Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 17:35:29 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./CsHF2.save/ file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 86 86 23 2680 2680 388 Max 87 87 24 2682 2682 391 Sum 3105 3105 859 96495 96495 14055 bravais-lattice index = 14 lattice parameter (alat) = 11.0539 a.u. unit-cell volume = 997.2851 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.053879 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.449097 celldm(5)= -0.449097 celldm(6)= -0.101806 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.101806 0.994804 0.000000 ) a(3) = ( -0.449097 -0.497402 0.742228 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.102337 0.673647 ) b(2) = ( 0.000000 1.005223 0.673647 ) b(3) = ( 0.000000 0.000000 1.347294 ) 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 F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 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 Cs read from file: /users/gautes/Pseudo/Cs.rel-pbe-oncvpsp.UPF MD5 check sum: b26d75608c6aa7e713949ad9f7a49707 Pseudo is Norm-conserving, Zval = 9.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 2414 points, 14 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 3 l(12) = 3 l(13) = 3 l(14) = 3 atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) F 7.00 18.99840 F( 1.00) Cs 9.00 132.90550 Cs( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 1 1 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5509028 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.4974022 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( -1 -1 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5509028 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.4974022 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 291 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0000000 0.0000000 0.0182067), wk = 0.0034364 k( 3) = ( 0.0000000 0.0000000 0.0364134), wk = 0.0034364 k( 4) = ( 0.0000000 0.0000000 0.0546200), wk = 0.0034364 k( 5) = ( 0.0000000 0.0000000 0.0728267), wk = 0.0034364 k( 6) = ( 0.0000000 0.0000000 0.0910334), wk = 0.0034364 k( 7) = ( 0.0000000 0.0000000 0.1092401), wk = 0.0034364 k( 8) = ( 0.0000000 0.0000000 0.1274468), wk = 0.0034364 k( 9) = ( 0.0000000 0.0000000 0.1456535), wk = 0.0034364 k( 10) = ( 0.0000000 0.0000000 0.1638601), wk = 0.0034364 k( 11) = ( 0.0000000 0.0000000 0.1820668), wk = 0.0034364 k( 12) = ( 0.0000000 0.0000000 0.2002735), wk = 0.0034364 k( 13) = ( 0.0000000 0.0000000 0.2184802), wk = 0.0034364 k( 14) = ( 0.0000000 0.0000000 0.2366869), wk = 0.0034364 k( 15) = ( 0.0000000 0.0000000 0.2548935), wk = 0.0034364 k( 16) = ( 0.0000000 0.0000000 0.2731002), wk = 0.0034364 k( 17) = ( 0.0000000 0.0000000 0.2913069), wk = 0.0034364 k( 18) = ( 0.0000000 0.0000000 0.3095136), wk = 0.0034364 k( 19) = ( 0.0000000 0.0000000 0.3277203), wk = 0.0034364 k( 20) = ( 0.0000000 0.0000000 0.3459270), wk = 0.0034364 k( 21) = ( 0.0000000 0.0000000 0.3641336), wk = 0.0034364 k( 22) = ( 0.0000000 0.0000000 0.3823403), wk = 0.0034364 k( 23) = ( 0.0000000 0.0000000 0.4005470), wk = 0.0034364 k( 24) = ( 0.0000000 0.0000000 0.4187537), wk = 0.0034364 k( 25) = ( 0.0000000 0.0000000 0.4369604), wk = 0.0034364 k( 26) = ( 0.0000000 0.0000000 0.4551670), wk = 0.0034364 k( 27) = ( 0.0000000 0.0000000 0.4733737), wk = 0.0034364 k( 28) = ( 0.0000000 0.0000000 0.4915804), wk = 0.0034364 k( 29) = ( 0.0000000 0.0000000 0.5097871), wk = 0.0034364 k( 30) = ( 0.0000000 0.0000000 0.5279938), wk = 0.0034364 k( 31) = ( 0.0000000 0.0000000 0.5462005), wk = 0.0034364 k( 32) = ( 0.0000000 0.0000000 0.5644071), wk = 0.0034364 k( 33) = ( 0.0000000 0.0000000 0.5826138), wk = 0.0034364 k( 34) = ( 0.0000000 0.0000000 0.6008205), wk = 0.0034364 k( 35) = ( 0.0000000 0.0000000 0.6190272), wk = 0.0034364 k( 36) = ( 0.0000000 0.0000000 0.6372338), wk = 0.0034364 k( 37) = ( 0.0000000 0.0000000 0.6554405), wk = 0.0034364 k( 38) = ( 0.0000000 0.0000000 0.6736472), wk = 0.0034364 k( 39) = ( 0.0000000 0.0000000 0.6736472), wk = 0.0034364 k( 40) = ( -0.0133336 0.0120387 0.6736472), wk = 0.0034364 k( 41) = ( -0.0266672 0.0240774 0.6736472), wk = 0.0034364 k( 42) = ( -0.0400007 0.0361161 0.6736472), wk = 0.0034364 k( 43) = ( -0.0533343 0.0481548 0.6736472), wk = 0.0034364 k( 44) = ( -0.0666679 0.0601935 0.6736472), wk = 0.0034364 k( 45) = ( -0.0800015 0.0722322 0.6736472), wk = 0.0034364 k( 46) = ( -0.0933351 0.0842709 0.6736472), wk = 0.0034364 k( 47) = ( -0.1066686 0.0963096 0.6736472), wk = 0.0034364 k( 48) = ( -0.1200022 0.1083483 0.6736472), wk = 0.0034364 k( 49) = ( -0.1333358 0.1203870 0.6736472), wk = 0.0034364 k( 50) = ( -0.1466694 0.1324257 0.6736472), wk = 0.0034364 k( 51) = ( -0.1600030 0.1444644 0.6736472), wk = 0.0034364 k( 52) = ( -0.1733366 0.1565031 0.6736472), wk = 0.0034364 k( 53) = ( -0.1866701 0.1685418 0.6736472), wk = 0.0034364 k( 54) = ( -0.2000037 0.1805805 0.6736472), wk = 0.0034364 k( 55) = ( -0.2133373 0.1926192 0.6736472), wk = 0.0034364 k( 56) = ( -0.2266709 0.2046578 0.6736472), wk = 0.0034364 k( 57) = ( -0.2400045 0.2166965 0.6736472), wk = 0.0034364 k( 58) = ( -0.2533380 0.2287352 0.6736472), wk = 0.0034364 k( 59) = ( -0.2666716 0.2407739 0.6736472), wk = 0.0034364 k( 60) = ( -0.2800052 0.2528126 0.6736472), wk = 0.0034364 k( 61) = ( -0.2933388 0.2648513 0.6736472), wk = 0.0034364 k( 62) = ( -0.3066723 0.2768900 0.6736472), wk = 0.0034364 k( 63) = ( -0.3066723 0.2768900 0.6736472), wk = 0.0034364 k( 64) = ( -0.3163387 0.2856177 0.6606238), wk = 0.0034364 k( 65) = ( -0.3260051 0.2943453 0.6476003), wk = 0.0034364 k( 66) = ( -0.3356715 0.3030729 0.6345768), wk = 0.0034364 k( 67) = ( -0.3453379 0.3118006 0.6215534), wk = 0.0034364 k( 68) = ( -0.3550043 0.3205282 0.6085299), wk = 0.0034364 k( 69) = ( -0.3646706 0.3292559 0.5955064), wk = 0.0034364 k( 70) = ( -0.3743370 0.3379835 0.5824830), wk = 0.0034364 k( 71) = ( -0.3840034 0.3467111 0.5694595), wk = 0.0034364 k( 72) = ( -0.3936698 0.3554388 0.5564360), wk = 0.0034364 k( 73) = ( -0.4033362 0.3641664 0.5434126), wk = 0.0034364 k( 74) = ( -0.4033362 0.3641664 0.5434126), wk = 0.0034364 k( 75) = ( -0.3937329 0.3554958 0.5304742), wk = 0.0034364 k( 76) = ( -0.3841297 0.3468251 0.5175358), wk = 0.0034364 k( 77) = ( -0.3745265 0.3381545 0.5045974), wk = 0.0034364 k( 78) = ( -0.3649232 0.3294839 0.4916590), wk = 0.0034364 k( 79) = ( -0.3553200 0.3208133 0.4787206), wk = 0.0034364 k( 80) = ( -0.3457167 0.3121426 0.4657822), wk = 0.0034364 k( 81) = ( -0.3361135 0.3034720 0.4528438), wk = 0.0034364 k( 82) = ( -0.3265102 0.2948014 0.4399054), wk = 0.0034364 k( 83) = ( -0.3169070 0.2861307 0.4269670), wk = 0.0034364 k( 84) = ( -0.3073037 0.2774601 0.4140286), wk = 0.0034364 k( 85) = ( -0.2977005 0.2687895 0.4010902), wk = 0.0034364 k( 86) = ( -0.2880973 0.2601189 0.3881518), wk = 0.0034364 k( 87) = ( -0.2784940 0.2514482 0.3752135), wk = 0.0034364 k( 88) = ( -0.2688908 0.2427776 0.3622751), wk = 0.0034364 k( 89) = ( -0.2592875 0.2341070 0.3493367), wk = 0.0034364 k( 90) = ( -0.2496843 0.2254363 0.3363983), wk = 0.0034364 k( 91) = ( -0.2400811 0.2167657 0.3234599), wk = 0.0034364 k( 92) = ( -0.2304778 0.2080951 0.3105215), wk = 0.0034364 k( 93) = ( -0.2208746 0.1994245 0.2975831), wk = 0.0034364 k( 94) = ( -0.2112713 0.1907538 0.2846447), wk = 0.0034364 k( 95) = ( -0.2016681 0.1820832 0.2717063), wk = 0.0034364 k( 96) = ( -0.1920649 0.1734126 0.2587679), wk = 0.0034364 k( 97) = ( -0.1824616 0.1647419 0.2458295), wk = 0.0034364 k( 98) = ( -0.1728584 0.1560713 0.2328911), wk = 0.0034364 k( 99) = ( -0.1632551 0.1474007 0.2199527), wk = 0.0034364 k( 100) = ( -0.1536519 0.1387301 0.2070143), wk = 0.0034364 k( 101) = ( -0.1440486 0.1300594 0.1940759), wk = 0.0034364 k( 102) = ( -0.1344454 0.1213888 0.1811375), wk = 0.0034364 k( 103) = ( -0.1248421 0.1127182 0.1681991), wk = 0.0034364 k( 104) = ( -0.1152389 0.1040475 0.1552607), wk = 0.0034364 k( 105) = ( -0.1056357 0.0953769 0.1423223), wk = 0.0034364 k( 106) = ( -0.0960324 0.0867063 0.1293839), wk = 0.0034364 k( 107) = ( -0.0864292 0.0780357 0.1164456), wk = 0.0034364 k( 108) = ( -0.0768259 0.0693650 0.1035072), wk = 0.0034364 k( 109) = ( -0.0672227 0.0606944 0.0905688), wk = 0.0034364 k( 110) = ( -0.0576195 0.0520238 0.0776304), wk = 0.0034364 k( 111) = ( -0.0480162 0.0433531 0.0646920), wk = 0.0034364 k( 112) = ( -0.0384130 0.0346825 0.0517536), wk = 0.0034364 k( 113) = ( -0.0288097 0.0260119 0.0388152), wk = 0.0034364 k( 114) = ( -0.0192065 0.0173413 0.0258768), wk = 0.0034364 k( 115) = ( -0.0096032 0.0086706 0.0129384), wk = 0.0034364 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 118) = ( 0.0121951 0.0135068 -0.0000000), wk = 0.0034364 k( 119) = ( 0.0243902 0.0270137 -0.0000000), wk = 0.0034364 k( 120) = ( 0.0365854 0.0405205 -0.0000000), wk = 0.0034364 k( 121) = ( 0.0487805 0.0540273 0.0000000), wk = 0.0034364 k( 122) = ( 0.0609756 0.0675342 -0.0000000), wk = 0.0034364 k( 123) = ( 0.0731707 0.0810410 -0.0000000), wk = 0.0034364 k( 124) = ( 0.0853658 0.0945478 -0.0000000), wk = 0.0034364 k( 125) = ( 0.0975610 0.1080546 0.0000000), wk = 0.0034364 k( 126) = ( 0.1097561 0.1215615 -0.0000000), wk = 0.0034364 k( 127) = ( 0.1219512 0.1350683 -0.0000000), wk = 0.0034364 k( 128) = ( 0.1341463 0.1485751 -0.0000000), wk = 0.0034364 k( 129) = ( 0.1463415 0.1620820 -0.0000000), wk = 0.0034364 k( 130) = ( 0.1585366 0.1755888 -0.0000000), wk = 0.0034364 k( 131) = ( 0.1707317 0.1890956 -0.0000000), wk = 0.0034364 k( 132) = ( 0.1829268 0.2026025 -0.0000000), wk = 0.0034364 k( 133) = ( 0.1951219 0.2161093 -0.0000000), wk = 0.0034364 k( 134) = ( 0.2073171 0.2296161 -0.0000000), wk = 0.0034364 k( 135) = ( 0.2195122 0.2431230 -0.0000000), wk = 0.0034364 k( 136) = ( 0.2317073 0.2566298 -0.0000000), wk = 0.0034364 k( 137) = ( 0.2439024 0.2701366 -0.0000000), wk = 0.0034364 k( 138) = ( 0.2560976 0.2836434 -0.0000000), wk = 0.0034364 k( 139) = ( 0.2682927 0.2971503 -0.0000000), wk = 0.0034364 k( 140) = ( 0.2804878 0.3106571 -0.0000000), wk = 0.0034364 k( 141) = ( 0.2926829 0.3241639 -0.0000000), wk = 0.0034364 k( 142) = ( 0.3048781 0.3376708 -0.0000000), wk = 0.0034364 k( 143) = ( 0.3170732 0.3511776 -0.0000000), wk = 0.0034364 k( 144) = ( 0.3292683 0.3646844 -0.0000000), wk = 0.0034364 k( 145) = ( 0.3414634 0.3781913 -0.0000000), wk = 0.0034364 k( 146) = ( 0.3536585 0.3916981 -0.0000000), wk = 0.0034364 k( 147) = ( 0.3658537 0.4052049 -0.0000000), wk = 0.0034364 k( 148) = ( 0.3780488 0.4187117 -0.0000000), wk = 0.0034364 k( 149) = ( 0.3902439 0.4322186 -0.0000000), wk = 0.0034364 k( 150) = ( 0.4024390 0.4457254 -0.0000000), wk = 0.0034364 k( 151) = ( 0.4146341 0.4592322 -0.0000000), wk = 0.0034364 k( 152) = ( 0.4268293 0.4727391 -0.0000000), wk = 0.0034364 k( 153) = ( 0.4390244 0.4862459 -0.0000000), wk = 0.0034364 k( 154) = ( 0.4512195 0.4997527 -0.0000000), wk = 0.0034364 k( 155) = ( 0.4634146 0.5132596 -0.0000000), wk = 0.0034364 k( 156) = ( 0.4756098 0.5267664 -0.0000000), wk = 0.0034364 k( 157) = ( 0.4878049 0.5402732 -0.0000000), wk = 0.0034364 k( 158) = ( 0.5000000 0.5537801 -0.0000000), wk = 0.0034364 k( 159) = ( 0.5000000 0.5537801 -0.0000000), wk = 0.0034364 k( 160) = ( 0.4903336 0.5625077 0.0130235), wk = 0.0034364 k( 161) = ( 0.4806672 0.5712353 0.0260469), wk = 0.0034364 k( 162) = ( 0.4710009 0.5799630 0.0390704), wk = 0.0034364 k( 163) = ( 0.4613345 0.5886906 0.0520939), wk = 0.0034364 k( 164) = ( 0.4516681 0.5974182 0.0651173), wk = 0.0034364 k( 165) = ( 0.4420017 0.6061459 0.0781408), wk = 0.0034364 k( 166) = ( 0.4323353 0.6148735 0.0911642), wk = 0.0034364 k( 167) = ( 0.4226689 0.6236012 0.1041877), wk = 0.0034364 k( 168) = ( 0.4130026 0.6323288 0.1172112), wk = 0.0034364 k( 169) = ( 0.4033362 0.6410564 0.1302346), wk = 0.0034364 k( 170) = ( 0.4033362 0.6410564 0.1302346), wk = 0.0034364 k( 171) = ( 0.3878233 0.6357316 0.1381804), wk = 0.0034364 k( 172) = ( 0.3723103 0.6304068 0.1461261), wk = 0.0034364 k( 173) = ( 0.3567974 0.6250820 0.1540718), wk = 0.0034364 k( 174) = ( 0.3412845 0.6197572 0.1620176), wk = 0.0034364 k( 175) = ( 0.3257715 0.6144324 0.1699633), wk = 0.0034364 k( 176) = ( 0.3102586 0.6091076 0.1779090), wk = 0.0034364 k( 177) = ( 0.2947457 0.6037828 0.1858547), wk = 0.0034364 k( 178) = ( 0.2792327 0.5984580 0.1938005), wk = 0.0034364 k( 179) = ( 0.2637198 0.5931332 0.2017462), wk = 0.0034364 k( 180) = ( 0.2482069 0.5878083 0.2096919), wk = 0.0034364 k( 181) = ( 0.2326940 0.5824835 0.2176377), wk = 0.0034364 k( 182) = ( 0.2171810 0.5771587 0.2255834), wk = 0.0034364 k( 183) = ( 0.2016681 0.5718339 0.2335291), wk = 0.0034364 k( 184) = ( 0.1861552 0.5665091 0.2414748), wk = 0.0034364 k( 185) = ( 0.1706422 0.5611843 0.2494206), wk = 0.0034364 k( 186) = ( 0.1551293 0.5558595 0.2573663), wk = 0.0034364 k( 187) = ( 0.1396164 0.5505347 0.2653120), wk = 0.0034364 k( 188) = ( 0.1241034 0.5452099 0.2732578), wk = 0.0034364 k( 189) = ( 0.1085905 0.5398851 0.2812035), wk = 0.0034364 k( 190) = ( 0.0930776 0.5345603 0.2891492), wk = 0.0034364 k( 191) = ( 0.0775646 0.5292355 0.2970950), wk = 0.0034364 k( 192) = ( 0.0620517 0.5239106 0.3050407), wk = 0.0034364 k( 193) = ( 0.0465388 0.5185858 0.3129864), wk = 0.0034364 k( 194) = ( 0.0310259 0.5132610 0.3209321), wk = 0.0034364 k( 195) = ( 0.0155129 0.5079362 0.3288779), wk = 0.0034364 k( 196) = ( 0.0000000 0.5026114 0.3368236), wk = 0.0034364 k( 197) = ( 0.0000000 0.5026114 0.3368236), wk = 0.0034364 k( 198) = ( 0.0096154 0.4939298 0.3497784), wk = 0.0034364 k( 199) = ( 0.0192308 0.4852482 0.3627331), wk = 0.0034364 k( 200) = ( 0.0288462 0.4765666 0.3756879), wk = 0.0034364 k( 201) = ( 0.0384615 0.4678850 0.3886426), wk = 0.0034364 k( 202) = ( 0.0480769 0.4592035 0.4015974), wk = 0.0034364 k( 203) = ( 0.0576923 0.4505219 0.4145521), wk = 0.0034364 k( 204) = ( 0.0673077 0.4418403 0.4275069), wk = 0.0034364 k( 205) = ( 0.0769231 0.4331587 0.4404616), wk = 0.0034364 k( 206) = ( 0.0865385 0.4244771 0.4534164), wk = 0.0034364 k( 207) = ( 0.0961538 0.4157955 0.4663712), wk = 0.0034364 k( 208) = ( 0.1057692 0.4071139 0.4793259), wk = 0.0034364 k( 209) = ( 0.1153846 0.3984323 0.4922807), wk = 0.0034364 k( 210) = ( 0.1250000 0.3897507 0.5052354), wk = 0.0034364 k( 211) = ( 0.1346154 0.3810691 0.5181902), wk = 0.0034364 k( 212) = ( 0.1442308 0.3723875 0.5311449), wk = 0.0034364 k( 213) = ( 0.1538461 0.3637059 0.5440997), wk = 0.0034364 k( 214) = ( 0.1634615 0.3550244 0.5570544), wk = 0.0034364 k( 215) = ( 0.1730769 0.3463428 0.5700092), wk = 0.0034364 k( 216) = ( 0.1826923 0.3376612 0.5829639), wk = 0.0034364 k( 217) = ( 0.1923077 0.3289796 0.5959187), wk = 0.0034364 k( 218) = ( 0.2019231 0.3202980 0.6088734), wk = 0.0034364 k( 219) = ( 0.2115385 0.3116164 0.6218282), wk = 0.0034364 k( 220) = ( 0.2211539 0.3029348 0.6347830), wk = 0.0034364 k( 221) = ( 0.2307692 0.2942532 0.6477377), wk = 0.0034364 k( 222) = ( 0.2403846 0.2855716 0.6606925), wk = 0.0034364 k( 223) = ( 0.2500000 0.2768900 0.6736472), wk = 0.0034364 k( 224) = ( 0.2500000 0.2768900 0.6736472), wk = 0.0034364 k( 225) = ( 0.2583333 0.2861197 0.6598746), wk = 0.0034364 k( 226) = ( 0.2666667 0.2953494 0.6461020), wk = 0.0034364 k( 227) = ( 0.2750000 0.3045790 0.6323294), wk = 0.0034364 k( 228) = ( 0.2833333 0.3138087 0.6185568), wk = 0.0034364 k( 229) = ( 0.2916667 0.3230384 0.6047842), wk = 0.0034364 k( 230) = ( 0.3000000 0.3322680 0.5910116), wk = 0.0034364 k( 231) = ( 0.3083333 0.3414977 0.5772390), wk = 0.0034364 k( 232) = ( 0.3166667 0.3507274 0.5634664), wk = 0.0034364 k( 233) = ( 0.3250000 0.3599570 0.5496938), wk = 0.0034364 k( 234) = ( 0.3333333 0.3691867 0.5359212), wk = 0.0034364 k( 235) = ( 0.3416667 0.3784164 0.5221486), wk = 0.0034364 k( 236) = ( 0.3500000 0.3876460 0.5083760), wk = 0.0034364 k( 237) = ( 0.3583333 0.3968757 0.4946034), wk = 0.0034364 k( 238) = ( 0.3666667 0.4061054 0.4808308), wk = 0.0034364 k( 239) = ( 0.3750000 0.4153350 0.4670582), wk = 0.0034364 k( 240) = ( 0.3833333 0.4245647 0.4532856), wk = 0.0034364 k( 241) = ( 0.3916667 0.4337944 0.4395130), wk = 0.0034364 k( 242) = ( 0.4000000 0.4430240 0.4257404), wk = 0.0034364 k( 243) = ( 0.4083333 0.4522537 0.4119678), wk = 0.0034364 k( 244) = ( 0.4166667 0.4614834 0.3981953), wk = 0.0034364 k( 245) = ( 0.4250000 0.4707130 0.3844226), wk = 0.0034364 k( 246) = ( 0.4333333 0.4799427 0.3706500), wk = 0.0034364 k( 247) = ( 0.4416667 0.4891724 0.3568775), wk = 0.0034364 k( 248) = ( 0.4500000 0.4984021 0.3431049), wk = 0.0034364 k( 249) = ( 0.4583333 0.5076317 0.3293322), wk = 0.0034364 k( 250) = ( 0.4666667 0.5168614 0.3155597), wk = 0.0034364 k( 251) = ( 0.4750000 0.5260911 0.3017871), wk = 0.0034364 k( 252) = ( 0.4833333 0.5353207 0.2880145), wk = 0.0034364 k( 253) = ( 0.4916667 0.5445504 0.2742419), wk = 0.0034364 k( 254) = ( 0.5000000 0.5537801 0.2604693), wk = 0.0034364 k( 255) = ( 0.5000000 0.5537801 0.2604693), wk = 0.0034364 k( 256) = ( 0.5000000 0.5537801 0.2418643), wk = 0.0034364 k( 257) = ( 0.5000000 0.5537801 0.2232594), wk = 0.0034364 k( 258) = ( 0.5000000 0.5537801 0.2046544), wk = 0.0034364 k( 259) = ( 0.5000000 0.5537801 0.1860495), wk = 0.0034364 k( 260) = ( 0.5000000 0.5537801 0.1674445), wk = 0.0034364 k( 261) = ( 0.5000000 0.5537801 0.1488396), wk = 0.0034364 k( 262) = ( 0.5000000 0.5537801 0.1302346), wk = 0.0034364 k( 263) = ( 0.5000000 0.5537801 0.1116297), wk = 0.0034364 k( 264) = ( 0.5000000 0.5537801 0.0930247), wk = 0.0034364 k( 265) = ( 0.5000000 0.5537801 0.0744198), wk = 0.0034364 k( 266) = ( 0.5000000 0.5537801 0.0558148), wk = 0.0034364 k( 267) = ( 0.5000000 0.5537801 0.0372099), wk = 0.0034364 k( 268) = ( 0.5000000 0.5537801 0.0186050), wk = 0.0034364 k( 269) = ( 0.5000000 0.5537801 -0.0000000), wk = 0.0034364 k( 270) = ( 0.0000000 0.0000000 0.6736472), wk = 0.0034364 k( 271) = ( 0.0119048 0.0131852 0.6736472), wk = 0.0034364 k( 272) = ( 0.0238095 0.0263705 0.6736472), wk = 0.0034364 k( 273) = ( 0.0357143 0.0395557 0.6736472), wk = 0.0034364 k( 274) = ( 0.0476191 0.0527410 0.6736472), wk = 0.0034364 k( 275) = ( 0.0595238 0.0659262 0.6736472), wk = 0.0034364 k( 276) = ( 0.0714286 0.0791114 0.6736472), wk = 0.0034364 k( 277) = ( 0.0833333 0.0922967 0.6736472), wk = 0.0034364 k( 278) = ( 0.0952381 0.1054819 0.6736472), wk = 0.0034364 k( 279) = ( 0.1071429 0.1186672 0.6736472), wk = 0.0034364 k( 280) = ( 0.1190476 0.1318524 0.6736472), wk = 0.0034364 k( 281) = ( 0.1309524 0.1450376 0.6736472), wk = 0.0034364 k( 282) = ( 0.1428571 0.1582229 0.6736472), wk = 0.0034364 k( 283) = ( 0.1547619 0.1714081 0.6736472), wk = 0.0034364 k( 284) = ( 0.1666667 0.1845934 0.6736472), wk = 0.0034364 k( 285) = ( 0.1785714 0.1977786 0.6736472), wk = 0.0034364 k( 286) = ( 0.1904762 0.2109638 0.6736472), wk = 0.0034364 k( 287) = ( 0.2023810 0.2241491 0.6736472), wk = 0.0034364 k( 288) = ( 0.2142857 0.2373343 0.6736472), wk = 0.0034364 k( 289) = ( 0.2261905 0.2505196 0.6736472), wk = 0.0034364 k( 290) = ( 0.2380952 0.2637048 0.6736472), wk = 0.0034364 k( 291) = ( 0.2500000 0.2768900 0.6736472), wk = 0.0034364 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 2) = ( 0.0000000 0.0000000 0.0135135), wk = 0.0034364 k( 3) = ( 0.0000000 0.0000000 0.0270270), wk = 0.0034364 k( 4) = ( 0.0000000 0.0000000 0.0405405), wk = 0.0034364 k( 5) = ( 0.0000000 0.0000000 0.0540540), wk = 0.0034364 k( 6) = ( 0.0000000 0.0000000 0.0675676), wk = 0.0034364 k( 7) = ( 0.0000000 0.0000000 0.0810811), wk = 0.0034364 k( 8) = ( 0.0000000 0.0000000 0.0945946), wk = 0.0034364 k( 9) = ( 0.0000000 0.0000000 0.1081081), wk = 0.0034364 k( 10) = ( 0.0000000 0.0000000 0.1216216), wk = 0.0034364 k( 11) = ( 0.0000000 0.0000000 0.1351351), wk = 0.0034364 k( 12) = ( 0.0000000 0.0000000 0.1486486), wk = 0.0034364 k( 13) = ( 0.0000000 0.0000000 0.1621622), wk = 0.0034364 k( 14) = ( 0.0000000 0.0000000 0.1756757), wk = 0.0034364 k( 15) = ( 0.0000000 0.0000000 0.1891892), wk = 0.0034364 k( 16) = ( 0.0000000 0.0000000 0.2027027), wk = 0.0034364 k( 17) = ( 0.0000000 0.0000000 0.2162162), wk = 0.0034364 k( 18) = ( 0.0000000 0.0000000 0.2297297), wk = 0.0034364 k( 19) = ( 0.0000000 0.0000000 0.2432432), wk = 0.0034364 k( 20) = ( 0.0000000 0.0000000 0.2567568), wk = 0.0034364 k( 21) = ( 0.0000000 0.0000000 0.2702703), wk = 0.0034364 k( 22) = ( 0.0000000 0.0000000 0.2837838), wk = 0.0034364 k( 23) = ( 0.0000000 0.0000000 0.2972973), wk = 0.0034364 k( 24) = ( 0.0000000 0.0000000 0.3108108), wk = 0.0034364 k( 25) = ( 0.0000000 0.0000000 0.3243243), wk = 0.0034364 k( 26) = ( 0.0000000 0.0000000 0.3378378), wk = 0.0034364 k( 27) = ( 0.0000000 0.0000000 0.3513514), wk = 0.0034364 k( 28) = ( 0.0000000 0.0000000 0.3648649), wk = 0.0034364 k( 29) = ( 0.0000000 0.0000000 0.3783784), wk = 0.0034364 k( 30) = ( 0.0000000 0.0000000 0.3918919), wk = 0.0034364 k( 31) = ( 0.0000000 0.0000000 0.4054054), wk = 0.0034364 k( 32) = ( 0.0000000 0.0000000 0.4189189), wk = 0.0034364 k( 33) = ( 0.0000000 0.0000000 0.4324324), wk = 0.0034364 k( 34) = ( 0.0000000 0.0000000 0.4459459), wk = 0.0034364 k( 35) = ( 0.0000000 0.0000000 0.4594595), wk = 0.0034364 k( 36) = ( 0.0000000 0.0000000 0.4729730), wk = 0.0034364 k( 37) = ( 0.0000000 0.0000000 0.4864865), wk = 0.0034364 k( 38) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 39) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 40) = ( -0.0133336 0.0133336 0.5000000), wk = 0.0034364 k( 41) = ( -0.0266672 0.0266672 0.5000000), wk = 0.0034364 k( 42) = ( -0.0400007 0.0400007 0.5000000), wk = 0.0034364 k( 43) = ( -0.0533343 0.0533343 0.5000000), wk = 0.0034364 k( 44) = ( -0.0666679 0.0666679 0.5000000), wk = 0.0034364 k( 45) = ( -0.0800015 0.0800015 0.5000000), wk = 0.0034364 k( 46) = ( -0.0933351 0.0933351 0.5000000), wk = 0.0034364 k( 47) = ( -0.1066686 0.1066686 0.5000000), wk = 0.0034364 k( 48) = ( -0.1200022 0.1200022 0.5000000), wk = 0.0034364 k( 49) = ( -0.1333358 0.1333358 0.5000000), wk = 0.0034364 k( 50) = ( -0.1466694 0.1466694 0.5000000), wk = 0.0034364 k( 51) = ( -0.1600030 0.1600030 0.5000000), wk = 0.0034364 k( 52) = ( -0.1733366 0.1733366 0.5000000), wk = 0.0034364 k( 53) = ( -0.1866701 0.1866701 0.5000000), wk = 0.0034364 k( 54) = ( -0.2000037 0.2000037 0.5000000), wk = 0.0034364 k( 55) = ( -0.2133373 0.2133373 0.5000000), wk = 0.0034364 k( 56) = ( -0.2266709 0.2266709 0.5000000), wk = 0.0034364 k( 57) = ( -0.2400045 0.2400045 0.5000000), wk = 0.0034364 k( 58) = ( -0.2533380 0.2533380 0.5000000), wk = 0.0034364 k( 59) = ( -0.2666716 0.2666716 0.5000000), wk = 0.0034364 k( 60) = ( -0.2800052 0.2800052 0.5000000), wk = 0.0034364 k( 61) = ( -0.2933388 0.2933388 0.5000000), wk = 0.0034364 k( 62) = ( -0.3066723 0.3066723 0.5000000), wk = 0.0034364 k( 63) = ( -0.3066723 0.3066723 0.5000000), wk = 0.0034364 k( 64) = ( -0.3163387 0.3163387 0.4903336), wk = 0.0034364 k( 65) = ( -0.3260051 0.3260051 0.4806672), wk = 0.0034364 k( 66) = ( -0.3356715 0.3356715 0.4710009), wk = 0.0034364 k( 67) = ( -0.3453379 0.3453379 0.4613345), wk = 0.0034364 k( 68) = ( -0.3550043 0.3550043 0.4516681), wk = 0.0034364 k( 69) = ( -0.3646706 0.3646707 0.4420017), wk = 0.0034364 k( 70) = ( -0.3743370 0.3743370 0.4323353), wk = 0.0034364 k( 71) = ( -0.3840034 0.3840034 0.4226689), wk = 0.0034364 k( 72) = ( -0.3936698 0.3936698 0.4130026), wk = 0.0034364 k( 73) = ( -0.4033362 0.4033362 0.4033362), wk = 0.0034364 k( 74) = ( -0.4033362 0.4033362 0.4033362), wk = 0.0034364 k( 75) = ( -0.3937329 0.3937329 0.3937329), wk = 0.0034364 k( 76) = ( -0.3841297 0.3841297 0.3841297), wk = 0.0034364 k( 77) = ( -0.3745265 0.3745265 0.3745264), wk = 0.0034364 k( 78) = ( -0.3649232 0.3649232 0.3649232), wk = 0.0034364 k( 79) = ( -0.3553200 0.3553200 0.3553200), wk = 0.0034364 k( 80) = ( -0.3457167 0.3457167 0.3457167), wk = 0.0034364 k( 81) = ( -0.3361135 0.3361135 0.3361135), wk = 0.0034364 k( 82) = ( -0.3265102 0.3265102 0.3265102), wk = 0.0034364 k( 83) = ( -0.3169070 0.3169070 0.3169070), wk = 0.0034364 k( 84) = ( -0.3073037 0.3073038 0.3073037), wk = 0.0034364 k( 85) = ( -0.2977005 0.2977005 0.2977005), wk = 0.0034364 k( 86) = ( -0.2880973 0.2880973 0.2880973), wk = 0.0034364 k( 87) = ( -0.2784940 0.2784940 0.2784940), wk = 0.0034364 k( 88) = ( -0.2688908 0.2688908 0.2688908), wk = 0.0034364 k( 89) = ( -0.2592875 0.2592875 0.2592875), wk = 0.0034364 k( 90) = ( -0.2496843 0.2496843 0.2496843), wk = 0.0034364 k( 91) = ( -0.2400811 0.2400811 0.2400811), wk = 0.0034364 k( 92) = ( -0.2304778 0.2304778 0.2304778), wk = 0.0034364 k( 93) = ( -0.2208746 0.2208746 0.2208746), wk = 0.0034364 k( 94) = ( -0.2112713 0.2112713 0.2112713), wk = 0.0034364 k( 95) = ( -0.2016681 0.2016681 0.2016681), wk = 0.0034364 k( 96) = ( -0.1920649 0.1920649 0.1920648), wk = 0.0034364 k( 97) = ( -0.1824616 0.1824616 0.1824616), wk = 0.0034364 k( 98) = ( -0.1728584 0.1728584 0.1728584), wk = 0.0034364 k( 99) = ( -0.1632551 0.1632551 0.1632551), wk = 0.0034364 k( 100) = ( -0.1536519 0.1536519 0.1536519), wk = 0.0034364 k( 101) = ( -0.1440486 0.1440486 0.1440486), wk = 0.0034364 k( 102) = ( -0.1344454 0.1344454 0.1344454), wk = 0.0034364 k( 103) = ( -0.1248421 0.1248422 0.1248421), wk = 0.0034364 k( 104) = ( -0.1152389 0.1152389 0.1152389), wk = 0.0034364 k( 105) = ( -0.1056357 0.1056357 0.1056357), wk = 0.0034364 k( 106) = ( -0.0960324 0.0960324 0.0960324), wk = 0.0034364 k( 107) = ( -0.0864292 0.0864292 0.0864292), wk = 0.0034364 k( 108) = ( -0.0768259 0.0768259 0.0768259), wk = 0.0034364 k( 109) = ( -0.0672227 0.0672227 0.0672227), wk = 0.0034364 k( 110) = ( -0.0576195 0.0576195 0.0576195), wk = 0.0034364 k( 111) = ( -0.0480162 0.0480162 0.0480162), wk = 0.0034364 k( 112) = ( -0.0384130 0.0384130 0.0384130), wk = 0.0034364 k( 113) = ( -0.0288097 0.0288097 0.0288097), wk = 0.0034364 k( 114) = ( -0.0192065 0.0192065 0.0192065), wk = 0.0034364 k( 115) = ( -0.0096032 0.0096032 0.0096032), wk = 0.0034364 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0034364 k( 118) = ( 0.0121951 0.0121951 -0.0121951), wk = 0.0034364 k( 119) = ( 0.0243902 0.0243902 -0.0243902), wk = 0.0034364 k( 120) = ( 0.0365854 0.0365854 -0.0365854), wk = 0.0034364 k( 121) = ( 0.0487805 0.0487805 -0.0487805), wk = 0.0034364 k( 122) = ( 0.0609756 0.0609756 -0.0609756), wk = 0.0034364 k( 123) = ( 0.0731707 0.0731707 -0.0731707), wk = 0.0034364 k( 124) = ( 0.0853658 0.0853659 -0.0853659), wk = 0.0034364 k( 125) = ( 0.0975610 0.0975610 -0.0975610), wk = 0.0034364 k( 126) = ( 0.1097561 0.1097561 -0.1097561), wk = 0.0034364 k( 127) = ( 0.1219512 0.1219512 -0.1219512), wk = 0.0034364 k( 128) = ( 0.1341463 0.1341463 -0.1341463), wk = 0.0034364 k( 129) = ( 0.1463415 0.1463415 -0.1463415), wk = 0.0034364 k( 130) = ( 0.1585366 0.1585366 -0.1585366), wk = 0.0034364 k( 131) = ( 0.1707317 0.1707317 -0.1707317), wk = 0.0034364 k( 132) = ( 0.1829268 0.1829268 -0.1829268), wk = 0.0034364 k( 133) = ( 0.1951219 0.1951220 -0.1951219), wk = 0.0034364 k( 134) = ( 0.2073171 0.2073171 -0.2073171), wk = 0.0034364 k( 135) = ( 0.2195122 0.2195122 -0.2195122), wk = 0.0034364 k( 136) = ( 0.2317073 0.2317073 -0.2317073), wk = 0.0034364 k( 137) = ( 0.2439024 0.2439024 -0.2439024), wk = 0.0034364 k( 138) = ( 0.2560976 0.2560976 -0.2560976), wk = 0.0034364 k( 139) = ( 0.2682927 0.2682927 -0.2682927), wk = 0.0034364 k( 140) = ( 0.2804878 0.2804878 -0.2804878), wk = 0.0034364 k( 141) = ( 0.2926829 0.2926829 -0.2926829), wk = 0.0034364 k( 142) = ( 0.3048781 0.3048781 -0.3048780), wk = 0.0034364 k( 143) = ( 0.3170732 0.3170732 -0.3170732), wk = 0.0034364 k( 144) = ( 0.3292683 0.3292683 -0.3292683), wk = 0.0034364 k( 145) = ( 0.3414634 0.3414634 -0.3414634), wk = 0.0034364 k( 146) = ( 0.3536585 0.3536585 -0.3536585), wk = 0.0034364 k( 147) = ( 0.3658537 0.3658537 -0.3658537), wk = 0.0034364 k( 148) = ( 0.3780488 0.3780488 -0.3780488), wk = 0.0034364 k( 149) = ( 0.3902439 0.3902439 -0.3902439), wk = 0.0034364 k( 150) = ( 0.4024390 0.4024390 -0.4024390), wk = 0.0034364 k( 151) = ( 0.4146341 0.4146342 -0.4146341), wk = 0.0034364 k( 152) = ( 0.4268293 0.4268293 -0.4268293), wk = 0.0034364 k( 153) = ( 0.4390244 0.4390244 -0.4390244), wk = 0.0034364 k( 154) = ( 0.4512195 0.4512195 -0.4512195), wk = 0.0034364 k( 155) = ( 0.4634146 0.4634146 -0.4634146), wk = 0.0034364 k( 156) = ( 0.4756098 0.4756098 -0.4756098), wk = 0.0034364 k( 157) = ( 0.4878049 0.4878049 -0.4878049), wk = 0.0034364 k( 158) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034364 k( 159) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034364 k( 160) = ( 0.4903336 0.5096664 -0.4903336), wk = 0.0034364 k( 161) = ( 0.4806672 0.5193328 -0.4806672), wk = 0.0034364 k( 162) = ( 0.4710009 0.5289991 -0.4710008), wk = 0.0034364 k( 163) = ( 0.4613345 0.5386655 -0.4613345), wk = 0.0034364 k( 164) = ( 0.4516681 0.5483319 -0.4516681), wk = 0.0034364 k( 165) = ( 0.4420017 0.5579983 -0.4420017), wk = 0.0034364 k( 166) = ( 0.4323353 0.5676647 -0.4323353), wk = 0.0034364 k( 167) = ( 0.4226689 0.5773311 -0.4226689), wk = 0.0034364 k( 168) = ( 0.4130026 0.5869974 -0.4130026), wk = 0.0034364 k( 169) = ( 0.4033362 0.5966638 -0.4033362), wk = 0.0034364 k( 170) = ( 0.4033362 0.5966638 -0.4033362), wk = 0.0034364 k( 171) = ( 0.3878233 0.5929460 -0.3878233), wk = 0.0034364 k( 172) = ( 0.3723103 0.5892282 -0.3723103), wk = 0.0034364 k( 173) = ( 0.3567974 0.5855103 -0.3567974), wk = 0.0034364 k( 174) = ( 0.3412845 0.5817925 -0.3412845), wk = 0.0034364 k( 175) = ( 0.3257715 0.5780746 -0.3257715), wk = 0.0034364 k( 176) = ( 0.3102586 0.5743568 -0.3102586), wk = 0.0034364 k( 177) = ( 0.2947457 0.5706390 -0.2947457), wk = 0.0034364 k( 178) = ( 0.2792327 0.5669211 -0.2792327), wk = 0.0034364 k( 179) = ( 0.2637198 0.5632033 -0.2637198), wk = 0.0034364 k( 180) = ( 0.2482069 0.5594854 -0.2482069), wk = 0.0034364 k( 181) = ( 0.2326940 0.5557676 -0.2326940), wk = 0.0034364 k( 182) = ( 0.2171810 0.5520498 -0.2171810), wk = 0.0034364 k( 183) = ( 0.2016681 0.5483319 -0.2016681), wk = 0.0034364 k( 184) = ( 0.1861552 0.5446141 -0.1861552), wk = 0.0034364 k( 185) = ( 0.1706422 0.5408962 -0.1706422), wk = 0.0034364 k( 186) = ( 0.1551293 0.5371784 -0.1551293), wk = 0.0034364 k( 187) = ( 0.1396164 0.5334606 -0.1396164), wk = 0.0034364 k( 188) = ( 0.1241034 0.5297427 -0.1241034), wk = 0.0034364 k( 189) = ( 0.1085905 0.5260249 -0.1085905), wk = 0.0034364 k( 190) = ( 0.0930776 0.5223070 -0.0930776), wk = 0.0034364 k( 191) = ( 0.0775646 0.5185892 -0.0775647), wk = 0.0034364 k( 192) = ( 0.0620517 0.5148714 -0.0620517), wk = 0.0034364 k( 193) = ( 0.0465388 0.5111535 -0.0465388), wk = 0.0034364 k( 194) = ( 0.0310259 0.5074357 -0.0310259), wk = 0.0034364 k( 195) = ( 0.0155129 0.5037178 -0.0155129), wk = 0.0034364 k( 196) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034364 k( 197) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0034364 k( 198) = ( 0.0096154 0.4903846 0.0096154), wk = 0.0034364 k( 199) = ( 0.0192308 0.4807692 0.0192308), wk = 0.0034364 k( 200) = ( 0.0288462 0.4711539 0.0288461), wk = 0.0034364 k( 201) = ( 0.0384615 0.4615385 0.0384615), wk = 0.0034364 k( 202) = ( 0.0480769 0.4519231 0.0480769), wk = 0.0034364 k( 203) = ( 0.0576923 0.4423077 0.0576923), wk = 0.0034364 k( 204) = ( 0.0673077 0.4326923 0.0673077), wk = 0.0034364 k( 205) = ( 0.0769231 0.4230769 0.0769231), wk = 0.0034364 k( 206) = ( 0.0865385 0.4134615 0.0865385), wk = 0.0034364 k( 207) = ( 0.0961538 0.4038462 0.0961538), wk = 0.0034364 k( 208) = ( 0.1057692 0.3942308 0.1057692), wk = 0.0034364 k( 209) = ( 0.1153846 0.3846154 0.1153846), wk = 0.0034364 k( 210) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0034364 k( 211) = ( 0.1346154 0.3653846 0.1346154), wk = 0.0034364 k( 212) = ( 0.1442308 0.3557692 0.1442308), wk = 0.0034364 k( 213) = ( 0.1538461 0.3461539 0.1538462), wk = 0.0034364 k( 214) = ( 0.1634615 0.3365385 0.1634615), wk = 0.0034364 k( 215) = ( 0.1730769 0.3269231 0.1730769), wk = 0.0034364 k( 216) = ( 0.1826923 0.3173077 0.1826923), wk = 0.0034364 k( 217) = ( 0.1923077 0.3076923 0.1923077), wk = 0.0034364 k( 218) = ( 0.2019231 0.2980769 0.2019231), wk = 0.0034364 k( 219) = ( 0.2115385 0.2884615 0.2115385), wk = 0.0034364 k( 220) = ( 0.2211539 0.2788462 0.2211538), wk = 0.0034364 k( 221) = ( 0.2307692 0.2692308 0.2307692), wk = 0.0034364 k( 222) = ( 0.2403846 0.2596154 0.2403846), wk = 0.0034364 k( 223) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034364 k( 224) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034364 k( 225) = ( 0.2583333 0.2583333 0.2314442), wk = 0.0034364 k( 226) = ( 0.2666667 0.2666667 0.2128885), wk = 0.0034364 k( 227) = ( 0.2750000 0.2750000 0.1943328), wk = 0.0034364 k( 228) = ( 0.2833333 0.2833333 0.1757770), wk = 0.0034364 k( 229) = ( 0.2916667 0.2916667 0.1572213), wk = 0.0034364 k( 230) = ( 0.3000000 0.3000000 0.1386655), wk = 0.0034364 k( 231) = ( 0.3083333 0.3083333 0.1201098), wk = 0.0034364 k( 232) = ( 0.3166667 0.3166667 0.1015540), wk = 0.0034364 k( 233) = ( 0.3250000 0.3250000 0.0829983), wk = 0.0034364 k( 234) = ( 0.3333333 0.3333333 0.0644426), wk = 0.0034364 k( 235) = ( 0.3416667 0.3416667 0.0458868), wk = 0.0034364 k( 236) = ( 0.3500000 0.3500000 0.0273311), wk = 0.0034364 k( 237) = ( 0.3583333 0.3583333 0.0087753), wk = 0.0034364 k( 238) = ( 0.3666667 0.3666667 -0.0097804), wk = 0.0034364 k( 239) = ( 0.3750000 0.3750000 -0.0283362), wk = 0.0034364 k( 240) = ( 0.3833333 0.3833333 -0.0468919), wk = 0.0034364 k( 241) = ( 0.3916667 0.3916667 -0.0654477), wk = 0.0034364 k( 242) = ( 0.4000000 0.4000000 -0.0840034), wk = 0.0034364 k( 243) = ( 0.4083333 0.4083333 -0.1025592), wk = 0.0034364 k( 244) = ( 0.4166667 0.4166667 -0.1211149), wk = 0.0034364 k( 245) = ( 0.4250000 0.4250000 -0.1396707), wk = 0.0034364 k( 246) = ( 0.4333333 0.4333333 -0.1582264), wk = 0.0034364 k( 247) = ( 0.4416667 0.4416667 -0.1767821), wk = 0.0034364 k( 248) = ( 0.4500000 0.4500000 -0.1953379), wk = 0.0034364 k( 249) = ( 0.4583333 0.4583333 -0.2138936), wk = 0.0034364 k( 250) = ( 0.4666667 0.4666667 -0.2324494), wk = 0.0034364 k( 251) = ( 0.4750000 0.4750000 -0.2510051), wk = 0.0034364 k( 252) = ( 0.4833333 0.4833333 -0.2695609), wk = 0.0034364 k( 253) = ( 0.4916667 0.4916667 -0.2881166), wk = 0.0034364 k( 254) = ( 0.5000000 0.5000000 -0.3066723), wk = 0.0034364 k( 255) = ( 0.5000000 0.5000000 -0.3066723), wk = 0.0034364 k( 256) = ( 0.5000000 0.5000000 -0.3204815), wk = 0.0034364 k( 257) = ( 0.5000000 0.5000000 -0.3342906), wk = 0.0034364 k( 258) = ( 0.5000000 0.5000000 -0.3480997), wk = 0.0034364 k( 259) = ( 0.5000000 0.5000000 -0.3619088), wk = 0.0034364 k( 260) = ( 0.5000000 0.5000000 -0.3757179), wk = 0.0034364 k( 261) = ( 0.5000000 0.5000000 -0.3895271), wk = 0.0034364 k( 262) = ( 0.5000000 0.5000000 -0.4033362), wk = 0.0034364 k( 263) = ( 0.5000000 0.5000000 -0.4171453), wk = 0.0034364 k( 264) = ( 0.5000000 0.5000000 -0.4309544), wk = 0.0034364 k( 265) = ( 0.5000000 0.5000000 -0.4447635), wk = 0.0034364 k( 266) = ( 0.5000000 0.5000000 -0.4585727), wk = 0.0034364 k( 267) = ( 0.5000000 0.5000000 -0.4723818), wk = 0.0034364 k( 268) = ( 0.5000000 0.5000000 -0.4861909), wk = 0.0034364 k( 269) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0034364 k( 270) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0034364 k( 271) = ( 0.0119048 0.0119048 0.4880952), wk = 0.0034364 k( 272) = ( 0.0238095 0.0238095 0.4761905), wk = 0.0034364 k( 273) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0034364 k( 274) = ( 0.0476191 0.0476191 0.4523810), wk = 0.0034364 k( 275) = ( 0.0595238 0.0595238 0.4404762), wk = 0.0034364 k( 276) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0034364 k( 277) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0034364 k( 278) = ( 0.0952381 0.0952381 0.4047619), wk = 0.0034364 k( 279) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0034364 k( 280) = ( 0.1190476 0.1190476 0.3809524), wk = 0.0034364 k( 281) = ( 0.1309524 0.1309524 0.3690476), wk = 0.0034364 k( 282) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0034364 k( 283) = ( 0.1547619 0.1547619 0.3452381), wk = 0.0034364 k( 284) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0034364 k( 285) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0034364 k( 286) = ( 0.1904762 0.1904762 0.3095238), wk = 0.0034364 k( 287) = ( 0.2023810 0.2023810 0.2976191), wk = 0.0034364 k( 288) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0034364 k( 289) = ( 0.2261905 0.2261905 0.2738095), wk = 0.0034364 k( 290) = ( 0.2380952 0.2380952 0.2619048), wk = 0.0034364 k( 291) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0034364 Dense grid: 96495 G-vectors FFT dimensions: ( 64, 64, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.61 Mb ( 690, 58) NL pseudopotentials 0.97 Mb ( 345, 184) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.02 Mb ( 2681) G-vector shells 0.01 Mb ( 1235) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.44 Mb ( 690, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.33 Mb ( 184, 2, 58) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./CsHF2.save/charge-density.dat Starting wfc are 56 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.7 secs Computing kpt #: 2 total cpu time spent up to now is 4.9 secs Computing kpt #: 3 total cpu time spent up to now is 6.1 secs Computing kpt #: 4 total cpu time spent up to now is 7.4 secs Computing kpt #: 5 total cpu time spent up to now is 8.6 secs Computing kpt #: 6 total cpu time spent up to now is 9.9 secs Computing kpt #: 7 total cpu time spent up to now is 11.1 secs Computing kpt #: 8 total cpu time spent up to now is 12.3 secs Computing kpt #: 9 total cpu time spent up to now is 13.6 secs Computing kpt #: 10 total cpu time spent up to now is 14.8 secs Computing kpt #: 11 total cpu time spent up to now is 15.8 secs Computing kpt #: 12 total cpu time spent up to now is 16.7 secs Computing kpt #: 13 total cpu time spent up to now is 17.7 secs Computing kpt #: 14 total cpu time spent up to now is 18.7 secs Computing kpt #: 15 total cpu time spent up to now is 19.7 secs Computing kpt #: 16 total cpu time spent up to now is 20.6 secs Computing kpt #: 17 total cpu time spent up to now is 21.7 secs Computing kpt #: 18 total cpu time spent up to now is 22.7 secs Computing kpt #: 19 total cpu time spent up to now is 23.7 secs Computing kpt #: 20 total cpu time spent up to now is 24.7 secs Computing kpt #: 21 total cpu time spent up to now is 25.8 secs Computing kpt #: 22 total cpu time spent up to now is 26.8 secs Computing kpt #: 23 total cpu time spent up to now is 28.1 secs Computing kpt #: 24 total cpu time spent up to now is 29.3 secs Computing kpt #: 25 total cpu time spent up to now is 30.6 secs Computing kpt #: 26 total cpu time spent up to now is 31.7 secs Computing kpt #: 27 total cpu time spent up to now is 32.7 secs Computing kpt #: 28 total cpu time spent up to now is 33.8 secs Computing kpt #: 29 total cpu time spent up to now is 34.8 secs Computing kpt #: 30 total cpu time spent up to now is 35.8 secs Computing kpt #: 31 total cpu time spent up to now is 36.9 secs Computing kpt #: 32 total cpu time spent up to now is 37.9 secs Computing kpt #: 33 total cpu time spent up to now is 39.0 secs Computing kpt #: 34 total cpu time spent up to now is 40.0 secs Computing kpt #: 35 total cpu time spent up to now is 41.1 secs Computing kpt #: 36 total cpu time spent up to now is 42.1 secs Computing kpt #: 37 total cpu time spent up to now is 43.1 secs Computing kpt #: 38 total cpu time spent up to now is 44.1 secs Computing kpt #: 39 total cpu time spent up to now is 45.2 secs Computing kpt #: 40 total cpu time spent up to now is 46.2 secs Computing kpt #: 41 total cpu time spent up to now is 47.3 secs Computing kpt #: 42 total cpu time spent up to now is 48.4 secs Computing kpt #: 43 total cpu time spent up to now is 49.4 secs Computing kpt #: 44 total cpu time spent up to now is 50.5 secs Computing kpt #: 45 total cpu time spent up to now is 51.5 secs Computing kpt #: 46 total cpu time spent up to now is 52.5 secs Computing kpt #: 47 total cpu time spent up to now is 53.5 secs Computing kpt #: 48 total cpu time spent up to now is 54.5 secs Computing kpt #: 49 total cpu time spent up to now is 55.5 secs Computing kpt #: 50 total cpu time spent up to now is 56.5 secs Computing kpt #: 51 total cpu time spent up to now is 57.5 secs Computing kpt #: 52 total cpu time spent up to now is 58.5 secs Computing kpt #: 53 total cpu time spent up to now is 59.5 secs Computing kpt #: 54 total cpu time spent up to now is 60.5 secs Computing kpt #: 55 total cpu time spent up to now is 61.5 secs Computing kpt #: 56 total cpu time spent up to now is 62.6 secs Computing kpt #: 57 total cpu time spent up to now is 63.6 secs Computing kpt #: 58 total cpu time spent up to now is 64.9 secs Computing kpt #: 59 total cpu time spent up to now is 66.1 secs Computing kpt #: 60 total cpu time spent up to now is 67.4 secs Computing kpt #: 61 total cpu time spent up to now is 68.6 secs Computing kpt #: 62 total cpu time spent up to now is 69.7 secs Computing kpt #: 63 total cpu time spent up to now is 70.8 secs Computing kpt #: 64 total cpu time spent up to now is 71.8 secs Computing kpt #: 65 total cpu time spent up to now is 72.9 secs Computing kpt #: 66 total cpu time spent up to now is 73.9 secs Computing kpt #: 67 total cpu time spent up to now is 75.0 secs Computing kpt #: 68 total cpu time spent up to now is 76.1 secs Computing kpt #: 69 total cpu time spent up to now is 77.2 secs Computing kpt #: 70 total cpu time spent up to now is 78.3 secs Computing kpt #: 71 total cpu time spent up to now is 79.4 secs Computing kpt #: 72 total cpu time spent up to now is 80.6 secs Computing kpt #: 73 total cpu time spent up to now is 81.7 secs Computing kpt #: 74 total cpu time spent up to now is 82.8 secs Computing kpt #: 75 total cpu time spent up to now is 83.9 secs Computing kpt #: 76 total cpu time spent up to now is 85.1 secs Computing kpt #: 77 total cpu time spent up to now is 86.1 secs Computing kpt #: 78 total cpu time spent up to now is 87.2 secs Computing kpt #: 79 total cpu time spent up to now is 88.4 secs Computing kpt #: 80 total cpu time spent up to now is 89.6 secs Computing kpt #: 81 total cpu time spent up to now is 90.8 secs Computing kpt #: 82 total cpu time spent up to now is 92.1 secs Computing kpt #: 83 total cpu time spent up to now is 93.3 secs Computing kpt #: 84 total cpu time spent up to now is 94.6 secs Computing kpt #: 85 total cpu time spent up to now is 95.8 secs Computing kpt #: 86 total cpu time spent up to now is 97.1 secs Computing kpt #: 87 total cpu time spent up to now is 98.4 secs Computing kpt #: 88 total cpu time spent up to now is 99.6 secs Computing kpt #: 89 total cpu time spent up to now is 100.9 secs Computing kpt #: 90 total cpu time spent up to now is 102.4 secs Computing kpt #: 91 total cpu time spent up to now is 103.9 secs Computing kpt #: 92 total cpu time spent up to now is 105.2 secs Computing kpt #: 93 total cpu time spent up to now is 106.5 secs Computing kpt #: 94 total cpu time spent up to now is 107.7 secs Computing kpt #: 95 total cpu time spent up to now is 108.9 secs Computing kpt #: 96 total cpu time spent up to now is 110.2 secs Computing kpt #: 97 total cpu time spent up to now is 111.3 secs Computing kpt #: 98 total cpu time spent up to now is 112.5 secs Computing kpt #: 99 total cpu time spent up to now is 113.8 secs Computing kpt #: 100 total cpu time spent up to now is 115.0 secs Computing kpt #: 101 total cpu time spent up to now is 116.2 secs Computing kpt #: 102 total cpu time spent up to now is 117.4 secs Computing kpt #: 103 total cpu time spent up to now is 118.7 secs Computing kpt #: 104 total cpu time spent up to now is 119.9 secs Computing kpt #: 105 total cpu time spent up to now is 121.2 secs Computing kpt #: 106 total cpu time spent up to now is 122.4 secs Computing kpt #: 107 total cpu time spent up to now is 123.6 secs Computing kpt #: 108 total cpu time spent up to now is 124.8 secs Computing kpt #: 109 total cpu time spent up to now is 126.1 secs Computing kpt #: 110 total cpu time spent up to now is 127.3 secs Computing kpt #: 111 total cpu time spent up to now is 128.5 secs Computing kpt #: 112 total cpu time spent up to now is 129.8 secs Computing kpt #: 113 total cpu time spent up to now is 131.0 secs Computing kpt #: 114 total cpu time spent up to now is 132.3 secs Computing kpt #: 115 total cpu time spent up to now is 133.5 secs Computing kpt #: 116 total cpu time spent up to now is 134.7 secs Computing kpt #: 117 total cpu time spent up to now is 135.9 secs Computing kpt #: 118 total cpu time spent up to now is 137.2 secs Computing kpt #: 119 total cpu time spent up to now is 138.4 secs Computing kpt #: 120 total cpu time spent up to now is 139.7 secs Computing kpt #: 121 total cpu time spent up to now is 140.9 secs Computing kpt #: 122 total cpu time spent up to now is 142.1 secs Computing kpt #: 123 total cpu time spent up to now is 143.4 secs Computing kpt #: 124 total cpu time spent up to now is 144.6 secs Computing kpt #: 125 total cpu time spent up to now is 145.8 secs Computing kpt #: 126 total cpu time spent up to now is 146.9 secs Computing kpt #: 127 total cpu time spent up to now is 148.0 secs Computing kpt #: 128 total cpu time spent up to now is 149.2 secs Computing kpt #: 129 total cpu time spent up to now is 150.4 secs Computing kpt #: 130 total cpu time spent up to now is 151.7 secs Computing kpt #: 131 total cpu time spent up to now is 152.9 secs Computing kpt #: 132 total cpu time spent up to now is 154.2 secs Computing kpt #: 133 total cpu time spent up to now is 155.4 secs Computing kpt #: 134 total cpu time spent up to now is 156.7 secs Computing kpt #: 135 total cpu time spent up to now is 158.0 secs Computing kpt #: 136 total cpu time spent up to now is 159.3 secs Computing kpt #: 137 total cpu time spent up to now is 160.5 secs Computing kpt #: 138 total cpu time spent up to now is 161.8 secs Computing kpt #: 139 total cpu time spent up to now is 163.1 secs Computing kpt #: 140 total cpu time spent up to now is 164.5 secs Computing kpt #: 141 total cpu time spent up to now is 165.8 secs Computing kpt #: 142 total cpu time spent up to now is 167.1 secs Computing kpt #: 143 total cpu time spent up to now is 168.7 secs Computing kpt #: 144 total cpu time spent up to now is 170.3 secs Computing kpt #: 145 total cpu time spent up to now is 172.0 secs Computing kpt #: 146 total cpu time spent up to now is 173.8 secs Computing kpt #: 147 total cpu time spent up to now is 175.4 secs Computing kpt #: 148 total cpu time spent up to now is 177.0 secs Computing kpt #: 149 total cpu time spent up to now is 178.6 secs Computing kpt #: 150 total cpu time spent up to now is 180.3 secs Computing kpt #: 151 total cpu time spent up to now is 181.9 secs Computing kpt #: 152 total cpu time spent up to now is 183.5 secs Computing kpt #: 153 total cpu time spent up to now is 185.1 secs Computing kpt #: 154 total cpu time spent up to now is 186.7 secs Computing kpt #: 155 total cpu time spent up to now is 188.3 secs Computing kpt #: 156 total cpu time spent up to now is 189.9 secs Computing kpt #: 157 total cpu time spent up to now is 191.5 secs Computing kpt #: 158 total cpu time spent up to now is 193.1 secs Computing kpt #: 159 total cpu time spent up to now is 194.8 secs Computing kpt #: 160 total cpu time spent up to now is 196.1 secs Computing kpt #: 161 total cpu time spent up to now is 197.3 secs Computing kpt #: 162 total cpu time spent up to now is 198.5 secs Computing kpt #: 163 total cpu time spent up to now is 199.6 secs Computing kpt #: 164 total cpu time spent up to now is 200.6 secs Computing kpt #: 165 total cpu time spent up to now is 201.7 secs Computing kpt #: 166 total cpu time spent up to now is 202.7 secs Computing kpt #: 167 total cpu time spent up to now is 203.8 secs Computing kpt #: 168 total cpu time spent up to now is 205.0 secs Computing kpt #: 169 total cpu time spent up to now is 206.1 secs Computing kpt #: 170 total cpu time spent up to now is 207.2 secs Computing kpt #: 171 total cpu time spent up to now is 208.2 secs Computing kpt #: 172 total cpu time spent up to now is 209.3 secs Computing kpt #: 173 total cpu time spent up to now is 210.4 secs Computing kpt #: 174 total cpu time spent up to now is 211.4 secs Computing kpt #: 175 total cpu time spent up to now is 212.5 secs Computing kpt #: 176 total cpu time spent up to now is 213.5 secs Computing kpt #: 177 total cpu time spent up to now is 214.6 secs Computing kpt #: 178 total cpu time spent up to now is 215.6 secs Computing kpt #: 179 total cpu time spent up to now is 216.7 secs Computing kpt #: 180 total cpu time spent up to now is 217.7 secs Computing kpt #: 181 total cpu time spent up to now is 218.8 secs Computing kpt #: 182 total cpu time spent up to now is 219.8 secs Computing kpt #: 183 total cpu time spent up to now is 220.9 secs Computing kpt #: 184 total cpu time spent up to now is 222.0 secs Computing kpt #: 185 total cpu time spent up to now is 223.3 secs Computing kpt #: 186 total cpu time spent up to now is 224.5 secs Computing kpt #: 187 total cpu time spent up to now is 225.8 secs Computing kpt #: 188 total cpu time spent up to now is 227.1 secs Computing kpt #: 189 total cpu time spent up to now is 228.4 secs Computing kpt #: 190 total cpu time spent up to now is 229.8 secs Computing kpt #: 191 total cpu time spent up to now is 231.1 secs Computing kpt #: 192 total cpu time spent up to now is 232.5 secs Computing kpt #: 193 total cpu time spent up to now is 233.8 secs Computing kpt #: 194 total cpu time spent up to now is 235.2 secs Computing kpt #: 195 total cpu time spent up to now is 236.6 secs Computing kpt #: 196 total cpu time spent up to now is 237.8 secs Computing kpt #: 197 total cpu time spent up to now is 239.1 secs Computing kpt #: 198 total cpu time spent up to now is 240.9 secs Computing kpt #: 199 total cpu time spent up to now is 242.2 secs Computing kpt #: 200 total cpu time spent up to now is 243.6 secs Computing kpt #: 201 total cpu time spent up to now is 244.9 secs Computing kpt #: 202 total cpu time spent up to now is 246.2 secs Computing kpt #: 203 total cpu time spent up to now is 247.5 secs Computing kpt #: 204 total cpu time spent up to now is 248.8 secs Computing kpt #: 205 total cpu time spent up to now is 250.1 secs Computing kpt #: 206 total cpu time spent up to now is 251.4 secs Computing kpt #: 207 total cpu time spent up to now is 252.8 secs Computing kpt #: 208 total cpu time spent up to now is 254.1 secs Computing kpt #: 209 total cpu time spent up to now is 255.2 secs Computing kpt #: 210 total cpu time spent up to now is 256.5 secs Computing kpt #: 211 total cpu time spent up to now is 257.7 secs Computing kpt #: 212 total cpu time spent up to now is 259.0 secs Computing kpt #: 213 total cpu time spent up to now is 260.4 secs Computing kpt #: 214 total cpu time spent up to now is 261.7 secs Computing kpt #: 215 total cpu time spent up to now is 263.0 secs Computing kpt #: 216 total cpu time spent up to now is 264.4 secs Computing kpt #: 217 total cpu time spent up to now is 266.4 secs Computing kpt #: 218 total cpu time spent up to now is 268.7 secs Computing kpt #: 219 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 271.5 secs Computing kpt #: 220 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 274.4 secs Computing kpt #: 221 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 277.3 secs Computing kpt #: 222 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 280.2 secs Computing kpt #: 223 total cpu time spent up to now is 281.4 secs Computing kpt #: 224 total cpu time spent up to now is 282.7 secs Computing kpt #: 225 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 285.6 secs Computing kpt #: 226 total cpu time spent up to now is 288.2 secs Computing kpt #: 227 total cpu time spent up to now is 289.8 secs Computing kpt #: 228 total cpu time spent up to now is 291.2 secs Computing kpt #: 229 total cpu time spent up to now is 292.5 secs Computing kpt #: 230 total cpu time spent up to now is 293.7 secs Computing kpt #: 231 total cpu time spent up to now is 295.0 secs Computing kpt #: 232 total cpu time spent up to now is 296.2 secs Computing kpt #: 233 total cpu time spent up to now is 297.5 secs Computing kpt #: 234 total cpu time spent up to now is 298.8 secs Computing kpt #: 235 total cpu time spent up to now is 300.0 secs Computing kpt #: 236 total cpu time spent up to now is 301.3 secs Computing kpt #: 237 total cpu time spent up to now is 302.5 secs Computing kpt #: 238 total cpu time spent up to now is 303.6 secs Computing kpt #: 239 total cpu time spent up to now is 304.7 secs Computing kpt #: 240 total cpu time spent up to now is 305.7 secs Computing kpt #: 241 total cpu time spent up to now is 306.7 secs Computing kpt #: 242 total cpu time spent up to now is 307.8 secs Computing kpt #: 243 total cpu time spent up to now is 308.8 secs Computing kpt #: 244 total cpu time spent up to now is 309.9 secs Computing kpt #: 245 total cpu time spent up to now is 310.9 secs Computing kpt #: 246 total cpu time spent up to now is 312.0 secs Computing kpt #: 247 total cpu time spent up to now is 313.0 secs Computing kpt #: 248 total cpu time spent up to now is 314.1 secs Computing kpt #: 249 total cpu time spent up to now is 315.4 secs Computing kpt #: 250 total cpu time spent up to now is 316.6 secs Computing kpt #: 251 total cpu time spent up to now is 317.9 secs Computing kpt #: 252 total cpu time spent up to now is 319.1 secs Computing kpt #: 253 total cpu time spent up to now is 320.2 secs Computing kpt #: 254 total cpu time spent up to now is 321.3 secs Computing kpt #: 255 total cpu time spent up to now is 322.4 secs Computing kpt #: 256 total cpu time spent up to now is 323.4 secs Computing kpt #: 257 total cpu time spent up to now is 324.4 secs Computing kpt #: 258 total cpu time spent up to now is 325.5 secs Computing kpt #: 259 total cpu time spent up to now is 326.5 secs Computing kpt #: 260 total cpu time spent up to now is 327.6 secs Computing kpt #: 261 total cpu time spent up to now is 328.6 secs Computing kpt #: 262 total cpu time spent up to now is 329.6 secs Computing kpt #: 263 total cpu time spent up to now is 330.7 secs Computing kpt #: 264 total cpu time spent up to now is 331.8 secs Computing kpt #: 265 total cpu time spent up to now is 332.8 secs Computing kpt #: 266 total cpu time spent up to now is 334.1 secs Computing kpt #: 267 total cpu time spent up to now is 335.3 secs Computing kpt #: 268 total cpu time spent up to now is 336.6 secs Computing kpt #: 269 total cpu time spent up to now is 338.2 secs Computing kpt #: 270 total cpu time spent up to now is 339.2 secs Computing kpt #: 271 total cpu time spent up to now is 340.2 secs Computing kpt #: 272 total cpu time spent up to now is 341.2 secs Computing kpt #: 273 total cpu time spent up to now is 342.2 secs Computing kpt #: 274 total cpu time spent up to now is 343.2 secs Computing kpt #: 275 total cpu time spent up to now is 344.3 secs Computing kpt #: 276 total cpu time spent up to now is 345.3 secs Computing kpt #: 277 total cpu time spent up to now is 346.4 secs Computing kpt #: 278 total cpu time spent up to now is 347.4 secs Computing kpt #: 279 total cpu time spent up to now is 348.4 secs Computing kpt #: 280 total cpu time spent up to now is 349.5 secs Computing kpt #: 281 total cpu time spent up to now is 350.6 secs Computing kpt #: 282 total cpu time spent up to now is 351.7 secs Computing kpt #: 283 total cpu time spent up to now is 352.7 secs Computing kpt #: 284 total cpu time spent up to now is 353.8 secs Computing kpt #: 285 total cpu time spent up to now is 355.0 secs Computing kpt #: 286 total cpu time spent up to now is 356.3 secs Computing kpt #: 287 total cpu time spent up to now is 357.6 secs Computing kpt #: 288 total cpu time spent up to now is 358.9 secs Computing kpt #: 289 total cpu time spent up to now is 360.6 secs Computing kpt #: 290 total cpu time spent up to now is 363.4 secs Computing kpt #: 291 total cpu time spent up to now is 364.6 secs ethr = 2.08E-08, avg # of iterations = 26.1 total cpu time spent up to now is 364.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12089 PWs) bands (ev): -19.6887 -19.6887 -19.5798 -19.5798 -18.3548 -18.3548 -18.3539 -18.3539 -15.3613 -15.3613 -15.1818 -15.1818 -4.5111 -4.5111 -3.9407 -3.9407 -3.8343 -3.8343 -3.6010 -3.6010 -3.3306 -3.3306 -3.0318 -3.0318 -2.6523 -2.6523 -2.4096 -2.4096 -0.3112 -0.3112 -0.1292 -0.1292 -0.0684 -0.0684 0.2649 0.2649 0.5463 0.5463 0.5951 0.5951 0.6185 0.6185 0.7524 0.7524 0.8730 0.8730 0.9680 0.9680 7.6060 7.6060 8.7147 8.7147 9.0837 9.0837 9.5859 9.5859 10.2660 10.2660 k = 0.0000 0.0000 0.0182 ( 12081 PWs) bands (ev): -19.6886 -19.6886 -19.5799 -19.5799 -18.3548 -18.3548 -18.3539 -18.3539 -15.3613 -15.3613 -15.1819 -15.1819 -4.5110 -4.5110 -3.9423 -3.9423 -3.8330 -3.8330 -3.6012 -3.6012 -3.3304 -3.3304 -3.0314 -3.0314 -2.6522 -2.6522 -2.4093 -2.4093 -0.3104 -0.3104 -0.1289 -0.1289 -0.0682 -0.0682 0.2643 0.2643 0.5455 0.5455 0.5935 0.5935 0.6200 0.6200 0.7521 0.7521 0.8727 0.8727 0.9674 0.9674 7.6092 7.6092 8.7157 8.7157 9.0857 9.0857 9.5874 9.5874 10.2657 10.2657 k = 0.0000 0.0000 0.0364 ( 12077 PWs) bands (ev): -19.6883 -19.6883 -19.5801 -19.5801 -18.3548 -18.3548 -18.3541 -18.3541 -15.3611 -15.3611 -15.1822 -15.1822 -4.5104 -4.5104 -3.9469 -3.9469 -3.8293 -3.8293 -3.6017 -3.6017 -3.3298 -3.3298 -3.0303 -3.0303 -2.6518 -2.6518 -2.4083 -2.4083 -0.3082 -0.3082 -0.1279 -0.1279 -0.0676 -0.0676 0.2626 0.2626 0.5429 0.5429 0.5892 0.5892 0.6236 0.6236 0.7515 0.7515 0.8717 0.8717 0.9658 0.9658 7.6187 7.6187 8.7189 8.7189 9.0916 9.0916 9.5920 9.5920 10.2631 10.2631 k = 0.0000 0.0000 0.0546 ( 12071 PWs) bands (ev): -19.6878 -19.6878 -19.5804 -19.5804 -18.3549 -18.3549 -18.3543 -18.3543 -15.3609 -15.3609 -15.1826 -15.1826 -4.5095 -4.5095 -3.9540 -3.9540 -3.8238 -3.8238 -3.6026 -3.6026 -3.3288 -3.3288 -3.0283 -3.0283 -2.6512 -2.6512 -2.4068 -2.4068 -0.3046 -0.3046 -0.1262 -0.1262 -0.0665 -0.0665 0.2598 0.2598 0.5387 0.5387 0.5833 0.5833 0.6285 0.6285 0.7504 0.7504 0.8702 0.8702 0.9631 0.9631 7.6345 7.6345 8.7241 8.7241 9.1014 9.1014 9.5996 9.5996 10.2554 10.2554 k = 0.0000 0.0000 0.0728 ( 12067 PWs) bands (ev): -19.6870 -19.6870 -19.5808 -19.5808 -18.3549 -18.3549 -18.3546 -18.3546 -15.3605 -15.3605 -15.1833 -15.1833 -4.5083 -4.5083 -3.9630 -3.9630 -3.8171 -3.8171 -3.6038 -3.6038 -3.3276 -3.3276 -3.0255 -3.0255 -2.6504 -2.6504 -2.4047 -2.4047 -0.2995 -0.2995 -0.1239 -0.1239 -0.0650 -0.0650 0.2559 0.2559 0.5329 0.5329 0.5763 0.5763 0.6341 0.6341 0.7488 0.7488 0.8680 0.8680 0.9593 0.9593 7.6564 7.6564 8.7313 8.7313 9.1153 9.1153 9.6103 9.6103 10.2417 10.2417 k = 0.0000 0.0000 0.0910 ( 12063 PWs) bands (ev): -19.6861 -19.6861 -19.5814 -19.5814 -18.3550 -18.3550 -18.3549 -18.3549 -15.3601 -15.3601 -15.1841 -15.1841 -4.5067 -4.5067 -3.9734 -3.9734 -3.8096 -3.8096 -3.6053 -3.6053 -3.3261 -3.3261 -3.0217 -3.0217 -2.6494 -2.6494 -2.4020 -2.4020 -0.2930 -0.2930 -0.1212 -0.1212 -0.0629 -0.0629 0.2509 0.2509 0.5254 0.5254 0.5687 0.5687 0.6401 0.6401 0.7466 0.7466 0.8653 0.8653 0.9544 0.9544 7.6842 7.6842 8.7405 8.7405 9.1334 9.1334 9.6241 9.6241 10.2230 10.2230 k = 0.0000 0.0000 0.1092 ( 12061 PWs) bands (ev): -19.6849 -19.6849 -19.5821 -19.5821 -18.3554 -18.3554 -18.3550 -18.3550 -15.3595 -15.3595 -15.1851 -15.1851 -4.5048 -4.5048 -3.9848 -3.9848 -3.8017 -3.8017 -3.6070 -3.6070 -3.3245 -3.3245 -3.0168 -3.0168 -2.6482 -2.6482 -2.3987 -2.3987 -0.2852 -0.2852 -0.1181 -0.1181 -0.0603 -0.0603 0.2450 0.2450 0.5160 0.5160 0.5611 0.5611 0.6465 0.6465 0.7439 0.7439 0.8621 0.8621 0.9484 0.9484 7.7176 7.7176 8.7514 8.7514 9.1556 9.1556 9.6409 9.6409 10.2000 10.2000 k = 0.0000 0.0000 0.1274 ( 12055 PWs) bands (ev): -19.6836 -19.6836 -19.5829 -19.5829 -18.3559 -18.3559 -18.3551 -18.3551 -15.3589 -15.3589 -15.1862 -15.1862 -4.5026 -4.5026 -3.9970 -3.9970 -3.7938 -3.7938 -3.6089 -3.6089 -3.3229 -3.3229 -3.0106 -3.0106 -2.6468 -2.6468 -2.3949 -2.3949 -0.2762 -0.2762 -0.1146 -0.1146 -0.0572 -0.0572 0.2383 0.2383 0.5046 0.5046 0.5536 0.5536 0.6530 0.6530 0.7405 0.7405 0.8583 0.8583 0.9415 0.9415 7.7562 7.7562 8.7641 8.7641 9.1823 9.1823 9.6609 9.6609 10.1731 10.1731 k = 0.0000 0.0000 0.1457 ( 12051 PWs) bands (ev): -19.6821 -19.6821 -19.5838 -19.5838 -18.3566 -18.3566 -18.3551 -18.3551 -15.3581 -15.3581 -15.1875 -15.1875 -4.5002 -4.5002 -4.0098 -4.0098 -3.7859 -3.7859 -3.6108 -3.6108 -3.3215 -3.3215 -3.0031 -3.0031 -2.6453 -2.6453 -2.3906 -2.3906 -0.2660 -0.2660 -0.1109 -0.1109 -0.0535 -0.0535 0.2307 0.2307 0.4913 0.4913 0.5467 0.5467 0.6595 0.6595 0.7364 0.7364 0.8541 0.8541 0.9335 0.9335 7.7996 7.7996 8.7785 8.7785 9.2133 9.2133 9.6839 9.6839 10.1429 10.1429 k = 0.0000 0.0000 0.1639 ( 12043 PWs) bands (ev): -19.6804 -19.6804 -19.5848 -19.5848 -18.3573 -18.3573 -18.3552 -18.3552 -15.3573 -15.3573 -15.1889 -15.1889 -4.4976 -4.4976 -4.0231 -4.0231 -3.7782 -3.7782 -3.6128 -3.6128 -3.3202 -3.3202 -2.9942 -2.9942 -2.6437 -2.6437 -2.3857 -2.3857 -0.2548 -0.2548 -0.1070 -0.1070 -0.0493 -0.0493 0.2226 0.2226 0.4764 0.4764 0.5403 0.5403 0.6660 0.6660 0.7316 0.7316 0.8496 0.8496 0.9246 0.9246 7.8473 7.8473 8.7945 8.7945 9.2488 9.2488 9.7100 9.7100 10.1096 10.1096 k = 0.0000 0.0000 0.1821 ( 12043 PWs) bands (ev): -19.6786 -19.6786 -19.5858 -19.5858 -18.3580 -18.3580 -18.3553 -18.3553 -15.3564 -15.3564 -15.1905 -15.1905 -4.4948 -4.4948 -4.0368 -4.0368 -3.7709 -3.7709 -3.6147 -3.6147 -3.3193 -3.3193 -2.9837 -2.9837 -2.6420 -2.6420 -2.3805 -2.3805 -0.2426 -0.2426 -0.1029 -0.1029 -0.0449 -0.0449 0.2138 0.2138 0.4603 0.4603 0.5343 0.5343 0.6724 0.6724 0.7260 0.7260 0.8447 0.8447 0.9148 0.9148 7.8989 7.8989 8.8121 8.8121 9.2888 9.2888 9.7392 9.7392 10.0738 10.0738 k = 0.0000 0.0000 0.2003 ( 12039 PWs) bands (ev): -19.6766 -19.6766 -19.5870 -19.5870 -18.3589 -18.3589 -18.3554 -18.3554 -15.3555 -15.3555 -15.1922 -15.1922 -4.4918 -4.4918 -4.0507 -4.0507 -3.7640 -3.7640 -3.6163 -3.6163 -3.3189 -3.3189 -2.9716 -2.9716 -2.6402 -2.6402 -2.3748 -2.3748 -0.2296 -0.2296 -0.0986 -0.0986 -0.0405 -0.0405 0.2047 0.2047 0.4436 0.4436 0.5288 0.5288 0.6782 0.6782 0.7199 0.7199 0.8396 0.8396 0.9041 0.9041 7.9536 7.9536 8.8314 8.8314 9.3334 9.3334 9.7715 9.7715 10.0358 10.0358 k = 0.0000 0.0000 0.2185 ( 12035 PWs) bands (ev): -19.6744 -19.6744 -19.5883 -19.5883 -18.3597 -18.3597 -18.3555 -18.3555 -15.3545 -15.3545 -15.1939 -15.1939 -4.4887 -4.4887 -4.0649 -4.0649 -3.7577 -3.7577 -3.6177 -3.6177 -3.3188 -3.3188 -2.9579 -2.9579 -2.6384 -2.6384 -2.3687 -2.3687 -0.2160 -0.2160 -0.0940 -0.0940 -0.0363 -0.0363 0.1953 0.1953 0.4267 0.4267 0.5236 0.5236 0.6831 0.6831 0.7134 0.7134 0.8342 0.8342 0.8926 0.8926 8.0108 8.0108 8.8524 8.8524 9.3823 9.3823 9.8068 9.8068 9.9963 9.9963 k = 0.0000 0.0000 0.2367 ( 12055 PWs) bands (ev): -19.6722 -19.6722 -19.5896 -19.5896 -18.3607 -18.3607 -18.3556 -18.3556 -15.3534 -15.3534 -15.1958 -15.1958 -4.4856 -4.4856 -4.0793 -4.0793 -3.7519 -3.7519 -3.6188 -3.6188 -3.3193 -3.3193 -2.9425 -2.9425 -2.6365 -2.6365 -2.3622 -2.3622 -0.2020 -0.2020 -0.0890 -0.0890 -0.0327 -0.0327 0.1859 0.1859 0.4103 0.4103 0.5187 0.5187 0.6858 0.6858 0.7078 0.7078 0.8287 0.8287 0.8803 0.8803 8.0699 8.0699 8.8753 8.8753 9.4355 9.4355 9.8450 9.8450 9.9558 9.9558 k = 0.0000 0.0000 0.2549 ( 12051 PWs) bands (ev): -19.6698 -19.6698 -19.5909 -19.5909 -18.3617 -18.3617 -18.3557 -18.3557 -15.3523 -15.3523 -15.1978 -15.1978 -4.4823 -4.4823 -4.0938 -4.0938 -3.7468 -3.7468 -3.6193 -3.6193 -3.3203 -3.3203 -2.9255 -2.9255 -2.6347 -2.6347 -2.3555 -2.3555 -0.1879 -0.1879 -0.0837 -0.0837 -0.0302 -0.0302 0.1765 0.1765 0.3950 0.3950 0.5140 0.5140 0.6835 0.6835 0.7055 0.7055 0.8233 0.8233 0.8675 0.8675 8.1299 8.1299 8.9002 8.9002 9.4924 9.4924 9.8837 9.8837 9.9174 9.9174 k = 0.0000 0.0000 0.2731 ( 12059 PWs) bands (ev): -19.6674 -19.6674 -19.5923 -19.5923 -18.3628 -18.3628 -18.3559 -18.3559 -15.3511 -15.3511 -15.1998 -15.1998 -4.4791 -4.4791 -4.1084 -4.1084 -3.7425 -3.7425 -3.6193 -3.6193 -3.3217 -3.3217 -2.9070 -2.9070 -2.6330 -2.6330 -2.3485 -2.3485 -0.1739 -0.1739 -0.0779 -0.0779 -0.0290 -0.0290 0.1673 0.1673 0.3815 0.3815 0.5095 0.5095 0.6761 0.6761 0.7066 0.7066 0.8179 0.8179 0.8542 0.8542 8.1901 8.1901 8.9273 8.9273 9.5523 9.5523 9.8699 9.8699 9.9350 9.9350 k = 0.0000 0.0000 0.2913 ( 12063 PWs) bands (ev): -19.6649 -19.6649 -19.5938 -19.5938 -18.3639 -18.3639 -18.3560 -18.3560 -15.3499 -15.3499 -15.2019 -15.2019 -4.4758 -4.4758 -4.1230 -4.1230 -3.7388 -3.7388 -3.6188 -3.6188 -3.3236 -3.3236 -2.8870 -2.8870 -2.6312 -2.6312 -2.3413 -2.3413 -0.1606 -0.1606 -0.0716 -0.0716 -0.0293 -0.0293 0.1586 0.1586 0.3704 0.3704 0.5051 0.5051 0.6658 0.6658 0.7083 0.7083 0.8127 0.8127 0.8407 0.8407 8.2498 8.2498 8.9569 8.9569 9.6127 9.6127 9.8329 9.8329 9.9820 9.9820 k = 0.0000 0.0000 0.3095 ( 12063 PWs) bands (ev): -19.6623 -19.6623 -19.5952 -19.5952 -18.3650 -18.3650 -18.3561 -18.3561 -15.3487 -15.3487 -15.2040 -15.2040 -4.4726 -4.4726 -4.1375 -4.1375 -3.7358 -3.7358 -3.6177 -3.6177 -3.3258 -3.3258 -2.8658 -2.8658 -2.6296 -2.6296 -2.3339 -2.3339 -0.1484 -0.1484 -0.0651 -0.0651 -0.0311 -0.0311 0.1507 0.1507 0.3621 0.3621 0.5008 0.5008 0.6541 0.6541 0.7091 0.7091 0.8077 0.8077 0.8273 0.8273 8.3079 8.3079 8.9891 8.9891 9.6652 9.6652 9.8065 9.8065 10.0329 10.0329 k = 0.0000 0.0000 0.3277 ( 12063 PWs) bands (ev): -19.6597 -19.6597 -19.5967 -19.5967 -18.3661 -18.3661 -18.3562 -18.3562 -15.3474 -15.3474 -15.2062 -15.2062 -4.4694 -4.4694 -4.1520 -4.1520 -3.7335 -3.7335 -3.6161 -3.6161 -3.3284 -3.3284 -2.8435 -2.8435 -2.6280 -2.6280 -2.3264 -2.3264 -0.1380 -0.1380 -0.0594 -0.0594 -0.0333 -0.0333 0.1440 0.1440 0.3569 0.3569 0.4966 0.4966 0.6412 0.6412 0.7081 0.7081 0.8020 0.8020 0.8156 0.8156 8.3639 8.3639 9.0242 9.0242 9.6823 9.6823 9.8186 9.8186 10.0872 10.0872 k = 0.0000 0.0000 0.3459 ( 12075 PWs) bands (ev): -19.6571 -19.6571 -19.5982 -19.5982 -18.3673 -18.3673 -18.3564 -18.3564 -15.3462 -15.3462 -15.2083 -15.2083 -4.4664 -4.4664 -4.1662 -4.1662 -3.7317 -3.7317 -3.6139 -3.6139 -3.3312 -3.3312 -2.8203 -2.8203 -2.6265 -2.6265 -2.3188 -2.3188 -0.1300 -0.1300 -0.0574 -0.0574 -0.0326 -0.0326 0.1389 0.1389 0.3550 0.3550 0.4925 0.4925 0.6275 0.6275 0.7047 0.7047 0.7929 0.7929 0.8087 0.8087 8.4170 8.4170 9.0622 9.0622 9.6589 9.6589 9.8742 9.8742 10.1447 10.1447 k = 0.0000 0.0000 0.3641 ( 12081 PWs) bands (ev): -19.6544 -19.6544 -19.5996 -19.5996 -18.3685 -18.3685 -18.3565 -18.3565 -15.3449 -15.3449 -15.2104 -15.2104 -4.4634 -4.4634 -4.1803 -4.1803 -3.7304 -3.7304 -3.6113 -3.6113 -3.3343 -3.3343 -2.7963 -2.7963 -2.6250 -2.6250 -2.3113 -2.3113 -0.1253 -0.1253 -0.0613 -0.0613 -0.0265 -0.0265 0.1361 0.1361 0.3561 0.3561 0.4884 0.4884 0.6132 0.6132 0.6986 0.6986 0.7808 0.7808 0.8064 0.8064 8.4668 8.4668 9.1031 9.1031 9.6224 9.6224 9.9457 9.9457 10.2052 10.2052 k = 0.0000 0.0000 0.3823 ( 12071 PWs) bands (ev): -19.6518 -19.6518 -19.6011 -19.6011 -18.3697 -18.3697 -18.3566 -18.3566 -15.3437 -15.3437 -15.2126 -15.2126 -4.4605 -4.4605 -4.1940 -4.1940 -3.7296 -3.7296 -3.6084 -3.6084 -3.3374 -3.3374 -2.7719 -2.7719 -2.6237 -2.6237 -2.3037 -2.3037 -0.1247 -0.1247 -0.0682 -0.0682 -0.0170 -0.0170 0.1362 0.1362 0.3599 0.3599 0.4844 0.4844 0.5983 0.5983 0.6898 0.6898 0.7680 0.7680 0.8065 0.8065 8.5128 8.5128 9.1466 9.1466 9.5828 9.5828 10.0225 10.0225 10.2688 10.2688 k = 0.0000 0.0000 0.4005 ( 12063 PWs) bands (ev): -19.6493 -19.6493 -19.6025 -19.6025 -18.3708 -18.3708 -18.3567 -18.3567 -15.3424 -15.3424 -15.2146 -15.2146 -4.4577 -4.4577 -4.2074 -4.2074 -3.7290 -3.7290 -3.6053 -3.6053 -3.3407 -3.3407 -2.7473 -2.7473 -2.6224 -2.6224 -2.2963 -2.2963 -0.1289 -0.1289 -0.0756 -0.0756 -0.0059 -0.0059 0.1395 0.1395 0.3660 0.3660 0.4802 0.4802 0.5829 0.5829 0.6786 0.6786 0.7553 0.7553 0.8079 0.8079 8.5550 8.5550 9.1926 9.1926 9.5430 9.5430 10.1012 10.1012 10.3352 10.3352 k = 0.0000 0.0000 0.4188 ( 12067 PWs) bands (ev): -19.6468 -19.6468 -19.6039 -19.6039 -18.3720 -18.3720 -18.3569 -18.3569 -15.3412 -15.3412 -15.2166 -15.2166 -4.4551 -4.4551 -4.2203 -4.2203 -3.7286 -3.7286 -3.6019 -3.6019 -3.3440 -3.3440 -2.7227 -2.7227 -2.6210 -2.6210 -2.2890 -2.2890 -0.1378 -0.1378 -0.0825 -0.0825 0.0061 0.0061 0.1460 0.1460 0.3738 0.3738 0.4760 0.4760 0.5673 0.5673 0.6655 0.6655 0.7428 0.7428 0.8103 0.8103 8.5933 8.5933 9.2402 9.2402 9.5040 9.5040 10.1801 10.1801 10.4042 10.4042 k = 0.0000 0.0000 0.4370 ( 12076 PWs) bands (ev): -19.6443 -19.6443 -19.6052 -19.6052 -18.3731 -18.3731 -18.3570 -18.3570 -15.3401 -15.3401 -15.2186 -15.2186 -4.4526 -4.4526 -4.2327 -4.2327 -3.7285 -3.7285 -3.5985 -3.5985 -3.3473 -3.3473 -2.6985 -2.6985 -2.6196 -2.6196 -2.2819 -2.2819 -0.1503 -0.1503 -0.0890 -0.0890 0.0187 0.0187 0.1555 0.1555 0.3829 0.3829 0.4716 0.4716 0.5516 0.5516 0.6510 0.6510 0.7305 0.7305 0.8133 0.8133 8.6279 8.6279 9.2885 9.2885 9.4669 9.4669 10.2577 10.2577 10.4598 10.4598 k = 0.0000 0.0000 0.4552 ( 12072 PWs) bands (ev): -19.6420 -19.6420 -19.6065 -19.6065 -18.3742 -18.3742 -18.3571 -18.3571 -15.3390 -15.3390 -15.2204 -15.2204 -4.4502 -4.4502 -4.2446 -4.2446 -3.7284 -3.7284 -3.5951 -3.5951 -3.3505 -3.3505 -2.6752 -2.6752 -2.6179 -2.6179 -2.2750 -2.2750 -0.1650 -0.1650 -0.0954 -0.0954 0.0320 0.0320 0.1674 0.1674 0.3929 0.3929 0.4670 0.4670 0.5358 0.5358 0.6358 0.6358 0.7182 0.7182 0.8166 0.8166 8.6591 8.6591 9.3353 9.3353 9.4336 9.4336 10.3328 10.3328 10.3743 10.3743 k = 0.0000 0.0000 0.4734 ( 12050 PWs) bands (ev): -19.6398 -19.6398 -19.6077 -19.6077 -18.3753 -18.3753 -18.3572 -18.3572 -15.3379 -15.3379 -15.2222 -15.2222 -4.4481 -4.4481 -4.2558 -4.2558 -3.7283 -3.7283 -3.5918 -3.5918 -3.3536 -3.3536 -2.6536 -2.6536 -2.6151 -2.6151 -2.2685 -2.2685 -0.1807 -0.1807 -0.1020 -0.1020 0.0459 0.0459 0.1813 0.1813 0.4032 0.4032 0.4620 0.4620 0.5202 0.5202 0.6202 0.6202 0.7061 0.7061 0.8200 0.8200 8.6870 8.6870 9.3660 9.3660 9.4181 9.4181 10.2858 10.2858 10.4043 10.4043 k = 0.0000 0.0000 0.4916 ( 12048 PWs) bands (ev): -19.6377 -19.6377 -19.6088 -19.6088 -18.3763 -18.3763 -18.3573 -18.3573 -15.3369 -15.3369 -15.2239 -15.2239 -4.4460 -4.4460 -4.2663 -4.2663 -3.7283 -3.7283 -3.5886 -3.5886 -3.3565 -3.3565 -2.6365 -2.6365 -2.6090 -2.6090 -2.2623 -2.2623 -0.1968 -0.1968 -0.1087 -0.1087 0.0603 0.0603 0.1965 0.1965 0.4135 0.4135 0.4566 0.4566 0.5049 0.5049 0.6048 0.6048 0.6939 0.6939 0.8234 0.8234 8.7121 8.7121 9.3506 9.3506 9.4501 9.4501 10.2042 10.2042 10.4709 10.4709 k = 0.0000 0.0000 0.5098 ( 12050 PWs) bands (ev): -19.6358 -19.6358 -19.6098 -19.6098 -18.3772 -18.3772 -18.3574 -18.3574 -15.3360 -15.3360 -15.2254 -15.2254 -4.4442 -4.4442 -4.2761 -4.2761 -3.7283 -3.7283 -3.5855 -3.5855 -3.3593 -3.3593 -2.6273 -2.6273 -2.5963 -2.5963 -2.2565 -2.2565 -0.2125 -0.2125 -0.1155 -0.1155 0.0752 0.0752 0.2126 0.2126 0.4233 0.4233 0.4507 0.4507 0.4901 0.4901 0.5900 0.5900 0.6818 0.6818 0.8267 0.8267 8.7345 8.7345 9.3231 9.3231 9.4949 9.4949 10.1300 10.1300 10.5318 10.5318 k = 0.0000 0.0000 0.5280 ( 12052 PWs) bands (ev): -19.6340 -19.6340 -19.6108 -19.6108 -18.3781 -18.3781 -18.3575 -18.3575 -15.3352 -15.3352 -15.2268 -15.2268 -4.4425 -4.4425 -4.2850 -4.2850 -3.7283 -3.7283 -3.5826 -3.5826 -3.3619 -3.3619 -2.6237 -2.6237 -2.5794 -2.5794 -2.2512 -2.2512 -0.2274 -0.2274 -0.1220 -0.1220 0.0904 0.0904 0.2290 0.2290 0.4309 0.4309 0.4454 0.4454 0.4761 0.4761 0.5763 0.5763 0.6699 0.6699 0.8298 0.8298 8.7543 8.7543 9.2960 9.2960 9.5395 9.5395 10.0632 10.0632 10.5862 10.5862 k = 0.0000 0.0000 0.5462 ( 12042 PWs) bands (ev): -19.6324 -19.6324 -19.6116 -19.6116 -18.3789 -18.3789 -18.3576 -18.3576 -15.3344 -15.3344 -15.2281 -15.2281 -4.4410 -4.4410 -4.2930 -4.2930 -3.7283 -3.7283 -3.5800 -3.5800 -3.3642 -3.3642 -2.6220 -2.6220 -2.5625 -2.5625 -2.2464 -2.2464 -0.2413 -0.2413 -0.1282 -0.1282 0.1057 0.1057 0.2454 0.2454 0.4296 0.4296 0.4470 0.4470 0.4634 0.4634 0.5640 0.5640 0.6584 0.6584 0.8327 0.8327 8.7719 8.7719 9.2709 9.2709 9.5816 9.5816 10.0040 10.0040 10.6337 10.6337 k = 0.0000 0.0000 0.5644 ( 12050 PWs) bands (ev): -19.6310 -19.6310 -19.6123 -19.6123 -18.3796 -18.3796 -18.3576 -18.3576 -15.3337 -15.3337 -15.2292 -15.2292 -4.4397 -4.4397 -4.3001 -4.3001 -3.7282 -3.7282 -3.5777 -3.5777 -3.3663 -3.3663 -2.6211 -2.6211 -2.5467 -2.5467 -2.2422 -2.2422 -0.2537 -0.2537 -0.1339 -0.1339 0.1210 0.1210 0.2614 0.2614 0.4205 0.4205 0.4514 0.4514 0.4547 0.4547 0.5535 0.5535 0.6473 0.6473 0.8353 0.8353 8.7872 8.7872 9.2484 9.2484 9.6203 9.6203 9.9525 9.9525 10.6740 10.6740 k = 0.0000 0.0000 0.5826 ( 12066 PWs) bands (ev): -19.6298 -19.6298 -19.6130 -19.6130 -18.3802 -18.3802 -18.3577 -18.3577 -15.3332 -15.3332 -15.2301 -15.2301 -4.4386 -4.4386 -4.3061 -4.3061 -3.7282 -3.7282 -3.5756 -3.5756 -3.3682 -3.3682 -2.6205 -2.6205 -2.5329 -2.5329 -2.2385 -2.2385 -0.2646 -0.2646 -0.1389 -0.1389 0.1358 0.1358 0.2767 0.2767 0.4090 0.4090 0.4424 0.4424 0.4612 0.4612 0.5448 0.5448 0.6370 0.6370 0.8375 0.8375 8.8003 8.8003 9.2288 9.2288 9.6547 9.6547 9.9089 9.9089 10.7071 10.7071 k = 0.0000 0.0000 0.6008 ( 12066 PWs) bands (ev): -19.6288 -19.6288 -19.6135 -19.6135 -18.3807 -18.3807 -18.3577 -18.3577 -15.3327 -15.3327 -15.2309 -15.2309 -4.4376 -4.4376 -4.3112 -4.3112 -3.7281 -3.7281 -3.5739 -3.5739 -3.3697 -3.3697 -2.6201 -2.6201 -2.5212 -2.5212 -2.2355 -2.2355 -0.2737 -0.2737 -0.1432 -0.1432 0.1497 0.1497 0.2908 0.2908 0.3966 0.3966 0.4343 0.4343 0.4672 0.4672 0.5379 0.5379 0.6279 0.6279 0.8393 0.8393 8.8111 8.8111 9.2123 9.2123 9.6840 9.6840 9.8730 9.8730 10.7333 10.7333 k = 0.0000 0.0000 0.6190 ( 12058 PWs) bands (ev): -19.6280 -19.6280 -19.6139 -19.6139 -18.3810 -18.3810 -18.3578 -18.3578 -15.3323 -15.3323 -15.2315 -15.2315 -4.4369 -4.4369 -4.3152 -4.3152 -3.7281 -3.7281 -3.5726 -3.5726 -3.3709 -3.3709 -2.6198 -2.6198 -2.5119 -2.5119 -2.2331 -2.2331 -0.2809 -0.2809 -0.1466 -0.1466 0.1620 0.1620 0.3034 0.3034 0.3845 0.3845 0.4276 0.4276 0.4722 0.4722 0.5328 0.5328 0.6202 0.6202 0.8408 0.8408 8.8197 8.8197 9.1992 9.1992 9.7076 9.7076 9.8451 9.8451 10.7531 10.7531 k = 0.0000 0.0000 0.6372 ( 12036 PWs) bands (ev): -19.6275 -19.6275 -19.6141 -19.6141 -18.3813 -18.3813 -18.3578 -18.3578 -15.3320 -15.3320 -15.2320 -15.2320 -4.4363 -4.4363 -4.3180 -4.3180 -3.7281 -3.7281 -3.5716 -3.5716 -3.3717 -3.3717 -2.6196 -2.6196 -2.5051 -2.5051 -2.2314 -2.2314 -0.2862 -0.2862 -0.1490 -0.1490 0.1718 0.1718 0.3141 0.3141 0.3735 0.3735 0.4226 0.4226 0.4758 0.4758 0.5293 0.5293 0.6143 0.6143 0.8418 0.8418 8.8259 8.8259 9.1897 9.1897 9.7248 9.7248 9.8251 9.8251 10.7667 10.7667 k = 0.0000 0.0000 0.6554 ( 12048 PWs) bands (ev): -19.6271 -19.6271 -19.6143 -19.6143 -18.3815 -18.3815 -18.3578 -18.3578 -15.3319 -15.3319 -15.2322 -15.2322 -4.4360 -4.4360 -4.3197 -4.3197 -3.7280 -3.7280 -3.5710 -3.5710 -3.3723 -3.3723 -2.6195 -2.6195 -2.5010 -2.5010 -2.2303 -2.2303 -0.2893 -0.2893 -0.1505 -0.1505 0.1782 0.1782 0.3219 0.3219 0.3653 0.3653 0.4193 0.4193 0.4780 0.4780 0.5272 0.5272 0.6106 0.6106 0.8425 0.8425 8.8297 8.8297 9.1839 9.1839 9.7354 9.7354 9.8131 9.8131 10.7748 10.7748 k = 0.0000 0.0000 0.6736 ( 12060 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3816 -18.3816 -18.3578 -18.3578 -15.3318 -15.3318 -15.2323 -15.2323 -4.4359 -4.4359 -4.3203 -4.3203 -3.7280 -3.7280 -3.5708 -3.5708 -3.3724 -3.3724 -2.6195 -2.6195 -2.4996 -2.4996 -2.2300 -2.2300 -0.2904 -0.2904 -0.1510 -0.1510 0.1805 0.1805 0.3250 0.3250 0.3620 0.3620 0.4182 0.4182 0.4788 0.4788 0.5266 0.5266 0.6093 0.6093 0.8427 0.8427 8.8310 8.8310 9.1819 9.1819 9.7389 9.7389 9.8091 9.8091 10.7774 10.7774 k = 0.0000 0.0000 0.6736 ( 12060 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3816 -18.3816 -18.3578 -18.3578 -15.3318 -15.3318 -15.2323 -15.2323 -4.4359 -4.4359 -4.3203 -4.3203 -3.7280 -3.7280 -3.5708 -3.5708 -3.3724 -3.3724 -2.6195 -2.6195 -2.4996 -2.4996 -2.2300 -2.2300 -0.2904 -0.2904 -0.1510 -0.1510 0.1805 0.1805 0.3250 0.3250 0.3620 0.3620 0.4182 0.4182 0.4788 0.4788 0.5266 0.5266 0.6093 0.6093 0.8427 0.8427 8.8310 8.8310 9.1819 9.1819 9.7389 9.7389 9.8091 9.8091 10.7774 10.7774 k =-0.0133 0.0120 0.6736 ( 12054 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3815 -18.3815 -18.3578 -18.3578 -15.3318 -15.3318 -15.2324 -15.2324 -4.4368 -4.4368 -4.3192 -4.3192 -3.7282 -3.7282 -3.5716 -3.5716 -3.3704 -3.3704 -2.6202 -2.6202 -2.4996 -2.4996 -2.2299 -2.2299 -0.2903 -0.2903 -0.1510 -0.1510 0.1800 0.1800 0.3226 0.3226 0.3628 0.3628 0.4195 0.4195 0.4789 0.4789 0.5265 0.5265 0.6092 0.6092 0.8420 0.8420 8.8340 8.8340 9.1841 9.1841 9.7405 9.7405 9.8082 9.8082 10.7415 10.7415 k =-0.0267 0.0241 0.6736 ( 12054 PWs) bands (ev): -19.6268 -19.6268 -19.6146 -19.6146 -18.3814 -18.3814 -18.3578 -18.3578 -15.3318 -15.3318 -15.2327 -15.2327 -4.4393 -4.4393 -4.3160 -4.3160 -3.7286 -3.7286 -3.5740 -3.5740 -3.3644 -3.3644 -2.6224 -2.6224 -2.4994 -2.4994 -2.2298 -2.2298 -0.2900 -0.2900 -0.1508 -0.1508 0.1787 0.1787 0.3159 0.3159 0.3648 0.3648 0.4233 0.4233 0.4794 0.4794 0.5265 0.5265 0.6088 0.6088 0.8401 0.8401 8.8432 8.8432 9.1906 9.1906 9.7453 9.7453 9.8054 9.8054 10.6631 10.6631 k =-0.0400 0.0361 0.6736 ( 12044 PWs) bands (ev): -19.6265 -19.6265 -19.6150 -19.6150 -18.3812 -18.3812 -18.3578 -18.3578 -15.3318 -15.3318 -15.2332 -15.2332 -4.4432 -4.4432 -4.3109 -4.3109 -3.7292 -3.7292 -3.5777 -3.5777 -3.3547 -3.3547 -2.6261 -2.6261 -2.4992 -2.4992 -2.2296 -2.2296 -0.2895 -0.2895 -0.1506 -0.1506 0.1764 0.1764 0.3062 0.3062 0.3678 0.3678 0.4288 0.4288 0.4801 0.4801 0.5264 0.5264 0.6082 0.6082 0.8370 0.8370 8.8582 8.8582 9.2015 9.2015 9.7533 9.7533 9.8007 9.8007 10.5704 10.5704 k =-0.0533 0.0482 0.6736 ( 12046 PWs) bands (ev): -19.6260 -19.6260 -19.6154 -19.6154 -18.3809 -18.3809 -18.3578 -18.3578 -15.3317 -15.3317 -15.2338 -15.2338 -4.4481 -4.4481 -4.3044 -4.3044 -3.7300 -3.7300 -3.5824 -3.5824 -3.3417 -3.3417 -2.6312 -2.6312 -2.4989 -2.4989 -2.2292 -2.2292 -0.2888 -0.2888 -0.1503 -0.1503 0.1731 0.1731 0.2943 0.2943 0.3714 0.3714 0.4352 0.4352 0.4812 0.4812 0.5263 0.5263 0.6074 0.6074 0.8327 0.8327 8.8790 8.8790 9.2167 9.2167 9.7649 9.7649 9.7943 9.7943 10.4724 10.4724 k =-0.0667 0.0602 0.6736 ( 12038 PWs) bands (ev): -19.6255 -19.6255 -19.6160 -19.6160 -18.3806 -18.3806 -18.3578 -18.3578 -15.3317 -15.3317 -15.2346 -15.2346 -4.4537 -4.4537 -4.2968 -4.2968 -3.7308 -3.7308 -3.5879 -3.5879 -3.3258 -3.3258 -2.6377 -2.6377 -2.4984 -2.4984 -2.2288 -2.2288 -0.2879 -0.2879 -0.1498 -0.1498 0.1689 0.1689 0.2807 0.2807 0.3756 0.3756 0.4420 0.4420 0.4826 0.4826 0.5263 0.5263 0.6063 0.6063 0.8272 0.8272 8.9052 8.9052 9.2361 9.2361 9.7800 9.7800 9.7863 9.7863 10.3724 10.3724 k =-0.0800 0.0722 0.6736 ( 12054 PWs) bands (ev): -19.6248 -19.6248 -19.6167 -19.6167 -18.3802 -18.3802 -18.3578 -18.3578 -15.3317 -15.3317 -15.2356 -15.2356 -4.4596 -4.4596 -4.2884 -4.2884 -3.7315 -3.7315 -3.5940 -3.5940 -3.3073 -3.3073 -2.6455 -2.6455 -2.4978 -2.4978 -2.2283 -2.2283 -0.2867 -0.2867 -0.1494 -0.1494 0.1637 0.1637 0.2659 0.2659 0.3803 0.3803 0.4488 0.4488 0.4843 0.4843 0.5263 0.5263 0.6050 0.6050 0.8205 0.8205 8.9363 8.9363 9.2597 9.2597 9.7764 9.7764 9.7994 9.7994 10.2715 10.2715 k =-0.0933 0.0843 0.6736 ( 12054 PWs) bands (ev): -19.6241 -19.6241 -19.6174 -19.6174 -18.3797 -18.3797 -18.3578 -18.3578 -15.3316 -15.3316 -15.2368 -15.2368 -4.4658 -4.4658 -4.2796 -4.2796 -3.7321 -3.7321 -3.6004 -3.6004 -3.2865 -3.2865 -2.6546 -2.6546 -2.4971 -2.4971 -2.2277 -2.2277 -0.2852 -0.2852 -0.1488 -0.1488 0.1575 0.1575 0.2501 0.2501 0.3856 0.3856 0.4554 0.4554 0.4863 0.4863 0.5265 0.5265 0.6035 0.6035 0.8128 0.8128 8.9719 8.9719 9.2876 9.2876 9.7653 9.7653 9.8231 9.8231 10.1708 10.1708 k =-0.1067 0.0963 0.6736 ( 12050 PWs) bands (ev): -19.6234 -19.6234 -19.6182 -19.6182 -18.3792 -18.3792 -18.3579 -18.3579 -15.3316 -15.3316 -15.2381 -15.2381 -4.4719 -4.4719 -4.2705 -4.2705 -3.7325 -3.7325 -3.6069 -3.6069 -3.2638 -3.2638 -2.6648 -2.6648 -2.4962 -2.4962 -2.2269 -2.2269 -0.2834 -0.2834 -0.1483 -0.1483 0.1503 0.1503 0.2335 0.2335 0.3913 0.3913 0.4617 0.4617 0.4887 0.4887 0.5269 0.5269 0.6017 0.6017 0.8040 0.8040 9.0112 9.0112 9.3195 9.3195 9.7528 9.7528 9.8517 9.8517 10.0706 10.0706 k =-0.1200 0.1083 0.6736 ( 12040 PWs) bands (ev): -19.6228 -19.6228 -19.6187 -19.6187 -18.3786 -18.3786 -18.3579 -18.3579 -15.3315 -15.3315 -15.2396 -15.2396 -4.4779 -4.4779 -4.2614 -4.2614 -3.7326 -3.7326 -3.6135 -3.6135 -3.2394 -3.2394 -2.6762 -2.6762 -2.4951 -2.4951 -2.2260 -2.2260 -0.2813 -0.2813 -0.1477 -0.1477 0.1420 0.1420 0.2163 0.2163 0.3973 0.3973 0.4674 0.4674 0.4913 0.4913 0.5276 0.5276 0.5996 0.5996 0.7943 0.7943 9.0535 9.0535 9.3555 9.3555 9.7392 9.7392 9.8859 9.8859 9.9714 9.9714 k =-0.1333 0.1204 0.6736 ( 12036 PWs) bands (ev): -19.6228 -19.6228 -19.6188 -19.6188 -18.3779 -18.3779 -18.3579 -18.3579 -15.3315 -15.3315 -15.2412 -15.2412 -4.4836 -4.4836 -4.2524 -4.2524 -3.7323 -3.7323 -3.6198 -3.6198 -3.2135 -3.2135 -2.6886 -2.6886 -2.4938 -2.4938 -2.2250 -2.2250 -0.2788 -0.2788 -0.1472 -0.1472 0.1326 0.1326 0.1986 0.1986 0.4034 0.4034 0.4728 0.4728 0.4943 0.4943 0.5285 0.5285 0.5974 0.5974 0.7837 0.7837 9.0979 9.0979 9.3954 9.3954 9.7245 9.7245 9.8734 9.8734 9.9265 9.9265 k =-0.1467 0.1324 0.6736 ( 12030 PWs) bands (ev): -19.6234 -19.6234 -19.6182 -19.6182 -18.3772 -18.3772 -18.3579 -18.3579 -15.3314 -15.3314 -15.2429 -15.2429 -4.4891 -4.4891 -4.2436 -4.2436 -3.7319 -3.7319 -3.6259 -3.6259 -3.1864 -3.1864 -2.7019 -2.7019 -2.4923 -2.4923 -2.2238 -2.2238 -0.2759 -0.2759 -0.1467 -0.1467 0.1221 0.1221 0.1807 0.1807 0.4096 0.4096 0.4777 0.4777 0.4976 0.4976 0.5296 0.5296 0.5950 0.5950 0.7724 0.7724 9.1435 9.1435 9.4392 9.4392 9.7089 9.7089 9.7772 9.7772 9.9739 9.9739 k =-0.1600 0.1445 0.6736 ( 12028 PWs) bands (ev): -19.6245 -19.6245 -19.6172 -19.6172 -18.3764 -18.3764 -18.3580 -18.3580 -15.3313 -15.3313 -15.2447 -15.2447 -4.4941 -4.4941 -4.2354 -4.2354 -3.7313 -3.7313 -3.6313 -3.6313 -3.1582 -3.1582 -2.7159 -2.7159 -2.4904 -2.4904 -2.2225 -2.2225 -0.2725 -0.2725 -0.1464 -0.1464 0.1103 0.1103 0.1627 0.1627 0.4156 0.4156 0.4822 0.4822 0.5011 0.5011 0.5310 0.5310 0.5924 0.5924 0.7605 0.7605 9.1893 9.1893 9.4865 9.4865 9.6829 9.6829 9.6927 9.6927 10.0290 10.0290 k =-0.1733 0.1565 0.6736 ( 12030 PWs) bands (ev): -19.6258 -19.6258 -19.6159 -19.6159 -18.3756 -18.3756 -18.3580 -18.3580 -15.3313 -15.3313 -15.2467 -15.2467 -4.4987 -4.4987 -4.2276 -4.2276 -3.7309 -3.7309 -3.6358 -3.6358 -3.1293 -3.1293 -2.7304 -2.7304 -2.4883 -2.4883 -2.2211 -2.2211 -0.2688 -0.2688 -0.1462 -0.1462 0.0971 0.0971 0.1450 0.1450 0.4212 0.4212 0.4866 0.4866 0.5048 0.5048 0.5326 0.5326 0.5896 0.5896 0.7481 0.7481 9.2344 9.2344 9.5361 9.5361 9.5923 9.5923 9.6758 9.6758 10.0925 10.0925 k =-0.1867 0.1685 0.6736 ( 12030 PWs) bands (ev): -19.6272 -19.6272 -19.6145 -19.6145 -18.3748 -18.3748 -18.3581 -18.3581 -15.3312 -15.3312 -15.2487 -15.2487 -4.5028 -4.5028 -4.2206 -4.2206 -3.7309 -3.7309 -3.6389 -3.6389 -3.0998 -3.0998 -2.7454 -2.7454 -2.4858 -2.4858 -2.2196 -2.2196 -0.2646 -0.2646 -0.1464 -0.1464 0.0825 0.0825 0.1278 0.1278 0.4262 0.4262 0.4907 0.4907 0.5087 0.5087 0.5344 0.5344 0.5868 0.5868 0.7352 0.7352 9.2781 9.2781 9.4980 9.4980 9.5951 9.5951 9.6586 9.6586 10.1649 10.1649 k =-0.2000 0.1806 0.6736 ( 12022 PWs) bands (ev): -19.6287 -19.6287 -19.6130 -19.6130 -18.3739 -18.3739 -18.3582 -18.3582 -15.3311 -15.3311 -15.2508 -15.2508 -4.5064 -4.5064 -4.2142 -4.2142 -3.7317 -3.7317 -3.6403 -3.6403 -3.0702 -3.0702 -2.7603 -2.7603 -2.4830 -2.4830 -2.2180 -2.2180 -0.2599 -0.2599 -0.1469 -0.1469 0.0665 0.0665 0.1114 0.1114 0.4304 0.4304 0.4948 0.4948 0.5126 0.5126 0.5364 0.5364 0.5839 0.5839 0.7222 0.7222 9.3197 9.3197 9.4111 9.4111 9.6411 9.6411 9.6528 9.6528 10.2464 10.2464 k =-0.2133 0.1926 0.6736 ( 12036 PWs) bands (ev): -19.6302 -19.6302 -19.6115 -19.6115 -18.3730 -18.3730 -18.3582 -18.3582 -15.3310 -15.3310 -15.2529 -15.2529 -4.5094 -4.5094 -4.2087 -4.2087 -3.7335 -3.7335 -3.6397 -3.6397 -3.0410 -3.0410 -2.7749 -2.7749 -2.4798 -2.4798 -2.2162 -2.2162 -0.2547 -0.2547 -0.1479 -0.1479 0.0494 0.0494 0.0959 0.0959 0.4336 0.4336 0.4986 0.4986 0.5167 0.5167 0.5386 0.5386 0.5811 0.5811 0.7092 0.7092 9.3256 9.3256 9.3594 9.3594 9.6235 9.6235 9.7145 9.7145 10.3371 10.3371 k =-0.2267 0.2047 0.6736 ( 12046 PWs) bands (ev): -19.6318 -19.6318 -19.6099 -19.6099 -18.3721 -18.3721 -18.3583 -18.3583 -15.3309 -15.3309 -15.2551 -15.2551 -4.5120 -4.5120 -4.2041 -4.2041 -3.7366 -3.7366 -3.6370 -3.6370 -3.0128 -3.0128 -2.7884 -2.7884 -2.4761 -2.4761 -2.2144 -2.2144 -0.2491 -0.2491 -0.1497 -0.1497 0.0316 0.0316 0.0810 0.0810 0.4355 0.4355 0.5022 0.5022 0.5207 0.5207 0.5411 0.5411 0.5784 0.5784 0.6964 0.6964 9.2435 9.2435 9.3960 9.3960 9.6058 9.6058 9.7796 9.7796 10.4369 10.4369 k =-0.2400 0.2167 0.6736 ( 12050 PWs) bands (ev): -19.6335 -19.6335 -19.6083 -19.6083 -18.3712 -18.3712 -18.3584 -18.3584 -15.3309 -15.3309 -15.2573 -15.2573 -4.5140 -4.5140 -4.2003 -4.2003 -3.7408 -3.7408 -3.6322 -3.6322 -2.9870 -2.9870 -2.7996 -2.7996 -2.4720 -2.4720 -2.2125 -2.2125 -0.2430 -0.2430 -0.1526 -0.1526 0.0136 0.0136 0.0669 0.0669 0.4360 0.4360 0.5054 0.5054 0.5245 0.5245 0.5439 0.5439 0.5760 0.5760 0.6840 0.6840 9.1640 9.1640 9.4303 9.4303 9.5883 9.5883 9.8480 9.8480 10.5453 10.5453 k =-0.2533 0.2287 0.6736 ( 12050 PWs) bands (ev): -19.6351 -19.6351 -19.6067 -19.6067 -18.3702 -18.3702 -18.3585 -18.3585 -15.3308 -15.3308 -15.2595 -15.2595 -4.5155 -4.5155 -4.1973 -4.1973 -3.7458 -3.7458 -3.6256 -3.6256 -2.9656 -2.9656 -2.8066 -2.8066 -2.4674 -2.4674 -2.2106 -2.2106 -0.2365 -0.2365 -0.1568 -0.1568 -0.0038 -0.0038 0.0532 0.0532 0.4349 0.4349 0.5083 0.5083 0.5278 0.5278 0.5470 0.5470 0.5742 0.5742 0.6723 0.6723 9.0876 9.0876 9.4622 9.4622 9.5710 9.5710 9.9195 9.9195 10.5737 10.5737 k =-0.2667 0.2408 0.6736 ( 12050 PWs) bands (ev): -19.6367 -19.6367 -19.6050 -19.6050 -18.3693 -18.3693 -18.3586 -18.3586 -15.3307 -15.3307 -15.2617 -15.2617 -4.5165 -4.5165 -4.1952 -4.1952 -3.7515 -3.7515 -3.6175 -3.6175 -2.9516 -2.9516 -2.8065 -2.8065 -2.4623 -2.4623 -2.2086 -2.2086 -0.2297 -0.2297 -0.1628 -0.1628 -0.0200 -0.0200 0.0400 0.0400 0.4322 0.4322 0.5109 0.5109 0.5304 0.5304 0.5503 0.5503 0.5731 0.5731 0.6615 0.6615 9.0143 9.0143 9.4919 9.4919 9.5541 9.5541 9.9940 9.9940 10.4578 10.4578 k =-0.2800 0.2528 0.6736 ( 12046 PWs) bands (ev): -19.6383 -19.6383 -19.6034 -19.6034 -18.3684 -18.3684 -18.3587 -18.3587 -15.3306 -15.3306 -15.2639 -15.2639 -4.5170 -4.5170 -4.1939 -4.1939 -3.7576 -3.7576 -3.6083 -3.6083 -2.9468 -2.9468 -2.7974 -2.7974 -2.4567 -2.4567 -2.2066 -2.2066 -0.2228 -0.2228 -0.1708 -0.1708 -0.0343 -0.0343 0.0274 0.0274 0.4277 0.4277 0.5130 0.5130 0.5324 0.5324 0.5533 0.5533 0.5732 0.5732 0.6519 0.6519 8.9444 8.9444 9.5195 9.5195 9.5377 9.5377 10.0714 10.0714 10.3463 10.3463 k =-0.2933 0.2649 0.6736 ( 12040 PWs) bands (ev): -19.6399 -19.6399 -19.6018 -19.6018 -18.3675 -18.3675 -18.3588 -18.3588 -15.3305 -15.3305 -15.2660 -15.2660 -4.5170 -4.5170 -4.1934 -4.1934 -3.7639 -3.7639 -3.5982 -3.5982 -2.9506 -2.9506 -2.7802 -2.7802 -2.4505 -2.4505 -2.2046 -2.2046 -0.2164 -0.2164 -0.1804 -0.1804 -0.0463 -0.0463 0.0152 0.0152 0.4214 0.4214 0.5147 0.5147 0.5339 0.5339 0.5553 0.5553 0.5747 0.5747 0.6437 0.6437 8.8780 8.8780 9.5215 9.5215 9.5456 9.5456 10.1514 10.1514 10.2398 10.2398 k =-0.3067 0.2769 0.6736 ( 12050 PWs) bands (ev): -19.6415 -19.6415 -19.6002 -19.6002 -18.3666 -18.3666 -18.3590 -18.3590 -15.3304 -15.3304 -15.2681 -15.2681 -4.5167 -4.5167 -4.1935 -4.1935 -3.7701 -3.7701 -3.5875 -3.5875 -2.9601 -2.9601 -2.7579 -2.7579 -2.4438 -2.4438 -2.2027 -2.2027 -0.2135 -0.2135 -0.1888 -0.1888 -0.0559 -0.0559 0.0036 0.0036 0.4135 0.4135 0.5161 0.5161 0.5350 0.5350 0.5562 0.5562 0.5773 0.5773 0.6372 0.6372 8.8152 8.8152 9.5063 9.5063 9.5696 9.5696 10.1382 10.1382 10.2343 10.2343 k =-0.3067 0.2769 0.6736 ( 12050 PWs) bands (ev): -19.6415 -19.6415 -19.6002 -19.6002 -18.3666 -18.3666 -18.3590 -18.3590 -15.3304 -15.3304 -15.2681 -15.2681 -4.5167 -4.5167 -4.1935 -4.1935 -3.7701 -3.7701 -3.5875 -3.5875 -2.9601 -2.9601 -2.7579 -2.7579 -2.4438 -2.4438 -2.2027 -2.2027 -0.2135 -0.2135 -0.1888 -0.1888 -0.0559 -0.0559 0.0036 0.0036 0.4135 0.4135 0.5161 0.5161 0.5350 0.5350 0.5562 0.5562 0.5773 0.5773 0.6372 0.6372 8.8152 8.8152 9.5063 9.5063 9.5696 9.5696 10.1382 10.1382 10.2343 10.2343 k =-0.3163 0.2856 0.6606 ( 12052 PWs) bands (ev): -19.6425 -19.6425 -19.5991 -19.5991 -18.3660 -18.3660 -18.3591 -18.3591 -15.3304 -15.3304 -15.2696 -15.2696 -4.5162 -4.5162 -4.1938 -4.1938 -3.7746 -3.7746 -3.5797 -3.5797 -2.9688 -2.9688 -2.7403 -2.7403 -2.4394 -2.4394 -2.2013 -2.2013 -0.2175 -0.2175 -0.1900 -0.1900 -0.0614 -0.0614 -0.0036 -0.0036 0.4067 0.4067 0.5154 0.5154 0.5362 0.5362 0.5566 0.5566 0.5801 0.5801 0.6338 0.6338 8.7728 8.7728 9.4975 9.4975 9.5855 9.5855 10.0685 10.0685 10.2959 10.2959 k =-0.3260 0.2943 0.6476 ( 12060 PWs) bands (ev): -19.6435 -19.6435 -19.5981 -19.5981 -18.3654 -18.3654 -18.3592 -18.3592 -15.3303 -15.3303 -15.2708 -15.2708 -4.5155 -4.5155 -4.1942 -4.1942 -3.7789 -3.7789 -3.5720 -3.5720 -2.9777 -2.9777 -2.7227 -2.7227 -2.4360 -2.4360 -2.2002 -2.2002 -0.2253 -0.2253 -0.1878 -0.1878 -0.0658 -0.0658 -0.0088 -0.0088 0.3991 0.3991 0.5124 0.5124 0.5377 0.5377 0.5576 0.5576 0.5834 0.5834 0.6315 0.6315 8.7343 8.7343 9.4930 9.4930 9.5997 9.5997 10.0024 10.0024 10.3590 10.3590 k =-0.3357 0.3031 0.6346 ( 12064 PWs) bands (ev): -19.6443 -19.6443 -19.5973 -19.5973 -18.3648 -18.3648 -18.3593 -18.3593 -15.3303 -15.3303 -15.2720 -15.2720 -4.5148 -4.5148 -4.1946 -4.1946 -3.7830 -3.7830 -3.5647 -3.5647 -2.9865 -2.9865 -2.7056 -2.7056 -2.4338 -2.4338 -2.1993 -2.1993 -0.2342 -0.2342 -0.1849 -0.1849 -0.0694 -0.0694 -0.0119 -0.0119 0.3912 0.3912 0.5082 0.5082 0.5392 0.5392 0.5592 0.5592 0.5866 0.5866 0.6303 0.6303 8.7000 8.7000 9.4927 9.4927 9.6121 9.6121 9.9401 9.9401 10.4226 10.4226 k =-0.3453 0.3118 0.6216 ( 12070 PWs) bands (ev): -19.6451 -19.6451 -19.5966 -19.5966 -18.3642 -18.3642 -18.3594 -18.3594 -15.3303 -15.3303 -15.2730 -15.2730 -4.5140 -4.5140 -4.1950 -4.1950 -3.7867 -3.7867 -3.5579 -3.5579 -2.9947 -2.9947 -2.6895 -2.6895 -2.4325 -2.4325 -2.1986 -2.1986 -0.2429 -0.2429 -0.1826 -0.1826 -0.0723 -0.0723 -0.0132 -0.0132 0.3833 0.3833 0.5036 0.5036 0.5405 0.5405 0.5609 0.5609 0.5894 0.5894 0.6299 0.6299 8.6699 8.6699 9.4966 9.4966 9.6228 9.6228 9.8817 9.8817 10.4859 10.4859 k =-0.3550 0.3205 0.6085 ( 12068 PWs) bands (ev): -19.6457 -19.6457 -19.5959 -19.5959 -18.3637 -18.3637 -18.3595 -18.3595 -15.3303 -15.3303 -15.2739 -15.2739 -4.5132 -4.5132 -4.1955 -4.1955 -3.7900 -3.7900 -3.5518 -3.5518 -3.0021 -3.0021 -2.6749 -2.6749 -2.4320 -2.4320 -2.1980 -2.1980 -0.2508 -0.2508 -0.1809 -0.1809 -0.0745 -0.0745 -0.0131 -0.0131 0.3757 0.3757 0.4991 0.4991 0.5416 0.5416 0.5626 0.5626 0.5918 0.5918 0.6301 0.6301 8.6443 8.6443 9.5048 9.5048 9.6319 9.6319 9.8274 9.8274 10.5477 10.5477 k =-0.3647 0.3293 0.5955 ( 12074 PWs) bands (ev): -19.6463 -19.6463 -19.5954 -19.5954 -18.3633 -18.3633 -18.3596 -18.3596 -15.3303 -15.3303 -15.2746 -15.2746 -4.5124 -4.5124 -4.1959 -4.1959 -3.7928 -3.7928 -3.5467 -3.5467 -3.0084 -3.0084 -2.6622 -2.6622 -2.4322 -2.4322 -2.1976 -2.1976 -0.2576 -0.2576 -0.1799 -0.1799 -0.0762 -0.0762 -0.0120 -0.0120 0.3688 0.3688 0.4951 0.4951 0.5424 0.5424 0.5640 0.5640 0.5939 0.5939 0.6307 0.6307 8.6231 8.6231 9.5170 9.5170 9.6392 9.6392 9.7772 9.7772 10.6060 10.6060 k =-0.3743 0.3380 0.5825 ( 12072 PWs) bands (ev): -19.6467 -19.6467 -19.5950 -19.5950 -18.3630 -18.3630 -18.3597 -18.3597 -15.3303 -15.3303 -15.2751 -15.2751 -4.5118 -4.5118 -4.1962 -4.1962 -3.7950 -3.7950 -3.5425 -3.5425 -3.0134 -3.0134 -2.6518 -2.6518 -2.4327 -2.4327 -2.1972 -2.1972 -0.2630 -0.2630 -0.1795 -0.1795 -0.0774 -0.0774 -0.0104 -0.0104 0.3630 0.3630 0.4918 0.4918 0.5430 0.5430 0.5650 0.5650 0.5955 0.5955 0.6313 0.6313 8.6066 8.6066 9.5333 9.5333 9.6449 9.6449 9.7314 9.7314 10.6584 10.6584 k =-0.3840 0.3467 0.5695 ( 12070 PWs) bands (ev): -19.6470 -19.6470 -19.5948 -19.5948 -18.3628 -18.3628 -18.3597 -18.3597 -15.3304 -15.3304 -15.2755 -15.2755 -4.5113 -4.5113 -4.1965 -4.1965 -3.7966 -3.7966 -3.5394 -3.5394 -3.0171 -3.0171 -2.6440 -2.6440 -2.4333 -2.4333 -2.1970 -2.1970 -0.2669 -0.2669 -0.1794 -0.1794 -0.0782 -0.0782 -0.0089 -0.0089 0.3586 0.3586 0.4893 0.4893 0.5434 0.5434 0.5657 0.5657 0.5967 0.5967 0.6319 0.6319 8.5948 8.5948 9.5531 9.5531 9.6489 9.6489 9.6905 9.6905 10.7012 10.7012 k =-0.3937 0.3554 0.5564 ( 12069 PWs) bands (ev): -19.6471 -19.6471 -19.5946 -19.5946 -18.3627 -18.3627 -18.3597 -18.3597 -15.3304 -15.3304 -15.2758 -15.2758 -4.5110 -4.5110 -4.1967 -4.1967 -3.7976 -3.7976 -3.5376 -3.5376 -3.0194 -3.0194 -2.6392 -2.6392 -2.4337 -2.4337 -2.1969 -2.1969 -0.2693 -0.2693 -0.1794 -0.1794 -0.0786 -0.0786 -0.0079 -0.0079 0.3559 0.3559 0.4879 0.4879 0.5437 0.5437 0.5661 0.5661 0.5974 0.5974 0.6323 0.6323 8.5876 8.5876 9.5748 9.5748 9.6508 9.6508 9.6566 9.6566 10.7298 10.7298 k =-0.4033 0.3642 0.5434 ( 12068 PWs) bands (ev): -19.6472 -19.6472 -19.5945 -19.5945 -18.3628 -18.3628 -18.3596 -18.3596 -15.3304 -15.3304 -15.2759 -15.2759 -4.5109 -4.5109 -4.1967 -4.1967 -3.7979 -3.7979 -3.5369 -3.5369 -3.0202 -3.0202 -2.6376 -2.6376 -2.4339 -2.4339 -2.1968 -2.1968 -0.2701 -0.2701 -0.1793 -0.1793 -0.0788 -0.0788 -0.0075 -0.0075 0.3549 0.3549 0.4874 0.4874 0.5438 0.5438 0.5662 0.5662 0.5977 0.5977 0.6324 0.6324 8.5853 8.5853 9.5884 9.5884 9.6380 9.6380 9.6525 9.6525 10.7400 10.7400 k =-0.4033 0.3642 0.5434 ( 12068 PWs) bands (ev): -19.6472 -19.6472 -19.5945 -19.5945 -18.3628 -18.3628 -18.3596 -18.3596 -15.3304 -15.3304 -15.2759 -15.2759 -4.5109 -4.5109 -4.1967 -4.1967 -3.7979 -3.7979 -3.5369 -3.5369 -3.0202 -3.0202 -2.6376 -2.6376 -2.4339 -2.4339 -2.1968 -2.1968 -0.2701 -0.2701 -0.1793 -0.1793 -0.0788 -0.0788 -0.0075 -0.0075 0.3549 0.3549 0.4874 0.4874 0.5438 0.5438 0.5662 0.5662 0.5977 0.5977 0.6324 0.6324 8.5853 8.5853 9.5884 9.5884 9.6380 9.6380 9.6525 9.6525 10.7400 10.7400 k =-0.3937 0.3555 0.5305 ( 12064 PWs) bands (ev): -19.6458 -19.6458 -19.5961 -19.5961 -18.3632 -18.3632 -18.3596 -18.3596 -15.3305 -15.3305 -15.2740 -15.2740 -4.5123 -4.5123 -4.1934 -4.1934 -3.7947 -3.7947 -3.5462 -3.5462 -3.0044 -3.0044 -2.6572 -2.6572 -2.4519 -2.4519 -2.1993 -2.1993 -0.2475 -0.2475 -0.1898 -0.1898 -0.0767 -0.0767 0.0067 0.0067 0.3646 0.3646 0.4806 0.4806 0.5431 0.5431 0.5650 0.5650 0.6051 0.6051 0.6309 0.6309 8.6299 8.6299 9.6317 9.6317 9.6337 9.6337 9.6862 9.6862 10.6696 10.6696 k =-0.3841 0.3468 0.5175 ( 12054 PWs) bands (ev): -19.6443 -19.6443 -19.5978 -19.5978 -18.3637 -18.3637 -18.3595 -18.3595 -15.3307 -15.3307 -15.2720 -15.2720 -4.5135 -4.5135 -4.1901 -4.1901 -3.7915 -3.7915 -3.5554 -3.5554 -2.9882 -2.9882 -2.6780 -2.6780 -2.4707 -2.4707 -2.2021 -2.2021 -0.2254 -0.2254 -0.1986 -0.1986 -0.0742 -0.0742 0.0221 0.0221 0.3732 0.3732 0.4734 0.4734 0.5413 0.5413 0.5632 0.5632 0.6138 0.6138 0.6307 0.6307 8.6778 8.6778 9.6135 9.6135 9.6793 9.6793 9.7383 9.7383 10.6028 10.6028 k =-0.3745 0.3382 0.5046 ( 12058 PWs) bands (ev): -19.6428 -19.6428 -19.5996 -19.5996 -18.3642 -18.3642 -18.3595 -18.3595 -15.3310 -15.3310 -15.2698 -15.2698 -4.5144 -4.5144 -4.1866 -4.1866 -3.7886 -3.7886 -3.5644 -3.5644 -2.9718 -2.9718 -2.6995 -2.6995 -2.4903 -2.4903 -2.2052 -2.2052 -0.2150 -0.2150 -0.1945 -0.1945 -0.0714 -0.0714 0.0385 0.0385 0.3805 0.3805 0.4661 0.4661 0.5370 0.5370 0.5627 0.5627 0.6224 0.6224 0.6326 0.6326 8.7283 8.7283 9.5919 9.5919 9.7303 9.7303 9.7946 9.7946 10.5398 10.5398 k =-0.3649 0.3295 0.4917 ( 12044 PWs) bands (ev): -19.6411 -19.6411 -19.6015 -19.6015 -18.3647 -18.3647 -18.3595 -18.3595 -15.3313 -15.3313 -15.2675 -15.2675 -4.5150 -4.5150 -4.1830 -4.1830 -3.7859 -3.7859 -3.5729 -3.5729 -2.9555 -2.9555 -2.7215 -2.7215 -2.5105 -2.5105 -2.2086 -2.2086 -0.2213 -0.2213 -0.1729 -0.1729 -0.0680 -0.0680 0.0558 0.0558 0.3863 0.3863 0.4587 0.4587 0.5298 0.5298 0.5644 0.5644 0.6280 0.6280 0.6392 0.6392 8.7810 8.7810 9.5689 9.5689 9.7849 9.7849 9.8550 9.8550 10.4806 10.4806 k =-0.3553 0.3208 0.4787 ( 12042 PWs) bands (ev): -19.6393 -19.6393 -19.6036 -19.6036 -18.3652 -18.3652 -18.3594 -18.3594 -15.3316 -15.3316 -15.2651 -15.2651 -4.5153 -4.5153 -4.1794 -4.1794 -3.7837 -3.7837 -3.5808 -3.5808 -2.9398 -2.9398 -2.7435 -2.7435 -2.5312 -2.5312 -2.2124 -2.2124 -0.2287 -0.2287 -0.1497 -0.1497 -0.0640 -0.0640 0.0738 0.0738 0.3905 0.3905 0.4516 0.4516 0.5202 0.5202 0.5679 0.5679 0.6313 0.6313 0.6492 0.6492 8.8353 8.8353 9.5446 9.5446 9.8427 9.8427 9.9195 9.9195 10.4253 10.4253 k =-0.3457 0.3121 0.4658 ( 12038 PWs) bands (ev): -19.6375 -19.6375 -19.6058 -19.6058 -18.3656 -18.3656 -18.3593 -18.3593 -15.3320 -15.3320 -15.2626 -15.2626 -4.5152 -4.5152 -4.1758 -4.1758 -3.7821 -3.7821 -3.5878 -3.5878 -2.9255 -2.9255 -2.7648 -2.7648 -2.5523 -2.5523 -2.2164 -2.2164 -0.2352 -0.2352 -0.1270 -0.1270 -0.0593 -0.0593 0.0923 0.0923 0.3933 0.3933 0.4448 0.4448 0.5088 0.5088 0.5729 0.5729 0.6347 0.6347 0.6604 0.6604 8.8903 8.8903 9.5191 9.5191 9.9035 9.9035 9.9878 9.9878 10.3739 10.3739 k =-0.3361 0.3035 0.4528 ( 12024 PWs) bands (ev): -19.6356 -19.6356 -19.6081 -19.6081 -18.3660 -18.3660 -18.3593 -18.3593 -15.3325 -15.3325 -15.2599 -15.2599 -4.5148 -4.5148 -4.1721 -4.1721 -3.7811 -3.7811 -3.5940 -3.5940 -2.9137 -2.9137 -2.7840 -2.7840 -2.5738 -2.5738 -2.2207 -2.2207 -0.2407 -0.2407 -0.1056 -0.1056 -0.0536 -0.0536 0.1112 0.1112 0.3948 0.3948 0.4387 0.4387 0.4962 0.4962 0.5790 0.5790 0.6385 0.6385 0.6719 0.6719 8.9451 8.9451 9.4926 9.4926 9.9668 9.9668 10.0599 10.0599 10.3266 10.3266 k =-0.3265 0.2948 0.4399 ( 12032 PWs) bands (ev): -19.6336 -19.6336 -19.6105 -19.6105 -18.3664 -18.3664 -18.3592 -18.3592 -15.3330 -15.3330 -15.2572 -15.2572 -4.5140 -4.5140 -4.1685 -4.1685 -3.7808 -3.7808 -3.5991 -3.5991 -2.9071 -2.9071 -2.7987 -2.7987 -2.5954 -2.5954 -2.2254 -2.2254 -0.2449 -0.2449 -0.0863 -0.0863 -0.0468 -0.0468 0.1301 0.1301 0.3951 0.3951 0.4335 0.4335 0.4826 0.4826 0.5858 0.5858 0.6431 0.6431 0.6836 0.6836 8.9984 8.9984 9.4654 9.4654 10.0321 10.0321 10.1357 10.1357 10.2832 10.2832 k =-0.3169 0.2861 0.4270 ( 12028 PWs) bands (ev): -19.6315 -19.6315 -19.6131 -19.6131 -18.3667 -18.3667 -18.3591 -18.3591 -15.3335 -15.3335 -15.2544 -15.2544 -4.5129 -4.5129 -4.1648 -4.1648 -3.7812 -3.7812 -3.6031 -3.6031 -2.9086 -2.9086 -2.8057 -2.8057 -2.6171 -2.6171 -2.2303 -2.2303 -0.2479 -0.2479 -0.0697 -0.0697 -0.0385 -0.0385 0.1489 0.1489 0.3945 0.3945 0.4294 0.4294 0.4686 0.4686 0.5932 0.5932 0.6482 0.6482 0.6952 0.6952 9.0483 9.0483 9.4378 9.4378 10.0984 10.0984 10.2150 10.2150 10.2439 10.2439 k =-0.3073 0.2775 0.4140 ( 12032 PWs) bands (ev): -19.6294 -19.6294 -19.6157 -19.6157 -18.3669 -18.3669 -18.3590 -18.3590 -15.3341 -15.3341 -15.2515 -15.2515 -4.5114 -4.5114 -4.1612 -4.1612 -3.7821 -3.7821 -3.6061 -3.6061 -2.9195 -2.9195 -2.8039 -2.8039 -2.6388 -2.6388 -2.2356 -2.2356 -0.2495 -0.2495 -0.0564 -0.0564 -0.0288 -0.0288 0.1672 0.1672 0.3933 0.3933 0.4263 0.4263 0.4550 0.4550 0.6009 0.6009 0.6540 0.6540 0.7066 0.7066 9.0924 9.0924 9.4107 9.4107 10.1637 10.1637 10.2093 10.2093 10.2979 10.2979 k =-0.2977 0.2688 0.4011 ( 12026 PWs) bands (ev): -19.6273 -19.6273 -19.6185 -19.6185 -18.3671 -18.3671 -18.3589 -18.3589 -15.3348 -15.3348 -15.2485 -15.2485 -4.5096 -4.5096 -4.1576 -4.1576 -3.7836 -3.7836 -3.6081 -3.6081 -2.9370 -2.9370 -2.7958 -2.7958 -2.6604 -2.6604 -2.2411 -2.2411 -0.2498 -0.2498 -0.0457 -0.0457 -0.0187 -0.0187 0.1846 0.1846 0.3916 0.3916 0.4226 0.4226 0.4440 0.4440 0.6086 0.6086 0.6604 0.6604 0.7179 0.7179 9.1276 9.1276 9.3850 9.3850 10.1749 10.1749 10.2307 10.2307 10.3839 10.3839 k =-0.2881 0.2601 0.3882 ( 12020 PWs) bands (ev): -19.6252 -19.6252 -19.6212 -19.6212 -18.3672 -18.3672 -18.3588 -18.3588 -15.3355 -15.3355 -15.2455 -15.2455 -4.5075 -4.5075 -4.1541 -4.1541 -3.7853 -3.7853 -3.6093 -3.6093 -2.9581 -2.9581 -2.7846 -2.7846 -2.6819 -2.6819 -2.2468 -2.2468 -0.2489 -0.2489 -0.0369 -0.0369 -0.0093 -0.0093 0.2005 0.2005 0.3897 0.3897 0.4146 0.4146 0.4401 0.4401 0.6162 0.6162 0.6674 0.6674 0.7290 0.7290 9.1497 9.1497 9.3626 9.3626 10.1477 10.1477 10.2895 10.2895 10.4731 10.4731 k =-0.2785 0.2514 0.3752 ( 12020 PWs) bands (ev): -19.6243 -19.6243 -19.6228 -19.6228 -18.3673 -18.3673 -18.3586 -18.3586 -15.3363 -15.3363 -15.2425 -15.2425 -4.5052 -4.5052 -4.1506 -4.1506 -3.7872 -3.7872 -3.6098 -3.6098 -2.9810 -2.9810 -2.7720 -2.7720 -2.7031 -2.7031 -2.2528 -2.2528 -0.2466 -0.2466 -0.0295 -0.0295 -0.0013 -0.0013 0.2143 0.2143 0.3878 0.3878 0.4033 0.4033 0.4434 0.4434 0.6236 0.6236 0.6751 0.6751 0.7397 0.7397 9.1550 9.1550 9.3448 9.3448 10.1238 10.1238 10.3403 10.3403 10.5650 10.5650 k =-0.2689 0.2428 0.3623 ( 12030 PWs) bands (ev): -19.6272 -19.6272 -19.6206 -19.6206 -18.3673 -18.3673 -18.3585 -18.3585 -15.3371 -15.3371 -15.2394 -15.2394 -4.5027 -4.5027 -4.1472 -4.1472 -3.7890 -3.7890 -3.6098 -3.6098 -3.0045 -3.0045 -2.7592 -2.7592 -2.7239 -2.7239 -2.2591 -2.2591 -0.2432 -0.2432 -0.0238 -0.0238 0.0055 0.0055 0.2250 0.2250 0.3859 0.3859 0.3924 0.3924 0.4510 0.4510 0.6306 0.6306 0.6835 0.6835 0.7501 0.7501 9.1423 9.1423 9.3305 9.3305 10.1033 10.1033 10.3781 10.3781 10.5371 10.5371 k =-0.2593 0.2341 0.3493 ( 12032 PWs) bands (ev): -19.6302 -19.6302 -19.6184 -19.6184 -18.3672 -18.3672 -18.3584 -18.3584 -15.3380 -15.3380 -15.2363 -15.2363 -4.5001 -4.5001 -4.1437 -4.1437 -3.7905 -3.7905 -3.6094 -3.6094 -3.0283 -3.0283 -2.7480 -2.7480 -2.7428 -2.7428 -2.2655 -2.2655 -0.2387 -0.2387 -0.0209 -0.0209 0.0121 0.0121 0.2314 0.2314 0.3836 0.3836 0.3848 0.3848 0.4618 0.4618 0.6370 0.6370 0.6925 0.6925 0.7601 0.7601 9.1143 9.1143 9.3155 9.3155 10.0864 10.0864 10.3984 10.3984 10.4423 10.4423 k =-0.2497 0.2254 0.3364 ( 12045 PWs) bands (ev): -19.6333 -19.6333 -19.6162 -19.6162 -18.3670 -18.3670 -18.3582 -18.3582 -15.3389 -15.3389 -15.2332 -15.2332 -4.4975 -4.4975 -4.1403 -4.1403 -3.7916 -3.7916 -3.6089 -3.6089 -3.0519 -3.0519 -2.7649 -2.7649 -2.7336 -2.7336 -2.2722 -2.2722 -0.2331 -0.2331 -0.0216 -0.0216 0.0197 0.0197 0.2325 0.2325 0.3794 0.3794 0.3839 0.3839 0.4750 0.4750 0.6429 0.6429 0.7022 0.7022 0.7698 0.7698 9.0745 9.0745 9.2960 9.2960 10.0729 10.0729 10.3496 10.3496 10.3996 10.3996 k =-0.2401 0.2168 0.3235 ( 12041 PWs) bands (ev): -19.6364 -19.6364 -19.6139 -19.6139 -18.3668 -18.3668 -18.3580 -18.3580 -15.3399 -15.3399 -15.2300 -15.2300 -4.4949 -4.4949 -4.1368 -4.1368 -3.7923 -3.7923 -3.6083 -3.6083 -3.0750 -3.0750 -2.7844 -2.7844 -2.7220 -2.7220 -2.2790 -2.2790 -0.2267 -0.2267 -0.0259 -0.0259 0.0284 0.0284 0.2279 0.2279 0.3783 0.3783 0.3850 0.3850 0.4903 0.4903 0.6481 0.6481 0.7125 0.7125 0.7791 0.7791 9.0252 9.0252 9.2707 9.2707 10.0625 10.0625 10.2595 10.2595 10.3830 10.3830 k =-0.2305 0.2081 0.3105 ( 12049 PWs) bands (ev): -19.6395 -19.6395 -19.6117 -19.6117 -18.3665 -18.3665 -18.3579 -18.3579 -15.3410 -15.3410 -15.2269 -15.2269 -4.4925 -4.4925 -4.1331 -4.1331 -3.7923 -3.7923 -3.6077 -3.6077 -3.0976 -3.0976 -2.8035 -2.8035 -2.7110 -2.7110 -2.2859 -2.2859 -0.2195 -0.2195 -0.0334 -0.0334 0.0380 0.0380 0.2183 0.2183 0.3788 0.3788 0.3894 0.3894 0.5071 0.5071 0.6527 0.6527 0.7233 0.7233 0.7880 0.7880 8.9678 8.9678 9.2402 9.2402 10.0550 10.0550 10.1724 10.1724 10.3527 10.3527 k =-0.2209 0.1994 0.2976 ( 12037 PWs) bands (ev): -19.6426 -19.6426 -19.6095 -19.6095 -18.3661 -18.3661 -18.3577 -18.3577 -15.3420 -15.3420 -15.2239 -15.2239 -4.4902 -4.4902 -4.1292 -4.1292 -3.7917 -3.7917 -3.6073 -3.6073 -3.1194 -3.1194 -2.8219 -2.8219 -2.7008 -2.7008 -2.2930 -2.2930 -0.2118 -0.2118 -0.0433 -0.0433 0.0483 0.0483 0.2052 0.2052 0.3797 0.3797 0.3973 0.3973 0.5248 0.5248 0.6565 0.6565 0.7345 0.7345 0.7967 0.7967 8.9030 8.9030 9.2064 9.2064 10.0481 10.0481 10.0903 10.0903 10.3130 10.3130 k =-0.2113 0.1908 0.2846 ( 12045 PWs) bands (ev): -19.6458 -19.6458 -19.6073 -19.6073 -18.3657 -18.3657 -18.3575 -18.3575 -15.3431 -15.3431 -15.2208 -15.2208 -4.4882 -4.4882 -4.1250 -4.1250 -3.7906 -3.7906 -3.6070 -3.6070 -3.1404 -3.1404 -2.8397 -2.8397 -2.6915 -2.6915 -2.3001 -2.3001 -0.2037 -0.2037 -0.0551 -0.0551 0.0587 0.0587 0.1900 0.1900 0.3813 0.3813 0.4075 0.4075 0.5431 0.5431 0.6598 0.6598 0.7460 0.7460 0.8050 0.8050 8.8320 8.8320 9.1709 9.1709 10.0007 10.0007 10.0545 10.0545 10.2674 10.2674 k =-0.2017 0.1821 0.2717 ( 12047 PWs) bands (ev): -19.6489 -19.6489 -19.6052 -19.6052 -18.3652 -18.3652 -18.3573 -18.3573 -15.3443 -15.3443 -15.2178 -15.2178 -4.4866 -4.4866 -4.1204 -4.1204 -3.7889 -3.7889 -3.6070 -3.6070 -3.1605 -3.1605 -2.8568 -2.8568 -2.6832 -2.6832 -2.3073 -2.3073 -0.1954 -0.1954 -0.0684 -0.0684 0.0690 0.0690 0.1738 0.1738 0.3836 0.3836 0.4188 0.4188 0.5616 0.5616 0.6624 0.6624 0.7576 0.7576 0.8131 0.8131 8.7559 8.7559 9.1350 9.1350 9.9237 9.9237 10.0539 10.0539 10.2187 10.2187 k =-0.1921 0.1734 0.2588 ( 12057 PWs) bands (ev): -19.6520 -19.6520 -19.6031 -19.6031 -18.3646 -18.3646 -18.3571 -18.3571 -15.3454 -15.3454 -15.2149 -15.2149 -4.4854 -4.4854 -4.1152 -4.1152 -3.7869 -3.7869 -3.6073 -3.6073 -3.1795 -3.1795 -2.8732 -2.8732 -2.6757 -2.6757 -2.3145 -2.3145 -0.1870 -0.1870 -0.0828 -0.0828 0.0781 0.0781 0.1582 0.1582 0.3869 0.3869 0.4308 0.4308 0.5800 0.5800 0.6644 0.6644 0.7691 0.7691 0.8212 0.8212 8.6762 8.6762 9.0997 9.0997 9.8484 9.8484 10.0569 10.0569 10.1690 10.1690 k =-0.1825 0.1647 0.2458 ( 12061 PWs) bands (ev): -19.6550 -19.6550 -19.6011 -19.6011 -18.3641 -18.3641 -18.3569 -18.3569 -15.3466 -15.3466 -15.2120 -15.2120 -4.4846 -4.4846 -4.1095 -4.1095 -3.7846 -3.7846 -3.6078 -3.6078 -3.1973 -3.1973 -2.8888 -2.8888 -2.6692 -2.6692 -2.3217 -2.3217 -0.1790 -0.1790 -0.0978 -0.0978 0.0843 0.0843 0.1454 0.1454 0.3913 0.3913 0.4429 0.4429 0.5980 0.5980 0.6658 0.6658 0.7804 0.7804 0.8293 0.8293 8.5941 8.5941 9.0653 9.0653 9.7760 9.7760 10.0611 10.0611 10.1205 10.1205 k =-0.1729 0.1561 0.2329 ( 12063 PWs) bands (ev): -19.6580 -19.6580 -19.5991 -19.5991 -18.3634 -18.3634 -18.3567 -18.3567 -15.3478 -15.3478 -15.2092 -15.2092 -4.4843 -4.4843 -4.1032 -4.1032 -3.7821 -3.7821 -3.6085 -3.6085 -3.2141 -3.2141 -2.9037 -2.9037 -2.6635 -2.6635 -2.3289 -2.3289 -0.1715 -0.1715 -0.1130 -0.1130 0.0839 0.0839 0.1393 0.1393 0.3968 0.3968 0.4550 0.4550 0.6154 0.6154 0.6668 0.6668 0.7911 0.7911 0.8376 0.8376 8.5110 8.5110 9.0321 9.0321 9.7069 9.7069 10.0541 10.0541 10.0858 10.0858 k =-0.1633 0.1474 0.2200 ( 12063 PWs) bands (ev): -19.6609 -19.6609 -19.5972 -19.5972 -18.3628 -18.3628 -18.3565 -18.3565 -15.3490 -15.3490 -15.2065 -15.2065 -4.4845 -4.4845 -4.0962 -4.0962 -3.7797 -3.7797 -3.6094 -3.6094 -3.2296 -3.2296 -2.9178 -2.9178 -2.6588 -2.6588 -2.3360 -2.3360 -0.1655 -0.1655 -0.1275 -0.1275 0.0751 0.0751 0.1417 0.1417 0.4033 0.4033 0.4668 0.4668 0.6319 0.6319 0.6673 0.6673 0.8011 0.8011 0.8464 0.8464 8.4280 8.4280 9.0001 9.0001 9.6411 9.6411 10.0141 10.0141 10.0874 10.0874 k =-0.1537 0.1387 0.2070 ( 12067 PWs) bands (ev): -19.6638 -19.6638 -19.5953 -19.5953 -18.3621 -18.3621 -18.3563 -18.3563 -15.3501 -15.3501 -15.2039 -15.2039 -4.4852 -4.4852 -4.0884 -4.0884 -3.7776 -3.7776 -3.6104 -3.6104 -3.2438 -3.2438 -2.9310 -2.9310 -2.6549 -2.6549 -2.3430 -2.3430 -0.1638 -0.1638 -0.1381 -0.1381 0.0614 0.0614 0.1494 0.1494 0.4110 0.4110 0.4783 0.4783 0.6469 0.6469 0.6679 0.6679 0.8100 0.8100 0.8557 0.8557 8.3461 8.3461 8.9696 8.9696 9.5788 9.5788 9.9687 9.9687 10.0978 10.0978 k =-0.1440 0.1301 0.1941 ( 12067 PWs) bands (ev): -19.6665 -19.6665 -19.5936 -19.5936 -18.3614 -18.3614 -18.3561 -18.3561 -15.3513 -15.3513 -15.2014 -15.2014 -4.4862 -4.4862 -4.0800 -4.0800 -3.7760 -3.7760 -3.6113 -3.6113 -3.2568 -3.2568 -2.9435 -2.9435 -2.6518 -2.6518 -2.3499 -2.3499 -0.1715 -0.1715 -0.1400 -0.1400 0.0460 0.0460 0.1593 0.1593 0.4196 0.4196 0.4894 0.4894 0.6584 0.6584 0.6705 0.6705 0.8179 0.8179 0.8655 0.8655 8.2661 8.2661 8.9405 8.9405 9.5199 9.5199 9.9244 9.9244 10.1104 10.1104 k =-0.1344 0.1214 0.1811 ( 12047 PWs) bands (ev): -19.6691 -19.6691 -19.5919 -19.5919 -18.3607 -18.3607 -18.3559 -18.3559 -15.3524 -15.3524 -15.1990 -15.1990 -4.4877 -4.4877 -4.0709 -4.0709 -3.7751 -3.7751 -3.6120 -3.6120 -3.2685 -3.2685 -2.9551 -2.9551 -2.6495 -2.6495 -2.3566 -2.3566 -0.1849 -0.1849 -0.1365 -0.1365 0.0304 0.0304 0.1700 0.1700 0.4291 0.4291 0.5000 0.5000 0.6617 0.6617 0.6798 0.6798 0.8249 0.8249 0.8758 0.8758 8.1887 8.1887 8.9129 8.9129 9.4645 9.4645 9.8822 9.8822 10.1244 10.1244 k =-0.1248 0.1127 0.1682 ( 12043 PWs) bands (ev): -19.6717 -19.6717 -19.5903 -19.5903 -18.3600 -18.3600 -18.3557 -18.3557 -15.3535 -15.3535 -15.1968 -15.1968 -4.4895 -4.4895 -4.0612 -4.0612 -3.7750 -3.7750 -3.6126 -3.6126 -3.2790 -3.2790 -2.9659 -2.9659 -2.6478 -2.6478 -2.3630 -2.3630 -0.1994 -0.1994 -0.1322 -0.1322 0.0151 0.0151 0.1809 0.1809 0.4394 0.4394 0.5101 0.5101 0.6611 0.6611 0.6913 0.6913 0.8311 0.8311 0.8862 0.8862 8.1145 8.1145 8.8868 8.8868 9.4128 9.4128 9.8424 9.8424 10.1392 10.1392 k =-0.1152 0.1040 0.1553 ( 12039 PWs) bands (ev): -19.6740 -19.6740 -19.5888 -19.5888 -18.3593 -18.3593 -18.3555 -18.3555 -15.3545 -15.3545 -15.1947 -15.1947 -4.4915 -4.4915 -4.0509 -4.0509 -3.7760 -3.7760 -3.6127 -3.6127 -3.2882 -3.2882 -2.9758 -2.9758 -2.6468 -2.6468 -2.3692 -2.3692 -0.2140 -0.2140 -0.1282 -0.1282 0.0007 0.0007 0.1916 0.1916 0.4503 0.4503 0.5196 0.5196 0.6594 0.6594 0.7022 0.7022 0.8366 0.8366 0.8966 0.8966 8.0440 8.0440 8.8624 8.8624 9.3647 9.3647 9.8051 9.8051 10.1546 10.1546 k =-0.1056 0.0954 0.1423 ( 12057 PWs) bands (ev): -19.6763 -19.6763 -19.5874 -19.5874 -18.3586 -18.3586 -18.3553 -18.3553 -15.3555 -15.3555 -15.1927 -15.1927 -4.4937 -4.4937 -4.0402 -4.0402 -3.7780 -3.7780 -3.6125 -3.6125 -3.2964 -3.2964 -2.9849 -2.9849 -2.6463 -2.6463 -2.3751 -2.3751 -0.2281 -0.2281 -0.1247 -0.1247 -0.0127 -0.0127 0.2020 0.2020 0.4616 0.4616 0.5286 0.5286 0.6572 0.6572 0.7120 0.7120 0.8417 0.8417 0.9067 0.9067 7.9776 7.9776 8.8396 8.8396 9.3202 9.3202 9.7706 9.7706 10.1702 10.1702 k =-0.0960 0.0867 0.1294 ( 12057 PWs) bands (ev): -19.6783 -19.6783 -19.5861 -19.5861 -18.3580 -18.3580 -18.3551 -18.3551 -15.3565 -15.3565 -15.1909 -15.1909 -4.4960 -4.4960 -4.0290 -4.0290 -3.7812 -3.7812 -3.6119 -3.6119 -3.3034 -3.3034 -2.9932 -2.9932 -2.6462 -2.6462 -2.3807 -2.3807 -0.2414 -0.2414 -0.1221 -0.1221 -0.0247 -0.0247 0.2119 0.2119 0.4731 0.4731 0.5370 0.5370 0.6546 0.6546 0.7205 0.7205 0.8464 0.8464 0.9165 0.9165 7.9158 7.9158 8.8185 8.8185 9.2795 9.2795 9.7388 9.7388 10.1857 10.1857 k =-0.0864 0.0780 0.1164 ( 12065 PWs) bands (ev): -19.6802 -19.6802 -19.5850 -19.5850 -18.3574 -18.3574 -18.3550 -18.3550 -15.3573 -15.3573 -15.1892 -15.1892 -4.4984 -4.4984 -4.0177 -4.0177 -3.7855 -3.7855 -3.6109 -3.6109 -3.3094 -3.3094 -3.0006 -3.0006 -2.6465 -2.6465 -2.3858 -2.3858 -0.2539 -0.2539 -0.1205 -0.1205 -0.0353 -0.0353 0.2212 0.2212 0.4845 0.4845 0.5450 0.5450 0.6516 0.6516 0.7279 0.7279 0.8508 0.8508 0.9256 0.9256 7.8589 7.8589 8.7993 8.7993 9.2426 9.2426 9.7100 9.7100 10.2008 10.2008 k =-0.0768 0.0694 0.1035 ( 12065 PWs) bands (ev): -19.6820 -19.6820 -19.5839 -19.5839 -18.3568 -18.3568 -18.3548 -18.3548 -15.3581 -15.3581 -15.1877 -15.1877 -4.5007 -4.5007 -4.0062 -4.0062 -3.7907 -3.7907 -3.6097 -3.6097 -3.3145 -3.3145 -3.0072 -3.0072 -2.6471 -2.6471 -2.3906 -2.3906 -0.2654 -0.2654 -0.1197 -0.1197 -0.0443 -0.0443 0.2299 0.2299 0.4957 0.4957 0.5524 0.5524 0.6482 0.6482 0.7340 0.7340 0.8550 0.8550 0.9341 0.9341 7.8073 7.8073 8.7819 8.7819 9.2094 9.2094 9.6841 9.6841 10.2151 10.2151 k =-0.0672 0.0607 0.0906 ( 12069 PWs) bands (ev): -19.6835 -19.6835 -19.5830 -19.5830 -18.3563 -18.3563 -18.3546 -18.3546 -15.3589 -15.3589 -15.1863 -15.1863 -4.5029 -4.5029 -3.9947 -3.9947 -3.7968 -3.7968 -3.6082 -3.6082 -3.3187 -3.3187 -3.0130 -3.0130 -2.6479 -2.6479 -2.3949 -2.3949 -0.2758 -0.2758 -0.1199 -0.1199 -0.0516 -0.0516 0.2377 0.2377 0.5064 0.5064 0.5594 0.5594 0.6446 0.6446 0.7391 0.7391 0.8588 0.8588 0.9417 0.9417 7.7610 7.7610 8.7663 8.7663 9.1801 9.1801 9.6612 9.6612 10.2282 10.2282 k =-0.0576 0.0520 0.0776 ( 12065 PWs) bands (ev): -19.6849 -19.6849 -19.5821 -19.5821 -18.3559 -18.3559 -18.3545 -18.3545 -15.3595 -15.3595 -15.1851 -15.1851 -4.5049 -4.5049 -3.9835 -3.9835 -3.8035 -3.8035 -3.6067 -3.6067 -3.3222 -3.3222 -3.0181 -3.0181 -2.6488 -2.6488 -2.3987 -2.3987 -0.2849 -0.2849 -0.1210 -0.1210 -0.0573 -0.0573 0.2447 0.2447 0.5162 0.5162 0.5661 0.5661 0.6407 0.6407 0.7431 0.7431 0.8623 0.8623 0.9485 0.9485 7.7205 7.7205 8.7528 8.7528 9.1546 9.1546 9.6413 9.6413 10.2400 10.2400 k =-0.0480 0.0434 0.0647 ( 12075 PWs) bands (ev): -19.6861 -19.6861 -19.5814 -19.5814 -18.3555 -18.3555 -18.3543 -18.3543 -15.3601 -15.3601 -15.1841 -15.1841 -4.5067 -4.5067 -3.9728 -3.9728 -3.8105 -3.8105 -3.6052 -3.6052 -3.3249 -3.3249 -3.0223 -3.0223 -2.6497 -2.6497 -2.4019 -2.4019 -0.2928 -0.2928 -0.1226 -0.1226 -0.0614 -0.0614 0.2507 0.2507 0.5250 0.5250 0.5724 0.5724 0.6365 0.6365 0.7462 0.7462 0.8654 0.8654 0.9544 0.9544 7.6859 7.6859 8.7412 8.7412 9.1330 9.1330 9.6244 9.6244 10.2498 10.2498 k =-0.0384 0.0347 0.0518 ( 12065 PWs) bands (ev): -19.6870 -19.6870 -19.5809 -19.5809 -18.3552 -18.3552 -18.3542 -18.3542 -15.3605 -15.3605 -15.1833 -15.1833 -4.5083 -4.5083 -3.9628 -3.9628 -3.8174 -3.8174 -3.6038 -3.6038 -3.3271 -3.3271 -3.0257 -3.0257 -2.6505 -2.6505 -2.4047 -2.4047 -0.2993 -0.2993 -0.1245 -0.1245 -0.0644 -0.0644 0.2557 0.2557 0.5325 0.5325 0.5784 0.5784 0.6322 0.6322 0.7486 0.7486 0.8680 0.8680 0.9592 0.9592 7.6573 7.6573 8.7317 8.7317 9.1153 9.1153 9.6105 9.6105 10.2573 10.2573 k =-0.0288 0.0260 0.0388 ( 12067 PWs) bands (ev): -19.6878 -19.6878 -19.5804 -19.5804 -18.3550 -18.3550 -18.3541 -18.3541 -15.3609 -15.3609 -15.1826 -15.1826 -4.5095 -4.5095 -3.9540 -3.9540 -3.8239 -3.8239 -3.6026 -3.6026 -3.3287 -3.3287 -3.0284 -3.0284 -2.6513 -2.6513 -2.4068 -2.4068 -0.3045 -0.3045 -0.1263 -0.1263 -0.0663 -0.0663 0.2597 0.2597 0.5385 0.5385 0.5842 0.5842 0.6277 0.6277 0.7503 0.7503 0.8701 0.8701 0.9630 0.9630 7.6349 7.6349 8.7243 8.7243 9.1015 9.1015 9.5998 9.5998 10.2623 10.2623 k =-0.0192 0.0173 0.0259 ( 12073 PWs) bands (ev): -19.6883 -19.6883 -19.5801 -19.5801 -18.3549 -18.3549 -18.3540 -18.3540 -15.3611 -15.3611 -15.1822 -15.1822 -4.5104 -4.5104 -3.9469 -3.9469 -3.8293 -3.8293 -3.6017 -3.6017 -3.3298 -3.3298 -3.0303 -3.0303 -2.6518 -2.6518 -2.4083 -2.4083 -0.3082 -0.3082 -0.1279 -0.1279 -0.0675 -0.0675 0.2626 0.2626 0.5428 0.5428 0.5894 0.5894 0.6234 0.6234 0.7515 0.7515 0.8717 0.8717 0.9658 0.9658 7.6189 7.6189 8.7189 8.7189 9.0916 9.0916 9.5921 9.5921 10.2648 10.2648 k =-0.0096 0.0087 0.0129 ( 12079 PWs) bands (ev): -19.6886 -19.6886 -19.5799 -19.5799 -18.3548 -18.3548 -18.3539 -18.3539 -15.3613 -15.3613 -15.1819 -15.1819 -4.5110 -4.5110 -3.9423 -3.9423 -3.8330 -3.8330 -3.6012 -3.6012 -3.3304 -3.3304 -3.0314 -3.0314 -2.6522 -2.6522 -2.4093 -2.4093 -0.3104 -0.3104 -0.1289 -0.1289 -0.0682 -0.0682 0.2643 0.2643 0.5454 0.5454 0.5935 0.5935 0.6200 0.6200 0.7521 0.7521 0.8727 0.8727 0.9674 0.9674 7.6092 7.6092 8.7157 8.7157 9.0857 9.0857 9.5874 9.5874 10.2658 10.2658 k = 0.0000 0.0000 0.0000 ( 12089 PWs) bands (ev): -19.6887 -19.6887 -19.5798 -19.5798 -18.3548 -18.3548 -18.3539 -18.3539 -15.3613 -15.3613 -15.1818 -15.1818 -4.5111 -4.5111 -3.9407 -3.9407 -3.8343 -3.8343 -3.6010 -3.6010 -3.3306 -3.3306 -3.0318 -3.0318 -2.6523 -2.6523 -2.4096 -2.4096 -0.3112 -0.3112 -0.1292 -0.1292 -0.0684 -0.0684 0.2649 0.2649 0.5463 0.5463 0.5951 0.5951 0.6185 0.6185 0.7524 0.7524 0.8730 0.8730 0.9680 0.9680 7.6060 7.6060 8.7147 8.7147 9.0837 9.0837 9.5859 9.5859 10.2660 10.2660 k = 0.0000 0.0000 0.0000 ( 12089 PWs) bands (ev): -19.6887 -19.6887 -19.5798 -19.5798 -18.3548 -18.3548 -18.3539 -18.3539 -15.3613 -15.3613 -15.1818 -15.1818 -4.5111 -4.5111 -3.9407 -3.9407 -3.8343 -3.8343 -3.6010 -3.6010 -3.3306 -3.3306 -3.0318 -3.0318 -2.6523 -2.6523 -2.4096 -2.4096 -0.3112 -0.3112 -0.1292 -0.1292 -0.0684 -0.0684 0.2649 0.2649 0.5463 0.5463 0.5951 0.5951 0.6185 0.6185 0.7524 0.7524 0.8730 0.8730 0.9680 0.9680 7.6060 7.6060 8.7147 8.7147 9.0837 9.0837 9.5859 9.5859 10.2660 10.2660 k = 0.0122 0.0135-0.0000 ( 12077 PWs) bands (ev): -19.6887 -19.6887 -19.5798 -19.5798 -18.3548 -18.3548 -18.3539 -18.3539 -15.3612 -15.3612 -15.1820 -15.1820 -4.5104 -4.5104 -3.9413 -3.9413 -3.8343 -3.8343 -3.6010 -3.6010 -3.3297 -3.3297 -3.0322 -3.0322 -2.6515 -2.6515 -2.4099 -2.4099 -0.3109 -0.3109 -0.1294 -0.1294 -0.0686 -0.0686 0.2637 0.2637 0.5461 0.5461 0.5949 0.5949 0.6186 0.6186 0.7522 0.7522 0.8729 0.8729 0.9674 0.9674 7.6081 7.6081 8.7197 8.7197 9.0837 9.0837 9.5841 9.5841 10.2677 10.2677 k = 0.0244 0.0270-0.0000 ( 12093 PWs) bands (ev): -19.6885 -19.6885 -19.5799 -19.5799 -18.3548 -18.3548 -18.3539 -18.3539 -15.3609 -15.3609 -15.1827 -15.1827 -4.5082 -4.5082 -3.9431 -3.9431 -3.8342 -3.8342 -3.6009 -3.6009 -3.3269 -3.3269 -3.0334 -3.0334 -2.6491 -2.6491 -2.4109 -2.4109 -0.3099 -0.3099 -0.1298 -0.1298 -0.0694 -0.0694 0.2603 0.2603 0.5454 0.5454 0.5944 0.5944 0.6187 0.6187 0.7519 0.7519 0.8726 0.8726 0.9658 0.9658 7.6144 7.6144 8.7347 8.7347 9.0835 9.0835 9.5786 9.5786 10.2728 10.2728 k = 0.0366 0.0405-0.0000 ( 12097 PWs) bands (ev): -19.6883 -19.6883 -19.5799 -19.5799 -18.3549 -18.3549 -18.3540 -18.3540 -15.3604 -15.3604 -15.1838 -15.1838 -4.5045 -4.5045 -3.9461 -3.9461 -3.8341 -3.8341 -3.6008 -3.6008 -3.3223 -3.3223 -3.0354 -3.0354 -2.6452 -2.6452 -2.4126 -2.4126 -0.3082 -0.3082 -0.1306 -0.1306 -0.0705 -0.0705 0.2546 0.2546 0.5443 0.5443 0.5934 0.5934 0.6189 0.6189 0.7513 0.7513 0.8722 0.8722 0.9631 0.9631 7.6250 7.6250 8.7597 8.7597 9.0831 9.0831 9.5695 9.5695 10.2814 10.2814 k = 0.0488 0.0540 0.0000 ( 12085 PWs) bands (ev): -19.6879 -19.6879 -19.5800 -19.5800 -18.3549 -18.3549 -18.3540 -18.3540 -15.3596 -15.3596 -15.1854 -15.1854 -4.4995 -4.4995 -3.9503 -3.9503 -3.8340 -3.8340 -3.6005 -3.6005 -3.3159 -3.3159 -3.0380 -3.0380 -2.6399 -2.6399 -2.4149 -2.4149 -0.3060 -0.3060 -0.1316 -0.1316 -0.0721 -0.0721 0.2467 0.2467 0.5429 0.5429 0.5921 0.5921 0.6193 0.6193 0.7503 0.7503 0.8715 0.8715 0.9593 0.9593 7.6396 7.6396 8.7945 8.7945 9.0825 9.0825 9.5572 9.5572 10.2933 10.2933 k = 0.0610 0.0675-0.0000 ( 12073 PWs) bands (ev): -19.6875 -19.6875 -19.5801 -19.5801 -18.3550 -18.3550 -18.3541 -18.3541 -15.3587 -15.3587 -15.1874 -15.1874 -4.4931 -4.4931 -3.9558 -3.9558 -3.8338 -3.8338 -3.6002 -3.6002 -3.3075 -3.3075 -3.0412 -3.0412 -2.6331 -2.6331 -2.4177 -2.4177 -0.3031 -0.3031 -0.1329 -0.1329 -0.0742 -0.0742 0.2366 0.2366 0.5411 0.5411 0.5905 0.5905 0.6197 0.6197 0.7491 0.7491 0.8706 0.8706 0.9544 0.9544 7.6583 7.6583 8.8390 8.8390 9.0815 9.0815 9.5417 9.5417 10.3086 10.3086 k = 0.0732 0.0810-0.0000 ( 12073 PWs) bands (ev): -19.6869 -19.6869 -19.5802 -19.5802 -18.3551 -18.3551 -18.3542 -18.3542 -15.3575 -15.3575 -15.1898 -15.1898 -4.4855 -4.4855 -3.9625 -3.9625 -3.8335 -3.8335 -3.5996 -3.5996 -3.2972 -3.2972 -3.0449 -3.0449 -2.6252 -2.6252 -2.4211 -2.4211 -0.2996 -0.2996 -0.1345 -0.1345 -0.0766 -0.0766 0.2245 0.2245 0.5391 0.5391 0.5886 0.5886 0.6201 0.6201 0.7476 0.7476 0.8694 0.8694 0.9484 0.9484 7.6809 7.6809 8.8931 8.8931 9.0800 9.0800 9.5237 9.5237 10.3272 10.3272 k = 0.0854 0.0945-0.0000 ( 12065 PWs) bands (ev): -19.6863 -19.6863 -19.5803 -19.5803 -18.3552 -18.3552 -18.3543 -18.3543 -15.3561 -15.3561 -15.1925 -15.1925 -4.4768 -4.4768 -3.9704 -3.9704 -3.8332 -3.8332 -3.5989 -3.5989 -3.2849 -3.2849 -3.0491 -3.0491 -2.6162 -2.6162 -2.4250 -2.4250 -0.2955 -0.2955 -0.1363 -0.1363 -0.0793 -0.0793 0.2103 0.2103 0.5369 0.5369 0.5864 0.5864 0.6207 0.6207 0.7457 0.7457 0.8679 0.8679 0.9413 0.9413 7.7073 7.7073 8.9565 8.9565 9.0778 9.0778 9.5033 9.5033 10.3492 10.3492 k = 0.0976 0.1081 0.0000 ( 12065 PWs) bands (ev): -19.6856 -19.6856 -19.5805 -19.5805 -18.3553 -18.3553 -18.3544 -18.3544 -15.3546 -15.3546 -15.1957 -15.1957 -4.4672 -4.4672 -3.9796 -3.9796 -3.8329 -3.8329 -3.5979 -3.5979 -3.2706 -3.2706 -3.0534 -3.0534 -2.6063 -2.6063 -2.4293 -2.4293 -0.2909 -0.2909 -0.1383 -0.1383 -0.0823 -0.0823 0.1944 0.1944 0.5345 0.5345 0.5840 0.5840 0.6214 0.6214 0.7434 0.7434 0.8660 0.8660 0.9331 0.9331 7.7374 7.7374 9.0291 9.0291 9.0746 9.0746 9.4813 9.4813 10.3745 10.3745 k = 0.1098 0.1216-0.0000 ( 12057 PWs) bands (ev): -19.6848 -19.6848 -19.5807 -19.5807 -18.3554 -18.3554 -18.3545 -18.3545 -15.3529 -15.3529 -15.1993 -15.1993 -4.4567 -4.4567 -3.9901 -3.9901 -3.8325 -3.8325 -3.5966 -3.5966 -3.2543 -3.2543 -3.0580 -3.0580 -2.5955 -2.5955 -2.4339 -2.4339 -0.2857 -0.2857 -0.1404 -0.1404 -0.0856 -0.0856 0.1768 0.1768 0.5320 0.5320 0.5814 0.5814 0.6221 0.6221 0.7406 0.7406 0.8637 0.8637 0.9239 0.9239 7.7710 7.7710 9.0701 9.0701 9.1104 9.1104 9.4583 9.4583 10.4031 10.4031 k = 0.1220 0.1351-0.0000 ( 12065 PWs) bands (ev): -19.6839 -19.6839 -19.5808 -19.5808 -18.3556 -18.3556 -18.3546 -18.3546 -15.3510 -15.3510 -15.2031 -15.2031 -4.4455 -4.4455 -4.0018 -4.0018 -3.8322 -3.8322 -3.5949 -3.5949 -3.2359 -3.2359 -3.0627 -3.0627 -2.5841 -2.5841 -2.4389 -2.4389 -0.2800 -0.2800 -0.1427 -0.1427 -0.0889 -0.0889 0.1576 0.1576 0.5295 0.5295 0.5787 0.5787 0.6229 0.6229 0.7373 0.7373 0.8610 0.8610 0.9136 0.9136 7.8081 7.8081 9.0639 9.0639 9.2002 9.2002 9.4349 9.4349 10.4349 10.4349 k = 0.1341 0.1486-0.0000 ( 12085 PWs) bands (ev): -19.6829 -19.6829 -19.5810 -19.5810 -18.3557 -18.3557 -18.3548 -18.3548 -15.3489 -15.3489 -15.2073 -15.2073 -4.4338 -4.4338 -4.0148 -4.0148 -3.8317 -3.8317 -3.5928 -3.5928 -3.2153 -3.2153 -3.0674 -3.0674 -2.5722 -2.5722 -2.4440 -2.4440 -0.2739 -0.2739 -0.1450 -0.1450 -0.0924 -0.0924 0.1371 0.1371 0.5270 0.5270 0.5759 0.5759 0.6237 0.6237 0.7336 0.7336 0.8577 0.8577 0.9022 0.9022 7.8484 7.8484 9.0554 9.0554 9.2980 9.2980 9.4120 9.4120 10.4698 10.4698 k = 0.1463 0.1621-0.0000 ( 12069 PWs) bands (ev): -19.6819 -19.6819 -19.5813 -19.5813 -18.3559 -18.3559 -18.3550 -18.3550 -15.3467 -15.3467 -15.2118 -15.2118 -4.4217 -4.4217 -4.0290 -4.0290 -3.8312 -3.8312 -3.5902 -3.5902 -3.1926 -3.1926 -3.0720 -3.0720 -2.5598 -2.5598 -2.4492 -2.4492 -0.2673 -0.2673 -0.1475 -0.1475 -0.0959 -0.0959 0.1154 0.1154 0.5245 0.5245 0.5731 0.5731 0.6246 0.6246 0.7292 0.7292 0.8538 0.8538 0.8898 0.8898 7.8918 7.8918 9.0441 9.0441 9.3904 9.3904 9.4035 9.4035 10.5080 10.5080 k = 0.1585 0.1756-0.0000 ( 12045 PWs) bands (ev): -19.6808 -19.6808 -19.5815 -19.5815 -18.3561 -18.3561 -18.3551 -18.3551 -15.3443 -15.3443 -15.2165 -15.2165 -4.4095 -4.4095 -4.0444 -4.0444 -3.8308 -3.8308 -3.5871 -3.5871 -3.1677 -3.1677 -3.0765 -3.0765 -2.5472 -2.5472 -2.4546 -2.4546 -0.2603 -0.2603 -0.1499 -0.1499 -0.0994 -0.0994 0.0928 0.0928 0.5221 0.5221 0.5702 0.5702 0.6256 0.6256 0.7242 0.7242 0.8494 0.8494 0.8764 0.8764 7.9382 7.9382 9.0296 9.0296 9.3709 9.3709 9.5162 9.5162 10.5492 10.5492 k = 0.1707 0.1891-0.0000 ( 12053 PWs) bands (ev): -19.6797 -19.6797 -19.5817 -19.5817 -18.3562 -18.3562 -18.3553 -18.3553 -15.3419 -15.3419 -15.2215 -15.2215 -4.3972 -4.3972 -4.0608 -4.0608 -3.8302 -3.8302 -3.5836 -3.5836 -3.1405 -3.1405 -3.0808 -3.0808 -2.5344 -2.5344 -2.4599 -2.4599 -0.2530 -0.2530 -0.1524 -0.1524 -0.1027 -0.1027 0.0694 0.0694 0.5197 0.5197 0.5673 0.5673 0.6266 0.6266 0.7185 0.7185 0.8443 0.8443 0.8620 0.8620 7.9874 7.9874 9.0115 9.0115 9.3542 9.3542 9.6355 9.6355 10.5933 10.5933 k = 0.1829 0.2026-0.0000 ( 12065 PWs) bands (ev): -19.6785 -19.6785 -19.5820 -19.5820 -18.3564 -18.3564 -18.3555 -18.3555 -15.3393 -15.3393 -15.2266 -15.2266 -4.3850 -4.3850 -4.0783 -4.0783 -3.8297 -3.8297 -3.5797 -3.5797 -3.1112 -3.1112 -3.0850 -3.0850 -2.5215 -2.5215 -2.4652 -2.4652 -0.2454 -0.2454 -0.1549 -0.1549 -0.1058 -0.1058 0.0455 0.0455 0.5174 0.5174 0.5644 0.5644 0.6276 0.6276 0.7121 0.7121 0.8386 0.8386 0.8467 0.8467 8.0392 8.0392 8.9897 8.9897 9.3407 9.3407 9.7609 9.7609 10.6404 10.6404 k = 0.1951 0.2161-0.0000 ( 12053 PWs) bands (ev): -19.6773 -19.6773 -19.5822 -19.5822 -18.3566 -18.3566 -18.3557 -18.3557 -15.3366 -15.3366 -15.2320 -15.2320 -4.3730 -4.3730 -4.0966 -4.0966 -3.8291 -3.8291 -3.5753 -3.5753 -3.0888 -3.0888 -3.0796 -3.0796 -2.5086 -2.5086 -2.4704 -2.4704 -0.2375 -0.2375 -0.1574 -0.1574 -0.1086 -0.1086 0.0213 0.0213 0.5152 0.5152 0.5616 0.5616 0.6287 0.6287 0.7049 0.7049 0.8306 0.8306 0.8323 0.8323 8.0934 8.0934 8.9643 8.9643 9.3305 9.3305 9.8917 9.8917 10.6904 10.6904 k = 0.2073 0.2296-0.0000 ( 12045 PWs) bands (ev): -19.6760 -19.6760 -19.5825 -19.5825 -18.3568 -18.3568 -18.3559 -18.3559 -15.3339 -15.3339 -15.2374 -15.2374 -4.3615 -4.3615 -4.1157 -4.1157 -3.8285 -3.8285 -3.5705 -3.5705 -3.0924 -3.0924 -3.0458 -3.0458 -2.4958 -2.4958 -2.4754 -2.4754 -0.2295 -0.2295 -0.1600 -0.1600 -0.1110 -0.1110 -0.0029 -0.0029 0.5131 0.5131 0.5589 0.5589 0.6298 0.6298 0.6967 0.6967 0.8138 0.8138 0.8252 0.8252 8.1500 8.1500 8.9357 8.9357 9.3234 9.3234 10.0272 10.0272 10.7430 10.7430 k = 0.2195 0.2431-0.0000 ( 12061 PWs) bands (ev): -19.6747 -19.6747 -19.5828 -19.5828 -18.3570 -18.3570 -18.3561 -18.3561 -15.3310 -15.3310 -15.2430 -15.2430 -4.3505 -4.3505 -4.1354 -4.1354 -3.8279 -3.8279 -3.5654 -3.5654 -3.0957 -3.0957 -3.0100 -3.0100 -2.4832 -2.4832 -2.4802 -2.4802 -0.2213 -0.2213 -0.1627 -0.1627 -0.1130 -0.1130 -0.0269 -0.0269 0.5111 0.5111 0.5562 0.5562 0.6309 0.6309 0.6875 0.6875 0.7965 0.7965 0.8175 0.8175 8.2085 8.2085 8.9045 8.9045 9.3191 9.3191 10.1667 10.1667 10.7981 10.7981 k = 0.2317 0.2566-0.0000 ( 12045 PWs) bands (ev): -19.6734 -19.6734 -19.5830 -19.5830 -18.3572 -18.3572 -18.3563 -18.3563 -15.3282 -15.3282 -15.2486 -15.2486 -4.3403 -4.3403 -4.1554 -4.1554 -3.8273 -3.8273 -3.5600 -3.5600 -3.0987 -3.0987 -2.9721 -2.9721 -2.4847 -2.4847 -2.4709 -2.4709 -0.2130 -0.2130 -0.1657 -0.1657 -0.1145 -0.1145 -0.0503 -0.0503 0.5092 0.5092 0.5537 0.5537 0.6320 0.6320 0.6771 0.6771 0.7789 0.7789 0.8092 0.8092 8.2690 8.2690 8.8714 8.8714 9.3171 9.3171 10.3092 10.3092 10.8557 10.8557 k = 0.2439 0.2701-0.0000 ( 12061 PWs) bands (ev): -19.6721 -19.6721 -19.5833 -19.5833 -18.3574 -18.3574 -18.3565 -18.3565 -15.3253 -15.3253 -15.2543 -15.2543 -4.3309 -4.3309 -4.1755 -4.1755 -3.8266 -3.8266 -3.5544 -3.5544 -3.1014 -3.1014 -2.9324 -2.9324 -2.4890 -2.4890 -2.4589 -2.4589 -0.2047 -0.2047 -0.1693 -0.1693 -0.1154 -0.1154 -0.0726 -0.0726 0.5074 0.5074 0.5513 0.5513 0.6331 0.6331 0.6652 0.6652 0.7613 0.7613 0.8002 0.8002 8.3311 8.3311 8.8368 8.8368 9.3172 9.3172 10.4537 10.4537 10.9154 10.9154 k = 0.2561 0.2836-0.0000 ( 12041 PWs) bands (ev): -19.6708 -19.6708 -19.5836 -19.5836 -18.3576 -18.3576 -18.3567 -18.3567 -15.3224 -15.3224 -15.2599 -15.2599 -4.3228 -4.3228 -4.1952 -4.1952 -3.8260 -3.8260 -3.5487 -3.5487 -3.1037 -3.1037 -2.8909 -2.8909 -2.4930 -2.4930 -2.4474 -2.4474 -0.1964 -0.1964 -0.1742 -0.1742 -0.1157 -0.1157 -0.0930 -0.0930 0.5058 0.5058 0.5490 0.5490 0.6342 0.6342 0.6516 0.6516 0.7440 0.7440 0.7906 0.7906 8.3945 8.3945 8.8015 8.8015 9.3189 9.3189 10.5991 10.5991 10.9769 10.9769 k = 0.2683 0.2972-0.0000 ( 12033 PWs) bands (ev): -19.6694 -19.6694 -19.5839 -19.5839 -18.3579 -18.3579 -18.3569 -18.3569 -15.3194 -15.3194 -15.2656 -15.2656 -4.3164 -4.3164 -4.2139 -4.2139 -3.8253 -3.8253 -3.5429 -3.5429 -3.1058 -3.1058 -2.8480 -2.8480 -2.4967 -2.4967 -2.4362 -2.4362 -0.1883 -0.1883 -0.1813 -0.1813 -0.1154 -0.1154 -0.1103 -0.1103 0.5042 0.5042 0.5468 0.5468 0.6352 0.6352 0.6363 0.6363 0.7273 0.7273 0.7804 0.7804 8.4592 8.4592 8.7659 8.7659 9.3219 9.3219 10.7440 10.7440 11.0399 11.0399 k = 0.2805 0.3107-0.0000 ( 12053 PWs) bands (ev): -19.6681 -19.6681 -19.5842 -19.5842 -18.3581 -18.3581 -18.3571 -18.3571 -15.3165 -15.3165 -15.2711 -15.2711 -4.3129 -4.3129 -4.2304 -4.2304 -3.8247 -3.8247 -3.5372 -3.5372 -3.1076 -3.1076 -2.8038 -2.8038 -2.4999 -2.4999 -2.4256 -2.4256 -0.1918 -0.1918 -0.1803 -0.1803 -0.1235 -0.1235 -0.1143 -0.1143 0.5028 0.5028 0.5448 0.5448 0.6187 0.6187 0.6364 0.6364 0.7114 0.7114 0.7697 0.7697 8.5247 8.5247 8.7304 8.7304 9.3259 9.3259 10.8869 10.8869 11.1025 11.1025 k = 0.2927 0.3242-0.0000 ( 12045 PWs) bands (ev): -19.6668 -19.6668 -19.5844 -19.5844 -18.3583 -18.3583 -18.3573 -18.3573 -15.3137 -15.3137 -15.2766 -15.2766 -4.3140 -4.3140 -4.2428 -4.2428 -3.8241 -3.8241 -3.5315 -3.5315 -3.1090 -3.1090 -2.7587 -2.7587 -2.5027 -2.5027 -2.4155 -2.4155 -0.2057 -0.2057 -0.1725 -0.1725 -0.1320 -0.1320 -0.1125 -0.1125 0.5014 0.5014 0.5430 0.5430 0.5993 0.5993 0.6374 0.6374 0.6966 0.6966 0.7586 0.7586 8.5908 8.5908 8.6953 8.6953 9.3307 9.3307 11.0255 11.0255 11.0615 11.0615 k = 0.3049 0.3377-0.0000 ( 12045 PWs) bands (ev): -19.6655 -19.6655 -19.5847 -19.5847 -18.3585 -18.3585 -18.3575 -18.3575 -15.3109 -15.3109 -15.2820 -15.2820 -4.3211 -4.3211 -4.2494 -4.2494 -3.8234 -3.8234 -3.5259 -3.5259 -3.1103 -3.1103 -2.7131 -2.7131 -2.5050 -2.5050 -2.4060 -2.4060 -0.2222 -0.2222 -0.1650 -0.1650 -0.1368 -0.1368 -0.1100 -0.1100 0.4999 0.4999 0.5413 0.5413 0.5782 0.5782 0.6383 0.6383 0.6827 0.6827 0.7471 0.7471 8.6572 8.6572 8.6610 8.6610 9.3360 9.3360 10.9193 10.9193 11.1578 11.1578 k = 0.3171 0.3512-0.0000 ( 12053 PWs) bands (ev): -19.6643 -19.6643 -19.5850 -19.5850 -18.3587 -18.3587 -18.3577 -18.3577 -15.3081 -15.3081 -15.2871 -15.2871 -4.3336 -4.3336 -4.2508 -4.2508 -3.8228 -3.8228 -3.5205 -3.5205 -3.1112 -3.1112 -2.6676 -2.6676 -2.5063 -2.5063 -2.3971 -2.3971 -0.2400 -0.2400 -0.1577 -0.1577 -0.1391 -0.1391 -0.1069 -0.1069 0.4982 0.4982 0.5397 0.5397 0.5561 0.5561 0.6391 0.6391 0.6697 0.6697 0.7353 0.7353 8.6277 8.6277 8.7236 8.7236 9.3418 9.3418 10.7829 10.7829 11.2725 11.2725 k = 0.3293 0.3647-0.0000 ( 12065 PWs) bands (ev): -19.6631 -19.6631 -19.5852 -19.5852 -18.3589 -18.3589 -18.3579 -18.3579 -15.3055 -15.3055 -15.2921 -15.2921 -4.3492 -4.3492 -4.2490 -4.2490 -3.8222 -3.8222 -3.5153 -3.5153 -3.1119 -3.1119 -2.6233 -2.6233 -2.5062 -2.5062 -2.3888 -2.3888 -0.2580 -0.2580 -0.1508 -0.1508 -0.1398 -0.1398 -0.1032 -0.1032 0.4954 0.4954 0.5341 0.5341 0.5384 0.5384 0.6398 0.6398 0.6574 0.6574 0.7234 0.7234 8.5957 8.5957 8.7895 8.7895 9.3479 9.3479 10.6537 10.6537 11.3481 11.3481 k = 0.3415 0.3782-0.0000 ( 12081 PWs) bands (ev): -19.6620 -19.6620 -19.5854 -19.5854 -18.3590 -18.3590 -18.3581 -18.3581 -15.3030 -15.3030 -15.2969 -15.2969 -4.3661 -4.3661 -4.2458 -4.2458 -3.8216 -3.8216 -3.5104 -3.5104 -3.1125 -3.1125 -2.5825 -2.5825 -2.5025 -2.5025 -2.3811 -2.3811 -0.2757 -0.2757 -0.1441 -0.1441 -0.1394 -0.1394 -0.0990 -0.0990 0.4882 0.4882 0.5159 0.5159 0.5373 0.5373 0.6403 0.6403 0.6456 0.6456 0.7114 0.7114 8.5651 8.5651 8.8545 8.8545 9.3541 9.3541 10.5321 10.5321 11.4041 11.4041 k = 0.3537 0.3917-0.0000 ( 12069 PWs) bands (ev): -19.6609 -19.6609 -19.5857 -19.5857 -18.3592 -18.3592 -18.3582 -18.3582 -15.3015 -15.3015 -15.3005 -15.3005 -4.3831 -4.3831 -4.2421 -4.2421 -3.8211 -3.8211 -3.5057 -3.5057 -3.1128 -3.1128 -2.5519 -2.5519 -2.4892 -2.4892 -2.3740 -2.3740 -0.2927 -0.2927 -0.1383 -0.1383 -0.1378 -0.1378 -0.0944 -0.0944 0.4712 0.4712 0.5072 0.5072 0.5363 0.5363 0.6344 0.6344 0.6405 0.6405 0.6997 0.6997 8.5363 8.5363 8.9182 8.9182 9.3603 9.3603 10.4185 10.4185 11.4484 11.4484 k = 0.3659 0.4052-0.0000 ( 12061 PWs) bands (ev): -19.6599 -19.6599 -19.5859 -19.5859 -18.3594 -18.3594 -18.3584 -18.3584 -15.3057 -15.3057 -15.2982 -15.2982 -4.3998 -4.3998 -4.2383 -4.2383 -3.8206 -3.8206 -3.5014 -3.5014 -3.1130 -3.1130 -2.5377 -2.5377 -2.4603 -2.4603 -2.3676 -2.3676 -0.3088 -0.3088 -0.1366 -0.1366 -0.1317 -0.1317 -0.0896 -0.0896 0.4484 0.4484 0.5045 0.5045 0.5356 0.5356 0.6236 0.6236 0.6403 0.6403 0.6884 0.6884 8.5092 8.5092 8.9802 8.9802 9.3665 9.3665 10.3130 10.3130 11.4793 11.4793 k = 0.3780 0.4187-0.0000 ( 12057 PWs) bands (ev): -19.6589 -19.6589 -19.5861 -19.5861 -18.3595 -18.3595 -18.3586 -18.3586 -15.3097 -15.3097 -15.2961 -15.2961 -4.4156 -4.4156 -4.2346 -4.2346 -3.8201 -3.8201 -3.4974 -3.4974 -3.1131 -3.1131 -2.5332 -2.5332 -2.4231 -2.4231 -2.3618 -2.3618 -0.3238 -0.3238 -0.1344 -0.1344 -0.1259 -0.1259 -0.0846 -0.0846 0.4242 0.4242 0.5037 0.5037 0.5350 0.5350 0.6133 0.6133 0.6393 0.6393 0.6780 0.6780 8.4840 8.4840 9.0398 9.0398 9.3724 9.3724 10.2159 10.2159 11.4962 11.4962 k = 0.3902 0.4322-0.0000 ( 12065 PWs) bands (ev): -19.6580 -19.6580 -19.5863 -19.5863 -18.3597 -18.3597 -18.3587 -18.3587 -15.3134 -15.3134 -15.2941 -15.2941 -4.4305 -4.4305 -4.2312 -4.2312 -3.8196 -3.8196 -3.4938 -3.4938 -3.1130 -3.1130 -2.5319 -2.5319 -2.3845 -2.3845 -2.3567 -2.3567 -0.3376 -0.3376 -0.1320 -0.1320 -0.1204 -0.1204 -0.0797 -0.0797 0.4001 0.4001 0.5037 0.5037 0.5347 0.5347 0.6035 0.6035 0.6370 0.6370 0.6692 0.6692 8.4609 8.4609 9.0965 9.0965 9.3781 9.3781 10.1275 10.1275 11.5014 11.5014 k = 0.4024 0.4457-0.0000 ( 12061 PWs) bands (ev): -19.6572 -19.6572 -19.5864 -19.5864 -18.3598 -18.3598 -18.3588 -18.3588 -15.3167 -15.3167 -15.2923 -15.2923 -4.4442 -4.4442 -4.2280 -4.2280 -3.8192 -3.8192 -3.4905 -3.4905 -3.1129 -3.1129 -2.5317 -2.5317 -2.3521 -2.3521 -2.3473 -2.3473 -0.3502 -0.3502 -0.1294 -0.1294 -0.1152 -0.1152 -0.0749 -0.0749 0.3768 0.3768 0.5042 0.5042 0.5346 0.5346 0.5942 0.5942 0.6327 0.6327 0.6627 0.6627 8.4400 8.4400 9.1498 9.1498 9.3834 9.3834 10.0478 10.0478 11.4987 11.4987 k = 0.4146 0.4592-0.0000 ( 12065 PWs) bands (ev): -19.6565 -19.6565 -19.5866 -19.5866 -18.3599 -18.3599 -18.3589 -18.3589 -15.3197 -15.3197 -15.2907 -15.2907 -4.4566 -4.4566 -4.2252 -4.2252 -3.8188 -3.8188 -3.4875 -3.4875 -3.1128 -3.1128 -2.5319 -2.5319 -2.3481 -2.3481 -2.3125 -2.3125 -0.3614 -0.3614 -0.1267 -0.1267 -0.1105 -0.1105 -0.0704 -0.0704 0.3548 0.3548 0.5051 0.5051 0.5348 0.5348 0.5854 0.5854 0.6264 0.6264 0.6588 0.6588 8.4214 8.4214 9.1989 9.1989 9.3883 9.3883 9.9771 9.9771 11.4917 11.4917 k = 0.4268 0.4727-0.0000 ( 12073 PWs) bands (ev): -19.6558 -19.6558 -19.5867 -19.5867 -18.3600 -18.3600 -18.3590 -18.3590 -15.3223 -15.3223 -15.2892 -15.2892 -4.4675 -4.4675 -4.2228 -4.2228 -3.8185 -3.8185 -3.4850 -3.4850 -3.1126 -3.1126 -2.5322 -2.5322 -2.3447 -2.3447 -2.2810 -2.2810 -0.3713 -0.3713 -0.1240 -0.1240 -0.1061 -0.1061 -0.0662 -0.0662 0.3345 0.3345 0.5063 0.5063 0.5352 0.5352 0.5772 0.5772 0.6190 0.6190 0.6567 0.6567 8.4050 8.4050 9.2433 9.2433 9.3927 9.3927 9.9155 9.9155 11.4827 11.4827 k = 0.4390 0.4862-0.0000 ( 12073 PWs) bands (ev): -19.6553 -19.6553 -19.5868 -19.5868 -18.3601 -18.3601 -18.3591 -18.3591 -15.3246 -15.3246 -15.2880 -15.2880 -4.4769 -4.4769 -4.2207 -4.2207 -3.8182 -3.8182 -3.4828 -3.4828 -3.1124 -3.1124 -2.5326 -2.5326 -2.3418 -2.3418 -2.2532 -2.2532 -0.3797 -0.3797 -0.1215 -0.1215 -0.1024 -0.1024 -0.0625 -0.0625 0.3165 0.3165 0.5077 0.5077 0.5358 0.5358 0.5698 0.5698 0.6115 0.6115 0.6557 0.6557 8.3911 8.3911 9.2823 9.2823 9.3965 9.3965 9.8632 9.8632 11.4735 11.4735 k = 0.4512 0.4998-0.0000 ( 12069 PWs) bands (ev): -19.6548 -19.6548 -19.5869 -19.5869 -18.3602 -18.3602 -18.3592 -18.3592 -15.3264 -15.3264 -15.2870 -15.2870 -4.4847 -4.4847 -4.2190 -4.2190 -3.8180 -3.8180 -3.4811 -3.4811 -3.1122 -3.1122 -2.5329 -2.5329 -2.3395 -2.3395 -2.2298 -2.2298 -0.3866 -0.3866 -0.1191 -0.1191 -0.0992 -0.0992 -0.0593 -0.0593 0.3010 0.3010 0.5094 0.5094 0.5366 0.5366 0.5631 0.5631 0.6044 0.6044 0.6551 0.6551 8.3796 8.3796 9.3152 9.3152 9.3997 9.3997 9.8202 9.8202 11.4650 11.4650 k = 0.4634 0.5133-0.0000 ( 12074 PWs) bands (ev): -19.6545 -19.6545 -19.5870 -19.5870 -18.3602 -18.3602 -18.3592 -18.3592 -15.3279 -15.3279 -15.2862 -15.2862 -4.4908 -4.4908 -4.2176 -4.2176 -3.8178 -3.8178 -3.4797 -3.4797 -3.1120 -3.1120 -2.5332 -2.5332 -2.3378 -2.3378 -2.2111 -2.2111 -0.3920 -0.3920 -0.1172 -0.1172 -0.0966 -0.0966 -0.0567 -0.0567 0.2885 0.2885 0.5112 0.5112 0.5374 0.5374 0.5574 0.5574 0.5984 0.5984 0.6549 0.6549 8.3707 8.3707 9.3415 9.3415 9.4023 9.4023 9.7867 9.7867 11.4580 11.4580 k = 0.4756 0.5268-0.0000 ( 12058 PWs) bands (ev): -19.6542 -19.6542 -19.5871 -19.5871 -18.3603 -18.3603 -18.3593 -18.3593 -15.3289 -15.3289 -15.2856 -15.2856 -4.4952 -4.4952 -4.2167 -4.2167 -3.8177 -3.8177 -3.4787 -3.4787 -3.1119 -3.1119 -2.5334 -2.5334 -2.3365 -2.3365 -2.1975 -2.1975 -0.3959 -0.3959 -0.1157 -0.1157 -0.0947 -0.0947 -0.0548 -0.0548 0.2793 0.2793 0.5128 0.5128 0.5382 0.5382 0.5530 0.5530 0.5938 0.5938 0.6548 0.6548 8.3643 8.3643 9.3606 9.3606 9.4041 9.4041 9.7627 9.7627 11.4527 11.4527 k = 0.4878 0.5403-0.0000 ( 12034 PWs) bands (ev): -19.6541 -19.6541 -19.5871 -19.5871 -18.3603 -18.3603 -18.3593 -18.3593 -15.3295 -15.3295 -15.2853 -15.2853 -4.4979 -4.4979 -4.2161 -4.2161 -3.8176 -3.8176 -3.4781 -3.4781 -3.1118 -3.1118 -2.5336 -2.5336 -2.3357 -2.3357 -2.1893 -2.1893 -0.3982 -0.3982 -0.1148 -0.1148 -0.0936 -0.0936 -0.0537 -0.0537 0.2737 0.2737 0.5140 0.5140 0.5388 0.5388 0.5500 0.5500 0.5909 0.5909 0.6547 0.6547 8.3604 8.3604 9.3723 9.3723 9.4052 9.4052 9.7483 9.7483 11.4494 11.4494 k = 0.5000 0.5538-0.0000 ( 12030 PWs) bands (ev): -19.6540 -19.6540 -19.5871 -19.5871 -18.3603 -18.3603 -18.3593 -18.3593 -15.3297 -15.3297 -15.2852 -15.2852 -4.4987 -4.4987 -4.2159 -4.2159 -3.8176 -3.8176 -3.4779 -3.4779 -3.1118 -3.1118 -2.5336 -2.5336 -2.3355 -2.3355 -2.1865 -2.1865 -0.3990 -0.3990 -0.1144 -0.1144 -0.0932 -0.0932 -0.0533 -0.0533 0.2718 0.2718 0.5144 0.5144 0.5390 0.5390 0.5490 0.5490 0.5899 0.5899 0.6547 0.6547 8.3591 8.3591 9.3762 9.3762 9.4056 9.4056 9.7435 9.7435 11.4483 11.4483 k = 0.5000 0.5538-0.0000 ( 12030 PWs) bands (ev): -19.6540 -19.6540 -19.5871 -19.5871 -18.3603 -18.3603 -18.3593 -18.3593 -15.3297 -15.3297 -15.2852 -15.2852 -4.4987 -4.4987 -4.2159 -4.2159 -3.8176 -3.8176 -3.4779 -3.4779 -3.1118 -3.1118 -2.5336 -2.5336 -2.3355 -2.3355 -2.1865 -2.1865 -0.3990 -0.3990 -0.1144 -0.1144 -0.0932 -0.0932 -0.0533 -0.0533 0.2718 0.2718 0.5144 0.5144 0.5390 0.5390 0.5490 0.5490 0.5899 0.5899 0.6547 0.6547 8.3591 8.3591 9.3762 9.3762 9.4056 9.4056 9.7435 9.7435 11.4483 11.4483 k = 0.4903 0.5625 0.0130 ( 12030 PWs) bands (ev): -19.6540 -19.6540 -19.5872 -19.5872 -18.3603 -18.3603 -18.3593 -18.3593 -15.3298 -15.3298 -15.2851 -15.2851 -4.4989 -4.4989 -4.2157 -4.2157 -3.8173 -3.8173 -3.4787 -3.4787 -3.1107 -3.1107 -2.5347 -2.5347 -2.3366 -2.3366 -2.1866 -2.1866 -0.3975 -0.3975 -0.1146 -0.1146 -0.0933 -0.0933 -0.0535 -0.0535 0.2731 0.2731 0.5145 0.5145 0.5391 0.5391 0.5490 0.5490 0.5898 0.5898 0.6544 0.6544 8.3614 8.3614 9.3784 9.3784 9.4079 9.4079 9.7426 9.7426 11.4335 11.4335 k = 0.4807 0.5712 0.0260 ( 12034 PWs) bands (ev): -19.6538 -19.6538 -19.5874 -19.5874 -18.3604 -18.3604 -18.3594 -18.3594 -15.3298 -15.3298 -15.2848 -15.2848 -4.4994 -4.4994 -4.2150 -4.2150 -3.8167 -3.8167 -3.4809 -3.4809 -3.1074 -3.1074 -2.5381 -2.5381 -2.3399 -2.3399 -2.1868 -2.1868 -0.3931 -0.3931 -0.1153 -0.1153 -0.0934 -0.0934 -0.0540 -0.0540 0.2769 0.2769 0.5146 0.5146 0.5393 0.5393 0.5491 0.5491 0.5897 0.5897 0.6534 0.6534 8.3685 8.3685 9.3848 9.3848 9.4150 9.4150 9.7398 9.7398 11.3823 11.3823 k = 0.4710 0.5800 0.0391 ( 12040 PWs) bands (ev): -19.6534 -19.6534 -19.5878 -19.5878 -18.3605 -18.3605 -18.3594 -18.3594 -15.3298 -15.3298 -15.2843 -15.2843 -4.5003 -4.5003 -4.2139 -4.2139 -3.8156 -3.8156 -3.4845 -3.4845 -3.1022 -3.1022 -2.5436 -2.5436 -2.3454 -2.3454 -2.1872 -2.1872 -0.3859 -0.3859 -0.1175 -0.1175 -0.0929 -0.0929 -0.0543 -0.0543 0.2830 0.2830 0.5145 0.5145 0.5399 0.5399 0.5492 0.5492 0.5895 0.5895 0.6519 0.6519 8.3802 8.3802 9.3955 9.3955 9.4267 9.4267 9.7351 9.7351 11.3080 11.3080 k = 0.4613 0.5887 0.0521 ( 12068 PWs) bands (ev): -19.6529 -19.6529 -19.5883 -19.5883 -18.3606 -18.3606 -18.3595 -18.3595 -15.3298 -15.3298 -15.2836 -15.2836 -4.5014 -4.5014 -4.2123 -4.2123 -3.8140 -3.8140 -3.4893 -3.4893 -3.0949 -3.0949 -2.5513 -2.5513 -2.3529 -2.3529 -2.1879 -2.1879 -0.3760 -0.3760 -0.1218 -0.1218 -0.0915 -0.0915 -0.0537 -0.0537 0.2909 0.2909 0.5136 0.5136 0.5411 0.5411 0.5497 0.5497 0.5892 0.5892 0.6498 0.6498 8.3965 8.3965 9.4105 9.4105 9.4431 9.4431 9.7287 9.7287 11.2253 11.2253 k = 0.4517 0.5974 0.0651 ( 12086 PWs) bands (ev): -19.6523 -19.6523 -19.5890 -19.5890 -18.3608 -18.3608 -18.3595 -18.3595 -15.3299 -15.3299 -15.2828 -15.2828 -4.5028 -4.5028 -4.2104 -4.2104 -3.8121 -3.8121 -3.4954 -3.4954 -3.0859 -3.0859 -2.5611 -2.5611 -2.3624 -2.3624 -2.1887 -2.1887 -0.3635 -0.3635 -0.1284 -0.1284 -0.0893 -0.0893 -0.0515 -0.0515 0.3003 0.3003 0.5116 0.5116 0.5426 0.5426 0.5510 0.5510 0.5890 0.5890 0.6472 0.6472 8.4173 8.4173 9.4297 9.4297 9.4642 9.4642 9.7204 9.7204 11.1402 11.1402 k = 0.4420 0.6061 0.0781 ( 12090 PWs) bands (ev): -19.6515 -19.6515 -19.5898 -19.5898 -18.3611 -18.3611 -18.3596 -18.3596 -15.3299 -15.3299 -15.2817 -15.2817 -4.5044 -4.5044 -4.2082 -4.2082 -3.8098 -3.8098 -3.5024 -3.5024 -3.0752 -3.0752 -2.5729 -2.5729 -2.3737 -2.3737 -2.1898 -2.1898 -0.3486 -0.3486 -0.1369 -0.1369 -0.0868 -0.0868 -0.0471 -0.0471 0.3108 0.3108 0.5085 0.5085 0.5436 0.5436 0.5538 0.5538 0.5888 0.5888 0.6442 0.6442 8.4426 8.4426 9.4532 9.4532 9.4899 9.4899 9.7102 9.7102 11.0555 11.0555 k = 0.4323 0.6149 0.0912 ( 12094 PWs) bands (ev): -19.6506 -19.6506 -19.5908 -19.5908 -18.3615 -18.3615 -18.3596 -18.3596 -15.3300 -15.3300 -15.2805 -15.2805 -4.5060 -4.5060 -4.2056 -4.2056 -3.8072 -3.8072 -3.5102 -3.5102 -3.0632 -3.0632 -2.5865 -2.5865 -2.3867 -2.3867 -2.1911 -2.1911 -0.3316 -0.3316 -0.1467 -0.1467 -0.0846 -0.0846 -0.0404 -0.0404 0.3219 0.3219 0.5044 0.5044 0.5440 0.5440 0.5579 0.5579 0.5889 0.5889 0.6410 0.6410 8.4722 8.4722 9.4808 9.4808 9.5202 9.5202 9.6983 9.6983 10.9725 10.9725 k = 0.4227 0.6236 0.1042 ( 12086 PWs) bands (ev): -19.6496 -19.6496 -19.5919 -19.5919 -18.3619 -18.3619 -18.3596 -18.3596 -15.3301 -15.3301 -15.2791 -15.2791 -4.5077 -4.5077 -4.2029 -4.2029 -3.8043 -3.8043 -3.5187 -3.5187 -3.0498 -3.0498 -2.6020 -2.6020 -2.4011 -2.4011 -2.1927 -2.1927 -0.3126 -0.3126 -0.1573 -0.1573 -0.0826 -0.0826 -0.0314 -0.0314 0.3332 0.3332 0.4995 0.4995 0.5441 0.5441 0.5623 0.5623 0.5897 0.5897 0.6378 0.6378 8.5060 8.5060 9.5126 9.5126 9.5551 9.5551 9.6847 9.6847 10.8919 10.8919 k = 0.4130 0.6323 0.1172 ( 12082 PWs) bands (ev): -19.6485 -19.6485 -19.5931 -19.5931 -18.3623 -18.3623 -18.3596 -18.3596 -15.3302 -15.3302 -15.2776 -15.2776 -4.5094 -4.5094 -4.1999 -4.1999 -3.8012 -3.8012 -3.5277 -3.5277 -3.0354 -3.0354 -2.6190 -2.6190 -2.4169 -2.4169 -2.1946 -2.1946 -0.2920 -0.2920 -0.1683 -0.1683 -0.0807 -0.0807 -0.0203 -0.0203 0.3443 0.3443 0.4937 0.4937 0.5440 0.5440 0.5654 0.5654 0.5924 0.5924 0.6348 0.6348 8.5437 8.5437 9.5485 9.5485 9.5944 9.5944 9.6693 9.6693 10.8143 10.8143 k = 0.4033 0.6411 0.1302 ( 12068 PWs) bands (ev): -19.6472 -19.6472 -19.5945 -19.5945 -18.3628 -18.3628 -18.3596 -18.3596 -15.3304 -15.3304 -15.2759 -15.2759 -4.5109 -4.5109 -4.1967 -4.1967 -3.7979 -3.7979 -3.5369 -3.5369 -3.0202 -3.0202 -2.6376 -2.6376 -2.4339 -2.4339 -2.1968 -2.1968 -0.2701 -0.2701 -0.1793 -0.1793 -0.0788 -0.0788 -0.0075 -0.0075 0.3549 0.3549 0.4874 0.4874 0.5438 0.5438 0.5662 0.5662 0.5977 0.5977 0.6324 0.6324 8.5853 8.5853 9.5884 9.5884 9.6380 9.6380 9.6525 9.6525 10.7400 10.7400 k = 0.4033 0.6411 0.1302 ( 12068 PWs) bands (ev): -19.6472 -19.6472 -19.5945 -19.5945 -18.3628 -18.3628 -18.3596 -18.3596 -15.3304 -15.3304 -15.2759 -15.2759 -4.5109 -4.5109 -4.1967 -4.1967 -3.7979 -3.7979 -3.5369 -3.5369 -3.0202 -3.0202 -2.6376 -2.6376 -2.4339 -2.4339 -2.1968 -2.1968 -0.2701 -0.2701 -0.1793 -0.1793 -0.0788 -0.0788 -0.0075 -0.0075 0.3549 0.3549 0.4874 0.4874 0.5438 0.5438 0.5662 0.5662 0.5977 0.5977 0.6324 0.6324 8.5853 8.5853 9.5884 9.5884 9.6380 9.6380 9.6525 9.6525 10.7400 10.7400 k = 0.3878 0.6357 0.1382 ( 12066 PWs) bands (ev): -19.6464 -19.6464 -19.5955 -19.5955 -18.3630 -18.3630 -18.3596 -18.3596 -15.3303 -15.3303 -15.2748 -15.2748 -4.5113 -4.5113 -4.1948 -4.1948 -3.7960 -3.7960 -3.5427 -3.5427 -3.0106 -3.0106 -2.6495 -2.6495 -2.4447 -2.4447 -2.2000 -2.2000 -0.2564 -0.2564 -0.1854 -0.1854 -0.0776 -0.0776 0.0010 0.0010 0.3614 0.3614 0.4833 0.4833 0.5432 0.5432 0.5653 0.5653 0.6030 0.6030 0.6316 0.6316 8.6131 8.6131 9.6118 9.6118 9.6437 9.6437 9.6671 9.6671 10.6984 10.6984 k = 0.3723 0.6304 0.1461 ( 12064 PWs) bands (ev): -19.6456 -19.6456 -19.5964 -19.5964 -18.3633 -18.3633 -18.3596 -18.3596 -15.3301 -15.3301 -15.2738 -15.2738 -4.5105 -4.5105 -4.1930 -4.1930 -3.7942 -3.7942 -3.5487 -3.5487 -3.0009 -3.0009 -2.6619 -2.6619 -2.4556 -2.4556 -2.2065 -2.2065 -0.2429 -0.2429 -0.1900 -0.1900 -0.0767 -0.0767 0.0102 0.0102 0.3680 0.3680 0.4795 0.4795 0.5421 0.5421 0.5633 0.5633 0.6103 0.6103 0.6323 0.6323 8.6435 8.6435 9.6308 9.6308 9.6409 9.6409 9.6965 9.6965 10.6627 10.6627 k = 0.3568 0.6251 0.1541 ( 12054 PWs) bands (ev): -19.6448 -19.6448 -19.5974 -19.5974 -18.3636 -18.3636 -18.3595 -18.3595 -15.3296 -15.3296 -15.2730 -15.2730 -4.5085 -4.5085 -4.1913 -4.1913 -3.7926 -3.7926 -3.5549 -3.5549 -2.9911 -2.9911 -2.6746 -2.6746 -2.4666 -2.4666 -2.2163 -2.2163 -0.2302 -0.2302 -0.1927 -0.1927 -0.0758 -0.0758 0.0201 0.0201 0.3748 0.3748 0.4758 0.4758 0.5405 0.5405 0.5605 0.5605 0.6172 0.6172 0.6360 0.6360 8.6765 8.6765 9.6429 9.6429 9.6454 9.6454 9.7269 9.7269 10.6335 10.6335 k = 0.3413 0.6198 0.1620 ( 12056 PWs) bands (ev): -19.6441 -19.6441 -19.5984 -19.5984 -18.3638 -18.3638 -18.3595 -18.3595 -15.3290 -15.3290 -15.2723 -15.2723 -4.5055 -4.5055 -4.1898 -4.1898 -3.7912 -3.7912 -3.5611 -3.5611 -2.9813 -2.9813 -2.6875 -2.6875 -2.4774 -2.4774 -2.2292 -2.2292 -0.2191 -0.2191 -0.1930 -0.1930 -0.0752 -0.0752 0.0308 0.0308 0.3814 0.3814 0.4723 0.4723 0.5387 0.5387 0.5573 0.5573 0.6216 0.6216 0.6442 0.6442 8.7119 8.7119 9.6505 9.6505 9.6547 9.6547 9.7581 9.7581 10.6112 10.6112 k = 0.3258 0.6144 0.1700 ( 12050 PWs) bands (ev): -19.6433 -19.6433 -19.5995 -19.5995 -18.3641 -18.3641 -18.3595 -18.3595 -15.3281 -15.3281 -15.2716 -15.2716 -4.5013 -4.5013 -4.1883 -4.1883 -3.7900 -3.7900 -3.5674 -3.5674 -2.9716 -2.9716 -2.7006 -2.7006 -2.4881 -2.4881 -2.2448 -2.2448 -0.2108 -0.2108 -0.1900 -0.1900 -0.0746 -0.0746 0.0425 0.0425 0.3879 0.3879 0.4691 0.4691 0.5367 0.5367 0.5537 0.5537 0.6244 0.6244 0.6556 0.6556 8.7494 8.7494 9.6586 9.6586 9.6639 9.6639 9.7901 9.7901 10.5959 10.5959 k = 0.3103 0.6091 0.1779 ( 12048 PWs) bands (ev): -19.6425 -19.6425 -19.6006 -19.6006 -18.3643 -18.3643 -18.3595 -18.3595 -15.3270 -15.3270 -15.2711 -15.2711 -4.4961 -4.4961 -4.1870 -4.1870 -3.7891 -3.7891 -3.5738 -3.5738 -2.9620 -2.9620 -2.7137 -2.7137 -2.4986 -2.4986 -2.2631 -2.2631 -0.2053 -0.2053 -0.1840 -0.1840 -0.0741 -0.0741 0.0550 0.0550 0.3942 0.3942 0.4661 0.4661 0.5346 0.5346 0.5500 0.5500 0.6269 0.6269 0.6685 0.6685 8.7890 8.7890 9.6587 9.6587 9.6816 9.6816 9.8229 9.8229 10.5876 10.5876 k = 0.2947 0.6038 0.1859 ( 12048 PWs) bands (ev): -19.6418 -19.6418 -19.6017 -19.6017 -18.3645 -18.3645 -18.3595 -18.3595 -15.3258 -15.3258 -15.2707 -15.2707 -4.4898 -4.4898 -4.1858 -4.1858 -3.7884 -3.7884 -3.5802 -3.5802 -2.9526 -2.9526 -2.7266 -2.7266 -2.5089 -2.5089 -2.2835 -2.2835 -0.2008 -0.2008 -0.1768 -0.1768 -0.0736 -0.0736 0.0682 0.0682 0.4003 0.4003 0.4633 0.4633 0.5326 0.5326 0.5462 0.5462 0.6298 0.6298 0.6821 0.6821 8.8304 8.8304 9.6546 9.6546 9.7046 9.7046 9.8564 9.8564 10.5860 10.5860 k = 0.2792 0.5985 0.1938 ( 12049 PWs) bands (ev): -19.6410 -19.6410 -19.6028 -19.6028 -18.3646 -18.3646 -18.3595 -18.3595 -15.3244 -15.3244 -15.2704 -15.2704 -4.4824 -4.4824 -4.1848 -4.1848 -3.7880 -3.7880 -3.5867 -3.5867 -2.9435 -2.9435 -2.7392 -2.7392 -2.5190 -2.5190 -2.3058 -2.3058 -0.1962 -0.1962 -0.1699 -0.1699 -0.0730 -0.0730 0.0820 0.0820 0.4060 0.4060 0.4605 0.4605 0.5307 0.5307 0.5423 0.5423 0.6333 0.6333 0.6958 0.6958 8.8733 8.8733 9.6471 9.6471 9.7324 9.7324 9.8905 9.8905 10.5903 10.5903 k = 0.2637 0.5931 0.2017 ( 12047 PWs) bands (ev): -19.6403 -19.6403 -19.6040 -19.6040 -18.3647 -18.3647 -18.3595 -18.3595 -15.3228 -15.3228 -15.2702 -15.2702 -4.4741 -4.4741 -4.1840 -4.1840 -3.7878 -3.7878 -3.5932 -3.5932 -2.9346 -2.9346 -2.7514 -2.7514 -2.5288 -2.5288 -2.3297 -2.3297 -0.1910 -0.1910 -0.1638 -0.1638 -0.0721 -0.0721 0.0961 0.0961 0.4113 0.4113 0.4576 0.4576 0.5289 0.5289 0.5387 0.5387 0.6374 0.6374 0.7093 0.7093 8.9176 8.9176 9.6370 9.6370 9.7650 9.7650 9.9253 9.9253 10.6001 10.6001 k = 0.2482 0.5878 0.2097 ( 12045 PWs) bands (ev): -19.6395 -19.6395 -19.6052 -19.6052 -18.3648 -18.3648 -18.3596 -18.3596 -15.3212 -15.3212 -15.2702 -15.2702 -4.4649 -4.4649 -4.1835 -4.1835 -3.7878 -3.7878 -3.5997 -3.5997 -2.9262 -2.9262 -2.7629 -2.7629 -2.5385 -2.5385 -2.3547 -2.3547 -0.1852 -0.1852 -0.1587 -0.1587 -0.0709 -0.0709 0.1101 0.1101 0.4162 0.4162 0.4548 0.4548 0.5274 0.5274 0.5353 0.5353 0.6423 0.6423 0.7225 0.7225 8.9628 8.9628 9.6252 9.6252 9.8021 9.8021 9.9608 9.9608 10.6143 10.6143 k = 0.2327 0.5825 0.2176 ( 12047 PWs) bands (ev): -19.6387 -19.6387 -19.6064 -19.6064 -18.3649 -18.3649 -18.3596 -18.3596 -15.3193 -15.3193 -15.2703 -15.2703 -4.4548 -4.4548 -4.1833 -4.1833 -3.7879 -3.7879 -3.6063 -3.6063 -2.9183 -2.9183 -2.7735 -2.7735 -2.5481 -2.5481 -2.3805 -2.3805 -0.1792 -0.1792 -0.1544 -0.1544 -0.0690 -0.0690 0.1235 0.1235 0.4206 0.4206 0.4519 0.4519 0.5262 0.5262 0.5323 0.5323 0.6480 0.6480 0.7350 0.7350 9.0087 9.0087 9.6124 9.6124 9.8435 9.8435 9.9969 9.9969 10.6322 10.6322 k = 0.2172 0.5772 0.2256 ( 12062 PWs) bands (ev): -19.6380 -19.6380 -19.6076 -19.6076 -18.3649 -18.3649 -18.3597 -18.3597 -15.3174 -15.3174 -15.2705 -15.2705 -4.4438 -4.4438 -4.1834 -4.1834 -3.7880 -3.7880 -3.6130 -3.6130 -2.9112 -2.9112 -2.7830 -2.7830 -2.5576 -2.5576 -2.4065 -2.4065 -0.1733 -0.1733 -0.1507 -0.1507 -0.0662 -0.0662 0.1361 0.1361 0.4243 0.4243 0.4491 0.4491 0.5253 0.5253 0.5298 0.5298 0.6543 0.6543 0.7467 0.7467 9.0550 9.0550 9.5993 9.5993 9.8887 9.8887 10.0339 10.0339 10.6530 10.6530 k = 0.2017 0.5718 0.2335 ( 12055 PWs) bands (ev): -19.6372 -19.6372 -19.6088 -19.6088 -18.3649 -18.3649 -18.3598 -18.3598 -15.3154 -15.3154 -15.2709 -15.2709 -4.4322 -4.4322 -4.1839 -4.1839 -3.7879 -3.7879 -3.6200 -3.6200 -2.9048 -2.9048 -2.7913 -2.7913 -2.5670 -2.5670 -2.4325 -2.4325 -0.1678 -0.1678 -0.1475 -0.1475 -0.0623 -0.0623 0.1473 0.1473 0.4271 0.4271 0.4467 0.4467 0.5246 0.5246 0.5279 0.5279 0.6614 0.6614 0.7575 0.7575 9.1012 9.1012 9.5866 9.5866 9.9373 9.9373 10.0720 10.0720 10.6758 10.6758 k = 0.1862 0.5665 0.2415 ( 12055 PWs) bands (ev): -19.6363 -19.6363 -19.6101 -19.6101 -18.3649 -18.3649 -18.3599 -18.3599 -15.3133 -15.3133 -15.2714 -15.2714 -4.4199 -4.4199 -4.1850 -4.1850 -3.7877 -3.7877 -3.6271 -3.6271 -2.8994 -2.8994 -2.7981 -2.7981 -2.5764 -2.5764 -2.4580 -2.4580 -0.1632 -0.1632 -0.1446 -0.1446 -0.0568 -0.0568 0.1568 0.1568 0.4288 0.4288 0.4448 0.4448 0.5242 0.5242 0.5266 0.5266 0.6692 0.6692 0.7672 0.7672 9.1469 9.1469 9.5746 9.5746 9.9885 9.9885 10.1116 10.1116 10.6998 10.6998 k = 0.1706 0.5612 0.2494 ( 12061 PWs) bands (ev): -19.6355 -19.6355 -19.6113 -19.6113 -18.3649 -18.3649 -18.3600 -18.3600 -15.3111 -15.3111 -15.2720 -15.2720 -4.4070 -4.4070 -4.1866 -4.1866 -3.7871 -3.7871 -3.6345 -3.6345 -2.8950 -2.8950 -2.8034 -2.8034 -2.5859 -2.5859 -2.4826 -2.4826 -0.1596 -0.1596 -0.1422 -0.1422 -0.0497 -0.0497 0.1643 0.1643 0.4294 0.4294 0.4439 0.4439 0.5238 0.5238 0.5260 0.5260 0.6777 0.6777 0.7758 0.7758 9.1916 9.1916 9.5636 9.5636 10.0411 10.0411 10.1534 10.1534 10.7239 10.7239 k = 0.1551 0.5559 0.2574 ( 12058 PWs) bands (ev): -19.6347 -19.6347 -19.6126 -19.6126 -18.3648 -18.3648 -18.3602 -18.3602 -15.3089 -15.3089 -15.2728 -15.2728 -4.3937 -4.3937 -4.1889 -4.1889 -3.7861 -3.7861 -3.6422 -3.6422 -2.8915 -2.8915 -2.8072 -2.8072 -2.5953 -2.5953 -2.5058 -2.5058 -0.1570 -0.1570 -0.1402 -0.1402 -0.0407 -0.0407 0.1694 0.1694 0.4290 0.4290 0.4437 0.4437 0.5235 0.5235 0.5260 0.5260 0.6868 0.6868 0.7831 0.7831 9.2349 9.2349 9.5540 9.5540 10.0937 10.0937 10.1986 10.1986 10.7468 10.7468 k = 0.1396 0.5505 0.2653 ( 12052 PWs) bands (ev): -19.6338 -19.6338 -19.6138 -19.6138 -18.3647 -18.3647 -18.3604 -18.3604 -15.3067 -15.3067 -15.2737 -15.2737 -4.3800 -4.3800 -4.1920 -4.1920 -3.7844 -3.7844 -3.6502 -3.6502 -2.8889 -2.8889 -2.8100 -2.8100 -2.6047 -2.6047 -2.5272 -2.5272 -0.1550 -0.1550 -0.1389 -0.1389 -0.0301 -0.0301 0.1721 0.1721 0.4282 0.4282 0.4439 0.4439 0.5235 0.5235 0.5263 0.5263 0.6964 0.6964 0.7890 0.7890 9.2763 9.2763 9.5457 9.5457 10.1445 10.1445 10.2483 10.2483 10.7662 10.7662 k = 0.1241 0.5452 0.2733 ( 12057 PWs) bands (ev): -19.6329 -19.6329 -19.6151 -19.6151 -18.3645 -18.3645 -18.3605 -18.3605 -15.3044 -15.3044 -15.2747 -15.2747 -4.3661 -4.3661 -4.1958 -4.1958 -3.7821 -3.7821 -3.6587 -3.6587 -2.8867 -2.8867 -2.8122 -2.8122 -2.6139 -2.6139 -2.5466 -2.5466 -0.1535 -0.1535 -0.1382 -0.1382 -0.0180 -0.0180 0.1723 0.1723 0.4276 0.4276 0.4440 0.4440 0.5237 0.5237 0.5268 0.5268 0.7064 0.7064 0.7936 0.7936 9.3152 9.3152 9.5388 9.5388 10.1922 10.1922 10.3032 10.3032 10.7778 10.7778 k = 0.1086 0.5399 0.2812 ( 12050 PWs) bands (ev): -19.6320 -19.6320 -19.6163 -19.6163 -18.3644 -18.3644 -18.3608 -18.3608 -15.3021 -15.3021 -15.2758 -15.2758 -4.3520 -4.3520 -4.2005 -4.2005 -3.7790 -3.7790 -3.6674 -3.6674 -2.8846 -2.8846 -2.8142 -2.8142 -2.6225 -2.6225 -2.5638 -2.5638 -0.1523 -0.1523 -0.1381 -0.1381 -0.0047 -0.0047 0.1699 0.1699 0.4274 0.4274 0.4439 0.4439 0.5241 0.5241 0.5273 0.5273 0.7166 0.7166 0.7968 0.7968 9.3512 9.3512 9.5331 9.5331 10.2369 10.2369 10.3626 10.3626 10.7747 10.7747 k = 0.0931 0.5346 0.2891 ( 12052 PWs) bands (ev): -19.6310 -19.6310 -19.6176 -19.6176 -18.3642 -18.3642 -18.3610 -18.3610 -15.2999 -15.2999 -15.2771 -15.2771 -4.3379 -4.3379 -4.2062 -4.2062 -3.7750 -3.7750 -3.6766 -3.6766 -2.8822 -2.8822 -2.8168 -2.8168 -2.6301 -2.6301 -2.5789 -2.5789 -0.1513 -0.1513 -0.1385 -0.1385 0.0095 0.0095 0.1652 0.1652 0.4277 0.4277 0.4435 0.4435 0.5248 0.5248 0.5278 0.5278 0.7269 0.7269 0.7986 0.7986 9.3838 9.3838 9.5285 9.5285 10.2792 10.2792 10.4249 10.4249 10.7541 10.7541 k = 0.0776 0.5292 0.2971 ( 12052 PWs) bands (ev): -19.6300 -19.6300 -19.6188 -19.6188 -18.3640 -18.3640 -18.3612 -18.3612 -15.2976 -15.2976 -15.2785 -15.2785 -4.3240 -4.3240 -4.2128 -4.2128 -3.7701 -3.7701 -3.6859 -3.6859 -2.8793 -2.8793 -2.8204 -2.8204 -2.6362 -2.6362 -2.5920 -2.5920 -0.1503 -0.1503 -0.1392 -0.1392 0.0244 0.0244 0.1582 0.1582 0.4284 0.4284 0.4428 0.4428 0.5255 0.5255 0.5283 0.5283 0.7371 0.7371 0.7989 0.7989 9.4127 9.4127 9.5247 9.5247 10.3200 10.3200 10.4878 10.4878 10.7230 10.7230 k = 0.0621 0.5239 0.3050 ( 12060 PWs) bands (ev): -19.6290 -19.6290 -19.6200 -19.6200 -18.3637 -18.3637 -18.3614 -18.3614 -15.2954 -15.2954 -15.2800 -15.2800 -4.3102 -4.3102 -4.2203 -4.2203 -3.7643 -3.7643 -3.6955 -3.6955 -2.8755 -2.8755 -2.8251 -2.8251 -2.6402 -2.6402 -2.6034 -2.6034 -0.1494 -0.1494 -0.1401 -0.1401 0.0396 0.0396 0.1494 0.1494 0.4296 0.4296 0.4419 0.4419 0.5262 0.5262 0.5287 0.5287 0.7471 0.7471 0.7979 0.7979 9.4376 9.4376 9.5211 9.5211 10.3599 10.3599 10.5483 10.5483 10.6890 10.6890 k = 0.0465 0.5186 0.3130 ( 12064 PWs) bands (ev): -19.6280 -19.6280 -19.6212 -19.6212 -18.3635 -18.3635 -18.3617 -18.3617 -15.2932 -15.2932 -15.2816 -15.2816 -4.2968 -4.2968 -4.2288 -4.2288 -3.7577 -3.7577 -3.7052 -3.7052 -2.8708 -2.8708 -2.8309 -2.8309 -2.6420 -2.6420 -2.6133 -2.6133 -0.1484 -0.1484 -0.1412 -0.1412 0.0550 0.0550 0.1389 0.1389 0.4310 0.4310 0.4407 0.4407 0.5270 0.5270 0.5289 0.5289 0.7565 0.7565 0.7955 0.7955 9.4586 9.4586 9.5174 9.5174 10.3994 10.3994 10.5951 10.5951 10.6651 10.6651 k = 0.0310 0.5133 0.3209 ( 12066 PWs) bands (ev): -19.6269 -19.6269 -19.6224 -19.6224 -18.3633 -18.3633 -18.3619 -18.3619 -15.2911 -15.2911 -15.2833 -15.2833 -4.2838 -4.2838 -4.2382 -4.2382 -3.7502 -3.7502 -3.7148 -3.7148 -2.8653 -2.8653 -2.8376 -2.8376 -2.6415 -2.6415 -2.6218 -2.6218 -0.1473 -0.1473 -0.1424 -0.1424 0.0703 0.0703 0.1270 0.1270 0.4326 0.4326 0.4393 0.4393 0.5276 0.5276 0.5290 0.5290 0.7654 0.7654 0.7917 0.7917 9.4757 9.4757 9.5130 9.5130 10.4388 10.4388 10.5891 10.5891 10.6904 10.6904 k = 0.0155 0.5079 0.3289 ( 12062 PWs) bands (ev): -19.6259 -19.6259 -19.6235 -19.6235 -18.3631 -18.3631 -18.3621 -18.3621 -15.2890 -15.2890 -15.2851 -15.2851 -4.2713 -4.2713 -4.2484 -4.2484 -3.7421 -3.7421 -3.7242 -3.7242 -2.8590 -2.8590 -2.8448 -2.8448 -2.6391 -2.6391 -2.6291 -2.6291 -0.1462 -0.1462 -0.1437 -0.1437 0.0854 0.0854 0.1140 0.1140 0.4343 0.4343 0.4377 0.4377 0.5281 0.5281 0.5290 0.5290 0.7735 0.7735 0.7868 0.7868 9.4892 9.4892 9.5073 9.5073 10.4780 10.4780 10.5551 10.5551 10.7401 10.7401 k = 0.0000 0.5026 0.3368 ( 12064 PWs) bands (ev): -19.6251 -19.6251 -19.6243 -19.6243 -18.3631 -18.3631 -18.3621 -18.3621 -15.2870 -15.2870 -15.2870 -15.2870 -4.2596 -4.2596 -4.2595 -4.2595 -3.7337 -3.7337 -3.7331 -3.7331 -2.8520 -2.8520 -2.8520 -2.8520 -2.6349 -2.6349 -2.6348 -2.6348 -0.1453 -0.1453 -0.1446 -0.1446 0.0997 0.0997 0.1004 0.1004 0.4358 0.4358 0.4363 0.4363 0.5284 0.5284 0.5289 0.5289 0.7803 0.7803 0.7810 0.7810 9.4995 9.4995 9.4995 9.4995 10.5170 10.5170 10.5170 10.5170 10.7900 10.7900 k = 0.0000 0.5026 0.3368 ( 12064 PWs) bands (ev): -19.6251 -19.6251 -19.6243 -19.6243 -18.3631 -18.3631 -18.3621 -18.3621 -15.2870 -15.2870 -15.2870 -15.2870 -4.2596 -4.2596 -4.2595 -4.2595 -3.7337 -3.7337 -3.7331 -3.7331 -2.8520 -2.8520 -2.8520 -2.8520 -2.6349 -2.6349 -2.6348 -2.6348 -0.1453 -0.1453 -0.1446 -0.1446 0.0997 0.0997 0.1004 0.1004 0.4358 0.4358 0.4363 0.4363 0.5284 0.5284 0.5289 0.5289 0.7803 0.7803 0.7810 0.7810 9.4995 9.4995 9.4995 9.4995 10.5170 10.5170 10.5170 10.5170 10.7900 10.7900 k = 0.0096 0.4939 0.3498 ( 12064 PWs) bands (ev): -19.6251 -19.6251 -19.6243 -19.6243 -18.3631 -18.3631 -18.3622 -18.3622 -15.2870 -15.2870 -15.2870 -15.2870 -4.2638 -4.2638 -4.2556 -4.2556 -3.7415 -3.7415 -3.7251 -3.7251 -2.8576 -2.8576 -2.8465 -2.8465 -2.6356 -2.6356 -2.6339 -2.6339 -0.1453 -0.1453 -0.1443 -0.1443 0.0993 0.0993 0.1018 0.1018 0.4357 0.4357 0.4362 0.4362 0.5275 0.5275 0.5292 0.5292 0.7794 0.7794 0.7814 0.7814 9.4994 9.4994 9.4996 9.4996 10.5035 10.5035 10.5090 10.5090 10.7916 10.7916 k = 0.0192 0.4852 0.3627 ( 12064 PWs) bands (ev): -19.6251 -19.6251 -19.6242 -19.6242 -18.3632 -18.3632 -18.3622 -18.3622 -15.2870 -15.2870 -15.2870 -15.2870 -4.2683 -4.2683 -4.2520 -4.2520 -3.7493 -3.7493 -3.7168 -3.7168 -2.8631 -2.8631 -2.8413 -2.8413 -2.6363 -2.6363 -2.6330 -2.6330 -0.1451 -0.1451 -0.1435 -0.1435 0.0997 0.0997 0.1044 0.1044 0.4354 0.4354 0.4360 0.4360 0.5259 0.5259 0.5291 0.5291 0.7779 0.7779 0.7818 0.7818 9.4992 9.4992 9.4995 9.4995 10.4740 10.4740 10.4825 10.4825 10.8073 10.8073 k = 0.0288 0.4766 0.3757 ( 12044 PWs) bands (ev): -19.6250 -19.6250 -19.6241 -19.6241 -18.3633 -18.3633 -18.3624 -18.3624 -15.2869 -15.2869 -15.2869 -15.2869 -4.2729 -4.2729 -4.2490 -4.2490 -3.7567 -3.7567 -3.7086 -3.7086 -2.8685 -2.8685 -2.8364 -2.8364 -2.6366 -2.6366 -2.6319 -2.6319 -0.1445 -0.1445 -0.1425 -0.1425 0.1012 0.1012 0.1078 0.1078 0.4351 0.4351 0.4357 0.4357 0.5238 0.5238 0.5286 0.5286 0.7760 0.7760 0.7817 0.7817 9.4988 9.4988 9.4992 9.4992 10.4360 10.4360 10.4452 10.4452 10.8270 10.8270 k = 0.0385 0.4679 0.3886 ( 12044 PWs) bands (ev): -19.6249 -19.6249 -19.6240 -19.6240 -18.3635 -18.3635 -18.3625 -18.3625 -15.2868 -15.2868 -15.2868 -15.2868 -4.2777 -4.2777 -4.2465 -4.2465 -3.7634 -3.7634 -3.7006 -3.7006 -2.8737 -2.8737 -2.8320 -2.8320 -2.6366 -2.6366 -2.6308 -2.6308 -0.1435 -0.1435 -0.1412 -0.1412 0.1037 0.1037 0.1119 0.1119 0.4345 0.4345 0.4352 0.4352 0.5213 0.5213 0.5276 0.5276 0.7736 0.7736 0.7811 0.7811 9.4981 9.4981 9.4987 9.4987 10.3944 10.3944 10.4029 10.4029 10.8433 10.8433 k = 0.0481 0.4592 0.4016 ( 12040 PWs) bands (ev): -19.6248 -19.6248 -19.6239 -19.6239 -18.3637 -18.3637 -18.3628 -18.3628 -15.2867 -15.2867 -15.2867 -15.2867 -4.2825 -4.2825 -4.2446 -4.2446 -3.7694 -3.7694 -3.6930 -3.6930 -2.8787 -2.8787 -2.8283 -2.8283 -2.6361 -2.6361 -2.6296 -2.6296 -0.1420 -0.1420 -0.1396 -0.1396 0.1071 0.1071 0.1166 0.1166 0.4339 0.4339 0.4346 0.4346 0.5184 0.5184 0.5264 0.5264 0.7709 0.7709 0.7801 0.7801 9.4970 9.4970 9.4979 9.4979 10.3520 10.3520 10.3594 10.3594 10.8544 10.8544 k = 0.0577 0.4505 0.4146 ( 12042 PWs) bands (ev): -19.6246 -19.6246 -19.6238 -19.6238 -18.3639 -18.3639 -18.3630 -18.3630 -15.2865 -15.2865 -15.2865 -15.2865 -4.2873 -4.2873 -4.2433 -4.2433 -3.7746 -3.7746 -3.6858 -3.6858 -2.8834 -2.8834 -2.8255 -2.8255 -2.6351 -2.6351 -2.6282 -2.6282 -0.1400 -0.1400 -0.1377 -0.1377 0.1113 0.1113 0.1216 0.1216 0.4332 0.4332 0.4338 0.4338 0.5154 0.5154 0.5251 0.5251 0.7676 0.7676 0.7786 0.7786 9.4954 9.4954 9.4965 9.4965 10.3103 10.3103 10.3164 10.3164 10.8617 10.8617 k = 0.0673 0.4418 0.4275 ( 12036 PWs) bands (ev): -19.6245 -19.6245 -19.6236 -19.6236 -18.3642 -18.3642 -18.3633 -18.3633 -15.2864 -15.2864 -15.2864 -15.2864 -4.2920 -4.2920 -4.2428 -4.2428 -3.7787 -3.7787 -3.6792 -3.6792 -2.8879 -2.8879 -2.8237 -2.8237 -2.6334 -2.6334 -2.6267 -2.6267 -0.1374 -0.1374 -0.1355 -0.1355 0.1161 0.1161 0.1266 0.1266 0.4323 0.4323 0.4329 0.4329 0.5123 0.5123 0.5237 0.5237 0.7638 0.7638 0.7766 0.7766 9.4931 9.4931 9.4944 9.4944 10.2704 10.2704 10.2751 10.2751 10.8671 10.8671 k = 0.0769 0.4332 0.4405 ( 12040 PWs) bands (ev): -19.6243 -19.6243 -19.6234 -19.6234 -18.3646 -18.3646 -18.3637 -18.3637 -15.2862 -15.2862 -15.2862 -15.2862 -4.2965 -4.2965 -4.2431 -4.2431 -3.7819 -3.7819 -3.6732 -3.6732 -2.8920 -2.8920 -2.8230 -2.8230 -2.6309 -2.6309 -2.6250 -2.6250 -0.1342 -0.1342 -0.1329 -0.1329 0.1213 0.1213 0.1315 0.1315 0.4314 0.4314 0.4320 0.4320 0.5094 0.5094 0.5224 0.5224 0.7596 0.7596 0.7740 0.7740 9.4899 9.4899 9.4915 9.4915 10.2328 10.2328 10.2362 10.2362 10.8720 10.8720 k = 0.0865 0.4245 0.4534 ( 12038 PWs) bands (ev): -19.6241 -19.6241 -19.6232 -19.6232 -18.3649 -18.3649 -18.3640 -18.3640 -15.2860 -15.2860 -15.2860 -15.2860 -4.3009 -4.3009 -4.2441 -4.2441 -3.7840 -3.7840 -3.6678 -3.6678 -2.8960 -2.8960 -2.8234 -2.8234 -2.6278 -2.6278 -2.6230 -2.6230 -0.1305 -0.1305 -0.1299 -0.1299 0.1267 0.1267 0.1359 0.1359 0.4302 0.4302 0.4315 0.4315 0.5068 0.5068 0.5213 0.5213 0.7548 0.7548 0.7708 0.7708 9.4858 9.4858 9.4876 9.4876 10.1980 10.1980 10.2001 10.2001 10.8775 10.8775 k = 0.0962 0.4158 0.4664 ( 12036 PWs) bands (ev): -19.6238 -19.6238 -19.6230 -19.6230 -18.3653 -18.3653 -18.3644 -18.3644 -15.2858 -15.2858 -15.2858 -15.2858 -4.3050 -4.3050 -4.2458 -4.2458 -3.7849 -3.7849 -3.6632 -3.6632 -2.8996 -2.8996 -2.8250 -2.8250 -2.6240 -2.6240 -2.6208 -2.6208 -0.1268 -0.1268 -0.1258 -0.1258 0.1320 0.1320 0.1397 0.1397 0.4291 0.4291 0.4313 0.4313 0.5045 0.5045 0.5206 0.5206 0.7494 0.7494 0.7669 0.7669 9.4805 9.4805 9.4826 9.4826 10.1662 10.1662 10.1672 10.1672 10.8843 10.8843 k = 0.1058 0.4071 0.4793 ( 12042 PWs) bands (ev): -19.6236 -19.6236 -19.6228 -19.6228 -18.3657 -18.3657 -18.3648 -18.3648 -15.2855 -15.2855 -15.2855 -15.2855 -4.3089 -4.3089 -4.2483 -4.2483 -3.7847 -3.7847 -3.6594 -3.6594 -2.9030 -2.9030 -2.8276 -2.8276 -2.6196 -2.6196 -2.6182 -2.6182 -0.1230 -0.1230 -0.1208 -0.1208 0.1368 0.1368 0.1424 0.1424 0.4283 0.4283 0.4317 0.4317 0.5027 0.5027 0.5202 0.5202 0.7434 0.7434 0.7625 0.7625 9.4743 9.4743 9.4765 9.4765 10.1373 10.1373 10.1374 10.1374 10.8929 10.8934 k = 0.1154 0.3984 0.4923 ( 12036 PWs) bands (ev): -19.6234 -19.6234 -19.6225 -19.6225 -18.3661 -18.3661 -18.3652 -18.3652 -15.2853 -15.2853 -15.2853 -15.2853 -4.3124 -4.3124 -4.2514 -4.2514 -3.7834 -3.7834 -3.6565 -3.6565 -2.9061 -2.9061 -2.8312 -2.8312 -2.6153 -2.6153 -2.6147 -2.6147 -0.1188 -0.1188 -0.1152 -0.1152 0.1409 0.1409 0.1441 0.1441 0.4279 0.4279 0.4327 0.4327 0.5014 0.5014 0.5204 0.5204 0.7369 0.7369 0.7574 0.7574 9.4669 9.4669 9.4694 9.4694 10.1109 10.1109 10.1116 10.1116 10.9037 10.9037 k = 0.1250 0.3898 0.5052 ( 12036 PWs) bands (ev): -19.6231 -19.6231 -19.6223 -19.6223 -18.3666 -18.3666 -18.3657 -18.3657 -15.2850 -15.2850 -15.2850 -15.2850 -4.3156 -4.3156 -4.2551 -4.2551 -3.7810 -3.7810 -3.6543 -3.6543 -2.9090 -2.9090 -2.8357 -2.8357 -2.6121 -2.6121 -2.6096 -2.6096 -0.1140 -0.1140 -0.1089 -0.1089 0.1439 0.1439 0.1444 0.1444 0.4282 0.4282 0.4345 0.4345 0.5007 0.5007 0.5210 0.5210 0.7298 0.7298 0.7516 0.7516 9.4586 9.4586 9.4612 9.4612 10.0874 10.0874 10.0887 10.0887 10.9168 10.9170 k = 0.1346 0.3811 0.5182 ( 12042 PWs) bands (ev): -19.6229 -19.6229 -19.6220 -19.6220 -18.3670 -18.3670 -18.3661 -18.3661 -15.2848 -15.2848 -15.2848 -15.2848 -4.3185 -4.3185 -4.2593 -4.2593 -3.7777 -3.7777 -3.6530 -3.6530 -2.9117 -2.9117 -2.8408 -2.8408 -2.6086 -2.6086 -2.6042 -2.6042 -0.1088 -0.1088 -0.1022 -0.1022 0.1431 0.1431 0.1459 0.1459 0.4295 0.4295 0.4371 0.4371 0.5005 0.5005 0.5222 0.5222 0.7220 0.7220 0.7452 0.7452 9.4496 9.4496 9.4522 9.4522 10.0668 10.0668 10.0686 10.0686 10.9328 10.9330 k = 0.1442 0.3724 0.5311 ( 12038 PWs) bands (ev): -19.6227 -19.6227 -19.6218 -19.6218 -18.3674 -18.3674 -18.3665 -18.3665 -15.2846 -15.2846 -15.2846 -15.2846 -4.3209 -4.3209 -4.2639 -4.2639 -3.7734 -3.7734 -3.6525 -3.6525 -2.9140 -2.9140 -2.8465 -2.8465 -2.6049 -2.6049 -2.5988 -2.5988 -0.1031 -0.1031 -0.0949 -0.0949 0.1405 0.1405 0.1462 0.1462 0.4319 0.4319 0.4405 0.4405 0.5008 0.5008 0.5241 0.5241 0.7138 0.7138 0.7382 0.7382 9.4399 9.4399 9.4425 9.4425 10.0490 10.0490 10.0511 10.0511 10.9518 10.9518 k = 0.1538 0.3637 0.5441 ( 12048 PWs) bands (ev): -19.6224 -19.6224 -19.6216 -19.6216 -18.3678 -18.3678 -18.3669 -18.3669 -15.2843 -15.2843 -15.2843 -15.2843 -4.3228 -4.3228 -4.2688 -4.2688 -3.7683 -3.7683 -3.6529 -3.6529 -2.9160 -2.9160 -2.8527 -2.8527 -2.6009 -2.6009 -2.5936 -2.5936 -0.0969 -0.0969 -0.0873 -0.0873 0.1364 0.1364 0.1450 0.1450 0.4354 0.4354 0.4445 0.4445 0.5017 0.5017 0.5266 0.5266 0.7050 0.7050 0.7305 0.7305 9.4300 9.4300 9.4326 9.4326 10.0336 10.0336 10.0358 10.0358 10.9731 10.9732 k = 0.1635 0.3550 0.5571 ( 12042 PWs) bands (ev): -19.6222 -19.6222 -19.6213 -19.6213 -18.3682 -18.3682 -18.3673 -18.3673 -15.2841 -15.2841 -15.2841 -15.2841 -4.3243 -4.3243 -4.2739 -4.2739 -3.7625 -3.7625 -3.6541 -3.6541 -2.9176 -2.9176 -2.8590 -2.8590 -2.5969 -2.5969 -2.5886 -2.5886 -0.0902 -0.0902 -0.0793 -0.0793 0.1312 0.1312 0.1422 0.1422 0.4400 0.4400 0.4490 0.4490 0.5031 0.5031 0.5298 0.5298 0.6957 0.6957 0.7223 0.7223 9.4201 9.4201 9.4225 9.4225 10.0204 10.0204 10.0226 10.0226 10.9966 10.9966 k = 0.1731 0.3463 0.5700 ( 12048 PWs) bands (ev): -19.6220 -19.6220 -19.6211 -19.6211 -18.3686 -18.3686 -18.3676 -18.3676 -15.2839 -15.2839 -15.2839 -15.2839 -4.3254 -4.3254 -4.2792 -4.2792 -3.7561 -3.7561 -3.6561 -3.6561 -2.9189 -2.9189 -2.8655 -2.8655 -2.5927 -2.5927 -2.5840 -2.5840 -0.0832 -0.0832 -0.0711 -0.0711 0.1250 0.1250 0.1380 0.1380 0.4453 0.4453 0.4537 0.4537 0.5053 0.5053 0.5338 0.5338 0.6861 0.6861 0.7136 0.7136 9.4105 9.4105 9.4127 9.4127 10.0091 10.0091 10.0112 10.0112 11.0219 11.0220 k = 0.1827 0.3377 0.5830 ( 12046 PWs) bands (ev): -19.6218 -19.6218 -19.6209 -19.6209 -18.3689 -18.3689 -18.3680 -18.3680 -15.2837 -15.2837 -15.2837 -15.2837 -4.3259 -4.3259 -4.2844 -4.2844 -3.7493 -3.7493 -3.6589 -3.6589 -2.9197 -2.9197 -2.8720 -2.8720 -2.5887 -2.5887 -2.5799 -2.5799 -0.0758 -0.0758 -0.0628 -0.0628 0.1180 0.1180 0.1325 0.1325 0.4511 0.4511 0.4583 0.4583 0.5084 0.5084 0.5386 0.5386 0.6763 0.6763 0.7044 0.7044 9.4013 9.4013 9.4033 9.4033 9.9996 9.9996 10.0015 10.0015 11.0485 11.0485 k = 0.1923 0.3290 0.5959 ( 12050 PWs) bands (ev): -19.6216 -19.6216 -19.6208 -19.6208 -18.3692 -18.3692 -18.3683 -18.3683 -15.2836 -15.2836 -15.2835 -15.2835 -4.3260 -4.3260 -4.2896 -4.2896 -3.7420 -3.7420 -3.6625 -3.6625 -2.9199 -2.9199 -2.8784 -2.8784 -2.5847 -2.5847 -2.5763 -2.5763 -0.0681 -0.0681 -0.0547 -0.0547 0.1108 0.1108 0.1260 0.1260 0.4569 0.4569 0.4625 0.4625 0.5126 0.5126 0.5440 0.5440 0.6664 0.6664 0.6948 0.6948 9.3929 9.3929 9.3947 9.3947 9.9916 9.9916 9.9934 9.9934 11.0755 11.0756 k = 0.2019 0.3203 0.6089 ( 12050 PWs) bands (ev): -19.6215 -19.6215 -19.6206 -19.6206 -18.3695 -18.3695 -18.3685 -18.3685 -15.2834 -15.2834 -15.2834 -15.2834 -4.3255 -4.3255 -4.2947 -4.2947 -3.7345 -3.7345 -3.6667 -3.6667 -2.9197 -2.9197 -2.8846 -2.8846 -2.5810 -2.5810 -2.5734 -2.5734 -0.0604 -0.0604 -0.0471 -0.0471 0.1037 0.1037 0.1188 0.1188 0.4622 0.4622 0.4662 0.4662 0.5180 0.5180 0.5498 0.5498 0.6569 0.6569 0.6849 0.6849 9.3855 9.3855 9.3870 9.3870 9.9851 9.9851 9.9866 9.9866 11.1020 11.1020 k = 0.2115 0.3116 0.6218 ( 12050 PWs) bands (ev): -19.6214 -19.6214 -19.6205 -19.6205 -18.3697 -18.3697 -18.3688 -18.3688 -15.2833 -15.2833 -15.2833 -15.2833 -4.3245 -4.3245 -4.2995 -4.2995 -3.7268 -3.7268 -3.6716 -3.6716 -2.9188 -2.9188 -2.8904 -2.8904 -2.5777 -2.5777 -2.5711 -2.5711 -0.0529 -0.0529 -0.0403 -0.0403 0.0971 0.0971 0.1114 0.1114 0.4666 0.4666 0.4693 0.4693 0.5247 0.5247 0.5554 0.5554 0.6483 0.6483 0.6750 0.6750 9.3793 9.3793 9.3804 9.3804 9.9799 9.9799 9.9811 9.9811 11.1266 11.1267 k = 0.2212 0.3029 0.6348 ( 12046 PWs) bands (ev): -19.6213 -19.6213 -19.6204 -19.6204 -18.3699 -18.3699 -18.3689 -18.3689 -15.2832 -15.2832 -15.2832 -15.2832 -4.3230 -4.3230 -4.3041 -4.3041 -3.7191 -3.7191 -3.6771 -3.6771 -2.9174 -2.9174 -2.8959 -2.8959 -2.5747 -2.5747 -2.5695 -2.5695 -0.0457 -0.0457 -0.0348 -0.0348 0.0918 0.0918 0.1041 0.1041 0.4700 0.4700 0.4716 0.4716 0.5324 0.5324 0.5598 0.5598 0.6414 0.6414 0.6652 0.6652 9.3743 9.3743 9.3752 9.3752 9.9759 9.9759 9.9769 9.9769 11.1481 11.1482 k = 0.2308 0.2943 0.6477 ( 12040 PWs) bands (ev): -19.6212 -19.6212 -19.6203 -19.6203 -18.3700 -18.3700 -18.3691 -18.3691 -15.2831 -15.2831 -15.2831 -15.2831 -4.3210 -4.3210 -4.3083 -4.3083 -3.7115 -3.7115 -3.6832 -3.6832 -2.9153 -2.9153 -2.9009 -2.9009 -2.5723 -2.5723 -2.5687 -2.5687 -0.0393 -0.0393 -0.0311 -0.0311 0.0883 0.0883 0.0974 0.0974 0.4723 0.4723 0.4733 0.4733 0.5407 0.5407 0.5619 0.5619 0.6373 0.6373 0.6558 0.6558 9.3707 9.3707 9.3713 9.3713 9.9732 9.9732 9.9738 9.9738 11.1652 11.1664 k = 0.2404 0.2856 0.6607 ( 12052 PWs) bands (ev): -19.6211 -19.6211 -19.6203 -19.6203 -18.3701 -18.3701 -18.3691 -18.3691 -15.2831 -15.2831 -15.2831 -15.2831 -4.3185 -4.3185 -4.3121 -4.3121 -3.7039 -3.7039 -3.6897 -3.6897 -2.9126 -2.9126 -2.9054 -2.9054 -2.5704 -2.5704 -2.5686 -2.5686 -0.0342 -0.0342 -0.0297 -0.0297 0.0871 0.0871 0.0920 0.0920 0.4736 0.4736 0.4743 0.4743 0.5489 0.5489 0.5606 0.5606 0.6372 0.6372 0.6474 0.6474 9.3685 9.3685 9.3688 9.3688 9.9716 9.9716 9.9719 9.9719 11.1766 11.1769 k = 0.2500 0.2769 0.6736 ( 12048 PWs) bands (ev): -19.6211 -19.6211 -19.6203 -19.6203 -18.3701 -18.3701 -18.3692 -18.3692 -15.2831 -15.2831 -15.2830 -15.2830 -4.3156 -4.3156 -4.3155 -4.3155 -3.6969 -3.6969 -3.6964 -3.6964 -2.9093 -2.9093 -2.9092 -2.9092 -2.5692 -2.5692 -2.5691 -2.5691 -0.0311 -0.0311 -0.0306 -0.0306 0.0880 0.0880 0.0888 0.0888 0.4741 0.4741 0.4746 0.4746 0.5555 0.5555 0.5563 0.5563 0.6405 0.6405 0.6412 0.6412 9.3679 9.3679 9.3680 9.3680 9.9712 9.9712 9.9713 9.9713 11.1814 11.1814 k = 0.2500 0.2769 0.6736 ( 12048 PWs) bands (ev): -19.6211 -19.6211 -19.6203 -19.6203 -18.3701 -18.3701 -18.3692 -18.3692 -15.2831 -15.2831 -15.2830 -15.2830 -4.3156 -4.3156 -4.3155 -4.3155 -3.6969 -3.6969 -3.6964 -3.6964 -2.9093 -2.9093 -2.9092 -2.9092 -2.5692 -2.5692 -2.5691 -2.5691 -0.0311 -0.0311 -0.0306 -0.0306 0.0880 0.0880 0.0888 0.0888 0.4741 0.4741 0.4746 0.4746 0.5555 0.5555 0.5563 0.5563 0.6405 0.6405 0.6412 0.6412 9.3679 9.3679 9.3680 9.3680 9.9712 9.9712 9.9713 9.9713 11.1814 11.1814 k = 0.2583 0.2861 0.6599 ( 12046 PWs) bands (ev): -19.6211 -19.6211 -19.6203 -19.6203 -18.3707 -18.3707 -18.3685 -18.3685 -15.2856 -15.2856 -15.2805 -15.2805 -4.3189 -4.3189 -4.3123 -4.3123 -3.7053 -3.7053 -3.6880 -3.6880 -2.9335 -2.9335 -2.8846 -2.8846 -2.5699 -2.5699 -2.5681 -2.5681 -0.0410 -0.0410 -0.0222 -0.0222 0.0766 0.0766 0.1015 0.1015 0.4735 0.4735 0.4747 0.4747 0.5496 0.5496 0.5607 0.5607 0.6307 0.6307 0.6527 0.6527 9.3477 9.3477 9.3889 9.3889 9.9278 9.9278 10.0155 10.0155 11.1709 11.1719 k = 0.2667 0.2953 0.6461 ( 12039 PWs) bands (ev): -19.6212 -19.6212 -19.6202 -19.6202 -18.3713 -18.3713 -18.3678 -18.3678 -15.2881 -15.2881 -15.2780 -15.2780 -4.3227 -4.3227 -4.3088 -4.3088 -3.7136 -3.7136 -3.6797 -3.6797 -2.9566 -2.9566 -2.8603 -2.8603 -2.5709 -2.5709 -2.5664 -2.5664 -0.0510 -0.0510 -0.0170 -0.0170 0.0658 0.0658 0.1167 0.1167 0.4715 0.4715 0.4751 0.4751 0.5426 0.5426 0.5634 0.5634 0.6211 0.6211 0.6669 0.6669 9.3320 9.3320 9.4064 9.4064 9.8877 9.8877 10.0583 10.0583 11.1398 11.1398 k = 0.2750 0.3046 0.6323 ( 12040 PWs) bands (ev): -19.6213 -19.6213 -19.6202 -19.6202 -18.3719 -18.3719 -18.3671 -18.3671 -15.2906 -15.2906 -15.2756 -15.2756 -4.3270 -4.3270 -4.3050 -4.3050 -3.7217 -3.7217 -3.6716 -3.6716 -2.9782 -2.9782 -2.8364 -2.8364 -2.5719 -2.5719 -2.5639 -2.5639 -0.0606 -0.0606 -0.0160 -0.0160 0.0570 0.0570 0.1333 0.1333 0.4688 0.4688 0.4754 0.4754 0.5353 0.5353 0.5647 0.5647 0.6122 0.6122 0.6821 0.6821 9.3207 9.3207 9.4202 9.4202 9.8518 9.8518 10.0978 10.0978 11.0773 11.0773 k = 0.2833 0.3138 0.6186 ( 12039 PWs) bands (ev): -19.6213 -19.6213 -19.6203 -19.6203 -18.3724 -18.3724 -18.3664 -18.3664 -15.2930 -15.2930 -15.2734 -15.2734 -4.3320 -4.3320 -4.3009 -4.3009 -3.7294 -3.7294 -3.6639 -3.6639 -2.9981 -2.9981 -2.8132 -2.8132 -2.5728 -2.5728 -2.5608 -2.5608 -0.0700 -0.0700 -0.0193 -0.0193 0.0509 0.0509 0.1506 0.1506 0.4652 0.4652 0.4756 0.4756 0.5277 0.5277 0.5652 0.5652 0.6042 0.6042 0.6973 0.6973 9.3139 9.3139 9.4300 9.4300 9.8210 9.8210 10.1319 10.1319 10.9956 10.9956 k = 0.2917 0.3230 0.6048 ( 12038 PWs) bands (ev): -19.6213 -19.6213 -19.6204 -19.6204 -18.3729 -18.3729 -18.3657 -18.3657 -15.2954 -15.2954 -15.2713 -15.2713 -4.3376 -4.3376 -4.2964 -4.2964 -3.7367 -3.7367 -3.6567 -3.6567 -3.0162 -3.0162 -2.7913 -2.7913 -2.5731 -2.5731 -2.5569 -2.5569 -0.0790 -0.0790 -0.0263 -0.0263 0.0474 0.0474 0.1680 0.1680 0.4610 0.4610 0.4755 0.4755 0.5201 0.5201 0.5653 0.5653 0.5972 0.5972 0.7120 0.7120 9.3114 9.3114 9.4355 9.4355 9.7960 9.7960 10.1581 10.1581 10.9089 10.9089 k = 0.3000 0.3323 0.5910 ( 12036 PWs) bands (ev): -19.6212 -19.6212 -19.6206 -19.6206 -18.3733 -18.3733 -18.3650 -18.3650 -15.2977 -15.2977 -15.2692 -15.2692 -4.3440 -4.3440 -4.2915 -4.2915 -3.7434 -3.7434 -3.6501 -3.6501 -3.0323 -3.0323 -2.7712 -2.7712 -2.5723 -2.5723 -2.5525 -2.5525 -0.0878 -0.0878 -0.0360 -0.0360 0.0457 0.0457 0.1850 0.1850 0.4562 0.4562 0.4750 0.4750 0.5128 0.5128 0.5652 0.5652 0.5911 0.5911 0.7257 0.7257 9.3131 9.3131 9.4368 9.4368 9.7769 9.7769 10.1735 10.1735 10.8231 10.8231 k = 0.3083 0.3415 0.5772 ( 12032 PWs) bands (ev): -19.6211 -19.6211 -19.6208 -19.6208 -18.3737 -18.3737 -18.3643 -18.3643 -15.2999 -15.2999 -15.2674 -15.2674 -4.3511 -4.3511 -4.2863 -4.2863 -3.7493 -3.7493 -3.6442 -3.6442 -3.0462 -3.0462 -2.7535 -2.7535 -2.5699 -2.5699 -2.5474 -2.5474 -0.0964 -0.0964 -0.0472 -0.0472 0.0451 0.0451 0.2011 0.2011 0.4511 0.4511 0.4737 0.4737 0.5063 0.5063 0.5650 0.5650 0.5859 0.5859 0.7383 0.7383 9.3188 9.3188 9.4347 9.4347 9.7635 9.7635 10.1760 10.1760 10.7403 10.7403 k = 0.3167 0.3507 0.5635 ( 12031 PWs) bands (ev): -19.6214 -19.6214 -19.6206 -19.6206 -18.3740 -18.3740 -18.3636 -18.3636 -15.3021 -15.3021 -15.2657 -15.2657 -4.3588 -4.3588 -4.2808 -4.2808 -3.7544 -3.7544 -3.6392 -3.6392 -3.0579 -3.0579 -2.7389 -2.7389 -2.5652 -2.5652 -2.5415 -2.5415 -0.1050 -0.1050 -0.0590 -0.0590 0.0449 0.0449 0.2156 0.2156 0.4460 0.4460 0.4712 0.4712 0.5012 0.5012 0.5648 0.5648 0.5814 0.5814 0.7494 0.7494 9.3283 9.3283 9.4299 9.4299 9.7550 9.7550 10.1641 10.1641 10.6617 10.6617 k = 0.3250 0.3600 0.5497 ( 12032 PWs) bands (ev): -19.6219 -19.6219 -19.6203 -19.6203 -18.3743 -18.3743 -18.3629 -18.3629 -15.3042 -15.3042 -15.2641 -15.2641 -4.3671 -4.3671 -4.2750 -4.2750 -3.7587 -3.7587 -3.6350 -3.6350 -3.0672 -3.0672 -2.7282 -2.7282 -2.5581 -2.5581 -2.5344 -2.5344 -0.1134 -0.1134 -0.0709 -0.0709 0.0448 0.0448 0.2282 0.2282 0.4411 0.4411 0.4674 0.4674 0.4979 0.4979 0.5646 0.5646 0.5777 0.5777 0.7589 0.7589 9.3412 9.3412 9.4237 9.4237 9.7506 9.7506 10.1381 10.1381 10.5882 10.5882 k = 0.3333 0.3692 0.5359 ( 12034 PWs) bands (ev): -19.6224 -19.6224 -19.6199 -19.6199 -18.3745 -18.3745 -18.3623 -18.3623 -15.3063 -15.3063 -15.2627 -15.2627 -4.3761 -4.3761 -4.2691 -4.2691 -3.7620 -3.7620 -3.6318 -3.6318 -3.0742 -3.0742 -2.7216 -2.7216 -2.5494 -2.5494 -2.5253 -2.5253 -0.1219 -0.1219 -0.0826 -0.0826 0.0446 0.0446 0.2383 0.2383 0.4369 0.4369 0.4625 0.4625 0.4963 0.4963 0.5644 0.5644 0.5747 0.5747 0.7668 0.7668 9.3572 9.3572 9.4174 9.4174 9.7490 9.7490 10.0999 10.0999 10.5204 10.5204 k = 0.3417 0.3784 0.5221 ( 12045 PWs) bands (ev): -19.6230 -19.6230 -19.6194 -19.6194 -18.3747 -18.3747 -18.3617 -18.3617 -15.3083 -15.3083 -15.2614 -15.2614 -4.3855 -4.3855 -4.2630 -4.2630 -3.7643 -3.7643 -3.6294 -3.6294 -3.0788 -3.0788 -2.7187 -2.7187 -2.5405 -2.5405 -2.5130 -2.5130 -0.1304 -0.1304 -0.0938 -0.0938 0.0442 0.0442 0.2452 0.2452 0.4337 0.4337 0.4573 0.4573 0.4959 0.4959 0.5642 0.5642 0.5722 0.5722 0.7728 0.7728 9.3757 9.3757 9.4118 9.4118 9.7495 9.7495 10.0517 10.0517 10.4590 10.4590 k = 0.3500 0.3876 0.5084 ( 12047 PWs) bands (ev): -19.6236 -19.6236 -19.6188 -19.6188 -18.3748 -18.3748 -18.3611 -18.3611 -15.3103 -15.3103 -15.2603 -15.2603 -4.3953 -4.3953 -4.2569 -4.2569 -3.7656 -3.7656 -3.6280 -3.6280 -3.0810 -3.0810 -2.7190 -2.7190 -2.5326 -2.5326 -2.4971 -2.4971 -0.1389 -0.1389 -0.1042 -0.1042 0.0434 0.0434 0.2485 0.2485 0.4318 0.4318 0.4524 0.4524 0.4964 0.4964 0.5639 0.5639 0.5704 0.5704 0.7770 0.7770 9.3959 9.3959 9.4080 9.4080 9.7511 9.7511 9.9962 9.9962 10.4050 10.4050 k = 0.3583 0.3969 0.4946 ( 12043 PWs) bands (ev): -19.6243 -19.6243 -19.6182 -19.6182 -18.3748 -18.3748 -18.3606 -18.3606 -15.3122 -15.3122 -15.2594 -15.2594 -4.4053 -4.4053 -4.2507 -4.2507 -3.7661 -3.7661 -3.6275 -3.6275 -3.0809 -3.0809 -2.7218 -2.7218 -2.5257 -2.5257 -2.4782 -2.4782 -0.1474 -0.1474 -0.1139 -0.1139 0.0422 0.0422 0.2481 0.2481 0.4311 0.4311 0.4486 0.4486 0.4973 0.4973 0.5635 0.5635 0.5692 0.5692 0.7793 0.7793 9.4057 9.4057 9.4176 9.4176 9.7531 9.7531 9.9358 9.9358 10.3592 10.3592 k = 0.3667 0.4061 0.4808 ( 12048 PWs) bands (ev): -19.6251 -19.6251 -19.6175 -19.6175 -18.3748 -18.3748 -18.3601 -18.3601 -15.3140 -15.3140 -15.2587 -15.2587 -4.4156 -4.4156 -4.2446 -4.2446 -3.7656 -3.7656 -3.6276 -3.6276 -3.0786 -3.0786 -2.7266 -2.7266 -2.5195 -2.5195 -2.4573 -2.4573 -0.1560 -0.1560 -0.1227 -0.1227 0.0406 0.0406 0.2437 0.2437 0.4310 0.4310 0.4467 0.4467 0.4987 0.4987 0.5629 0.5629 0.5685 0.5685 0.7797 0.7797 9.4064 9.4064 9.4388 9.4388 9.7539 9.7539 9.8736 9.8736 10.3229 10.3229 k = 0.3750 0.4153 0.4671 ( 12035 PWs) bands (ev): -19.6259 -19.6259 -19.6167 -19.6167 -18.3747 -18.3747 -18.3597 -18.3597 -15.3158 -15.3158 -15.2581 -15.2581 -4.4258 -4.4258 -4.2387 -4.2387 -3.7643 -3.7643 -3.6284 -3.6284 -3.0741 -3.0741 -2.7327 -2.7327 -2.5137 -2.5137 -2.4355 -2.4355 -0.1644 -0.1644 -0.1305 -0.1305 0.0386 0.0386 0.2359 0.2359 0.4307 0.4307 0.4474 0.4474 0.5003 0.5003 0.5622 0.5622 0.5682 0.5682 0.7782 0.7782 9.4092 9.4092 9.4589 9.4589 9.7474 9.7474 9.8171 9.8171 10.2971 10.2971 k = 0.3833 0.4246 0.4533 ( 12043 PWs) bands (ev): -19.6267 -19.6267 -19.6158 -19.6158 -18.3745 -18.3745 -18.3593 -18.3593 -15.3175 -15.3175 -15.2577 -15.2577 -4.4360 -4.4360 -4.2330 -4.2330 -3.7624 -3.7624 -3.6297 -3.6297 -3.0676 -3.0676 -2.7400 -2.7400 -2.5082 -2.5082 -2.4131 -2.4131 -0.1728 -0.1728 -0.1373 -0.1373 0.0360 0.0360 0.2249 0.2249 0.4299 0.4299 0.4506 0.4506 0.5022 0.5022 0.5615 0.5615 0.5682 0.5682 0.7749 0.7749 9.4139 9.4139 9.4768 9.4768 9.7118 9.7118 9.7898 9.7898 10.2830 10.2830 k = 0.3917 0.4338 0.4395 ( 12038 PWs) bands (ev): -19.6276 -19.6276 -19.6150 -19.6150 -18.3743 -18.3743 -18.3589 -18.3589 -15.3192 -15.3192 -15.2575 -15.2575 -4.4460 -4.4460 -4.2275 -4.2275 -3.7600 -3.7600 -3.6312 -3.6312 -3.0592 -3.0592 -2.7480 -2.7480 -2.5030 -2.5030 -2.3906 -2.3906 -0.1809 -0.1809 -0.1431 -0.1431 0.0329 0.0329 0.2114 0.2114 0.4292 0.4292 0.4553 0.4553 0.5044 0.5044 0.5609 0.5609 0.5684 0.5684 0.7698 0.7698 9.4194 9.4194 9.4915 9.4915 9.6526 9.6526 9.7880 9.7880 10.2815 10.2815 k = 0.4000 0.4430 0.4257 ( 12045 PWs) bands (ev): -19.6285 -19.6285 -19.6140 -19.6140 -18.3740 -18.3740 -18.3586 -18.3586 -15.3207 -15.3207 -15.2574 -15.2574 -4.4557 -4.4557 -4.2223 -4.2223 -3.7573 -3.7573 -3.6328 -3.6328 -3.0490 -3.0490 -2.7566 -2.7566 -2.4981 -2.4981 -2.3683 -2.3683 -0.1887 -0.1887 -0.1479 -0.1479 0.0293 0.0293 0.1958 0.1958 0.4287 0.4287 0.4608 0.4608 0.5067 0.5067 0.5603 0.5603 0.5687 0.5687 0.7630 0.7630 9.4226 9.4226 9.5024 9.5024 9.5921 9.5921 9.7932 9.7932 10.2933 10.2933 k = 0.4083 0.4523 0.4120 ( 12039 PWs) bands (ev): -19.6295 -19.6295 -19.6130 -19.6130 -18.3737 -18.3737 -18.3584 -18.3584 -15.3222 -15.3222 -15.2575 -15.2575 -4.4649 -4.4649 -4.2175 -4.2175 -3.7545 -3.7545 -3.6342 -3.6342 -3.0373 -3.0373 -2.7656 -2.7656 -2.4933 -2.4933 -2.3466 -2.3466 -0.1960 -0.1960 -0.1518 -0.1518 0.0251 0.0251 0.1786 0.1786 0.4288 0.4288 0.4667 0.4667 0.5092 0.5092 0.5597 0.5597 0.5691 0.5691 0.7547 0.7547 9.4155 9.4155 9.5091 9.5091 9.5427 9.5427 9.8019 9.8019 10.3181 10.3181 k = 0.4167 0.4615 0.3982 ( 12041 PWs) bands (ev): -19.6305 -19.6305 -19.6120 -19.6120 -18.3733 -18.3733 -18.3582 -18.3582 -15.3235 -15.3235 -15.2578 -15.2578 -4.4736 -4.4736 -4.2130 -4.2130 -3.7520 -3.7520 -3.6350 -3.6350 -3.0244 -3.0244 -2.7746 -2.7746 -2.4887 -2.4887 -2.3256 -2.3256 -0.2026 -0.2026 -0.1548 -0.1548 0.0204 0.0204 0.1602 0.1602 0.4291 0.4291 0.4727 0.4727 0.5120 0.5120 0.5591 0.5591 0.5695 0.5695 0.7449 0.7449 9.3843 9.3843 9.5111 9.5111 9.5198 9.5198 9.8139 9.8139 10.3555 10.3555 k = 0.4250 0.4707 0.3844 ( 12039 PWs) bands (ev): -19.6315 -19.6315 -19.6109 -19.6109 -18.3729 -18.3729 -18.3580 -18.3580 -15.3248 -15.3248 -15.2582 -15.2582 -4.4817 -4.4817 -4.2090 -4.2090 -3.7499 -3.7499 -3.6351 -3.6351 -3.0105 -3.0105 -2.7836 -2.7836 -2.4843 -2.4843 -2.3057 -2.3057 -0.2085 -0.2085 -0.1572 -0.1572 0.0150 0.0150 0.1411 0.1411 0.4298 0.4298 0.4786 0.4786 0.5149 0.5149 0.5584 0.5584 0.5701 0.5701 0.7339 0.7339 9.3316 9.3316 9.5123 9.5123 9.5175 9.5175 9.8299 9.8299 10.4045 10.4045 k = 0.4333 0.4799 0.3707 ( 12036 PWs) bands (ev): -19.6325 -19.6325 -19.6098 -19.6098 -18.3724 -18.3724 -18.3579 -18.3579 -15.3260 -15.3260 -15.2588 -15.2588 -4.4891 -4.4891 -4.2054 -4.2054 -3.7487 -3.7487 -3.6341 -3.6341 -2.9961 -2.9961 -2.7920 -2.7920 -2.4800 -2.4800 -2.2869 -2.2869 -0.2134 -0.2134 -0.1590 -0.1590 0.0089 0.0089 0.1216 0.1216 0.4305 0.4305 0.4843 0.4843 0.5181 0.5181 0.5576 0.5576 0.5707 0.5707 0.7219 0.7219 9.2708 9.2708 9.5166 9.5166 9.5190 9.5190 9.8508 9.8508 10.4639 10.4639 k = 0.4417 0.4892 0.3569 ( 12040 PWs) bands (ev): -19.6336 -19.6336 -19.6086 -19.6086 -18.3719 -18.3719 -18.3578 -18.3578 -15.3270 -15.3270 -15.2595 -15.2595 -4.4957 -4.4957 -4.2023 -4.2023 -3.7484 -3.7484 -3.6319 -3.6319 -2.9818 -2.9818 -2.7995 -2.7995 -2.4758 -2.4758 -2.2696 -2.2696 -0.2172 -0.2172 -0.1605 -0.1605 0.0021 0.0021 0.1022 0.1022 0.4311 0.4311 0.4897 0.4897 0.5213 0.5213 0.5568 0.5568 0.5713 0.5713 0.7092 0.7092 9.2080 9.2080 9.5169 9.5169 9.5256 9.5256 9.8772 9.8772 10.5326 10.5326 k = 0.4500 0.4984 0.3431 ( 12034 PWs) bands (ev): -19.6346 -19.6346 -19.6075 -19.6075 -18.3713 -18.3713 -18.3578 -18.3578 -15.3279 -15.3279 -15.2604 -15.2604 -4.5015 -4.5015 -4.1996 -4.1996 -3.7492 -3.7492 -3.6284 -3.6284 -2.9685 -2.9685 -2.8051 -2.8051 -2.4715 -2.4715 -2.2539 -2.2539 -0.2198 -0.2198 -0.1619 -0.1619 -0.0054 -0.0054 0.0835 0.0835 0.4313 0.4313 0.4949 0.4949 0.5246 0.5246 0.5558 0.5558 0.5720 0.5720 0.6962 0.6962 9.1456 9.1456 9.5176 9.5176 9.5311 9.5311 9.9099 9.9099 10.6095 10.6095 k = 0.4583 0.5076 0.3293 ( 12033 PWs) bands (ev): -19.6357 -19.6357 -19.6063 -19.6063 -18.3707 -18.3707 -18.3577 -18.3577 -15.3287 -15.3287 -15.2614 -15.2614 -4.5064 -4.5064 -4.1975 -4.1975 -3.7510 -3.7510 -3.6237 -3.6237 -2.9573 -2.9573 -2.8080 -2.8080 -2.4673 -2.4673 -2.2400 -2.2400 -0.2211 -0.2211 -0.1638 -0.1638 -0.0138 -0.0138 0.0658 0.0658 0.4310 0.4310 0.4998 0.4998 0.5278 0.5278 0.5550 0.5550 0.5727 0.5727 0.6832 0.6832 9.0847 9.0847 9.5198 9.5198 9.5339 9.5339 9.9490 9.9490 10.5614 10.5614 k = 0.4667 0.5169 0.3156 ( 12041 PWs) bands (ev): -19.6368 -19.6368 -19.6051 -19.6051 -18.3701 -18.3701 -18.3578 -18.3578 -15.3294 -15.3294 -15.2625 -15.2625 -4.5104 -4.5104 -4.1957 -4.1957 -3.7537 -3.7537 -3.6178 -3.6178 -2.9496 -2.9496 -2.8068 -2.8068 -2.4630 -2.4630 -2.2280 -2.2280 -0.2211 -0.2211 -0.1664 -0.1664 -0.0228 -0.0228 0.0497 0.0497 0.4299 0.4299 0.5044 0.5044 0.5306 0.5306 0.5544 0.5544 0.5734 0.5734 0.6707 0.6707 9.0256 9.0256 9.5240 9.5240 9.5339 9.5339 9.9944 9.9944 10.4745 10.4745 k = 0.4750 0.5261 0.3018 ( 12041 PWs) bands (ev): -19.6380 -19.6380 -19.6038 -19.6038 -18.3695 -18.3695 -18.3578 -18.3578 -15.3299 -15.3299 -15.2638 -15.2638 -4.5134 -4.5134 -4.1945 -4.1945 -3.7571 -3.7571 -3.6111 -3.6111 -2.9462 -2.9462 -2.8007 -2.8007 -2.4586 -2.4586 -2.2182 -2.2182 -0.2197 -0.2197 -0.1702 -0.1702 -0.0321 -0.0321 0.0353 0.0353 0.4278 0.4278 0.5086 0.5086 0.5327 0.5327 0.5542 0.5542 0.5740 0.5740 0.6593 0.6593 8.9689 8.9689 9.5293 9.5293 9.5324 9.5324 10.0457 10.0457 10.3890 10.3890 k = 0.4833 0.5353 0.2880 ( 12042 PWs) bands (ev): -19.6391 -19.6391 -19.6026 -19.6026 -18.3688 -18.3688 -18.3579 -18.3579 -15.3302 -15.3302 -15.2651 -15.2651 -4.5155 -4.5155 -4.1937 -4.1937 -3.7612 -3.7612 -3.6037 -3.6037 -2.9474 -2.9474 -2.7899 -2.7899 -2.4539 -2.4539 -2.2106 -2.2106 -0.2173 -0.2173 -0.1756 -0.1756 -0.0411 -0.0411 0.0229 0.0229 0.4245 0.4245 0.5122 0.5122 0.5341 0.5341 0.5546 0.5546 0.5747 0.5747 0.6495 0.6495 8.9148 8.9148 9.5249 9.5249 9.5408 9.5408 10.1021 10.1021 10.3053 10.3053 k = 0.4917 0.5446 0.2742 ( 12042 PWs) bands (ev): -19.6403 -19.6403 -19.6014 -19.6014 -18.3682 -18.3682 -18.3580 -18.3580 -15.3304 -15.3304 -15.2666 -15.2666 -4.5166 -4.5166 -4.1934 -4.1934 -3.7656 -3.7656 -3.5958 -3.5958 -2.9524 -2.9524 -2.7753 -2.7753 -2.4490 -2.4490 -2.2054 -2.2054 -0.2143 -0.2143 -0.1823 -0.1823 -0.0494 -0.0494 0.0121 0.0121 0.4198 0.4198 0.5150 0.5150 0.5348 0.5348 0.5552 0.5552 0.5757 0.5757 0.6418 0.6418 8.8635 8.8635 9.5168 9.5168 9.5535 9.5535 10.1611 10.1611 10.2257 10.2257 k = 0.5000 0.5538 0.2605 ( 12050 PWs) bands (ev): -19.6414 -19.6414 -19.6002 -19.6002 -18.3675 -18.3675 -18.3581 -18.3581 -15.3304 -15.3304 -15.2681 -15.2681 -4.5166 -4.5166 -4.1935 -4.1935 -3.7702 -3.7702 -3.5876 -3.5876 -2.9601 -2.9601 -2.7579 -2.7579 -2.4438 -2.4438 -2.2027 -2.2027 -0.2129 -0.2129 -0.1883 -0.1883 -0.0564 -0.0564 0.0029 0.0029 0.4138 0.4138 0.5166 0.5166 0.5354 0.5354 0.5557 0.5557 0.5775 0.5775 0.6365 0.6365 8.8152 8.8152 9.5064 9.5064 9.5696 9.5696 10.1382 10.1382 10.2342 10.2342 k = 0.5000 0.5538 0.2605 ( 12050 PWs) bands (ev): -19.6414 -19.6414 -19.6002 -19.6002 -18.3675 -18.3675 -18.3581 -18.3581 -15.3304 -15.3304 -15.2681 -15.2681 -4.5166 -4.5166 -4.1935 -4.1935 -3.7702 -3.7702 -3.5876 -3.5876 -2.9601 -2.9601 -2.7579 -2.7579 -2.4438 -2.4438 -2.2027 -2.2027 -0.2129 -0.2129 -0.1883 -0.1883 -0.0564 -0.0564 0.0029 0.0029 0.4138 0.4138 0.5166 0.5166 0.5354 0.5354 0.5557 0.5557 0.5775 0.5775 0.6365 0.6365 8.8152 8.8152 9.5064 9.5064 9.5696 9.5696 10.1382 10.1382 10.2342 10.2342 k = 0.5000 0.5538 0.2419 ( 12050 PWs) bands (ev): -19.6430 -19.6430 -19.5986 -19.5986 -18.3666 -18.3666 -18.3582 -18.3582 -15.3303 -15.3303 -15.2702 -15.2702 -4.5159 -4.5159 -4.1942 -4.1942 -3.7765 -3.7765 -3.5762 -3.5762 -2.9732 -2.9732 -2.7322 -2.7322 -2.4363 -2.4363 -2.2007 -2.2007 -0.2209 -0.2209 -0.1882 -0.1882 -0.0639 -0.0639 -0.0084 -0.0084 0.4039 0.4039 0.5176 0.5176 0.5363 0.5363 0.5558 0.5558 0.5806 0.5806 0.6318 0.6318 8.7540 8.7540 9.4912 9.4912 9.5928 9.5928 10.0391 10.0391 10.3224 10.3224 k = 0.5000 0.5538 0.2233 ( 12072 PWs) bands (ev): -19.6445 -19.6445 -19.5971 -19.5971 -18.3658 -18.3658 -18.3583 -18.3583 -15.3303 -15.3303 -15.2722 -15.2722 -4.5148 -4.5148 -4.1954 -4.1954 -3.7825 -3.7825 -3.5647 -3.5647 -2.9881 -2.9881 -2.7058 -2.7058 -2.4282 -2.4282 -2.1987 -2.1987 -0.2370 -0.2370 -0.1814 -0.1814 -0.0694 -0.0694 -0.0189 -0.0189 0.3926 0.3926 0.5183 0.5183 0.5370 0.5370 0.5554 0.5554 0.5833 0.5833 0.6294 0.6294 8.6969 8.6969 9.4769 9.4769 9.6143 9.6143 9.9463 9.9463 10.4131 10.4131 k = 0.5000 0.5538 0.2047 ( 12060 PWs) bands (ev): -19.6459 -19.6459 -19.5956 -19.5956 -18.3650 -18.3650 -18.3584 -18.3584 -15.3302 -15.3302 -15.2741 -15.2741 -4.5134 -4.5134 -4.1971 -4.1971 -3.7881 -3.7881 -3.5533 -3.5533 -3.0035 -3.0035 -2.6798 -2.6798 -2.4195 -2.4195 -2.1969 -2.1969 -0.2558 -0.2558 -0.1729 -0.1729 -0.0736 -0.0736 -0.0283 -0.0283 0.3801 0.3801 0.5187 0.5187 0.5377 0.5377 0.5546 0.5546 0.5853 0.5853 0.6292 0.6292 8.6439 8.6439 9.4634 9.4634 9.6342 9.6342 9.8600 9.8600 10.5061 10.5061 k = 0.5000 0.5538 0.1860 ( 12068 PWs) bands (ev): -19.6472 -19.6472 -19.5942 -19.5942 -18.3642 -18.3642 -18.3586 -18.3586 -15.3301 -15.3301 -15.2759 -15.2759 -4.5118 -4.5118 -4.1991 -4.1991 -3.7933 -3.7933 -3.5422 -3.5422 -3.0191 -3.0191 -2.6549 -2.6549 -2.4102 -2.4102 -2.1951 -2.1951 -0.2755 -0.2755 -0.1638 -0.1638 -0.0769 -0.0769 -0.0366 -0.0366 0.3669 0.3669 0.5187 0.5187 0.5383 0.5383 0.5537 0.5537 0.5865 0.5865 0.6308 0.6308 8.5952 8.5952 9.4509 9.4509 9.6526 9.6526 9.7805 9.7805 10.6012 10.6012 k = 0.5000 0.5538 0.1674 ( 12076 PWs) bands (ev): -19.6485 -19.6485 -19.5930 -19.5930 -18.3635 -18.3635 -18.3587 -18.3587 -15.3301 -15.3301 -15.2776 -15.2776 -4.5100 -4.5100 -4.2013 -4.2013 -3.7980 -3.7980 -3.5315 -3.5315 -3.0343 -3.0343 -2.6318 -2.6318 -2.4005 -2.4005 -2.1935 -2.1935 -0.2951 -0.2951 -0.1547 -0.1547 -0.0799 -0.0799 -0.0435 -0.0435 0.3533 0.3533 0.5186 0.5186 0.5388 0.5388 0.5526 0.5526 0.5873 0.5873 0.6335 0.6335 8.5509 8.5509 9.4394 9.4394 9.6694 9.6694 9.7081 9.7081 10.6981 10.6981 k = 0.5000 0.5538 0.1488 ( 12072 PWs) bands (ev): -19.6496 -19.6496 -19.5918 -19.5918 -18.3628 -18.3628 -18.3588 -18.3588 -15.3300 -15.3300 -15.2791 -15.2791 -4.5082 -4.5082 -4.2037 -4.2037 -3.8023 -3.8023 -3.5214 -3.5214 -3.0487 -3.0487 -2.6109 -2.6109 -2.3904 -2.3904 -2.1920 -2.1920 -0.3142 -0.3142 -0.1458 -0.1458 -0.0827 -0.0827 -0.0488 -0.0488 0.3396 0.3396 0.5182 0.5182 0.5392 0.5392 0.5515 0.5515 0.5877 0.5877 0.6369 0.6369 8.5111 8.5111 9.4289 9.4289 9.6429 9.6429 9.6846 9.6846 10.7966 10.7966 k = 0.5000 0.5538 0.1302 ( 12076 PWs) bands (ev): -19.6506 -19.6506 -19.5907 -19.5907 -18.3623 -18.3623 -18.3589 -18.3589 -15.3299 -15.3299 -15.2805 -15.2805 -4.5064 -4.5064 -4.2061 -4.2061 -3.8059 -3.8059 -3.5120 -3.5120 -3.0622 -3.0622 -2.5924 -2.5924 -2.3802 -2.3802 -2.1907 -2.1907 -0.3322 -0.3322 -0.1375 -0.1375 -0.0856 -0.0856 -0.0526 -0.0526 0.3263 0.3263 0.5177 0.5177 0.5394 0.5394 0.5507 0.5507 0.5881 0.5881 0.6404 0.6404 8.4757 8.4757 9.4194 9.4194 9.5851 9.5851 9.6981 9.6981 10.8963 10.8963 k = 0.5000 0.5538 0.1116 ( 12072 PWs) bands (ev): -19.6515 -19.6515 -19.5898 -19.5898 -18.3617 -18.3617 -18.3590 -18.3590 -15.3299 -15.3299 -15.2817 -15.2817 -4.5046 -4.5046 -4.2084 -4.2084 -3.8091 -3.8091 -3.5035 -3.5035 -3.0745 -3.0745 -2.5764 -2.5764 -2.3703 -2.3703 -2.1896 -2.1896 -0.3487 -0.3487 -0.1301 -0.1301 -0.0885 -0.0885 -0.0548 -0.0548 0.3136 0.3136 0.5171 0.5171 0.5395 0.5395 0.5500 0.5500 0.5885 0.5885 0.6438 0.6438 8.4449 8.4449 9.4109 9.4109 9.5349 9.5349 9.7099 9.7099 10.9966 10.9966 k = 0.5000 0.5538 0.0930 ( 12070 PWs) bands (ev): -19.6523 -19.6523 -19.5890 -19.5890 -18.3613 -18.3613 -18.3591 -18.3591 -15.3298 -15.3298 -15.2828 -15.2828 -4.5030 -4.5030 -4.2105 -4.2105 -3.8117 -3.8117 -3.4960 -3.4960 -3.0854 -3.0854 -2.5630 -2.5630 -2.3609 -2.3609 -2.1886 -2.1886 -0.3633 -0.3633 -0.1240 -0.1240 -0.0909 -0.0909 -0.0557 -0.0557 0.3020 0.3020 0.5164 0.5164 0.5395 0.5395 0.5495 0.5495 0.5889 0.5889 0.6470 0.6470 8.4188 8.4188 9.4033 9.4033 9.4926 9.4926 9.7201 9.7201 11.0968 11.0968 k = 0.5000 0.5538 0.0744 ( 12066 PWs) bands (ev): -19.6529 -19.6529 -19.5883 -19.5883 -18.3609 -18.3609 -18.3592 -18.3592 -15.3298 -15.3298 -15.2836 -15.2836 -4.5015 -4.5015 -4.2123 -4.2123 -3.8139 -3.8139 -3.4897 -3.4897 -3.0946 -3.0946 -2.5523 -2.5523 -2.3524 -2.3524 -2.1878 -2.1878 -0.3758 -0.3758 -0.1194 -0.1194 -0.0926 -0.0926 -0.0557 -0.0557 0.2918 0.2918 0.5158 0.5158 0.5394 0.5394 0.5492 0.5492 0.5892 0.5892 0.6496 0.6496 8.3974 8.3974 9.3965 9.3965 9.4585 9.4585 9.7284 9.7284 11.1954 11.1954 k = 0.5000 0.5538 0.0558 ( 12066 PWs) bands (ev): -19.6534 -19.6534 -19.5878 -19.5878 -18.3607 -18.3607 -18.3592 -18.3592 -15.3298 -15.3298 -15.2843 -15.2843 -4.5003 -4.5003 -4.2139 -4.2139 -3.8155 -3.8155 -3.4846 -3.4846 -3.1020 -3.1020 -2.5440 -2.5440 -2.3453 -2.3453 -2.1872 -2.1872 -0.3857 -0.3857 -0.1165 -0.1165 -0.0935 -0.0935 -0.0550 -0.0550 0.2834 0.2834 0.5152 0.5152 0.5393 0.5393 0.5491 0.5491 0.5895 0.5895 0.6518 0.6518 8.3806 8.3806 9.3900 9.3900 9.4331 9.4331 9.7350 9.7350 11.2898 11.2898 k = 0.5000 0.5538 0.0372 ( 12036 PWs) bands (ev): -19.6537 -19.6537 -19.5874 -19.5874 -18.3604 -18.3604 -18.3593 -18.3593 -15.3298 -15.3298 -15.2848 -15.2848 -4.4995 -4.4995 -4.2150 -4.2150 -3.8166 -3.8166 -3.4809 -3.4809 -3.1074 -3.1074 -2.5382 -2.5382 -2.3400 -2.3400 -2.1868 -2.1868 -0.3930 -0.3930 -0.1151 -0.1151 -0.0935 -0.0935 -0.0542 -0.0542 0.2771 0.2771 0.5148 0.5148 0.5391 0.5391 0.5490 0.5490 0.5897 0.5897 0.6534 0.6534 8.3687 8.3687 9.3836 9.3836 9.4165 9.4165 9.7397 9.7397 11.3739 11.3739 k = 0.5000 0.5538 0.0186 ( 12026 PWs) bands (ev): -19.6540 -19.6540 -19.5872 -19.5872 -18.3603 -18.3603 -18.3593 -18.3593 -15.3298 -15.3298 -15.2851 -15.2851 -4.4989 -4.4989 -4.2157 -4.2157 -3.8173 -3.8173 -3.4787 -3.4787 -3.1106 -3.1106 -2.5347 -2.5347 -2.3366 -2.3366 -2.1866 -2.1866 -0.3975 -0.3975 -0.1146 -0.1146 -0.0933 -0.0933 -0.0535 -0.0535 0.2732 0.2732 0.5145 0.5145 0.5390 0.5390 0.5490 0.5490 0.5898 0.5898 0.6544 0.6544 8.3615 8.3615 9.3783 9.3783 9.4081 9.4081 9.7426 9.7426 11.4321 11.4321 k = 0.5000 0.5538-0.0000 ( 12030 PWs) bands (ev): -19.6540 -19.6540 -19.5871 -19.5871 -18.3603 -18.3603 -18.3593 -18.3593 -15.3297 -15.3297 -15.2852 -15.2852 -4.4987 -4.4987 -4.2159 -4.2159 -3.8176 -3.8176 -3.4779 -3.4779 -3.1118 -3.1118 -2.5336 -2.5336 -2.3355 -2.3355 -2.1865 -2.1865 -0.3990 -0.3990 -0.1144 -0.1144 -0.0932 -0.0932 -0.0533 -0.0533 0.2718 0.2718 0.5144 0.5144 0.5390 0.5390 0.5490 0.5490 0.5899 0.5899 0.6547 0.6547 8.3591 8.3591 9.3762 9.3762 9.4056 9.4056 9.7435 9.7435 11.4483 11.4483 k = 0.0000 0.0000 0.6736 ( 12060 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3816 -18.3816 -18.3578 -18.3578 -15.3318 -15.3318 -15.2323 -15.2323 -4.4359 -4.4359 -4.3203 -4.3203 -3.7280 -3.7280 -3.5708 -3.5708 -3.3724 -3.3724 -2.6195 -2.6195 -2.4996 -2.4996 -2.2300 -2.2300 -0.2904 -0.2904 -0.1510 -0.1510 0.1805 0.1805 0.3250 0.3250 0.3620 0.3620 0.4182 0.4182 0.4788 0.4788 0.5266 0.5266 0.6093 0.6093 0.8427 0.8427 8.8310 8.8310 9.1819 9.1819 9.7389 9.7389 9.8091 9.8091 10.7774 10.7774 k = 0.0119 0.0132 0.6736 ( 12056 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3815 -18.3815 -18.3578 -18.3578 -15.3317 -15.3317 -15.2325 -15.2325 -4.4353 -4.4353 -4.3202 -4.3202 -3.7285 -3.7285 -3.5711 -3.5711 -3.3710 -3.3710 -2.6198 -2.6198 -2.4999 -2.4999 -2.2321 -2.2321 -0.2894 -0.2894 -0.1504 -0.1504 0.1797 0.1797 0.3241 0.3241 0.3628 0.3628 0.4188 0.4188 0.4788 0.4788 0.5267 0.5267 0.6092 0.6092 0.8421 0.8421 8.8332 8.8332 9.1840 9.1840 9.7423 9.7423 9.8078 9.8078 10.7758 10.7758 k = 0.0238 0.0264 0.6736 ( 12044 PWs) bands (ev): -19.6270 -19.6270 -19.6144 -19.6144 -18.3814 -18.3814 -18.3579 -18.3579 -15.3313 -15.3313 -15.2329 -15.2329 -4.4335 -4.4335 -4.3200 -4.3200 -3.7297 -3.7297 -3.5720 -3.5720 -3.3666 -3.3666 -2.6206 -2.6206 -2.5009 -2.5009 -2.2384 -2.2384 -0.2862 -0.2862 -0.1484 -0.1484 0.1774 0.1774 0.3214 0.3214 0.3654 0.3654 0.4207 0.4207 0.4788 0.4788 0.5270 0.5270 0.6090 0.6090 0.8404 0.8404 8.8398 8.8398 9.1901 9.1901 9.7523 9.7523 9.8038 9.8038 10.7710 10.7710 k = 0.0357 0.0396 0.6736 ( 12034 PWs) bands (ev): -19.6269 -19.6269 -19.6145 -19.6145 -18.3812 -18.3812 -18.3581 -18.3581 -15.3306 -15.3306 -15.2336 -15.2336 -4.4306 -4.4306 -4.3196 -4.3196 -3.7316 -3.7316 -3.5734 -3.5734 -3.3594 -3.3594 -2.6219 -2.6219 -2.5025 -2.5025 -2.2487 -2.2487 -0.2811 -0.2811 -0.1450 -0.1450 0.1736 0.1736 0.3172 0.3172 0.3694 0.3694 0.4236 0.4236 0.4788 0.4788 0.5276 0.5276 0.6086 0.6086 0.8376 0.8376 8.8505 8.8505 9.2002 9.2002 9.7693 9.7693 9.7971 9.7971 10.7628 10.7628 k = 0.0476 0.0527 0.6736 ( 12036 PWs) bands (ev): -19.6268 -19.6268 -19.6146 -19.6146 -18.3810 -18.3810 -18.3584 -18.3584 -15.3297 -15.3297 -15.2346 -15.2346 -4.4266 -4.4266 -4.3190 -4.3190 -3.7340 -3.7340 -3.5754 -3.5754 -3.3495 -3.3495 -2.6237 -2.6237 -2.5046 -2.5046 -2.2629 -2.2629 -0.2741 -0.2741 -0.1404 -0.1404 0.1684 0.1684 0.3117 0.3117 0.3746 0.3746 0.4275 0.4275 0.4788 0.4788 0.5284 0.5284 0.6080 0.6080 0.8337 0.8337 8.8653 8.8653 9.2143 9.2143 9.7879 9.7879 9.7933 9.7933 10.7512 10.7512 k = 0.0595 0.0659 0.6736 ( 12040 PWs) bands (ev): -19.6266 -19.6266 -19.6148 -19.6148 -18.3807 -18.3807 -18.3587 -18.3587 -15.3285 -15.3285 -15.2359 -15.2359 -4.4216 -4.4216 -4.3183 -4.3183 -3.7368 -3.7368 -3.5781 -3.5781 -3.3371 -3.3371 -2.6262 -2.6262 -2.5074 -2.5074 -2.2807 -2.2807 -0.2654 -0.2654 -0.1345 -0.1345 0.1620 0.1620 0.3051 0.3051 0.3810 0.3810 0.4321 0.4321 0.4787 0.4787 0.5295 0.5295 0.6073 0.6073 0.8287 0.8287 8.8836 8.8836 9.2324 9.2324 9.7762 9.7762 9.8245 9.8245 10.7359 10.7359 k = 0.0714 0.0791 0.6736 ( 12042 PWs) bands (ev): -19.6264 -19.6264 -19.6150 -19.6150 -18.3803 -18.3803 -18.3590 -18.3590 -15.3271 -15.3271 -15.2374 -15.2374 -4.4157 -4.4157 -4.3174 -4.3174 -3.7396 -3.7396 -3.5814 -3.5814 -3.3223 -3.3223 -2.6291 -2.6291 -2.5106 -2.5106 -2.3017 -2.3017 -0.2551 -0.2551 -0.1274 -0.1274 0.1544 0.1544 0.2975 0.2975 0.3883 0.3883 0.4372 0.4372 0.4787 0.4787 0.5309 0.5309 0.6064 0.6064 0.8227 0.8227 8.9051 8.9051 9.2544 9.2544 9.7622 9.7622 9.8632 9.8632 10.7166 10.7166 k = 0.0833 0.0923 0.6736 ( 12034 PWs) bands (ev): -19.6262 -19.6262 -19.6152 -19.6152 -18.3799 -18.3799 -18.3594 -18.3594 -15.3254 -15.3254 -15.2392 -15.2392 -4.4090 -4.4090 -4.3165 -4.3165 -3.7424 -3.7424 -3.5852 -3.5852 -3.3054 -3.3054 -2.6328 -2.6328 -2.5143 -2.5143 -2.3255 -2.3255 -0.2435 -0.2435 -0.1190 -0.1190 0.1459 0.1459 0.2888 0.2888 0.3964 0.3964 0.4428 0.4428 0.4787 0.4787 0.5327 0.5327 0.6053 0.6053 0.8156 0.8156 8.9294 8.9294 9.2803 9.2803 9.7459 9.7459 9.9098 9.9098 10.6932 10.6932 k = 0.0952 0.1055 0.6736 ( 12028 PWs) bands (ev): -19.6260 -19.6260 -19.6154 -19.6154 -18.3794 -18.3794 -18.3599 -18.3599 -15.3235 -15.3235 -15.2413 -15.2413 -4.4016 -4.4016 -4.3155 -4.3155 -3.7448 -3.7448 -3.5898 -3.5898 -3.2865 -3.2865 -2.6371 -2.6371 -2.5185 -2.5185 -2.3516 -2.3516 -0.2306 -0.2306 -0.1095 -0.1095 0.1366 0.1366 0.2792 0.2792 0.4053 0.4053 0.4487 0.4487 0.4787 0.4787 0.5349 0.5349 0.6040 0.6040 0.8076 0.8076 8.9560 8.9560 9.3099 9.3099 9.7275 9.7275 9.9645 9.9645 10.6654 10.6654 k = 0.1071 0.1187 0.6736 ( 12032 PWs) bands (ev): -19.6257 -19.6257 -19.6157 -19.6157 -18.3788 -18.3788 -18.3605 -18.3605 -15.3213 -15.3213 -15.2436 -15.2436 -4.3938 -4.3938 -4.3144 -4.3144 -3.7467 -3.7467 -3.5950 -3.5950 -3.2658 -3.2658 -2.6423 -2.6423 -2.5229 -2.5229 -2.3794 -2.3794 -0.2169 -0.2169 -0.0989 -0.0989 0.1265 0.1265 0.2687 0.2687 0.4146 0.4146 0.4548 0.4548 0.4787 0.4787 0.5377 0.5377 0.6024 0.6024 0.7985 0.7985 8.9844 8.9844 9.3432 9.3432 9.7072 9.7072 10.0275 10.0275 10.6332 10.6332 k = 0.1190 0.1319 0.6736 ( 12034 PWs) bands (ev): -19.6254 -19.6254 -19.6160 -19.6160 -18.3782 -18.3782 -18.3611 -18.3611 -15.3190 -15.3190 -15.2461 -15.2461 -4.3856 -4.3856 -4.3134 -4.3134 -3.7480 -3.7480 -3.6008 -3.6008 -3.2433 -3.2433 -2.6487 -2.6487 -2.5276 -2.5276 -2.4082 -2.4082 -0.2024 -0.2024 -0.0872 -0.0872 0.1158 0.1158 0.2574 0.2574 0.4241 0.4241 0.4612 0.4612 0.4787 0.4787 0.5409 0.5409 0.6007 0.6007 0.7886 0.7886 9.0141 9.0141 9.3801 9.3801 9.6850 9.6850 10.0989 10.0989 10.5964 10.5964 k = 0.1310 0.1450 0.6736 ( 12034 PWs) bands (ev): -19.6251 -19.6251 -19.6163 -19.6163 -18.3776 -18.3776 -18.3617 -18.3617 -15.3164 -15.3164 -15.2488 -15.2488 -4.3772 -4.3772 -4.3123 -4.3123 -3.7484 -3.7484 -3.6073 -3.6073 -3.2192 -3.2192 -2.6567 -2.6567 -2.5325 -2.5325 -2.4372 -2.4372 -0.1872 -0.1872 -0.0745 -0.0745 0.1045 0.1045 0.2451 0.2451 0.4334 0.4334 0.4681 0.4681 0.4787 0.4787 0.5449 0.5449 0.5987 0.5987 0.7778 0.7778 9.0450 9.0450 9.4204 9.4204 9.6613 9.6613 10.1789 10.1789 10.5553 10.5553 k = 0.1429 0.1582 0.6736 ( 12028 PWs) bands (ev): -19.6247 -19.6247 -19.6167 -19.6167 -18.3769 -18.3769 -18.3624 -18.3624 -15.3137 -15.3137 -15.2517 -15.2517 -4.3689 -4.3689 -4.3113 -4.3113 -3.7478 -3.7478 -3.6144 -3.6144 -3.1935 -3.1935 -2.6669 -2.6669 -2.5374 -2.5374 -2.4653 -2.4653 -0.1717 -0.1717 -0.0610 -0.0610 0.0928 0.0928 0.2321 0.2321 0.4420 0.4420 0.4753 0.4753 0.4790 0.4790 0.5495 0.5495 0.5964 0.5964 0.7663 0.7663 9.0765 9.0765 9.4640 9.4640 9.6360 9.6360 10.2669 10.2669 10.5103 10.5103 k = 0.1548 0.1714 0.6736 ( 12032 PWs) bands (ev): -19.6243 -19.6243 -19.6171 -19.6171 -18.3761 -18.3761 -18.3632 -18.3632 -15.3107 -15.3107 -15.2547 -15.2547 -4.3607 -4.3607 -4.3105 -4.3105 -3.7462 -3.7462 -3.6222 -3.6222 -3.1665 -3.1665 -2.6802 -2.6802 -2.5424 -2.5424 -2.4912 -2.4912 -0.1560 -0.1560 -0.0466 -0.0466 0.0806 0.0806 0.2183 0.2183 0.4495 0.4495 0.4780 0.4780 0.4847 0.4847 0.5549 0.5549 0.5940 0.5940 0.7540 0.7540 9.1085 9.1085 9.5107 9.5107 9.6095 9.6095 10.3605 10.3605 10.4641 10.4641 k = 0.1667 0.1846 0.6736 ( 12038 PWs) bands (ev): -19.6240 -19.6240 -19.6174 -19.6174 -18.3753 -18.3753 -18.3639 -18.3639 -15.3077 -15.3077 -15.2579 -15.2579 -4.3529 -4.3529 -4.3098 -4.3098 -3.7435 -3.7435 -3.6305 -3.6305 -3.1380 -3.1380 -2.6973 -2.6973 -2.5473 -2.5473 -2.5139 -2.5139 -0.1400 -0.1400 -0.0315 -0.0315 0.0680 0.0680 0.2039 0.2039 0.4556 0.4556 0.4781 0.4781 0.4939 0.4939 0.5610 0.5610 0.5914 0.5914 0.7410 0.7410 9.1408 9.1408 9.5604 9.5604 9.5819 9.5819 10.3960 10.3960 10.4808 10.4808 k = 0.1786 0.1978 0.6736 ( 12050 PWs) bands (ev): -19.6235 -19.6235 -19.6179 -19.6179 -18.3745 -18.3745 -18.3647 -18.3647 -15.3044 -15.3044 -15.2613 -15.2613 -4.3455 -4.3455 -4.3094 -4.3094 -3.7397 -3.7397 -3.6393 -3.6393 -3.1083 -3.1083 -2.7188 -2.7188 -2.5519 -2.5519 -2.5323 -2.5323 -0.1241 -0.1241 -0.0158 -0.0158 0.0551 0.0551 0.1887 0.1887 0.4605 0.4605 0.4779 0.4779 0.5039 0.5039 0.5677 0.5677 0.5890 0.5890 0.7275 0.7275 9.1733 9.1733 9.5532 9.5532 9.6128 9.6128 10.3447 10.3447 10.5888 10.5888 k = 0.1905 0.2110 0.6736 ( 12042 PWs) bands (ev): -19.6231 -19.6231 -19.6183 -19.6183 -18.3737 -18.3737 -18.3656 -18.3656 -15.3011 -15.3011 -15.2648 -15.2648 -4.3387 -4.3387 -4.3093 -4.3093 -3.7348 -3.7348 -3.6485 -3.6485 -3.0774 -3.0774 -2.7446 -2.7446 -2.5563 -2.5563 -2.5462 -2.5462 -0.1082 -0.1082 0.0002 0.0002 0.0422 0.0422 0.1731 0.1731 0.4643 0.4643 0.4776 0.4776 0.5140 0.5140 0.5735 0.5735 0.5882 0.5882 0.7136 0.7136 9.2059 9.2059 9.5237 9.5237 9.6678 9.6678 10.2865 10.2865 10.7084 10.7084 k = 0.2024 0.2241 0.6736 ( 12050 PWs) bands (ev): -19.6227 -19.6227 -19.6187 -19.6187 -18.3728 -18.3728 -18.3665 -18.3665 -15.2976 -15.2976 -15.2683 -15.2683 -4.3326 -4.3326 -4.3095 -4.3095 -3.7288 -3.7288 -3.6581 -3.6581 -3.0454 -3.0454 -2.7740 -2.7740 -2.5602 -2.5602 -2.5562 -2.5562 -0.0924 -0.0924 0.0147 0.0147 0.0308 0.0308 0.1569 0.1569 0.4672 0.4672 0.4773 0.4773 0.5238 0.5238 0.5748 0.5748 0.5928 0.5928 0.6992 0.6992 9.2384 9.2384 9.4935 9.4935 9.7251 9.7251 10.2255 10.2255 10.8345 10.8345 k = 0.2143 0.2373 0.6736 ( 12042 PWs) bands (ev): -19.6223 -19.6223 -19.6191 -19.6191 -18.3719 -18.3719 -18.3673 -18.3673 -15.2941 -15.2941 -15.2719 -15.2719 -4.3272 -4.3272 -4.3102 -4.3102 -3.7219 -3.7219 -3.6678 -3.6678 -3.0124 -3.0124 -2.8060 -2.8060 -2.5636 -2.5636 -2.5628 -2.5628 -0.0767 -0.0767 0.0116 0.0116 0.0371 0.0371 0.1402 0.1402 0.4696 0.4696 0.4769 0.4769 0.5329 0.5329 0.5719 0.5719 0.6022 0.6022 0.6846 0.6846 9.2710 9.2710 9.4627 9.4627 9.7844 9.7844 10.1628 10.1628 10.9637 10.9637 k = 0.2262 0.2505 0.6736 ( 12050 PWs) bands (ev): -19.6218 -19.6218 -19.6196 -19.6196 -18.3710 -18.3710 -18.3682 -18.3682 -15.2904 -15.2904 -15.2756 -15.2756 -4.3225 -4.3225 -4.3114 -4.3114 -3.7140 -3.7140 -3.6777 -3.6777 -2.9786 -2.9786 -2.8397 -2.8397 -2.5668 -2.5668 -2.5664 -2.5664 -0.0613 -0.0613 -0.0016 -0.0016 0.0535 0.0535 0.1232 0.1232 0.4714 0.4714 0.4763 0.4763 0.5413 0.5413 0.5676 0.5676 0.6139 0.6139 0.6700 0.6700 9.3034 9.3034 9.4315 9.4315 9.8454 9.8454 10.0992 10.0992 11.0849 11.0849 k = 0.2381 0.2637 0.6736 ( 12042 PWs) bands (ev): -19.6214 -19.6214 -19.6200 -19.6200 -18.3701 -18.3701 -18.3692 -18.3692 -15.2868 -15.2868 -15.2793 -15.2793 -4.3186 -4.3186 -4.3132 -4.3132 -3.7055 -3.7055 -3.6874 -3.6874 -2.9441 -2.9441 -2.8743 -2.8743 -2.5687 -2.5687 -2.5683 -2.5683 -0.0460 -0.0460 -0.0159 -0.0159 0.0707 0.0707 0.1060 0.1060 0.4729 0.4729 0.4755 0.4755 0.5488 0.5488 0.5623 0.5623 0.6268 0.6268 0.6554 0.6554 9.3358 9.3358 9.3998 9.3998 9.9078 9.9078 10.0351 10.0351 11.1618 11.1618 k = 0.2500 0.2769 0.6736 ( 12048 PWs) bands (ev): -19.6211 -19.6211 -19.6203 -19.6203 -18.3701 -18.3701 -18.3692 -18.3692 -15.2831 -15.2831 -15.2830 -15.2830 -4.3156 -4.3156 -4.3155 -4.3155 -3.6969 -3.6969 -3.6964 -3.6964 -2.9093 -2.9093 -2.9092 -2.9092 -2.5692 -2.5692 -2.5691 -2.5691 -0.0311 -0.0311 -0.0306 -0.0306 0.0880 0.0880 0.0888 0.0888 0.4741 0.4741 0.4746 0.4746 0.5555 0.5555 0.5563 0.5563 0.6405 0.6405 0.6412 0.6412 9.3679 9.3679 9.3680 9.3680 9.9712 9.9712 9.9713 9.9713 11.1814 11.1814 Writing output data file CsHF2.save init_run : 0.56s CPU 0.88s WALL ( 1 calls) electrons : 358.21s CPU 362.16s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.08s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 358.20s CPU 362.14s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.18s CPU 0.19s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.14s CPU 0.21s WALL ( 291 calls) cegterg : 331.21s CPU 333.79s WALL ( 513 calls) Called by sum_band: Called by *egterg: h_psi : 214.74s CPU 216.64s WALL ( 8390 calls) s_psi : 7.96s CPU 7.93s WALL ( 8390 calls) g_psi : 0.71s CPU 0.72s WALL ( 7586 calls) cdiaghg : 74.88s CPU 76.04s WALL ( 7877 calls) cegterg:over : 17.86s CPU 17.84s WALL ( 7586 calls) cegterg:upda : 19.51s CPU 19.50s WALL ( 7586 calls) cegterg:last : 7.93s CPU 7.92s WALL ( 1123 calls) cdiaghg:chol : 4.36s CPU 4.41s WALL ( 7877 calls) cdiaghg:inve : 3.12s CPU 3.09s WALL ( 7877 calls) cdiaghg:para : 4.92s CPU 5.02s WALL ( 15754 calls) Called by h_psi: h_psi:vloc : 185.52s CPU 187.11s WALL ( 8390 calls) h_psi:vnl : 28.48s CPU 28.80s WALL ( 8390 calls) add_vuspsi : 16.13s CPU 16.28s WALL ( 8390 calls) General routines calbec : 12.32s CPU 12.49s WALL ( 8390 calls) fft : 0.00s CPU 0.01s WALL ( 15 calls) fftw : 175.98s CPU 177.78s WALL ( 836532 calls) davcio : 0.33s CPU 0.48s WALL ( 582 calls) Parallel routines fft_scatter : 56.60s CPU 57.54s WALL ( 836547 calls) PWSCF : 6m29.22s CPU 6m57.75s WALL This run was terminated on: 17:42:27 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=