Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:25:51 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./K4Br2O.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized file K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3S 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 76 47 13 2015 966 147 Max 77 48 14 2019 992 150 Sum 5531 3413 969 145241 70467 10689 bravais-lattice index = 14 lattice parameter (alat) = 17.0621 a.u. unit-cell volume = 1476.1527 (a.u.)^3 number of atoms/cell = 7 number of atomic types = 3 number of electrons = 56.00 number of Kohn-Sham states= 68 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 17.062138 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.837643 celldm(5)= -0.837643 celldm(6)= 0.675286 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.675286 0.737556 0.000000 ) a(3) = ( -0.837643 -0.368778 0.402936 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.915572 1.240893 ) b(2) = ( 0.000000 1.355829 1.240893 ) b(3) = ( 0.000000 0.000000 2.481785 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for 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. # 3 for K read from file: /users/gautes/Pseudo/K.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3dd1b7807415f540a701f2a402ca1bb0 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1165 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 atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Br 7.00 79.90400 Br( 1.00) K 9.00 39.09830 K( 1.00) 4 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 271 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0282021), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0564042), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0846063), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.1128084), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.1410105), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.1692126), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.1974147), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.2256168), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.2538190), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.2820211), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.3102232), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.3384253), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.3666274), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.3948295), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.4230316), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.4512337), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.4794358), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.5076379), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.5358400), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.5640421), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.5922442), wk = 0.0036900 k( 23) = ( 0.0000000 0.0000000 0.6204463), wk = 0.0036900 k( 24) = ( 0.0000000 0.0000000 0.6486485), wk = 0.0036900 k( 25) = ( 0.0000000 0.0000000 0.6768505), wk = 0.0036900 k( 26) = ( 0.0000000 0.0000000 0.7050527), wk = 0.0036900 k( 27) = ( 0.0000000 0.0000000 0.7332548), wk = 0.0036900 k( 28) = ( 0.0000000 0.0000000 0.7614569), wk = 0.0036900 k( 29) = ( 0.0000000 0.0000000 0.7896590), wk = 0.0036900 k( 30) = ( 0.0000000 0.0000000 0.8178611), wk = 0.0036900 k( 31) = ( 0.0000000 0.0000000 0.8460632), wk = 0.0036900 k( 32) = ( 0.0000000 0.0000000 0.8742653), wk = 0.0036900 k( 33) = ( 0.0000000 0.0000000 0.9024674), wk = 0.0036900 k( 34) = ( 0.0000000 0.0000000 0.9306695), wk = 0.0036900 k( 35) = ( 0.0000000 0.0000000 0.9588716), wk = 0.0036900 k( 36) = ( 0.0000000 0.0000000 0.9870737), wk = 0.0036900 k( 37) = ( 0.0000000 0.0000000 1.0152758), wk = 0.0036900 k( 38) = ( 0.0000000 0.0000000 1.0434780), wk = 0.0036900 k( 39) = ( 0.0000000 0.0000000 1.0716800), wk = 0.0036900 k( 40) = ( 0.0000000 0.0000000 1.0998822), wk = 0.0036900 k( 41) = ( 0.0000000 0.0000000 1.1280842), wk = 0.0036900 k( 42) = ( 0.0000000 0.0000000 1.1562864), wk = 0.0036900 k( 43) = ( 0.0000000 0.0000000 1.1844885), wk = 0.0036900 k( 44) = ( 0.0000000 0.0000000 1.2126906), wk = 0.0036900 k( 45) = ( 0.0000000 0.0000000 1.2408927), wk = 0.0036900 k( 46) = ( 0.0000000 0.0000000 1.2408927), wk = 0.0036900 k( 47) = ( -0.0096913 0.0220128 1.2408927), wk = 0.0036900 k( 48) = ( -0.0193826 0.0440257 1.2408927), wk = 0.0036900 k( 49) = ( -0.0290739 0.0660386 1.2408927), wk = 0.0036900 k( 50) = ( -0.0387653 0.0880514 1.2408927), wk = 0.0036900 k( 51) = ( -0.0484566 0.1100643 1.2408927), wk = 0.0036900 k( 52) = ( -0.0484566 0.1100643 1.2408927), wk = 0.0036900 k( 53) = ( -0.0565199 0.1283792 1.2208814), wk = 0.0036900 k( 54) = ( -0.0645831 0.1466941 1.2008701), wk = 0.0036900 k( 55) = ( -0.0726464 0.1650090 1.1808587), wk = 0.0036900 k( 56) = ( -0.0807097 0.1833240 1.1608474), wk = 0.0036900 k( 57) = ( -0.0887730 0.2016389 1.1408361), wk = 0.0036900 k( 58) = ( -0.0968362 0.2199538 1.1208248), wk = 0.0036900 k( 59) = ( -0.1048995 0.2382687 1.1008134), wk = 0.0036900 k( 60) = ( -0.1129628 0.2565837 1.0808021), wk = 0.0036900 k( 61) = ( -0.1210260 0.2748986 1.0607908), wk = 0.0036900 k( 62) = ( -0.1290893 0.2932135 1.0407795), wk = 0.0036900 k( 63) = ( -0.1371526 0.3115284 1.0207682), wk = 0.0036900 k( 64) = ( -0.1452159 0.3298434 1.0007568), wk = 0.0036900 k( 65) = ( -0.1532792 0.3481583 0.9807455), wk = 0.0036900 k( 66) = ( -0.1613424 0.3664732 0.9607342), wk = 0.0036900 k( 67) = ( -0.1694057 0.3847882 0.9407229), wk = 0.0036900 k( 68) = ( -0.1774690 0.4031031 0.9207116), wk = 0.0036900 k( 69) = ( -0.1855323 0.4214180 0.9007003), wk = 0.0036900 k( 70) = ( -0.1935955 0.4397329 0.8806889), wk = 0.0036900 k( 71) = ( -0.2016588 0.4580479 0.8606776), wk = 0.0036900 k( 72) = ( -0.2097221 0.4763628 0.8406663), wk = 0.0036900 k( 73) = ( -0.2177854 0.4946777 0.8206550), wk = 0.0036900 k( 74) = ( -0.2258486 0.5129926 0.8006437), wk = 0.0036900 k( 75) = ( -0.2339119 0.5313075 0.7806323), wk = 0.0036900 k( 76) = ( -0.2419752 0.5496225 0.7606210), wk = 0.0036900 k( 77) = ( -0.2500385 0.5679374 0.7406097), wk = 0.0036900 k( 78) = ( -0.2581017 0.5862523 0.7205984), wk = 0.0036900 k( 79) = ( -0.2661650 0.6045672 0.7005871), wk = 0.0036900 k( 80) = ( -0.2742283 0.6228822 0.6805758), wk = 0.0036900 k( 81) = ( -0.2742283 0.6228822 0.6805758), wk = 0.0036900 k( 82) = ( -0.2661628 0.6045621 0.6605588), wk = 0.0036900 k( 83) = ( -0.2580972 0.5862420 0.6405419), wk = 0.0036900 k( 84) = ( -0.2500317 0.5679220 0.6205249), wk = 0.0036900 k( 85) = ( -0.2419661 0.5496019 0.6005080), wk = 0.0036900 k( 86) = ( -0.2339006 0.5312819 0.5804911), wk = 0.0036900 k( 87) = ( -0.2258351 0.5129618 0.5604741), wk = 0.0036900 k( 88) = ( -0.2177695 0.4946417 0.5404572), wk = 0.0036900 k( 89) = ( -0.2097040 0.4763217 0.5204403), wk = 0.0036900 k( 90) = ( -0.2016384 0.4580016 0.5004234), wk = 0.0036900 k( 91) = ( -0.1935729 0.4396815 0.4804064), wk = 0.0036900 k( 92) = ( -0.1855074 0.4213615 0.4603895), wk = 0.0036900 k( 93) = ( -0.1774418 0.4030414 0.4403725), wk = 0.0036900 k( 94) = ( -0.1693763 0.3847214 0.4203556), wk = 0.0036900 k( 95) = ( -0.1613108 0.3664013 0.4003387), wk = 0.0036900 k( 96) = ( -0.1532452 0.3480812 0.3803217), wk = 0.0036900 k( 97) = ( -0.1451797 0.3297611 0.3603048), wk = 0.0036900 k( 98) = ( -0.1371141 0.3114411 0.3402879), wk = 0.0036900 k( 99) = ( -0.1290486 0.2931210 0.3202710), wk = 0.0036900 k( 100) = ( -0.1209831 0.2748010 0.3002540), wk = 0.0036900 k( 101) = ( -0.1129175 0.2564809 0.2802371), wk = 0.0036900 k( 102) = ( -0.1048520 0.2381608 0.2602201), wk = 0.0036900 k( 103) = ( -0.0967864 0.2198408 0.2402032), wk = 0.0036900 k( 104) = ( -0.0887209 0.2015207 0.2201863), wk = 0.0036900 k( 105) = ( -0.0806554 0.1832006 0.2001693), wk = 0.0036900 k( 106) = ( -0.0725898 0.1648806 0.1801524), wk = 0.0036900 k( 107) = ( -0.0645243 0.1465605 0.1601355), wk = 0.0036900 k( 108) = ( -0.0564588 0.1282405 0.1401185), wk = 0.0036900 k( 109) = ( -0.0483932 0.1099204 0.1201016), wk = 0.0036900 k( 110) = ( -0.0403277 0.0916003 0.1000847), wk = 0.0036900 k( 111) = ( -0.0322622 0.0732803 0.0800677), wk = 0.0036900 k( 112) = ( -0.0241966 0.0549602 0.0600508), wk = 0.0036900 k( 113) = ( -0.0161311 0.0366401 0.0400339), wk = 0.0036900 k( 114) = ( -0.0080655 0.0183201 0.0200169), wk = 0.0036900 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 117) = ( 0.0250000 0.0110064 0.0000000), wk = 0.0036900 k( 118) = ( 0.0500000 0.0220129 0.0000000), wk = 0.0036900 k( 119) = ( 0.0750000 0.0330193 0.0000000), wk = 0.0036900 k( 120) = ( 0.1000000 0.0440257 0.0000000), wk = 0.0036900 k( 121) = ( 0.1250000 0.0550321 0.0000000), wk = 0.0036900 k( 122) = ( 0.1500000 0.0660386 0.0000000), wk = 0.0036900 k( 123) = ( 0.1750000 0.0770450 0.0000000), wk = 0.0036900 k( 124) = ( 0.2000000 0.0880514 0.0000000), wk = 0.0036900 k( 125) = ( 0.2250000 0.0990578 0.0000000), wk = 0.0036900 k( 126) = ( 0.2500000 0.1100643 0.0000000), wk = 0.0036900 k( 127) = ( 0.2750000 0.1210707 0.0000000), wk = 0.0036900 k( 128) = ( 0.3000000 0.1320771 0.0000000), wk = 0.0036900 k( 129) = ( 0.3250000 0.1430836 0.0000000), wk = 0.0036900 k( 130) = ( 0.3500000 0.1540900 0.0000000), wk = 0.0036900 k( 131) = ( 0.3750000 0.1650964 0.0000000), wk = 0.0036900 k( 132) = ( 0.4000000 0.1761028 0.0000000), wk = 0.0036900 k( 133) = ( 0.4250000 0.1871093 0.0000000), wk = 0.0036900 k( 134) = ( 0.4500000 0.1981157 0.0000000), wk = 0.0036900 k( 135) = ( 0.4750000 0.2091221 0.0000000), wk = 0.0036900 k( 136) = ( 0.5000000 0.2201285 0.0000000), wk = 0.0036900 k( 137) = ( 0.5000000 0.2201285 0.0000000), wk = 0.0036900 k( 138) = ( 0.4919367 0.2384435 0.0200113), wk = 0.0036900 k( 139) = ( 0.4838734 0.2567584 0.0400226), wk = 0.0036900 k( 140) = ( 0.4758102 0.2750733 0.0600340), wk = 0.0036900 k( 141) = ( 0.4677469 0.2933882 0.0800453), wk = 0.0036900 k( 142) = ( 0.4596836 0.3117032 0.1000566), wk = 0.0036900 k( 143) = ( 0.4516204 0.3300181 0.1200679), wk = 0.0036900 k( 144) = ( 0.4435571 0.3483330 0.1400792), wk = 0.0036900 k( 145) = ( 0.4354938 0.3666479 0.1600905), wk = 0.0036900 k( 146) = ( 0.4274305 0.3849629 0.1801019), wk = 0.0036900 k( 147) = ( 0.4193673 0.4032778 0.2001132), wk = 0.0036900 k( 148) = ( 0.4113040 0.4215927 0.2201245), wk = 0.0036900 k( 149) = ( 0.4032407 0.4399077 0.2401358), wk = 0.0036900 k( 150) = ( 0.3951774 0.4582226 0.2601471), wk = 0.0036900 k( 151) = ( 0.3871141 0.4765375 0.2801585), wk = 0.0036900 k( 152) = ( 0.3790509 0.4948524 0.3001698), wk = 0.0036900 k( 153) = ( 0.3709876 0.5131673 0.3201811), wk = 0.0036900 k( 154) = ( 0.3629243 0.5314823 0.3401924), wk = 0.0036900 k( 155) = ( 0.3548610 0.5497972 0.3602037), wk = 0.0036900 k( 156) = ( 0.3467978 0.5681121 0.3802151), wk = 0.0036900 k( 157) = ( 0.3387345 0.5864270 0.4002264), wk = 0.0036900 k( 158) = ( 0.3306712 0.6047420 0.4202377), wk = 0.0036900 k( 159) = ( 0.3226079 0.6230569 0.4402490), wk = 0.0036900 k( 160) = ( 0.3145447 0.6413718 0.4602604), wk = 0.0036900 k( 161) = ( 0.3064814 0.6596867 0.4802717), wk = 0.0036900 k( 162) = ( 0.2984181 0.6780017 0.5002830), wk = 0.0036900 k( 163) = ( 0.2903548 0.6963166 0.5202943), wk = 0.0036900 k( 164) = ( 0.2822916 0.7146315 0.5403056), wk = 0.0036900 k( 165) = ( 0.2742283 0.7329464 0.5603169), wk = 0.0036900 k( 166) = ( 0.2742283 0.7329464 0.5603169), wk = 0.0036900 k( 167) = ( 0.2468055 0.7274432 0.5663299), wk = 0.0036900 k( 168) = ( 0.2193826 0.7219400 0.5723428), wk = 0.0036900 k( 169) = ( 0.1919598 0.7164368 0.5783558), wk = 0.0036900 k( 170) = ( 0.1645370 0.7109336 0.5843687), wk = 0.0036900 k( 171) = ( 0.1371141 0.7054304 0.5903816), wk = 0.0036900 k( 172) = ( 0.1096913 0.6999272 0.5963946), wk = 0.0036900 k( 173) = ( 0.0822685 0.6944239 0.6024075), wk = 0.0036900 k( 174) = ( 0.0548457 0.6889207 0.6084205), wk = 0.0036900 k( 175) = ( 0.0274228 0.6834175 0.6144334), wk = 0.0036900 k( 176) = ( 0.0000000 0.6779143 0.6204463), wk = 0.0036900 k( 177) = ( 0.0000000 0.6779143 0.6204463), wk = 0.0036900 k( 178) = ( 0.0080645 0.6595966 0.6404608), wk = 0.0036900 k( 179) = ( 0.0161290 0.6412788 0.6604751), wk = 0.0036900 k( 180) = ( 0.0241936 0.6229611 0.6804895), wk = 0.0036900 k( 181) = ( 0.0322581 0.6046433 0.7005039), wk = 0.0036900 k( 182) = ( 0.0403226 0.5863256 0.7205183), wk = 0.0036900 k( 183) = ( 0.0483871 0.5680078 0.7405327), wk = 0.0036900 k( 184) = ( 0.0564516 0.5496901 0.7605471), wk = 0.0036900 k( 185) = ( 0.0645161 0.5313724 0.7805615), wk = 0.0036900 k( 186) = ( 0.0725806 0.5130546 0.8005759), wk = 0.0036900 k( 187) = ( 0.0806452 0.4947369 0.8205903), wk = 0.0036900 k( 188) = ( 0.0887097 0.4764191 0.8406047), wk = 0.0036900 k( 189) = ( 0.0967742 0.4581014 0.8606191), wk = 0.0036900 k( 190) = ( 0.1048387 0.4397836 0.8806335), wk = 0.0036900 k( 191) = ( 0.1129032 0.4214659 0.9006479), wk = 0.0036900 k( 192) = ( 0.1209677 0.4031482 0.9206623), wk = 0.0036900 k( 193) = ( 0.1290323 0.3848304 0.9406767), wk = 0.0036900 k( 194) = ( 0.1370968 0.3665127 0.9606911), wk = 0.0036900 k( 195) = ( 0.1451613 0.3481949 0.9807055), wk = 0.0036900 k( 196) = ( 0.1532258 0.3298772 1.0007199), wk = 0.0036900 k( 197) = ( 0.1612903 0.3115595 1.0207343), wk = 0.0036900 k( 198) = ( 0.1693548 0.2932417 1.0407487), wk = 0.0036900 k( 199) = ( 0.1774194 0.2749240 1.0607631), wk = 0.0036900 k( 200) = ( 0.1854839 0.2566062 1.0807775), wk = 0.0036900 k( 201) = ( 0.1935484 0.2382885 1.1007919), wk = 0.0036900 k( 202) = ( 0.2016129 0.2199707 1.1208063), wk = 0.0036900 k( 203) = ( 0.2096774 0.2016530 1.1408207), wk = 0.0036900 k( 204) = ( 0.2177419 0.1833352 1.1608351), wk = 0.0036900 k( 205) = ( 0.2258064 0.1650175 1.1808495), wk = 0.0036900 k( 206) = ( 0.2338710 0.1466998 1.2008639), wk = 0.0036900 k( 207) = ( 0.2419355 0.1283820 1.2208783), wk = 0.0036900 k( 208) = ( 0.2500000 0.1100643 1.2408927), wk = 0.0036900 k( 209) = ( 0.2500000 0.1100643 1.2408927), wk = 0.0036900 k( 210) = ( 0.2727273 0.1200701 1.2299601), wk = 0.0036900 k( 211) = ( 0.2954545 0.1300760 1.2190275), wk = 0.0036900 k( 212) = ( 0.3181818 0.1400818 1.2080948), wk = 0.0036900 k( 213) = ( 0.3409091 0.1500876 1.1971622), wk = 0.0036900 k( 214) = ( 0.3636364 0.1600935 1.1862296), wk = 0.0036900 k( 215) = ( 0.3863636 0.1700993 1.1752970), wk = 0.0036900 k( 216) = ( 0.4090909 0.1801052 1.1643644), wk = 0.0036900 k( 217) = ( 0.4318182 0.1901110 1.1534317), wk = 0.0036900 k( 218) = ( 0.4545455 0.2001169 1.1424991), wk = 0.0036900 k( 219) = ( 0.4772727 0.2101227 1.1315665), wk = 0.0036900 k( 220) = ( 0.5000000 0.2201285 1.1206339), wk = 0.0036900 k( 221) = ( 0.5000000 0.2201285 1.1206339), wk = 0.0036900 k( 222) = ( 0.5000000 0.2201285 1.0918997), wk = 0.0036900 k( 223) = ( 0.5000000 0.2201285 1.0631655), wk = 0.0036900 k( 224) = ( 0.5000000 0.2201285 1.0344313), wk = 0.0036900 k( 225) = ( 0.5000000 0.2201285 1.0056971), wk = 0.0036900 k( 226) = ( 0.5000000 0.2201285 0.9769629), wk = 0.0036900 k( 227) = ( 0.5000000 0.2201285 0.9482287), wk = 0.0036900 k( 228) = ( 0.5000000 0.2201285 0.9194945), wk = 0.0036900 k( 229) = ( 0.5000000 0.2201285 0.8907602), wk = 0.0036900 k( 230) = ( 0.5000000 0.2201285 0.8620261), wk = 0.0036900 k( 231) = ( 0.5000000 0.2201285 0.8332919), wk = 0.0036900 k( 232) = ( 0.5000000 0.2201285 0.8045576), wk = 0.0036900 k( 233) = ( 0.5000000 0.2201285 0.7758235), wk = 0.0036900 k( 234) = ( 0.5000000 0.2201285 0.7470892), wk = 0.0036900 k( 235) = ( 0.5000000 0.2201285 0.7183550), wk = 0.0036900 k( 236) = ( 0.5000000 0.2201285 0.6896208), wk = 0.0036900 k( 237) = ( 0.5000000 0.2201285 0.6608866), wk = 0.0036900 k( 238) = ( 0.5000000 0.2201285 0.6321524), wk = 0.0036900 k( 239) = ( 0.5000000 0.2201285 0.6034182), wk = 0.0036900 k( 240) = ( 0.5000000 0.2201285 0.5746840), wk = 0.0036900 k( 241) = ( 0.5000000 0.2201285 0.5459498), wk = 0.0036900 k( 242) = ( 0.5000000 0.2201285 0.5172156), wk = 0.0036900 k( 243) = ( 0.5000000 0.2201285 0.4884814), wk = 0.0036900 k( 244) = ( 0.5000000 0.2201285 0.4597472), wk = 0.0036900 k( 245) = ( 0.5000000 0.2201285 0.4310130), wk = 0.0036900 k( 246) = ( 0.5000000 0.2201285 0.4022788), wk = 0.0036900 k( 247) = ( 0.5000000 0.2201285 0.3735446), wk = 0.0036900 k( 248) = ( 0.5000000 0.2201285 0.3448104), wk = 0.0036900 k( 249) = ( 0.5000000 0.2201285 0.3160762), wk = 0.0036900 k( 250) = ( 0.5000000 0.2201285 0.2873420), wk = 0.0036900 k( 251) = ( 0.5000000 0.2201285 0.2586078), wk = 0.0036900 k( 252) = ( 0.5000000 0.2201285 0.2298736), wk = 0.0036900 k( 253) = ( 0.5000000 0.2201285 0.2011394), wk = 0.0036900 k( 254) = ( 0.5000000 0.2201285 0.1724052), wk = 0.0036900 k( 255) = ( 0.5000000 0.2201285 0.1436710), wk = 0.0036900 k( 256) = ( 0.5000000 0.2201285 0.1149368), wk = 0.0036900 k( 257) = ( 0.5000000 0.2201285 0.0862026), wk = 0.0036900 k( 258) = ( 0.5000000 0.2201285 0.0574684), wk = 0.0036900 k( 259) = ( 0.5000000 0.2201285 0.0287342), wk = 0.0036900 k( 260) = ( 0.5000000 0.2201285 0.0000000), wk = 0.0036900 k( 261) = ( 0.0000000 0.0000000 1.2408927), wk = 0.0036900 k( 262) = ( 0.0250000 0.0110064 1.2408927), wk = 0.0036900 k( 263) = ( 0.0500000 0.0220129 1.2408927), wk = 0.0036900 k( 264) = ( 0.0750000 0.0330193 1.2408927), wk = 0.0036900 k( 265) = ( 0.1000000 0.0440257 1.2408927), wk = 0.0036900 k( 266) = ( 0.1250000 0.0550321 1.2408927), wk = 0.0036900 k( 267) = ( 0.1500000 0.0660386 1.2408927), wk = 0.0036900 k( 268) = ( 0.1750000 0.0770450 1.2408927), wk = 0.0036900 k( 269) = ( 0.2000000 0.0880514 1.2408927), wk = 0.0036900 k( 270) = ( 0.2250000 0.0990578 1.2408927), wk = 0.0036900 k( 271) = ( 0.2500000 0.1100643 1.2408927), wk = 0.0036900 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 2) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0036900 k( 3) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0036900 k( 4) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0036900 k( 5) = ( 0.0000000 0.0000000 0.0454545), wk = 0.0036900 k( 6) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0036900 k( 7) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0036900 k( 8) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0036900 k( 9) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0036900 k( 10) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0036900 k( 11) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0036900 k( 12) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0036900 k( 13) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0036900 k( 14) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0036900 k( 15) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0036900 k( 16) = ( 0.0000000 0.0000000 0.1704545), wk = 0.0036900 k( 17) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0036900 k( 18) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0036900 k( 19) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0036900 k( 20) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0036900 k( 21) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0036900 k( 22) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0036900 k( 23) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0036900 k( 24) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0036900 k( 25) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0036900 k( 26) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0036900 k( 27) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0036900 k( 28) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0036900 k( 29) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0036900 k( 30) = ( 0.0000000 0.0000000 0.3295454), wk = 0.0036900 k( 31) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0036900 k( 32) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0036900 k( 33) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0036900 k( 34) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0036900 k( 35) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0036900 k( 36) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0036900 k( 37) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0036900 k( 38) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0036900 k( 39) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0036900 k( 40) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0036900 k( 41) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0036900 k( 42) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0036900 k( 43) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0036900 k( 44) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0036900 k( 45) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 46) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 47) = ( -0.0096913 0.0096913 0.5000000), wk = 0.0036900 k( 48) = ( -0.0193826 0.0193826 0.5000000), wk = 0.0036900 k( 49) = ( -0.0290739 0.0290739 0.5000000), wk = 0.0036900 k( 50) = ( -0.0387653 0.0387653 0.5000000), wk = 0.0036900 k( 51) = ( -0.0484566 0.0484566 0.5000000), wk = 0.0036900 k( 52) = ( -0.0484566 0.0484566 0.5000000), wk = 0.0036900 k( 53) = ( -0.0565199 0.0565198 0.4919367), wk = 0.0036900 k( 54) = ( -0.0645831 0.0645831 0.4838734), wk = 0.0036900 k( 55) = ( -0.0726464 0.0726464 0.4758102), wk = 0.0036900 k( 56) = ( -0.0807097 0.0807097 0.4677469), wk = 0.0036900 k( 57) = ( -0.0887730 0.0887730 0.4596836), wk = 0.0036900 k( 58) = ( -0.0968362 0.0968362 0.4516203), wk = 0.0036900 k( 59) = ( -0.1048995 0.1048995 0.4435571), wk = 0.0036900 k( 60) = ( -0.1129628 0.1129628 0.4354938), wk = 0.0036900 k( 61) = ( -0.1210260 0.1210260 0.4274305), wk = 0.0036900 k( 62) = ( -0.1290893 0.1290893 0.4193672), wk = 0.0036900 k( 63) = ( -0.1371526 0.1371526 0.4113040), wk = 0.0036900 k( 64) = ( -0.1452159 0.1452159 0.4032407), wk = 0.0036900 k( 65) = ( -0.1532792 0.1532792 0.3951774), wk = 0.0036900 k( 66) = ( -0.1613424 0.1613424 0.3871141), wk = 0.0036900 k( 67) = ( -0.1694057 0.1694057 0.3790509), wk = 0.0036900 k( 68) = ( -0.1774690 0.1774690 0.3709876), wk = 0.0036900 k( 69) = ( -0.1855323 0.1855323 0.3629243), wk = 0.0036900 k( 70) = ( -0.1935955 0.1935955 0.3548610), wk = 0.0036900 k( 71) = ( -0.2016588 0.2016588 0.3467978), wk = 0.0036900 k( 72) = ( -0.2097221 0.2097221 0.3387345), wk = 0.0036900 k( 73) = ( -0.2177854 0.2177854 0.3306712), wk = 0.0036900 k( 74) = ( -0.2258486 0.2258486 0.3226079), wk = 0.0036900 k( 75) = ( -0.2339119 0.2339119 0.3145447), wk = 0.0036900 k( 76) = ( -0.2419752 0.2419752 0.3064814), wk = 0.0036900 k( 77) = ( -0.2500385 0.2500385 0.2984181), wk = 0.0036900 k( 78) = ( -0.2581017 0.2581017 0.2903548), wk = 0.0036900 k( 79) = ( -0.2661650 0.2661650 0.2822916), wk = 0.0036900 k( 80) = ( -0.2742283 0.2742283 0.2742283), wk = 0.0036900 k( 81) = ( -0.2742283 0.2742283 0.2742283), wk = 0.0036900 k( 82) = ( -0.2661628 0.2661628 0.2661628), wk = 0.0036900 k( 83) = ( -0.2580972 0.2580972 0.2580972), wk = 0.0036900 k( 84) = ( -0.2500317 0.2500317 0.2500317), wk = 0.0036900 k( 85) = ( -0.2419661 0.2419661 0.2419661), wk = 0.0036900 k( 86) = ( -0.2339006 0.2339006 0.2339006), wk = 0.0036900 k( 87) = ( -0.2258351 0.2258351 0.2258351), wk = 0.0036900 k( 88) = ( -0.2177695 0.2177695 0.2177695), wk = 0.0036900 k( 89) = ( -0.2097040 0.2097040 0.2097040), wk = 0.0036900 k( 90) = ( -0.2016384 0.2016384 0.2016384), wk = 0.0036900 k( 91) = ( -0.1935729 0.1935729 0.1935729), wk = 0.0036900 k( 92) = ( -0.1855074 0.1855074 0.1855074), wk = 0.0036900 k( 93) = ( -0.1774418 0.1774418 0.1774418), wk = 0.0036900 k( 94) = ( -0.1693763 0.1693763 0.1693763), wk = 0.0036900 k( 95) = ( -0.1613108 0.1613108 0.1613108), wk = 0.0036900 k( 96) = ( -0.1532452 0.1532452 0.1532452), wk = 0.0036900 k( 97) = ( -0.1451797 0.1451797 0.1451797), wk = 0.0036900 k( 98) = ( -0.1371141 0.1371141 0.1371141), wk = 0.0036900 k( 99) = ( -0.1290486 0.1290486 0.1290486), wk = 0.0036900 k( 100) = ( -0.1209831 0.1209831 0.1209831), wk = 0.0036900 k( 101) = ( -0.1129175 0.1129175 0.1129175), wk = 0.0036900 k( 102) = ( -0.1048520 0.1048520 0.1048520), wk = 0.0036900 k( 103) = ( -0.0967864 0.0967864 0.0967864), wk = 0.0036900 k( 104) = ( -0.0887209 0.0887209 0.0887209), wk = 0.0036900 k( 105) = ( -0.0806554 0.0806554 0.0806554), wk = 0.0036900 k( 106) = ( -0.0725898 0.0725898 0.0725898), wk = 0.0036900 k( 107) = ( -0.0645243 0.0645243 0.0645243), wk = 0.0036900 k( 108) = ( -0.0564588 0.0564588 0.0564588), wk = 0.0036900 k( 109) = ( -0.0483932 0.0483932 0.0483932), wk = 0.0036900 k( 110) = ( -0.0403277 0.0403277 0.0403277), wk = 0.0036900 k( 111) = ( -0.0322622 0.0322621 0.0322622), wk = 0.0036900 k( 112) = ( -0.0241966 0.0241966 0.0241966), wk = 0.0036900 k( 113) = ( -0.0161311 0.0161311 0.0161311), wk = 0.0036900 k( 114) = ( -0.0080655 0.0080655 0.0080655), wk = 0.0036900 k( 115) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036900 k( 117) = ( 0.0250000 0.0250000 -0.0250000), wk = 0.0036900 k( 118) = ( 0.0500000 0.0500000 -0.0500000), wk = 0.0036900 k( 119) = ( 0.0750000 0.0750000 -0.0750000), wk = 0.0036900 k( 120) = ( 0.1000000 0.1000000 -0.1000000), wk = 0.0036900 k( 121) = ( 0.1250000 0.1250000 -0.1250000), wk = 0.0036900 k( 122) = ( 0.1500000 0.1500000 -0.1500000), wk = 0.0036900 k( 123) = ( 0.1750000 0.1750000 -0.1750000), wk = 0.0036900 k( 124) = ( 0.2000000 0.2000000 -0.2000000), wk = 0.0036900 k( 125) = ( 0.2250000 0.2250000 -0.2250000), wk = 0.0036900 k( 126) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0036900 k( 127) = ( 0.2750000 0.2750000 -0.2750000), wk = 0.0036900 k( 128) = ( 0.3000000 0.3000000 -0.3000000), wk = 0.0036900 k( 129) = ( 0.3250000 0.3250000 -0.3250000), wk = 0.0036900 k( 130) = ( 0.3500000 0.3500000 -0.3500000), wk = 0.0036900 k( 131) = ( 0.3750000 0.3750000 -0.3750000), wk = 0.0036900 k( 132) = ( 0.4000000 0.4000000 -0.4000000), wk = 0.0036900 k( 133) = ( 0.4250000 0.4250000 -0.4250000), wk = 0.0036900 k( 134) = ( 0.4500000 0.4500000 -0.4500000), wk = 0.0036900 k( 135) = ( 0.4750000 0.4750000 -0.4750000), wk = 0.0036900 k( 136) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 137) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 138) = ( 0.4919367 0.5080633 -0.4919367), wk = 0.0036900 k( 139) = ( 0.4838734 0.5161265 -0.4838734), wk = 0.0036900 k( 140) = ( 0.4758102 0.5241898 -0.4758102), wk = 0.0036900 k( 141) = ( 0.4677469 0.5322531 -0.4677469), wk = 0.0036900 k( 142) = ( 0.4596836 0.5403164 -0.4596836), wk = 0.0036900 k( 143) = ( 0.4516204 0.5483796 -0.4516204), wk = 0.0036900 k( 144) = ( 0.4435571 0.5564429 -0.4435571), wk = 0.0036900 k( 145) = ( 0.4354938 0.5645062 -0.4354938), wk = 0.0036900 k( 146) = ( 0.4274305 0.5725695 -0.4274305), wk = 0.0036900 k( 147) = ( 0.4193673 0.5806328 -0.4193673), wk = 0.0036900 k( 148) = ( 0.4113040 0.5886960 -0.4113040), wk = 0.0036900 k( 149) = ( 0.4032407 0.5967593 -0.4032407), wk = 0.0036900 k( 150) = ( 0.3951774 0.6048226 -0.3951774), wk = 0.0036900 k( 151) = ( 0.3871141 0.6128859 -0.3871141), wk = 0.0036900 k( 152) = ( 0.3790509 0.6209491 -0.3790509), wk = 0.0036900 k( 153) = ( 0.3709876 0.6290124 -0.3709876), wk = 0.0036900 k( 154) = ( 0.3629243 0.6370757 -0.3629243), wk = 0.0036900 k( 155) = ( 0.3548610 0.6451390 -0.3548610), wk = 0.0036900 k( 156) = ( 0.3467978 0.6532022 -0.3467978), wk = 0.0036900 k( 157) = ( 0.3387345 0.6612655 -0.3387345), wk = 0.0036900 k( 158) = ( 0.3306712 0.6693288 -0.3306712), wk = 0.0036900 k( 159) = ( 0.3226079 0.6773921 -0.3226079), wk = 0.0036900 k( 160) = ( 0.3145447 0.6854553 -0.3145447), wk = 0.0036900 k( 161) = ( 0.3064814 0.6935186 -0.3064814), wk = 0.0036900 k( 162) = ( 0.2984181 0.7015819 -0.2984181), wk = 0.0036900 k( 163) = ( 0.2903548 0.7096452 -0.2903548), wk = 0.0036900 k( 164) = ( 0.2822916 0.7177084 -0.2822916), wk = 0.0036900 k( 165) = ( 0.2742283 0.7257717 -0.2742283), wk = 0.0036900 k( 166) = ( 0.2742283 0.7257717 -0.2742283), wk = 0.0036900 k( 167) = ( 0.2468055 0.7031945 -0.2468055), wk = 0.0036900 k( 168) = ( 0.2193826 0.6806174 -0.2193826), wk = 0.0036900 k( 169) = ( 0.1919598 0.6580402 -0.1919598), wk = 0.0036900 k( 170) = ( 0.1645370 0.6354630 -0.1645370), wk = 0.0036900 k( 171) = ( 0.1371141 0.6128859 -0.1371141), wk = 0.0036900 k( 172) = ( 0.1096913 0.5903087 -0.1096913), wk = 0.0036900 k( 173) = ( 0.0822685 0.5677315 -0.0822685), wk = 0.0036900 k( 174) = ( 0.0548457 0.5451543 -0.0548457), wk = 0.0036900 k( 175) = ( 0.0274228 0.5225772 -0.0274228), wk = 0.0036900 k( 176) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036900 k( 177) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036900 k( 178) = ( 0.0080645 0.4919355 0.0080645), wk = 0.0036900 k( 179) = ( 0.0161290 0.4838710 0.0161290), wk = 0.0036900 k( 180) = ( 0.0241936 0.4758064 0.0241936), wk = 0.0036900 k( 181) = ( 0.0322581 0.4677419 0.0322581), wk = 0.0036900 k( 182) = ( 0.0403226 0.4596774 0.0403226), wk = 0.0036900 k( 183) = ( 0.0483871 0.4516129 0.0483871), wk = 0.0036900 k( 184) = ( 0.0564516 0.4435484 0.0564516), wk = 0.0036900 k( 185) = ( 0.0645161 0.4354839 0.0645161), wk = 0.0036900 k( 186) = ( 0.0725806 0.4274193 0.0725807), wk = 0.0036900 k( 187) = ( 0.0806452 0.4193548 0.0806452), wk = 0.0036900 k( 188) = ( 0.0887097 0.4112903 0.0887097), wk = 0.0036900 k( 189) = ( 0.0967742 0.4032258 0.0967742), wk = 0.0036900 k( 190) = ( 0.1048387 0.3951613 0.1048387), wk = 0.0036900 k( 191) = ( 0.1129032 0.3870968 0.1129032), wk = 0.0036900 k( 192) = ( 0.1209677 0.3790323 0.1209677), wk = 0.0036900 k( 193) = ( 0.1290323 0.3709677 0.1290323), wk = 0.0036900 k( 194) = ( 0.1370968 0.3629032 0.1370968), wk = 0.0036900 k( 195) = ( 0.1451613 0.3548387 0.1451613), wk = 0.0036900 k( 196) = ( 0.1532258 0.3467742 0.1532258), wk = 0.0036900 k( 197) = ( 0.1612903 0.3387097 0.1612903), wk = 0.0036900 k( 198) = ( 0.1693548 0.3306452 0.1693548), wk = 0.0036900 k( 199) = ( 0.1774194 0.3225807 0.1774193), wk = 0.0036900 k( 200) = ( 0.1854839 0.3145161 0.1854839), wk = 0.0036900 k( 201) = ( 0.1935484 0.3064516 0.1935484), wk = 0.0036900 k( 202) = ( 0.2016129 0.2983871 0.2016129), wk = 0.0036900 k( 203) = ( 0.2096774 0.2903226 0.2096774), wk = 0.0036900 k( 204) = ( 0.2177419 0.2822581 0.2177419), wk = 0.0036900 k( 205) = ( 0.2258064 0.2741936 0.2258064), wk = 0.0036900 k( 206) = ( 0.2338710 0.2661290 0.2338710), wk = 0.0036900 k( 207) = ( 0.2419355 0.2580645 0.2419355), wk = 0.0036900 k( 208) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 k( 209) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 k( 210) = ( 0.2727273 0.2727273 0.2228676), wk = 0.0036900 k( 211) = ( 0.2954545 0.2954545 0.1957352), wk = 0.0036900 k( 212) = ( 0.3181818 0.3181818 0.1686027), wk = 0.0036900 k( 213) = ( 0.3409091 0.3409091 0.1414703), wk = 0.0036900 k( 214) = ( 0.3636364 0.3636364 0.1143379), wk = 0.0036900 k( 215) = ( 0.3863636 0.3863636 0.0872055), wk = 0.0036900 k( 216) = ( 0.4090909 0.4090909 0.0600731), wk = 0.0036900 k( 217) = ( 0.4318182 0.4318182 0.0329407), wk = 0.0036900 k( 218) = ( 0.4545455 0.4545455 0.0058083), wk = 0.0036900 k( 219) = ( 0.4772727 0.4772727 -0.0213242), wk = 0.0036900 k( 220) = ( 0.5000000 0.5000000 -0.0484566), wk = 0.0036900 k( 221) = ( 0.5000000 0.5000000 -0.0484566), wk = 0.0036900 k( 222) = ( 0.5000000 0.5000000 -0.0600346), wk = 0.0036900 k( 223) = ( 0.5000000 0.5000000 -0.0716126), wk = 0.0036900 k( 224) = ( 0.5000000 0.5000000 -0.0831907), wk = 0.0036900 k( 225) = ( 0.5000000 0.5000000 -0.0947687), wk = 0.0036900 k( 226) = ( 0.5000000 0.5000000 -0.1063468), wk = 0.0036900 k( 227) = ( 0.5000000 0.5000000 -0.1179248), wk = 0.0036900 k( 228) = ( 0.5000000 0.5000000 -0.1295028), wk = 0.0036900 k( 229) = ( 0.5000000 0.5000000 -0.1410809), wk = 0.0036900 k( 230) = ( 0.5000000 0.5000000 -0.1526589), wk = 0.0036900 k( 231) = ( 0.5000000 0.5000000 -0.1642369), wk = 0.0036900 k( 232) = ( 0.5000000 0.5000000 -0.1758150), wk = 0.0036900 k( 233) = ( 0.5000000 0.5000000 -0.1873930), wk = 0.0036900 k( 234) = ( 0.5000000 0.5000000 -0.1989711), wk = 0.0036900 k( 235) = ( 0.5000000 0.5000000 -0.2105491), wk = 0.0036900 k( 236) = ( 0.5000000 0.5000000 -0.2221271), wk = 0.0036900 k( 237) = ( 0.5000000 0.5000000 -0.2337052), wk = 0.0036900 k( 238) = ( 0.5000000 0.5000000 -0.2452832), wk = 0.0036900 k( 239) = ( 0.5000000 0.5000000 -0.2568612), wk = 0.0036900 k( 240) = ( 0.5000000 0.5000000 -0.2684393), wk = 0.0036900 k( 241) = ( 0.5000000 0.5000000 -0.2800173), wk = 0.0036900 k( 242) = ( 0.5000000 0.5000000 -0.2915953), wk = 0.0036900 k( 243) = ( 0.5000000 0.5000000 -0.3031734), wk = 0.0036900 k( 244) = ( 0.5000000 0.5000000 -0.3147514), wk = 0.0036900 k( 245) = ( 0.5000000 0.5000000 -0.3263295), wk = 0.0036900 k( 246) = ( 0.5000000 0.5000000 -0.3379075), wk = 0.0036900 k( 247) = ( 0.5000000 0.5000000 -0.3494855), wk = 0.0036900 k( 248) = ( 0.5000000 0.5000000 -0.3610636), wk = 0.0036900 k( 249) = ( 0.5000000 0.5000000 -0.3726416), wk = 0.0036900 k( 250) = ( 0.5000000 0.5000000 -0.3842196), wk = 0.0036900 k( 251) = ( 0.5000000 0.5000000 -0.3957977), wk = 0.0036900 k( 252) = ( 0.5000000 0.5000000 -0.4073757), wk = 0.0036900 k( 253) = ( 0.5000000 0.5000000 -0.4189537), wk = 0.0036900 k( 254) = ( 0.5000000 0.5000000 -0.4305318), wk = 0.0036900 k( 255) = ( 0.5000000 0.5000000 -0.4421098), wk = 0.0036900 k( 256) = ( 0.5000000 0.5000000 -0.4536879), wk = 0.0036900 k( 257) = ( 0.5000000 0.5000000 -0.4652659), wk = 0.0036900 k( 258) = ( 0.5000000 0.5000000 -0.4768439), wk = 0.0036900 k( 259) = ( 0.5000000 0.5000000 -0.4884220), wk = 0.0036900 k( 260) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036900 k( 261) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036900 k( 262) = ( 0.0250000 0.0250000 0.4750000), wk = 0.0036900 k( 263) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0036900 k( 264) = ( 0.0750000 0.0750000 0.4250000), wk = 0.0036900 k( 265) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0036900 k( 266) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0036900 k( 267) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0036900 k( 268) = ( 0.1750000 0.1750000 0.3250000), wk = 0.0036900 k( 269) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0036900 k( 270) = ( 0.2250000 0.2250000 0.2750000), wk = 0.0036900 k( 271) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036900 Dense grid: 145241 G-vectors FFT dimensions: ( 100, 100, 100) Smooth grid: 70467 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.26 Mb ( 248, 68) NL pseudopotentials 0.34 Mb ( 124, 178) Each V/rho on FFT grid 0.31 Mb ( 20000) Each G-vector array 0.02 Mb ( 2016) G-vector shells 0.01 Mb ( 967) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.03 Mb ( 248, 272) Each subspace H/S matrix 0.03 Mb ( 45, 45) Each matrix 0.37 Mb ( 178, 2, 68) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./K4Br2O.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.9 secs Computing kpt #: 2 total cpu time spent up to now is 7.9 secs Computing kpt #: 3 total cpu time spent up to now is 10.4 secs Computing kpt #: 4 total cpu time spent up to now is 13.3 secs Computing kpt #: 5 total cpu time spent up to now is 15.7 secs Computing kpt #: 6 total cpu time spent up to now is 18.2 secs Computing kpt #: 7 total cpu time spent up to now is 21.0 secs Computing kpt #: 8 total cpu time spent up to now is 23.5 secs Computing kpt #: 9 total cpu time spent up to now is 25.9 secs Computing kpt #: 10 total cpu time spent up to now is 28.6 secs Computing kpt #: 11 total cpu time spent up to now is 31.1 secs Computing kpt #: 12 total cpu time spent up to now is 33.6 secs Computing kpt #: 13 total cpu time spent up to now is 36.1 secs Computing kpt #: 14 total cpu time spent up to now is 39.4 secs Computing kpt #: 15 total cpu time spent up to now is 41.9 secs Computing kpt #: 16 total cpu time spent up to now is 44.4 secs Computing kpt #: 17 total cpu time spent up to now is 46.8 secs Computing kpt #: 18 total cpu time spent up to now is 49.3 secs Computing kpt #: 19 total cpu time spent up to now is 51.8 secs Computing kpt #: 20 total cpu time spent up to now is 54.4 secs Computing kpt 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95.2 secs Computing kpt #: 37 total cpu time spent up to now is 97.8 secs Computing kpt #: 38 total cpu time spent up to now is 100.4 secs Computing kpt #: 39 total cpu time spent up to now is 102.9 secs Computing kpt #: 40 total cpu time spent up to now is 105.6 secs Computing kpt #: 41 total cpu time spent up to now is 108.3 secs Computing kpt #: 42 total cpu time spent up to now is 110.8 secs Computing kpt #: 43 total cpu time spent up to now is 113.3 secs Computing kpt #: 44 total cpu time spent up to now is 116.0 secs Computing kpt #: 45 total cpu time spent up to now is 118.6 secs Computing kpt #: 46 total cpu time spent up to now is 121.2 secs Computing kpt #: 47 total cpu time spent up to now is 123.8 secs Computing kpt #: 48 total cpu time spent up to now is 126.4 secs Computing kpt #: 49 total cpu time spent up to now is 129.0 secs Computing kpt #: 50 total cpu time spent up to now is 131.5 secs Computing kpt #: 51 total cpu time spent up to now is 134.4 secs Computing kpt #: 52 total cpu time spent up to now is 137.1 secs Computing kpt #: 53 total cpu time spent up to now is 139.7 secs Computing kpt #: 54 total cpu time spent up to now is 142.7 secs Computing kpt #: 55 total cpu time spent up to now is 145.5 secs Computing kpt #: 56 total cpu time spent up to now is 147.9 secs Computing kpt #: 57 total cpu time spent up to now is 150.5 secs Computing kpt #: 58 total cpu time spent up to now is 153.0 secs Computing kpt #: 59 total cpu time spent up to now is 155.3 secs Computing kpt #: 60 total cpu time spent up to now is 157.7 secs Computing kpt #: 61 total cpu time spent up to now is 160.2 secs Computing kpt #: 62 total cpu time spent up to now is 162.6 secs Computing kpt #: 63 total cpu time spent up to now is 164.9 secs Computing kpt #: 64 total cpu time spent up to now is 167.3 secs Computing kpt #: 65 total cpu time spent up to now is 169.8 secs Computing kpt #: 66 total cpu time spent up to now is 172.3 secs Computing kpt #: 67 total cpu time spent up to now is 174.9 secs Computing kpt #: 68 total cpu time spent up to now is 177.4 secs Computing kpt #: 69 total cpu time spent up to now is 180.0 secs Computing kpt #: 70 total cpu time spent up to now is 182.5 secs Computing kpt #: 71 total cpu time spent up to now is 185.6 secs Computing kpt #: 72 total cpu time spent up to now is 188.1 secs Computing kpt #: 73 total cpu time spent up to now is 190.6 secs Computing kpt #: 74 total cpu time spent up to now is 193.1 secs Computing kpt #: 75 total cpu time spent up to now is 195.7 secs Computing kpt #: 76 total cpu time spent up to now is 198.5 secs Computing kpt #: 77 total cpu time spent up to now is 201.0 secs Computing kpt #: 78 total cpu time spent up to now is 203.7 secs Computing kpt #: 79 total cpu time spent up to now is 206.2 secs Computing kpt #: 80 total cpu time spent up to now is 209.0 secs Computing kpt #: 81 total cpu time spent up to now is 211.5 secs Computing kpt #: 82 total cpu time spent up to now is 213.9 secs Computing kpt #: 83 total cpu time spent up to now is 216.2 secs Computing kpt #: 84 total cpu time spent up to now is 218.7 secs Computing kpt #: 85 total cpu time spent up to now is 221.1 secs Computing kpt #: 86 total cpu time spent up to now is 223.6 secs Computing kpt #: 87 total cpu time spent up to now is 226.1 secs Computing kpt #: 88 total cpu time spent up to now is 228.5 secs Computing kpt #: 89 total cpu time spent up to now is 230.9 secs Computing kpt #: 90 total cpu time spent up to now is 233.4 secs Computing kpt #: 91 total cpu time spent up to now is 235.9 secs Computing kpt #: 92 total cpu time spent up to now is 238.5 secs Computing kpt #: 93 total cpu time spent up to now is 241.1 secs Computing kpt #: 94 total cpu time spent up to now is 243.6 secs Computing kpt #: 95 total cpu time spent up to now is 246.2 secs Computing kpt #: 96 total cpu time spent up to now is 249.1 secs Computing kpt #: 97 total cpu time spent up to now is 251.8 secs Computing kpt #: 98 total cpu time spent up to now is 254.4 secs Computing kpt #: 99 total cpu time spent up to now is 257.1 secs Computing kpt #: 100 total cpu time spent up to now is 259.7 secs Computing kpt #: 101 total cpu time spent up to now is 262.5 secs Computing kpt #: 102 total cpu time spent up to now is 265.3 secs Computing kpt #: 103 total cpu time spent up to now is 267.9 secs Computing kpt #: 104 total cpu time spent up to now is 270.7 secs Computing kpt #: 105 total cpu time spent up to now is 273.4 secs Computing kpt #: 106 total cpu time spent up to now is 276.2 secs Computing kpt #: 107 total cpu time spent up to now is 278.7 secs Computing kpt #: 108 total cpu time spent up to now is 281.6 secs Computing kpt #: 109 total cpu time spent up to now is 284.4 secs Computing kpt #: 110 total cpu time spent up to now is 287.5 secs Computing kpt #: 111 total cpu time spent up to now is 290.7 secs Computing kpt #: 112 total cpu time spent up to now is 294.5 secs Computing kpt #: 113 total cpu time spent up to now is 297.1 secs Computing kpt #: 114 total cpu time spent up to now is 299.8 secs Computing kpt #: 115 total cpu time spent up to now is 302.3 secs Computing kpt #: 116 total cpu time spent up to now is 304.8 secs Computing kpt #: 117 total cpu time spent up to now is 307.3 secs Computing kpt #: 118 total cpu time spent up to now is 309.8 secs Computing kpt #: 119 total cpu time spent up to now is 312.7 secs Computing kpt #: 120 total cpu time spent up to now is 315.3 secs Computing kpt #: 121 total cpu time spent up to now is 317.9 secs Computing kpt #: 122 total cpu time spent up to now is 320.5 secs Computing kpt #: 123 total cpu time spent up to now is 323.6 secs Computing kpt #: 124 total cpu time spent up to now is 327.8 secs Computing kpt #: 125 total cpu time spent up to now is 331.1 secs Computing kpt #: 126 total cpu time spent up to now is 335.1 secs Computing kpt #: 127 total cpu time spent up to now is 338.4 secs Computing kpt #: 128 total cpu time spent up to now is 341.5 secs Computing kpt #: 129 total cpu time spent up to now is 344.6 secs Computing kpt #: 130 total cpu time spent up to now is 347.2 secs Computing kpt #: 131 total cpu time spent up to now is 350.3 secs Computing kpt #: 132 total cpu time spent up to now is 353.0 secs Computing kpt #: 133 total cpu time spent up to now is 355.7 secs Computing kpt #: 134 total cpu time spent up to now is 358.4 secs Computing kpt #: 135 total cpu time spent up to now is 361.2 secs Computing kpt #: 136 total cpu time spent up to now is 364.0 secs Computing kpt #: 137 total cpu time spent up to now is 366.8 secs Computing kpt #: 138 total cpu time spent up to now is 369.5 secs Computing kpt #: 139 total cpu time spent up to now is 372.2 secs Computing kpt #: 140 total cpu time spent up to now is 375.0 secs Computing kpt #: 141 total cpu time spent up to now is 377.7 secs Computing kpt #: 142 total cpu time spent up to now is 380.5 secs Computing kpt #: 143 total cpu time spent up to now is 383.3 secs Computing kpt #: 144 total cpu time spent up to now is 386.4 secs Computing kpt #: 145 total cpu time spent up to now is 389.6 secs Computing kpt #: 146 total cpu time spent up to now is 392.8 secs Computing kpt #: 147 total cpu time spent up to now is 396.1 secs Computing kpt #: 148 total cpu time spent up to now is 400.2 secs Computing kpt #: 149 total cpu time spent up to now is 403.5 secs Computing kpt #: 150 total cpu time spent up to now is 406.7 secs Computing kpt #: 151 total cpu time spent up to now is 409.2 secs Computing kpt #: 152 total cpu time spent up to now is 411.6 secs Computing kpt #: 153 total cpu time spent up to now is 414.0 secs Computing kpt #: 154 total cpu time spent up to now is 416.2 secs Computing kpt #: 155 total cpu time spent up to now is 418.4 secs Computing kpt #: 156 total cpu time spent up to now is 420.8 secs Computing kpt #: 157 total cpu time spent up to now is 423.4 secs Computing kpt #: 158 total cpu time spent up to now is 426.1 secs Computing kpt #: 159 total cpu time spent up to now is 428.7 secs Computing kpt #: 160 total cpu time spent up to now is 431.3 secs Computing kpt #: 161 total cpu time spent up to now is 434.1 secs Computing kpt #: 162 total cpu time spent up to now is 436.8 secs Computing kpt #: 163 total cpu time spent up to now is 439.4 secs Computing kpt #: 164 total cpu time spent up to now is 442.2 secs Computing kpt #: 165 total cpu time spent up to now is 444.8 secs Computing kpt #: 166 total cpu time spent up to now is 447.3 secs Computing kpt #: 167 total cpu time spent up to now is 449.7 secs Computing kpt #: 168 total cpu time spent up to now is 452.2 secs Computing kpt #: 169 total cpu time spent up to now is 454.8 secs Computing kpt #: 170 total cpu time spent up to now is 457.1 secs Computing kpt #: 171 total cpu time spent up to now is 459.5 secs Computing kpt #: 172 total cpu time spent up to now is 462.0 secs Computing kpt #: 173 total cpu time spent up to now is 464.6 secs Computing kpt #: 174 total cpu time spent up to now is 467.0 secs Computing kpt #: 175 total cpu time spent up to now is 469.4 secs Computing kpt #: 176 total cpu time spent up to now is 471.9 secs Computing kpt #: 177 total cpu time spent up to now is 474.3 secs Computing kpt #: 178 total cpu time spent up to now is 476.6 secs Computing kpt #: 179 total cpu time spent up to now is 479.1 secs Computing kpt #: 180 total cpu time spent up to now is 481.5 secs Computing kpt #: 181 total cpu time spent up to now is 484.0 secs Computing kpt #: 182 total cpu time spent up to now is 486.4 secs Computing kpt #: 183 total cpu time spent up to now is 488.8 secs Computing kpt #: 184 total cpu time spent up to now is 491.3 secs Computing kpt #: 185 total cpu time spent up to now is 493.9 secs Computing kpt #: 186 total cpu time spent up to now is 496.3 secs Computing kpt #: 187 total cpu time spent up to now is 499.1 secs Computing kpt #: 188 total cpu time spent up to now is 501.5 secs Computing kpt #: 189 total cpu time spent up to now is 504.0 secs Computing kpt #: 190 total cpu time spent up to now is 506.5 secs Computing kpt #: 191 total cpu time spent up to now is 509.2 secs Computing kpt #: 192 total cpu time spent up to now is 511.6 secs Computing kpt #: 193 total cpu time spent up to now is 514.2 secs Computing kpt #: 194 total cpu time spent up to now is 516.6 secs Computing kpt #: 195 total cpu time spent up to now is 519.1 secs Computing kpt #: 196 total cpu time spent up to now is 521.6 secs Computing kpt #: 197 total cpu time spent up to now is 524.1 secs Computing kpt #: 198 total cpu time spent up to now is 526.7 secs Computing kpt #: 199 total cpu time spent up to now is 529.3 secs Computing kpt #: 200 total cpu time spent up to now is 532.0 secs Computing kpt #: 201 total cpu time spent up to now is 534.5 secs Computing kpt #: 202 total cpu time spent up to now is 537.3 secs Computing kpt #: 203 total cpu time spent up to now is 539.8 secs Computing kpt #: 204 total cpu time spent up to now is 542.4 secs Computing kpt #: 205 total cpu time spent up to now is 545.2 secs Computing kpt #: 206 total cpu time spent up to now is 547.8 secs Computing kpt #: 207 total cpu time spent up to now is 550.4 secs Computing kpt #: 208 total cpu time spent up to now is 553.1 secs Computing kpt #: 209 total cpu time spent up to now is 555.8 secs Computing kpt #: 210 total cpu time spent up to now is 558.5 secs Computing kpt #: 211 total cpu time spent up to now is 561.2 secs Computing kpt #: 212 total cpu time spent up to now is 564.0 secs Computing kpt #: 213 total cpu time spent up to now is 566.6 secs Computing kpt #: 214 total cpu time spent up to now is 569.2 secs Computing kpt #: 215 total cpu time spent up to now is 571.8 secs Computing kpt #: 216 total cpu time spent up to now is 574.4 secs Computing kpt #: 217 total cpu time spent up to now is 576.9 secs Computing kpt #: 218 total cpu time spent up to now is 579.4 secs Computing kpt #: 219 total cpu time spent up to now is 582.0 secs Computing kpt #: 220 total cpu time spent up to now is 584.6 secs Computing kpt #: 221 total cpu time spent up to now is 587.3 secs Computing kpt #: 222 total cpu time spent up to now is 589.9 secs Computing kpt #: 223 total cpu time spent up to now is 592.4 secs Computing kpt #: 224 total cpu time spent up to now is 595.2 secs Computing kpt #: 225 total cpu time spent up to now is 598.0 secs Computing kpt #: 226 total cpu time spent up to now is 600.6 secs Computing kpt #: 227 total cpu time spent up to now is 603.1 secs Computing kpt #: 228 total cpu time spent up to now is 605.5 secs Computing kpt #: 229 total cpu time spent up to now is 608.0 secs Computing kpt #: 230 total cpu time spent up to now is 610.6 secs Computing kpt #: 231 total cpu time spent up to now is 613.0 secs Computing kpt #: 232 total cpu time spent up to now is 615.6 secs Computing kpt #: 233 total cpu time spent up to now is 618.2 secs Computing kpt #: 234 total cpu time spent up to now is 620.8 secs Computing kpt #: 235 total cpu time spent up to now is 623.5 secs Computing kpt #: 236 total cpu time spent up to now is 626.2 secs Computing kpt #: 237 total cpu time spent up to now is 628.9 secs Computing kpt #: 238 total cpu time spent up to now is 631.8 secs Computing kpt #: 239 total cpu time spent up to now is 634.4 secs Computing kpt #: 240 total cpu time spent up to now is 637.5 secs Computing kpt #: 241 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 642.9 secs Computing kpt #: 242 total cpu time spent up to now is 646.2 secs Computing kpt #: 243 total cpu time spent up to now is 648.9 secs Computing kpt #: 244 total cpu time spent up to now is 651.5 secs Computing kpt #: 245 total cpu time spent up to now is 654.2 secs Computing kpt #: 246 total cpu time spent up to now is 656.8 secs Computing kpt #: 247 total cpu time spent up to now is 659.4 secs Computing kpt #: 248 total cpu time spent up to now is 662.1 secs Computing kpt #: 249 total cpu time spent up to now is 664.7 secs Computing kpt #: 250 total cpu time spent up to now is 667.3 secs Computing kpt #: 251 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 673.0 secs Computing kpt #: 252 total cpu time spent up to now is 676.3 secs Computing kpt #: 253 total cpu time spent up to now is 679.4 secs Computing kpt #: 254 total cpu time spent up to now is 682.1 secs Computing kpt #: 255 total cpu time spent up to now is 684.9 secs Computing kpt #: 256 total cpu time spent up to now is 687.8 secs Computing kpt #: 257 total cpu time spent up to now is 690.4 secs Computing kpt #: 258 total cpu time spent up to now is 693.2 secs Computing kpt #: 259 total cpu time spent up to now is 696.0 secs Computing kpt #: 260 total cpu time spent up to now is 698.7 secs Computing kpt #: 261 total cpu time spent up to now is 701.4 secs Computing kpt #: 262 total cpu time spent up to now is 703.9 secs Computing kpt #: 263 total cpu time spent up to now is 706.5 secs Computing kpt #: 264 total cpu time spent up to now is 709.1 secs Computing kpt #: 265 total cpu time spent up to now is 711.6 secs Computing kpt #: 266 total cpu time spent up to now is 714.1 secs Computing kpt #: 267 total cpu time spent up to now is 716.6 secs Computing kpt #: 268 total cpu time spent up to now is 719.2 secs Computing kpt #: 269 total cpu time spent up to now is 721.7 secs Computing kpt #: 270 total cpu time spent up to now is 724.4 secs Computing kpt #: 271 total cpu time spent up to now is 727.1 secs ethr = 1.79E-08, avg # of iterations = 29.8 total cpu time spent up to now is 727.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8819 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3983 -25.3983 -11.0600 -11.0600 -11.0479 -11.0479 -10.6839 -10.6839 -10.0186 -10.0186 -9.9865 -9.9865 -9.8063 -9.8063 -9.8011 -9.8011 -9.6423 -9.6423 -9.2905 -9.2905 -9.2181 -9.2181 -9.1752 -9.1752 -9.0618 -9.0618 -9.0112 -9.0112 -8.7316 -8.7316 -8.6301 -8.6301 0.2706 0.2706 0.6345 0.6345 0.7436 0.7436 0.9410 0.9410 1.0968 1.0968 1.0974 1.0974 3.9148 3.9148 4.3709 4.3709 4.3846 4.3846 5.3959 5.3959 7.5198 7.5198 7.5431 7.5431 7.8877 7.8877 8.0513 8.0513 8.7247 8.7248 k = 0.0000 0.0000 0.0282 ( 8815 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3984 -25.3984 -11.0600 -11.0600 -11.0480 -11.0480 -10.6847 -10.6847 -10.0185 -10.0185 -9.9865 -9.9865 -9.8063 -9.8063 -9.8011 -9.8011 -9.6423 -9.6423 -9.2908 -9.2908 -9.2183 -9.2183 -9.1752 -9.1752 -9.0613 -9.0613 -9.0111 -9.0111 -8.7309 -8.7309 -8.6296 -8.6296 0.2708 0.2708 0.6339 0.6339 0.7434 0.7434 0.9405 0.9405 1.0959 1.0959 1.0970 1.0970 3.9146 3.9146 4.3695 4.3695 4.3832 4.3832 5.3998 5.3998 7.5214 7.5214 7.5458 7.5458 7.8898 7.8898 8.0529 8.0529 8.7256 8.7257 k = 0.0000 0.0000 0.0564 ( 8819 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4693 -25.4693 -25.3985 -25.3985 -11.0602 -11.0602 -11.0484 -11.0484 -10.6870 -10.6870 -10.0183 -10.0183 -9.9865 -9.9865 -9.8060 -9.8060 -9.8009 -9.8009 -9.6422 -9.6422 -9.2918 -9.2918 -9.2190 -9.2190 -9.1752 -9.1752 -9.0601 -9.0601 -9.0109 -9.0109 -8.7287 -8.7287 -8.6280 -8.6280 0.2714 0.2714 0.6319 0.6319 0.7429 0.7429 0.9391 0.9391 1.0928 1.0928 1.0961 1.0961 3.9140 3.9140 4.3652 4.3652 4.3789 4.3789 5.4114 5.4114 7.5263 7.5263 7.5540 7.5540 7.8963 7.8963 8.0576 8.0576 8.7275 8.7275 k = 0.0000 0.0000 0.0846 ( 8815 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4691 -25.4691 -25.3987 -25.3987 -11.0603 -11.0603 -11.0491 -11.0491 -10.6909 -10.6909 -10.0180 -10.0180 -9.9865 -9.9865 -9.8055 -9.8055 -9.8007 -9.8007 -9.6421 -9.6421 -9.2935 -9.2935 -9.2199 -9.2199 -9.1753 -9.1753 -9.0580 -9.0580 -9.0106 -9.0106 -8.7253 -8.7253 -8.6253 -8.6253 0.2723 0.2723 0.6287 0.6287 0.7420 0.7420 0.9367 0.9367 1.0878 1.0878 1.0946 1.0946 3.9130 3.9130 4.3578 4.3578 4.3721 4.3721 5.4305 5.4305 7.5343 7.5343 7.5675 7.5675 7.9071 7.9071 8.0654 8.0654 8.7307 8.7307 k = 0.0000 0.0000 0.1128 ( 8809 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4688 -25.4688 -25.3990 -25.3990 -11.0606 -11.0606 -11.0501 -11.0501 -10.6962 -10.6962 -10.0175 -10.0175 -9.9864 -9.9864 -9.8049 -9.8049 -9.8005 -9.8005 -9.6420 -9.6420 -9.2958 -9.2958 -9.2208 -9.2208 -9.1754 -9.1754 -9.0555 -9.0555 -9.0102 -9.0102 -8.7206 -8.7206 -8.6213 -8.6213 0.2736 0.2736 0.6241 0.6241 0.7407 0.7407 0.9333 0.9333 1.0809 1.0809 1.0925 1.0925 3.9116 3.9116 4.3475 4.3475 4.3629 4.3629 5.4568 5.4568 7.5453 7.5453 7.5862 7.5862 7.9222 7.9222 8.0763 8.0763 8.7353 8.7353 k = 0.0000 0.0000 0.1410 ( 8813 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4684 -25.4684 -25.3994 -25.3994 -11.0609 -11.0609 -11.0513 -11.0513 -10.7030 -10.7030 -10.0170 -10.0170 -9.9864 -9.9864 -9.8042 -9.8042 -9.8001 -9.8001 -9.6418 -9.6418 -9.2989 -9.2989 -9.2215 -9.2215 -9.1755 -9.1755 -9.0525 -9.0525 -9.0097 -9.0097 -8.7150 -8.7150 -8.6159 -8.6159 0.2753 0.2753 0.6184 0.6184 0.7392 0.7392 0.9292 0.9292 1.0723 1.0723 1.0899 1.0899 3.9098 3.9098 4.3342 4.3342 4.3517 4.3517 5.4898 5.4898 7.5594 7.5594 7.6101 7.6101 7.9414 7.9414 8.0903 8.0903 8.7412 8.7412 k = 0.0000 0.0000 0.1692 ( 8817 PWs) bands (ev): -26.3019 -26.3019 -26.2976 -26.2976 -25.4679 -25.4679 -25.3999 -25.3999 -11.0612 -11.0612 -11.0528 -11.0528 -10.7111 -10.7111 -10.0164 -10.0164 -9.9864 -9.9864 -9.8033 -9.8033 -9.7997 -9.7997 -9.6416 -9.6416 -9.3026 -9.3026 -9.2220 -9.2220 -9.1757 -9.1757 -9.0494 -9.0494 -9.0092 -9.0092 -8.7088 -8.7088 -8.6088 -8.6088 0.2773 0.2773 0.6115 0.6115 0.7373 0.7373 0.9243 0.9243 1.0621 1.0621 1.0867 1.0867 3.9076 3.9076 4.3183 4.3183 4.3385 4.3385 5.5291 5.5291 7.5763 7.5763 7.6389 7.6389 7.9648 7.9648 8.1071 8.1071 8.7485 8.7485 k = 0.0000 0.0000 0.1974 ( 8817 PWs) bands (ev): -26.3019 -26.3019 -26.2976 -26.2976 -25.4673 -25.4673 -25.4004 -25.4004 -11.0616 -11.0616 -11.0545 -11.0545 -10.7206 -10.7206 -10.0157 -10.0157 -9.9863 -9.9863 -9.8023 -9.8023 -9.7993 -9.7993 -9.6414 -9.6414 -9.3070 -9.3070 -9.2221 -9.2221 -9.1759 -9.1759 -9.0462 -9.0462 -9.0086 -9.0086 -8.7022 -8.7022 -8.5998 -8.5998 0.2795 0.2795 0.6035 0.6035 0.7353 0.7353 0.9186 0.9186 1.0506 1.0506 1.0830 1.0830 3.9049 3.9049 4.3000 4.3000 4.3233 4.3233 5.5743 5.5743 7.5958 7.5958 7.6724 7.6724 7.9922 7.9922 8.1269 8.1269 8.7574 8.7574 k = 0.0000 0.0000 0.2256 ( 8813 PWs) bands (ev): -26.3018 -26.3018 -26.2977 -26.2977 -25.4666 -25.4666 -25.4011 -25.4011 -11.0620 -11.0620 -11.0564 -11.0564 -10.7312 -10.7312 -10.0149 -10.0149 -9.9864 -9.9864 -9.8012 -9.8012 -9.7988 -9.7988 -9.6412 -9.6412 -9.3118 -9.3118 -9.2219 -9.2219 -9.1759 -9.1759 -9.0431 -9.0431 -9.0079 -9.0079 -8.6955 -8.6955 -8.5887 -8.5887 0.2821 0.2821 0.5945 0.5945 0.7332 0.7332 0.9124 0.9124 1.0380 1.0380 1.0788 1.0788 3.9018 3.9018 4.2796 4.2796 4.3062 4.3062 5.6248 5.6248 7.6177 7.6177 7.7104 7.7104 8.0235 8.0235 8.1493 8.1493 8.7679 8.7679 k = 0.0000 0.0000 0.2538 ( 8821 PWs) bands (ev): -26.3017 -26.3017 -26.2977 -26.2977 -25.4659 -25.4659 -25.4018 -25.4018 -11.0623 -11.0623 -11.0584 -11.0584 -10.7430 -10.7430 -10.0141 -10.0141 -9.9864 -9.9864 -9.8001 -9.8001 -9.7982 -9.7982 -9.6409 -9.6409 -9.3170 -9.3170 -9.2215 -9.2215 -9.1759 -9.1759 -9.0402 -9.0402 -9.0071 -9.0071 -8.6890 -8.6890 -8.5756 -8.5756 0.2849 0.2849 0.5845 0.5845 0.7309 0.7309 0.9057 0.9057 1.0244 1.0244 1.0741 1.0741 3.8983 3.8983 4.2574 4.2574 4.2873 4.2873 5.6802 5.6802 7.6418 7.6418 7.7527 7.7527 8.0586 8.0586 8.1744 8.1744 8.7803 8.7803 k = 0.0000 0.0000 0.2820 ( 8803 PWs) bands (ev): -26.3017 -26.3017 -26.2977 -26.2977 -25.4650 -25.4650 -25.4025 -25.4025 -11.0627 -11.0627 -11.0606 -11.0606 -10.7558 -10.7558 -10.0133 -10.0133 -9.9865 -9.9865 -9.7991 -9.7991 -9.7976 -9.7976 -9.6406 -9.6406 -9.3223 -9.3223 -9.2210 -9.2210 -9.1756 -9.1756 -9.0375 -9.0375 -9.0062 -9.0062 -8.6827 -8.6827 -8.5603 -8.5603 0.2880 0.2880 0.5737 0.5737 0.7287 0.7287 0.8985 0.8985 1.0102 1.0102 1.0690 1.0690 3.8943 3.8943 4.2337 4.2337 4.2667 4.2667 5.7400 5.7400 7.6678 7.6678 7.7988 7.7988 8.0974 8.0974 8.2020 8.2020 8.7946 8.7946 k = 0.0000 0.0000 0.3102 ( 8785 PWs) bands (ev): -26.3016 -26.3016 -26.2977 -26.2977 -25.4641 -25.4641 -25.4033 -25.4033 -11.0634 -11.0634 -11.0625 -11.0625 -10.7695 -10.7695 -10.0125 -10.0125 -9.9867 -9.9867 -9.7981 -9.7981 -9.7968 -9.7968 -9.6403 -9.6403 -9.3277 -9.3277 -9.2206 -9.2206 -9.1750 -9.1750 -9.0352 -9.0352 -9.0050 -9.0050 -8.6767 -8.6767 -8.5430 -8.5430 0.2912 0.2912 0.5621 0.5621 0.7266 0.7266 0.8910 0.8910 0.9954 0.9954 1.0634 1.0634 3.8898 3.8898 4.2086 4.2086 4.2443 4.2443 5.8039 5.8039 7.6952 7.6952 7.8486 7.8486 8.1396 8.1396 8.2318 8.2318 8.8110 8.8110 k = 0.0000 0.0000 0.3384 ( 8783 PWs) bands (ev): -26.3015 -26.3015 -26.2977 -26.2977 -25.4632 -25.4632 -25.4042 -25.4042 -11.0656 -11.0656 -11.0629 -11.0629 -10.7840 -10.7840 -10.0118 -10.0118 -9.9870 -9.9870 -9.7975 -9.7975 -9.7959 -9.7959 -9.6400 -9.6400 -9.3332 -9.3332 -9.2205 -9.2205 -9.1740 -9.1740 -9.0334 -9.0334 -9.0034 -9.0034 -8.6709 -8.6709 -8.5240 -8.5240 0.2946 0.2946 0.5499 0.5499 0.7248 0.7248 0.8832 0.8832 0.9804 0.9804 1.0575 1.0575 3.8849 3.8849 4.1822 4.1822 4.2204 4.2204 5.8713 5.8713 7.7238 7.7238 7.9015 7.9015 8.1852 8.1852 8.2638 8.2638 8.8298 8.8298 k = 0.0000 0.0000 0.3666 ( 8787 PWs) bands (ev): -26.3014 -26.3014 -26.2977 -26.2977 -25.4622 -25.4622 -25.4052 -25.4052 -11.0682 -11.0682 -11.0630 -11.0630 -10.7991 -10.7991 -10.0111 -10.0111 -9.9874 -9.9874 -9.7970 -9.7970 -9.7949 -9.7949 -9.6398 -9.6398 -9.3385 -9.3385 -9.2207 -9.2207 -9.1727 -9.1727 -9.0321 -9.0321 -9.0012 -9.0012 -8.6654 -8.6654 -8.5034 -8.5034 0.2981 0.2981 0.5372 0.5372 0.7232 0.7232 0.8753 0.8753 0.9653 0.9653 1.0512 1.0512 3.8795 3.8795 4.1548 4.1548 4.1951 4.1951 5.9419 5.9419 7.7532 7.7532 7.9572 7.9572 8.2338 8.2338 8.2976 8.2976 8.8513 8.8513 k = 0.0000 0.0000 0.3948 ( 8787 PWs) bands (ev): -26.3013 -26.3013 -26.2977 -26.2977 -25.4611 -25.4611 -25.4062 -25.4062 -11.0708 -11.0708 -11.0629 -11.0629 -10.8148 -10.8148 -10.0105 -10.0105 -9.9878 -9.9878 -9.7966 -9.7966 -9.7939 -9.7939 -9.6395 -9.6395 -9.3437 -9.3437 -9.2214 -9.2214 -9.1710 -9.1710 -9.0315 -9.0315 -8.9984 -8.9984 -8.6600 -8.6600 -8.4816 -8.4816 0.3017 0.3017 0.5241 0.5241 0.7220 0.7220 0.8673 0.8673 0.9502 0.9502 1.0447 1.0447 3.8737 3.8737 4.1266 4.1266 4.1685 4.1685 6.0155 6.0155 7.7828 7.7828 8.0154 8.0154 8.2853 8.2853 8.3330 8.3330 8.8756 8.8756 k = 0.0000 0.0000 0.4230 ( 8795 PWs) bands (ev): -26.3012 -26.3012 -26.2977 -26.2977 -25.4599 -25.4599 -25.4073 -25.4073 -11.0736 -11.0736 -11.0626 -11.0626 -10.8310 -10.8310 -10.0099 -10.0099 -9.9884 -9.9884 -9.7964 -9.7964 -9.7929 -9.7929 -9.6392 -9.6392 -9.3487 -9.3487 -9.2226 -9.2226 -9.1690 -9.1690 -9.0314 -9.0314 -8.9949 -8.9949 -8.6547 -8.6547 -8.4586 -8.4586 0.3054 0.3054 0.5107 0.5107 0.7212 0.7212 0.8593 0.8593 0.9353 0.9353 1.0379 1.0379 3.8674 3.8674 4.0975 4.0975 4.1407 4.1407 6.0915 6.0915 7.8123 7.8123 8.0756 8.0756 8.3394 8.3394 8.3696 8.3696 8.9032 8.9032 k = 0.0000 0.0000 0.4512 ( 8807 PWs) bands (ev): -26.3011 -26.3011 -26.2977 -26.2977 -25.4588 -25.4588 -25.4084 -25.4084 -11.0764 -11.0764 -11.0622 -11.0622 -10.8474 -10.8474 -10.0095 -10.0095 -9.9891 -9.9891 -9.7964 -9.7964 -9.7921 -9.7921 -9.6389 -9.6389 -9.3535 -9.3535 -9.2242 -9.2242 -9.1668 -9.1668 -9.0318 -9.0318 -8.9907 -8.9907 -8.6494 -8.6494 -8.4349 -8.4349 0.3091 0.3091 0.4973 0.4973 0.7211 0.7211 0.8513 0.8513 0.9207 0.9207 1.0309 1.0309 3.8607 3.8607 4.0678 4.0678 4.1118 4.1118 6.1698 6.1698 7.8411 7.8411 8.1373 8.1373 8.3958 8.3958 8.4070 8.4070 8.9342 8.9342 k = 0.0000 0.0000 0.4794 ( 8807 PWs) bands (ev): -26.3010 -26.3010 -26.2977 -26.2977 -25.4576 -25.4576 -25.4095 -25.4095 -11.0793 -11.0793 -11.0616 -11.0616 -10.8639 -10.8639 -10.0091 -10.0091 -9.9899 -9.9899 -9.7965 -9.7965 -9.7914 -9.7914 -9.6387 -9.6387 -9.3580 -9.3580 -9.2262 -9.2262 -9.1644 -9.1644 -9.0326 -9.0326 -8.9859 -8.9859 -8.6440 -8.6440 -8.4105 -8.4105 0.3129 0.3129 0.4838 0.4838 0.7215 0.7215 0.8435 0.8435 0.9066 0.9066 1.0237 1.0237 3.8536 3.8536 4.0375 4.0375 4.0821 4.0821 6.2500 6.2500 7.8690 7.8690 8.2001 8.2001 8.4434 8.4434 8.4549 8.4549 8.9690 8.9690 k = 0.0000 0.0000 0.5076 ( 8797 PWs) bands (ev): -26.3009 -26.3009 -26.2977 -26.2977 -25.4563 -25.4563 -25.4106 -25.4106 -11.0824 -11.0824 -11.0608 -11.0608 -10.8805 -10.8805 -10.0089 -10.0089 -9.9908 -9.9908 -9.7967 -9.7967 -9.7909 -9.7909 -9.6384 -9.6384 -9.3622 -9.3622 -9.2285 -9.2285 -9.1619 -9.1619 -9.0337 -9.0337 -8.9806 -8.9806 -8.6386 -8.6386 -8.3856 -8.3856 0.3167 0.3167 0.4706 0.4706 0.7225 0.7225 0.8359 0.8359 0.8929 0.8929 1.0164 1.0164 3.8461 3.8461 4.0069 4.0069 4.0517 4.0517 6.3319 6.3319 7.8954 7.8954 8.2635 8.2635 8.4793 8.4793 8.5149 8.5149 9.0076 9.0076 k = 0.0000 0.0000 0.5358 ( 8823 PWs) bands (ev): -26.3007 -26.3007 -26.2977 -26.2977 -25.4550 -25.4550 -25.4118 -25.4118 -11.0856 -11.0856 -11.0598 -11.0598 -10.8969 -10.8969 -10.0088 -10.0088 -9.9919 -9.9919 -9.7972 -9.7972 -9.7905 -9.7905 -9.6382 -9.6382 -9.3662 -9.3662 -9.2311 -9.2311 -9.1595 -9.1595 -9.0351 -9.0351 -8.9748 -8.9748 -8.6330 -8.6330 -8.3605 -8.3605 0.3205 0.3205 0.4576 0.4576 0.7242 0.7242 0.8286 0.8286 0.8798 0.8798 1.0091 1.0091 3.8383 3.8383 3.9760 3.9760 4.0208 4.0208 6.4151 6.4151 7.9200 7.9200 8.3271 8.3271 8.5119 8.5119 8.5763 8.5763 9.0494 9.0494 k = 0.0000 0.0000 0.5640 ( 8823 PWs) bands (ev): -26.3006 -26.3006 -26.2978 -26.2978 -25.4537 -25.4537 -25.4130 -25.4130 -11.0889 -11.0889 -11.0586 -11.0586 -10.9130 -10.9130 -10.0088 -10.0088 -9.9930 -9.9930 -9.7979 -9.7979 -9.7903 -9.7903 -9.6379 -9.6379 -9.3700 -9.3700 -9.2340 -9.2340 -9.1571 -9.1571 -9.0366 -9.0366 -8.9686 -8.9686 -8.6273 -8.6273 -8.3353 -8.3353 0.3244 0.3244 0.4451 0.4451 0.7265 0.7265 0.8217 0.8217 0.8674 0.8674 1.0017 1.0017 3.8301 3.8301 3.9449 3.9449 3.9894 3.9894 6.4994 6.4994 7.9427 7.9427 8.3902 8.3902 8.5387 8.5387 8.6386 8.6386 9.0348 9.0348 k = 0.0000 0.0000 0.5922 ( 8819 PWs) bands (ev): -26.3005 -26.3005 -26.2978 -26.2978 -25.4524 -25.4524 -25.4143 -25.4143 -11.0926 -11.0926 -11.0572 -11.0572 -10.9286 -10.9286 -10.0089 -10.0089 -9.9943 -9.9943 -9.7988 -9.7988 -9.7903 -9.7903 -9.6377 -9.6377 -9.3735 -9.3735 -9.2371 -9.2371 -9.1548 -9.1548 -9.0382 -9.0382 -8.9621 -8.9621 -8.6215 -8.6215 -8.3101 -8.3101 0.3282 0.3282 0.4331 0.4331 0.7293 0.7293 0.8151 0.8151 0.8557 0.8557 0.9943 0.9943 3.8216 3.8216 3.9138 3.9138 3.9579 3.9579 6.5845 6.5845 7.9631 7.9631 8.4522 8.4522 8.5564 8.5564 8.7013 8.7013 9.0059 9.0059 k = 0.0000 0.0000 0.6204 ( 8815 PWs) bands (ev): -26.3004 -26.3004 -26.2978 -26.2978 -25.4511 -25.4511 -25.4155 -25.4155 -11.0965 -11.0965 -11.0555 -11.0555 -10.9436 -10.9436 -10.0092 -10.0092 -9.9957 -9.9957 -9.7999 -9.7999 -9.7904 -9.7904 -9.6375 -9.6375 -9.3767 -9.3767 -9.2404 -9.2404 -9.1526 -9.1526 -9.0399 -9.0399 -8.9553 -8.9553 -8.6155 -8.6155 -8.2851 -8.2851 0.3319 0.3319 0.4218 0.4218 0.7326 0.7326 0.8090 0.8090 0.8449 0.8449 0.9869 0.9869 3.8128 3.8128 3.8829 3.8829 3.9262 3.9262 6.6703 6.6703 7.9812 7.9812 8.5118 8.5118 8.5619 8.5619 8.7637 8.7637 8.9925 8.9925 k = 0.0000 0.0000 0.6486 ( 8815 PWs) bands (ev): -26.3003 -26.3003 -26.2978 -26.2978 -25.4498 -25.4498 -25.4167 -25.4167 -11.1009 -11.1009 -11.0537 -11.0537 -10.9578 -10.9578 -10.0096 -10.0096 -9.9972 -9.9972 -9.8012 -9.8012 -9.7908 -9.7908 -9.6374 -9.6374 -9.3797 -9.3797 -9.2438 -9.2438 -9.1506 -9.1506 -9.0415 -9.0415 -8.9484 -8.9484 -8.6094 -8.6094 -8.2604 -8.2604 0.3356 0.3356 0.4112 0.4112 0.7361 0.7361 0.8034 0.8034 0.8351 0.8351 0.9797 0.9797 3.8036 3.8036 3.8522 3.8522 3.8947 3.8947 6.7564 6.7564 7.9970 7.9970 8.5442 8.5442 8.5776 8.5776 8.8252 8.8252 8.9969 8.9969 k = 0.0000 0.0000 0.6769 ( 8810 PWs) bands (ev): -26.3002 -26.3002 -26.2978 -26.2978 -25.4485 -25.4485 -25.4179 -25.4179 -11.1058 -11.1058 -11.0516 -11.0516 -10.9709 -10.9709 -10.0102 -10.0102 -9.9988 -9.9988 -9.8028 -9.8028 -9.7913 -9.7913 -9.6372 -9.6372 -9.3825 -9.3825 -9.2473 -9.2473 -9.1488 -9.1488 -9.0432 -9.0432 -8.9413 -8.9413 -8.6032 -8.6032 -8.2360 -8.2360 0.3391 0.3391 0.4015 0.4015 0.7395 0.7395 0.7984 0.7984 0.8264 0.8264 0.9725 0.9725 3.7938 3.7938 3.8223 3.8223 3.8636 3.8636 6.8425 6.8425 8.0105 8.0105 8.5235 8.5235 8.6306 8.6306 8.8852 8.8852 9.0172 9.0172 k = 0.0000 0.0000 0.7051 ( 8804 PWs) bands (ev): -26.3000 -26.3000 -26.2978 -26.2978 -25.4472 -25.4472 -25.4191 -25.4191 -11.1114 -11.1114 -11.0494 -11.0494 -10.9828 -10.9828 -10.0109 -10.0109 -10.0006 -10.0006 -9.8045 -9.8045 -9.7920 -9.7920 -9.6371 -9.6371 -9.3851 -9.3851 -9.2508 -9.2508 -9.1471 -9.1471 -9.0448 -9.0448 -8.9342 -8.9342 -8.5968 -8.5968 -8.2122 -8.2122 0.3422 0.3422 0.3929 0.3929 0.7426 0.7426 0.7943 0.7943 0.8192 0.8192 0.9655 0.9655 3.7817 3.7817 3.7948 3.7948 3.8330 3.8330 6.9285 6.9285 8.0219 8.0219 8.4908 8.4908 8.6823 8.6823 8.9427 8.9427 9.0497 9.0497 k = 0.0000 0.0000 0.7333 ( 8800 PWs) bands (ev): -26.2999 -26.2999 -26.2978 -26.2978 -25.4459 -25.4459 -25.4203 -25.4203 -11.1177 -11.1177 -11.0470 -11.0470 -10.9934 -10.9934 -10.0117 -10.0117 -10.0023 -10.0023 -9.8065 -9.8065 -9.7928 -9.7928 -9.6369 -9.6369 -9.3875 -9.3875 -9.2544 -9.2544 -9.1455 -9.1455 -9.0463 -9.0463 -8.9272 -8.9272 -8.5904 -8.5904 -8.1890 -8.1890 0.3449 0.3449 0.3855 0.3855 0.7446 0.7446 0.7910 0.7910 0.8139 0.8139 0.9587 0.9587 3.7591 3.7591 3.7776 3.7776 3.8037 3.8037 7.0140 7.0140 8.0312 8.0312 8.4522 8.4522 8.7283 8.7283 8.9970 8.9970 9.0897 9.0897 k = 0.0000 0.0000 0.7615 ( 8806 PWs) bands (ev): -26.2998 -26.2998 -26.2978 -26.2978 -25.4446 -25.4446 -25.4215 -25.4215 -11.1247 -11.1247 -11.0444 -11.0444 -11.0026 -11.0026 -10.0126 -10.0126 -10.0042 -10.0042 -9.8086 -9.8086 -9.7938 -9.7938 -9.6368 -9.6368 -9.3897 -9.3897 -9.2580 -9.2580 -9.1442 -9.1442 -9.0478 -9.0478 -8.9202 -8.9202 -8.5839 -8.5839 -8.1666 -8.1666 0.3467 0.3467 0.3798 0.3798 0.7451 0.7451 0.7884 0.7884 0.8109 0.8109 0.9521 0.9521 3.7315 3.7315 3.7627 3.7627 3.7786 3.7786 7.0986 7.0986 8.0387 8.0387 8.4108 8.4108 8.7645 8.7645 9.0471 9.0471 9.0644 9.0644 k = 0.0000 0.0000 0.7897 ( 8820 PWs) bands (ev): -26.2997 -26.2997 -26.2978 -26.2978 -25.4434 -25.4434 -25.4226 -25.4226 -11.1323 -11.1323 -11.0418 -11.0418 -11.0103 -11.0103 -10.0136 -10.0136 -10.0062 -10.0062 -9.8108 -9.8108 -9.7948 -9.7948 -9.6367 -9.6367 -9.3917 -9.3917 -9.2616 -9.2616 -9.1429 -9.1429 -9.0492 -9.0492 -8.9134 -8.9134 -8.5774 -8.5774 -8.1449 -8.1449 0.3471 0.3471 0.3762 0.3762 0.7441 0.7441 0.7862 0.7862 0.8106 0.8106 0.9458 0.9458 3.7039 3.7039 3.7393 3.7393 3.7635 3.7635 7.1821 7.1821 8.0445 8.0445 8.3687 8.3687 8.7820 8.7820 9.0182 9.0182 9.0923 9.0923 k = 0.0000 0.0000 0.8179 ( 8824 PWs) bands (ev): -26.2996 -26.2996 -26.2979 -26.2979 -25.4422 -25.4422 -25.4237 -25.4237 -11.1406 -11.1406 -11.0390 -11.0390 -11.0167 -11.0167 -10.0147 -10.0147 -10.0082 -10.0082 -9.8132 -9.8132 -9.7960 -9.7960 -9.6366 -9.6366 -9.3935 -9.3935 -9.2651 -9.2651 -9.1417 -9.1417 -9.0505 -9.0505 -8.9068 -8.9068 -8.5710 -8.5710 -8.1241 -8.1241 0.3458 0.3458 0.3750 0.3750 0.7416 0.7416 0.7843 0.7843 0.8131 0.8131 0.9397 0.9397 3.6771 3.6771 3.7127 3.7127 3.7531 3.7531 7.2639 7.2639 8.0489 8.0489 8.3271 8.3271 8.7691 8.7691 9.0006 9.0006 9.1316 9.1316 k = 0.0000 0.0000 0.8461 ( 8816 PWs) bands (ev): -26.2995 -26.2995 -26.2979 -26.2979 -25.4411 -25.4411 -25.4247 -25.4247 -11.1493 -11.1493 -11.0361 -11.0361 -11.0218 -11.0218 -10.0159 -10.0159 -10.0102 -10.0102 -9.8157 -9.8157 -9.7972 -9.7972 -9.6365 -9.6365 -9.3952 -9.3952 -9.2685 -9.2685 -9.1407 -9.1407 -9.0517 -9.0517 -8.9005 -8.9005 -8.5645 -8.5645 -8.1043 -8.1043 0.3432 0.3432 0.3756 0.3756 0.7381 0.7381 0.7826 0.7826 0.8176 0.8176 0.9339 0.9339 3.6513 3.6513 3.6863 3.6863 3.7437 3.7437 7.3436 7.3436 8.0520 8.0520 8.2870 8.2870 8.7279 8.7279 9.0102 9.0102 9.1644 9.1644 k = 0.0000 0.0000 0.8743 ( 8818 PWs) bands (ev): -26.2994 -26.2994 -26.2979 -26.2979 -25.4400 -25.4400 -25.4257 -25.4257 -11.1581 -11.1581 -11.0333 -11.0333 -11.0258 -11.0258 -10.0171 -10.0171 -10.0122 -10.0122 -9.8182 -9.8182 -9.7985 -9.7985 -9.6364 -9.6364 -9.3967 -9.3967 -9.2718 -9.2718 -9.1398 -9.1398 -9.0528 -9.0528 -8.8945 -8.8945 -8.5583 -8.5583 -8.0855 -8.0855 0.3401 0.3401 0.3773 0.3773 0.7341 0.7341 0.7814 0.7814 0.8234 0.8234 0.9284 0.9284 3.6266 3.6266 3.6609 3.6609 3.7348 3.7348 7.4206 7.4206 8.0541 8.0541 8.2492 8.2492 8.6729 8.6729 9.0331 9.0331 9.1907 9.1907 k = 0.0000 0.0000 0.9025 ( 8822 PWs) bands (ev): -26.2993 -26.2993 -26.2979 -26.2979 -25.4390 -25.4390 -25.4267 -25.4267 -11.1670 -11.1670 -11.0306 -11.0306 -11.0288 -11.0288 -10.0184 -10.0184 -10.0142 -10.0142 -9.8207 -9.8207 -9.7997 -9.7997 -9.6363 -9.6363 -9.3981 -9.3981 -9.2750 -9.2750 -9.1389 -9.1389 -9.0538 -9.0538 -8.8889 -8.8889 -8.5522 -8.5522 -8.0679 -8.0679 0.3369 0.3369 0.3795 0.3795 0.7300 0.7300 0.7805 0.7805 0.8300 0.8300 0.9233 0.9233 3.6033 3.6033 3.6368 3.6368 3.7263 3.7263 7.4941 7.4941 8.0554 8.0554 8.2143 8.2143 8.6137 8.6137 9.0600 9.0600 9.2103 9.2103 k = 0.0000 0.0000 0.9307 ( 8814 PWs) bands (ev): -26.2992 -26.2992 -26.2979 -26.2979 -25.4380 -25.4380 -25.4275 -25.4275 -11.1757 -11.1757 -11.0315 -11.0315 -11.0274 -11.0274 -10.0197 -10.0197 -10.0162 -10.0162 -9.8232 -9.8232 -9.8010 -9.8010 -9.6363 -9.6363 -9.3994 -9.3994 -9.2781 -9.2781 -9.1382 -9.1382 -9.0548 -9.0548 -8.8836 -8.8836 -8.5463 -8.5463 -8.0514 -8.0514 0.3338 0.3338 0.3820 0.3820 0.7259 0.7259 0.7801 0.7801 0.8369 0.8369 0.9185 0.9185 3.5814 3.5814 3.6142 3.6142 3.7182 3.7182 7.5633 7.5633 8.0559 8.0559 8.1829 8.1829 8.5548 8.5548 9.0871 9.0871 9.2238 9.2238 k = 0.0000 0.0000 0.9589 ( 8814 PWs) bands (ev): -26.2991 -26.2991 -26.2979 -26.2979 -25.4371 -25.4371 -25.4284 -25.4284 -11.1841 -11.1841 -11.0332 -11.0332 -11.0247 -11.0247 -10.0210 -10.0210 -10.0181 -10.0181 -9.8256 -9.8256 -9.8022 -9.8022 -9.6362 -9.6362 -9.4005 -9.4005 -9.2809 -9.2809 -9.1375 -9.1375 -9.0556 -9.0556 -8.8787 -8.8787 -8.5407 -8.5407 -8.0361 -8.0361 0.3311 0.3311 0.3845 0.3845 0.7220 0.7220 0.7802 0.7802 0.8439 0.8439 0.9142 0.9142 3.5610 3.5610 3.5931 3.5931 3.7105 3.7105 7.6271 7.6271 8.0560 8.0560 8.1557 8.1557 8.4983 8.4983 9.1125 9.1125 9.2320 9.2320 k = 0.0000 0.0000 0.9871 ( 8826 PWs) bands (ev): -26.2991 -26.2991 -26.2979 -26.2979 -25.4363 -25.4363 -25.4291 -25.4291 -11.1921 -11.1921 -11.0345 -11.0345 -11.0220 -11.0220 -10.0223 -10.0223 -10.0199 -10.0199 -9.8280 -9.8280 -9.8034 -9.8034 -9.6361 -9.6361 -9.4015 -9.4015 -9.2836 -9.2836 -9.1369 -9.1369 -9.0563 -9.0563 -8.8742 -8.8742 -8.5354 -8.5354 -8.0222 -8.0222 0.3286 0.3286 0.3869 0.3869 0.7184 0.7184 0.7806 0.7806 0.8506 0.8506 0.9103 0.9103 3.5422 3.5422 3.5736 3.5736 3.7034 3.7034 7.6843 7.6843 8.0556 8.0556 8.1335 8.1335 8.4453 8.4453 9.1357 9.1357 9.2358 9.2358 k = 0.0000 0.0000 1.0153 ( 8826 PWs) bands (ev): -26.2990 -26.2990 -26.2979 -26.2979 -25.4355 -25.4355 -25.4298 -25.4298 -11.1994 -11.1994 -11.0354 -11.0354 -11.0195 -11.0195 -10.0235 -10.0235 -10.0216 -10.0216 -9.8302 -9.8302 -9.8046 -9.8046 -9.6361 -9.6361 -9.4024 -9.4024 -9.2860 -9.2860 -9.1364 -9.1364 -9.0569 -9.0569 -8.8702 -8.8702 -8.5306 -8.5306 -8.0095 -8.0095 0.3266 0.3266 0.3890 0.3890 0.7152 0.7152 0.7813 0.7813 0.8569 0.8569 0.9069 0.9069 3.5251 3.5251 3.5560 3.5560 3.6968 3.6968 7.7333 7.7333 8.0550 8.0550 8.1171 8.1171 8.3965 8.3965 9.1564 9.1564 9.2363 9.2363 k = 0.0000 0.0000 1.0435 ( 8820 PWs) bands (ev): -26.2990 -26.2990 -26.2979 -26.2979 -25.4348 -25.4348 -25.4304 -25.4304 -11.2061 -11.2061 -11.0361 -11.0361 -11.0172 -11.0172 -10.0247 -10.0247 -10.0232 -10.0232 -9.8322 -9.8322 -9.8056 -9.8056 -9.6360 -9.6360 -9.4031 -9.4031 -9.2882 -9.2882 -9.1359 -9.1359 -9.0575 -9.0575 -8.8667 -8.8667 -8.5261 -8.5261 -7.9983 -7.9983 0.3249 0.3249 0.3910 0.3910 0.7123 0.7123 0.7821 0.7821 0.8626 0.8626 0.9042 0.9042 3.5099 3.5099 3.5402 3.5402 3.6908 3.6908 7.7730 7.7730 8.0542 8.0542 8.1074 8.1074 8.3525 8.3525 9.1742 9.1742 9.2346 9.2346 k = 0.0000 0.0000 1.0717 ( 8824 PWs) bands (ev): -26.2989 -26.2989 -26.2979 -26.2979 -25.4342 -25.4342 -25.4310 -25.4310 -11.2120 -11.2120 -11.0365 -11.0365 -11.0151 -11.0151 -10.0258 -10.0258 -10.0246 -10.0246 -9.8340 -9.8340 -9.8065 -9.8065 -9.6360 -9.6360 -9.4038 -9.4038 -9.2902 -9.2902 -9.1356 -9.1356 -9.0580 -9.0580 -8.8636 -8.8636 -8.5222 -8.5222 -7.9884 -7.9884 0.3234 0.3234 0.3927 0.3927 0.7098 0.7098 0.7831 0.7831 0.8674 0.8674 0.9021 0.9021 3.4965 3.4965 3.5263 3.5263 3.6855 3.6855 7.8025 7.8025 8.0533 8.0533 8.1045 8.1045 8.3137 8.3137 9.1893 9.1893 9.2317 9.2317 k = 0.0000 0.0000 1.0999 ( 8844 PWs) bands (ev): -26.2989 -26.2989 -26.2979 -26.2979 -25.4337 -25.4337 -25.4315 -25.4315 -11.2171 -11.2171 -11.0368 -11.0368 -11.0133 -11.0133 -10.0268 -10.0268 -10.0258 -10.0258 -9.8356 -9.8356 -9.8074 -9.8074 -9.6359 -9.6359 -9.4043 -9.4043 -9.2919 -9.2919 -9.1352 -9.1352 -9.0584 -9.0584 -8.8609 -8.8609 -8.5188 -8.5188 -7.9801 -7.9801 0.3223 0.3223 0.3942 0.3942 0.7077 0.7077 0.7841 0.7841 0.8712 0.8712 0.9008 0.9008 3.4850 3.4850 3.5145 3.5145 3.6809 3.6809 7.8222 7.8222 8.0524 8.0524 8.1077 8.1077 8.2804 8.2804 9.2013 9.2013 9.2286 9.2286 k = 0.0000 0.0000 1.1281 ( 8848 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4333 -25.4333 -25.4318 -25.4318 -11.2213 -11.2213 -11.0369 -11.0369 -11.0117 -11.0117 -10.0277 -10.0277 -10.0267 -10.0267 -9.8369 -9.8369 -9.8080 -9.8080 -9.6359 -9.6359 -9.4048 -9.4048 -9.2932 -9.2932 -9.1350 -9.1350 -9.0587 -9.0587 -8.8588 -8.8588 -8.5159 -8.5159 -7.9732 -7.9732 0.3214 0.3214 0.3954 0.3954 0.7060 0.7060 0.7851 0.7851 0.8739 0.8739 0.9002 0.9002 3.4756 3.4756 3.5048 3.5048 3.6771 3.6771 7.8339 7.8339 8.0515 8.0515 8.1148 8.1148 8.2528 8.2528 9.2095 9.2095 9.2269 9.2269 k = 0.0000 0.0000 1.1563 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4330 -25.4330 -25.4321 -25.4321 -11.2246 -11.2246 -11.0370 -11.0370 -11.0105 -11.0105 -10.0285 -10.0285 -10.0274 -10.0274 -9.8379 -9.8379 -9.8086 -9.8086 -9.6359 -9.6359 -9.4051 -9.4051 -9.2943 -9.2943 -9.1348 -9.1348 -9.0589 -9.0589 -8.8571 -8.8571 -8.5137 -8.5137 -7.9678 -7.9678 0.3207 0.3207 0.3964 0.3964 0.7046 0.7046 0.7860 0.7860 0.8756 0.8756 0.9003 0.9003 3.4682 3.4682 3.4971 3.4971 3.6741 3.6741 7.8400 7.8400 8.0508 8.0508 8.1233 8.1233 8.2311 8.2311 9.2126 9.2126 9.2283 9.2283 k = 0.0000 0.0000 1.1845 ( 8840 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4327 -25.4327 -25.4324 -25.4324 -11.2270 -11.2270 -11.0370 -11.0370 -11.0096 -11.0096 -10.0291 -10.0291 -10.0279 -10.0279 -9.8387 -9.8387 -9.8090 -9.8090 -9.6359 -9.6359 -9.4053 -9.4053 -9.2951 -9.2951 -9.1346 -9.1346 -9.0591 -9.0591 -8.8559 -8.8559 -8.5120 -8.5120 -7.9639 -7.9639 0.3202 0.3202 0.3970 0.3970 0.7037 0.7037 0.7866 0.7866 0.8764 0.8764 0.9007 0.9007 3.4628 3.4628 3.4916 3.4916 3.6719 3.6719 7.8428 7.8428 8.0502 8.0502 8.1309 8.1309 8.2155 8.2155 9.2124 9.2124 9.2316 9.2316 k = 0.0000 0.0000 1.2127 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4325 -25.4325 -11.2285 -11.2285 -11.0371 -11.0371 -11.0091 -11.0091 -10.0294 -10.0294 -10.0282 -10.0282 -9.8391 -9.8391 -9.8092 -9.8092 -9.6358 -9.6358 -9.4055 -9.4055 -9.2956 -9.2956 -9.1346 -9.1346 -9.0592 -9.0592 -8.8552 -8.8552 -8.5111 -8.5111 -7.9616 -7.9616 0.3199 0.3199 0.3974 0.3974 0.7031 0.7031 0.7870 0.7870 0.8768 0.8768 0.9011 0.9011 3.4596 3.4596 3.4883 3.4883 3.6706 3.6706 7.8439 7.8439 8.0499 8.0499 8.1360 8.1360 8.2061 8.2061 9.2116 9.2116 9.2341 9.2341 k = 0.0000 0.0000 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2289 -11.2289 -11.0371 -11.0371 -11.0089 -11.0089 -10.0296 -10.0296 -10.0283 -10.0283 -9.8393 -9.8393 -9.8093 -9.8093 -9.6358 -9.6358 -9.4056 -9.4056 -9.2957 -9.2957 -9.1345 -9.1345 -9.0592 -9.0592 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3198 0.3198 0.3976 0.3976 0.7029 0.7029 0.7872 0.7872 0.8769 0.8769 0.9012 0.9012 3.4586 3.4586 3.4872 3.4872 3.6702 3.6702 7.8441 7.8441 8.0497 8.0497 8.1378 8.1378 8.2030 8.2030 9.2112 9.2112 9.2350 9.2350 k = 0.0000 0.0000 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2289 -11.2289 -11.0371 -11.0371 -11.0089 -11.0089 -10.0296 -10.0296 -10.0283 -10.0283 -9.8393 -9.8393 -9.8093 -9.8093 -9.6358 -9.6358 -9.4056 -9.4056 -9.2957 -9.2957 -9.1345 -9.1345 -9.0592 -9.0592 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3198 0.3198 0.3976 0.3976 0.7029 0.7029 0.7872 0.7872 0.8769 0.8769 0.9012 0.9012 3.4586 3.4586 3.4872 3.4872 3.6702 3.6702 7.8441 7.8441 8.0497 8.0497 8.1378 8.1378 8.2030 8.2030 9.2112 9.2112 9.2350 9.2350 k =-0.0097 0.0220 1.2409 ( 8838 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4325 -25.4325 -11.2286 -11.2286 -11.0370 -11.0370 -11.0090 -11.0090 -10.0297 -10.0297 -10.0280 -10.0280 -9.8392 -9.8392 -9.8092 -9.8092 -9.6359 -9.6359 -9.4054 -9.4054 -9.2957 -9.2957 -9.1345 -9.1345 -9.0592 -9.0592 -8.8551 -8.8551 -8.5110 -8.5110 -7.9614 -7.9614 0.3199 0.3199 0.3973 0.3973 0.7024 0.7024 0.7875 0.7875 0.8765 0.8765 0.9019 0.9019 3.4594 3.4594 3.4879 3.4879 3.6704 3.6704 7.8449 7.8449 8.0419 8.0419 8.1397 8.1397 8.2113 8.2113 9.2021 9.2021 9.2347 9.2347 k =-0.0194 0.0440 1.2409 ( 8842 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4327 -25.4327 -25.4324 -25.4324 -11.2275 -11.2275 -11.0370 -11.0370 -11.0095 -11.0095 -10.0300 -10.0300 -10.0273 -10.0273 -9.8389 -9.8389 -9.8091 -9.8091 -9.6361 -9.6361 -9.4051 -9.4051 -9.2955 -9.2955 -9.1345 -9.1345 -9.0591 -9.0591 -8.8556 -8.8556 -8.5117 -8.5117 -7.9631 -7.9631 0.3200 0.3200 0.3967 0.3967 0.7008 0.7008 0.7886 0.7886 0.8754 0.8754 0.9037 0.9037 3.4618 3.4618 3.4900 3.4900 3.6712 3.6712 7.8474 7.8474 8.0219 8.0219 8.1457 8.1457 8.2328 8.2328 9.1765 9.1765 9.2357 9.2357 k =-0.0291 0.0660 1.2409 ( 8840 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4328 -25.4328 -25.4323 -25.4323 -11.2257 -11.2257 -11.0369 -11.0369 -11.0101 -11.0101 -10.0301 -10.0301 -10.0264 -10.0264 -9.8384 -9.8384 -9.8088 -9.8088 -9.6364 -9.6364 -9.4045 -9.4045 -9.2951 -9.2951 -9.1345 -9.1345 -9.0589 -9.0589 -8.8565 -8.8565 -8.5129 -8.5129 -7.9659 -7.9659 0.3203 0.3203 0.3956 0.3956 0.6984 0.6984 0.7902 0.7902 0.8739 0.8739 0.9064 0.9064 3.4659 3.4659 3.4934 3.4934 3.6725 3.6725 7.8516 7.8516 7.9951 7.9951 8.1555 8.1555 8.2619 8.2619 9.1405 9.1405 9.2386 9.2386 k =-0.0388 0.0881 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4331 -25.4331 -25.4320 -25.4320 -11.2233 -11.2233 -11.0368 -11.0368 -11.0111 -11.0111 -10.0302 -10.0302 -10.0253 -10.0253 -9.8377 -9.8377 -9.8084 -9.8084 -9.6368 -9.6368 -9.4037 -9.4037 -9.2947 -9.2947 -9.1345 -9.1345 -9.0586 -9.0586 -8.8577 -8.8577 -8.5145 -8.5145 -7.9698 -7.9698 0.3206 0.3206 0.3941 0.3941 0.6953 0.6953 0.7922 0.7922 0.8725 0.8725 0.9096 0.9096 3.4715 3.4715 3.4983 3.4983 3.6743 3.6743 7.8574 7.8574 7.9649 7.9649 8.1691 8.1691 8.2953 8.2953 9.0984 9.0984 9.2430 9.2430 k =-0.0485 0.1101 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4334 -25.4334 -25.4318 -25.4318 -11.2202 -11.2202 -11.0366 -11.0366 -11.0123 -11.0123 -10.0301 -10.0301 -10.0240 -10.0240 -9.8368 -9.8368 -9.8080 -9.8080 -9.6373 -9.6373 -9.4027 -9.4027 -9.2941 -9.2941 -9.1346 -9.1346 -9.0583 -9.0583 -8.8592 -8.8592 -8.5166 -8.5166 -7.9748 -7.9748 0.3210 0.3210 0.3923 0.3923 0.6917 0.6917 0.7943 0.7943 0.8712 0.8712 0.9131 0.9131 3.4788 3.4788 3.5045 3.5045 3.6765 3.6765 7.8647 7.8647 7.9326 7.9326 8.1861 8.1861 8.3316 8.3316 9.0525 9.0525 9.2489 9.2489 k =-0.0485 0.1101 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4334 -25.4334 -25.4318 -25.4318 -11.2202 -11.2202 -11.0366 -11.0366 -11.0123 -11.0123 -10.0301 -10.0301 -10.0240 -10.0240 -9.8368 -9.8368 -9.8080 -9.8080 -9.6373 -9.6373 -9.4027 -9.4027 -9.2941 -9.2941 -9.1346 -9.1346 -9.0583 -9.0583 -8.8592 -8.8592 -8.5166 -8.5166 -7.9748 -7.9748 0.3210 0.3210 0.3923 0.3923 0.6917 0.6917 0.7943 0.7943 0.8712 0.8712 0.9131 0.9131 3.4788 3.4788 3.5045 3.5045 3.6765 3.6765 7.8647 7.8647 7.9326 7.9326 8.1861 8.1861 8.3316 8.3316 9.0525 9.0525 9.2489 9.2489 k =-0.0565 0.1284 1.2209 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4337 -25.4337 -25.4315 -25.4315 -11.2168 -11.2168 -11.0363 -11.0363 -11.0135 -11.0135 -10.0299 -10.0299 -10.0228 -10.0228 -9.8358 -9.8358 -9.8075 -9.8075 -9.6379 -9.6379 -9.4016 -9.4016 -9.2935 -9.2935 -9.1346 -9.1346 -9.0580 -9.0580 -8.8609 -8.8609 -8.5189 -8.5189 -7.9801 -7.9801 0.3215 0.3215 0.3904 0.3904 0.6886 0.6886 0.7960 0.7960 0.8703 0.8703 0.9161 0.9161 3.4854 3.4854 3.5123 3.5123 3.6790 3.6790 7.8718 7.8718 7.9053 7.9053 8.2017 8.2017 8.3645 8.3645 9.0124 9.0124 9.2543 9.2543 k =-0.0646 0.1467 1.2009 ( 8849 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4340 -25.4340 -25.4313 -25.4313 -11.2126 -11.2126 -11.0360 -11.0360 -11.0151 -11.0151 -10.0296 -10.0296 -10.0213 -10.0213 -9.8346 -9.8346 -9.8068 -9.8068 -9.6385 -9.6385 -9.4004 -9.4004 -9.2926 -9.2926 -9.1347 -9.1347 -9.0575 -9.0575 -8.8630 -8.8630 -8.5218 -8.5218 -7.9869 -7.9869 0.3219 0.3219 0.3882 0.3882 0.6857 0.6857 0.7974 0.7974 0.8697 0.8697 0.9190 0.9190 3.4910 3.4910 3.5251 3.5251 3.6822 3.6822 7.8760 7.8760 7.8820 7.8820 8.2171 8.2171 8.4007 8.4007 8.9717 8.9717 9.2594 9.2594 k =-0.0726 0.1650 1.1809 ( 8859 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4343 -25.4343 -25.4310 -25.4310 -11.2076 -11.2076 -11.0356 -11.0356 -11.0170 -11.0170 -10.0291 -10.0291 -10.0196 -10.0196 -9.8331 -9.8331 -9.8061 -9.8061 -9.6392 -9.6392 -9.3989 -9.3989 -9.2914 -9.2914 -9.1348 -9.1348 -9.0570 -9.0570 -8.8656 -8.8656 -8.5255 -8.5255 -7.9949 -7.9949 0.3223 0.3223 0.3856 0.3856 0.6830 0.6830 0.7986 0.7986 0.8693 0.8693 0.9219 0.9219 3.4958 3.4958 3.5426 3.5426 3.6861 3.6861 7.8517 7.8517 7.8879 7.8879 8.2322 8.2322 8.4398 8.4398 8.9311 8.9311 9.2643 9.2643 k =-0.0807 0.1833 1.1608 ( 8863 PWs) bands (ev): -26.2989 -26.2989 -26.2981 -26.2981 -25.4345 -25.4345 -25.4308 -25.4308 -11.2018 -11.2018 -11.0350 -11.0350 -11.0192 -11.0192 -10.0284 -10.0284 -10.0178 -10.0178 -9.8314 -9.8314 -9.8052 -9.8052 -9.6399 -9.6399 -9.3973 -9.3973 -9.2900 -9.2900 -9.1350 -9.1350 -9.0564 -9.0564 -8.8687 -8.8687 -8.5298 -8.5298 -8.0040 -8.0040 0.3226 0.3226 0.3828 0.3828 0.6807 0.6807 0.7994 0.7994 0.8692 0.8692 0.9247 0.9247 3.5002 3.5002 3.5641 3.5641 3.6906 3.6906 7.8264 7.8264 7.8950 7.8950 8.2469 8.2469 8.4818 8.4818 8.8917 8.8917 9.2688 9.2688 k =-0.0888 0.2016 1.1408 ( 8856 PWs) bands (ev): -26.2989 -26.2989 -26.2981 -26.2981 -25.4348 -25.4348 -25.4306 -25.4306 -11.1954 -11.1954 -11.0342 -11.0342 -11.0216 -11.0216 -10.0277 -10.0277 -10.0157 -10.0157 -9.8294 -9.8294 -9.8042 -9.8042 -9.6407 -9.6407 -9.3955 -9.3955 -9.2884 -9.2884 -9.1352 -9.1352 -9.0557 -9.0557 -8.8721 -8.8721 -8.5349 -8.5349 -8.0141 -8.0141 0.3227 0.3227 0.3796 0.3796 0.6788 0.6788 0.7998 0.7998 0.8694 0.8694 0.9275 0.9275 3.5046 3.5046 3.5890 3.5890 3.6958 3.6958 7.8018 7.8018 7.9007 7.9007 8.2611 8.2611 8.5265 8.5265 8.8545 8.8545 9.2730 9.2730 k =-0.0968 0.2200 1.1208 ( 8852 PWs) bands (ev): -26.2989 -26.2989 -26.2981 -26.2981 -25.4351 -25.4351 -25.4303 -25.4303 -11.1885 -11.1885 -11.0332 -11.0332 -11.0242 -11.0242 -10.0268 -10.0268 -10.0135 -10.0135 -9.8273 -9.8273 -9.8031 -9.8031 -9.6416 -9.6416 -9.3935 -9.3935 -9.2865 -9.2865 -9.1355 -9.1355 -9.0549 -9.0549 -8.8760 -8.8760 -8.5408 -8.5408 -8.0251 -8.0251 0.3225 0.3225 0.3762 0.3762 0.6775 0.6775 0.7998 0.7998 0.8699 0.8699 0.9302 0.9302 3.5092 3.5092 3.6169 3.6169 3.7016 3.7016 7.7781 7.7781 7.9036 7.9036 8.2753 8.2753 8.5738 8.5738 8.8204 8.8204 9.2764 9.2764 k =-0.1049 0.2383 1.1008 ( 8845 PWs) bands (ev): -26.2989 -26.2989 -26.2981 -26.2981 -25.4354 -25.4354 -25.4301 -25.4301 -11.1811 -11.1811 -11.0320 -11.0320 -11.0269 -11.0269 -10.0258 -10.0258 -10.0111 -10.0111 -9.8249 -9.8249 -9.8019 -9.8019 -9.6425 -9.6425 -9.3913 -9.3913 -9.2844 -9.2844 -9.1359 -9.1359 -9.0540 -9.0540 -8.8802 -8.8802 -8.5476 -8.5476 -8.0367 -8.0367 0.3220 0.3220 0.3726 0.3726 0.6767 0.6767 0.7994 0.7994 0.8706 0.8706 0.9330 0.9330 3.5139 3.5139 3.6473 3.6473 3.7080 3.7080 7.7551 7.7551 7.9024 7.9024 8.2902 8.2902 8.6237 8.6237 8.7901 8.7901 9.2763 9.2763 k =-0.1130 0.2566 1.0808 ( 8836 PWs) bands (ev): -26.2990 -26.2990 -26.2982 -26.2982 -25.4356 -25.4356 -25.4299 -25.4299 -11.1734 -11.1734 -11.0315 -11.0315 -11.0287 -11.0287 -10.0248 -10.0248 -10.0086 -10.0086 -9.8224 -9.8224 -9.8006 -9.8006 -9.6435 -9.6435 -9.3890 -9.3890 -9.2820 -9.2820 -9.1364 -9.1364 -9.0530 -9.0530 -8.8849 -8.8849 -8.5551 -8.5551 -8.0488 -8.0488 0.3210 0.3210 0.3688 0.3688 0.6766 0.6766 0.7987 0.7987 0.8716 0.8716 0.9358 0.9358 3.5189 3.5189 3.6797 3.6797 3.7151 3.7151 7.7329 7.7329 7.8956 7.8956 8.3069 8.3069 8.6759 8.6759 8.7641 8.7641 9.2545 9.2545 k =-0.1210 0.2749 1.0608 ( 8842 PWs) bands (ev): -26.2990 -26.2990 -26.2982 -26.2982 -25.4359 -25.4359 -25.4297 -25.4297 -11.1657 -11.1657 -11.0339 -11.0339 -11.0273 -11.0273 -10.0237 -10.0237 -10.0061 -10.0061 -9.8198 -9.8198 -9.7993 -9.7993 -9.6445 -9.6445 -9.3865 -9.3865 -9.2794 -9.2794 -9.1370 -9.1370 -9.0519 -9.0519 -8.8898 -8.8898 -8.5635 -8.5635 -8.0613 -8.0613 0.3196 0.3196 0.3650 0.3650 0.6771 0.6771 0.7976 0.7976 0.8729 0.8729 0.9386 0.9386 3.5240 3.5240 3.7112 3.7112 3.7256 3.7256 7.7115 7.7115 7.8823 7.8823 8.3263 8.3263 8.7294 8.7294 8.7435 8.7435 9.2216 9.2216 k =-0.1291 0.2932 1.0408 ( 8838 PWs) bands (ev): -26.2991 -26.2991 -26.2982 -26.2982 -25.4362 -25.4362 -25.4296 -25.4296 -11.1580 -11.1580 -11.0370 -11.0370 -11.0246 -11.0246 -10.0225 -10.0225 -10.0034 -10.0034 -9.8171 -9.8171 -9.7979 -9.7979 -9.6456 -9.6456 -9.3839 -9.3839 -9.2766 -9.2766 -9.1377 -9.1377 -9.0506 -9.0506 -8.8951 -8.8951 -8.5727 -8.5727 -8.0738 -8.0738 0.3176 0.3176 0.3610 0.3610 0.6782 0.6782 0.7962 0.7962 0.8744 0.8744 0.9415 0.9415 3.5293 3.5293 3.7261 3.7261 3.7547 3.7547 7.6907 7.6907 7.8622 7.8622 8.3493 8.3493 8.7233 8.7233 8.7885 8.7885 9.1864 9.1864 k =-0.1372 0.3115 1.0208 ( 8850 PWs) bands (ev): -26.2991 -26.2991 -26.2982 -26.2982 -25.4364 -25.4364 -25.4294 -25.4294 -11.1505 -11.1505 -11.0403 -11.0403 -11.0212 -11.0212 -10.0214 -10.0214 -10.0007 -10.0007 -9.8143 -9.8143 -9.7965 -9.7965 -9.6466 -9.6466 -9.3811 -9.3811 -9.2735 -9.2735 -9.1386 -9.1386 -9.0493 -9.0493 -8.9007 -8.9007 -8.5828 -8.5828 -8.0862 -8.0862 0.3151 0.3151 0.3570 0.3570 0.6799 0.6799 0.7946 0.7946 0.8761 0.8761 0.9445 0.9445 3.5347 3.5347 3.7344 3.7344 3.7919 3.7919 7.6706 7.6706 7.8355 7.8355 8.3764 8.3764 8.7082 8.7082 8.8477 8.8477 9.1501 9.1501 k =-0.1452 0.3298 1.0008 ( 8846 PWs) bands (ev): -26.2992 -26.2992 -26.2983 -26.2983 -25.4367 -25.4367 -25.4292 -25.4292 -11.1435 -11.1435 -11.0436 -11.0436 -11.0169 -11.0169 -10.0202 -10.0202 -9.9979 -9.9979 -9.8115 -9.8115 -9.7951 -9.7951 -9.6477 -9.6477 -9.3782 -9.3782 -9.2703 -9.2703 -9.1395 -9.1395 -9.0478 -9.0478 -8.9065 -8.9065 -8.5936 -8.5936 -8.0984 -8.0984 0.3121 0.3121 0.3531 0.3531 0.6822 0.6822 0.7927 0.7927 0.8780 0.8780 0.9476 0.9476 3.5401 3.5401 3.7422 3.7422 3.8307 3.8307 7.6512 7.6512 7.8032 7.8032 8.4077 8.4077 8.6952 8.6952 8.9092 8.9092 9.1131 9.1131 k =-0.1533 0.3482 0.9807 ( 8840 PWs) bands (ev): -26.2992 -26.2992 -26.2983 -26.2983 -25.4369 -25.4369 -25.4291 -25.4291 -11.1370 -11.1370 -11.0469 -11.0469 -11.0119 -11.0119 -10.0189 -10.0189 -9.9952 -9.9952 -9.8087 -9.8087 -9.7936 -9.7936 -9.6488 -9.6488 -9.3752 -9.3752 -9.2668 -9.2668 -9.1407 -9.1407 -9.0461 -9.0461 -8.9125 -8.9125 -8.6051 -8.6051 -8.1102 -8.1102 0.3086 0.3086 0.3493 0.3493 0.6849 0.6849 0.7907 0.7907 0.8800 0.8800 0.9507 0.9507 3.5455 3.5455 3.7499 3.7499 3.8703 3.8703 7.6324 7.6324 7.7666 7.7666 8.4429 8.4429 8.6837 8.6837 8.9727 8.9727 9.0763 9.0763 k =-0.1613 0.3665 0.9607 ( 8831 PWs) bands (ev): -26.2992 -26.2992 -26.2983 -26.2983 -25.4371 -25.4371 -25.4289 -25.4289 -11.1313 -11.1313 -11.0502 -11.0502 -11.0060 -11.0060 -10.0177 -10.0177 -9.9924 -9.9924 -9.8059 -9.8059 -9.7922 -9.7922 -9.6499 -9.6499 -9.3721 -9.3721 -9.2632 -9.2632 -9.1420 -9.1420 -9.0444 -9.0444 -8.9187 -8.9187 -8.6173 -8.6173 -8.1215 -8.1215 0.3046 0.3046 0.3455 0.3455 0.6879 0.6879 0.7887 0.7887 0.8822 0.8822 0.9540 0.9540 3.5508 3.5508 3.7575 3.7575 3.9101 3.9101 7.6143 7.6143 7.7270 7.7270 8.4815 8.4815 8.6732 8.6732 9.0342 9.0342 9.0438 9.0438 k =-0.1694 0.3848 0.9407 ( 8827 PWs) bands (ev): -26.2993 -26.2993 -26.2983 -26.2983 -25.4374 -25.4374 -25.4288 -25.4288 -11.1262 -11.1262 -11.0535 -11.0535 -10.9994 -10.9994 -10.0166 -10.0166 -9.9897 -9.9897 -9.8031 -9.8031 -9.7908 -9.7908 -9.6509 -9.6509 -9.3689 -9.3689 -9.2594 -9.2594 -9.1435 -9.1435 -9.0425 -9.0425 -8.9250 -8.9250 -8.6299 -8.6299 -8.1322 -8.1322 0.3004 0.3004 0.3419 0.3419 0.6911 0.6911 0.7866 0.7866 0.8844 0.8844 0.9573 0.9573 3.5561 3.5561 3.7650 3.7650 3.9497 3.9497 7.5970 7.5970 7.6857 7.6857 8.5230 8.5230 8.6633 8.6633 9.0039 9.0039 9.1057 9.1057 k =-0.1775 0.4031 0.9207 ( 8825 PWs) bands (ev): -26.2993 -26.2993 -26.2984 -26.2984 -25.4376 -25.4376 -25.4287 -25.4287 -11.1220 -11.1220 -11.0566 -11.0566 -10.9922 -10.9922 -10.0154 -10.0154 -9.9871 -9.9871 -9.8004 -9.8004 -9.7894 -9.7894 -9.6519 -9.6519 -9.3656 -9.3656 -9.2554 -9.2554 -9.1452 -9.1452 -9.0405 -9.0405 -8.9315 -8.9315 -8.6429 -8.6429 -8.1421 -8.1421 0.2960 0.2960 0.3385 0.3385 0.6945 0.6945 0.7845 0.7845 0.8867 0.8867 0.9607 0.9607 3.5611 3.5611 3.7722 3.7722 3.9888 3.9888 7.5803 7.5803 7.6439 7.6439 8.5664 8.5664 8.6541 8.6541 8.9702 8.9702 9.1741 9.1741 k =-0.1855 0.4214 0.9007 ( 8827 PWs) bands (ev): -26.2994 -26.2994 -26.2984 -26.2984 -25.4377 -25.4377 -25.4286 -25.4286 -11.1185 -11.1185 -11.0596 -11.0596 -10.9845 -10.9845 -10.0144 -10.0144 -9.9846 -9.9846 -9.7978 -9.7978 -9.7881 -9.7881 -9.6529 -9.6529 -9.3624 -9.3624 -9.2513 -9.2513 -9.1472 -9.1472 -9.0383 -9.0383 -8.9379 -8.9379 -8.6561 -8.6561 -8.1513 -8.1513 0.2914 0.2914 0.3352 0.3352 0.6979 0.6979 0.7825 0.7825 0.8890 0.8890 0.9641 0.9641 3.5659 3.5659 3.7792 3.7792 4.0268 4.0268 7.5642 7.5642 7.6028 7.6028 8.6090 8.6090 8.6477 8.6477 8.9384 8.9384 9.2436 9.2436 k =-0.1936 0.4397 0.8807 ( 8827 PWs) bands (ev): -26.2994 -26.2994 -26.2984 -26.2984 -25.4379 -25.4379 -25.4285 -25.4285 -11.1156 -11.1156 -11.0625 -11.0625 -10.9765 -10.9765 -10.0134 -10.0134 -9.9823 -9.9823 -9.7954 -9.7954 -9.7868 -9.7868 -9.6539 -9.6539 -9.3591 -9.3591 -9.2471 -9.2471 -9.1493 -9.1493 -9.0359 -9.0359 -8.9444 -8.9444 -8.6692 -8.6692 -8.1596 -8.1596 0.2868 0.2868 0.3321 0.3321 0.7012 0.7012 0.7807 0.7807 0.8912 0.8912 0.9675 0.9675 3.5705 3.5705 3.7858 3.7858 4.0633 4.0633 7.5475 7.5475 7.5644 7.5644 8.6271 8.6271 8.6670 8.6670 8.9090 8.9090 9.3121 9.3121 k =-0.2017 0.4580 0.8607 ( 8819 PWs) bands (ev): -26.2995 -26.2995 -26.2984 -26.2984 -25.4381 -25.4381 -25.4284 -25.4284 -11.1133 -11.1133 -11.0651 -11.0651 -10.9685 -10.9685 -10.0124 -10.0124 -9.9800 -9.9800 -9.7931 -9.7931 -9.7855 -9.7855 -9.6548 -9.6548 -9.3559 -9.3559 -9.2428 -9.2428 -9.1517 -9.1517 -9.0334 -9.0334 -8.9509 -8.9509 -8.6820 -8.6820 -8.1671 -8.1671 0.2824 0.2824 0.3292 0.3292 0.7042 0.7042 0.7790 0.7790 0.8933 0.8933 0.9709 0.9709 3.5747 3.5747 3.7921 3.7921 4.0979 4.0979 7.5204 7.5204 7.5394 7.5394 8.6210 8.6210 8.7106 8.7106 8.8830 8.8830 9.3436 9.3436 k =-0.2097 0.4764 0.8407 ( 8811 PWs) bands (ev): -26.2995 -26.2995 -26.2985 -26.2985 -25.4382 -25.4382 -25.4283 -25.4283 -11.1115 -11.1115 -11.0675 -11.0675 -10.9606 -10.9606 -10.0115 -10.0115 -9.9780 -9.9780 -9.7911 -9.7911 -9.7844 -9.7844 -9.6556 -9.6556 -9.3528 -9.3528 -9.2385 -9.2385 -9.1542 -9.1542 -9.0307 -9.0307 -8.9572 -8.9572 -8.6943 -8.6943 -8.1738 -8.1738 0.2782 0.2782 0.3265 0.3265 0.7070 0.7070 0.7775 0.7775 0.8953 0.8953 0.9742 0.9742 3.5786 3.5786 3.7978 3.7978 4.1302 4.1302 7.4860 7.4860 7.5254 7.5254 8.6129 8.6129 8.7540 8.7540 8.8624 8.8624 9.3556 9.3556 k =-0.2178 0.4947 0.8207 ( 8809 PWs) bands (ev): -26.2995 -26.2995 -26.2985 -26.2985 -25.4384 -25.4384 -25.4282 -25.4282 -11.1100 -11.1100 -11.0697 -11.0697 -10.9532 -10.9532 -10.0107 -10.0107 -9.9761 -9.9761 -9.7892 -9.7892 -9.7833 -9.7833 -9.6564 -9.6564 -9.3498 -9.3498 -9.2342 -9.2342 -9.1570 -9.1570 -9.0279 -9.0279 -8.9635 -8.9635 -8.7059 -8.7059 -8.1796 -8.1796 0.2742 0.2742 0.3241 0.3241 0.7095 0.7095 0.7763 0.7763 0.8971 0.8971 0.9773 0.9773 3.5821 3.5821 3.8030 3.8030 4.1598 4.1598 7.4537 7.4537 7.5136 7.5136 8.6049 8.6049 8.7861 8.7861 8.8554 8.8554 9.3683 9.3683 k =-0.2258 0.5130 0.8006 ( 8799 PWs) bands (ev): -26.2995 -26.2995 -26.2985 -26.2985 -25.4385 -25.4385 -25.4281 -25.4281 -11.1089 -11.1089 -11.0717 -11.0717 -10.9463 -10.9463 -10.0100 -10.0100 -9.9744 -9.9744 -9.7876 -9.7876 -9.7823 -9.7823 -9.6570 -9.6570 -9.3471 -9.3471 -9.2299 -9.2299 -9.1599 -9.1599 -9.0248 -9.0248 -8.9695 -8.9695 -8.7165 -8.7165 -8.1846 -8.1846 0.2706 0.2706 0.3219 0.3219 0.7116 0.7116 0.7753 0.7753 0.8988 0.8988 0.9802 0.9802 3.5852 3.5852 3.8077 3.8077 4.1863 4.1863 7.4248 7.4248 7.5033 7.5033 8.5975 8.5975 8.7907 8.7907 8.8773 8.8773 9.3822 9.3822 k =-0.2339 0.5313 0.7806 ( 8795 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4386 -25.4386 -25.4281 -25.4281 -11.1081 -11.1081 -11.0734 -11.0734 -10.9401 -10.9401 -10.0095 -10.0095 -9.9730 -9.9730 -9.7863 -9.7863 -9.7814 -9.7814 -9.6576 -9.6576 -9.3446 -9.3446 -9.2257 -9.2257 -9.1628 -9.1628 -9.0216 -9.0216 -8.9754 -8.9754 -8.7259 -8.7259 -8.1888 -8.1888 0.2675 0.2675 0.3200 0.3200 0.7134 0.7134 0.7745 0.7745 0.9002 0.9002 0.9828 0.9828 3.5879 3.5879 3.8117 3.8117 4.2094 4.2094 7.3996 7.3996 7.4944 7.4944 8.5909 8.5909 8.7806 8.7806 8.9140 8.9140 9.3973 9.3973 k =-0.2420 0.5496 0.7606 ( 8790 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4386 -25.4386 -25.4280 -25.4280 -11.1075 -11.1075 -11.0748 -11.0748 -10.9349 -10.9349 -10.0090 -10.0090 -9.9718 -9.9718 -9.7852 -9.7852 -9.7806 -9.7806 -9.6581 -9.6581 -9.3425 -9.3425 -9.2218 -9.2218 -9.1658 -9.1658 -9.0182 -9.0182 -8.9809 -8.9809 -8.7339 -8.7339 -8.1922 -8.1922 0.2649 0.2649 0.3185 0.3185 0.7148 0.7148 0.7740 0.7740 0.9013 0.9013 0.9850 0.9850 3.5901 3.5901 3.8150 3.8150 4.2287 4.2287 7.3787 7.3787 7.4871 7.4871 8.5853 8.5853 8.7691 8.7691 8.9509 8.9509 9.4132 9.4132 k =-0.2500 0.5679 0.7406 ( 8793 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4387 -25.4387 -25.4280 -25.4280 -11.1070 -11.1070 -11.0759 -11.0759 -10.9307 -10.9307 -10.0086 -10.0086 -9.9708 -9.9708 -9.7844 -9.7844 -9.7800 -9.7800 -9.6585 -9.6585 -9.3407 -9.3407 -9.2183 -9.2183 -9.1685 -9.1685 -9.0146 -9.0146 -8.9862 -8.9862 -8.7404 -8.7404 -8.1948 -8.1948 0.2628 0.2628 0.3172 0.3172 0.7158 0.7158 0.7736 0.7736 0.9022 0.9022 0.9868 0.9868 3.5918 3.5918 3.8176 3.8176 4.2440 4.2440 7.3621 7.3621 7.4813 7.4813 8.5808 8.5808 8.7593 8.7593 8.9833 8.9833 9.4292 9.4292 k =-0.2581 0.5863 0.7206 ( 8792 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4387 -25.4387 -25.4280 -25.4280 -11.1067 -11.1067 -11.0767 -11.0767 -10.9276 -10.9276 -10.0083 -10.0083 -9.9702 -9.9702 -9.7838 -9.7838 -9.7795 -9.7795 -9.6588 -9.6588 -9.3395 -9.3395 -9.2154 -9.2154 -9.1708 -9.1708 -9.0110 -9.0110 -8.9912 -8.9912 -8.7451 -8.7451 -8.1966 -8.1966 0.2612 0.2612 0.3163 0.3163 0.7165 0.7165 0.7734 0.7734 0.9029 0.9029 0.9882 0.9882 3.5930 3.5930 3.8195 3.8195 4.2551 4.2551 7.3501 7.3501 7.4772 7.4772 8.5775 8.5775 8.7520 8.7520 9.0085 9.0085 9.4442 9.4442 k =-0.2662 0.6046 0.7006 ( 8792 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4388 -25.4388 -25.4280 -25.4280 -11.1066 -11.1066 -11.0771 -11.0771 -10.9257 -10.9257 -10.0081 -10.0081 -9.9697 -9.9697 -9.7835 -9.7835 -9.7792 -9.7792 -9.6590 -9.6590 -9.3387 -9.3387 -9.2135 -9.2135 -9.1724 -9.1724 -9.0075 -9.0075 -8.9954 -8.9954 -8.7480 -8.7480 -8.1978 -8.1978 0.2603 0.2603 0.3158 0.3158 0.7169 0.7169 0.7732 0.7732 0.9033 0.9033 0.9890 0.9890 3.5938 3.5938 3.8207 3.8207 4.2618 4.2618 7.3429 7.3429 7.4747 7.4747 8.5755 8.5755 8.7475 8.7475 9.0246 9.0246 9.4557 9.4557 k =-0.2742 0.6229 0.6806 ( 8777 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4388 -25.4388 -25.4280 -25.4280 -11.1065 -11.1065 -11.0773 -11.0773 -10.9251 -10.9251 -10.0081 -10.0081 -9.9696 -9.9696 -9.7833 -9.7833 -9.7791 -9.7791 -9.6590 -9.6590 -9.3384 -9.3384 -9.2128 -9.2128 -9.1730 -9.1730 -9.0056 -9.0056 -8.9976 -8.9976 -8.7489 -8.7489 -8.1981 -8.1981 0.2600 0.2600 0.3156 0.3156 0.7170 0.7170 0.7732 0.7732 0.9034 0.9034 0.9893 0.9893 3.5940 3.5940 3.8211 3.8211 4.2641 4.2641 7.3405 7.3405 7.4738 7.4738 8.5749 8.5749 8.7460 8.7460 9.0301 9.0301 9.4602 9.4602 k =-0.2742 0.6229 0.6806 ( 8777 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4388 -25.4388 -25.4280 -25.4280 -11.1065 -11.1065 -11.0773 -11.0773 -10.9251 -10.9251 -10.0081 -10.0081 -9.9696 -9.9696 -9.7833 -9.7833 -9.7791 -9.7791 -9.6590 -9.6590 -9.3384 -9.3384 -9.2128 -9.2128 -9.1730 -9.1730 -9.0056 -9.0056 -8.9976 -8.9976 -8.7489 -8.7489 -8.1981 -8.1981 0.2600 0.2600 0.3156 0.3156 0.7170 0.7170 0.7732 0.7732 0.9034 0.9034 0.9893 0.9893 3.5940 3.5940 3.8211 3.8211 4.2641 4.2641 7.3405 7.3405 7.4738 7.4738 8.5749 8.5749 8.7460 8.7460 9.0301 9.0301 9.4602 9.4602 k =-0.2662 0.6046 0.6606 ( 8789 PWs) bands (ev): -26.2997 -26.2997 -26.2985 -26.2985 -25.4370 -25.4370 -25.4297 -25.4297 -11.1074 -11.1074 -11.0773 -11.0773 -10.9283 -10.9283 -10.0073 -10.0073 -9.9699 -9.9699 -9.7831 -9.7831 -9.7788 -9.7788 -9.6568 -9.6568 -9.3401 -9.3401 -9.2117 -9.2117 -9.1741 -9.1741 -9.0056 -9.0056 -8.9971 -8.9971 -8.7500 -8.7500 -8.1926 -8.1926 0.2578 0.2578 0.3144 0.3144 0.7133 0.7133 0.7732 0.7732 0.9002 0.9002 0.9905 0.9905 3.5846 3.5846 3.8212 3.8212 4.2630 4.2630 7.3171 7.3171 7.5357 7.5357 8.6102 8.6102 8.7900 8.7900 9.0126 9.0126 9.4291 9.4291 k =-0.2581 0.5862 0.6405 ( 8787 PWs) bands (ev): -26.2997 -26.2997 -26.2984 -26.2984 -25.4352 -25.4352 -25.4315 -25.4315 -11.1080 -11.1080 -11.0773 -11.0773 -10.9304 -10.9304 -10.0065 -10.0065 -9.9702 -9.9702 -9.7830 -9.7830 -9.7785 -9.7785 -9.6548 -9.6548 -9.3417 -9.3417 -9.2107 -9.2107 -9.1751 -9.1751 -9.0056 -9.0056 -8.9968 -8.9968 -8.7506 -8.7506 -8.1893 -8.1893 0.2568 0.2568 0.3141 0.3141 0.7097 0.7097 0.7739 0.7739 0.8971 0.8971 0.9920 0.9920 3.5788 3.5788 3.8217 3.8217 4.2624 4.2624 7.2868 7.2868 7.5944 7.5944 8.6376 8.6376 8.8299 8.8299 8.9971 8.9971 9.3899 9.3899 k =-0.2500 0.5679 0.6205 ( 8783 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1082 -11.1082 -11.0772 -11.0772 -10.9314 -10.9314 -10.0059 -10.0059 -9.9706 -9.9706 -9.7831 -9.7831 -9.7784 -9.7784 -9.6528 -9.6528 -9.3431 -9.3431 -9.2099 -9.2099 -9.1762 -9.1762 -9.0057 -9.0057 -8.9967 -8.9967 -8.7508 -8.7508 -8.1882 -8.1882 0.2571 0.2571 0.3149 0.3149 0.7064 0.7064 0.7752 0.7752 0.8943 0.8943 0.9939 0.9939 3.5766 3.5766 3.8225 3.8225 4.2623 4.2623 7.2495 7.2495 7.6494 7.6494 8.6566 8.6566 8.8652 8.8652 8.9842 8.9842 9.3435 9.3435 k =-0.2420 0.5496 0.6005 ( 8785 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4352 -25.4352 -25.4316 -25.4316 -11.1081 -11.1081 -11.0770 -11.0770 -10.9314 -10.9314 -10.0054 -10.0054 -9.9711 -9.9711 -9.7833 -9.7833 -9.7783 -9.7783 -9.6510 -9.6510 -9.3442 -9.3442 -9.2092 -9.2092 -9.1772 -9.1772 -9.0058 -9.0058 -8.9969 -8.9969 -8.7506 -8.7506 -8.1894 -8.1894 0.2585 0.2585 0.3167 0.3167 0.7034 0.7034 0.7772 0.7772 0.8918 0.8918 0.9961 0.9961 3.5780 3.5780 3.8237 3.8237 4.2628 4.2628 7.2054 7.2054 7.6999 7.6999 8.6671 8.6671 8.8958 8.8958 8.9739 8.9739 9.2909 9.2909 k =-0.2339 0.5313 0.5805 ( 8787 PWs) bands (ev): -26.2999 -26.2999 -26.2982 -26.2982 -25.4370 -25.4370 -25.4298 -25.4298 -11.1076 -11.1076 -11.0767 -11.0767 -10.9303 -10.9303 -10.0049 -10.0049 -9.9716 -9.9716 -9.7835 -9.7835 -9.7784 -9.7784 -9.6494 -9.6494 -9.3452 -9.3452 -9.2086 -9.2086 -9.1781 -9.1781 -9.0060 -9.0060 -8.9972 -8.9972 -8.7500 -8.7500 -8.1929 -8.1929 0.2609 0.2609 0.3197 0.3197 0.7006 0.7006 0.7798 0.7798 0.8895 0.8895 0.9987 0.9987 3.5830 3.5830 3.8253 3.8253 4.2638 4.2638 7.1549 7.1549 7.7453 7.7453 8.6696 8.6696 8.9201 8.9201 8.9672 8.9672 9.2327 9.2327 k =-0.2258 0.5130 0.5605 ( 8783 PWs) bands (ev): -26.3000 -26.3000 -26.2982 -26.2982 -25.4388 -25.4388 -25.4280 -25.4280 -11.1067 -11.1067 -11.0764 -11.0764 -10.9281 -10.9281 -10.0046 -10.0046 -9.9722 -9.9722 -9.7839 -9.7839 -9.7786 -9.7786 -9.6479 -9.6479 -9.3460 -9.3460 -9.2082 -9.2082 -9.1790 -9.1790 -9.0062 -9.0062 -8.9976 -8.9976 -8.7489 -8.7489 -8.1986 -8.1986 0.2642 0.2642 0.3239 0.3239 0.6981 0.6981 0.7831 0.7831 0.8877 0.8877 1.0015 1.0015 3.5917 3.5917 3.8272 3.8272 4.2653 4.2653 7.0984 7.0984 7.7850 7.7850 8.6649 8.6649 8.9301 8.9301 8.9714 8.9714 9.1699 9.1699 k =-0.2178 0.4946 0.5405 ( 8777 PWs) bands (ev): -26.3001 -26.3001 -26.2981 -26.2981 -25.4405 -25.4405 -25.4262 -25.4262 -11.1055 -11.1055 -11.0760 -11.0760 -10.9248 -10.9248 -10.0043 -10.0043 -9.9728 -9.9728 -9.7843 -9.7843 -9.7788 -9.7788 -9.6465 -9.6465 -9.3465 -9.3465 -9.2080 -9.2080 -9.1798 -9.1798 -9.0065 -9.0065 -8.9982 -8.9982 -8.7475 -8.7475 -8.2065 -8.2065 0.2680 0.2680 0.3295 0.3295 0.6960 0.6960 0.7870 0.7870 0.8863 0.8863 1.0047 1.0047 3.6038 3.6038 3.8295 3.8295 4.2673 4.2673 7.0365 7.0365 7.8185 7.8185 8.6542 8.6542 8.9217 8.9217 8.9893 8.9893 9.1032 9.1032 k =-0.2097 0.4763 0.5204 ( 8775 PWs) bands (ev): -26.3001 -26.3001 -26.2981 -26.2981 -25.4423 -25.4423 -25.4245 -25.4245 -11.1040 -11.1040 -11.0756 -11.0756 -10.9205 -10.9205 -10.0042 -10.0042 -9.9735 -9.9735 -9.7849 -9.7849 -9.7793 -9.7793 -9.6453 -9.6453 -9.3469 -9.3469 -9.2080 -9.2080 -9.1806 -9.1806 -9.0070 -9.0070 -8.9988 -8.9988 -8.7457 -8.7457 -8.2165 -8.2165 0.2722 0.2722 0.3366 0.3366 0.6943 0.6943 0.7916 0.7916 0.8854 0.8854 1.0081 1.0081 3.6194 3.6194 3.8321 3.8321 4.2698 4.2698 6.9698 6.9698 7.8455 7.8455 8.6381 8.6381 8.9039 8.9039 9.0069 9.0069 9.0382 9.0382 k =-0.2016 0.4580 0.5004 ( 8799 PWs) bands (ev): -26.3002 -26.3002 -26.2980 -26.2980 -25.4441 -25.4441 -25.4228 -25.4228 -11.1022 -11.1022 -11.0750 -11.0750 -10.9151 -10.9151 -10.0041 -10.0041 -9.9743 -9.9743 -9.7855 -9.7855 -9.7798 -9.7798 -9.6442 -9.6442 -9.3470 -9.3470 -9.2082 -9.2082 -9.1811 -9.1811 -9.0077 -9.0077 -8.9994 -8.9994 -8.7436 -8.7436 -8.2286 -8.2286 0.2764 0.2764 0.3452 0.3452 0.6930 0.6930 0.7967 0.7967 0.8851 0.8851 1.0118 1.0118 3.6383 3.6383 3.8351 3.8351 4.2728 4.2728 6.8989 6.8989 7.8656 7.8656 8.6175 8.6175 8.8796 8.8796 8.9547 8.9547 9.0419 9.0419 k =-0.1936 0.4397 0.4804 ( 8807 PWs) bands (ev): -26.3003 -26.3003 -26.2980 -26.2980 -25.4458 -25.4458 -25.4211 -25.4211 -11.1001 -11.1001 -11.0744 -11.0744 -10.9088 -10.9088 -10.0042 -10.0042 -9.9751 -9.9751 -9.7861 -9.7861 -9.7805 -9.7805 -9.6433 -9.6433 -9.3469 -9.3469 -9.2087 -9.2087 -9.1816 -9.1816 -9.0086 -9.0086 -8.9999 -8.9999 -8.7412 -8.7412 -8.2425 -8.2425 0.2805 0.2805 0.3553 0.3553 0.6922 0.6922 0.8024 0.8024 0.8855 0.8855 1.0157 1.0157 3.6603 3.6603 3.8384 3.8384 4.2762 4.2762 6.8247 6.8247 7.8789 7.8789 8.5928 8.5928 8.8488 8.8488 8.8801 8.8801 9.0681 9.0681 k =-0.1855 0.4214 0.4604 ( 8803 PWs) bands (ev): -26.3004 -26.3004 -26.2980 -26.2980 -25.4475 -25.4475 -25.4194 -25.4194 -11.0978 -11.0978 -11.0738 -11.0738 -10.9015 -10.9015 -10.0043 -10.0043 -9.9759 -9.9759 -9.7868 -9.7868 -9.7813 -9.7813 -9.6425 -9.6425 -9.3465 -9.3465 -9.2093 -9.2093 -9.1819 -9.1819 -9.0098 -9.0098 -9.0004 -9.0004 -8.7386 -8.7386 -8.2583 -8.2583 0.2843 0.2843 0.3670 0.3670 0.6918 0.6918 0.8086 0.8086 0.8866 0.8866 1.0198 1.0198 3.6853 3.6853 3.8419 3.8419 4.2801 4.2801 6.7476 6.7476 7.8856 7.8856 8.5647 8.5647 8.7978 8.7978 8.8175 8.8175 9.0972 9.0972 k =-0.1774 0.4030 0.4404 ( 8795 PWs) bands (ev): -26.3005 -26.3005 -26.2979 -26.2979 -25.4492 -25.4492 -25.4178 -25.4178 -11.0954 -11.0954 -11.0731 -11.0731 -10.8932 -10.8932 -10.0045 -10.0045 -9.9768 -9.9768 -9.7876 -9.7876 -9.7822 -9.7822 -9.6418 -9.6418 -9.3459 -9.3459 -9.2101 -9.2101 -9.1820 -9.1820 -9.0111 -9.0111 -9.0009 -9.0009 -8.7357 -8.7357 -8.2758 -8.2758 0.2876 0.2876 0.3800 0.3800 0.6921 0.6921 0.8153 0.8153 0.8886 0.8886 1.0241 1.0241 3.7130 3.7130 3.8458 3.8458 4.2844 4.2844 6.6684 6.6684 7.8861 7.8861 8.5334 8.5334 8.7198 8.7198 8.7755 8.7755 9.1288 9.1288 k =-0.1694 0.3847 0.4204 ( 8811 PWs) bands (ev): -26.3006 -26.3006 -26.2979 -26.2979 -25.4508 -25.4508 -25.4162 -25.4162 -11.0927 -11.0927 -11.0724 -11.0724 -10.8841 -10.8841 -10.0049 -10.0049 -9.9776 -9.9776 -9.7884 -9.7884 -9.7832 -9.7832 -9.6412 -9.6412 -9.3450 -9.3450 -9.2111 -9.2111 -9.1820 -9.1820 -9.0126 -9.0126 -9.0013 -9.0013 -8.7328 -8.7328 -8.2948 -8.2948 0.2904 0.2904 0.3943 0.3943 0.6928 0.6928 0.8224 0.8224 0.8916 0.8916 1.0286 1.0286 3.7433 3.7433 3.8499 3.8499 4.2890 4.2890 6.5876 6.5876 7.8807 7.8807 8.4996 8.4996 8.6395 8.6395 8.7306 8.7306 9.1628 9.1628 k =-0.1613 0.3664 0.4003 ( 8807 PWs) bands (ev): -26.3007 -26.3007 -26.2979 -26.2979 -25.4524 -25.4524 -25.4147 -25.4147 -11.0899 -11.0899 -11.0716 -11.0716 -10.8742 -10.8742 -10.0053 -10.0053 -9.9785 -9.9785 -9.7893 -9.7893 -9.7843 -9.7843 -9.6408 -9.6408 -9.3438 -9.3438 -9.2122 -9.2122 -9.1819 -9.1819 -9.0143 -9.0143 -9.0016 -9.0016 -8.7296 -8.7296 -8.3152 -8.3152 0.2926 0.2926 0.4095 0.4095 0.6941 0.6941 0.8298 0.8298 0.8957 0.8957 1.0332 1.0332 3.7758 3.7758 3.8542 3.8542 4.2939 4.2939 6.5059 6.5059 7.8704 7.8704 8.4636 8.4636 8.5588 8.5588 8.6827 8.6827 9.1427 9.1427 k =-0.1532 0.3481 0.3803 ( 8799 PWs) bands (ev): -26.3008 -26.3008 -26.2978 -26.2978 -25.4539 -25.4539 -25.4132 -25.4132 -11.0870 -11.0870 -11.0708 -11.0708 -10.8635 -10.8635 -10.0057 -10.0057 -9.9793 -9.9793 -9.7901 -9.7901 -9.7854 -9.7854 -9.6405 -9.6405 -9.3424 -9.3424 -9.2135 -9.2135 -9.1816 -9.1816 -9.0161 -9.0161 -9.0019 -9.0019 -8.7265 -8.7265 -8.3367 -8.3367 0.2943 0.2943 0.4256 0.4256 0.6960 0.6960 0.8373 0.8373 0.9010 0.9010 1.0378 1.0378 3.8101 3.8101 3.8589 3.8589 4.2991 4.2991 6.4237 6.4237 7.8557 7.8557 8.4253 8.4253 8.4790 8.4790 8.6324 8.6324 9.1044 9.1044 k =-0.1452 0.3298 0.3603 ( 8805 PWs) bands (ev): -26.3009 -26.3009 -26.2978 -26.2978 -25.4554 -25.4554 -25.4118 -25.4118 -11.0841 -11.0841 -11.0700 -11.0700 -10.8522 -10.8522 -10.0063 -10.0063 -9.9801 -9.9801 -9.7910 -9.7910 -9.7867 -9.7867 -9.6403 -9.6403 -9.3406 -9.3406 -9.2148 -9.2148 -9.1813 -9.1813 -9.0181 -9.0181 -9.0022 -9.0022 -8.7233 -8.7233 -8.3592 -8.3592 0.2953 0.2953 0.4422 0.4422 0.6983 0.6983 0.8448 0.8448 0.9077 0.9077 1.0425 1.0425 3.8449 3.8449 3.8649 3.8649 4.3045 4.3045 6.3417 6.3417 7.8374 7.8374 8.3800 8.3800 8.4058 8.4058 8.5807 8.5807 9.0674 9.0674 k =-0.1371 0.3114 0.3403 ( 8781 PWs) bands (ev): -26.3010 -26.3010 -26.2978 -26.2978 -25.4568 -25.4568 -25.4104 -25.4104 -11.0811 -11.0811 -11.0692 -11.0692 -10.8404 -10.8404 -10.0070 -10.0070 -9.9809 -9.9809 -9.7919 -9.7919 -9.7880 -9.7880 -9.6401 -9.6401 -9.3385 -9.3385 -9.2162 -9.2162 -9.1809 -9.1809 -9.0201 -9.0201 -9.0026 -9.0026 -8.7203 -8.7203 -8.3825 -8.3825 0.2957 0.2957 0.4592 0.4592 0.7011 0.7011 0.8522 0.8522 0.9159 0.9159 1.0472 1.0472 3.8648 3.8648 3.8874 3.8874 4.3102 4.3102 6.2602 6.2602 7.8164 7.8164 8.3118 8.3118 8.3560 8.3560 8.5285 8.5285 9.0319 9.0319 k =-0.1290 0.2931 0.3203 ( 8785 PWs) bands (ev): -26.3011 -26.3011 -26.2978 -26.2978 -25.4582 -25.4582 -25.4091 -25.4091 -11.0781 -11.0781 -11.0684 -11.0684 -10.8281 -10.8281 -10.0077 -10.0077 -9.9817 -9.9817 -9.7928 -9.7928 -9.7894 -9.7894 -9.6400 -9.6400 -9.3362 -9.3362 -9.2175 -9.2175 -9.1804 -9.1804 -9.0222 -9.0222 -9.0029 -9.0029 -8.7173 -8.7173 -8.4063 -8.4063 0.2955 0.2955 0.4762 0.4762 0.7042 0.7042 0.8595 0.8595 0.9256 0.9256 1.0519 1.0519 3.8706 3.8706 3.9250 3.9250 4.3159 4.3159 6.1798 6.1798 7.7934 7.7934 8.2360 8.2360 8.3151 8.3151 8.4767 8.4767 8.9980 8.9980 k =-0.1210 0.2748 0.3003 ( 8787 PWs) bands (ev): -26.3012 -26.3012 -26.2977 -26.2977 -25.4595 -25.4595 -25.4078 -25.4078 -11.0751 -11.0751 -11.0675 -11.0675 -10.8155 -10.8155 -10.0085 -10.0085 -9.9824 -9.9824 -9.7937 -9.7937 -9.7908 -9.7908 -9.6401 -9.6401 -9.3335 -9.3335 -9.2189 -9.2189 -9.1799 -9.1799 -9.0244 -9.0244 -9.0034 -9.0034 -8.7145 -8.7145 -8.4303 -8.4303 0.2948 0.2948 0.4931 0.4931 0.7076 0.7076 0.8666 0.8666 0.9366 0.9366 1.0566 1.0566 3.8753 3.8753 3.9643 3.9643 4.3217 4.3217 6.1009 6.1009 7.7689 7.7689 8.1610 8.1610 8.2754 8.2754 8.4261 8.4261 8.9658 8.9658 k =-0.1129 0.2565 0.2802 ( 8785 PWs) bands (ev): -26.3013 -26.3013 -26.2977 -26.2977 -25.4607 -25.4607 -25.4067 -25.4067 -11.0721 -11.0721 -11.0667 -11.0667 -10.8027 -10.8027 -10.0093 -10.0093 -9.9831 -9.9831 -9.7946 -9.7946 -9.7922 -9.7922 -9.6401 -9.6401 -9.3305 -9.3305 -9.2202 -9.2202 -9.1794 -9.1794 -9.0267 -9.0267 -9.0038 -9.0038 -8.7120 -8.7120 -8.4543 -8.4543 0.2937 0.2937 0.5096 0.5096 0.7111 0.7111 0.8736 0.8736 0.9488 0.9488 1.0611 1.0611 3.8799 3.8799 4.0042 4.0042 4.3275 4.3275 6.0239 6.0239 7.7438 7.7438 8.0884 8.0884 8.2362 8.2362 8.3775 8.3775 8.9355 8.9355 k =-0.1049 0.2382 0.2602 ( 8793 PWs) bands (ev): -26.3014 -26.3014 -26.2977 -26.2977 -25.4619 -25.4619 -25.4055 -25.4055 -11.0692 -11.0692 -11.0659 -11.0659 -10.7898 -10.7898 -10.0102 -10.0102 -9.9837 -9.9837 -9.7955 -9.7955 -9.7936 -9.7936 -9.6402 -9.6402 -9.3273 -9.3273 -9.2213 -9.2213 -9.1789 -9.1789 -9.0291 -9.0291 -9.0043 -9.0043 -8.7098 -8.7098 -8.4780 -8.4780 0.2922 0.2922 0.5257 0.5257 0.7148 0.7148 0.8805 0.8805 0.9620 0.9620 1.0655 1.0655 3.8842 3.8842 4.0441 4.0441 4.3332 4.3332 5.9493 5.9493 7.7184 7.7184 8.0188 8.0188 8.1974 8.1974 8.3316 8.3316 8.9070 8.9070 k =-0.0968 0.2198 0.2402 ( 8799 PWs) bands (ev): -26.3015 -26.3015 -26.2977 -26.2977 -25.4630 -25.4630 -25.4045 -25.4045 -11.0665 -11.0665 -11.0650 -11.0650 -10.7770 -10.7770 -10.0111 -10.0111 -9.9842 -9.9842 -9.7965 -9.7965 -9.7949 -9.7949 -9.6404 -9.6404 -9.3239 -9.3239 -9.2223 -9.2223 -9.1783 -9.1783 -9.0316 -9.0316 -9.0049 -9.0049 -8.7081 -8.7081 -8.5010 -8.5010 0.2903 0.2903 0.5410 0.5410 0.7185 0.7185 0.8874 0.8874 0.9760 0.9760 1.0698 1.0698 3.8884 3.8884 4.0837 4.0837 4.3389 4.3389 5.8775 5.8775 7.6934 7.6934 7.9525 7.9525 8.1592 8.1592 8.2889 8.2889 8.8805 8.8805 k =-0.0887 0.2015 0.2202 ( 8809 PWs) bands (ev): -26.3016 -26.3016 -26.2977 -26.2977 -25.4640 -25.4640 -25.4035 -25.4035 -11.0646 -11.0646 -11.0636 -11.0636 -10.7645 -10.7645 -10.0120 -10.0120 -9.9847 -9.9847 -9.7975 -9.7975 -9.7961 -9.7961 -9.6406 -9.6406 -9.3202 -9.3202 -9.2231 -9.2231 -9.1778 -9.1778 -9.0343 -9.0343 -9.0056 -9.0056 -8.7069 -8.7069 -8.5230 -8.5230 0.2882 0.2882 0.5554 0.5554 0.7221 0.7221 0.8941 0.8941 0.9905 0.9905 1.0738 1.0738 3.8923 3.8923 4.1225 4.1225 4.3444 4.3444 5.8090 5.8090 7.6691 7.6691 7.8902 7.8902 8.1218 8.1218 8.2497 8.2497 8.8560 8.8560 k =-0.0807 0.1832 0.2002 ( 8799 PWs) bands (ev): -26.3017 -26.3017 -26.2977 -26.2977 -25.4649 -25.4649 -25.4027 -25.4027 -11.0638 -11.0638 -11.0611 -11.0611 -10.7524 -10.7524 -10.0130 -10.0130 -9.9851 -9.9851 -9.7986 -9.7986 -9.7971 -9.7971 -9.6408 -9.6408 -9.3164 -9.3164 -9.2237 -9.2237 -9.1773 -9.1773 -9.0370 -9.0370 -9.0062 -9.0062 -8.7064 -8.7064 -8.5437 -8.5437 0.2860 0.2860 0.5688 0.5688 0.7255 0.7255 0.9007 0.9007 1.0051 1.0051 1.0776 1.0776 3.8960 3.8960 4.1602 4.1602 4.3496 4.3496 5.7441 5.7441 7.6459 7.6459 7.8321 7.8321 8.0858 8.0858 8.2142 8.2142 8.8335 8.8335 k =-0.0726 0.1649 0.1802 ( 8793 PWs) bands (ev): -26.3017 -26.3017 -26.2977 -26.2977 -25.4658 -25.4658 -25.4018 -25.4018 -11.0631 -11.0631 -11.0588 -11.0588 -10.7408 -10.7408 -10.0139 -10.0139 -9.9854 -9.9854 -9.7998 -9.7998 -9.7979 -9.7979 -9.6410 -9.6410 -9.3125 -9.3125 -9.2240 -9.2240 -9.1769 -9.1769 -9.0399 -9.0399 -9.0069 -9.0069 -8.7067 -8.7067 -8.5625 -8.5625 0.2836 0.2836 0.5811 0.5811 0.7288 0.7288 0.9072 0.9072 1.0196 1.0196 1.0811 1.0811 3.8994 3.8994 4.1962 4.1962 4.3546 4.3546 5.6834 5.6834 7.6240 7.6240 7.7785 7.7785 8.0515 8.0515 8.1825 8.1825 8.8130 8.8130 k =-0.0645 0.1466 0.1601 ( 8805 PWs) bands (ev): -26.3018 -26.3018 -26.2977 -26.2977 -25.4665 -25.4665 -25.4011 -25.4011 -11.0625 -11.0625 -11.0566 -11.0566 -10.7299 -10.7299 -10.0147 -10.0147 -9.9857 -9.9857 -9.8010 -9.8010 -9.7986 -9.7986 -9.6412 -9.6412 -9.3086 -9.3086 -9.2240 -9.2240 -9.1764 -9.1764 -9.0430 -9.0430 -9.0076 -9.0076 -8.7080 -8.7080 -8.5792 -8.5792 0.2813 0.2813 0.5922 0.5922 0.7318 0.7318 0.9134 0.9134 1.0336 1.0336 1.0844 1.0844 3.9025 3.9025 4.2302 4.2302 4.3593 4.3593 5.6272 5.6272 7.6038 7.6038 7.7299 7.7299 8.0194 8.0194 8.1545 8.1545 8.7946 8.7946 k =-0.0565 0.1282 0.1401 ( 8809 PWs) bands (ev): -26.3019 -26.3019 -26.2976 -26.2976 -25.4672 -25.4672 -25.4005 -25.4005 -11.0619 -11.0619 -11.0547 -11.0547 -10.7198 -10.7198 -10.0156 -10.0156 -9.9860 -9.9860 -9.8022 -9.8022 -9.7992 -9.7992 -9.6414 -9.6414 -9.3049 -9.3049 -9.2237 -9.2237 -9.1761 -9.1761 -9.0461 -9.0461 -9.0083 -9.0083 -8.7102 -8.7102 -8.5934 -8.5934 0.2791 0.2791 0.6021 0.6021 0.7345 0.7345 0.9192 0.9192 1.0469 1.0469 1.0873 1.0873 3.9053 3.9053 4.2617 4.2617 4.3635 4.3635 5.5760 5.5760 7.5855 7.5855 7.6864 7.6864 7.9900 7.9900 8.1299 8.1299 8.7784 8.7784 k =-0.0484 0.1099 0.1201 ( 8817 PWs) bands (ev): -26.3019 -26.3019 -26.2976 -26.2976 -25.4678 -25.4678 -25.3999 -25.3999 -11.0614 -11.0614 -11.0529 -11.0529 -10.7108 -10.7108 -10.0163 -10.0163 -9.9861 -9.9861 -9.8032 -9.8032 -9.7997 -9.7997 -9.6416 -9.6416 -9.3014 -9.3014 -9.2230 -9.2230 -9.1758 -9.1758 -9.0493 -9.0493 -9.0090 -9.0090 -8.7134 -8.7134 -8.6049 -8.6049 0.2770 0.2770 0.6107 0.6107 0.7369 0.7369 0.9245 0.9245 1.0592 1.0592 1.0899 1.0899 3.9078 3.9078 4.2902 4.2902 4.3674 4.3674 5.5304 5.5304 7.5692 7.5692 7.6483 7.6483 7.9638 7.9638 8.1089 8.1089 8.7642 8.7642 k =-0.0403 0.0916 0.1001 ( 8809 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4683 -25.4683 -25.3994 -25.3994 -11.0610 -11.0610 -11.0514 -11.0514 -10.7029 -10.7029 -10.0170 -10.0170 -9.9863 -9.9863 -9.8041 -9.8041 -9.8001 -9.8001 -9.6418 -9.6418 -9.2982 -9.2982 -9.2221 -9.2221 -9.1756 -9.1756 -9.0525 -9.0525 -9.0096 -9.0096 -8.7174 -8.7174 -8.6139 -8.6139 0.2752 0.2752 0.6180 0.6180 0.7389 0.7389 0.9293 0.9293 1.0701 1.0701 1.0921 1.0921 3.9099 3.9099 4.3153 4.3153 4.3709 4.3709 5.4906 5.4906 7.5550 7.5550 7.6159 7.6159 7.9411 7.9411 8.0912 8.0912 8.7523 8.7523 k =-0.0323 0.0733 0.0801 ( 8805 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4688 -25.4688 -25.3990 -25.3990 -11.0606 -11.0606 -11.0502 -11.0502 -10.6962 -10.6962 -10.0175 -10.0175 -9.9864 -9.9864 -9.8049 -9.8049 -9.8004 -9.8004 -9.6420 -9.6420 -9.2955 -9.2955 -9.2211 -9.2211 -9.1754 -9.1754 -9.0554 -9.0554 -9.0102 -9.0102 -8.7216 -8.7216 -8.6204 -8.6204 0.2736 0.2736 0.6239 0.6239 0.7406 0.7406 0.9334 0.9334 1.0795 1.0795 1.0939 1.0939 3.9116 3.9116 4.3363 4.3363 4.3741 4.3741 5.4573 5.4573 7.5430 7.5430 7.5893 7.5893 7.9221 7.9221 8.0768 8.0768 8.7425 8.7425 k =-0.0242 0.0550 0.0601 ( 8815 PWs) bands (ev): -26.3020 -26.3020 -26.2976 -26.2976 -25.4691 -25.4691 -25.3987 -25.3987 -11.0604 -11.0604 -11.0492 -11.0492 -10.6909 -10.6909 -10.0180 -10.0180 -9.9864 -9.9864 -9.8055 -9.8055 -9.8007 -9.8007 -9.6421 -9.6421 -9.2934 -9.2934 -9.2200 -9.2200 -9.1753 -9.1753 -9.0580 -9.0580 -9.0106 -9.0106 -8.7255 -8.7255 -8.6250 -8.6250 0.2723 0.2723 0.6286 0.6286 0.7419 0.7419 0.9367 0.9367 1.0870 1.0870 1.0954 1.0954 3.9130 3.9130 4.3528 4.3528 4.3770 4.3770 5.4308 5.4308 7.5333 7.5333 7.5687 7.5687 7.9072 7.9072 8.0656 8.0656 8.7348 8.7349 k =-0.0161 0.0366 0.0400 ( 8821 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4693 -25.4693 -25.3985 -25.3985 -11.0602 -11.0602 -11.0484 -11.0484 -10.6871 -10.6871 -10.0183 -10.0183 -9.9865 -9.9865 -9.8060 -9.8060 -9.8009 -9.8009 -9.6422 -9.6422 -9.2918 -9.2918 -9.2190 -9.2190 -9.1752 -9.1752 -9.0600 -9.0600 -9.0109 -9.0109 -8.7288 -8.7288 -8.6280 -8.6280 0.2714 0.2714 0.6319 0.6319 0.7429 0.7429 0.9391 0.9391 1.0925 1.0925 1.0964 1.0964 3.9140 3.9140 4.3638 4.3638 4.3802 4.3802 5.4115 5.4115 7.5261 7.5261 7.5543 7.5543 7.8964 7.8964 8.0576 8.0576 8.7293 8.7327 k =-0.0081 0.0183 0.0200 ( 8821 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3984 -25.3984 -11.0600 -11.0600 -11.0480 -11.0480 -10.6847 -10.6847 -10.0185 -10.0185 -9.9865 -9.9865 -9.8063 -9.8063 -9.8011 -9.8011 -9.6423 -9.6423 -9.2909 -9.2909 -9.2183 -9.2183 -9.1752 -9.1752 -9.0613 -9.0613 -9.0111 -9.0111 -8.7309 -8.7309 -8.6296 -8.6296 0.2708 0.2708 0.6339 0.6339 0.7434 0.7434 0.9405 0.9405 1.0958 1.0958 1.0971 1.0971 3.9146 3.9146 4.3694 4.3694 4.3832 4.3832 5.3999 5.3999 7.5214 7.5214 7.5459 7.5459 7.8899 7.8899 8.0529 8.0529 8.7261 8.7268 k = 0.0000 0.0000 0.0000 ( 8819 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3983 -25.3983 -11.0600 -11.0600 -11.0479 -11.0479 -10.6839 -10.6839 -10.0186 -10.0186 -9.9865 -9.9865 -9.8063 -9.8063 -9.8011 -9.8011 -9.6423 -9.6423 -9.2905 -9.2905 -9.2181 -9.2181 -9.1752 -9.1752 -9.0618 -9.0618 -9.0112 -9.0112 -8.7316 -8.7316 -8.6301 -8.6301 0.2706 0.2706 0.6345 0.6345 0.7436 0.7436 0.9410 0.9410 1.0968 1.0968 1.0974 1.0974 3.9148 3.9148 4.3709 4.3709 4.3846 4.3846 5.3959 5.3959 7.5198 7.5198 7.5431 7.5431 7.8877 7.8877 8.0513 8.0513 8.7247 8.7248 k = 0.0000 0.0000 0.0000 ( 8819 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3983 -25.3983 -11.0600 -11.0600 -11.0479 -11.0479 -10.6839 -10.6839 -10.0186 -10.0186 -9.9865 -9.9865 -9.8063 -9.8063 -9.8011 -9.8011 -9.6423 -9.6423 -9.2905 -9.2905 -9.2181 -9.2181 -9.1752 -9.1752 -9.0618 -9.0618 -9.0112 -9.0112 -8.7316 -8.7316 -8.6301 -8.6301 0.2706 0.2706 0.6345 0.6345 0.7436 0.7436 0.9410 0.9410 1.0968 1.0968 1.0974 1.0974 3.9148 3.9148 4.3709 4.3709 4.3846 4.3846 5.3959 5.3959 7.5198 7.5198 7.5431 7.5431 7.8877 7.8877 8.0513 8.0513 8.7247 8.7248 k = 0.0250 0.0110 0.0000 ( 8819 PWs) bands (ev): -26.3021 -26.3021 -26.2976 -26.2976 -25.4695 -25.4695 -25.3983 -25.3983 -11.0605 -11.0605 -11.0473 -11.0473 -10.6838 -10.6838 -10.0187 -10.0187 -9.9864 -9.9864 -9.8067 -9.8067 -9.8007 -9.8007 -9.6427 -9.6427 -9.2905 -9.2905 -9.2183 -9.2183 -9.1748 -9.1748 -9.0617 -9.0617 -9.0112 -9.0112 -8.7316 -8.7316 -8.6302 -8.6302 0.2712 0.2712 0.6340 0.6340 0.7440 0.7440 0.9412 0.9412 1.0966 1.0966 1.0966 1.0966 3.9140 3.9140 4.3709 4.3709 4.3845 4.3845 5.3992 5.3992 7.5132 7.5132 7.5384 7.5384 7.8959 7.8959 8.0509 8.0509 8.7269 8.7269 k = 0.0500 0.0220 0.0000 ( 8823 PWs) bands (ev): -26.3021 -26.3021 -26.2977 -26.2977 -25.4695 -25.4695 -25.3983 -25.3983 -11.0619 -11.0619 -11.0460 -11.0460 -10.6834 -10.6834 -10.0192 -10.0192 -9.9860 -9.9860 -9.8076 -9.8076 -9.7998 -9.7998 -9.6440 -9.6440 -9.2905 -9.2905 -9.2186 -9.2186 -9.1738 -9.1738 -9.0613 -9.0613 -9.0112 -9.0112 -8.7315 -8.7315 -8.6302 -8.6302 0.2728 0.2728 0.6326 0.6326 0.7452 0.7452 0.9418 0.9418 1.0945 1.0945 1.0959 1.0959 3.9118 3.9118 4.3707 4.3707 4.3843 4.3843 5.4090 5.4090 7.4950 7.4950 7.5244 7.5244 7.9191 7.9191 8.0498 8.0498 8.7334 8.7334 k = 0.0750 0.0330 0.0000 ( 8831 PWs) bands (ev): -26.3020 -26.3020 -26.2977 -26.2977 -25.4695 -25.4695 -25.3983 -25.3983 -11.0636 -11.0636 -11.0442 -11.0442 -10.6827 -10.6827 -10.0200 -10.0200 -9.9854 -9.9854 -9.8087 -9.8087 -9.7987 -9.7987 -9.6462 -9.6462 -9.2905 -9.2905 -9.2191 -9.2191 -9.1723 -9.1723 -9.0607 -9.0607 -9.0112 -9.0112 -8.7315 -8.7315 -8.6302 -8.6302 0.2755 0.2755 0.6302 0.6302 0.7472 0.7472 0.9428 0.9428 1.0909 1.0909 1.0948 1.0948 3.9083 3.9083 4.3704 4.3704 4.3840 4.3840 5.4251 5.4251 7.4687 7.4687 7.5016 7.5016 7.9534 7.9534 8.0479 8.0479 8.7441 8.7442 k = 0.1000 0.0440 0.0000 ( 8811 PWs) bands (ev): -26.3020 -26.3020 -26.2977 -26.2977 -25.4695 -25.4695 -25.3983 -25.3983 -11.0654 -11.0654 -11.0424 -11.0424 -10.6818 -10.6818 -10.0211 -10.0211 -9.9846 -9.9846 -9.8099 -9.8099 -9.7975 -9.7975 -9.6492 -9.6492 -9.2905 -9.2905 -9.2195 -9.2195 -9.1704 -9.1704 -9.0599 -9.0599 -9.0112 -9.0112 -8.7313 -8.7313 -8.6302 -8.6302 0.2792 0.2792 0.6269 0.6269 0.7499 0.7499 0.9442 0.9442 1.0858 1.0858 1.0933 1.0933 3.9037 3.9037 4.3699 4.3699 4.3835 4.3835 5.4472 5.4472 7.4379 7.4379 7.4706 7.4706 7.9954 7.9954 8.0452 8.0452 8.7591 8.7592 k = 0.1250 0.0550 0.0000 ( 8795 PWs) bands (ev): -26.3019 -26.3019 -26.2978 -26.2978 -25.4695 -25.4695 -25.3983 -25.3983 -11.0672 -11.0672 -11.0407 -11.0407 -10.6805 -10.6805 -10.0223 -10.0223 -9.9836 -9.9836 -9.8111 -9.8111 -9.7962 -9.7962 -9.6529 -9.6529 -9.2905 -9.2905 -9.2198 -9.2198 -9.1683 -9.1683 -9.0588 -9.0588 -9.0112 -9.0112 -8.7312 -8.7312 -8.6302 -8.6302 0.2840 0.2840 0.6226 0.6226 0.7533 0.7533 0.9460 0.9460 1.0794 1.0794 1.0913 1.0913 3.8983 3.8983 4.3694 4.3694 4.3829 4.3829 5.4749 5.4749 7.4050 7.4050 7.4322 7.4322 8.0417 8.0417 8.0425 8.0425 8.7784 8.7785 k = 0.1500 0.0660 0.0000 ( 8795 PWs) bands (ev): -26.3018 -26.3018 -26.2979 -26.2979 -25.4695 -25.4695 -25.3983 -25.3983 -11.0688 -11.0688 -11.0392 -11.0392 -10.6790 -10.6790 -10.0238 -10.0238 -9.9826 -9.9826 -9.8124 -9.8124 -9.7950 -9.7950 -9.6573 -9.6573 -9.2905 -9.2905 -9.2197 -9.2197 -9.1662 -9.1662 -9.0577 -9.0577 -9.0111 -9.0111 -8.7311 -8.7311 -8.6302 -8.6302 0.2899 0.2899 0.6175 0.6175 0.7574 0.7574 0.9481 0.9481 1.0717 1.0717 1.0890 1.0890 3.8922 3.8922 4.3688 4.3688 4.3822 4.3822 5.5079 5.5079 7.3716 7.3716 7.3875 7.3875 8.0372 8.0372 8.0927 8.0927 8.8018 8.8018 k = 0.1750 0.0770 0.0000 ( 8779 PWs) bands (ev): -26.3017 -26.3017 -26.2979 -26.2979 -25.4695 -25.4695 -25.3983 -25.3983 -11.0701 -11.0701 -11.0380 -11.0380 -10.6772 -10.6772 -10.0253 -10.0253 -9.9814 -9.9814 -9.8135 -9.8135 -9.7938 -9.7938 -9.6623 -9.6623 -9.2905 -9.2905 -9.2192 -9.2192 -9.1642 -9.1642 -9.0564 -9.0564 -9.0111 -9.0111 -8.7309 -8.7309 -8.6302 -8.6302 0.2969 0.2969 0.6116 0.6116 0.7621 0.7621 0.9506 0.9506 1.0627 1.0627 1.0863 1.0863 3.8859 3.8859 4.3681 4.3681 4.3814 4.3814 5.5456 5.5456 7.3372 7.3372 7.3387 7.3387 8.0318 8.0318 8.1448 8.1448 8.8293 8.8295 k = 0.2000 0.0881 0.0000 ( 8791 PWs) bands (ev): -26.3016 -26.3016 -26.2980 -26.2980 -25.4695 -25.4695 -25.3983 -25.3983 -11.0712 -11.0712 -11.0371 -11.0371 -10.6752 -10.6752 -10.0270 -10.0270 -9.9803 -9.9803 -9.8147 -9.8147 -9.7926 -9.7926 -9.6677 -9.6677 -9.2906 -9.2906 -9.2184 -9.2184 -9.1623 -9.1623 -9.0551 -9.0551 -9.0111 -9.0111 -8.7307 -8.7307 -8.6302 -8.6302 0.3049 0.3049 0.6048 0.6048 0.7676 0.7676 0.9534 0.9534 1.0525 1.0525 1.0832 1.0832 3.8796 3.8796 4.3673 4.3673 4.3806 4.3806 5.5875 5.5875 7.2824 7.2824 7.3069 7.3069 8.0255 8.0255 8.1977 8.1977 8.8608 8.8610 k = 0.2250 0.0991 0.0000 ( 8799 PWs) bands (ev): -26.3015 -26.3015 -26.2982 -26.2982 -25.4695 -25.4695 -25.3983 -25.3983 -11.0720 -11.0720 -11.0367 -11.0367 -10.6730 -10.6730 -10.0287 -10.0287 -9.9791 -9.9791 -9.8158 -9.8158 -9.7915 -9.7915 -9.6734 -9.6734 -9.2906 -9.2906 -9.2171 -9.2171 -9.1606 -9.1606 -9.0538 -9.0538 -9.0112 -9.0112 -8.7305 -8.7305 -8.6302 -8.6302 0.3138 0.3138 0.5971 0.5971 0.7737 0.7737 0.9565 0.9565 1.0412 1.0412 1.0798 1.0798 3.8735 3.8735 4.3665 4.3665 4.3797 4.3797 5.6331 5.6331 7.2240 7.2240 7.2769 7.2769 8.0183 8.0183 8.2507 8.2507 8.8962 8.8962 k = 0.2500 0.1101 0.0000 ( 8823 PWs) bands (ev): -26.3014 -26.3014 -26.2983 -26.2983 -25.4695 -25.4695 -25.3983 -25.3983 -11.0724 -11.0724 -11.0366 -11.0366 -10.6706 -10.6706 -10.0305 -10.0305 -9.9780 -9.9780 -9.8168 -9.8168 -9.7905 -9.7905 -9.6793 -9.6793 -9.2906 -9.2906 -9.2154 -9.2154 -9.1591 -9.1591 -9.0525 -9.0525 -9.0112 -9.0112 -8.7303 -8.7303 -8.6302 -8.6302 0.3238 0.3238 0.5887 0.5887 0.7804 0.7804 0.9598 0.9598 1.0289 1.0289 1.0762 1.0762 3.8677 3.8677 4.3657 4.3657 4.3788 4.3788 5.6819 5.6819 7.1628 7.1628 7.2488 7.2488 8.0105 8.0105 8.3028 8.3028 8.9306 8.9306 k = 0.2750 0.1211 0.0000 ( 8823 PWs) bands (ev): -26.3013 -26.3013 -26.2984 -26.2984 -25.4695 -25.4695 -25.3983 -25.3983 -11.0725 -11.0725 -11.0369 -11.0369 -10.6681 -10.6681 -10.0322 -10.0322 -9.9769 -9.9769 -9.8177 -9.8177 -9.7895 -9.7895 -9.6853 -9.6853 -9.2906 -9.2906 -9.2134 -9.2134 -9.1580 -9.1580 -9.0513 -9.0513 -9.0112 -9.0112 -8.7301 -8.7301 -8.6303 -8.6303 0.3346 0.3346 0.5794 0.5794 0.7878 0.7878 0.9634 0.9634 1.0158 1.0158 1.0723 1.0723 3.8625 3.8625 4.3649 4.3649 4.3779 4.3779 5.7333 5.7333 7.0996 7.0996 7.2230 7.2230 8.0021 8.0021 8.3534 8.3534 8.9465 8.9465 k = 0.3000 0.1321 0.0000 ( 8827 PWs) bands (ev): -26.3012 -26.3012 -26.2985 -26.2985 -25.4695 -25.4695 -25.3983 -25.3983 -11.0723 -11.0723 -11.0376 -11.0376 -10.6655 -10.6655 -10.0339 -10.0339 -9.9759 -9.9759 -9.8186 -9.8186 -9.7886 -9.7886 -9.6911 -9.6911 -9.2906 -9.2906 -9.2111 -9.2111 -9.1571 -9.1571 -9.0501 -9.0501 -9.0112 -9.0112 -8.7299 -8.7299 -8.6303 -8.6303 0.3463 0.3463 0.5694 0.5694 0.7959 0.7959 0.9672 0.9672 1.0020 1.0020 1.0683 1.0683 3.8579 3.8579 4.3641 4.3641 4.3770 4.3770 5.7866 5.7866 7.0353 7.0353 7.1995 7.1995 7.9933 7.9933 8.4016 8.4016 8.9632 8.9632 k = 0.3250 0.1431 0.0000 ( 8831 PWs) bands (ev): -26.3010 -26.3010 -26.2987 -26.2987 -25.4695 -25.4695 -25.3983 -25.3983 -11.0718 -11.0718 -11.0386 -11.0386 -10.6629 -10.6629 -10.0355 -10.0355 -9.9750 -9.9750 -9.8194 -9.8194 -9.7878 -9.7878 -9.6967 -9.6967 -9.2907 -9.2907 -9.2087 -9.2087 -9.1564 -9.1564 -9.0491 -9.0491 -9.0112 -9.0112 -8.7298 -8.7298 -8.6303 -8.6303 0.3588 0.3588 0.5586 0.5586 0.8046 0.8046 0.9711 0.9711 0.9876 0.9876 1.0641 1.0641 3.8540 3.8540 4.3633 4.3633 4.3762 4.3762 5.8413 5.8413 6.9707 6.9707 7.1786 7.1786 7.9846 7.9846 8.4468 8.4468 8.9803 8.9803 k = 0.3500 0.1541 0.0000 ( 8831 PWs) bands (ev): -26.3009 -26.3009 -26.2988 -26.2988 -25.4695 -25.4695 -25.3983 -25.3983 -11.0711 -11.0711 -11.0398 -11.0398 -10.6605 -10.6605 -10.0369 -10.0369 -9.9742 -9.9742 -9.8200 -9.8200 -9.7871 -9.7871 -9.7018 -9.7018 -9.2907 -9.2907 -9.2061 -9.2061 -9.1560 -9.1560 -9.0482 -9.0482 -9.0112 -9.0112 -8.7296 -8.7296 -8.6303 -8.6303 0.3719 0.3719 0.5472 0.5472 0.8141 0.8141 0.9729 0.9729 0.9750 0.9750 1.0600 1.0600 3.8506 3.8506 4.3627 4.3627 4.3754 4.3754 5.8964 5.8964 6.9068 6.9068 7.1602 7.1602 7.9761 7.9761 8.4880 8.4880 8.9974 8.9974 k = 0.3750 0.1651 0.0000 ( 8819 PWs) bands (ev): -26.3007 -26.3007 -26.2990 -26.2990 -25.4695 -25.4695 -25.3983 -25.3983 -11.0701 -11.0701 -11.0413 -11.0413 -10.6583 -10.6583 -10.0382 -10.0382 -9.9734 -9.9734 -9.8206 -9.8206 -9.7865 -9.7865 -9.7064 -9.7064 -9.2907 -9.2907 -9.2037 -9.2037 -9.1558 -9.1558 -9.0474 -9.0474 -9.0112 -9.0112 -8.7294 -8.7294 -8.6303 -8.6303 0.3855 0.3855 0.5351 0.5351 0.8242 0.8242 0.9580 0.9580 0.9788 0.9788 1.0559 1.0559 3.8480 3.8480 4.3620 4.3620 4.3748 4.3748 5.9508 5.9508 6.8448 6.8448 7.1446 7.1446 7.9682 7.9682 8.5247 8.5247 9.0140 9.0140 k = 0.4000 0.1761 0.0000 ( 8811 PWs) bands (ev): -26.3005 -26.3005 -26.2992 -26.2992 -25.4695 -25.4695 -25.3983 -25.3983 -11.0690 -11.0690 -11.0428 -11.0428 -10.6563 -10.6563 -10.0394 -10.0394 -9.9728 -9.9728 -9.8211 -9.8211 -9.7860 -9.7860 -9.7103 -9.7103 -9.2907 -9.2907 -9.2014 -9.2014 -9.1557 -9.1557 -9.0468 -9.0468 -9.0112 -9.0112 -8.7293 -8.7293 -8.6303 -8.6303 0.3994 0.3994 0.5224 0.5224 0.8350 0.8350 0.9430 0.9430 0.9825 0.9825 1.0521 1.0521 3.8459 3.8459 4.3615 4.3615 4.3742 4.3742 6.0029 6.0029 6.7864 6.7864 7.1318 7.1318 7.9612 7.9612 8.5559 8.5559 9.0294 9.0294 k = 0.4250 0.1871 0.0000 ( 8787 PWs) bands (ev): -26.3004 -26.3004 -26.2993 -26.2993 -25.4695 -25.4695 -25.3983 -25.3983 -11.0679 -11.0679 -11.0443 -11.0443 -10.6546 -10.6546 -10.0403 -10.0403 -9.9723 -9.9723 -9.8215 -9.8215 -9.7856 -9.7856 -9.7135 -9.7135 -9.2907 -9.2907 -9.1994 -9.1994 -9.1558 -9.1558 -9.0464 -9.0464 -9.0112 -9.0112 -8.7292 -8.7292 -8.6303 -8.6303 0.4134 0.4134 0.5096 0.5096 0.8465 0.8465 0.9281 0.9281 0.9857 0.9857 1.0487 1.0487 3.8443 3.8443 4.3611 4.3611 4.3737 4.3737 6.0505 6.0505 6.7339 6.7339 7.1218 7.1218 7.9554 7.9554 8.5810 8.5810 9.0428 9.0428 k = 0.4500 0.1981 0.0000 ( 8784 PWs) bands (ev): -26.3002 -26.3002 -26.2995 -26.2995 -25.4695 -25.4695 -25.3983 -25.3983 -11.0668 -11.0668 -11.0456 -11.0456 -10.6534 -10.6534 -10.0410 -10.0410 -9.9719 -9.9719 -9.8218 -9.8218 -9.7853 -9.7853 -9.7158 -9.7158 -9.2907 -9.2907 -9.1980 -9.1980 -9.1558 -9.1558 -9.0461 -9.0461 -9.0112 -9.0112 -8.7291 -8.7291 -8.6303 -8.6303 0.4269 0.4269 0.4969 0.4969 0.8586 0.8586 0.9134 0.9134 0.9883 0.9883 1.0459 1.0459 3.8433 3.8433 4.3608 4.3608 4.3734 4.3734 6.0901 6.0901 6.6907 6.6907 7.1146 7.1146 7.9511 7.9511 8.5994 8.5994 9.0533 9.0533 k = 0.4750 0.2091 0.0000 ( 8792 PWs) bands (ev): -26.3001 -26.3001 -26.2996 -26.2996 -25.4695 -25.4695 -25.3983 -25.3983 -11.0661 -11.0661 -11.0465 -11.0465 -10.6527 -10.6527 -10.0414 -10.0414 -9.9717 -9.9717 -9.8219 -9.8219 -9.7851 -9.7851 -9.7173 -9.7173 -9.2907 -9.2907 -9.1970 -9.1970 -9.1559 -9.1559 -9.0459 -9.0459 -9.0112 -9.0112 -8.7291 -8.7291 -8.6303 -8.6303 0.4386 0.4386 0.4857 0.4857 0.8712 0.8712 0.8993 0.8993 0.9900 0.9900 1.0442 1.0442 3.8427 3.8427 4.3606 4.3606 4.3732 4.3732 6.1171 6.1171 6.6616 6.6616 7.1102 7.1102 7.9484 7.9484 8.6106 8.6106 9.0601 9.0601 k = 0.5000 0.2201 0.0000 ( 8776 PWs) bands (ev): -26.3000 -26.3000 -26.2997 -26.2997 -25.4695 -25.4695 -25.3983 -25.3983 -11.0658 -11.0658 -11.0468 -11.0468 -10.6524 -10.6524 -10.0416 -10.0416 -9.9716 -9.9716 -9.8220 -9.8220 -9.7851 -9.7851 -9.7177 -9.7177 -9.2907 -9.2907 -9.1967 -9.1967 -9.1560 -9.1560 -9.0458 -9.0458 -9.0111 -9.0111 -8.7291 -8.7291 -8.6303 -8.6303 0.4440 0.4440 0.4804 0.4804 0.8816 0.8816 0.8883 0.8883 0.9906 0.9906 1.0435 1.0435 3.8425 3.8425 4.3606 4.3606 4.3731 4.3731 6.1268 6.1268 6.6512 6.6512 7.1088 7.1088 7.9475 7.9475 8.6144 8.6144 9.0624 9.0624 k = 0.5000 0.2201 0.0000 ( 8776 PWs) bands (ev): -26.3000 -26.3000 -26.2997 -26.2997 -25.4695 -25.4695 -25.3983 -25.3983 -11.0658 -11.0658 -11.0468 -11.0468 -10.6524 -10.6524 -10.0416 -10.0416 -9.9716 -9.9716 -9.8220 -9.8220 -9.7851 -9.7851 -9.7177 -9.7177 -9.2907 -9.2907 -9.1967 -9.1967 -9.1560 -9.1560 -9.0458 -9.0458 -9.0111 -9.0111 -8.7291 -8.7291 -8.6303 -8.6303 0.4440 0.4440 0.4804 0.4804 0.8816 0.8816 0.8883 0.8883 0.9906 0.9906 1.0435 1.0435 3.8425 3.8425 4.3606 4.3606 4.3731 4.3731 6.1268 6.1268 6.6512 6.6512 7.1088 7.1088 7.9475 7.9475 8.6144 8.6144 9.0624 9.0624 k = 0.4919 0.2384 0.0200 ( 8790 PWs) bands (ev): -26.3000 -26.3000 -26.2997 -26.2997 -25.4695 -25.4695 -25.3984 -25.3984 -11.0659 -11.0659 -11.0470 -11.0470 -10.6533 -10.6533 -10.0415 -10.0415 -9.9716 -9.9716 -9.8218 -9.8218 -9.7851 -9.7851 -9.7176 -9.7176 -9.2907 -9.2907 -9.1973 -9.1973 -9.1560 -9.1560 -9.0454 -9.0454 -9.0111 -9.0111 -8.7283 -8.7283 -8.6298 -8.6298 0.4438 0.4438 0.4799 0.4799 0.8804 0.8804 0.8887 0.8887 0.9902 0.9902 1.0433 1.0433 3.8425 3.8425 4.3592 4.3592 4.3719 4.3719 6.1291 6.1291 6.6543 6.6543 7.1112 7.1112 7.9487 7.9487 8.6166 8.6166 9.0640 9.0640 k = 0.4839 0.2568 0.0400 ( 8790 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4693 -25.4693 -25.3985 -25.3985 -11.0660 -11.0660 -11.0474 -11.0474 -10.6559 -10.6559 -10.0412 -10.0412 -9.9716 -9.9716 -9.8214 -9.8214 -9.7851 -9.7851 -9.7172 -9.7172 -9.2906 -9.2906 -9.1989 -9.1989 -9.1560 -9.1560 -9.0444 -9.0444 -9.0110 -9.0110 -8.7262 -8.7262 -8.6280 -8.6280 0.4430 0.4430 0.4785 0.4785 0.8775 0.8775 0.8892 0.8892 0.9888 0.9888 1.0426 1.0426 3.8425 3.8425 4.3543 4.3543 4.3691 4.3691 6.1360 6.1360 6.6635 6.6635 7.1183 7.1183 7.9520 7.9520 8.6231 8.6231 9.0687 9.0687 k = 0.4758 0.2751 0.0600 ( 8794 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4691 -25.4691 -25.3987 -25.3987 -11.0661 -11.0661 -11.0481 -11.0481 -10.6602 -10.6602 -10.0407 -10.0407 -9.9716 -9.9716 -9.8208 -9.8208 -9.7850 -9.7850 -9.7166 -9.7166 -9.2906 -9.2906 -9.2014 -9.2014 -9.1561 -9.1561 -9.0428 -9.0428 -9.0107 -9.0107 -8.7230 -8.7230 -8.6249 -8.6249 0.4417 0.4417 0.4762 0.4762 0.8736 0.8736 0.8891 0.8891 0.9867 0.9867 1.0414 1.0414 3.8426 3.8426 4.3444 4.3444 4.3662 4.3662 6.1475 6.1475 6.6786 6.6786 7.1302 7.1302 7.9577 7.9577 8.6341 8.6341 9.0766 9.0766 k = 0.4677 0.2934 0.0800 ( 8795 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4688 -25.4688 -25.3990 -25.3990 -11.0664 -11.0664 -11.0491 -11.0491 -10.6662 -10.6662 -10.0400 -10.0400 -9.9716 -9.9716 -9.8199 -9.8199 -9.7850 -9.7850 -9.7158 -9.7158 -9.2905 -9.2905 -9.2046 -9.2046 -9.1562 -9.1562 -9.0407 -9.0407 -9.0104 -9.0104 -8.7191 -8.7191 -8.6201 -8.6201 0.4398 0.4398 0.4730 0.4730 0.8689 0.8689 0.8881 0.8881 0.9839 0.9839 1.0398 1.0398 3.8426 3.8426 4.3297 4.3297 4.3635 4.3635 6.1635 6.1635 6.6993 6.6993 7.1470 7.1470 7.9655 7.9655 8.6493 8.6493 9.0875 9.0875 k = 0.4597 0.3117 0.1001 ( 8805 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4683 -25.4683 -25.3994 -25.3994 -11.0666 -11.0666 -11.0504 -11.0504 -10.6736 -10.6736 -10.0391 -10.0391 -9.9716 -9.9716 -9.8187 -9.8187 -9.7850 -9.7850 -9.7147 -9.7147 -9.2906 -9.2906 -9.2083 -9.2083 -9.1563 -9.1563 -9.0384 -9.0384 -9.0100 -9.0100 -8.7150 -8.7150 -8.6132 -8.6132 0.4374 0.4374 0.4689 0.4689 0.8636 0.8636 0.8861 0.8861 0.9806 0.9806 1.0378 1.0378 3.8426 3.8426 4.3105 4.3105 4.3605 4.3605 6.1840 6.1840 6.7253 6.7253 7.1687 7.1687 7.9755 7.9755 8.6689 8.6689 9.1013 9.1013 k = 0.4516 0.3300 0.1201 ( 8797 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4678 -25.4678 -25.3999 -25.3999 -11.0670 -11.0670 -11.0519 -11.0519 -10.6824 -10.6824 -10.0381 -10.0381 -9.9716 -9.9716 -9.8174 -9.8174 -9.7849 -9.7849 -9.7134 -9.7134 -9.2907 -9.2907 -9.2122 -9.2122 -9.1565 -9.1565 -9.0359 -9.0359 -9.0095 -9.0095 -8.7113 -8.7113 -8.6039 -8.6039 0.4344 0.4344 0.4639 0.4639 0.8578 0.8578 0.8831 0.8831 0.9770 0.9770 1.0353 1.0353 3.8426 3.8426 4.2874 4.2874 4.3573 4.3573 6.2088 6.2088 6.7560 6.7560 7.1955 7.1955 7.9877 7.9877 8.6926 8.6926 9.1180 9.1180 k = 0.4436 0.3483 0.1401 ( 8795 PWs) bands (ev): -26.2998 -26.2998 -26.2997 -26.2997 -25.4672 -25.4672 -25.4005 -25.4005 -11.0674 -11.0674 -11.0537 -11.0537 -10.6925 -10.6925 -10.0369 -10.0369 -9.9715 -9.9715 -9.8159 -9.8159 -9.7848 -9.7848 -9.7119 -9.7119 -9.2910 -9.2910 -9.2161 -9.2161 -9.1567 -9.1567 -9.0334 -9.0334 -9.0091 -9.0091 -8.7083 -8.7083 -8.5919 -8.5919 0.4308 0.4308 0.4581 0.4581 0.8515 0.8515 0.8789 0.8789 0.9734 0.9734 1.0326 1.0326 3.8425 3.8425 4.2609 4.2609 4.3537 4.3537 6.2380 6.2380 6.7909 6.7909 7.2274 7.2274 8.0019 8.0019 8.7204 8.7204 9.1374 9.1374 k = 0.4355 0.3666 0.1601 ( 8795 PWs) bands (ev): -26.2998 -26.2998 -26.2997 -26.2997 -25.4665 -25.4665 -25.4011 -25.4011 -11.0678 -11.0678 -11.0556 -11.0556 -10.7037 -10.7037 -10.0357 -10.0357 -9.9714 -9.9714 -9.8142 -9.8142 -9.7847 -9.7847 -9.7102 -9.7102 -9.2916 -9.2916 -9.2198 -9.2198 -9.1570 -9.1570 -9.0310 -9.0310 -9.0086 -9.0086 -8.7064 -8.7064 -8.5773 -8.5773 0.4265 0.4265 0.4515 0.4515 0.8448 0.8448 0.8738 0.8738 0.9698 0.9698 1.0295 1.0295 3.8423 3.8423 4.2312 4.2312 4.3497 4.3497 6.2713 6.2713 6.8291 6.8291 7.2646 7.2646 8.0182 8.0182 8.7523 8.7523 9.1593 9.1593 k = 0.4274 0.3850 0.1801 ( 8809 PWs) bands (ev): -26.2998 -26.2998 -26.2996 -26.2996 -25.4658 -25.4658 -25.4018 -25.4018 -11.0683 -11.0683 -11.0578 -11.0578 -10.7157 -10.7157 -10.0343 -10.0343 -9.9714 -9.9714 -9.8124 -9.8124 -9.7846 -9.7846 -9.7083 -9.7083 -9.2924 -9.2924 -9.2230 -9.2230 -9.1574 -9.1574 -9.0286 -9.0286 -9.0081 -9.0081 -8.7054 -8.7054 -8.5603 -8.5603 0.4215 0.4215 0.4441 0.4441 0.8378 0.8378 0.8678 0.8678 0.9663 0.9663 1.0263 1.0263 3.8419 3.8419 4.1988 4.1988 4.3454 4.3454 6.3086 6.3086 6.8700 6.8700 7.3072 7.3072 8.0363 8.0363 8.7880 8.7880 9.1835 9.1835 k = 0.4194 0.4033 0.2001 ( 8811 PWs) bands (ev): -26.2997 -26.2997 -26.2996 -26.2996 -25.4649 -25.4649 -25.4027 -25.4027 -11.0688 -11.0688 -11.0602 -11.0602 -10.7286 -10.7286 -10.0329 -10.0329 -9.9713 -9.9713 -9.8105 -9.8105 -9.7844 -9.7844 -9.7062 -9.7062 -9.2936 -9.2936 -9.2258 -9.2258 -9.1577 -9.1577 -9.0264 -9.0264 -9.0076 -9.0076 -8.7053 -8.7053 -8.5412 -8.5412 0.4158 0.4158 0.4362 0.4362 0.8304 0.8304 0.8611 0.8611 0.9630 0.9630 1.0228 1.0228 3.8414 3.8414 4.1642 4.1642 4.3408 4.3408 6.3499 6.3499 6.9128 6.9128 7.3552 7.3552 8.0564 8.0564 8.8274 8.8274 9.2099 9.2099 k = 0.4113 0.4216 0.2201 ( 8817 PWs) bands (ev): -26.2997 -26.2997 -26.2996 -26.2996 -25.4640 -25.4640 -25.4035 -25.4035 -11.0694 -11.0694 -11.0628 -11.0628 -10.7420 -10.7420 -10.0314 -10.0314 -9.9711 -9.9711 -9.8085 -9.8085 -9.7843 -9.7843 -9.7040 -9.7040 -9.2951 -9.2951 -9.2279 -9.2279 -9.1582 -9.1582 -9.0242 -9.0242 -9.0072 -9.0072 -8.7060 -8.7060 -8.5204 -8.5204 0.4093 0.4093 0.4278 0.4278 0.8229 0.8229 0.8540 0.8540 0.9598 0.9598 1.0193 1.0193 3.8408 3.8408 4.1277 4.1277 4.3359 4.3359 6.3948 6.3948 6.9568 6.9568 7.4088 7.4088 8.0784 8.0784 8.8703 8.8703 9.2382 9.2382 k = 0.4032 0.4399 0.2401 ( 8807 PWs) bands (ev): -26.2996 -26.2996 -26.2996 -26.2996 -25.4630 -25.4630 -25.4045 -25.4045 -11.0700 -11.0700 -11.0654 -11.0654 -10.7558 -10.7558 -10.0298 -10.0298 -9.9710 -9.9710 -9.8065 -9.8065 -9.7841 -9.7841 -9.7017 -9.7017 -9.2970 -9.2970 -9.2295 -9.2295 -9.1587 -9.1587 -9.0221 -9.0221 -9.0068 -9.0068 -8.7074 -8.7074 -8.4983 -8.4983 0.4020 0.4020 0.4191 0.4191 0.8152 0.8152 0.8466 0.8466 0.9567 0.9567 1.0158 1.0158 3.8399 3.8399 4.0897 4.0897 4.3309 4.3309 6.4432 6.4432 7.0011 7.0011 7.4676 7.4676 8.1023 8.1023 8.9165 8.9165 9.2587 9.2587 k = 0.3952 0.4582 0.2601 ( 8795 PWs) bands (ev): -26.2996 -26.2996 -26.2995 -26.2995 -25.4619 -25.4619 -25.4055 -25.4055 -11.0707 -11.0707 -11.0681 -11.0681 -10.7698 -10.7698 -10.0283 -10.0283 -9.9708 -9.9708 -9.8045 -9.8045 -9.7838 -9.7838 -9.6992 -9.6992 -9.2992 -9.2992 -9.2303 -9.2303 -9.1592 -9.1592 -9.0201 -9.0201 -9.0065 -9.0065 -8.7092 -8.7092 -8.4752 -8.4752 0.3937 0.3937 0.4104 0.4104 0.8073 0.8073 0.8391 0.8391 0.9537 0.9537 1.0122 1.0122 3.8389 3.8389 4.0508 4.0508 4.3256 4.3256 6.4949 6.4949 7.0452 7.0452 7.5315 7.5315 8.1279 8.1279 8.9655 8.9655 9.2393 9.2393 k = 0.3871 0.4765 0.2802 ( 8799 PWs) bands (ev): -26.2995 -26.2995 -26.2995 -26.2995 -25.4607 -25.4607 -25.4067 -25.4067 -11.0719 -11.0719 -11.0705 -11.0705 -10.7839 -10.7839 -10.0267 -10.0267 -9.9706 -9.9706 -9.8025 -9.8025 -9.7836 -9.7836 -9.6966 -9.6966 -9.3017 -9.3017 -9.2307 -9.2307 -9.1598 -9.1598 -9.0181 -9.0181 -9.0062 -9.0062 -8.7115 -8.7115 -8.4516 -8.4516 0.3845 0.3845 0.4017 0.4017 0.7995 0.7995 0.8317 0.8317 0.9507 0.9507 1.0088 1.0088 3.8377 3.8377 4.0113 4.0113 4.3203 4.3203 6.5497 6.5497 7.0884 7.0884 7.6001 7.6001 8.1554 8.1554 9.0171 9.0171 9.2216 9.2216 k = 0.3791 0.4949 0.3002 ( 8791 PWs) bands (ev): -26.2995 -26.2995 -26.2994 -26.2994 -25.4595 -25.4595 -25.4078 -25.4078 -11.0744 -11.0744 -11.0716 -11.0716 -10.7980 -10.7980 -10.0251 -10.0251 -9.9704 -9.9704 -9.8005 -9.8005 -9.7833 -9.7833 -9.6940 -9.6940 -9.3044 -9.3044 -9.2305 -9.2305 -9.1605 -9.1605 -9.0162 -9.0162 -9.0060 -9.0060 -8.7141 -8.7141 -8.4277 -8.4277 0.3744 0.3744 0.3932 0.3932 0.7918 0.7918 0.8246 0.8246 0.9477 0.9477 1.0055 1.0055 3.8364 3.8364 3.9717 3.9717 4.3149 4.3149 6.6073 6.6073 7.1302 7.1302 7.6727 7.6727 8.1848 8.1848 9.0708 9.0708 9.2059 9.2059 k = 0.3710 0.5132 0.3202 ( 8797 PWs) bands (ev): -26.2995 -26.2995 -26.2994 -26.2994 -25.4582 -25.4582 -25.4091 -25.4091 -11.0774 -11.0774 -11.0723 -11.0723 -10.8118 -10.8118 -10.0235 -10.0235 -9.9702 -9.9702 -9.7985 -9.7985 -9.7830 -9.7830 -9.6912 -9.6912 -9.3073 -9.3073 -9.2299 -9.2299 -9.1613 -9.1613 -9.0144 -9.0144 -9.0059 -9.0059 -8.7170 -8.7170 -8.4037 -8.4037 0.3637 0.3637 0.3848 0.3848 0.7842 0.7842 0.8178 0.8178 0.9446 0.9446 1.0024 1.0024 3.8348 3.8348 3.9323 3.9323 4.3096 4.3096 6.6675 6.6675 7.1701 7.1701 7.7487 7.7487 8.2161 8.2161 9.1256 9.1256 9.1922 9.1922 k = 0.3629 0.5315 0.3402 ( 8789 PWs) bands (ev): -26.2995 -26.2995 -26.2993 -26.2993 -25.4568 -25.4568 -25.4104 -25.4104 -11.0804 -11.0804 -11.0729 -11.0729 -10.8253 -10.8253 -10.0219 -10.0219 -9.9700 -9.9700 -9.7966 -9.7966 -9.7827 -9.7827 -9.6884 -9.6884 -9.3103 -9.3103 -9.2289 -9.2289 -9.1620 -9.1620 -9.0126 -9.0126 -9.0057 -9.0057 -8.7200 -8.7200 -8.3801 -8.3801 0.3526 0.3526 0.3767 0.3767 0.7768 0.7768 0.8114 0.8114 0.9415 0.9415 0.9995 0.9995 3.8331 3.8331 3.8936 3.8936 4.3043 4.3043 6.7300 6.7300 7.2077 7.2077 7.8273 7.8273 8.2494 8.2494 9.1726 9.1726 9.1889 9.1889 k = 0.3549 0.5498 0.3602 ( 8785 PWs) bands (ev): -26.2995 -26.2995 -26.2992 -26.2992 -25.4554 -25.4554 -25.4118 -25.4118 -11.0834 -11.0834 -11.0735 -11.0735 -10.8384 -10.8384 -10.0204 -10.0204 -9.9698 -9.9698 -9.7947 -9.7947 -9.7824 -9.7824 -9.6856 -9.6856 -9.3133 -9.3133 -9.2277 -9.2277 -9.1629 -9.1629 -9.0108 -9.0108 -9.0056 -9.0056 -8.7231 -8.7231 -8.3570 -8.3570 0.3414 0.3414 0.3688 0.3688 0.7698 0.7698 0.8053 0.8053 0.9383 0.9383 0.9969 0.9969 3.8308 3.8308 3.8564 3.8564 4.2991 4.2991 6.7945 6.7945 7.2426 7.2426 7.9075 7.9075 8.2848 8.2848 9.1670 9.1670 9.2393 9.2393 k = 0.3468 0.5681 0.3802 ( 8797 PWs) bands (ev): -26.2995 -26.2995 -26.2992 -26.2992 -25.4539 -25.4539 -25.4132 -25.4132 -11.0864 -11.0864 -11.0741 -11.0741 -10.8508 -10.8508 -10.0189 -10.0189 -9.9696 -9.9696 -9.7930 -9.7930 -9.7821 -9.7821 -9.6828 -9.6828 -9.3162 -9.3162 -9.2264 -9.2264 -9.1637 -9.1637 -9.0091 -9.0091 -9.0055 -9.0055 -8.7263 -8.7263 -8.3346 -8.3346 0.3302 0.3302 0.3611 0.3611 0.7630 0.7630 0.7998 0.7998 0.9350 0.9350 0.9946 0.9946 3.8164 3.8164 3.8326 3.8326 4.2942 4.2942 6.8607 6.8607 7.2741 7.2741 7.9884 7.9884 8.3225 8.3225 9.1574 9.1574 9.2934 9.2934 k = 0.3387 0.5864 0.4002 ( 8803 PWs) bands (ev): -26.2995 -26.2995 -26.2991 -26.2991 -25.4524 -25.4524 -25.4147 -25.4147 -11.0893 -11.0893 -11.0747 -11.0747 -10.8627 -10.8627 -10.0174 -10.0174 -9.9695 -9.9695 -9.7913 -9.7913 -9.7818 -9.7818 -9.6799 -9.6799 -9.3192 -9.3192 -9.2249 -9.2249 -9.1647 -9.1647 -9.0075 -9.0075 -9.0054 -9.0054 -8.7295 -8.7295 -8.3133 -8.3133 0.3192 0.3192 0.3538 0.3538 0.7566 0.7566 0.7947 0.7947 0.9316 0.9316 0.9926 0.9926 3.7829 3.7829 3.8295 3.8295 4.2894 4.2894 6.9282 6.9282 7.3020 7.3020 8.0689 8.0689 8.3625 8.3625 9.1480 9.1480 9.3449 9.3449 k = 0.3307 0.6047 0.4202 ( 8803 PWs) bands (ev): -26.2995 -26.2995 -26.2990 -26.2990 -25.4508 -25.4508 -25.4162 -25.4162 -11.0922 -11.0922 -11.0752 -11.0752 -10.8737 -10.8737 -10.0160 -10.0160 -9.9693 -9.9693 -9.7898 -9.7898 -9.7815 -9.7815 -9.6771 -9.6771 -9.3220 -9.3220 -9.2233 -9.2233 -9.1656 -9.1656 -9.0063 -9.0063 -9.0050 -9.0050 -8.7326 -8.7326 -8.2931 -8.2931 0.3087 0.3087 0.3468 0.3468 0.7506 0.7506 0.7900 0.7900 0.9282 0.9282 0.9909 0.9909 3.7501 3.7501 3.8276 3.8276 4.2849 4.2849 6.9968 6.9968 7.3257 7.3257 8.1480 8.1480 8.4050 8.4050 9.1383 9.1383 9.3918 9.3918 k = 0.3226 0.6231 0.4402 ( 8805 PWs) bands (ev): -26.2995 -26.2995 -26.2989 -26.2989 -25.4492 -25.4492 -25.4178 -25.4178 -11.0949 -11.0949 -11.0757 -11.0757 -10.8839 -10.8839 -10.0147 -10.0147 -9.9692 -9.9692 -9.7884 -9.7884 -9.7812 -9.7812 -9.6743 -9.6743 -9.3248 -9.3248 -9.2216 -9.2216 -9.1666 -9.1666 -9.0058 -9.0058 -9.0039 -9.0039 -8.7357 -8.7357 -8.2743 -8.2743 0.2988 0.2988 0.3403 0.3403 0.7449 0.7449 0.7859 0.7859 0.9246 0.9246 0.9896 0.9896 3.7194 3.7194 3.8261 3.8261 4.2807 4.2807 7.0661 7.0661 7.3449 7.3449 8.2244 8.2244 8.4499 8.4499 9.1276 9.1276 9.4320 9.4320 k = 0.3145 0.6414 0.4603 ( 8791 PWs) bands (ev): -26.2995 -26.2995 -26.2989 -26.2989 -25.4475 -25.4475 -25.4194 -25.4194 -11.0974 -11.0974 -11.0761 -11.0761 -10.8933 -10.8933 -10.0134 -10.0134 -9.9692 -9.9692 -9.7871 -9.7871 -9.7808 -9.7808 -9.6716 -9.6716 -9.3274 -9.3274 -9.2200 -9.2200 -9.1676 -9.1676 -9.0057 -9.0057 -9.0026 -9.0026 -8.7385 -8.7385 -8.2570 -8.2570 0.2897 0.2897 0.3344 0.3344 0.7396 0.7396 0.7824 0.7824 0.9210 0.9210 0.9887 0.9887 3.6911 3.6911 3.8247 3.8247 4.2769 4.2769 7.1357 7.1357 7.3590 7.3590 8.2971 8.2971 8.4972 8.4972 9.1154 9.1154 9.4637 9.4637 k = 0.3065 0.6597 0.4803 ( 8785 PWs) bands (ev): -26.2995 -26.2995 -26.2988 -26.2988 -25.4458 -25.4458 -25.4210 -25.4210 -11.0997 -11.0997 -11.0764 -11.0764 -10.9016 -10.9016 -10.0122 -10.0122 -9.9691 -9.9691 -9.7860 -9.7860 -9.7805 -9.7805 -9.6689 -9.6689 -9.3299 -9.3299 -9.2184 -9.2184 -9.1687 -9.1687 -9.0056 -9.0056 -9.0013 -9.0013 -8.7412 -8.7412 -8.2413 -8.2413 0.2815 0.2815 0.3292 0.3292 0.7345 0.7345 0.7793 0.7793 0.9175 0.9175 0.9881 0.9881 3.6655 3.6655 3.8235 3.8235 4.2734 4.2734 7.2052 7.2052 7.3677 7.3677 8.3648 8.3648 8.5466 8.5466 9.1013 9.1013 9.4852 9.4852 k = 0.2984 0.6780 0.5003 ( 8789 PWs) bands (ev): -26.2995 -26.2995 -26.2987 -26.2987 -25.4441 -25.4441 -25.4227 -25.4227 -11.1018 -11.1018 -11.0768 -11.0768 -10.9090 -10.9090 -10.0110 -10.0110 -9.9692 -9.9692 -9.7850 -9.7850 -9.7802 -9.7802 -9.6663 -9.6663 -9.3323 -9.3323 -9.2169 -9.2169 -9.1698 -9.1698 -9.0056 -9.0056 -9.0001 -9.0001 -8.7436 -8.7436 -8.2275 -8.2275 0.2744 0.2744 0.3246 0.3246 0.7298 0.7298 0.7769 0.7769 0.9139 0.9139 0.9878 0.9878 3.6428 3.6428 3.8225 3.8225 4.2704 4.2704 7.2741 7.2741 7.3707 7.3707 8.4270 8.4270 8.5974 8.5974 9.0852 9.0852 9.4955 9.4955 k = 0.2904 0.6963 0.5203 ( 8791 PWs) bands (ev): -26.2996 -26.2996 -26.2987 -26.2987 -25.4423 -25.4423 -25.4245 -25.4245 -11.1037 -11.1037 -11.0770 -11.0770 -10.9154 -10.9154 -10.0100 -10.0100 -9.9693 -9.9693 -9.7843 -9.7843 -9.7798 -9.7798 -9.6638 -9.6638 -9.3345 -9.3345 -9.2154 -9.2154 -9.1708 -9.1708 -9.0056 -9.0056 -8.9991 -8.9991 -8.7457 -8.7457 -8.2157 -8.2157 0.2684 0.2684 0.3207 0.3207 0.7253 0.7253 0.7750 0.7750 0.9103 0.9103 0.9880 0.9880 3.6233 3.6233 3.8217 3.8217 4.2678 4.2678 7.3411 7.3411 7.3684 7.3684 8.4829 8.4829 8.6484 8.6484 9.0675 9.0675 9.4944 9.4944 k = 0.2823 0.7146 0.5403 ( 8789 PWs) bands (ev): -26.2996 -26.2996 -26.2986 -26.2986 -25.4406 -25.4406 -25.4262 -25.4262 -11.1053 -11.1053 -11.0772 -11.0772 -10.9208 -10.9208 -10.0090 -10.0090 -9.9694 -9.9694 -9.7837 -9.7837 -9.7794 -9.7794 -9.6613 -9.6613 -9.3365 -9.3365 -9.2141 -9.2141 -9.1719 -9.1719 -9.0056 -9.0056 -8.9982 -8.9982 -8.7475 -8.7475 -8.2058 -8.2058 0.2635 0.2635 0.3177 0.3177 0.7211 0.7211 0.7738 0.7738 0.9068 0.9068 0.9884 0.9884 3.6070 3.6070 3.8212 3.8212 4.2657 4.2657 7.3566 7.3566 7.4097 7.4097 8.5323 8.5323 8.6984 8.6984 9.0488 9.0488 9.4824 9.4824 k = 0.2742 0.7329 0.5603 ( 8777 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4388 -25.4388 -25.4280 -25.4280 -11.1065 -11.1065 -11.0773 -11.0773 -10.9251 -10.9251 -10.0081 -10.0081 -9.9696 -9.9696 -9.7833 -9.7833 -9.7791 -9.7791 -9.6590 -9.6590 -9.3384 -9.3384 -9.2128 -9.2128 -9.1730 -9.1730 -9.0056 -9.0056 -8.9976 -8.9976 -8.7489 -8.7489 -8.1981 -8.1981 0.2600 0.2600 0.3156 0.3156 0.7170 0.7170 0.7732 0.7732 0.9034 0.9034 0.9893 0.9893 3.5940 3.5940 3.8211 3.8211 4.2641 4.2641 7.3405 7.3405 7.4738 7.4738 8.5749 8.5749 8.7460 8.7460 9.0301 9.0301 9.4602 9.4602 k = 0.2742 0.7329 0.5603 ( 8777 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4388 -25.4388 -25.4280 -25.4280 -11.1065 -11.1065 -11.0773 -11.0773 -10.9251 -10.9251 -10.0081 -10.0081 -9.9696 -9.9696 -9.7833 -9.7833 -9.7791 -9.7791 -9.6590 -9.6590 -9.3384 -9.3384 -9.2128 -9.2128 -9.1730 -9.1730 -9.0056 -9.0056 -8.9976 -8.9976 -8.7489 -8.7489 -8.1981 -8.1981 0.2600 0.2600 0.3156 0.3156 0.7170 0.7170 0.7732 0.7732 0.9034 0.9034 0.9893 0.9893 3.5940 3.5940 3.8211 3.8211 4.2641 4.2641 7.3405 7.3405 7.4738 7.4738 8.5749 8.5749 8.7460 8.7460 9.0301 9.0301 9.4602 9.4602 k = 0.2468 0.7274 0.5663 ( 8791 PWs) bands (ev): -26.2996 -26.2996 -26.2985 -26.2985 -25.4382 -25.4382 -25.4285 -25.4285 -11.1067 -11.1067 -11.0774 -11.0774 -10.9261 -10.9261 -10.0078 -10.0078 -9.9697 -9.9697 -9.7832 -9.7832 -9.7790 -9.7790 -9.6583 -9.6583 -9.3390 -9.3390 -9.2125 -9.2125 -9.1734 -9.1734 -9.0056 -9.0056 -8.9974 -8.9974 -8.7493 -8.7493 -8.1962 -8.1962 0.2595 0.2595 0.3148 0.3148 0.7158 0.7158 0.7733 0.7733 0.9024 0.9024 0.9895 0.9895 3.5908 3.5908 3.8211 3.8211 4.2637 4.2637 7.3321 7.3321 7.4950 7.4950 8.5878 8.5878 8.7597 8.7597 9.0247 9.0247 9.4508 9.4508 k = 0.2194 0.7219 0.5723 ( 8795 PWs) bands (ev): -26.2997 -26.2997 -26.2985 -26.2985 -25.4377 -25.4377 -25.4290 -25.4290 -11.1067 -11.1067 -11.0778 -11.0778 -10.9271 -10.9271 -10.0075 -10.0075 -9.9698 -9.9698 -9.7831 -9.7831 -9.7790 -9.7790 -9.6577 -9.6577 -9.3395 -9.3395 -9.2121 -9.2121 -9.1738 -9.1738 -9.0055 -9.0055 -8.9973 -8.9973 -8.7496 -8.7496 -8.1945 -8.1945 0.2597 0.2597 0.3133 0.3133 0.7146 0.7146 0.7739 0.7739 0.9015 0.9015 0.9897 0.9897 3.5877 3.5877 3.8212 3.8212 4.2634 4.2634 7.3215 7.3215 7.5175 7.5175 8.6028 8.6028 8.7728 8.7728 9.0200 9.0200 9.4390 9.4390 k = 0.1920 0.7164 0.5784 ( 8792 PWs) bands (ev): -26.2997 -26.2997 -26.2985 -26.2985 -25.4372 -25.4372 -25.4296 -25.4296 -11.1065 -11.1065 -11.0784 -11.0784 -10.9279 -10.9279 -10.0071 -10.0071 -9.9700 -9.9700 -9.7829 -9.7829 -9.7790 -9.7790 -9.6570 -9.6570 -9.3399 -9.3399 -9.2117 -9.2117 -9.1743 -9.1743 -9.0055 -9.0055 -8.9973 -8.9973 -8.7499 -8.7499 -8.1930 -8.1930 0.2607 0.2607 0.3111 0.3111 0.7134 0.7134 0.7748 0.7748 0.9006 0.9006 0.9897 0.9897 3.5849 3.5849 3.8213 3.8213 4.2631 4.2631 7.3109 7.3109 7.5391 7.5391 8.6196 8.6196 8.7847 8.7847 9.0163 9.0163 9.4251 9.4251 k = 0.1645 0.7109 0.5844 ( 8788 PWs) bands (ev): -26.2997 -26.2997 -26.2984 -26.2984 -25.4366 -25.4366 -25.4301 -25.4301 -11.1061 -11.1061 -11.0792 -11.0792 -10.9286 -10.9286 -10.0068 -10.0068 -9.9701 -9.9701 -9.7826 -9.7826 -9.7791 -9.7791 -9.6564 -9.6564 -9.3403 -9.3403 -9.2114 -9.2114 -9.1747 -9.1747 -9.0054 -9.0054 -8.9972 -8.9972 -8.7502 -8.7502 -8.1918 -8.1918 0.2623 0.2623 0.3083 0.3083 0.7123 0.7123 0.7759 0.7759 0.8998 0.8998 0.9896 0.9896 3.5823 3.5823 3.8214 3.8214 4.2629 4.2629 7.3013 7.3013 7.5584 7.5584 8.6375 8.6375 8.7951 8.7951 9.0140 9.0140 9.4099 9.4099 k = 0.1371 0.7054 0.5904 ( 8779 PWs) bands (ev): -26.2997 -26.2997 -26.2984 -26.2984 -25.4361 -25.4361 -25.4306 -25.4306 -11.1055 -11.1055 -11.0802 -11.0802 -10.9291 -10.9291 -10.0064 -10.0064 -9.9703 -9.9703 -9.7823 -9.7823 -9.7792 -9.7792 -9.6559 -9.6559 -9.3406 -9.3406 -9.2110 -9.2110 -9.1752 -9.1752 -9.0053 -9.0053 -8.9973 -8.9973 -8.7504 -8.7504 -8.1907 -8.1907 0.2645 0.2645 0.3050 0.3050 0.7114 0.7114 0.7770 0.7770 0.8992 0.8992 0.9894 0.9894 3.5801 3.5801 3.8216 3.8216 4.2627 4.2627 7.2931 7.2931 7.5750 7.5750 8.6559 8.6559 8.8035 8.8035 9.0134 9.0134 9.3940 9.3940 k = 0.1097 0.6999 0.5964 ( 8784 PWs) bands (ev): -26.2997 -26.2997 -26.2984 -26.2984 -25.4355 -25.4355 -25.4312 -25.4312 -11.1048 -11.1048 -11.0812 -11.0812 -10.9295 -10.9295 -10.0061 -10.0061 -9.9704 -9.9704 -9.7820 -9.7820 -9.7793 -9.7793 -9.6555 -9.6555 -9.3408 -9.3408 -9.2108 -9.2108 -9.1757 -9.1757 -9.0053 -9.0053 -8.9973 -8.9973 -8.7505 -8.7505 -8.1898 -8.1898 0.2674 0.2674 0.3012 0.3012 0.7106 0.7106 0.7782 0.7782 0.8986 0.8986 0.9891 0.9891 3.5781 3.5781 3.8217 3.8217 4.2626 4.2626 7.2864 7.2864 7.5886 7.5886 8.6738 8.6738 8.8096 8.8096 9.0141 9.0141 9.3785 9.3785 k = 0.0823 0.6944 0.6024 ( 8795 PWs) bands (ev): -26.2998 -26.2998 -26.2984 -26.2984 -25.4350 -25.4350 -25.4317 -25.4317 -11.1041 -11.1041 -11.0822 -11.0822 -10.9298 -10.9298 -10.0058 -10.0058 -9.9705 -9.9705 -9.7817 -9.7817 -9.7795 -9.7795 -9.6552 -9.6552 -9.3410 -9.3410 -9.2105 -9.2105 -9.1761 -9.1761 -9.0052 -9.0052 -8.9973 -8.9973 -8.7507 -8.7507 -8.1891 -8.1891 0.2707 0.2707 0.2970 0.2970 0.7100 0.7100 0.7792 0.7792 0.8982 0.8982 0.9889 0.9889 3.5766 3.5766 3.8218 3.8218 4.2625 4.2625 7.2812 7.2812 7.5992 7.5992 8.6900 8.6900 8.8134 8.8134 9.0158 9.0158 9.3644 9.3644 k = 0.0548 0.6889 0.6084 ( 8795 PWs) bands (ev): -26.2998 -26.2998 -26.2984 -26.2984 -25.4345 -25.4345 -25.4322 -25.4322 -11.1034 -11.1034 -11.0830 -11.0830 -10.9301 -10.9301 -10.0056 -10.0056 -9.9706 -9.9706 -9.7814 -9.7814 -9.7798 -9.7798 -9.6549 -9.6549 -9.3411 -9.3411 -9.2104 -9.2104 -9.1763 -9.1763 -9.0051 -9.0051 -8.9974 -8.9974 -8.7508 -8.7508 -8.1886 -8.1886 0.2744 0.2744 0.2927 0.2927 0.7096 0.7096 0.7800 0.7800 0.8979 0.8979 0.9886 0.9886 3.5755 3.5755 3.8219 3.8219 4.2624 4.2624 7.2776 7.2776 7.6068 7.6068 8.7032 8.7032 8.8153 8.8153 9.0179 9.0179 9.3532 9.3532 k = 0.0274 0.6834 0.6144 ( 8790 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4340 -25.4340 -25.4328 -25.4328 -11.1030 -11.1030 -11.0836 -11.0836 -10.9302 -10.9302 -10.0055 -10.0055 -9.9707 -9.9707 -9.7811 -9.7811 -9.7800 -9.7800 -9.6548 -9.6548 -9.3412 -9.3412 -9.2102 -9.2102 -9.1765 -9.1765 -9.0051 -9.0051 -8.9974 -8.9974 -8.7508 -8.7508 -8.1883 -8.1883 0.2783 0.2783 0.2884 0.2884 0.7094 0.7094 0.7805 0.7805 0.8977 0.8977 0.9885 0.9885 3.5748 3.5748 3.8219 3.8219 4.2623 4.2623 7.2754 7.2754 7.6113 7.6113 8.7119 8.7119 8.8159 8.8159 9.0196 9.0196 9.3458 9.3458 k = 0.0000 0.6779 0.6204 ( 8796 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1028 -11.1028 -11.0838 -11.0838 -10.9302 -10.9302 -10.0054 -10.0054 -9.9707 -9.9707 -9.7810 -9.7810 -9.7801 -9.7801 -9.6547 -9.6547 -9.3412 -9.3412 -9.2102 -9.2102 -9.1766 -9.1766 -9.0051 -9.0051 -8.9974 -8.9974 -8.7508 -8.7508 -8.1882 -8.1882 0.2808 0.2808 0.2857 0.2857 0.7093 0.7093 0.7807 0.7807 0.8977 0.8977 0.9884 0.9884 3.5746 3.5746 3.8219 3.8219 4.2623 4.2623 7.2747 7.2747 7.6128 7.6128 8.7150 8.7150 8.8160 8.8160 9.0202 9.0202 9.3433 9.3433 k = 0.0000 0.6779 0.6204 ( 8796 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1028 -11.1028 -11.0838 -11.0838 -10.9302 -10.9302 -10.0054 -10.0054 -9.9707 -9.9707 -9.7810 -9.7810 -9.7801 -9.7801 -9.6547 -9.6547 -9.3412 -9.3412 -9.2102 -9.2102 -9.1766 -9.1766 -9.0051 -9.0051 -8.9974 -8.9974 -8.7508 -8.7508 -8.1882 -8.1882 0.2808 0.2808 0.2857 0.2857 0.7093 0.7093 0.7807 0.7807 0.8977 0.8977 0.9884 0.9884 3.5746 3.5746 3.8219 3.8219 4.2623 4.2623 7.2747 7.2747 7.6128 7.6128 8.7150 8.7150 8.8160 8.8160 9.0202 9.0202 9.3433 9.3433 k = 0.0081 0.6596 0.6405 ( 8800 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1028 -11.1028 -11.0837 -11.0837 -10.9308 -10.9308 -10.0055 -10.0055 -9.9709 -9.9709 -9.7810 -9.7810 -9.7802 -9.7802 -9.6547 -9.6547 -9.3415 -9.3415 -9.2110 -9.2110 -9.1759 -9.1759 -9.0072 -9.0072 -8.9951 -8.9951 -8.7499 -8.7499 -8.1879 -8.1879 0.2809 0.2809 0.2862 0.2862 0.7093 0.7093 0.7806 0.7806 0.8976 0.8976 0.9881 0.9881 3.5743 3.5743 3.8215 3.8215 4.2601 4.2601 7.2769 7.2769 7.6136 7.6136 8.7151 8.7151 8.8171 8.8171 9.0162 9.0162 9.3414 9.3414 k = 0.0161 0.6413 0.6605 ( 8794 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1027 -11.1027 -11.0836 -11.0836 -10.9326 -10.9326 -10.0057 -10.0057 -9.9713 -9.9713 -9.7813 -9.7813 -9.7806 -9.7806 -9.6546 -9.6546 -9.3421 -9.3421 -9.2133 -9.2133 -9.1740 -9.1740 -9.0109 -9.0109 -8.9906 -8.9906 -8.7470 -8.7470 -8.1868 -8.1868 0.2812 0.2812 0.2876 0.2876 0.7091 0.7091 0.7803 0.7803 0.8973 0.8973 0.9872 0.9872 3.5736 3.5736 3.8204 3.8204 4.2534 4.2534 7.2836 7.2836 7.6160 7.6160 8.7154 8.7154 8.8203 8.8203 9.0047 9.0047 9.3358 9.3358 k = 0.0242 0.6230 0.6805 ( 8794 PWs) bands (ev): -26.2998 -26.2998 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1027 -11.1027 -11.0833 -11.0833 -10.9354 -10.9354 -10.0060 -10.0060 -9.9720 -9.9720 -9.7819 -9.7819 -9.7811 -9.7811 -9.6544 -9.6544 -9.3433 -9.3433 -9.2166 -9.2166 -9.1713 -9.1713 -9.0147 -9.0147 -8.9855 -8.9855 -8.7422 -8.7422 -8.1849 -8.1849 0.2818 0.2818 0.2897 0.2897 0.7089 0.7089 0.7799 0.7799 0.8967 0.8967 0.9857 0.9857 3.5724 3.5724 3.8185 3.8185 4.2423 4.2423 7.2948 7.2948 7.6201 7.6201 8.7158 8.7158 8.8250 8.8250 8.9875 8.9875 9.3272 9.3272 k = 0.0323 0.6046 0.7005 ( 8796 PWs) bands (ev): -26.2997 -26.2997 -26.2983 -26.2983 -25.4336 -25.4336 -25.4331 -25.4331 -11.1026 -11.1026 -11.0829 -11.0829 -10.9393 -10.9393 -10.0064 -10.0064 -9.9730 -9.9730 -9.7828 -9.7828 -9.7817 -9.7817 -9.6542 -9.6542 -9.3448 -9.3448 -9.2206 -9.2206 -9.1682 -9.1682 -9.0184 -9.0184 -8.9800 -8.9800 -8.7358 -8.7358 -8.1823 -8.1823 0.2829 0.2829 0.2925 0.2925 0.7086 0.7086 0.7794 0.7794 0.8960 0.8960 0.9837 0.9837 3.5708 3.5708 3.8158 3.8158 4.2270 4.2270 7.3102 7.3102 7.6257 7.6257 8.7160 8.7160 8.8299 8.8299 8.9672 8.9672 9.3162 9.3162 k = 0.0403 0.5863 0.7205 ( 8798 PWs) bands (ev): -26.2997 -26.2997 -26.2983 -26.2983 -25.4335 -25.4335 -25.4331 -25.4331 -11.1027 -11.1027 -11.0824 -11.0824 -10.9441 -10.9441 -10.0069 -10.0069 -9.9742 -9.9742 -9.7841 -9.7841 -9.7823 -9.7823 -9.6539 -9.6539 -9.3466 -9.3466 -9.2249 -9.2249 -9.1650 -9.1650 -9.0219 -9.0219 -8.9743 -8.9743 -8.7277 -8.7277 -8.1789 -8.1789 0.2843 0.2843 0.2958 0.2958 0.7081 0.7081 0.7788 0.7788 0.8951 0.8951 0.9812 0.9812 3.5687 3.5687 3.8124 3.8124 4.2077 4.2077 7.3297 7.3297 7.6327 7.6327 8.7157 8.7157 8.8320 8.8320 8.9481 8.9481 9.3038 9.3038 k = 0.0484 0.5680 0.7405 ( 8800 PWs) bands (ev): -26.2997 -26.2997 -26.2983 -26.2983 -25.4335 -25.4335 -25.4331 -25.4331 -11.1029 -11.1029 -11.0818 -11.0818 -10.9497 -10.9497 -10.0075 -10.0075 -9.9757 -9.9757 -9.7857 -9.7857 -9.7831 -9.7831 -9.6536 -9.6536 -9.3487 -9.3487 -9.2295 -9.2295 -9.1618 -9.1618 -9.0252 -9.0252 -8.9683 -8.9683 -8.7182 -8.7182 -8.1748 -8.1748 0.2862 0.2862 0.2997 0.2997 0.7074 0.7074 0.7783 0.7783 0.8939 0.8939 0.9783 0.9783 3.5661 3.5661 3.8084 3.8084 4.1847 4.1847 7.3532 7.3532 7.6410 7.6410 8.7145 8.7145 8.8259 8.8259 8.9366 8.9366 9.2910 9.2910 k = 0.0565 0.5497 0.7605 ( 8812 PWs) bands (ev): -26.2997 -26.2997 -26.2983 -26.2983 -25.4335 -25.4335 -25.4330 -25.4330 -11.1033 -11.1033 -11.0811 -11.0811 -10.9559 -10.9559 -10.0082 -10.0082 -9.9775 -9.9775 -9.7875 -9.7875 -9.7839 -9.7839 -9.6532 -9.6532 -9.3511 -9.3511 -9.2342 -9.2342 -9.1587 -9.1587 -9.0284 -9.0284 -8.9621 -8.9621 -8.7075 -8.7075 -8.1698 -8.1698 0.2884 0.2884 0.3040 0.3040 0.7064 0.7064 0.7778 0.7778 0.8926 0.8926 0.9750 0.9750 3.5632 3.5632 3.8037 3.8037 4.1583 4.1583 7.3803 7.3803 7.6505 7.6505 8.7120 8.7120 8.8077 8.8077 8.9372 8.9372 9.2786 9.2786 k = 0.0645 0.5314 0.7806 ( 8820 PWs) bands (ev): -26.2996 -26.2996 -26.2983 -26.2983 -25.4334 -25.4334 -25.4330 -25.4330 -11.1041 -11.1041 -11.0803 -11.0803 -10.9623 -10.9623 -10.0090 -10.0090 -9.9794 -9.9794 -9.7896 -9.7896 -9.7849 -9.7849 -9.6527 -9.6527 -9.3536 -9.3536 -9.2390 -9.2390 -9.1558 -9.1558 -9.0313 -9.0313 -8.9558 -8.9558 -8.6958 -8.6958 -8.1641 -8.1641 0.2909 0.2909 0.3087 0.3087 0.7051 0.7051 0.7776 0.7776 0.8910 0.8910 0.9714 0.9714 3.5598 3.5598 3.7984 3.7984 4.1287 4.1287 7.4108 7.4108 7.6610 7.6610 8.7077 8.7077 8.7798 8.7798 8.9477 8.9477 9.2673 9.2673 k = 0.0726 0.5131 0.8006 ( 8810 PWs) bands (ev): -26.2996 -26.2996 -26.2983 -26.2983 -25.4334 -25.4334 -25.4330 -25.4330 -11.1054 -11.1054 -11.0794 -11.0794 -10.9690 -10.9690 -10.0099 -10.0099 -9.9816 -9.9816 -9.7918 -9.7918 -9.7859 -9.7859 -9.6522 -9.6522 -9.3561 -9.3561 -9.2438 -9.2438 -9.1531 -9.1531 -9.0341 -9.0341 -8.9493 -8.9493 -8.6833 -8.6833 -8.1575 -8.1575 0.2937 0.2937 0.3137 0.3137 0.7036 0.7036 0.7776 0.7776 0.8893 0.8893 0.9677 0.9677 3.5561 3.5561 3.7926 3.7926 4.0965 4.0965 7.4442 7.4442 7.6724 7.6724 8.7012 8.7012 8.7467 8.7467 8.9635 8.9635 9.2579 9.2579 k = 0.0806 0.4947 0.8206 ( 8810 PWs) bands (ev): -26.2995 -26.2995 -26.2982 -26.2982 -25.4334 -25.4334 -25.4330 -25.4330 -11.1074 -11.1074 -11.0784 -11.0784 -10.9754 -10.9754 -10.0109 -10.0109 -9.9839 -9.9839 -9.7943 -9.7943 -9.7871 -9.7871 -9.6517 -9.6517 -9.3588 -9.3588 -9.2485 -9.2485 -9.1506 -9.1506 -9.0367 -9.0367 -8.9428 -8.9428 -8.6704 -8.6704 -8.1500 -8.1500 0.2967 0.2967 0.3190 0.3190 0.7018 0.7018 0.7780 0.7780 0.8873 0.8873 0.9638 0.9638 3.5520 3.5520 3.7862 3.7862 4.0619 4.0619 7.4802 7.4802 7.6846 7.6846 8.6918 8.6918 8.7110 8.7110 8.9807 8.9807 9.2508 9.2508 k = 0.0887 0.4764 0.8406 ( 8808 PWs) bands (ev): -26.2995 -26.2995 -26.2982 -26.2982 -25.4333 -25.4333 -25.4329 -25.4329 -11.1101 -11.1101 -11.0774 -11.0774 -10.9814 -10.9814 -10.0120 -10.0120 -9.9864 -9.9864 -9.7969 -9.7969 -9.7883 -9.7883 -9.6511 -9.6511 -9.3614 -9.3614 -9.2531 -9.2531 -9.1484 -9.1484 -9.0391 -9.0391 -8.9362 -8.9362 -8.6571 -8.6571 -8.1418 -8.1418 0.2998 0.2998 0.3245 0.3245 0.6997 0.6997 0.7787 0.7787 0.8852 0.8852 0.9599 0.9599 3.5476 3.5476 3.7795 3.7795 4.0254 4.0254 7.5182 7.5182 7.6973 7.6973 8.6733 8.6733 8.6802 8.6802 8.9957 8.9957 9.2463 9.2463 k = 0.0968 0.4581 0.8606 ( 8816 PWs) bands (ev): -26.2995 -26.2995 -26.2982 -26.2982 -25.4333 -25.4333 -25.4329 -25.4329 -11.1138 -11.1138 -11.0764 -11.0764 -10.9868 -10.9868 -10.0131 -10.0131 -9.9890 -9.9890 -9.7996 -9.7996 -9.7896 -9.7896 -9.6506 -9.6506 -9.3640 -9.3640 -9.2577 -9.2577 -9.1464 -9.1464 -9.0413 -9.0413 -8.9296 -8.9296 -8.6438 -8.6438 -8.1327 -8.1327 0.3030 0.3030 0.3300 0.3300 0.6975 0.6975 0.7797 0.7797 0.8830 0.8830 0.9559 0.9559 3.5430 3.5430 3.7724 3.7724 3.9875 3.9875 7.5577 7.5577 7.7105 7.7105 8.6364 8.6364 8.6642 8.6642 9.0040 9.0040 9.2444 9.2444 k = 0.1048 0.4398 0.8806 ( 8826 PWs) bands (ev): -26.2994 -26.2994 -26.2982 -26.2982 -25.4332 -25.4332 -25.4329 -25.4329 -11.1184 -11.1184 -11.0753 -11.0753 -10.9913 -10.9913 -10.0143 -10.0143 -9.9917 -9.9917 -9.8025 -9.8025 -9.7910 -9.7910 -9.6500 -9.6500 -9.3666 -9.3666 -9.2621 -9.2621 -9.1446 -9.1446 -9.0434 -9.0434 -8.9231 -8.9231 -8.6305 -8.6305 -8.1229 -8.1229 0.3061 0.3061 0.3356 0.3356 0.6952 0.6952 0.7811 0.7811 0.8806 0.8806 0.9520 0.9520 3.5382 3.5382 3.7650 3.7650 3.9485 3.9485 7.5981 7.5981 7.7239 7.7239 8.5992 8.5992 8.6452 8.6452 9.0024 9.0024 9.2449 9.2449 k = 0.1129 0.4215 0.9006 ( 8830 PWs) bands (ev): -26.2994 -26.2994 -26.2982 -26.2982 -25.4332 -25.4332 -25.4329 -25.4329 -11.1241 -11.1241 -11.0741 -11.0741 -10.9949 -10.9949 -10.0156 -10.0156 -9.9945 -9.9945 -9.8054 -9.8054 -9.7924 -9.7924 -9.6493 -9.6493 -9.3690 -9.3690 -9.2664 -9.2664 -9.1430 -9.1430 -9.0453 -9.0453 -8.9167 -8.9167 -8.6177 -8.6177 -8.1124 -8.1124 0.3093 0.3093 0.3412 0.3412 0.6930 0.6930 0.7828 0.7828 0.8782 0.8782 0.9482 0.9482 3.5332 3.5332 3.7573 3.7573 3.9088 3.9088 7.6387 7.6387 7.7376 7.7376 8.5625 8.5625 8.6231 8.6231 8.9907 8.9907 9.2478 9.2478 k = 0.1210 0.4031 0.9207 ( 8832 PWs) bands (ev): -26.2993 -26.2993 -26.2982 -26.2982 -25.4331 -25.4331 -25.4328 -25.4328 -11.1308 -11.1308 -11.0730 -11.0730 -10.9974 -10.9974 -10.0169 -10.0169 -9.9973 -9.9973 -9.8084 -9.8084 -9.7938 -9.7938 -9.6487 -9.6487 -9.3713 -9.3713 -9.2706 -9.2706 -9.1417 -9.1417 -9.0471 -9.0471 -8.9105 -8.9105 -8.6052 -8.6052 -8.1013 -8.1013 0.3122 0.3122 0.3466 0.3466 0.6909 0.6909 0.7848 0.7848 0.8757 0.8757 0.9445 0.9445 3.5280 3.5280 3.7495 3.7495 3.8690 3.8690 7.6787 7.6787 7.7513 7.7513 8.5263 8.5263 8.5980 8.5980 8.9731 8.9731 9.2528 9.2528 k = 0.1290 0.3848 0.9407 ( 8842 PWs) bands (ev): -26.2993 -26.2993 -26.2981 -26.2981 -25.4331 -25.4331 -25.4328 -25.4328 -11.1382 -11.1382 -11.0718 -11.0718 -10.9991 -10.9991 -10.0182 -10.0182 -10.0002 -10.0002 -9.8114 -9.8114 -9.7953 -9.7953 -9.6481 -9.6481 -9.3736 -9.3736 -9.2745 -9.2745 -9.1404 -9.1404 -9.0488 -9.0488 -8.9044 -8.9044 -8.5934 -8.5934 -8.0897 -8.0897 0.3150 0.3150 0.3518 0.3518 0.6890 0.6890 0.7871 0.7871 0.8731 0.8731 0.9409 0.9409 3.5229 3.5229 3.7416 3.7416 3.8294 3.8294 7.7172 7.7172 7.7652 7.7652 8.4910 8.4910 8.5704 8.5704 8.9543 8.9543 9.2593 9.2593 k = 0.1371 0.3665 0.9607 ( 8846 PWs) bands (ev): -26.2992 -26.2992 -26.2981 -26.2981 -25.4330 -25.4330 -25.4328 -25.4328 -11.1462 -11.1462 -11.0707 -11.0707 -10.9999 -10.9999 -10.0195 -10.0195 -10.0030 -10.0030 -9.8144 -9.8144 -9.7967 -9.7967 -9.6475 -9.6475 -9.3756 -9.3756 -9.2783 -9.2783 -9.1394 -9.1394 -9.0503 -9.0503 -8.8986 -8.8986 -8.5823 -8.5823 -8.0777 -8.0777 0.3174 0.3174 0.3568 0.3568 0.6875 0.6875 0.7895 0.7895 0.8706 0.8706 0.9374 0.9374 3.5176 3.5176 3.7336 3.7336 3.7906 3.7906 7.7533 7.7533 7.7793 7.7793 8.4567 8.4567 8.5405 8.5405 8.9381 8.9381 9.2670 9.2670 k = 0.1452 0.3482 0.9807 ( 8838 PWs) bands (ev): -26.2991 -26.2991 -26.2981 -26.2981 -25.4329 -25.4329 -25.4328 -25.4328 -11.1546 -11.1546 -11.0695 -11.0695 -11.0000 -11.0000 -10.0207 -10.0207 -10.0059 -10.0059 -9.8173 -9.8173 -9.7982 -9.7982 -9.6468 -9.6468 -9.3776 -9.3776 -9.2819 -9.2819 -9.1385 -9.1385 -9.0516 -9.0516 -8.8930 -8.8930 -8.5720 -8.5720 -8.0654 -8.0654 0.3196 0.3196 0.3615 0.3615 0.6864 0.6864 0.7921 0.7921 0.8682 0.8682 0.9340 0.9340 3.5125 3.5125 3.7250 3.7250 3.7533 3.7533 7.7844 7.7844 7.7956 7.7956 8.4234 8.4234 8.5090 8.5090 8.9268 8.9268 9.2754 9.2754 k = 0.1532 0.3299 1.0007 ( 8844 PWs) bands (ev): -26.2991 -26.2991 -26.2981 -26.2981 -25.4329 -25.4329 -25.4327 -25.4327 -11.1631 -11.1631 -11.0684 -11.0684 -10.9996 -10.9996 -10.0220 -10.0220 -10.0086 -10.0086 -9.8201 -9.8201 -9.7996 -9.7996 -9.6462 -9.6462 -9.3793 -9.3793 -9.2852 -9.2852 -9.1377 -9.1377 -9.0529 -9.0529 -8.8877 -8.8877 -8.5625 -8.5625 -8.0531 -8.0531 0.3214 0.3214 0.3659 0.3659 0.6857 0.6857 0.7948 0.7948 0.8659 0.8659 0.9308 0.9308 3.5074 3.5074 3.7098 3.7098 3.7242 3.7242 7.8033 7.8033 7.8205 7.8205 8.3914 8.3914 8.4763 8.4763 8.9220 8.9220 9.2841 9.2841 k = 0.1613 0.3116 1.0207 ( 8838 PWs) bands (ev): -26.2991 -26.2991 -26.2981 -26.2981 -25.4328 -25.4328 -25.4327 -25.4327 -11.1716 -11.1716 -11.0673 -11.0673 -10.9987 -10.9987 -10.0232 -10.0232 -10.0113 -10.0113 -9.8229 -9.8229 -9.8009 -9.8009 -9.6457 -9.6457 -9.3810 -9.3810 -9.2884 -9.2884 -9.1371 -9.1371 -9.0540 -9.0540 -8.8828 -8.8828 -8.5538 -8.5538 -8.0408 -8.0408 0.3228 0.3228 0.3700 0.3700 0.6855 0.6855 0.7974 0.7974 0.8638 0.8638 0.9276 0.9276 3.5025 3.5025 3.6781 3.6781 3.7134 3.7134 7.8175 7.8175 7.8461 7.8461 8.3607 8.3607 8.4430 8.4430 8.9244 8.9244 9.2928 9.2928 k = 0.1694 0.2932 1.0407 ( 8830 PWs) bands (ev): -26.2990 -26.2990 -26.2980 -26.2980 -25.4328 -25.4328 -25.4327 -25.4327 -11.1799 -11.1799 -11.0663 -11.0663 -10.9976 -10.9976 -10.0243 -10.0243 -10.0139 -10.0139 -9.8255 -9.8255 -9.8022 -9.8022 -9.6451 -9.6451 -9.3825 -9.3825 -9.2912 -9.2912 -9.1365 -9.1365 -9.0550 -9.0550 -8.8781 -8.8781 -8.5460 -8.5460 -8.0289 -8.0289 0.3239 0.3239 0.3737 0.3737 0.6857 0.6857 0.8001 0.8001 0.8619 0.8619 0.9245 0.9245 3.4978 3.4978 3.6455 3.6455 3.7059 3.7059 7.8310 7.8310 7.8681 7.8681 8.3315 8.3315 8.4094 8.4094 8.9345 8.9345 9.3012 9.3012 k = 0.1774 0.2749 1.0608 ( 8832 PWs) bands (ev): -26.2990 -26.2990 -26.2980 -26.2980 -25.4327 -25.4327 -25.4326 -25.4326 -11.1878 -11.1878 -11.0653 -11.0653 -10.9963 -10.9963 -10.0254 -10.0254 -10.0163 -10.0163 -9.8279 -9.8279 -9.8035 -9.8035 -9.6446 -9.6446 -9.3838 -9.3838 -9.2939 -9.2939 -9.1360 -9.1360 -9.0559 -9.0559 -8.8739 -8.8739 -8.5390 -8.5390 -8.0174 -8.0174 0.3246 0.3246 0.3771 0.3771 0.6863 0.6863 0.8026 0.8026 0.8604 0.8604 0.9214 0.9214 3.4934 3.4934 3.6148 3.6148 3.6992 3.6992 7.8444 7.8444 7.8862 7.8862 8.3041 8.3041 8.3763 8.3763 8.9519 8.9519 9.3091 9.3091 k = 0.1855 0.2566 1.0808 ( 8826 PWs) bands (ev): -26.2989 -26.2989 -26.2980 -26.2980 -25.4327 -25.4327 -25.4326 -25.4326 -11.1952 -11.1952 -11.0644 -11.0644 -10.9949 -10.9949 -10.0264 -10.0264 -10.0186 -10.0186 -9.8302 -9.8302 -9.8046 -9.8046 -9.6442 -9.6442 -9.3850 -9.3850 -9.2963 -9.2963 -9.1357 -9.1357 -9.0567 -9.0567 -8.8700 -8.8700 -8.5328 -8.5328 -8.0066 -8.0066 0.3250 0.3250 0.3802 0.3802 0.6873 0.6873 0.8048 0.8048 0.8593 0.8593 0.9185 0.9185 3.4892 3.4892 3.5866 3.5866 3.6931 3.6931 7.8576 7.8576 7.9005 7.9005 8.2787 8.2787 8.3439 8.3439 8.9763 8.9763 9.3162 9.3162 k = 0.1935 0.2383 1.1008 ( 8832 PWs) bands (ev): -26.2989 -26.2989 -26.2980 -26.2980 -25.4327 -25.4327 -25.4326 -25.4326 -11.2019 -11.2019 -11.0636 -11.0636 -10.9935 -10.9935 -10.0273 -10.0273 -10.0207 -10.0207 -9.8322 -9.8322 -9.8056 -9.8056 -9.6437 -9.6437 -9.3860 -9.3860 -9.2984 -9.2984 -9.1354 -9.1354 -9.0573 -9.0573 -8.8665 -8.8665 -8.5275 -8.5275 -7.9966 -7.9966 0.3251 0.3251 0.3828 0.3828 0.6884 0.6884 0.8068 0.8068 0.8586 0.8586 0.9155 0.9155 3.4854 3.4854 3.5611 3.5611 3.6875 3.6875 7.8707 7.8707 7.9115 7.9115 8.2555 8.2555 8.3129 8.3129 9.0068 9.0068 9.3225 9.3225 k = 0.2016 0.2200 1.1208 ( 8824 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4326 -25.4326 -25.4326 -25.4326 -11.2080 -11.2080 -11.0629 -11.0629 -10.9921 -10.9921 -10.0280 -10.0280 -10.0226 -10.0226 -9.8340 -9.8340 -9.8065 -9.8065 -9.6433 -9.6433 -9.3869 -9.3869 -9.3002 -9.3002 -9.1351 -9.1351 -9.0579 -9.0579 -8.8635 -8.8635 -8.5230 -8.5230 -7.9876 -7.9876 0.3251 0.3251 0.3852 0.3852 0.6897 0.6897 0.8084 0.8084 0.8584 0.8584 0.9127 0.9127 3.4820 3.4820 3.5386 3.5386 3.6826 3.6826 7.8835 7.8835 7.9196 7.9196 8.2348 8.2348 8.2836 8.2836 9.0424 9.0424 9.3279 9.3279 k = 0.2097 0.2017 1.1408 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4326 -25.4326 -25.4326 -25.4326 -11.2132 -11.2132 -11.0623 -11.0623 -10.9909 -10.9909 -10.0287 -10.0287 -10.0243 -10.0243 -9.8356 -9.8356 -9.8073 -9.8073 -9.6430 -9.6430 -9.3877 -9.3877 -9.3018 -9.3018 -9.1349 -9.1349 -9.0584 -9.0584 -8.8609 -8.8609 -8.5192 -8.5192 -7.9797 -7.9797 0.3249 0.3249 0.3871 0.3871 0.6911 0.6911 0.8097 0.8097 0.8587 0.8587 0.9100 0.9100 3.4788 3.4788 3.5193 3.5193 3.6784 3.6784 7.8958 7.8958 7.9255 7.9255 8.2167 8.2167 8.2568 8.2568 9.0820 9.0820 9.3323 9.3323 k = 0.2177 0.1833 1.1608 ( 8822 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4326 -25.4326 -25.4326 -25.4326 -11.2176 -11.2176 -11.0618 -11.0618 -10.9898 -10.9898 -10.0291 -10.0291 -10.0257 -10.0257 -9.8369 -9.8369 -9.8080 -9.8080 -9.6428 -9.6428 -9.3883 -9.3883 -9.3031 -9.3031 -9.1348 -9.1348 -9.0588 -9.0588 -8.8588 -8.8588 -8.5161 -8.5161 -7.9730 -7.9730 0.3246 0.3246 0.3887 0.3887 0.6923 0.6923 0.8106 0.8106 0.8594 0.8594 0.9075 0.9075 3.4760 3.4760 3.5036 3.5036 3.6748 3.6748 7.9072 7.9072 7.9298 7.9298 8.2016 8.2016 8.2329 8.2329 9.1241 9.1241 9.3357 9.3357 k = 0.2258 0.1650 1.1808 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4325 -25.4325 -11.2210 -11.2210 -11.0613 -11.0613 -10.9890 -10.9890 -10.0294 -10.0294 -10.0269 -10.0269 -9.8380 -9.8380 -9.8085 -9.8085 -9.6425 -9.6425 -9.3888 -9.3888 -9.3041 -9.3041 -9.1347 -9.1347 -9.0591 -9.0591 -8.8571 -8.8571 -8.5137 -8.5137 -7.9678 -7.9678 0.3243 0.3243 0.3900 0.3900 0.6934 0.6934 0.8111 0.8111 0.8602 0.8602 0.9054 0.9054 3.4733 3.4733 3.4917 3.4917 3.6720 3.6720 7.9170 7.9170 7.9330 7.9330 8.1896 8.1896 8.2128 8.2128 9.1674 9.1674 9.3380 9.3380 k = 0.2339 0.1467 1.2009 ( 8822 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2235 -11.2235 -11.0610 -11.0610 -10.9883 -10.9883 -10.0296 -10.0296 -10.0279 -10.0279 -9.8387 -9.8387 -9.8089 -9.8089 -9.6424 -9.6424 -9.3891 -9.3891 -9.3048 -9.3048 -9.1346 -9.1346 -9.0593 -9.0593 -8.8559 -8.8559 -8.5121 -8.5121 -7.9639 -7.9639 0.3241 0.3241 0.3909 0.3909 0.6942 0.6942 0.8115 0.8115 0.8611 0.8611 0.9037 0.9037 3.4705 3.4705 3.4840 3.4840 3.6700 3.6700 7.9243 7.9243 7.9357 7.9357 8.1809 8.1809 8.1974 8.1974 9.2092 9.2092 9.3391 9.3391 k = 0.2419 0.1284 1.2209 ( 8822 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2250 -11.2250 -11.0609 -11.0609 -10.9879 -10.9879 -10.0295 -10.0295 -10.0286 -10.0286 -9.8392 -9.8392 -9.8091 -9.8091 -9.6423 -9.6423 -9.3893 -9.3893 -9.3053 -9.3053 -9.1345 -9.1345 -9.0594 -9.0594 -8.8552 -8.8552 -8.5111 -8.5111 -7.9616 -7.9616 0.3239 0.3239 0.3914 0.3914 0.6948 0.6948 0.8116 0.8116 0.8617 0.8617 0.9025 0.9025 3.4681 3.4681 3.4801 3.4801 3.6688 3.6688 7.9284 7.9284 7.9381 7.9381 8.1757 8.1757 8.1876 8.1876 9.2445 9.2445 9.3386 9.3386 k = 0.2500 0.1101 1.2409 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2255 -11.2255 -11.0608 -11.0608 -10.9878 -10.9878 -10.0293 -10.0293 -10.0290 -10.0290 -9.8393 -9.8393 -9.8092 -9.8092 -9.6423 -9.6423 -9.3894 -9.3894 -9.3054 -9.3054 -9.1345 -9.1345 -9.0595 -9.0595 -8.8549 -8.8549 -8.5107 -8.5107 -7.9609 -7.9609 0.3238 0.3238 0.3916 0.3916 0.6949 0.6949 0.8117 0.8117 0.8619 0.8619 0.9022 0.9022 3.4670 3.4670 3.4790 3.4790 3.6684 3.6684 7.9295 7.9295 7.9391 7.9391 8.1739 8.1739 8.1843 8.1843 9.2604 9.2604 9.3374 9.3374 k = 0.2500 0.1101 1.2409 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2255 -11.2255 -11.0608 -11.0608 -10.9878 -10.9878 -10.0293 -10.0293 -10.0290 -10.0290 -9.8393 -9.8393 -9.8092 -9.8092 -9.6423 -9.6423 -9.3894 -9.3894 -9.3054 -9.3054 -9.1345 -9.1345 -9.0595 -9.0595 -8.8549 -8.8549 -8.5107 -8.5107 -7.9609 -7.9609 0.3238 0.3238 0.3916 0.3916 0.6949 0.6949 0.8117 0.8117 0.8619 0.8619 0.9022 0.9022 3.4670 3.4670 3.4790 3.4790 3.6684 3.6684 7.9295 7.9295 7.9391 7.9391 8.1739 8.1739 8.1843 8.1843 9.2604 9.2604 9.3374 9.3374 k = 0.2727 0.1201 1.2300 ( 8830 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2255 -11.2255 -11.0605 -11.0605 -10.9881 -10.9881 -10.0294 -10.0294 -10.0289 -10.0289 -9.8393 -9.8393 -9.8092 -9.8092 -9.6422 -9.6422 -9.3897 -9.3897 -9.3052 -9.3052 -9.1345 -9.1345 -9.0595 -9.0595 -8.8550 -8.8550 -8.5108 -8.5108 -7.9610 -7.9610 0.3238 0.3238 0.3917 0.3917 0.6951 0.6951 0.8111 0.8111 0.8623 0.8623 0.9022 0.9022 3.4669 3.4669 3.4794 3.4794 3.6685 3.6685 7.9196 7.9196 7.9491 7.9491 8.1724 8.1724 8.1863 8.1863 9.2564 9.2564 9.3379 9.3379 k = 0.2955 0.1301 1.2190 ( 8824 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4325 -25.4325 -11.2255 -11.2255 -11.0595 -11.0595 -10.9890 -10.9890 -10.0295 -10.0295 -10.0287 -10.0287 -9.8392 -9.8392 -9.8091 -9.8091 -9.6418 -9.6418 -9.3907 -9.3907 -9.3045 -9.3045 -9.1345 -9.1345 -9.0594 -9.0594 -8.8551 -8.8551 -8.5109 -8.5109 -7.9613 -7.9613 0.3235 0.3235 0.3920 0.3920 0.6953 0.6953 0.8094 0.8094 0.8634 0.8634 0.9024 0.9024 3.4667 3.4667 3.4806 3.4806 3.6688 3.6688 7.9071 7.9071 7.9614 7.9614 8.1697 8.1697 8.1912 8.1912 9.2449 9.2449 9.3339 9.3339 k = 0.3182 0.1401 1.2081 ( 8820 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4325 -25.4325 -11.2255 -11.2255 -11.0578 -11.0578 -10.9906 -10.9906 -10.0297 -10.0297 -10.0283 -10.0283 -9.8391 -9.8391 -9.8091 -9.8091 -9.6413 -9.6413 -9.3922 -9.3922 -9.3034 -9.3034 -9.1345 -9.1345 -9.0594 -9.0594 -8.8552 -8.8552 -8.5112 -8.5112 -7.9619 -7.9619 0.3232 0.3232 0.3924 0.3924 0.6957 0.6957 0.8069 0.8069 0.8650 0.8650 0.9027 0.9027 3.4664 3.4664 3.4824 3.4824 3.6692 3.6692 7.8956 7.8956 7.9717 7.9717 8.1671 8.1671 8.1983 8.1983 9.2279 9.2279 9.3217 9.3217 k = 0.3409 0.1501 1.1972 ( 8821 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4326 -25.4326 -25.4324 -25.4324 -11.2254 -11.2254 -11.0556 -11.0556 -10.9927 -10.9927 -10.0298 -10.0298 -10.0279 -10.0279 -9.8390 -9.8390 -9.8090 -9.8090 -9.6406 -9.6406 -9.3941 -9.3941 -9.3020 -9.3020 -9.1345 -9.1345 -9.0593 -9.0593 -8.8555 -8.8555 -8.5115 -8.5115 -7.9627 -7.9627 0.3227 0.3227 0.3928 0.3928 0.6961 0.6961 0.8040 0.8040 0.8667 0.8667 0.9033 0.9033 3.4664 3.4664 3.4846 3.4846 3.6698 3.6698 7.8854 7.8854 7.9790 7.9790 8.1652 8.1652 8.2082 8.2082 9.2077 9.2077 9.3066 9.3066 k = 0.3636 0.1601 1.1862 ( 8831 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4327 -25.4327 -25.4324 -25.4324 -11.2252 -11.2252 -11.0529 -11.0529 -10.9952 -10.9952 -10.0299 -10.0299 -10.0275 -10.0275 -9.8388 -9.8388 -9.8089 -9.8089 -9.6398 -9.6398 -9.3962 -9.3962 -9.3005 -9.3005 -9.1345 -9.1345 -9.0592 -9.0592 -8.8558 -8.8558 -8.5120 -8.5120 -7.9637 -7.9637 0.3223 0.3223 0.3933 0.3933 0.6963 0.6963 0.8011 0.8011 0.8683 0.8683 0.9041 0.9041 3.4667 3.4667 3.4870 3.4870 3.6705 3.6705 7.8769 7.8769 7.9824 7.9824 8.1642 8.1642 8.2210 8.2210 9.1859 9.1859 9.2916 9.2916 k = 0.3864 0.1701 1.1753 ( 8830 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4328 -25.4328 -25.4323 -25.4323 -11.2248 -11.2248 -11.0498 -11.0498 -10.9982 -10.9982 -10.0300 -10.0300 -10.0270 -10.0270 -9.8385 -9.8385 -9.8088 -9.8088 -9.6390 -9.6390 -9.3982 -9.3982 -9.2990 -9.2990 -9.1346 -9.1346 -9.0591 -9.0591 -8.8562 -8.8562 -8.5125 -8.5125 -7.9650 -7.9650 0.3218 0.3218 0.3937 0.3937 0.6964 0.6964 0.7984 0.7984 0.8697 0.8697 0.9052 0.9052 3.4674 3.4674 3.4897 3.4897 3.6714 3.6714 7.8701 7.8701 7.9819 7.9819 8.1643 8.1643 8.2367 8.2367 9.1634 9.1634 9.2779 9.2779 k = 0.4091 0.1801 1.1644 ( 8843 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4329 -25.4329 -25.4322 -25.4322 -11.2244 -11.2244 -11.0464 -11.0464 -11.0015 -11.0015 -10.0301 -10.0301 -10.0264 -10.0264 -9.8383 -9.8383 -9.8087 -9.8087 -9.6383 -9.6383 -9.4000 -9.4000 -9.2976 -9.2976 -9.1346 -9.1346 -9.0589 -9.0589 -8.8567 -8.8567 -8.5131 -8.5131 -7.9665 -7.9665 0.3214 0.3214 0.3939 0.3939 0.6962 0.6962 0.7961 0.7961 0.8707 0.8707 0.9065 0.9065 3.4686 3.4686 3.4925 3.4925 3.6723 3.6723 7.8652 7.8652 7.9776 7.9776 8.1656 8.1656 8.2547 8.2547 9.1409 9.1409 9.2661 9.2661 k = 0.4318 0.1901 1.1534 ( 8847 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4330 -25.4330 -25.4321 -25.4321 -11.2237 -11.2237 -11.0431 -11.0431 -11.0049 -11.0049 -10.0301 -10.0301 -10.0258 -10.0258 -9.8379 -9.8379 -9.8086 -9.8086 -9.6377 -9.6377 -9.4015 -9.4015 -9.2963 -9.2963 -9.1346 -9.1346 -9.0588 -9.0588 -8.8572 -8.8572 -8.5139 -8.5139 -7.9682 -7.9682 0.3211 0.3211 0.3939 0.3939 0.6956 0.6956 0.7946 0.7946 0.8713 0.8713 0.9081 0.9081 3.4704 3.4704 3.4954 3.4954 3.6733 3.6733 7.8622 7.8622 7.9700 7.9700 8.1683 8.1683 8.2742 8.2742 9.1185 9.1185 9.2568 9.2568 k = 0.4545 0.2001 1.1425 ( 8846 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4331 -25.4331 -25.4320 -25.4320 -11.2228 -11.2228 -11.0400 -11.0400 -11.0082 -11.0082 -10.0301 -10.0301 -10.0252 -10.0252 -9.8376 -9.8376 -9.8084 -9.8084 -9.6373 -9.6373 -9.4025 -9.4025 -9.2953 -9.2953 -9.1346 -9.1346 -9.0586 -9.0586 -8.8578 -8.8578 -8.5147 -8.5147 -7.9702 -7.9702 0.3209 0.3209 0.3936 0.3936 0.6946 0.6946 0.7937 0.7937 0.8716 0.8716 0.9097 0.9097 3.4726 3.4726 3.4983 3.4983 3.6743 3.6743 7.8611 7.8611 7.9596 7.9596 8.1726 8.1726 8.2941 8.2941 9.0963 9.0963 9.2505 9.2505 k = 0.4773 0.2101 1.1316 ( 8846 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4332 -25.4332 -25.4319 -25.4319 -11.2216 -11.2216 -11.0376 -11.0376 -11.0109 -11.0109 -10.0301 -10.0301 -10.0246 -10.0246 -9.8372 -9.8372 -9.8082 -9.8082 -9.6372 -9.6372 -9.4029 -9.4029 -9.2946 -9.2946 -9.1346 -9.1346 -9.0585 -9.0585 -8.8585 -8.8585 -8.5156 -8.5156 -7.9724 -7.9724 0.3209 0.3209 0.3931 0.3931 0.6933 0.6933 0.7937 0.7937 0.8715 0.8715 0.9114 0.9114 3.4754 3.4754 3.5014 3.5014 3.6754 3.6754 7.8620 7.8620 7.9469 7.9469 8.1785 8.1785 8.3136 8.3136 9.0742 9.0742 9.2478 9.2478 k = 0.5000 0.2201 1.1206 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4334 -25.4334 -25.4318 -25.4318 -11.2202 -11.2202 -11.0366 -11.0366 -11.0123 -11.0123 -10.0301 -10.0301 -10.0240 -10.0240 -9.8368 -9.8368 -9.8080 -9.8080 -9.6373 -9.6373 -9.4027 -9.4027 -9.2941 -9.2941 -9.1346 -9.1346 -9.0583 -9.0583 -8.8592 -8.8592 -8.5166 -8.5166 -7.9748 -7.9748 0.3210 0.3210 0.3923 0.3923 0.6917 0.6917 0.7943 0.7943 0.8712 0.8712 0.9131 0.9131 3.4788 3.4788 3.5045 3.5045 3.6765 3.6765 7.8647 7.8647 7.9326 7.9326 8.1861 8.1861 8.3316 8.3316 9.0525 9.0525 9.2489 9.2489 k = 0.5000 0.2201 1.1206 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4334 -25.4334 -25.4318 -25.4318 -11.2202 -11.2202 -11.0366 -11.0366 -11.0123 -11.0123 -10.0301 -10.0301 -10.0240 -10.0240 -9.8368 -9.8368 -9.8080 -9.8080 -9.6373 -9.6373 -9.4027 -9.4027 -9.2941 -9.2941 -9.1346 -9.1346 -9.0583 -9.0583 -8.8592 -8.8592 -8.5166 -8.5166 -7.9748 -7.9748 0.3210 0.3210 0.3923 0.3923 0.6917 0.6917 0.7943 0.7943 0.8712 0.8712 0.9131 0.9131 3.4788 3.4788 3.5045 3.5045 3.6765 3.6765 7.8647 7.8647 7.9326 7.9326 8.1861 8.1861 8.3316 8.3316 9.0525 9.0525 9.2489 9.2489 k = 0.5000 0.2201 1.0919 ( 8852 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4338 -25.4338 -25.4313 -25.4313 -11.2156 -11.2156 -11.0362 -11.0362 -11.0140 -11.0140 -10.0299 -10.0299 -10.0223 -10.0223 -9.8355 -9.8355 -9.8073 -9.8073 -9.6381 -9.6381 -9.4012 -9.4012 -9.2933 -9.2933 -9.1346 -9.1346 -9.0578 -9.0578 -8.8615 -8.8615 -8.5197 -8.5197 -7.9822 -7.9822 0.3216 0.3216 0.3896 0.3896 0.6871 0.6871 0.7968 0.7968 0.8701 0.8701 0.9175 0.9175 3.4894 3.4894 3.5137 3.5137 3.6799 3.6799 7.8753 7.8753 7.8924 7.8924 8.2105 8.2105 8.3779 8.3779 8.9942 8.9942 9.2577 9.2577 k = 0.5000 0.2201 1.0632 ( 8858 PWs) bands (ev): -26.2988 -26.2988 -26.2980 -26.2980 -25.4344 -25.4344 -25.4308 -25.4308 -11.2101 -11.2101 -11.0357 -11.0357 -11.0161 -11.0161 -10.0296 -10.0296 -10.0203 -10.0203 -9.8339 -9.8339 -9.8065 -9.8065 -9.6391 -9.6391 -9.3993 -9.3993 -9.2922 -9.2922 -9.1346 -9.1346 -9.0573 -9.0573 -8.8643 -8.8643 -8.5233 -8.5233 -7.9911 -7.9911 0.3223 0.3223 0.3866 0.3866 0.6825 0.6825 0.7990 0.7990 0.8698 0.8698 0.9220 0.9220 3.5022 3.5022 3.5248 3.5248 3.6838 3.6838 7.8494 7.8494 7.8890 7.8890 8.2385 8.2385 8.4267 8.4267 8.9333 8.9333 9.2684 9.2684 k = 0.5000 0.2201 1.0344 ( 8848 PWs) bands (ev): -26.2988 -26.2988 -26.2981 -26.2981 -25.4350 -25.4350 -25.4303 -25.4303 -11.2037 -11.2037 -11.0350 -11.0350 -11.0184 -11.0184 -10.0291 -10.0291 -10.0182 -10.0182 -9.8321 -9.8321 -9.8056 -9.8056 -9.6402 -9.6402 -9.3972 -9.3972 -9.2910 -9.2910 -9.1347 -9.1347 -9.0566 -9.0566 -8.8676 -8.8676 -8.5275 -8.5275 -8.0015 -8.0015 0.3230 0.3230 0.3832 0.3832 0.6782 0.6782 0.8008 0.8008 0.8702 0.8702 0.9265 0.9265 3.5171 3.5171 3.5379 3.5379 3.6884 3.6884 7.8055 7.8055 7.9041 7.9041 8.2692 8.2692 8.4780 8.4780 8.8705 8.8705 9.2808 9.2808 k = 0.5000 0.2201 1.0057 ( 8848 PWs) bands (ev): -26.2988 -26.2988 -26.2981 -26.2981 -25.4357 -25.4357 -25.4296 -25.4296 -11.1967 -11.1967 -11.0340 -11.0340 -11.0209 -11.0209 -10.0286 -10.0286 -10.0160 -10.0160 -9.8301 -9.8301 -9.8047 -9.8047 -9.6415 -9.6415 -9.3948 -9.3948 -9.2897 -9.2897 -9.1347 -9.1347 -9.0558 -9.0558 -8.8713 -8.8713 -8.5322 -8.5322 -8.0134 -8.0134 0.3238 0.3238 0.3797 0.3797 0.6743 0.6743 0.8021 0.8021 0.8713 0.8713 0.9310 0.9310 3.5340 3.5340 3.5528 3.5528 3.6935 3.6935 7.7598 7.7598 7.9212 7.9212 8.3009 8.3009 8.5314 8.5314 8.8068 8.8068 9.2923 9.2923 k = 0.5000 0.2201 0.9770 ( 8848 PWs) bands (ev): -26.2989 -26.2989 -26.2981 -26.2981 -25.4365 -25.4365 -25.4289 -25.4289 -11.1889 -11.1889 -11.0326 -11.0326 -11.0236 -11.0236 -10.0280 -10.0280 -10.0136 -10.0136 -9.8279 -9.8279 -9.8036 -9.8036 -9.6429 -9.6429 -9.3922 -9.3922 -9.2881 -9.2881 -9.1348 -9.1348 -9.0549 -9.0549 -8.8755 -8.8755 -8.5373 -8.5373 -8.0267 -8.0267 0.3247 0.3247 0.3760 0.3760 0.6711 0.6711 0.8031 0.8031 0.8730 0.8730 0.9353 0.9353 3.5526 3.5526 3.5697 3.5697 3.6992 3.6992 7.7124 7.7124 7.9400 7.9400 8.3317 8.3317 8.5869 8.5869 8.7433 8.7433 9.2564 9.2564 k = 0.5000 0.2201 0.9482 ( 8856 PWs) bands (ev): -26.2989 -26.2989 -26.2982 -26.2982 -25.4374 -25.4374 -25.4281 -25.4281 -11.1806 -11.1806 -11.0310 -11.0310 -11.0262 -11.0262 -10.0274 -10.0274 -10.0111 -10.0111 -9.8256 -9.8256 -9.8025 -9.8025 -9.6445 -9.6445 -9.3893 -9.3893 -9.2864 -9.2864 -9.1350 -9.1350 -9.0539 -9.0539 -8.8802 -8.8802 -8.5428 -8.5428 -8.0413 -8.0413 0.3256 0.3256 0.3723 0.3723 0.6687 0.6687 0.8037 0.8037 0.8752 0.8752 0.9395 0.9395 3.5730 3.5730 3.5885 3.5885 3.7053 3.7053 7.6632 7.6632 7.9604 7.9604 8.3580 8.3580 8.6440 8.6440 8.6824 8.6824 9.1945 9.1945 k = 0.5000 0.2201 0.9195 ( 8858 PWs) bands (ev): -26.2989 -26.2989 -26.2983 -26.2983 -25.4384 -25.4384 -25.4272 -25.4272 -11.1719 -11.1719 -11.0307 -11.0307 -11.0271 -11.0271 -10.0267 -10.0267 -10.0086 -10.0086 -9.8231 -9.8231 -9.8015 -9.8015 -9.6462 -9.6462 -9.3862 -9.3862 -9.2845 -9.2845 -9.1351 -9.1351 -9.0528 -9.0528 -8.8852 -8.8852 -8.5486 -8.5486 -8.0573 -8.0573 0.3266 0.3266 0.3687 0.3687 0.6673 0.6673 0.8042 0.8042 0.8778 0.8778 0.9436 0.9436 3.5950 3.5950 3.6091 3.6091 3.7118 3.7118 7.6122 7.6122 7.9820 7.9820 8.3744 8.3744 8.6265 8.6265 8.7040 8.7040 9.1286 9.1286 k = 0.5000 0.2201 0.8908 ( 8846 PWs) bands (ev): -26.2989 -26.2989 -26.2983 -26.2983 -25.4394 -25.4394 -25.4263 -25.4263 -11.1629 -11.1629 -11.0332 -11.0332 -11.0245 -11.0245 -10.0261 -10.0261 -10.0060 -10.0060 -9.8205 -9.8205 -9.8004 -9.8004 -9.6481 -9.6481 -9.3829 -9.3829 -9.2825 -9.2825 -9.1353 -9.1353 -9.0516 -9.0516 -8.8907 -8.8907 -8.5547 -8.5547 -8.0745 -8.0745 0.3276 0.3276 0.3654 0.3654 0.6668 0.6668 0.8046 0.8046 0.8805 0.8805 0.9475 0.9475 3.6183 3.6183 3.6316 3.6316 3.7187 3.7187 7.5594 7.5594 8.0044 8.0044 8.3718 8.3718 8.5855 8.5855 8.7646 8.7646 9.0604 9.0604 k = 0.5000 0.2201 0.8620 ( 8850 PWs) bands (ev): -26.2990 -26.2990 -26.2984 -26.2984 -25.4405 -25.4405 -25.4253 -25.4253 -11.1538 -11.1538 -11.0362 -11.0362 -11.0204 -11.0204 -10.0255 -10.0255 -10.0035 -10.0035 -9.8179 -9.8179 -9.7993 -9.7993 -9.6501 -9.6501 -9.3794 -9.3794 -9.2803 -9.2803 -9.1356 -9.1356 -9.0502 -9.0502 -8.8965 -8.8965 -8.5610 -8.5610 -8.0928 -8.0928 0.3288 0.3288 0.3624 0.3624 0.6675 0.6675 0.8051 0.8051 0.8834 0.8834 0.9513 0.9513 3.6427 3.6427 3.6559 3.6559 3.7260 3.7260 7.5050 7.5050 8.0269 8.0269 8.3428 8.3428 8.5638 8.5638 8.8265 8.8265 8.9913 8.9913 k = 0.5000 0.2201 0.8333 ( 8842 PWs) bands (ev): -26.2990 -26.2990 -26.2984 -26.2984 -25.4416 -25.4416 -25.4243 -25.4243 -11.1449 -11.1449 -11.0392 -11.0392 -11.0152 -11.0152 -10.0249 -10.0249 -10.0009 -10.0009 -9.8152 -9.8152 -9.7983 -9.7983 -9.6523 -9.6523 -9.3757 -9.3757 -9.2780 -9.2780 -9.1359 -9.1359 -9.0488 -9.0488 -8.9027 -8.9027 -8.5675 -8.5675 -8.1123 -8.1123 0.3302 0.3302 0.3599 0.3599 0.6692 0.6692 0.8058 0.8058 0.8864 0.8864 0.9550 0.9550 3.6682 3.6682 3.6820 3.6820 3.7336 3.7336 7.4489 7.4489 8.0487 8.0487 8.2917 8.2917 8.5560 8.5560 8.8890 8.8890 8.9230 8.9230 k = 0.5000 0.2201 0.8046 ( 8834 PWs) bands (ev): -26.2990 -26.2990 -26.2985 -26.2985 -25.4428 -25.4428 -25.4232 -25.4232 -11.1363 -11.1363 -11.0423 -11.0423 -11.0088 -11.0088 -10.0244 -10.0244 -9.9984 -9.9984 -9.8125 -9.8125 -9.7974 -9.7974 -9.6546 -9.6546 -9.3719 -9.3719 -9.2755 -9.2755 -9.1363 -9.1363 -9.0473 -9.0473 -8.9091 -8.9091 -8.5741 -8.5741 -8.1328 -8.1328 0.3319 0.3319 0.3578 0.3578 0.6719 0.6719 0.8067 0.8067 0.8893 0.8893 0.9585 0.9585 3.6945 3.6945 3.7095 3.7095 3.7416 3.7416 7.3914 7.3914 8.0685 8.0685 8.2283 8.2283 8.5516 8.5516 8.8561 8.8561 8.9528 8.9528 k = 0.5000 0.2201 0.7758 ( 8834 PWs) bands (ev): -26.2990 -26.2990 -26.2986 -26.2986 -25.4440 -25.4440 -25.4220 -25.4220 -11.1282 -11.1282 -11.0453 -11.0453 -11.0009 -11.0009 -10.0240 -10.0240 -9.9959 -9.9959 -9.8099 -9.8099 -9.7966 -9.7966 -9.6570 -9.6570 -9.3679 -9.3679 -9.2729 -9.2729 -9.1368 -9.1368 -9.0457 -9.0457 -8.9159 -8.9159 -8.5807 -8.5807 -8.1543 -8.1543 0.3338 0.3338 0.3564 0.3564 0.6757 0.6757 0.8078 0.8078 0.8923 0.8923 0.9620 0.9620 3.7211 3.7211 3.7382 3.7382 3.7506 3.7506 7.3326 7.3326 8.0839 8.0839 8.1593 8.1593 8.5443 8.5443 8.7943 8.7943 9.0158 9.0158 k = 0.5000 0.2201 0.7471 ( 8828 PWs) bands (ev): -26.2991 -26.2991 -26.2986 -26.2986 -25.4453 -25.4453 -25.4209 -25.4209 -11.1208 -11.1208 -11.0481 -11.0481 -10.9914 -10.9914 -10.0236 -10.0236 -9.9935 -9.9935 -9.8074 -9.8074 -9.7959 -9.7959 -9.6595 -9.6595 -9.3638 -9.3638 -9.2702 -9.2702 -9.1374 -9.1374 -9.0441 -9.0441 -8.9228 -8.9228 -8.5873 -8.5873 -8.1767 -8.1767 0.3362 0.3362 0.3556 0.3556 0.6805 0.6805 0.8093 0.8093 0.8951 0.8951 0.9654 0.9654 3.7450 3.7450 3.7619 3.7619 3.7693 3.7693 7.2726 7.2726 8.0775 8.0775 8.1027 8.1027 8.5318 8.5318 8.7399 8.7399 9.0780 9.0780 k = 0.5000 0.2201 0.7184 ( 8808 PWs) bands (ev): -26.2991 -26.2991 -26.2987 -26.2987 -25.4466 -25.4466 -25.4197 -25.4197 -11.1141 -11.1141 -11.0508 -11.0508 -10.9805 -10.9805 -10.0233 -10.0233 -9.9912 -9.9912 -9.8049 -9.8049 -9.7953 -9.7953 -9.6622 -9.6622 -9.3596 -9.3596 -9.2675 -9.2675 -9.1381 -9.1381 -9.0423 -9.0423 -8.9298 -8.9298 -8.5938 -8.5938 -8.1998 -8.1998 0.3390 0.3390 0.3556 0.3556 0.6862 0.6862 0.8111 0.8111 0.8980 0.8980 0.9688 0.9688 3.7591 3.7591 3.7853 3.7853 3.7999 3.7999 7.2117 7.2117 8.0076 8.0076 8.0985 8.0985 8.5138 8.5138 8.6962 8.6962 9.1382 9.1382 k = 0.5000 0.2201 0.6896 ( 8812 PWs) bands (ev): -26.2991 -26.2991 -26.2988 -26.2988 -25.4479 -25.4479 -25.4185 -25.4185 -11.1081 -11.1081 -11.0534 -11.0534 -10.9681 -10.9681 -10.0232 -10.0232 -9.9891 -9.9891 -9.8026 -9.8026 -9.7949 -9.7949 -9.6650 -9.6650 -9.3554 -9.3554 -9.2646 -9.2646 -9.1389 -9.1389 -9.0405 -9.0405 -8.9369 -8.9369 -8.6004 -8.6004 -8.2236 -8.2236 0.3423 0.3423 0.3563 0.3563 0.6928 0.6928 0.8132 0.8132 0.9008 0.9008 0.9722 0.9722 3.7682 3.7682 3.8141 3.8141 3.8315 3.8315 7.1501 7.1501 7.9319 7.9319 8.0871 8.0871 8.4907 8.4907 8.6665 8.6665 9.1953 9.1953 k = 0.5000 0.2201 0.6609 ( 8816 PWs) bands (ev): -26.2992 -26.2992 -26.2988 -26.2988 -25.4492 -25.4492 -25.4172 -25.4172 -11.1029 -11.1029 -11.0558 -11.0558 -10.9544 -10.9544 -10.0232 -10.0232 -9.9870 -9.9870 -9.8006 -9.8006 -9.7946 -9.7946 -9.6678 -9.6678 -9.3510 -9.3510 -9.2617 -9.2617 -9.1398 -9.1398 -9.0387 -9.0387 -8.9440 -8.9440 -8.6068 -8.6068 -8.2480 -8.2480 0.3461 0.3461 0.3577 0.3577 0.7000 0.7000 0.8158 0.8158 0.9035 0.9035 0.9756 0.9756 3.7761 3.7761 3.8445 3.8445 3.8637 3.8637 7.0879 7.0879 7.8552 7.8552 8.0625 8.0625 8.4635 8.4635 8.6529 8.6529 9.2475 9.2475 k = 0.5000 0.2201 0.6322 ( 8814 PWs) bands (ev): -26.2992 -26.2992 -26.2989 -26.2989 -25.4506 -25.4506 -25.4160 -25.4160 -11.0981 -11.0981 -11.0579 -11.0579 -10.9395 -10.9395 -10.0233 -10.0233 -9.9851 -9.9851 -9.7988 -9.7988 -9.7943 -9.7943 -9.6707 -9.6707 -9.3466 -9.3466 -9.2588 -9.2588 -9.1409 -9.1409 -9.0368 -9.0368 -8.9511 -8.9511 -8.6130 -8.6130 -8.2728 -8.2728 0.3506 0.3506 0.3599 0.3599 0.7079 0.7079 0.8188 0.8188 0.9063 0.9063 0.9790 0.9790 3.7835 3.7835 3.8756 3.8756 3.8963 3.8963 7.0254 7.0254 7.7782 7.7782 8.0251 8.0251 8.4331 8.4331 8.6550 8.6550 9.2934 9.2934 k = 0.5000 0.2201 0.6034 ( 8810 PWs) bands (ev): -26.2993 -26.2993 -26.2990 -26.2990 -25.4519 -25.4519 -25.4147 -25.4147 -11.0939 -11.0939 -11.0599 -11.0599 -10.9237 -10.9237 -10.0235 -10.0235 -9.9833 -9.9833 -9.7975 -9.7975 -9.7939 -9.7939 -9.6737 -9.6737 -9.3421 -9.3421 -9.2559 -9.2559 -9.1421 -9.1421 -9.0349 -9.0349 -8.9579 -8.9579 -8.6192 -8.6192 -8.2980 -8.2980 0.3556 0.3556 0.3628 0.3628 0.7164 0.7164 0.8221 0.8221 0.9092 0.9092 0.9825 0.9825 3.7906 3.7906 3.9073 3.9073 3.9291 3.9291 6.9629 6.9629 7.7013 7.7013 7.9772 7.9772 8.4006 8.4006 8.6705 8.6705 9.3317 9.3317 k = 0.5000 0.2201 0.5747 ( 8794 PWs) bands (ev): -26.2993 -26.2993 -26.2991 -26.2991 -25.4532 -25.4532 -25.4135 -25.4135 -11.0900 -11.0900 -11.0616 -11.0616 -10.9070 -10.9070 -10.0238 -10.0238 -9.9816 -9.9816 -9.7971 -9.7971 -9.7931 -9.7931 -9.6768 -9.6768 -9.3376 -9.3376 -9.2531 -9.2531 -9.1434 -9.1434 -9.0331 -9.0331 -8.9646 -8.9646 -8.6251 -8.6251 -8.3235 -8.3235 0.3612 0.3612 0.3663 0.3663 0.7253 0.7253 0.8259 0.8259 0.9121 0.9121 0.9860 0.9860 3.7973 3.7973 3.9392 3.9392 3.9618 3.9618 6.9006 6.9006 7.6248 7.6248 7.9220 7.9220 8.3667 8.3667 8.6965 8.6965 9.3620 9.3620 k = 0.5000 0.2201 0.5459 ( 8786 PWs) bands (ev): -26.2993 -26.2993 -26.2991 -26.2991 -25.4546 -25.4546 -25.4123 -25.4123 -11.0864 -11.0864 -11.0631 -11.0631 -10.8898 -10.8898 -10.0243 -10.0243 -9.9801 -9.9801 -9.7974 -9.7974 -9.7919 -9.7919 -9.6798 -9.6798 -9.3331 -9.3331 -9.2502 -9.2502 -9.1448 -9.1448 -9.0313 -9.0313 -8.9710 -8.9710 -8.6310 -8.6310 -8.3490 -8.3490 0.3674 0.3674 0.3704 0.3704 0.7345 0.7345 0.8301 0.8301 0.9152 0.9152 0.9895 0.9895 3.8035 3.8035 3.9712 3.9712 3.9944 3.9944 6.8388 6.8388 7.5490 7.5490 7.8622 7.8622 8.3323 8.3323 8.7302 8.7302 9.3784 9.3785 k = 0.5000 0.2201 0.5172 ( 8790 PWs) bands (ev): -26.2994 -26.2994 -26.2992 -26.2992 -25.4559 -25.4559 -25.4111 -25.4111 -11.0830 -11.0830 -11.0644 -11.0644 -10.8721 -10.8721 -10.0249 -10.0249 -9.9787 -9.9787 -9.7981 -9.7981 -9.7907 -9.7907 -9.6829 -9.6829 -9.3286 -9.3286 -9.2475 -9.2475 -9.1463 -9.1463 -9.0295 -9.0295 -8.9770 -8.9770 -8.6367 -8.6367 -8.3745 -8.3745 0.3739 0.3739 0.3752 0.3752 0.7440 0.7440 0.8347 0.8347 0.9184 0.9184 0.9932 0.9932 3.8094 3.8094 4.0031 4.0031 4.0266 4.0266 6.7778 6.7778 7.4742 7.4742 7.8000 7.8000 8.2978 8.2978 8.7696 8.7696 9.3065 9.3065 k = 0.5000 0.2201 0.4885 ( 8794 PWs) bands (ev): -26.2994 -26.2994 -26.2993 -26.2993 -25.4572 -25.4572 -25.4099 -25.4099 -11.0798 -11.0798 -11.0654 -11.0654 -10.8542 -10.8542 -10.0256 -10.0256 -9.9775 -9.9775 -9.7991 -9.7991 -9.7896 -9.7896 -9.6860 -9.6860 -9.3241 -9.3241 -9.2449 -9.2449 -9.1478 -9.1478 -9.0279 -9.0279 -8.9827 -8.9827 -8.6422 -8.6422 -8.3997 -8.3997 0.3798 0.3798 0.3816 0.3816 0.7537 0.7537 0.8396 0.8396 0.9218 0.9218 0.9968 0.9968 3.8148 3.8148 4.0347 4.0347 4.0583 4.0583 6.7179 6.7179 7.4005 7.4005 7.7370 7.7370 8.2638 8.2638 8.8133 8.8133 9.2359 9.2359 k = 0.5000 0.2201 0.4597 ( 8788 PWs) bands (ev): -26.2994 -26.2994 -26.2993 -26.2993 -25.4584 -25.4584 -25.4087 -25.4087 -11.0767 -11.0767 -11.0662 -11.0662 -10.8362 -10.8362 -10.0265 -10.0265 -9.9764 -9.9764 -9.8003 -9.8003 -9.7886 -9.7886 -9.6891 -9.6891 -9.3196 -9.3196 -9.2423 -9.2423 -9.1493 -9.1493 -9.0265 -9.0265 -8.9879 -8.9879 -8.6476 -8.6476 -8.4246 -8.4246 0.3852 0.3852 0.3891 0.3891 0.7635 0.7635 0.8447 0.8447 0.9254 0.9254 1.0006 1.0006 3.8197 3.8197 4.0659 4.0659 4.0893 4.0893 6.6592 6.6592 7.3284 7.3284 7.6744 7.6744 8.2306 8.2306 8.8599 8.8599 9.1683 9.1683 k = 0.5000 0.2201 0.4310 ( 8794 PWs) bands (ev): -26.2995 -26.2995 -26.2994 -26.2994 -25.4596 -25.4596 -25.4076 -25.4076 -11.0737 -11.0737 -11.0669 -11.0669 -10.8183 -10.8183 -10.0274 -10.0274 -9.9754 -9.9754 -9.8017 -9.8017 -9.7878 -9.7878 -9.6921 -9.6921 -9.3153 -9.3153 -9.2399 -9.2399 -9.1507 -9.1507 -9.0254 -9.0254 -8.9925 -8.9925 -8.6530 -8.6530 -8.4490 -8.4490 0.3908 0.3908 0.3970 0.3970 0.7734 0.7734 0.8500 0.8500 0.9294 0.9294 1.0043 1.0043 3.8241 3.8241 4.0964 4.0964 4.1194 4.1194 6.6023 6.6023 7.2581 7.2581 7.6131 7.6131 8.1985 8.1985 8.9087 8.9087 9.1040 9.1040 k = 0.5000 0.2201 0.4023 ( 8814 PWs) bands (ev): -26.2995 -26.2995 -26.2995 -26.2995 -25.4608 -25.4608 -25.4065 -25.4065 -11.0709 -11.0709 -11.0673 -11.0673 -10.8006 -10.8006 -10.0285 -10.0285 -9.9746 -9.9746 -9.8033 -9.8033 -9.7871 -9.7871 -9.6950 -9.6950 -9.3111 -9.3111 -9.2375 -9.2375 -9.1520 -9.1520 -9.0246 -9.0246 -8.9967 -8.9967 -8.6583 -8.6583 -8.4726 -8.4726 0.3964 0.3964 0.4051 0.4051 0.7833 0.7833 0.8553 0.8553 0.9336 0.9336 1.0081 1.0081 3.8280 3.8280 4.1262 4.1262 4.1485 4.1485 6.5472 6.5472 7.1899 7.1899 7.5537 7.5537 8.1678 8.1678 8.9589 8.9589 9.0431 9.0431 k = 0.5000 0.2201 0.3735 ( 8806 PWs) bands (ev): -26.2995 -26.2995 -26.2995 -26.2995 -25.4619 -25.4619 -25.4055 -25.4055 -11.0684 -11.0684 -11.0673 -11.0673 -10.7832 -10.7832 -10.0296 -10.0296 -9.9739 -9.9739 -9.8050 -9.8050 -9.7865 -9.7865 -9.6978 -9.6978 -9.3072 -9.3072 -9.2351 -9.2351 -9.1532 -9.1532 -9.0242 -9.0242 -9.0001 -9.0001 -8.6636 -8.6636 -8.4951 -8.4951 0.4021 0.4021 0.4133 0.4133 0.7931 0.7931 0.8605 0.8605 0.9382 0.9382 1.0119 1.0119 3.8314 3.8314 4.1549 4.1549 4.1764 4.1764 6.4944 6.4944 7.1241 7.1241 7.4968 7.4968 8.1387 8.1387 8.9857 8.9857 9.0100 9.0100 k = 0.5000 0.2201 0.3448 ( 8816 PWs) bands (ev): -26.2996 -26.2996 -26.2996 -26.2996 -25.4630 -25.4630 -25.4045 -25.4045 -11.0679 -11.0679 -11.0652 -11.0652 -10.7664 -10.7664 -10.0308 -10.0308 -9.9734 -9.9734 -9.8068 -9.8068 -9.7860 -9.7860 -9.7006 -9.7006 -9.3035 -9.3035 -9.2327 -9.2327 -9.1542 -9.1542 -9.0244 -9.0244 -9.0030 -9.0030 -8.6690 -8.6690 -8.5165 -8.5165 0.4076 0.4076 0.4215 0.4215 0.8028 0.8028 0.8655 0.8655 0.9431 0.9431 1.0156 1.0156 3.8343 3.8343 4.1825 4.1825 4.2029 4.2029 6.4441 6.4441 7.0612 7.0612 7.4428 7.4428 8.1114 8.1114 8.9322 8.9322 9.0610 9.0610 k = 0.5000 0.2201 0.3161 ( 8816 PWs) bands (ev): -26.2997 -26.2997 -26.2996 -26.2996 -25.4639 -25.4639 -25.4035 -25.4035 -11.0679 -11.0679 -11.0626 -11.0626 -10.7502 -10.7502 -10.0320 -10.0320 -9.9729 -9.9729 -9.8086 -9.8086 -9.7857 -9.7857 -9.7031 -9.7031 -9.3003 -9.3003 -9.2300 -9.2300 -9.1550 -9.1550 -9.0251 -9.0251 -9.0051 -9.0051 -8.6745 -8.6745 -8.5364 -8.5364 0.4130 0.4130 0.4296 0.4296 0.8123 0.8123 0.8702 0.8702 0.9483 0.9483 1.0193 1.0193 3.8366 3.8366 4.2088 4.2088 4.2280 4.2280 6.3967 6.3967 7.0014 7.0014 7.3920 7.3920 8.0859 8.0859 8.8825 8.8825 9.1117 9.1117 k = 0.5000 0.2201 0.2873 ( 8812 PWs) bands (ev): -26.2997 -26.2997 -26.2996 -26.2996 -25.4649 -25.4649 -25.4027 -25.4027 -11.0678 -11.0678 -11.0602 -11.0602 -10.7348 -10.7348 -10.0333 -10.0333 -9.9725 -9.9725 -9.8105 -9.8105 -9.7854 -9.7854 -9.7055 -9.7055 -9.2975 -9.2975 -9.2271 -9.2271 -9.1556 -9.1556 -9.0265 -9.0265 -9.0067 -9.0067 -8.6803 -8.6803 -8.5547 -8.5547 0.4181 0.4181 0.4373 0.4373 0.8216 0.8216 0.8745 0.8745 0.9537 0.9537 1.0228 1.0228 3.8385 3.8385 4.2335 4.2335 4.2515 4.2515 6.3523 6.3523 6.9451 6.9451 7.3447 7.3447 8.0623 8.0623 8.8368 8.8368 9.1613 9.1613 k = 0.5000 0.2201 0.2586 ( 8812 PWs) bands (ev): -26.2997 -26.2997 -26.2996 -26.2996 -25.4657 -25.4657 -25.4019 -25.4019 -11.0676 -11.0676 -11.0579 -11.0579 -10.7203 -10.7203 -10.0346 -10.0346 -9.9722 -9.9722 -9.8123 -9.8123 -9.7852 -9.7852 -9.7077 -9.7077 -9.2952 -9.2952 -9.2239 -9.2239 -9.1560 -9.1560 -9.0284 -9.0284 -9.0077 -9.0077 -8.6864 -8.6864 -8.5709 -8.5709 0.4228 0.4228 0.4448 0.4448 0.8306 0.8306 0.8784 0.8784 0.9591 0.9591 1.0263 1.0263 3.8399 3.8399 4.2564 4.2564 4.2733 4.2733 6.3113 6.3113 6.8926 6.8926 7.3013 7.3013 8.0409 8.0409 8.7951 8.7951 9.1973 9.1973 k = 0.5000 0.2201 0.2299 ( 8804 PWs) bands (ev): -26.2998 -26.2998 -26.2997 -26.2997 -25.4665 -25.4665 -25.4012 -25.4012 -11.0674 -11.0674 -11.0557 -11.0557 -10.7069 -10.7069 -10.0358 -10.0358 -9.9720 -9.9720 -9.8140 -9.8140 -9.7851 -9.7851 -9.7098 -9.7098 -9.2934 -9.2934 -9.2204 -9.2204 -9.1562 -9.1562 -9.0306 -9.0306 -9.0085 -9.0085 -8.6927 -8.6927 -8.5851 -8.5851 0.4272 0.4272 0.4517 0.4517 0.8392 0.8392 0.8817 0.8817 0.9646 0.9646 1.0295 1.0295 3.8410 3.8410 4.2775 4.2775 4.2932 4.2932 6.2739 6.2739 6.8445 6.8445 7.2618 7.2618 8.0215 8.0215 8.7576 8.7576 9.1690 9.1690 k = 0.5000 0.2201 0.2011 ( 8802 PWs) bands (ev): -26.2998 -26.2998 -26.2997 -26.2997 -25.4672 -25.4672 -25.4005 -25.4005 -11.0671 -11.0671 -11.0538 -11.0538 -10.6948 -10.6948 -10.0370 -10.0370 -9.9718 -9.9718 -9.8157 -9.8157 -9.7850 -9.7850 -9.7116 -9.7116 -9.2922 -9.2922 -9.2166 -9.2166 -9.1563 -9.1563 -9.0330 -9.0330 -9.0091 -9.0091 -8.6993 -8.6993 -8.5971 -8.5971 0.4311 0.4311 0.4581 0.4581 0.8473 0.8473 0.8844 0.8844 0.9699 0.9699 1.0325 1.0325 3.8417 3.8417 4.2965 4.2965 4.3111 4.3111 6.2403 6.2403 6.8009 6.8009 7.2266 7.2266 8.0043 8.0043 8.7243 8.7243 9.1438 9.1438 k = 0.5000 0.2201 0.1724 ( 8798 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4678 -25.4678 -25.3999 -25.3999 -11.0669 -11.0669 -11.0520 -11.0520 -10.6839 -10.6839 -10.0381 -10.0381 -9.9717 -9.9717 -9.8173 -9.8173 -9.7850 -9.7850 -9.7132 -9.7132 -9.2914 -9.2914 -9.2126 -9.2126 -9.1563 -9.1563 -9.0356 -9.0356 -9.0096 -9.0096 -8.7058 -8.7058 -8.6069 -8.6069 0.4345 0.4345 0.4638 0.4638 0.8549 0.8549 0.8866 0.8866 0.9749 0.9749 1.0353 1.0353 3.8422 3.8422 4.3132 4.3132 4.3270 4.3270 6.2107 6.2107 6.7624 6.7624 7.1958 7.1958 7.9893 7.9893 8.6953 8.6953 9.1221 9.1221 k = 0.5000 0.2201 0.1437 ( 8792 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4683 -25.4683 -25.3994 -25.3994 -11.0666 -11.0666 -11.0505 -11.0505 -10.6745 -10.6745 -10.0391 -10.0391 -9.9717 -9.9717 -9.8186 -9.8186 -9.7850 -9.7850 -9.7146 -9.7146 -9.2909 -9.2909 -9.2086 -9.2086 -9.1562 -9.1562 -9.0381 -9.0381 -9.0100 -9.0100 -8.7121 -8.7121 -8.6147 -8.6147 0.4374 0.4374 0.4687 0.4687 0.8617 0.8617 0.8882 0.8882 0.9794 0.9794 1.0377 1.0377 3.8424 3.8424 4.3275 4.3275 4.3407 4.3407 6.1854 6.1854 6.7291 6.7291 7.1694 7.1694 7.9766 7.9766 8.6707 8.6707 9.1037 9.1037 k = 0.5000 0.2201 0.1149 ( 8794 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4687 -25.4687 -25.3990 -25.3990 -11.0663 -11.0663 -11.0492 -11.0492 -10.6667 -10.6667 -10.0399 -10.0399 -9.9716 -9.9716 -9.8198 -9.8198 -9.7850 -9.7850 -9.7157 -9.7157 -9.2907 -9.2907 -9.2048 -9.2048 -9.1562 -9.1562 -9.0405 -9.0405 -9.0104 -9.0104 -8.7177 -8.7177 -8.6207 -8.6207 0.4398 0.4398 0.4728 0.4728 0.8678 0.8678 0.8892 0.8892 0.9832 0.9832 1.0397 1.0397 3.8425 3.8425 4.3393 4.3393 4.3522 4.3522 6.1645 6.1645 6.7014 6.7014 7.1477 7.1477 7.9662 7.9662 8.6505 8.6505 9.0888 9.0888 k = 0.5000 0.2201 0.0862 ( 8802 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4691 -25.4691 -25.3987 -25.3987 -11.0661 -11.0661 -11.0482 -11.0482 -10.6605 -10.6605 -10.0406 -10.0406 -9.9716 -9.9716 -9.8207 -9.8207 -9.7850 -9.7850 -9.7166 -9.7166 -9.2906 -9.2906 -9.2015 -9.2015 -9.1561 -9.1561 -9.0427 -9.0427 -9.0107 -9.0107 -8.7225 -8.7225 -8.6250 -8.6250 0.4416 0.4416 0.4761 0.4761 0.8730 0.8730 0.8895 0.8895 0.9864 0.9864 1.0414 1.0414 3.8425 3.8425 4.3486 4.3486 4.3612 4.3612 6.1481 6.1481 6.6796 6.6796 7.1307 7.1307 7.9580 7.9580 8.6347 8.6347 9.0772 9.0772 k = 0.5000 0.2201 0.0575 ( 8790 PWs) bands (ev): -26.2999 -26.2999 -26.2997 -26.2997 -25.4693 -25.4693 -25.3985 -25.3985 -11.0660 -11.0660 -11.0474 -11.0474 -10.6560 -10.6560 -10.0411 -10.0411 -9.9716 -9.9716 -9.8214 -9.8214 -9.7851 -9.7851 -9.7172 -9.7172 -9.2906 -9.2906 -9.1989 -9.1989 -9.1560 -9.1560 -9.0444 -9.0444 -9.0109 -9.0109 -8.7261 -8.7261 -8.6280 -8.6280 0.4430 0.4430 0.4785 0.4785 0.8773 0.8773 0.8893 0.8893 0.9887 0.9887 1.0426 1.0426 3.8425 3.8425 4.3552 4.3552 4.3678 4.3678 6.1363 6.1363 6.6639 6.6639 7.1186 7.1186 7.9522 7.9522 8.6234 8.6234 9.0689 9.0689 k = 0.5000 0.2201 0.0287 ( 8786 PWs) bands (ev): -26.3000 -26.3000 -26.2997 -26.2997 -25.4695 -25.4695 -25.3984 -25.3984 -11.0659 -11.0659 -11.0470 -11.0470 -10.6533 -10.6533 -10.0415 -10.0415 -9.9716 -9.9716 -9.8218 -9.8218 -9.7851 -9.7851 -9.7176 -9.7176 -9.2906 -9.2906 -9.1973 -9.1973 -9.1560 -9.1560 -9.0454 -9.0454 -9.0111 -9.0111 -8.7283 -8.7283 -8.6298 -8.6298 0.4438 0.4438 0.4799 0.4799 0.8804 0.8804 0.8887 0.8887 0.9902 0.9902 1.0433 1.0433 3.8425 3.8425 4.3592 4.3592 4.3718 4.3718 6.1292 6.1292 6.6544 6.6544 7.1112 7.1112 7.9487 7.9487 8.6166 8.6166 9.0640 9.0640 k = 0.5000 0.2201 0.0000 ( 8776 PWs) bands (ev): -26.3000 -26.3000 -26.2997 -26.2997 -25.4695 -25.4695 -25.3983 -25.3983 -11.0658 -11.0658 -11.0468 -11.0468 -10.6524 -10.6524 -10.0416 -10.0416 -9.9716 -9.9716 -9.8220 -9.8220 -9.7851 -9.7851 -9.7177 -9.7177 -9.2907 -9.2907 -9.1967 -9.1967 -9.1560 -9.1560 -9.0458 -9.0458 -9.0111 -9.0111 -8.7291 -8.7291 -8.6303 -8.6303 0.4440 0.4440 0.4804 0.4804 0.8816 0.8816 0.8883 0.8883 0.9906 0.9906 1.0435 1.0435 3.8425 3.8425 4.3606 4.3606 4.3731 4.3731 6.1268 6.1268 6.6512 6.6512 7.1088 7.1088 7.9475 7.9475 8.6144 8.6144 9.0624 9.0624 k = 0.0000 0.0000 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2289 -11.2289 -11.0371 -11.0371 -11.0089 -11.0089 -10.0296 -10.0296 -10.0283 -10.0283 -9.8393 -9.8393 -9.8093 -9.8093 -9.6358 -9.6358 -9.4056 -9.4056 -9.2957 -9.2957 -9.1345 -9.1345 -9.0592 -9.0592 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3198 0.3198 0.3976 0.3976 0.7029 0.7029 0.7872 0.7872 0.8769 0.8769 0.9012 0.9012 3.4586 3.4586 3.4872 3.4872 3.6702 3.6702 7.8441 7.8441 8.0497 8.0497 8.1378 8.1378 8.2030 8.2030 9.2112 9.2112 9.2350 9.2350 k = 0.0250 0.0110 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2289 -11.2289 -11.0380 -11.0380 -11.0080 -11.0080 -10.0296 -10.0296 -10.0284 -10.0284 -9.8393 -9.8393 -9.8093 -9.8093 -9.6360 -9.6360 -9.4052 -9.4052 -9.2959 -9.2959 -9.1345 -9.1345 -9.0592 -9.0592 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3199 0.3199 0.3974 0.3974 0.7027 0.7027 0.7877 0.7877 0.8767 0.8767 0.9013 0.9013 3.4587 3.4587 3.4871 3.4871 3.6701 3.6701 7.8451 7.8451 8.0481 8.0481 8.1384 8.1384 8.2028 8.2028 9.2136 9.2136 9.2357 9.2357 k = 0.0500 0.0220 1.2409 ( 8832 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2286 -11.2286 -11.0406 -11.0406 -11.0056 -11.0056 -10.0296 -10.0296 -10.0284 -10.0284 -9.8393 -9.8393 -9.8093 -9.8093 -9.6365 -9.6365 -9.4041 -9.4041 -9.2965 -9.2965 -9.1345 -9.1345 -9.0592 -9.0592 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3202 0.3202 0.3970 0.3970 0.7021 0.7021 0.7893 0.7893 0.8759 0.8759 0.9013 0.9013 3.4592 3.4592 3.4867 3.4867 3.6700 3.6700 7.8481 7.8481 8.0432 8.0432 8.1402 8.1402 8.2022 8.2022 9.2205 9.2205 9.2379 9.2379 k = 0.0750 0.0330 1.2409 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2283 -11.2283 -11.0439 -11.0439 -11.0025 -11.0025 -10.0295 -10.0295 -10.0284 -10.0284 -9.8393 -9.8393 -9.8092 -9.8092 -9.6372 -9.6372 -9.4024 -9.4024 -9.2975 -9.2975 -9.1345 -9.1345 -9.0593 -9.0593 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3206 0.3206 0.3964 0.3964 0.7011 0.7011 0.7918 0.7918 0.8746 0.8746 0.9014 0.9014 3.4599 3.4599 3.4860 3.4860 3.6698 3.6698 7.8531 7.8531 8.0354 8.0354 8.1431 8.1431 8.2012 8.2012 9.2295 9.2295 9.2436 9.2436 k = 0.1000 0.0440 1.2409 ( 8824 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2278 -11.2278 -11.0476 -11.0476 -10.9992 -10.9992 -10.0295 -10.0295 -10.0285 -10.0285 -9.8393 -9.8393 -9.8092 -9.8092 -9.6381 -9.6381 -9.4002 -9.4002 -9.2988 -9.2988 -9.1345 -9.1345 -9.0593 -9.0593 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3212 0.3212 0.3956 0.3956 0.6999 0.6999 0.7949 0.7949 0.8729 0.8729 0.9015 0.9015 3.4608 3.4608 3.4851 3.4851 3.6695 3.6695 7.8599 7.8599 8.0250 8.0250 8.1470 8.1470 8.1997 8.1997 9.2363 9.2363 9.2565 9.2565 k = 0.1250 0.0550 1.2409 ( 8844 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2273 -11.2273 -11.0512 -11.0512 -10.9961 -10.9961 -10.0295 -10.0295 -10.0286 -10.0286 -9.8393 -9.8393 -9.8092 -9.8092 -9.6391 -9.6391 -9.3978 -9.3978 -9.3002 -9.3002 -9.1345 -9.1345 -9.0594 -9.0594 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3218 0.3218 0.3947 0.3947 0.6987 0.6987 0.7985 0.7985 0.8707 0.8707 0.9016 0.9016 3.4620 3.4620 3.4839 3.4839 3.6693 3.6693 7.8686 7.8686 8.0124 8.0124 8.1516 8.1516 8.1978 8.1978 9.2413 9.2413 9.2753 9.2753 k = 0.1500 0.0660 1.2409 ( 8836 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2267 -11.2267 -11.0544 -11.0544 -10.9932 -10.9932 -10.0295 -10.0295 -10.0288 -10.0288 -9.8393 -9.8393 -9.8092 -9.8092 -9.6401 -9.6401 -9.3953 -9.3953 -9.3017 -9.3017 -9.1345 -9.1345 -9.0594 -9.0594 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3224 0.3224 0.3937 0.3937 0.6975 0.6975 0.8023 0.8023 0.8684 0.8684 0.9017 0.9017 3.4633 3.4633 3.4827 3.4827 3.6690 3.6690 7.8789 7.8789 7.9981 7.9981 8.1567 8.1567 8.1954 8.1954 9.2461 9.2461 9.2971 9.2971 k = 0.1750 0.0770 1.2409 ( 8814 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2263 -11.2263 -11.0571 -11.0571 -10.9909 -10.9909 -10.0294 -10.0294 -10.0288 -10.0288 -9.8393 -9.8393 -9.8092 -9.8092 -9.6410 -9.6410 -9.3929 -9.3929 -9.3032 -9.3032 -9.1345 -9.1345 -9.0594 -9.0594 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3230 0.3230 0.3929 0.3929 0.6964 0.6964 0.8059 0.8059 0.8660 0.8660 0.9019 0.9019 3.4646 3.4646 3.4814 3.4814 3.6688 3.6688 7.8908 7.8908 7.9828 7.9828 8.1620 8.1620 8.1925 8.1925 9.2511 9.2511 9.3192 9.3192 k = 0.2000 0.0881 1.2409 ( 8824 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2259 -11.2259 -11.0591 -11.0591 -10.9892 -10.9892 -10.0294 -10.0294 -10.0289 -10.0289 -9.8393 -9.8393 -9.8092 -9.8092 -9.6417 -9.6417 -9.3910 -9.3910 -9.3044 -9.3044 -9.1345 -9.1345 -9.0595 -9.0595 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3234 0.3234 0.3922 0.3922 0.6956 0.6956 0.8089 0.8089 0.8639 0.8639 0.9020 0.9020 3.4658 3.4658 3.4802 3.4802 3.6686 3.6686 7.9040 7.9040 7.9669 7.9669 8.1672 8.1672 8.1893 8.1893 9.2557 9.2557 9.3353 9.3353 k = 0.2250 0.0991 1.2409 ( 8826 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2256 -11.2256 -11.0604 -11.0604 -10.9882 -10.9882 -10.0293 -10.0293 -10.0290 -10.0290 -9.8393 -9.8393 -9.8092 -9.8092 -9.6421 -9.6421 -9.3898 -9.3898 -9.3052 -9.3052 -9.1345 -9.1345 -9.0595 -9.0595 -8.8549 -8.8549 -8.5107 -8.5107 -7.9608 -7.9608 0.3237 0.3237 0.3918 0.3918 0.6951 0.6951 0.8110 0.8110 0.8624 0.8624 0.9021 0.9021 3.4667 3.4667 3.4793 3.4793 3.6684 3.6684 7.9182 7.9182 7.9510 7.9510 8.1717 8.1717 8.1860 8.1860 9.2591 9.2591 9.3381 9.3381 k = 0.2500 0.1101 1.2409 ( 8828 PWs) bands (ev): -26.2988 -26.2988 -26.2979 -26.2979 -25.4325 -25.4325 -25.4325 -25.4325 -11.2255 -11.2255 -11.0608 -11.0608 -10.9878 -10.9878 -10.0293 -10.0293 -10.0290 -10.0290 -9.8393 -9.8393 -9.8092 -9.8092 -9.6423 -9.6423 -9.3894 -9.3894 -9.3054 -9.3054 -9.1345 -9.1345 -9.0595 -9.0595 -8.8549 -8.8549 -8.5107 -8.5107 -7.9609 -7.9609 0.3238 0.3238 0.3916 0.3916 0.6949 0.6949 0.8117 0.8117 0.8619 0.8619 0.9022 0.9022 3.4670 3.4670 3.4790 3.4790 3.6684 3.6684 7.9295 7.9295 7.9391 7.9391 8.1739 8.1739 8.1843 8.1843 9.2604 9.2604 9.3374 9.3374 Writing output data file K4Br2O.save init_run : 0.46s CPU 0.62s WALL ( 1 calls) electrons : 719.57s CPU 724.78s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.08s CPU 0.12s WALL ( 1 calls) Called by electrons: c_bands : 719.56s CPU 724.77s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.06s CPU 0.08s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.06s WALL ( 271 calls) cegterg : 663.43s CPU 667.76s WALL ( 577 calls) Called by sum_band: Called by *egterg: h_psi : 487.62s CPU 492.17s WALL ( 8914 calls) s_psi : 7.78s CPU 7.91s WALL ( 8914 calls) g_psi : 0.26s CPU 0.29s WALL ( 8066 calls) cdiaghg : 178.78s CPU 178.93s WALL ( 8337 calls) cegterg:over : 16.96s CPU 16.97s WALL ( 8066 calls) cegterg:upda : 11.30s CPU 11.12s WALL ( 8066 calls) cegterg:last : 4.99s CPU 4.96s WALL ( 1123 calls) cdiaghg:chol : 6.52s CPU 6.64s WALL ( 8337 calls) cdiaghg:inve : 4.80s CPU 4.93s WALL ( 8337 calls) cdiaghg:para : 10.84s CPU 10.82s WALL ( 16674 calls) Called by h_psi: h_psi:vloc : 467.46s CPU 472.05s WALL ( 8914 calls) h_psi:vnl : 19.84s CPU 19.78s WALL ( 8914 calls) add_vuspsi : 9.84s CPU 9.60s WALL ( 8914 calls) General routines calbec : 9.98s CPU 10.15s WALL ( 8914 calls) fft : 0.02s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 447.86s CPU 451.84s WALL ( 988312 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.18s CPU 0.23s WALL ( 542 calls) Parallel routines fft_scatter : 245.69s CPU 247.64s WALL ( 988335 calls) PWSCF : 12m50.87s CPU 13m22.84s WALL This run was terminated on: 4:39:14 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=