Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16: 8:27 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: ./Sr2BrN.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 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 73 45 13 1772 865 137 Max 74 46 14 1773 881 140 Sum 2643 1651 481 63823 31435 4971 bravais-lattice index = 14 lattice parameter (alat) = 14.4095 a.u. unit-cell volume = 657.8610 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 32.00 number of Kohn-Sham states= 40 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 321.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.409490 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.867020 celldm(5)= 0.867020 celldm(6)= 0.867020 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.867020 0.498273 0.000000 ) a(3) = ( 0.867020 0.231392 0.441287 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.740050 -1.052348 ) b(2) = ( 0.000000 2.006932 -1.052348 ) b(3) = ( 0.000000 0.000000 2.266100 ) PseudoPot. # 1 for Br read from file: /users/gautes/Pseudo/Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 5d639767687de88634f0d235e6526498 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 1213 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Sr read from file: /users/gautes/Pseudo/Sr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 971034ad0a3914f6282d12395b0824f8 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1221 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Br 7.00 79.90400 Br( 1.00) Sr 10.00 87.62000 Sr( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 307 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 2) = ( 0.0106383 -0.0185112 -0.0111952), wk = 0.0032573 k( 3) = ( 0.0212766 -0.0370224 -0.0223904), wk = 0.0032573 k( 4) = ( 0.0319149 -0.0555335 -0.0335856), wk = 0.0032573 k( 5) = ( 0.0425532 -0.0740447 -0.0447808), wk = 0.0032573 k( 6) = ( 0.0531915 -0.0925559 -0.0559760), wk = 0.0032573 k( 7) = ( 0.0638298 -0.1110670 -0.0671711), wk = 0.0032573 k( 8) = ( 0.0744681 -0.1295782 -0.0783663), wk = 0.0032573 k( 9) = ( 0.0851064 -0.1480894 -0.0895615), wk = 0.0032573 k( 10) = ( 0.0957447 -0.1666005 -0.1007567), wk = 0.0032573 k( 11) = ( 0.1063830 -0.1851117 -0.1119519), wk = 0.0032573 k( 12) = ( 0.1170213 -0.2036229 -0.1231471), wk = 0.0032573 k( 13) = ( 0.1276596 -0.2221341 -0.1343423), wk = 0.0032573 k( 14) = ( 0.1382979 -0.2406452 -0.1455375), wk = 0.0032573 k( 15) = ( 0.1489362 -0.2591564 -0.1567327), wk = 0.0032573 k( 16) = ( 0.1595745 -0.2776676 -0.1679279), wk = 0.0032573 k( 17) = ( 0.1702128 -0.2961788 -0.1791230), wk = 0.0032573 k( 18) = ( 0.1808511 -0.3146899 -0.1903182), wk = 0.0032573 k( 19) = ( 0.1914894 -0.3332011 -0.2015134), wk = 0.0032573 k( 20) = ( 0.2021277 -0.3517123 -0.2127086), wk = 0.0032573 k( 21) = ( 0.2127660 -0.3702235 -0.2239038), wk = 0.0032573 k( 22) = ( 0.2234043 -0.3887346 -0.2350990), wk = 0.0032573 k( 23) = ( 0.2340425 -0.4072458 -0.2462942), wk = 0.0032573 k( 24) = ( 0.2446809 -0.4257570 -0.2574894), wk = 0.0032573 k( 25) = ( 0.2553191 -0.4442681 -0.2686846), wk = 0.0032573 k( 26) = ( 0.2659574 -0.4627793 -0.2798798), wk = 0.0032573 k( 27) = ( 0.2765957 -0.4812905 -0.2910749), wk = 0.0032573 k( 28) = ( 0.2872340 -0.4998016 -0.3022701), wk = 0.0032573 k( 29) = ( 0.2978723 -0.5183128 -0.3134653), wk = 0.0032573 k( 30) = ( 0.3085106 -0.5368240 -0.3246605), wk = 0.0032573 k( 31) = ( 0.3191489 -0.5553352 -0.3358557), wk = 0.0032573 k( 32) = ( 0.3297872 -0.5738463 -0.3470509), wk = 0.0032573 k( 33) = ( 0.3404255 -0.5923575 -0.3582461), wk = 0.0032573 k( 34) = ( 0.3510638 -0.6108687 -0.3694413), wk = 0.0032573 k( 35) = ( 0.3617021 -0.6293799 -0.3806365), wk = 0.0032573 k( 36) = ( 0.3723404 -0.6478910 -0.3918317), wk = 0.0032573 k( 37) = ( 0.3829787 -0.6664022 -0.4030268), wk = 0.0032573 k( 38) = ( 0.3936170 -0.6849134 -0.4142220), wk = 0.0032573 k( 39) = ( 0.4042553 -0.7034246 -0.4254172), wk = 0.0032573 k( 40) = ( 0.4148936 -0.7219357 -0.4366124), wk = 0.0032573 k( 41) = ( 0.4255319 -0.7404469 -0.4478076), wk = 0.0032573 k( 42) = ( 0.4361702 -0.7589581 -0.4590028), wk = 0.0032573 k( 43) = ( 0.4468085 -0.7774692 -0.4701980), wk = 0.0032573 k( 44) = ( 0.4574468 -0.7959804 -0.4813932), wk = 0.0032573 k( 45) = ( 0.4680851 -0.8144916 -0.4925884), wk = 0.0032573 k( 46) = ( 0.4787234 -0.8330027 -0.5037835), wk = 0.0032573 k( 47) = ( 0.4893617 -0.8515139 -0.5149787), wk = 0.0032573 k( 48) = ( 0.5000000 -0.8700251 -0.5261739), wk = 0.0032573 k( 49) = ( 0.5000000 -0.8700251 -0.5261739), wk = 0.0032573 k( 50) = ( 0.5000000 -0.8577909 -0.5464031), wk = 0.0032573 k( 51) = ( 0.5000000 -0.8455567 -0.5666323), wk = 0.0032573 k( 52) = ( 0.5000000 -0.8333224 -0.5868615), wk = 0.0032573 k( 53) = ( 0.5000000 -0.8210882 -0.6070908), wk = 0.0032573 k( 54) = ( 0.5000000 -0.8088540 -0.6273200), wk = 0.0032573 k( 55) = ( 0.5000000 -0.7966197 -0.6475492), wk = 0.0032573 k( 56) = ( 0.5000000 -0.7843855 -0.6677784), wk = 0.0032573 k( 57) = ( 0.5000000 -0.7721513 -0.6880076), wk = 0.0032573 k( 58) = ( 0.5000000 -0.7599171 -0.7082368), wk = 0.0032573 k( 59) = ( 0.5000000 -0.7476829 -0.7284660), wk = 0.0032573 k( 60) = ( 0.5000000 -0.7354486 -0.7486952), wk = 0.0032573 k( 61) = ( 0.5000000 -0.7232144 -0.7689244), wk = 0.0032573 k( 62) = ( 0.5000000 -0.7109802 -0.7891536), wk = 0.0032573 k( 63) = ( 0.5000000 -0.6987460 -0.8093828), wk = 0.0032573 k( 64) = ( 0.5000000 -0.6865118 -0.8296120), wk = 0.0032573 k( 65) = ( 0.5000000 -0.6742775 -0.8498413), wk = 0.0032573 k( 66) = ( 0.5000000 -0.6620433 -0.8700705), wk = 0.0032573 k( 67) = ( 0.5000000 -0.6498091 -0.8902997), wk = 0.0032573 k( 68) = ( 0.5000000 -0.6375748 -0.9105289), wk = 0.0032573 k( 69) = ( 0.5000000 -0.6253406 -0.9307581), wk = 0.0032573 k( 70) = ( 0.5000000 -0.6131064 -0.9509873), wk = 0.0032573 k( 71) = ( 0.5000000 -0.6008722 -0.9712165), wk = 0.0032573 k( 72) = ( 0.5000000 -0.5886379 -0.9914457), wk = 0.0032573 k( 73) = ( 0.5000000 -0.5764037 -1.0116749), wk = 0.0032573 k( 74) = ( 0.5000000 -0.5641695 -1.0319041), wk = 0.0032573 k( 75) = ( 0.5000000 -0.5519353 -1.0521333), wk = 0.0032573 k( 76) = ( 0.5000000 -0.5397011 -1.0723625), wk = 0.0032573 k( 77) = ( 0.5000000 -0.5274668 -1.0925918), wk = 0.0032573 k( 78) = ( 0.5000000 -0.5152326 -1.1128209), wk = 0.0032573 k( 79) = ( 0.5000000 -0.5029984 -1.1330502), wk = 0.0032573 k( 80) = ( 0.8171205 -0.4183648 -0.9716455), wk = 0.0032573 k( 81) = ( 0.8109024 -0.4075451 -0.9510113), wk = 0.0032573 k( 82) = ( 0.8046844 -0.3967254 -0.9303770), wk = 0.0032573 k( 83) = ( 0.7984663 -0.3859057 -0.9097427), wk = 0.0032573 k( 84) = ( 0.7922483 -0.3750859 -0.8891085), wk = 0.0032573 k( 85) = ( 0.7860302 -0.3642662 -0.8684742), wk = 0.0032573 k( 86) = ( 0.7798122 -0.3534465 -0.8478399), wk = 0.0032573 k( 87) = ( 0.7735941 -0.3426268 -0.8272056), wk = 0.0032573 k( 88) = ( 0.7673761 -0.3318071 -0.8065714), wk = 0.0032573 k( 89) = ( 0.7611580 -0.3209874 -0.7859371), wk = 0.0032573 k( 90) = ( 0.7549400 -0.3101676 -0.7653028), wk = 0.0032573 k( 91) = ( 0.7487219 -0.2993479 -0.7446686), wk = 0.0032573 k( 92) = ( 0.7425039 -0.2885282 -0.7240343), wk = 0.0032573 k( 93) = ( 0.7362858 -0.2777085 -0.7034000), wk = 0.0032573 k( 94) = ( 0.7300678 -0.2668888 -0.6827657), wk = 0.0032573 k( 95) = ( 0.7238497 -0.2560691 -0.6621315), wk = 0.0032573 k( 96) = ( 0.7176317 -0.2452494 -0.6414972), wk = 0.0032573 k( 97) = ( 0.7114137 -0.2344296 -0.6208629), wk = 0.0032573 k( 98) = ( 0.7051956 -0.2236099 -0.6002287), wk = 0.0032573 k( 99) = ( 0.6989775 -0.2127902 -0.5795944), wk = 0.0032573 k( 100) = ( 0.6927595 -0.2019705 -0.5589601), wk = 0.0032573 k( 101) = ( 0.6865414 -0.1911508 -0.5383258), wk = 0.0032573 k( 102) = ( 0.6803234 -0.1803311 -0.5176916), wk = 0.0032573 k( 103) = ( 0.6741054 -0.1695113 -0.4970573), wk = 0.0032573 k( 104) = ( 0.6678873 -0.1586916 -0.4764230), wk = 0.0032573 k( 105) = ( 0.6616693 -0.1478719 -0.4557888), wk = 0.0032573 k( 106) = ( 0.6554512 -0.1370522 -0.4351545), wk = 0.0032573 k( 107) = ( 0.6492332 -0.1262325 -0.4145202), wk = 0.0032573 k( 108) = ( 0.6430151 -0.1154128 -0.3938860), wk = 0.0032573 k( 109) = ( 0.6367971 -0.1045930 -0.3732517), wk = 0.0032573 k( 110) = ( 0.6305790 -0.0937733 -0.3526174), wk = 0.0032573 k( 111) = ( 0.6243610 -0.0829536 -0.3319831), wk = 0.0032573 k( 112) = ( 0.6181429 -0.0721339 -0.3113489), wk = 0.0032573 k( 113) = ( 0.6119249 -0.0613142 -0.2907146), wk = 0.0032573 k( 114) = ( 0.6057068 -0.0504944 -0.2700803), wk = 0.0032573 k( 115) = ( 0.5994888 -0.0396747 -0.2494461), wk = 0.0032573 k( 116) = ( 0.5932707 -0.0288550 -0.2288118), wk = 0.0032573 k( 117) = ( 0.5870527 -0.0180353 -0.2081775), wk = 0.0032573 k( 118) = ( 0.5808346 -0.0072156 -0.1875432), wk = 0.0032573 k( 119) = ( 0.5746166 0.0036041 -0.1669089), wk = 0.0032573 k( 120) = ( 0.5683985 0.0144239 -0.1462747), wk = 0.0032573 k( 121) = ( 0.5621805 0.0252436 -0.1256404), wk = 0.0032573 k( 122) = ( 0.5559624 0.0360633 -0.1050061), wk = 0.0032573 k( 123) = ( 0.5497444 0.0468830 -0.0843719), wk = 0.0032573 k( 124) = ( 0.5435263 0.0577027 -0.0637376), wk = 0.0032573 k( 125) = ( 0.5373083 0.0685224 -0.0431033), wk = 0.0032573 k( 126) = ( 0.5310902 0.0793422 -0.0224690), wk = 0.0032573 k( 127) = ( 0.5248722 0.0901619 -0.0018348), wk = 0.0032573 k( 128) = ( 0.5186542 0.1009816 0.0187995), wk = 0.0032573 k( 129) = ( 0.5124361 0.1118013 0.0394338), wk = 0.0032573 k( 130) = ( 0.5062180 0.1226210 0.0600680), wk = 0.0032573 k( 131) = ( 0.5000000 0.1334407 0.0807023), wk = 0.0032573 k( 132) = ( 0.5000000 0.1334407 0.0807023), wk = 0.0032573 k( 133) = ( 0.4772727 0.1273752 0.0770340), wk = 0.0032573 k( 134) = ( 0.4545455 0.1213098 0.0733657), wk = 0.0032573 k( 135) = ( 0.4318182 0.1152443 0.0696974), wk = 0.0032573 k( 136) = ( 0.4090909 0.1091788 0.0660292), wk = 0.0032573 k( 137) = ( 0.3863636 0.1031133 0.0623609), wk = 0.0032573 k( 138) = ( 0.3636364 0.0970478 0.0586926), wk = 0.0032573 k( 139) = ( 0.3409091 0.0909823 0.0550243), wk = 0.0032573 k( 140) = ( 0.3181818 0.0849168 0.0513560), wk = 0.0032573 k( 141) = ( 0.2954545 0.0788513 0.0476877), wk = 0.0032573 k( 142) = ( 0.2727273 0.0727859 0.0440194), wk = 0.0032573 k( 143) = ( 0.2500000 0.0667204 0.0403512), wk = 0.0032573 k( 144) = ( 0.2272727 0.0606549 0.0366829), wk = 0.0032573 k( 145) = ( 0.2045454 0.0545894 0.0330146), wk = 0.0032573 k( 146) = ( 0.1818182 0.0485239 0.0293463), wk = 0.0032573 k( 147) = ( 0.1590909 0.0424584 0.0256780), wk = 0.0032573 k( 148) = ( 0.1363636 0.0363929 0.0220097), wk = 0.0032573 k( 149) = ( 0.1136364 0.0303274 0.0183414), wk = 0.0032573 k( 150) = ( 0.0909091 0.0242620 0.0146731), wk = 0.0032573 k( 151) = ( 0.0681818 0.0181965 0.0110049), wk = 0.0032573 k( 152) = ( 0.0454546 0.0121310 0.0073366), wk = 0.0032573 k( 153) = ( 0.0227273 0.0060655 0.0036683), wk = 0.0032573 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 156) = ( 0.0062080 -0.0108022 -0.0206009), wk = 0.0032573 k( 157) = ( 0.0124160 -0.0216044 -0.0412018), wk = 0.0032573 k( 158) = ( 0.0186240 -0.0324067 -0.0618027), wk = 0.0032573 k( 159) = ( 0.0248320 -0.0432089 -0.0824036), wk = 0.0032573 k( 160) = ( 0.0310400 -0.0540111 -0.1030046), wk = 0.0032573 k( 161) = ( 0.0372480 -0.0648133 -0.1236055), wk = 0.0032573 k( 162) = ( 0.0434560 -0.0756156 -0.1442064), wk = 0.0032573 k( 163) = ( 0.0496640 -0.0864178 -0.1648073), wk = 0.0032573 k( 164) = ( 0.0558720 -0.0972200 -0.1854082), wk = 0.0032573 k( 165) = ( 0.0620800 -0.1080222 -0.2060091), wk = 0.0032573 k( 166) = ( 0.0682880 -0.1188245 -0.2266100), wk = 0.0032573 k( 167) = ( 0.0744960 -0.1296267 -0.2472110), wk = 0.0032573 k( 168) = ( 0.0807039 -0.1404289 -0.2678118), wk = 0.0032573 k( 169) = ( 0.0869119 -0.1512311 -0.2884128), wk = 0.0032573 k( 170) = ( 0.0931199 -0.1620334 -0.3090137), wk = 0.0032573 k( 171) = ( 0.0993279 -0.1728356 -0.3296146), wk = 0.0032573 k( 172) = ( 0.1055359 -0.1836378 -0.3502155), wk = 0.0032573 k( 173) = ( 0.1117439 -0.1944400 -0.3708164), wk = 0.0032573 k( 174) = ( 0.1179519 -0.2052423 -0.3914173), wk = 0.0032573 k( 175) = ( 0.1241599 -0.2160445 -0.4120182), wk = 0.0032573 k( 176) = ( 0.1303679 -0.2268467 -0.4326192), wk = 0.0032573 k( 177) = ( 0.1365759 -0.2376489 -0.4532201), wk = 0.0032573 k( 178) = ( 0.1427839 -0.2484512 -0.4738210), wk = 0.0032573 k( 179) = ( 0.1489919 -0.2592534 -0.4944219), wk = 0.0032573 k( 180) = ( 0.1551999 -0.2700556 -0.5150228), wk = 0.0032573 k( 181) = ( 0.1614079 -0.2808578 -0.5356237), wk = 0.0032573 k( 182) = ( 0.1676159 -0.2916600 -0.5562246), wk = 0.0032573 k( 183) = ( 0.1738239 -0.3024623 -0.5768255), wk = 0.0032573 k( 184) = ( 0.1800319 -0.3132645 -0.5974265), wk = 0.0032573 k( 185) = ( 0.1862399 -0.3240667 -0.6180274), wk = 0.0032573 k( 186) = ( 0.1924479 -0.3348690 -0.6386283), wk = 0.0032573 k( 187) = ( 0.1986559 -0.3456712 -0.6592292), wk = 0.0032573 k( 188) = ( 0.2048639 -0.3564734 -0.6798301), wk = 0.0032573 k( 189) = ( 0.2110719 -0.3672756 -0.7004310), wk = 0.0032573 k( 190) = ( 0.2172798 -0.3780778 -0.7210319), wk = 0.0032573 k( 191) = ( 0.2234878 -0.3888801 -0.7416329), wk = 0.0032573 k( 192) = ( 0.2296958 -0.3996823 -0.7622337), wk = 0.0032573 k( 193) = ( 0.2359038 -0.4104845 -0.7828347), wk = 0.0032573 k( 194) = ( 0.2421118 -0.4212867 -0.8034356), wk = 0.0032573 k( 195) = ( 0.2483198 -0.4320890 -0.8240365), wk = 0.0032573 k( 196) = ( 0.2545278 -0.4428912 -0.8446374), wk = 0.0032573 k( 197) = ( 0.2607358 -0.4536934 -0.8652383), wk = 0.0032573 k( 198) = ( 0.2669438 -0.4644956 -0.8858392), wk = 0.0032573 k( 199) = ( 0.2731518 -0.4752979 -0.9064401), wk = 0.0032573 k( 200) = ( 0.2793598 -0.4861001 -0.9270411), wk = 0.0032573 k( 201) = ( 0.2855678 -0.4969023 -0.9476419), wk = 0.0032573 k( 202) = ( 0.2917758 -0.5077045 -0.9682429), wk = 0.0032573 k( 203) = ( 0.2979838 -0.5185068 -0.9888438), wk = 0.0032573 k( 204) = ( 0.3041918 -0.5293090 -1.0094447), wk = 0.0032573 k( 205) = ( 0.3103998 -0.5401112 -1.0300456), wk = 0.0032573 k( 206) = ( 0.3166078 -0.5509134 -1.0506465), wk = 0.0032573 k( 207) = ( 0.3228158 -0.5617157 -1.0712474), wk = 0.0032573 k( 208) = ( 0.3290238 -0.5725179 -1.0918483), wk = 0.0032573 k( 209) = ( 0.3352318 -0.5833201 -1.1124493), wk = 0.0032573 k( 210) = ( 0.3414398 -0.5941223 -1.1330502), wk = 0.0032573 k( 211) = ( 0.6585602 -0.4606816 -1.0523479), wk = 0.0032573 k( 212) = ( 0.6524618 -0.4378308 -1.0523479), wk = 0.0032573 k( 213) = ( 0.6463633 -0.4149799 -1.0523479), wk = 0.0032573 k( 214) = ( 0.6402648 -0.3921290 -1.0523479), wk = 0.0032573 k( 215) = ( 0.6341663 -0.3692781 -1.0523479), wk = 0.0032573 k( 216) = ( 0.6280679 -0.3464273 -1.0523479), wk = 0.0032573 k( 217) = ( 0.6219694 -0.3235764 -1.0523479), wk = 0.0032573 k( 218) = ( 0.6158709 -0.3007256 -1.0523479), wk = 0.0032573 k( 219) = ( 0.6097725 -0.2778747 -1.0523479), wk = 0.0032573 k( 220) = ( 0.6036740 -0.2550239 -1.0523479), wk = 0.0032573 k( 221) = ( 0.5975755 -0.2321730 -1.0523479), wk = 0.0032573 k( 222) = ( 0.5914771 -0.2093222 -1.0523479), wk = 0.0032573 k( 223) = ( 0.5853786 -0.1864713 -1.0523479), wk = 0.0032573 k( 224) = ( 0.5792801 -0.1636204 -1.0523479), wk = 0.0032573 k( 225) = ( 0.5731816 -0.1407696 -1.0523479), wk = 0.0032573 k( 226) = ( 0.5670832 -0.1179187 -1.0523479), wk = 0.0032573 k( 227) = ( 0.5609847 -0.0950679 -1.0523479), wk = 0.0032573 k( 228) = ( 0.5548862 -0.0722170 -1.0523479), wk = 0.0032573 k( 229) = ( 0.5487878 -0.0493661 -1.0523479), wk = 0.0032573 k( 230) = ( 0.5426893 -0.0265153 -1.0523479), wk = 0.0032573 k( 231) = ( 0.5365908 -0.0036644 -1.0523479), wk = 0.0032573 k( 232) = ( 0.5304923 0.0191864 -1.0523479), wk = 0.0032573 k( 233) = ( 0.5243939 0.0420373 -1.0523479), wk = 0.0032573 k( 234) = ( 0.5182954 0.0648882 -1.0523479), wk = 0.0032573 k( 235) = ( 0.5121969 0.0877390 -1.0523479), wk = 0.0032573 k( 236) = ( 0.5060985 0.1105899 -1.0523479), wk = 0.0032573 k( 237) = ( 0.5000000 0.1334407 -1.0523479), wk = 0.0032573 k( 238) = ( 0.5000000 0.1334407 -1.0523479), wk = 0.0032573 k( 239) = ( 0.5198200 0.1387303 -1.0422601), wk = 0.0032573 k( 240) = ( 0.5396401 0.1440199 -1.0321723), wk = 0.0032573 k( 241) = ( 0.5594601 0.1493095 -1.0220845), wk = 0.0032573 k( 242) = ( 0.5792801 0.1545991 -1.0119967), wk = 0.0032573 k( 243) = ( 0.5991002 0.1598887 -1.0019089), wk = 0.0032573 k( 244) = ( 0.6189202 0.1651783 -0.9918211), wk = 0.0032573 k( 245) = ( 0.6387402 0.1704679 -0.9817333), wk = 0.0032573 k( 246) = ( 0.6585602 0.1757575 -0.9716456), wk = 0.0032573 k( 247) = ( 0.6585602 0.1757575 -0.9716456), wk = 0.0032573 k( 248) = ( 0.6549566 0.1747958 -0.9477285), wk = 0.0032573 k( 249) = ( 0.6513530 0.1738340 -0.9238116), wk = 0.0032573 k( 250) = ( 0.6477493 0.1728723 -0.8998946), wk = 0.0032573 k( 251) = ( 0.6441457 0.1719105 -0.8759776), wk = 0.0032573 k( 252) = ( 0.6405420 0.1709488 -0.8520606), wk = 0.0032573 k( 253) = ( 0.6369384 0.1699870 -0.8281436), wk = 0.0032573 k( 254) = ( 0.6333347 0.1690253 -0.8042266), wk = 0.0032573 k( 255) = ( 0.6297311 0.1680636 -0.7803096), wk = 0.0032573 k( 256) = ( 0.6261275 0.1671018 -0.7563926), wk = 0.0032573 k( 257) = ( 0.6225238 0.1661401 -0.7324756), wk = 0.0032573 k( 258) = ( 0.6189202 0.1651783 -0.7085586), wk = 0.0032573 k( 259) = ( 0.6153165 0.1642166 -0.6846416), wk = 0.0032573 k( 260) = ( 0.6117129 0.1632548 -0.6607246), wk = 0.0032573 k( 261) = ( 0.6081093 0.1622931 -0.6368076), wk = 0.0032573 k( 262) = ( 0.6045056 0.1613313 -0.6128906), wk = 0.0032573 k( 263) = ( 0.6009020 0.1603696 -0.5889736), wk = 0.0032573 k( 264) = ( 0.5972983 0.1594079 -0.5650566), wk = 0.0032573 k( 265) = ( 0.5936947 0.1584461 -0.5411396), wk = 0.0032573 k( 266) = ( 0.5900910 0.1574844 -0.5172226), wk = 0.0032573 k( 267) = ( 0.5864874 0.1565226 -0.4933056), wk = 0.0032573 k( 268) = ( 0.5828838 0.1555609 -0.4693886), wk = 0.0032573 k( 269) = ( 0.5792801 0.1545991 -0.4454716), wk = 0.0032573 k( 270) = ( 0.5756765 0.1536374 -0.4215546), wk = 0.0032573 k( 271) = ( 0.5720728 0.1526756 -0.3976376), wk = 0.0032573 k( 272) = ( 0.5684692 0.1517139 -0.3737206), wk = 0.0032573 k( 273) = ( 0.5648656 0.1507521 -0.3498036), wk = 0.0032573 k( 274) = ( 0.5612619 0.1497904 -0.3258866), wk = 0.0032573 k( 275) = ( 0.5576583 0.1488287 -0.3019697), wk = 0.0032573 k( 276) = ( 0.5540546 0.1478669 -0.2780526), wk = 0.0032573 k( 277) = ( 0.5504510 0.1469052 -0.2541356), wk = 0.0032573 k( 278) = ( 0.5468473 0.1459434 -0.2302187), wk = 0.0032573 k( 279) = ( 0.5432437 0.1449817 -0.2063016), wk = 0.0032573 k( 280) = ( 0.5396401 0.1440199 -0.1823847), wk = 0.0032573 k( 281) = ( 0.5360364 0.1430582 -0.1584677), wk = 0.0032573 k( 282) = ( 0.5324328 0.1420964 -0.1345507), wk = 0.0032573 k( 283) = ( 0.5288291 0.1411347 -0.1106337), wk = 0.0032573 k( 284) = ( 0.5252255 0.1401729 -0.0867167), wk = 0.0032573 k( 285) = ( 0.5216219 0.1392112 -0.0627997), wk = 0.0032573 k( 286) = ( 0.5180182 0.1382495 -0.0388827), wk = 0.0032573 k( 287) = ( 0.5144146 0.1372877 -0.0149657), wk = 0.0032573 k( 288) = ( 0.5108109 0.1363260 0.0089513), wk = 0.0032573 k( 289) = ( 0.5072073 0.1353642 0.0328683), wk = 0.0032573 k( 290) = ( 0.5036036 0.1344025 0.0567853), wk = 0.0032573 k( 291) = ( 0.5000000 0.1334407 0.0807023), wk = 0.0032573 k( 292) = ( 0.5000000 -0.8700251 -0.5261739), wk = 0.0032573 k( 293) = ( 0.5211414 -0.8611290 -0.5207938), wk = 0.0032573 k( 294) = ( 0.5422827 -0.8522330 -0.5154136), wk = 0.0032573 k( 295) = ( 0.5634241 -0.8433370 -0.5100335), wk = 0.0032573 k( 296) = ( 0.5845655 -0.8344409 -0.5046533), wk = 0.0032573 k( 297) = ( 0.6057068 -0.8255449 -0.4992732), wk = 0.0032573 k( 298) = ( 0.6268482 -0.8166488 -0.4938930), wk = 0.0032573 k( 299) = ( 0.6479896 -0.8077527 -0.4885128), wk = 0.0032573 k( 300) = ( 0.6691309 -0.7988567 -0.4831327), wk = 0.0032573 k( 301) = ( 0.6902723 -0.7899607 -0.4777525), wk = 0.0032573 k( 302) = ( 0.7114137 -0.7810646 -0.4723724), wk = 0.0032573 k( 303) = ( 0.7325550 -0.7721686 -0.4669922), wk = 0.0032573 k( 304) = ( 0.7536964 -0.7632725 -0.4616121), wk = 0.0032573 k( 305) = ( 0.7748377 -0.7543765 -0.4562319), wk = 0.0032573 k( 306) = ( 0.7959791 -0.7454804 -0.4508518), wk = 0.0032573 k( 307) = ( 0.8171205 -0.7365844 -0.4454716), wk = 0.0032573 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 2) = ( 0.0106383 -0.0000000 -0.0000000), wk = 0.0032573 k( 3) = ( 0.0212766 -0.0000000 -0.0000000), wk = 0.0032573 k( 4) = ( 0.0319149 0.0000000 0.0000000), wk = 0.0032573 k( 5) = ( 0.0425532 0.0000000 0.0000000), wk = 0.0032573 k( 6) = ( 0.0531915 0.0000000 -0.0000000), wk = 0.0032573 k( 7) = ( 0.0638298 0.0000000 0.0000000), wk = 0.0032573 k( 8) = ( 0.0744681 0.0000000 0.0000000), wk = 0.0032573 k( 9) = ( 0.0851064 0.0000000 0.0000000), wk = 0.0032573 k( 10) = ( 0.0957447 0.0000000 0.0000000), wk = 0.0032573 k( 11) = ( 0.1063830 0.0000000 -0.0000000), wk = 0.0032573 k( 12) = ( 0.1170213 -0.0000000 -0.0000000), wk = 0.0032573 k( 13) = ( 0.1276596 0.0000000 -0.0000000), wk = 0.0032573 k( 14) = ( 0.1382979 0.0000000 -0.0000000), wk = 0.0032573 k( 15) = ( 0.1489362 0.0000000 -0.0000000), wk = 0.0032573 k( 16) = ( 0.1595745 -0.0000000 -0.0000000), wk = 0.0032573 k( 17) = ( 0.1702128 -0.0000000 -0.0000000), wk = 0.0032573 k( 18) = ( 0.1808511 0.0000000 0.0000000), wk = 0.0032573 k( 19) = ( 0.1914894 0.0000000 0.0000000), wk = 0.0032573 k( 20) = ( 0.2021277 0.0000000 -0.0000000), wk = 0.0032573 k( 21) = ( 0.2127660 0.0000000 -0.0000000), wk = 0.0032573 k( 22) = ( 0.2234043 -0.0000000 -0.0000000), wk = 0.0032573 k( 23) = ( 0.2340425 -0.0000000 0.0000000), wk = 0.0032573 k( 24) = ( 0.2446809 -0.0000000 -0.0000000), wk = 0.0032573 k( 25) = ( 0.2553191 0.0000000 0.0000000), wk = 0.0032573 k( 26) = ( 0.2659574 0.0000000 -0.0000000), wk = 0.0032573 k( 27) = ( 0.2765957 0.0000000 -0.0000000), wk = 0.0032573 k( 28) = ( 0.2872340 0.0000000 -0.0000000), wk = 0.0032573 k( 29) = ( 0.2978723 0.0000000 -0.0000000), wk = 0.0032573 k( 30) = ( 0.3085106 0.0000000 0.0000000), wk = 0.0032573 k( 31) = ( 0.3191489 -0.0000000 -0.0000000), wk = 0.0032573 k( 32) = ( 0.3297872 -0.0000000 -0.0000000), wk = 0.0032573 k( 33) = ( 0.3404255 -0.0000000 0.0000000), wk = 0.0032573 k( 34) = ( 0.3510638 0.0000000 0.0000000), wk = 0.0032573 k( 35) = ( 0.3617021 -0.0000000 0.0000000), wk = 0.0032573 k( 36) = ( 0.3723404 0.0000000 0.0000000), wk = 0.0032573 k( 37) = ( 0.3829787 0.0000000 0.0000000), wk = 0.0032573 k( 38) = ( 0.3936170 -0.0000000 -0.0000000), wk = 0.0032573 k( 39) = ( 0.4042553 0.0000000 -0.0000000), wk = 0.0032573 k( 40) = ( 0.4148936 -0.0000000 0.0000000), wk = 0.0032573 k( 41) = ( 0.4255319 0.0000000 0.0000000), wk = 0.0032573 k( 42) = ( 0.4361702 0.0000000 0.0000000), wk = 0.0032573 k( 43) = ( 0.4468085 0.0000000 0.0000000), wk = 0.0032573 k( 44) = ( 0.4574468 -0.0000000 -0.0000000), wk = 0.0032573 k( 45) = ( 0.4680851 -0.0000000 0.0000000), wk = 0.0032573 k( 46) = ( 0.4787234 -0.0000000 0.0000000), wk = 0.0032573 k( 47) = ( 0.4893617 -0.0000000 -0.0000000), wk = 0.0032573 k( 48) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0032573 k( 49) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0032573 k( 50) = ( 0.5000000 0.0060960 -0.0060960), wk = 0.0032573 k( 51) = ( 0.5000000 0.0121920 -0.0121920), wk = 0.0032573 k( 52) = ( 0.5000000 0.0182879 -0.0182879), wk = 0.0032573 k( 53) = ( 0.5000000 0.0243839 -0.0243839), wk = 0.0032573 k( 54) = ( 0.5000000 0.0304799 -0.0304799), wk = 0.0032573 k( 55) = ( 0.5000000 0.0365759 -0.0365759), wk = 0.0032573 k( 56) = ( 0.5000000 0.0426719 -0.0426719), wk = 0.0032573 k( 57) = ( 0.5000000 0.0487679 -0.0487679), wk = 0.0032573 k( 58) = ( 0.5000000 0.0548639 -0.0548639), wk = 0.0032573 k( 59) = ( 0.5000000 0.0609598 -0.0609598), wk = 0.0032573 k( 60) = ( 0.5000000 0.0670558 -0.0670558), wk = 0.0032573 k( 61) = ( 0.5000000 0.0731518 -0.0731518), wk = 0.0032573 k( 62) = ( 0.5000000 0.0792478 -0.0792478), wk = 0.0032573 k( 63) = ( 0.5000000 0.0853438 -0.0853438), wk = 0.0032573 k( 64) = ( 0.5000000 0.0914398 -0.0914398), wk = 0.0032573 k( 65) = ( 0.5000000 0.0975357 -0.0975358), wk = 0.0032573 k( 66) = ( 0.5000000 0.1036317 -0.1036317), wk = 0.0032573 k( 67) = ( 0.5000000 0.1097277 -0.1097277), wk = 0.0032573 k( 68) = ( 0.5000000 0.1158237 -0.1158237), wk = 0.0032573 k( 69) = ( 0.5000000 0.1219197 -0.1219197), wk = 0.0032573 k( 70) = ( 0.5000000 0.1280157 -0.1280157), wk = 0.0032573 k( 71) = ( 0.5000000 0.1341117 -0.1341116), wk = 0.0032573 k( 72) = ( 0.5000000 0.1402076 -0.1402076), wk = 0.0032573 k( 73) = ( 0.5000000 0.1463036 -0.1463036), wk = 0.0032573 k( 74) = ( 0.5000000 0.1523996 -0.1523996), wk = 0.0032573 k( 75) = ( 0.5000000 0.1584956 -0.1584956), wk = 0.0032573 k( 76) = ( 0.5000000 0.1645916 -0.1645916), wk = 0.0032573 k( 77) = ( 0.5000000 0.1706876 -0.1706876), wk = 0.0032573 k( 78) = ( 0.5000000 0.1767835 -0.1767835), wk = 0.0032573 k( 79) = ( 0.5000000 0.1828795 -0.1828795), wk = 0.0032573 k( 80) = ( 0.8171205 0.5000000 0.1828795), wk = 0.0032573 k( 81) = ( 0.8109024 0.5000000 0.1890976), wk = 0.0032573 k( 82) = ( 0.8046844 0.5000000 0.1953156), wk = 0.0032573 k( 83) = ( 0.7984663 0.5000000 0.2015337), wk = 0.0032573 k( 84) = ( 0.7922483 0.5000000 0.2077517), wk = 0.0032573 k( 85) = ( 0.7860302 0.5000000 0.2139698), wk = 0.0032573 k( 86) = ( 0.7798122 0.5000000 0.2201878), wk = 0.0032573 k( 87) = ( 0.7735941 0.5000000 0.2264059), wk = 0.0032573 k( 88) = ( 0.7673761 0.5000000 0.2326239), wk = 0.0032573 k( 89) = ( 0.7611580 0.5000000 0.2388420), wk = 0.0032573 k( 90) = ( 0.7549400 0.5000000 0.2450600), wk = 0.0032573 k( 91) = ( 0.7487219 0.5000000 0.2512781), wk = 0.0032573 k( 92) = ( 0.7425039 0.5000000 0.2574961), wk = 0.0032573 k( 93) = ( 0.7362858 0.5000000 0.2637142), wk = 0.0032573 k( 94) = ( 0.7300678 0.5000000 0.2699322), wk = 0.0032573 k( 95) = ( 0.7238497 0.5000000 0.2761502), wk = 0.0032573 k( 96) = ( 0.7176317 0.5000000 0.2823683), wk = 0.0032573 k( 97) = ( 0.7114137 0.5000000 0.2885863), wk = 0.0032573 k( 98) = ( 0.7051956 0.5000000 0.2948044), wk = 0.0032573 k( 99) = ( 0.6989775 0.5000000 0.3010225), wk = 0.0032573 k( 100) = ( 0.6927595 0.5000000 0.3072405), wk = 0.0032573 k( 101) = ( 0.6865414 0.5000000 0.3134585), wk = 0.0032573 k( 102) = ( 0.6803234 0.5000000 0.3196766), wk = 0.0032573 k( 103) = ( 0.6741054 0.5000000 0.3258946), wk = 0.0032573 k( 104) = ( 0.6678873 0.5000000 0.3321127), wk = 0.0032573 k( 105) = ( 0.6616693 0.5000000 0.3383307), wk = 0.0032573 k( 106) = ( 0.6554512 0.5000000 0.3445488), wk = 0.0032573 k( 107) = ( 0.6492332 0.5000000 0.3507668), wk = 0.0032573 k( 108) = ( 0.6430151 0.5000000 0.3569849), wk = 0.0032573 k( 109) = ( 0.6367971 0.5000000 0.3632029), wk = 0.0032573 k( 110) = ( 0.6305790 0.5000000 0.3694210), wk = 0.0032573 k( 111) = ( 0.6243610 0.5000000 0.3756390), wk = 0.0032573 k( 112) = ( 0.6181429 0.5000000 0.3818571), wk = 0.0032573 k( 113) = ( 0.6119249 0.5000000 0.3880751), wk = 0.0032573 k( 114) = ( 0.6057068 0.5000000 0.3942932), wk = 0.0032573 k( 115) = ( 0.5994888 0.5000000 0.4005112), wk = 0.0032573 k( 116) = ( 0.5932707 0.5000000 0.4067293), wk = 0.0032573 k( 117) = ( 0.5870527 0.5000000 0.4129473), wk = 0.0032573 k( 118) = ( 0.5808346 0.5000000 0.4191654), wk = 0.0032573 k( 119) = ( 0.5746166 0.5000000 0.4253834), wk = 0.0032573 k( 120) = ( 0.5683985 0.5000000 0.4316015), wk = 0.0032573 k( 121) = ( 0.5621805 0.5000000 0.4378195), wk = 0.0032573 k( 122) = ( 0.5559624 0.5000000 0.4440376), wk = 0.0032573 k( 123) = ( 0.5497444 0.5000000 0.4502556), wk = 0.0032573 k( 124) = ( 0.5435263 0.5000000 0.4564737), wk = 0.0032573 k( 125) = ( 0.5373083 0.5000000 0.4626917), wk = 0.0032573 k( 126) = ( 0.5310902 0.5000000 0.4689098), wk = 0.0032573 k( 127) = ( 0.5248722 0.5000000 0.4751278), wk = 0.0032573 k( 128) = ( 0.5186542 0.5000000 0.4813459), wk = 0.0032573 k( 129) = ( 0.5124361 0.5000000 0.4875639), wk = 0.0032573 k( 130) = ( 0.5062180 0.5000000 0.4937819), wk = 0.0032573 k( 131) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 k( 132) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 k( 133) = ( 0.4772727 0.4772727 0.4772727), wk = 0.0032573 k( 134) = ( 0.4545455 0.4545454 0.4545455), wk = 0.0032573 k( 135) = ( 0.4318182 0.4318182 0.4318182), wk = 0.0032573 k( 136) = ( 0.4090909 0.4090909 0.4090909), wk = 0.0032573 k( 137) = ( 0.3863636 0.3863636 0.3863636), wk = 0.0032573 k( 138) = ( 0.3636364 0.3636364 0.3636364), wk = 0.0032573 k( 139) = ( 0.3409091 0.3409091 0.3409091), wk = 0.0032573 k( 140) = ( 0.3181818 0.3181818 0.3181818), wk = 0.0032573 k( 141) = ( 0.2954545 0.2954545 0.2954546), wk = 0.0032573 k( 142) = ( 0.2727273 0.2727273 0.2727273), wk = 0.0032573 k( 143) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032573 k( 144) = ( 0.2272727 0.2272727 0.2272727), wk = 0.0032573 k( 145) = ( 0.2045454 0.2045454 0.2045454), wk = 0.0032573 k( 146) = ( 0.1818182 0.1818182 0.1818182), wk = 0.0032573 k( 147) = ( 0.1590909 0.1590909 0.1590909), wk = 0.0032573 k( 148) = ( 0.1363636 0.1363636 0.1363636), wk = 0.0032573 k( 149) = ( 0.1136364 0.1136364 0.1136364), wk = 0.0032573 k( 150) = ( 0.0909091 0.0909091 0.0909091), wk = 0.0032573 k( 151) = ( 0.0681818 0.0681818 0.0681818), wk = 0.0032573 k( 152) = ( 0.0454546 0.0454546 0.0454546), wk = 0.0032573 k( 153) = ( 0.0227273 0.0227273 0.0227273), wk = 0.0032573 k( 154) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 155) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032573 k( 156) = ( 0.0062080 0.0000000 -0.0062080), wk = 0.0032573 k( 157) = ( 0.0124160 -0.0000000 -0.0124160), wk = 0.0032573 k( 158) = ( 0.0186240 -0.0000000 -0.0186240), wk = 0.0032573 k( 159) = ( 0.0248320 -0.0000000 -0.0248320), wk = 0.0032573 k( 160) = ( 0.0310400 0.0000000 -0.0310400), wk = 0.0032573 k( 161) = ( 0.0372480 -0.0000000 -0.0372480), wk = 0.0032573 k( 162) = ( 0.0434560 0.0000000 -0.0434560), wk = 0.0032573 k( 163) = ( 0.0496640 0.0000000 -0.0496640), wk = 0.0032573 k( 164) = ( 0.0558720 0.0000000 -0.0558720), wk = 0.0032573 k( 165) = ( 0.0620800 0.0000000 -0.0620800), wk = 0.0032573 k( 166) = ( 0.0682880 0.0000000 -0.0682880), wk = 0.0032573 k( 167) = ( 0.0744960 -0.0000000 -0.0744960), wk = 0.0032573 k( 168) = ( 0.0807039 -0.0000000 -0.0807039), wk = 0.0032573 k( 169) = ( 0.0869119 0.0000000 -0.0869119), wk = 0.0032573 k( 170) = ( 0.0931199 -0.0000000 -0.0931199), wk = 0.0032573 k( 171) = ( 0.0993279 -0.0000000 -0.0993279), wk = 0.0032573 k( 172) = ( 0.1055359 0.0000000 -0.1055359), wk = 0.0032573 k( 173) = ( 0.1117439 0.0000000 -0.1117439), wk = 0.0032573 k( 174) = ( 0.1179519 -0.0000000 -0.1179519), wk = 0.0032573 k( 175) = ( 0.1241599 0.0000000 -0.1241599), wk = 0.0032573 k( 176) = ( 0.1303679 0.0000000 -0.1303679), wk = 0.0032573 k( 177) = ( 0.1365759 0.0000000 -0.1365759), wk = 0.0032573 k( 178) = ( 0.1427839 0.0000000 -0.1427839), wk = 0.0032573 k( 179) = ( 0.1489919 -0.0000000 -0.1489919), wk = 0.0032573 k( 180) = ( 0.1551999 -0.0000000 -0.1551999), wk = 0.0032573 k( 181) = ( 0.1614079 -0.0000000 -0.1614079), wk = 0.0032573 k( 182) = ( 0.1676159 -0.0000000 -0.1676159), wk = 0.0032573 k( 183) = ( 0.1738239 0.0000000 -0.1738239), wk = 0.0032573 k( 184) = ( 0.1800319 -0.0000000 -0.1800319), wk = 0.0032573 k( 185) = ( 0.1862399 -0.0000000 -0.1862399), wk = 0.0032573 k( 186) = ( 0.1924479 -0.0000000 -0.1924479), wk = 0.0032573 k( 187) = ( 0.1986559 -0.0000000 -0.1986559), wk = 0.0032573 k( 188) = ( 0.2048639 -0.0000000 -0.2048639), wk = 0.0032573 k( 189) = ( 0.2110719 -0.0000000 -0.2110719), wk = 0.0032573 k( 190) = ( 0.2172798 0.0000000 -0.2172798), wk = 0.0032573 k( 191) = ( 0.2234878 0.0000000 -0.2234879), wk = 0.0032573 k( 192) = ( 0.2296958 0.0000000 -0.2296958), wk = 0.0032573 k( 193) = ( 0.2359038 -0.0000000 -0.2359038), wk = 0.0032573 k( 194) = ( 0.2421118 -0.0000000 -0.2421118), wk = 0.0032573 k( 195) = ( 0.2483198 0.0000000 -0.2483198), wk = 0.0032573 k( 196) = ( 0.2545278 -0.0000000 -0.2545278), wk = 0.0032573 k( 197) = ( 0.2607358 0.0000000 -0.2607358), wk = 0.0032573 k( 198) = ( 0.2669438 0.0000000 -0.2669438), wk = 0.0032573 k( 199) = ( 0.2731518 0.0000000 -0.2731518), wk = 0.0032573 k( 200) = ( 0.2793598 -0.0000000 -0.2793598), wk = 0.0032573 k( 201) = ( 0.2855678 0.0000000 -0.2855678), wk = 0.0032573 k( 202) = ( 0.2917758 0.0000000 -0.2917758), wk = 0.0032573 k( 203) = ( 0.2979838 -0.0000000 -0.2979838), wk = 0.0032573 k( 204) = ( 0.3041918 0.0000000 -0.3041918), wk = 0.0032573 k( 205) = ( 0.3103998 -0.0000000 -0.3103998), wk = 0.0032573 k( 206) = ( 0.3166078 0.0000000 -0.3166078), wk = 0.0032573 k( 207) = ( 0.3228158 -0.0000000 -0.3228158), wk = 0.0032573 k( 208) = ( 0.3290238 0.0000000 -0.3290238), wk = 0.0032573 k( 209) = ( 0.3352318 -0.0000000 -0.3352318), wk = 0.0032573 k( 210) = ( 0.3414398 0.0000000 -0.3414398), wk = 0.0032573 k( 211) = ( 0.6585602 0.3414398 -0.0000000), wk = 0.0032573 k( 212) = ( 0.6524618 0.3475382 0.0000000), wk = 0.0032573 k( 213) = ( 0.6463633 0.3536367 0.0000000), wk = 0.0032573 k( 214) = ( 0.6402648 0.3597352 -0.0000000), wk = 0.0032573 k( 215) = ( 0.6341663 0.3658337 -0.0000000), wk = 0.0032573 k( 216) = ( 0.6280679 0.3719321 -0.0000000), wk = 0.0032573 k( 217) = ( 0.6219694 0.3780306 -0.0000000), wk = 0.0032573 k( 218) = ( 0.6158709 0.3841291 -0.0000000), wk = 0.0032573 k( 219) = ( 0.6097725 0.3902275 0.0000000), wk = 0.0032573 k( 220) = ( 0.6036740 0.3963260 0.0000000), wk = 0.0032573 k( 221) = ( 0.5975755 0.4024245 -0.0000000), wk = 0.0032573 k( 222) = ( 0.5914771 0.4085229 0.0000000), wk = 0.0032573 k( 223) = ( 0.5853786 0.4146214 0.0000000), wk = 0.0032573 k( 224) = ( 0.5792801 0.4207199 -0.0000000), wk = 0.0032573 k( 225) = ( 0.5731816 0.4268184 -0.0000000), wk = 0.0032573 k( 226) = ( 0.5670832 0.4329168 0.0000000), wk = 0.0032573 k( 227) = ( 0.5609847 0.4390153 -0.0000000), wk = 0.0032573 k( 228) = ( 0.5548862 0.4451138 0.0000000), wk = 0.0032573 k( 229) = ( 0.5487878 0.4512122 -0.0000000), wk = 0.0032573 k( 230) = ( 0.5426893 0.4573107 0.0000000), wk = 0.0032573 k( 231) = ( 0.5365908 0.4634092 0.0000000), wk = 0.0032573 k( 232) = ( 0.5304923 0.4695076 -0.0000000), wk = 0.0032573 k( 233) = ( 0.5243939 0.4756061 -0.0000000), wk = 0.0032573 k( 234) = ( 0.5182954 0.4817046 -0.0000000), wk = 0.0032573 k( 235) = ( 0.5121969 0.4878031 -0.0000000), wk = 0.0032573 k( 236) = ( 0.5060985 0.4939015 -0.0000000), wk = 0.0032573 k( 237) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 238) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0032573 k( 239) = ( 0.5198200 0.5198200 0.0228599), wk = 0.0032573 k( 240) = ( 0.5396401 0.5396401 0.0457199), wk = 0.0032573 k( 241) = ( 0.5594601 0.5594601 0.0685798), wk = 0.0032573 k( 242) = ( 0.5792801 0.5792801 0.0914398), wk = 0.0032573 k( 243) = ( 0.5991002 0.5991001 0.1142997), wk = 0.0032573 k( 244) = ( 0.6189202 0.6189202 0.1371596), wk = 0.0032573 k( 245) = ( 0.6387402 0.6387402 0.1600196), wk = 0.0032573 k( 246) = ( 0.6585602 0.6585602 0.1828795), wk = 0.0032573 k( 247) = ( 0.6585602 0.6585602 0.1828795), wk = 0.0032573 k( 248) = ( 0.6549566 0.6549566 0.1900868), wk = 0.0032573 k( 249) = ( 0.6513530 0.6513530 0.1972941), wk = 0.0032573 k( 250) = ( 0.6477493 0.6477493 0.2045014), wk = 0.0032573 k( 251) = ( 0.6441457 0.6441457 0.2117087), wk = 0.0032573 k( 252) = ( 0.6405420 0.6405420 0.2189159), wk = 0.0032573 k( 253) = ( 0.6369384 0.6369384 0.2261232), wk = 0.0032573 k( 254) = ( 0.6333347 0.6333347 0.2333305), wk = 0.0032573 k( 255) = ( 0.6297311 0.6297311 0.2405378), wk = 0.0032573 k( 256) = ( 0.6261275 0.6261275 0.2477451), wk = 0.0032573 k( 257) = ( 0.6225238 0.6225238 0.2549524), wk = 0.0032573 k( 258) = ( 0.6189202 0.6189202 0.2621597), wk = 0.0032573 k( 259) = ( 0.6153165 0.6153165 0.2693669), wk = 0.0032573 k( 260) = ( 0.6117129 0.6117129 0.2765742), wk = 0.0032573 k( 261) = ( 0.6081093 0.6081093 0.2837815), wk = 0.0032573 k( 262) = ( 0.6045056 0.6045056 0.2909888), wk = 0.0032573 k( 263) = ( 0.6009020 0.6009020 0.2981961), wk = 0.0032573 k( 264) = ( 0.5972983 0.5972983 0.3054034), wk = 0.0032573 k( 265) = ( 0.5936947 0.5936947 0.3126106), wk = 0.0032573 k( 266) = ( 0.5900910 0.5900910 0.3198179), wk = 0.0032573 k( 267) = ( 0.5864874 0.5864874 0.3270252), wk = 0.0032573 k( 268) = ( 0.5828838 0.5828838 0.3342325), wk = 0.0032573 k( 269) = ( 0.5792801 0.5792801 0.3414398), wk = 0.0032573 k( 270) = ( 0.5756765 0.5756765 0.3486471), wk = 0.0032573 k( 271) = ( 0.5720728 0.5720728 0.3558543), wk = 0.0032573 k( 272) = ( 0.5684692 0.5684692 0.3630616), wk = 0.0032573 k( 273) = ( 0.5648656 0.5648656 0.3702689), wk = 0.0032573 k( 274) = ( 0.5612619 0.5612619 0.3774762), wk = 0.0032573 k( 275) = ( 0.5576583 0.5576583 0.3846835), wk = 0.0032573 k( 276) = ( 0.5540546 0.5540546 0.3918908), wk = 0.0032573 k( 277) = ( 0.5504510 0.5504510 0.3990980), wk = 0.0032573 k( 278) = ( 0.5468473 0.5468473 0.4063053), wk = 0.0032573 k( 279) = ( 0.5432437 0.5432437 0.4135126), wk = 0.0032573 k( 280) = ( 0.5396401 0.5396401 0.4207199), wk = 0.0032573 k( 281) = ( 0.5360364 0.5360364 0.4279272), wk = 0.0032573 k( 282) = ( 0.5324328 0.5324328 0.4351345), wk = 0.0032573 k( 283) = ( 0.5288291 0.5288291 0.4423417), wk = 0.0032573 k( 284) = ( 0.5252255 0.5252255 0.4495490), wk = 0.0032573 k( 285) = ( 0.5216219 0.5216218 0.4567563), wk = 0.0032573 k( 286) = ( 0.5180182 0.5180182 0.4639636), wk = 0.0032573 k( 287) = ( 0.5144146 0.5144146 0.4711709), wk = 0.0032573 k( 288) = ( 0.5108109 0.5108109 0.4783781), wk = 0.0032573 k( 289) = ( 0.5072073 0.5072073 0.4855854), wk = 0.0032573 k( 290) = ( 0.5036036 0.5036036 0.4927927), wk = 0.0032573 k( 291) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032573 k( 292) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0032573 k( 293) = ( 0.5211414 0.0227627 0.0227626), wk = 0.0032573 k( 294) = ( 0.5422827 0.0455253 0.0455253), wk = 0.0032573 k( 295) = ( 0.5634241 0.0682879 0.0682880), wk = 0.0032573 k( 296) = ( 0.5845655 0.0910506 0.0910506), wk = 0.0032573 k( 297) = ( 0.6057068 0.1138133 0.1138132), wk = 0.0032573 k( 298) = ( 0.6268482 0.1365759 0.1365759), wk = 0.0032573 k( 299) = ( 0.6479896 0.1593386 0.1593386), wk = 0.0032573 k( 300) = ( 0.6691309 0.1821012 0.1821012), wk = 0.0032573 k( 301) = ( 0.6902723 0.2048639 0.2048639), wk = 0.0032573 k( 302) = ( 0.7114137 0.2276265 0.2276265), wk = 0.0032573 k( 303) = ( 0.7325550 0.2503892 0.2503892), wk = 0.0032573 k( 304) = ( 0.7536964 0.2731518 0.2731518), wk = 0.0032573 k( 305) = ( 0.7748377 0.2959145 0.2959145), wk = 0.0032573 k( 306) = ( 0.7959791 0.3186771 0.3186771), wk = 0.0032573 k( 307) = ( 0.8171205 0.3414398 0.3414398), wk = 0.0032573 Dense grid: 63823 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 31435 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.13 Mb ( 214, 40) NL pseudopotentials 0.16 Mb ( 107, 96) Each V/rho on FFT grid 0.37 Mb ( 24300) Each G-vector array 0.01 Mb ( 1773) G-vector shells 0.01 Mb ( 1484) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.52 Mb ( 214, 160) Each subspace H/S matrix 0.02 Mb ( 40, 40) Each matrix 0.12 Mb ( 96, 2, 40) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./Sr2BrN.save/charge-density.dat Starting wfc are 48 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.2 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 6.6 secs Computing kpt #: 4 total cpu time spent up to now is 7.2 secs Computing kpt #: 5 total cpu time spent up to now is 7.8 secs Computing kpt #: 6 total cpu time spent up to now is 8.4 secs Computing kpt #: 7 total cpu time spent up to now is 9.0 secs Computing kpt #: 8 total cpu time spent up to now is 9.5 secs Computing kpt #: 9 total cpu time spent up to now is 10.1 secs Computing kpt #: 10 total cpu time spent up to now is 10.7 secs Computing kpt #: 11 total cpu time spent up to now is 11.3 secs Computing kpt #: 12 total cpu time spent up to now is 11.9 secs Computing kpt #: 13 total cpu time spent up to now is 12.5 secs Computing kpt #: 14 total cpu time spent up to now is 13.1 secs Computing kpt #: 15 total cpu time spent up to now is 13.7 secs Computing kpt #: 16 total cpu time spent up to now is 14.4 secs Computing kpt #: 17 total cpu time spent up to now is 15.0 secs Computing kpt #: 18 total cpu time spent up to now is 15.6 secs Computing kpt #: 19 total cpu time spent up to now is 16.2 secs Computing kpt #: 20 total cpu time spent up to now is 16.7 secs Computing kpt #: 21 total cpu time spent up to now is 17.3 secs Computing kpt #: 22 total cpu time spent up to now is 17.8 secs Computing kpt #: 23 total cpu time spent up to now is 18.4 secs Computing kpt #: 24 total cpu time spent up to now is 18.9 secs Computing kpt #: 25 total cpu time spent up to now is 19.5 secs Computing kpt #: 26 total cpu time spent up to now is 20.0 secs Computing kpt #: 27 total cpu time spent up to now is 20.6 secs Computing kpt #: 28 total cpu time spent up to now is 21.1 secs Computing kpt #: 29 total cpu time spent up to now is 21.6 secs Computing kpt #: 30 total cpu time spent up to now is 22.2 secs Computing kpt #: 31 total cpu time spent up to now is 22.7 secs Computing kpt #: 32 total cpu time spent up to now is 23.4 secs Computing kpt #: 33 total cpu time spent up to now is 23.9 secs Computing kpt #: 34 total cpu time spent up to now is 24.4 secs Computing kpt #: 35 total cpu time spent up to now is 25.0 secs Computing kpt #: 36 total cpu time spent up to now is 25.5 secs Computing kpt #: 37 total cpu time spent up to now is 26.0 secs Computing kpt #: 38 total cpu time spent up to now is 26.6 secs Computing kpt #: 39 total cpu time spent up to now is 27.1 secs Computing kpt #: 40 total cpu time spent up to now is 27.6 secs Computing kpt #: 41 total cpu time spent up to now is 28.1 secs Computing kpt #: 42 total cpu time spent up to now is 28.6 secs Computing kpt #: 43 total cpu time spent up to now is 29.1 secs Computing kpt #: 44 total cpu time spent up to now is 29.6 secs Computing kpt #: 45 total cpu time spent up to now is 30.1 secs Computing kpt #: 46 total cpu time spent up to now is 30.6 secs Computing kpt #: 47 total cpu time spent up to now is 31.1 secs Computing kpt #: 48 total cpu time spent up to now is 31.6 secs Computing kpt #: 49 total cpu time spent up to now is 32.1 secs Computing kpt #: 50 total cpu time spent up to now is 32.6 secs Computing kpt #: 51 total cpu time spent up to now is 33.1 secs Computing kpt #: 52 total cpu time spent up to now is 33.6 secs Computing kpt #: 53 total cpu time spent up to now is 34.2 secs Computing kpt #: 54 total cpu time spent up to now is 34.7 secs Computing kpt #: 55 total cpu time spent up to now is 35.2 secs Computing kpt #: 56 total cpu time spent up to now is 35.7 secs Computing kpt #: 57 total cpu time spent up to now is 36.3 secs Computing kpt #: 58 total cpu time spent up to now is 36.8 secs Computing kpt #: 59 total cpu time spent up to now is 37.4 secs Computing kpt #: 60 total cpu time spent up to now is 38.0 secs Computing kpt #: 61 total cpu time spent up to now is 38.6 secs Computing kpt #: 62 total cpu time spent up to now is 39.1 secs Computing kpt #: 63 total cpu time spent up to now is 39.6 secs Computing kpt #: 64 total cpu time spent up to now is 40.2 secs Computing kpt #: 65 total cpu time spent up to now is 40.7 secs Computing kpt #: 66 total cpu time spent up to now is 41.2 secs Computing kpt #: 67 total cpu time spent up to now is 41.8 secs Computing kpt #: 68 total cpu time spent up to now is 42.3 secs Computing kpt #: 69 total cpu time spent up to now is 42.8 secs Computing kpt #: 70 total cpu time spent up to now is 43.2 secs Computing kpt #: 71 total cpu time spent up to now is 43.7 secs Computing kpt #: 72 total cpu time spent up to now is 44.2 secs Computing kpt #: 73 total cpu time spent up to now is 44.7 secs Computing kpt #: 74 total cpu time spent up to now is 45.2 secs Computing kpt #: 75 total cpu time spent up to now is 45.7 secs Computing kpt #: 76 total cpu time spent up to now is 46.2 secs Computing kpt #: 77 total cpu time spent up to now is 46.8 secs Computing kpt #: 78 total cpu time spent up to now is 47.3 secs Computing kpt #: 79 total cpu time spent up to now is 47.8 secs Computing kpt #: 80 total cpu time spent up to now is 48.4 secs Computing kpt #: 81 total cpu time spent up to now is 48.9 secs Computing kpt #: 82 total cpu time spent up to now is 49.4 secs Computing kpt #: 83 total cpu time spent up to now is 50.0 secs Computing kpt #: 84 total cpu time spent up to now is 50.5 secs Computing kpt #: 85 total cpu time spent up to now is 51.0 secs Computing kpt #: 86 total cpu time spent up to now is 51.5 secs Computing kpt #: 87 total cpu time spent up to now is 52.1 secs Computing kpt #: 88 total cpu time spent up to now is 52.6 secs Computing kpt #: 89 total cpu time spent up to now is 53.1 secs Computing kpt #: 90 total cpu time spent up to now is 53.7 secs Computing kpt #: 91 total cpu time spent up to now is 54.2 secs Computing kpt #: 92 total cpu time spent up to now is 54.7 secs Computing kpt #: 93 total cpu time spent up to now is 55.3 secs Computing kpt #: 94 total cpu time spent up to now is 55.8 secs Computing kpt #: 95 total cpu time spent up to now is 56.4 secs Computing kpt #: 96 total cpu time spent up to now is 57.0 secs Computing kpt #: 97 total cpu time spent up to now is 57.5 secs Computing kpt #: 98 total cpu time spent up to now is 58.1 secs Computing kpt #: 99 total cpu time spent up to now is 58.7 secs Computing kpt #: 100 total cpu time spent up to now is 59.2 secs Computing kpt #: 101 total cpu time spent up to now is 59.7 secs Computing kpt #: 102 total cpu time spent up to now is 60.4 secs Computing kpt #: 103 total cpu time spent up to now is 60.9 secs Computing kpt #: 104 total cpu time spent up to now is 61.4 secs Computing kpt #: 105 total cpu time spent up to now is 62.0 secs Computing kpt #: 106 total cpu time spent up to now is 62.5 secs Computing kpt #: 107 total cpu time spent up to now is 63.1 secs Computing kpt #: 108 total cpu time spent up to now is 63.6 secs Computing kpt #: 109 total cpu time spent up to now is 64.1 secs Computing kpt #: 110 total cpu time spent up to now is 64.7 secs Computing kpt #: 111 total cpu time spent up to now is 65.2 secs Computing kpt #: 112 total cpu time spent up to now is 65.8 secs Computing kpt #: 113 total cpu time spent up to now is 66.3 secs Computing kpt #: 114 total cpu time spent up to now is 66.8 secs Computing kpt #: 115 total cpu time spent up to now is 67.4 secs Computing kpt #: 116 total cpu time spent up to now is 67.9 secs Computing kpt #: 117 total cpu time spent up to now is 68.4 secs Computing kpt #: 118 total cpu time spent up to now is 69.0 secs Computing kpt #: 119 total cpu time spent up to now is 69.6 secs Computing kpt #: 120 total cpu time spent up to now is 70.1 secs Computing kpt #: 121 total cpu time spent up to now is 70.7 secs Computing kpt #: 122 total cpu time spent up to now is 71.3 secs Computing kpt #: 123 total cpu time spent up to now is 71.9 secs Computing kpt #: 124 total cpu time spent up to now is 72.5 secs Computing kpt #: 125 total cpu time spent up to now is 73.1 secs Computing kpt #: 126 total cpu time spent up to now is 73.9 secs Computing kpt #: 127 total cpu time spent up to now is 74.6 secs Computing kpt #: 128 total cpu time spent up to now is 75.3 secs Computing kpt #: 129 total cpu time spent up to now is 76.0 secs Computing kpt #: 130 total cpu time spent up to now is 76.6 secs Computing kpt #: 131 total cpu time spent up to now is 77.5 secs Computing kpt #: 132 total cpu time spent up to now is 78.1 secs Computing kpt #: 133 total cpu time spent up to now is 78.8 secs Computing kpt #: 134 total cpu time spent up to now is 79.4 secs Computing kpt #: 135 total cpu time spent up to now is 80.2 secs Computing kpt #: 136 total cpu time spent up to now is 80.9 secs Computing kpt #: 137 total cpu time spent up to now is 81.5 secs Computing kpt #: 138 total cpu time spent up to now is 82.2 secs Computing kpt #: 139 total cpu time spent up to now is 82.8 secs Computing kpt #: 140 total cpu time spent up to now is 83.4 secs Computing kpt #: 141 total cpu time spent up to now is 84.1 secs Computing kpt #: 142 total cpu time spent up to now is 84.7 secs Computing kpt #: 143 total cpu time spent up to now is 85.3 secs Computing kpt #: 144 total cpu time spent up to now is 86.0 secs Computing kpt #: 145 total cpu time spent up to now is 86.6 secs Computing kpt #: 146 total cpu time spent up to now is 87.3 secs Computing kpt #: 147 total cpu time spent up to now is 87.9 secs Computing kpt #: 148 total cpu time spent up to now is 88.5 secs Computing kpt #: 149 total cpu time spent up to now is 89.2 secs Computing kpt #: 150 total cpu time spent up to now is 89.8 secs Computing kpt #: 151 total cpu time spent up to now is 90.5 secs Computing kpt #: 152 total cpu time spent up to now is 91.1 secs Computing kpt #: 153 total cpu time spent up to now is 91.7 secs Computing kpt #: 154 total cpu time spent up to now is 92.4 secs Computing kpt #: 155 total cpu time spent up to now is 93.0 secs Computing kpt #: 156 total cpu time spent up to now is 93.6 secs Computing kpt #: 157 total cpu time spent up to now is 94.3 secs Computing kpt #: 158 total cpu time spent up to now is 94.8 secs Computing kpt #: 159 total cpu time spent up to now is 95.5 secs Computing kpt #: 160 total cpu time spent up to now is 96.1 secs Computing kpt #: 161 total cpu time spent up to now is 96.7 secs Computing kpt #: 162 total cpu time spent up to now is 97.2 secs Computing kpt #: 163 total cpu time spent up to now is 97.8 secs Computing kpt #: 164 total cpu time spent up to now is 98.4 secs Computing kpt #: 165 total cpu time spent up to now is 98.9 secs Computing kpt #: 166 total cpu time spent up to now is 99.5 secs Computing kpt #: 167 total cpu time spent up to now is 100.0 secs Computing kpt #: 168 total cpu time spent up to now is 100.6 secs Computing kpt #: 169 total cpu time spent up to now is 101.2 secs Computing kpt #: 170 total cpu time spent up to now is 101.8 secs Computing kpt #: 171 total cpu time spent up to now is 102.4 secs Computing kpt #: 172 total cpu time spent up to now is 103.0 secs Computing kpt #: 173 total cpu time spent up to now is 103.6 secs Computing kpt #: 174 total cpu time spent up to now is 104.1 secs Computing kpt #: 175 total cpu time spent up to now is 104.7 secs Computing kpt #: 176 total cpu time spent up to now is 105.2 secs Computing kpt #: 177 total cpu time spent up to now is 105.8 secs Computing kpt #: 178 total cpu time spent up to now is 106.4 secs Computing kpt #: 179 total cpu time spent up to now is 107.0 secs Computing kpt #: 180 total cpu time spent up to now is 107.7 secs Computing kpt #: 181 total cpu time spent up to now is 108.2 secs Computing kpt #: 182 total cpu time spent up to now is 108.8 secs Computing kpt #: 183 total cpu time spent up to now is 109.3 secs Computing kpt #: 184 total cpu time spent up to now is 109.8 secs Computing kpt #: 185 total cpu time spent up to now is 110.4 secs Computing kpt #: 186 total cpu time spent up to now is 110.9 secs Computing kpt #: 187 total cpu time spent up to now is 111.4 secs Computing kpt #: 188 total cpu time spent up to now is 111.9 secs Computing kpt #: 189 total cpu time spent up to now is 112.4 secs Computing kpt #: 190 total cpu time spent up to now is 112.9 secs Computing kpt #: 191 total cpu time spent up to now is 113.4 secs Computing kpt #: 192 total cpu time spent up to now is 113.9 secs Computing kpt #: 193 total cpu time spent up to now is 114.4 secs Computing kpt #: 194 total cpu time spent up to now is 114.9 secs Computing kpt #: 195 total cpu time spent up to now is 115.4 secs Computing kpt #: 196 total cpu time spent up to now is 115.9 secs Computing kpt #: 197 total cpu time spent up to now is 116.4 secs Computing kpt #: 198 total cpu time spent up to now is 116.9 secs Computing kpt #: 199 total cpu time spent up to now is 117.4 secs Computing kpt #: 200 total cpu time spent up to now is 117.9 secs Computing kpt #: 201 total cpu time spent up to now is 118.4 secs Computing kpt #: 202 total cpu time spent up to now is 118.9 secs Computing kpt #: 203 total cpu time spent up to now is 119.4 secs Computing kpt #: 204 total cpu time spent up to now is 119.9 secs Computing kpt #: 205 total cpu time spent up to now is 120.4 secs Computing kpt #: 206 total cpu time spent up to now is 120.9 secs Computing kpt #: 207 total cpu time spent up to now is 121.4 secs Computing kpt #: 208 total cpu time spent up to now is 122.0 secs Computing kpt #: 209 total cpu time spent up to now is 122.5 secs Computing kpt #: 210 total cpu time spent up to now is 123.0 secs Computing kpt #: 211 total cpu time spent up to now is 123.6 secs Computing kpt #: 212 total cpu time spent up to now is 124.1 secs Computing kpt #: 213 total cpu time spent up to now is 124.7 secs Computing kpt #: 214 total cpu time spent up to now is 125.3 secs Computing kpt #: 215 total cpu time spent up to now is 125.8 secs Computing kpt #: 216 total cpu time spent up to now is 126.4 secs Computing kpt #: 217 total cpu time spent up to now is 126.9 secs Computing kpt #: 218 total cpu time spent up to now is 127.4 secs Computing kpt #: 219 total cpu time spent up to now is 128.0 secs Computing kpt #: 220 total cpu time spent up to now is 128.6 secs Computing kpt #: 221 total cpu time spent up to now is 129.3 secs Computing kpt #: 222 total cpu time spent up to now is 129.8 secs Computing kpt #: 223 total cpu time spent up to now is 130.4 secs Computing kpt #: 224 total cpu time spent up to now is 130.9 secs Computing kpt #: 225 total cpu time spent up to now is 131.4 secs Computing kpt #: 226 total cpu time spent up to now is 132.4 secs Computing kpt #: 227 total cpu time spent up to now is 132.9 secs Computing kpt #: 228 total cpu time spent up to now is 133.5 secs Computing kpt #: 229 total cpu time spent up to now is 134.0 secs Computing kpt #: 230 total cpu time spent up to now is 134.5 secs Computing kpt #: 231 total cpu time spent up to now is 135.1 secs Computing kpt #: 232 total cpu time spent up to now is 135.6 secs Computing kpt #: 233 total cpu time spent up to now is 136.1 secs Computing kpt #: 234 total cpu time spent up to now is 136.7 secs Computing kpt #: 235 total cpu time spent up to now is 137.2 secs Computing kpt #: 236 total cpu time spent up to now is 137.7 secs Computing kpt #: 237 total cpu time spent up to now is 138.2 secs Computing kpt #: 238 total cpu time spent up to now is 138.7 secs Computing kpt #: 239 total cpu time spent up to now is 139.2 secs Computing kpt #: 240 total cpu time spent up to now is 139.7 secs Computing kpt #: 241 total cpu time spent up to now is 140.3 secs Computing kpt #: 242 total cpu time spent up to now is 140.8 secs Computing kpt #: 243 total cpu time spent up to now is 141.3 secs Computing kpt #: 244 total cpu time spent up to now is 141.8 secs Computing kpt #: 245 total cpu time spent up to now is 142.4 secs Computing kpt #: 246 total cpu time spent up to now is 142.9 secs Computing kpt #: 247 total cpu time spent up to now is 143.4 secs Computing kpt #: 248 total cpu time spent up to now is 143.9 secs Computing kpt #: 249 total cpu time spent up to now is 144.4 secs Computing kpt #: 250 total cpu time spent up to now is 145.0 secs Computing kpt #: 251 total cpu time spent up to now is 145.5 secs Computing kpt #: 252 total cpu time spent up to now is 146.0 secs Computing kpt #: 253 total cpu time spent up to now is 146.6 secs Computing kpt #: 254 total cpu time spent up to now is 147.1 secs Computing kpt #: 255 total cpu time spent up to now is 147.7 secs Computing kpt #: 256 total cpu time spent up to now is 148.3 secs Computing kpt #: 257 total cpu time spent up to now is 148.8 secs Computing kpt #: 258 total cpu time spent up to now is 149.4 secs Computing kpt #: 259 total cpu time spent up to now is 149.9 secs Computing kpt #: 260 total cpu time spent up to now is 150.5 secs Computing kpt #: 261 total cpu time spent up to now is 151.0 secs Computing kpt #: 262 total cpu time spent up to now is 151.5 secs Computing kpt #: 263 total cpu time spent up to now is 152.1 secs Computing kpt #: 264 total cpu time spent up to now is 152.6 secs Computing kpt #: 265 total cpu time spent up to now is 153.3 secs Computing kpt #: 266 total cpu time spent up to now is 153.8 secs Computing kpt #: 267 total cpu time spent up to now is 154.4 secs Computing kpt #: 268 total cpu time spent up to now is 154.9 secs Computing kpt #: 269 total cpu time spent up to now is 155.4 secs Computing kpt #: 270 total cpu time spent up to now is 156.0 secs Computing kpt #: 271 total cpu time spent up to now is 156.5 secs Computing kpt #: 272 total cpu time spent up to now is 157.0 secs Computing kpt #: 273 total cpu time spent up to now is 157.6 secs Computing kpt #: 274 total cpu time spent up to now is 158.1 secs Computing kpt #: 275 total cpu time spent up to now is 158.7 secs Computing kpt #: 276 total cpu time spent up to now is 159.2 secs Computing kpt #: 277 total cpu time spent up to now is 159.8 secs Computing kpt #: 278 total cpu time spent up to now is 160.3 secs Computing kpt #: 279 total cpu time spent up to now is 160.8 secs Computing kpt #: 280 total cpu time spent up to now is 161.4 secs Computing kpt #: 281 total cpu time spent up to now is 162.0 secs Computing kpt #: 282 total cpu time spent up to now is 162.7 secs Computing kpt #: 283 total cpu time spent up to now is 163.3 secs Computing kpt #: 284 total cpu time spent up to now is 164.0 secs Computing kpt #: 285 total cpu time spent up to now is 164.6 secs Computing kpt #: 286 total cpu time spent up to now is 165.3 secs Computing kpt #: 287 total cpu time spent up to now is 166.0 secs Computing kpt #: 288 total cpu time spent up to now is 166.6 secs Computing kpt #: 289 total cpu time spent up to now is 167.3 secs Computing kpt #: 290 total cpu time spent up to now is 168.0 secs Computing kpt #: 291 total cpu time spent up to now is 168.6 secs Computing kpt #: 292 total cpu time spent up to now is 169.3 secs Computing kpt #: 293 total cpu time spent up to now is 170.0 secs Computing kpt #: 294 total cpu time spent up to now is 170.7 secs Computing kpt #: 295 total cpu time spent up to now is 171.2 secs Computing kpt #: 296 total cpu time spent up to now is 171.7 secs Computing kpt #: 297 total cpu time spent up to now is 172.2 secs Computing kpt #: 298 total cpu time spent up to now is 172.7 secs Computing kpt #: 299 total cpu time spent up to now is 173.2 secs Computing kpt #: 300 total cpu time spent up to now is 173.7 secs Computing kpt #: 301 total cpu time spent up to now is 174.2 secs Computing kpt #: 302 total cpu time spent up to now is 174.7 secs Computing kpt #: 303 total cpu time spent up to now is 175.3 secs Computing kpt #: 304 total cpu time spent up to now is 175.8 secs Computing kpt #: 305 total cpu time spent up to now is 176.3 secs Computing kpt #: 306 total cpu time spent up to now is 176.8 secs Computing kpt #: 307 total cpu time spent up to now is 177.3 secs ethr = 3.13E-08, avg # of iterations = 19.3 total cpu time spent up to now is 177.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3943 PWs) bands (ev): -26.4048 -26.4048 -26.3154 -26.3154 -9.5519 -9.5519 -9.0268 -9.0268 -8.5881 -8.5881 -7.9397 -7.9397 -7.8959 -7.8959 -7.8392 -7.8392 -7.8305 -7.8305 -2.9253 -2.9253 2.9198 2.9198 4.4707 4.4707 4.7917 4.7917 6.7036 6.7036 7.3242 7.3242 7.3488 7.3488 9.4524 9.4524 11.0886 11.0886 11.8206 11.8206 11.8392 11.8392 k = 0.0106-0.0185-0.0112 ( 3948 PWs) bands (ev): -26.4047 -26.4047 -26.3153 -26.3153 -9.5516 -9.5516 -9.0272 -9.0272 -8.5881 -8.5881 -7.9404 -7.9404 -7.8969 -7.8969 -7.8500 -7.8500 -7.8186 -7.8186 -2.9251 -2.9251 2.9203 2.9203 4.4691 4.4691 4.7900 4.7900 6.7041 6.7041 7.3226 7.3226 7.3474 7.3474 9.4582 9.4582 11.0920 11.0920 11.8169 11.8169 11.8380 11.8380 k = 0.0213-0.0370-0.0224 ( 3952 PWs) bands (ev): -26.4045 -26.4045 -26.3153 -26.3153 -9.5506 -9.5506 -9.0283 -9.0283 -8.5883 -8.5883 -7.9425 -7.9425 -7.9004 -7.9004 -7.8620 -7.8620 -7.8029 -7.8029 -2.9245 -2.9245 2.9221 2.9221 4.4644 4.4644 4.7849 4.7849 6.7056 6.7056 7.3170 7.3170 7.3442 7.3442 9.4754 9.4754 11.1022 11.1022 11.7993 11.7993 11.8418 11.8418 k = 0.0319-0.0555-0.0336 ( 3944 PWs) bands (ev): -26.4042 -26.4042 -26.3152 -26.3152 -9.5491 -9.5491 -9.0301 -9.0301 -8.5887 -8.5887 -7.9462 -7.9462 -7.9078 -7.9078 -7.8701 -7.8701 -7.7870 -7.7870 -2.9234 -2.9234 2.9251 2.9251 4.4564 4.4564 4.7766 4.7766 6.7080 6.7080 7.3052 7.3052 7.3417 7.3417 9.5035 9.5035 11.1189 11.1189 11.7672 11.7672 11.8528 11.8528 k = 0.0426-0.0740-0.0448 ( 3945 PWs) bands (ev): -26.4038 -26.4038 -26.3151 -26.3151 -9.5469 -9.5469 -9.0327 -9.0327 -8.5891 -8.5891 -7.9516 -7.9516 -7.9186 -7.9186 -7.8741 -7.8741 -7.7712 -7.7712 -2.9220 -2.9220 2.9291 2.9291 4.4449 4.4449 4.7654 4.7654 6.7115 6.7115 7.2872 7.2872 7.3408 7.3408 9.5416 9.5416 11.1417 11.1417 11.7248 11.7248 11.8693 11.8693 k = 0.0532-0.0926-0.0560 ( 3948 PWs) bands (ev): -26.4033 -26.4033 -26.3150 -26.3150 -9.5442 -9.5442 -9.0360 -9.0360 -8.5897 -8.5897 -7.9594 -7.9594 -7.9303 -7.9303 -7.8758 -7.8758 -7.7557 -7.7557 -2.9201 -2.9201 2.9343 2.9343 4.4297 4.4297 4.7518 4.7518 6.7159 6.7159 7.2645 7.2645 7.3409 7.3409 9.5888 9.5888 11.1698 11.1698 11.6755 11.6755 11.8907 11.8907 k = 0.0638-0.1111-0.0672 ( 3952 PWs) bands (ev): -26.4026 -26.4026 -26.3149 -26.3149 -9.5409 -9.5409 -9.0400 -9.0400 -8.5904 -8.5904 -7.9702 -7.9702 -7.9410 -7.9410 -7.8764 -7.8764 -7.7407 -7.7407 -2.9179 -2.9179 2.9404 2.9404 4.4105 4.4105 4.7361 4.7361 6.7214 6.7214 7.2385 7.2385 7.3417 7.3417 9.6438 9.6438 11.2015 11.2015 11.6227 11.6227 11.9168 11.9168 k = 0.0745-0.1296-0.0784 ( 3952 PWs) bands (ev): -26.4019 -26.4019 -26.3147 -26.3147 -9.5371 -9.5371 -9.0446 -9.0446 -8.5912 -8.5912 -7.9837 -7.9837 -7.9501 -7.9501 -7.8765 -7.8765 -7.7261 -7.7261 -2.9153 -2.9153 2.9474 2.9474 4.3871 4.3871 4.7189 4.7189 6.7278 6.7278 7.2102 7.2102 7.3430 7.3430 9.7054 9.7054 11.2338 11.2338 11.5712 11.5712 11.9476 11.9476 k = 0.0851-0.1481-0.0896 ( 3949 PWs) bands (ev): -26.4010 -26.4010 -26.3145 -26.3145 -9.5327 -9.5327 -9.0500 -9.0500 -8.5921 -8.5921 -7.9990 -7.9990 -7.9582 -7.9582 -7.8764 -7.8764 -7.7120 -7.7120 -2.9123 -2.9123 2.9553 2.9553 4.3591 4.3591 4.7008 4.7008 6.7354 6.7354 7.1806 7.1806 7.3446 7.3446 9.7726 9.7726 11.2599 11.2599 11.5286 11.5286 11.9828 11.9828 k = 0.0957-0.1666-0.1008 ( 3947 PWs) bands (ev): -26.4000 -26.4000 -26.3143 -26.3143 -9.5279 -9.5279 -9.0559 -9.0559 -8.5930 -8.5930 -8.0151 -8.0151 -7.9660 -7.9660 -7.8764 -7.8764 -7.6985 -7.6985 -2.9089 -2.9089 2.9640 2.9640 4.3266 4.3266 4.6822 4.6822 6.7441 6.7441 7.1507 7.1507 7.3466 7.3466 9.8443 9.8443 11.2668 11.2668 11.5085 11.5085 12.0223 12.0223 k = 0.1064-0.1851-0.1120 ( 3953 PWs) bands (ev): -26.3990 -26.3990 -26.3140 -26.3140 -9.5226 -9.5226 -9.0625 -9.0625 -8.5939 -8.5939 -8.0316 -8.0316 -7.9737 -7.9737 -7.8764 -7.8764 -7.6857 -7.6857 -2.9052 -2.9052 2.9732 2.9732 4.2894 4.2894 4.6635 4.6635 6.7538 6.7538 7.1210 7.1210 7.3489 7.3489 9.9194 9.9194 11.2443 11.2443 11.5214 11.5214 12.0660 12.0660 k = 0.1170-0.2036-0.1231 ( 3949 PWs) bands (ev): -26.3978 -26.3978 -26.3138 -26.3138 -9.5170 -9.5170 -9.0697 -9.0697 -8.5948 -8.5948 -8.0481 -8.0481 -7.9815 -7.9815 -7.8766 -7.8766 -7.6736 -7.6736 -2.9012 -2.9012 2.9830 2.9830 4.2478 4.2478 4.6449 4.6449 6.7648 6.7648 7.0921 7.0921 7.3514 7.3514 9.9971 9.9971 11.1994 11.1994 11.5600 11.5600 12.1136 12.1136 k = 0.1277-0.2221-0.1343 ( 3946 PWs) bands (ev): -26.3965 -26.3965 -26.3135 -26.3135 -9.5110 -9.5110 -9.0774 -9.0774 -8.5958 -8.5958 -8.0645 -8.0645 -7.9895 -7.9895 -7.8769 -7.8769 -7.6622 -7.6622 -2.8969 -2.8969 2.9932 2.9932 4.2020 4.2020 4.6266 4.6266 6.7770 6.7770 7.0643 7.0643 7.3542 7.3542 10.0765 10.0765 11.1442 11.1442 11.6117 11.6117 12.1650 12.1650 k = 0.1383-0.2406-0.1455 ( 3948 PWs) bands (ev): -26.3951 -26.3951 -26.3132 -26.3132 -9.5046 -9.5046 -9.0856 -9.0856 -8.5966 -8.5966 -8.0807 -8.0807 -7.9976 -7.9976 -7.8774 -7.8774 -7.6514 -7.6514 -2.8923 -2.8923 3.0038 3.0038 4.1524 4.1524 4.6087 4.6087 6.7905 6.7905 7.0379 7.0379 7.3572 7.3572 10.1569 10.1569 11.0851 11.0851 11.6692 11.6692 12.2198 12.2198 k = 0.1489-0.2592-0.1567 ( 3948 PWs) bands (ev): -26.3937 -26.3937 -26.3130 -26.3130 -9.4981 -9.4981 -9.0943 -9.0943 -8.5974 -8.5974 -8.0966 -8.0966 -8.0060 -8.0060 -7.8781 -7.8781 -7.6415 -7.6415 -2.8874 -2.8874 3.0145 3.0145 4.0995 4.0995 4.5910 4.5910 6.8052 6.8052 7.0131 7.0131 7.3605 7.3605 10.2375 10.2375 11.0253 11.0253 11.7280 11.7280 12.2778 12.2778 k = 0.1596-0.2777-0.1679 ( 3947 PWs) bands (ev): -26.3922 -26.3922 -26.3127 -26.3127 -9.4913 -9.4913 -9.1035 -9.1035 -8.5980 -8.5980 -8.1121 -8.1121 -8.0145 -8.0145 -7.8790 -7.8790 -7.6323 -7.6323 -2.8824 -2.8824 3.0253 3.0253 4.0439 4.0439 4.5738 4.5738 6.8211 6.8211 6.9900 6.9900 7.3639 7.3639 10.3175 10.3175 10.9665 10.9665 11.7850 11.7850 12.3386 12.3386 k = 0.1702-0.2962-0.1791 ( 3947 PWs) bands (ev): -26.3905 -26.3905 -26.3124 -26.3124 -9.4844 -9.4844 -9.1130 -9.1130 -8.5985 -8.5985 -8.1272 -8.1272 -8.0232 -8.0232 -7.8800 -7.8800 -7.6238 -7.6238 -2.8772 -2.8772 3.0360 3.0360 3.9861 3.9861 4.5568 4.5568 6.8380 6.8380 6.9686 6.9686 7.3676 7.3676 10.3961 10.3961 10.9101 10.9101 11.8374 11.8374 12.4017 12.4017 k = 0.1809-0.3147-0.1903 ( 3943 PWs) bands (ev): -26.3889 -26.3889 -26.3121 -26.3121 -9.4775 -9.4775 -9.1229 -9.1229 -8.5988 -8.5988 -8.1418 -8.1418 -8.0319 -8.0319 -7.8811 -7.8811 -7.6162 -7.6162 -2.8718 -2.8718 3.0467 3.0467 3.9267 3.9267 4.5400 4.5400 6.8553 6.8553 6.9496 6.9496 7.3714 7.3714 10.4717 10.4717 10.8575 10.8575 11.8833 11.8833 12.4144 12.4144 k = 0.1915-0.3332-0.2015 ( 3943 PWs) bands (ev): -26.3871 -26.3871 -26.3118 -26.3118 -9.4705 -9.4705 -9.1331 -9.1331 -8.5988 -8.5988 -8.1560 -8.1560 -8.0408 -8.0408 -7.8825 -7.8825 -7.6093 -7.6093 -2.8663 -2.8663 3.0570 3.0570 3.8662 3.8662 4.5234 4.5234 6.8708 6.8708 6.9349 6.9349 7.3753 7.3753 10.5412 10.5412 10.8117 10.8117 11.9212 11.9212 12.3712 12.3712 k = 0.2021-0.3517-0.2127 ( 3943 PWs) bands (ev): -26.3853 -26.3853 -26.3115 -26.3115 -9.4635 -9.4635 -9.1436 -9.1436 -8.5985 -8.5985 -8.1697 -8.1697 -8.0496 -8.0496 -7.8839 -7.8839 -7.6031 -7.6031 -2.8607 -2.8607 3.0668 3.0668 3.8053 3.8053 4.5070 4.5070 6.8779 6.8779 6.9310 6.9310 7.3794 7.3794 10.5959 10.5959 10.7813 10.7813 11.9506 11.9506 12.3226 12.3226 k = 0.2128-0.3702-0.2239 ( 3935 PWs) bands (ev): -26.3834 -26.3834 -26.3112 -26.3112 -9.4567 -9.4567 -9.1543 -9.1543 -8.5980 -8.5980 -8.1828 -8.1828 -8.0585 -8.0585 -7.8855 -7.8855 -7.5977 -7.5977 -2.8551 -2.8551 3.0760 3.0760 3.7445 3.7445 4.4908 4.4908 6.8709 6.8709 6.9432 6.9432 7.3835 7.3835 10.6156 10.6156 10.7860 10.7860 11.9722 11.9722 12.2721 12.2721 k = 0.2234-0.3887-0.2351 ( 3932 PWs) bands (ev): -26.3815 -26.3815 -26.3110 -26.3110 -9.4500 -9.4500 -9.1651 -9.1651 -8.5970 -8.5970 -8.1954 -8.1954 -8.0674 -8.0674 -7.8871 -7.8871 -7.5931 -7.5931 -2.8496 -2.8496 3.0844 3.0844 3.6844 3.6844 4.4748 4.4748 6.8566 6.8566 6.9644 6.9644 7.3876 7.3876 10.5975 10.5975 10.8284 10.8284 11.9869 11.9869 12.2218 12.2218 k = 0.2340-0.4072-0.2463 ( 3930 PWs) bands (ev): -26.3796 -26.3796 -26.3107 -26.3107 -9.4435 -9.4435 -9.1761 -9.1761 -8.5958 -8.5958 -8.2074 -8.2074 -8.0762 -8.0762 -7.8889 -7.8889 -7.5892 -7.5892 -2.8441 -2.8441 3.0915 3.0915 3.6259 3.6259 4.4590 4.4590 6.8401 6.8401 6.9893 6.9893 7.3918 7.3918 10.5643 10.5643 10.8851 10.8851 11.9957 11.9957 12.1735 12.1735 k = 0.2447-0.4258-0.2575 ( 3928 PWs) bands (ev): -26.3776 -26.3776 -26.3105 -26.3105 -9.4373 -9.4373 -9.1871 -9.1871 -8.5941 -8.5941 -8.2189 -8.2189 -8.0849 -8.0849 -7.8907 -7.8907 -7.5859 -7.5859 -2.8386 -2.8386 3.0970 3.0970 3.5696 3.5696 4.4434 4.4434 6.8225 6.8225 7.0161 7.0161 7.3960 7.3960 10.5277 10.5277 10.9440 10.9440 11.9984 11.9984 12.1296 12.1296 k = 0.2553-0.4443-0.2687 ( 3929 PWs) bands (ev): -26.3755 -26.3755 -26.3103 -26.3103 -9.4315 -9.4315 -9.1981 -9.1981 -8.5920 -8.5920 -8.2298 -8.2298 -8.0936 -8.0936 -7.8926 -7.8926 -7.5834 -7.5834 -2.8333 -2.8333 3.1000 3.1000 3.5165 3.5165 4.4281 4.4281 6.8044 6.8044 7.0442 7.0442 7.4001 7.4001 10.4913 10.4913 11.0009 11.0009 11.9928 11.9928 12.0943 12.0943 k = 0.2660-0.4628-0.2799 ( 3923 PWs) bands (ev): -26.3735 -26.3735 -26.3101 -26.3101 -9.4259 -9.4259 -9.2091 -9.2091 -8.5895 -8.5895 -8.2401 -8.2401 -8.1020 -8.1020 -7.8946 -7.8946 -7.5815 -7.5815 -2.8282 -2.8282 3.0998 3.0998 3.4680 3.4680 4.4131 4.4131 6.7857 6.7857 7.0732 7.0732 7.4042 7.4042 10.4563 10.4563 11.0541 11.0541 11.9752 11.9752 12.0729 12.0729 k = 0.2766-0.4813-0.2911 ( 3925 PWs) bands (ev): -26.3714 -26.3714 -26.3100 -26.3100 -9.4208 -9.4208 -9.2200 -9.2200 -8.5866 -8.5866 -8.2498 -8.2498 -8.1103 -8.1103 -7.8966 -7.8966 -7.5802 -7.5802 -2.8232 -2.8232 3.0950 3.0950 3.4255 3.4255 4.3984 4.3984 6.7665 6.7665 7.1028 7.1028 7.4082 7.4082 10.4231 10.4231 11.1023 11.1023 11.9471 11.9471 12.0651 12.0651 k = 0.2872-0.4998-0.3023 ( 3928 PWs) bands (ev): -26.3694 -26.3694 -26.3098 -26.3098 -9.4160 -9.4160 -9.2307 -9.2307 -8.5832 -8.5832 -8.2589 -8.2589 -8.1184 -8.1184 -7.8986 -7.8986 -7.5794 -7.5794 -2.8185 -2.8185 3.0842 3.0842 3.3906 3.3906 4.3840 4.3840 6.7468 6.7468 7.1325 7.1325 7.4121 7.4121 10.3919 10.3919 11.1448 11.1448 11.9156 11.9156 12.0650 12.0650 k = 0.2979-0.5183-0.3135 ( 3926 PWs) bands (ev): -26.3673 -26.3673 -26.3098 -26.3098 -9.4116 -9.4116 -9.2413 -9.2413 -8.5795 -8.5795 -8.2673 -8.2673 -8.1263 -8.1263 -7.9006 -7.9006 -7.5792 -7.5792 -2.8141 -2.8141 3.0666 3.0666 3.3644 3.3644 4.3701 4.3701 6.7265 6.7265 7.1621 7.1621 7.4158 7.4158 10.3628 10.3628 11.1809 11.1809 11.8855 11.8855 12.0690 12.0690 k = 0.3085-0.5368-0.3247 ( 3922 PWs) bands (ev): -26.3653 -26.3653 -26.3097 -26.3097 -9.4077 -9.4077 -9.2516 -9.2516 -8.5755 -8.5755 -8.2752 -8.2752 -8.1339 -8.1339 -7.9026 -7.9026 -7.5795 -7.5795 -2.8099 -2.8099 3.0423 3.0423 3.3471 3.3471 4.3566 4.3566 6.7057 6.7057 7.1913 7.1913 7.4195 7.4195 10.3358 10.3358 11.2100 11.2100 11.8591 11.8591 12.0754 12.0754 k = 0.3191-0.5553-0.3359 ( 3927 PWs) bands (ev): -26.3632 -26.3632 -26.3097 -26.3097 -9.4042 -9.4042 -9.2617 -9.2617 -8.5711 -8.5711 -8.2825 -8.2825 -8.1412 -8.1412 -7.9046 -7.9046 -7.5802 -7.5802 -2.8060 -2.8060 3.0125 3.0125 3.3374 3.3374 4.3436 4.3436 6.6845 6.6845 7.2199 7.2199 7.4230 7.4230 10.3107 10.3107 11.2318 11.2318 11.8379 11.8379 12.0837 12.0837 k = 0.3298-0.5738-0.3471 ( 3925 PWs) bands (ev): -26.3612 -26.3612 -26.3097 -26.3097 -9.4011 -9.4011 -9.2715 -9.2715 -8.5666 -8.5666 -8.2891 -8.2891 -8.1482 -8.1482 -7.9066 -7.9066 -7.5813 -7.5813 -2.8023 -2.8023 2.9790 2.9790 3.3337 3.3337 4.3312 4.3312 6.6630 6.6630 7.2475 7.2475 7.4263 7.4263 10.2876 10.2876 11.2462 11.2462 11.8224 11.8224 12.0938 12.0938 k = 0.3404-0.5924-0.3582 ( 3917 PWs) bands (ev): -26.3592 -26.3592 -26.3098 -26.3098 -9.3983 -9.3983 -9.2810 -9.2810 -8.5618 -8.5618 -8.2950 -8.2950 -8.1550 -8.1550 -7.9085 -7.9085 -7.5828 -7.5828 -2.7990 -2.7990 2.9437 2.9437 3.3343 3.3343 4.3193 4.3193 6.6414 6.6414 7.2738 7.2738 7.4296 7.4296 10.2663 10.2663 11.2535 11.2535 11.8130 11.8130 12.1056 12.1056 k = 0.3511-0.6109-0.3694 ( 3915 PWs) bands (ev): -26.3573 -26.3573 -26.3099 -26.3099 -9.3959 -9.3959 -9.2901 -9.2901 -8.5569 -8.5569 -8.3004 -8.3004 -8.1614 -8.1614 -7.9103 -7.9103 -7.5845 -7.5845 -2.7960 -2.7960 2.9080 2.9080 3.3377 3.3377 4.3080 4.3080 6.6196 6.6196 7.2988 7.2988 7.4327 7.4327 10.2468 10.2468 11.2544 11.2544 11.8094 11.8094 12.1191 12.1191 k = 0.3617-0.6294-0.3806 ( 3909 PWs) bands (ev): -26.3554 -26.3554 -26.3100 -26.3100 -9.3938 -9.3938 -9.2988 -9.2988 -8.5521 -8.5521 -8.3051 -8.3051 -8.1674 -8.1674 -7.9121 -7.9121 -7.5865 -7.5865 -2.7933 -2.7933 2.8729 2.8729 3.3431 3.3431 4.2974 4.2974 6.5980 6.5980 7.3220 7.3220 7.4358 7.4358 10.2289 10.2289 11.2498 11.2498 11.8109 11.8109 12.1344 12.1344 k = 0.3723-0.6479-0.3918 ( 3914 PWs) bands (ev): -26.3536 -26.3536 -26.3102 -26.3102 -9.3920 -9.3920 -9.3071 -9.3071 -8.5472 -8.5472 -8.3093 -8.3093 -8.1731 -8.1731 -7.9138 -7.9138 -7.5887 -7.5887 -2.7909 -2.7909 2.8391 2.8391 3.3497 3.3497 4.2875 4.2875 6.5768 6.5768 7.3434 7.3434 7.4389 7.4389 10.2127 10.2127 11.2411 11.2411 11.8167 11.8167 12.1513 12.1513 k = 0.3830-0.6664-0.4030 ( 3918 PWs) bands (ev): -26.3518 -26.3518 -26.3104 -26.3104 -9.3904 -9.3904 -9.3150 -9.3150 -8.5425 -8.5425 -8.3128 -8.3128 -8.1784 -8.1784 -7.9155 -7.9155 -7.5909 -7.5909 -2.7888 -2.7888 2.8070 2.8070 3.3571 3.3571 4.2782 4.2782 6.5560 6.5560 7.3628 7.3628 7.4420 7.4420 10.1980 10.1980 11.2294 11.2294 11.8257 11.8257 12.1698 12.1698 k = 0.3936-0.6849-0.4142 ( 3920 PWs) bands (ev): -26.3501 -26.3501 -26.3106 -26.3106 -9.3889 -9.3889 -9.3225 -9.3225 -8.5380 -8.5380 -8.3157 -8.3157 -8.1834 -8.1834 -7.9170 -7.9170 -7.5933 -7.5933 -2.7870 -2.7870 2.7771 2.7771 3.3648 3.3648 4.2698 4.2698 6.5361 6.5361 7.3798 7.3798 7.4454 7.4454 10.1848 10.1848 11.2160 11.2160 11.8372 11.8372 12.1894 12.1894 k = 0.4043-0.7034-0.4254 ( 3918 PWs) bands (ev): -26.3486 -26.3486 -26.3109 -26.3109 -9.3876 -9.3876 -9.3295 -9.3295 -8.5338 -8.5338 -8.3181 -8.3181 -8.1879 -8.1879 -7.9184 -7.9184 -7.5956 -7.5956 -2.7854 -2.7854 2.7496 2.7496 3.3725 3.3725 4.2620 4.2620 6.5171 6.5171 7.3945 7.3945 7.4491 7.4491 10.1730 10.1730 11.2017 11.2017 11.8502 11.8502 12.2099 12.2099 k = 0.4149-0.7219-0.4366 ( 3918 PWs) bands (ev): -26.3471 -26.3471 -26.3112 -26.3112 -9.3863 -9.3863 -9.3360 -9.3360 -8.5299 -8.5299 -8.3200 -8.3200 -8.1920 -8.1920 -7.9197 -7.9197 -7.5979 -7.5979 -2.7841 -2.7841 2.7247 2.7247 3.3800 3.3800 4.2551 4.2551 6.4994 6.4994 7.4065 7.4065 7.4533 7.4533 10.1625 10.1625 11.1873 11.1873 11.8640 11.8640 12.2308 12.2308 k = 0.4255-0.7404-0.4478 ( 3917 PWs) bands (ev): -26.3457 -26.3457 -26.3114 -26.3114 -9.3850 -9.3850 -9.3420 -9.3420 -8.5264 -8.5264 -8.3214 -8.3214 -8.1957 -8.1957 -7.9209 -7.9209 -7.6000 -7.6000 -2.7829 -2.7829 2.7024 2.7024 3.3872 3.3872 4.2489 4.2489 6.4831 6.4831 7.4157 7.4157 7.4582 7.4582 10.1534 10.1534 11.1734 11.1734 11.8779 11.8779 12.2514 12.2514 k = 0.4362-0.7590-0.4590 ( 3920 PWs) bands (ev): -26.3445 -26.3445 -26.3117 -26.3117 -9.3837 -9.3837 -9.3476 -9.3476 -8.5234 -8.5234 -8.3225 -8.3225 -8.1989 -8.1989 -7.9219 -7.9219 -7.6020 -7.6020 -2.7820 -2.7820 2.6830 2.6830 3.3937 3.3937 4.2436 4.2436 6.4684 6.4684 7.4225 7.4225 7.4636 7.4636 10.1456 10.1456 11.1606 11.1606 11.8913 11.8913 12.2711 12.2711 k = 0.4468-0.7775-0.4702 ( 3918 PWs) bands (ev): -26.3434 -26.3434 -26.3120 -26.3120 -9.3823 -9.3823 -9.3528 -9.3528 -8.5207 -8.5207 -8.3232 -8.3232 -8.2017 -8.2017 -7.9228 -7.9228 -7.6038 -7.6038 -2.7812 -2.7812 2.6665 2.6665 3.3995 3.3995 4.2391 4.2391 6.4556 6.4556 7.4273 7.4273 7.4690 7.4690 10.1391 10.1391 11.1492 11.1492 11.9037 11.9037 12.2893 12.2893 k = 0.4574-0.7960-0.4814 ( 3917 PWs) bands (ev): -26.3425 -26.3425 -26.3122 -26.3122 -9.3807 -9.3807 -9.3574 -9.3574 -8.5186 -8.5186 -8.3237 -8.3237 -8.2040 -8.2040 -7.9236 -7.9236 -7.6053 -7.6053 -2.7807 -2.7807 2.6529 2.6529 3.4044 3.4044 4.2353 4.2353 6.4449 6.4449 7.4305 7.4305 7.4739 7.4739 10.1337 10.1337 11.1396 11.1396 11.9146 11.9146 12.3054 12.3054 k = 0.4681-0.8145-0.4926 ( 3919 PWs) bands (ev): -26.3418 -26.3418 -26.3124 -26.3124 -9.3789 -9.3789 -9.3616 -9.3616 -8.5169 -8.5169 -8.3239 -8.3239 -8.2058 -8.2058 -7.9242 -7.9242 -7.6065 -7.6065 -2.7802 -2.7802 2.6423 2.6423 3.4084 3.4084 4.2324 4.2324 6.4364 6.4364 7.4327 7.4327 7.4781 7.4781 10.1296 10.1296 11.1318 11.1318 11.9235 11.9235 12.3186 12.3186 k = 0.4787-0.8330-0.5038 ( 3921 PWs) bands (ev): -26.3413 -26.3413 -26.3126 -26.3126 -9.3768 -9.3768 -9.3654 -9.3654 -8.5157 -8.5157 -8.3241 -8.3241 -8.2071 -8.2071 -7.9246 -7.9246 -7.6074 -7.6074 -2.7799 -2.7799 2.6347 2.6347 3.4113 3.4113 4.2304 4.2304 6.4302 6.4302 7.4341 7.4341 7.4811 7.4811 10.1267 10.1267 11.1262 11.1262 11.9301 11.9301 12.3284 12.3284 k = 0.4894-0.8515-0.5150 ( 3923 PWs) bands (ev): -26.3410 -26.3410 -26.3127 -26.3127 -9.3745 -9.3745 -9.3688 -9.3688 -8.5150 -8.5150 -8.3242 -8.3242 -8.2079 -8.2079 -7.9248 -7.9248 -7.6080 -7.6080 -2.7797 -2.7797 2.6301 2.6301 3.4130 3.4130 4.2291 4.2291 6.4265 6.4265 7.4349 7.4349 7.4830 7.4830 10.1249 10.1249 11.1228 11.1228 11.9342 11.9342 12.3345 12.3345 k = 0.5000-0.8700-0.5262 ( 3916 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3723 -9.3723 -9.3714 -9.3714 -8.5148 -8.5148 -8.3242 -8.3242 -8.2082 -8.2082 -7.9249 -7.9249 -7.6081 -7.6081 -2.7797 -2.7797 2.6286 2.6286 3.4136 3.4136 4.2287 4.2287 6.4252 6.4252 7.4352 7.4352 7.4837 7.4837 10.1243 10.1243 11.1217 11.1217 11.9356 11.9356 12.3366 12.3366 k = 0.5000-0.8700-0.5262 ( 3916 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3723 -9.3723 -9.3714 -9.3714 -8.5148 -8.5148 -8.3242 -8.3242 -8.2082 -8.2082 -7.9249 -7.9249 -7.6081 -7.6081 -2.7797 -2.7797 2.6286 2.6286 3.4136 3.4136 4.2287 4.2287 6.4252 6.4252 7.4352 7.4352 7.4837 7.4837 10.1243 10.1243 11.1217 11.1217 11.9356 11.9356 12.3366 12.3366 k = 0.5000-0.8578-0.5464 ( 3914 PWs) bands (ev): -26.3408 -26.3408 -26.3127 -26.3127 -9.3726 -9.3726 -9.3710 -9.3710 -8.5146 -8.5146 -8.3244 -8.3244 -8.2082 -8.2082 -7.9254 -7.9254 -7.6080 -7.6080 -2.7795 -2.7795 2.6292 2.6292 3.4135 3.4135 4.2262 4.2262 6.4267 6.4267 7.4350 7.4350 7.4836 7.4836 10.1265 10.1265 11.1256 11.1256 11.9332 11.9332 12.3377 12.3377 k = 0.5000-0.8456-0.5666 ( 3914 PWs) bands (ev): -26.3407 -26.3407 -26.3128 -26.3128 -9.3730 -9.3730 -9.3703 -9.3703 -8.5142 -8.5142 -8.3251 -8.3251 -8.2082 -8.2082 -7.9268 -7.9268 -7.6075 -7.6075 -2.7790 -2.7790 2.6311 2.6311 3.4133 3.4133 4.2186 4.2186 6.4312 6.4312 7.4344 7.4344 7.4835 7.4835 10.1329 10.1329 11.1373 11.1373 11.9258 11.9258 12.3412 12.3412 k = 0.5000-0.8333-0.5869 ( 3916 PWs) bands (ev): -26.3406 -26.3406 -26.3128 -26.3128 -9.3734 -9.3734 -9.3695 -9.3695 -8.5135 -8.5135 -8.3263 -8.3263 -8.2083 -8.2083 -7.9290 -7.9290 -7.6067 -7.6067 -2.7781 -2.7781 2.6342 2.6342 3.4129 3.4129 4.2060 4.2060 6.4387 6.4387 7.4333 7.4333 7.4833 7.4833 10.1435 10.1435 11.1567 11.1567 11.9136 11.9136 12.3472 12.3472 k = 0.5000-0.8211-0.6071 ( 3920 PWs) bands (ev): -26.3403 -26.3403 -26.3129 -26.3129 -9.3737 -9.3737 -9.3686 -9.3686 -8.5125 -8.5125 -8.3278 -8.3278 -8.2085 -8.2085 -7.9321 -7.9321 -7.6057 -7.6057 -2.7769 -2.7769 2.6386 2.6386 3.4123 3.4123 4.1887 4.1887 6.4490 6.4490 7.4317 7.4317 7.4830 7.4830 10.1584 10.1584 11.1833 11.1833 11.8967 11.8967 12.3560 12.3560 k = 0.5000-0.8089-0.6273 ( 3922 PWs) bands (ev): -26.3401 -26.3401 -26.3129 -26.3129 -9.3739 -9.3739 -9.3676 -9.3676 -8.5113 -8.5113 -8.3297 -8.3297 -8.2086 -8.2086 -7.9360 -7.9360 -7.6045 -7.6045 -2.7754 -2.7754 2.6443 2.6443 3.4117 3.4117 4.1669 4.1669 6.4622 6.4622 7.4296 7.4296 7.4826 7.4826 10.1775 10.1775 11.2166 11.2166 11.8753 11.8753 12.3681 12.3681 k = 0.5000-0.7966-0.6475 ( 3922 PWs) bands (ev): -26.3397 -26.3397 -26.3130 -26.3130 -9.3741 -9.3741 -9.3666 -9.3666 -8.5099 -8.5099 -8.3319 -8.3319 -8.2088 -8.2088 -7.9406 -7.9406 -7.6031 -7.6031 -2.7737 -2.7737 2.6512 2.6512 3.4109 3.4109 4.1408 4.1408 6.4780 6.4780 7.4267 7.4267 7.4822 7.4822 10.2007 10.2007 11.2561 11.2561 11.8498 11.8498 12.3838 12.3838 k = 0.5000-0.7844-0.6678 ( 3910 PWs) bands (ev): -26.3393 -26.3393 -26.3131 -26.3131 -9.3741 -9.3741 -9.3655 -9.3655 -8.5084 -8.5084 -8.3343 -8.3343 -8.2091 -8.2091 -7.9457 -7.9457 -7.6016 -7.6016 -2.7717 -2.7717 2.6593 2.6593 3.4101 3.4101 4.1109 4.1109 6.4965 6.4965 7.4231 7.4231 7.4817 7.4817 10.2280 10.2280 11.3009 11.3009 11.8205 11.8205 12.4035 12.4035 k = 0.5000-0.7722-0.6880 ( 3910 PWs) bands (ev): -26.3388 -26.3388 -26.3133 -26.3133 -9.3741 -9.3741 -9.3644 -9.3644 -8.5069 -8.5069 -8.3368 -8.3368 -8.2093 -8.2093 -7.9513 -7.9513 -7.6002 -7.6002 -2.7694 -2.7694 2.6686 2.6686 3.4091 3.4091 4.0775 4.0775 6.5173 6.5173 7.4185 7.4185 7.4812 7.4812 10.2594 10.2594 11.3501 11.3501 11.7881 11.7881 12.4277 12.4277 k = 0.5000-0.7599-0.7082 ( 3914 PWs) bands (ev): -26.3383 -26.3383 -26.3134 -26.3134 -9.3741 -9.3741 -9.3633 -9.3633 -8.5053 -8.5053 -8.3394 -8.3394 -8.2095 -8.2095 -7.9574 -7.9574 -7.5987 -7.5987 -2.7670 -2.7670 2.6791 2.6791 3.4081 3.4081 4.0410 4.0410 6.5404 6.5404 7.4129 7.4129 7.4807 7.4807 10.2948 10.2948 11.4027 11.4027 11.7531 11.7531 12.4565 12.4565 k = 0.5000-0.7477-0.7285 ( 3912 PWs) bands (ev): -26.3377 -26.3377 -26.3136 -26.3136 -9.3740 -9.3740 -9.3622 -9.3622 -8.5038 -8.5038 -8.3419 -8.3419 -8.2097 -8.2097 -7.9637 -7.9637 -7.5974 -7.5974 -2.7644 -2.7644 2.6908 2.6908 3.4071 3.4071 4.0019 4.0019 6.5656 6.5656 7.4062 7.4062 7.4803 7.4803 10.3341 10.3341 11.4572 11.4572 11.7163 11.7163 12.4900 12.4900 k = 0.5000-0.7354-0.7487 ( 3916 PWs) bands (ev): -26.3371 -26.3371 -26.3138 -26.3138 -9.3739 -9.3739 -9.3611 -9.3611 -8.5025 -8.5025 -8.3442 -8.3442 -8.2099 -8.2099 -7.9703 -7.9703 -7.5963 -7.5963 -2.7618 -2.7618 2.7036 2.7036 3.4060 3.4060 3.9607 3.9607 6.5927 6.5927 7.3982 7.3982 7.4798 7.4798 10.3771 10.3771 11.5115 11.5115 11.6793 11.6793 12.5236 12.5236 k = 0.5000-0.7232-0.7689 ( 3912 PWs) bands (ev): -26.3364 -26.3364 -26.3141 -26.3141 -9.3738 -9.3738 -9.3601 -9.3601 -8.5014 -8.5014 -8.3462 -8.3462 -8.2099 -8.2099 -7.9770 -7.9770 -7.5953 -7.5953 -2.7590 -2.7590 2.7175 2.7175 3.4049 3.4049 3.9179 3.9179 6.6214 6.6214 7.3890 7.3890 7.4794 7.4794 10.4238 10.4238 11.5591 11.5591 11.6478 11.6478 12.4919 12.4919 k = 0.5000-0.7110-0.7892 ( 3914 PWs) bands (ev): -26.3357 -26.3357 -26.3143 -26.3143 -9.3736 -9.3736 -9.3591 -9.3591 -8.5006 -8.5006 -8.3478 -8.3478 -8.2098 -8.2098 -7.9836 -7.9836 -7.5947 -7.5947 -2.7563 -2.7563 2.7325 2.7325 3.4036 3.4036 3.8739 3.8739 6.6515 6.6515 7.3784 7.3784 7.4790 7.4790 10.4739 10.4739 11.5687 11.5687 11.6527 11.6527 12.4121 12.4121 k = 0.5000-0.6987-0.8094 ( 3916 PWs) bands (ev): -26.3349 -26.3349 -26.3146 -26.3146 -9.3734 -9.3734 -9.3582 -9.3582 -8.5002 -8.5002 -8.3490 -8.3490 -8.2095 -8.2095 -7.9903 -7.9903 -7.5943 -7.5943 -2.7535 -2.7535 2.7484 2.7484 3.4022 3.4022 3.8294 3.8294 6.6828 6.6828 7.3663 7.3663 7.4786 7.4786 10.5273 10.5273 11.5371 11.5371 11.6966 11.6966 12.3314 12.3314 k = 0.5000-0.6865-0.8296 ( 3916 PWs) bands (ev): -26.3341 -26.3341 -26.3150 -26.3150 -9.3733 -9.3733 -9.3575 -9.3575 -8.5003 -8.5003 -8.3497 -8.3497 -8.2090 -8.2090 -7.9968 -7.9968 -7.5943 -7.5943 -2.7508 -2.7508 2.7654 2.7654 3.4005 3.4005 3.7848 3.7848 6.7150 6.7150 7.3529 7.3529 7.4782 7.4782 10.5837 10.5837 11.4973 11.4973 11.7459 11.7459 12.2527 12.2527 k = 0.5000-0.6743-0.8498 ( 3920 PWs) bands (ev): -26.3333 -26.3333 -26.3153 -26.3153 -9.3732 -9.3732 -9.3568 -9.3568 -8.5008 -8.5008 -8.3499 -8.3499 -8.2082 -8.2082 -8.0031 -8.0031 -7.5947 -7.5947 -2.7483 -2.7483 2.7831 2.7831 3.3983 3.3983 3.7409 3.7409 6.7478 6.7478 7.3380 7.3380 7.4779 7.4779 10.6428 10.6428 11.4558 11.4558 11.7942 11.7942 12.1768 12.1768 k = 0.5000-0.6620-0.8701 ( 3922 PWs) bands (ev): -26.3324 -26.3324 -26.3157 -26.3157 -9.3730 -9.3730 -9.3563 -9.3563 -8.5018 -8.5018 -8.3496 -8.3496 -8.2069 -8.2069 -8.0091 -8.0091 -7.5955 -7.5955 -2.7458 -2.7458 2.8016 2.8016 3.3953 3.3953 3.6983 3.6983 6.7810 6.7810 7.3217 7.3217 7.4776 7.4776 10.7042 10.7042 11.4138 11.4138 11.8398 11.8398 12.1041 12.1041 k = 0.5000-0.6498-0.8903 ( 3918 PWs) bands (ev): -26.3315 -26.3315 -26.3162 -26.3162 -9.3729 -9.3729 -9.3559 -9.3559 -8.5031 -8.5031 -8.3489 -8.3489 -8.2053 -8.2053 -8.0148 -8.0148 -7.5967 -7.5967 -2.7435 -2.7435 2.8207 2.8207 3.3912 3.3912 3.6580 3.6580 6.8144 6.8144 7.3041 7.3041 7.4773 7.4773 10.7674 10.7674 11.3720 11.3720 11.8825 11.8825 12.0351 12.0351 k = 0.5000-0.6376-0.9105 ( 3922 PWs) bands (ev): -26.3306 -26.3306 -26.3167 -26.3167 -9.3729 -9.3729 -9.3558 -9.3558 -8.5048 -8.5048 -8.3478 -8.3478 -8.2031 -8.2031 -8.0201 -8.0201 -7.5983 -7.5983 -2.7414 -2.7414 2.8403 2.8403 3.3854 3.3854 3.6209 3.6209 6.8476 6.8476 7.2852 7.2852 7.4771 7.4771 10.8316 10.8316 11.3304 11.3304 11.9219 11.9219 11.9709 11.9709 k = 0.5000-0.6253-0.9308 ( 3926 PWs) bands (ev): -26.3297 -26.3297 -26.3172 -26.3172 -9.3728 -9.3728 -9.3558 -9.3558 -8.5068 -8.5068 -8.3464 -8.3464 -8.2003 -8.2003 -8.0250 -8.0250 -7.6004 -7.6004 -2.7395 -2.7395 2.8600 2.8600 3.3772 3.3772 3.5881 3.5881 6.8803 6.8803 7.2651 7.2651 7.4770 7.4770 10.8959 10.8959 11.2892 11.2892 11.9098 11.9098 11.9606 11.9606 k = 0.5000-0.6131-0.9510 ( 3928 PWs) bands (ev): -26.3287 -26.3287 -26.3178 -26.3178 -9.3728 -9.3728 -9.3559 -9.3559 -8.5090 -8.5090 -8.3448 -8.3448 -8.1970 -8.1970 -8.0294 -8.0294 -7.6029 -7.6029 -2.7378 -2.7378 2.8795 2.8795 3.3661 3.3661 3.5608 3.5608 6.9124 6.9124 7.2440 7.2440 7.4769 7.4769 10.9588 10.9588 11.2483 11.2483 11.8572 11.8572 11.9948 11.9948 k = 0.5000-0.6009-0.9712 ( 3930 PWs) bands (ev): -26.3278 -26.3278 -26.3184 -26.3184 -9.3728 -9.3728 -9.3563 -9.3563 -8.5114 -8.5114 -8.3432 -8.3432 -8.1931 -8.1931 -8.0333 -8.0333 -7.6058 -7.6058 -2.7364 -2.7364 2.8985 2.8985 3.3520 3.3520 3.5397 3.5397 6.9435 6.9435 7.2220 7.2220 7.4770 7.4770 11.0184 11.0184 11.2078 11.2078 11.8125 11.8125 12.0272 12.0272 k = 0.5000-0.5886-0.9914 ( 3926 PWs) bands (ev): -26.3268 -26.3268 -26.3191 -26.3191 -9.3728 -9.3728 -9.3568 -9.3568 -8.5137 -8.5137 -8.3415 -8.3415 -8.1886 -8.1886 -8.0366 -8.0366 -7.6092 -7.6092 -2.7352 -2.7352 2.9163 2.9163 3.3358 3.3358 3.5246 3.5246 6.9733 6.9733 7.1993 7.1993 7.4772 7.4772 11.0719 11.0719 11.1677 11.1677 11.7785 11.7785 12.0577 12.0577 k = 0.5000-0.5764-1.0117 ( 3930 PWs) bands (ev): -26.3258 -26.3258 -26.3198 -26.3198 -9.3728 -9.3728 -9.3575 -9.3575 -8.5160 -8.5160 -8.3399 -8.3399 -8.1836 -8.1836 -8.0392 -8.0392 -7.6130 -7.6130 -2.7343 -2.7343 2.9322 2.9322 3.3192 3.3192 3.5147 3.5147 7.0017 7.0017 7.1762 7.1762 7.4776 7.4776 11.1124 11.1124 11.1311 11.1311 11.7586 11.7586 12.0865 12.0865 k = 0.5000-0.5642-1.0319 ( 3928 PWs) bands (ev): -26.3249 -26.3249 -26.3206 -26.3206 -9.3729 -9.3729 -9.3584 -9.3584 -8.5183 -8.5183 -8.3383 -8.3383 -8.1781 -8.1781 -8.0411 -8.0411 -7.6172 -7.6172 -2.7337 -2.7337 2.9453 2.9453 3.3043 3.3043 3.5089 3.5089 7.0283 7.0283 7.1529 7.1529 7.4781 7.4781 11.0854 11.0854 11.1487 11.1487 11.7561 11.7561 12.1139 12.1139 k = 0.5000-0.5519-1.0521 ( 3924 PWs) bands (ev): -26.3239 -26.3239 -26.3214 -26.3214 -9.3730 -9.3730 -9.3594 -9.3594 -8.5204 -8.5204 -8.3367 -8.3367 -8.1724 -8.1724 -8.0421 -8.0421 -7.6218 -7.6218 -2.7334 -2.7334 2.9546 2.9546 3.2931 3.2931 3.5062 3.5062 7.0524 7.0524 7.1301 7.1301 7.4788 7.4788 11.0453 11.0453 11.1637 11.1637 11.7732 11.7732 12.1402 12.1402 k = 0.5000-0.5397-1.0724 ( 3922 PWs) bands (ev): -26.3230 -26.3230 -26.3223 -26.3223 -9.3730 -9.3730 -9.3604 -9.3604 -8.5223 -8.5223 -8.3353 -8.3353 -8.1665 -8.1665 -8.0423 -8.0423 -7.6267 -7.6267 -2.7333 -2.7333 2.9594 2.9594 3.2873 3.2873 3.5057 3.5057 7.0712 7.0712 7.1109 7.1109 7.4796 7.4796 11.0046 11.0046 11.1640 11.1640 11.8088 11.8088 12.1654 12.1654 k = 0.5000-0.5275-1.0926 ( 3924 PWs) bands (ev): -26.3233 -26.3233 -26.3220 -26.3220 -9.3732 -9.3732 -9.3615 -9.3615 -8.5240 -8.5240 -8.3339 -8.3339 -8.1606 -8.1606 -8.0415 -8.0415 -7.6319 -7.6319 -2.7335 -2.7335 2.9593 2.9593 3.2876 3.2876 3.5070 3.5070 7.0701 7.0701 7.1097 7.1097 7.4805 7.4805 10.9635 10.9635 11.1523 11.1523 11.8598 11.8598 12.1898 12.1898 k = 0.5000-0.5152-1.1128 ( 3928 PWs) bands (ev): -26.3243 -26.3243 -26.3211 -26.3211 -9.3734 -9.3734 -9.3626 -9.3626 -8.5254 -8.5254 -8.3325 -8.3325 -8.1548 -8.1548 -8.0396 -8.0396 -7.6373 -7.6373 -2.7340 -2.7340 2.9550 2.9550 3.2937 3.2937 3.5100 3.5100 7.0514 7.0514 7.1247 7.1247 7.4816 7.4816 10.9220 10.9220 11.1324 11.1324 11.9219 11.9219 12.2133 12.2133 k = 0.5000-0.5030-1.1331 ( 3924 PWs) bands (ev): -26.3253 -26.3253 -26.3202 -26.3202 -9.3738 -9.3738 -9.3634 -9.3634 -8.5267 -8.5267 -8.3311 -8.3311 -8.1494 -8.1494 -8.0366 -8.0366 -7.6430 -7.6430 -2.7348 -2.7348 2.9473 2.9473 3.3047 3.3047 3.5145 3.5145 7.0299 7.0299 7.1410 7.1410 7.4828 7.4828 10.8802 10.8802 11.1076 11.1076 11.9913 11.9913 12.2360 12.2360 k = 0.8171-0.4184-0.9716 ( 3924 PWs) bands (ev): -26.3253 -26.3253 -26.3202 -26.3202 -9.3738 -9.3738 -9.3634 -9.3634 -8.5267 -8.5267 -8.3311 -8.3311 -8.1494 -8.1494 -8.0366 -8.0366 -7.6430 -7.6430 -2.7348 -2.7348 2.9473 2.9473 3.3047 3.3047 3.5145 3.5145 7.0299 7.0299 7.1410 7.1410 7.4828 7.4828 10.8802 10.8802 11.1076 11.1076 11.9913 11.9913 12.2360 12.2360 k = 0.8109-0.4075-0.9510 ( 3922 PWs) bands (ev): -26.3265 -26.3265 -26.3193 -26.3193 -9.3743 -9.3743 -9.3640 -9.3640 -8.5277 -8.5277 -8.3297 -8.3297 -8.1443 -8.1443 -8.0324 -8.0324 -7.6489 -7.6489 -2.7358 -2.7358 2.9373 2.9373 3.3192 3.3192 3.5209 3.5209 7.0082 7.0082 7.1563 7.1563 7.4839 7.4839 10.8371 10.8371 11.0796 11.0796 12.0666 12.0666 12.2581 12.2581 k = 0.8047-0.3967-0.9304 ( 3926 PWs) bands (ev): -26.3277 -26.3277 -26.3184 -26.3184 -9.3752 -9.3752 -9.3642 -9.3642 -8.5285 -8.5285 -8.3283 -8.3283 -8.1397 -8.1397 -8.0271 -8.0271 -7.6548 -7.6548 -2.7370 -2.7370 2.9265 2.9265 3.3356 3.3356 3.5296 3.5296 6.9874 6.9874 7.1698 7.1698 7.4851 7.4851 10.7939 10.7939 11.0508 11.0508 12.1441 12.1441 12.2791 12.2791 k = 0.7985-0.3859-0.9097 ( 3924 PWs) bands (ev): -26.3290 -26.3290 -26.3176 -26.3176 -9.3764 -9.3764 -9.3639 -9.3639 -8.5290 -8.5290 -8.3268 -8.3268 -8.1355 -8.1355 -8.0208 -8.0208 -7.6607 -7.6607 -2.7385 -2.7385 2.9158 2.9158 3.3519 3.3519 3.5412 3.5412 6.9677 6.9677 7.1813 7.1813 7.4861 7.4861 10.7506 10.7506 11.0222 11.0222 12.2215 12.2215 12.2987 12.2987 k = 0.7922-0.3751-0.8891 ( 3916 PWs) bands (ev): -26.3304 -26.3304 -26.3168 -26.3168 -9.3778 -9.3778 -9.3631 -9.3631 -8.5294 -8.5294 -8.3254 -8.3254 -8.1318 -8.1318 -8.0136 -8.0136 -7.6665 -7.6665 -2.7402 -2.7402 2.9060 2.9060 3.3667 3.3667 3.5563 3.5563 6.9496 6.9496 7.1910 7.1910 7.4868 7.4868 10.7076 10.7076 10.9947 10.9947 12.2947 12.2947 12.3192 12.3192 k = 0.7860-0.3643-0.8685 ( 3920 PWs) bands (ev): -26.3318 -26.3318 -26.3160 -26.3160 -9.3793 -9.3793 -9.3620 -9.3620 -8.5296 -8.5296 -8.3239 -8.3239 -8.1284 -8.1284 -8.0059 -8.0059 -7.6720 -7.6720 -2.7421 -2.7421 2.8978 2.8978 3.3789 3.3789 3.5754 3.5754 6.9331 6.9331 7.1987 7.1987 7.4873 7.4873 10.6650 10.6650 10.9689 10.9689 12.3265 12.3265 12.3755 12.3755 k = 0.7798-0.3534-0.8478 ( 3922 PWs) bands (ev): -26.3333 -26.3333 -26.3153 -26.3153 -9.3808 -9.3808 -9.3605 -9.3605 -8.5297 -8.5297 -8.3224 -8.3224 -8.1252 -8.1252 -7.9978 -7.9978 -7.6772 -7.6772 -2.7442 -2.7442 2.8916 2.8916 3.3878 3.3878 3.5986 3.5986 6.9185 6.9185 7.2046 7.2046 7.4873 7.4873 10.6231 10.6231 10.9451 10.9451 12.3383 12.3383 12.4442 12.4442 k = 0.7736-0.3426-0.8272 ( 3926 PWs) bands (ev): -26.3348 -26.3348 -26.3146 -26.3146 -9.3824 -9.3824 -9.3587 -9.3587 -8.5296 -8.5296 -8.3209 -8.3209 -8.1221 -8.1221 -7.9896 -7.9896 -7.6819 -7.6819 -2.7464 -2.7464 2.8876 2.8876 3.3935 3.3935 3.6256 3.6256 6.9058 6.9058 7.2088 7.2088 7.4869 7.4869 10.5823 10.5823 10.9237 10.9237 12.3453 12.3453 12.5081 12.5081 k = 0.7674-0.3318-0.8066 ( 3926 PWs) bands (ev): -26.3364 -26.3364 -26.3140 -26.3140 -9.3838 -9.3838 -9.3565 -9.3565 -8.5294 -8.5294 -8.3194 -8.3194 -8.1190 -8.1190 -7.9814 -7.9814 -7.6859 -7.6859 -2.7489 -2.7489 2.8861 2.8861 3.3963 3.3963 3.6557 3.6557 6.8953 6.8953 7.2112 7.2112 7.4860 7.4860 10.5429 10.5429 10.9048 10.9048 12.3473 12.3473 12.5650 12.5650 k = 0.7612-0.3210-0.7859 ( 3930 PWs) bands (ev): -26.3381 -26.3381 -26.3134 -26.3134 -9.3852 -9.3852 -9.3539 -9.3539 -8.5292 -8.5292 -8.3179 -8.3179 -8.1158 -8.1158 -7.9737 -7.9737 -7.6891 -7.6891 -2.7515 -2.7515 2.8872 2.8872 3.3965 3.3965 3.6882 3.6882 6.8870 6.8870 7.2119 7.2119 7.4845 7.4845 10.5051 10.5051 10.8887 10.8887 12.3439 12.3439 12.6134 12.6134 k = 0.7549-0.3102-0.7653 ( 3934 PWs) bands (ev): -26.3398 -26.3398 -26.3128 -26.3128 -9.3865 -9.3865 -9.3510 -9.3510 -8.5289 -8.5289 -8.3165 -8.3165 -8.1125 -8.1125 -7.9664 -7.9664 -7.6914 -7.6914 -2.7542 -2.7542 2.8909 2.8909 3.3947 3.3947 3.7227 3.7227 6.8809 6.8809 7.2108 7.2108 7.4824 7.4824 10.4694 10.4694 10.8755 10.8755 12.3349 12.3349 12.6518 12.6518 k = 0.7487-0.2993-0.7447 ( 3924 PWs) bands (ev): -26.3415 -26.3415 -26.3123 -26.3123 -9.3876 -9.3876 -9.3478 -9.3478 -8.5286 -8.5286 -8.3152 -8.3152 -8.1090 -8.1090 -7.9599 -7.9599 -7.6925 -7.6925 -2.7572 -2.7572 2.8974 2.8974 3.3912 3.3912 3.7585 3.7585 6.8771 6.8771 7.2080 7.2080 7.4796 7.4796 10.4361 10.4361 10.8653 10.8653 12.3201 12.3201 12.6790 12.6790 k = 0.7425-0.2885-0.7240 ( 3920 PWs) bands (ev): -26.3434 -26.3434 -26.3119 -26.3119 -9.3885 -9.3885 -9.3443 -9.3443 -8.5284 -8.5284 -8.3139 -8.3139 -8.1052 -8.1052 -7.9543 -7.9543 -7.6925 -7.6925 -2.7602 -2.7602 2.9066 2.9066 3.3864 3.3864 3.7953 3.7953 6.8756 6.8756 7.2034 7.2034 7.4763 7.4763 10.4054 10.4054 10.8583 10.8583 12.2996 12.2996 12.6944 12.6944 k = 0.7363-0.2777-0.7034 ( 3920 PWs) bands (ev): -26.3452 -26.3452 -26.3115 -26.3115 -9.3893 -9.3893 -9.3405 -9.3405 -8.5281 -8.5281 -8.3128 -8.3128 -8.1011 -8.1011 -7.9496 -7.9496 -7.6911 -7.6911 -2.7635 -2.7635 2.9185 2.9185 3.3807 3.3807 3.8327 3.8327 6.8763 6.8763 7.1969 7.1969 7.4724 7.4724 10.3776 10.3776 10.8544 10.8544 12.2737 12.2737 12.6979 12.6979 k = 0.7301-0.2669-0.6828 ( 3922 PWs) bands (ev): -26.3471 -26.3471 -26.3112 -26.3112 -9.3898 -9.3898 -9.3364 -9.3364 -8.5279 -8.5279 -8.3117 -8.3117 -8.0967 -8.0967 -7.9460 -7.9460 -7.6885 -7.6885 -2.7669 -2.7669 2.9328 2.9328 3.3744 3.3744 3.8706 3.8706 6.8792 6.8792 7.1884 7.1884 7.4681 7.4681 10.3531 10.3531 10.8539 10.8539 12.2428 12.2428 12.6904 12.6904 k = 0.7238-0.2561-0.6621 ( 3918 PWs) bands (ev): -26.3491 -26.3491 -26.3109 -26.3109 -9.3902 -9.3902 -9.3321 -9.3321 -8.5277 -8.5277 -8.3109 -8.3109 -8.0920 -8.0920 -7.9433 -7.9433 -7.6846 -7.6846 -2.7705 -2.7705 2.9493 2.9493 3.3678 3.3678 3.9087 3.9087 6.8841 6.8841 7.1778 7.1778 7.4632 7.4632 10.3321 10.3321 10.8566 10.8566 12.2076 12.2076 12.6735 12.6735 k = 0.7176-0.2452-0.6415 ( 3922 PWs) bands (ev): -26.3511 -26.3511 -26.3106 -26.3106 -9.3904 -9.3904 -9.3275 -9.3275 -8.5276 -8.5276 -8.3101 -8.3101 -8.0870 -8.0870 -7.9415 -7.9415 -7.6794 -7.6794 -2.7742 -2.7742 2.9679 2.9679 3.3615 3.3615 3.9467 3.9467 6.8911 6.8911 7.1650 7.1650 7.4580 7.4580 10.3148 10.3148 10.8628 10.8628 12.1687 12.1687 12.6490 12.6490 k = 0.7114-0.2344-0.6209 ( 3916 PWs) bands (ev): -26.3531 -26.3531 -26.3104 -26.3104 -9.3904 -9.3904 -9.3227 -9.3227 -8.5276 -8.5276 -8.3095 -8.3095 -8.0816 -8.0816 -7.9405 -7.9405 -7.6731 -7.6731 -2.7782 -2.7782 2.9880 2.9880 3.3560 3.3560 3.9846 3.9846 6.8999 6.8999 7.1499 7.1499 7.4525 7.4525 10.3013 10.3013 10.8723 10.8723 12.1269 12.1269 12.6188 12.6188 k = 0.7052-0.2236-0.6002 ( 3918 PWs) bands (ev): -26.3552 -26.3552 -26.3103 -26.3103 -9.3902 -9.3902 -9.3177 -9.3177 -8.5276 -8.5276 -8.3091 -8.3091 -8.0759 -8.0759 -7.9401 -7.9401 -7.6659 -7.6659 -2.7824 -2.7824 3.0090 3.0090 3.3521 3.3521 4.0222 4.0222 6.9104 6.9104 7.1324 7.1324 7.4467 7.4467 10.2920 10.2920 10.8852 10.8852 12.0829 12.0829 12.5846 12.5846 k = 0.6990-0.2128-0.5796 ( 3920 PWs) bands (ev): -26.3572 -26.3572 -26.3102 -26.3102 -9.3898 -9.3898 -9.3125 -9.3125 -8.5276 -8.5276 -8.3088 -8.3088 -8.0699 -8.0699 -7.9403 -7.9403 -7.6578 -7.6578 -2.7867 -2.7867 3.0301 3.0301 3.3505 3.3505 4.0593 4.0593 6.9223 6.9223 7.1126 7.1126 7.4408 7.4408 10.2868 10.2868 10.9015 10.9015 12.0373 12.0373 12.5474 12.5474 k = 0.6928-0.2020-0.5590 ( 3918 PWs) bands (ev): -26.3593 -26.3593 -26.3101 -26.3101 -9.3893 -9.3893 -9.3073 -9.3073 -8.5277 -8.5277 -8.3087 -8.3087 -8.0637 -8.0637 -7.9407 -7.9407 -7.6490 -7.6490 -2.7914 -2.7914 3.0502 3.0502 3.3526 3.3526 4.0960 4.0960 6.9356 6.9356 7.0903 7.0903 7.4347 7.4347 10.2860 10.2860 10.9212 10.9212 11.9908 11.9908 12.5085 12.5085 k = 0.6865-0.1912-0.5383 ( 3904 PWs) bands (ev): -26.3614 -26.3614 -26.3101 -26.3101 -9.3886 -9.3886 -9.3020 -9.3020 -8.5279 -8.5279 -8.3087 -8.3087 -8.0572 -8.0572 -7.9413 -7.9413 -7.6397 -7.6397 -2.7962 -2.7962 3.0681 3.0681 3.3597 3.3597 4.1319 4.1319 6.9499 6.9499 7.0659 7.0659 7.4284 7.4284 10.2894 10.2894 10.9442 10.9442 11.9440 11.9440 12.4684 12.4684 k = 0.6803-0.1803-0.5177 ( 3906 PWs) bands (ev): -26.3636 -26.3636 -26.3102 -26.3102 -9.3878 -9.3878 -9.2966 -9.2966 -8.5280 -8.5280 -8.3088 -8.3088 -8.0504 -8.0504 -7.9420 -7.9420 -7.6301 -7.6301 -2.8013 -2.8013 3.0825 3.0825 3.3729 3.3729 4.1672 4.1672 6.9646 6.9646 7.0395 7.0395 7.4221 7.4221 10.2972 10.2972 10.9705 10.9705 11.8973 11.8973 12.4277 12.4277 k = 0.6741-0.1695-0.4971 ( 3916 PWs) bands (ev): -26.3657 -26.3657 -26.3102 -26.3102 -9.3868 -9.3868 -9.2913 -9.2913 -8.5282 -8.5282 -8.3091 -8.3091 -8.0435 -8.0435 -7.9426 -7.9426 -7.6201 -7.6201 -2.8067 -2.8067 3.0926 3.0926 3.3931 3.3931 4.2017 4.2017 6.9776 6.9776 7.0135 7.0135 7.4155 7.4155 10.3093 10.3093 10.9999 10.9999 11.8513 11.8513 12.3868 12.3868 k = 0.6679-0.1587-0.4764 ( 3916 PWs) bands (ev): -26.3678 -26.3678 -26.3104 -26.3104 -9.3858 -9.3858 -9.2860 -9.2860 -8.5283 -8.5283 -8.3094 -8.3094 -8.0365 -8.0365 -7.9429 -7.9429 -7.6100 -7.6100 -2.8123 -2.8123 3.0983 3.0983 3.4204 3.4204 4.2353 4.2353 6.9702 6.9702 7.0063 7.0063 7.4089 7.4089 10.3257 10.3257 11.0324 11.0324 11.8063 11.8063 12.3460 12.3460 k = 0.6617-0.1479-0.4558 ( 3920 PWs) bands (ev): -26.3699 -26.3699 -26.3105 -26.3105 -9.3847 -9.3847 -9.2809 -9.2809 -8.5284 -8.5284 -8.3098 -8.3098 -8.0294 -8.0294 -7.9429 -7.9429 -7.5998 -7.5998 -2.8183 -2.8183 3.1002 3.1002 3.4541 3.4541 4.2681 4.2681 6.9402 6.9402 7.0201 7.0201 7.4020 7.4020 10.3461 10.3461 11.0678 11.0678 11.7626 11.7626 12.3055 12.3055 k = 0.6555-0.1371-0.4352 ( 3926 PWs) bands (ev): -26.3720 -26.3720 -26.3107 -26.3107 -9.3835 -9.3835 -9.2758 -9.2758 -8.5285 -8.5285 -8.3102 -8.3102 -8.0223 -8.0223 -7.9426 -7.9426 -7.5897 -7.5897 -2.8244 -2.8244 3.0990 3.0990 3.4935 3.4935 4.2999 4.2999 6.9057 6.9057 7.0367 7.0367 7.3950 7.3950 10.3706 10.3706 11.1059 11.1059 11.7204 11.7204 12.2655 12.2655 k = 0.6492-0.1262-0.4145 ( 3928 PWs) bands (ev): -26.3741 -26.3741 -26.3109 -26.3109 -9.3823 -9.3823 -9.2710 -9.2710 -8.5285 -8.5285 -8.3107 -8.3107 -8.0152 -8.0152 -7.9417 -7.9417 -7.5796 -7.5796 -2.8309 -2.8309 3.0958 3.0958 3.5376 3.5376 4.3307 4.3307 6.8692 6.8692 7.0538 7.0538 7.3878 7.3878 10.3989 10.3989 11.1465 11.1465 11.6799 11.6799 12.2262 12.2262 k = 0.6430-0.1154-0.3939 ( 3932 PWs) bands (ev): -26.3762 -26.3762 -26.3111 -26.3111 -9.3811 -9.3811 -9.2663 -9.2663 -8.5284 -8.5284 -8.3112 -8.3112 -8.0083 -8.0083 -7.9403 -7.9403 -7.5697 -7.5697 -2.8376 -2.8376 3.0911 3.0911 3.5854 3.5854 4.3605 4.3605 6.8311 6.8311 7.0708 7.0708 7.3803 7.3803 10.4306 10.4306 11.1894 11.1894 11.6412 11.6412 12.1878 12.1878 k = 0.6368-0.1046-0.3733 ( 3936 PWs) bands (ev): -26.3782 -26.3782 -26.3114 -26.3114 -9.3799 -9.3799 -9.2619 -9.2619 -8.5283 -8.5283 -8.3116 -8.3116 -8.0016 -8.0016 -7.9382 -7.9382 -7.5599 -7.5599 -2.8446 -2.8446 3.0856 3.0856 3.6363 3.6363 4.3893 4.3893 6.7919 6.7919 7.0875 7.0875 7.3727 7.3727 10.4657 10.4657 11.2340 11.2340 11.6042 11.6042 12.1505 12.1505 k = 0.6306-0.0938-0.3526 ( 3940 PWs) bands (ev): -26.3802 -26.3802 -26.3117 -26.3117 -9.3786 -9.3786 -9.2578 -9.2578 -8.5280 -8.5280 -8.3120 -8.3120 -7.9953 -7.9953 -7.9355 -7.9355 -7.5504 -7.5504 -2.8518 -2.8518 3.0798 3.0798 3.6895 3.6895 4.4171 4.4171 6.7518 6.7518 7.1037 7.1037 7.3648 7.3648 10.5036 10.5036 11.2799 11.2799 11.5691 11.5691 12.1147 12.1147 k = 0.6244-0.0830-0.3320 ( 3944 PWs) bands (ev): -26.3821 -26.3821 -26.3120 -26.3120 -9.3774 -9.3774 -9.2540 -9.2540 -8.5277 -8.5277 -8.3124 -8.3124 -7.9894 -7.9894 -7.9319 -7.9319 -7.5411 -7.5411 -2.8591 -2.8591 3.0738 3.0738 3.7447 3.7447 4.4440 4.4440 6.7111 6.7111 7.1192 7.1192 7.3568 7.3568 10.5438 10.5438 11.3265 11.3265 11.5359 11.5359 12.0808 12.0808 k = 0.6181-0.0721-0.3113 ( 3946 PWs) bands (ev): -26.3840 -26.3840 -26.3123 -26.3123 -9.3762 -9.3762 -9.2505 -9.2505 -8.5273 -8.5273 -8.3127 -8.3127 -7.9840 -7.9840 -7.9277 -7.9277 -7.5322 -7.5322 -2.8667 -2.8667 3.0680 3.0680 3.8012 3.8012 4.4699 4.4699 6.6700 6.6700 7.1339 7.1339 7.3486 7.3486 10.5859 10.5859 11.3727 11.3727 11.5046 11.5046 12.0498 12.0498 k = 0.6119-0.0613-0.2907 ( 3942 PWs) bands (ev): -26.3858 -26.3858 -26.3126 -26.3126 -9.3751 -9.3751 -9.2473 -9.2473 -8.5267 -8.5267 -8.3130 -8.3130 -7.9790 -7.9790 -7.9227 -7.9227 -7.5236 -7.5236 -2.8744 -2.8744 3.0626 3.0626 3.8585 3.8585 4.4949 4.4949 6.6289 6.6289 7.1476 7.1476 7.3403 7.3403 10.6290 10.6290 11.4171 11.4171 11.4757 11.4757 12.0226 12.0226 k = 0.6057-0.0505-0.2701 ( 3948 PWs) bands (ev): -26.3876 -26.3876 -26.3129 -26.3129 -9.3740 -9.3740 -9.2444 -9.2444 -8.5260 -8.5260 -8.3132 -8.3132 -7.9746 -7.9746 -7.9172 -7.9172 -7.5153 -7.5153 -2.8821 -2.8821 3.0575 3.0575 3.9163 3.9163 4.5191 4.5191 6.5879 6.5879 7.1603 7.1603 7.3318 7.3318 10.6721 10.6721 11.4453 11.4453 11.4620 11.4620 12.0011 12.0011 k = 0.5995-0.0397-0.2494 ( 3944 PWs) bands (ev): -26.3893 -26.3893 -26.3132 -26.3132 -9.3729 -9.3729 -9.2419 -9.2419 -8.5252 -8.5252 -8.3133 -8.3133 -7.9706 -7.9706 -7.9111 -7.9111 -7.5074 -7.5074 -2.8899 -2.8899 3.0529 3.0529 3.9740 3.9740 4.5426 4.5426 6.5473 6.5473 7.1720 7.1720 7.3234 7.3234 10.7140 10.7140 11.4242 11.4242 11.4952 11.4952 11.9874 11.9874 k = 0.5933-0.0289-0.2288 ( 3946 PWs) bands (ev): -26.3909 -26.3909 -26.3136 -26.3136 -9.3720 -9.3720 -9.2396 -9.2396 -8.5244 -8.5244 -8.3134 -8.3134 -7.9669 -7.9669 -7.9048 -7.9048 -7.4999 -7.4999 -2.8977 -2.8977 3.0489 3.0489 4.0311 4.0311 4.5653 4.5653 6.5075 6.5075 7.1825 7.1825 7.3149 7.3149 10.7528 10.7528 11.4055 11.4055 11.5221 11.5221 11.9841 11.9841 k = 0.5871-0.0180-0.2082 ( 3952 PWs) bands (ev): -26.3925 -26.3925 -26.3139 -26.3139 -9.3711 -9.3711 -9.2377 -9.2377 -8.5235 -8.5235 -8.3134 -8.3134 -7.9636 -7.9636 -7.8982 -7.8982 -7.4929 -7.4929 -2.9054 -2.9054 3.0453 3.0453 4.0870 4.0870 4.5875 4.5875 6.4686 6.4686 7.1918 7.1918 7.3066 7.3066 10.7863 10.7863 11.3930 11.3930 11.5384 11.5384 11.9931 11.9931 k = 0.5808-0.0072-0.1875 ( 3952 PWs) bands (ev): -26.3939 -26.3939 -26.3142 -26.3142 -9.3702 -9.3702 -9.2361 -9.2361 -8.5225 -8.5225 -8.3134 -8.3134 -7.9605 -7.9605 -7.8915 -7.8915 -7.4862 -7.4862 -2.9129 -2.9129 3.0423 3.0423 4.1413 4.1413 4.6093 4.6093 6.4308 6.4308 7.2000 7.2000 7.2984 7.2984 10.8122 10.8122 11.3890 11.3890 11.5435 11.5435 12.0147 12.0147 k = 0.5746 0.0036-0.1669 ( 3952 PWs) bands (ev): -26.3953 -26.3953 -26.3145 -26.3145 -9.3695 -9.3695 -9.2347 -9.2347 -8.5214 -8.5214 -8.3133 -8.3133 -7.9576 -7.9576 -7.8849 -7.8849 -7.4800 -7.4800 -2.9203 -2.9203 3.0398 3.0398 4.1933 4.1933 4.6308 4.6308 6.3946 6.3946 7.2071 7.2071 7.2904 7.2904 10.8281 10.8281 11.3956 11.3956 11.5388 11.5388 12.0464 12.0464 k = 0.5684 0.0144-0.1463 ( 3956 PWs) bands (ev): -26.3966 -26.3966 -26.3148 -26.3148 -9.3688 -9.3688 -9.2336 -9.2336 -8.5203 -8.5203 -8.3132 -8.3132 -7.9550 -7.9550 -7.8785 -7.8785 -7.4742 -7.4742 -2.9273 -2.9273 3.0378 3.0378 4.2424 4.2424 4.6521 4.6521 6.3599 6.3599 7.2131 7.2131 7.2827 7.2827 10.8332 10.8332 11.4139 11.4139 11.5271 11.5271 12.0845 12.0845 k = 0.5622 0.0252-0.1256 ( 3956 PWs) bands (ev): -26.3978 -26.3978 -26.3151 -26.3151 -9.3681 -9.3681 -9.2327 -9.2327 -8.5193 -8.5193 -8.3130 -8.3130 -7.9525 -7.9525 -7.8724 -7.8724 -7.4689 -7.4689 -2.9341 -2.9341 3.0362 3.0362 4.2881 4.2881 4.6732 4.6732 6.3272 6.3272 7.2182 7.2182 7.2754 7.2754 10.8278 10.8278 11.4435 11.4435 11.5108 11.5108 12.1239 12.1239 k = 0.5560 0.0361-0.1050 ( 3958 PWs) bands (ev): -26.3989 -26.3989 -26.3153 -26.3153 -9.3676 -9.3676 -9.2319 -9.2319 -8.5182 -8.5182 -8.3128 -8.3128 -7.9502 -7.9502 -7.8665 -7.8665 -7.4641 -7.4641 -2.9404 -2.9404 3.0350 3.0350 4.3298 4.3298 4.6943 4.6943 6.2966 6.2966 7.2222 7.2222 7.2686 7.2686 10.8141 10.8141 11.4820 11.4820 11.4929 11.4929 12.1589 12.1589 k = 0.5497 0.0469-0.0844 ( 3964 PWs) bands (ev): -26.3999 -26.3999 -26.3156 -26.3156 -9.3671 -9.3671 -9.2314 -9.2314 -8.5172 -8.5172 -8.3127 -8.3127 -7.9482 -7.9482 -7.8611 -7.8611 -7.4597 -7.4597 -2.9463 -2.9463 3.0340 3.0340 4.3670 4.3670 4.7152 4.7152 6.2683 6.2683 7.2255 7.2255 7.2623 7.2623 10.7945 10.7945 11.4726 11.4726 11.5296 11.5296 12.1846 12.1846 k = 0.5435 0.0577-0.0637 ( 3968 PWs) bands (ev): -26.4008 -26.4008 -26.3158 -26.3158 -9.3667 -9.3667 -9.2310 -9.2310 -8.5163 -8.5163 -8.3125 -8.3125 -7.9463 -7.9463 -7.8562 -7.8562 -7.4559 -7.4559 -2.9516 -2.9516 3.0334 3.0334 4.3996 4.3996 4.7357 4.7357 6.2427 6.2427 7.2279 7.2279 7.2567 7.2567 10.7717 10.7717 11.4538 11.4538 11.5809 11.5809 12.1989 12.1989 k = 0.5373 0.0685-0.0431 ( 3966 PWs) bands (ev): -26.4015 -26.4015 -26.3160 -26.3160 -9.3663 -9.3663 -9.2307 -9.2307 -8.5154 -8.5154 -8.3123 -8.3123 -7.9446 -7.9446 -7.8518 -7.8518 -7.4525 -7.4525 -2.9564 -2.9564 3.0330 3.0330 4.4273 4.4273 4.7554 4.7554 6.2198 6.2198 7.2296 7.2296 7.2518 7.2518 10.7480 10.7480 11.4362 11.4362 11.6351 11.6351 12.2042 12.2042 k = 0.5311 0.0793-0.0225 ( 3968 PWs) bands (ev): -26.4022 -26.4022 -26.3161 -26.3161 -9.3660 -9.3660 -9.2305 -9.2305 -8.5146 -8.5146 -8.3121 -8.3121 -7.9432 -7.9432 -7.8480 -7.8480 -7.4496 -7.4496 -2.9605 -2.9605 3.0327 3.0327 4.4503 4.4503 4.7736 4.7736 6.2000 6.2000 7.2306 7.2306 7.2478 7.2478 10.7251 10.7251 11.4205 11.4205 11.6900 11.6900 12.2040 12.2040 k = 0.5249 0.0902-0.0018 ( 3972 PWs) bands (ev): -26.4027 -26.4027 -26.3163 -26.3163 -9.3658 -9.3658 -9.2303 -9.2303 -8.5140 -8.5140 -8.3120 -8.3120 -7.9420 -7.9420 -7.8448 -7.8448 -7.4473 -7.4473 -2.9640 -2.9640 3.0325 3.0325 4.4686 4.4686 4.7898 4.7898 6.1835 6.1835 7.2310 7.2310 7.2448 7.2448 10.7045 10.7045 11.4072 11.4072 11.7435 11.7435 12.2013 12.2013 k = 0.5187 0.1010 0.0188 ( 3972 PWs) bands (ev): -26.4031 -26.4031 -26.3164 -26.3164 -9.3656 -9.3656 -9.2302 -9.2302 -8.5134 -8.5134 -8.3119 -8.3119 -7.9411 -7.9411 -7.8424 -7.8424 -7.4454 -7.4454 -2.9667 -2.9667 3.0325 3.0325 4.4825 4.4825 4.8032 4.8032 6.1704 6.1704 7.2307 7.2307 7.2428 7.2428 10.6874 10.6874 11.3965 11.3965 11.7931 11.7931 12.1977 12.1977 k = 0.5124 0.1118 0.0394 ( 3976 PWs) bands (ev): -26.4034 -26.4034 -26.3165 -26.3165 -9.3655 -9.3655 -9.2302 -9.2302 -8.5131 -8.5131 -8.3118 -8.3118 -7.9404 -7.9404 -7.8405 -7.8405 -7.4441 -7.4441 -2.9686 -2.9686 3.0324 3.0324 4.4922 4.4922 4.8133 4.8133 6.1609 6.1609 7.2302 7.2302 7.2417 7.2417 10.6746 10.6746 11.3887 11.3887 11.8354 11.8354 12.1938 12.1938 k = 0.5062 0.1226 0.0601 ( 3984 PWs) bands (ev): -26.4036 -26.4036 -26.3165 -26.3165 -9.3654 -9.3654 -9.2302 -9.2302 -8.5128 -8.5128 -8.3118 -8.3118 -7.9400 -7.9400 -7.8395 -7.8395 -7.4433 -7.4433 -2.9698 -2.9698 3.0324 3.0324 4.4979 4.4979 4.8196 4.8196 6.1551 6.1551 7.2297 7.2297 7.2411 7.2411 10.6667 10.6667 11.3840 11.3840 11.8650 11.8650 12.1889 12.1889 k = 0.5000 0.1334 0.0807 ( 3990 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3654 -9.3654 -9.2302 -9.2302 -8.5128 -8.5128 -8.3117 -8.3117 -7.9399 -7.9399 -7.8391 -7.8391 -7.4431 -7.4431 -2.9702 -2.9702 3.0324 3.0324 4.4998 4.4998 4.8217 4.8217 6.1532 6.1532 7.2295 7.2295 7.2410 7.2410 10.6640 10.6640 11.3824 11.3824 11.8759 11.8759 12.1852 12.1852 k = 0.5000 0.1334 0.0807 ( 3990 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3654 -9.3654 -9.2302 -9.2302 -8.5128 -8.5128 -8.3117 -8.3117 -7.9399 -7.9399 -7.8391 -7.8391 -7.4431 -7.4431 -2.9702 -2.9702 3.0324 3.0324 4.4998 4.4998 4.8217 4.8217 6.1532 6.1532 7.2295 7.2295 7.2410 7.2410 10.6640 10.6640 11.3824 11.3824 11.8759 11.8759 12.1852 12.1852 k = 0.4773 0.1274 0.0770 ( 3985 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3678 -9.3678 -9.2277 -9.2277 -8.5134 -8.5134 -8.3103 -8.3103 -7.9399 -7.9399 -7.8391 -7.8391 -7.4442 -7.4442 -2.9700 -2.9700 3.0318 3.0318 4.4996 4.4996 4.8216 4.8216 6.1556 6.1556 7.2300 7.2300 7.2415 7.2415 10.6605 10.6605 11.3621 11.3621 11.8978 11.8978 12.1824 12.1824 k = 0.4545 0.1213 0.0734 ( 3982 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3744 -9.3744 -9.2208 -9.2208 -8.5153 -8.5153 -8.3059 -8.3059 -7.9399 -7.9399 -7.8391 -7.8391 -7.4474 -7.4474 -2.9693 -2.9693 3.0300 3.0300 4.4992 4.4992 4.8211 4.8211 6.1627 6.1627 7.2314 7.2314 7.2431 7.2431 10.6496 10.6496 11.3112 11.3112 11.9538 11.9538 12.1742 12.1742 k = 0.4318 0.1152 0.0697 ( 3973 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3842 -9.3842 -9.2105 -9.2105 -8.5183 -8.5183 -8.2987 -8.2987 -7.9399 -7.9399 -7.8391 -7.8391 -7.4527 -7.4527 -2.9682 -2.9682 3.0270 3.0270 4.4984 4.4984 4.8203 4.8203 6.1745 6.1745 7.2337 7.2337 7.2457 7.2457 10.6296 10.6296 11.2473 11.2473 12.0272 12.0272 12.1611 12.1611 k = 0.4091 0.1092 0.0660 ( 3970 PWs) bands (ev): -26.4037 -26.4037 -26.3164 -26.3164 -9.3959 -9.3959 -9.1981 -9.1981 -8.5222 -8.5222 -8.2890 -8.2890 -7.9399 -7.9399 -7.8391 -7.8391 -7.4602 -7.4602 -2.9666 -2.9666 3.0230 3.0230 4.4973 4.4973 4.8193 4.8193 6.1908 6.1908 7.2368 7.2368 7.2494 7.2494 10.5983 10.5983 11.1835 11.1835 12.1060 12.1060 12.1438 12.1438 k = 0.3864 0.1031 0.0624 ( 3964 PWs) bands (ev): -26.4038 -26.4038 -26.3164 -26.3164 -9.4088 -9.4088 -9.1845 -9.1845 -8.5268 -8.5268 -8.2770 -8.2770 -7.9399 -7.9399 -7.8391 -7.8391 -7.4697 -7.4697 -2.9647 -2.9647 3.0179 3.0179 4.4960 4.4960 4.8180 4.8180 6.2113 6.2113 7.2408 7.2408 7.2539 7.2539 10.5536 10.5536 11.1279 11.1279 12.1231 12.1231 12.1379 12.1379 k = 0.3636 0.0970 0.0587 ( 3964 PWs) bands (ev): -26.4038 -26.4038 -26.3163 -26.3163 -9.4222 -9.4222 -9.1702 -9.1702 -8.5318 -8.5318 -8.2629 -8.2629 -7.9398 -7.9398 -7.8391 -7.8391 -7.4813 -7.4813 -2.9624 -2.9624 3.0120 3.0120 4.4945 4.4945 4.8164 4.8164 6.2358 6.2358 7.2455 7.2455 7.2593 7.2593 10.4946 10.4946 11.0847 11.0847 12.0998 12.0998 12.1155 12.1155 k = 0.3409 0.0910 0.0550 ( 3955 PWs) bands (ev): -26.4039 -26.4039 -26.3162 -26.3162 -9.4356 -9.4356 -9.1557 -9.1557 -8.5371 -8.5371 -8.2469 -8.2469 -7.9398 -7.9398 -7.8391 -7.8391 -7.4947 -7.4947 -2.9599 -2.9599 3.0053 3.0053 4.4927 4.4927 4.8147 4.8147 6.2639 6.2639 7.2508 7.2508 7.2654 7.2654 10.4227 10.4227 11.0544 11.0544 12.0749 12.0749 12.0909 12.0909 k = 0.3182 0.0849 0.0514 ( 3946 PWs) bands (ev): -26.4040 -26.4040 -26.3162 -26.3162 -9.4489 -9.4489 -9.1413 -9.1413 -8.5425 -8.5425 -8.2292 -8.2292 -7.9398 -7.9398 -7.8391 -7.8391 -7.5100 -7.5100 -2.9570 -2.9570 2.9981 2.9981 4.4909 4.4909 4.8128 4.8128 6.2953 6.2953 7.2566 7.2566 7.2721 7.2721 10.3409 10.3409 11.0355 11.0355 12.0489 12.0489 12.0652 12.0652 k = 0.2955 0.0789 0.0477 ( 3949 PWs) bands (ev): -26.4040 -26.4040 -26.3161 -26.3161 -9.4618 -9.4618 -9.1272 -9.1272 -8.5478 -8.5478 -8.2099 -8.2099 -7.9398 -7.9398 -7.8391 -7.8391 -7.5271 -7.5271 -2.9540 -2.9540 2.9904 2.9904 4.4889 4.4889 4.8107 4.8107 6.3294 6.3294 7.2628 7.2628 7.2793 7.2793 10.2528 10.2528 11.0255 11.0255 12.0227 12.0227 12.0392 12.0392 k = 0.2727 0.0728 0.0440 ( 3949 PWs) bands (ev): -26.4041 -26.4041 -26.3160 -26.3160 -9.4742 -9.4742 -9.1137 -9.1137 -8.5531 -8.5531 -8.1892 -8.1892 -7.9398 -7.9398 -7.8391 -7.8391 -7.5459 -7.5459 -2.9509 -2.9509 2.9824 2.9824 4.4868 4.4868 4.8086 4.8086 6.3657 6.3657 7.2694 7.2694 7.2868 7.2868 10.1614 10.1614 11.0219 11.0219 11.9968 11.9968 12.0135 12.0135 k = 0.2500 0.0667 0.0404 ( 3937 PWs) bands (ev): -26.4042 -26.4042 -26.3159 -26.3159 -9.4859 -9.4859 -9.1008 -9.1008 -8.5581 -8.5581 -8.1671 -8.1671 -7.9398 -7.9398 -7.8391 -7.8391 -7.5662 -7.5662 -2.9477 -2.9477 2.9744 2.9744 4.4847 4.4847 4.8065 4.8065 6.4036 6.4036 7.2761 7.2761 7.2944 7.2944 10.0695 10.0695 11.0231 11.0231 11.9716 11.9716 11.9885 11.9885 k = 0.2273 0.0607 0.0367 ( 3952 PWs) bands (ev): -26.4043 -26.4043 -26.3158 -26.3158 -9.4968 -9.4968 -9.0887 -9.0887 -8.5629 -8.5629 -8.1439 -8.1439 -7.9398 -7.9398 -7.8392 -7.8392 -7.5880 -7.5880 -2.9445 -2.9445 2.9664 2.9664 4.4827 4.4827 4.8044 4.8044 6.4425 6.4425 7.2828 7.2828 7.3021 7.3021 9.9790 9.9790 11.0274 11.0274 11.9475 11.9475 11.9646 11.9646 k = 0.2045 0.0546 0.0330 ( 3943 PWs) bands (ev): -26.4044 -26.4044 -26.3158 -26.3158 -9.5069 -9.5069 -9.0774 -9.0774 -8.5674 -8.5674 -8.1195 -8.1195 -7.9398 -7.9398 -7.8392 -7.8392 -7.6111 -7.6111 -2.9414 -2.9414 2.9587 2.9587 4.4807 4.4807 4.8023 4.8023 6.4816 6.4816 7.2894 7.2894 7.3096 7.3096 9.8916 9.8916 11.0339 11.0339 11.9249 11.9249 11.9423 11.9423 k = 0.1818 0.0485 0.0293 ( 3943 PWs) bands (ev): -26.4044 -26.4044 -26.3157 -26.3157 -9.5161 -9.5161 -9.0672 -9.0672 -8.5715 -8.5715 -8.0942 -8.0942 -7.9398 -7.9398 -7.8392 -7.8392 -7.6354 -7.6354 -2.9384 -2.9384 2.9513 2.9513 4.4788 4.4788 4.8003 4.8003 6.5202 6.5202 7.2958 7.2958 7.3169 7.3169 9.8089 9.8089 11.0417 11.0417 11.9040 11.9040 11.9216 11.9216 k = 0.1591 0.0425 0.0257 ( 3931 PWs) bands (ev): -26.4045 -26.4045 -26.3156 -26.3156 -9.5243 -9.5243 -9.0579 -9.0579 -8.5752 -8.5752 -8.0680 -8.0680 -7.9397 -7.9397 -7.8392 -7.8392 -7.6608 -7.6608 -2.9356 -2.9356 2.9445 2.9445 4.4770 4.4770 4.7984 4.7984 6.5573 6.5573 7.3018 7.3018 7.3237 7.3237 9.7320 9.7320 11.0502 11.0502 11.8852 11.8852 11.9030 11.9030 k = 0.1364 0.0364 0.0220 ( 3931 PWs) bands (ev): -26.4046 -26.4046 -26.3155 -26.3155 -9.5315 -9.5315 -9.0498 -9.0498 -8.5785 -8.5785 -8.0410 -8.0410 -7.9397 -7.9397 -7.8392 -7.8392 -7.6870 -7.6870 -2.9330 -2.9330 2.9383 2.9383 4.4754 4.4754 4.7968 4.7968 6.5921 6.5921 7.3073 7.3073 7.3299 7.3299 9.6624 9.6624 11.0588 11.0588 11.8685 11.8685 11.8865 11.8865 k = 0.1136 0.0303 0.0183 ( 3928 PWs) bands (ev): -26.4046 -26.4046 -26.3155 -26.3155 -9.5377 -9.5377 -9.0429 -9.0429 -8.5814 -8.5814 -8.0135 -8.0135 -7.9397 -7.9397 -7.8392 -7.8392 -7.7139 -7.7139 -2.9307 -2.9307 2.9328 2.9328 4.4740 4.4740 4.7953 4.7953 6.6236 6.6236 7.3122 7.3122 7.3355 7.3355 9.6010 9.6010 11.0669 11.0669 11.8541 11.8541 11.8723 11.8723 k = 0.0909 0.0243 0.0147 ( 3928 PWs) bands (ev): -26.4047 -26.4047 -26.3154 -26.3154 -9.5427 -9.5427 -9.0372 -9.0372 -8.5838 -8.5838 -7.9857 -7.9857 -7.9397 -7.9397 -7.8392 -7.8392 -7.7413 -7.7413 -2.9288 -2.9288 2.9282 2.9282 4.4729 4.4729 4.7940 4.7940 6.6510 6.6510 7.3164 7.3164 7.3401 7.3401 9.5491 9.5491 11.0742 11.0742 11.8421 11.8421 11.8605 11.8605 k = 0.0682 0.0182 0.0110 ( 3946 PWs) bands (ev): -26.4047 -26.4047 -26.3154 -26.3154 -9.5467 -9.5467 -9.0327 -9.0327 -8.5856 -8.5856 -7.9580 -7.9580 -7.9397 -7.9397 -7.8392 -7.8392 -7.7688 -7.7688 -2.9273 -2.9273 2.9246 2.9246 4.4719 4.4719 4.7930 4.7930 6.6734 6.6734 7.3197 7.3197 7.3439 7.3439 9.5075 9.5075 11.0803 11.0803 11.8327 11.8327 11.8512 11.8512 k = 0.0455 0.0121 0.0073 ( 3946 PWs) bands (ev): -26.4047 -26.4047 -26.3154 -26.3154 -9.5496 -9.5496 -9.0294 -9.0294 -8.5870 -8.5870 -7.9397 -7.9397 -7.9311 -7.9311 -7.8392 -7.8392 -7.7955 -7.7955 -2.9262 -2.9262 2.9219 2.9219 4.4712 4.4712 4.7923 4.7923 6.6900 6.6900 7.3222 7.3222 7.3466 7.3466 9.4771 9.4771 11.0848 11.0848 11.8260 11.8260 11.8445 11.8445 k = 0.0227 0.0061 0.0037 ( 3958 PWs) bands (ev): -26.4048 -26.4048 -26.3154 -26.3154 -9.5513 -9.5513 -9.0275 -9.0275 -8.5878 -8.5878 -7.9397 -7.9397 -7.9074 -7.9074 -7.8392 -7.8392 -7.8190 -7.8190 -2.9255 -2.9255 2.9203 2.9203 4.4708 4.4708 4.7918 4.7918 6.7002 6.7002 7.3237 7.3237 7.3483 7.3483 9.4586 9.4586 11.0876 11.0876 11.8219 11.8219 11.8405 11.8405 k = 0.0000 0.0000 0.0000 ( 3943 PWs) bands (ev): -26.4048 -26.4048 -26.3154 -26.3154 -9.5519 -9.5519 -9.0268 -9.0268 -8.5881 -8.5881 -7.9397 -7.9397 -7.8959 -7.8959 -7.8392 -7.8392 -7.8305 -7.8305 -2.9253 -2.9253 2.9198 2.9198 4.4707 4.4707 4.7917 4.7917 6.7036 6.7036 7.3242 7.3242 7.3488 7.3488 9.4524 9.4524 11.0886 11.0886 11.8206 11.8206 11.8392 11.8392 k = 0.0000 0.0000 0.0000 ( 3943 PWs) bands (ev): -26.4048 -26.4048 -26.3154 -26.3154 -9.5519 -9.5519 -9.0268 -9.0268 -8.5881 -8.5881 -7.9397 -7.9397 -7.8959 -7.8959 -7.8392 -7.8392 -7.8305 -7.8305 -2.9253 -2.9253 2.9198 2.9198 4.4707 4.4707 4.7917 4.7917 6.7036 6.7036 7.3242 7.3242 7.3488 7.3488 9.4524 9.4524 11.0886 11.0886 11.8206 11.8206 11.8392 11.8392 k = 0.0062-0.0108-0.0206 ( 3949 PWs) bands (ev): -26.4047 -26.4047 -26.3153 -26.3153 -9.5516 -9.5516 -9.0272 -9.0272 -8.5881 -8.5881 -7.9404 -7.9404 -7.8965 -7.8965 -7.8503 -7.8503 -7.8186 -7.8186 -2.9251 -2.9251 2.9203 2.9203 4.4691 4.4691 4.7899 4.7899 6.7042 6.7042 7.3226 7.3226 7.3473 7.3473 9.4582 9.4582 11.0921 11.0921 11.8169 11.8169 11.8379 11.8379 k = 0.0124-0.0216-0.0412 ( 3947 PWs) bands (ev): -26.4045 -26.4045 -26.3153 -26.3153 -9.5507 -9.5507 -9.0283 -9.0283 -8.5884 -8.5884 -7.9425 -7.9425 -7.8992 -7.8992 -7.8630 -7.8630 -7.8031 -7.8031 -2.9244 -2.9244 2.9221 2.9221 4.4642 4.4642 4.7847 4.7847 6.7060 6.7060 7.3169 7.3169 7.3440 7.3440 9.4753 9.4753 11.1027 11.1027 11.7993 11.7993 11.8411 11.8411 k = 0.0186-0.0324-0.0618 ( 3945 PWs) bands (ev): -26.4042 -26.4042 -26.3152 -26.3152 -9.5492 -9.5492 -9.0301 -9.0301 -8.5887 -8.5887 -7.9461 -7.9461 -7.9058 -7.9058 -7.8718 -7.8718 -7.7875 -7.7875 -2.9233 -2.9233 2.9251 2.9251 4.4560 4.4560 4.7763 4.7763 6.7089 6.7089 7.3051 7.3051 7.3413 7.3413 9.5034 9.5034 11.1201 11.1201 11.7670 11.7670 11.8511 11.8511 k = 0.0248-0.0432-0.0824 ( 3939 PWs) bands (ev): -26.4038 -26.4038 -26.3151 -26.3151 -9.5471 -9.5471 -9.0326 -9.0326 -8.5893 -8.5893 -7.9511 -7.9511 -7.9166 -7.9166 -7.8759 -7.8759 -7.7722 -7.7722 -2.9218 -2.9218 2.9292 2.9292 4.4443 4.4443 4.7649 4.7649 6.7129 6.7129 7.2870 7.2870 7.3401 7.3401 9.5415 9.5415 11.1442 11.1442 11.7238 11.7238 11.8663 11.8663 k = 0.0310-0.0540-0.1030 ( 3947 PWs) bands (ev): -26.4032 -26.4032 -26.3150 -26.3150 -9.5444 -9.5444 -9.0358 -9.0358 -8.5899 -8.5899 -7.9580 -7.9580 -7.9294 -7.9294 -7.8771 -7.8771 -7.7571 -7.7571 -2.9199 -2.9199 2.9343 2.9343 4.4287 4.4287 4.7510 4.7510 6.7182 6.7182 7.2639 7.2639 7.3398 7.3398 9.5889 9.5889 11.1746 11.1746 11.6725 11.6725 11.8863 11.8863 k = 0.0372-0.0648-0.1236 ( 3947 PWs) bands (ev): -26.4026 -26.4026 -26.3148 -26.3148 -9.5412 -9.5412 -9.0397 -9.0397 -8.5907 -8.5907 -7.9675 -7.9675 -7.9416 -7.9416 -7.8771 -7.8771 -7.7424 -7.7424 -2.9176 -2.9176 2.9406 2.9406 4.4091 4.4091 4.7350 4.7350 6.7245 6.7245 7.2371 7.2371 7.3402 7.3402 9.6444 9.6444 11.2111 11.2111 11.6154 11.6154 11.9109 11.9109 k = 0.0435-0.0756-0.1442 ( 3947 PWs) bands (ev): -26.4018 -26.4018 -26.3147 -26.3147 -9.5374 -9.5374 -9.0444 -9.0444 -8.5915 -8.5915 -7.9799 -7.9799 -7.9521 -7.9521 -7.8767 -7.8767 -7.7283 -7.7283 -2.9149 -2.9149 2.9478 2.9478 4.3852 4.3852 4.7175 4.7175 6.7320 6.7320 7.2077 7.2077 7.3410 7.3410 9.7069 9.7069 11.2531 11.2531 11.5543 11.5543 11.9400 11.9400 k = 0.0497-0.0864-0.1648 ( 3951 PWs) bands (ev): -26.4009 -26.4009 -26.3145 -26.3145 -9.5331 -9.5331 -9.0497 -9.0497 -8.5924 -8.5924 -7.9947 -7.9947 -7.9609 -7.9609 -7.8761 -7.8761 -7.7146 -7.7146 -2.9118 -2.9118 2.9559 2.9559 4.3569 4.3569 4.6989 4.6989 6.7406 6.7406 7.1767 7.1767 7.3422 7.3422 9.7754 9.7754 11.3002 11.3002 11.4908 11.4908 11.9736 11.9736 k = 0.0559-0.0972-0.1854 ( 3947 PWs) bands (ev): -26.3999 -26.3999 -26.3142 -26.3142 -9.5283 -9.5283 -9.0556 -9.0556 -8.5934 -8.5934 -8.0108 -8.0108 -7.9690 -7.9690 -7.8756 -7.8756 -7.7015 -7.7015 -2.9084 -2.9084 2.9649 2.9649 4.3241 4.3241 4.6797 4.6797 6.7502 6.7502 7.1448 7.1448 7.3437 7.3437 9.8489 9.8489 11.3516 11.3516 11.4261 11.4261 12.0115 12.0115 k = 0.0621-0.1080-0.2060 ( 3941 PWs) bands (ev): -26.3988 -26.3988 -26.3140 -26.3140 -9.5231 -9.5231 -9.0622 -9.0622 -8.5943 -8.5943 -8.0274 -8.0274 -7.9768 -7.9768 -7.8753 -7.8753 -7.6890 -7.6890 -2.9046 -2.9046 2.9746 2.9746 4.2868 4.2868 4.6601 4.6601 6.7609 6.7609 7.1128 7.1128 7.3455 7.3455 9.9265 9.9265 11.3604 11.3604 11.4079 11.4079 12.0535 12.0535 k = 0.0683-0.1188-0.2266 ( 3935 PWs) bands (ev): -26.3976 -26.3976 -26.3137 -26.3137 -9.5175 -9.5175 -9.0694 -9.0694 -8.5952 -8.5952 -8.0443 -8.0443 -7.9847 -7.9847 -7.8752 -7.8752 -7.6770 -7.6770 -2.9006 -2.9006 2.9850 2.9850 4.2454 4.2454 4.6402 4.6402 6.7726 6.7726 7.0812 7.0812 7.3477 7.3477 10.0074 10.0074 11.2963 11.2963 11.4663 11.4663 12.0988 12.0988 k = 0.0745-0.1296-0.2472 ( 3937 PWs) bands (ev): -26.3963 -26.3963 -26.3135 -26.3135 -9.5115 -9.5115 -9.0772 -9.0772 -8.5961 -8.5961 -8.0611 -8.0611 -7.9926 -7.9926 -7.8753 -7.8753 -7.6657 -7.6657 -2.8962 -2.8962 2.9960 2.9960 4.2002 4.2002 4.6201 4.6201 6.7852 6.7852 7.0506 7.0506 7.3501 7.3501 10.0907 10.0907 11.2331 11.2331 11.5276 11.5276 12.1463 12.1463 k = 0.0807-0.1404-0.2678 ( 3933 PWs) bands (ev): -26.3950 -26.3950 -26.3132 -26.3132 -9.5051 -9.5051 -9.0856 -9.0856 -8.5968 -8.5968 -8.0778 -8.0778 -8.0007 -8.0007 -7.8757 -7.8757 -7.6550 -7.6550 -2.8916 -2.8916 3.0073 3.0073 4.1515 4.1515 4.5997 4.5997 6.7988 6.7988 7.0213 7.0213 7.3529 7.3529 10.1759 10.1759 11.1717 11.1717 11.5910 11.5910 12.1934 12.1934 k = 0.0869-0.1512-0.2884 ( 3941 PWs) bands (ev): -26.3935 -26.3935 -26.3129 -26.3129 -9.4985 -9.4985 -9.0945 -9.0945 -8.5974 -8.5974 -8.0943 -8.0943 -8.0089 -8.0089 -7.8763 -7.8763 -7.6450 -7.6450 -2.8868 -2.8868 3.0191 3.0191 4.1001 4.1001 4.5790 4.5790 6.8133 6.8133 6.9936 6.9936 7.3561 7.3561 10.2623 10.2623 11.1125 11.1125 11.6559 11.6559 12.2347 12.2347 k = 0.0931-0.1620-0.3090 ( 3939 PWs) bands (ev): -26.3919 -26.3919 -26.3126 -26.3126 -9.4917 -9.4917 -9.1039 -9.1039 -8.5978 -8.5978 -8.1106 -8.1106 -8.0173 -8.0173 -7.8773 -7.8773 -7.6356 -7.6356 -2.8817 -2.8817 3.0310 3.0310 4.0463 4.0463 4.5579 4.5579 6.8285 6.8285 6.9677 6.9677 7.3595 7.3595 10.3494 10.3494 11.0559 11.0559 11.7215 11.7215 12.2595 12.2595 k = 0.0993-0.1728-0.3296 ( 3941 PWs) bands (ev): -26.3903 -26.3903 -26.3123 -26.3123 -9.4846 -9.4846 -9.1138 -9.1138 -8.5979 -8.5979 -8.1265 -8.1265 -8.0259 -8.0259 -7.8785 -7.8785 -7.6268 -7.6268 -2.8765 -2.8765 3.0429 3.0429 3.9908 3.9908 4.5362 4.5362 6.8444 6.8444 6.9439 6.9439 7.3633 7.3633 10.4367 10.4367 11.0022 11.0022 11.7872 11.7872 12.2564 12.2564 k = 0.1055-0.1836-0.3502 ( 3943 PWs) bands (ev): -26.3886 -26.3886 -26.3120 -26.3120 -9.4774 -9.4774 -9.1240 -9.1240 -8.5977 -8.5977 -8.1421 -8.1421 -8.0346 -8.0346 -7.8800 -7.8800 -7.6187 -7.6187 -2.8710 -2.8710 3.0549 3.0549 3.9341 3.9341 4.5139 4.5139 6.8608 6.8608 6.9223 6.9223 7.3675 7.3675 10.5237 10.5237 10.9517 10.9517 11.8518 11.8518 12.2272 12.2272 k = 0.1117-0.1944-0.3708 ( 3939 PWs) bands (ev): -26.3868 -26.3868 -26.3117 -26.3117 -9.4702 -9.4702 -9.1347 -9.1347 -8.5972 -8.5972 -8.1572 -8.1572 -8.0434 -8.0434 -7.8818 -7.8818 -7.6113 -7.6113 -2.8655 -2.8655 3.0665 3.0665 3.8767 3.8767 4.4908 4.4908 6.8770 6.8770 6.9037 6.9037 7.3719 7.3719 10.6100 10.6100 10.9046 10.9046 11.9125 11.9125 12.1862 12.1862 k = 0.1180-0.2052-0.3914 ( 3945 PWs) bands (ev): -26.3849 -26.3849 -26.3114 -26.3114 -9.4629 -9.4629 -9.1456 -9.1456 -8.5962 -8.5962 -8.1721 -8.1721 -8.0523 -8.0523 -7.8839 -7.8839 -7.6044 -7.6044 -2.8598 -2.8598 3.0778 3.0778 3.8192 3.8192 4.4669 4.4669 6.8811 6.8811 6.8999 6.8999 7.3765 7.3765 10.6952 10.6952 10.8611 10.8611 11.9605 11.9605 12.1512 12.1512 k = 0.1242-0.2160-0.4120 ( 3947 PWs) bands (ev): -26.3830 -26.3830 -26.3111 -26.3111 -9.4556 -9.4556 -9.1567 -9.1567 -8.5948 -8.5948 -8.1865 -8.1865 -8.0613 -8.0613 -7.8863 -7.8863 -7.5982 -7.5982 -2.8540 -2.8540 3.0885 3.0885 3.7622 3.7622 4.4421 4.4421 6.8678 6.8678 6.9161 6.9161 7.3815 7.3815 10.7788 10.7788 10.8215 10.8215 11.9730 11.9730 12.1496 12.1496 k = 0.1304-0.2268-0.4326 ( 3939 PWs) bands (ev): -26.3811 -26.3811 -26.3108 -26.3108 -9.4484 -9.4484 -9.1681 -9.1681 -8.5928 -8.5928 -8.2004 -8.2004 -8.0704 -8.0704 -7.8890 -7.8890 -7.5926 -7.5926 -2.8482 -2.8482 3.0983 3.0983 3.7062 3.7062 4.4164 4.4164 6.8550 6.8550 6.9342 6.9342 7.3866 7.3866 10.7857 10.7857 10.8606 10.8606 11.9428 11.9428 12.1905 12.1905 k = 0.1366-0.2376-0.4532 ( 3939 PWs) bands (ev): -26.3791 -26.3791 -26.3106 -26.3106 -9.4413 -9.4413 -9.1796 -9.1796 -8.5904 -8.5904 -8.2140 -8.2140 -8.0795 -8.0795 -7.8919 -7.8919 -7.5877 -7.5877 -2.8423 -2.8423 3.1069 3.1069 3.6518 3.6518 4.3897 4.3897 6.8441 6.8441 6.9529 6.9529 7.3919 7.3919 10.7540 10.7540 10.9400 10.9400 11.8942 11.8942 12.2509 12.2509 k = 0.1428-0.2485-0.4738 ( 3935 PWs) bands (ev): -26.3770 -26.3770 -26.3103 -26.3103 -9.4344 -9.4344 -9.1911 -9.1911 -8.5873 -8.5873 -8.2271 -8.2271 -8.0888 -8.0888 -7.8951 -7.8951 -7.5832 -7.5832 -2.8364 -2.8364 3.1140 3.1140 3.5998 3.5998 4.3620 4.3620 6.8351 6.8351 6.9717 6.9717 7.3974 7.3974 10.7265 10.7265 11.0168 11.0168 11.8404 11.8404 12.3181 12.3181 k = 0.1490-0.2593-0.4944 ( 3931 PWs) bands (ev): -26.3750 -26.3750 -26.3101 -26.3101 -9.4277 -9.4277 -9.2026 -9.2026 -8.5836 -8.5836 -8.2398 -8.2398 -8.0981 -8.0981 -7.8985 -7.8985 -7.5794 -7.5794 -2.8305 -2.8305 3.1191 3.1191 3.5508 3.5508 4.3333 4.3333 6.8281 6.8281 6.9905 6.9905 7.4029 7.4029 10.7032 10.7032 11.0906 11.0906 11.7857 11.7857 12.3872 12.3872 k = 0.1552-0.2701-0.5150 ( 3931 PWs) bands (ev): -26.3729 -26.3729 -26.3099 -26.3099 -9.4213 -9.4213 -9.2141 -9.2141 -8.5793 -8.5793 -8.2520 -8.2520 -8.1074 -8.1074 -7.9022 -7.9022 -7.5761 -7.5761 -2.8246 -2.8246 3.1214 3.1214 3.5057 3.5057 4.3037 4.3037 6.8230 6.8230 7.0093 7.0093 7.4085 7.4085 10.6842 10.6842 11.1610 11.1610 11.7317 11.7317 12.4357 12.4357 k = 0.1614-0.2809-0.5356 ( 3929 PWs) bands (ev): -26.3707 -26.3707 -26.3098 -26.3098 -9.4151 -9.4151 -9.2255 -9.2255 -8.5744 -8.5744 -8.2638 -8.2638 -8.1167 -8.1167 -7.9062 -7.9062 -7.5733 -7.5733 -2.8188 -2.8188 3.1203 3.1203 3.4656 3.4656 4.2731 4.2731 6.8197 6.8197 7.0278 7.0278 7.4141 7.4141 10.6695 10.6695 11.2275 11.2275 11.6789 11.6789 12.4240 12.4240 k = 0.1676-0.2917-0.5562 ( 3927 PWs) bands (ev): -26.3686 -26.3686 -26.3097 -26.3097 -9.4093 -9.4093 -9.2367 -9.2367 -8.5688 -8.5688 -8.2752 -8.2752 -8.1260 -8.1260 -7.9104 -7.9104 -7.5710 -7.5710 -2.8130 -2.8130 3.1149 3.1149 3.4314 3.4314 4.2416 4.2416 6.8181 6.8181 7.0459 7.0459 7.4197 7.4197 10.6593 10.6593 11.2900 11.2900 11.6280 11.6280 12.4048 12.4048 k = 0.1738-0.3025-0.5768 ( 3925 PWs) bands (ev): -26.3665 -26.3665 -26.3096 -26.3096 -9.4038 -9.4038 -9.2476 -9.2476 -8.5626 -8.5626 -8.2861 -8.2861 -8.1353 -8.1353 -7.9148 -7.9148 -7.5692 -7.5692 -2.8074 -2.8074 3.1045 3.1045 3.4041 3.4041 4.2091 4.2091 6.8181 6.8181 7.0636 7.0636 7.4251 7.4251 10.6534 10.6534 11.3480 11.3480 11.5790 11.5790 12.3840 12.3840 k = 0.1800-0.3133-0.5974 ( 3923 PWs) bands (ev): -26.3643 -26.3643 -26.3095 -26.3095 -9.3987 -9.3987 -9.2582 -9.2582 -8.5558 -8.5558 -8.2965 -8.2965 -8.1446 -8.1446 -7.9194 -7.9194 -7.5679 -7.5679 -2.8018 -2.8018 3.0892 3.0892 3.3838 3.3838 4.1759 4.1759 6.8196 6.8196 7.0807 7.0807 7.4304 7.4304 10.6518 10.6518 11.4012 11.4012 11.5322 11.5322 12.3623 12.3623 k = 0.1862-0.3241-0.6180 ( 3922 PWs) bands (ev): -26.3622 -26.3622 -26.3095 -26.3095 -9.3940 -9.3940 -9.2685 -9.2685 -8.5486 -8.5486 -8.3064 -8.3064 -8.1537 -8.1537 -7.9242 -7.9242 -7.5669 -7.5669 -2.7963 -2.7963 3.0695 3.0695 3.3701 3.3701 4.1418 4.1418 6.8225 6.8225 7.0971 7.0971 7.4355 7.4355 10.6547 10.6547 11.4490 11.4490 11.4879 11.4879 12.3400 12.3400 k = 0.1924-0.3349-0.6386 ( 3920 PWs) bands (ev): -26.3600 -26.3600 -26.3096 -26.3096 -9.3897 -9.3897 -9.2784 -9.2784 -8.5409 -8.5409 -8.3158 -8.3158 -8.1627 -8.1627 -7.9292 -7.9292 -7.5664 -7.5664 -2.7910 -2.7910 3.0467 3.0467 3.3618 3.3618 4.1070 4.1070 6.8267 6.8267 7.1127 7.1127 7.4403 7.4403 10.6619 10.6619 11.4443 11.4443 11.4932 11.4932 12.3175 12.3175 k = 0.1987-0.3457-0.6592 ( 3922 PWs) bands (ev): -26.3579 -26.3579 -26.3096 -26.3096 -9.3857 -9.3857 -9.2878 -9.2878 -8.5329 -8.5329 -8.3246 -8.3246 -8.1716 -8.1716 -7.9344 -7.9344 -7.5663 -7.5663 -2.7859 -2.7859 3.0223 3.0223 3.3576 3.3576 4.0716 4.0716 6.8321 6.8321 7.1274 7.1274 7.4449 7.4449 10.6734 10.6734 11.4045 11.4045 11.5305 11.5305 12.2950 12.2950 k = 0.2049-0.3565-0.6798 ( 3928 PWs) bands (ev): -26.3558 -26.3558 -26.3098 -26.3098 -9.3822 -9.3822 -9.2966 -9.2966 -8.5247 -8.5247 -8.3328 -8.3328 -8.1803 -8.1803 -7.9398 -7.9398 -7.5665 -7.5665 -2.7809 -2.7809 2.9975 2.9975 3.3564 3.3564 4.0355 4.0355 6.8385 6.8385 7.1410 7.1410 7.4491 7.4491 10.6891 10.6891 11.3667 11.3667 11.5627 11.5627 12.2728 12.2728 k = 0.2111-0.3673-0.7004 ( 3932 PWs) bands (ev): -26.3537 -26.3537 -26.3099 -26.3099 -9.3791 -9.3791 -9.3049 -9.3049 -8.5165 -8.5165 -8.3401 -8.3401 -8.1887 -8.1887 -7.9453 -7.9453 -7.5671 -7.5671 -2.7762 -2.7762 2.9734 2.9734 3.3573 3.3573 3.9990 3.9990 6.8459 6.8459 7.1534 7.1534 7.4531 7.4531 10.7091 10.7091 11.3311 11.3311 11.5894 11.5894 12.2510 12.2510 k = 0.2173-0.3781-0.7210 ( 3930 PWs) bands (ev): -26.3517 -26.3517 -26.3101 -26.3101 -9.3764 -9.3764 -9.3126 -9.3126 -8.5086 -8.5086 -8.3466 -8.3466 -8.1967 -8.1967 -7.9510 -7.9510 -7.5680 -7.5680 -2.7716 -2.7716 2.9507 2.9507 3.3594 3.3594 3.9620 3.9620 6.8542 6.8542 7.1647 7.1647 7.4567 7.4567 10.7331 10.7331 11.2977 11.2977 11.6108 11.6108 12.2300 12.2300 k = 0.2235-0.3889-0.7416 ( 3928 PWs) bands (ev): -26.3496 -26.3496 -26.3104 -26.3104 -9.3741 -9.3741 -9.3196 -9.3196 -8.5012 -8.5012 -8.3520 -8.3520 -8.2043 -8.2043 -7.9568 -7.9568 -7.5691 -7.5691 -2.7673 -2.7673 2.9301 2.9301 3.3624 3.3624 3.9248 3.9248 6.8633 6.8633 7.1747 7.1747 7.4599 7.4599 10.7612 10.7612 11.2665 11.2665 11.6269 11.6269 12.2101 12.2101 k = 0.2297-0.3997-0.7622 ( 3932 PWs) bands (ev): -26.3477 -26.3477 -26.3107 -26.3107 -9.3723 -9.3723 -9.3259 -9.3259 -8.4946 -8.4946 -8.3561 -8.3561 -8.2114 -8.2114 -7.9626 -7.9626 -7.5706 -7.5706 -2.7632 -2.7632 2.9119 2.9119 3.3659 3.3659 3.8873 3.8873 6.8730 6.8730 7.1832 7.1832 7.4627 7.4627 10.7933 10.7933 11.2375 11.2375 11.6379 11.6379 12.1913 12.1913 k = 0.2359-0.4105-0.7828 ( 3936 PWs) bands (ev): -26.3457 -26.3457 -26.3111 -26.3111 -9.3710 -9.3710 -9.3315 -9.3315 -8.4893 -8.4893 -8.3587 -8.3587 -8.2178 -8.2178 -7.9686 -7.9686 -7.5724 -7.5724 -2.7594 -2.7594 2.8963 2.8963 3.3694 3.3694 3.8499 3.8499 6.8834 6.8834 7.1903 7.1903 7.4652 7.4652 10.8292 10.8292 11.2106 11.2106 11.6441 11.6441 12.1740 12.1740 k = 0.2421-0.4213-0.8034 ( 3938 PWs) bands (ev): -26.3438 -26.3438 -26.3115 -26.3115 -9.3702 -9.3702 -9.3362 -9.3362 -8.4854 -8.4854 -8.3597 -8.3597 -8.2234 -8.2234 -7.9746 -7.9746 -7.5743 -7.5743 -2.7558 -2.7558 2.8836 2.8836 3.3729 3.3729 3.8126 3.8126 6.8942 6.8942 7.1959 7.1959 7.4673 7.4673 10.8689 10.8689 11.1858 11.1858 11.6455 11.6455 12.1585 12.1585 k = 0.2483-0.4321-0.8240 ( 3938 PWs) bands (ev): -26.3420 -26.3420 -26.3120 -26.3120 -9.3699 -9.3699 -9.3400 -9.3400 -8.4833 -8.4833 -8.3591 -8.3591 -8.2280 -8.2280 -7.9807 -7.9807 -7.5766 -7.5766 -2.7525 -2.7525 2.8739 2.8739 3.3761 3.3761 3.7756 3.7756 6.9055 6.9055 7.2000 7.2000 7.4690 7.4690 10.9122 10.9122 11.1630 11.1630 11.6424 11.6424 12.1448 12.1448 k = 0.2545-0.4429-0.8446 ( 3940 PWs) bands (ev): -26.3402 -26.3402 -26.3125 -26.3125 -9.3700 -9.3700 -9.3431 -9.3431 -8.4828 -8.4828 -8.3572 -8.3572 -8.2315 -8.2315 -7.9868 -7.9868 -7.5790 -7.5790 -2.7495 -2.7495 2.8673 2.8673 3.3788 3.3788 3.7391 3.7391 6.9172 6.9172 7.2024 7.2024 7.4705 7.4705 10.9591 10.9591 11.1422 11.1422 11.6348 11.6348 12.1332 12.1332 k = 0.2607-0.4537-0.8652 ( 3934 PWs) bands (ev): -26.3384 -26.3384 -26.3131 -26.3131 -9.3706 -9.3706 -9.3454 -9.3454 -8.4837 -8.4837 -8.3543 -8.3543 -8.2336 -8.2336 -7.9928 -7.9928 -7.5817 -7.5817 -2.7467 -2.7467 2.8638 2.8638 3.3807 3.3807 3.7036 3.7036 6.9292 6.9292 7.2032 7.2032 7.4717 7.4717 11.0093 11.0093 11.1233 11.1233 11.6229 11.6229 12.1238 12.1238 k = 0.2669-0.4645-0.8858 ( 3928 PWs) bands (ev): -26.3367 -26.3367 -26.3137 -26.3137 -9.3715 -9.3715 -9.3471 -9.3471 -8.4859 -8.4859 -8.3509 -8.3509 -8.2341 -8.2341 -7.9989 -7.9989 -7.5846 -7.5846 -2.7442 -2.7442 2.8633 2.8633 3.3815 3.3815 3.6693 3.6693 6.9415 6.9415 7.2023 7.2023 7.4727 7.4727 11.0626 11.0626 11.1064 11.1064 11.6066 11.6066 12.1168 12.1168 k = 0.2732-0.4753-0.9064 ( 3934 PWs) bands (ev): -26.3351 -26.3351 -26.3143 -26.3143 -9.3724 -9.3724 -9.3484 -9.3484 -8.4890 -8.4890 -8.3475 -8.3475 -8.2328 -8.2328 -8.0048 -8.0048 -7.5877 -7.5877 -2.7419 -2.7419 2.8657 2.8657 3.3809 3.3809 3.6368 3.6368 6.9541 6.9541 7.1997 7.1997 7.4735 7.4735 11.0900 11.0900 11.1203 11.1203 11.5859 11.5859 12.1121 12.1121 k = 0.2794-0.4861-0.9270 ( 3930 PWs) bands (ev): -26.3336 -26.3336 -26.3150 -26.3150 -9.3733 -9.3733 -9.3496 -9.3496 -8.4927 -8.4927 -8.3446 -8.3446 -8.2298 -8.2298 -8.0106 -8.0106 -7.5910 -7.5910 -2.7400 -2.7400 2.8709 2.8709 3.3784 3.3784 3.6067 3.6067 6.9668 6.9668 7.1954 7.1954 7.4741 7.4741 11.0768 11.0768 11.1795 11.1795 11.5607 11.5607 12.1100 12.1100 k = 0.2856-0.4969-0.9476 ( 3936 PWs) bands (ev): -26.3321 -26.3321 -26.3158 -26.3158 -9.3740 -9.3740 -9.3506 -9.3506 -8.4967 -8.4967 -8.3423 -8.3423 -8.2249 -8.2249 -8.0162 -8.0162 -7.5945 -7.5945 -2.7383 -2.7383 2.8787 2.8787 3.3733 3.3733 3.5799 3.5799 6.9797 6.9797 7.1895 7.1895 7.4747 7.4747 11.0648 11.0648 11.2420 11.2420 11.5310 11.5310 12.1103 12.1103 k = 0.2918-0.5077-0.9682 ( 3930 PWs) bands (ev): -26.3306 -26.3306 -26.3166 -26.3166 -9.3745 -9.3745 -9.3516 -9.3516 -8.5009 -8.5009 -8.3406 -8.3406 -8.2186 -8.2186 -8.0215 -8.0215 -7.5983 -7.5983 -2.7369 -2.7369 2.8887 2.8887 3.3653 3.3653 3.5571 3.5571 6.9927 6.9927 7.1821 7.1821 7.4752 7.4752 11.0542 11.0542 11.3069 11.3069 11.4969 11.4969 12.1132 12.1132 k = 0.2980-0.5185-0.9888 ( 3928 PWs) bands (ev): -26.3292 -26.3292 -26.3174 -26.3174 -9.3747 -9.3747 -9.3527 -9.3527 -8.5051 -8.5051 -8.3394 -8.3394 -8.2111 -8.2111 -8.0266 -8.0266 -7.6022 -7.6022 -2.7357 -2.7357 2.9006 2.9006 3.3540 3.3540 3.5388 3.5388 7.0059 7.0059 7.1731 7.1731 7.4758 7.4758 11.0449 11.0449 11.3734 11.3734 11.4591 11.4591 12.1185 12.1185 k = 0.3042-0.5293-1.0094 ( 3928 PWs) bands (ev): -26.3279 -26.3279 -26.3182 -26.3182 -9.3747 -9.3747 -9.3540 -9.3540 -8.5091 -8.5091 -8.3386 -8.3386 -8.2028 -8.2028 -8.0311 -8.0311 -7.6063 -7.6063 -2.7348 -2.7348 2.9137 2.9137 3.3401 3.3401 3.5253 3.5253 7.0192 7.0192 7.1626 7.1626 7.4763 7.4763 11.0366 11.0366 11.4070 11.4070 11.4520 11.4520 12.1262 12.1262 k = 0.3104-0.5401-1.0300 ( 3926 PWs) bands (ev): -26.3267 -26.3267 -26.3191 -26.3191 -9.3744 -9.3744 -9.3554 -9.3554 -8.5128 -8.5128 -8.3379 -8.3379 -8.1941 -8.1941 -8.0351 -8.0351 -7.6106 -7.6106 -2.7341 -2.7341 2.9273 2.9273 3.3247 3.3247 3.5159 3.5159 7.0325 7.0325 7.1510 7.1510 7.4769 7.4769 11.0289 11.0289 11.3633 11.3633 11.5204 11.5204 12.1362 12.1362 k = 0.3166-0.5509-1.0506 ( 3924 PWs) bands (ev): -26.3255 -26.3255 -26.3200 -26.3200 -9.3740 -9.3740 -9.3569 -9.3569 -8.5162 -8.5162 -8.3373 -8.3373 -8.1854 -8.1854 -8.0384 -8.0384 -7.6151 -7.6151 -2.7336 -2.7336 2.9402 2.9402 3.3097 3.3097 3.5100 3.5100 7.0458 7.0458 7.1383 7.1383 7.4776 7.4776 11.0209 11.0209 11.3127 11.3127 11.5944 11.5944 12.1486 12.1486 k = 0.3228-0.5617-1.0712 ( 3926 PWs) bands (ev): -26.3244 -26.3244 -26.3210 -26.3210 -9.3735 -9.3735 -9.3585 -9.3585 -8.5191 -8.5191 -8.3365 -8.3365 -8.1770 -8.1770 -8.0408 -8.0408 -7.6199 -7.6199 -2.7333 -2.7333 2.9509 2.9509 3.2970 3.2970 3.5067 3.5067 7.0587 7.0587 7.1250 7.1250 7.4784 7.4784 11.0112 11.0112 11.2602 11.2602 11.6706 11.6706 12.1632 12.1632 k = 0.3290-0.5725-1.0918 ( 3930 PWs) bands (ev): -26.3233 -26.3233 -26.3219 -26.3219 -9.3731 -9.3731 -9.3600 -9.3600 -8.5215 -8.5215 -8.3356 -8.3356 -8.1693 -8.1693 -8.0420 -8.0420 -7.6249 -7.6249 -2.7333 -2.7333 2.9580 2.9580 3.2888 3.2888 3.5056 3.5056 7.0700 7.0700 7.1127 7.1127 7.4793 7.4793 10.9968 10.9968 11.2093 11.2093 11.7483 11.7483 12.1801 12.1801 k = 0.3352-0.5833-1.1124 ( 3932 PWs) bands (ev): -26.3229 -26.3229 -26.3223 -26.3223 -9.3732 -9.3732 -9.3611 -9.3611 -8.5234 -8.5234 -8.3343 -8.3343 -8.1626 -8.1626 -8.0419 -8.0419 -7.6300 -7.6300 -2.7334 -2.7334 2.9598 2.9598 3.2868 3.2868 3.5064 3.5064 7.0741 7.0741 7.1067 7.1067 7.4802 7.4802 10.9727 10.9727 11.1653 11.1653 11.8270 11.8270 12.1994 12.1994 k = 0.3414-0.5941-1.1331 ( 3934 PWs) bands (ev): -26.3239 -26.3239 -26.3214 -26.3214 -9.3741 -9.3741 -9.3616 -9.3616 -8.5247 -8.5247 -8.3328 -8.3328 -8.1571 -8.1571 -8.0403 -8.0403 -7.6355 -7.6355 -2.7337 -2.7337 2.9556 2.9556 3.2917 3.2917 3.5090 3.5090 7.0652 7.0652 7.1135 7.1135 7.4813 7.4813 10.9333 10.9333 11.1344 11.1344 11.9062 11.9062 12.2215 12.2215 k = 0.6586-0.4607-1.0523 ( 3934 PWs) bands (ev): -26.3239 -26.3239 -26.3214 -26.3214 -9.3741 -9.3741 -9.3616 -9.3616 -8.5247 -8.5247 -8.3328 -8.3328 -8.1571 -8.1571 -8.0403 -8.0403 -7.6355 -7.6355 -2.7337 -2.7337 2.9556 2.9556 3.2917 3.2917 3.5090 3.5090 7.0652 7.0652 7.1135 7.1135 7.4813 7.4813 10.9333 10.9333 11.1344 11.1344 11.9062 11.9062 12.2215 12.2215 k = 0.6525-0.4378-1.0523 ( 3926 PWs) bands (ev): -26.3249 -26.3249 -26.3205 -26.3205 -9.3758 -9.3758 -9.3612 -9.3612 -8.5254 -8.5254 -8.3310 -8.3310 -8.1531 -8.1531 -8.0373 -8.0373 -7.6410 -7.6410 -2.7342 -2.7342 2.9457 2.9457 3.3026 3.3026 3.5135 3.5135 7.0502 7.0502 7.1260 7.1260 7.4825 7.4825 10.8790 10.8790 11.1178 11.1178 11.9834 11.9834 12.2467 12.2467 k = 0.6464-0.4150-1.0523 ( 3936 PWs) bands (ev): -26.3259 -26.3259 -26.3197 -26.3197 -9.3784 -9.3784 -9.3603 -9.3603 -8.5255 -8.5255 -8.3289 -8.3289 -8.1502 -8.1502 -8.0328 -8.0328 -7.6468 -7.6468 -2.7348 -2.7348 2.9310 2.9310 3.3180 3.3180 3.5207 3.5207 7.0333 7.0333 7.1404 7.1404 7.4837 7.4837 10.8136 10.8136 11.1111 11.1111 12.0583 12.0583 12.2766 12.2766 k = 0.6403-0.3921-1.0523 ( 3932 PWs) bands (ev): -26.3269 -26.3269 -26.3190 -26.3190 -9.3815 -9.3815 -9.3590 -9.3590 -8.5250 -8.5250 -8.3265 -8.3265 -8.1485 -8.1485 -8.0271 -8.0271 -7.6528 -7.6528 -2.7356 -2.7356 2.9127 2.9127 3.3358 3.3358 3.5314 3.5314 7.0155 7.0155 7.1557 7.1557 7.4851 7.4851 10.7411 10.7411 11.1107 11.1107 12.1281 12.1281 12.3140 12.3140 k = 0.6342-0.3693-1.0523 ( 3928 PWs) bands (ev): -26.3279 -26.3279 -26.3183 -26.3183 -9.3850 -9.3850 -9.3575 -9.3575 -8.5240 -8.5240 -8.3239 -8.3239 -8.1475 -8.1475 -8.0204 -8.0204 -7.6590 -7.6590 -2.7365 -2.7365 2.8918 2.8918 3.3536 3.3536 3.5466 3.5466 6.9973 6.9973 7.1716 7.1716 7.4865 7.4865 10.6644 10.6644 11.1140 11.1140 12.1890 12.1890 12.3623 12.3623 k = 0.6281-0.3464-1.0523 ( 3926 PWs) bands (ev): -26.3288 -26.3288 -26.3177 -26.3177 -9.3888 -9.3888 -9.3558 -9.3558 -8.5224 -8.5224 -8.3211 -8.3211 -8.1471 -8.1471 -8.0130 -8.0130 -7.6654 -7.6654 -2.7375 -2.7375 2.8693 2.8693 3.3692 3.3692 3.5673 3.5673 6.9790 6.9790 7.1881 7.1881 7.4880 7.4880 10.5852 10.5852 11.1199 11.1199 12.2391 12.2391 12.4234 12.4234 k = 0.6220-0.3236-1.0523 ( 3926 PWs) bands (ev): -26.3298 -26.3298 -26.3171 -26.3171 -9.3928 -9.3928 -9.3542 -9.3542 -8.5203 -8.5203 -8.3182 -8.3182 -8.1470 -8.1470 -8.0050 -8.0050 -7.6720 -7.6720 -2.7385 -2.7385 2.8459 2.8459 3.3817 3.3817 3.5938 3.5938 6.9606 6.9606 7.2051 7.2051 7.4896 7.4896 10.5046 10.5046 11.1275 11.1275 12.2801 12.2801 12.4951 12.4951 k = 0.6159-0.3007-1.0523 ( 3916 PWs) bands (ev): -26.3307 -26.3307 -26.3165 -26.3165 -9.3970 -9.3970 -9.3525 -9.3525 -8.5178 -8.5178 -8.3153 -8.3153 -8.1469 -8.1469 -7.9968 -7.9968 -7.6789 -7.6789 -2.7397 -2.7397 2.8222 2.8222 3.3906 3.3906 3.6256 3.6256 6.9423 6.9423 7.2225 7.2225 7.4912 7.4912 10.4235 10.4235 11.1363 11.1363 12.3159 12.3159 12.5735 12.5735 k = 0.6098-0.2779-1.0523 ( 3916 PWs) bands (ev): -26.3317 -26.3317 -26.3160 -26.3160 -9.4013 -9.4013 -9.3508 -9.3508 -8.5148 -8.5148 -8.3124 -8.3124 -8.1466 -8.1466 -7.9886 -7.9886 -7.6859 -7.6859 -2.7409 -2.7409 2.7985 2.7985 3.3965 3.3965 3.6617 3.6617 6.9244 6.9244 7.2405 7.2405 7.4929 7.4929 10.3426 10.3426 11.1459 11.1459 12.3491 12.3491 12.6557 12.6557 k = 0.6037-0.2550-1.0523 ( 3924 PWs) bands (ev): -26.3326 -26.3326 -26.3156 -26.3156 -9.4057 -9.4057 -9.3493 -9.3493 -8.5115 -8.5115 -8.3097 -8.3097 -8.1459 -8.1459 -7.9803 -7.9803 -7.6931 -7.6931 -2.7422 -2.7422 2.7752 2.7752 3.3999 3.3999 3.7010 3.7010 6.9068 6.9068 7.2588 7.2588 7.4946 7.4946 10.2624 10.2624 11.1559 11.1559 12.3815 12.3815 12.7392 12.7392 k = 0.5976-0.2322-1.0523 ( 3926 PWs) bands (ev): -26.3335 -26.3335 -26.3152 -26.3152 -9.4101 -9.4101 -9.3478 -9.3478 -8.5079 -8.5079 -8.3071 -8.3071 -8.1446 -8.1446 -7.9723 -7.9723 -7.7005 -7.7005 -2.7435 -2.7435 2.7524 2.7524 3.4015 3.4015 3.7423 3.7423 6.8897 6.8897 7.2775 7.2775 7.4963 7.4963 10.1834 10.1834 11.1660 11.1660 12.4139 12.4139 12.8036 12.8036 k = 0.5915-0.2093-1.0523 ( 3928 PWs) bands (ev): -26.3343 -26.3343 -26.3148 -26.3148 -9.4145 -9.4145 -9.3464 -9.3464 -8.5040 -8.5040 -8.3049 -8.3049 -8.1427 -8.1427 -7.9645 -7.9645 -7.7079 -7.7079 -2.7449 -2.7449 2.7304 2.7304 3.4018 3.4018 3.7849 3.7849 6.8732 6.8732 7.2964 7.2964 7.4981 7.4981 10.1060 10.1060 11.1760 11.1760 12.4468 12.4468 12.7559 12.7559 k = 0.5854-0.1865-1.0523 ( 3930 PWs) bands (ev): -26.3351 -26.3351 -26.3144 -26.3144 -9.4189 -9.4189 -9.3451 -9.3451 -8.4999 -8.4999 -8.3031 -8.3031 -8.1402 -8.1402 -7.9571 -7.9571 -7.7155 -7.7155 -2.7462 -2.7462 2.7093 2.7093 3.4010 3.4010 3.8279 3.8279 6.8574 6.8574 7.3156 7.3156 7.4999 7.4999 10.0308 10.0308 11.1856 11.1856 12.4807 12.4807 12.7007 12.7007 k = 0.5793-0.1636-1.0523 ( 3934 PWs) bands (ev): -26.3359 -26.3359 -26.3141 -26.3141 -9.4231 -9.4231 -9.3438 -9.3438 -8.4958 -8.4958 -8.3017 -8.3017 -8.1368 -8.1368 -7.9501 -7.9501 -7.7230 -7.7230 -2.7475 -2.7475 2.6892 2.6892 3.3996 3.3996 3.8706 3.8706 6.8424 6.8424 7.3348 7.3348 7.5017 7.5017 9.9581 9.9581 11.1946 11.1946 12.5155 12.5155 12.6453 12.6453 k = 0.5732-0.1408-1.0523 ( 3936 PWs) bands (ev): -26.3366 -26.3366 -26.3139 -26.3139 -9.4272 -9.4272 -9.3428 -9.3428 -8.4916 -8.4916 -8.3007 -8.3007 -8.1328 -8.1328 -7.9437 -7.9437 -7.7305 -7.7305 -2.7488 -2.7488 2.6702 2.6702 3.3977 3.3977 3.9126 3.9126 6.8282 6.8282 7.3539 7.3539 7.5035 7.5035 9.8884 9.8884 11.2026 11.2026 12.5506 12.5506 12.5918 12.5918 k = 0.5671-0.1179-1.0523 ( 3930 PWs) bands (ev): -26.3373 -26.3373 -26.3136 -26.3136 -9.4311 -9.4311 -9.3418 -9.3418 -8.4874 -8.4874 -8.3000 -8.3000 -8.1281 -8.1281 -7.9378 -7.9378 -7.7379 -7.7379 -2.7501 -2.7501 2.6525 2.6525 3.3955 3.3955 3.9534 3.9534 6.8150 6.8150 7.3727 7.3727 7.5054 7.5054 9.8219 9.8219 11.2097 11.2097 12.5363 12.5363 12.5906 12.5906 k = 0.5610-0.0951-1.0523 ( 3930 PWs) bands (ev): -26.3379 -26.3379 -26.3134 -26.3134 -9.4349 -9.4349 -9.3409 -9.3409 -8.4833 -8.4833 -8.2998 -8.2998 -8.1228 -8.1228 -7.9325 -7.9325 -7.7451 -7.7451 -2.7514 -2.7514 2.6361 2.6361 3.3931 3.3931 3.9923 3.9923 6.8027 6.8027 7.3911 7.3911 7.5073 7.5073 9.7592 9.7592 11.2155 11.2155 12.4870 12.4870 12.6282 12.6282 k = 0.5549-0.0722-1.0523 ( 3930 PWs) bands (ev): -26.3385 -26.3385 -26.3132 -26.3132 -9.4383 -9.4383 -9.3401 -9.3401 -8.4793 -8.4793 -8.2999 -8.2999 -8.1171 -8.1171 -7.9278 -7.9278 -7.7520 -7.7520 -2.7525 -2.7525 2.6210 2.6210 3.3906 3.3906 4.0291 4.0291 6.7914 6.7914 7.4087 7.4087 7.5093 7.5093 9.7006 9.7006 11.2201 11.2201 12.4406 12.4406 12.6672 12.6672 k = 0.5488-0.0494-1.0523 ( 3928 PWs) bands (ev): -26.3391 -26.3391 -26.3131 -26.3131 -9.4415 -9.4415 -9.3394 -9.3394 -8.4756 -8.4756 -8.3002 -8.3002 -8.1112 -8.1112 -7.9238 -7.9238 -7.7585 -7.7585 -2.7536 -2.7536 2.6074 2.6074 3.3881 3.3881 4.0632 4.0632 6.7812 6.7812 7.4252 7.4252 7.5115 7.5115 9.6466 9.6466 11.2234 11.2234 12.3983 12.3983 12.7067 12.7067 k = 0.5427-0.0265-1.0523 ( 3926 PWs) bands (ev): -26.3395 -26.3395 -26.3129 -26.3129 -9.4444 -9.4444 -9.3388 -9.3388 -8.4721 -8.4721 -8.3007 -8.3007 -8.1052 -8.1052 -7.9206 -7.9206 -7.7645 -7.7645 -2.7546 -2.7546 2.5953 2.5953 3.3857 3.3857 4.0944 4.0944 6.7721 6.7721 7.4403 7.4403 7.5139 7.5139 9.5976 9.5976 11.2256 11.2256 12.3605 12.3605 12.7460 12.7460 k = 0.5366-0.0037-1.0523 ( 3926 PWs) bands (ev): -26.3399 -26.3399 -26.3128 -26.3128 -9.4469 -9.4469 -9.3383 -9.3383 -8.4690 -8.4690 -8.3014 -8.3014 -8.0993 -8.0993 -7.9180 -7.9180 -7.7699 -7.7699 -2.7555 -2.7555 2.5847 2.5847 3.3835 3.3835 4.1221 4.1221 6.7642 6.7642 7.4536 7.4536 7.5166 7.5166 9.5540 9.5540 11.2266 11.2266 12.3276 12.3276 12.7846 12.7846 k = 0.5305 0.0192-1.0523 ( 3920 PWs) bands (ev): -26.3403 -26.3403 -26.3127 -26.3127 -9.4491 -9.4491 -9.3379 -9.3379 -8.4663 -8.4663 -8.3020 -8.3020 -8.0937 -8.0937 -7.9161 -7.9161 -7.7747 -7.7747 -2.7562 -2.7562 2.5756 2.5756 3.3816 3.3816 4.1462 4.1462 6.7574 6.7574 7.4647 7.4647 7.5197 7.5197 9.5163 9.5163 11.2269 11.2269 12.2997 12.2997 12.8212 12.8212 k = 0.5244 0.0420-1.0523 ( 3922 PWs) bands (ev): -26.3406 -26.3406 -26.3126 -26.3126 -9.4509 -9.4509 -9.3376 -9.3376 -8.4639 -8.4639 -8.3026 -8.3026 -8.0888 -8.0888 -7.9148 -7.9148 -7.7786 -7.7786 -2.7569 -2.7569 2.5682 2.5682 3.3799 3.3799 4.1663 4.1663 6.7518 6.7518 7.4735 7.4735 7.5231 7.5231 9.4847 9.4847 11.2265 11.2265 12.2770 12.2770 12.8547 12.8547 k = 0.5183 0.0649-1.0523 ( 3920 PWs) bands (ev): -26.3408 -26.3408 -26.3126 -26.3126 -9.4524 -9.4524 -9.3373 -9.3373 -8.4621 -8.4621 -8.3032 -8.3032 -8.0846 -8.0846 -7.9139 -7.9139 -7.7818 -7.7818 -2.7574 -2.7574 2.5624 2.5624 3.3785 3.3785 4.1822 4.1822 6.7475 6.7475 7.4798 7.4798 7.5265 7.5265 9.4598 9.4598 11.2259 11.2259 12.2594 12.2594 12.8835 12.8835 k = 0.5122 0.0877-1.0523 ( 3916 PWs) bands (ev): -26.3410 -26.3410 -26.3125 -26.3125 -9.4534 -9.4534 -9.3372 -9.3372 -8.4607 -8.4607 -8.3036 -8.3036 -8.0814 -8.0814 -7.9134 -7.9134 -7.7840 -7.7840 -2.7577 -2.7577 2.5582 2.5582 3.3776 3.3776 4.1937 4.1937 6.7444 6.7444 7.4840 7.4840 7.5295 7.5295 9.4417 9.4417 11.2252 11.2252 12.2470 12.2470 12.9060 12.9060 k = 0.5061 0.1106-1.0523 ( 3922 PWs) bands (ev): -26.3411 -26.3411 -26.3125 -26.3125 -9.4540 -9.4540 -9.3370 -9.3370 -8.4599 -8.4599 -8.3039 -8.3039 -8.0795 -8.0795 -7.9132 -7.9132 -7.7854 -7.7854 -2.7579 -2.7579 2.5557 2.5557 3.3770 3.3770 4.2007 4.2007 6.7425 6.7425 7.4863 7.4863 7.5315 7.5315 9.4308 9.4308 11.2247 11.2247 12.2395 12.2395 12.9203 12.9203 k = 0.5000 0.1334-1.0523 ( 3918 PWs) bands (ev): -26.3411 -26.3411 -26.3125 -26.3125 -9.4542 -9.4542 -9.3370 -9.3370 -8.4597 -8.4597 -8.3040 -8.3040 -8.0788 -8.0788 -7.9131 -7.9131 -7.7858 -7.7858 -2.7580 -2.7580 2.5549 2.5549 3.3768 3.3768 4.2030 4.2030 6.7419 6.7419 7.4871 7.4871 7.5323 7.5323 9.4271 9.4271 11.2246 11.2246 12.2371 12.2371 12.9252 12.9252 k = 0.5000 0.1334-1.0523 ( 3918 PWs) bands (ev): -26.3411 -26.3411 -26.3125 -26.3125 -9.4542 -9.4542 -9.3370 -9.3370 -8.4597 -8.4597 -8.3040 -8.3040 -8.0788 -8.0788 -7.9131 -7.9131 -7.7858 -7.7858 -2.7580 -2.7580 2.5549 2.5549 3.3768 3.3768 4.2030 4.2030 6.7419 6.7419 7.4871 7.4871 7.5323 7.5323 9.4271 9.4271 11.2246 11.2246 12.2371 12.2371 12.9252 12.9252 k = 0.5198 0.1387-1.0423 ( 3920 PWs) bands (ev): -26.3411 -26.3411 -26.3125 -26.3125 -9.4541 -9.4541 -9.3370 -9.3370 -8.4599 -8.4599 -8.3040 -8.3040 -8.0796 -8.0796 -7.9132 -7.9132 -7.7849 -7.7849 -2.7581 -2.7581 2.5554 2.5554 3.3768 3.3768 4.2031 4.2031 6.7407 6.7407 7.4869 7.4869 7.5320 7.5320 9.4289 9.4289 11.2252 11.2252 12.2363 12.2363 12.9222 12.9222 k = 0.5396 0.1440-1.0322 ( 3922 PWs) bands (ev): -26.3411 -26.3411 -26.3125 -26.3125 -9.4535 -9.4535 -9.3369 -9.3369 -8.4607 -8.4607 -8.3039 -8.3039 -8.0819 -8.0819 -7.9133 -7.9133 -7.7820 -7.7820 -2.7584 -2.7584 2.5568 2.5568 3.3769 3.3769 4.2035 4.2035 6.7372 6.7372 7.4862 7.4862 7.5314 7.5314 9.4340 9.4340 11.2273 11.2273 12.2342 12.2342 12.9129 12.9129 k = 0.5595 0.1493-1.0221 ( 3922 PWs) bands (ev): -26.3412 -26.3412 -26.3125 -26.3125 -9.4526 -9.4526 -9.3369 -9.3369 -8.4621 -8.4621 -8.3038 -8.3038 -8.0855 -8.0855 -7.9136 -7.9136 -7.7774 -7.7774 -2.7589 -2.7589 2.5593 2.5593 3.3770 3.3770 4.2041 4.2041 6.7314 6.7314 7.4852 7.4852 7.5303 7.5303 9.4427 9.4427 11.2306 11.2306 12.2308 12.2308 12.8971 12.8971 k = 0.5793 0.1546-1.0120 ( 3920 PWs) bands (ev): -26.3412 -26.3412 -26.3125 -26.3125 -9.4514 -9.4514 -9.3367 -9.3367 -8.4639 -8.4639 -8.3037 -8.3037 -8.0903 -8.0903 -7.9140 -7.9140 -7.7712 -7.7712 -2.7596 -2.7596 2.5627 2.5627 3.3772 3.3772 4.2050 4.2050 6.7234 6.7234 7.4839 7.4839 7.5288 7.5288 9.4547 9.4547 11.2350 11.2350 12.2266 12.2266 12.8742 12.8742 k = 0.5991 0.1599-1.0019 ( 3920 PWs) bands (ev): -26.3413 -26.3413 -26.3125 -26.3125 -9.4498 -9.4498 -9.3366 -9.3366 -8.4663 -8.4663 -8.3036 -8.3036 -8.0961 -8.0961 -7.9145 -7.9145 -7.7637 -7.7637 -2.7604 -2.7604 2.5669 2.5669 3.3775 3.3775 4.2061 4.2061 6.7135 6.7135 7.4821 7.4821 7.5269 7.5269 9.4700 9.4700 11.2403 11.2403 12.2219 12.2219 12.8439 12.8439 k = 0.6189 0.1652-0.9918 ( 3920 PWs) bands (ev): -26.3413 -26.3413 -26.3125 -26.3125 -9.4479 -9.4479 -9.3364 -9.3364 -8.4691 -8.4691 -8.3035 -8.3035 -8.1026 -8.1026 -7.9151 -7.9151 -7.7551 -7.7551 -2.7614 -2.7614 2.5720 2.5720 3.3778 3.3778 4.2074 4.2074 6.7019 6.7019 7.4800 7.4800 7.5247 7.5247 9.4884 9.4884 11.2462 11.2462 12.2171 12.2171 12.8065 12.8065 k = 0.6387 0.1705-0.9817 ( 3917 PWs) bands (ev): -26.3414 -26.3414 -26.3124 -26.3124 -9.4456 -9.4456 -9.3362 -9.3362 -8.4723 -8.4723 -8.3034 -8.3034 -8.1095 -8.1095 -7.9159 -7.9159 -7.7456 -7.7456 -2.7625 -2.7625 2.5778 2.5778 3.3782 3.3782 4.2089 4.2089 6.6887 6.6887 7.4776 7.4776 7.5221 7.5221 9.5100 9.5100 11.2524 11.2524 12.2124 12.2124 12.7627 12.7627 k = 0.6586 0.1758-0.9716 ( 3915 PWs) bands (ev): -26.3415 -26.3415 -26.3124 -26.3124 -9.4431 -9.4431 -9.3360 -9.3360 -8.4759 -8.4759 -8.3034 -8.3034 -8.1168 -8.1168 -7.9167 -7.9167 -7.7354 -7.7354 -2.7638 -2.7638 2.5843 2.5843 3.3785 3.3785 4.2106 4.2106 6.6742 6.6742 7.4750 7.4750 7.5192 7.5192 9.5345 9.5345 11.2587 11.2587 12.2081 12.2081 12.7134 12.7134 k = 0.6586 0.1758-0.9716 ( 3915 PWs) bands (ev): -26.3415 -26.3415 -26.3124 -26.3124 -9.4431 -9.4431 -9.3360 -9.3360 -8.4759 -8.4759 -8.3034 -8.3034 -8.1168 -8.1168 -7.9167 -7.9167 -7.7354 -7.7354 -2.7638 -2.7638 2.5843 2.5843 3.3785 3.3785 4.2106 4.2106 6.6742 6.6742 7.4750 7.4750 7.5192 7.5192 9.5345 9.5345 11.2587 11.2587 12.2081 12.2081 12.7134 12.7134 k = 0.6550 0.1748-0.9477 ( 3915 PWs) bands (ev): -26.3421 -26.3421 -26.3123 -26.3123 -9.4432 -9.4432 -9.3344 -9.3344 -8.4785 -8.4785 -8.3024 -8.3024 -8.1100 -8.1100 -7.9180 -7.9180 -7.7370 -7.7370 -2.7644 -2.7644 2.5950 2.5950 3.3743 3.3743 4.2127 4.2127 6.6813 6.6813 7.4733 7.4733 7.5175 7.5175 9.5281 9.5281 11.2536 11.2536 12.2029 12.2029 12.7347 12.7347 k = 0.6514 0.1738-0.9238 ( 3920 PWs) bands (ev): -26.3428 -26.3428 -26.3121 -26.3121 -9.4426 -9.4426 -9.3326 -9.3326 -8.4813 -8.4813 -8.3018 -8.3018 -8.1035 -8.1035 -7.9194 -7.9194 -7.7372 -7.7372 -2.7653 -2.7653 2.6091 2.6091 3.3694 3.3694 4.2158 4.2158 6.6891 6.6891 7.4699 7.4699 7.5148 7.5148 9.5253 9.5253 11.2456 11.2456 12.1994 12.1994 12.7569 12.7569 k = 0.6477 0.1729-0.8999 ( 3927 PWs) bands (ev): -26.3438 -26.3438 -26.3119 -26.3119 -9.4416 -9.4416 -9.3307 -9.3307 -8.4841 -8.4841 -8.3013 -8.3013 -8.0971 -8.0971 -7.9212 -7.9212 -7.7360 -7.7360 -2.7665 -2.7665 2.6266 2.6266 3.3638 3.3638 4.2198 4.2198 6.6975 6.6975 7.4645 7.4645 7.5114 7.5114 9.5263 9.5263 11.2350 11.2350 12.1974 12.1974 12.7801 12.7801 k = 0.6441 0.1719-0.8760 ( 3927 PWs) bands (ev): -26.3449 -26.3449 -26.3117 -26.3117 -9.4400 -9.4400 -9.3286 -9.3286 -8.4869 -8.4869 -8.3010 -8.3010 -8.0910 -8.0910 -7.9232 -7.9232 -7.7333 -7.7333 -2.7680 -2.7680 2.6473 2.6473 3.3576 3.3576 4.2248 4.2248 6.7066 6.7066 7.4567 7.4567 7.5078 7.5078 9.5310 9.5310 11.2222 11.2222 12.1963 12.1963 12.8038 12.8038 k = 0.6405 0.1709-0.8521 ( 3931 PWs) bands (ev): -26.3461 -26.3461 -26.3114 -26.3114 -9.4379 -9.4379 -9.3263 -9.3263 -8.4898 -8.4898 -8.3009 -8.3009 -8.0853 -8.0853 -7.9256 -7.9256 -7.7292 -7.7292 -2.7698 -2.7698 2.6712 2.6712 3.3508 3.3508 4.2308 4.2308 6.7165 6.7165 7.4462 7.4462 7.5041 7.5041 9.5396 9.5396 11.2079 11.2079 12.1955 12.1955 12.8277 12.8277 k = 0.6369 0.1700-0.8281 ( 3929 PWs) bands (ev): -26.3475 -26.3475 -26.3112 -26.3112 -9.4354 -9.4354 -9.3238 -9.3238 -8.4926 -8.4926 -8.3009 -8.3009 -8.0798 -8.0798 -7.9281 -7.9281 -7.7237 -7.7237 -2.7718 -2.7718 2.6981 2.6981 3.3435 3.3435 4.2376 4.2376 6.7270 6.7270 7.4331 7.4331 7.5004 7.5004 9.5520 9.5520 11.1926 11.1926 12.1945 12.1945 12.8512 12.8512 k = 0.6333 0.1690-0.8042 ( 3921 PWs) bands (ev): -26.3490 -26.3490 -26.3110 -26.3110 -9.4326 -9.4326 -9.3211 -9.3211 -8.4954 -8.4954 -8.3010 -8.3010 -8.0745 -8.0745 -7.9308 -7.9308 -7.7171 -7.7171 -2.7741 -2.7741 2.7279 2.7279 3.3360 3.3360 4.2454 4.2454 6.7381 6.7381 7.4175 7.4175 7.4965 7.4965 9.5681 9.5681 11.1769 11.1769 12.1931 12.1931 12.8735 12.8735 k = 0.6297 0.1681-0.7803 ( 3921 PWs) bands (ev): -26.3506 -26.3506 -26.3108 -26.3108 -9.4295 -9.4295 -9.3181 -9.3181 -8.4982 -8.4982 -8.3013 -8.3013 -8.0694 -8.0694 -7.9336 -7.9336 -7.7093 -7.7093 -2.7767 -2.7767 2.7602 2.7602 3.3283 3.3283 4.2540 4.2540 6.7499 6.7499 7.3995 7.3995 7.4924 7.4924 9.5881 9.5881 11.1616 11.1616 12.1907 12.1907 12.8933 12.8933 k = 0.6261 0.1671-0.7564 ( 3921 PWs) bands (ev): -26.3523 -26.3523 -26.3106 -26.3106 -9.4262 -9.4262 -9.3149 -9.3149 -8.5009 -8.5009 -8.3017 -8.3017 -8.0645 -8.0645 -7.9364 -7.9364 -7.7007 -7.7007 -2.7796 -2.7796 2.7948 2.7948 3.3207 3.3207 4.2635 4.2635 6.7621 6.7621 7.3792 7.3792 7.4880 7.4880 9.6119 9.6119 11.1471 11.1471 12.1871 12.1871 12.9086 12.9086 k = 0.6225 0.1661-0.7325 ( 3923 PWs) bands (ev): -26.3541 -26.3541 -26.3104 -26.3104 -9.4226 -9.4226 -9.3116 -9.3116 -8.5035 -8.5035 -8.3022 -8.3022 -8.0596 -8.0596 -7.9391 -7.9391 -7.6913 -7.6913 -2.7827 -2.7827 2.8313 2.8313 3.3136 3.3136 4.2739 4.2739 6.7747 6.7747 7.3568 7.3568 7.4833 7.4833 9.6394 9.6394 11.1340 11.1340 12.1821 12.1821 12.9162 12.9162 k = 0.6189 0.1652-0.7086 ( 3916 PWs) bands (ev): -26.3559 -26.3559 -26.3103 -26.3103 -9.4190 -9.4190 -9.3079 -9.3079 -8.5061 -8.5061 -8.3027 -8.3027 -8.0547 -8.0547 -7.9416 -7.9416 -7.6813 -7.6813 -2.7862 -2.7862 2.8693 2.8693 3.3074 3.3074 4.2850 4.2850 6.7874 6.7874 7.3326 7.3326 7.4782 7.4782 9.6705 9.6705 11.1229 11.1229 12.1755 12.1755 12.9107 12.9107 k = 0.6153 0.1642-0.6846 ( 3920 PWs) bands (ev): -26.3578 -26.3578 -26.3102 -26.3102 -9.4153 -9.4153 -9.3041 -9.3041 -8.5086 -8.5086 -8.3034 -8.3034 -8.0497 -8.0497 -7.9439 -7.9439 -7.6708 -7.6708 -2.7899 -2.7899 2.9081 2.9081 3.3028 3.3028 4.2970 4.2970 6.8001 6.8001 7.3069 7.3069 7.4726 7.4726 9.7053 9.7053 11.1141 11.1141 12.1672 12.1672 12.8864 12.8864 k = 0.6117 0.1633-0.6607 ( 3924 PWs) bands (ev): -26.3598 -26.3598 -26.3102 -26.3102 -9.4117 -9.4117 -9.3001 -9.3001 -8.5109 -8.5109 -8.3041 -8.3041 -8.0447 -8.0447 -7.9459 -7.9459 -7.6600 -7.6600 -2.7940 -2.7940 2.9466 2.9466 3.3008 3.3008 4.3096 4.3096 6.8123 6.8123 7.2800 7.2800 7.4666 7.4666 9.7435 9.7435 11.1080 11.1080 12.1571 12.1571 12.8432 12.8432 k = 0.6081 0.1623-0.6368 ( 3929 PWs) bands (ev): -26.3618 -26.3618 -26.3102 -26.3102 -9.4080 -9.4080 -9.2960 -9.2960 -8.5132 -8.5132 -8.3049 -8.3049 -8.0396 -8.0396 -7.9476 -7.9476 -7.6489 -7.6489 -2.7983 -2.7983 2.9833 2.9833 3.3026 3.3026 4.3230 4.3230 6.8237 6.8237 7.2525 7.2525 7.4600 7.4600 9.7851 9.7851 11.1051 11.1051 12.1451 12.1451 12.7873 12.7873 k = 0.6045 0.1613-0.6129 ( 3927 PWs) bands (ev): -26.3638 -26.3638 -26.3102 -26.3102 -9.4045 -9.4045 -9.2917 -9.2917 -8.5153 -8.5153 -8.3057 -8.3057 -8.0343 -8.0343 -7.9489 -7.9489 -7.6377 -7.6377 -2.8030 -2.8030 3.0165 3.0165 3.3103 3.3103 4.3371 4.3371 6.8335 6.8335 7.2249 7.2249 7.4531 7.4531 9.8299 9.8299 11.1054 11.1054 12.1311 12.1311 12.7250 12.7250 k = 0.6009 0.1604-0.5890 ( 3921 PWs) bands (ev): -26.3658 -26.3658 -26.3103 -26.3103 -9.4010 -9.4010 -9.2873 -9.2873 -8.5172 -8.5172 -8.3066 -8.3066 -8.0288 -8.0288 -7.9497 -7.9497 -7.6265 -7.6265 -2.8080 -2.8080 3.0440 3.0440 3.3259 3.3259 4.3517 4.3517 6.8409 6.8409 7.1984 7.1984 7.4456 7.4456 9.8779 9.8779 11.1092 11.1092 12.1148 12.1148 12.6605 12.6605 k = 0.5973 0.1594-0.5651 ( 3921 PWs) bands (ev): -26.3679 -26.3679 -26.3104 -26.3104 -9.3978 -9.3978 -9.2828 -9.2828 -8.5190 -8.5190 -8.3074 -8.3074 -8.0233 -8.0233 -7.9501 -7.9501 -7.6153 -7.6153 -2.8133 -2.8133 3.0642 3.0642 3.3508 3.3508 4.3669 4.3669 6.8447 6.8447 7.1739 7.1739 7.4377 7.4377 9.9288 9.9288 11.1165 11.1165 12.0961 12.0961 12.5962 12.5962 k = 0.5937 0.1584-0.5411 ( 3920 PWs) bands (ev): -26.3700 -26.3700 -26.3105 -26.3105 -9.3946 -9.3946 -9.2783 -9.2783 -8.5205 -8.5205 -8.3083 -8.3083 -8.0176 -8.0176 -7.9499 -7.9499 -7.6043 -7.6043 -2.8189 -2.8189 3.0768 3.0768 3.3852 3.3852 4.3826 4.3826 6.8436 6.8436 7.1531 7.1531 7.4294 7.4294 9.9825 9.9825 11.1274 11.1274 12.0745 12.0745 12.5335 12.5335 k = 0.5901 0.1575-0.5172 ( 3928 PWs) bands (ev): -26.3720 -26.3720 -26.3107 -26.3107 -9.3917 -9.3917 -9.2739 -9.2739 -8.5219 -8.5219 -8.3091 -8.3091 -8.0119 -8.0119 -7.9491 -7.9491 -7.5933 -7.5933 -2.8249 -2.8249 3.0831 3.0831 3.4279 3.4279 4.3989 4.3989 6.8363 6.8363 7.1371 7.1371 7.4206 7.4206 10.0387 10.0387 11.1418 11.1418 12.0498 12.0498 12.4737 12.4737 k = 0.5865 0.1565-0.4933 ( 3926 PWs) bands (ev): -26.3741 -26.3741 -26.3109 -26.3109 -9.3890 -9.3890 -9.2695 -9.2695 -8.5231 -8.5231 -8.3098 -8.3098 -8.0062 -8.0062 -7.9478 -7.9478 -7.5826 -7.5826 -2.8311 -2.8311 3.0848 3.0848 3.4770 3.4770 4.4155 4.4155 6.8219 6.8219 7.1270 7.1270 7.4116 7.4116 10.0972 10.0972 11.1595 11.1595 12.0216 12.0216 12.4177 12.4177 k = 0.5829 0.1556-0.4694 ( 3932 PWs) bands (ev): -26.3761 -26.3761 -26.3111 -26.3111 -9.3864 -9.3864 -9.2653 -9.2653 -8.5240 -8.5240 -8.3106 -8.3106 -8.0007 -8.0007 -7.9457 -7.9457 -7.5722 -7.5722 -2.8377 -2.8377 3.0835 3.0835 3.5307 3.5307 4.4325 4.4325 6.8006 6.8006 7.1228 7.1228 7.4021 7.4021 10.1578 10.1578 11.1801 11.1801 11.9896 11.9896 12.3661 12.3661 k = 0.5793 0.1546-0.4455 ( 3935 PWs) bands (ev): -26.3781 -26.3781 -26.3114 -26.3114 -9.3841 -9.3841 -9.2612 -9.2612 -8.5248 -8.5248 -8.3112 -8.3112 -7.9953 -7.9953 -7.9430 -7.9430 -7.5620 -7.5620 -2.8445 -2.8445 3.0802 3.0802 3.5878 3.5878 4.4498 4.4498 6.7732 6.7732 7.1235 7.1235 7.3925 7.3925 10.2202 10.2202 11.2033 11.2033 11.9539 11.9539 12.3194 12.3194 k = 0.5757 0.1536-0.4216 ( 3936 PWs) bands (ev): -26.3801 -26.3801 -26.3117 -26.3117 -9.3819 -9.3819 -9.2573 -9.2573 -8.5253 -8.5253 -8.3118 -8.3118 -7.9902 -7.9902 -7.9395 -7.9395 -7.5521 -7.5521 -2.8516 -2.8516 3.0759 3.0759 3.6472 3.6472 4.4674 4.4674 6.7412 6.7412 7.1281 7.1281 7.3826 7.3826 10.2839 10.2839 11.2283 11.2283 11.9149 11.9149 12.2777 12.2777 k = 0.5721 0.1527-0.3976 ( 3941 PWs) bands (ev): -26.3820 -26.3820 -26.3120 -26.3120 -9.3800 -9.3800 -9.2537 -9.2537 -8.5256 -8.5256 -8.3122 -8.3122 -7.9854 -7.9854 -7.9353 -7.9353 -7.5425 -7.5425 -2.8589 -2.8589 3.0711 3.0711 3.7082 3.7082 4.4852 4.4852 6.7057 6.7057 7.1352 7.1352 7.3725 7.3725 10.3486 10.3486 11.2545 11.2545 11.8733 11.8733 12.2410 12.2410 k = 0.5685 0.1517-0.3737 ( 3945 PWs) bands (ev): -26.3839 -26.3839 -26.3123 -26.3123 -9.3782 -9.3782 -9.2503 -9.2503 -8.5256 -8.5256 -8.3126 -8.3126 -7.9810 -7.9810 -7.9303 -7.9303 -7.5333 -7.5333 -2.8664 -2.8664 3.0661 3.0661 3.7702 3.7702 4.5032 4.5032 6.6680 6.6680 7.1439 7.1439 7.3623 7.3623 10.4138 10.4138 11.2807 11.2807 11.8303 11.8303 12.2092 12.2092 k = 0.5649 0.1508-0.3498 ( 3941 PWs) bands (ev): -26.3857 -26.3857 -26.3126 -26.3126 -9.3765 -9.3765 -9.2472 -9.2472 -8.5255 -8.5255 -8.3130 -8.3130 -7.9769 -7.9769 -7.9248 -7.9248 -7.5245 -7.5245 -2.8740 -2.8740 3.0613 3.0613 3.8325 3.8325 4.5214 4.5214 6.6288 6.6288 7.1534 7.1534 7.3521 7.3521 10.4787 10.4787 11.3056 11.3056 11.7873 11.7873 12.1824 12.1824 k = 0.5613 0.1498-0.3259 ( 3939 PWs) bands (ev): -26.3875 -26.3875 -26.3129 -26.3129 -9.3750 -9.3750 -9.2444 -9.2444 -8.5251 -8.5251 -8.3132 -8.3132 -7.9731 -7.9731 -7.9187 -7.9187 -7.5161 -7.5161 -2.8817 -2.8817 3.0566 3.0566 3.8948 3.8948 4.5398 4.5398 6.5890 6.5890 7.1632 7.1632 7.3419 7.3419 10.5426 10.5426 11.3276 11.3276 11.7458 11.7458 12.1611 12.1611 k = 0.5577 0.1488-0.3020 ( 3940 PWs) bands (ev): -26.3892 -26.3892 -26.3132 -26.3132 -9.3737 -9.3737 -9.2419 -9.2419 -8.5246 -8.5246 -8.3133 -8.3133 -7.9696 -7.9696 -7.9123 -7.9123 -7.5081 -7.5081 -2.8895 -2.8895 3.0523 3.0523 3.9565 3.9565 4.5583 4.5583 6.5491 6.5491 7.1729 7.1729 7.3319 7.3319 10.6042 10.6042 11.3454 11.3454 11.7071 11.7071 12.1464 12.1464 k = 0.5541 0.1479-0.2781 ( 3936 PWs) bands (ev): -26.3908 -26.3908 -26.3135 -26.3135 -9.3725 -9.3725 -9.2396 -9.2396 -8.5240 -8.5240 -8.3134 -8.3134 -7.9663 -7.9663 -7.9056 -7.9056 -7.5005 -7.5005 -2.8973 -2.8973 3.0485 3.0485 4.0170 4.0170 4.5771 4.5771 6.5095 6.5095 7.1822 7.1822 7.3219 7.3219 10.6620 10.6620 11.3582 11.3582 11.6721 11.6721 12.1397 12.1397 k = 0.5505 0.1469-0.2541 ( 3934 PWs) bands (ev): -26.3924 -26.3924 -26.3139 -26.3139 -9.3714 -9.3714 -9.2377 -9.2377 -8.5232 -8.5232 -8.3134 -8.3134 -7.9632 -7.9632 -7.8989 -7.8989 -7.4933 -7.4933 -2.9050 -2.9050 3.0451 3.0451 4.0760 4.0760 4.5960 4.5960 6.4706 6.4706 7.1908 7.1908 7.3123 7.3123 10.7139 10.7139 11.3668 11.3668 11.6412 11.6412 12.1423 12.1423 k = 0.5468 0.1459-0.2302 ( 3944 PWs) bands (ev): -26.3939 -26.3939 -26.3142 -26.3142 -9.3705 -9.3705 -9.2361 -9.2361 -8.5223 -8.5223 -8.3134 -8.3134 -7.9603 -7.9603 -7.8921 -7.8921 -7.4866 -7.4866 -2.9126 -2.9126 3.0422 3.0422 4.1328 4.1328 4.6151 4.6151 6.4327 6.4327 7.1987 7.1987 7.3029 7.3029 10.7573 10.7573 11.3737 11.3737 11.6135 11.6135 12.1552 12.1552 k = 0.5432 0.1450-0.2063 ( 3946 PWs) bands (ev): -26.3953 -26.3953 -26.3145 -26.3145 -9.3696 -9.3696 -9.2347 -9.2347 -8.5213 -8.5213 -8.3133 -8.3133 -7.9576 -7.9576 -7.8854 -7.8854 -7.4803 -7.4803 -2.9199 -2.9199 3.0398 3.0398 4.1869 4.1869 4.6345 4.6345 6.3963 6.3963 7.2057 7.2057 7.2939 7.2939 10.7895 10.7895 11.3833 11.3833 11.5881 11.5881 12.1780 12.1780 k = 0.5396 0.1440-0.1824 ( 3946 PWs) bands (ev): -26.3965 -26.3965 -26.3148 -26.3148 -9.3689 -9.3689 -9.2336 -9.2336 -8.5203 -8.5203 -8.3132 -8.3132 -7.9550 -7.9550 -7.8788 -7.8788 -7.4745 -7.4745 -2.9271 -2.9271 3.0378 3.0378 4.2377 4.2377 4.6543 4.6543 6.3614 6.3614 7.2119 7.2119 7.2854 7.2854 10.8083 10.8083 11.3996 11.3996 11.5645 11.5645 12.2094 12.2094 k = 0.5360 0.1431-0.1585 ( 3952 PWs) bands (ev): -26.3977 -26.3977 -26.3151 -26.3151 -9.3682 -9.3682 -9.2327 -9.2327 -8.5193 -8.5193 -8.3130 -8.3130 -7.9525 -7.9525 -7.8726 -7.8726 -7.4691 -7.4691 -2.9338 -2.9338 3.0362 3.0362 4.2847 4.2847 4.6744 4.6744 6.3285 6.3285 7.2171 7.2171 7.2774 7.2774 10.8134 10.8134 11.4237 11.4237 11.5437 11.5437 12.2448 12.2448 k = 0.5324 0.1421-0.1346 ( 3956 PWs) bands (ev): -26.3988 -26.3988 -26.3153 -26.3153 -9.3676 -9.3676 -9.2320 -9.2320 -8.5182 -8.5182 -8.3128 -8.3128 -7.9503 -7.9503 -7.8667 -7.8667 -7.4642 -7.4642 -2.9402 -2.9402 3.0350 3.0350 4.3274 4.3274 4.6947 4.6947 6.2976 6.2976 7.2214 7.2214 7.2699 7.2699 10.8067 10.8067 11.4504 11.4504 11.5309 11.5309 12.2486 12.2486 k = 0.5288 0.1411-0.1106 ( 3963 PWs) bands (ev): -26.3998 -26.3998 -26.3156 -26.3156 -9.3671 -9.3671 -9.2314 -9.2314 -8.5172 -8.5172 -8.3127 -8.3127 -7.9482 -7.9482 -7.8613 -7.8613 -7.4598 -7.4598 -2.9461 -2.9461 3.0341 3.0341 4.3654 4.3654 4.7152 4.7152 6.2692 6.2692 7.2249 7.2249 7.2632 7.2632 10.7913 10.7913 11.4610 11.4610 11.5436 11.5436 12.2373 12.2373 k = 0.5252 0.1402-0.0867 ( 3969 PWs) bands (ev): -26.4007 -26.4007 -26.3158 -26.3158 -9.3667 -9.3667 -9.2310 -9.2310 -8.5163 -8.5163 -8.3125 -8.3125 -7.9463 -7.9463 -7.8563 -7.8563 -7.4560 -7.4560 -2.9515 -2.9515 3.0334 3.0334 4.3985 4.3985 4.7355 4.7355 6.2433 6.2433 7.2275 7.2275 7.2572 7.2572 10.7706 10.7706 11.4511 11.4511 11.5841 11.5841 12.2268 12.2268 k = 0.5216 0.1392-0.0628 ( 3972 PWs) bands (ev): -26.4015 -26.4015 -26.3160 -26.3160 -9.3663 -9.3663 -9.2307 -9.2307 -8.5154 -8.5154 -8.3123 -8.3123 -7.9447 -7.9447 -7.8519 -7.8519 -7.4526 -7.4526 -2.9563 -2.9563 3.0330 3.0330 4.4266 4.4266 4.7550 4.7550 6.2203 6.2203 7.2294 7.2294 7.2521 7.2521 10.7478 10.7478 11.4357 11.4357 11.6352 11.6352 12.2176 12.2176 k = 0.5180 0.1382-0.0389 ( 3968 PWs) bands (ev): -26.4022 -26.4022 -26.3161 -26.3161 -9.3660 -9.3660 -9.2305 -9.2305 -8.5146 -8.5146 -8.3121 -8.3121 -7.9432 -7.9432 -7.8481 -7.8481 -7.4497 -7.4497 -2.9605 -2.9605 3.0327 3.0327 4.4498 4.4498 4.7733 4.7733 6.2004 6.2004 7.2305 7.2305 7.2479 7.2479 10.7253 10.7253 11.4206 11.4206 11.6893 11.6893 12.2099 12.2099 k = 0.5144 0.1373-0.0150 ( 3971 PWs) bands (ev): -26.4027 -26.4027 -26.3163 -26.3163 -9.3658 -9.3658 -9.2303 -9.2303 -8.5140 -8.5140 -8.3120 -8.3120 -7.9420 -7.9420 -7.8449 -7.8449 -7.4473 -7.4473 -2.9639 -2.9639 3.0325 3.0325 4.4683 4.4683 4.7896 4.7896 6.1837 6.1837 7.2309 7.2309 7.2448 7.2448 10.7047 10.7047 11.4073 11.4073 11.7428 11.7428 12.2035 12.2035 k = 0.5108 0.1363 0.0090 ( 3975 PWs) bands (ev): -26.4031 -26.4031 -26.3164 -26.3164 -9.3656 -9.3656 -9.2302 -9.2302 -8.5135 -8.5135 -8.3119 -8.3119 -7.9411 -7.9411 -7.8424 -7.8424 -7.4455 -7.4455 -2.9667 -2.9667 3.0325 3.0325 4.4823 4.4823 4.8031 4.8031 6.1705 6.1705 7.2307 7.2307 7.2428 7.2428 10.6875 10.6875 11.3966 11.3966 11.7926 11.7926 12.1984 12.1984 k = 0.5072 0.1354 0.0329 ( 3978 PWs) bands (ev): -26.4034 -26.4034 -26.3165 -26.3165 -9.3655 -9.3655 -9.2302 -9.2302 -8.5131 -8.5131 -8.3118 -8.3118 -7.9404 -7.9404 -7.8406 -7.8406 -7.4441 -7.4441 -2.9686 -2.9686 3.0324 3.0324 4.4921 4.4921 4.8133 4.8133 6.1609 6.1609 7.2302 7.2302 7.2417 7.2417 10.6747 10.6747 11.3888 11.3888 11.8351 11.8351 12.1940 12.1940 k = 0.5036 0.1344 0.0568 ( 3986 PWs) bands (ev): -26.4036 -26.4036 -26.3165 -26.3165 -9.3654 -9.3654 -9.2302 -9.2302 -8.5128 -8.5128 -8.3118 -8.3118 -7.9400 -7.9400 -7.8395 -7.8395 -7.4433 -7.4433 -2.9698 -2.9698 3.0324 3.0324 4.4979 4.4979 4.8196 4.8196 6.1551 6.1551 7.2297 7.2297 7.2411 7.2411 10.6667 10.6667 11.3840 11.3840 11.8649 11.8649 12.1889 12.1889 k = 0.5000 0.1334 0.0807 ( 3990 PWs) bands (ev): -26.4037 -26.4037 -26.3165 -26.3165 -9.3654 -9.3654 -9.2302 -9.2302 -8.5128 -8.5128 -8.3117 -8.3117 -7.9399 -7.9399 -7.8391 -7.8391 -7.4431 -7.4431 -2.9702 -2.9702 3.0324 3.0324 4.4998 4.4998 4.8217 4.8217 6.1532 6.1532 7.2295 7.2295 7.2410 7.2410 10.6640 10.6640 11.3824 11.3824 11.8759 11.8759 12.1852 12.1852 k = 0.5000-0.8700-0.5262 ( 3916 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3723 -9.3723 -9.3714 -9.3714 -8.5148 -8.5148 -8.3242 -8.3242 -8.2082 -8.2082 -7.9249 -7.9249 -7.6081 -7.6081 -2.7797 -2.7797 2.6286 2.6286 3.4136 3.4136 4.2287 4.2287 6.4252 6.4252 7.4352 7.4352 7.4837 7.4837 10.1243 10.1243 11.1217 11.1217 11.9356 11.9356 12.3366 12.3366 k = 0.5211-0.8611-0.5208 ( 3919 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3766 -9.3766 -9.3674 -9.3674 -8.5145 -8.5145 -8.3240 -8.3240 -8.2078 -8.2078 -7.9249 -7.9249 -7.6088 -7.6088 -2.7796 -2.7796 2.6283 2.6283 3.4133 3.4133 4.2286 4.2286 6.4269 6.4269 7.4354 7.4354 7.4839 7.4839 10.1180 10.1180 11.1266 11.1266 11.9377 11.9377 12.3362 12.3362 k = 0.5423-0.8522-0.5154 ( 3921 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3815 -9.3815 -9.3633 -9.3633 -8.5136 -8.5136 -8.3233 -8.3233 -8.2068 -8.2068 -7.9247 -7.9247 -7.6110 -7.6110 -2.7792 -2.7792 2.6274 2.6274 3.4125 3.4125 4.2282 4.2282 6.4318 6.4318 7.4363 7.4363 7.4845 7.4845 10.0994 10.0994 11.1407 11.1407 11.9443 11.9443 12.3353 12.3353 k = 0.5634-0.8433-0.5100 ( 3917 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3865 -9.3865 -9.3594 -9.3594 -8.5121 -8.5121 -8.3222 -8.3222 -8.2051 -8.2051 -7.9244 -7.9244 -7.6144 -7.6144 -2.7787 -2.7787 2.6259 2.6259 3.4112 3.4112 4.2275 4.2275 6.4399 6.4399 7.4377 7.4377 7.4856 7.4856 10.0704 10.0704 11.1616 11.1616 11.9559 11.9559 12.3339 12.3339 k = 0.5846-0.8344-0.5047 ( 3924 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3918 -9.3918 -9.3559 -9.3559 -8.5102 -8.5102 -8.3207 -8.3207 -8.2027 -8.2027 -7.9239 -7.9239 -7.6193 -7.6193 -2.7780 -2.7780 2.6239 2.6239 3.4094 3.4094 4.2267 4.2267 6.4510 6.4510 7.4396 7.4396 7.4871 7.4871 10.0329 10.0329 11.1865 11.1865 11.9732 11.9732 12.3325 12.3325 k = 0.6057-0.8255-0.4993 ( 3930 PWs) bands (ev): -26.3409 -26.3409 -26.3127 -26.3127 -9.3971 -9.3971 -9.3526 -9.3526 -8.5078 -8.5078 -8.3189 -8.3189 -8.1994 -8.1994 -7.9234 -7.9234 -7.6254 -7.6254 -2.7771 -2.7771 2.6214 2.6214 3.4071 3.4071 4.2256 4.2256 6.4648 6.4648 7.4420 7.4420 7.4889 7.4889 9.9893 9.9893 11.2122 11.2122 11.9970 11.9970 12.3316 12.3316 k = 0.6268-0.8166-0.4939 ( 3924 PWs) bands (ev): -26.3410 -26.3410 -26.3127 -26.3127 -9.4024 -9.4024 -9.3497 -9.3497 -8.5050 -8.5050 -8.3170 -8.3170 -8.1952 -8.1952 -7.9228 -7.9228 -7.6328 -7.6328 -2.7760 -2.7760 2.6185 2.6185 3.4046 3.4046 4.2243 4.2243 6.4812 6.4812 7.4448 7.4448 7.4912 7.4912 9.9416 9.9416 11.2358 11.2358 12.0274 12.0274 12.3322 12.3322 k = 0.6480-0.8078-0.4885 ( 3928 PWs) bands (ev): -26.3410 -26.3410 -26.3127 -26.3127 -9.4078 -9.4078 -9.3471 -9.3471 -8.5019 -8.5019 -8.3149 -8.3149 -8.1901 -8.1901 -7.9221 -7.9221 -7.6414 -7.6414 -2.7748 -2.7748 2.6151 2.6151 3.4017 3.4017 4.2228 4.2228 6.4997 6.4997 7.4479 7.4479 7.4938 7.4938 9.8916 9.8916 11.2554 11.2554 12.0635 12.0635 12.3358 12.3358 k = 0.6691-0.7989-0.4831 ( 3926 PWs) bands (ev): -26.3411 -26.3411 -26.3126 -26.3126 -9.4130 -9.4130 -9.3448 -9.3448 -8.4987 -8.4987 -8.3128 -8.3128 -8.1839 -8.1839 -7.9214 -7.9214 -7.6510 -7.6510 -2.7735 -2.7735 2.6114 2.6114 3.3987 3.3987 4.2213 4.2213 6.5200 6.5200 7.4513 7.4513 7.4966 7.4966 9.8406 9.8406 11.2698 11.2698 12.1025 12.1025 12.3453 12.3453 k = 0.6903-0.7900-0.4778 ( 3914 PWs) bands (ev): -26.3411 -26.3411 -26.3126 -26.3126 -9.4182 -9.4182 -9.3428 -9.3428 -8.4953 -8.4953 -8.3108 -8.3108 -8.1767 -8.1767 -7.9206 -7.9206 -7.6616 -7.6616 -2.7721 -2.7721 2.6076 2.6076 3.3955 3.3955 4.2197 4.2197 6.5417 6.5417 7.4548 7.4548 7.4997 7.4997 9.7899 9.7899 11.2789 11.2789 12.1396 12.1396 12.3649 12.3649 k = 0.7114-0.7811-0.4724 ( 3914 PWs) bands (ev): -26.3412 -26.3412 -26.3126 -26.3126 -9.4231 -9.4231 -9.3411 -9.3411 -8.4919 -8.4919 -8.3089 -8.3089 -8.1684 -8.1684 -7.9198 -7.9198 -7.6730 -7.6730 -2.7707 -2.7707 2.6035 2.6035 3.3924 3.3924 4.2180 4.2180 6.5643 6.5643 7.4585 7.4585 7.5030 7.5030 9.7403 9.7403 11.2830 11.2830 12.1688 12.1688 12.3990 12.3990 k = 0.7326-0.7722-0.4670 ( 3908 PWs) bands (ev): -26.3412 -26.3412 -26.3126 -26.3126 -9.4278 -9.4278 -9.3396 -9.3396 -8.4885 -8.4885 -8.3073 -8.3073 -8.1593 -8.1593 -7.9191 -7.9191 -7.6850 -7.6850 -2.7692 -2.7692 2.5994 2.5994 3.3892 3.3892 4.2164 4.2164 6.5873 6.5873 7.4621 7.4621 7.5064 7.5064 9.6927 9.6927 11.2829 11.2829 12.1878 12.1878 12.4487 12.4487 k = 0.7537-0.7633-0.4616 ( 3909 PWs) bands (ev): -26.3413 -26.3413 -26.3125 -26.3125 -9.4322 -9.4322 -9.3384 -9.3384 -8.4851 -8.4851 -8.3059 -8.3059 -8.1493 -8.1493 -7.9184 -7.9184 -7.6976 -7.6976 -2.7678 -2.7678 2.5953 2.5953 3.3862 3.3862 4.2148 4.2148 6.6103 6.6103 7.4657 7.4657 7.5098 7.5098 9.6478 9.6478 11.2796 11.2796 12.1982 12.1982 12.5101 12.5101 k = 0.7748-0.7544-0.4562 ( 3914 PWs) bands (ev): -26.3414 -26.3414 -26.3125 -26.3125 -9.4363 -9.4363 -9.3374 -9.3374 -8.4819 -8.4819 -8.3048 -8.3048 -8.1387 -8.1387 -7.9177 -7.9177 -7.7103 -7.7103 -2.7663 -2.7663 2.5914 2.5914 3.3834 3.3834 4.2132 4.2132 6.6328 6.6328 7.4690 7.4690 7.5132 7.5132 9.6061 9.6061 11.2739 11.2739 12.2035 12.2035 12.5777 12.5777 k = 0.7960-0.7455-0.4509 ( 3915 PWs) bands (ev): -26.3414 -26.3414 -26.3125 -26.3125 -9.4399 -9.4399 -9.3366 -9.3366 -8.4788 -8.4788 -8.3040 -8.3040 -8.1277 -8.1277 -7.9172 -7.9172 -7.7231 -7.7231 -2.7650 -2.7650 2.5877 2.5877 3.3808 3.3808 4.2118 4.2118 6.6542 6.6542 7.4722 7.4722 7.5163 7.5163 9.5682 9.5682 11.2667 11.2667 12.2062 12.2062 12.6469 12.6469 k = 0.8171-0.7366-0.4455 ( 3915 PWs) bands (ev): -26.3415 -26.3415 -26.3124 -26.3124 -9.4431 -9.4431 -9.3360 -9.3360 -8.4759 -8.4759 -8.3034 -8.3034 -8.1168 -8.1168 -7.9167 -7.9167 -7.7354 -7.7354 -2.7638 -2.7638 2.5843 2.5843 3.3785 3.3785 4.2106 4.2106 6.6742 6.6742 7.4750 7.4750 7.5192 7.5192 9.5345 9.5345 11.2587 11.2587 12.2081 12.2081 12.7134 12.7134 Writing output data file Sr2BrN.save init_run : 0.35s CPU 1.03s WALL ( 1 calls) electrons : 169.68s CPU 172.76s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.21s WALL ( 1 calls) potinit : 0.06s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 169.68s CPU 172.75s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.05s WALL ( 307 calls) cegterg : 153.41s CPU 154.85s WALL ( 376 calls) Called by sum_band: Called by *egterg: h_psi : 123.27s CPU 124.32s WALL ( 6599 calls) s_psi : 2.62s CPU 2.81s WALL ( 6599 calls) g_psi : 0.12s CPU 0.14s WALL ( 5916 calls) cdiaghg : 32.69s CPU 32.99s WALL ( 6223 calls) cegterg:over : 3.23s CPU 3.21s WALL ( 5916 calls) cegterg:upda : 2.93s CPU 3.08s WALL ( 5916 calls) cegterg:last : 1.36s CPU 1.38s WALL ( 990 calls) cdiaghg:chol : 1.88s CPU 1.89s WALL ( 6223 calls) cdiaghg:inve : 1.10s CPU 1.06s WALL ( 6223 calls) cdiaghg:para : 1.88s CPU 1.89s WALL ( 12446 calls) Called by h_psi: h_psi:vloc : 117.97s CPU 119.05s WALL ( 6599 calls) h_psi:vnl : 5.18s CPU 5.16s WALL ( 6599 calls) add_vuspsi : 2.53s CPU 2.53s WALL ( 6599 calls) General routines calbec : 2.62s CPU 2.61s WALL ( 6599 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 107.52s CPU 108.07s WALL ( 531200 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.16s CPU 0.14s WALL ( 614 calls) Parallel routines fft_scatter : 24.79s CPU 25.01s WALL ( 531223 calls) PWSCF : 3m 1.54s CPU 3m33.33s WALL This run was terminated on: 16:12: 0 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=