688 -4.3688 -4.1324 -4.1324 -2.3718 -2.3718 -2.2219 -2.2219 -1.6431 -1.6431 -1.5062 -1.5062 -1.4522 -1.4522 -1.3079 -1.3079 -0.7421 -0.7421 -0.7009 -0.7009 0.6332 0.6332 0.7644 0.7644 1.1644 1.1644 1.2467 1.2467 3.7585 3.7585 3.9127 3.9127 5.3018 5.3018 5.4320 5.4320 8.0401 8.0401 8.1638 8.1638 8.3248 8.3248 k = 0.4844-0.1046-0.1069 ( 7726 PWs) bands (ev): -19.5828 -19.5828 -19.5244 -19.5244 -17.5060 -17.5060 -17.4747 -17.4747 -16.5002 -16.5002 -16.4046 -16.4046 -13.8161 -13.8161 -13.7579 -13.7579 -10.9236 -10.9236 -10.7401 -10.7401 -10.2585 -10.2585 -10.0897 -10.0897 -7.8651 -7.8651 -7.8391 -7.8391 -7.0945 -7.0945 -6.9499 -6.9499 -6.0983 -6.0983 -6.0676 -6.0676 -5.7642 -5.7642 -5.3917 -5.3917 -5.3282 -5.3282 -4.3946 -4.3946 -4.3663 -4.3663 -4.1329 -4.1329 -2.3719 -2.3719 -2.2219 -2.2219 -1.6436 -1.6436 -1.5086 -1.5086 -1.4504 -1.4504 -1.3077 -1.3077 -0.7433 -0.7433 -0.7000 -0.7000 0.6330 0.6330 0.7649 0.7649 1.1639 1.1639 1.2473 1.2473 3.7585 3.7585 3.9132 3.9132 5.3012 5.3012 5.4322 5.4322 8.0210 8.0210 8.1823 8.1823 8.3240 8.3240 k = 0.4688-0.1013-0.1035 ( 7721 PWs) bands (ev): -19.5833 -19.5833 -19.5242 -19.5242 -17.5059 -17.5059 -17.4747 -17.4747 -16.4995 -16.4995 -16.4050 -16.4050 -13.8168 -13.8168 -13.7573 -13.7573 -10.9227 -10.9227 -10.7412 -10.7412 -10.2573 -10.2573 -10.0905 -10.0905 -7.8690 -7.8690 -7.8363 -7.8363 -7.0953 -7.0953 -6.9493 -6.9493 -6.0982 -6.0982 -6.0669 -6.0669 -5.7624 -5.7624 -5.3936 -5.3936 -5.3273 -5.3273 -4.3985 -4.3985 -4.3602 -4.3602 -4.1344 -4.1344 -2.3722 -2.3722 -2.2222 -2.2222 -1.6450 -1.6450 -1.5147 -1.5147 -1.4460 -1.4460 -1.3072 -1.3072 -0.7464 -0.7464 -0.6977 -0.6977 0.6325 0.6325 0.7663 0.7663 1.1624 1.1624 1.2489 1.2489 3.7585 3.7585 3.9148 3.9148 5.2997 5.2997 5.4328 5.4328 7.9803 7.9803 8.2211 8.2211 8.3218 8.3218 k = 0.4531-0.0979-0.1000 ( 7715 PWs) bands (ev): -19.5841 -19.5841 -19.5238 -19.5238 -17.5059 -17.5059 -17.4747 -17.4747 -16.4982 -16.4982 -16.4056 -16.4056 -13.8179 -13.8179 -13.7562 -13.7562 -10.9211 -10.9211 -10.7430 -10.7430 -10.2553 -10.2553 -10.0918 -10.0918 -7.8742 -7.8742 -7.8329 -7.8329 -7.0967 -7.0967 -6.9483 -6.9483 -6.0981 -6.0981 -6.0657 -6.0657 -5.7594 -5.7594 -5.3971 -5.3971 -5.3256 -5.3256 -4.4028 -4.4028 -4.3524 -4.3524 -4.1369 -4.1369 -2.3726 -2.3726 -2.2226 -2.2226 -1.6477 -1.6477 -1.5226 -1.5226 -1.4405 -1.4405 -1.3064 -1.3064 -0.7509 -0.7509 -0.6944 -0.6944 0.6317 0.6317 0.7686 0.7686 1.1600 1.1600 1.2515 1.2515 3.7585 3.7585 3.9174 3.9174 5.2972 5.2972 5.4338 5.4338 7.9329 7.9329 8.2646 8.2646 8.3192 8.3192 k = 0.4375-0.0945-0.0966 ( 7714 PWs) bands (ev): -19.5851 -19.5851 -19.5232 -19.5232 -17.5057 -17.5057 -17.4747 -17.4747 -16.4964 -16.4964 -16.4064 -16.4064 -13.8193 -13.8193 -13.7549 -13.7549 -10.9189 -10.9189 -10.7456 -10.7456 -10.2526 -10.2526 -10.0935 -10.0935 -7.8800 -7.8800 -7.8294 -7.8294 -7.0985 -7.0985 -6.9471 -6.9471 -6.0979 -6.0979 -6.0641 -6.0641 -5.7552 -5.7552 -5.4023 -5.4023 -5.3228 -5.3228 -4.4065 -4.4065 -4.3436 -4.3436 -4.1403 -4.1403 -2.3731 -2.3731 -2.2232 -2.2232 -1.6522 -1.6522 -1.5306 -1.5306 -1.4350 -1.4350 -1.3054 -1.3054 -0.7563 -0.7563 -0.6906 -0.6906 0.6307 0.6307 0.7717 0.7717 1.1570 1.1570 1.2548 1.2548 3.7586 3.7586 3.9210 3.9210 5.2938 5.2938 5.4353 5.4353 7.8830 7.8830 8.2986 8.2986 8.3260 8.3260 k = 0.4219-0.0911-0.0931 ( 7708 PWs) bands (ev): -19.5865 -19.5865 -19.5226 -19.5226 -17.5056 -17.5056 -17.4747 -17.4747 -16.4941 -16.4941 -16.4075 -16.4075 -13.8209 -13.8209 -13.7533 -13.7533 -10.9161 -10.9161 -10.7489 -10.7489 -10.2491 -10.2491 -10.0958 -10.0958 -7.8862 -7.8862 -7.8262 -7.8262 -7.1007 -7.1007 -6.9457 -6.9457 -6.0977 -6.0977 -6.0622 -6.0622 -5.7498 -5.7498 -5.4094 -5.4094 -5.3189 -5.3189 -4.4092 -4.4092 -4.3343 -4.3343 -4.1446 -4.1446 -2.3738 -2.3738 -2.2239 -2.2239 -1.6589 -1.6589 -1.5377 -1.5377 -1.4301 -1.4301 -1.3044 -1.3044 -0.7622 -0.7622 -0.6867 -0.6867 0.6295 0.6295 0.7756 0.7756 1.1536 1.1536 1.2587 1.2587 3.7586 3.7586 3.9255 3.9255 5.2895 5.2895 5.4372 5.4372 7.8322 7.8322 8.3001 8.3001 8.3643 8.3643 k = 0.4062-0.0878-0.0897 ( 7713 PWs) bands (ev): -19.5881 -19.5881 -19.5218 -19.5218 -17.5054 -17.5054 -17.4747 -17.4747 -16.4913 -16.4913 -16.4088 -16.4088 -13.8227 -13.8227 -13.7517 -13.7517 -10.9128 -10.9128 -10.7529 -10.7529 -10.2450 -10.2450 -10.0985 -10.0985 -7.8924 -7.8924 -7.8235 -7.8235 -7.1032 -7.1032 -6.9442 -6.9442 -6.0974 -6.0974 -6.0601 -6.0601 -5.7433 -5.7433 -5.4185 -5.4185 -5.3139 -5.3139 -4.4108 -4.4108 -4.3245 -4.3245 -4.1498 -4.1498 -2.3747 -2.3747 -2.2248 -2.2248 -1.6682 -1.6682 -1.5431 -1.5431 -1.4258 -1.4258 -1.3036 -1.3036 -0.7685 -0.7685 -0.6830 -0.6830 0.6282 0.6282 0.7802 0.7802 1.1498 1.1498 1.2630 1.2630 3.7587 3.7587 3.9308 3.9308 5.2843 5.2843 5.4395 5.4395 7.7811 7.7811 8.2939 8.2939 8.4086 8.4086 k = 0.3906-0.0844-0.0862 ( 7711 PWs) bands (ev): -19.5898 -19.5898 -19.5210 -19.5210 -17.5052 -17.5052 -17.4747 -17.4747 -16.4882 -16.4882 -16.4102 -16.4102 -13.8245 -13.8245 -13.7500 -13.7500 -10.9089 -10.9089 -10.7575 -10.7575 -10.2402 -10.2402 -10.1015 -10.1015 -7.8987 -7.8987 -7.8211 -7.8211 -7.1060 -7.1060 -6.9426 -6.9426 -6.0971 -6.0971 -6.0579 -6.0579 -5.7357 -5.7357 -5.4293 -5.4293 -5.3076 -5.3076 -4.4111 -4.4111 -4.3145 -4.3145 -4.1557 -4.1557 -2.3758 -2.3758 -2.2259 -2.2259 -1.6800 -1.6800 -1.5467 -1.5467 -1.4222 -1.4222 -1.3030 -1.3030 -0.7749 -0.7749 -0.6795 -0.6795 0.6268 0.6268 0.7855 0.7855 1.1460 1.1460 1.2674 1.2674 3.7588 3.7588 3.9369 3.9369 5.2785 5.2785 5.4422 5.4422 7.7301 7.7301 8.2865 8.2865 8.4524 8.4524 k = 0.3750-0.0810-0.0828 ( 7712 PWs) bands (ev): -19.5918 -19.5918 -19.5201 -19.5201 -17.5049 -17.5049 -17.4747 -17.4747 -16.4846 -16.4846 -16.4119 -16.4119 -13.8263 -13.8263 -13.7483 -13.7483 -10.9045 -10.9045 -10.7628 -10.7628 -10.2348 -10.2348 -10.1050 -10.1050 -7.9048 -7.9048 -7.8192 -7.8192 -7.1089 -7.1089 -6.9412 -6.9412 -6.0967 -6.0967 -6.0556 -6.0556 -5.7272 -5.7272 -5.4419 -5.4419 -5.3004 -5.3004 -4.4100 -4.4100 -4.3042 -4.3042 -4.1623 -4.1623 -2.3771 -2.3771 -2.2271 -2.2271 -1.6940 -1.6940 -1.5486 -1.5486 -1.4194 -1.4194 -1.3029 -1.3029 -0.7813 -0.7813 -0.6763 -0.6763 0.6255 0.6255 0.7913 0.7913 1.1422 1.1422 1.2719 1.2719 3.7588 3.7588 3.9435 3.9435 5.2719 5.2719 5.4454 5.4454 7.6795 7.6795 8.2786 8.2786 8.4945 8.4945 k = 0.3594-0.0776-0.0793 ( 7708 PWs) bands (ev): -19.5939 -19.5939 -19.5191 -19.5191 -17.5046 -17.5046 -17.4747 -17.4747 -16.4807 -16.4807 -16.4137 -16.4137 -13.8280 -13.8280 -13.7468 -13.7468 -10.8997 -10.8997 -10.7686 -10.7686 -10.2288 -10.2288 -10.1087 -10.1087 -7.9106 -7.9106 -7.8179 -7.8179 -7.1119 -7.1119 -6.9399 -6.9399 -6.0963 -6.0963 -6.0533 -6.0533 -5.7178 -5.7178 -5.4561 -5.4561 -5.2922 -5.2922 -4.4074 -4.4074 -4.2938 -4.2938 -4.1695 -4.1695 -2.3785 -2.3785 -2.2285 -2.2285 -1.7098 -1.7098 -1.5493 -1.5493 -1.4170 -1.4170 -1.3033 -1.3033 -0.7875 -0.7875 -0.6736 -0.6736 0.6243 0.6243 0.7976 0.7976 1.1385 1.1385 1.2764 1.2764 3.7589 3.7589 3.9507 3.9507 5.2649 5.2649 5.4490 5.4490 7.6295 7.6295 8.2707 8.2707 8.5343 8.5343 k = 0.3438-0.0743-0.0759 ( 7707 PWs) bands (ev): -19.5962 -19.5962 -19.5182 -19.5182 -17.5042 -17.5042 -17.4747 -17.4747 -16.4765 -16.4765 -16.4156 -16.4156 -13.8295 -13.8295 -13.7454 -13.7454 -10.8945 -10.8945 -10.7749 -10.7749 -10.2224 -10.2224 -10.1127 -10.1127 -7.9160 -7.9160 -7.8170 -7.8170 -7.1150 -7.1150 -6.9388 -6.9388 -6.0959 -6.0959 -6.0511 -6.0511 -5.7078 -5.7078 -5.4714 -5.4714 -5.2833 -5.2833 -4.4033 -4.4033 -4.2834 -4.2834 -4.1772 -4.1772 -2.3800 -2.3800 -2.2301 -2.2301 -1.7269 -1.7269 -1.5494 -1.5494 -1.4152 -1.4152 -1.3043 -1.3043 -0.7935 -0.7935 -0.6713 -0.6713 0.6233 0.6233 0.8043 0.8043 1.1351 1.1351 1.2806 1.2806 3.7589 3.7589 3.9582 3.9582 5.2573 5.2573 5.4532 5.4532 7.5803 7.5803 8.2630 8.2630 8.5713 8.5713 k = 0.3281-0.0709-0.0724 ( 7699 PWs) bands (ev): -19.5985 -19.5985 -19.5172 -19.5172 -17.5039 -17.5039 -17.4748 -17.4748 -16.4721 -16.4721 -16.4176 -16.4176 -13.8309 -13.8309 -13.7443 -13.7443 -10.8889 -10.8889 -10.7817 -10.7817 -10.2155 -10.2155 -10.1169 -10.1169 -7.9210 -7.9210 -7.8165 -7.8165 -7.1181 -7.1181 -6.9380 -6.9380 -6.0955 -6.0955 -6.0491 -6.0491 -5.6975 -5.6975 -5.4876 -5.4876 -5.2737 -5.2737 -4.3977 -4.3977 -4.2730 -4.2730 -4.1853 -4.1853 -2.3818 -2.3818 -2.2319 -2.2319 -1.7447 -1.7447 -1.5493 -1.5493 -1.4139 -1.4139 -1.3058 -1.3058 -0.7992 -0.7992 -0.6695 -0.6695 0.6225 0.6225 0.8114 0.8114 1.1320 1.1320 1.2846 1.2846 3.7588 3.7588 3.9660 3.9660 5.2494 5.2494 5.4578 5.4578 7.5321 7.5321 8.2559 8.2559 8.6050 8.6050 k = 0.3125-0.0675-0.0690 ( 7698 PWs) bands (ev): -19.6009 -19.6009 -19.5162 -19.5162 -17.5034 -17.5034 -17.4748 -17.4748 -16.4675 -16.4675 -16.4196 -16.4196 -13.8319 -13.8319 -13.7434 -13.7434 -10.8830 -10.8830 -10.7889 -10.7889 -10.2083 -10.2083 -10.1212 -10.1212 -7.9254 -7.9254 -7.8165 -7.8165 -7.1211 -7.1211 -6.9375 -6.9375 -6.0951 -6.0951 -6.0473 -6.0473 -5.6873 -5.6873 -5.5040 -5.5040 -5.2637 -5.2637 -4.3906 -4.3906 -4.2627 -4.2627 -4.1935 -4.1935 -2.3836 -2.3836 -2.2338 -2.2338 -1.7628 -1.7628 -1.5495 -1.5495 -1.4131 -1.4131 -1.3077 -1.3077 -0.8045 -0.8045 -0.6683 -0.6683 0.6219 0.6219 0.8187 0.8187 1.1293 1.1293 1.2883 1.2883 3.7587 3.7587 3.9739 3.9739 5.2413 5.2413 5.4628 5.4628 7.4851 7.4851 8.2495 8.2495 8.6349 8.6349 k = 0.2969-0.0641-0.0655 ( 7698 PWs) bands (ev): -19.6034 -19.6034 -19.5153 -19.5153 -17.5030 -17.5030 -17.4749 -17.4749 -16.4629 -16.4629 -16.4216 -16.4216 -13.8328 -13.8328 -13.7427 -13.7427 -10.8770 -10.8770 -10.7964 -10.7964 -10.2008 -10.2008 -10.1257 -10.1257 -7.9293 -7.9293 -7.8170 -7.8170 -7.1240 -7.1240 -6.9373 -6.9373 -6.0946 -6.0946 -6.0458 -6.0458 -5.6780 -5.6780 -5.5199 -5.5199 -5.2533 -5.2533 -4.3821 -4.3821 -4.2529 -4.2529 -4.2016 -4.2016 -2.3856 -2.3856 -2.2359 -2.2359 -1.7810 -1.7810 -1.5501 -1.5501 -1.4130 -1.4130 -1.3097 -1.3097 -0.8093 -0.8093 -0.6677 -0.6677 0.6215 0.6215 0.8262 0.8262 1.1271 1.1271 1.2914 1.2914 3.7585 3.7585 3.9819 3.9819 5.2330 5.2330 5.4683 5.4683 7.4394 7.4394 8.2440 8.2440 8.6606 8.6606 k = 0.2812-0.0608-0.0621 ( 7702 PWs) bands (ev): -19.6058 -19.6058 -19.5143 -19.5143 -17.5025 -17.5025 -17.4750 -17.4750 -16.4583 -16.4583 -16.4234 -16.4234 -13.8333 -13.8333 -13.7424 -13.7424 -10.8708 -10.8708 -10.8041 -10.8041 -10.1931 -10.1931 -10.1301 -10.1301 -7.9325 -7.9325 -7.8179 -7.8179 -7.1269 -7.1269 -6.9374 -6.9374 -6.0942 -6.0942 -6.0446 -6.0446 -5.6707 -5.6707 -5.5340 -5.5340 -5.2428 -5.2428 -4.3722 -4.3722 -4.2442 -4.2442 -4.2088 -4.2088 -2.3877 -2.3877 -2.2381 -2.2381 -1.7989 -1.7989 -1.5514 -1.5514 -1.4139 -1.4139 -1.3114 -1.3114 -0.8135 -0.8135 -0.6677 -0.6677 0.6215 0.6215 0.8339 0.8339 1.1255 1.1255 1.2941 1.2941 3.7583 3.7583 3.9899 3.9899 5.2246 5.2246 5.4743 5.4743 7.3952 7.3952 8.2396 8.2396 8.6822 8.6822 k = 0.2656-0.0574-0.0586 ( 7699 PWs) bands (ev): -19.6083 -19.6083 -19.5134 -19.5134 -17.5020 -17.5020 -17.4751 -17.4751 -16.4541 -16.4541 -16.4249 -16.4249 -13.8335 -13.8335 -13.7424 -13.7424 -10.8646 -10.8646 -10.8118 -10.8118 -10.1854 -10.1854 -10.1344 -10.1344 -7.9351 -7.9351 -7.8191 -7.8191 -7.1297 -7.1297 -6.9379 -6.9379 -6.0937 -6.0937 -6.0438 -6.0438 -5.6673 -5.6673 -5.5442 -5.5442 -5.2323 -5.2323 -4.3613 -4.3613 -4.2387 -4.2387 -4.2130 -4.2130 -2.3899 -2.3899 -2.2405 -2.2405 -1.8164 -1.8164 -1.5536 -1.5536 -1.4161 -1.4161 -1.3126 -1.3126 -0.8172 -0.8172 -0.6682 -0.6682 0.6217 0.6217 0.8416 0.8416 1.1244 1.1244 1.2962 1.2962 3.7579 3.7579 3.9976 3.9976 5.2163 5.2163 5.4806 5.4806 7.3526 7.3526 8.2364 8.2364 8.6996 8.6996 k = 0.2500-0.0540-0.0552 ( 7700 PWs) bands (ev): -19.6108 -19.6108 -19.5125 -19.5125 -17.5014 -17.5014 -17.4753 -17.4753 -16.4504 -16.4504 -16.4258 -16.4258 -13.8333 -13.8333 -13.7428 -13.7428 -10.8587 -10.8587 -10.8193 -10.8193 -10.1779 -10.1779 -10.1385 -10.1385 -7.9369 -7.9369 -7.8207 -7.8207 -7.1323 -7.1323 -6.9387 -6.9387 -6.0932 -6.0932 -6.0434 -6.0434 -5.6697 -5.6697 -5.5487 -5.5487 -5.2219 -5.2219 -4.3494 -4.3494 -4.2398 -4.2398 -4.2107 -4.2107 -2.3921 -2.3921 -2.2430 -2.2430 -1.8332 -1.8332 -1.5567 -1.5567 -1.4198 -1.4198 -1.3129 -1.3129 -0.8202 -0.8202 -0.6693 -0.6693 0.6223 0.6223 0.8494 0.8494 1.1239 1.1239 1.2977 1.2977 3.7575 3.7575 4.0052 4.0052 5.2081 5.2081 5.4873 5.4873 7.3117 7.3117 8.2345 8.2345 8.7130 8.7130 k = 0.2344-0.0506-0.0517 ( 7701 PWs) bands (ev): -19.6132 -19.6132 -19.5116 -19.5116 -17.5008 -17.5008 -17.4755 -17.4755 -16.4478 -16.4478 -16.4255 -16.4255 -13.8328 -13.8328 -13.7435 -13.7435 -10.8538 -10.8538 -10.8260 -10.8260 -10.1708 -10.1708 -10.1420 -10.1420 -7.9379 -7.9379 -7.8227 -7.8227 -7.1348 -7.1348 -6.9398 -6.9398 -6.0926 -6.0926 -6.0434 -6.0434 -5.6784 -5.6784 -5.5467 -5.5467 -5.2118 -5.2118 -4.3369 -4.3369 -4.2455 -4.2455 -4.2036 -4.2036 -2.3943 -2.3943 -2.2455 -2.2455 -1.8492 -1.8492 -1.5608 -1.5608 -1.4251 -1.4251 -1.3122 -1.3122 -0.8225 -0.8225 -0.6710 -0.6710 0.6231 0.6231 0.8571 0.8571 1.1241 1.1241 1.2985 1.2985 3.7569 3.7569 4.0124 4.0124 5.2001 5.2001 5.4943 5.4943 7.2728 7.2728 8.2340 8.2340 8.7227 8.7227 k = 0.2188-0.0473-0.0483 ( 7706 PWs) bands (ev): -19.6155 -19.6155 -19.5108 -19.5108 -17.5002 -17.5002 -17.4757 -17.4757 -16.4466 -16.4466 -16.4239 -16.4239 -13.8319 -13.8319 -13.7445 -13.7445 -10.8515 -10.8515 -10.8300 -10.8300 -10.1651 -10.1651 -10.1441 -10.1441 -7.9383 -7.9383 -7.8250 -7.8250 -7.1372 -7.1372 -6.9412 -6.9412 -6.0919 -6.0919 -6.0437 -6.0437 -5.6922 -5.6922 -5.5394 -5.5394 -5.2020 -5.2020 -4.3242 -4.3242 -4.2525 -4.2525 -4.1949 -4.1949 -2.3966 -2.3966 -2.2482 -2.2482 -1.8642 -1.8642 -1.5658 -1.5658 -1.4318 -1.4318 -1.3105 -1.3105 -0.8242 -0.8242 -0.6732 -0.6732 0.6241 0.6241 0.8646 0.8646 1.1250 1.1250 1.2987 1.2987 3.7563 3.7563 4.0193 4.0193 5.1923 5.1923 5.5015 5.5015 7.2358 7.2358 8.2350 8.2350 8.7289 8.7289 k = 0.2031-0.0439-0.0448 ( 7708 PWs) bands (ev): -19.6178 -19.6178 -19.5100 -19.5100 -17.4996 -17.4996 -17.4759 -17.4759 -16.4467 -16.4467 -16.4211 -16.4211 -13.8307 -13.8307 -13.7459 -13.7459 -10.8539 -10.8539 -10.8294 -10.8294 -10.1624 -10.1624 -10.1432 -10.1432 -7.9379 -7.9379 -7.8277 -7.8277 -7.1394 -7.1394 -6.9428 -6.9428 -6.0911 -6.0911 -6.0445 -6.0445 -5.7091 -5.7091 -5.5288 -5.5288 -5.1927 -5.1927 -4.3119 -4.3119 -4.2590 -4.2590 -4.1859 -4.1859 -2.3987 -2.3987 -2.2508 -2.2508 -1.8783 -1.8783 -1.5718 -1.5718 -1.4396 -1.4396 -1.3079 -1.3079 -0.8252 -0.8252 -0.6759 -0.6759 0.6254 0.6254 0.8720 0.8720 1.1265 1.1265 1.2981 1.2981 3.7556 3.7556 4.0257 4.0257 5.1849 5.1849 5.5089 5.5089 7.2010 7.2010 8.2376 8.2376 8.7317 8.7317 k = 0.1875-0.0405-0.0414 ( 7703 PWs) bands (ev): -19.6200 -19.6200 -19.5093 -19.5093 -17.4989 -17.4989 -17.4762 -17.4762 -16.4477 -16.4477 -16.4175 -16.4175 -13.8291 -13.8291 -13.7477 -13.7477 -10.8596 -10.8596 -10.8254 -10.8254 -10.1632 -10.1632 -10.1389 -10.1389 -7.9368 -7.9368 -7.8306 -7.8306 -7.1415 -7.1415 -6.9446 -6.9446 -6.0902 -6.0902 -6.0455 -6.0455 -5.7276 -5.7276 -5.5161 -5.5161 -5.1839 -5.1839 -4.3019 -4.3019 -4.2631 -4.2631 -4.1770 -4.1770 -2.4008 -2.4008 -2.2534 -2.2534 -1.8913 -1.8913 -1.5786 -1.5786 -1.4481 -1.4481 -1.3047 -1.3047 -0.8255 -0.8255 -0.6791 -0.6791 0.6269 0.6269 0.8791 0.8791 1.1287 1.1287 1.2969 1.2969 3.7548 3.7548 4.0316 4.0316 5.1779 5.1779 5.5163 5.5163 7.1684 7.1684 8.2418 8.2418 8.7313 8.7313 k = 0.1719-0.0371-0.0379 ( 7716 PWs) bands (ev): -19.6221 -19.6221 -19.5086 -19.5086 -17.4982 -17.4982 -17.4765 -17.4765 -16.4491 -16.4491 -16.4135 -16.4135 -13.8272 -13.8272 -13.7497 -13.7497 -10.8664 -10.8664 -10.8203 -10.8203 -10.1656 -10.1656 -10.1329 -10.1329 -7.9351 -7.9351 -7.8339 -7.8339 -7.1434 -7.1434 -6.9466 -6.9466 -6.0892 -6.0892 -6.0469 -6.0469 -5.7468 -5.7468 -5.5025 -5.5025 -5.1758 -5.1758 -4.2972 -4.2972 -4.2616 -4.2616 -4.1684 -4.1684 -2.4028 -2.4028 -2.2559 -2.2559 -1.9031 -1.9031 -1.5862 -1.5862 -1.4569 -1.4569 -1.3011 -1.3011 -0.8252 -0.8252 -0.6827 -0.6827 0.6285 0.6285 0.8858 0.8858 1.1315 1.1315 1.2949 1.2949 3.7539 3.7539 4.0370 4.0370 5.1714 5.1714 5.5237 5.5237 7.1380 7.1380 8.2476 8.2476 8.7278 8.7278 k = 0.1562-0.0338-0.0345 ( 7718 PWs) bands (ev): -19.6240 -19.6240 -19.5080 -19.5080 -17.4976 -17.4976 -17.4768 -17.4768 -16.4507 -16.4507 -16.4094 -16.4094 -13.8250 -13.8250 -13.7521 -13.7521 -10.8734 -10.8734 -10.8150 -10.8150 -10.1686 -10.1686 -10.1266 -10.1266 -7.9327 -7.9327 -7.8374 -7.8374 -7.1451 -7.1451 -6.9486 -6.9486 -6.0881 -6.0881 -6.0485 -6.0485 -5.7657 -5.7657 -5.4885 -5.4885 -5.1684 -5.1684 -4.2988 -4.2988 -4.2539 -4.2539 -4.1601 -4.1601 -2.4046 -2.4046 -2.2583 -2.2583 -1.9138 -1.9138 -1.5946 -1.5946 -1.4657 -1.4657 -1.2975 -1.2975 -0.8243 -0.8243 -0.6866 -0.6866 0.6302 0.6302 0.8922 0.8922 1.1349 1.1349 1.2923 1.2923 3.7530 3.7530 4.0420 4.0420 5.1653 5.1653 5.5309 5.5309 7.1101 7.1101 8.2549 8.2549 8.7214 8.7214 k = 0.1406-0.0304-0.0310 ( 7720 PWs) bands (ev): -19.6258 -19.6258 -19.5074 -19.5074 -17.4969 -17.4969 -17.4772 -17.4772 -16.4524 -16.4524 -16.4055 -16.4055 -13.8224 -13.8224 -13.7548 -13.7548 -10.8802 -10.8802 -10.8098 -10.8098 -10.1715 -10.1715 -10.1204 -10.1204 -7.9297 -7.9297 -7.8412 -7.8412 -7.1468 -7.1468 -6.9506 -6.9506 -6.0868 -6.0868 -6.0502 -6.0502 -5.7841 -5.7841 -5.4747 -5.4747 -5.1617 -5.1617 -4.3035 -4.3035 -4.2431 -4.2431 -4.1523 -4.1523 -2.4063 -2.4063 -2.2606 -2.2606 -1.9234 -1.9234 -1.6034 -1.6034 -1.4740 -1.4740 -1.2939 -1.2939 -0.8228 -0.8228 -0.6908 -0.6908 0.6320 0.6320 0.8981 0.8981 1.1389 1.1389 1.2892 1.2892 3.7522 3.7522 4.0463 4.0463 5.1598 5.1598 5.5378 5.5378 7.0846 7.0846 8.2636 8.2636 8.7123 8.7123 k = 0.1250-0.0270-0.0276 ( 7723 PWs) bands (ev): -19.6275 -19.6275 -19.5069 -19.5069 -17.4962 -17.4962 -17.4775 -17.4775 -16.4540 -16.4540 -16.4018 -16.4018 -13.8196 -13.8196 -13.7578 -13.7578 -10.8866 -10.8866 -10.8049 -10.8049 -10.1744 -10.1744 -10.1145 -10.1145 -7.9261 -7.9261 -7.8453 -7.8453 -7.1482 -7.1482 -6.9527 -6.9527 -6.0855 -6.0855 -6.0521 -6.0521 -5.8015 -5.8015 -5.4614 -5.4614 -5.1558 -5.1558 -4.3091 -4.3091 -4.2317 -4.2317 -4.1449 -4.1449 -2.4078 -2.4078 -2.2627 -2.2627 -1.9318 -1.9318 -1.6126 -1.6126 -1.4816 -1.4816 -1.2904 -1.2904 -0.8209 -0.8209 -0.6953 -0.6953 0.6337 0.6337 0.9035 0.9035 1.1433 1.1433 1.2855 1.2855 3.7513 3.7513 4.0502 4.0502 5.1548 5.1548 5.5444 5.5444 7.0616 7.0616 8.2736 8.2736 8.7010 8.7010 k = 0.1094-0.0236-0.0241 ( 7722 PWs) bands (ev): -19.6290 -19.6290 -19.5065 -19.5065 -17.4956 -17.4956 -17.4779 -17.4779 -16.4556 -16.4556 -16.3983 -16.3983 -13.8165 -13.8165 -13.7610 -13.7610 -10.8924 -10.8924 -10.8004 -10.8004 -10.1770 -10.1770 -10.1091 -10.1091 -7.9221 -7.9221 -7.8496 -7.8496 -7.1495 -7.1495 -6.9546 -6.9546 -6.0840 -6.0840 -6.0540 -6.0540 -5.8176 -5.8176 -5.4488 -5.4488 -5.1507 -5.1507 -4.3146 -4.3146 -4.2207 -4.2207 -4.1382 -4.1382 -2.4091 -2.4091 -2.2645 -2.2645 -1.9391 -1.9391 -1.6218 -1.6218 -1.4885 -1.4885 -1.2873 -1.2873 -0.8185 -0.8185 -0.6998 -0.6998 0.6354 0.6354 0.9083 0.9083 1.1481 1.1481 1.2814 1.2814 3.7504 3.7504 4.0536 4.0536 5.1504 5.1504 5.5505 5.5505 7.0412 7.0412 8.2846 8.2846 8.6880 8.6880 k = 0.0938-0.0203-0.0207 ( 7717 PWs) bands (ev): -19.6303 -19.6303 -19.5061 -19.5061 -17.4950 -17.4950 -17.4782 -17.4782 -16.4570 -16.4570 -16.3953 -16.3953 -13.8131 -13.8131 -13.7644 -13.7644 -10.8977 -10.8977 -10.7964 -10.7964 -10.1793 -10.1793 -10.1042 -10.1042 -7.9176 -7.9176 -7.8542 -7.8542 -7.1506 -7.1506 -6.9564 -6.9564 -6.0825 -6.0825 -6.0559 -6.0559 -5.8321 -5.8321 -5.4374 -5.4374 -5.1463 -5.1463 -4.3198 -4.3198 -4.2107 -4.2107 -4.1321 -4.1321 -2.4102 -2.4102 -2.2661 -2.2661 -1.9453 -1.9453 -1.6307 -1.6307 -1.4944 -1.4944 -1.2846 -1.2846 -0.8159 -0.8159 -0.7043 -0.7043 0.6370 0.6370 0.9126 0.9126 1.1531 1.1531 1.2770 1.2770 3.7496 3.7496 4.0564 4.0564 5.1466 5.1466 5.5560 5.5560 7.0234 7.0234 8.2963 8.2963 8.6738 8.6738 k = 0.0781-0.0169-0.0172 ( 7722 PWs) bands (ev): -19.6314 -19.6314 -19.5057 -19.5057 -17.4944 -17.4944 -17.4785 -17.4785 -16.4582 -16.4582 -16.3926 -16.3926 -13.8096 -13.8096 -13.7680 -13.7680 -10.9023 -10.9023 -10.7929 -10.7929 -10.1813 -10.1813 -10.1000 -10.1000 -7.9128 -7.9128 -7.8590 -7.8590 -7.1515 -7.1515 -6.9581 -6.9581 -6.0810 -6.0810 -6.0578 -6.0578 -5.8449 -5.8449 -5.4272 -5.4272 -5.1427 -5.1427 -4.3245 -4.3245 -4.2018 -4.2018 -4.1267 -4.1267 -2.4111 -2.4111 -2.2674 -2.2674 -1.9505 -1.9505 -1.6390 -1.6390 -1.4994 -1.4994 -1.2822 -1.2822 -0.8131 -0.8131 -0.7086 -0.7086 0.6385 0.6385 0.9162 0.9162 1.1581 1.1581 1.2725 1.2725 3.7489 3.7489 4.0588 4.0588 5.1433 5.1433 5.5609 5.5609 7.0082 7.0082 8.3083 8.3083 8.6591 8.6591 k = 0.0625-0.0135-0.0138 ( 7722 PWs) bands (ev): -19.6323 -19.6323 -19.5055 -19.5055 -17.4939 -17.4939 -17.4788 -17.4788 -16.4592 -16.4592 -16.3903 -16.3903 -13.8059 -13.8059 -13.7718 -13.7718 -10.9061 -10.9061 -10.7899 -10.7899 -10.1830 -10.1830 -10.0965 -10.0965 -7.9077 -7.9077 -7.8641 -7.8641 -7.1523 -7.1523 -6.9594 -6.9594 -6.0796 -6.0796 -6.0594 -6.0594 -5.8557 -5.8557 -5.4185 -5.4185 -5.1398 -5.1398 -4.3284 -4.3284 -4.1944 -4.1944 -4.1222 -4.1222 -2.4118 -2.4118 -2.2685 -2.2685 -1.9547 -1.9547 -1.6463 -1.6463 -1.5035 -1.5035 -1.2803 -1.2803 -0.8104 -0.8104 -0.7126 -0.7126 0.6397 0.6397 0.9192 0.9192 1.1629 1.1629 1.2681 1.2681 3.7483 3.7483 4.0607 4.0607 5.1407 5.1407 5.5649 5.5649 6.9958 6.9958 8.3200 8.3200 8.6450 8.6450 k = 0.0469-0.0101-0.0103 ( 7718 PWs) bands (ev): -19.6330 -19.6330 -19.5053 -19.5053 -17.4935 -17.4935 -17.4791 -17.4791 -16.4600 -16.4600 -16.3886 -16.3886 -13.8022 -13.8022 -13.7756 -13.7756 -10.9091 -10.9091 -10.7876 -10.7876 -10.1843 -10.1843 -10.0937 -10.0937 -7.9024 -7.9024 -7.8693 -7.8693 -7.1529 -7.1529 -6.9606 -6.9606 -6.0783 -6.0783 -6.0609 -6.0609 -5.8643 -5.8643 -5.4116 -5.4116 -5.1377 -5.1377 -4.3315 -4.3315 -4.1885 -4.1885 -4.1186 -4.1186 -2.4123 -2.4123 -2.2694 -2.2694 -1.9579 -1.9579 -1.6524 -1.6524 -1.5066 -1.5066 -1.2788 -1.2788 -0.8080 -0.8080 -0.7160 -0.7160 0.6407 0.6407 0.9216 0.9216 1.1673 1.1673 1.2641 1.2641 3.7478 3.7478 4.0622 4.0622 5.1386 5.1386 5.5682 5.5682 6.9861 6.9861 8.3305 8.3305 8.6322 8.6322 k = 0.0312-0.0068-0.0069 ( 7720 PWs) bands (ev): -19.6336 -19.6336 -19.5051 -19.5051 -17.4932 -17.4932 -17.4793 -17.4793 -16.4606 -16.4606 -16.3873 -16.3873 -13.7985 -13.7985 -13.7793 -13.7793 -10.9113 -10.9113 -10.7860 -10.7860 -10.1853 -10.1853 -10.0917 -10.0917 -7.8969 -7.8969 -7.8747 -7.8747 -7.1533 -7.1533 -6.9614 -6.9614 -6.0772 -6.0772 -6.0620 -6.0620 -5.8705 -5.8705 -5.4065 -5.4065 -5.1361 -5.1361 -4.3338 -4.3338 -4.1842 -4.1842 -4.1159 -4.1159 -2.4127 -2.4127 -2.2700 -2.2700 -1.9601 -1.9601 -1.6569 -1.6569 -1.5088 -1.5088 -1.2777 -1.2777 -0.8060 -0.8060 -0.7187 -0.7187 0.6415 0.6415 0.9233 0.9233 1.1708 1.1708 1.2609 1.2609 3.7475 3.7475 4.0632 4.0632 5.1371 5.1371 5.5706 5.5706 6.9791 6.9791 8.3390 8.3390 8.6219 8.6219 k = 0.0156-0.0034-0.0034 ( 7716 PWs) bands (ev): -19.6339 -19.6339 -19.5050 -19.5050 -17.4931 -17.4931 -17.4794 -17.4794 -16.4610 -16.4610 -16.3865 -16.3865 -13.7952 -13.7952 -13.7826 -13.7826 -10.9127 -10.9127 -10.7850 -10.7850 -10.1859 -10.1859 -10.0905 -10.0905 -7.8913 -7.8913 -7.8801 -7.8801 -7.1536 -7.1536 -6.9619 -6.9619 -6.0765 -6.0765 -6.0627 -6.0627 -5.8743 -5.8743 -5.4034 -5.4034 -5.1352 -5.1352 -4.3352 -4.3352 -4.1817 -4.1817 -4.1142 -4.1142 -2.4129 -2.4129 -2.2703 -2.2703 -1.9615 -1.9615 -1.6597 -1.6597 -1.5101 -1.5101 -1.2771 -1.2771 -0.8047 -0.8047 -0.7204 -0.7204 0.6419 0.6419 0.9243 0.9243 1.1731 1.1731 1.2587 1.2587 3.7473 3.7473 4.0638 4.0638 5.1363 5.1363 5.5720 5.5720 6.9750 6.9750 8.3446 8.3446 8.6152 8.6152 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0161-0.0009 ( 7717 PWs) bands (ev): -19.6339 -19.6339 -19.5049 -19.5049 -17.4934 -17.4934 -17.4797 -17.4797 -16.4610 -16.4610 -16.3862 -16.3862 -13.7936 -13.7936 -13.7836 -13.7836 -10.9128 -10.9128 -10.7846 -10.7846 -10.1859 -10.1859 -10.0901 -10.0901 -7.8892 -7.8892 -7.8827 -7.8827 -7.1545 -7.1545 -6.9633 -6.9633 -6.0770 -6.0770 -6.0626 -6.0626 -5.8742 -5.8742 -5.4021 -5.4021 -5.1347 -5.1347 -4.3358 -4.3358 -4.1812 -4.1812 -4.1137 -4.1137 -2.4133 -2.4133 -2.2699 -2.2699 -1.9620 -1.9620 -1.6600 -1.6600 -1.5101 -1.5101 -1.2762 -1.2762 -0.8050 -0.8050 -0.7220 -0.7220 0.6416 0.6416 0.9243 0.9243 1.1743 1.1743 1.2583 1.2583 3.7475 3.7475 4.0642 4.0642 5.1370 5.1370 5.5732 5.5732 6.9751 6.9751 8.3466 8.3466 8.6124 8.6124 k = 0.0000 0.0321-0.0019 ( 7717 PWs) bands (ev): -19.6335 -19.6335 -19.5047 -19.5047 -17.4948 -17.4948 -17.4805 -17.4805 -16.4606 -16.4606 -16.3859 -16.3859 -13.7935 -13.7935 -13.7817 -13.7817 -10.9121 -10.9121 -10.7846 -10.7846 -10.1854 -10.1854 -10.0902 -10.0902 -7.8930 -7.8930 -7.8801 -7.8801 -7.1568 -7.1568 -6.9668 -6.9668 -6.0791 -6.0791 -6.0618 -6.0618 -5.8700 -5.8700 -5.4013 -5.4013 -5.1338 -5.1338 -4.3362 -4.3362 -4.1822 -4.1822 -4.1139 -4.1139 -2.4144 -2.4144 -2.2685 -2.2685 -1.9624 -1.9624 -1.6580 -1.6580 -1.5088 -1.5088 -1.2744 -1.2744 -0.8072 -0.8072 -0.7250 -0.7250 0.6401 0.6401 0.9233 0.9233 1.1755 1.1755 1.2593 1.2593 3.7482 3.7482 4.0649 4.0649 5.1400 5.1400 5.5752 5.5752 6.9796 6.9796 8.3466 8.3466 8.6108 8.6108 k = 0.0000 0.0482-0.0028 ( 7720 PWs) bands (ev): -19.6328 -19.6328 -19.5045 -19.5045 -17.4969 -17.4969 -17.4818 -17.4818 -16.4601 -16.4601 -16.3855 -16.3855 -13.7931 -13.7931 -13.7789 -13.7789 -10.9108 -10.9108 -10.7845 -10.7845 -10.1846 -10.1846 -10.0903 -10.0903 -7.8972 -7.8972 -7.8780 -7.8780 -7.1607 -7.1607 -6.9727 -6.9727 -6.0821 -6.0821 -6.0606 -6.0606 -5.8633 -5.8633 -5.4000 -5.4000 -5.1325 -5.1325 -4.3369 -4.3369 -4.1840 -4.1840 -4.1141 -4.1141 -2.4159 -2.4159 -2.2662 -2.2662 -1.9631 -1.9631 -1.6548 -1.6548 -1.5065 -1.5065 -1.2713 -1.2713 -0.8109 -0.8109 -0.7299 -0.7299 0.6377 0.6377 0.9216 0.9216 1.1775 1.1775 1.2610 1.2610 3.7494 3.7494 4.0659 4.0659 5.1450 5.1450 5.5786 5.5786 6.9872 6.9872 8.3465 8.3465 8.6082 8.6082 k = 0.0000 0.0642-0.0038 ( 7715 PWs) bands (ev): -19.6319 -19.6319 -19.5041 -19.5041 -17.4999 -17.4999 -17.4836 -17.4836 -16.4593 -16.4593 -16.3849 -16.3849 -13.7922 -13.7922 -13.7752 -13.7752 -10.9091 -10.9091 -10.7844 -10.7844 -10.1834 -10.1834 -10.0904 -10.0904 -7.9017 -7.9017 -7.8763 -7.8763 -7.1661 -7.1661 -6.9807 -6.9807 -6.0855 -6.0855 -6.0593 -6.0593 -5.8542 -5.8542 -5.3983 -5.3983 -5.1306 -5.1306 -4.3378 -4.3378 -4.1865 -4.1865 -4.1144 -4.1144 -2.4180 -2.4180 -2.2632 -2.2632 -1.9640 -1.9640 -1.6504 -1.6504 -1.5032 -1.5032 -1.2671 -1.2671 -0.8159 -0.8159 -0.7367 -0.7367 0.6343 0.6343 0.9193 0.9193 1.1803 1.1803 1.2633 1.2633 3.7511 3.7511 4.0675 4.0675 5.1519 5.1519 5.5832 5.5832 6.9977 6.9977 8.3464 8.3464 8.6046 8.6046 k = 0.0000 0.0803-0.0047 ( 7716 PWs) bands (ev): -19.6307 -19.6307 -19.5036 -19.5036 -17.5035 -17.5035 -17.4860 -17.4860 -16.4584 -16.4584 -16.3842 -16.3842 -13.7910 -13.7910 -13.7708 -13.7708 -10.9068 -10.9068 -10.7843 -10.7843 -10.1820 -10.1820 -10.0906 -10.0906 -7.9066 -7.9066 -7.8750 -7.8750 -7.1730 -7.1730 -6.9908 -6.9908 -6.0893 -6.0893 -6.0579 -6.0579 -5.8431 -5.8431 -5.3960 -5.3960 -5.1282 -5.1282 -4.3389 -4.3389 -4.1897 -4.1897 -4.1148 -4.1148 -2.4204 -2.4204 -2.2596 -2.2596 -1.9651 -1.9651 -1.6452 -1.6452 -1.4989 -1.4989 -1.2618 -1.2618 -0.8222 -0.8222 -0.7452 -0.7452 0.6301 0.6301 0.9164 0.9164 1.1839 1.1839 1.2663 1.2663 3.7532 3.7532 4.0694 4.0694 5.1606 5.1606 5.5891 5.5891 7.0111 7.0111 8.3464 8.3464 8.5997 8.5997 k = 0.0000 0.0963-0.0057 ( 7715 PWs) bands (ev): -19.6293 -19.6293 -19.5030 -19.5030 -17.5078 -17.5078 -17.4888 -17.4888 -16.4572 -16.4572 -16.3834 -16.3834 -13.7892 -13.7892 -13.7658 -13.7658 -10.9042 -10.9042 -10.7841 -10.7841 -10.1803 -10.1803 -10.0908 -10.0908 -7.9116 -7.9116 -7.8743 -7.8743 -7.1812 -7.1812 -7.0028 -7.0028 -6.0932 -6.0932 -6.0564 -6.0564 -5.8302 -5.8302 -5.3934 -5.3934 -5.1254 -5.1254 -4.3402 -4.3402 -4.1934 -4.1934 -4.1153 -4.1153 -2.4229 -2.4229 -2.2556 -2.2556 -1.9665 -1.9665 -1.6392 -1.6392 -1.4935 -1.4935 -1.2557 -1.2557 -0.8297 -0.8297 -0.7553 -0.7553 0.6250 0.6250 0.9129 0.9129 1.1881 1.1881 1.2698 1.2698 3.7557 3.7557 4.0719 4.0719 5.1709 5.1709 5.5961 5.5961 7.0273 7.0273 8.3464 8.3464 8.5937 8.5937 k = 0.0000 0.1124-0.0066 ( 7718 PWs) bands (ev): -19.6277 -19.6277 -19.5023 -19.5023 -17.5127 -17.5127 -17.4922 -17.4922 -16.4559 -16.4559 -16.3824 -16.3824 -13.7869 -13.7869 -13.7603 -13.7603 -10.9010 -10.9010 -10.7840 -10.7840 -10.1784 -10.1784 -10.0910 -10.0910 -7.9168 -7.9168 -7.8739 -7.8739 -7.1908 -7.1908 -7.0166 -7.0166 -6.0969 -6.0969 -6.0547 -6.0547 -5.8159 -5.8159 -5.3904 -5.3904 -5.1221 -5.1221 -4.3417 -4.3417 -4.1978 -4.1978 -4.1159 -4.1159 -2.4255 -2.4255 -2.2513 -2.2513 -1.9680 -1.9680 -1.6329 -1.6329 -1.4869 -1.4869 -1.2489 -1.2489 -0.8381 -0.8381 -0.7668 -0.7668 0.6192 0.6192 0.9089 0.9089 1.1929 1.1929 1.2739 1.2739 3.7585 3.7585 4.0749 4.0749 5.1826 5.1826 5.6041 5.6041 7.0464 7.0464 8.3465 8.3465 8.5863 8.5863 k = 0.0000 0.1284-0.0076 ( 7716 PWs) bands (ev): -19.6259 -19.6259 -19.5015 -19.5015 -17.5180 -17.5180 -17.4960 -17.4960 -16.4545 -16.4545 -16.3813 -16.3813 -13.7843 -13.7843 -13.7543 -13.7543 -10.8975 -10.8975 -10.7837 -10.7837 -10.1762 -10.1762 -10.0912 -10.0912 -7.9222 -7.9222 -7.8741 -7.8741 -7.2015 -7.2015 -7.0318 -7.0318 -6.1004 -6.1004 -6.0530 -6.0530 -5.8003 -5.8003 -5.3870 -5.3870 -5.1184 -5.1184 -4.3433 -4.3433 -4.2027 -4.2027 -4.1166 -4.1166 -2.4280 -2.4280 -2.2469 -2.2469 -1.9696 -1.9696 -1.6262 -1.6262 -1.4790 -1.4790 -1.2416 -1.2416 -0.8475 -0.8475 -0.7795 -0.7795 0.6126 0.6126 0.9043 0.9043 1.1984 1.1984 1.2784 1.2784 3.7615 3.7615 4.0784 4.0784 5.1957 5.1957 5.6131 5.6131 7.0682 7.0682 8.3467 8.3467 8.5777 8.5777 k = 0.0000 0.1445-0.0085 ( 7719 PWs) bands (ev): -19.6239 -19.6239 -19.5007 -19.5007 -17.5237 -17.5237 -17.5003 -17.5003 -16.4529 -16.4529 -16.3802 -16.3802 -13.7812 -13.7812 -13.7479 -13.7479 -10.8937 -10.8937 -10.7835 -10.7835 -10.1739 -10.1739 -10.0915 -10.0915 -7.9275 -7.9275 -7.8747 -7.8747 -7.2133 -7.2133 -7.0484 -7.0484 -6.1036 -6.1036 -6.0512 -6.0512 -5.7837 -5.7837 -5.3835 -5.3835 -5.1144 -5.1144 -4.3450 -4.3450 -4.2081 -4.2081 -4.1175 -4.1175 -2.4304 -2.4304 -2.2425 -2.2425 -1.9713 -1.9713 -1.6196 -1.6196 -1.4700 -1.4700 -1.2340 -1.2340 -0.8575 -0.8575 -0.7931 -0.7931 0.6055 0.6055 0.8994 0.8994 1.2043 1.2043 1.2834 1.2834 3.7648 3.7648 4.0824 4.0824 5.2099 5.2099 5.6228 5.6228 7.0926 7.0926 8.3470 8.3470 8.5676 8.5676 k = 0.0000 0.1605-0.0095 ( 7717 PWs) bands (ev): -19.6218 -19.6218 -19.4998 -19.4998 -17.5297 -17.5297 -17.5049 -17.5049 -16.4513 -16.4513 -16.3790 -16.3790 -13.7779 -13.7779 -13.7412 -13.7412 -10.8895 -10.8895 -10.7831 -10.7831 -10.1714 -10.1714 -10.0917 -10.0917 -7.9328 -7.9328 -7.8757 -7.8757 -7.2261 -7.2261 -7.0660 -7.0660 -6.1064 -6.1064 -6.0493 -6.0493 -5.7662 -5.7662 -5.3798 -5.3798 -5.1102 -5.1102 -4.3468 -4.3468 -4.2140 -4.2140 -4.1184 -4.1184 -2.4324 -2.4324 -2.2382 -2.2382 -1.9731 -1.9731 -1.6132 -1.6132 -1.4597 -1.4597 -1.2263 -1.2263 -0.8681 -0.8681 -0.8074 -0.8074 0.5979 0.5979 0.8941 0.8941 1.2107 1.2107 1.2888 1.2888 3.7682 3.7682 4.0870 4.0870 5.2249 5.2249 5.6333 5.6333 7.1196 7.1196 8.3475 8.3475 8.5560 8.5560 k = 0.0000 0.1766-0.0104 ( 7713 PWs) bands (ev): -19.6195 -19.6195 -19.4989 -19.4989 -17.5360 -17.5360 -17.5097 -17.5097 -16.4496 -16.4496 -16.3777 -16.3777 -13.7743 -13.7743 -13.7343 -13.7343 -10.8850 -10.8850 -10.7828 -10.7828 -10.1688 -10.1688 -10.0920 -10.0920 -7.9380 -7.9380 -7.8772 -7.8772 -7.2397 -7.2397 -7.0844 -7.0844 -6.1088 -6.1088 -6.0473 -6.0473 -5.7481 -5.7481 -5.3759 -5.3759 -5.1057 -5.1057 -4.3486 -4.3486 -4.2203 -4.2203 -4.1194 -4.1194 -2.4341 -2.4341 -2.2343 -2.2343 -1.9748 -1.9748 -1.6070 -1.6070 -1.4485 -1.4485 -1.2188 -1.2188 -0.8791 -0.8791 -0.8219 -0.8219 0.5899 0.5899 0.8884 0.8884 1.2174 1.2174 1.2945 1.2945 3.7717 3.7717 4.0919 4.0919 5.2407 5.2407 5.6443 5.6443 7.1491 7.1491 8.3482 8.3482 8.5428 8.5428 k = 0.0000 0.1927-0.0114 ( 7715 PWs) bands (ev): -19.6171 -19.6171 -19.4980 -19.4980 -17.5424 -17.5424 -17.5148 -17.5148 -16.4478 -16.4478 -16.3764 -16.3764 -13.7704 -13.7704 -13.7272 -13.7272 -10.8803 -10.8803 -10.7824 -10.7824 -10.1661 -10.1661 -10.0922 -10.0922 -7.9430 -7.9430 -7.8791 -7.8791 -7.2538 -7.2538 -7.1033 -7.1033 -6.1108 -6.1108 -6.0453 -6.0453 -5.7296 -5.7296 -5.3721 -5.3721 -5.1011 -5.1011 -4.3503 -4.3503 -4.2270 -4.2270 -4.1205 -4.1205 -2.4355 -2.4355 -2.2307 -2.2307 -1.9765 -1.9765 -1.6013 -1.6013 -1.4364 -1.4364 -1.2116 -1.2116 -0.8905 -0.8905 -0.8363 -0.8363 0.5816 0.5816 0.8826 0.8826 1.2243 1.2243 1.3004 1.3004 3.7752 3.7752 4.0973 4.0973 5.2569 5.2569 5.6556 5.6556 7.1809 7.1809 8.3491 8.3491 8.5279 8.5279 k = 0.0000 0.2087-0.0123 ( 7709 PWs) bands (ev): -19.6147 -19.6147 -19.4971 -19.4971 -17.5488 -17.5488 -17.5200 -17.5200 -16.4461 -16.4461 -16.3751 -16.3751 -13.7665 -13.7665 -13.7200 -13.7200 -10.8754 -10.8754 -10.7820 -10.7820 -10.1633 -10.1633 -10.0925 -10.0925 -7.9477 -7.9477 -7.8815 -7.8815 -7.2683 -7.2683 -7.1225 -7.1225 -6.1124 -6.1124 -6.0433 -6.0433 -5.7107 -5.7107 -5.3684 -5.3684 -5.0964 -5.0964 -4.3520 -4.3520 -4.2340 -4.2340 -4.1217 -4.1217 -2.4365 -2.4365 -2.2275 -2.2275 -1.9781 -1.9781 -1.5959 -1.5959 -1.4237 -1.4237 -1.2051 -1.2051 -0.9022 -0.9022 -0.8500 -0.8500 0.5731 0.5731 0.8766 0.8766 1.2314 1.2314 1.3065 1.3065 3.7788 3.7788 4.1031 4.1031 5.2733 5.2733 5.6672 5.6672 7.2150 7.2150 8.3502 8.3502 8.5110 8.5110 k = 0.0000 0.2248-0.0133 ( 7705 PWs) bands (ev): -19.6122 -19.6122 -19.4961 -19.4961 -17.5552 -17.5552 -17.5253 -17.5253 -16.4443 -16.4443 -16.3738 -16.3738 -13.7624 -13.7624 -13.7128 -13.7128 -10.8703 -10.8703 -10.7816 -10.7816 -10.1606 -10.1606 -10.0927 -10.0927 -7.9521 -7.9521 -7.8843 -7.8843 -7.2830 -7.2830 -7.1418 -7.1418 -6.1136 -6.1136 -6.0413 -6.0413 -5.6916 -5.6916 -5.3648 -5.3648 -5.0916 -5.0916 -4.3535 -4.3535 -4.2413 -4.2413 -4.1229 -4.1229 -2.4370 -2.4370 -2.2249 -2.2249 -1.9795 -1.9795 -1.5910 -1.5910 -1.4106 -1.4106 -1.1993 -1.1993 -0.9143 -0.9143 -0.8626 -0.8626 0.5646 0.5646 0.8706 0.8706 1.2385 1.2385 1.3127 1.3127 3.7823 3.7823 4.1091 4.1091 5.2897 5.2897 5.6789 5.6789 7.2512 7.2512 8.3513 8.3513 8.4920 8.4920 k = 0.0000 0.2408-0.0142 ( 7705 PWs) bands (ev): -19.6098 -19.6098 -19.4952 -19.4952 -17.5616 -17.5616 -17.5306 -17.5306 -16.4426 -16.4426 -16.3725 -16.3725 -13.7584 -13.7584 -13.7058 -13.7058 -10.8653 -10.8653 -10.7812 -10.7812 -10.1579 -10.1579 -10.0930 -10.0930 -7.9561 -7.9561 -7.8875 -7.8875 -7.2978 -7.2978 -7.1607 -7.1607 -6.1145 -6.1145 -6.0393 -6.0393 -5.6727 -5.6727 -5.3616 -5.3616 -5.0869 -5.0869 -4.3548 -4.3548 -4.2487 -4.2487 -4.1241 -4.1241 -2.4372 -2.4372 -2.2228 -2.2228 -1.9807 -1.9807 -1.5865 -1.5865 -1.3975 -1.3975 -1.1946 -1.1946 -0.9268 -0.9268 -0.8737 -0.8737 0.5561 0.5561 0.8646 0.8646 1.2455 1.2455 1.3189 1.3189 3.7857 3.7857 4.1152 4.1152 5.3059 5.3059 5.6904 5.6904 7.2896 7.2896 8.3522 8.3522 8.4704 8.4704 k = 0.0000 0.2569-0.0152 ( 7703 PWs) bands (ev): -19.6073 -19.6073 -19.4944 -19.4944 -17.5677 -17.5677 -17.5358 -17.5358 -16.4409 -16.4409 -16.3713 -16.3713 -13.7544 -13.7544 -13.6989 -13.6989 -10.8602 -10.8602 -10.7808 -10.7808 -10.1552 -10.1552 -10.0932 -10.0932 -7.9595 -7.9595 -7.8910 -7.8910 -7.3122 -7.3122 -7.1792 -7.1792 -6.1151 -6.1151 -6.0373 -6.0373 -5.6539 -5.6539 -5.3586 -5.3586 -5.0823 -5.0823 -4.3558 -4.3558 -4.2563 -4.2563 -4.1254 -4.1254 -2.4370 -2.4370 -2.2213 -2.2213 -1.9817 -1.9817 -1.5824 -1.5824 -1.3846 -1.3846 -1.1908 -1.1908 -0.9395 -0.9395 -0.8830 -0.8830 0.5478 0.5478 0.8588 0.8588 1.2524 1.2524 1.3251 1.3251 3.7890 3.7890 4.1215 4.1215 5.3217 5.3217 5.7018 5.7018 7.3299 7.3299 8.3521 8.3521 8.4463 8.4463 k = 0.0000 0.2729-0.0161 ( 7701 PWs) bands (ev): -19.6049 -19.6049 -19.4935 -19.4935 -17.5736 -17.5736 -17.5408 -17.5408 -16.4393 -16.4393 -16.3701 -16.3701 -13.7505 -13.7505 -13.6923 -13.6923 -10.8552 -10.8552 -10.7804 -10.7804 -10.1526 -10.1526 -10.0935 -10.0935 -7.9624 -7.9624 -7.8950 -7.8950 -7.3262 -7.3262 -7.1970 -7.1970 -6.1154 -6.1154 -6.0354 -6.0354 -5.6354 -5.6354 -5.3561 -5.3561 -5.0779 -5.0779 -4.3565 -4.3565 -4.2639 -4.2639 -4.1266 -4.1266 -2.4364 -2.4364 -2.2203 -2.2203 -1.9825 -1.9825 -1.5787 -1.5787 -1.3722 -1.3722 -1.1881 -1.1881 -0.9524 -0.9524 -0.8902 -0.8902 0.5397 0.5397 0.8531 0.8531 1.2590 1.2590 1.3310 1.3310 3.7921 3.7921 4.1277 4.1277 5.3368 5.3368 5.7127 5.7127 7.3722 7.3722 8.3492 8.3492 8.4210 8.4210 k = 0.0000 0.2890-0.0171 ( 7697 PWs) bands (ev): -19.6026 -19.6026 -19.4927 -19.4927 -17.5791 -17.5791 -17.5456 -17.5456 -16.4378 -16.4378 -16.3690 -16.3690 -13.7468 -13.7468 -13.6860 -13.6860 -10.8504 -10.8504 -10.7800 -10.7800 -10.1501 -10.1501 -10.0938 -10.0938 -7.9648 -7.9648 -7.8992 -7.8992 -7.3396 -7.3396 -7.2138 -7.2138 -6.1155 -6.1155 -6.0336 -6.0336 -5.6176 -5.6176 -5.3541 -5.3541 -5.0737 -5.0737 -4.3568 -4.3568 -4.2716 -4.2716 -4.1278 -4.1278 -2.4356 -2.4356 -2.2199 -2.2199 -1.9830 -1.9830 -1.5753 -1.5753 -1.3604 -1.3604 -1.1864 -1.1864 -0.9651 -0.9651 -0.8956 -0.8956 0.5320 0.5320 0.8477 0.8477 1.2654 1.2654 1.3368 1.3368 3.7951 3.7951 4.1338 4.1338 5.3512 5.3512 5.7231 5.7231 7.4162 7.4162 8.3376 8.3376 8.3998 8.3998 k = 0.0000 0.3050-0.0180 ( 7697 PWs) bands (ev): -19.6004 -19.6004 -19.4920 -19.4920 -17.5843 -17.5843 -17.5501 -17.5501 -16.4364 -16.4364 -16.3679 -16.3679 -13.7433 -13.7433 -13.6802 -13.6802 -10.8458 -10.8458 -10.7797 -10.7797 -10.1478 -10.1478 -10.0940 -10.0940 -7.9665 -7.9665 -7.9036 -7.9036 -7.3520 -7.3520 -7.2295 -7.2295 -6.1155 -6.1155 -6.0319 -6.0319 -5.6006 -5.6006 -5.3526 -5.3526 -5.0698 -5.0698 -4.3568 -4.3568 -4.2791 -4.2791 -4.1290 -4.1290 -2.4345 -2.4345 -2.2199 -2.2199 -1.9833 -1.9833 -1.5724 -1.5724 -1.3497 -1.3497 -1.1855 -1.1855 -0.9773 -0.9773 -0.8994 -0.8994 0.5248 0.5248 0.8426 0.8426 1.2713 1.2713 1.3421 1.3421 3.7978 3.7978 4.1395 4.1395 5.3645 5.3645 5.7328 5.7328 7.4619 7.4619 8.3104 8.3104 8.3895 8.3895 k = 0.0000 0.3211-0.0189 ( 7694 PWs) bands (ev): -19.5984 -19.5984 -19.4914 -19.4914 -17.5890 -17.5890 -17.5543 -17.5543 -16.4351 -16.4351 -16.3670 -16.3670 -13.7401 -13.7401 -13.6749 -13.6749 -10.8415 -10.8415 -10.7794 -10.7794 -10.1456 -10.1456 -10.0943 -10.0943 -7.9676 -7.9676 -7.9083 -7.9083 -7.3635 -7.3635 -7.2438 -7.2438 -6.1153 -6.1153 -6.0304 -6.0304 -5.5845 -5.5845 -5.3516 -5.3516 -5.0663 -5.0663 -4.3562 -4.3562 -4.2866 -4.2866 -4.1300 -4.1300 -2.4333 -2.4333 -2.2203 -2.2203 -1.9834 -1.9834 -1.5697 -1.5697 -1.3400 -1.3400 -1.1853 -1.1853 -0.9887 -0.9887 -0.9019 -0.9019 0.5182 0.5182 0.8380 0.8380 1.2767 1.2767 1.3471 1.3471 3.8003 3.8003 4.1449 4.1449 5.3766 5.3766 5.7417 5.7417 7.5091 7.5091 8.2707 8.2707 8.3875 8.3875 k = 0.0000 0.3371-0.0199 ( 7698 PWs) bands (ev): -19.5966 -19.5966 -19.4908 -19.4908 -17.5931 -17.5931 -17.5580 -17.5580 -16.4340 -16.4340 -16.3662 -16.3662 -13.7373 -13.7373 -13.6701 -13.6701 -10.8375 -10.8375 -10.7792 -10.7792 -10.1437 -10.1437 -10.0946 -10.0946 -7.9681 -7.9681 -7.9130 -7.9130 -7.3737 -7.3737 -7.2565 -7.2565 -6.1151 -6.1151 -6.0290 -6.0290 -5.5697 -5.5697 -5.3512 -5.3512 -5.0631 -5.0631 -4.3552 -4.3552 -4.2938 -4.2938 -4.1310 -4.1310 -2.4320 -2.4320 -2.2210 -2.2210 -1.9834 -1.9834 -1.5674 -1.5674 -1.3317 -1.3317 -1.1855 -1.1855 -0.9989 -0.9989 -0.9033 -0.9033 0.5123 0.5123 0.8338 0.8338 1.2816 1.2816 1.3516 1.3516 3.8025 3.8025 4.1498 4.1498 5.3875 5.3875 5.7496 5.7496 7.5576 7.5576 8.2242 8.2242 8.3888 8.3888 k = 0.0000 0.3532-0.0208 ( 7699 PWs) bands (ev): -19.5950 -19.5950 -19.4903 -19.4903 -17.5968 -17.5968 -17.5612 -17.5612 -16.4330 -16.4330 -16.3654 -16.3654 -13.7348 -13.7348 -13.6660 -13.6660 -10.8340 -10.8340 -10.7790 -10.7790 -10.1419 -10.1419 -10.0948 -10.0948 -7.9681 -7.9681 -7.9176 -7.9176 -7.3826 -7.3826 -7.2676 -7.2676 -6.1148 -6.1148 -6.0278 -6.0278 -5.5565 -5.5565 -5.3511 -5.3511 -5.0604 -5.0604 -4.3538 -4.3538 -4.3006 -4.3006 -4.1319 -4.1319 -2.4307 -2.4307 -2.2218 -2.2218 -1.9832 -1.9832 -1.5655 -1.5655 -1.3247 -1.3247 -1.1860 -1.1860 -1.0079 -1.0079 -0.9040 -0.9040 0.5071 0.5071 0.8302 0.8302 1.2858 1.2858 1.3555 1.3555 3.8044 3.8044 4.1542 4.1542 5.3969 5.3969 5.7565 5.7565 7.6073 7.6073 8.1740 8.1740 8.3914 8.3914 k = 0.0000 0.3693-0.0218 ( 7698 PWs) bands (ev): -19.5937 -19.5937 -19.4899 -19.4899 -17.5998 -17.5998 -17.5639 -17.5639 -16.4322 -16.4322 -16.3648 -16.3648 -13.7327 -13.7327 -13.6626 -13.6626 -10.8310 -10.8310 -10.7789 -10.7789 -10.1405 -10.1405 -10.0951 -10.0951 -7.9675 -7.9675 -7.9220 -7.9220 -7.3901 -7.3901 -7.2768 -7.2768 -6.1146 -6.1146 -6.0269 -6.0269 -5.5450 -5.5450 -5.3515 -5.3515 -5.0581 -5.0581 -4.3519 -4.3519 -4.3070 -4.3070 -4.1326 -4.1326 -2.4295 -2.4295 -2.2226 -2.2226 -1.9831 -1.9831 -1.5639 -1.5639 -1.3190 -1.3190 -1.1865 -1.1865 -1.0154 -1.0154 -0.9042 -0.9042 0.5028 0.5028 0.8272 0.8272 1.2893 1.2893 1.3588 1.3588 3.8060 3.8060 4.1579 4.1579 5.4048 5.4048 5.7623 5.7623 7.6578 7.6578 8.1218 8.1218 8.3945 8.3945 k = 0.0000 0.3853-0.0227 ( 7706 PWs) bands (ev): -19.5926 -19.5926 -19.4896 -19.4896 -17.6022 -17.6022 -17.5661 -17.5661 -16.4316 -16.4316 -16.3644 -16.3644 -13.7310 -13.7310 -13.6598 -13.6598 -10.8286 -10.8286 -10.7788 -10.7788 -10.1393 -10.1393 -10.0953 -10.0953 -7.9667 -7.9667 -7.9259 -7.9259 -7.3959 -7.3959 -7.2842 -7.2842 -6.1144 -6.1144 -6.0261 -6.0261 -5.5357 -5.5357 -5.3520 -5.3520 -5.0562 -5.0562 -4.3497 -4.3497 -4.3129 -4.3129 -4.1332 -4.1332 -2.4285 -2.4285 -2.2235 -2.2235 -1.9829 -1.9829 -1.5627 -1.5627 -1.3148 -1.3148 -1.1870 -1.1870 -1.0214 -1.0214 -0.9041 -0.9041 0.4994 0.4994 0.8248 0.8248 1.2921 1.2921 1.3613 1.3613 3.8073 3.8073 4.1608 4.1608 5.4110 5.4110 5.7669 5.7669 7.7084 7.7084 8.0691 8.0691 8.3975 8.3975 k = 0.0000 0.4014-0.0237 ( 7707 PWs) bands (ev): -19.5919 -19.5919 -19.4893 -19.4893 -17.6039 -17.6039 -17.5676 -17.5676 -16.4311 -16.4311 -16.3640 -16.3640 -13.7298 -13.7298 -13.6579 -13.6579 -10.8268 -10.8268 -10.7788 -10.7788 -10.1385 -10.1385 -10.0954 -10.0954 -7.9657 -7.9657 -7.9291 -7.9291 -7.4002 -7.4002 -7.2894 -7.2894 -6.1142 -6.1142 -6.0255 -6.0255 -5.5287 -5.5287 -5.3526 -5.3526 -5.0549 -5.0549 -4.3474 -4.3474 -4.3178 -4.3178 -4.1336 -4.1336 -2.4277 -2.4277 -2.2241 -2.2241 -1.9827 -1.9827 -1.5618 -1.5618 -1.3118 -1.3118 -1.1873 -1.1873 -1.0257 -1.0257 -0.9039 -0.9039 0.4969 0.4969 0.8230 0.8230 1.2942 1.2942 1.3632 1.3632 3.8082 3.8082 4.1629 4.1629 5.4155 5.4155 5.7702 5.7702 7.7576 7.7576 8.0181 8.0181 8.4000 8.4000 k = 0.0000 0.4174-0.0246 ( 7704 PWs) bands (ev): -19.5914 -19.5914 -19.4892 -19.4892 -17.6049 -17.6049 -17.5685 -17.5685 -16.4308 -16.4308 -16.3638 -16.3638 -13.7291 -13.7291 -13.6567 -13.6567 -10.8257 -10.8257 -10.7788 -10.7788 -10.1379 -10.1379 -10.0955 -10.0955 -7.9649 -7.9649 -7.9313 -7.9313 -7.4028 -7.4028 -7.2926 -7.2926 -6.1141 -6.1141 -6.0251 -6.0251 -5.5244 -5.5244 -5.3530 -5.3530 -5.0541 -5.0541 -4.3455 -4.3455 -4.3213 -4.3213 -4.1339 -4.1339 -2.4273 -2.4273 -2.2245 -2.2245 -1.9826 -1.9826 -1.5613 -1.5613 -1.3100 -1.3100 -1.1876 -1.1876 -1.0283 -1.0283 -0.9037 -0.9037 0.4954 0.4954 0.8220 0.8220 1.2954 1.2954 1.3644 1.3644 3.8087 3.8087 4.1642 4.1642 5.4182 5.4182 5.7722 5.7722 7.8006 7.8006 7.9738 7.9738 8.4017 8.4017 k = 0.0000 0.4335-0.0256 ( 7700 PWs) bands (ev): -19.5912 -19.5912 -19.4891 -19.4891 -17.6053 -17.6053 -17.5689 -17.5689 -16.4307 -16.4307 -16.3637 -16.3637 -13.7288 -13.7288 -13.6563 -13.6563 -10.8254 -10.8254 -10.7788 -10.7788 -10.1377 -10.1377 -10.0956 -10.0956 -7.9646 -7.9646 -7.9320 -7.9320 -7.4036 -7.4036 -7.2937 -7.2937 -6.1141 -6.1141 -6.0250 -6.0250 -5.5230 -5.5230 -5.3531 -5.3531 -5.0539 -5.0539 -4.3447 -4.3447 -4.3226 -4.3226 -4.1340 -4.1340 -2.4271 -2.4271 -2.2247 -2.2247 -1.9825 -1.9825 -1.5611 -1.5611 -1.3094 -1.3094 -1.1876 -1.1876 -1.0292 -1.0292 -0.9036 -0.9036 0.4949 0.4949 0.8216 0.8216 1.2958 1.2958 1.3648 1.3648 3.8089 3.8089 4.1647 4.1647 5.4191 5.4191 5.7729 5.7729 7.8213 7.8213 7.9527 7.9527 8.4023 8.4023 k = 0.5000 0.3255-0.1359 ( 7710 PWs) bands (ev): -19.5459 -19.5459 -19.5081 -19.5081 -17.5895 -17.5895 -17.5722 -17.5722 -16.4726 -16.4726 -16.3742 -16.3742 -13.7835 -13.7835 -13.6798 -13.6798 -10.8313 -10.8313 -10.7178 -10.7178 -10.1347 -10.1347 -10.0433 -10.0433 -7.9731 -7.9731 -7.9154 -7.9154 -7.3632 -7.3632 -7.2649 -7.2649 -6.1130 -6.1130 -5.9965 -5.9965 -5.5069 -5.5069 -5.4115 -5.4115 -5.2267 -5.2267 -4.5314 -4.5314 -4.2621 -4.2621 -4.1941 -4.1941 -2.5468 -2.5468 -2.2442 -2.2442 -1.6470 -1.6470 -1.4525 -1.4525 -1.1962 -1.1962 -1.1494 -1.1494 -0.9834 -0.9834 -0.9691 -0.9691 0.8230 0.8230 0.9123 0.9123 1.2688 1.2688 1.3640 1.3640 3.7029 3.7029 4.0301 4.0301 5.2265 5.2265 5.2899 5.2899 8.2218 8.2218 8.2883 8.2883 8.7854 8.7854 k = 0.4865 0.3167-0.1323 ( 7713 PWs) bands (ev): -19.5461 -19.5461 -19.5080 -19.5080 -17.5893 -17.5893 -17.5720 -17.5720 -16.4724 -16.4724 -16.3743 -16.3743 -13.7835 -13.7835 -13.6800 -13.6800 -10.8313 -10.8313 -10.7181 -10.7181 -10.1347 -10.1347 -10.0436 -10.0436 -7.9729 -7.9729 -7.9154 -7.9154 -7.3637 -7.3637 -7.2635 -7.2635 -6.1130 -6.1130 -5.9966 -5.9966 -5.5072 -5.5072 -5.4118 -5.4118 -5.2265 -5.2265 -4.5313 -4.5313 -4.2625 -4.2625 -4.1934 -4.1934 -2.5466 -2.5466 -2.2440 -2.2440 -1.6477 -1.6477 -1.4527 -1.4527 -1.1973 -1.1973 -1.1495 -1.1495 -0.9867 -0.9867 -0.9645 -0.9645 0.8223 0.8223 0.9125 0.9125 1.2666 1.2666 1.3659 1.3659 3.7030 3.7030 4.0303 4.0303 5.2265 5.2265 5.2900 5.2900 8.2217 8.2217 8.2847 8.2847 8.7859 8.7859 k = 0.4730 0.3079-0.1286 ( 7710 PWs) bands (ev): -19.5468 -19.5468 -19.5078 -19.5078 -17.5887 -17.5887 -17.5716 -17.5716 -16.4719 -16.4719 -16.3748 -16.3748 -13.7837 -13.7837 -13.6804 -13.6804 -10.8311 -10.8311 -10.7190 -10.7190 -10.1348 -10.1348 -10.0443 -10.0443 -7.9724 -7.9724 -7.9152 -7.9152 -7.3649 -7.3649 -7.2594 -7.2594 -6.1131 -6.1131 -5.9971 -5.9971 -5.5079 -5.5079 -5.4125 -5.4125 -5.2256 -5.2256 -4.5309 -4.5309 -4.2639 -4.2639 -4.1913 -4.1913 -2.5461 -2.5461 -2.2436 -2.2436 -1.6499 -1.6499 -1.4532 -1.4532 -1.2006 -1.2006 -1.1500 -1.1500 -0.9921 -0.9921 -0.9553 -0.9553 0.8203 0.8203 0.9131 0.9131 1.2605 1.2605 1.3711 1.3711 3.7036 3.7036 4.0311 4.0311 5.2265 5.2265 5.2902 5.2902 8.2214 8.2214 8.2739 8.2739 8.7870 8.7870 k = 0.4595 0.2991-0.1249 ( 7718 PWs) bands (ev): -19.5480 -19.5480 -19.5074 -19.5074 -17.5878 -17.5878 -17.5708 -17.5708 -16.4712 -16.4712 -16.3755 -16.3755 -13.7840 -13.7840 -13.6811 -13.6811 -10.8309 -10.8309 -10.7206 -10.7206 -10.1348 -10.1348 -10.0454 -10.0454 -7.9714 -7.9714 -7.9149 -7.9149 -7.3667 -7.3667 -7.2531 -7.2531 -6.1132 -6.1132 -5.9978 -5.9978 -5.5092 -5.5092 -5.4136 -5.4136 -5.2242 -5.2242 -4.5303 -4.5303 -4.2659 -4.2659 -4.1880 -4.1880 -2.5454 -2.5454 -2.2429 -2.2429 -1.6535 -1.6535 -1.4541 -1.4541 -1.2060 -1.2060 -1.1507 -1.1507 -0.9971 -0.9971 -0.9443 -0.9443 0.8171 0.8171 0.9140 0.9140 1.2516 1.2516 1.3784 1.3784 3.7044 3.7044 4.0324 4.0324 5.2263 5.2263 5.2907 5.2907 8.2210 8.2210 8.2564 8.2564 8.7880 8.7880 k = 0.4459 0.2903-0.1212 ( 7722 PWs) bands (ev): -19.5495 -19.5495 -19.5070 -19.5070 -17.5866 -17.5866 -17.5698 -17.5698 -16.4701 -16.4701 -16.3765 -16.3765 -13.7843 -13.7843 -13.6821 -13.6821 -10.8306 -10.8306 -10.7228 -10.7228 -10.1348 -10.1348 -10.0471 -10.0471 -7.9701 -7.9701 -7.9144 -7.9144 -7.3684 -7.3684 -7.2449 -7.2449 -6.1134 -6.1134 -5.9988 -5.9988 -5.5110 -5.5110 -5.4153 -5.4153 -5.2224 -5.2224 -4.5294 -4.5294 -4.2682 -4.2682 -4.1839 -4.1839 -2.5443 -2.5443 -2.2418 -2.2418 -1.6585 -1.6585 -1.4554 -1.4554 -1.2130 -1.2130 -1.1517 -1.1517 -1.0014 -1.0014 -0.9320 -0.9320 0.8127 0.8127 0.9150 0.9150 1.2412 1.2412 1.3867 1.3867 3.7056 3.7056 4.0341 4.0341 5.2261 5.2261 5.2914 5.2914 8.2203 8.2203 8.2328 8.2328 8.7880 8.7880 k = 0.4324 0.2815-0.1176 ( 7727 PWs) bands (ev): -19.5515 -19.5515 -19.5064 -19.5064 -17.5850 -17.5850 -17.5684 -17.5684 -16.4688 -16.4688 -16.3777 -16.3777 -13.7848 -13.7848 -13.6834 -13.6834 -10.8302 -10.8302 -10.7256 -10.7256 -10.1348 -10.1348 -10.0491 -10.0491 -7.9685 -7.9685 -7.9140 -7.9140 -7.3698 -7.3698 -7.2353 -7.2353 -6.1135 -6.1135 -6.0000 -6.0000 -5.5133 -5.5133 -5.4173 -5.4173 -5.2200 -5.2200 -4.5281 -4.5281 -4.2707 -4.2707 -4.1791 -4.1791 -2.5429 -2.5429 -2.2406 -2.2406 -1.6648 -1.6648 -1.4571 -1.4571 -1.2213 -1.2213 -1.1531 -1.1531 -1.0048 -1.0048 -0.9188 -0.9188 0.8075 0.8075 0.9161 0.9161 1.2300 1.2300 1.3953 1.3953 3.7070 3.7070 4.0362 4.0362 5.2258 5.2258 5.2925 5.2925 8.2034 8.2034 8.2200 8.2200 8.7865 8.7865 k = 0.4189 0.2727-0.1139 ( 7714 PWs) bands (ev): -19.5537 -19.5537 -19.5059 -19.5059 -17.5831 -17.5831 -17.5668 -17.5668 -16.4672 -16.4672 -16.3792 -16.3792 -13.7854 -13.7854 -13.6850 -13.6850 -10.8297 -10.8297 -10.7290 -10.7290 -10.1347 -10.1347 -10.0516 -10.0516 -7.9665 -7.9665 -7.9134 -7.9134 -7.3705 -7.3705 -7.2247 -7.2247 -6.1137 -6.1137 -6.0016 -6.0016 -5.5162 -5.5162 -5.4198 -5.4198 -5.2173 -5.2173 -4.5264 -4.5264 -4.2732 -4.2732 -4.1738 -4.1738 -2.5412 -2.5412 -2.2390 -2.2390 -1.6725 -1.6725 -1.4592 -1.4592 -1.2307 -1.2307 -1.1549 -1.1549 -1.0076 -1.0076 -0.9050 -0.9050 0.8016 0.8016 0.9171 0.9171 1.2185 1.2185 1.4035 1.4035 3.7088 3.7088 4.0387 4.0387 5.2252 5.2252 5.2941 5.2941 8.1695 8.1695 8.2193 8.2193 8.7837 8.7837 k = 0.4054 0.2639-0.1102 ( 7718 PWs) bands (ev): -19.5562 -19.5562 -19.5053 -19.5053 -17.5808 -17.5808 -17.5650 -17.5650 -16.4653 -16.4653 -16.3810 -16.3810 -13.7860 -13.7860 -13.6868 -13.6868 -10.8291 -10.8291 -10.7330 -10.7330 -10.1346 -10.1346 -10.0546 -10.0546 -7.9642 -7.9642 -7.9128 -7.9128 -7.3702 -7.3702 -7.2133 -7.2133 -6.1139 -6.1139 -6.0034 -6.0034 -5.5196 -5.5196 -5.4227 -5.4227 -5.2142 -5.2142 -4.5243 -4.5243 -4.2754 -4.2754 -4.1683 -4.1683 -2.5392 -2.5392 -2.2373 -2.2373 -1.6813 -1.6813 -1.4617 -1.4617 -1.2409 -1.2409 -1.1570 -1.1570 -1.0097 -1.0097 -0.8908 -0.8908 0.7952 0.7952 0.9179 0.9179 1.2071 1.2071 1.4110 1.4110 3.7108 3.7108 4.0415 4.0415 5.2244 5.2244 5.2963 5.2963 8.1313 8.1313 8.2187 8.2187 8.7800 8.7800 k = 0.3919 0.2551-0.1066 ( 7709 PWs) bands (ev): -19.5589 -19.5589 -19.5048 -19.5048 -17.5783 -17.5783 -17.5628 -17.5628 -16.4633 -16.4633 -16.3830 -16.3830 -13.7867 -13.7867 -13.6889 -13.6889 -10.8284 -10.8284 -10.7374 -10.7374 -10.1344 -10.1344 -10.0579 -10.0579 -7.9617 -7.9617 -7.9121 -7.9121 -7.3687 -7.3687 -7.2013 -7.2013 -6.1141 -6.1141 -6.0055 -6.0055 -5.5236 -5.5236 -5.4259 -5.4259 -5.2107 -5.2107 -4.5215 -4.5215 -4.2773 -4.2773 -4.1627 -4.1627 -2.5369 -2.5369 -2.2354 -2.2354 -1.6913 -1.6913 -1.4647 -1.4647 -1.2516 -1.2516 -1.1595 -1.1595 -1.0112 -1.0112 -0.8765 -0.8765 0.7884 0.7884 0.9185 0.9185 1.1962 1.1962 1.4177 1.4177 3.7130 3.7130 4.0445 4.0445 5.2233 5.2233 5.2991 5.2991 8.0894 8.0894 8.2183 8.2183 8.7761 8.7761 k = 0.3784 0.2463-0.1029 ( 7712 PWs) bands (ev): -19.5619 -19.5619 -19.5043 -19.5043 -17.5755 -17.5755 -17.5605 -17.5605 -16.4610 -16.4610 -16.3852 -16.3852 -13.7875 -13.7875 -13.6912 -13.6912 -10.8276 -10.8276 -10.7424 -10.7424 -10.1342 -10.1342 -10.0616 -10.0616 -7.9590 -7.9590 -7.9114 -7.9114 -7.3661 -7.3661 -7.1891 -7.1891 -6.1143 -6.1143 -6.0078 -6.0078 -5.5284 -5.5284 -5.4293 -5.4293 -5.2071 -5.2071 -4.5182 -4.5182 -4.2789 -4.2789 -4.1570 -4.1570 -2.5344 -2.5344 -2.2334 -2.2334 -1.7023 -1.7023 -1.4682 -1.4682 -1.2626 -1.2626 -1.1625 -1.1625 -1.0120 -1.0120 -0.8621 -0.8621 0.7813 0.7813 0.9189 0.9189 1.1859 1.1859 1.4232 1.4232 3.7153 3.7153 4.0476 4.0476 5.2219 5.2219 5.3028 5.3028 8.0442 8.0442 8.2179 8.2179 8.7728 8.7728 k = 0.3649 0.2375-0.0992 ( 7719 PWs) bands (ev): -19.5650 -19.5650 -19.5038 -19.5038 -17.5724 -17.5724 -17.5578 -17.5578 -16.4585 -16.4585 -16.3875 -16.3875 -13.7884 -13.7884 -13.6938 -13.6938 -10.8268 -10.8268 -10.7478 -10.7478 -10.1338 -10.1338 -10.0657 -10.0657 -7.9561 -7.9561 -7.9106 -7.9106 -7.3622 -7.3622 -7.1766 -7.1766 -6.1144 -6.1144 -6.0104 -6.0104 -5.5340 -5.5340 -5.4329 -5.4329 -5.2032 -5.2032 -4.5141 -4.5141 -4.2800 -4.2800 -4.1514 -4.1514 -2.5315 -2.5315 -2.2312 -2.2312 -1.7143 -1.7143 -1.4722 -1.4722 -1.2739 -1.2739 -1.1659 -1.1659 -1.0122 -1.0122 -0.8479 -0.8479 0.7740 0.7740 0.9190 0.9190 1.1763 1.1763 1.4274 1.4274 3.7178 3.7178 4.0507 4.0507 5.2200 5.2200 5.3074 5.3074 7.9963 7.9963 8.2178 8.2178 8.7706 8.7706 k = 0.3514 0.2287-0.0955 ( 7712 PWs) bands (ev): -19.5683 -19.5683 -19.5034 -19.5034 -17.5691 -17.5691 -17.5550 -17.5550 -16.4559 -16.4559 -16.3901 -16.3901 -13.7893 -13.7893 -13.6966 -13.6966 -10.8260 -10.8260 -10.7536 -10.7536 -10.1334 -10.1334 -10.0701 -10.0701 -7.9531 -7.9531 -7.9097 -7.9097 -7.3571 -7.3571 -7.1641 -7.1641 -6.1145 -6.1145 -6.0133 -6.0133 -5.5405 -5.5405 -5.4365 -5.4365 -5.1991 -5.1991 -4.5092 -4.5092 -4.2807 -4.2807 -4.1459 -4.1459 -2.5284 -2.5284 -2.2291 -2.2291 -1.7271 -1.7271 -1.4767 -1.4767 -1.2853 -1.2853 -1.1697 -1.1697 -1.0116 -1.0116 -0.8341 -0.8341 0.7667 0.7667 0.9190 0.9190 1.1676 1.1676 1.4304 1.4304 3.7204 3.7204 4.0538 4.0538 5.2177 5.2177 5.3129 5.3129 7.9461 7.9461 8.2178 8.2178 8.7699 8.7699 k = 0.3378 0.2199-0.0919 ( 7714 PWs) bands (ev): -19.5717 -19.5717 -19.5031 -19.5031 -17.5655 -17.5655 -17.5520 -17.5520 -16.4531 -16.4531 -16.3927 -16.3927 -13.7902 -13.7902 -13.6996 -13.6996 -10.8251 -10.8251 -10.7598 -10.7598 -10.1328 -10.1328 -10.0748 -10.0748 -7.9501 -7.9501 -7.9087 -7.9087 -7.3507 -7.3507 -7.1516 -7.1516 -6.1145 -6.1145 -6.0163 -6.0163 -5.5480 -5.5480 -5.4399 -5.4399 -5.1950 -5.1950 -4.5036 -4.5036 -4.2810 -4.2810 -4.1405 -4.1405 -2.5250 -2.5250 -2.2269 -2.2269 -1.7406 -1.7406 -1.4818 -1.4818 -1.2967 -1.2967 -1.1740 -1.1740 -1.0102 -1.0102 -0.8207 -0.8207 0.7594 0.7594 0.9188 0.9188 1.1598 1.1598 1.4319 1.4319 3.7231 3.7231 4.0568 4.0568 5.2150 5.2150 5.3194 5.3194 7.8942 7.8942 8.2181 8.2181 8.7711 8.7711 k = 0.3243 0.2111-0.0882 ( 7714 PWs) bands (ev): -19.5752 -19.5752 -19.5028 -19.5028 -17.5618 -17.5618 -17.5488 -17.5488 -16.4503 -16.4503 -16.3954 -16.3954 -13.7912 -13.7912 -13.7027 -13.7027 -10.8242 -10.8242 -10.7662 -10.7662 -10.1321 -10.1321 -10.0798 -10.0798 -7.9472 -7.9472 -7.9075 -7.9075 -7.3432 -7.3432 -7.1392 -7.1392 -6.1145 -6.1145 -6.0195 -6.0195 -5.5568 -5.5568 -5.4429 -5.4429 -5.1908 -5.1908 -4.4971 -4.4971 -4.2810 -4.2810 -4.1353 -4.1353 -2.5213 -2.5213 -2.2247 -2.2247 -1.7547 -1.7547 -1.4874 -1.4874 -1.3082 -1.3082 -1.1786 -1.1786 -1.0079 -1.0079 -0.8080 -0.8080 0.7521 0.7521 0.9185 0.9185 1.1530 1.1530 1.4321 1.4321 3.7257 3.7257 4.0597 4.0597 5.2119 5.2119 5.3270 5.3270 7.8410 7.8410 8.2186 8.2186 8.7740 8.7740 k = 0.3108 0.2023-0.0845 ( 7714 PWs) bands (ev): -19.5787 -19.5787 -19.5026 -19.5026 -17.5580 -17.5580 -17.5454 -17.5454 -16.4475 -16.4475 -16.3982 -16.3982 -13.7922 -13.7922 -13.7061 -13.7061 -10.8234 -10.8234 -10.7728 -10.7728 -10.1314 -10.1314 -10.0849 -10.0849 -7.9444 -7.9444 -7.9060 -7.9060 -7.3346 -7.3346 -7.1270 -7.1270 -6.1143 -6.1143 -6.0229 -6.0229 -5.5667 -5.5667 -5.4455 -5.4455 -5.1866 -5.1866 -4.4897 -4.4897 -4.2805 -4.2805 -4.1303 -4.1303 -2.5174 -2.5174 -2.2227 -2.2227 -1.7693 -1.7693 -1.4935 -1.4935 -1.3196 -1.3196 -1.1837 -1.1837 -1.0046 -1.0046 -0.7959 -0.7959 0.7450 0.7450 0.9182 0.9182 1.1472 1.1472 1.4308 1.4308 3.7283 3.7283 4.0623 4.0623 5.2085 5.2085 5.3355 5.3355 7.7869 7.7869 8.2194 8.2194 8.7783 8.7783 k = 0.2973 0.1935-0.0808 ( 7721 PWs) bands (ev): -19.5823 -19.5823 -19.5025 -19.5025 -17.5540 -17.5540 -17.5419 -17.5419 -16.4447 -16.4447 -16.4009 -16.4009 -13.7932 -13.7932 -13.7096 -13.7096 -10.8228 -10.8228 -10.7794 -10.7794 -10.1306 -10.1306 -10.0901 -10.0901 -7.9417 -7.9417 -7.9043 -7.9043 -7.3251 -7.3251 -7.1151 -7.1151 -6.1140 -6.1140 -6.0264 -6.0264 -5.5779 -5.5779 -5.4475 -5.4475 -5.1824 -5.1824 -4.4815 -4.4815 -4.2798 -4.2798 -4.1255 -4.1255 -2.5132 -2.5132 -2.2209 -2.2209 -1.7841 -1.7841 -1.5002 -1.5002 -1.3311 -1.3311 -1.1892 -1.1892 -1.0004 -1.0004 -0.7846 -0.7846 0.7379 0.7379 0.9180 0.9180 1.1424 1.1424 1.4280 1.4280 3.7309 3.7309 4.0647 4.0647 5.2048 5.2048 5.3450 5.3450 7.7323 7.7323 8.2205 8.2205 8.7835 8.7835 k = 0.2838 0.1847-0.0772 ( 7715 PWs) bands (ev): -19.5859 -19.5859 -19.5024 -19.5024 -17.5499 -17.5499 -17.5383 -17.5383 -16.4421 -16.4421 -16.4035 -16.4035 -13.7942 -13.7942 -13.7133 -13.7133 -10.8225 -10.8225 -10.7858 -10.7858 -10.1298 -10.1298 -10.0953 -10.0953 -7.9393 -7.9393 -7.9023 -7.9023 -7.3149 -7.3149 -7.1034 -7.1034 -6.1136 -6.1136 -6.0300 -6.0300 -5.5903 -5.5903 -5.4489 -5.4489 -5.1782 -5.1782 -4.4724 -4.4724 -4.2788 -4.2788 -4.1210 -4.1210 -2.5089 -2.5089 -2.2193 -2.2193 -1.7990 -1.7990 -1.5074 -1.5074 -1.3425 -1.3425 -1.1950 -1.1950 -0.9952 -0.9952 -0.7742 -0.7742 0.7309 0.7309 0.9179 0.9179 1.1385 1.1385 1.4239 1.4239 3.7333 3.7333 4.0668 4.0668 5.2008 5.2008 5.3555 5.3555 7.6776 7.6776 8.2219 8.2219 8.7885 8.7885 k = 0.2703 0.1759-0.0735 ( 7727 PWs) bands (ev): -19.5895 -19.5895 -19.5023 -19.5023 -17.5458 -17.5458 -17.5345 -17.5345 -16.4397 -16.4397 -16.4058 -16.4058 -13.7952 -13.7952 -13.7171 -13.7171 -10.8229 -10.8229 -10.7917 -10.7917 -10.1291 -10.1291 -10.1003 -10.1003 -7.9370 -7.9370 -7.9001 -7.9001 -7.3040 -7.3040 -7.0920 -7.0920 -6.1130 -6.1130 -6.0337 -6.0337 -5.6040 -5.6040 -5.4496 -5.4496 -5.1742 -5.1742 -4.4627 -4.4627 -4.2775 -4.2775 -4.1168 -4.1168 -2.5043 -2.5043 -2.2180 -2.2180 -1.8140 -1.8140 -1.5150 -1.5150 -1.3540 -1.3540 -1.2010 -1.2010 -0.9890 -0.9890 -0.7646 -0.7646 0.7241 0.7241 0.9180 0.9180 1.1356 1.1356 1.4186 1.4186 3.7356 3.7356 4.0685 4.0685 5.1966 5.1966 5.3668 5.3668 7.6232 7.6232 8.2237 8.2237 8.7924 8.7924 k = 0.2568 0.1671-0.0698 ( 7729 PWs) bands (ev): -19.5931 -19.5931 -19.5023 -19.5023 -17.5416 -17.5416 -17.5307 -17.5307 -16.4378 -16.4378 -16.4077 -16.4077 -13.7962 -13.7962 -13.7210 -13.7210 -10.8245 -10.8245 -10.7964 -10.7964 -10.1288 -10.1288 -10.1049 -10.1049 -7.9349 -7.9349 -7.8976 -7.8976 -7.2926 -7.2926 -7.0810 -7.0810 -6.1122 -6.1122 -6.0374 -6.0374 -5.6187 -5.6187 -5.4496 -5.4496 -5.1702 -5.1702 -4.4523 -4.4523 -4.2761 -4.2761 -4.1129 -4.1129 -2.4995 -2.4995 -2.2171 -2.2171 -1.8288 -1.8288 -1.5231 -1.5231 -1.3654 -1.3654 -1.2072 -1.2072 -0.9818 -0.9818 -0.7559 -0.7559 0.7174 0.7174 0.9182 0.9182 1.1337 1.1337 1.4120 1.4120 3.7377 3.7377 4.0699 4.0699 5.1923 5.1923 5.3788 5.3788 7.5694 7.5694 8.2259 8.2259 8.7941 8.7941 k = 0.2432 0.1583-0.0661 ( 7724 PWs) bands (ev): -19.5967 -19.5967 -19.5024 -19.5024 -17.5375 -17.5375 -17.5268 -17.5268 -16.4365 -16.4365 -16.4090 -16.4090 -13.7971 -13.7971 -13.7250 -13.7250 -10.8278 -10.8278 -10.7994 -10.7994 -10.1293 -10.1293 -10.1086 -10.1086 -7.9329 -7.9329 -7.8950 -7.8950 -7.2810 -7.2810 -7.0703 -7.0703 -6.1113 -6.1113 -6.0410 -6.0410 -5.6343 -5.6343 -5.4490 -5.4490 -5.1664 -5.1664 -4.4414 -4.4414 -4.2743 -4.2743 -4.1093 -4.1093 -2.4946 -2.4946 -2.2166 -2.2166 -1.8432 -1.8432 -1.5315 -1.5315 -1.3769 -1.3769 -1.2134 -1.2134 -0.9736 -0.9736 -0.7480 -0.7480 0.7108 0.7108 0.9187 0.9187 1.1327 1.1327 1.4042 1.4042 3.7396 3.7396 4.0710 4.0710 5.1879 5.1879 5.3916 5.3916 7.5164 7.5164 8.2287 8.2287 8.7931 8.7931 k = 0.2297 0.1495-0.0625 ( 7720 PWs) bands (ev): -19.6002 -19.6002 -19.5025 -19.5025 -17.5334 -17.5334 -17.5229 -17.5229 -16.4361 -16.4361 -16.4095 -16.4095 -13.7979 -13.7979 -13.7290 -13.7290 -10.8326 -10.8326 -10.8009 -10.8009 -10.1311 -10.1311 -10.1108 -10.1108 -7.9309 -7.9309 -7.8923 -7.8923 -7.2692 -7.2692 -7.0600 -7.0600 -6.1100 -6.1100 -6.0446 -6.0446 -5.6507 -5.6507 -5.4477 -5.4477 -5.1627 -5.1627 -4.4301 -4.4301 -4.2724 -4.2724 -4.1060 -4.1060 -2.4895 -2.4895 -2.2165 -2.2165 -1.8572 -1.8572 -1.5402 -1.5402 -1.3884 -1.3884 -1.2197 -1.2197 -0.9645 -0.9645 -0.7411 -0.7411 0.7044 0.7044 0.9193 0.9193 1.1325 1.1325 1.3955 1.3955 3.7414 3.7414 4.0717 4.0717 5.1834 5.1834 5.4049 5.4049 7.4647 7.4647 8.2319 8.2319 8.7893 8.7893 k = 0.2162 0.1407-0.0588 ( 7720 PWs) bands (ev): -19.6036 -19.6036 -19.5026 -19.5026 -17.5294 -17.5294 -17.5190 -17.5190 -16.4365 -16.4365 -16.4091 -16.4091 -13.7986 -13.7986 -13.7331 -13.7331 -10.8387 -10.8387 -10.8010 -10.8010 -10.1344 -10.1344 -10.1114 -10.1114 -7.9290 -7.9290 -7.8896 -7.8896 -7.2574 -7.2574 -7.0501 -7.0501 -6.1086 -6.1086 -6.0481 -6.0481 -5.6678 -5.6678 -5.4459 -5.4459 -5.1592 -5.1592 -4.4187 -4.4187 -4.2702 -4.2702 -4.1031 -4.1031 -2.4842 -2.4842 -2.2171 -2.2171 -1.8705 -1.8705 -1.5492 -1.5492 -1.3998 -1.3998 -1.2259 -1.2259 -0.9547 -0.9547 -0.7350 -0.7350 0.6982 0.6982 0.9200 0.9200 1.1332 1.1332 1.3859 1.3859 3.7429 3.7429 4.0721 4.0721 5.1790 5.1790 5.4186 5.4186 7.4145 7.4145 8.2357 8.2357 8.7832 8.7832 k = 0.2027 0.1319-0.0551 ( 7720 PWs) bands (ev): -19.6069 -19.6069 -19.5028 -19.5028 -17.5255 -17.5255 -17.5151 -17.5151 -16.4377 -16.4377 -16.4080 -16.4080 -13.7993 -13.7993 -13.7372 -13.7372 -10.8454 -10.8454 -10.8004 -10.8004 -10.1386 -10.1386 -10.1108 -10.1108 -7.9269 -7.9269 -7.8870 -7.8870 -7.2459 -7.2459 -7.0406 -7.0406 -6.1068 -6.1068 -6.0514 -6.0514 -5.6852 -5.6852 -5.4435 -5.4435 -5.1560 -5.1560 -4.4073 -4.4073 -4.2676 -4.2676 -4.1007 -4.1007 -2.4788 -2.4788 -2.2182 -2.2182 -1.8831 -1.8831 -1.5584 -1.5584 -1.4111 -1.4111 -1.2319 -1.2319 -0.9441 -0.9441 -0.7297 -0.7297 0.6922 0.6922 0.9207 0.9207 1.1347 1.1347 1.3757 1.3757 3.7442 3.7442 4.0722 4.0722 5.1745 5.1745 5.4325 5.4325 7.3659 7.3659 8.2402 8.2402 8.7751 8.7751 k = 0.1892 0.1231-0.0514 ( 7723 PWs) bands (ev): -19.6100 -19.6100 -19.5029 -19.5029 -17.5217 -17.5217 -17.5112 -17.5112 -16.4395 -16.4395 -16.4063 -16.4063 -13.7998 -13.7998 -13.7413 -13.7413 -10.8524 -10.8524 -10.7993 -10.7993 -10.1433 -10.1433 -10.1096 -10.1096 -7.9248 -7.9248 -7.8846 -7.8846 -7.2346 -7.2346 -7.0315 -7.0315 -6.1048 -6.1048 -6.0546 -6.0546 -5.7029 -5.7029 -5.4408 -5.4408 -5.1529 -5.1529 -4.3962 -4.3962 -4.2646 -4.2646 -4.0986 -4.0986 -2.4734 -2.4734 -2.2200 -2.2200 -1.8949 -1.8949 -1.5678 -1.5678 -1.4223 -1.4223 -1.2376 -1.2376 -0.9330 -0.9330 -0.7252 -0.7252 0.6864 0.6864 0.9216 0.9216 1.1368 1.1368 1.3648 1.3648 3.7452 3.7452 4.0721 4.0721 5.1702 5.1702 5.4466 5.4466 7.3193 7.3193 8.2454 8.2454 8.7656 8.7656 k = 0.1757 0.1143-0.0478 ( 7722 PWs) bands (ev): -19.6131 -19.6131 -19.5031 -19.5031 -17.5181 -17.5181 -17.5074 -17.5074 -16.4416 -16.4416 -16.4044 -16.4044 -13.8002 -13.8002 -13.7453 -13.7453 -10.8594 -10.8594 -10.7980 -10.7980 -10.1482 -10.1482 -10.1079 -10.1079 -7.9226 -7.9226 -7.8823 -7.8823 -7.2239 -7.2239 -7.0229 -7.0229 -6.1025 -6.1025 -6.0576 -6.0576 -5.7208 -5.7208 -5.4377 -5.4377 -5.1501 -5.1501 -4.3856 -4.3856 -4.2610 -4.2610 -4.0970 -4.0970 -2.4678 -2.4678 -2.2223 -2.2223 -1.9057 -1.9057 -1.5772 -1.5772 -1.4331 -1.4331 -1.2431 -1.2431 -0.9214 -0.9214 -0.7215 -0.7215 0.6808 0.6808 0.9223 0.9223 1.1395 1.1395 1.3537 1.3537 3.7461 3.7461 4.0718 4.0718 5.1660 5.1660 5.4607 5.4607 7.2749 7.2749 8.2512 8.2512 8.7548 8.7548 k = 0.1622 0.1056-0.0441 ( 7723 PWs) bands (ev): -19.6160 -19.6160 -19.5033 -19.5033 -17.5146 -17.5146 -17.5038 -17.5038 -16.4439 -16.4439 -16.4022 -16.4022 -13.8005 -13.8005 -13.7494 -13.7494 -10.8663 -10.8663 -10.7966 -10.7966 -10.1531 -10.1531 -10.1060 -10.1060 -7.9202 -7.9202 -7.8804 -7.8804 -7.2137 -7.2137 -7.0146 -7.0146 -6.0998 -6.0998 -6.0604 -6.0604 -5.7385 -5.7385 -5.4343 -5.4343 -5.1476 -5.1476 -4.3758 -4.3758 -4.2567 -4.2567 -4.0959 -4.0959 -2.4622 -2.4622 -2.2254 -2.2254 -1.9154 -1.9154 -1.5867 -1.5867 -1.4436 -1.4436 -1.2481 -1.2481 -0.9095 -0.9095 -0.7185 -0.7185 0.6755 0.6755 0.9231 0.9231 1.1427 1.1427 1.3423 1.3423 3.7468 3.7468 4.0713 4.0713 5.1619 5.1619 5.4746 5.4746 7.2329 7.2329 8.2578 8.2578 8.7432 8.7432 k = 0.1486 0.0968-0.0404 ( 7723 PWs) bands (ev): -19.6187 -19.6187 -19.5036 -19.5036 -17.5114 -17.5114 -17.5003 -17.5003 -16.4462 -16.4462 -16.4000 -16.4000 -13.8007 -13.8007 -13.7533 -13.7533 -10.8730 -10.8730 -10.7951 -10.7951 -10.1578 -10.1578 -10.1041 -10.1041 -7.9177 -7.9177 -7.8788 -7.8788 -7.2041 -7.2041 -7.0069 -7.0069 -6.0969 -6.0969 -6.0630 -6.0630 -5.7560 -5.7560 -5.4306 -5.4306 -5.1453 -5.1453 -4.3670 -4.3670 -4.2516 -4.2516 -4.0954 -4.0954 -2.4566 -2.4566 -2.2290 -2.2290 -1.9242 -1.9242 -1.5960 -1.5960 -1.4537 -1.4537 -1.2528 -1.2528 -0.8974 -0.8974 -0.7163 -0.7163 0.6704 0.6704 0.9237 0.9237 1.1462 1.1462 1.3310 1.3310 3.7472 3.7472 4.0706 4.0706 5.1581 5.1581 5.4881 5.4881 7.1935 7.1935 8.2651 8.2651 8.7307 8.7307 k = 0.1351 0.0880-0.0367 ( 7725 PWs) bands (ev): -19.6212 -19.6212 -19.5038 -19.5038 -17.5084 -17.5084 -17.4969 -17.4969 -16.4485 -16.4485 -16.3979 -16.3979 -13.8007 -13.8007 -13.7572 -13.7572 -10.8794 -10.8794 -10.7936 -10.7936 -10.1623 -10.1623 -10.1021 -10.1021 -7.9150 -7.9150 -7.8775 -7.8775 -7.1953 -7.1953 -6.9996 -6.9996 -6.0936 -6.0936 -6.0653 -6.0653 -5.7730 -5.7730 -5.4269 -5.4269 -5.1432 -5.1432 -4.3594 -4.3594 -4.2456 -4.2456 -4.0953 -4.0953 -2.4510 -2.4510 -2.2331 -2.2331 -1.9318 -1.9318 -1.6053 -1.6053 -1.4631 -1.4631 -1.2571 -1.2571 -0.8853 -0.8853 -0.7147 -0.7147 0.6658 0.6658 0.9242 0.9242 1.1500 1.1500 1.3199 1.3199 3.7476 3.7476 4.0698 4.0698 5.1545 5.1545 5.5011 5.5011 7.1568 7.1568 8.2731 8.2731 8.7177 8.7177 k = 0.1216 0.0792-0.0331 ( 7724 PWs) bands (ev): -19.6236 -19.6236 -19.5040 -19.5040 -17.5056 -17.5056 -17.4938 -17.4938 -16.4507 -16.4507 -16.3959 -16.3959 -13.8005 -13.8005 -13.7610 -13.7610 -10.8854 -10.8854 -10.7921 -10.7921 -10.1666 -10.1666 -10.1001 -10.1001 -7.9122 -7.9122 -7.8766 -7.8766 -7.1874 -7.1874 -6.9929 -6.9929 -6.0901 -6.0901 -6.0674 -6.0674 -5.7894 -5.7894 -5.4232 -5.4232 -5.1415 -5.1415 -4.3531 -4.3531 -4.2387 -4.2387 -4.0959 -4.0959 -2.4454 -2.4454 -2.2376 -2.2376 -1.9384 -1.9384 -1.6142 -1.6142 -1.4718 -1.4718 -1.2610 -1.2610 -0.8733 -0.8733 -0.7137 -0.7137 0.6614 0.6614 0.9245 0.9245 1.1539 1.1539 1.3092 1.3092 3.7477 3.7477 4.0690 4.0690 5.1511 5.1511 5.5135 5.5135 7.1231 7.1231 8.2817 8.2817 8.7041 8.7041 k = 0.1081 0.0704-0.0294 ( 7721 PWs) bands (ev): -19.6257 -19.6257 -19.5042 -19.5042 -17.5030 -17.5030 -17.4910 -17.4910 -16.4527 -16.4527 -16.3940 -16.3940 -13.8001 -13.8001 -13.7646 -13.7646 -10.8909 -10.8909 -10.7907 -10.7907 -10.1705 -10.1705 -10.0982 -10.0982 -7.9092 -7.9092 -7.8761 -7.8761 -7.1802 -7.1802 -6.9867 -6.9867 -6.0863 -6.0863 -6.0693 -6.0693 -5.8050 -5.8050 -5.4195 -5.4195 -5.1399 -5.1399 -4.3481 -4.3481 -4.2311 -4.2311 -4.0969 -4.0969 -2.4400 -2.4400 -2.2425 -2.2425 -1.9441 -1.9441 -1.6227 -1.6227 -1.4798 -1.4798 -1.2644 -1.2644 -0.8616 -0.8616 -0.7134 -0.7134 0.6575 0.6575 0.9248 0.9248 1.1577 1.1577 1.2992 1.2992 3.7478 3.7478 4.0681 4.0681 5.1481 5.1481 5.5250 5.5250 7.0925 7.0925 8.2908 8.2908 8.6903 8.6903 k = 0.0946 0.0616-0.0257 ( 7719 PWs) bands (ev): -19.6276 -19.6276 -19.5043 -19.5043 -17.5007 -17.5007 -17.4884 -17.4884 -16.4546 -16.4546 -16.3922 -16.3922 -13.7996 -13.7996 -13.7681 -13.7681 -10.8959 -10.8959 -10.7894 -10.7894 -10.1740 -10.1740 -10.0965 -10.0965 -7.9062 -7.9062 -7.8760 -7.8760 -7.1739 -7.1739 -6.9812 -6.9812 -6.0824 -6.0824 -6.0709 -6.0709 -5.8197 -5.8197 -5.4160 -5.4160 -5.1386 -5.1386 -4.3442 -4.3442 -4.2229 -4.2229 -4.0985 -4.0985 -2.4347 -2.4347 -2.2475 -2.2475 -1.9488 -1.9488 -1.6308 -1.6308 -1.4869 -1.4869 -1.2674 -1.2674 -0.8503 -0.8503 -0.7136 -0.7136 0.6539 0.6539 0.9249 0.9249 1.1613 1.1613 1.2899 1.2899 3.7478 3.7478 4.0673 4.0673 5.1453 5.1453 5.5355 5.5355 7.0652 7.0652 8.3002 8.3002 8.6764 8.6764 k = 0.0811 0.0528-0.0220 ( 7719 PWs) bands (ev): -19.6293 -19.6293 -19.5045 -19.5045 -17.4987 -17.4987 -17.4861 -17.4861 -16.4562 -16.4562 -16.3907 -16.3907 -13.7989 -13.7989 -13.7714 -13.7714 -10.9003 -10.9003 -10.7882 -10.7882 -10.1771 -10.1771 -10.0949 -10.0949 -7.9032 -7.9032 -7.8763 -7.8763 -7.1685 -7.1685 -6.9762 -6.9762 -6.0786 -6.0786 -6.0722 -6.0722 -5.8331 -5.8331 -5.4127 -5.4127 -5.1376 -5.1376 -4.3413 -4.3413 -4.2145 -4.2145 -4.1006 -4.1006 -2.4297 -2.4297 -2.2525 -2.2525 -1.9526 -1.9526 -1.6381 -1.6381 -1.4932 -1.4932 -1.2699 -1.2699 -0.8397 -0.8397 -0.7144 -0.7144 0.6508 0.6508 0.9249 0.9249 1.1646 1.1646 1.2816 1.2816 3.7477 3.7477 4.0665 4.0665 5.1429 5.1429 5.5449 5.5449 7.0412 7.0412 8.3097 8.3097 8.6627 8.6627 k = 0.0676 0.0440-0.0184 ( 7717 PWs) bands (ev): -19.6307 -19.6307 -19.5046 -19.5046 -17.4970 -17.4970 -17.4841 -17.4841 -16.4577 -16.4577 -16.3894 -16.3894 -13.7981 -13.7981 -13.7745 -13.7745 -10.9041 -10.9041 -10.7871 -10.7871 -10.1798 -10.1798 -10.0935 -10.0935 -7.9001 -7.9001 -7.8770 -7.8770 -7.1639 -7.1639 -6.9720 -6.9720 -6.0753 -6.0753 -6.0728 -6.0728 -5.8452 -5.8452 -5.4097 -5.4097 -5.1367 -5.1367 -4.3392 -4.3392 -4.2061 -4.2061 -4.1032 -4.1032 -2.4252 -2.4252 -2.2572 -2.2572 -1.9557 -1.9557 -1.6446 -1.6446 -1.4985 -1.4985 -1.2721 -1.2721 -0.8301 -0.8301 -0.7155 -0.7155 0.6482 0.6482 0.9249 0.9249 1.1674 1.1674 1.2745 1.2745 3.7476 3.7476 4.0658 4.0658 5.1408 5.1408 5.5531 5.5531 7.0208 7.0208 8.3191 8.3191 8.6497 8.6497 k = 0.0541 0.0352-0.0147 ( 7722 PWs) bands (ev): -19.6319 -19.6319 -19.5048 -19.5048 -17.4956 -17.4956 -17.4824 -17.4824 -16.4589 -16.4589 -16.3883 -16.3883 -13.7971 -13.7971 -13.7774 -13.7774 -10.9073 -10.9073 -10.7862 -10.7862 -10.1820 -10.1820 -10.0923 -10.0923 -7.8970 -7.8970 -7.8781 -7.8781 -7.1602 -7.1602 -6.9685 -6.9685 -6.0749 -6.0749 -6.0705 -6.0705 -5.8556 -5.8556 -5.4072 -5.4072 -5.1360 -5.1360 -4.3377 -4.3377 -4.1983 -4.1983 -4.1059 -4.1059 -2.4211 -2.4211 -2.2616 -2.2616 -1.9580 -1.9580 -1.6502 -1.6502 -1.5028 -1.5028 -1.2738 -1.2738 -0.8215 -0.8215 -0.7169 -0.7169 0.6460 0.6460 0.9248 0.9248 1.1698 1.1698 1.2686 1.2686 3.7475 3.7475 4.0652 4.0652 5.1391 5.1391 5.5600 5.5600 7.0039 7.0039 8.3278 8.3278 8.6378 8.6378 k = 0.0405 0.0264-0.0110 ( 7721 PWs) bands (ev): -19.6328 -19.6328 -19.5048 -19.5048 -17.4944 -17.4944 -17.4811 -17.4811 -16.4598 -16.4598 -16.3874 -16.3874 -13.7960 -13.7960 -13.7800 -13.7800 -10.9098 -10.9098 -10.7855 -10.7855 -10.1838 -10.1838 -10.0914 -10.0914 -7.8940 -7.8940 -7.8795 -7.8795 -7.1573 -7.1573 -6.9657 -6.9657 -6.0754 -6.0754 -6.0675 -6.0675 -5.8641 -5.8641 -5.4051 -5.4051 -5.1355 -5.1355 -4.3368 -4.3368 -4.1913 -4.1913 -4.1088 -4.1088 -2.4177 -2.4177 -2.2652 -2.2652 -1.9598 -1.9598 -1.6547 -1.6547 -1.5062 -1.5062 -1.2752 -1.2752 -0.8143 -0.8143 -0.7184 -0.7184 0.6443 0.6443 0.9248 0.9248 1.1716 1.1716 1.2639 1.2639 3.7474 3.7474 4.0647 4.0647 5.1377 5.1377 5.5654 5.5654 6.9907 6.9907 8.3354 8.3354 8.6276 8.6276 k = 0.0270 0.0176-0.0073 ( 7718 PWs) bands (ev): -19.6335 -19.6335 -19.5049 -19.5049 -17.4936 -17.4936 -17.4802 -17.4802 -16.4605 -16.4605 -16.3868 -16.3868 -13.7949 -13.7949 -13.7821 -13.7821 -10.9116 -10.9116 -10.7850 -10.7850 -10.1850 -10.1850 -10.0907 -10.0907 -7.8911 -7.8911 -7.8813 -7.8813 -7.1553 -7.1553 -6.9637 -6.9637 -6.0759 -6.0759 -6.0651 -6.0651 -5.8704 -5.8704 -5.4036 -5.4036 -5.1352 -5.1352 -4.3361 -4.3361 -4.1858 -4.1858 -4.1113 -4.1113 -2.4152 -2.4152 -2.2681 -2.2681 -1.9610 -1.9610 -1.6580 -1.6580 -1.5086 -1.5086 -1.2761 -1.2761 -0.8089 -0.8089 -0.7197 -0.7197 0.6431 0.6431 0.9247 0.9247 1.1729 1.1729 1.2606 1.2606 3.7473 3.7473 4.0643 4.0643 5.1367 5.1367 5.5693 5.5693 6.9812 6.9812 8.3414 8.3414 8.6196 8.6196 k = 0.0135 0.0088-0.0037 ( 7714 PWs) bands (ev): -19.6339 -19.6339 -19.5050 -19.5050 -17.4932 -17.4932 -17.4796 -17.4796 -16.4609 -16.4609 -16.3864 -16.3864 -13.7939 -13.7939 -13.7837 -13.7837 -10.9127 -10.9127 -10.7847 -10.7847 -10.1858 -10.1858 -10.0903 -10.0903 -7.8883 -7.8883 -7.8834 -7.8834 -7.1541 -7.1541 -6.9625 -6.9625 -6.0762 -6.0762 -6.0635 -6.0635 -5.8743 -5.8743 -5.4027 -5.4027 -5.1350 -5.1350 -4.3358 -4.3358 -4.1821 -4.1821 -4.1130 -4.1130 -2.4135 -2.4135 -2.2698 -2.2698 -1.9617 -1.9617 -1.6600 -1.6600 -1.5101 -1.5101 -1.2767 -1.2767 -0.8054 -0.8054 -0.7206 -0.7206 0.6423 0.6423 0.9246 0.9246 1.1736 1.1736 1.2586 1.2586 3.7472 3.7472 4.0641 4.0641 5.1362 5.1362 5.5717 5.5717 6.9755 6.9755 8.3453 8.3453 8.6146 8.6146 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0000 0.0165 ( 7717 PWs) bands (ev): -19.6339 -19.6339 -19.5051 -19.5051 -17.4930 -17.4930 -17.4795 -17.4795 -16.4610 -16.4610 -16.3863 -16.3863 -13.7941 -13.7941 -13.7837 -13.7837 -10.9130 -10.9130 -10.7848 -10.7848 -10.1860 -10.1860 -10.0902 -10.0902 -7.8910 -7.8910 -7.8805 -7.8805 -7.1536 -7.1536 -6.9621 -6.9621 -6.0765 -6.0765 -6.0627 -6.0627 -5.8751 -5.8751 -5.4030 -5.4030 -5.1339 -5.1339 -4.3357 -4.3357 -4.1820 -4.1820 -4.1138 -4.1138 -2.4130 -2.4130 -2.2698 -2.2698 -1.9623 -1.9623 -1.6607 -1.6607 -1.5105 -1.5105 -1.2770 -1.2770 -0.8048 -0.8048 -0.7204 -0.7204 0.6422 0.6422 0.9244 0.9244 1.1736 1.1736 1.2582 1.2582 3.7474 3.7474 4.0635 4.0635 5.1366 5.1366 5.5724 5.5724 6.9754 6.9754 8.3461 8.3461 8.6126 8.6126 k = 0.0000 0.0000 0.0330 ( 7720 PWs) bands (ev): -19.6335 -19.6335 -19.5055 -19.5055 -17.4930 -17.4930 -17.4795 -17.4795 -16.4608 -16.4608 -16.3865 -16.3865 -13.7955 -13.7955 -13.7823 -13.7823 -10.9125 -10.9125 -10.7852 -10.7852 -10.1857 -10.1857 -10.0905 -10.0905 -7.8963 -7.8963 -7.8754 -7.8754 -7.1534 -7.1534 -6.9620 -6.9620 -6.0772 -6.0772 -6.0621 -6.0621 -5.8736 -5.8736 -5.4050 -5.4050 -5.1308 -5.1308 -4.3356 -4.3356 -4.1854 -4.1854 -4.1142 -4.1142 -2.4129 -2.4129 -2.2681 -2.2681 -1.9634 -1.9634 -1.6609 -1.6609 -1.5104 -1.5104 -1.2773 -1.2773 -0.8066 -0.8066 -0.7189 -0.7189 0.6428 0.6428 0.9238 0.9238 1.1729 1.1729 1.2590 1.2590 3.7480 3.7480 4.0621 4.0621 5.1384 5.1384 5.5720 5.5720 6.9810 6.9810 8.3447 8.3447 8.6118 8.6118 k = 0.0000 0.0000 0.0495 ( 7718 PWs) bands (ev): -19.6329 -19.6329 -19.5061 -19.5061 -17.4931 -17.4931 -17.4794 -17.4794 -16.4605 -16.4605 -16.3867 -16.3867 -13.7972 -13.7972 -13.7805 -13.7805 -10.9119 -10.9119 -10.7860 -10.7860 -10.1852 -10.1852 -10.0910 -10.0910 -7.9016 -7.9016 -7.8704 -7.8704 -7.1530 -7.1530 -6.9620 -6.9620 -6.0782 -6.0782 -6.0611 -6.0611 -5.8710 -5.8710 -5.4081 -5.4081 -5.1257 -5.1257 -4.3355 -4.3355 -4.1909 -4.1909 -4.1149 -4.1149 -2.4126 -2.4126 -2.2652 -2.2652 -1.9651 -1.9651 -1.6612 -1.6612 -1.5102 -1.5102 -1.2778 -1.2778 -0.8092 -0.8092 -0.7164 -0.7164 0.6437 0.6437 0.9229 0.9229 1.1717 1.1717 1.2602 1.2602 3.7489 3.7489 4.0596 4.0596 5.1414 5.1414 5.5714 5.5714 6.9903 6.9903 8.3423 8.3423 8.6104 8.6104 k = 0.0000 0.0000 0.0660 ( 7719 PWs) bands (ev): -19.6321 -19.6321 -19.5070 -19.5070 -17.4932 -17.4932 -17.4794 -17.4794 -16.4601 -16.4601 -16.3870 -16.3870 -13.7992 -13.7992 -13.7786 -13.7786 -10.9109 -10.9109 -10.7871 -10.7871 -10.1845 -10.1845 -10.0917 -10.0917 -7.9069 -7.9069 -7.8656 -7.8656 -7.1525 -7.1525 -6.9619 -6.9619 -6.0794 -6.0794 -6.0600 -6.0600 -5.8675 -5.8675 -5.4125 -5.4125 -5.1185 -5.1185 -4.3356 -4.3356 -4.1984 -4.1984 -4.1161 -4.1161 -2.4123 -2.4123 -2.2614 -2.2614 -1.9673 -1.9673 -1.6618 -1.6618 -1.5099 -1.5099 -1.2785 -1.2785 -0.8127 -0.8127 -0.7133 -0.7133 0.6449 0.6449 0.9215 0.9215 1.1701 1.1701 1.2618 1.2618 3.7503 3.7503 4.0563 4.0563 5.1455 5.1455 5.5705 5.5705 7.0033 7.0033 8.3389 8.3389 8.6086 8.6086 k = 0.0000 0.0000 0.0825 ( 7718 PWs) bands (ev): -19.6310 -19.6310 -19.5081 -19.5081 -17.4933 -17.4933 -17.4794 -17.4794 -16.4596 -16.4596 -16.3875 -16.3875 -13.8012 -13.8012 -13.7765 -13.7765 -10.9096 -10.9096 -10.7885 -10.7885 -10.1837 -10.1837 -10.0926 -10.0926 -7.9122 -7.9122 -7.8609 -7.8609 -7.1519 -7.1519 -6.9618 -6.9618 -6.0808 -6.0808 -6.0586 -6.0586 -5.8630 -5.8630 -5.4180 -5.4180 -5.1095 -5.1095 -4.3359 -4.3359 -4.2075 -4.2075 -4.1177 -4.1177 -2.4118 -2.4118 -2.2568 -2.2568 -1.9698 -1.9698 -1.6626 -1.6626 -1.5096 -1.5096 -1.2794 -1.2794 -0.8168 -0.8168 -0.7096 -0.7096 0.6465 0.6465 0.9198 0.9198 1.1681 1.1681 1.2637 1.2637 3.7520 3.7520 4.0520 4.0520 5.1508 5.1508 5.5694 5.5694 7.0197 7.0197 8.3343 8.3343 8.6063 8.6063 k = 0.0000 0.0000 0.0990 ( 7712 PWs) bands (ev): -19.6298 -19.6298 -19.5094 -19.5094 -17.4934 -17.4934 -17.4794 -17.4794 -16.4589 -16.4589 -16.3880 -16.3880 -13.8032 -13.8032 -13.7744 -13.7744 -10.9081 -10.9081 -10.7902 -10.7902 -10.1827 -10.1827 -10.0936 -10.0936 -7.9174 -7.9174 -7.8564 -7.8564 -7.1511 -7.1511 -6.9616 -6.9616 -6.0822 -6.0822 -6.0571 -6.0571 -5.8576 -5.8576 -5.4245 -5.4245 -5.0987 -5.0987 -4.3368 -4.3368 -4.2177 -4.2177 -4.1197 -4.1197 -2.4111 -2.4111 -2.2515 -2.2515 -1.9723 -1.9723 -1.6638 -1.6638 -1.5092 -1.5092 -1.2805 -1.2805 -0.8213 -0.8213 -0.7056 -0.7056 0.6484 0.6484 0.9178 0.9178 1.1659 1.1659 1.2659 1.2659 3.7542 3.7542 4.0469 4.0469 5.1572 5.1572 5.5680 5.5680 7.0396 7.0396 8.3285 8.3285 8.6035 8.6035 k = 0.0000 0.0000 0.1155 ( 7709 PWs) bands (ev): -19.6283 -19.6283 -19.5110 -19.5110 -17.4936 -17.4936 -17.4793 -17.4793 -16.4582 -16.4582 -16.3886 -16.3886 -13.8051 -13.8051 -13.7724 -13.7724 -10.9064 -10.9064 -10.7921 -10.7921 -10.1815 -10.1815 -10.0949 -10.0949 -7.9225 -7.9225 -7.8521 -7.8521 -7.1503 -7.1503 -6.9615 -6.9615 -6.0837 -6.0837 -6.0556 -6.0556 -5.8513 -5.8513 -5.4320 -5.4320 -5.0860 -5.0860 -4.3388 -4.3388 -4.2286 -4.2286 -4.1224 -4.1224 -2.4101 -2.4101 -2.2459 -2.2459 -1.9746 -1.9746 -1.6655 -1.6655 -1.5087 -1.5087 -1.2818 -1.2818 -0.8260 -0.8260 -0.7014 -0.7014 0.6505 0.6505 0.9155 0.9155 1.1636 1.1636 1.2683 1.2683 3.7567 3.7567 4.0409 4.0409 5.1645 5.1645 5.5663 5.5663 7.0628 7.0628 8.3212 8.3212 8.6004 8.6004 k = 0.0000 0.0000 0.1320 ( 7710 PWs) bands (ev): -19.6266 -19.6266 -19.5127 -19.5127 -17.4937 -17.4937 -17.4793 -17.4793 -16.4574 -16.4574 -16.3893 -16.3893 -13.8070 -13.8070 -13.7704 -13.7704 -10.9044 -10.9044 -10.7944 -10.7944 -10.1802 -10.1802 -10.0963 -10.0963 -7.9274 -7.9274 -7.8480 -7.8480 -7.1494 -7.1494 -6.9613 -6.9613 -6.0853 -6.0853 -6.0540 -6.0540 -5.8441 -5.8441 -5.4404 -5.4404 -5.0717 -5.0717 -4.3425 -4.3425 -4.2394 -4.2394 -4.1255 -4.1255 -2.4089 -2.4089 -2.2402 -2.2402 -1.9764 -1.9764 -1.6679 -1.6679 -1.5082 -1.5082 -1.2833 -1.2833 -0.8309 -0.8309 -0.6971 -0.6971 0.6529 0.6529 0.9130 0.9130 1.1611 1.1611 1.2709 1.2709 3.7597 3.7597 4.0343 4.0343 5.1728 5.1728 5.5642 5.5642 7.0891 7.0891 8.3123 8.3123 8.5970 8.5970 k = 0.0000 0.0000 0.1485 ( 7716 PWs) bands (ev): -19.6247 -19.6247 -19.5147 -19.5147 -17.4939 -17.4939 -17.4793 -17.4793 -16.4565 -16.4565 -16.3900 -16.3900 -13.8089 -13.8089 -13.7685 -13.7685 -10.9021 -10.9021 -10.7968 -10.7968 -10.1787 -10.1787 -10.0978 -10.0978 -7.9322 -7.9322 -7.8441 -7.8441 -7.1484 -7.1484 -6.9611 -6.9611 -6.0869 -6.0869 -6.0524 -6.0524 -5.8361 -5.8361 -5.4496 -5.4496 -5.0557 -5.0557 -4.3488 -4.3488 -4.2490 -4.2490 -4.1292 -4.1292 -2.4075 -2.4075 -2.2346 -2.2346 -1.9774 -1.9774 -1.6711 -1.6711 -1.5075 -1.5075 -1.2850 -1.2850 -0.8358 -0.8358 -0.6928 -0.6928 0.6555 0.6555 0.9102 0.9102 1.1586 1.1586 1.2734 1.2734 3.7631 3.7631 4.0269 4.0269 5.1818 5.1818 5.5618 5.5618 7.1184 7.1184 8.3014 8.3014 8.5934 8.5934 k = 0.0000 0.0000 0.1650 ( 7715 PWs) bands (ev): -19.6227 -19.6227 -19.5168 -19.5168 -17.4940 -17.4940 -17.4793 -17.4793 -16.4555 -16.4555 -16.3908 -16.3908 -13.8106 -13.8106 -13.7666 -13.7666 -10.8996 -10.8996 -10.7996 -10.7996 -10.1771 -10.1771 -10.0995 -10.0995 -7.9368 -7.9368 -7.8405 -7.8405 -7.1474 -7.1474 -6.9609 -6.9609 -6.0884 -6.0884 -6.0508 -6.0508 -5.8274 -5.8274 -5.4596 -5.4596 -5.0382 -5.0382 -4.3586 -4.3586 -4.2564 -4.2564 -4.1333 -4.1333 -2.4058 -2.4058 -2.2294 -2.2294 -1.9771 -1.9771 -1.6752 -1.6752 -1.5067 -1.5067 -1.2868 -1.2868 -0.8407 -0.8407 -0.6886 -0.6886 0.6583 0.6583 0.9072 0.9072 1.1560 1.1560 1.2760 1.2760 3.7669 3.7669 4.0189 4.0189 5.1916 5.1916 5.5591 5.5591 7.1504 7.1504 8.2885 8.2885 8.5896 8.5896 k = 0.0000 0.0000 0.1815 ( 7716 PWs) bands (ev): -19.6205 -19.6205 -19.5190 -19.5190 -17.4942 -17.4942 -17.4792 -17.4792 -16.4545 -16.4545 -16.3917 -16.3917 -13.8123 -13.8123 -13.7648 -13.7648 -10.8969 -10.8969 -10.8025 -10.8025 -10.1754 -10.1754 -10.1013 -10.1013 -7.9411 -7.9411 -7.8372 -7.8372 -7.1463 -7.1463 -6.9606 -6.9606 -6.0899 -6.0899 -6.0491 -6.0491 -5.8180 -5.8180 -5.4702 -5.4702 -5.0192 -5.0192 -4.3723 -4.3723 -4.2612 -4.2612 -4.1379 -4.1379 -2.4038 -2.4038 -2.2250 -2.2250 -1.9753 -1.9753 -1.6804 -1.6804 -1.5058 -1.5058 -1.2887 -1.2887 -0.8455 -0.8455 -0.6845 -0.6845 0.6612 0.6612 0.9040 0.9040 1.1535 1.1535 1.2786 1.2786 3.7711 3.7711 4.0104 4.0104 5.2020 5.2020 5.5560 5.5560 7.1850 7.1850 8.2731 8.2731 8.5857 8.5857 k = 0.0000 0.0000 0.1981 ( 7709 PWs) bands (ev): -19.6182 -19.6182 -19.5214 -19.5214 -17.4944 -17.4944 -17.4792 -17.4792 -16.4534 -16.4534 -16.3925 -16.3925 -13.8139 -13.8139 -13.7632 -13.7632 -10.8940 -10.8940 -10.8057 -10.8057 -10.1736 -10.1736 -10.1032 -10.1032 -7.9453 -7.9453 -7.8340 -7.8340 -7.1453 -7.1453 -6.9604 -6.9604 -6.0913 -6.0913 -6.0476 -6.0476 -5.8079 -5.8079 -5.4814 -5.4814 -4.9988 -4.9988 -4.3898 -4.3898 -4.2633 -4.2633 -4.1429 -4.1429 -2.4017 -2.4017 -2.2214 -2.2214 -1.9718 -1.9718 -1.6866 -1.6866 -1.5047 -1.5047 -1.2907 -1.2907 -0.8500 -0.8500 -0.6806 -0.6806 0.6642 0.6642 0.9008 0.9008 1.1512 1.1512 1.2810 1.2810 3.7757 3.7757 4.0014 4.0014 5.2129 5.2129 5.5526 5.5526 7.2218 7.2218 8.2550 8.2550 8.5819 8.5819 k = 0.0000 0.0000 0.2146 ( 7709 PWs) bands (ev): -19.6158 -19.6158 -19.5239 -19.5239 -17.4946 -17.4946 -17.4792 -17.4792 -16.4523 -16.4523 -16.3934 -16.3934 -13.8153 -13.8153 -13.7616 -13.7616 -10.8909 -10.8909 -10.8090 -10.8090 -10.1716 -10.1716 -10.1052 -10.1052 -7.9491 -7.9491 -7.8312 -7.8312 -7.1443 -7.1443 -6.9602 -6.9602 -6.0927 -6.0927 -6.0460 -6.0460 -5.7973 -5.7973 -5.4932 -5.4932 -4.9771 -4.9771 -4.4104 -4.4104 -4.2633 -4.2633 -4.1483 -4.1483 -2.3993 -2.3993 -2.2189 -2.2189 -1.9663 -1.9663 -1.6942 -1.6942 -1.5034 -1.5034 -1.2928 -1.2928 -0.8543 -0.8543 -0.6769 -0.6769 0.6673 0.6673 0.8975 0.8975 1.1489 1.1489 1.2834 1.2834 3.7806 3.7806 3.9922 3.9922 5.2240 5.2240 5.5488 5.5488 7.2607 7.2607 8.2340 8.2340 8.5783 8.5783 k = 0.0000 0.0000 0.2311 ( 7714 PWs) bands (ev): -19.6133 -19.6133 -19.5264 -19.5264 -17.4947 -17.4947 -17.4791 -17.4791 -16.4512 -16.4512 -16.3944 -16.3944 -13.8167 -13.8167 -13.7602 -13.7602 -10.8876 -10.8876 -10.8126 -10.8126 -10.1697 -10.1697 -10.1073 -10.1073 -7.9527 -7.9527 -7.8286 -7.8286 -7.1433 -7.1433 -6.9599 -6.9599 -6.0939 -6.0939 -6.0446 -6.0446 -5.7861 -5.7861 -5.5053 -5.5053 -4.9541 -4.9541 -4.4336 -4.4336 -4.2616 -4.2616 -4.1540 -4.1540 -2.3969 -2.3969 -2.2174 -2.2174 -1.9590 -1.9590 -1.7029 -1.7029 -1.5019 -1.5019 -1.2949 -1.2949 -0.8584 -0.8584 -0.6735 -0.6735 0.6703 0.6703 0.8942 0.8942 1.1468 1.1468 1.2856 1.2856 3.7860 3.7860 3.9826 3.9826 5.2353 5.2353 5.5448 5.5448 7.3011 7.3011 8.2100 8.2100 8.5749 8.5749 k = 0.0000 0.0000 0.2476 ( 7719 PWs) bands (ev): -19.6109 -19.6109 -19.5290 -19.5290 -17.4949 -17.4949 -17.4791 -17.4791 -16.4502 -16.4502 -16.3953 -16.3953 -13.8179 -13.8179 -13.7589 -13.7589 -10.8842 -10.8842 -10.8163 -10.8163 -10.1676 -10.1676 -10.1094 -10.1094 -7.9559 -7.9559 -7.8263 -7.8263 -7.1424 -7.1424 -6.9597 -6.9597 -6.0951 -6.0951 -6.0433 -6.0433 -5.7746 -5.7746 -5.5178 -5.5178 -4.9299 -4.9299 -4.4587 -4.4587 -4.2586 -4.2586 -4.1601 -4.1601 -2.3943 -2.3943 -2.2168 -2.2168 -1.9497 -1.9497 -1.7130 -1.7130 -1.5003 -1.5003 -1.2970 -1.2970 -0.8621 -0.8621 -0.6704 -0.6704 0.6733 0.6733 0.8910 0.8910 1.1449 1.1449 1.2877 1.2877 3.7916 3.7916 3.9730 3.9730 5.2464 5.2464 5.5405 5.5405 7.3428 7.3428 8.1830 8.1830 8.5717 8.5717 k = 0.0000 0.0000 0.2641 ( 7722 PWs) bands (ev): -19.6084 -19.6084 -19.5316 -19.5316 -17.4950 -17.4950 -17.4791 -17.4791 -16.4492 -16.4492 -16.3962 -16.3962 -13.8190 -13.8190 -13.7577 -13.7577 -10.8806 -10.8806 -10.8201 -10.8201 -10.1656 -10.1656 -10.1115 -10.1115 -7.9588 -7.9588 -7.8243 -7.8243 -7.1415 -7.1415 -6.9594 -6.9594 -6.0962 -6.0962 -6.0420 -6.0420 -5.7629 -5.7629 -5.5305 -5.5305 -4.9047 -4.9047 -4.4853 -4.4853 -4.2547 -4.2547 -4.1663 -4.1663 -2.3918 -2.3918 -2.2171 -2.2171 -1.9386 -1.9386 -1.7242 -1.7242 -1.4986 -1.4986 -1.2990 -1.2990 -0.8654 -0.8654 -0.6675 -0.6675 0.6761 0.6761 0.8879 0.8879 1.1431 1.1431 1.2895 1.2895 3.7975 3.7975 3.9635 3.9635 5.2572 5.2572 5.5361 5.5361 7.3853 7.3853 8.1535 8.1535 8.5689 8.5689 k = 0.0000 0.0000 0.2806 ( 7716 PWs) bands (ev): -19.6060 -19.6060 -19.5340 -19.5340 -17.4951 -17.4951 -17.4791 -17.4791 -16.4482 -16.4482 -16.3970 -16.3970 -13.8199 -13.8199 -13.7567 -13.7567 -10.8769 -10.8769 -10.8239 -10.8239 -10.1637 -10.1637 -10.1135 -10.1135 -7.9614 -7.9614 -7.8225 -7.8225 -7.1408 -7.1408 -6.9592 -6.9592 -6.0971 -6.0971 -6.0409 -6.0409 -5.7510 -5.7510 -5.5431 -5.5431 -4.8786 -4.8786 -4.5130 -4.5130 -4.2501 -4.2501 -4.1728 -4.1728 -2.3894 -2.3894 -2.2179 -2.2179 -1.9261 -1.9261 -1.7366 -1.7366 -1.4969 -1.4969 -1.3009 -1.3009 -0.8684 -0.8684 -0.6650 -0.6650 0.6787 0.6787 0.8851 0.8851 1.1416 1.1416 1.2912 1.2912 3.8035 3.8035 3.9541 3.9541 5.2675 5.2675 5.5317 5.5317 7.4278 7.4278 8.1218 8.1218 8.5666 8.5666 k = 0.0000 0.0000 0.2971 ( 7715 PWs) bands (ev): -19.6038 -19.6038 -19.5363 -19.5363 -17.4953 -17.4953 -17.4791 -17.4791 -16.4473 -16.4473 -16.3977 -16.3977 -13.8207 -13.8207 -13.7558 -13.7558 -10.8732 -10.8732 -10.8279 -10.8279 -10.1618 -10.1618 -10.1154 -10.1154 -7.9636 -7.9636 -7.8210 -7.8210 -7.1401 -7.1401 -6.9590 -6.9590 -6.0979 -6.0979 -6.0399 -6.0399 -5.7392 -5.7392 -5.5556 -5.5556 -4.8518 -4.8518 -4.5415 -4.5415 -4.2449 -4.2449 -4.1795 -4.1795 -2.3871 -2.3871 -2.2192 -2.2192 -1.9122 -1.9122 -1.7500 -1.7500 -1.4952 -1.4952 -1.3026 -1.3026 -0.8709 -0.8709 -0.6629 -0.6629 0.6811 0.6811 0.8826 0.8826 1.1403 1.1403 1.2926 1.2926 3.8094 3.8094 3.9452 3.9452 5.2770 5.2770 5.5275 5.5275 7.4697 7.4697 8.0889 8.0889 8.5646 8.5646 k = 0.0000 0.0000 0.3136 ( 7712 PWs) bands (ev): -19.6017 -19.6017 -19.5384 -19.5384 -17.4953 -17.4953 -17.4791 -17.4791 -16.4466 -16.4466 -16.3984 -16.3984 -13.8214 -13.8214 -13.7551 -13.7551 -10.8694 -10.8694 -10.8318 -10.8318 -10.1601 -10.1601 -10.1172 -10.1172 -7.9654 -7.9654 -7.8198 -7.8198 -7.1395 -7.1395 -6.9589 -6.9589 -6.0986 -6.0986 -6.0391 -6.0391 -5.7279 -5.7279 -5.5674 -5.5674 -4.8244 -4.8244 -4.5703 -4.5703 -4.2393 -4.2393 -4.1862 -4.1862 -2.3850 -2.3850 -2.2206 -2.2206 -1.8974 -1.8974 -1.7643 -1.7643 -1.4938 -1.4938 -1.3041 -1.3041 -0.8730 -0.8730 -0.6611 -0.6611 0.6831 0.6831 0.8804 0.8804 1.1392 1.1392 1.2938 1.2938 3.8152 3.8152 3.9369 3.9369 5.2853 5.2853 5.5235 5.5235 7.5096 7.5096 8.0560 8.0560 8.5630 8.5630 k = 0.0000 0.0000 0.3301 ( 7724 PWs) bands (ev): -19.6000 -19.6000 -19.5401 -19.5401 -17.4954 -17.4954 -17.4791 -17.4791 -16.4459 -16.4459 -16.3989 -16.3989 -13.8219 -13.8219 -13.7545 -13.7545 -10.8657 -10.8657 -10.8357 -10.8357 -10.1586 -10.1586 -10.1187 -10.1187 -7.9668 -7.9668 -7.8188 -7.8188 -7.1391 -7.1391 -6.9587 -6.9587 -6.0991 -6.0991 -6.0385 -6.0385 -5.7175 -5.7175 -5.5782 -5.5782 -4.7970 -4.7970 -4.5989 -4.5989 -4.2333 -4.2333 -4.1931 -4.1931 -2.3834 -2.3834 -2.2219 -2.2219 -1.8819 -1.8819 -1.7792 -1.7792 -1.4925 -1.4925 -1.3054 -1.3054 -0.8747 -0.8747 -0.6597 -0.6597 0.6848 0.6848 0.8786 0.8786 1.1384 1.1384 1.2947 1.2947 3.8204 3.8204 3.9297 3.9297 5.2922 5.2922 5.5202 5.5202 7.5458 7.5458 8.0251 8.0251 8.5618 8.5618 k = 0.0000 0.0000 0.3466 ( 7720 PWs) bands (ev): -19.5987 -19.5987 -19.5415 -19.5415 -17.4955 -17.4955 -17.4790 -17.4790 -16.4455 -16.4455 -16.3993 -16.3993 -13.8223 -13.8223 -13.7541 -13.7541 -10.8622 -10.8622 -10.8392 -10.8392 -10.1574 -10.1574 -10.1199 -10.1199 -7.9678 -7.9678 -7.8181 -7.8181 -7.1388 -7.1388 -6.9586 -6.9586 -6.0995 -6.0995 -6.0380 -6.0380 -5.7088 -5.7088 -5.5872 -5.5872 -4.7706 -4.7706 -4.6263 -4.6263 -4.2271 -4.2271 -4.1999 -4.1999 -2.3821 -2.3821 -2.2230 -2.2230 -1.8663 -1.8663 -1.7944 -1.7944 -1.4916 -1.4916 -1.3063 -1.3063 -0.8759 -0.8759 -0.6587 -0.6587 0.6860 0.6860 0.8773 0.8773 1.1378 1.1378 1.2954 1.2954 3.8247 3.8247 3.9240 3.9240 5.2974 5.2974 5.5175 5.5175 7.5758 7.5758 7.9988 7.9988 8.5610 8.5610 k = 0.0000 0.0000 0.3631 ( 7725 PWs) bands (ev): -19.5979 -19.5979 -19.5423 -19.5423 -17.4955 -17.4955 -17.4790 -17.4790 -16.4452 -16.4452 -16.3996 -16.3996 -13.8225 -13.8225 -13.7539 -13.7539 -10.8594 -10.8594 -10.8420 -10.8420 -10.1567 -10.1567 -10.1206 -10.1206 -7.9684 -7.9684 -7.8177 -7.8177 -7.1386 -7.1386 -6.9586 -6.9586 -6.0997 -6.0997 -6.0378 -6.0378 -5.7029 -5.7029 -5.5934 -5.5934 -4.7476 -4.7476 -4.6498 -4.6498 -4.2207 -4.2207 -4.2066 -4.2066 -2.3813 -2.3813 -2.2237 -2.2237 -1.8516 -1.8516 -1.8088 -1.8088 -1.4910 -1.4910 -1.3069 -1.3069 -0.8766 -0.8766 -0.6581 -0.6581 0.6868 0.6868 0.8765 0.8765 1.1374 1.1374 1.2958 1.2958 3.8276 3.8276 3.9202 3.9202 5.3006 5.3006 5.5159 5.5159 7.5962 7.5962 7.9806 7.9806 8.5605 8.5605 k = 0.0000 0.0000 0.3796 ( 7726 PWs) bands (ev): -19.5976 -19.5976 -19.5426 -19.5426 -17.4955 -17.4955 -17.4790 -17.4790 -16.4451 -16.4451 -16.3997 -16.3997 -13.8226 -13.8226 -13.7538 -13.7538 -10.8583 -10.8583 -10.8432 -10.8432 -10.1564 -10.1564 -10.1209 -10.1209 -7.9686 -7.9686 -7.8176 -7.8176 -7.1385 -7.1385 -6.9586 -6.9586 -6.0998 -6.0998 -6.0377 -6.0377 -5.7007 -5.7007 -5.5956 -5.5956 -4.7369 -4.7369 -4.6608 -4.6608 -4.2157 -4.2157 -4.2117 -4.2117 -2.3810 -2.3810 -2.2240 -2.2240 -1.8434 -1.8434 -1.8168 -1.8168 -1.4908 -1.4908 -1.3070 -1.3070 -0.8769 -0.8769 -0.6579 -0.6579 0.6870 0.6870 0.8762 0.8762 1.1373 1.1373 1.2959 1.2959 3.8286 3.8286 3.9189 3.9189 5.3017 5.3017 5.5153 5.5153 7.6035 7.6035 7.9740 7.9740 8.5604 8.5604 k = 0.5000-0.1080 0.2692 ( 7700 PWs) bands (ev): -19.5546 -19.5546 -19.5526 -19.5526 -17.5055 -17.5055 -17.4732 -17.4732 -16.4990 -16.4990 -16.4100 -16.4100 -13.8381 -13.8381 -13.7380 -13.7380 -10.8552 -10.8552 -10.8032 -10.8032 -10.1768 -10.1768 -10.1737 -10.1737 -7.9043 -7.9043 -7.8216 -7.8216 -7.1211 -7.1211 -6.9180 -6.9180 -6.0924 -6.0924 -6.0507 -6.0507 -5.6431 -5.6431 -5.4928 -5.4928 -4.9138 -4.9138 -4.8224 -4.8224 -4.3376 -4.3376 -4.2605 -4.2605 -2.3831 -2.3831 -2.2055 -2.2055 -1.6402 -1.6402 -1.4536 -1.4536 -1.3923 -1.3923 -1.3537 -1.3537 -0.7594 -0.7594 -0.7081 -0.7081 0.5071 0.5071 0.8771 0.8771 1.1076 1.1076 1.3328 1.3328 3.7807 3.7807 3.8634 3.8634 5.2230 5.2230 5.5559 5.5559 8.0507 8.0507 8.3715 8.3715 8.4314 8.4314 k = 0.4857-0.1049 0.2615 ( 7701 PWs) bands (ev): -19.5567 -19.5567 -19.5505 -19.5505 -17.5055 -17.5055 -17.4732 -17.4732 -16.4989 -16.4989 -16.4099 -16.4099 -13.8381 -13.8381 -13.7380 -13.7380 -10.8553 -10.8553 -10.8031 -10.8031 -10.1779 -10.1779 -10.1724 -10.1724 -7.9043 -7.9043 -7.8217 -7.8217 -7.1212 -7.1212 -6.9181 -6.9181 -6.0924 -6.0924 -6.0507 -6.0507 -5.6439 -5.6439 -5.4923 -5.4923 -4.9186 -4.9186 -4.8169 -4.8169 -4.3374 -4.3374 -4.2604 -4.2604 -2.3830 -2.3830 -2.2057 -2.2057 -1.6418 -1.6418 -1.4537 -1.4537 -1.3917 -1.3917 -1.3539 -1.3539 -0.7595 -0.7595 -0.7081 -0.7081 0.5074 0.5074 0.8771 0.8771 1.1078 1.1078 1.3326 1.3326 3.7807 3.7807 3.8638 3.8638 5.2226 5.2226 5.5561 5.5561 8.0487 8.0487 8.3685 8.3685 8.4343 8.4343 k = 0.4714-0.1018 0.2538 ( 7693 PWs) bands (ev): -19.5596 -19.5596 -19.5478 -19.5478 -17.5054 -17.5054 -17.4732 -17.4732 -16.4987 -16.4987 -16.4098 -16.4098 -13.8379 -13.8379 -13.7382 -13.7382 -10.8557 -10.8557 -10.8029 -10.8029 -10.1797 -10.1797 -10.1702 -10.1702 -7.9043 -7.9043 -7.8220 -7.8220 -7.1214 -7.1214 -6.9184 -6.9184 -6.0923 -6.0923 -6.0508 -6.0508 -5.6463 -5.6463 -5.4906 -5.4906 -4.9305 -4.9305 -4.8030 -4.8030 -4.3366 -4.3366 -4.2599 -4.2599 -2.3828 -2.3828 -2.2062 -2.2062 -1.6465 -1.6465 -1.4539 -1.4539 -1.3896 -1.3896 -1.3545 -1.3545 -0.7598 -0.7598 -0.7082 -0.7082 0.5080 0.5080 0.8774 0.8774 1.1082 1.1082 1.3322 1.3322 3.7807 3.7807 3.8650 3.8650 5.2214 5.2214 5.5566 5.5566 8.0425 8.0425 8.3609 8.3609 8.4419 8.4419 k = 0.4571-0.0988 0.2462 ( 7698 PWs) bands (ev): -19.5626 -19.5626 -19.5451 -19.5451 -17.5053 -17.5053 -17.4733 -17.4733 -16.4983 -16.4983 -16.4095 -16.4095 -13.8377 -13.8377 -13.7384 -13.7384 -10.8564 -10.8564 -10.8026 -10.8026 -10.1815 -10.1815 -10.1677 -10.1677 -7.9043 -7.9043 -7.8224 -7.8224 -7.1216 -7.1216 -6.9189 -6.9189 -6.0921 -6.0921 -6.0510 -6.0510 -5.6501 -5.6501 -5.4880 -5.4880 -4.9458 -4.9458 -4.7844 -4.7844 -4.3353 -4.3353 -4.2591 -4.2591 -2.3823 -2.3823 -2.2072 -2.2072 -1.6541 -1.6541 -1.4544 -1.4544 -1.3864 -1.3864 -1.3555 -1.3555 -0.7602 -0.7602 -0.7084 -0.7084 0.5091 0.5091 0.8778 0.8778 1.1090 1.1090 1.3313 1.3313 3.7806 3.7806 3.8670 3.8670 5.2194 5.2194 5.5574 5.5574 8.0321 8.0321 8.3508 8.3508 8.4521 8.4521 k = 0.4429-0.0957 0.2385 ( 7703 PWs) bands (ev): -19.5656 -19.5656 -19.5425 -19.5425 -17.5052 -17.5052 -17.4733 -17.4733 -16.4978 -16.4978 -16.4092 -16.4092 -13.8374 -13.8374 -13.7388 -13.7388 -10.8573 -10.8573 -10.8022 -10.8022 -10.1832 -10.1832 -10.1650 -10.1650 -7.9043 -7.9043 -7.8231 -7.8231 -7.1220 -7.1220 -6.9196 -6.9196 -6.0920 -6.0920 -6.0512 -6.0512 -5.6551 -5.6551 -5.4847 -5.4847 -4.9622 -4.9622 -4.7633 -4.7633 -4.3336 -4.3336 -4.2580 -4.2580 -2.3817 -2.3817 -2.2085 -2.2085 -1.6641 -1.6641 -1.4553 -1.4553 -1.3820 -1.3820 -1.3570 -1.3570 -0.7608 -0.7608 -0.7087 -0.7087 0.5106 0.5106 0.8784 0.8784 1.1100 1.1100 1.3302 1.3302 3.7806 3.7806 3.8698 3.8698 5.2167 5.2167 5.5585 5.5585 8.0173 8.0173 8.3397 8.3397 8.4636 8.4636 k = 0.4286-0.0926 0.2308 ( 7703 PWs) bands (ev): -19.5688 -19.5688 -19.5400 -19.5400 -17.5050 -17.5050 -17.4734 -17.4734 -16.4971 -16.4971 -16.4088 -16.4088 -13.8369 -13.8369 -13.7393 -13.7393 -10.8585 -10.8585 -10.8016 -10.8016 -10.1847 -10.1847 -10.1622 -10.1622 -7.9042 -7.9042 -7.8239 -7.8239 -7.1226 -7.1226 -6.9205 -6.9205 -6.0917 -6.0917 -6.0515 -6.0515 -5.6613 -5.6613 -5.4807 -5.4807 -4.9788 -4.9788 -4.7408 -4.7408 -4.3315 -4.3315 -4.2563 -4.2563 -2.3810 -2.3810 -2.2102 -2.2102 -1.6761 -1.6761 -1.4568 -1.4568 -1.3770 -1.3770 -1.3588 -1.3588 -0.7616 -0.7616 -0.7090 -0.7090 0.5125 0.5125 0.8791 0.8791 1.1113 1.1113 1.3288 1.3288 3.7805 3.7805 3.8734 3.8734 5.2133 5.2133 5.5598 5.5598 7.9980 7.9980 8.3285 8.3285 8.4759 8.4759 k = 0.4143-0.0895 0.2231 ( 7707 PWs) bands (ev): -19.5719 -19.5719 -19.5375 -19.5375 -17.5048 -17.5048 -17.4735 -17.4735 -16.4963 -16.4963 -16.4082 -16.4082 -13.8364 -13.8364 -13.7399 -13.7399 -10.8598 -10.8598 -10.8010 -10.8010 -10.1861 -10.1861 -10.1593 -10.1593 -7.9042 -7.9042 -7.8250 -7.8250 -7.1232 -7.1232 -6.9216 -6.9216 -6.0914 -6.0914 -6.0518 -6.0518 -5.6684 -5.6684 -5.4763 -5.4763 -4.9950 -4.9950 -4.7174 -4.7174 -4.3293 -4.3293 -4.2542 -4.2542 -2.3801 -2.3801 -2.2122 -2.2122 -1.6897 -1.6897 -1.4588 -1.4588 -1.3718 -1.3718 -1.3608 -1.3608 -0.7625 -0.7625 -0.7094 -0.7094 0.5149 0.5149 0.8800 0.8800 1.1129 1.1129 1.3271 1.3271 3.7803 3.7803 3.8777 3.8777 5.2094 5.2094 5.5613 5.5613 7.9742 7.9742 8.3175 8.3175 8.4888 8.4888 k = 0.4000-0.0864 0.2154 ( 7700 PWs) bands (ev): -19.5751 -19.5751 -19.5351 -19.5351 -17.5046 -17.5046 -17.4735 -17.4735 -16.4954 -16.4954 -16.4076 -16.4076 -13.8358 -13.8358 -13.7406 -13.7406 -10.8614 -10.8614 -10.8003 -10.8003 -10.1874 -10.1874 -10.1563 -10.1563 -7.9041 -7.9041 -7.8261 -7.8261 -7.1239 -7.1239 -6.9229 -6.9229 -6.0911 -6.0911 -6.0522 -6.0522 -5.6762 -5.6762 -5.4716 -5.4716 -5.0106 -5.0106 -4.6934 -4.6934 -4.3270 -4.3270 -4.2514 -4.2514 -2.3791 -2.3791 -2.2145 -2.2145 -1.7046 -1.7046 -1.4614 -1.4614 -1.3685 -1.3685 -1.3611 -1.3611 -0.7635 -0.7635 -0.7099 -0.7099 0.5177 0.5177 0.8810 0.8810 1.1147 1.1147 1.3252 1.3252 3.7800 3.7800 3.8828 3.8828 5.2050 5.2050 5.5628 5.5628 7.9458 7.9458 8.3072 8.3072 8.5023 8.5023 k = 0.3857-0.0833 0.2077 ( 7700 PWs) bands (ev): -19.5782 -19.5782 -19.5329 -19.5329 -17.5043 -17.5043 -17.4736 -17.4736 -16.4943 -16.4943 -16.4070 -16.4070 -13.8351 -13.8351 -13.7413 -13.7413 -10.8631 -10.8631 -10.7995 -10.7995 -10.1884 -10.1884 -10.1533 -10.1533 -7.9041 -7.9041 -7.8275 -7.8275 -7.1247 -7.1247 -6.9243 -6.9243 -6.0907 -6.0907 -6.0526 -6.0526 -5.6845 -5.6845 -5.4668 -5.4668 -5.0253 -5.0253 -4.6690 -4.6690 -4.3248 -4.3248 -4.2479 -4.2479 -2.3781 -2.3781 -2.2170 -2.2170 -1.7204 -1.7204 -1.4645 -1.4645 -1.3703 -1.3703 -1.3567 -1.3567 -0.7647 -0.7647 -0.7104 -0.7104 0.5209 0.5209 0.8821 0.8821 1.1167 1.1167 1.3231 1.3231 3.7797 3.7797 3.8885 3.8885 5.2002 5.2002 5.5644 5.5644 7.9132 7.9132 8.2978 8.2978 8.5164 8.5164 k = 0.3714-0.0802 0.2000 ( 7699 PWs) bands (ev): -19.5814 -19.5814 -19.5307 -19.5307 -17.5040 -17.5040 -17.4738 -17.4738 -16.4932 -16.4932 -16.4062 -16.4062 -13.8343 -13.8343 -13.7422 -13.7422 -10.8650 -10.8650 -10.7987 -10.7987 -10.1894 -10.1894 -10.1501 -10.1501 -7.9040 -7.9040 -7.8290 -7.8290 -7.1256 -7.1256 -6.9258 -6.9258 -6.0902 -6.0902 -6.0530 -6.0530 -5.6934 -5.6934 -5.4620 -5.4620 -5.0390 -5.0390 -4.6444 -4.6444 -4.3228 -4.3228 -4.2436 -4.2436 -2.3771 -2.3771 -2.2199 -2.2199 -1.7368 -1.7368 -1.4681 -1.4681 -1.3742 -1.3742 -1.3509 -1.3509 -0.7660 -0.7660 -0.7109 -0.7109 0.5245 0.5245 0.8834 0.8834 1.1189 1.1189 1.3207 1.3207 3.7792 3.7792 3.8949 3.8949 5.1952 5.1952 5.5660 5.5660 7.8765 7.8765 8.2893 8.2893 8.5310 8.5310 k = 0.3571-0.0772 0.1923 ( 7701 PWs) bands (ev): -19.5846 -19.5846 -19.5286 -19.5286 -17.5036 -17.5036 -17.4739 -17.4739 -16.4919 -16.4919 -16.4054 -16.4054 -13.8335 -13.8335 -13.7432 -13.7432 -10.8671 -10.8671 -10.7979 -10.7979 -10.1902 -10.1902 -10.1469 -10.1469 -7.9039 -7.9039 -7.8306 -7.8306 -7.1266 -7.1266 -6.9275 -6.9275 -6.0897 -6.0897 -6.0535 -6.0535 -5.7026 -5.7026 -5.4573 -5.4573 -5.0517 -5.0517 -4.6197 -4.6197 -4.3211 -4.3211 -4.2385 -4.2385 -2.3762 -2.3762 -2.2229 -2.2229 -1.7536 -1.7536 -1.4721 -1.4721 -1.3791 -1.3791 -1.3450 -1.3450 -0.7674 -0.7674 -0.7115 -0.7115 0.5284 0.5284 0.8849 0.8849 1.1212 1.1212 1.3182 1.3182 3.7786 3.7786 3.9020 3.9020 5.1901 5.1901 5.5675 5.5675 7.8363 7.8363 8.2817 8.2817 8.5463 8.5463 k = 0.3429-0.0741 0.1846 ( 7705 PWs) bands (ev): -19.5878 -19.5878 -19.5266 -19.5266 -17.5033 -17.5033 -17.4740 -17.4740 -16.4905 -16.4905 -16.4045 -16.4045 -13.8325 -13.8325 -13.7443 -13.7443 -10.8692 -10.8692 -10.7970 -10.7970 -10.1908 -10.1908 -10.1436 -10.1436 -7.9038 -7.9038 -7.8324 -7.8324 -7.1277 -7.1277 -6.9292 -6.9292 -6.0892 -6.0892 -6.0541 -6.0541 -5.7121 -5.7121 -5.4528 -5.4528 -5.0634 -5.0634 -4.5950 -4.5950 -4.3197 -4.3197 -4.2326 -4.2326 -2.3753 -2.3753 -2.2261 -2.2261 -1.7706 -1.7706 -1.4765 -1.4765 -1.3846 -1.3846 -1.3392 -1.3392 -0.7689 -0.7689 -0.7121 -0.7121 0.5327 0.5327 0.8864 0.8864 1.1236 1.1236 1.3156 1.3156 3.7779 3.7779 3.9096 3.9096 5.1848 5.1848 5.5689 5.5689 7.7931 7.7931 8.2752 8.2752 8.5622 8.5622 k = 0.3286-0.0710 0.1769 ( 7708 PWs) bands (ev): -19.5909 -19.5909 -19.5247 -19.5247 -17.5029 -17.5029 -17.4742 -17.4742 -16.4891 -16.4891 -16.4036 -16.4036 -13.8315 -13.8315 -13.7454 -13.7454 -10.8715 -10.8715 -10.7962 -10.7962 -10.1913 -10.1913 -10.1404 -10.1404 -7.9036 -7.9036 -7.8343 -7.8343 -7.1288 -7.1288 -6.9311 -6.9311 -6.0886 -6.0886 -6.0546 -6.0546 -5.7218 -5.7218 -5.4485 -5.4485 -5.0739 -5.0739 -4.5704 -4.5704 -4.3188 -4.3188 -4.2259 -4.2259 -2.3746 -2.3746 -2.2295 -2.2295 -1.7875 -1.7875 -1.4815 -1.4815 -1.3908 -1.3908 -1.3338 -1.3338 -0.7705 -0.7705 -0.7128 -0.7128 0.5374 0.5374 0.8881 0.8881 1.1261 1.1261 1.3128 1.3128 3.7770 3.7770 3.9176 3.9176 5.1796 5.1796 5.5701 5.5701 7.7475 7.7475 8.2696 8.2696 8.5788 8.5788 k = 0.3143-0.0679 0.1692 ( 7706 PWs) bands (ev): -19.5940 -19.5940 -19.5229 -19.5229 -17.5024 -17.5024 -17.4744 -17.4744 -16.4875 -16.4875 -16.4026 -16.4026 -13.8303 -13.8303 -13.7466 -13.7466 -10.8739 -10.8739 -10.7953 -10.7953 -10.1917 -10.1917 -10.1370 -10.1370 -7.9034 -7.9034 -7.8364 -7.8364 -7.1301 -7.1301 -6.9330 -6.9330 -6.0880 -6.0880 -6.0552 -6.0552 -5.7317 -5.7317 -5.4444 -5.4444 -5.0834 -5.0834 -4.5460 -4.5460 -4.3182 -4.3182 -4.2185 -4.2185 -2.3740 -2.3740 -2.2329 -2.2329 -1.8041 -1.8041 -1.4869 -1.4869 -1.3975 -1.3975 -1.3286 -1.3286 -0.7722 -0.7722 -0.7134 -0.7134 0.5424 0.5424 0.8899 0.8899 1.1287 1.1287 1.3099 1.3099 3.7760 3.7760 3.9261 3.9261 5.1746 5.1746 5.5712 5.5712 7.7000 7.7000 8.2651 8.2651 8.5961 8.5961 k = 0.3000-0.0648 0.1615 ( 7712 PWs) bands (ev): -19.5970 -19.5970 -19.5212 -19.5212 -17.5020 -17.5020 -17.4746 -17.4746 -16.4859 -16.4859 -16.4016 -16.4016 -13.8291 -13.8291 -13.7480 -13.7480 -10.8763 -10.8763 -10.7944 -10.7944 -10.1919 -10.1919 -10.1337 -10.1337 -7.9032 -7.9032 -7.8385 -7.8385 -7.1314 -7.1314 -6.9350 -6.9350 -6.0874 -6.0874 -6.0558 -6.0558 -5.7415 -5.7415 -5.4406 -5.4406 -5.0918 -5.0918 -4.5218 -4.5218 -4.3181 -4.3181 -4.2105 -4.2105 -2.3737 -2.3737 -2.2364 -2.2364 -1.8204 -1.8204 -1.4928 -1.4928 -1.4046 -1.4046 -1.3238 -1.3238 -0.7739 -0.7739 -0.7140 -0.7140 0.5476 0.5476 0.8918 0.8918 1.1314 1.1314 1.3070 1.3070 3.7748 3.7748 3.9350 3.9350 5.1696 5.1696 5.5720 5.5720 7.6512 7.6512 8.2616 8.2616 8.6139 8.6139 k = 0.2857-0.0617 0.1538 ( 7711 PWs) bands (ev): -19.6000 -19.6000 -19.5195 -19.5195 -17.5015 -17.5015 -17.4748 -17.4748 -16.4843 -16.4843 -16.4006 -16.4006 -13.8278 -13.8278 -13.7494 -13.7494 -10.8788 -10.8788 -10.7936 -10.7936 -10.1920 -10.1920 -10.1304 -10.1304 -7.9030 -7.9030 -7.8407 -7.8407 -7.1327 -7.1327 -6.9370 -6.9370 -6.0867 -6.0867 -6.0564 -6.0564 -5.7514 -5.7514 -5.4371 -5.4371 -5.0992 -5.0992 -4.4979 -4.4979 -4.3182 -4.3182 -4.2021 -4.2021 -2.3737 -2.3737 -2.2399 -2.2399 -1.8360 -1.8360 -1.4992 -1.4992 -1.4121 -1.4121 -1.3193 -1.3193 -0.7757 -0.7757 -0.7146 -0.7146 0.5531 0.5531 0.8938 0.8938 1.1341 1.1341 1.3040 1.3040 3.7735 3.7735 3.9440 3.9440 5.1650 5.1650 5.5727 5.5727 7.6016 7.6016 8.2591 8.2591 8.6323 8.6323 k = 0.2714-0.0586 0.1462 ( 7712 PWs) bands (ev): -19.6030 -19.6030 -19.5180 -19.5180 -17.5010 -17.5010 -17.4750 -17.4750 -16.4826 -16.4826 -16.3996 -16.3996 -13.8264 -13.8264 -13.7508 -13.7508 -10.8813 -10.8813 -10.7928 -10.7928 -10.1920 -10.1920 -10.1272 -10.1272 -7.9027 -7.9027 -7.8430 -7.8430 -7.1341 -7.1341 -6.9390 -6.9390 -6.0860 -6.0860 -6.0570 -6.0570 -5.7612 -5.7612 -5.4338 -5.4338 -5.1056 -5.1056 -4.4744 -4.4744 -4.3186 -4.3186 -4.1934 -4.1934 -2.3741 -2.3741 -2.2433 -2.2433 -1.8510 -1.8510 -1.5063 -1.5063 -1.4198 -1.4198 -1.3152 -1.3152 -0.7775 -0.7775 -0.7153 -0.7153 0.5589 0.5589 0.8958 0.8958 1.1367 1.1367 1.3010 1.3010 3.7721 3.7721 3.9533 3.9533 5.1606 5.1606 5.5732 5.5732 7.5517 7.5517 8.2576 8.2576 8.6511 8.6511 k = 0.2571-0.0555 0.1385 ( 7717 PWs) bands (ev): -19.6058 -19.6058 -19.5166 -19.5166 -17.5005 -17.5005 -17.4752 -17.4752 -16.4809 -16.4809 -16.3985 -16.3985 -13.8250 -13.8250 -13.7524 -13.7524 -10.8838 -10.8838 -10.7920 -10.7920 -10.1919 -10.1919 -10.1240 -10.1240 -7.9024 -7.9024 -7.8453 -7.8453 -7.1355 -7.1355 -6.9410 -6.9410 -6.0853 -6.0853 -6.0576 -6.0576 -5.7709 -5.7709 -5.4308 -5.4308 -5.1111 -5.1111 -4.4512 -4.4512 -4.3193 -4.3193 -4.1845 -4.1845 -2.3748 -2.3748 -2.2466 -2.2466 -1.8651 -1.8651 -1.5140 -1.5140 -1.4275 -1.4275 -1.3114 -1.3114 -0.7794 -0.7794 -0.7159 -0.7159 0.5648 0.5648 0.8979 0.8979 1.1394 1.1394 1.2979 1.2979 3.7705 3.7705 3.9626 3.9626 5.1566 5.1566 5.5735 5.5735 7.5021 7.5021 8.2571 8.2571 8.6699 8.6699 k = 0.2429-0.0525 0.1308 ( 7715 PWs) bands (ev): -19.6086 -19.6086 -19.5153 -19.5153 -17.5000 -17.5000 -17.4755 -17.4755 -16.4792 -16.4792 -16.3974 -16.3974 -13.8234 -13.8234 -13.7540 -13.7540 -10.8864 -10.8864 -10.7912 -10.7912 -10.1917 -10.1917 -10.1208 -10.1208 -7.9021 -7.9021 -7.8477 -7.8477 -7.1370 -7.1370 -6.9430 -6.9430 -6.0846 -6.0846 -6.0581 -6.0581 -5.7805 -5.7805 -5.4280 -5.4280 -5.1157 -5.1157 -4.4286 -4.4286 -4.3201 -4.3201 -4.1757 -4.1757 -2.3759 -2.3759 -2.2497 -2.2497 -1.8783 -1.8783 -1.5223 -1.5223 -1.4353 -1.4353 -1.3079 -1.3079 -0.7813 -0.7813 -0.7164 -0.7164 0.5708 0.5708 0.9000 0.9000 1.1421 1.1421 1.2949 1.2949 3.7689 3.7689 3.9719 3.9719 5.1530 5.1530 5.5737 5.5737 7.4530 7.4530 8.2577 8.2577 8.6882 8.6882 k = 0.2286-0.0494 0.1231 ( 7714 PWs) bands (ev): -19.6112 -19.6112 -19.5140 -19.5140 -17.4994 -17.4994 -17.4757 -17.4757 -16.4775 -16.4775 -16.3964 -16.3964 -13.8218 -13.8218 -13.7556 -13.7556 -10.8889 -10.8889 -10.7905 -10.7905 -10.1915 -10.1915 -10.1178 -10.1178 -7.9016 -7.9016 -7.8502 -7.8502 -7.1384 -7.1384 -6.9450 -6.9450 -6.0839 -6.0839 -6.0587 -6.0587 -5.7898 -5.7898 -5.4255 -5.4255 -5.1196 -5.1196 -4.4065 -4.4065 -4.3211 -4.3211 -4.1669 -4.1669 -2.3774 -2.3774 -2.2526 -2.2526 -1.8905 -1.8905 -1.5314 -1.5314 -1.4428 -1.4428 -1.3046 -1.3046 -0.7832 -0.7832 -0.7170 -0.7170 0.5770 0.5770 0.9022 0.9022 1.1447 1.1447 1.2919 1.2919 3.7672 3.7672 3.9811 3.9811 5.1497 5.1497 5.5737 5.5737 7.4049 7.4049 8.2593 8.2593 8.7049 8.7049 k = 0.2143-0.0463 0.1154 ( 7713 PWs) bands (ev): -19.6138 -19.6138 -19.5129 -19.5129 -17.4989 -17.4989 -17.4760 -17.4760 -16.4759 -16.4759 -16.3953 -16.3953 -13.8202 -13.8202 -13.7574 -13.7574 -10.8913 -10.8913 -10.7898 -10.7898 -10.1912 -10.1912 -10.1148 -10.1148 -7.9012 -7.9012 -7.8526 -7.8526 -7.1399 -7.1399 -6.9469 -6.9469 -6.0832 -6.0832 -6.0592 -6.0592 -5.7989 -5.7989 -5.4230 -5.4230 -5.1228 -5.1228 -4.3849 -4.3849 -4.3223 -4.3223 -4.1585 -4.1585 -2.3794 -2.3794 -2.2553 -2.2553 -1.9016 -1.9016 -1.5411 -1.5411 -1.4502 -1.4502 -1.3015 -1.3015 -0.7852 -0.7852 -0.7174 -0.7174 0.5831 0.5831 0.9044 0.9044 1.1473 1.1473 1.2889 1.2889 3.7654 3.7654 3.9901 3.9901 5.1469 5.1469 5.5737 5.5737 7.3581 7.3581 8.2619 8.2619 8.7177 8.7177 k = 0.2000-0.0432 0.1077 ( 7711 PWs) bands (ev): -19.6162 -19.6162 -19.5118 -19.5118 -17.4983 -17.4983 -17.4763 -17.4763 -16.4742 -16.4742 -16.3943 -16.3943 -13.8184 -13.8184 -13.7592 -13.7592 -10.8938 -10.8938 -10.7891 -10.7891 -10.1908 -10.1908 -10.1119 -10.1119 -7.9007 -7.9007 -7.8551 -7.8551 -7.1414 -7.1414 -6.9487 -6.9487 -6.0824 -6.0824 -6.0597 -6.0597 -5.8077 -5.8077 -5.4208 -5.4208 -5.1255 -5.1255 -4.3640 -4.3640 -4.3235 -4.3235 -4.1504 -4.1504 -2.3816 -2.3816 -2.2578 -2.2578 -1.9117 -1.9117 -1.5513 -1.5513 -1.4572 -1.4572 -1.2987 -1.2987 -0.7871 -0.7871 -0.7179 -0.7179 0.5893 0.5893 0.9065 0.9065 1.1499 1.1499 1.2859 1.2859 3.7636 3.7636 3.9988 3.9988 5.1444 5.1444 5.5735 5.5735 7.3130 7.3130 8.2655 8.2655 8.7233 8.7233 k = 0.1857-0.0401 0.1000 ( 7716 PWs) bands (ev): -19.6185 -19.6185 -19.5108 -19.5108 -17.4978 -17.4978 -17.4766 -17.4766 -16.4726 -16.4726 -16.3933 -16.3933 -13.8167 -13.8167 -13.7610 -13.7610 -10.8961 -10.8961 -10.7885 -10.7885 -10.1903 -10.1903 -10.1091 -10.1091 -7.9001 -7.9001 -7.8576 -7.8576 -7.1428 -7.1428 -6.9504 -6.9504 -6.0817 -6.0817 -6.0602 -6.0602 -5.8162 -5.8162 -5.4187 -5.4187 -5.1276 -5.1276 -4.3438 -4.3438 -4.3247 -4.3247 -4.1428 -4.1428 -2.3842 -2.3842 -2.2600 -2.2600 -1.9206 -1.9206 -1.5620 -1.5620 -1.4639 -1.4639 -1.2960 -1.2960 -0.7890 -0.7890 -0.7184 -0.7184 0.5953 0.5953 0.9087 0.9087 1.1524 1.1524 1.2829 1.2829 3.7618 3.7618 4.0072 4.0072 5.1423 5.1423 5.5734 5.5734 7.2697 7.2697 8.2700 8.2700 8.7208 8.7208 k = 0.1714-0.0370 0.0923 ( 7707 PWs) bands (ev): -19.6207 -19.6207 -19.5099 -19.5099 -17.4972 -17.4972 -17.4769 -17.4769 -16.4711 -16.4711 -16.3924 -16.3924 -13.8148 -13.8148 -13.7629 -13.7629 -10.8984 -10.8984 -10.7879 -10.7879 -10.1899 -10.1899 -10.1065 -10.1065 -7.8995 -7.8995 -7.8601 -7.8601 -7.1442 -7.1442 -6.9521 -6.9521 -6.0810 -6.0810 -6.0607 -6.0607 -5.8242 -5.8242 -5.4166 -5.4166 -5.1293 -5.1293 -4.3264 -4.3264 -4.3239 -4.3239 -4.1359 -4.1359 -2.3871 -2.3871 -2.2620 -2.2620 -1.9284 -1.9284 -1.5730 -1.5730 -1.4702 -1.4702 -1.2934 -1.2934 -0.7909 -0.7909 -0.7187 -0.7187 0.6013 0.6013 0.9107 0.9107 1.1549 1.1549 1.2801 1.2801 3.7600 3.7600 4.0152 4.0152 5.1406 5.1406 5.5732 5.5732 7.2287 7.2287 8.2754 8.2754 8.7131 8.7131 k = 0.1571-0.0339 0.0846 ( 7708 PWs) bands (ev): -19.6227 -19.6227 -19.5091 -19.5091 -17.4967 -17.4967 -17.4772 -17.4772 -16.4696 -16.4696 -16.3915 -16.3915 -13.8129 -13.8129 -13.7648 -13.7648 -10.9005 -10.9005 -10.7874 -10.7874 -10.1894 -10.1894 -10.1040 -10.1040 -7.8987 -7.8987 -7.8625 -7.8625 -7.1455 -7.1455 -6.9536 -6.9536 -6.0803 -6.0803 -6.0611 -6.0611 -5.8318 -5.8318 -5.4147 -5.4147 -5.1306 -5.1306 -4.3273 -4.3273 -4.3055 -4.3055 -4.1297 -4.1297 -2.3901 -2.3901 -2.2637 -2.2637 -1.9352 -1.9352 -1.5840 -1.5840 -1.4762 -1.4762 -1.2910 -1.2910 -0.7927 -0.7927 -0.7191 -0.7191 0.6070 0.6070 0.9127 0.9127 1.1573 1.1573 1.2772 1.2772 3.7582 3.7582 4.0227 4.0227 5.1392 5.1392 5.5730 5.5730 7.1901 7.1901 8.2816 8.2816 8.7029 8.7029 k = 0.1429-0.0309 0.0769 ( 7714 PWs) bands (ev): -19.6246 -19.6246 -19.5084 -19.5084 -17.4961 -17.4961 -17.4775 -17.4775 -16.4682 -16.4682 -16.3906 -16.3906 -13.8110 -13.8110 -13.7668 -13.7668 -10.9026 -10.9026 -10.7869 -10.7869 -10.1889 -10.1889 -10.1017 -10.1017 -7.8980 -7.8980 -7.8650 -7.8650 -7.1468 -7.1468 -6.9551 -6.9551 -6.0797 -6.0797 -6.0615 -6.0615 -5.8390 -5.8390 -5.4128 -5.4128 -5.1317 -5.1317 -4.3286 -4.3286 -4.2876 -4.2876 -4.1244 -4.1244 -2.3932 -2.3932 -2.2652 -2.2652 -1.9410 -1.9410 -1.5950 -1.5950 -1.4817 -1.4817 -1.2888 -1.2888 -0.7945 -0.7945 -0.7194 -0.7194 0.6124 0.6124 0.9146 0.9146 1.1596 1.1596 1.2745 1.2745 3.7565 3.7565 4.0296 4.0296 5.1381 5.1381 5.5728 5.5728 7.1542 7.1542 8.2884 8.2884 8.6917 8.6917 k = 0.1286-0.0278 0.0692 ( 7714 PWs) bands (ev): -19.6264 -19.6264 -19.5077 -19.5077 -17.4956 -17.4956 -17.4778 -17.4778 -16.4670 -16.4670 -16.3898 -16.3898 -13.8090 -13.8090 -13.7688 -13.7688 -10.9045 -10.9045 -10.7865 -10.7865 -10.1885 -10.1885 -10.0996 -10.0996 -7.8971 -7.8971 -7.8673 -7.8673 -7.1480 -7.1480 -6.9564 -6.9564 -6.0791 -6.0791 -6.0618 -6.0618 -5.8456 -5.8456 -5.4111 -5.4111 -5.1325 -5.1325 -4.3298 -4.3298 -4.2706 -4.2706 -4.1199 -4.1199 -2.3963 -2.3963 -2.2664 -2.2664 -1.9459 -1.9459 -1.6057 -1.6057 -1.4868 -1.4868 -1.2867 -1.2867 -0.7962 -0.7962 -0.7197 -0.7197 0.6176 0.6176 0.9164 0.9164 1.1619 1.1619 1.2718 1.2718 3.7549 3.7549 4.0360 4.0360 5.1373 5.1373 5.5726 5.5726 7.1211 7.1211 8.2957 8.2957 8.6802 8.6802 k = 0.1143-0.0247 0.0615 ( 7716 PWs) bands (ev): -19.6279 -19.6279 -19.5071 -19.5071 -17.4951 -17.4951 -17.4781 -17.4781 -16.4658 -16.4658 -16.3891 -16.3891 -13.8070 -13.8070 -13.7708 -13.7708 -10.9062 -10.9062 -10.7861 -10.7861 -10.1880 -10.1880 -10.0977 -10.0977 -7.8962 -7.8962 -7.8697 -7.8697 -7.1491 -7.1491 -6.9576 -6.9576 -6.0785 -6.0785 -6.0621 -6.0621 -5.8516 -5.8516 -5.4095 -5.4095 -5.1332 -5.1332 -4.3309 -4.3309 -4.2546 -4.2546 -4.1164 -4.1164 -2.3994 -2.3994 -2.2674 -2.2674 -1.9500 -1.9500 -1.6160 -1.6160 -1.4915 -1.4915 -1.2848 -1.2848 -0.7977 -0.7977 -0.7200 -0.7200 0.6224 0.6224 0.9180 0.9180 1.1640 1.1640 1.2693 1.2693 3.7534 3.7534 4.0418 4.0418 5.1367 5.1367 5.5725 5.5725 7.0910 7.0910 8.3034 8.3034 8.6688 8.6688 k = 0.1000-0.0216 0.0538 ( 7723 PWs) bands (ev): -19.6293 -19.6293 -19.5066 -19.5066 -17.4947 -17.4947 -17.4784 -17.4784 -16.4647 -16.4647 -16.3885 -16.3885 -13.8050 -13.8050 -13.7728 -13.7728 -10.9078 -10.9078 -10.7858 -10.7858 -10.1876 -10.1876 -10.0960 -10.0960 -7.8952 -7.8952 -7.8720 -7.8720 -7.1501 -7.1501 -6.9586 -6.9586 -6.0780 -6.0780 -6.0623 -6.0623 -5.8571 -5.8571 -5.4079 -5.4079 -5.1337 -5.1337 -4.3320 -4.3320 -4.2397 -4.2397 -4.1138 -4.1138 -2.4023 -2.4023 -2.2683 -2.2683 -1.9532 -1.9532 -1.6256 -1.6256 -1.4958 -1.4958 -1.2831 -1.2831 -0.7992 -0.7992 -0.7202 -0.7202 0.6268 0.6268 0.9195 0.9195 1.1661 1.1661 1.2669 1.2669 3.7520 3.7520 4.0470 4.0470 5.1364 5.1364 5.5724 5.5724 7.0640 7.0640 8.3112 8.3112 8.6577 8.6577 k = 0.0857-0.0185 0.0462 ( 7722 PWs) bands (ev): -19.6305 -19.6305 -19.5062 -19.5062 -17.4943 -17.4943 -17.4786 -17.4786 -16.4638 -16.4638 -16.3879 -16.3879 -13.8029 -13.8029 -13.7749 -13.7749 -10.9091 -10.9091 -10.7855 -10.7855 -10.1872 -10.1872 -10.0944 -10.0944 -7.8941 -7.8941 -7.8742 -7.8742 -7.1511 -7.1511 -6.9595 -6.9595 -6.0776 -6.0776 -6.0625 -6.0625 -5.8619 -5.8619 -5.4066 -5.4066 -5.1340 -5.1340 -4.3329 -4.3329 -4.2260 -4.2260 -4.1121 -4.1121 -2.4049 -2.4049 -2.2690 -2.2690 -1.9559 -1.9559 -1.6343 -1.6343 -1.4996 -1.4996 -1.2815 -1.2815 -0.8005 -0.8005 -0.7204 -0.7204 0.6307 0.6307 0.9208 0.9208 1.1679 1.1679 1.2648 1.2648 3.7508 3.7508 4.0515 4.0515 5.1361 5.1361 5.5724 5.5724 7.0404 7.0404 8.3190 8.3190 8.6473 8.6473 k = 0.0714-0.0154 0.0385 ( 7722 PWs) bands (ev): -19.6316 -19.6316 -19.5058 -19.5058 -17.4939 -17.4939 -17.4789 -17.4789 -16.4630 -16.4630 -16.3874 -16.3874 -13.8009 -13.8009 -13.7769 -13.7769 -10.9103 -10.9103 -10.7852 -10.7852 -10.1869 -10.1869 -10.0931 -10.0931 -7.8929 -7.8929 -7.8763 -7.8763 -7.1518 -7.1518 -6.9603 -6.9603 -6.0772 -6.0772 -6.0627 -6.0627 -5.8660 -5.8660 -5.4053 -5.4053 -5.1343 -5.1343 -4.3337 -4.3337 -4.2136 -4.2136 -4.1114 -4.1114 -2.4073 -2.4073 -2.2695 -2.2695 -1.9579 -1.9579 -1.6420 -1.6420 -1.5029 -1.5029 -1.2801 -1.2801 -0.8016 -0.8016 -0.7206 -0.7206 0.6341 0.6341 0.9219 0.9219 1.1696 1.1696 1.2628 1.2628 3.7497 3.7497 4.0553 4.0553 5.1360 5.1360 5.5724 5.5724 7.0202 7.0202 8.3263 8.3263 8.6377 8.6377 k = 0.0571-0.0123 0.0308 ( 7722 PWs) bands (ev): -19.6324 -19.6324 -19.5055 -19.5055 -17.4936 -17.4936 -17.4791 -17.4791 -16.4623 -16.4623 -16.3870 -16.3870 -13.7989 -13.7989 -13.7789 -13.7789 -10.9113 -10.9113 -10.7850 -10.7850 -10.1866 -10.1866 -10.0921 -10.0921 -7.8917 -7.8917 -7.8783 -7.8783 -7.1525 -7.1525 -6.9609 -6.9609 -6.0769 -6.0769 -6.0628 -6.0628 -5.8694 -5.8694 -5.4043 -5.4043 -5.1346 -5.1346 -4.3344 -4.3344 -4.2027 -4.2027 -4.1113 -4.1113 -2.4093 -2.4093 -2.2699 -2.2699 -1.9595 -1.9595 -1.6485 -1.6485 -1.5056 -1.5056 -1.2790 -1.2790 -0.8025 -0.8025 -0.7207 -0.7207 0.6369 0.6369 0.9229 0.9229 1.1711 1.1711 1.2612 1.2612 3.7488 3.7488 4.0584 4.0584 5.1359 5.1359 5.5724 5.5724 7.0035 7.0035 8.3330 8.3330 8.6294 8.6294 k = 0.0429-0.0093 0.0231 ( 7721 PWs) bands (ev): -19.6331 -19.6331 -19.5053 -19.5053 -17.4933 -17.4933 -17.4792 -17.4792 -16.4618 -16.4618 -16.3867 -16.3867 -13.7970 -13.7970 -13.7808 -13.7808 -10.9121 -10.9121 -10.7848 -10.7848 -10.1864 -10.1864 -10.0912 -10.0912 -7.8903 -7.8903 -7.8803 -7.8803 -7.1530 -7.1530 -6.9614 -6.9614 -6.0766 -6.0766 -6.0629 -6.0629 -5.8721 -5.8721 -5.4035 -5.4035 -5.1347 -5.1347 -4.3350 -4.3350 -4.1936 -4.1936 -4.1119 -4.1119 -2.4109 -2.4109 -2.2701 -2.2701 -1.9606 -1.9606 -1.6538 -1.6538 -1.5077 -1.5077 -1.2781 -1.2781 -0.8033 -0.8033 -0.7208 -0.7208 0.6391 0.6391 0.9236 0.9236 1.1723 1.1723 1.2598 1.2598 3.7481 3.7481 4.0609 4.0609 5.1359 5.1359 5.5724 5.5724 6.9905 6.9905 8.3386 8.3386 8.6224 8.6224 k = 0.0286-0.0062 0.0154 ( 7721 PWs) bands (ev): -19.6336 -19.6336 -19.5051 -19.5051 -17.4931 -17.4931 -17.4794 -17.4794 -16.4614 -16.4614 -16.3864 -16.3864 -13.7954 -13.7954 -13.7825 -13.7825 -10.9127 -10.9127 -10.7847 -10.7847 -10.1862 -10.1862 -10.0906 -10.0906 -7.8889 -7.8889 -7.8822 -7.8822 -7.1534 -7.1534 -6.9618 -6.9618 -6.0764 -6.0764 -6.0629 -6.0629 -5.8740 -5.8740 -5.4029 -5.4029 -5.1348 -5.1348 -4.3354 -4.3354 -4.1867 -4.1867 -4.1127 -4.1127 -2.4121 -2.4121 -2.2703 -2.2703 -1.9613 -1.9613 -1.6576 -1.6576 -1.5093 -1.5093 -1.2774 -1.2774 -0.8038 -0.8038 -0.7209 -0.7209 0.6407 0.6407 0.9242 0.9242 1.1732 1.1732 1.2588 1.2588 3.7476 3.7476 4.0626 4.0626 5.1359 5.1359 5.5725 5.5725 6.9811 6.9811 8.3430 8.3430 8.6172 8.6172 k = 0.0143-0.0031 0.0077 ( 7721 PWs) bands (ev): -19.6339 -19.6339 -19.5050 -19.5050 -17.4930 -17.4930 -17.4794 -17.4794 -16.4612 -16.4612 -16.3863 -16.3863 -13.7941 -13.7941 -13.7838 -13.7838 -10.9130 -10.9130 -10.7846 -10.7846 -10.1861 -10.1861 -10.0902 -10.0902 -7.8874 -7.8874 -7.8840 -7.8840 -7.1536 -7.1536 -6.9620 -6.9620 -6.0763 -6.0763 -6.0630 -6.0630 -5.8752 -5.8752 -5.4025 -5.4025 -5.1349 -5.1349 -4.3356 -4.3356 -4.1823 -4.1823 -4.1134 -4.1134 -2.4128 -2.4128 -2.2704 -2.2704 -1.9618 -1.9618 -1.6599 -1.6599 -1.5102 -1.5102 -1.2770 -1.2770 -0.8042 -0.8042 -0.7210 -0.7210 0.6417 0.6417 0.9245 0.9245 1.1737 1.1737 1.2582 1.2582 3.7473 3.7473 4.0637 4.0637 5.1360 5.1360 5.5725 5.5725 6.9755 6.9755 8.3457 8.3457 8.6140 8.6140 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 k = 0.0000 0.0127 0.0104 ( 7715 PWs) bands (ev): -19.6339 -19.6339 -19.5050 -19.5050 -17.4933 -17.4933 -17.4796 -17.4796 -16.4610 -16.4610 -16.3862 -16.3862 -13.7942 -13.7942 -13.7832 -13.7832 -10.9128 -10.9128 -10.7848 -10.7848 -10.1858 -10.1858 -10.0902 -10.0902 -7.8920 -7.8920 -7.8798 -7.8798 -7.1541 -7.1541 -6.9629 -6.9629 -6.0773 -6.0773 -6.0620 -6.0620 -5.8744 -5.8744 -5.4028 -5.4028 -5.1343 -5.1343 -4.3353 -4.3353 -4.1816 -4.1816 -4.1141 -4.1141 -2.4130 -2.4130 -2.2703 -2.2703 -1.9620 -1.9620 -1.6603 -1.6603 -1.5102 -1.5102 -1.2764 -1.2764 -0.8047 -0.8047 -0.7217 -0.7217 0.6419 0.6419 0.9242 0.9242 1.1740 1.1740 1.2583 1.2583 3.7479 3.7479 4.0635 4.0635 5.1367 5.1367 5.5731 5.5731 6.9751 6.9751 8.3459 8.3459 8.6127 8.6127 k = 0.0000 0.0255 0.0208 ( 7717 PWs) bands (ev): -19.6335 -19.6335 -19.5050 -19.5050 -17.4942 -17.4942 -17.4800 -17.4800 -16.4607 -16.4607 -16.3861 -16.3861 -13.7957 -13.7957 -13.7805 -13.7805 -10.9119 -10.9119 -10.7853 -10.7853 -10.1851 -10.1851 -10.0906 -10.0906 -7.8985 -7.8985 -7.8742 -7.8742 -7.1555 -7.1555 -6.9652 -6.9652 -6.0797 -6.0797 -6.0598 -6.0598 -5.8707 -5.8707 -5.4040 -5.4040 -5.1324 -5.1324 -4.3341 -4.3341 -4.1841 -4.1841 -4.1154 -4.1154 -2.4130 -2.4130 -2.2700 -2.2700 -1.9624 -1.9624 -1.6592 -1.6592 -1.5090 -1.5090 -1.2749 -1.2749 -0.8060 -0.8060 -0.7238 -0.7238 0.6416 0.6416 0.9229 0.9229 1.1743 1.1743 1.2591 1.2591 3.7501 3.7501 4.0619 4.0619 5.1389 5.1389 5.5748 5.5748 6.9796 6.9796 8.3437 8.3437 8.6123 8.6123 k = 0.0000 0.0382 0.0312 ( 7717 PWs) bands (ev): -19.6328 -19.6328 -19.5051 -19.5051 -17.4957 -17.4957 -17.4807 -17.4807 -16.4602 -16.4602 -16.3860 -16.3860 -13.7972 -13.7972 -13.7769 -13.7769 -10.9104 -10.9104 -10.7861 -10.7861 -10.1839 -10.1839 -10.0911 -10.0911 -7.9051 -7.9051 -7.8692 -7.8692 -7.1579 -7.1579 -6.9690 -6.9690 -6.0828 -6.0828 -6.0571 -6.0571 -5.8648 -5.8648 -5.4060 -5.4060 -5.1294 -5.1294 -4.3321 -4.3321 -4.1882 -4.1882 -4.1175 -4.1175 -2.4130 -2.4130 -2.2695 -2.2695 -1.9630 -1.9630 -1.6574 -1.6574 -1.5070 -1.5070 -1.2725 -1.2725 -0.8082 -0.8082 -0.7272 -0.7272 0.6410 0.6410 0.9208 0.9208 1.1749 1.1749 1.2606 1.2606 3.7538 3.7538 4.0594 4.0594 5.1425 5.1425 5.5777 5.5777 6.9870 6.9870 8.3401 8.3401 8.6117 8.6117 k = 0.0000 0.0510 0.0416 ( 7708 PWs) bands (ev): -19.6319 -19.6319 -19.5052 -19.5052 -17.4978 -17.4978 -17.4818 -17.4818 -16.4595 -16.4595 -16.3857 -16.3857 -13.7984 -13.7984 -13.7728 -13.7728 -10.9084 -10.9084 -10.7873 -10.7873 -10.1822 -10.1822 -10.0919 -10.0919 -7.9118 -7.9118 -7.8647 -7.8647 -7.1612 -7.1612 -6.9742 -6.9742 -6.0860 -6.0860 -6.0543 -6.0543 -5.8565 -5.8565 -5.4086 -5.4086 -5.1251 -5.1251 -4.3293 -4.3293 -4.1939 -4.1939 -4.1203 -4.1203 -2.4129 -2.4129 -2.2688 -2.2688 -1.9638 -1.9638 -1.6551 -1.6551 -1.5042 -1.5042 -1.2693 -1.2693 -0.8114 -0.8114 -0.7318 -0.7318 0.6402 0.6402 0.9178 0.9178 1.1757 1.1757 1.2626 1.2626 3.7588 3.7588 4.0558 4.0558 5.1475 5.1475 5.5818 5.5818 6.9975 6.9975 8.3353 8.3353 8.6107 8.6107 k = 0.0000 0.0637 0.0521 ( 7712 PWs) bands (ev): -19.6307 -19.6307 -19.5053 -19.5053 -17.5003 -17.5003 -17.4831 -17.4831 -16.4587 -16.4587 -16.3854 -16.3854 -13.7992 -13.7992 -13.7683 -13.7683 -10.9058 -10.9058 -10.7887 -10.7887 -10.1802 -10.1802 -10.0928 -10.0928 -7.9185 -7.9185 -7.8608 -7.8608 -7.1654 -7.1654 -6.9807 -6.9807 -6.0892 -6.0892 -6.0515 -6.0515 -5.8463 -5.8463 -5.4119 -5.4119 -5.1197 -5.1197 -4.3259 -4.3259 -4.2010 -4.2010 -4.1239 -4.1239 -2.4129 -2.4129 -2.2680 -2.2680 -1.9648 -1.9648 -1.6523 -1.6523 -1.5004 -1.5004 -1.2652 -1.2652 -0.8157 -0.8157 -0.7374 -0.7374 0.6392 0.6392 0.9140 0.9140 1.1766 1.1766 1.2652 1.2652 3.7651 3.7651 4.0515 4.0515 5.1537 5.1537 5.5869 5.5869 7.0108 7.0108 8.3294 8.3294 8.6092 8.6092 k = 0.0000 0.0765 0.0625 ( 7706 PWs) bands (ev): -19.6293 -19.6293 -19.5055 -19.5055 -17.5033 -17.5033 -17.4848 -17.4848 -16.4577 -16.4577 -16.3851 -16.3851 -13.7996 -13.7996 -13.7635 -13.7635 -10.9026 -10.9026 -10.7904 -10.7904 -10.1778 -10.1778 -10.0938 -10.0938 -7.9250 -7.9250 -7.8575 -7.8575 -7.1707 -7.1707 -6.9884 -6.9884 -6.0923 -6.0923 -6.0488 -6.0488 -5.8341 -5.8341 -5.4157 -5.4157 -5.1133 -5.1133 -4.3218 -4.3218 -4.2096 -4.2096 -4.1283 -4.1283 -2.4128 -2.4128 -2.2673 -2.2673 -1.9657 -1.9657 -1.6494 -1.6494 -1.4957 -1.4957 -1.2604 -1.2604 -0.8210 -0.8210 -0.7438 -0.7438 0.6381 0.6381 0.9094 0.9094 1.1778 1.1778 1.2684 1.2684 3.7726 3.7726 4.0464 4.0464 5.1612 5.1612 5.5930 5.5930 7.0271 7.0271 8.3226 8.3226 8.6074 8.6074 k = 0.0000 0.0892 0.0729 ( 7713 PWs) bands (ev): -19.6276 -19.6276 -19.5056 -19.5056 -17.5067 -17.5067 -17.4869 -17.4869 -16.4565 -16.4565 -16.3847 -16.3847 -13.7996 -13.7996 -13.7584 -13.7584 -10.8990 -10.8990 -10.7922 -10.7922 -10.1752 -10.1752 -10.0950 -10.0950 -7.9314 -7.9314 -7.8550 -7.8550 -7.1769 -7.1769 -6.9972 -6.9972 -6.0952 -6.0952 -6.0463 -6.0463 -5.8202 -5.8202 -5.4198 -5.4198 -5.1060 -5.1060 -4.3173 -4.3173 -4.2193 -4.2193 -4.1332 -4.1332 -2.4128 -2.4128 -2.2666 -2.2666 -1.9666 -1.9666 -1.6464 -1.6464 -1.4899 -1.4899 -1.2551 -1.2551 -0.8275 -0.8275 -0.7507 -0.7507 0.6368 0.6368 0.9040 0.9040 1.1791 1.1791 1.2721 1.2721 3.7811 3.7811 4.0407 4.0407 5.1697 5.1697 5.6001 5.6001 7.0462 7.0462 8.3150 8.3150 8.6050 8.6050 k = 0.0000 0.1020 0.0833 ( 7709 PWs) bands (ev): -19.6257 -19.6257 -19.5059 -19.5059 -17.5105 -17.5105 -17.4893 -17.4893 -16.4552 -16.4552 -16.3842 -16.3842 -13.7991 -13.7991 -13.7531 -13.7531 -10.8949 -10.8949 -10.7942 -10.7942 -10.1725 -10.1725 -10.0963 -10.0963 -7.9374 -7.9374 -7.8533 -7.8533 -7.1841 -7.1841 -7.0069 -7.0069 -6.0978 -6.0978 -6.0440 -6.0440 -5.8048 -5.8048 -5.4241 -5.4241 -5.0977 -5.0977 -4.3127 -4.3127 -4.2299 -4.2299 -4.1387 -4.1387 -2.4127 -2.4127 -2.2661 -2.2661 -1.9674 -1.9674 -1.6435 -1.6435 -1.4830 -1.4830 -1.2493 -1.2493 -0.8353 -0.8353 -0.7578 -0.7578 0.6353 0.6353 0.8979 0.8979 1.1805 1.1805 1.2765 1.2765 3.7906 3.7906 4.0345 4.0345 5.1791 5.1791 5.6082 5.6082 7.0682 7.0682 8.3070 8.3070 8.6019 8.6019 k = 0.0000 0.1147 0.0937 ( 7709 PWs) bands (ev): -19.6236 -19.6236 -19.5061 -19.5061 -17.5146 -17.5146 -17.4920 -17.4920 -16.4537 -16.4537 -16.3837 -16.3837 -13.7981 -13.7981 -13.7477 -13.7477 -10.8903 -10.8903 -10.7963 -10.7963 -10.1696 -10.1696 -10.0975 -10.0975 -7.9430 -7.9430 -7.8523 -7.8523 -7.1923 -7.1923 -7.0173 -7.0173 -6.1001 -6.1001 -6.0419 -6.0419 -5.7880 -5.7880 -5.4286 -5.4286 -5.0886 -5.0886 -4.3085 -4.3085 -4.2410 -4.2410 -4.1445 -4.1445 -2.4127 -2.4127 -2.2659 -2.2659 -1.9678 -1.9678 -1.6409 -1.6409 -1.4749 -1.4749 -1.2433 -1.2433 -0.8443 -0.8443 -0.7650 -0.7650 0.6338 0.6338 0.8911 0.8911 1.1821 1.1821 1.2813 1.2813 3.8008 3.8008 4.0281 4.0281 5.1893 5.1893 5.6170 5.6170 7.0928 7.0928 8.2988 8.2988 8.5982 8.5982 k = 0.0000 0.1275 0.1041 ( 7713 PWs) bands (ev): -19.6213 -19.6213 -19.5064 -19.5064 -17.5190 -17.5190 -17.4951 -17.4951 -16.4521 -16.4521 -16.3832 -16.3832 -13.7967 -13.7967 -13.7421 -13.7421 -10.8853 -10.8853 -10.7985 -10.7985 -10.1669 -10.1669 -10.0987 -10.0987 -7.9482 -7.9482 -7.8521 -7.8521 -7.2016 -7.2016 -7.0282 -7.0282 -6.1021 -6.1021 -6.0401 -6.0401 -5.7701 -5.7701 -5.4329 -5.4329 -5.0787 -5.0787 -4.3059 -4.3059 -4.2514 -4.2514 -4.1506 -4.1506 -2.4127 -2.4127 -2.2660 -2.2660 -1.9679 -1.9679 -1.6388 -1.6388 -1.4659 -1.4659 -1.2371 -1.2371 -0.8545 -0.8545 -0.7719 -0.7719 0.6323 0.6323 0.8836 0.8836 1.1838 1.1838 1.2867 1.2867 3.8115 3.8115 4.0217 4.0217 5.2002 5.2002 5.6267 5.6267 7.1202 7.1202 8.2906 8.2906 8.5937 8.5937 k = 0.0000 0.1402 0.1145 ( 7713 PWs) bands (ev): -19.6189 -19.6189 -19.5067 -19.5067 -17.5236 -17.5236 -17.4984 -17.4984 -16.4505 -16.4505 -16.3826 -16.3826 -13.7949 -13.7949 -13.7365 -13.7365 -10.8800 -10.8800 -10.8006 -10.8006 -10.1642 -10.1642 -10.0998 -10.0998 -7.9529 -7.9529 -7.8527 -7.8527 -7.2118 -7.2118 -7.0396 -7.0396 -6.1038 -6.1038 -6.0387 -6.0387 -5.7512 -5.7512 -5.4371 -5.4371 -5.0681 -5.0681 -4.3070 -4.3070 -4.2591 -4.2591 -4.1566 -4.1566 -2.4128 -2.4128 -2.2666 -2.2666 -1.9674 -1.9674 -1.6373 -1.6373 -1.4558 -1.4558 -1.2310 -1.2310 -0.8655 -0.8655 -0.7787 -0.7787 0.6307 0.6307 0.8756 0.8756 1.1856 1.1856 1.2926 1.2926 3.8225 3.8225 4.0156 4.0156 5.2115 5.2115 5.6370 5.6370 7.1502 7.1502 8.2826 8.2826 8.5883 8.5883 k = 0.0000 0.1530 0.1249 ( 7713 PWs) bands (ev): -19.6162 -19.6162 -19.5071 -19.5071 -17.5284 -17.5284 -17.5020 -17.5020 -16.4487 -16.4487 -16.3820 -16.3820 -13.7926 -13.7926 -13.7309 -13.7309 -10.8744 -10.8744 -10.8027 -10.8027 -10.1618 -10.1618 -10.1007 -10.1007 -7.9571 -7.9571 -7.8541 -7.8541 -7.2229 -7.2229 -7.0511 -7.0511 -6.1052 -6.1052 -6.0375 -6.0375 -5.7316 -5.7316 -5.4409 -5.4409 -5.0569 -5.0569 -4.3139 -4.3139 -4.2622 -4.2622 -4.1621 -4.1621 -2.4129 -2.4129 -2.2678 -2.2678 -1.9664 -1.9664 -1.6364 -1.6364 -1.4449 -1.4449 -1.2252 -1.2252 -0.8773 -0.8773 -0.7851 -0.7851 0.6292 0.6292 0.8669 0.8669 1.1874 1.1874 1.2989 1.2989 3.8332 3.8332 4.0100 4.0100 5.2232 5.2232 5.6479 5.6479 7.1827 7.1827 8.2751 8.2751 8.5821 8.5821 k = 0.0000 0.1657 0.1354 ( 7715 PWs) bands (ev): -19.6134 -19.6134 -19.5074 -19.5074 -17.5333 -17.5333 -17.5059 -17.5059 -16.4469 -16.4469 -16.3814 -16.3814 -13.7899 -13.7899 -13.7254 -13.7254 -10.8686 -10.8686 -10.8046 -10.8046 -10.1598 -10.1598 -10.1014 -10.1014 -7.9606 -7.9606 -7.8563 -7.8563 -7.2350 -7.2350 -7.0628 -7.0628 -6.1063 -6.1063 -6.0367 -6.0367 -5.7115 -5.7115 -5.4441 -5.4441 -5.0451 -5.0451 -4.3263 -4.3263 -4.2618 -4.2618 -4.1667 -4.1667 -2.4131 -2.4131 -2.2697 -2.2697 -1.9646 -1.9646 -1.6363 -1.6363 -1.4332 -1.4332 -1.2199 -1.2199 -0.8893 -0.8893 -0.7912 -0.7912 0.6278 0.6278 0.8579 0.8579 1.1893 1.1893 1.3057 1.3057 3.8435 3.8435 4.0055 4.0055 5.2350 5.2350 5.6594 5.6594 7.2176 7.2176 8.2683 8.2683 8.5749 8.5749 k = 0.0000 0.1785 0.1458 ( 7715 PWs) bands (ev): -19.6104 -19.6104 -19.5079 -19.5079 -17.5383 -17.5383 -17.5099 -17.5099 -16.4450 -16.4450 -16.3808 -16.3808 -13.7869 -13.7869 -13.7199 -13.7199 -10.8626 -10.8626 -10.8064 -10.8064 -10.1581 -10.1581 -10.1017 -10.1017 -7.9635 -7.9635 -7.8592 -7.8592 -7.2479 -7.2479 -7.0743 -7.0743 -6.1072 -6.1072 -6.0361 -6.0361 -5.6911 -5.6911 -5.4466 -5.4466 -5.0328 -5.0328 -4.3419 -4.3419 -4.2603 -4.2603 -4.1696 -4.1696 -2.4133 -2.4133 -2.2722 -2.2722 -1.9620 -1.9620 -1.6368 -1.6368 -1.4211 -1.4211 -1.2152 -1.2152 -0.9012 -0.9012 -0.7971 -0.7971 0.6264 0.6264 0.8484 0.8484 1.1912 1.1912 1.3128 1.3128 3.8527 3.8527 4.0023 4.0023 5.2468 5.2468 5.6714 5.6714 7.2548 7.2548 8.2624 8.2624 8.5668 8.5668 k = 0.0000 0.1912 0.1562 ( 7717 PWs) bands (ev): -19.6073 -19.6073 -19.5083 -19.5083 -17.5434 -17.5434 -17.5141 -17.5141 -16.4431 -16.4431 -16.3801 -16.3801 -13.7834 -13.7834 -13.7146 -13.7146 -10.8567 -10.8567 -10.8078 -10.8078 -10.1570 -10.1570 -10.1017 -10.1017 -7.9658 -7.9658 -7.8628 -7.8628 -7.2615 -7.2615 -7.0857 -7.0857 -6.1079 -6.1079 -6.0359 -6.0359 -5.6708 -5.6708 -5.4482 -5.4482 -5.0201 -5.0201 -4.3596 -4.3596 -4.2598 -4.2598 -4.1702 -4.1702 -2.4136 -2.4136 -2.2754 -2.2754 -1.9586 -1.9586 -1.6382 -1.6382 -1.4087 -1.4087 -1.2114 -1.2114 -0.9126 -0.9126 -0.8027 -0.8027 0.6251 0.6251 0.8386 0.8386 1.1931 1.1931 1.3202 1.3202 3.8603 3.8603 4.0011 4.0011 5.2584 5.2584 5.6837 5.6837 7.2943 7.2943 8.2575 8.2575 8.5577 8.5577 k = 0.0000 0.2040 0.1666 ( 7716 PWs) bands (ev): -19.6042 -19.6042 -19.5089 -19.5089 -17.5485 -17.5485 -17.5184 -17.5184 -16.4412 -16.4412 -16.3795 -16.3795 -13.7796 -13.7796 -13.7095 -13.7095 -10.8508 -10.8508 -10.8088 -10.8088 -10.1563 -10.1563 -10.1013 -10.1013 -7.9674 -7.9674 -7.8671 -7.8671 -7.2758 -7.2758 -7.0969 -7.0969 -6.1085 -6.1085 -6.0358 -6.0358 -5.6509 -5.6509 -5.4487 -5.4487 -5.0069 -5.0069 -4.3784 -4.3784 -4.2614 -4.2614 -4.1680 -4.1680 -2.4141 -2.4141 -2.2794 -2.2794 -1.9544 -1.9544 -1.6403 -1.6403 -1.3964 -1.3964 -1.2085 -1.2085 -0.9231 -0.9231 -0.8080 -0.8080 0.6240 0.6240 0.8285 0.8285 1.1950 1.1950 1.3279 1.3279 3.8659 3.8659 4.0022 4.0022 5.2697 5.2697 5.6964 5.6964 7.3358 7.3358 8.2539 8.2539 8.5476 8.5476 k = 0.0000 0.2167 0.1770 ( 7719 PWs) bands (ev): -19.6009 -19.6009 -19.5094 -19.5094 -17.5537 -17.5537 -17.5227 -17.5227 -16.4393 -16.4393 -16.3788 -16.3788 -13.7755 -13.7755 -13.7047 -13.7047 -10.8454 -10.8454 -10.8092 -10.8092 -10.1562 -10.1562 -10.1006 -10.1006 -7.9684 -7.9684 -7.8720 -7.8720 -7.2906 -7.2906 -7.1077 -7.1077 -6.1090 -6.1090 -6.0360 -6.0360 -5.6318 -5.6318 -5.4477 -5.4477 -4.9935 -4.9935 -4.3980 -4.3980 -4.2653 -4.2653 -4.1631 -4.1631 -2.4146 -2.4146 -2.2841 -2.2841 -1.9492 -1.9492 -1.6431 -1.6431 -1.3843 -1.3843 -1.2067 -1.2067 -0.9323 -0.9323 -0.8131 -0.8131 0.6231 0.6231 0.8183 0.8183 1.1969 1.1969 1.3357 1.3357 3.8694 3.8694 4.0058 4.0058 5.2806 5.2806 5.7093 5.7093 7.3792 7.3792 8.2516 8.2516 8.5368 8.5368 k = 0.0000 0.2295 0.1874 ( 7721 PWs) bands (ev): -19.5976 -19.5976 -19.5100 -19.5100 -17.5587 -17.5587 -17.5272 -17.5272 -16.4375 -16.4375 -16.3782 -16.3782 -13.7711 -13.7711 -13.7001 -13.7001 -10.8406 -10.8406 -10.8088 -10.8088 -10.1564 -10.1564 -10.0996 -10.0996 -7.9688 -7.9688 -7.8774 -7.8774 -7.3057 -7.3057 -7.1181 -7.1181 -6.1095 -6.1095 -6.0362 -6.0362 -5.6138 -5.6138 -5.4451 -5.4451 -4.9797 -4.9797 -4.4182 -4.4182 -4.2711 -4.2711 -4.1560 -4.1560 -2.4152 -2.4152 -2.2894 -2.2894 -1.9432 -1.9432 -1.6468 -1.6468 -1.3728 -1.3728 -1.2059 -1.2059 -0.9402 -0.9402 -0.8180 -0.8180 0.6224 0.6224 0.8080 0.8080 1.1988 1.1988 1.3436 1.3436 3.8706 3.8706 4.0117 4.0117 5.2908 5.2908 5.7224 5.7224 7.4244 7.4244 8.2509 8.2509 8.5251 8.5251 k = 0.0000 0.2422 0.1978 ( 7725 PWs) bands (ev): -19.5942 -19.5942 -19.5107 -19.5107 -17.5637 -17.5637 -17.5316 -17.5316 -16.4356 -16.4356 -16.3775 -16.3775 -13.7664 -13.7664 -13.6959 -13.6959 -10.8368 -10.8368 -10.8072 -10.8072 -10.1570 -10.1570 -10.0984 -10.0984 -7.9686 -7.9686 -7.8833 -7.8833 -7.3210 -7.3210 -7.1280 -7.1280 -6.1099 -6.1099 -6.0365 -6.0365 -5.5974 -5.5974 -5.4405 -5.4405 -4.9658 -4.9658 -4.4388 -4.4388 -4.2785 -4.2785 -4.1472 -4.1472 -2.4159 -2.4159 -2.2952 -2.2952 -1.9364 -1.9364 -1.6512 -1.6512 -1.3622 -1.3622 -1.2058 -1.2058 -0.9464 -0.9464 -0.8227 -0.8227 0.6219 0.6219 0.7977 0.7977 1.2006 1.2006 1.3516 1.3516 3.8700 3.8700 4.0195 4.0195 5.3005 5.3005 5.7355 5.7355 7.4711 7.4711 8.2516 8.2516 8.5126 8.5126 k = 0.0000 0.2550 0.2082 ( 7717 PWs) bands (ev): -19.5909 -19.5909 -19.5114 -19.5114 -17.5685 -17.5685 -17.5360 -17.5360 -16.4338 -16.4338 -16.3769 -16.3769 -13.7615 -13.7615 -13.6921 -13.6921 -10.8341 -10.8341 -10.8044 -10.8044 -10.1579 -10.1579 -10.0971 -10.0971 -7.9678 -7.9678 -7.8894 -7.8894 -7.3364 -7.3364 -7.1375 -7.1375 -6.1104 -6.1104 -6.0369 -6.0369 -5.5830 -5.5830 -5.4339 -5.4339 -4.9517 -4.9517 -4.4595 -4.4595 -4.2868 -4.2868 -4.1375 -4.1375 -2.4166 -2.4166 -2.3016 -2.3016 -1.9288 -1.9288 -1.6563 -1.6563 -1.3530 -1.3530 -1.2062 -1.2062 -0.9511 -0.9511 -0.8271 -0.8271 0.6216 0.6216 0.7874 0.7874 1.2023 1.2023 1.3595 1.3595 3.8681 3.8681 4.0288 4.0288 5.3094 5.3094 5.7487 5.7487 7.5193 7.5193 8.2539 8.2539 8.4997 8.4997 k = 0.0000 0.2677 0.2187 ( 7717 PWs) bands (ev): -19.5875 -19.5875 -19.5122 -19.5122 -17.5731 -17.5731 -17.5403 -17.5403 -16.4321 -16.4321 -16.3763 -16.3763 -13.7565 -13.7565 -13.6888 -13.6888 -10.8324 -10.8324 -10.8006 -10.8006 -10.1589 -10.1589 -10.0957 -10.0957 -7.9666 -7.9666 -7.8959 -7.8959 -7.3516 -7.3516 -7.1465 -7.1465 -6.1109 -6.1109 -6.0371 -6.0371 -5.5707 -5.5707 -5.4252 -5.4252 -4.9375 -4.9375 -4.4802 -4.4802 -4.2957 -4.2957 -4.1271 -4.1271 -2.4174 -2.4174 -2.3083 -2.3083 -1.9205 -1.9205 -1.6621 -1.6621 -1.3454 -1.3454 -1.2066 -1.2066 -0.9542 -0.9542 -0.8313 -0.8313 0.6215 0.6215 0.7773 0.7773 1.2040 1.2040 1.3672 1.3672 3.8653 3.8653 4.0389 4.0389 5.3174 5.3174 5.7617 5.7617 7.5686 7.5686 8.2577 8.2577 8.4862 8.4862 k = 0.0000 0.2805 0.2291 ( 7712 PWs) bands (ev): -19.5842 -19.5842 -19.5130 -19.5130 -17.5775 -17.5775 -17.5444 -17.5444 -16.4304 -16.4304 -16.3757 -16.3757 -13.7513 -13.7513 -13.6858 -13.6858 -10.8315 -10.8315 -10.7960 -10.7960 -10.1600 -10.1600 -10.0944 -10.0944 -7.9649 -7.9649 -7.9024 -7.9024 -7.3666 -7.3666 -7.1550 -7.1550 -6.1114 -6.1114 -6.0373 -6.0373 -5.5606 -5.5606 -5.4146 -5.4146 -4.9233 -4.9233 -4.5008 -4.5008 -4.3049 -4.3049 -4.1166 -4.1166 -2.4183 -2.4183 -2.3152 -2.3152 -1.9116 -1.9116 -1.6686 -1.6686 -1.3398 -1.3398 -1.2066 -1.2066 -0.9560 -0.9560 -0.8352 -0.8352 0.6217 0.6217 0.7674 0.7674 1.2056 1.2056 1.3748 1.3748 3.8620 3.8620 4.0493 4.0493 5.3247 5.3247 5.7744 5.7744 7.6188 7.6188 8.2630 8.2630 8.4725 8.4725 k = 0.0000 0.2932 0.2395 ( 7711 PWs) bands (ev): -19.5809 -19.5809 -19.5138 -19.5138 -17.5817 -17.5817 -17.5484 -17.5484 -16.4289 -16.4289 -16.3751 -16.3751 -13.7459 -13.7459 -13.6834 -13.6834 -10.8311 -10.8311 -10.7911 -10.7911 -10.1612 -10.1612 -10.0931 -10.0931 -7.9629 -7.9629 -7.9090 -7.9090 -7.3810 -7.3810 -7.1630 -7.1630 -6.1120 -6.1120 -6.0374 -6.0374 -5.5524 -5.5524 -5.4025 -5.4025 -4.9092 -4.9092 -4.5210 -4.5210 -4.3141 -4.3141 -4.1061 -4.1061 -2.4191 -2.4191 -2.3223 -2.3223 -1.9022 -1.9022 -1.6758 -1.6758 -1.3364 -1.3364 -1.2057 -1.2057 -0.9566 -0.9566 -0.8389 -0.8389 0.6221 0.6221 0.7578 0.7578 1.2070 1.2070 1.3821 1.3821 3.8585 3.8585 4.0598 4.0598 5.3312 5.3312 5.7869 5.7869 7.6696 7.6696 8.2697 8.2697 8.4587 8.4587 k = 0.0000 0.3060 0.2499 ( 7716 PWs) bands (ev): -19.5777 -19.5777 -19.5147 -19.5147 -17.5857 -17.5857 -17.5522 -17.5522 -16.4274 -16.4274 -16.3746 -16.3746 -13.7406 -13.7406 -13.6815 -13.6815 -10.8310 -10.8310 -10.7861 -10.7861 -10.1623 -10.1623 -10.0919 -10.0919 -7.9606 -7.9606 -7.9155 -7.9155 -7.3948 -7.3948 -7.1705 -7.1705 -6.1126 -6.1126 -6.0374 -6.0374 -5.5459 -5.5459 -5.3895 -5.3895 -4.8952 -4.8952 -4.5408 -4.5408 -4.3232 -4.3232 -4.0959 -4.0959 -2.4200 -2.4200 -2.3293 -2.3293 -1.8923 -1.8923 -1.6836 -1.6836 -1.3351 -1.3351 -1.2038 -1.2038 -0.9564 -0.9564 -0.8422 -0.8422 0.6228 0.6228 0.7485 0.7485 1.2084 1.2084 1.3891 1.3891 3.8550 3.8550 4.0700 4.0700 5.3368 5.3368 5.7988 5.7988 7.7206 7.7206 8.2774 8.2774 8.4449 8.4449 k = 0.0000 0.3187 0.2603 ( 7709 PWs) bands (ev): -19.5746 -19.5746 -19.5156 -19.5156 -17.5893 -17.5893 -17.5558 -17.5558 -16.4261 -16.4261 -16.3741 -16.3741 -13.7352 -13.7352 -13.6801 -13.6801 -10.8309 -10.8309 -10.7812 -10.7812 -10.1634 -10.1634 -10.0908 -10.0908 -7.9581 -7.9581 -7.9217 -7.9217 -7.4079 -7.4079 -7.1774 -7.1774 -6.1133 -6.1133 -6.0373 -6.0373 -5.5407 -5.5407 -5.3762 -5.3762 -4.8814 -4.8814 -4.5601 -4.5601 -4.3320 -4.3320 -4.0862 -4.0862 -2.4208 -2.4208 -2.3362 -2.3362 -1.8821 -1.8821 -1.6920 -1.6920 -1.3356 -1.3356 -1.2009 -1.2009 -0.9556 -0.9556 -0.8453 -0.8453 0.6237 0.6237 0.7396 0.7396 1.2097 1.2097 1.3956 1.3956 3.8516 3.8516 4.0797 4.0797 5.3416 5.3416 5.8101 5.8101 7.7715 7.7715 8.2860 8.2860 8.4315 8.4315 k = 0.0000 0.3315 0.2707 ( 7708 PWs) bands (ev): -19.5717 -19.5717 -19.5166 -19.5166 -17.5927 -17.5927 -17.5591 -17.5591 -16.4249 -16.4249 -16.3737 -16.3737 -13.7298 -13.7298 -13.6792 -13.6792 -10.8309 -10.8309 -10.7766 -10.7766 -10.1644 -10.1644 -10.0899 -10.0899 -7.9556 -7.9556 -7.9276 -7.9276 -7.4200 -7.4200 -7.1837 -7.1837 -6.1140 -6.1140 -6.0370 -6.0370 -5.5365 -5.5365 -5.3631 -5.3631 -4.8679 -4.8679 -4.5786 -4.5786 -4.3403 -4.3403 -4.0770 -4.0770 -2.4216 -2.4216 -2.3429 -2.3429 -1.8715 -1.8715 -1.7008 -1.7008 -1.3375 -1.3375 -1.1973 -1.1973 -0.9544 -0.9544 -0.8481 -0.8481 0.6248 0.6248 0.7312 0.7312 1.2109 1.2109 1.4016 1.4016 3.8485 3.8485 4.0888 4.0888 5.3457 5.3457 5.8207 5.8207 7.8219 7.8219 8.2949 8.2949 8.4187 8.4187 k = 0.0000 0.3442 0.2811 ( 7712 PWs) bands (ev): -19.5690 -19.5690 -19.5176 -19.5176 -17.5957 -17.5957 -17.5621 -17.5621 -16.4238 -16.4238 -16.3733 -16.3733 -13.7245 -13.7245 -13.6788 -13.6788 -10.8310 -10.8310 -10.7723 -10.7723 -10.1653 -10.1653 -10.0890 -10.0890 -7.9532 -7.9532 -7.9331 -7.9331 -7.4310 -7.4310 -7.1895 -7.1895 -6.1146 -6.1146 -6.0368 -6.0368 -5.5331 -5.5331 -5.3506 -5.3506 -4.8548 -4.8548 -4.5962 -4.5962 -4.3481 -4.3481 -4.0687 -4.0687 -2.4223 -2.4223 -2.3491 -2.3491 -1.8607 -1.8607 -1.7101 -1.7101 -1.3403 -1.3403 -1.1934 -1.1934 -0.9529 -0.9529 -0.8505 -0.8505 0.6261 0.6261 0.7233 0.7233 1.2119 1.2119 1.4071 1.4071 3.8457 3.8457 4.0969 4.0969 5.3491 5.3491 5.8304 5.8304 7.8710 7.8710 8.3034 8.3034 8.4071 8.4071 k = 0.0000 0.3570 0.2915 ( 7709 PWs) bands (ev): -19.5664 -19.5664 -19.5185 -19.5185 -17.5983 -17.5983 -17.5647 -17.5647 -16.4228 -16.4228 -16.3729 -16.3729 -13.7193 -13.7193 -13.6790 -13.6790 -10.8310 -10.8310 -10.7685 -10.7685 -10.1661 -10.1661 -10.0883 -10.0883 -7.9509 -7.9509 -7.9379 -7.9379 -7.4408 -7.4408 -7.1945 -7.1945 -6.1152 -6.1152 -6.0364 -6.0364 -5.5303 -5.5303 -5.3391 -5.3391 -4.8422 -4.8422 -4.6128 -4.6128 -4.3551 -4.3551 -4.0612 -4.0612 -2.4229 -2.4229 -2.3548 -2.3548 -1.8498 -1.8498 -1.7198 -1.7198 -1.3436 -1.3436 -1.1893 -1.1893 -0.9513 -0.9513 -0.8526 -0.8526 0.6275 0.6275 0.7162 0.7162 1.2128 1.2128 1.4120 1.4120 3.8433 3.8433 4.1042 4.1042 5.3519 5.3519 5.8391 5.8391 7.9184 7.9184 8.3102 8.3102 8.3977 8.3977 k = 0.0000 0.3697 0.3020 ( 7709 PWs) bands (ev): -19.5642 -19.5642 -19.5194 -19.5194 -17.6005 -17.6005 -17.5670 -17.5670 -16.4220 -16.4220 -16.3726 -16.3726 -13.7143 -13.7143 -13.6797 -13.6797 -10.8310 -10.8310 -10.7652 -10.7652 -10.1668 -10.1668 -10.0878 -10.0878 -7.9492 -7.9492 -7.9417 -7.9417 -7.4493 -7.4493 -7.1989 -7.1989 -6.1157 -6.1157 -6.0361 -6.0361 -5.5280 -5.5280 -5.3289 -5.3289 -4.8303 -4.8303 -4.6280 -4.6280 -4.3613 -4.3613 -4.0547 -4.0547 -2.4235 -2.4235 -2.3599 -2.3599 -1.8387 -1.8387 -1.7298 -1.7298 -1.3470 -1.3470 -1.1855 -1.1855 -0.9498 -0.9498 -0.8544 -0.8544 0.6291 0.6291 0.7097 0.7097 1.2136 1.2136 1.4162 1.4162 3.8412 3.8412 4.1105 4.1105 5.3541 5.3541 5.8467 5.8467 7.9630 7.9630 8.3136 8.3136 8.3918 8.3918 k = 0.0000 0.3825 0.3124 ( 7716 PWs) bands (ev): -19.5622 -19.5622 -19.5202 -19.5202 -17.6024 -17.6024 -17.5689 -17.5689 -16.4213 -16.4213 -16.3724 -16.3724 -13.7096 -13.7096 -13.6809 -13.6809 -10.8310 -10.8310 -10.7624 -10.7624 -10.1674 -10.1674 -10.0873 -10.0873 -7.9490 -7.9490 -7.9437 -7.9437 -7.4565 -7.4565 -7.2026 -7.2026 -6.1162 -6.1162 -6.0358 -6.0358 -5.5262 -5.5262 -5.3203 -5.3203 -4.8194 -4.8194 -4.6418 -4.6418 -4.3666 -4.3666 -4.0493 -4.0493 -2.4239 -2.4239 -2.3642 -2.3642 -1.8275 -1.8275 -1.7401 -1.7401 -1.3500 -1.3500 -1.1822 -1.1822 -0.9485 -0.9485 -0.8558 -0.8558 0.6306 0.6306 0.7041 0.7041 1.2143 1.2143 1.4197 1.4197 3.8395 3.8395 4.1156 4.1156 5.3558 5.3558 5.8531 5.8531 8.0039 8.0039 8.3123 8.3123 8.3904 8.3904 k = 0.0000 0.3952 0.3228 ( 7716 PWs) bands (ev): -19.5606 -19.5606 -19.5209 -19.5209 -17.6039 -17.6039 -17.5704 -17.5704 -16.4207 -16.4207 -16.3722 -16.3722 -13.7052 -13.7052 -13.6825 -13.6825 -10.8310 -10.8310 -10.7602 -10.7602 -10.1678 -10.1678 -10.0870 -10.0870 -7.9507 -7.9507 -7.9433 -7.9433 -7.4621 -7.4621 -7.2054 -7.2054 -6.1165 -6.1165 -6.0355 -6.0355 -5.5248 -5.5248 -5.3134 -5.3134 -4.8099 -4.8099 -4.6535 -4.6535 -4.3708 -4.3708 -4.0450 -4.0450 -2.4242 -2.4242 -2.3677 -2.3677 -1.8164 -1.8164 -1.7506 -1.7506 -1.3526 -1.3526 -1.1794 -1.1794 -0.9474 -0.9474 -0.8569 -0.8569 0.6320 0.6320 0.6995 0.6995 1.2148 1.2148 1.4225 1.4225 3.8382 3.8382 4.1197 4.1197 5.3571 5.3571 5.8581 5.8581 8.0397 8.0397 8.3066 8.3066 8.3927 8.3927 k = 0.0000 0.4080 0.3332 ( 7716 PWs) bands (ev): -19.5594 -19.5594 -19.5215 -19.5215 -17.6049 -17.6049 -17.5715 -17.5715 -16.4203 -16.4203 -16.3720 -16.3720 -13.7014 -13.7014 -13.6843 -13.6843 -10.8310 -10.8310 -10.7586 -10.7586 -10.1681 -10.1681 -10.0867 -10.0867 -7.9524 -7.9524 -7.9425 -7.9425 -7.4661 -7.4661 -7.2075 -7.2075 -6.1168 -6.1168 -6.0353 -6.0353 -5.5238 -5.5238 -5.3084 -5.3084 -4.8022 -4.8022 -4.6628 -4.6628 -4.3738 -4.3738 -4.0419 -4.0419 -2.4245 -2.4245 -2.3702 -2.3702 -1.8052 -1.8052 -1.7612 -1.7612 -1.3546 -1.3546 -1.1773 -1.1773 -0.9465 -0.9465 -0.8577 -0.8577 0.6332 0.6332 0.6960 0.6960 1.2151 1.2151 1.4245 1.4245 3.8373 3.8373 4.1227 4.1227 5.3580 5.3580 5.8618 5.8618 8.0684 8.0684 8.2991 8.2991 8.3966 8.3966 k = 0.0000 0.4207 0.3436 ( 7721 PWs) bands (ev): -19.5587 -19.5587 -19.5218 -19.5218 -17.6056 -17.6056 -17.5721 -17.5721 -16.4201 -16.4201 -16.3720 -16.3720 -13.6984 -13.6984 -13.6861 -13.6861 -10.8309 -10.8309 -10.7576 -10.7576 -10.1683 -10.1683 -10.0866 -10.0866 -7.9536 -7.9536 -7.9419 -7.9419 -7.4686 -7.4686 -7.2088 -7.2088 -6.1169 -6.1169 -6.0352 -6.0352 -5.5232 -5.5232 -5.3053 -5.3053 -4.7972 -4.7972 -4.6687 -4.6687 -4.3757 -4.3757 -4.0400 -4.0400 -2.4246 -2.4246 -2.3718 -2.3718 -1.7942 -1.7942 -1.7721 -1.7721 -1.3558 -1.3558 -1.1761 -1.1761 -0.9460 -0.9460 -0.8582 -0.8582 0.6340 0.6340 0.6939 0.6939 1.2153 1.2153 1.4258 1.4258 3.8367 3.8367 4.1244 4.1244 5.3585 5.3585 5.8640 5.8640 8.0875 8.0875 8.2926 8.2926 8.3998 8.3998 k = 0.0000 0.4335 0.3540 ( 7720 PWs) bands (ev): -19.5584 -19.5584 -19.5220 -19.5220 -17.6058 -17.6058 -17.5724 -17.5724 -16.4200 -16.4200 -16.3719 -16.3719 -13.6971 -13.6971 -13.6870 -13.6870 -10.8309 -10.8309 -10.7573 -10.7573 -10.1684 -10.1684 -10.0866 -10.0866 -7.9540 -7.9540 -7.9417 -7.9417 -7.4694 -7.4694 -7.2092 -7.2092 -6.1170 -6.1170 -6.0351 -6.0351 -5.5230 -5.5230 -5.3043 -5.3043 -4.7954 -4.7954 -4.6708 -4.6708 -4.3763 -4.3763 -4.0394 -4.0394 -2.4246 -2.4246 -2.3723 -2.3723 -1.7841 -1.7841 -1.7820 -1.7820 -1.3563 -1.3563 -1.1756 -1.1756 -0.9458 -0.9458 -0.8584 -0.8584 0.6342 0.6342 0.6931 0.6931 1.2154 1.2154 1.4262 1.4262 3.8366 3.8366 4.1250 4.1250 5.3587 5.3587 5.8647 5.8647 8.0943 8.0943 8.2900 8.2900 8.4011 8.4011 k = 0.5000 0.3255 0.2437 ( 7680 PWs) bands (ev): -19.5368 -19.5368 -19.5165 -19.5165 -17.5914 -17.5914 -17.5697 -17.5697 -16.4720 -16.4720 -16.3782 -16.3782 -13.7705 -13.7705 -13.6951 -13.6951 -10.7915 -10.7915 -10.7489 -10.7489 -10.0983 -10.0983 -10.0859 -10.0859 -7.9788 -7.9788 -7.8999 -7.8999 -7.4313 -7.4313 -7.1844 -7.1844 -6.1099 -6.1099 -6.0342 -6.0342 -5.5323 -5.5323 -5.3355 -5.3355 -4.9007 -4.9007 -4.8193 -4.8193 -4.4398 -4.4398 -4.0735 -4.0735 -2.4983 -2.4983 -2.4855 -2.4855 -1.6030 -1.6030 -1.4179 -1.4179 -1.2438 -1.2438 -1.1099 -1.1099 -1.0188 -1.0188 -0.8698 -0.8698 0.7876 0.7876 0.9900 0.9900 1.0822 1.0822 1.5333 1.5333 3.8120 3.8120 3.9246 3.9246 5.0026 5.0026 5.5149 5.5149 8.2509 8.2509 8.5663 8.5663 8.6793 8.6793 k = 0.4872 0.3171 0.2374 ( 7679 PWs) bands (ev): -19.5372 -19.5372 -19.5163 -19.5163 -17.5912 -17.5912 -17.5695 -17.5695 -16.4720 -16.4720 -16.3783 -16.3783 -13.7705 -13.7705 -13.6953 -13.6953 -10.7917 -10.7917 -10.7490 -10.7490 -10.0985 -10.0985 -10.0858 -10.0858 -7.9786 -7.9786 -7.8999 -7.8999 -7.4308 -7.4308 -7.1841 -7.1841 -6.1099 -6.1099 -6.0342 -6.0342 -5.5329 -5.5329 -5.3356 -5.3356 -4.9023 -4.9023 -4.8175 -4.8175 -4.4392 -4.4392 -4.0735 -4.0735 -2.4985 -2.4985 -2.4846 -2.4846 -1.6038 -1.6038 -1.4182 -1.4182 -1.2443 -1.2443 -1.1101 -1.1101 -1.0186 -1.0186 -0.8696 -0.8696 0.7873 0.7873 0.9895 0.9895 1.0827 1.0827 1.5328 1.5328 3.8122 3.8122 3.9247 3.9247 5.0028 5.0028 5.5149 5.5149 8.2501 8.2501 8.5661 8.5661 8.6796 8.6796 k = 0.4744 0.3088 0.2312 ( 7677 PWs) bands (ev): -19.5382 -19.5382 -19.5157 -19.5157 -17.5907 -17.5907 -17.5692 -17.5692 -16.4719 -16.4719 -16.3783 -16.3783 -13.7706 -13.7706 -13.6957 -13.6957 -10.7924 -10.7924 -10.7493 -10.7493 -10.0990 -10.0990 -10.0858 -10.0858 -7.9782 -7.9782 -7.8997 -7.8997 -7.4292 -7.4292 -7.1833 -7.1833 -6.1100 -6.1100 -6.0345 -6.0345 -5.5347 -5.5347 -5.3359 -5.3359 -4.9069 -4.9069 -4.8122 -4.8122 -4.4372 -4.4372 -4.0738 -4.0738 -2.4989 -2.4989 -2.4821 -2.4821 -1.6062 -1.6062 -1.4188 -1.4188 -1.2456 -1.2456 -1.1109 -1.1109 -1.0179 -1.0179 -0.8690 -0.8690 0.7864 0.7864 0.9878 0.9878 1.0844 1.0844 1.5315 1.5315 3.8126 3.8126 3.9252 3.9252 5.0035 5.0035 5.5148 5.5148 8.2479 8.2479 8.5654 8.5654 8.6807 8.6807 k = 0.4615 0.3004 0.2249 ( 7679 PWs) bands (ev): -19.5399 -19.5399 -19.5148 -19.5148 -17.5899 -17.5899 -17.5685 -17.5685 -16.4718 -16.4718 -16.3783 -16.3783 -13.7707 -13.7707 -13.6965 -13.6965 -10.7935 -10.7935 -10.7497 -10.7497 -10.0998 -10.0998 -10.0857 -10.0857 -7.9774 -7.9774 -7.8993 -7.8993 -7.4267 -7.4267 -7.1820 -7.1820 -6.1101 -6.1101 -6.0348 -6.0348 -5.5377 -5.5377 -5.3364 -5.3364 -4.9136 -4.9136 -4.8042 -4.8042 -4.4341 -4.4341 -4.0742 -4.0742 -2.4992 -2.4992 -2.4783 -2.4783 -1.6102 -1.6102 -1.4198 -1.4198 -1.2478 -1.2478 -1.1121 -1.1121 -1.0167 -1.0167 -0.8679 -0.8679 0.7850 0.7850 0.9853 0.9853 1.0871 1.0871 1.5292 1.5292 3.8135 3.8135 3.9260 3.9260 5.0047 5.0047 5.5146 5.5146 8.2443 8.2443 8.5633 8.5633 8.6828 8.6828 k = 0.4487 0.2921 0.2187 ( 7676 PWs) bands (ev): -19.5419 -19.5419 -19.5137 -19.5137 -17.5887 -17.5887 -17.5676 -17.5676 -16.4717 -16.4717 -16.3783 -16.3783 -13.7709 -13.7709 -13.6975 -13.6975 -10.7951 -10.7951 -10.7502 -10.7502 -10.1008 -10.1008 -10.0856 -10.0856 -7.9764 -7.9764 -7.8988 -7.8988 -7.4231 -7.4231 -7.1801 -7.1801 -6.1103 -6.1103 -6.0354 -6.0354 -5.5418 -5.5418 -5.3370 -5.3370 -4.9218 -4.9218 -4.7942 -4.7942 -4.4298 -4.4298 -4.0748 -4.0748 -2.4992 -2.4992 -2.4735 -2.4735 -1.6157 -1.6157 -1.4213 -1.4213 -1.2508 -1.2508 -1.1138 -1.1138 -1.0150 -1.0150 -0.8665 -0.8665 0.7830 0.7830 0.9820 0.9820 1.0905 1.0905 1.5260 1.5260 3.8146 3.8146 3.9270 3.9270 5.0063 5.0063 5.5144 5.5144 8.2393 8.2393 8.5585 8.5585 8.6863 8.6863 k = 0.4359 0.2837 0.2124 ( 7684 PWs) bands (ev): -19.5443 -19.5443 -19.5125 -19.5125 -17.5872 -17.5872 -17.5665 -17.5665 -16.4715 -16.4715 -16.3783 -16.3783 -13.7712 -13.7712 -13.6989 -13.6989 -10.7970 -10.7970 -10.7509 -10.7509 -10.1022 -10.1022 -10.0855 -10.0855 -7.9751 -7.9751 -7.8982 -7.8982 -7.4185 -7.4185 -7.1777 -7.1777 -6.1105 -6.1105 -6.0360 -6.0360 -5.5470 -5.5470 -5.3379 -5.3379 -4.9311 -4.9311 -4.7825 -4.7825 -4.4245 -4.4245 -4.0756 -4.0756 -2.4988 -2.4988 -2.4679 -2.4679 -1.6228 -1.6228 -1.4231 -1.4231 -1.2546 -1.2546 -1.1158 -1.1158 -1.0128 -1.0128 -0.8647 -0.8647 0.7805 0.7805 0.9783 0.9783 1.0945 1.0945 1.5219 1.5219 3.8161 3.8161 3.9282 3.9282 5.0084 5.0084 5.5141 5.5141 8.2330 8.2330 8.5492 8.5492 8.6919 8.6919 k = 0.4231 0.2754 0.2062 ( 7687 PWs) bands (ev): -19.5470 -19.5470 -19.5114 -19.5114 -17.5854 -17.5854 -17.5651 -17.5651 -16.4713 -16.4713 -16.3784 -16.3784 -13.7714 -13.7714 -13.7005 -13.7005 -10.7994 -10.7994 -10.7517 -10.7517 -10.1038 -10.1038 -10.0854 -10.0854 -7.9735 -7.9735 -7.8975 -7.8975 -7.4130 -7.4130 -7.1748 -7.1748 -6.1108 -6.1108 -6.0368 -6.0368 -5.5532 -5.5532 -5.3389 -5.3389 -4.9410 -4.9410 -4.7695 -4.7695 -4.4184 -4.4184 -4.0765 -4.0765 -2.4979 -2.4979 -2.4615 -2.4615 -1.6313 -1.6313 -1.4254 -1.4254 -1.2593 -1.2593 -1.1183 -1.1183 -1.0103 -1.0103 -0.8625 -0.8625 0.7774 0.7774 0.9742 0.9742 1.0989 1.0989 1.5170 1.5170 3.8178 3.8178 3.9296 3.9296 5.0109 5.0109 5.5138 5.5138 8.2253 8.2253 8.5333 8.5333 8.7000 8.7000 k = 0.4103 0.2670 0.1999 ( 7690 PWs) bands (ev): -19.5499 -19.5499 -19.5102 -19.5102 -17.5833 -17.5833 -17.5634 -17.5634 -16.4711 -16.4711 -16.3784 -16.3784 -13.7718 -13.7718 -13.7023 -13.7023 -10.8021 -10.8021 -10.7527 -10.7527 -10.1056 -10.1056 -10.0853 -10.0853 -7.9716 -7.9716 -7.8968 -7.8968 -7.4066 -7.4066 -7.1714 -7.1714 -6.1110 -6.1110 -6.0377 -6.0377 -5.5603 -5.5603 -5.3402 -5.3402 -4.9513 -4.9513 -4.7552 -4.7552 -4.4116 -4.4116 -4.0775 -4.0775 -2.4966 -2.4966 -2.4544 -2.4544 -1.6412 -1.6412 -1.4282 -1.4282 -1.2647 -1.2647 -1.1212 -1.1212 -1.0073 -1.0073 -0.8600 -0.8600 0.7739 0.7739 0.9700 0.9700 1.1036 1.1036 1.5112 1.5112 3.8199 3.8199 3.9311 3.9311 5.0139 5.0139 5.5136 5.5136 8.2161 8.2161 8.5097 8.5097 8.7109 8.7109 k = 0.3974 0.2587 0.1937 ( 7696 PWs) bands (ev): -19.5530 -19.5530 -19.5092 -19.5092 -17.5809 -17.5809 -17.5616 -17.5616 -16.4709 -16.4709 -16.3785 -16.3785 -13.7722 -13.7722 -13.7044 -13.7044 -10.8052 -10.8052 -10.7538 -10.7538 -10.1076 -10.1076 -10.0853 -10.0853 -7.9695 -7.9695 -7.8959 -7.8959 -7.3994 -7.3994 -7.1674 -7.1674 -6.1113 -6.1113 -6.0388 -6.0388 -5.5683 -5.5683 -5.3416 -5.3416 -4.9620 -4.9620 -4.7399 -4.7399 -4.4042 -4.4042 -4.0786 -4.0786 -2.4948 -2.4948 -2.4466 -2.4466 -1.6523 -1.6523 -1.4314 -1.4314 -1.2709 -1.2709 -1.1244 -1.1244 -1.0038 -1.0038 -0.8572 -0.8572 0.7698 0.7698 0.9658 0.9658 1.1084 1.1084 1.5047 1.5047 3.8222 3.8222 3.9327 3.9327 5.0173 5.0173 5.5133 5.5133 8.2050 8.2050 8.4780 8.4780 8.7245 8.7245 k = 0.3846 0.2504 0.1874 ( 7695 PWs) bands (ev): -19.5563 -19.5563 -19.5082 -19.5082 -17.5783 -17.5783 -17.5595 -17.5595 -16.4706 -16.4706 -16.3786 -16.3786 -13.7726 -13.7726 -13.7068 -13.7068 -10.8087 -10.8087 -10.7550 -10.7550 -10.1098 -10.1098 -10.0853 -10.0853 -7.9671 -7.9671 -7.8950 -7.8950 -7.3913 -7.3913 -7.1629 -7.1629 -6.1116 -6.1116 -6.0399 -6.0399 -5.5771 -5.5771 -5.3432 -5.3432 -4.9727 -4.9727 -4.7237 -4.7237 -4.3964 -4.3964 -4.0798 -4.0798 -2.4927 -2.4927 -2.4381 -2.4381 -1.6647 -1.6647 -1.4351 -1.4351 -1.2777 -1.2777 -1.1280 -1.1280 -0.9998 -0.9998 -0.8540 -0.8540 0.7653 0.7653 0.9617 0.9617 1.1133 1.1133 1.4974 1.4974 3.8248 3.8248 3.9343 3.9343 5.0211 5.0211 5.5131 5.5131 8.1913 8.1913 8.4397 8.4397 8.7407 8.7407 k = 0.3718 0.2420 0.1812 ( 7695 PWs) bands (ev): -19.5596 -19.5596 -19.5073 -19.5073 -17.5754 -17.5754 -17.5572 -17.5572 -16.4703 -16.4703 -16.3787 -16.3787 -13.7731 -13.7731 -13.7094 -13.7094 -10.8124 -10.8124 -10.7563 -10.7563 -10.1122 -10.1122 -10.0854 -10.0854 -7.9645 -7.9645 -7.8941 -7.8941 -7.3826 -7.3826 -7.1579 -7.1579 -6.1119 -6.1119 -6.0411 -6.0411 -5.5866 -5.5866 -5.3449 -5.3449 -4.9835 -4.9835 -4.7065 -4.7065 -4.3884 -4.3884 -4.0810 -4.0810 -2.4903 -2.4903 -2.4291 -2.4291 -1.6781 -1.6781 -1.4393 -1.4393 -1.2852 -1.2852 -1.1320 -1.1320 -0.9954 -0.9954 -0.8505 -0.8505 0.7603 0.7603 0.9578 0.9578 1.1181 1.1181 1.4893 1.4893 3.8275 3.8275 3.9360 3.9360 5.0252 5.0252 5.5130 5.5130 8.1736 8.1736 8.3976 8.3976 8.7590 8.7590 k = 0.3590 0.2337 0.1749 ( 7698 PWs) bands (ev): -19.5631 -19.5631 -19.5065 -19.5065 -17.5722 -17.5722 -17.5547 -17.5547 -16.4700 -16.4700 -16.3788 -16.3788 -13.7736 -13.7736 -13.7122 -13.7122 -10.8163 -10.8163 -10.7577 -10.7577 -10.1147 -10.1147 -10.0855 -10.0855 -7.9617 -7.9617 -7.8931 -7.8931 -7.3733 -7.3733 -7.1524 -7.1524 -6.1121 -6.1121 -6.0424 -6.0424 -5.5968 -5.5968 -5.3468 -5.3468 -4.9943 -4.9943 -4.6885 -4.6885 -4.3803 -4.3803 -4.0823 -4.0823 -2.4875 -2.4875 -2.4197 -2.4197 -1.6925 -1.6925 -1.4441 -1.4441 -1.2932 -1.2932 -1.1363 -1.1363 -0.9904 -0.9904 -0.8468 -0.8468 0.7550 0.7550 0.9541 0.9541 1.1229 1.1229 1.4806 1.4806 3.8302 3.8302 3.9377 3.9377 5.0298 5.0298 5.5130 5.5130 8.1498 8.1498 8.3558 8.3558 8.7787 8.7787 k = 0.3462 0.2253 0.1687 ( 7697 PWs) bands (ev): -19.5666 -19.5666 -19.5057 -19.5057 -17.5689 -17.5689 -17.5520 -17.5520 -16.4696 -16.4696 -16.3789 -16.3789 -13.7742 -13.7742 -13.7152 -13.7152 -10.8205 -10.8205 -10.7591 -10.7591 -10.1175 -10.1175 -10.0856 -10.0856 -7.9588 -7.9588 -7.8921 -7.8921 -7.3633 -7.3633 -7.1464 -7.1464 -6.1123 -6.1123 -6.0438 -6.0438 -5.6076 -5.6076 -5.3489 -5.3489 -5.0048 -5.0048 -4.6697 -4.6697 -4.3722 -4.3722 -4.0835 -4.0835 -2.4845 -2.4845 -2.4098 -2.4098 -1.7076 -1.7076 -1.4495 -1.4495 -1.3018 -1.3018 -1.1410 -1.1410 -0.9849 -0.9849 -0.8428 -0.8428 0.7494 0.7494 0.9508 0.9508 1.1275 1.1275 1.4712 1.4712 3.8329 3.8329 3.9394 3.9394 5.0346 5.0346 5.5131 5.5131 8.1172 8.1172 8.3189 8.3189 8.7989 8.7989 k = 0.3333 0.2170 0.1624 ( 7690 PWs) bands (ev): -19.5702 -19.5702 -19.5051 -19.5051 -17.5654 -17.5654 -17.5491 -17.5491 -16.4692 -16.4692 -16.3790 -16.3790 -13.7748 -13.7748 -13.7184 -13.7184 -10.8249 -10.8249 -10.7606 -10.7606 -10.1203 -10.1203 -10.0857 -10.0857 -7.9556 -7.9556 -7.8911 -7.8911 -7.3530 -7.3530 -7.1399 -7.1399 -6.1124 -6.1124 -6.0452 -6.0452 -5.6188 -5.6188 -5.3511 -5.3511 -5.0151 -5.0151 -4.6503 -4.6503 -4.3643 -4.3643 -4.0846 -4.0846 -2.4813 -2.4813 -2.3995 -2.3995 -1.7234 -1.7234 -1.4554 -1.4554 -1.3108 -1.3108 -1.1460 -1.1460 -0.9789 -0.9789 -0.8385 -0.8385 0.7435 0.7435 0.9478 0.9478 1.1321 1.1321 1.4613 1.4613 3.8354 3.8354 3.9413 3.9413 5.0398 5.0398 5.5134 5.5134 8.0744 8.0744 8.2899 8.2899 8.8146 8.8146 k = 0.3205 0.2086 0.1562 ( 7696 PWs) bands (ev): -19.5738 -19.5738 -19.5046 -19.5046 -17.5618 -17.5618 -17.5461 -17.5461 -16.4688 -16.4688 -16.3792 -16.3792 -13.7754 -13.7754 -13.7217 -13.7217 -10.8295 -10.8295 -10.7622 -10.7622 -10.1233 -10.1233 -10.0859 -10.0859 -7.9523 -7.9523 -7.8902 -7.8902 -7.3422 -7.3422 -7.1330 -7.1330 -6.1124 -6.1124 -6.0466 -6.0466 -5.6305 -5.6305 -5.3535 -5.3535 -5.0251 -5.0251 -4.6303 -4.6303 -4.3567 -4.3567 -4.0857 -4.0857 -2.4779 -2.4779 -2.3891 -2.3891 -1.7396 -1.7396 -1.4620 -1.4620 -1.3202 -1.3202 -1.1514 -1.1514 -0.9723 -0.9723 -0.8340 -0.8340 0.7374 0.7374 0.9452 0.9452 1.1365 1.1365 1.4509 1.4509 3.8375 3.8375 3.9434 3.9434 5.0451 5.0451 5.5140 5.5140 8.0223 8.0223 8.2691 8.2691 8.8132 8.8132 k = 0.3077 0.2003 0.1499 ( 7696 PWs) bands (ev): -19.5775 -19.5775 -19.5041 -19.5041 -17.5581 -17.5581 -17.5429 -17.5429 -16.4684 -16.4684 -16.3794 -16.3794 -13.7761 -13.7761 -13.7251 -13.7251 -10.8342 -10.8342 -10.7637 -10.7637 -10.1265 -10.1265 -10.0861 -10.0861 -7.9489 -7.9489 -7.8893 -7.8893 -7.3311 -7.3311 -7.1256 -7.1256 -6.1123 -6.1123 -6.0481 -6.0481 -5.6425 -5.6425 -5.3559 -5.3559 -5.0347 -5.0347 -4.6099 -4.6099 -4.3495 -4.3495 -4.0867 -4.0867 -2.4743 -2.4743 -2.3785 -2.3785 -1.7562 -1.7562 -1.4693 -1.4693 -1.3299 -1.3299 -1.1571 -1.1571 -0.9653 -0.9653 -0.8292 -0.8292 0.7312 0.7312 0.9429 0.9429 1.1407 1.1407 1.4400 1.4400 3.8392 3.8392 3.9458 3.9458 5.0507 5.0507 5.5147 5.5147 7.9638 7.9638 8.2546 8.2546 8.8085 8.8085 k = 0.2949 0.1919 0.1437 ( 7696 PWs) bands (ev): -19.5811 -19.5811 -19.5038 -19.5038 -17.5542 -17.5542 -17.5396 -17.5396 -16.4680 -16.4680 -16.3796 -16.3796 -13.7767 -13.7767 -13.7287 -13.7287 -10.8390 -10.8390 -10.7653 -10.7653 -10.1297 -10.1297 -10.0863 -10.0863 -7.9454 -7.9454 -7.8884 -7.8884 -7.3198 -7.3198 -7.1178 -7.1178 -6.1121 -6.1121 -6.0496 -6.0496 -5.6548 -5.6548 -5.3585 -5.3585 -5.0439 -5.0439 -4.5890 -4.5890 -4.3426 -4.3426 -4.0875 -4.0875 -2.4707 -2.4707 -2.3678 -2.3678 -1.7729 -1.7729 -1.4771 -1.4771 -1.3399 -1.3399 -1.1631 -1.1631 -0.9577 -0.9577 -0.8243 -0.8243 0.7248 0.7248 0.9409 0.9409 1.1448 1.1448 1.4288 1.4288 3.8402 3.8402 3.9487 3.9487 5.0563 5.0563 5.5158 5.5158 7.9015 7.9015 8.2447 8.2447 8.8030 8.8030 k = 0.2821 0.1836 0.1374 ( 7696 PWs) bands (ev): -19.5848 -19.5848 -19.5035 -19.5035 -17.5503 -17.5503 -17.5362 -17.5362 -16.4676 -16.4676 -16.3799 -16.3799 -13.7775 -13.7775 -13.7323 -13.7323 -10.8438 -10.8438 -10.7668 -10.7668 -10.1330 -10.1330 -10.0866 -10.0866 -7.9419 -7.9419 -7.8876 -7.8876 -7.3084 -7.3084 -7.1097 -7.1097 -6.1118 -6.1118 -6.0511 -6.0511 -5.6674 -5.6674 -5.3612 -5.3612 -5.0526 -5.0526 -4.5679 -4.5679 -4.3363 -4.3363 -4.0881 -4.0881 -2.4670 -2.4670 -2.3572 -2.3572 -1.7896 -1.7896 -1.4856 -1.4856 -1.3502 -1.3502 -1.1693 -1.1693 -0.9498 -0.9498 -0.8191 -0.8191 0.7185 0.7185 0.9391 0.9391 1.1487 1.1487 1.4173 1.4173 3.8403 3.8403 3.9521 3.9521 5.0620 5.0620 5.5171 5.5171 7.8373 7.8373 8.2381 8.2381 8.7969 8.7969 k = 0.2692 0.1752 0.1312 ( 7701 PWs) bands (ev): -19.5884 -19.5884 -19.5033 -19.5033 -17.5463 -17.5463 -17.5327 -17.5327 -16.4672 -16.4672 -16.3801 -16.3801 -13.7782 -13.7782 -13.7360 -13.7360 -10.8487 -10.8487 -10.7684 -10.7684 -10.1364 -10.1364 -10.0868 -10.0868 -7.9383 -7.9383 -7.8869 -7.8869 -7.2969 -7.2969 -7.1012 -7.1012 -6.1113 -6.1113 -6.0526 -6.0526 -5.6801 -5.6801 -5.3639 -5.3639 -5.0609 -5.0609 -4.5467 -4.5467 -4.3306 -4.3306 -4.0885 -4.0885 -2.4634 -2.4634 -2.3468 -2.3468 -1.8062 -1.8062 -1.4946 -1.4946 -1.3605 -1.3605 -1.1758 -1.1758 -0.9415 -0.9415 -0.8137 -0.8137 0.7121 0.7121 0.9377 0.9377 1.1524 1.1524 1.4055 1.4055 3.8395 3.8395 3.9561 3.9561 5.0678 5.0678 5.5187 5.5187 7.7725 7.7725 8.2340 8.2340 8.7903 8.7903 k = 0.2564 0.1669 0.1250 ( 7706 PWs) bands (ev): -19.5920 -19.5920 -19.5032 -19.5032 -17.5424 -17.5424 -17.5291 -17.5291 -16.4667 -16.4667 -16.3804 -16.3804 -13.7790 -13.7790 -13.7398 -13.7398 -10.8536 -10.8536 -10.7699 -10.7699 -10.1398 -10.1398 -10.0871 -10.0871 -7.9346 -7.9346 -7.8862 -7.8862 -7.2855 -7.2855 -7.0924 -7.0924 -6.1106 -6.1106 -6.0540 -6.0540 -5.6930 -5.6930 -5.3666 -5.3666 -5.0687 -5.0687 -4.5253 -4.5253 -4.3254 -4.3254 -4.0888 -4.0888 -2.4597 -2.4597 -2.3366 -2.3366 -1.8225 -1.8225 -1.5041 -1.5041 -1.3710 -1.3710 -1.1825 -1.1825 -0.9328 -0.9328 -0.8081 -0.8081 0.7059 0.7059 0.9364 0.9364 1.1559 1.1559 1.3936 1.3936 3.8378 3.8378 3.9608 3.9608 5.0734 5.0734 5.5206 5.5206 7.7080 7.7080 8.2319 8.2319 8.7832 8.7832 k = 0.2436 0.1586 0.1187 ( 7710 PWs) bands (ev): -19.5955 -19.5955 -19.5031 -19.5031 -17.5384 -17.5384 -17.5255 -17.5255 -16.4663 -16.4663 -16.3807 -16.3807 -13.7798 -13.7798 -13.7435 -13.7435 -10.8585 -10.8585 -10.7713 -10.7713 -10.1433 -10.1433 -10.0873 -10.0873 -7.9310 -7.9310 -7.8856 -7.8856 -7.2743 -7.2743 -7.0835 -7.0835 -6.1097 -6.1097 -6.0554 -6.0554 -5.7059 -5.7059 -5.3694 -5.3694 -5.0759 -5.0759 -4.5040 -4.5040 -4.3207 -4.3207 -4.0889 -4.0889 -2.4561 -2.4561 -2.3268 -2.3268 -1.8383 -1.8383 -1.5141 -1.5141 -1.3815 -1.3815 -1.1893 -1.1893 -0.9239 -0.9239 -0.8024 -0.8024 0.6998 0.6998 0.9354 0.9354 1.1593 1.1593 1.3817 1.3817 3.8351 3.8351 3.9661 3.9661 5.0790 5.0790 5.5228 5.5228 7.6445 7.6445 8.2315 8.2315 8.7756 8.7756 k = 0.2308 0.1502 0.1125 ( 7714 PWs) bands (ev): -19.5990 -19.5990 -19.5030 -19.5030 -17.5345 -17.5345 -17.5218 -17.5218 -16.4659 -16.4659 -16.3810 -16.3810 -13.7806 -13.7806 -13.7472 -13.7472 -10.8633 -10.8633 -10.7727 -10.7727 -10.1467 -10.1467 -10.0876 -10.0876 -7.9274 -7.9274 -7.8850 -7.8850 -7.2632 -7.2632 -7.0743 -7.0743 -6.1086 -6.1086 -6.0568 -6.0568 -5.7188 -5.7188 -5.3722 -5.3722 -5.0827 -5.0827 -4.4829 -4.4829 -4.3166 -4.3166 -4.0888 -4.0888 -2.4525 -2.4525 -2.3175 -2.3175 -1.8535 -1.8535 -1.5244 -1.5244 -1.3920 -1.3920 -1.1962 -1.1962 -0.9148 -0.9148 -0.7966 -0.7966 0.6939 0.6939 0.9345 0.9345 1.1624 1.1624 1.3698 1.3698 3.8315 3.8315 3.9719 3.9719 5.0845 5.0845 5.5253 5.5253 7.5825 7.5825 8.2326 8.2326 8.7676 8.7676 k = 0.2179 0.1419 0.1062 ( 7711 PWs) bands (ev): -19.6024 -19.6024 -19.5031 -19.5031 -17.5307 -17.5307 -17.5181 -17.5181 -16.4655 -16.4655 -16.3814 -16.3814 -13.7814 -13.7814 -13.7509 -13.7509 -10.8680 -10.8680 -10.7740 -10.7740 -10.1502 -10.1502 -10.0879 -10.0879 -7.9239 -7.9239 -7.8845 -7.8845 -7.2524 -7.2524 -7.0650 -7.0650 -6.1073 -6.1073 -6.0581 -6.0581 -5.7317 -5.7317 -5.3750 -5.3750 -5.0890 -5.0890 -4.4621 -4.4621 -4.3129 -4.3129 -4.0885 -4.0885 -2.4490 -2.4490 -2.3087 -2.3087 -1.8679 -1.8679 -1.5350 -1.5350 -1.4024 -1.4024 -1.2031 -1.2031 -0.9056 -0.9056 -0.7906 -0.7906 0.6882 0.6882 0.9337 0.9337 1.1654 1.1654 1.3581 1.3581 3.8271 3.8271 3.9783 3.9783 5.0897 5.0897 5.5281 5.5281 7.5223 7.5223 8.2351 8.2351 8.7591 8.7591 k = 0.2051 0.1335 0.1000 ( 7708 PWs) bands (ev): -19.6056 -19.6056 -19.5031 -19.5031 -17.5269 -17.5269 -17.5145 -17.5145 -16.4650 -16.4650 -16.3818 -16.3818 -13.7822 -13.7822 -13.7545 -13.7545 -10.8725 -10.8725 -10.7753 -10.7753 -10.1536 -10.1536 -10.0881 -10.0881 -7.9204 -7.9204 -7.8841 -7.8841 -7.2420 -7.2420 -7.0557 -7.0557 -6.1058 -6.1058 -6.0593 -6.0593 -5.7444 -5.7444 -5.3777 -5.3777 -5.0948 -5.0948 -4.4419 -4.4419 -4.3096 -4.3096 -4.0882 -4.0882 -2.4457 -2.4457 -2.3007 -2.3007 -1.8815 -1.8815 -1.5458 -1.5458 -1.4126 -1.4126 -1.2100 -1.2100 -0.8964 -0.8964 -0.7846 -0.7846 0.6828 0.6828 0.9330 0.9330 1.1681 1.1681 1.3466 1.3466 3.8220 3.8220 3.9851 3.9851 5.0948 5.0948 5.5312 5.5312 7.4643 7.4643 8.2387 8.2387 8.7502 8.7502 k = 0.1923 0.1252 0.0937 ( 7710 PWs) bands (ev): -19.6088 -19.6088 -19.5032 -19.5032 -17.5233 -17.5233 -17.5109 -17.5109 -16.4646 -16.4646 -16.3821 -16.3821 -13.7830 -13.7830 -13.7580 -13.7580 -10.8770 -10.8770 -10.7765 -10.7765 -10.1569 -10.1569 -10.0883 -10.0883 -7.9170 -7.9170 -7.8837 -7.8837 -7.2320 -7.2320 -7.0465 -7.0465 -6.1041 -6.1041 -6.0604 -6.0604 -5.7570 -5.7570 -5.3804 -5.3804 -5.1001 -5.1001 -4.4223 -4.4223 -4.3064 -4.3064 -4.0879 -4.0879 -2.4424 -2.4424 -2.2934 -2.2934 -1.8941 -1.8941 -1.5566 -1.5566 -1.4227 -1.4227 -1.2168 -1.2168 -0.8872 -0.8872 -0.7786 -0.7786 0.6777 0.6777 0.9323 0.9323 1.1706 1.1706 1.3355 1.3355 3.8163 3.8163 3.9921 3.9921 5.0996 5.0996 5.5344 5.5344 7.4086 7.4086 8.2435 8.2435 8.7409 8.7409 k = 0.1795 0.1168 0.0875 ( 7713 PWs) bands (ev): -19.6118 -19.6118 -19.5033 -19.5033 -17.5198 -17.5198 -17.5074 -17.5074 -16.4642 -16.4642 -16.3825 -16.3825 -13.7838 -13.7838 -13.7614 -13.7614 -10.8813 -10.8813 -10.7776 -10.7776 -10.1602 -10.1602 -10.0886 -10.0886 -7.9137 -7.9137 -7.8834 -7.8834 -7.2224 -7.2224 -7.0373 -7.0373 -6.1021 -6.1021 -6.0615 -6.0615 -5.7693 -5.7693 -5.3829 -5.3829 -5.1049 -5.1049 -4.4038 -4.4038 -4.3030 -4.3030 -4.0876 -4.0876 -2.4393 -2.4393 -2.2870 -2.2870 -1.9056 -1.9056 -1.5674 -1.5674 -1.4325 -1.4325 -1.2235 -1.2235 -0.8781 -0.8781 -0.7726 -0.7726 0.6729 0.6729 0.9317 0.9317 1.1728 1.1728 1.3248 1.3248 3.8102 3.8102 3.9993 3.9993 5.1042 5.1042 5.5378 5.5378 7.3556 7.3556 8.2493 8.2493 8.7311 8.7311 k = 0.1667 0.1085 0.0812 ( 7712 PWs) bands (ev): -19.6146 -19.6146 -19.5035 -19.5035 -17.5164 -17.5164 -17.5039 -17.5039 -16.4638 -16.4638 -16.3829 -16.3829 -13.7846 -13.7846 -13.7646 -13.7646 -10.8853 -10.8853 -10.7786 -10.7786 -10.1634 -10.1634 -10.0888 -10.0888 -7.9106 -7.9106 -7.8832 -7.8832 -7.2134 -7.2134 -7.0284 -7.0284 -6.1000 -6.1000 -6.0624 -6.0624 -5.7814 -5.7814 -5.3854 -5.3854 -5.1094 -5.1094 -4.3868 -4.3868 -4.2991 -4.2991 -4.0875 -4.0875 -2.4363 -2.4363 -2.2815 -2.2815 -1.9159 -1.9159 -1.5781 -1.5781 -1.4420 -1.4420 -1.2300 -1.2300 -0.8693 -0.8693 -0.7667 -0.7667 0.6685 0.6685 0.9310 0.9310 1.1748 1.1748 1.3147 1.3147 3.8038 3.8038 4.0065 4.0065 5.1084 5.1084 5.5414 5.5414 7.3055 7.3055 8.2560 8.2560 8.7210 8.7210 k = 0.1538 0.1001 0.0750 ( 7716 PWs) bands (ev): -19.6173 -19.6173 -19.5036 -19.5036 -17.5132 -17.5132 -17.5007 -17.5007 -16.4635 -16.4635 -16.3833 -16.3833 -13.7854 -13.7854 -13.7677 -13.7677 -10.8892 -10.8892 -10.7795 -10.7795 -10.1664 -10.1664 -10.0890 -10.0890 -7.9076 -7.9076 -7.8830 -7.8830 -7.2048 -7.2048 -7.0197 -7.0197 -6.0976 -6.0976 -6.0632 -6.0632 -5.7930 -5.7930 -5.3878 -5.3878 -5.1134 -5.1134 -4.3718 -4.3718 -4.2941 -4.2941 -4.0876 -4.0876 -2.4335 -2.4335 -2.2770 -2.2770 -1.9251 -1.9251 -1.5886 -1.5886 -1.4511 -1.4511 -1.2363 -1.2363 -0.8607 -0.8607 -0.7610 -0.7610 0.6644 0.6644 0.9304 0.9304 1.1764 1.1764 1.3053 1.3053 3.7973 3.7973 4.0136 4.0136 5.1124 5.1124 5.5449 5.5449 7.2584 7.2584 8.2634 8.2634 8.7106 8.7106 k = 0.1410 0.0918 0.0687 ( 7721 PWs) bands (ev): -19.6199 -19.6199 -19.5038 -19.5038 -17.5102 -17.5102 -17.4975 -17.4975 -16.4631 -16.4631 -16.3837 -16.3837 -13.7863 -13.7863 -13.7705 -13.7705 -10.8928 -10.8928 -10.7804 -10.7804 -10.1693 -10.1693 -10.0892 -10.0892 -7.9047 -7.9047 -7.8829 -7.8829 -7.1969 -7.1969 -7.0114 -7.0114 -6.0951 -6.0951 -6.0640 -6.0640 -5.8043 -5.8043 -5.3900 -5.3900 -5.1170 -5.1170 -4.3595 -4.3595 -4.2873 -4.2873 -4.0880 -4.0880 -2.4307 -2.4307 -2.2734 -2.2734 -1.9330 -1.9330 -1.5987 -1.5987 -1.4598 -1.4598 -1.2422 -1.2422 -0.8525 -0.8525 -0.7554 -0.7554 0.6607 0.6607 0.9297 0.9297 1.1776 1.1776 1.2966 1.2966 3.7907 3.7907 4.0206 4.0206 5.1161 5.1161 5.5485 5.5485 7.2144 7.2144 8.2715 8.2715 8.6999 8.6999 k = 0.1282 0.0835 0.0625 ( 7724 PWs) bands (ev): -19.6222 -19.6222 -19.5039 -19.5039 -17.5073 -17.5073 -17.4946 -17.4946 -16.4628 -16.4628 -16.3841 -16.3841 -13.7871 -13.7871 -13.7731 -13.7731 -10.8962 -10.8962 -10.7812 -10.7812 -10.1720 -10.1720 -10.0893 -10.0893 -7.9020 -7.9020 -7.8829 -7.8829 -7.1896 -7.1896 -7.0035 -7.0035 -6.0925 -6.0925 -6.0646 -6.0646 -5.8151 -5.8151 -5.3921 -5.3921 -5.1203 -5.1203 -4.3503 -4.3503 -4.2784 -4.2784 -4.0887 -4.0887 -2.4281 -2.4281 -2.2707 -2.2707 -1.9398 -1.9398 -1.6084 -1.6084 -1.4679 -1.4679 -1.2478 -1.2478 -0.8448 -0.8448 -0.7501 -0.7501 0.6573 0.6573 0.9291 0.9291 1.1784 1.1784 1.2889 1.2889 3.7843 3.7843 4.0273 4.0273 5.1195 5.1195 5.5521 5.5521 7.1738 7.1738 8.2801 8.2801 8.6891 8.6891 k = 0.1154 0.0751 0.0562 ( 7720 PWs) bands (ev): -19.6244 -19.6244 -19.5041 -19.5041 -17.5047 -17.5047 -17.4919 -17.4919 -16.4625 -16.4625 -16.3844 -16.3844 -13.7880 -13.7880 -13.7755 -13.7755 -10.8993 -10.8993 -10.7818 -10.7818 -10.1745 -10.1745 -10.0895 -10.0895 -7.8995 -7.8995 -7.8829 -7.8829 -7.1829 -7.1829 -6.9961 -6.9961 -6.0898 -6.0898 -6.0650 -6.0650 -5.8253 -5.8253 -5.3940 -5.3940 -5.1231 -5.1231 -4.3441 -4.3441 -4.2674 -4.2674 -4.0899 -4.0899 -2.4257 -2.4257 -2.2689 -2.2689 -1.9454 -1.9454 -1.6175 -1.6175 -1.4756 -1.4756 -1.2531 -1.2531 -0.8376 -0.8376 -0.7450 -0.7450 0.6543 0.6543 0.9284 0.9284 1.1788 1.1788 1.2820 1.2820 3.7781 3.7781 4.0337 4.0337 5.1226 5.1226 5.5555 5.5555 7.1366 7.1366 8.2891 8.2891 8.6782 8.6782 k = 0.1026 0.0668 0.0500 ( 7720 PWs) bands (ev): -19.6264 -19.6264 -19.5043 -19.5043 -17.5024 -17.5024 -17.4894 -17.4894 -16.4622 -16.4622 -16.3848 -16.3848 -13.7888 -13.7888 -13.7775 -13.7775 -10.9021 -10.9021 -10.7825 -10.7825 -10.1768 -10.1768 -10.0896 -10.0896 -7.8972 -7.8972 -7.8829 -7.8829 -7.1768 -7.1768 -6.9894 -6.9894 -6.0872 -6.0872 -6.0653 -6.0653 -5.8348 -5.8348 -5.3957 -5.3957 -5.1257 -5.1257 -4.3402 -4.3402 -4.2551 -4.2551 -4.0916 -4.0916 -2.4233 -2.4233 -2.2678 -2.2678 -1.9499 -1.9499 -1.6260 -1.6260 -1.4826 -1.4826 -1.2579 -1.2579 -0.8309 -0.8309 -0.7403 -0.7403 0.6516 0.6516 0.9278 0.9278 1.1788 1.1788 1.2761 1.2761 3.7722 3.7722 4.0396 4.0396 5.1254 5.1254 5.5587 5.5587 7.1030 7.1030 8.2982 8.2982 8.6674 8.6674 k = 0.0897 0.0584 0.0437 ( 7720 PWs) bands (ev): -19.6281 -19.6281 -19.5044 -19.5044 -17.5002 -17.5002 -17.4871 -17.4871 -16.4620 -16.4620 -16.3851 -16.3851 -13.7897 -13.7897 -13.7793 -13.7793 -10.9047 -10.9047 -10.7830 -10.7830 -10.1789 -10.1789 -10.0897 -10.0897 -7.8951 -7.8951 -7.8830 -7.8830 -7.1715 -7.1715 -6.9832 -6.9832 -6.0847 -6.0847 -6.0655 -6.0655 -5.8436 -5.8436 -5.3972 -5.3972 -5.1279 -5.1279 -4.3379 -4.3379 -4.2422 -4.2422 -4.0938 -4.0938 -2.4212 -2.4212 -2.2674 -2.2674 -1.9535 -1.9535 -1.6337 -1.6337 -1.4889 -1.4889 -1.2622 -1.2622 -0.8249 -0.8249 -0.7360 -0.7360 0.6493 0.6493 0.9272 0.9272 1.1784 1.1784 1.2712 1.2712 3.7667 3.7667 4.0451 4.0451 5.1278 5.1278 5.5617 5.5617 7.0731 7.0731 8.3073 8.3073 8.6569 8.6569 k = 0.0769 0.0501 0.0375 ( 7723 PWs) bands (ev): -19.6297 -19.6297 -19.5046 -19.5046 -17.4983 -17.4983 -17.4851 -17.4851 -16.4617 -16.4617 -16.3854 -16.3854 -13.7905 -13.7905 -13.7807 -13.7807 -10.9069 -10.9069 -10.7834 -10.7834 -10.1808 -10.1808 -10.0898 -10.0898 -7.8932 -7.8932 -7.8832 -7.8832 -7.1668 -7.1668 -6.9778 -6.9778 -6.0824 -6.0824 -6.0654 -6.0654 -5.8516 -5.8516 -5.3986 -5.3986 -5.1298 -5.1298 -4.3366 -4.3366 -4.2293 -4.2293 -4.0965 -4.0965 -2.4192 -2.4192 -2.2675 -2.2675 -1.9563 -1.9563 -1.6406 -1.6406 -1.4945 -1.4945 -1.2660 -1.2660 -0.8196 -0.8196 -0.7322 -0.7322 0.6473 0.6473 0.9266 0.9266 1.1778 1.1778 1.2672 1.2672 3.7618 3.7618 4.0499 4.0499 5.1300 5.1300 5.5644 5.5644 7.0469 7.0469 8.3161 8.3161 8.6468 8.6468 k = 0.0641 0.0417 0.0312 ( 7712 PWs) bands (ev): -19.6310 -19.6310 -19.5047 -19.5047 -17.4967 -17.4967 -17.4834 -17.4834 -16.4615 -16.4615 -16.3856 -16.3856 -13.7913 -13.7913 -13.7819 -13.7819 -10.9088 -10.9088 -10.7838 -10.7838 -10.1824 -10.1824 -10.0899 -10.0899 -7.8915 -7.8915 -7.8834 -7.8834 -7.1628 -7.1628 -6.9731 -6.9731 -6.0804 -6.0804 -6.0651 -6.0651 -5.8586 -5.8586 -5.3997 -5.3997 -5.1314 -5.1314 -4.3360 -4.3360 -4.2170 -4.2170 -4.0997 -4.0997 -2.4174 -2.4174 -2.2680 -2.2680 -1.9583 -1.9583 -1.6465 -1.6465 -1.4993 -1.4993 -1.2693 -1.2693 -0.8150 -0.8150 -0.7289 -0.7289 0.6457 0.6457 0.9260 0.9260 1.1770 1.1770 1.2641 1.2641 3.7575 3.7575 4.0541 4.0541 5.1318 5.1318 5.5668 5.5668 7.0247 7.0247 8.3243 8.3243 8.6375 8.6375 k = 0.0513 0.0334 0.0250 ( 7716 PWs) bands (ev): -19.6320 -19.6320 -19.5048 -19.5048 -17.4954 -17.4954 -17.4820 -17.4820 -16.4614 -16.4614 -16.3859 -16.3859 -13.7921 -13.7921 -13.7828 -13.7828 -10.9103 -10.9103 -10.7841 -10.7841 -10.1837 -10.1837 -10.0900 -10.0900 -7.8900 -7.8900 -7.8837 -7.8837 -7.1595 -7.1595 -6.9692 -6.9692 -6.0788 -6.0788 -6.0646 -6.0646 -5.8645 -5.8645 -5.4007 -5.4007 -5.1327 -5.1327 -4.3357 -4.3357 -4.2057 -4.2057 -4.1033 -4.1033 -2.4159 -2.4159 -2.2686 -2.2686 -1.9598 -1.9598 -1.6515 -1.6515 -1.5033 -1.5033 -1.2720 -1.2720 -0.8112 -0.8112 -0.7261 -0.7261 0.6444 0.6444 0.9255 0.9255 1.1760 1.1760 1.2617 1.2617 3.7539 3.7539 4.0576 4.0576 5.1333 5.1333 5.5688 5.5688 7.0064 7.0064 8.3317 8.3317 8.6293 8.6293 k = 0.0385 0.0250 0.0187 ( 7720 PWs) bands (ev): -19.6329 -19.6329 -19.5049 -19.5049 -17.4944 -17.4944 -17.4809 -17.4809 -16.4613 -16.4613 -16.3860 -16.3860 -13.7927 -13.7927 -13.7835 -13.7835 -10.9115 -10.9115 -10.7843 -10.7843 -10.1847 -10.1847 -10.0901 -10.0901 -7.8887 -7.8887 -7.8840 -7.8840 -7.1570 -7.1570 -6.9661 -6.9661 -6.0776 -6.0776 -6.0641 -6.0641 -5.8693 -5.8693 -5.4014 -5.4014 -5.1337 -5.1337 -4.3356 -4.3356 -4.1958 -4.1958 -4.1069 -4.1069 -2.4147 -2.4147 -2.2693 -2.2693 -1.9608 -1.9608 -1.6555 -1.6555 -1.5065 -1.5065 -1.2741 -1.2741 -0.8082 -0.8082 -0.7239 -0.7239 0.6434 0.6434 0.9251 0.9251 1.1752 1.1752 1.2600 1.2600 3.7510 3.7510 4.0604 4.0604 5.1345 5.1345 5.5704 5.5704 6.9920 6.9920 8.3379 8.3379 8.6224 8.6224 k = 0.0256 0.0167 0.0125 ( 7719 PWs) bands (ev): -19.6335 -19.6335 -19.5049 -19.5049 -17.4936 -17.4936 -17.4801 -17.4801 -16.4612 -16.4612 -16.3862 -16.3862 -13.7932 -13.7932 -13.7839 -13.7839 -10.9124 -10.9124 -10.7845 -10.7845 -10.1855 -10.1855 -10.0901 -10.0901 -7.8875 -7.8875 -7.8845 -7.8845 -7.1551 -7.1551 -6.9639 -6.9639 -6.0769 -6.0769 -6.0635 -6.0635 -5.8728 -5.8728 -5.4020 -5.4020 -5.1344 -5.1344 -4.3356 -4.3356 -4.1879 -4.1879 -4.1103 -4.1103 -2.4138 -2.4138 -2.2699 -2.2699 -1.9614 -1.9614 -1.6584 -1.6584 -1.5087 -1.5087 -1.2756 -1.2756 -0.8060 -0.8060 -0.7223 -0.7223 0.6426 0.6426 0.9249 0.9249 1.1745 1.1745 1.2588 1.2588 3.7489 3.7489 4.0624 4.0624 5.1353 5.1353 5.5715 5.5715 6.9818 6.9818 8.3426 8.3426 8.6172 8.6172 k = 0.0128 0.0083 0.0062 ( 7716 PWs) bands (ev): -19.6339 -19.6339 -19.5050 -19.5050 -17.4931 -17.4931 -17.4796 -17.4796 -16.4611 -16.4611 -16.3862 -16.3862 -13.7935 -13.7935 -13.7842 -13.7842 -10.9129 -10.9129 -10.7846 -10.7846 -10.1859 -10.1859 -10.0901 -10.0901 -7.8866 -7.8866 -7.8850 -7.8850 -7.1540 -7.1540 -6.9625 -6.9625 -6.0764 -6.0764 -6.0631 -6.0631 -5.8749 -5.8749 -5.4023 -5.4023 -5.1348 -5.1348 -4.3357 -4.3357 -4.1826 -4.1826 -4.1128 -4.1128 -2.4132 -2.4132 -2.2703 -2.2703 -1.9618 -1.9618 -1.6601 -1.6601 -1.5101 -1.5101 -1.2766 -1.2766 -0.8047 -0.8047 -0.7213 -0.7213 0.6422 0.6422 0.9247 0.9247 1.1741 1.1741 1.2582 1.2582 3.7476 3.7476 4.0636 4.0636 5.1358 5.1358 5.5722 5.5722 6.9756 6.9756 8.3456 8.3456 8.6140 8.6140 k = 0.0000 0.0000 0.0000 ( 7717 PWs) bands (ev): -19.6340 -19.6340 -19.5050 -19.5050 -17.4930 -17.4930 -17.4795 -17.4795 -16.4611 -16.4611 -16.3863 -16.3863 -13.7936 -13.7936 -13.7843 -13.7843 -10.9131 -10.9131 -10.7846 -10.7846 -10.1861 -10.1861 -10.0901 -10.0901 -7.8860 -7.8860 -7.8854 -7.8854 -7.1537 -7.1537 -6.9621 -6.9621 -6.0763 -6.0763 -6.0630 -6.0630 -5.8756 -5.8756 -5.4024 -5.4024 -5.1349 -5.1349 -4.3357 -4.3357 -4.1808 -4.1808 -4.1137 -4.1137 -2.4130 -2.4130 -2.2704 -2.2704 -1.9619 -1.9619 -1.6607 -1.6607 -1.5106 -1.5106 -1.2769 -1.2769 -0.8043 -0.8043 -0.7210 -0.7210 0.6421 0.6421 0.9246 0.9246 1.1739 1.1739 1.2580 1.2580 3.7472 3.7472 4.0640 4.0640 5.1360 5.1360 5.5725 5.5725 6.9736 6.9736 8.3466 8.3466 8.6129 8.6129 Writing output data file H4C3N4.save init_run : 0.93s CPU 0.64s WALL ( 1 calls) electrons : 436.29s CPU 333.97s WALL ( 1 calls) Called by init_run: wfcinit : 0.02s CPU 0.02s WALL ( 1 calls) potinit : 0.20s CPU 0.15s WALL ( 1 calls) Called by electrons: c_bands : 436.28s CPU 333.96s WALL ( 1 calls) v_of_rho : 0.03s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.03s CPU 0.02s WALL ( 1 calls) newd : 0.05s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.19s CPU 0.26s WALL ( 234 calls) cegterg : 366.09s CPU 294.16s WALL ( 445 calls) Called by sum_band: Called by *egterg: h_psi : 264.48s CPU 173.07s WALL ( 5980 calls) s_psi : 13.44s CPU 10.59s WALL ( 5980 calls) g_psi : 0.55s CPU 0.50s WALL ( 5301 calls) cdiaghg : 99.52s CPU 97.49s WALL ( 5535 calls) cegterg:over : 17.50s CPU 16.81s WALL ( 5301 calls) cegterg:upda : 14.68s CPU 13.96s WALL ( 5301 calls) cegterg:last : 7.14s CPU 7.08s WALL ( 913 calls) cdiaghg:chol : 5.62s CPU 5.72s WALL ( 5535 calls) cdiaghg:inve : 4.26s CPU 4.11s WALL ( 5535 calls) cdiaghg:para : 6.58s CPU 7.14s WALL ( 11070 calls) Called by h_psi: h_psi:vloc : 231.84s CPU 147.10s WALL ( 5980 calls) h_psi:vnl : 31.93s CPU 25.36s WALL ( 5980 calls) add_vuspsi : 15.15s CPU 11.94s WALL ( 5980 calls) General routines calbec : 16.74s CPU 13.40s WALL ( 5980 calls) fft : 0.04s CPU 0.03s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 217.83s CPU 135.64s WALL ( 990940 calls) interpolate : 0.02s CPU 0.01s WALL ( 4 calls) davcio : 0.50s CPU 1.71s WALL ( 468 calls) Parallel routines fft_scatter : 66.11s CPU 51.32s WALL ( 990963 calls) PWSCF : 7m43.98s CPU 6m34.46s WALL This run was terminated on: 19: 0:50 3Aug2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=