Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16: 4: 3 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Na4Br2O.save/ file Br.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 121 100 28 2813 2105 317 Max 122 101 29 2816 2129 319 Sum 4383 3623 1023 101325 76249 11459 bravais-lattice index = 14 lattice parameter (alat) = 15.3268 a.u. unit-cell volume = 1028.1463 (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 = 67.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.326812 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.844642 celldm(5)= -0.844642 celldm(6)= 0.689284 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.689284 0.724491 0.000000 ) a(3) = ( -0.844642 -0.362245 0.394155 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.951405 1.268538 ) b(2) = ( 0.000000 1.380280 1.268538 ) b(3) = ( 0.000000 0.000000 2.537076 ) 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 Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 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 1121 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Br 7.00 79.90400 Br( 1.00) Na 9.00 22.98980 Na( 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= 305 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 2) = ( 0.0000000 0.0000000 0.0253708), wk = 0.0032787 k( 3) = ( 0.0000000 0.0000000 0.0507415), wk = 0.0032787 k( 4) = ( 0.0000000 0.0000000 0.0761123), wk = 0.0032787 k( 5) = ( 0.0000000 0.0000000 0.1014830), wk = 0.0032787 k( 6) = ( 0.0000000 0.0000000 0.1268538), wk = 0.0032787 k( 7) = ( 0.0000000 0.0000000 0.1522246), wk = 0.0032787 k( 8) = ( 0.0000000 0.0000000 0.1775953), wk = 0.0032787 k( 9) = ( 0.0000000 0.0000000 0.2029661), wk = 0.0032787 k( 10) = ( 0.0000000 0.0000000 0.2283368), wk = 0.0032787 k( 11) = ( 0.0000000 0.0000000 0.2537076), wk = 0.0032787 k( 12) = ( 0.0000000 0.0000000 0.2790784), wk = 0.0032787 k( 13) = ( 0.0000000 0.0000000 0.3044491), wk = 0.0032787 k( 14) = ( 0.0000000 0.0000000 0.3298199), wk = 0.0032787 k( 15) = ( 0.0000000 0.0000000 0.3551906), wk = 0.0032787 k( 16) = ( 0.0000000 0.0000000 0.3805614), wk = 0.0032787 k( 17) = ( 0.0000000 0.0000000 0.4059322), wk = 0.0032787 k( 18) = ( 0.0000000 0.0000000 0.4313029), wk = 0.0032787 k( 19) = ( 0.0000000 0.0000000 0.4566737), wk = 0.0032787 k( 20) = ( 0.0000000 0.0000000 0.4820445), wk = 0.0032787 k( 21) = ( 0.0000000 0.0000000 0.5074152), wk = 0.0032787 k( 22) = ( 0.0000000 0.0000000 0.5327860), wk = 0.0032787 k( 23) = ( 0.0000000 0.0000000 0.5581567), wk = 0.0032787 k( 24) = ( 0.0000000 0.0000000 0.5835275), wk = 0.0032787 k( 25) = ( 0.0000000 0.0000000 0.6088983), wk = 0.0032787 k( 26) = ( 0.0000000 0.0000000 0.6342690), wk = 0.0032787 k( 27) = ( 0.0000000 0.0000000 0.6596398), wk = 0.0032787 k( 28) = ( 0.0000000 0.0000000 0.6850105), wk = 0.0032787 k( 29) = ( 0.0000000 0.0000000 0.7103813), wk = 0.0032787 k( 30) = ( 0.0000000 0.0000000 0.7357521), wk = 0.0032787 k( 31) = ( 0.0000000 0.0000000 0.7611228), wk = 0.0032787 k( 32) = ( 0.0000000 0.0000000 0.7864936), wk = 0.0032787 k( 33) = ( 0.0000000 0.0000000 0.8118643), wk = 0.0032787 k( 34) = ( 0.0000000 0.0000000 0.8372351), wk = 0.0032787 k( 35) = ( 0.0000000 0.0000000 0.8626059), wk = 0.0032787 k( 36) = ( 0.0000000 0.0000000 0.8879766), wk = 0.0032787 k( 37) = ( 0.0000000 0.0000000 0.9133474), wk = 0.0032787 k( 38) = ( 0.0000000 0.0000000 0.9387181), wk = 0.0032787 k( 39) = ( 0.0000000 0.0000000 0.9640889), wk = 0.0032787 k( 40) = ( 0.0000000 0.0000000 0.9894597), wk = 0.0032787 k( 41) = ( 0.0000000 0.0000000 1.0148304), wk = 0.0032787 k( 42) = ( 0.0000000 0.0000000 1.0402012), wk = 0.0032787 k( 43) = ( 0.0000000 0.0000000 1.0655719), wk = 0.0032787 k( 44) = ( 0.0000000 0.0000000 1.0909427), wk = 0.0032787 k( 45) = ( 0.0000000 0.0000000 1.1163135), wk = 0.0032787 k( 46) = ( 0.0000000 0.0000000 1.1416842), wk = 0.0032787 k( 47) = ( 0.0000000 0.0000000 1.1670550), wk = 0.0032787 k( 48) = ( 0.0000000 0.0000000 1.1924257), wk = 0.0032787 k( 49) = ( 0.0000000 0.0000000 1.2177965), wk = 0.0032787 k( 50) = ( 0.0000000 0.0000000 1.2431673), wk = 0.0032787 k( 51) = ( 0.0000000 0.0000000 1.2685380), wk = 0.0032787 k( 52) = ( 0.0000000 0.0000000 1.2685380), wk = 0.0032787 k( 53) = ( -0.0091967 0.0214437 1.2685380), wk = 0.0032787 k( 54) = ( -0.0183933 0.0428874 1.2685380), wk = 0.0032787 k( 55) = ( -0.0275900 0.0643312 1.2685380), wk = 0.0032787 k( 56) = ( -0.0367866 0.0857749 1.2685380), wk = 0.0032787 k( 57) = ( -0.0459833 0.1072186 1.2685380), wk = 0.0032787 k( 58) = ( -0.0459833 0.1072186 1.2685380), wk = 0.0032787 k( 59) = ( -0.0530773 0.1237596 1.2505400), wk = 0.0032787 k( 60) = ( -0.0601713 0.1403006 1.2325419), wk = 0.0032787 k( 61) = ( -0.0672653 0.1568416 1.2145439), wk = 0.0032787 k( 62) = ( -0.0743594 0.1733826 1.1965459), wk = 0.0032787 k( 63) = ( -0.0814534 0.1899236 1.1785478), wk = 0.0032787 k( 64) = ( -0.0885474 0.2064646 1.1605498), wk = 0.0032787 k( 65) = ( -0.0956414 0.2230056 1.1425517), wk = 0.0032787 k( 66) = ( -0.1027354 0.2395466 1.1245537), wk = 0.0032787 k( 67) = ( -0.1098294 0.2560876 1.1065556), wk = 0.0032787 k( 68) = ( -0.1169234 0.2726286 1.0885576), wk = 0.0032787 k( 69) = ( -0.1240174 0.2891696 1.0705595), wk = 0.0032787 k( 70) = ( -0.1311114 0.3057106 1.0525615), wk = 0.0032787 k( 71) = ( -0.1382055 0.3222516 1.0345634), wk = 0.0032787 k( 72) = ( -0.1452995 0.3387926 1.0165654), wk = 0.0032787 k( 73) = ( -0.1523935 0.3553336 0.9985674), wk = 0.0032787 k( 74) = ( -0.1594875 0.3718746 0.9805693), wk = 0.0032787 k( 75) = ( -0.1665815 0.3884156 0.9625713), wk = 0.0032787 k( 76) = ( -0.1736755 0.4049566 0.9445732), wk = 0.0032787 k( 77) = ( -0.1807695 0.4214976 0.9265752), wk = 0.0032787 k( 78) = ( -0.1878635 0.4380386 0.9085771), wk = 0.0032787 k( 79) = ( -0.1949575 0.4545796 0.8905791), wk = 0.0032787 k( 80) = ( -0.2020515 0.4711206 0.8725810), wk = 0.0032787 k( 81) = ( -0.2091456 0.4876616 0.8545830), wk = 0.0032787 k( 82) = ( -0.2162396 0.5042026 0.8365849), wk = 0.0032787 k( 83) = ( -0.2233336 0.5207436 0.8185869), wk = 0.0032787 k( 84) = ( -0.2304276 0.5372846 0.8005889), wk = 0.0032787 k( 85) = ( -0.2375216 0.5538256 0.7825908), wk = 0.0032787 k( 86) = ( -0.2446156 0.5703665 0.7645928), wk = 0.0032787 k( 87) = ( -0.2517096 0.5869075 0.7465947), wk = 0.0032787 k( 88) = ( -0.2588036 0.6034485 0.7285967), wk = 0.0032787 k( 89) = ( -0.2658976 0.6199896 0.7105986), wk = 0.0032787 k( 90) = ( -0.2729917 0.6365306 0.6926006), wk = 0.0032787 k( 91) = ( -0.2729917 0.6365306 0.6926006), wk = 0.0032787 k( 92) = ( -0.2658077 0.6197798 0.6743743), wk = 0.0032787 k( 93) = ( -0.2586237 0.6030289 0.6561479), wk = 0.0032787 k( 94) = ( -0.2514397 0.5862781 0.6379216), wk = 0.0032787 k( 95) = ( -0.2442557 0.5695273 0.6196953), wk = 0.0032787 k( 96) = ( -0.2370717 0.5527765 0.6014689), wk = 0.0032787 k( 97) = ( -0.2298877 0.5360257 0.5832426), wk = 0.0032787 k( 98) = ( -0.2227037 0.5192749 0.5650163), wk = 0.0032787 k( 99) = ( -0.2155197 0.5025241 0.5467899), wk = 0.0032787 k( 100) = ( -0.2083357 0.4857733 0.5285636), wk = 0.0032787 k( 101) = ( -0.2011517 0.4690225 0.5103373), wk = 0.0032787 k( 102) = ( -0.1939678 0.4522717 0.4921110), wk = 0.0032787 k( 103) = ( -0.1867838 0.4355209 0.4738846), wk = 0.0032787 k( 104) = ( -0.1795998 0.4187701 0.4556583), wk = 0.0032787 k( 105) = ( -0.1724158 0.4020193 0.4374319), wk = 0.0032787 k( 106) = ( -0.1652318 0.3852685 0.4192056), wk = 0.0032787 k( 107) = ( -0.1580478 0.3685177 0.4009793), wk = 0.0032787 k( 108) = ( -0.1508638 0.3517669 0.3827530), wk = 0.0032787 k( 109) = ( -0.1436798 0.3350161 0.3645266), wk = 0.0032787 k( 110) = ( -0.1364958 0.3182653 0.3463003), wk = 0.0032787 k( 111) = ( -0.1293118 0.3015145 0.3280740), wk = 0.0032787 k( 112) = ( -0.1221278 0.2847637 0.3098476), wk = 0.0032787 k( 113) = ( -0.1149439 0.2680129 0.2916213), wk = 0.0032787 k( 114) = ( -0.1077599 0.2512620 0.2733950), wk = 0.0032787 k( 115) = ( -0.1005759 0.2345112 0.2551686), wk = 0.0032787 k( 116) = ( -0.0933919 0.2177604 0.2369423), wk = 0.0032787 k( 117) = ( -0.0862079 0.2010096 0.2187160), wk = 0.0032787 k( 118) = ( -0.0790239 0.1842588 0.2004896), wk = 0.0032787 k( 119) = ( -0.0718399 0.1675080 0.1822633), wk = 0.0032787 k( 120) = ( -0.0646559 0.1507572 0.1640370), wk = 0.0032787 k( 121) = ( -0.0574719 0.1340064 0.1458107), wk = 0.0032787 k( 122) = ( -0.0502879 0.1172556 0.1275843), wk = 0.0032787 k( 123) = ( -0.0431040 0.1005048 0.1093580), wk = 0.0032787 k( 124) = ( -0.0359199 0.0837540 0.0911316), wk = 0.0032787 k( 125) = ( -0.0287360 0.0670032 0.0729053), wk = 0.0032787 k( 126) = ( -0.0215520 0.0502524 0.0546790), wk = 0.0032787 k( 127) = ( -0.0143680 0.0335016 0.0364527), wk = 0.0032787 k( 128) = ( -0.0071840 0.0167508 0.0182263), wk = 0.0032787 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 131) = ( 0.0227273 0.0097471 0.0000000), wk = 0.0032787 k( 132) = ( 0.0454546 0.0194943 0.0000000), wk = 0.0032787 k( 133) = ( 0.0681818 0.0292414 0.0000000), wk = 0.0032787 k( 134) = ( 0.0909091 0.0389886 0.0000000), wk = 0.0032787 k( 135) = ( 0.1136364 0.0487357 0.0000000), wk = 0.0032787 k( 136) = ( 0.1363636 0.0584829 0.0000000), wk = 0.0032787 k( 137) = ( 0.1590909 0.0682300 0.0000000), wk = 0.0032787 k( 138) = ( 0.1818182 0.0779772 0.0000000), wk = 0.0032787 k( 139) = ( 0.2045454 0.0877243 0.0000000), wk = 0.0032787 k( 140) = ( 0.2272727 0.0974715 0.0000000), wk = 0.0032787 k( 141) = ( 0.2500000 0.1072186 0.0000000), wk = 0.0032787 k( 142) = ( 0.2727273 0.1169657 0.0000000), wk = 0.0032787 k( 143) = ( 0.2954545 0.1267129 0.0000000), wk = 0.0032787 k( 144) = ( 0.3181818 0.1364600 0.0000000), wk = 0.0032787 k( 145) = ( 0.3409091 0.1462072 0.0000000), wk = 0.0032787 k( 146) = ( 0.3636364 0.1559543 0.0000000), wk = 0.0032787 k( 147) = ( 0.3863636 0.1657015 0.0000000), wk = 0.0032787 k( 148) = ( 0.4090909 0.1754486 0.0000000), wk = 0.0032787 k( 149) = ( 0.4318182 0.1851958 0.0000000), wk = 0.0032787 k( 150) = ( 0.4545455 0.1949429 0.0000000), wk = 0.0032787 k( 151) = ( 0.4772727 0.2046901 0.0000000), wk = 0.0032787 k( 152) = ( 0.5000000 0.2144372 0.0000000), wk = 0.0032787 k( 153) = ( 0.5000000 0.2144372 0.0000000), wk = 0.0032787 k( 154) = ( 0.4929060 0.2309782 0.0179980), wk = 0.0032787 k( 155) = ( 0.4858120 0.2475192 0.0359961), wk = 0.0032787 k( 156) = ( 0.4787180 0.2640602 0.0539941), wk = 0.0032787 k( 157) = ( 0.4716240 0.2806012 0.0719922), wk = 0.0032787 k( 158) = ( 0.4645300 0.2971422 0.0899902), wk = 0.0032787 k( 159) = ( 0.4574359 0.3136832 0.1079883), wk = 0.0032787 k( 160) = ( 0.4503419 0.3302242 0.1259863), wk = 0.0032787 k( 161) = ( 0.4432479 0.3467652 0.1439844), wk = 0.0032787 k( 162) = ( 0.4361539 0.3633062 0.1619824), wk = 0.0032787 k( 163) = ( 0.4290599 0.3798472 0.1799805), wk = 0.0032787 k( 164) = ( 0.4219659 0.3963882 0.1979785), wk = 0.0032787 k( 165) = ( 0.4148719 0.4129292 0.2159765), wk = 0.0032787 k( 166) = ( 0.4077779 0.4294702 0.2339746), wk = 0.0032787 k( 167) = ( 0.4006839 0.4460112 0.2519726), wk = 0.0032787 k( 168) = ( 0.3935898 0.4625522 0.2699707), wk = 0.0032787 k( 169) = ( 0.3864958 0.4790932 0.2879687), wk = 0.0032787 k( 170) = ( 0.3794018 0.4956342 0.3059668), wk = 0.0032787 k( 171) = ( 0.3723078 0.5121752 0.3239648), wk = 0.0032787 k( 172) = ( 0.3652138 0.5287162 0.3419628), wk = 0.0032787 k( 173) = ( 0.3581198 0.5452572 0.3599609), wk = 0.0032787 k( 174) = ( 0.3510258 0.5617982 0.3779590), wk = 0.0032787 k( 175) = ( 0.3439318 0.5783392 0.3959570), wk = 0.0032787 k( 176) = ( 0.3368377 0.5948802 0.4139550), wk = 0.0032787 k( 177) = ( 0.3297437 0.6114212 0.4319531), wk = 0.0032787 k( 178) = ( 0.3226497 0.6279622 0.4499511), wk = 0.0032787 k( 179) = ( 0.3155557 0.6445032 0.4679492), wk = 0.0032787 k( 180) = ( 0.3084617 0.6610442 0.4859472), wk = 0.0032787 k( 181) = ( 0.3013677 0.6775852 0.5039453), wk = 0.0032787 k( 182) = ( 0.2942737 0.6941262 0.5219433), wk = 0.0032787 k( 183) = ( 0.2871797 0.7106671 0.5399413), wk = 0.0032787 k( 184) = ( 0.2800857 0.7272081 0.5579394), wk = 0.0032787 k( 185) = ( 0.2729917 0.7437491 0.5759374), wk = 0.0032787 k( 186) = ( 0.2729917 0.7437491 0.5759374), wk = 0.0032787 k( 187) = ( 0.2502424 0.7392817 0.5807984), wk = 0.0032787 k( 188) = ( 0.2274931 0.7348143 0.5856594), wk = 0.0032787 k( 189) = ( 0.2047437 0.7303468 0.5905203), wk = 0.0032787 k( 190) = ( 0.1819944 0.7258794 0.5953813), wk = 0.0032787 k( 191) = ( 0.1592451 0.7214119 0.6002423), wk = 0.0032787 k( 192) = ( 0.1364958 0.7169445 0.6051032), wk = 0.0032787 k( 193) = ( 0.1137465 0.7124771 0.6099642), wk = 0.0032787 k( 194) = ( 0.0909972 0.7080096 0.6148252), wk = 0.0032787 k( 195) = ( 0.0682479 0.7035422 0.6196861), wk = 0.0032787 k( 196) = ( 0.0454986 0.6990747 0.6245471), wk = 0.0032787 k( 197) = ( 0.0227493 0.6946073 0.6294081), wk = 0.0032787 k( 198) = ( 0.0000000 0.6901398 0.6342690), wk = 0.0032787 k( 199) = ( 0.0000000 0.6901398 0.6342690), wk = 0.0032787 k( 200) = ( 0.0071429 0.6734850 0.6523910), wk = 0.0032787 k( 201) = ( 0.0142857 0.6568301 0.6705129), wk = 0.0032787 k( 202) = ( 0.0214286 0.6401752 0.6886349), wk = 0.0032787 k( 203) = ( 0.0285714 0.6235203 0.7067569), wk = 0.0032787 k( 204) = ( 0.0357143 0.6068654 0.7248789), wk = 0.0032787 k( 205) = ( 0.0428571 0.5902105 0.7430008), wk = 0.0032787 k( 206) = ( 0.0500000 0.5735556 0.7611228), wk = 0.0032787 k( 207) = ( 0.0571429 0.5569007 0.7792448), wk = 0.0032787 k( 208) = ( 0.0642857 0.5402458 0.7973668), wk = 0.0032787 k( 209) = ( 0.0714286 0.5235909 0.8154887), wk = 0.0032787 k( 210) = ( 0.0785714 0.5069360 0.8336107), wk = 0.0032787 k( 211) = ( 0.0857143 0.4902811 0.8517327), wk = 0.0032787 k( 212) = ( 0.0928571 0.4736262 0.8698546), wk = 0.0032787 k( 213) = ( 0.1000000 0.4569713 0.8879766), wk = 0.0032787 k( 214) = ( 0.1071429 0.4403165 0.9060986), wk = 0.0032787 k( 215) = ( 0.1142857 0.4236616 0.9242206), wk = 0.0032787 k( 216) = ( 0.1214286 0.4070067 0.9423425), wk = 0.0032787 k( 217) = ( 0.1285714 0.3903518 0.9604645), wk = 0.0032787 k( 218) = ( 0.1357143 0.3736969 0.9785865), wk = 0.0032787 k( 219) = ( 0.1428571 0.3570420 0.9967084), wk = 0.0032787 k( 220) = ( 0.1500000 0.3403871 1.0148304), wk = 0.0032787 k( 221) = ( 0.1571429 0.3237322 1.0329524), wk = 0.0032787 k( 222) = ( 0.1642857 0.3070773 1.0510744), wk = 0.0032787 k( 223) = ( 0.1714286 0.2904224 1.0691963), wk = 0.0032787 k( 224) = ( 0.1785714 0.2737675 1.0873183), wk = 0.0032787 k( 225) = ( 0.1857143 0.2571126 1.1054403), wk = 0.0032787 k( 226) = ( 0.1928571 0.2404577 1.1235622), wk = 0.0032787 k( 227) = ( 0.2000000 0.2238028 1.1416842), wk = 0.0032787 k( 228) = ( 0.2071429 0.2071479 1.1598062), wk = 0.0032787 k( 229) = ( 0.2142857 0.1904931 1.1779282), wk = 0.0032787 k( 230) = ( 0.2214286 0.1738382 1.1960501), wk = 0.0032787 k( 231) = ( 0.2285714 0.1571833 1.2141721), wk = 0.0032787 k( 232) = ( 0.2357143 0.1405284 1.2322941), wk = 0.0032787 k( 233) = ( 0.2428571 0.1238735 1.2504161), wk = 0.0032787 k( 234) = ( 0.2500000 0.1072186 1.2685380), wk = 0.0032787 k( 235) = ( 0.2500000 0.1072186 1.2685380), wk = 0.0032787 k( 236) = ( 0.2708333 0.1161535 1.2588161), wk = 0.0032787 k( 237) = ( 0.2916667 0.1250884 1.2490942), wk = 0.0032787 k( 238) = ( 0.3125000 0.1340232 1.2393722), wk = 0.0032787 k( 239) = ( 0.3333333 0.1429581 1.2296503), wk = 0.0032787 k( 240) = ( 0.3541667 0.1518930 1.2199284), wk = 0.0032787 k( 241) = ( 0.3750000 0.1608279 1.2102064), wk = 0.0032787 k( 242) = ( 0.3958333 0.1697628 1.2004845), wk = 0.0032787 k( 243) = ( 0.4166667 0.1786977 1.1907626), wk = 0.0032787 k( 244) = ( 0.4375000 0.1876325 1.1810407), wk = 0.0032787 k( 245) = ( 0.4583333 0.1965674 1.1713187), wk = 0.0032787 k( 246) = ( 0.4791667 0.2055023 1.1615968), wk = 0.0032787 k( 247) = ( 0.5000000 0.2144372 1.1518749), wk = 0.0032787 k( 248) = ( 0.5000000 0.2144372 1.1518749), wk = 0.0032787 k( 249) = ( 0.5000000 0.2144372 1.1262777), wk = 0.0032787 k( 250) = ( 0.5000000 0.2144372 1.1006804), wk = 0.0032787 k( 251) = ( 0.5000000 0.2144372 1.0750832), wk = 0.0032787 k( 252) = ( 0.5000000 0.2144372 1.0494860), wk = 0.0032787 k( 253) = ( 0.5000000 0.2144372 1.0238888), wk = 0.0032787 k( 254) = ( 0.5000000 0.2144372 0.9982916), wk = 0.0032787 k( 255) = ( 0.5000000 0.2144372 0.9726943), wk = 0.0032787 k( 256) = ( 0.5000000 0.2144372 0.9470971), wk = 0.0032787 k( 257) = ( 0.5000000 0.2144372 0.9214999), wk = 0.0032787 k( 258) = ( 0.5000000 0.2144372 0.8959027), wk = 0.0032787 k( 259) = ( 0.5000000 0.2144372 0.8703055), wk = 0.0032787 k( 260) = ( 0.5000000 0.2144372 0.8447082), wk = 0.0032787 k( 261) = ( 0.5000000 0.2144372 0.8191110), wk = 0.0032787 k( 262) = ( 0.5000000 0.2144372 0.7935138), wk = 0.0032787 k( 263) = ( 0.5000000 0.2144372 0.7679166), wk = 0.0032787 k( 264) = ( 0.5000000 0.2144372 0.7423194), wk = 0.0032787 k( 265) = ( 0.5000000 0.2144372 0.7167221), wk = 0.0032787 k( 266) = ( 0.5000000 0.2144372 0.6911249), wk = 0.0032787 k( 267) = ( 0.5000000 0.2144372 0.6655277), wk = 0.0032787 k( 268) = ( 0.5000000 0.2144372 0.6399305), wk = 0.0032787 k( 269) = ( 0.5000000 0.2144372 0.6143333), wk = 0.0032787 k( 270) = ( 0.5000000 0.2144372 0.5887360), wk = 0.0032787 k( 271) = ( 0.5000000 0.2144372 0.5631388), wk = 0.0032787 k( 272) = ( 0.5000000 0.2144372 0.5375416), wk = 0.0032787 k( 273) = ( 0.5000000 0.2144372 0.5119444), wk = 0.0032787 k( 274) = ( 0.5000000 0.2144372 0.4863472), wk = 0.0032787 k( 275) = ( 0.5000000 0.2144372 0.4607500), wk = 0.0032787 k( 276) = ( 0.5000000 0.2144372 0.4351527), wk = 0.0032787 k( 277) = ( 0.5000000 0.2144372 0.4095555), wk = 0.0032787 k( 278) = ( 0.5000000 0.2144372 0.3839583), wk = 0.0032787 k( 279) = ( 0.5000000 0.2144372 0.3583611), wk = 0.0032787 k( 280) = ( 0.5000000 0.2144372 0.3327639), wk = 0.0032787 k( 281) = ( 0.5000000 0.2144372 0.3071666), wk = 0.0032787 k( 282) = ( 0.5000000 0.2144372 0.2815694), wk = 0.0032787 k( 283) = ( 0.5000000 0.2144372 0.2559722), wk = 0.0032787 k( 284) = ( 0.5000000 0.2144372 0.2303750), wk = 0.0032787 k( 285) = ( 0.5000000 0.2144372 0.2047778), wk = 0.0032787 k( 286) = ( 0.5000000 0.2144372 0.1791805), wk = 0.0032787 k( 287) = ( 0.5000000 0.2144372 0.1535833), wk = 0.0032787 k( 288) = ( 0.5000000 0.2144372 0.1279861), wk = 0.0032787 k( 289) = ( 0.5000000 0.2144372 0.1023889), wk = 0.0032787 k( 290) = ( 0.5000000 0.2144372 0.0767917), wk = 0.0032787 k( 291) = ( 0.5000000 0.2144372 0.0511944), wk = 0.0032787 k( 292) = ( 0.5000000 0.2144372 0.0255972), wk = 0.0032787 k( 293) = ( 0.5000000 0.2144372 0.0000000), wk = 0.0032787 k( 294) = ( 0.0000000 0.0000000 1.2685380), wk = 0.0032787 k( 295) = ( 0.0227273 0.0097471 1.2685380), wk = 0.0032787 k( 296) = ( 0.0454546 0.0194943 1.2685380), wk = 0.0032787 k( 297) = ( 0.0681818 0.0292414 1.2685380), wk = 0.0032787 k( 298) = ( 0.0909091 0.0389886 1.2685380), wk = 0.0032787 k( 299) = ( 0.1136364 0.0487357 1.2685380), wk = 0.0032787 k( 300) = ( 0.1363636 0.0584829 1.2685380), wk = 0.0032787 k( 301) = ( 0.1590909 0.0682300 1.2685380), wk = 0.0032787 k( 302) = ( 0.1818182 0.0779772 1.2685380), wk = 0.0032787 k( 303) = ( 0.2045454 0.0877243 1.2685380), wk = 0.0032787 k( 304) = ( 0.2272727 0.0974715 1.2685380), wk = 0.0032787 k( 305) = ( 0.2500000 0.1072186 1.2685380), wk = 0.0032787 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 2) = ( 0.0000000 0.0000000 0.0100000), wk = 0.0032787 k( 3) = ( 0.0000000 0.0000000 0.0200000), wk = 0.0032787 k( 4) = ( 0.0000000 0.0000000 0.0300000), wk = 0.0032787 k( 5) = ( 0.0000000 0.0000000 0.0400000), wk = 0.0032787 k( 6) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0032787 k( 7) = ( 0.0000000 0.0000000 0.0600000), wk = 0.0032787 k( 8) = ( 0.0000000 0.0000000 0.0700000), wk = 0.0032787 k( 9) = ( 0.0000000 0.0000000 0.0800000), wk = 0.0032787 k( 10) = ( 0.0000000 0.0000000 0.0900000), wk = 0.0032787 k( 11) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0032787 k( 12) = ( 0.0000000 0.0000000 0.1100000), wk = 0.0032787 k( 13) = ( 0.0000000 0.0000000 0.1200000), wk = 0.0032787 k( 14) = ( 0.0000000 0.0000000 0.1300000), wk = 0.0032787 k( 15) = ( 0.0000000 0.0000000 0.1400000), wk = 0.0032787 k( 16) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0032787 k( 17) = ( 0.0000000 0.0000000 0.1600000), wk = 0.0032787 k( 18) = ( 0.0000000 0.0000000 0.1700000), wk = 0.0032787 k( 19) = ( 0.0000000 0.0000000 0.1800000), wk = 0.0032787 k( 20) = ( 0.0000000 0.0000000 0.1900000), wk = 0.0032787 k( 21) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0032787 k( 22) = ( 0.0000000 0.0000000 0.2100000), wk = 0.0032787 k( 23) = ( 0.0000000 0.0000000 0.2200000), wk = 0.0032787 k( 24) = ( 0.0000000 0.0000000 0.2300000), wk = 0.0032787 k( 25) = ( 0.0000000 0.0000000 0.2400000), wk = 0.0032787 k( 26) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0032787 k( 27) = ( 0.0000000 0.0000000 0.2600000), wk = 0.0032787 k( 28) = ( 0.0000000 0.0000000 0.2700000), wk = 0.0032787 k( 29) = ( 0.0000000 0.0000000 0.2800000), wk = 0.0032787 k( 30) = ( 0.0000000 0.0000000 0.2900000), wk = 0.0032787 k( 31) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0032787 k( 32) = ( 0.0000000 0.0000000 0.3100000), wk = 0.0032787 k( 33) = ( 0.0000000 0.0000000 0.3200000), wk = 0.0032787 k( 34) = ( 0.0000000 0.0000000 0.3300000), wk = 0.0032787 k( 35) = ( 0.0000000 0.0000000 0.3400000), wk = 0.0032787 k( 36) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0032787 k( 37) = ( 0.0000000 0.0000000 0.3600000), wk = 0.0032787 k( 38) = ( 0.0000000 0.0000000 0.3700000), wk = 0.0032787 k( 39) = ( 0.0000000 0.0000000 0.3800000), wk = 0.0032787 k( 40) = ( 0.0000000 0.0000000 0.3900000), wk = 0.0032787 k( 41) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0032787 k( 42) = ( 0.0000000 0.0000000 0.4100000), wk = 0.0032787 k( 43) = ( 0.0000000 0.0000000 0.4200000), wk = 0.0032787 k( 44) = ( 0.0000000 0.0000000 0.4300000), wk = 0.0032787 k( 45) = ( 0.0000000 0.0000000 0.4400000), wk = 0.0032787 k( 46) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0032787 k( 47) = ( 0.0000000 0.0000000 0.4600000), wk = 0.0032787 k( 48) = ( 0.0000000 0.0000000 0.4700000), wk = 0.0032787 k( 49) = ( 0.0000000 0.0000000 0.4800000), wk = 0.0032787 k( 50) = ( 0.0000000 0.0000000 0.4900000), wk = 0.0032787 k( 51) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032787 k( 52) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032787 k( 53) = ( -0.0091967 0.0091967 0.5000000), wk = 0.0032787 k( 54) = ( -0.0183933 0.0183933 0.5000000), wk = 0.0032787 k( 55) = ( -0.0275900 0.0275900 0.5000000), wk = 0.0032787 k( 56) = ( -0.0367866 0.0367866 0.5000000), wk = 0.0032787 k( 57) = ( -0.0459833 0.0459833 0.5000000), wk = 0.0032787 k( 58) = ( -0.0459833 0.0459833 0.5000000), wk = 0.0032787 k( 59) = ( -0.0530773 0.0530773 0.4929060), wk = 0.0032787 k( 60) = ( -0.0601713 0.0601713 0.4858120), wk = 0.0032787 k( 61) = ( -0.0672653 0.0672653 0.4787180), wk = 0.0032787 k( 62) = ( -0.0743594 0.0743594 0.4716240), wk = 0.0032787 k( 63) = ( -0.0814534 0.0814534 0.4645299), wk = 0.0032787 k( 64) = ( -0.0885474 0.0885474 0.4574359), wk = 0.0032787 k( 65) = ( -0.0956414 0.0956414 0.4503419), wk = 0.0032787 k( 66) = ( -0.1027354 0.1027354 0.4432479), wk = 0.0032787 k( 67) = ( -0.1098294 0.1098294 0.4361539), wk = 0.0032787 k( 68) = ( -0.1169234 0.1169234 0.4290599), wk = 0.0032787 k( 69) = ( -0.1240174 0.1240174 0.4219659), wk = 0.0032787 k( 70) = ( -0.1311114 0.1311114 0.4148719), wk = 0.0032787 k( 71) = ( -0.1382055 0.1382055 0.4077779), wk = 0.0032787 k( 72) = ( -0.1452995 0.1452995 0.4006838), wk = 0.0032787 k( 73) = ( -0.1523935 0.1523935 0.3935898), wk = 0.0032787 k( 74) = ( -0.1594875 0.1594875 0.3864958), wk = 0.0032787 k( 75) = ( -0.1665815 0.1665815 0.3794018), wk = 0.0032787 k( 76) = ( -0.1736755 0.1736755 0.3723078), wk = 0.0032787 k( 77) = ( -0.1807695 0.1807695 0.3652138), wk = 0.0032787 k( 78) = ( -0.1878635 0.1878635 0.3581198), wk = 0.0032787 k( 79) = ( -0.1949575 0.1949575 0.3510258), wk = 0.0032787 k( 80) = ( -0.2020515 0.2020516 0.3439318), wk = 0.0032787 k( 81) = ( -0.2091456 0.2091456 0.3368377), wk = 0.0032787 k( 82) = ( -0.2162396 0.2162396 0.3297437), wk = 0.0032787 k( 83) = ( -0.2233336 0.2233336 0.3226497), wk = 0.0032787 k( 84) = ( -0.2304276 0.2304276 0.3155557), wk = 0.0032787 k( 85) = ( -0.2375216 0.2375216 0.3084617), wk = 0.0032787 k( 86) = ( -0.2446156 0.2446156 0.3013677), wk = 0.0032787 k( 87) = ( -0.2517096 0.2517096 0.2942737), wk = 0.0032787 k( 88) = ( -0.2588036 0.2588036 0.2871797), wk = 0.0032787 k( 89) = ( -0.2658976 0.2658976 0.2800857), wk = 0.0032787 k( 90) = ( -0.2729917 0.2729917 0.2729917), wk = 0.0032787 k( 91) = ( -0.2729917 0.2729917 0.2729917), wk = 0.0032787 k( 92) = ( -0.2658077 0.2658077 0.2658077), wk = 0.0032787 k( 93) = ( -0.2586237 0.2586237 0.2586237), wk = 0.0032787 k( 94) = ( -0.2514397 0.2514397 0.2514397), wk = 0.0032787 k( 95) = ( -0.2442557 0.2442557 0.2442557), wk = 0.0032787 k( 96) = ( -0.2370717 0.2370717 0.2370717), wk = 0.0032787 k( 97) = ( -0.2298877 0.2298877 0.2298877), wk = 0.0032787 k( 98) = ( -0.2227037 0.2227037 0.2227037), wk = 0.0032787 k( 99) = ( -0.2155197 0.2155197 0.2155197), wk = 0.0032787 k( 100) = ( -0.2083357 0.2083357 0.2083357), wk = 0.0032787 k( 101) = ( -0.2011517 0.2011518 0.2011517), wk = 0.0032787 k( 102) = ( -0.1939678 0.1939678 0.1939678), wk = 0.0032787 k( 103) = ( -0.1867838 0.1867838 0.1867838), wk = 0.0032787 k( 104) = ( -0.1795998 0.1795998 0.1795998), wk = 0.0032787 k( 105) = ( -0.1724158 0.1724158 0.1724158), wk = 0.0032787 k( 106) = ( -0.1652318 0.1652318 0.1652318), wk = 0.0032787 k( 107) = ( -0.1580478 0.1580478 0.1580478), wk = 0.0032787 k( 108) = ( -0.1508638 0.1508638 0.1508638), wk = 0.0032787 k( 109) = ( -0.1436798 0.1436798 0.1436798), wk = 0.0032787 k( 110) = ( -0.1364958 0.1364958 0.1364958), wk = 0.0032787 k( 111) = ( -0.1293118 0.1293118 0.1293118), wk = 0.0032787 k( 112) = ( -0.1221278 0.1221279 0.1221278), wk = 0.0032787 k( 113) = ( -0.1149439 0.1149439 0.1149439), wk = 0.0032787 k( 114) = ( -0.1077599 0.1077599 0.1077599), wk = 0.0032787 k( 115) = ( -0.1005759 0.1005759 0.1005759), wk = 0.0032787 k( 116) = ( -0.0933919 0.0933919 0.0933919), wk = 0.0032787 k( 117) = ( -0.0862079 0.0862079 0.0862079), wk = 0.0032787 k( 118) = ( -0.0790239 0.0790239 0.0790239), wk = 0.0032787 k( 119) = ( -0.0718399 0.0718399 0.0718399), wk = 0.0032787 k( 120) = ( -0.0646559 0.0646559 0.0646559), wk = 0.0032787 k( 121) = ( -0.0574719 0.0574719 0.0574719), wk = 0.0032787 k( 122) = ( -0.0502879 0.0502879 0.0502879), wk = 0.0032787 k( 123) = ( -0.0431040 0.0431040 0.0431040), wk = 0.0032787 k( 124) = ( -0.0359199 0.0359200 0.0359199), wk = 0.0032787 k( 125) = ( -0.0287360 0.0287360 0.0287360), wk = 0.0032787 k( 126) = ( -0.0215520 0.0215520 0.0215520), wk = 0.0032787 k( 127) = ( -0.0143680 0.0143680 0.0143680), wk = 0.0032787 k( 128) = ( -0.0071840 0.0071840 0.0071840), wk = 0.0032787 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 130) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032787 k( 131) = ( 0.0227273 0.0227273 -0.0227273), wk = 0.0032787 k( 132) = ( 0.0454546 0.0454546 -0.0454546), wk = 0.0032787 k( 133) = ( 0.0681818 0.0681818 -0.0681818), wk = 0.0032787 k( 134) = ( 0.0909091 0.0909091 -0.0909091), wk = 0.0032787 k( 135) = ( 0.1136364 0.1136364 -0.1136364), wk = 0.0032787 k( 136) = ( 0.1363636 0.1363636 -0.1363636), wk = 0.0032787 k( 137) = ( 0.1590909 0.1590909 -0.1590909), wk = 0.0032787 k( 138) = ( 0.1818182 0.1818182 -0.1818182), wk = 0.0032787 k( 139) = ( 0.2045454 0.2045454 -0.2045454), wk = 0.0032787 k( 140) = ( 0.2272727 0.2272727 -0.2272727), wk = 0.0032787 k( 141) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0032787 k( 142) = ( 0.2727273 0.2727273 -0.2727273), wk = 0.0032787 k( 143) = ( 0.2954545 0.2954545 -0.2954545), wk = 0.0032787 k( 144) = ( 0.3181818 0.3181818 -0.3181818), wk = 0.0032787 k( 145) = ( 0.3409091 0.3409091 -0.3409091), wk = 0.0032787 k( 146) = ( 0.3636364 0.3636364 -0.3636364), wk = 0.0032787 k( 147) = ( 0.3863636 0.3863636 -0.3863636), wk = 0.0032787 k( 148) = ( 0.4090909 0.4090909 -0.4090909), wk = 0.0032787 k( 149) = ( 0.4318182 0.4318182 -0.4318182), wk = 0.0032787 k( 150) = ( 0.4545455 0.4545455 -0.4545454), wk = 0.0032787 k( 151) = ( 0.4772727 0.4772727 -0.4772727), wk = 0.0032787 k( 152) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032787 k( 153) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032787 k( 154) = ( 0.4929060 0.5070940 -0.4929060), wk = 0.0032787 k( 155) = ( 0.4858120 0.5141880 -0.4858120), wk = 0.0032787 k( 156) = ( 0.4787180 0.5212820 -0.4787180), wk = 0.0032787 k( 157) = ( 0.4716240 0.5283760 -0.4716240), wk = 0.0032787 k( 158) = ( 0.4645300 0.5354701 -0.4645299), wk = 0.0032787 k( 159) = ( 0.4574359 0.5425641 -0.4574359), wk = 0.0032787 k( 160) = ( 0.4503419 0.5496581 -0.4503419), wk = 0.0032787 k( 161) = ( 0.4432479 0.5567521 -0.4432479), wk = 0.0032787 k( 162) = ( 0.4361539 0.5638461 -0.4361539), wk = 0.0032787 k( 163) = ( 0.4290599 0.5709401 -0.4290599), wk = 0.0032787 k( 164) = ( 0.4219659 0.5780341 -0.4219659), wk = 0.0032787 k( 165) = ( 0.4148719 0.5851281 -0.4148719), wk = 0.0032787 k( 166) = ( 0.4077779 0.5922221 -0.4077779), wk = 0.0032787 k( 167) = ( 0.4006839 0.5993162 -0.4006839), wk = 0.0032787 k( 168) = ( 0.3935898 0.6064102 -0.3935898), wk = 0.0032787 k( 169) = ( 0.3864958 0.6135042 -0.3864958), wk = 0.0032787 k( 170) = ( 0.3794018 0.6205982 -0.3794018), wk = 0.0032787 k( 171) = ( 0.3723078 0.6276922 -0.3723078), wk = 0.0032787 k( 172) = ( 0.3652138 0.6347862 -0.3652138), wk = 0.0032787 k( 173) = ( 0.3581198 0.6418802 -0.3581198), wk = 0.0032787 k( 174) = ( 0.3510258 0.6489742 -0.3510258), wk = 0.0032787 k( 175) = ( 0.3439318 0.6560682 -0.3439318), wk = 0.0032787 k( 176) = ( 0.3368377 0.6631622 -0.3368378), wk = 0.0032787 k( 177) = ( 0.3297437 0.6702563 -0.3297437), wk = 0.0032787 k( 178) = ( 0.3226497 0.6773503 -0.3226497), wk = 0.0032787 k( 179) = ( 0.3155557 0.6844443 -0.3155557), wk = 0.0032787 k( 180) = ( 0.3084617 0.6915383 -0.3084617), wk = 0.0032787 k( 181) = ( 0.3013677 0.6986323 -0.3013677), wk = 0.0032787 k( 182) = ( 0.2942737 0.7057263 -0.2942737), wk = 0.0032787 k( 183) = ( 0.2871797 0.7128203 -0.2871797), wk = 0.0032787 k( 184) = ( 0.2800857 0.7199143 -0.2800857), wk = 0.0032787 k( 185) = ( 0.2729917 0.7270083 -0.2729917), wk = 0.0032787 k( 186) = ( 0.2729917 0.7270083 -0.2729917), wk = 0.0032787 k( 187) = ( 0.2502424 0.7080910 -0.2502424), wk = 0.0032787 k( 188) = ( 0.2274931 0.6891736 -0.2274930), wk = 0.0032787 k( 189) = ( 0.2047437 0.6702563 -0.2047437), wk = 0.0032787 k( 190) = ( 0.1819944 0.6513389 -0.1819944), wk = 0.0032787 k( 191) = ( 0.1592451 0.6324215 -0.1592451), wk = 0.0032787 k( 192) = ( 0.1364958 0.6135042 -0.1364958), wk = 0.0032787 k( 193) = ( 0.1137465 0.5945868 -0.1137465), wk = 0.0032787 k( 194) = ( 0.0909972 0.5756695 -0.0909972), wk = 0.0032787 k( 195) = ( 0.0682479 0.5567521 -0.0682479), wk = 0.0032787 k( 196) = ( 0.0454986 0.5378347 -0.0454986), wk = 0.0032787 k( 197) = ( 0.0227493 0.5189174 -0.0227493), wk = 0.0032787 k( 198) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032787 k( 199) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0032787 k( 200) = ( 0.0071429 0.4928571 0.0071429), wk = 0.0032787 k( 201) = ( 0.0142857 0.4857143 0.0142857), wk = 0.0032787 k( 202) = ( 0.0214286 0.4785714 0.0214286), wk = 0.0032787 k( 203) = ( 0.0285714 0.4714286 0.0285714), wk = 0.0032787 k( 204) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0032787 k( 205) = ( 0.0428571 0.4571429 0.0428571), wk = 0.0032787 k( 206) = ( 0.0500000 0.4500000 0.0500000), wk = 0.0032787 k( 207) = ( 0.0571429 0.4428571 0.0571429), wk = 0.0032787 k( 208) = ( 0.0642857 0.4357143 0.0642857), wk = 0.0032787 k( 209) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0032787 k( 210) = ( 0.0785714 0.4214286 0.0785714), wk = 0.0032787 k( 211) = ( 0.0857143 0.4142857 0.0857143), wk = 0.0032787 k( 212) = ( 0.0928571 0.4071429 0.0928571), wk = 0.0032787 k( 213) = ( 0.1000000 0.4000000 0.1000000), wk = 0.0032787 k( 214) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0032787 k( 215) = ( 0.1142857 0.3857143 0.1142857), wk = 0.0032787 k( 216) = ( 0.1214286 0.3785714 0.1214286), wk = 0.0032787 k( 217) = ( 0.1285714 0.3714286 0.1285714), wk = 0.0032787 k( 218) = ( 0.1357143 0.3642857 0.1357143), wk = 0.0032787 k( 219) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0032787 k( 220) = ( 0.1500000 0.3500000 0.1500000), wk = 0.0032787 k( 221) = ( 0.1571429 0.3428571 0.1571429), wk = 0.0032787 k( 222) = ( 0.1642857 0.3357143 0.1642857), wk = 0.0032787 k( 223) = ( 0.1714286 0.3285714 0.1714286), wk = 0.0032787 k( 224) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0032787 k( 225) = ( 0.1857143 0.3142857 0.1857143), wk = 0.0032787 k( 226) = ( 0.1928571 0.3071429 0.1928571), wk = 0.0032787 k( 227) = ( 0.2000000 0.3000000 0.2000000), wk = 0.0032787 k( 228) = ( 0.2071429 0.2928571 0.2071429), wk = 0.0032787 k( 229) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0032787 k( 230) = ( 0.2214286 0.2785714 0.2214286), wk = 0.0032787 k( 231) = ( 0.2285714 0.2714286 0.2285714), wk = 0.0032787 k( 232) = ( 0.2357143 0.2642857 0.2357143), wk = 0.0032787 k( 233) = ( 0.2428571 0.2571429 0.2428571), wk = 0.0032787 k( 234) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032787 k( 235) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032787 k( 236) = ( 0.2708333 0.2708333 0.2253347), wk = 0.0032787 k( 237) = ( 0.2916667 0.2916667 0.2006694), wk = 0.0032787 k( 238) = ( 0.3125000 0.3125000 0.1760042), wk = 0.0032787 k( 239) = ( 0.3333333 0.3333333 0.1513389), wk = 0.0032787 k( 240) = ( 0.3541667 0.3541667 0.1266736), wk = 0.0032787 k( 241) = ( 0.3750000 0.3750000 0.1020083), wk = 0.0032787 k( 242) = ( 0.3958333 0.3958333 0.0773431), wk = 0.0032787 k( 243) = ( 0.4166667 0.4166667 0.0526778), wk = 0.0032787 k( 244) = ( 0.4375000 0.4375000 0.0280125), wk = 0.0032787 k( 245) = ( 0.4583333 0.4583333 0.0033472), wk = 0.0032787 k( 246) = ( 0.4791667 0.4791667 -0.0213180), wk = 0.0032787 k( 247) = ( 0.5000000 0.5000000 -0.0459833), wk = 0.0032787 k( 248) = ( 0.5000000 0.5000000 -0.0459833), wk = 0.0032787 k( 249) = ( 0.5000000 0.5000000 -0.0560726), wk = 0.0032787 k( 250) = ( 0.5000000 0.5000000 -0.0661618), wk = 0.0032787 k( 251) = ( 0.5000000 0.5000000 -0.0762511), wk = 0.0032787 k( 252) = ( 0.5000000 0.5000000 -0.0863404), wk = 0.0032787 k( 253) = ( 0.5000000 0.5000000 -0.0964296), wk = 0.0032787 k( 254) = ( 0.5000000 0.5000000 -0.1065189), wk = 0.0032787 k( 255) = ( 0.5000000 0.5000000 -0.1166081), wk = 0.0032787 k( 256) = ( 0.5000000 0.5000000 -0.1266974), wk = 0.0032787 k( 257) = ( 0.5000000 0.5000000 -0.1367867), wk = 0.0032787 k( 258) = ( 0.5000000 0.5000000 -0.1468759), wk = 0.0032787 k( 259) = ( 0.5000000 0.5000000 -0.1569652), wk = 0.0032787 k( 260) = ( 0.5000000 0.5000000 -0.1670544), wk = 0.0032787 k( 261) = ( 0.5000000 0.5000000 -0.1771437), wk = 0.0032787 k( 262) = ( 0.5000000 0.5000000 -0.1872330), wk = 0.0032787 k( 263) = ( 0.5000000 0.5000000 -0.1973222), wk = 0.0032787 k( 264) = ( 0.5000000 0.5000000 -0.2074115), wk = 0.0032787 k( 265) = ( 0.5000000 0.5000000 -0.2175007), wk = 0.0032787 k( 266) = ( 0.5000000 0.5000000 -0.2275900), wk = 0.0032787 k( 267) = ( 0.5000000 0.5000000 -0.2376793), wk = 0.0032787 k( 268) = ( 0.5000000 0.5000000 -0.2477685), wk = 0.0032787 k( 269) = ( 0.5000000 0.5000000 -0.2578578), wk = 0.0032787 k( 270) = ( 0.5000000 0.5000000 -0.2679470), wk = 0.0032787 k( 271) = ( 0.5000000 0.5000000 -0.2780363), wk = 0.0032787 k( 272) = ( 0.5000000 0.5000000 -0.2881256), wk = 0.0032787 k( 273) = ( 0.5000000 0.5000000 -0.2982148), wk = 0.0032787 k( 274) = ( 0.5000000 0.5000000 -0.3083041), wk = 0.0032787 k( 275) = ( 0.5000000 0.5000000 -0.3183933), wk = 0.0032787 k( 276) = ( 0.5000000 0.5000000 -0.3284826), wk = 0.0032787 k( 277) = ( 0.5000000 0.5000000 -0.3385718), wk = 0.0032787 k( 278) = ( 0.5000000 0.5000000 -0.3486611), wk = 0.0032787 k( 279) = ( 0.5000000 0.5000000 -0.3587504), wk = 0.0032787 k( 280) = ( 0.5000000 0.5000000 -0.3688396), wk = 0.0032787 k( 281) = ( 0.5000000 0.5000000 -0.3789289), wk = 0.0032787 k( 282) = ( 0.5000000 0.5000000 -0.3890181), wk = 0.0032787 k( 283) = ( 0.5000000 0.5000000 -0.3991074), wk = 0.0032787 k( 284) = ( 0.5000000 0.5000000 -0.4091967), wk = 0.0032787 k( 285) = ( 0.5000000 0.5000000 -0.4192859), wk = 0.0032787 k( 286) = ( 0.5000000 0.5000000 -0.4293752), wk = 0.0032787 k( 287) = ( 0.5000000 0.5000000 -0.4394644), wk = 0.0032787 k( 288) = ( 0.5000000 0.5000000 -0.4495537), wk = 0.0032787 k( 289) = ( 0.5000000 0.5000000 -0.4596430), wk = 0.0032787 k( 290) = ( 0.5000000 0.5000000 -0.4697322), wk = 0.0032787 k( 291) = ( 0.5000000 0.5000000 -0.4798215), wk = 0.0032787 k( 292) = ( 0.5000000 0.5000000 -0.4899107), wk = 0.0032787 k( 293) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0032787 k( 294) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0032787 k( 295) = ( 0.0227273 0.0227273 0.4772727), wk = 0.0032787 k( 296) = ( 0.0454546 0.0454546 0.4545455), wk = 0.0032787 k( 297) = ( 0.0681818 0.0681818 0.4318182), wk = 0.0032787 k( 298) = ( 0.0909091 0.0909091 0.4090909), wk = 0.0032787 k( 299) = ( 0.1136364 0.1136364 0.3863636), wk = 0.0032787 k( 300) = ( 0.1363636 0.1363636 0.3636364), wk = 0.0032787 k( 301) = ( 0.1590909 0.1590909 0.3409091), wk = 0.0032787 k( 302) = ( 0.1818182 0.1818182 0.3181818), wk = 0.0032787 k( 303) = ( 0.2045454 0.2045454 0.2954545), wk = 0.0032787 k( 304) = ( 0.2272727 0.2272727 0.2727273), wk = 0.0032787 k( 305) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032787 Dense grid: 101325 G-vectors FFT dimensions: ( 90, 90, 90) Smooth grid: 76249 G-vectors FFT dimensions: ( 80, 80, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.56 Mb ( 542, 68) NL pseudopotentials 0.41 Mb ( 271, 98) Each V/rho on FFT grid 0.37 Mb ( 24300) Each G-vector array 0.02 Mb ( 2814) G-vector shells 0.01 Mb ( 1294) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.25 Mb ( 542, 272) Each subspace H/S matrix 0.07 Mb ( 68, 68) Each matrix 0.20 Mb ( 98, 2, 68) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./Na4Br2O.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs + 4 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 7.3 secs Computing kpt #: 4 total cpu time spent up to now is 8.9 secs Computing kpt #: 5 total cpu time spent up to now is 10.6 secs Computing kpt #: 6 total cpu time spent up to now is 12.3 secs Computing kpt #: 7 total cpu time spent up to now is 14.0 secs Computing kpt #: 8 total cpu time spent up to now is 15.7 secs Computing kpt #: 9 total cpu time spent up to now is 17.4 secs Computing kpt #: 10 total cpu time spent up to now is 19.1 secs Computing kpt #: 11 total cpu time spent up to now is 20.8 secs Computing kpt #: 12 total cpu time spent up to now is 22.5 secs Computing kpt #: 13 total cpu time spent up to now is 24.2 secs Computing kpt #: 14 total cpu time spent up to now is 25.9 secs Computing kpt #: 15 total cpu time spent up to now is 27.6 secs Computing kpt #: 16 total cpu time spent up to now is 29.4 secs Computing kpt #: 17 total cpu time spent up to now is 31.2 secs Computing kpt #: 18 total cpu time spent up to now is 33.1 secs Computing kpt #: 19 total cpu time spent up to now is 35.0 secs Computing kpt #: 20 total cpu time spent up to now is 36.9 secs Computing kpt #: 21 total cpu time spent up to now is 38.9 secs Computing kpt #: 22 total cpu time spent up to now is 40.8 secs Computing kpt #: 23 total cpu time spent up to now is 42.6 secs Computing kpt #: 24 total cpu time spent up to now is 44.4 secs Computing kpt #: 25 total cpu time spent up to now is 46.2 secs Computing kpt #: 26 total cpu time spent up to now is 48.0 secs Computing kpt #: 27 total cpu time spent up to now is 49.9 secs Computing kpt #: 28 total cpu time spent up to now is 51.7 secs Computing kpt #: 29 total cpu time spent up to now is 53.5 secs Computing kpt #: 30 total cpu time spent up to now is 55.8 secs Computing kpt #: 31 total cpu time spent up to now is 58.2 secs Computing kpt #: 32 total cpu time spent up to now is 60.5 secs Computing kpt #: 33 total cpu time spent up to now is 62.2 secs Computing kpt #: 34 total cpu time spent up to now is 64.0 secs Computing kpt #: 35 total cpu time spent up to now is 65.5 secs Computing kpt #: 36 total cpu time spent up to now is 67.8 secs Computing kpt #: 37 total cpu time spent up to now is 69.8 secs Computing kpt #: 38 total cpu time spent up to now is 71.5 secs Computing kpt #: 39 total cpu time spent up to now is 73.3 secs Computing kpt #: 40 total cpu time spent up to now is 74.8 secs Computing kpt #: 41 total cpu time spent up to now is 76.3 secs Computing kpt #: 42 total cpu time spent up to now is 77.7 secs Computing kpt #: 43 total cpu time spent up to now is 79.1 secs Computing kpt #: 44 total cpu time spent up to now is 80.5 secs Computing kpt #: 45 total cpu time spent up to now is 81.9 secs Computing kpt #: 46 total cpu time spent up to now is 83.3 secs Computing kpt #: 47 total cpu time spent up to now is 84.7 secs Computing kpt #: 48 total cpu time spent up to now is 86.1 secs Computing kpt #: 49 total cpu time spent up to now is 87.4 secs Computing kpt #: 50 total cpu time spent up to now is 88.8 secs Computing kpt #: 51 total cpu time spent up to now is 90.2 secs Computing kpt #: 52 total cpu time spent up to now is 91.5 secs Computing kpt #: 53 total cpu time spent up to now is 92.9 secs Computing kpt #: 54 total cpu time spent up to now is 94.3 secs Computing kpt #: 55 total cpu time spent up to now is 95.7 secs Computing kpt #: 56 total cpu time spent up to now is 97.1 secs Computing kpt #: 57 total cpu time spent up to now is 98.5 secs Computing kpt #: 58 total cpu time spent up to now is 99.9 secs Computing kpt #: 59 total cpu time spent up to now is 101.4 secs Computing kpt #: 60 total cpu time spent up to now is 104.9 secs Computing kpt #: 61 total cpu time spent up to now is 106.3 secs Computing kpt #: 62 total cpu time spent up to now is 107.7 secs Computing kpt #: 63 total cpu time spent up to now is 109.2 secs Computing kpt #: 64 total cpu time spent up to now is 110.7 secs Computing kpt #: 65 total cpu time spent up to now is 112.2 secs Computing kpt #: 66 total cpu time spent up to now is 113.6 secs Computing kpt #: 67 total cpu time spent up to now is 115.0 secs Computing kpt #: 68 total cpu time spent up to now is 116.8 secs Computing kpt #: 69 total cpu time spent up to now is 118.5 secs Computing kpt #: 70 total cpu time spent up to now is 120.3 secs Computing kpt #: 71 total cpu time spent up to now is 121.8 secs Computing kpt #: 72 total cpu time spent up to now is 123.3 secs Computing kpt #: 73 total cpu time spent up to now is 124.8 secs Computing kpt #: 74 total cpu time spent up to now is 126.3 secs Computing kpt #: 75 total cpu time spent up to now is 128.0 secs Computing kpt #: 76 total cpu time spent up to now is 129.8 secs Computing kpt #: 77 total cpu time spent up to now is 131.6 secs Computing kpt #: 78 total cpu time spent up to now is 133.3 secs Computing kpt #: 79 total cpu time spent up to now is 135.1 secs Computing kpt #: 80 total cpu time spent up to now is 136.9 secs Computing kpt #: 81 total cpu time spent up to now is 138.6 secs Computing kpt #: 82 total cpu time spent up to now is 140.4 secs Computing kpt #: 83 total cpu time spent up to now is 142.1 secs Computing kpt #: 84 total cpu time spent up to now is 143.8 secs Computing kpt #: 85 total cpu time spent up to now is 145.6 secs Computing kpt #: 86 total cpu time spent up to now is 147.3 secs Computing kpt #: 87 total cpu time spent up to now is 149.1 secs Computing kpt #: 88 total cpu time spent up to now is 150.8 secs Computing kpt #: 89 total cpu time spent up to now is 152.5 secs Computing kpt #: 90 total cpu time spent up to now is 154.3 secs Computing kpt #: 91 total cpu time spent up to now is 156.0 secs Computing kpt #: 92 total cpu time spent up to now is 157.7 secs Computing kpt #: 93 total cpu time spent up to now is 159.5 secs Computing kpt #: 94 total cpu time spent up to now is 161.2 secs Computing kpt #: 95 total cpu time spent up to now is 163.1 secs Computing kpt #: 96 total cpu time spent up to now is 164.9 secs Computing kpt #: 97 total cpu time spent up to now is 166.7 secs Computing kpt #: 98 total cpu time spent up to now is 168.7 secs Computing kpt #: 99 total cpu time spent up to now is 170.5 secs Computing kpt #: 100 total cpu time spent up to now is 172.2 secs Computing kpt #: 101 total cpu time spent up to now is 174.0 secs Computing kpt #: 102 total cpu time spent up to now is 175.7 secs Computing kpt #: 103 total cpu time spent up to now is 177.5 secs Computing kpt #: 104 total cpu time spent up to now is 179.2 secs Computing kpt #: 105 total cpu time spent up to now is 180.9 secs Computing kpt #: 106 total cpu time spent up to now is 182.6 secs Computing kpt #: 107 total cpu time spent up to now is 184.4 secs Computing kpt #: 108 total cpu time spent up to now is 186.1 secs Computing kpt #: 109 total cpu time spent up to now is 187.8 secs Computing kpt #: 110 total cpu time spent up to now is 189.5 secs Computing kpt #: 111 total cpu time spent up to now is 191.2 secs Computing kpt #: 112 total cpu time spent up to now is 193.0 secs Computing kpt #: 113 total cpu time spent up to now is 194.9 secs Computing kpt #: 114 total cpu time spent up to now is 196.8 secs Computing kpt #: 115 total cpu time spent up to now is 198.5 secs Computing kpt #: 116 total cpu time spent up to now is 199.9 secs Computing kpt #: 117 total cpu time spent up to now is 201.3 secs Computing kpt #: 118 total cpu time spent up to now is 202.7 secs Computing kpt #: 119 total cpu time spent up to now is 204.1 secs Computing kpt #: 120 total cpu time spent up to now is 205.5 secs Computing kpt #: 121 total cpu time spent up to now is 207.2 secs Computing kpt #: 122 total cpu time spent up to now is 208.9 secs Computing kpt #: 123 total cpu time spent up to now is 210.3 secs Computing kpt #: 124 total cpu time spent up to now is 212.0 secs Computing kpt #: 125 total cpu time spent up to now is 213.7 secs Computing kpt #: 126 total cpu time spent up to now is 215.4 secs Computing kpt #: 127 total cpu time spent up to now is 216.8 secs Computing kpt #: 128 total cpu time spent up to now is 218.5 secs Computing kpt #: 129 total cpu time spent up to now is 219.9 secs Computing kpt #: 130 total cpu time spent up to now is 221.2 secs Computing kpt #: 131 total cpu time spent up to now is 222.9 secs Computing kpt #: 132 total cpu time spent up to now is 224.3 secs Computing kpt #: 133 total cpu time spent up to now is 226.0 secs Computing kpt #: 134 total cpu time spent up to now is 227.8 secs Computing kpt #: 135 total cpu time spent up to now is 229.7 secs Computing kpt #: 136 total cpu time spent up to now is 231.7 secs Computing kpt #: 137 total cpu time spent up to now is 234.0 secs Computing kpt #: 138 total cpu time spent up to now is 236.5 secs Computing kpt #: 139 total cpu time spent up to now is 239.0 secs Computing kpt #: 140 total cpu time spent up to now is 241.4 secs Computing kpt #: 141 total cpu time spent up to now is 243.8 secs Computing kpt #: 142 total cpu time spent up to now is 246.1 secs Computing kpt #: 143 total cpu time spent up to now is 248.9 secs Computing kpt #: 144 total cpu time spent up to now is 251.3 secs Computing kpt #: 145 total cpu time spent up to now is 253.6 secs Computing kpt #: 146 total cpu time spent up to now is 255.4 secs Computing kpt #: 147 total cpu time spent up to now is 257.2 secs Computing kpt #: 148 total cpu time spent up to now is 258.6 secs Computing kpt #: 149 total cpu time spent up to now is 260.1 secs Computing kpt #: 150 total cpu time spent up to now is 261.5 secs Computing kpt #: 151 total cpu time spent up to now is 262.9 secs Computing kpt #: 152 total cpu time spent up to now is 264.4 secs Computing kpt #: 153 total cpu time spent up to now is 265.8 secs Computing kpt #: 154 total cpu time spent up to now is 267.3 secs Computing kpt #: 155 total cpu time spent up to now is 268.7 secs Computing kpt #: 156 total cpu time spent up to now is 270.2 secs Computing kpt #: 157 total cpu time spent up to now is 271.9 secs Computing kpt #: 158 total cpu time spent up to now is 273.3 secs Computing kpt #: 159 total cpu time spent up to now is 274.8 secs Computing kpt #: 160 total cpu time spent up to now is 276.2 secs Computing kpt #: 161 total cpu time spent up to now is 277.6 secs Computing kpt #: 162 total cpu time spent up to now is 279.0 secs Computing kpt #: 163 total cpu time spent up to now is 280.4 secs Computing kpt #: 164 total cpu time spent up to now is 281.7 secs Computing kpt #: 165 total cpu time spent up to now is 283.4 secs Computing kpt #: 166 total cpu time spent up to now is 284.8 secs Computing kpt #: 167 total cpu time spent up to now is 286.2 secs Computing kpt #: 168 total cpu time spent up to now is 287.6 secs Computing kpt #: 169 total cpu time spent up to now is 289.0 secs Computing kpt #: 170 total cpu time spent up to now is 290.7 secs Computing kpt #: 171 total cpu time spent up to now is 292.1 secs Computing kpt #: 172 total cpu time spent up to now is 293.4 secs Computing kpt #: 173 total cpu time spent up to now is 294.8 secs Computing kpt #: 174 total cpu time spent up to now is 296.5 secs Computing kpt #: 175 total cpu time spent up to now is 297.9 secs Computing kpt #: 176 total cpu time spent up to now is 299.6 secs Computing kpt #: 177 total cpu time spent up to now is 301.3 secs Computing kpt #: 178 total cpu time spent up to now is 303.0 secs Computing kpt #: 179 total cpu time spent up to now is 304.7 secs Computing kpt #: 180 total cpu time spent up to now is 306.4 secs Computing kpt #: 181 total cpu time spent up to now is 308.1 secs Computing kpt #: 182 total cpu time spent up to now is 309.9 secs Computing kpt #: 183 total cpu time spent up to now is 311.6 secs Computing kpt #: 184 total cpu time spent up to now is 313.3 secs Computing kpt #: 185 total cpu time spent up to now is 315.1 secs Computing kpt #: 186 total cpu time spent up to now is 316.8 secs Computing kpt #: 187 total cpu time spent up to now is 318.5 secs Computing kpt #: 188 total cpu time spent up to now is 320.3 secs Computing kpt #: 189 total cpu time spent up to now is 322.6 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 326.8 secs Computing kpt #: 191 total cpu time spent up to now is 330.7 secs Computing kpt #: 192 total cpu time spent up to now is 332.9 secs Computing kpt #: 193 total cpu time spent up to now is 335.2 secs Computing kpt #: 194 total cpu time spent up to now is 337.1 secs Computing kpt #: 195 total cpu time spent up to now is 339.4 secs Computing kpt #: 196 total cpu time spent up to now is 341.3 secs Computing kpt #: 197 total cpu time spent up to now is 343.2 secs Computing kpt #: 198 total cpu time spent up to now is 345.1 secs Computing kpt #: 199 total cpu time spent up to now is 347.0 secs Computing kpt #: 200 total cpu time spent up to now is 348.9 secs Computing kpt #: 201 total cpu time spent up to now is 350.8 secs Computing kpt #: 202 total cpu time spent up to now is 352.7 secs Computing kpt #: 203 total cpu time spent up to now is 354.5 secs Computing kpt #: 204 total cpu time spent up to now is 356.2 secs Computing kpt #: 205 total cpu time spent up to now is 358.0 secs Computing kpt #: 206 total cpu time spent up to now is 359.7 secs Computing kpt #: 207 total cpu time spent up to now is 361.5 secs Computing kpt #: 208 total cpu time spent up to now is 363.2 secs Computing kpt #: 209 total cpu time spent up to now is 365.0 secs Computing kpt #: 210 total cpu time spent up to now is 366.7 secs Computing kpt #: 211 total cpu time spent up to now is 368.5 secs Computing kpt #: 212 total cpu time spent up to now is 370.3 secs Computing kpt #: 213 total cpu time spent up to now is 372.1 secs Computing kpt #: 214 total cpu time spent up to now is 373.9 secs Computing kpt #: 215 total cpu time spent up to now is 375.7 secs Computing kpt #: 216 total cpu time spent up to now is 377.5 secs Computing kpt #: 217 total cpu time spent up to now is 379.4 secs Computing kpt #: 218 total cpu time spent up to now is 381.3 secs Computing kpt #: 219 total cpu time spent up to now is 383.2 secs Computing kpt #: 220 total cpu time spent up to now is 385.1 secs Computing kpt #: 221 total cpu time spent up to now is 386.9 secs Computing kpt #: 222 total cpu time spent up to now is 388.7 secs Computing kpt #: 223 total cpu time spent up to now is 390.6 secs Computing kpt #: 224 total cpu time spent up to now is 392.4 secs Computing kpt #: 225 total cpu time spent up to now is 394.1 secs Computing kpt #: 226 total cpu time spent up to now is 396.0 secs Computing kpt #: 227 total cpu time spent up to now is 398.2 secs Computing kpt #: 228 total cpu time spent up to now is 400.5 secs Computing kpt #: 229 total cpu time spent up to now is 402.3 secs Computing kpt #: 230 total cpu time spent up to now is 404.6 secs Computing kpt #: 231 total cpu time spent up to now is 406.3 secs Computing kpt #: 232 total cpu time spent up to now is 408.0 secs Computing kpt #: 233 total cpu time spent up to now is 409.8 secs Computing kpt #: 234 total cpu time spent up to now is 411.5 secs Computing kpt #: 235 total cpu time spent up to now is 413.2 secs Computing kpt #: 236 total cpu time spent up to now is 414.9 secs Computing kpt #: 237 total cpu time spent up to now is 416.7 secs Computing kpt #: 238 total cpu time spent up to now is 418.4 secs Computing kpt #: 239 total cpu time spent up to now is 420.1 secs Computing kpt #: 240 total cpu time spent up to now is 421.8 secs Computing kpt #: 241 total cpu time spent up to now is 423.3 secs Computing kpt #: 242 total cpu time spent up to now is 424.7 secs Computing kpt #: 243 total cpu time spent up to now is 426.1 secs Computing kpt #: 244 total cpu time spent up to now is 427.5 secs Computing kpt #: 245 total cpu time spent up to now is 429.0 secs Computing kpt #: 246 total cpu time spent up to now is 430.4 secs Computing kpt #: 247 total cpu time spent up to now is 431.8 secs Computing kpt #: 248 total cpu time spent up to now is 433.2 secs Computing kpt #: 249 total cpu time spent up to now is 434.6 secs Computing kpt #: 250 total cpu time spent up to now is 436.1 secs Computing kpt #: 251 total cpu time spent up to now is 437.5 secs Computing kpt #: 252 total cpu time spent up to now is 438.9 secs Computing kpt #: 253 total cpu time spent up to now is 440.3 secs Computing kpt #: 254 total cpu time spent up to now is 441.8 secs Computing kpt #: 255 total cpu time spent up to now is 443.2 secs Computing kpt #: 256 total cpu time spent up to now is 444.6 secs Computing kpt #: 257 total cpu time spent up to now is 446.3 secs Computing kpt #: 258 total cpu time spent up to now is 448.1 secs Computing kpt #: 259 total cpu time spent up to now is 449.9 secs Computing kpt #: 260 total cpu time spent up to now is 452.2 secs Computing kpt #: 261 total cpu time spent up to now is 454.5 secs Computing kpt #: 262 total cpu time spent up to now is 456.4 secs Computing kpt #: 263 total cpu time spent up to now is 458.2 secs Computing kpt #: 264 total cpu time spent up to now is 459.9 secs Computing kpt #: 265 total cpu time spent up to now is 461.6 secs Computing kpt #: 266 total cpu time spent up to now is 463.4 secs Computing kpt #: 267 total cpu time spent up to now is 465.2 secs Computing kpt #: 268 total cpu time spent up to now is 466.9 secs Computing kpt #: 269 total cpu time spent up to now is 468.7 secs Computing kpt #: 270 total cpu time spent up to now is 470.5 secs Computing kpt #: 271 total cpu time spent up to now is 472.8 secs Computing kpt #: 272 total cpu time spent up to now is 474.5 secs Computing kpt #: 273 total cpu time spent up to now is 476.0 secs Computing kpt #: 274 total cpu time spent up to now is 477.4 secs Computing kpt #: 275 total cpu time spent up to now is 479.1 secs Computing kpt #: 276 total cpu time spent up to now is 480.5 secs Computing kpt #: 277 total cpu time spent up to now is 482.2 secs Computing kpt #: 278 total cpu time spent up to now is 483.9 secs Computing kpt #: 279 total cpu time spent up to now is 485.6 secs Computing kpt #: 280 total cpu time spent up to now is 487.3 secs Computing kpt #: 281 total cpu time spent up to now is 488.7 secs Computing kpt #: 282 total cpu time spent up to now is 490.1 secs Computing kpt #: 283 total cpu time spent up to now is 491.8 secs Computing kpt #: 284 total cpu time spent up to now is 493.3 secs Computing kpt #: 285 total cpu time spent up to now is 494.8 secs Computing kpt #: 286 total cpu time spent up to now is 496.4 secs Computing kpt #: 287 total cpu time spent up to now is 498.2 secs Computing kpt #: 288 total cpu time spent up to now is 499.9 secs Computing kpt #: 289 total cpu time spent up to now is 501.6 secs Computing kpt #: 290 total cpu time spent up to now is 503.4 secs Computing kpt #: 291 total cpu time spent up to now is 504.8 secs Computing kpt #: 292 total cpu time spent up to now is 506.2 secs Computing kpt #: 293 total cpu time spent up to now is 507.7 secs Computing kpt #: 294 total cpu time spent up to now is 509.1 secs Computing kpt #: 295 total cpu time spent up to now is 510.5 secs Computing kpt #: 296 total cpu time spent up to now is 511.9 secs Computing kpt #: 297 total cpu time spent up to now is 513.3 secs Computing kpt #: 298 total cpu time spent up to now is 514.7 secs Computing kpt #: 299 total cpu time spent up to now is 516.1 secs Computing kpt #: 300 total cpu time spent up to now is 517.5 secs Computing kpt #: 301 total cpu time spent up to now is 518.9 secs Computing kpt #: 302 total cpu time spent up to now is 520.6 secs Computing kpt #: 303 total cpu time spent up to now is 522.4 secs Computing kpt #: 304 total cpu time spent up to now is 524.1 secs Computing kpt #: 305 total cpu time spent up to now is 525.8 secs ethr = 1.79E-08, avg # of iterations = 24.2 total cpu time spent up to now is 525.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 9485 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9994 -19.9994 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7737 -19.7737 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8876 -18.8876 -11.5839 -11.5839 -11.3416 -11.3416 -11.2812 -11.2812 -0.4568 -0.4568 0.3743 0.3743 0.3841 0.3841 0.6434 0.6434 0.8004 0.8004 0.8942 0.8942 2.7375 2.7375 3.0178 3.0178 3.0469 3.0469 5.1149 5.1149 7.6614 7.6614 8.3458 8.3458 9.1197 9.1197 9.1469 9.1469 10.9318 10.9318 k = 0.0000 0.0000 0.0254 ( 9493 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9969 -19.9969 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5836 -11.5836 -11.3416 -11.3416 -11.2811 -11.2811 -0.4567 -0.4567 0.3646 0.3646 0.3919 0.3919 0.6420 0.6420 0.8012 0.8012 0.8932 0.8932 2.7377 2.7377 3.0169 3.0169 3.0459 3.0459 5.1196 5.1196 7.6637 7.6637 8.3481 8.3481 9.1214 9.1214 9.1477 9.1477 10.9231 10.9231 k = 0.0000 0.0000 0.0507 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2293 -19.2293 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9193 -18.9193 -18.8878 -18.8878 -11.5828 -11.5828 -11.3415 -11.3415 -11.2808 -11.2808 -0.4563 -0.4563 0.3498 0.3498 0.4013 0.4013 0.6380 0.6380 0.8037 0.8037 0.8903 0.8903 2.7384 2.7384 3.0140 3.0140 3.0431 3.0431 5.1336 5.1336 7.6705 7.6705 8.3548 8.3548 9.1265 9.1265 9.1503 9.1503 10.8975 10.8975 k = 0.0000 0.0000 0.0761 ( 9485 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2292 -19.2292 -19.2084 -19.2084 -19.0814 -19.0814 -19.0692 -19.0692 -18.9194 -18.9194 -18.8880 -18.8880 -11.5814 -11.5814 -11.3413 -11.3413 -11.2804 -11.2804 -0.4558 -0.4558 0.3331 0.3331 0.4089 0.4089 0.6315 0.6315 0.8077 0.8077 0.8854 0.8854 2.7395 2.7395 3.0091 3.0091 3.0390 3.0390 5.1567 5.1567 7.6820 7.6820 8.3660 8.3660 9.1349 9.1349 9.1546 9.1546 10.8570 10.8570 k = 0.0000 0.0000 0.1015 ( 9487 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1127 -47.1127 -19.9995 -19.9995 -19.9969 -19.9969 -19.8434 -19.8434 -19.8426 -19.8426 -19.7739 -19.7739 -19.7638 -19.7638 -19.2292 -19.2292 -19.2084 -19.2084 -19.0814 -19.0814 -19.0692 -19.0692 -18.9196 -18.9196 -18.8883 -18.8883 -11.5795 -11.5795 -11.3411 -11.3411 -11.2798 -11.2798 -0.4549 -0.4549 0.3152 0.3152 0.4143 0.4143 0.6229 0.6229 0.8126 0.8126 0.8787 0.8787 2.7410 2.7410 3.0017 3.0017 3.0340 3.0340 5.1885 5.1885 7.6980 7.6980 8.3815 8.3815 9.1465 9.1465 9.1605 9.1605 10.8043 10.8043 k = 0.0000 0.0000 0.1269 ( 9505 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1235 -47.1235 -47.1128 -47.1128 -19.9996 -19.9996 -19.9969 -19.9969 -19.8435 -19.8435 -19.8427 -19.8427 -19.7739 -19.7739 -19.7638 -19.7638 -19.2291 -19.2291 -19.2085 -19.2085 -19.0813 -19.0813 -19.0693 -19.0693 -18.9198 -18.9198 -18.8887 -18.8887 -11.5770 -11.5770 -11.3408 -11.3408 -11.2791 -11.2791 -0.4538 -0.4538 0.2962 0.2962 0.4175 0.4175 0.6123 0.6123 0.8182 0.8182 0.8702 0.8702 2.7430 2.7430 2.9919 2.9919 3.0286 3.0286 5.2285 5.2285 7.7185 7.7185 8.4014 8.4014 9.1614 9.1614 9.1680 9.1680 10.7420 10.7420 k = 0.0000 0.0000 0.1522 ( 9509 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1235 -47.1235 -47.1129 -47.1129 -19.9996 -19.9996 -19.9970 -19.9970 -19.8436 -19.8436 -19.8428 -19.8428 -19.7740 -19.7740 -19.7638 -19.7638 -19.2290 -19.2290 -19.2086 -19.2086 -19.0812 -19.0812 -19.0692 -19.0692 -18.9202 -18.9202 -18.8891 -18.8891 -11.5740 -11.5740 -11.3405 -11.3405 -11.2782 -11.2782 -0.4525 -0.4525 0.2764 0.2764 0.4185 0.4185 0.6000 0.6000 0.8238 0.8238 0.8604 0.8604 2.7453 2.7453 2.9801 2.9801 3.0230 3.0230 5.2762 5.2762 7.7435 7.7435 8.4255 8.4255 9.1766 9.1766 9.1794 9.1794 10.6724 10.6724 k = 0.0000 0.0000 0.1776 ( 9509 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1234 -47.1234 -47.1129 -47.1129 -19.9996 -19.9996 -19.9970 -19.9970 -19.8436 -19.8436 -19.8428 -19.8428 -19.7740 -19.7740 -19.7637 -19.7637 -19.2288 -19.2288 -19.2086 -19.2086 -19.0811 -19.0811 -19.0692 -19.0692 -18.9206 -18.9206 -18.8895 -18.8895 -11.5705 -11.5705 -11.3401 -11.3401 -11.2771 -11.2771 -0.4508 -0.4508 0.2559 0.2559 0.4172 0.4172 0.5862 0.5862 0.8278 0.8278 0.8505 0.8505 2.7479 2.7479 2.9667 2.9667 3.0171 3.0171 5.3308 5.3308 7.7730 7.7730 8.4536 8.4536 9.1866 9.1866 9.2002 9.2002 10.5977 10.5977 k = 0.0000 0.0000 0.2030 ( 9499 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1233 -47.1233 -47.1130 -47.1130 -19.9997 -19.9997 -19.9970 -19.9970 -19.8436 -19.8436 -19.8429 -19.8429 -19.7741 -19.7741 -19.7637 -19.7637 -19.2287 -19.2287 -19.2086 -19.2086 -19.0810 -19.0810 -19.0692 -19.0692 -18.9211 -18.9211 -18.8899 -18.8899 -11.5665 -11.5665 -11.3396 -11.3396 -11.2758 -11.2758 -0.4489 -0.4489 0.2350 0.2350 0.4138 0.4138 0.5711 0.5711 0.8246 0.8246 0.8461 0.8461 2.7508 2.7508 2.9523 2.9523 3.0109 3.0109 5.3919 5.3919 7.8069 7.8069 8.4856 8.4856 9.1974 9.1974 9.2239 9.2239 10.5196 10.5196 k = 0.0000 0.0000 0.2283 ( 9495 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1232 -47.1232 -47.1131 -47.1131 -19.9997 -19.9997 -19.9971 -19.9971 -19.8437 -19.8437 -19.8429 -19.8429 -19.7741 -19.7741 -19.7637 -19.7637 -19.2285 -19.2285 -19.2087 -19.2087 -19.0810 -19.0810 -19.0691 -19.0691 -18.9218 -18.9218 -18.8902 -18.8902 -11.5620 -11.5620 -11.3391 -11.3391 -11.2744 -11.2744 -0.4467 -0.4467 0.2138 0.2138 0.4082 0.4082 0.5548 0.5548 0.8120 0.8120 0.8491 0.8491 2.7541 2.7541 2.9375 2.9375 3.0042 3.0042 5.4587 5.4587 7.8451 7.8451 8.5213 8.5213 9.2088 9.2088 9.2501 9.2501 10.4396 10.4396 k = 0.0000 0.0000 0.2537 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1231 -47.1231 -47.1132 -47.1132 -19.9997 -19.9997 -19.9971 -19.9971 -19.8437 -19.8437 -19.8430 -19.8430 -19.7742 -19.7742 -19.7637 -19.7637 -19.2283 -19.2283 -19.2088 -19.2088 -19.0809 -19.0809 -19.0689 -19.0689 -18.9227 -18.9227 -18.8905 -18.8905 -11.5571 -11.5571 -11.3386 -11.3386 -11.2729 -11.2729 -0.4441 -0.4441 0.1925 0.1925 0.4007 0.4007 0.5375 0.5375 0.7956 0.7956 0.8539 0.8539 2.7574 2.7574 2.9226 2.9226 2.9971 2.9971 5.5306 5.5306 7.8877 7.8877 8.5606 8.5606 9.2203 9.2203 9.2787 9.2787 10.3590 10.3590 k = 0.0000 0.0000 0.2791 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1230 -47.1230 -47.1133 -47.1133 -19.9998 -19.9998 -19.9972 -19.9972 -19.8438 -19.8438 -19.8430 -19.8430 -19.7743 -19.7743 -19.7637 -19.7637 -19.2282 -19.2282 -19.2089 -19.2089 -19.0809 -19.0809 -19.0688 -19.0688 -18.9237 -18.9237 -18.8907 -18.8907 -11.5517 -11.5517 -11.3380 -11.3380 -11.2712 -11.2712 -0.4413 -0.4413 0.1713 0.1713 0.3914 0.3914 0.5191 0.5191 0.7771 0.7771 0.8587 0.8587 2.7610 2.7610 2.9080 2.9080 2.9894 2.9894 5.6071 5.6071 7.9345 7.9345 8.6031 8.6031 9.2314 9.2314 9.3095 9.3095 10.2792 10.2792 k = 0.0000 0.0000 0.3044 ( 9485 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1229 -47.1229 -47.1134 -47.1134 -19.9998 -19.9998 -19.9972 -19.9972 -19.8439 -19.8439 -19.8431 -19.8431 -19.7744 -19.7744 -19.7637 -19.7637 -19.2280 -19.2280 -19.2089 -19.2089 -19.0809 -19.0809 -19.0685 -19.0685 -18.9250 -18.9250 -18.8908 -18.8908 -11.5460 -11.5460 -11.3374 -11.3374 -11.2694 -11.2694 -0.4381 -0.4381 0.1502 0.1502 0.3804 0.3804 0.4999 0.4999 0.7572 0.7572 0.8631 0.8631 2.7646 2.7646 2.8940 2.8940 2.9814 2.9814 5.6875 5.6875 7.9855 7.9855 8.6487 8.6487 9.2413 9.2413 9.3422 9.3422 10.2015 10.2015 k = 0.0000 0.0000 0.3298 ( 9490 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1228 -47.1228 -47.1135 -47.1135 -19.9999 -19.9999 -19.9973 -19.9973 -19.8440 -19.8440 -19.8432 -19.8432 -19.7745 -19.7745 -19.7637 -19.7637 -19.2279 -19.2279 -19.2090 -19.2090 -19.0810 -19.0810 -19.0682 -19.0682 -18.9264 -18.9264 -18.8907 -18.8907 -11.5398 -11.5398 -11.3368 -11.3368 -11.2674 -11.2674 -0.4345 -0.4345 0.1294 0.1294 0.3679 0.3679 0.4799 0.4799 0.7360 0.7360 0.8666 0.8666 2.7682 2.7682 2.8807 2.8807 2.9728 2.9728 5.7713 5.7713 8.0405 8.0405 8.6969 8.6969 9.2490 9.2490 9.3765 9.3765 10.1273 10.1273 k = 0.0000 0.0000 0.3552 ( 9502 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1226 -47.1226 -47.1137 -47.1137 -20.0000 -20.0000 -19.9974 -19.9974 -19.8441 -19.8441 -19.8433 -19.8433 -19.7746 -19.7746 -19.7636 -19.7636 -19.2278 -19.2278 -19.2091 -19.2091 -19.0811 -19.0811 -19.0679 -19.0679 -18.9281 -18.9281 -18.8906 -18.8906 -11.5333 -11.5333 -11.3362 -11.3362 -11.2653 -11.2653 -0.4306 -0.4306 0.1090 0.1090 0.3541 0.3541 0.4593 0.4593 0.7138 0.7138 0.8693 0.8693 2.7718 2.7718 2.8684 2.8684 2.9639 2.9639 5.8580 5.8580 8.0996 8.0996 8.7476 8.7476 9.2533 9.2533 9.4122 9.4122 10.0583 10.0583 k = 0.0000 0.0000 0.3806 ( 9508 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1225 -47.1225 -47.1138 -47.1138 -20.0001 -20.0001 -19.9974 -19.9974 -19.8442 -19.8442 -19.8433 -19.8433 -19.7747 -19.7747 -19.7636 -19.7636 -19.2278 -19.2278 -19.2092 -19.2092 -19.0813 -19.0813 -19.0674 -19.0674 -18.9299 -18.9299 -18.8902 -18.8902 -11.5265 -11.5265 -11.3355 -11.3355 -11.2631 -11.2631 -0.4264 -0.4264 0.0891 0.0891 0.3390 0.3390 0.4382 0.4382 0.6907 0.6907 0.8711 0.8711 2.7752 2.7752 2.8570 2.8570 2.9546 2.9546 5.9470 5.9470 8.1624 8.1624 8.8001 8.8001 9.2528 9.2528 9.4490 9.4490 9.9963 9.9963 k = 0.0000 0.0000 0.4059 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1224 -47.1224 -47.1139 -47.1139 -20.0002 -20.0002 -19.9975 -19.9975 -19.8443 -19.8443 -19.8434 -19.8434 -19.7749 -19.7749 -19.7636 -19.7636 -19.2277 -19.2277 -19.2092 -19.2092 -19.0815 -19.0815 -19.0670 -19.0670 -18.9320 -18.9320 -18.8898 -18.8898 -11.5194 -11.5194 -11.3349 -11.3349 -11.2607 -11.2607 -0.4218 -0.4218 0.0696 0.0696 0.3230 0.3230 0.4167 0.4167 0.6668 0.6668 0.8718 0.8718 2.7784 2.7784 2.8465 2.8465 2.9449 2.9449 6.0379 6.0379 8.2291 8.2291 8.8543 8.8543 9.2458 9.2458 9.4866 9.4866 9.9433 9.9433 k = 0.0000 0.0000 0.4313 ( 9504 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1222 -47.1222 -47.1141 -47.1141 -20.0002 -20.0002 -19.9976 -19.9976 -19.8443 -19.8443 -19.8435 -19.8435 -19.7750 -19.7750 -19.7636 -19.7636 -19.2277 -19.2277 -19.2093 -19.2093 -19.0818 -19.0818 -19.0664 -19.0664 -18.9341 -18.9341 -18.8892 -18.8892 -11.5120 -11.5120 -11.3342 -11.3342 -11.2582 -11.2582 -0.4169 -0.4169 0.0506 0.0506 0.3061 0.3061 0.3951 0.3951 0.6425 0.6425 0.8716 0.8716 2.7813 2.7813 2.8371 2.8371 2.9350 2.9350 6.1302 6.1302 8.2993 8.2993 8.9093 8.9093 9.2310 9.2310 9.5246 9.5246 9.9008 9.9008 k = 0.0000 0.0000 0.4567 ( 9510 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1220 -47.1220 -47.1142 -47.1142 -20.0003 -20.0003 -19.9977 -19.9977 -19.8444 -19.8444 -19.8436 -19.8436 -19.7751 -19.7751 -19.7636 -19.7636 -19.2278 -19.2278 -19.2093 -19.2093 -19.0822 -19.0822 -19.0658 -19.0658 -18.9365 -18.9365 -18.8885 -18.8885 -11.5045 -11.5045 -11.3335 -11.3335 -11.2556 -11.2556 -0.4117 -0.4117 0.0321 0.0321 0.2887 0.2887 0.3734 0.3734 0.6177 0.6177 0.8702 0.8702 2.7838 2.7838 2.8286 2.8286 2.9248 2.9248 6.2233 6.2233 8.3730 8.3730 8.9646 8.9646 9.2076 9.2076 9.5627 9.5627 9.8700 9.8700 k = 0.0000 0.0000 0.4820 ( 9510 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1219 -47.1219 -47.1144 -47.1144 -20.0004 -20.0004 -19.9977 -19.9977 -19.8445 -19.8445 -19.8437 -19.8437 -19.7753 -19.7753 -19.7636 -19.7636 -19.2279 -19.2279 -19.2093 -19.2093 -19.0825 -19.0825 -19.0651 -19.0651 -18.9389 -18.9389 -18.8876 -18.8876 -11.4967 -11.4967 -11.3329 -11.3329 -11.2529 -11.2529 -0.4062 -0.4062 0.0141 0.0141 0.2707 0.2707 0.3520 0.3520 0.5927 0.5927 0.8679 0.8679 2.7858 2.7858 2.8209 2.8209 2.9144 2.9144 6.3170 6.3170 8.4499 8.4499 9.0186 9.0186 9.1767 9.1767 9.6006 9.6006 9.8508 9.8508 k = 0.0000 0.0000 0.5074 ( 9524 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1217 -47.1217 -47.1146 -47.1146 -20.0005 -20.0005 -19.9978 -19.9978 -19.8447 -19.8447 -19.8438 -19.8438 -19.7755 -19.7755 -19.7636 -19.7636 -19.2280 -19.2280 -19.2094 -19.2094 -19.0829 -19.0829 -19.0644 -19.0644 -18.9415 -18.9415 -18.8867 -18.8867 -11.4888 -11.4888 -11.3322 -11.3322 -11.2501 -11.2501 -0.4004 -0.4004 -0.0035 -0.0035 0.2525 0.2525 0.3311 0.3311 0.5676 0.5676 0.8645 0.8645 2.7873 2.7873 2.8138 2.8138 2.9038 2.9038 6.4105 6.4105 8.5299 8.5299 9.0659 9.0659 9.1443 9.1443 9.6380 9.6380 9.8421 9.8421 k = 0.0000 0.0000 0.5328 ( 9528 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1216 -47.1216 -47.1147 -47.1147 -20.0006 -20.0006 -19.9979 -19.9979 -19.8448 -19.8448 -19.8439 -19.8439 -19.7756 -19.7756 -19.7635 -19.7635 -19.2282 -19.2282 -19.2094 -19.2094 -19.0834 -19.0834 -19.0636 -19.0636 -18.9442 -18.9442 -18.8857 -18.8857 -11.4808 -11.4808 -11.3316 -11.3316 -11.2472 -11.2472 -0.3945 -0.3945 -0.0207 -0.0207 0.2342 0.2342 0.3109 0.3109 0.5424 0.5424 0.8601 0.8601 2.7881 2.7881 2.8074 2.8074 2.8931 2.8931 6.5035 6.5035 8.6127 8.6127 9.0693 9.0693 9.1485 9.1485 9.6746 9.6746 9.8413 9.8413 k = 0.0000 0.0000 0.5582 ( 9528 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1214 -47.1214 -47.1149 -47.1149 -20.0007 -20.0007 -19.9979 -19.9979 -19.8449 -19.8449 -19.8440 -19.8440 -19.7758 -19.7758 -19.7635 -19.7635 -19.2284 -19.2284 -19.2094 -19.2094 -19.0839 -19.0839 -19.0628 -19.0628 -18.9469 -18.9469 -18.8846 -18.8846 -11.4728 -11.4728 -11.3310 -11.3310 -11.2442 -11.2442 -0.3884 -0.3884 -0.0376 -0.0376 0.2160 0.2160 0.2917 0.2917 0.5174 0.5174 0.8547 0.8547 2.7883 2.7883 2.8015 2.8015 2.8823 2.8823 6.5954 6.5954 8.6981 8.6981 9.0274 9.0274 9.1919 9.1919 9.7095 9.7095 9.7758 9.7758 k = 0.0000 0.0000 0.5835 ( 9534 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1212 -47.1212 -47.1151 -47.1151 -20.0008 -20.0008 -19.9980 -19.9980 -19.8450 -19.8450 -19.8440 -19.8440 -19.7760 -19.7760 -19.7635 -19.7635 -19.2287 -19.2287 -19.2094 -19.2094 -19.0844 -19.0844 -19.0619 -19.0619 -18.9496 -18.9496 -18.8834 -18.8834 -11.4647 -11.4647 -11.3305 -11.3305 -11.2410 -11.2410 -0.3823 -0.3823 -0.0544 -0.0544 0.1980 0.1980 0.2738 0.2738 0.4926 0.4926 0.8484 0.8484 2.7876 2.7876 2.7958 2.7958 2.8715 2.8715 6.6857 6.6857 8.7852 8.7852 8.9779 8.9779 9.2381 9.2381 9.6785 9.6785 9.7453 9.7453 k = 0.0000 0.0000 0.6089 ( 9532 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1210 -47.1210 -47.1152 -47.1152 -20.0009 -20.0009 -19.9981 -19.9981 -19.8451 -19.8451 -19.8441 -19.8441 -19.7761 -19.7761 -19.7635 -19.7635 -19.2291 -19.2291 -19.2093 -19.2093 -19.0849 -19.0849 -19.0611 -19.0611 -18.9524 -18.9524 -18.8822 -18.8822 -11.4567 -11.4567 -11.3299 -11.3299 -11.2378 -11.2378 -0.3763 -0.3763 -0.0711 -0.0711 0.1804 0.1804 0.2575 0.2575 0.4682 0.4682 0.8412 0.8412 2.7860 2.7860 2.7906 2.7906 2.8607 2.8607 6.7739 6.7739 8.8697 8.8697 8.9313 8.9313 9.2811 9.2811 9.5859 9.5859 9.7772 9.7772 k = 0.0000 0.0000 0.6343 ( 9532 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1209 -47.1209 -47.1154 -47.1154 -20.0010 -20.0010 -19.9982 -19.9982 -19.8452 -19.8452 -19.8442 -19.8442 -19.7763 -19.7763 -19.7634 -19.7634 -19.2294 -19.2294 -19.2093 -19.2093 -19.0854 -19.0854 -19.0602 -19.0602 -18.9552 -18.9552 -18.8809 -18.8809 -11.4487 -11.4487 -11.3294 -11.3294 -11.2345 -11.2345 -0.3705 -0.3705 -0.0879 -0.0879 0.1635 0.1635 0.2430 0.2430 0.4441 0.4441 0.8332 0.8332 2.7828 2.7828 2.7859 2.7859 2.8499 2.8499 6.8593 6.8593 8.8674 8.8674 8.9731 8.9731 9.3191 9.3191 9.4965 9.4965 9.8077 9.8077 k = 0.0000 0.0000 0.6596 ( 9524 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1207 -47.1207 -47.1156 -47.1156 -20.0010 -20.0010 -19.9982 -19.9982 -19.8453 -19.8453 -19.8443 -19.8443 -19.7764 -19.7764 -19.7634 -19.7634 -19.2298 -19.2298 -19.2093 -19.2093 -19.0859 -19.0859 -19.0593 -19.0593 -18.9579 -18.9579 -18.8796 -18.8796 -11.4408 -11.4408 -11.3290 -11.3290 -11.2311 -11.2311 -0.3649 -0.3649 -0.1047 -0.1047 0.1474 0.1474 0.2305 0.2305 0.4205 0.4205 0.8244 0.8244 2.7780 2.7780 2.7820 2.7820 2.8393 2.8393 6.9413 6.9413 8.8194 8.8194 9.0624 9.0624 9.3503 9.3503 9.4122 9.4122 9.8362 9.8362 k = 0.0000 0.0000 0.6850 ( 9520 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1205 -47.1205 -47.1157 -47.1157 -20.0011 -20.0011 -19.9983 -19.9983 -19.8453 -19.8453 -19.8444 -19.8444 -19.7766 -19.7766 -19.7634 -19.7634 -19.2303 -19.2303 -19.2092 -19.2092 -19.0864 -19.0864 -19.0585 -19.0585 -18.9607 -18.9607 -18.8782 -18.8782 -11.4331 -11.4331 -11.3285 -11.3285 -11.2276 -11.2276 -0.3598 -0.3598 -0.1216 -0.1216 0.1323 0.1323 0.2202 0.2202 0.3975 0.3975 0.8148 0.8148 2.7723 2.7723 2.7778 2.7778 2.8288 2.8288 7.0195 7.0195 8.7721 8.7721 9.1489 9.1489 9.3323 9.3323 9.3794 9.3794 9.8626 9.8626 k = 0.0000 0.0000 0.7104 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1204 -47.1204 -47.1159 -47.1159 -20.0012 -20.0012 -19.9983 -19.9983 -19.8454 -19.8454 -19.8444 -19.8444 -19.7768 -19.7768 -19.7634 -19.7634 -19.2308 -19.2308 -19.2092 -19.2092 -19.0869 -19.0869 -19.0576 -19.0576 -18.9633 -18.9633 -18.8768 -18.8768 -11.4256 -11.4256 -11.3281 -11.3281 -11.2241 -11.2241 -0.3553 -0.3553 -0.1385 -0.1385 0.1183 0.1183 0.2122 0.2122 0.3751 0.3751 0.8045 0.8045 2.7662 2.7662 2.7729 2.7729 2.8185 2.8185 7.0930 7.0930 8.7276 8.7276 9.1940 9.1940 9.3023 9.3023 9.3980 9.3980 9.8866 9.8866 k = 0.0000 0.0000 0.7358 ( 9504 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1202 -47.1202 -47.1161 -47.1161 -20.0012 -20.0012 -19.9984 -19.9984 -19.8455 -19.8455 -19.8445 -19.8445 -19.7769 -19.7769 -19.7634 -19.7634 -19.2313 -19.2313 -19.2091 -19.2091 -19.0874 -19.0874 -19.0567 -19.0567 -18.9660 -18.9660 -18.8754 -18.8754 -11.4182 -11.4182 -11.3278 -11.3278 -11.2205 -11.2205 -0.3517 -0.3517 -0.1554 -0.1554 0.1057 0.1057 0.2064 0.2064 0.3535 0.3535 0.7936 0.7936 2.7596 2.7596 2.7671 2.7671 2.8084 2.8084 7.1615 7.1615 8.6867 8.6867 9.1449 9.1449 9.3616 9.3616 9.4187 9.4187 9.9069 9.9069 k = 0.0000 0.0000 0.7611 ( 9502 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1200 -47.1200 -47.1162 -47.1162 -20.0013 -20.0013 -19.9984 -19.9984 -19.8455 -19.8455 -19.8445 -19.8445 -19.7771 -19.7771 -19.7633 -19.7633 -19.2319 -19.2319 -19.2091 -19.2091 -19.0879 -19.0879 -19.0559 -19.0559 -18.9685 -18.9685 -18.8740 -18.8740 -11.4111 -11.4111 -11.3275 -11.3275 -11.2169 -11.2169 -0.3491 -0.3491 -0.1721 -0.1721 0.0947 0.0947 0.2029 0.2029 0.3326 0.3326 0.7820 0.7820 2.7524 2.7524 2.7606 2.7606 2.7985 2.7985 7.2241 7.2241 8.6501 8.6501 9.0766 9.0766 9.3959 9.3959 9.4812 9.4812 9.9177 9.9177 k = 0.0000 0.0000 0.7865 ( 9506 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1198 -47.1198 -47.1164 -47.1164 -20.0014 -20.0014 -19.9985 -19.9985 -19.8456 -19.8456 -19.8446 -19.8446 -19.7773 -19.7773 -19.7633 -19.7633 -19.2325 -19.2325 -19.2090 -19.2090 -19.0884 -19.0884 -19.0551 -19.0551 -18.9710 -18.9710 -18.8726 -18.8726 -11.4043 -11.4043 -11.3272 -11.3272 -11.2132 -11.2132 -0.3477 -0.3477 -0.1885 -0.1885 0.0853 0.0853 0.2015 0.2015 0.3127 0.3127 0.7700 0.7700 2.7448 2.7448 2.7534 2.7534 2.7888 2.7888 7.2806 7.2806 8.6183 8.6183 9.0086 9.0086 9.3988 9.3988 9.5727 9.5727 9.9076 9.9076 k = 0.0000 0.0000 0.8119 ( 9512 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1197 -47.1197 -47.1165 -47.1165 -20.0015 -20.0015 -19.9985 -19.9985 -19.8457 -19.8457 -19.8446 -19.8446 -19.7775 -19.7775 -19.7633 -19.7633 -19.2331 -19.2331 -19.2090 -19.2090 -19.0889 -19.0889 -19.0543 -19.0543 -18.9735 -18.9735 -18.8712 -18.8712 -11.3977 -11.3977 -11.3269 -11.3269 -11.2095 -11.2095 -0.3477 -0.3477 -0.2043 -0.2043 0.0777 0.0777 0.2019 0.2019 0.2939 0.2939 0.7574 0.7574 2.7366 2.7366 2.7455 2.7455 2.7793 2.7793 7.3304 7.3304 8.5917 8.5917 8.9434 8.9434 9.3935 9.3935 9.6678 9.6678 9.8851 9.8851 k = 0.0000 0.0000 0.8372 ( 9512 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1195 -47.1195 -47.1167 -47.1167 -20.0015 -20.0015 -19.9986 -19.9986 -19.8458 -19.8458 -19.8447 -19.8447 -19.7776 -19.7776 -19.7633 -19.7633 -19.2337 -19.2337 -19.2090 -19.2090 -19.0894 -19.0894 -19.0536 -19.0536 -18.9758 -18.9758 -18.8698 -18.8698 -11.3915 -11.3915 -11.3267 -11.3267 -11.2058 -11.2058 -0.3493 -0.3493 -0.2192 -0.2192 0.0720 0.0720 0.2038 0.2038 0.2765 0.2765 0.7443 0.7443 2.7279 2.7279 2.7371 2.7371 2.7700 2.7700 7.3733 7.3733 8.5706 8.5706 8.8816 8.8816 9.3837 9.3837 9.7594 9.7594 9.8616 9.8616 k = 0.0000 0.0000 0.8626 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1194 -47.1194 -47.1168 -47.1168 -20.0016 -20.0016 -19.9986 -19.9986 -19.8459 -19.8459 -19.8448 -19.8448 -19.7778 -19.7778 -19.7633 -19.7633 -19.2343 -19.2343 -19.2090 -19.2090 -19.0899 -19.0899 -19.0529 -19.0529 -18.9780 -18.9780 -18.8685 -18.8685 -11.3856 -11.3856 -11.3266 -11.3266 -11.2021 -11.2021 -0.3525 -0.3525 -0.2332 -0.2332 0.0682 0.0682 0.2063 0.2063 0.2613 0.2613 0.7308 0.7308 2.7186 2.7186 2.7283 2.7283 2.7609 2.7609 7.4092 7.4092 8.5552 8.5552 8.8234 8.8234 9.3709 9.3709 9.8044 9.8044 9.8816 9.8816 k = 0.0000 0.0000 0.8880 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1192 -47.1192 -47.1170 -47.1170 -20.0017 -20.0017 -19.9987 -19.9987 -19.8460 -19.8460 -19.8448 -19.8448 -19.7779 -19.7779 -19.7633 -19.7633 -19.2350 -19.2350 -19.2090 -19.2090 -19.0903 -19.0903 -19.0522 -19.0522 -18.9801 -18.9801 -18.8672 -18.8672 -11.3801 -11.3801 -11.3264 -11.3264 -11.1984 -11.1984 -0.3574 -0.3574 -0.2461 -0.2461 0.0662 0.0662 0.2074 0.2074 0.2501 0.2501 0.7169 0.7169 2.7090 2.7090 2.7192 2.7192 2.7521 2.7521 7.4382 7.4382 8.5458 8.5458 8.7690 8.7690 9.3561 9.3561 9.7813 9.7813 9.9659 9.9659 k = 0.0000 0.0000 0.9133 ( 9508 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1191 -47.1191 -47.1171 -47.1171 -20.0017 -20.0017 -19.9987 -19.9987 -19.8460 -19.8460 -19.8448 -19.8448 -19.7781 -19.7781 -19.7632 -19.7632 -19.2355 -19.2355 -19.2090 -19.2090 -19.0907 -19.0907 -19.0516 -19.0516 -18.9820 -18.9820 -18.8659 -18.8659 -11.3749 -11.3749 -11.3263 -11.3263 -11.1948 -11.1948 -0.3637 -0.3637 -0.2578 -0.2578 0.0659 0.0659 0.2039 0.2039 0.2459 0.2459 0.7027 0.7027 2.6989 2.6989 2.7098 2.7098 2.7436 2.7436 7.4606 7.4606 8.5422 8.5422 8.7185 8.7185 9.3401 9.3401 9.7493 9.7493 10.0211 10.0211 k = 0.0000 0.0000 0.9387 ( 9508 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1190 -47.1190 -47.1172 -47.1172 -20.0018 -20.0018 -19.9987 -19.9987 -19.8461 -19.8461 -19.8449 -19.8449 -19.7782 -19.7782 -19.7632 -19.7632 -19.2361 -19.2361 -19.2090 -19.2090 -19.0911 -19.0911 -19.0510 -19.0510 -18.9838 -18.9838 -18.8647 -18.8647 -11.3701 -11.3701 -11.3262 -11.3262 -11.1913 -11.1913 -0.3713 -0.3713 -0.2683 -0.2683 0.0671 0.0671 0.1954 0.1954 0.2493 0.2493 0.6882 0.6882 2.6886 2.6886 2.7004 2.7004 2.7355 2.7355 7.4769 7.4769 8.5443 8.5443 8.6718 8.6718 9.3235 9.3235 9.7149 9.7149 10.0326 10.0326 k = 0.0000 0.0000 0.9641 ( 9516 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1188 -47.1188 -47.1174 -47.1174 -20.0018 -20.0018 -19.9988 -19.9988 -19.8461 -19.8461 -19.8449 -19.8449 -19.7784 -19.7784 -19.7632 -19.7632 -19.2367 -19.2367 -19.2090 -19.2090 -19.0915 -19.0915 -19.0505 -19.0505 -18.9856 -18.9856 -18.8636 -18.8636 -11.3657 -11.3657 -11.3262 -11.3262 -11.1879 -11.1879 -0.3798 -0.3798 -0.2778 -0.2778 0.0696 0.0696 0.1846 0.1846 0.2571 0.2571 0.6735 0.6735 2.6780 2.6780 2.6909 2.6909 2.7278 2.7278 7.4879 7.4879 8.5516 8.5516 8.6289 8.6289 9.3068 9.3068 9.6789 9.6789 10.0411 10.0411 k = 0.0000 0.0000 0.9895 ( 9530 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1187 -47.1187 -47.1175 -47.1175 -20.0019 -20.0019 -19.9989 -19.9989 -19.8462 -19.8462 -19.8450 -19.8450 -19.7785 -19.7785 -19.7633 -19.7633 -19.2373 -19.2373 -19.2090 -19.2090 -19.0919 -19.0919 -19.0500 -19.0500 -18.9872 -18.9872 -18.8625 -18.8625 -11.3616 -11.3616 -11.3261 -11.3261 -11.1846 -11.1846 -0.3889 -0.3889 -0.2864 -0.2864 0.0731 0.0731 0.1737 0.1737 0.2673 0.2673 0.6585 0.6585 2.6675 2.6675 2.6815 2.6815 2.7206 2.7206 7.4943 7.4943 8.5630 8.5630 8.5907 8.5907 9.2905 9.2905 9.6415 9.6415 10.0482 10.0482 k = 0.0000 0.0000 1.0148 ( 9526 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1186 -47.1186 -47.1176 -47.1176 -20.0019 -20.0019 -19.9989 -19.9989 -19.8462 -19.8462 -19.8450 -19.8450 -19.7786 -19.7786 -19.7633 -19.7633 -19.2379 -19.2379 -19.2090 -19.2090 -19.0922 -19.0922 -19.0496 -19.0496 -18.9886 -18.9886 -18.8615 -18.8615 -11.3579 -11.3579 -11.3261 -11.3261 -11.1815 -11.1815 -0.3980 -0.3980 -0.2941 -0.2941 0.0772 0.0772 0.1635 0.1635 0.2788 0.2788 0.6435 0.6435 2.6570 2.6570 2.6723 2.6723 2.7140 2.7140 7.4970 7.4970 8.5521 8.5521 8.5828 8.5828 9.2748 9.2748 9.6027 9.6027 10.0541 10.0541 k = 0.0000 0.0000 1.0402 ( 9534 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1185 -47.1185 -47.1177 -47.1177 -20.0020 -20.0020 -19.9989 -19.9989 -19.8463 -19.8463 -19.8450 -19.8450 -19.7787 -19.7787 -19.7633 -19.7633 -19.2384 -19.2384 -19.2091 -19.2091 -19.0925 -19.0925 -19.0492 -19.0492 -18.9899 -18.9899 -18.8605 -18.8605 -11.3546 -11.3546 -11.3261 -11.3261 -11.1786 -11.1786 -0.4071 -0.4071 -0.3011 -0.3011 0.0815 0.0815 0.1545 0.1545 0.2913 0.2913 0.6284 0.6284 2.6468 2.6468 2.6635 2.6635 2.7079 2.7079 7.4968 7.4968 8.5210 8.5210 8.6025 8.6025 9.2600 9.2600 9.5629 9.5629 10.0591 10.0591 k = 0.0000 0.0000 1.0656 ( 9514 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1184 -47.1184 -47.1178 -47.1178 -20.0020 -20.0020 -19.9989 -19.9989 -19.8463 -19.8463 -19.8450 -19.8450 -19.7788 -19.7788 -19.7632 -19.7632 -19.2388 -19.2388 -19.2090 -19.2090 -19.0927 -19.0927 -19.0488 -19.0488 -18.9910 -18.9910 -18.8596 -18.8596 -11.3517 -11.3517 -11.3261 -11.3261 -11.1759 -11.1759 -0.4157 -0.4157 -0.3075 -0.3075 0.0854 0.0854 0.1470 0.1470 0.3044 0.3044 0.6133 0.6133 2.6371 2.6371 2.6551 2.6551 2.7024 2.7024 7.4946 7.4946 8.4929 8.4929 8.6260 8.6260 9.2462 9.2462 9.5223 9.5223 10.0633 10.0633 k = 0.0000 0.0000 1.0909 ( 9516 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1183 -47.1183 -47.1178 -47.1178 -20.0021 -20.0021 -19.9989 -19.9989 -19.8464 -19.8464 -19.8450 -19.8450 -19.7789 -19.7789 -19.7632 -19.7632 -19.2392 -19.2392 -19.2091 -19.2091 -19.0930 -19.0930 -19.0485 -19.0485 -18.9920 -18.9920 -18.8589 -18.8589 -11.3491 -11.3491 -11.3261 -11.3261 -11.1735 -11.1735 -0.4236 -0.4236 -0.3131 -0.3131 0.0885 0.0885 0.1415 0.1415 0.3177 0.3177 0.5984 0.5984 2.6281 2.6281 2.6474 2.6474 2.6975 2.6975 7.4910 7.4910 8.4681 8.4681 8.6520 8.6520 9.2337 9.2337 9.4816 9.4816 10.0667 10.0667 k = 0.0000 0.0000 1.1163 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1183 -47.1183 -47.1179 -47.1179 -20.0021 -20.0021 -19.9989 -19.9989 -19.8464 -19.8464 -19.8451 -19.8451 -19.7790 -19.7790 -19.7632 -19.7632 -19.2396 -19.2396 -19.2091 -19.2091 -19.0932 -19.0932 -19.0483 -19.0483 -18.9929 -18.9929 -18.8582 -18.8582 -11.3469 -11.3469 -11.3261 -11.3261 -11.1714 -11.1714 -0.4308 -0.4308 -0.3181 -0.3181 0.0903 0.0903 0.1382 0.1382 0.3311 0.3311 0.5838 0.5838 2.6198 2.6198 2.6404 2.6404 2.6932 2.6932 7.4867 7.4867 8.4467 8.4467 8.6795 8.6795 9.2225 9.2225 9.4414 9.4414 10.0695 10.0695 k = 0.0000 0.0000 1.1417 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9989 -19.9989 -19.8465 -19.8465 -19.8451 -19.8451 -19.7791 -19.7791 -19.7632 -19.7632 -19.2399 -19.2399 -19.2091 -19.2091 -19.0934 -19.0934 -19.0480 -19.0480 -18.9937 -18.9937 -18.8576 -18.8576 -11.3450 -11.3450 -11.3261 -11.3261 -11.1695 -11.1695 -0.4370 -0.4370 -0.3223 -0.3223 0.0906 0.0906 0.1369 0.1369 0.3441 0.3441 0.5699 0.5699 2.6125 2.6125 2.6342 2.6342 2.6896 2.6896 7.4822 7.4822 8.4288 8.4288 8.7075 8.7075 9.2128 9.2128 9.4028 9.4028 10.0717 10.0717 k = 0.0000 0.0000 1.1671 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1180 -47.1180 -20.0022 -20.0022 -19.9989 -19.9989 -19.8465 -19.8465 -19.8451 -19.8451 -19.7791 -19.7791 -19.7631 -19.7631 -19.2402 -19.2402 -19.2091 -19.2091 -19.0935 -19.0935 -19.0479 -19.0479 -18.9943 -18.9943 -18.8571 -18.8571 -11.3435 -11.3435 -11.3262 -11.3262 -11.1679 -11.1679 -0.4422 -0.4422 -0.3258 -0.3258 0.0899 0.0899 0.1372 0.1372 0.3564 0.3564 0.5569 0.5569 2.6063 2.6063 2.6290 2.6290 2.6866 2.6866 7.4780 7.4780 8.4142 8.4142 8.7346 8.7346 9.2046 9.2046 9.3671 9.3671 10.0734 10.0734 k = 0.0000 0.0000 1.1924 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1180 -47.1180 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7792 -19.7792 -19.7632 -19.7632 -19.2404 -19.2404 -19.2091 -19.2091 -19.0936 -19.0936 -19.0477 -19.0477 -18.9947 -18.9947 -18.8568 -18.8568 -11.3424 -11.3424 -11.3262 -11.3262 -11.1667 -11.1667 -0.4463 -0.4463 -0.3286 -0.3286 0.0886 0.0886 0.1382 0.1382 0.3674 0.3674 0.5454 0.5454 2.6013 2.6013 2.6249 2.6249 2.6843 2.6843 7.4743 7.4743 8.4028 8.4028 8.7593 8.7593 9.1979 9.1979 9.3359 9.3359 10.0746 10.0746 k = 0.0000 0.0000 1.2178 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7792 -19.7792 -19.7632 -19.7632 -19.2406 -19.2406 -19.2092 -19.2092 -19.0937 -19.0937 -19.0477 -19.0477 -18.9951 -18.9951 -18.8565 -18.8565 -11.3415 -11.3415 -11.3262 -11.3262 -11.1658 -11.1658 -0.4493 -0.4493 -0.3306 -0.3306 0.0874 0.0874 0.1394 0.1394 0.3763 0.3763 0.5361 0.5361 2.5977 2.5977 2.6219 2.6219 2.6826 2.6826 7.4715 7.4715 8.3948 8.3948 8.7794 8.7794 9.1928 9.1928 9.3114 9.3114 10.0755 10.0755 k = 0.0000 0.0000 1.2432 ( 9552 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8564 -18.8564 -11.3410 -11.3410 -11.3262 -11.3262 -11.1653 -11.1653 -0.4511 -0.4511 -0.3318 -0.3318 0.0866 0.0866 0.1403 0.1403 0.3822 0.3822 0.5300 0.5300 2.5955 2.5955 2.6200 2.6200 2.6816 2.6816 7.4698 7.4698 8.3899 8.3899 8.7927 8.7927 9.1896 9.1896 9.2956 9.2956 10.0760 10.0760 k = 0.0000 0.0000 1.2685 ( 9560 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8466 -19.8466 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9954 -18.9954 -18.8564 -18.8564 -11.3409 -11.3409 -11.3262 -11.3262 -11.1651 -11.1651 -0.4517 -0.4517 -0.3322 -0.3322 0.0863 0.0863 0.1407 0.1407 0.3843 0.3843 0.5278 0.5278 2.5948 2.5948 2.6194 2.6194 2.6813 2.6813 7.4692 7.4692 8.3883 8.3883 8.7974 8.7974 9.1884 9.1884 9.2902 9.2902 10.0762 10.0762 k = 0.0000 0.0000 1.2685 ( 9560 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8466 -19.8466 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9954 -18.9954 -18.8564 -18.8564 -11.3409 -11.3409 -11.3262 -11.3262 -11.1651 -11.1651 -0.4517 -0.4517 -0.3322 -0.3322 0.0863 0.0863 0.1407 0.1407 0.3843 0.3843 0.5278 0.5278 2.5948 2.5948 2.6194 2.6194 2.6813 2.6813 7.4692 7.4692 8.3883 8.3883 8.7974 8.7974 9.1884 9.1884 9.2902 9.2902 10.0762 10.0762 k =-0.0092 0.0214 1.2685 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8564 -18.8564 -11.3409 -11.3409 -11.3263 -11.3263 -11.1653 -11.1653 -0.4513 -0.4513 -0.3322 -0.3322 0.0810 0.0810 0.1461 0.1461 0.3848 0.3848 0.5280 0.5280 2.5951 2.5951 2.6197 2.6197 2.6812 2.6812 7.4718 7.4718 8.3892 8.3892 8.7982 8.7982 9.1891 9.1891 9.2875 9.2875 10.0757 10.0757 k =-0.0184 0.0429 1.2685 ( 9546 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2406 -19.2406 -19.2092 -19.2092 -19.0937 -19.0937 -19.0477 -19.0477 -18.9951 -18.9951 -18.8565 -18.8565 -11.3409 -11.3409 -11.3266 -11.3266 -11.1658 -11.1658 -0.4499 -0.4499 -0.3321 -0.3321 0.0692 0.0692 0.1587 0.1587 0.3861 0.3861 0.5286 0.5286 2.5961 2.5961 2.6205 2.6205 2.6808 2.6808 7.4797 7.4797 8.3919 8.3919 8.8007 8.8007 9.1911 9.1911 9.2796 9.2796 10.0744 10.0744 k =-0.0276 0.0643 1.2685 ( 9538 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0021 -20.0021 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7791 -19.7791 -19.7632 -19.7632 -19.2405 -19.2405 -19.2092 -19.2092 -19.0937 -19.0937 -19.0477 -19.0477 -18.9948 -18.9948 -18.8567 -18.8567 -11.3409 -11.3409 -11.3272 -11.3272 -11.1668 -11.1668 -0.4476 -0.4476 -0.3318 -0.3318 0.0549 0.0549 0.1741 0.1741 0.3882 0.3882 0.5296 0.5296 2.5977 2.5977 2.6219 2.6219 2.6801 2.6801 7.4929 7.4929 8.3963 8.3963 8.8049 8.8049 9.1940 9.1940 9.2669 9.2669 10.0723 10.0723 k =-0.0368 0.0858 1.2685 ( 9530 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7791 -19.7791 -19.7633 -19.7633 -19.2403 -19.2403 -19.2091 -19.2091 -19.0936 -19.0936 -19.0478 -19.0478 -18.9944 -18.9944 -18.8570 -18.8570 -11.3409 -11.3409 -11.3279 -11.3279 -11.1680 -11.1680 -0.4444 -0.4444 -0.3315 -0.3315 0.0401 0.0401 0.1906 0.1906 0.3912 0.3912 0.5310 0.5310 2.6000 2.6000 2.6238 2.6238 2.6793 2.6793 7.5111 7.5111 8.4022 8.4022 8.8107 8.8107 9.1964 9.1964 9.2505 9.2505 10.0698 10.0698 k =-0.0460 0.1072 1.2685 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7790 -19.7790 -19.7633 -19.7633 -19.2401 -19.2401 -19.2091 -19.2091 -19.0934 -19.0934 -19.0480 -19.0480 -18.9939 -18.9939 -18.8574 -18.8574 -11.3409 -11.3409 -11.3289 -11.3289 -11.1696 -11.1696 -0.4404 -0.4404 -0.3310 -0.3310 0.0255 0.0255 0.2074 0.2074 0.3950 0.3950 0.5327 0.5327 2.6030 2.6030 2.6263 2.6263 2.6783 2.6783 7.5343 7.5343 8.4095 8.4095 8.8182 8.8182 9.1933 9.1933 9.2353 9.2353 10.0671 10.0671 k =-0.0460 0.1072 1.2685 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7790 -19.7790 -19.7633 -19.7633 -19.2401 -19.2401 -19.2091 -19.2091 -19.0934 -19.0934 -19.0480 -19.0480 -18.9939 -18.9939 -18.8574 -18.8574 -11.3409 -11.3409 -11.3289 -11.3289 -11.1696 -11.1696 -0.4404 -0.4404 -0.3310 -0.3310 0.0255 0.0255 0.2074 0.2074 0.3950 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-19.2396 -19.2091 -19.2091 -19.0932 -19.0932 -19.0483 -19.0483 -18.9928 -18.9928 -18.8583 -18.8583 -11.3413 -11.3413 -11.3308 -11.3308 -11.1731 -11.1731 -0.4318 -0.4318 -0.3295 -0.3295 0.0048 0.0048 0.2328 0.2328 0.3991 0.3991 0.5399 0.5399 2.6100 2.6100 2.6323 2.6323 2.6776 2.6776 7.5808 7.5808 8.4256 8.4256 8.8167 8.8167 9.1757 9.1757 9.2358 9.2358 10.0632 10.0632 k =-0.0673 0.1568 1.2145 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1183 -47.1183 -47.1179 -47.1179 -20.0020 -20.0020 -19.9990 -19.9990 -19.8463 -19.8463 -19.8451 -19.8451 -19.7788 -19.7788 -19.7634 -19.7634 -19.2392 -19.2392 -19.2091 -19.2091 -19.0930 -19.0930 -19.0485 -19.0485 -18.9920 -18.9920 -18.8589 -18.8589 -11.3417 -11.3417 -11.3319 -11.3319 -11.1754 -11.1754 -0.4266 -0.4266 -0.3284 -0.3284 -0.0041 -0.0041 0.2451 0.2451 0.4002 0.4002 0.5459 0.5459 2.6148 2.6148 2.6367 2.6367 2.6780 2.6780 7.6089 7.6089 8.4362 8.4362 8.8024 8.8024 9.1738 9.1738 9.2423 9.2423 10.0615 10.0615 k =-0.0744 0.1734 1.1965 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1178 -47.1178 -20.0019 -20.0019 -19.9990 -19.9990 -19.8462 -19.8462 -19.8452 -19.8452 -19.7787 -19.7787 -19.7634 -19.7634 -19.2389 -19.2389 -19.2091 -19.2091 -19.0928 -19.0928 -19.0488 -19.0488 -18.9911 -18.9911 -18.8597 -18.8597 -11.3423 -11.3423 -11.3332 -11.3332 -11.1780 -11.1780 -0.4211 -0.4211 -0.3273 -0.3273 -0.0117 -0.0117 0.2572 0.2572 0.4011 0.4011 0.5532 0.5532 2.6203 2.6203 2.6417 2.6417 2.6791 2.6791 7.6402 7.6402 8.4479 8.4479 8.7782 8.7782 9.1803 9.1803 9.2501 9.2501 10.0599 10.0599 k =-0.0815 0.1899 1.1785 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1178 -47.1178 -20.0019 -20.0019 -19.9990 -19.9990 -19.8462 -19.8462 -19.8452 -19.8452 -19.7786 -19.7786 -19.7635 -19.7635 -19.2384 -19.2384 -19.2091 -19.2091 -19.0925 -19.0925 -19.0491 -19.0491 -18.9900 -18.9900 -18.8605 -18.8605 -11.3430 -11.3430 -11.3345 -11.3345 -11.1809 -11.1809 -0.4158 -0.4158 -0.3263 -0.3263 -0.0177 -0.0177 0.2692 0.2692 0.4022 0.4022 0.5612 0.5612 2.6261 2.6261 2.6476 2.6476 2.6813 2.6813 7.6743 7.6743 8.4602 8.4602 8.7449 8.7449 9.1947 9.1947 9.2583 9.2583 10.0585 10.0585 k =-0.0885 0.2065 1.1605 ( 9542 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1178 -47.1178 -20.0018 -20.0018 -19.9990 -19.9990 -19.8461 -19.8461 -19.8452 -19.8452 -19.7785 -19.7785 -19.7635 -19.7635 -19.2379 -19.2379 -19.2091 -19.2091 -19.0923 -19.0923 -19.0495 -19.0495 -18.9888 -18.9888 -18.8615 -18.8615 -11.3439 -11.3439 -11.3359 -11.3359 -11.1840 -11.1840 -0.4109 -0.4109 -0.3255 -0.3255 -0.0218 -0.0218 0.2814 0.2814 0.4040 0.4040 0.5697 0.5697 2.6319 2.6319 2.6541 2.6541 2.6847 2.6847 7.7109 7.7109 8.4722 8.4722 8.7041 8.7041 9.2154 9.2154 9.2668 9.2668 10.0573 10.0573 k =-0.0956 0.2230 1.1426 ( 9542 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1178 -47.1178 -20.0018 -20.0018 -19.9991 -19.9991 -19.8461 -19.8461 -19.8452 -19.8452 -19.7783 -19.7783 -19.7636 -19.7636 -19.2374 -19.2374 -19.2091 -19.2091 -19.0920 -19.0920 -19.0499 -19.0499 -18.9875 -18.9875 -18.8625 -18.8625 -11.3449 -11.3449 -11.3374 -11.3374 -11.1875 -11.1875 -0.4068 -0.4068 -0.3250 -0.3250 -0.0239 -0.0239 0.2937 0.2937 0.4065 0.4065 0.5785 0.5785 2.6372 2.6372 2.6613 2.6613 2.6897 2.6897 7.7498 7.7498 8.4830 8.4830 8.6576 8.6576 9.2389 9.2389 9.2771 9.2771 10.0560 10.0560 k =-0.1027 0.2395 1.1246 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1177 -47.1177 -20.0017 -20.0017 -19.9990 -19.9990 -19.8460 -19.8460 -19.8451 -19.8451 -19.7782 -19.7782 -19.7636 -19.7636 -19.2368 -19.2368 -19.2091 -19.2091 -19.0916 -19.0916 -19.0504 -19.0504 -18.9860 -18.9860 -18.8636 -18.8636 -11.3460 -11.3460 -11.3389 -11.3389 -11.1912 -11.1912 -0.4039 -0.4039 -0.3250 -0.3250 -0.0236 -0.0236 0.3066 0.3066 0.4098 0.4098 0.5874 0.5874 2.6418 2.6418 2.6691 2.6691 2.6965 2.6965 7.7905 7.7905 8.4911 8.4911 8.6070 8.6070 9.2578 9.2578 9.2955 9.2955 10.0543 10.0543 k =-0.1098 0.2561 1.1066 ( 9542 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1177 -47.1177 -20.0016 -20.0016 -19.9990 -19.9990 -19.8459 -19.8459 -19.8451 -19.8451 -19.7780 -19.7780 -19.7637 -19.7637 -19.2362 -19.2362 -19.2091 -19.2091 -19.0912 -19.0912 -19.0509 -19.0509 -18.9845 -18.9845 -18.8649 -18.8649 -11.3472 -11.3472 -11.3405 -11.3405 -11.1951 -11.1951 -0.4025 -0.4025 -0.3255 -0.3255 -0.0209 -0.0209 0.3200 0.3200 0.4141 0.4141 0.5965 0.5965 2.6453 2.6453 2.6777 2.6777 2.7050 2.7050 7.8324 7.8324 8.4950 8.4950 8.5539 8.5539 9.2670 9.2670 9.3262 9.3262 10.0511 10.0511 k =-0.1169 0.2726 1.0886 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1177 -47.1177 -20.0016 -20.0016 -19.9990 -19.9990 -19.8459 -19.8459 -19.8451 -19.8451 -19.7778 -19.7778 -19.7637 -19.7637 -19.2355 -19.2355 -19.2091 -19.2091 -19.0908 -19.0908 -19.0515 -19.0515 -18.9827 -18.9827 -18.8662 -18.8662 -11.3485 -11.3485 -11.3422 -11.3422 -11.1991 -11.1991 -0.4026 -0.4026 -0.3266 -0.3266 -0.0156 -0.0156 0.3341 0.3341 0.4192 0.4192 0.6055 0.6055 2.6481 2.6481 2.6867 2.6867 2.7152 2.7152 7.8746 7.8746 8.4894 8.4894 8.5031 8.5031 9.2720 9.2720 9.3641 9.3641 10.0444 10.0444 k =-0.1240 0.2892 1.0706 ( 9535 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1176 -47.1176 -20.0015 -20.0015 -19.9990 -19.9990 -19.8458 -19.8458 -19.8451 -19.8451 -19.7777 -19.7777 -19.7638 -19.7638 -19.2348 -19.2348 -19.2092 -19.2092 -19.0903 -19.0903 -19.0521 -19.0521 -18.9809 -18.9809 -18.8676 -18.8676 -11.3499 -11.3499 -11.3439 -11.3439 -11.2033 -11.2033 -0.4044 -0.4044 -0.3285 -0.3285 -0.0080 -0.0080 0.3489 0.3489 0.4254 0.4254 0.6146 0.6146 2.6501 2.6501 2.6962 2.6962 2.7267 2.7267 7.9157 7.9157 8.4432 8.4432 8.4856 8.4856 9.2769 9.2769 9.4059 9.4059 10.0294 10.0294 k =-0.1311 0.3057 1.0526 ( 9533 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1176 -47.1176 -20.0014 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7.9835 7.9835 8.3490 8.3490 8.4370 8.4370 9.2966 9.2966 9.4966 9.4966 9.9441 9.9441 k =-0.1453 0.3388 1.0166 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1176 -47.1176 -20.0013 -20.0013 -19.9990 -19.9990 -19.8456 -19.8456 -19.8450 -19.8450 -19.7772 -19.7772 -19.7639 -19.7639 -19.2324 -19.2324 -19.2094 -19.2094 -19.0888 -19.0888 -19.0543 -19.0543 -18.9745 -18.9745 -18.8725 -18.8725 -11.3544 -11.3544 -11.3491 -11.3491 -11.2165 -11.2165 -0.4180 -0.4180 -0.3391 -0.3391 0.0272 0.0272 0.3938 0.3938 0.4528 0.4528 0.6424 0.6424 2.6536 2.6536 2.7260 2.7260 2.7666 2.7666 7.9993 7.9993 8.3193 8.3193 8.3976 8.3976 9.3150 9.3150 9.5436 9.5436 9.8779 9.8779 k =-0.1524 0.3553 0.9986 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1175 -47.1175 -20.0012 -20.0012 -19.9990 -19.9990 -19.8455 -19.8455 -19.8450 -19.8450 -19.7770 -19.7770 -19.7640 -19.7640 -19.2316 -19.2316 -19.2096 -19.2096 -19.0882 -19.0882 -19.0551 -19.0551 -18.9722 -18.9722 -18.8744 -18.8744 -11.3559 -11.3559 -11.3508 -11.3508 -11.2209 -11.2209 -0.4246 -0.4246 -0.3442 -0.3442 0.0418 0.0418 0.4069 0.4069 0.4666 0.4666 0.6521 0.6521 2.6541 2.6541 2.7361 2.7361 2.7810 2.7810 7.9939 7.9939 8.3101 8.3101 8.3495 8.3495 9.3404 9.3404 9.5891 9.5891 9.8091 9.8091 k =-0.1595 0.3719 0.9806 ( 9519 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1175 -47.1175 -20.0011 -20.0011 -19.9990 -19.9990 -19.8454 -19.8454 -19.8450 -19.8450 -19.7768 -19.7768 -19.7640 -19.7640 -19.2307 -19.2307 -19.2097 -19.2097 -19.0875 -19.0875 -19.0559 -19.0559 -18.9697 -18.9697 -18.8763 -18.8763 -11.3575 -11.3575 -11.3525 -11.3525 -11.2253 -11.2253 -0.4319 -0.4319 -0.3498 -0.3498 0.0571 0.0571 0.4181 0.4181 0.4831 0.4831 0.6619 0.6619 2.6544 2.6544 2.7460 2.7460 2.7957 2.7957 7.9666 7.9666 8.2887 8.2887 8.3275 8.3275 9.3726 9.3726 9.6235 9.6235 9.7515 9.7515 k =-0.1666 0.3884 0.9626 ( 9523 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 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-19.0847 -19.0598 -19.0598 -18.9592 -18.9592 -18.8849 -18.8849 -11.3635 -11.3635 -11.3589 -11.3589 -11.2420 -11.2420 -0.4633 -0.4633 -0.3760 -0.3760 0.1176 0.1176 0.4496 0.4496 0.5675 0.5675 0.7047 0.7047 2.6531 2.6531 2.7832 2.7832 2.8535 2.8535 7.7642 7.7642 8.0235 8.0235 8.4734 8.4734 9.4339 9.4339 9.5578 9.5578 9.8782 9.8782 k =-0.1950 0.4546 0.8906 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1174 -47.1174 -20.0008 -20.0008 -19.9989 -19.9989 -19.8451 -19.8451 -19.8449 -19.8449 -19.7760 -19.7760 -19.7643 -19.7643 -19.2264 -19.2264 -19.2110 -19.2110 -19.0839 -19.0839 -19.0608 -19.0608 -18.9565 -18.9565 -18.8872 -18.8872 -11.3649 -11.3649 -11.3603 -11.3603 -11.2457 -11.2457 -0.4710 -0.4710 -0.3827 -0.3827 0.1310 0.1310 0.4554 0.4554 0.5901 0.5901 0.7161 0.7161 2.6522 2.6522 2.7915 2.7915 2.8671 2.8671 7.7099 7.7099 7.9558 7.9558 8.5139 8.5139 9.3771 9.3771 9.6135 9.6135 9.9292 9.9292 k =-0.2021 0.4711 0.8726 ( 9529 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1174 -47.1174 -20.0008 -20.0008 -19.9989 -19.9989 -19.8450 -19.8450 -19.8449 -19.8449 -19.7759 -19.7759 -19.7643 -19.7643 -19.2255 -19.2255 -19.2113 -19.2113 -19.0831 -19.0831 -19.0618 -19.0618 -18.9536 -18.9536 -18.8895 -18.8895 -11.3662 -11.3662 -11.3616 -11.3616 -11.2493 -11.2493 -0.4783 -0.4783 -0.3891 -0.3891 0.1433 0.1433 0.4607 0.4607 0.6125 0.6125 0.7275 0.7275 2.6512 2.6512 2.7993 2.7993 2.8800 2.8800 7.6575 7.6575 7.8905 7.8905 8.5522 8.5522 9.3251 9.3251 9.6715 9.6715 9.9792 9.9792 k =-0.2091 0.4877 0.8546 ( 9533 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1174 -47.1174 -20.0007 -20.0007 -19.9989 -19.9989 -19.8450 -19.8450 -19.8449 -19.8449 -19.7758 -19.7758 -19.7644 -19.7644 -19.2246 -19.2246 -19.2117 -19.2117 -19.0822 -19.0822 -19.0629 -19.0629 -18.9508 -18.9508 -18.8919 -18.8919 -11.3675 -11.3675 -11.3629 -11.3629 -11.2526 -11.2526 -0.4852 -0.4852 -0.3953 -0.3953 0.1544 0.1544 0.4654 0.4654 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-19.2229 -19.2125 -19.2125 -19.0804 -19.0804 -19.0651 -19.0651 -18.9451 -18.9451 -18.8969 -18.8969 -11.3696 -11.3696 -11.3650 -11.3650 -11.2583 -11.2583 -0.4974 -0.4974 -0.4064 -0.4064 0.1727 0.1727 0.4732 0.4732 0.6743 0.6743 0.7598 0.7598 2.6473 2.6473 2.8189 2.8189 2.9136 2.9136 7.5197 7.5197 7.7187 7.7187 8.6467 8.6467 9.2023 9.2023 9.8506 9.8506 10.1157 10.1157 k =-0.2304 0.5373 0.8006 ( 9535 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0006 -20.0006 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7645 -19.7645 -19.2221 -19.2221 -19.2130 -19.2130 -19.0795 -19.0795 -19.0662 -19.0662 -18.9423 -18.9423 -18.8993 -18.8993 -11.3705 -11.3705 -11.3659 -11.3659 -11.2607 -11.2607 -0.5025 -0.5025 -0.4111 -0.4111 0.1799 0.1799 0.4763 0.4763 0.6920 0.6920 0.7692 0.7692 2.6459 2.6459 2.8241 2.8241 2.9227 2.9227 7.4823 7.4823 7.6721 7.6721 8.6697 8.6697 9.1732 9.1732 9.9091 9.9091 10.1544 10.1544 k =-0.2375 0.5538 0.7826 ( 9537 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0006 -20.0006 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7645 -19.7645 -19.2213 -19.2213 -19.2135 -19.2135 -19.0785 -19.0785 -19.0673 -19.0673 -18.9397 -18.9397 -18.9017 -18.9017 -11.3713 -11.3713 -11.3667 -11.3667 -11.2627 -11.2627 -0.5069 -0.5069 -0.4152 -0.4152 0.1859 0.1859 0.4790 0.4790 0.7077 0.7077 0.7774 0.7774 2.6446 2.6446 2.8286 2.8286 2.9306 2.9306 7.4500 7.4500 7.6317 7.6317 8.6881 8.6881 9.1498 9.1498 9.9650 9.9650 10.1887 10.1887 k =-0.2446 0.5704 0.7646 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7753 -19.7753 -19.7645 -19.7645 -19.2205 -19.2205 -19.2139 -19.2139 -19.0775 -19.0775 -19.0684 -19.0684 -18.9372 -18.9372 -18.9040 -18.9040 -11.3720 -11.3720 -11.3673 -11.3673 -11.2645 -11.2645 -0.5106 -0.5106 -0.4186 -0.4186 0.1907 0.1907 0.4811 0.4811 0.7212 0.7212 0.7843 0.7843 2.6435 2.6435 2.8322 2.8322 2.9371 2.9371 7.4230 7.4230 7.5980 7.5980 8.7021 8.7021 9.1318 9.1318 10.0169 10.0169 10.2178 10.2178 k =-0.2517 0.5869 0.7466 ( 9526 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8447 -19.8447 -19.7752 -19.7752 -19.7645 -19.7645 -19.2198 -19.2198 -19.2144 -19.2144 -19.0765 -19.0765 -19.0694 -19.0694 -18.9349 -18.9349 -18.9060 -18.9060 -11.3725 -11.3725 -11.3678 -11.3678 -11.2658 -11.2658 -0.5135 -0.5135 -0.4213 -0.4213 0.1944 0.1944 0.4827 0.4827 0.7321 0.7321 0.7898 0.7898 2.6425 2.6425 2.8351 2.8351 2.9423 2.9423 7.4017 7.4017 7.5715 7.5715 8.7122 8.7122 9.1188 9.1188 10.0629 10.0629 10.2413 10.2413 k =-0.2588 0.6034 0.7286 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1173 -47.1173 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8447 -19.8447 -19.7752 -19.7752 -19.7645 -19.7645 -19.2192 -19.2192 -19.2149 -19.2149 -19.0755 -19.0755 -19.0704 -19.0704 -18.9330 -18.9330 -18.9078 -18.9078 -11.3728 -11.3728 -11.3682 -11.3682 -11.2668 -11.2668 -0.5156 -0.5156 -0.4233 -0.4233 0.1971 0.1971 0.4839 0.4839 0.7401 0.7401 0.7937 0.7937 2.6418 2.6418 2.8372 2.8372 2.9461 2.9461 7.3863 7.3863 7.5524 7.5524 8.7189 8.7189 9.1101 9.1101 10.1001 10.1001 10.2586 10.2586 k =-0.2659 0.6200 0.7106 ( 9525 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8447 -19.8447 -19.7752 -19.7752 -19.7645 -19.7645 -19.2188 -19.2188 -19.2152 -19.2152 -19.0747 -19.0747 -19.0713 -19.0713 -18.9318 -18.9318 -18.9089 -18.9089 -11.3731 -11.3731 -11.3684 -11.3684 -11.2673 -11.2673 -0.5168 -0.5168 -0.4245 -0.4245 0.1986 0.1986 0.4846 0.4846 0.7451 0.7451 0.7961 0.7961 2.6413 2.6413 2.8385 2.8385 2.9484 2.9484 7.3770 7.3770 7.5408 7.5408 8.7226 8.7226 9.1051 9.1051 10.1250 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-11.3685 -11.2675 -11.2675 -0.5172 -0.5172 -0.4249 -0.4249 0.1991 0.1991 0.4848 0.4848 0.7467 0.7467 0.7968 0.7968 2.6412 2.6412 2.8389 2.8389 2.9491 2.9491 7.3739 7.3739 7.5369 7.5369 8.7238 8.7238 9.1035 9.1035 10.1339 10.1339 10.2731 10.2731 k =-0.2658 0.6198 0.6744 ( 9539 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1176 -47.1176 -20.0006 -20.0006 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7753 -19.7753 -19.7645 -19.7645 -19.2181 -19.2181 -19.2159 -19.2159 -19.0742 -19.0742 -19.0719 -19.0719 -18.9315 -18.9315 -18.9096 -18.9096 -11.3752 -11.3752 -11.3650 -11.3650 -11.2666 -11.2666 -0.5247 -0.5247 -0.4325 -0.4325 0.1916 0.1916 0.4956 0.4956 0.7512 0.7512 0.7968 0.7968 2.6323 2.6323 2.8382 2.8382 2.9480 2.9480 7.3849 7.3849 7.5740 7.5740 8.6612 8.6612 9.1598 9.1598 10.1079 10.1079 10.3006 10.3006 k =-0.2586 0.6030 0.6561 ( 9539 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1178 -47.1178 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7644 -19.7644 -19.2176 -19.2176 -19.2163 -19.2163 -19.0741 -19.0741 -19.0719 -19.0719 -18.9316 -18.9316 -18.9098 -18.9098 -11.3782 -11.3782 -11.3617 -11.3617 -11.2655 -11.2655 -0.5303 -0.5303 -0.4377 -0.4377 0.1846 0.1846 0.5063 0.5063 0.7522 0.7522 0.7998 0.7998 2.6244 2.6244 2.8370 2.8370 2.9472 2.9472 7.3922 7.3922 7.6100 7.6100 8.6005 8.6005 9.2156 9.2156 10.0788 10.0788 10.3265 10.3265 k =-0.2514 0.5863 0.6379 ( 9539 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2171 -19.2171 -19.2168 -19.2168 -19.0740 -19.0740 -19.0720 -19.0720 -18.9317 -18.9317 -18.9098 -18.9098 -11.3819 -11.3819 -11.3585 -11.3585 -11.2643 -11.2643 -0.5342 -0.5342 -0.4403 -0.4403 0.1784 0.1784 0.5169 0.5169 0.7502 0.7502 0.8055 0.8055 2.6177 2.6177 2.8354 2.8354 2.9468 2.9468 7.3942 7.3942 7.6451 7.6451 8.5438 8.5438 9.2704 9.2704 10.0475 10.0475 10.3501 10.3501 k =-0.2443 0.5695 0.6197 ( 9539 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1183 -47.1183 -47.1179 -47.1179 -20.0007 -20.0007 -19.9987 -19.9987 -19.8450 -19.8450 -19.8447 -19.8447 -19.7755 -19.7755 -19.7642 -19.7642 -19.2174 -19.2174 -19.2166 -19.2166 -19.0740 -19.0740 -19.0720 -19.0720 -18.9316 -18.9316 -18.9098 -18.9098 -11.3862 -11.3862 -11.3556 -11.3556 -11.2630 -11.2630 -0.5363 -0.5363 -0.4404 -0.4404 0.1729 0.1729 0.5271 0.5271 0.7463 0.7463 0.8128 0.8128 2.6123 2.6123 2.8335 2.8335 2.9466 2.9466 7.3893 7.3893 7.6790 7.6790 8.4934 8.4934 9.3240 9.3240 10.0146 10.0146 10.3709 10.3709 k =-0.2371 0.5528 0.6015 ( 9527 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1177 -47.1177 -20.0007 -20.0007 -19.9987 -19.9987 -19.8450 -19.8450 -19.8447 -19.8447 -19.7755 -19.7755 -19.7641 -19.7641 -19.2178 -19.2178 -19.2160 -19.2160 -19.0741 -19.0741 -19.0719 -19.0719 -18.9315 -18.9315 -18.9097 -18.9097 -11.3913 -11.3913 -11.3529 -11.3529 -11.2617 -11.2617 -0.5368 -0.5368 -0.4378 -0.4378 0.1683 0.1683 0.5370 0.5370 0.7413 0.7413 0.8209 0.8209 2.6081 2.6081 2.8312 2.8312 2.9469 2.9469 7.3760 7.3760 7.7116 7.7116 8.4514 8.4514 9.3758 9.3758 9.9806 9.9806 10.3886 10.3886 k =-0.2299 0.5360 0.5832 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1174 -47.1174 -20.0008 -20.0008 -19.9987 -19.9987 -19.8450 -19.8450 -19.8447 -19.8447 -19.7756 -19.7756 -19.7641 -19.7641 -19.2184 -19.2184 -19.2156 -19.2156 -19.0743 -19.0743 -19.0718 -19.0718 -18.9314 -18.9314 -18.9095 -18.9095 -11.3968 -11.3968 -11.3504 -11.3504 -11.2605 -11.2605 -0.5358 -0.5358 -0.4327 -0.4327 0.1647 0.1647 0.5463 0.5463 0.7359 0.7359 0.8291 0.8291 2.6052 2.6052 2.8287 2.8287 2.9474 2.9474 7.3528 7.3528 7.7429 7.7429 8.4197 8.4197 9.4255 9.4255 9.9460 9.9460 10.4030 10.4030 k =-0.2227 0.5193 0.5650 ( 9529 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1191 -47.1191 -47.1172 -47.1172 -20.0008 -20.0008 -19.9986 -19.9986 -19.8450 -19.8450 -19.8446 -19.8446 -19.7756 -19.7756 -19.7640 -19.7640 -19.2189 -19.2189 -19.2151 -19.2151 -19.0744 -19.0744 -19.0717 -19.0717 -18.9312 -18.9312 -18.9092 -18.9092 -11.4029 -11.4029 -11.3481 -11.3481 -11.2594 -11.2594 -0.5333 -0.5333 -0.4250 -0.4250 0.1622 0.1622 0.5550 0.5550 0.7302 0.7302 0.8374 0.8374 2.6038 2.6038 2.8260 2.8260 2.9483 2.9483 7.3188 7.3188 7.7727 7.7727 8.3995 8.3995 9.4728 9.4728 9.9108 9.9108 10.4137 10.4137 k =-0.2155 0.5025 0.5468 ( 9529 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1193 -47.1193 -47.1170 -47.1170 -20.0008 -20.0008 -19.9985 -19.9985 -19.8450 -19.8450 -19.8445 -19.8445 -19.7756 -19.7756 -19.7640 -19.7640 -19.2194 -19.2194 -19.2146 -19.2146 -19.0747 -19.0747 -19.0715 -19.0715 -18.9310 -18.9310 -18.9089 -18.9089 -11.4094 -11.4094 -11.3460 -11.3460 -11.2584 -11.2584 -0.5296 -0.5296 -0.4147 -0.4147 0.1609 0.1609 0.5630 0.5630 0.7245 0.7245 0.8453 0.8453 2.6038 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-19.0752 -19.0752 -19.0712 -19.0712 -18.9303 -18.9303 -18.9080 -18.9080 -11.4235 -11.4235 -11.3425 -11.3425 -11.2570 -11.2570 -0.5189 -0.5189 -0.3870 -0.3870 0.1625 0.1625 0.5763 0.5763 0.7141 0.7141 0.8601 0.8601 2.6082 2.6082 2.8169 2.8169 2.9530 2.9530 7.1529 7.1529 7.8513 7.8513 8.4081 8.4081 9.5981 9.5981 9.8022 9.8022 10.4183 10.4183 k =-0.1940 0.4523 0.4921 ( 9533 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1200 -47.1200 -47.1163 -47.1163 -20.0008 -20.0008 -19.9984 -19.9984 -19.8450 -19.8450 -19.8444 -19.8444 -19.7756 -19.7756 -19.7638 -19.7638 -19.2210 -19.2210 -19.2134 -19.2134 -19.0755 -19.0755 -19.0711 -19.0711 -18.9299 -18.9299 -18.9075 -18.9075 -11.4309 -11.4309 -11.3411 -11.3411 -11.2566 -11.2566 -0.5124 -0.5124 -0.3696 -0.3696 0.1657 0.1657 0.5814 0.5814 0.7098 0.7098 0.8667 0.8667 2.6128 2.6128 2.8137 2.8137 2.9552 2.9552 7.0798 7.0798 7.8733 7.8733 8.4309 8.4309 9.6336 9.6336 9.7640 9.7640 10.4087 10.4087 k =-0.1868 0.4355 0.4739 ( 9529 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1203 -47.1203 -47.1160 -47.1160 -20.0007 -20.0007 -19.9983 -19.9983 -19.8449 -19.8449 -19.8443 -19.8443 -19.7755 -19.7755 -19.7638 -19.7638 -19.2215 -19.2215 -19.2130 -19.2130 -19.0757 -19.0757 -19.0710 -19.0710 -18.9294 -18.9294 -18.9068 -18.9068 -11.4386 -11.4386 -11.3398 -11.3398 -11.2564 -11.2564 -0.5053 -0.5053 -0.3500 -0.3500 0.1706 0.1706 0.5852 0.5852 0.7062 0.7062 0.8728 0.8728 2.6189 2.6189 2.8105 2.8105 2.9578 2.9578 7.0003 7.0003 7.8929 7.8929 8.4611 8.4611 9.6655 9.6655 9.7244 9.7244 10.3930 10.3930 k =-0.1796 0.4188 0.4557 ( 9541 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1205 -47.1205 -47.1158 -47.1158 -20.0007 -20.0007 -19.9982 -19.9982 -19.8449 -19.8449 -19.8443 -19.8443 -19.7755 -19.7755 -19.7638 -19.7638 -19.2220 -19.2220 -19.2126 -19.2126 -19.0761 -19.0761 -19.0709 -19.0709 -18.9290 -18.9290 -18.9062 -18.9062 -11.4465 -11.4465 -11.3388 -11.3388 -11.2564 -11.2564 -0.4980 -0.4980 -0.3283 -0.3283 0.1775 0.1775 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-19.7637 -19.2230 -19.2230 -19.2119 -19.2119 -19.0767 -19.0767 -19.0706 -19.0706 -18.9279 -18.9279 -18.9046 -18.9046 -11.4626 -11.4626 -11.3372 -11.3372 -11.2570 -11.2570 -0.4834 -0.4834 -0.2792 -0.2792 0.1972 0.1972 0.5887 0.5887 0.7019 0.7019 0.8873 0.8873 2.6464 2.6464 2.8007 2.8007 2.9669 2.9669 6.7350 6.7350 7.9361 7.9361 8.5830 8.5830 9.5778 9.5778 9.7487 9.7487 10.3094 10.3094 k =-0.1580 0.3685 0.4010 ( 9519 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1211 -47.1211 -47.1152 -47.1152 -20.0006 -20.0006 -19.9980 -19.9980 -19.8447 -19.8447 -19.8439 -19.8439 -19.7753 -19.7753 -19.7637 -19.7637 -19.2235 -19.2235 -19.2115 -19.2115 -19.0770 -19.0770 -19.0705 -19.0705 -18.9274 -18.9274 -18.9037 -18.9037 -11.4707 -11.4707 -11.3367 -11.3367 -11.2576 -11.2576 -0.4766 -0.4766 -0.2519 -0.2519 0.2100 0.2100 0.5874 0.5874 0.7027 0.7027 0.8908 0.8908 2.6586 2.6586 2.7974 2.7974 2.9704 2.9704 6.6410 6.6410 7.9449 7.9449 8.6299 8.6299 9.5192 9.5192 9.7696 9.7696 10.2715 10.2715 k =-0.1509 0.3518 0.3828 ( 9523 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1213 -47.1213 -47.1149 -47.1149 -20.0005 -20.0005 -19.9979 -19.9979 -19.8447 -19.8447 -19.8439 -19.8439 -19.7752 -19.7752 -19.7637 -19.7637 -19.2240 -19.2240 -19.2112 -19.2112 -19.0773 -19.0773 -19.0703 -19.0703 -18.9269 -18.9269 -18.9028 -18.9028 -11.4788 -11.4788 -11.3363 -11.3363 -11.2584 -11.2584 -0.4703 -0.4703 -0.2230 -0.2230 0.2249 0.2249 0.5850 0.5850 0.7046 0.7046 0.8937 0.8937 2.6722 2.6722 2.7942 2.7942 2.9741 2.9741 6.5455 6.5455 7.9508 7.9508 8.6781 8.6781 9.4542 9.4542 9.7868 9.7868 10.2311 10.2311 k =-0.1437 0.3350 0.3645 ( 9507 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1215 -47.1215 -47.1147 -47.1147 -20.0004 -20.0004 -19.9978 -19.9978 -19.8446 -19.8446 -19.8438 -19.8438 -19.7751 -19.7751 -19.7636 -19.7636 -19.2244 -19.2244 -19.2109 -19.2109 -19.0776 -19.0776 -19.0702 -19.0702 -18.9263 -18.9263 -18.9018 -18.9018 -11.4869 -11.4869 -11.3361 -11.3361 -11.2594 -11.2594 -0.4647 -0.4647 -0.1928 -0.1928 0.2416 0.2416 0.5819 0.5819 0.7075 0.7075 0.8957 0.8957 2.6872 2.6872 2.7909 2.7909 2.9779 2.9779 6.4492 6.4492 7.9537 7.9537 8.7266 8.7266 9.3831 9.3831 9.7990 9.7990 10.1913 10.1913 k =-0.1365 0.3183 0.3463 ( 9497 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1217 -47.1217 -47.1146 -47.1146 -20.0003 -20.0003 -19.9977 -19.9977 -19.8445 -19.8445 -19.8437 -19.8437 -19.7750 -19.7750 -19.7636 -19.7636 -19.2249 -19.2249 -19.2106 -19.2106 -19.0779 -19.0779 -19.0701 -19.0701 -18.9257 -18.9257 -18.9008 -18.9008 -11.4948 -11.4948 -11.3360 -11.3360 -11.2605 -11.2605 -0.4598 -0.4598 -0.1612 -0.1612 0.2599 0.2599 0.5782 0.5782 0.7113 0.7113 0.8971 0.8971 2.7035 2.7035 2.7877 2.7877 2.9818 2.9818 6.3524 6.3524 7.9537 7.9537 8.7743 8.7743 9.3068 9.3068 9.8033 9.8033 10.1565 10.1565 k =-0.1293 0.3015 0.3281 ( 9499 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1219 -47.1219 -47.1144 -47.1144 -20.0003 -20.0003 -19.9977 -19.9977 -19.8444 -19.8444 -19.8436 -19.8436 -19.7749 -19.7749 -19.7637 -19.7637 -19.2253 -19.2253 -19.2104 -19.2104 -19.0782 -19.0782 -19.0700 -19.0700 -18.9251 -18.9251 -18.8999 -18.8999 -11.5027 -11.5027 -11.3360 -11.3360 -11.2617 -11.2617 -0.4558 -0.4558 -0.1285 -0.1285 0.2796 0.2796 0.5743 0.5743 0.7159 0.7159 0.8978 0.8978 2.7209 2.7209 2.7846 2.7846 2.9858 2.9858 6.2558 6.2558 7.9508 7.9508 8.8204 8.8204 9.2266 9.2266 9.7959 9.7959 10.1326 10.1326 k =-0.1221 0.2848 0.3098 ( 9511 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1221 -47.1221 -47.1142 -47.1142 -20.0002 -20.0002 -19.9976 -19.9976 -19.8443 -19.8443 -19.8435 -19.8435 -19.7748 -19.7748 -19.7637 -19.7637 -19.2257 -19.2257 -19.2101 -19.2101 -19.0786 -19.0786 -19.0700 -19.0700 -18.9246 -18.9246 -18.8989 -18.8989 -11.5104 -11.5104 -11.3362 -11.3362 -11.2630 -11.2630 -0.4526 -0.4526 -0.0950 -0.0950 0.3001 0.3001 0.5705 0.5705 0.7213 0.7213 0.8977 0.8977 2.7393 2.7393 2.7816 2.7816 2.9898 2.9898 6.1598 6.1598 7.9450 7.9450 8.8637 8.8637 9.1443 9.1443 9.7737 9.7737 10.1244 10.1244 k =-0.1149 0.2680 0.2916 ( 9515 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1223 -47.1223 -47.1140 -47.1140 -20.0002 -20.0002 -19.9975 -19.9975 -19.8443 -19.8443 -19.8434 -19.8434 -19.7747 -19.7747 -19.7637 -19.7637 -19.2261 -19.2261 -19.2099 -19.2099 -19.0789 -19.0789 -19.0699 -19.0699 -18.9241 -18.9241 -18.8979 -18.8979 -11.5178 -11.5178 -11.3364 -11.3364 -11.2644 -11.2644 -0.4502 -0.4502 -0.0608 -0.0608 0.3211 0.3211 0.5669 0.5669 0.7275 0.7275 0.8969 0.8969 2.7576 2.7576 2.7797 2.7797 2.9938 2.9938 6.0648 6.0648 7.9364 7.9364 8.9024 8.9024 9.0628 9.0628 9.7370 9.7370 10.1333 10.1333 k =-0.1078 0.2513 0.2734 ( 9515 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1224 -47.1224 -47.1139 -47.1139 -20.0001 -20.0001 -19.9975 -19.9975 -19.8442 -19.8442 -19.8434 -19.8434 -19.7746 -19.7746 -19.7637 -19.7637 -19.2265 -19.2265 -19.2097 -19.2097 -19.0792 -19.0792 -19.0698 -19.0698 -18.9235 -18.9235 -18.8969 -18.8969 -11.5251 -11.5251 -11.3367 -11.3367 -11.2659 -11.2659 -0.4485 -0.4485 -0.0261 -0.0261 0.3420 0.3420 0.5639 0.5639 0.7345 0.7345 0.8954 0.8954 2.7692 2.7692 2.7853 2.7853 2.9978 2.9978 5.9714 5.9714 7.9251 7.9251 8.9265 8.9265 8.9930 8.9930 9.6897 9.6897 10.1570 10.1570 k =-0.1006 0.2345 0.2552 ( 9517 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1226 -47.1226 -47.1137 -47.1137 -20.0001 -20.0001 -19.9974 -19.9974 -19.8441 -19.8441 -19.8433 -19.8433 -19.7746 -19.7746 -19.7637 -19.7637 -19.2269 -19.2269 -19.2095 -19.2095 -19.0795 -19.0795 -19.0697 -19.0697 -18.9230 -18.9230 -18.8959 -18.8959 -11.5320 -11.5320 -11.3370 -11.3370 -11.2674 -11.2674 -0.4475 -0.4475 0.0088 0.0088 0.3620 0.3620 0.5617 0.5617 0.7424 0.7424 0.8932 0.8932 2.7687 2.7687 2.8038 2.8038 3.0017 3.0017 5.8799 5.8799 7.9112 7.9112 8.8827 8.8827 8.9895 8.9895 9.6361 9.6361 10.1924 10.1924 k =-0.0934 0.2178 0.2369 ( 9515 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1227 -47.1227 -47.1136 -47.1136 -20.0000 -20.0000 -19.9973 -19.9973 -19.8440 -19.8440 -19.8432 -19.8432 -19.7745 -19.7745 -19.7637 -19.7637 -19.2272 -19.2272 -19.2094 -19.2094 -19.0797 -19.0797 -19.0697 -19.0697 -18.9226 -18.9226 -18.8949 -18.8949 -11.5386 -11.5386 -11.3374 -11.3374 -11.2689 -11.2689 -0.4471 -0.4471 0.0437 0.0437 0.3805 0.3805 0.5609 0.5609 0.7510 0.7510 0.8904 0.8904 2.7660 2.7660 2.8251 2.8251 3.0056 3.0056 5.7908 5.7908 7.8947 7.8947 8.8099 8.8099 9.0143 9.0143 9.5796 9.5796 10.2369 10.2369 k =-0.0862 0.2010 0.2187 ( 9517 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1229 -47.1229 -47.1135 -47.1135 -19.9999 -19.9999 -19.9973 -19.9973 -19.8440 -19.8440 -19.8431 -19.8431 -19.7744 -19.7744 -19.7637 -19.7637 -19.2275 -19.2275 -19.2092 -19.2092 -19.0800 -19.0800 -19.0696 -19.0696 -18.9221 -18.9221 -18.8940 -18.8940 -11.5449 -11.5449 -11.3379 -11.3379 -11.2704 -11.2704 -0.4472 -0.4472 0.0782 0.0782 0.3966 0.3966 0.5618 0.5618 0.7605 0.7605 0.8871 0.8871 2.7629 2.7629 2.8471 2.8471 3.0093 3.0093 5.7047 5.7047 7.8760 7.8760 8.7385 8.7385 9.0384 9.0384 9.5226 9.5226 10.2888 10.2888 k =-0.0790 0.1843 0.2005 ( 9519 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1230 -47.1230 -47.1133 -47.1133 -19.9999 -19.9999 -19.9972 -19.9972 -19.8439 -19.8439 -19.8430 -19.8430 -19.7743 -19.7743 -19.7637 -19.7637 -19.2278 -19.2278 -19.2091 -19.2091 -19.0802 -19.0802 -19.0695 -19.0695 -18.9217 -18.9217 -18.8931 -18.8931 -11.5508 -11.5508 -11.3383 -11.3383 -11.2719 -11.2719 -0.4477 -0.4477 0.1121 0.1121 0.4098 0.4098 0.5646 0.5646 0.7706 0.7706 0.8833 0.8833 2.7597 2.7597 2.8693 2.8693 3.0129 3.0129 5.6220 5.6220 7.8551 7.8551 8.6718 8.6718 9.0593 9.0593 9.4667 9.4667 10.3466 10.3466 k =-0.0718 0.1675 0.1823 ( 9509 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1231 -47.1231 -47.1132 -47.1132 -19.9998 -19.9998 -19.9971 -19.9971 -19.8438 -19.8438 -19.8430 -19.8430 -19.7742 -19.7742 -19.7637 -19.7637 -19.2281 -19.2281 -19.2089 -19.2089 -19.0805 -19.0805 -19.0695 -19.0695 -18.9213 -18.9213 -18.8922 -18.8922 -11.5563 -11.5563 -11.3388 -11.3388 -11.2733 -11.2733 -0.4485 -0.4485 0.1452 0.1452 0.4195 0.4195 0.5697 0.5697 0.7811 0.7811 0.8793 0.8793 2.7566 2.7566 2.8913 2.8913 3.0164 3.0164 5.5434 5.5434 7.8326 7.8326 8.6112 8.6112 9.0769 9.0769 9.4132 9.4132 10.4091 10.4091 k =-0.0647 0.1508 0.1640 ( 9511 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1232 -47.1232 -47.1131 -47.1131 -19.9997 -19.9997 -19.9971 -19.9971 -19.8437 -19.8437 -19.8429 -19.8429 -19.7742 -19.7742 -19.7637 -19.7637 -19.2283 -19.2283 -19.2088 -19.2088 -19.0807 -19.0807 -19.0694 -19.0694 -18.9209 -18.9209 -18.8914 -18.8914 -11.5614 -11.5614 -11.3392 -11.3392 -11.2747 -11.2747 -0.4495 -0.4495 0.1771 0.1771 0.4257 0.4257 0.5767 0.5767 0.7914 0.7914 0.8755 0.8755 2.7535 2.7535 2.9129 2.9129 3.0197 3.0197 5.4693 5.4693 7.8089 7.8089 8.5570 8.5570 9.0913 9.0913 9.3629 9.3629 10.4750 10.4750 k =-0.0575 0.1340 0.1458 ( 9511 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1233 -47.1233 -47.1130 -47.1130 -19.9997 -19.9997 -19.9971 -19.9971 -19.8437 -19.8437 -19.8429 -19.8429 -19.7741 -19.7741 -19.7637 -19.7637 -19.2286 -19.2286 -19.2087 -19.2087 -19.0809 -19.0809 -19.0694 -19.0694 -18.9206 -18.9206 -18.8906 -18.8906 -11.5660 -11.5660 -11.3397 -11.3397 -11.2760 -11.2760 -0.4506 -0.4506 0.2075 0.2075 0.4287 0.4287 0.5853 0.5853 0.8008 0.8008 0.8723 0.8723 2.7505 2.7505 2.9337 2.9337 3.0229 3.0229 5.4005 5.4005 7.7845 7.7845 8.5095 8.5095 9.1029 9.1029 9.3166 9.3166 10.5430 10.5430 k =-0.0503 0.1173 0.1276 ( 9515 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1234 -47.1234 -47.1129 -47.1129 -19.9997 -19.9997 -19.9970 -19.9970 -19.8436 -19.8436 -19.8428 -19.8428 -19.7740 -19.7740 -19.7637 -19.7637 -19.2288 -19.2288 -19.2086 -19.2086 -19.0810 -19.0810 -19.0693 -19.0693 -18.9203 -18.9203 -18.8900 -18.8900 -11.5701 -11.5701 -11.3401 -11.3401 -11.2771 -11.2771 -0.4518 -0.4518 0.2363 0.2363 0.4290 0.4290 0.5949 0.5949 0.8081 0.8081 0.8708 0.8708 2.7478 2.7478 2.9532 2.9532 3.0260 3.0260 5.3376 5.3376 7.7604 7.7604 8.4688 8.4688 9.1119 9.1119 9.2747 9.2747 10.6117 10.6117 k =-0.0431 0.1005 0.1094 ( 9521 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1235 -47.1235 -47.1129 -47.1129 -19.9996 -19.9996 -19.9970 -19.9970 -19.8436 -19.8436 -19.8428 -19.8428 -19.7740 -19.7740 -19.7638 -19.7638 -19.2289 -19.2289 -19.2086 -19.2086 -19.0812 -19.0812 -19.0693 -19.0693 -18.9200 -18.9200 -18.8894 -18.8894 -11.5737 -11.5737 -11.3405 -11.3405 -11.2782 -11.2782 -0.4530 -0.4530 0.2632 0.2632 0.4270 0.4270 0.6048 0.6048 0.8121 0.8121 0.8718 0.8718 2.7452 2.7452 2.9709 2.9709 3.0291 3.0291 5.2813 5.2813 7.7373 7.7373 8.4345 8.4345 9.1188 9.1188 9.2379 9.2379 10.6795 10.6795 k =-0.0359 0.0838 0.0911 ( 9513 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1235 -47.1235 -47.1128 -47.1128 -19.9996 -19.9996 -19.9969 -19.9969 -19.8435 -19.8435 -19.8427 -19.8427 -19.7739 -19.7739 -19.7638 -19.7638 -19.2291 -19.2291 -19.2085 -19.2085 -19.0813 -19.0813 -19.0693 -19.0693 -18.9198 -18.9198 -18.8889 -18.8889 -11.5768 -11.5768 -11.3408 -11.3408 -11.2791 -11.2791 -0.4540 -0.4540 0.2879 0.2879 0.4231 0.4231 0.6146 0.6146 0.8126 0.8126 0.8754 0.8754 2.7430 2.7430 2.9863 2.9863 3.0322 3.0322 5.2321 5.2321 7.7160 7.7160 8.4064 8.4064 9.1238 9.1238 9.2065 9.2065 10.7445 10.7445 k =-0.0287 0.0670 0.0729 ( 9505 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1128 -47.1128 -19.9996 -19.9996 -19.9969 -19.9969 -19.8435 -19.8435 -19.8427 -19.8427 -19.7739 -19.7739 -19.7638 -19.7638 -19.2292 -19.2292 -19.2084 -19.2084 -19.0814 -19.0814 -19.0693 -19.0693 -18.9196 -18.9196 -18.8884 -18.8884 -11.5793 -11.5793 -11.3411 -11.3411 -11.2798 -11.2798 -0.4550 -0.4550 0.3105 0.3105 0.4176 0.4176 0.6237 0.6237 0.8105 0.8105 0.8805 0.8805 2.7411 2.7411 2.9988 2.9988 3.0357 3.0357 5.1909 5.1909 7.6973 7.6973 8.3840 8.3840 9.1267 9.1267 9.1812 9.1812 10.8043 10.8043 k =-0.0216 0.0503 0.0547 ( 9497 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8435 -19.8435 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2293 -19.2293 -19.2084 -19.2084 -19.0814 -19.0814 -19.0692 -19.0692 -18.9194 -18.9194 -18.8881 -18.8881 -11.5813 -11.5813 -11.3413 -11.3413 -11.2804 -11.2804 -0.4558 -0.4558 0.3308 0.3308 0.4105 0.4105 0.6317 0.6317 0.8071 0.8071 0.8858 0.8858 2.7395 2.7395 3.0079 3.0079 3.0395 3.0395 5.1581 5.1581 7.6821 7.6821 8.3670 8.3670 9.1273 9.1273 9.1628 9.1628 10.8561 10.8561 k =-0.0144 0.0335 0.0365 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1236 -47.1236 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7637 -19.7637 -19.2293 -19.2293 -19.2084 -19.2084 -19.0815 -19.0815 -19.0692 -19.0692 -18.9193 -18.9193 -18.8878 -18.8878 -11.5828 -11.5828 -11.3415 -11.3415 -11.2808 -11.2808 -0.4563 -0.4563 0.3488 0.3488 0.4020 0.4020 0.6380 0.6380 0.8037 0.8037 0.8903 0.8903 2.7384 2.7384 3.0138 3.0138 3.0431 3.0431 5.1342 5.1342 7.6707 7.6707 8.3552 8.3552 9.1250 9.1250 9.1521 9.1521 10.8967 10.8967 k =-0.0072 0.0168 0.0182 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2293 -19.2293 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5836 -11.5836 -11.3416 -11.3416 -11.2811 -11.2811 -0.4567 -0.4567 0.3644 0.3644 0.3921 0.3921 0.6420 0.6420 0.8012 0.8012 0.8932 0.8932 2.7377 2.7377 3.0168 3.0168 3.0459 3.0459 5.1198 5.1198 7.6637 7.6637 8.3481 8.3481 9.1213 9.1213 9.1479 9.1479 10.9228 10.9228 k = 0.0000 0.0000 0.0000 ( 9485 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9994 -19.9994 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7737 -19.7737 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8876 -18.8876 -11.5839 -11.5839 -11.3416 -11.3416 -11.2812 -11.2812 -0.4568 -0.4568 0.3743 0.3743 0.3841 0.3841 0.6434 0.6434 0.8004 0.8004 0.8942 0.8942 2.7375 2.7375 3.0178 3.0178 3.0469 3.0469 5.1149 5.1149 7.6614 7.6614 8.3458 8.3458 9.1197 9.1197 9.1469 9.1469 10.9318 10.9318 k = 0.0000 0.0000 0.0000 ( 9485 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9994 -19.9994 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7737 -19.7737 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8876 -18.8876 -11.5839 -11.5839 -11.3416 -11.3416 -11.2812 -11.2812 -0.4568 -0.4568 0.3743 0.3743 0.3841 0.3841 0.6434 0.6434 0.8004 0.8004 0.8942 0.8942 2.7375 2.7375 3.0178 3.0178 3.0469 3.0469 5.1149 5.1149 7.6614 7.6614 8.3458 8.3458 9.1197 9.1197 9.1469 9.1469 10.9318 10.9318 k = 0.0227 0.0097 0.0000 ( 9493 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8434 -19.8434 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5836 -11.5836 -11.3422 -11.3422 -11.2809 -11.2809 -0.4558 -0.4558 0.3694 0.3694 0.3884 0.3884 0.6430 0.6430 0.7998 0.7998 0.8947 0.8947 2.7362 2.7362 3.0177 3.0177 3.0467 3.0467 5.1193 5.1193 7.6581 7.6581 8.3436 8.3436 9.1232 9.1232 9.1406 9.1406 10.9362 10.9362 k = 0.0455 0.0195 0.0000 ( 9505 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9969 -19.9969 -19.8435 -19.8435 -19.8426 -19.8426 -19.7738 -19.7738 -19.7638 -19.7638 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5829 -11.5829 -11.3437 -11.3437 -11.2802 -11.2802 -0.4527 -0.4527 0.3612 0.3612 0.3950 0.3950 0.6417 0.6417 0.7982 0.7982 0.8963 0.8963 2.7322 2.7322 3.0173 3.0173 3.0464 3.0464 5.1323 5.1323 7.6485 7.6485 8.3372 8.3372 9.1219 9.1219 9.1335 9.1335 10.9494 10.9494 k = 0.0682 0.0292 0.0000 ( 9489 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8435 -19.8435 -19.8425 -19.8425 -19.7737 -19.7737 -19.7638 -19.7638 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8876 -18.8876 -11.5815 -11.5815 -11.3463 -11.3463 -11.2791 -11.2791 -0.4475 -0.4475 0.3520 0.3520 0.4012 0.4012 0.6396 0.6396 0.7956 0.7956 0.8989 0.8989 2.7258 2.7258 3.0168 3.0168 3.0458 3.0458 5.1537 5.1537 7.6327 7.6327 8.3269 8.3269 9.0915 9.0915 9.1502 9.1502 10.9713 10.9713 k = 0.0909 0.0390 0.0000 ( 9497 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9968 -19.9968 -19.8436 -19.8436 -19.8424 -19.8424 -19.7737 -19.7737 -19.7639 -19.7639 -19.2294 -19.2294 -19.2084 -19.2084 -19.0815 -19.0815 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5797 -11.5797 -11.3496 -11.3496 -11.2776 -11.2776 -0.4403 -0.4403 0.3424 0.3424 0.4068 0.4068 0.6368 0.6368 0.7921 0.7921 0.9024 0.9024 2.7172 2.7172 3.0160 3.0160 3.0451 3.0451 5.1833 5.1833 7.6109 7.6109 8.3133 8.3133 9.0504 9.0504 9.1726 9.1726 11.0014 11.0014 k = 0.1136 0.0487 0.0000 ( 9501 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9969 -19.9969 -19.8437 -19.8437 -19.8423 -19.8423 -19.7735 -19.7735 -19.7640 -19.7640 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5774 -11.5774 -11.3538 -11.3538 -11.2760 -11.2760 -0.4311 -0.4311 0.3322 0.3322 0.4115 0.4115 0.6334 0.6334 0.7878 0.7878 0.9067 0.9067 2.7067 2.7067 3.0151 3.0151 3.0441 3.0441 5.2207 5.2207 7.5837 7.5837 8.2973 8.2973 8.9999 8.9999 9.1998 9.1998 11.0393 11.0393 k = 0.1364 0.0585 0.0000 ( 9509 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9995 -19.9995 -19.9969 -19.9969 -19.8438 -19.8438 -19.8422 -19.8422 -19.7734 -19.7734 -19.7642 -19.7642 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5745 -11.5745 -11.3585 -11.3585 -11.2742 -11.2742 -0.4199 -0.4199 0.3216 0.3216 0.4152 0.4152 0.6295 0.6295 0.7828 0.7828 0.9116 0.9116 2.6947 2.6947 3.0140 3.0140 3.0429 3.0429 5.2653 5.2653 7.5514 7.5514 8.2793 8.2793 8.9414 8.9414 9.2310 9.2310 11.0837 11.0837 k = 0.1591 0.0682 0.0000 ( 9501 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9994 -19.9994 -19.9969 -19.9969 -19.8438 -19.8438 -19.8422 -19.8422 -19.7733 -19.7733 -19.7643 -19.7643 -19.2294 -19.2294 -19.2084 -19.2084 -19.0815 -19.0815 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5712 -11.5712 -11.3638 -11.3638 -11.2724 -11.2724 -0.4069 -0.4069 0.3105 0.3105 0.4178 0.4178 0.6253 0.6253 0.7773 0.7773 0.9170 0.9170 2.6815 2.6815 3.0128 3.0128 3.0417 3.0417 5.3166 5.3166 7.5146 7.5146 8.2602 8.2602 8.8765 8.8765 9.2654 9.2654 11.1220 11.1220 k = 0.1818 0.0780 0.0000 ( 9493 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9993 -19.9993 -19.9970 -19.9970 -19.8439 -19.8439 -19.8421 -19.8421 -19.7730 -19.7730 -19.7644 -19.7644 -19.2294 -19.2294 -19.2083 -19.2083 -19.0815 -19.0815 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5674 -11.5674 -11.3696 -11.3696 -11.2706 -11.2706 -0.3920 -0.3920 0.2989 0.2989 0.4192 0.4192 0.6208 0.6208 0.7715 0.7715 0.9227 0.9227 2.6677 2.6677 3.0115 3.0115 3.0402 3.0402 5.3740 5.3740 7.4735 7.4735 8.2405 8.2405 8.8068 8.8068 9.3022 9.3022 11.0989 11.0990 k = 0.2045 0.0877 0.0000 ( 9501 PWs) bands (ev): -47.9379 -47.9379 -47.9377 -47.9377 -47.1237 -47.1237 -47.1127 -47.1127 -19.9993 -19.9993 -19.9970 -19.9970 -19.8440 -19.8440 -19.8421 -19.8421 -19.7729 -19.7729 -19.7646 -19.7646 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5631 -11.5631 -11.3758 -11.3758 -11.2689 -11.2689 -0.3754 -0.3754 0.2867 0.2867 0.4194 0.4194 0.6162 0.6162 0.7657 0.7657 0.9287 0.9287 2.6536 2.6536 3.0101 3.0101 3.0387 3.0387 5.4370 5.4370 7.4287 7.4287 8.2207 8.2207 8.7338 8.7338 9.3405 9.3405 11.0657 11.0657 k = 0.2273 0.0975 0.0000 ( 9521 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9993 -19.9993 -19.9970 -19.9970 -19.8441 -19.8441 -19.8420 -19.8420 -19.7728 -19.7728 -19.7648 -19.7648 -19.2295 -19.2295 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8877 -18.8877 -11.5584 -11.5584 -11.3824 -11.3824 -11.2673 -11.2673 -0.3572 -0.3572 0.2737 0.2737 0.4184 0.4184 0.6115 0.6115 0.7600 0.7600 0.9347 0.9347 2.6395 2.6395 3.0087 3.0087 3.0371 3.0371 5.5050 5.5050 7.3804 7.3804 8.2012 8.2012 8.6591 8.6591 9.3798 9.3798 11.0328 11.0328 k = 0.2500 0.1072 0.0000 ( 9521 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9993 -19.9993 -19.9971 -19.9971 -19.8442 -19.8442 -19.8419 -19.8419 -19.7726 -19.7726 -19.7650 -19.7650 -19.2295 -19.2295 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8877 -18.8877 -11.5533 -11.5533 -11.3892 -11.3892 -11.2657 -11.2657 -0.3375 -0.3375 0.2600 0.2600 0.4163 0.4163 0.6069 0.6069 0.7546 0.7546 0.9407 0.9407 2.6257 2.6257 3.0073 3.0073 3.0355 3.0355 5.5773 5.5773 7.3288 7.3288 8.1824 8.1824 8.5841 8.5841 9.4192 9.4192 11.0014 11.0014 k = 0.2727 0.1170 0.0000 ( 9509 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9992 -19.9992 -19.9971 -19.9971 -19.8442 -19.8442 -19.8418 -19.8418 -19.7724 -19.7724 -19.7652 -19.7652 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8876 -18.8876 -11.5477 -11.5477 -11.3964 -11.3964 -11.2643 -11.2643 -0.3165 -0.3165 0.2453 0.2453 0.4132 0.4132 0.6025 0.6025 0.7497 0.7497 0.9466 0.9466 2.6126 2.6126 3.0060 3.0060 3.0338 3.0338 5.6536 5.6536 7.2741 7.2741 8.1645 8.1645 8.5103 8.5103 9.4582 9.4582 10.9718 10.9718 k = 0.2955 0.1267 0.0000 ( 9505 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9992 -19.9992 -19.9971 -19.9971 -19.8443 -19.8443 -19.8417 -19.8417 -19.7721 -19.7721 -19.7654 -19.7654 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8876 -18.8876 -11.5418 -11.5418 -11.4038 -11.4038 -11.2631 -11.2631 -0.2942 -0.2942 0.2296 0.2296 0.4092 0.4092 0.5983 0.5983 0.7453 0.7453 0.9522 0.9522 2.6003 2.6003 3.0046 3.0046 3.0322 3.0322 5.7330 5.7330 7.2163 7.2163 8.1477 8.1477 8.4391 8.4391 9.4961 9.4961 10.9445 10.9445 k = 0.3182 0.1365 0.0000 ( 9493 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9991 -19.9991 -19.9971 -19.9971 -19.8443 -19.8443 -19.8417 -19.8417 -19.7719 -19.7719 -19.7656 -19.7656 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8876 -18.8876 -11.5356 -11.5356 -11.4114 -11.4114 -11.2619 -11.2619 -0.2711 -0.2711 0.2129 0.2129 0.4048 0.4048 0.5944 0.5944 0.7416 0.7416 0.9574 0.9574 2.5890 2.5890 3.0033 3.0033 3.0307 3.0307 5.8152 5.8152 7.1555 7.1555 8.1323 8.1323 8.3716 8.3716 9.5322 9.5322 10.9196 10.9196 k = 0.3409 0.1462 0.0000 ( 9493 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9991 -19.9991 -19.9972 -19.9972 -19.8444 -19.8444 -19.8416 -19.8416 -19.7716 -19.7716 -19.7658 -19.7658 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8876 -18.8876 -11.5290 -11.5290 -11.4191 -11.4191 -11.2609 -11.2609 -0.2473 -0.2473 0.1951 0.1951 0.4001 0.4001 0.5909 0.5909 0.7385 0.7385 0.9623 0.9623 2.5788 2.5788 3.0021 3.0021 3.0293 3.0293 5.8994 5.8994 7.0917 7.0917 8.1184 8.1184 8.3092 8.3092 9.5659 9.5659 10.8972 10.8972 k = 0.3636 0.1560 0.0000 ( 9492 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9991 -19.9991 -19.9972 -19.9972 -19.8444 -19.8444 -19.8416 -19.8416 -19.7714 -19.7714 -19.7661 -19.7661 -19.2294 -19.2294 -19.2084 -19.2084 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8876 -18.8876 -11.5222 -11.5222 -11.4270 -11.4270 -11.2600 -11.2600 -0.2233 -0.2233 0.1766 0.1766 0.3954 0.3954 0.5877 0.5877 0.7360 0.7360 0.9666 0.9666 2.5699 2.5699 3.0011 3.0011 3.0279 3.0279 5.9850 5.9850 7.0249 7.0249 8.1062 8.1062 8.2529 8.2529 9.5967 9.5967 10.8776 10.8776 k = 0.3864 0.1657 0.0000 ( 9484 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9972 -19.9972 -19.8444 -19.8444 -19.8415 -19.8415 -19.7711 -19.7711 -19.7663 -19.7663 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0692 -19.0692 -18.9192 -18.9192 -18.8876 -18.8876 -11.5151 -11.5151 -11.4350 -11.4350 -11.2593 -11.2593 -0.1995 -0.1995 0.1575 0.1575 0.3910 0.3910 0.5850 0.5850 0.7340 0.7340 0.9704 0.9704 2.5623 2.5623 3.0001 3.0001 3.0268 3.0268 6.0714 6.0714 6.9554 6.9554 8.0956 8.0956 8.2037 8.2037 9.6239 9.6239 10.8609 10.8609 k = 0.4091 0.1754 0.0000 ( 9496 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9973 -19.9973 -19.8445 -19.8445 -19.8415 -19.8415 -19.7710 -19.7710 -19.7665 -19.7665 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0692 -19.0692 -18.9192 -18.9192 -18.8877 -18.8877 -11.5077 -11.5077 -11.4431 -11.4431 -11.2587 -11.2587 -0.1766 -0.1766 0.1387 0.1387 0.3872 0.3872 0.5827 0.5827 0.7326 0.7326 0.9735 0.9735 2.5561 2.5561 2.9993 2.9993 3.0258 3.0258 6.1574 6.1574 6.8838 6.8838 8.0869 8.0869 8.1624 8.1624 9.6469 9.6469 10.8470 10.8470 k = 0.4318 0.1852 0.0000 ( 9504 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9973 -19.9973 -19.8445 -19.8445 -19.8415 -19.8415 -19.7708 -19.7708 -19.7667 -19.7667 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.5003 -11.5003 -11.4512 -11.4512 -11.2582 -11.2582 -0.1558 -0.1558 0.1210 0.1210 0.3840 0.3840 0.5809 0.5809 0.7315 0.7315 0.9761 0.9761 2.5512 2.5512 2.9987 2.9987 3.0250 3.0250 6.2416 6.2416 6.8111 6.8111 8.0801 8.0801 8.1296 8.1296 9.6654 9.6654 10.8362 10.8362 k = 0.4545 0.1949 0.0000 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9973 -19.9973 -19.8445 -19.8445 -19.8415 -19.8415 -19.7707 -19.7707 -19.7669 -19.7669 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.4927 -11.4927 -11.4591 -11.4591 -11.2579 -11.2579 -0.1385 -0.1385 0.1059 0.1059 0.3817 0.3817 0.5796 0.5796 0.7308 0.7308 0.9779 0.9779 2.5477 2.5477 2.9982 2.9982 3.0244 3.0244 6.3208 6.3208 6.7403 6.7403 8.0752 8.0752 8.1059 8.1059 9.6790 9.6790 10.8285 10.8285 k = 0.4773 0.2047 0.0000 ( 9508 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9989 -19.9989 -19.9973 -19.9973 -19.8446 -19.8446 -19.8415 -19.8415 -19.7706 -19.7706 -19.7669 -19.7669 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.4854 -11.4854 -11.4667 -11.4667 -11.2577 -11.2577 -0.1268 -0.1268 0.0955 0.0955 0.3803 0.3803 0.5788 0.5788 0.7304 0.7304 0.9790 0.9790 2.5456 2.5456 2.9979 2.9979 3.0240 3.0240 6.3868 6.3868 6.6794 6.6794 8.0722 8.0722 8.0916 8.0916 9.6872 9.6872 10.8238 10.8238 k = 0.5000 0.2144 0.0000 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8414 -19.8414 -19.7706 -19.7706 -19.7670 -19.7670 -19.2295 -19.2295 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.4808 -11.4808 -11.4714 -11.4714 -11.2576 -11.2576 -0.1226 -0.1226 0.0917 0.0917 0.3798 0.3798 0.5785 0.5785 0.7303 0.7303 0.9793 0.9793 2.5449 2.5449 2.9978 2.9978 3.0239 3.0239 6.4165 6.4165 6.6515 6.6515 8.0712 8.0712 8.0867 8.0867 9.6900 9.6900 10.8222 10.8222 k = 0.5000 0.2144 0.0000 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8414 -19.8414 -19.7706 -19.7706 -19.7670 -19.7670 -19.2295 -19.2295 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.4808 -11.4808 -11.4714 -11.4714 -11.2576 -11.2576 -0.1226 -0.1226 0.0917 0.0917 0.3798 0.3798 0.5785 0.5785 0.7303 0.7303 0.9793 0.9793 2.5449 2.5449 2.9978 2.9978 3.0239 3.0239 6.4165 6.4165 6.6515 6.6515 8.0712 8.0712 8.0867 8.0867 9.6900 9.6900 10.8222 10.8222 k = 0.4929 0.2310 0.0180 ( 9508 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9989 -19.9989 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7706 -19.7706 -19.7669 -19.7669 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8877 -18.8877 -11.4805 -11.4805 -11.4712 -11.4712 -11.2576 -11.2576 -0.1226 -0.1226 0.0906 0.0906 0.3798 0.3798 0.5780 0.5780 0.7294 0.7294 0.9780 0.9780 2.5463 2.5463 2.9974 2.9974 3.0235 3.0235 6.4186 6.4186 6.6538 6.6538 8.0739 8.0739 8.0877 8.0877 9.6913 9.6913 10.8187 10.8187 k = 0.4858 0.2475 0.0360 ( 9510 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1127 -47.1127 -19.9989 -19.9989 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7706 -19.7706 -19.7669 -19.7669 -19.2294 -19.2294 -19.2086 -19.2086 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8878 -18.8878 -11.4798 -11.4798 -11.4707 -11.4707 -11.2576 -11.2576 -0.1227 -0.1227 0.0874 0.0874 0.3798 0.3798 0.5762 0.5762 0.7267 0.7267 0.9742 0.9742 2.5503 2.5503 2.9962 2.9962 3.0224 3.0224 6.4249 6.4249 6.6607 6.6607 8.0816 8.0816 8.0909 8.0909 9.6951 9.6951 10.8058 10.8058 k = 0.4787 0.2641 0.0540 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1127 -47.1127 -19.9989 -19.9989 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7707 -19.7707 -19.7669 -19.7669 -19.2293 -19.2293 -19.2086 -19.2086 -19.0816 -19.0816 -19.0693 -19.0693 -18.9194 -18.9194 -18.8881 -18.8881 -11.4786 -11.4786 -11.4699 -11.4699 -11.2576 -11.2576 -0.1228 -0.1228 0.0821 0.0821 0.3797 0.3797 0.5735 0.5735 0.7221 0.7221 0.9681 0.9681 2.5569 2.5569 2.9940 2.9940 3.0205 3.0205 6.4354 6.4354 6.6721 6.6721 8.0926 8.0926 8.0980 8.0980 9.7016 9.7016 10.7839 10.7839 k = 0.4716 0.2806 0.0720 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1128 -47.1128 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7707 -19.7707 -19.7669 -19.7669 -19.2292 -19.2292 -19.2086 -19.2086 -19.0815 -19.0815 -19.0694 -19.0694 -18.9196 -18.9196 -18.8884 -18.8884 -11.4770 -11.4770 -11.4689 -11.4689 -11.2576 -11.2576 -0.1232 -0.1232 0.0747 0.0747 0.3795 0.3795 0.5697 0.5697 0.7156 0.7156 0.9602 0.9602 2.5659 2.5659 2.9908 2.9908 3.0183 3.0183 6.4500 6.4500 6.6877 6.6877 8.1007 8.1007 8.1153 8.1153 9.7106 9.7106 10.7546 10.7546 k = 0.4645 0.2971 0.0900 ( 9498 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1235 -47.1235 -47.1128 -47.1128 -19.9989 -19.9989 -19.9975 -19.9975 -19.8446 -19.8446 -19.8416 -19.8416 -19.7708 -19.7708 -19.7668 -19.7668 -19.2291 -19.2291 -19.2087 -19.2087 -19.0814 -19.0814 -19.0693 -19.0693 -18.9197 -18.9197 -18.8888 -18.8888 -11.4748 -11.4748 -11.4675 -11.4675 -11.2576 -11.2576 -0.1238 -0.1238 0.0652 0.0652 0.3792 0.3792 0.5652 0.5652 0.7069 0.7069 0.9510 0.9510 2.5769 2.5769 2.9863 2.9863 3.0159 3.0159 6.4685 6.4685 6.7071 6.7071 8.1094 8.1094 8.1393 8.1393 9.7221 9.7221 10.7191 10.7191 k = 0.4574 0.3137 0.1080 ( 9494 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1235 -47.1235 -47.1129 -47.1129 -19.9989 -19.9989 -19.9975 -19.9975 -19.8446 -19.8446 -19.8416 -19.8416 -19.7708 -19.7708 -19.7668 -19.7668 -19.2289 -19.2289 -19.2087 -19.2087 -19.0812 -19.0812 -19.0693 -19.0693 -18.9199 -18.9199 -18.8893 -18.8893 -11.4723 -11.4723 -11.4658 -11.4658 -11.2576 -11.2576 -0.1248 -0.1248 0.0537 0.0537 0.3785 0.3785 0.5601 0.5601 0.6962 0.6962 0.9411 0.9411 2.5896 2.5896 2.9804 2.9804 3.0134 3.0134 6.4906 6.4906 6.7300 6.7300 8.1198 8.1198 8.1688 8.1688 9.7362 9.7362 10.6787 10.6787 k = 0.4503 0.3302 0.1260 ( 9496 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1234 -47.1234 -47.1129 -47.1129 -19.9989 -19.9989 -19.9976 -19.9976 -19.8446 -19.8446 -19.8417 -19.8417 -19.7710 -19.7710 -19.7668 -19.7668 -19.2288 -19.2288 -19.2088 -19.2088 -19.0811 -19.0811 -19.0694 -19.0694 -18.9202 -18.9202 -18.8899 -18.8899 -11.4693 -11.4693 -11.4638 -11.4638 -11.2576 -11.2576 -0.1263 -0.1263 0.0402 0.0402 0.3775 0.3775 0.5544 0.5544 0.6836 0.6836 0.9312 0.9312 2.6038 2.6038 2.9731 2.9731 3.0109 3.0109 6.5163 6.5163 6.7559 6.7559 8.1321 8.1321 8.2037 8.2037 9.7526 9.7526 10.6348 10.6348 k = 0.4432 0.3468 0.1440 ( 9490 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1233 -47.1233 -47.1130 -47.1130 -19.9989 -19.9989 -19.9977 -19.9977 -19.8446 -19.8446 -19.8418 -19.8418 -19.7711 -19.7711 -19.7667 -19.7667 -19.2286 -19.2286 -19.2089 -19.2089 -19.0809 -19.0809 -19.0694 -19.0694 -18.9205 -18.9205 -18.8905 -18.8905 -11.4659 -11.4659 -11.4616 -11.4616 -11.2576 -11.2576 -0.1286 -0.1286 0.0250 0.0250 0.3761 0.3761 0.5480 0.5480 0.6696 0.6696 0.9215 0.9215 2.6190 2.6190 2.9645 2.9645 3.0085 3.0085 6.5453 6.5453 6.7842 6.7842 8.1463 8.1463 8.2439 8.2439 9.7715 9.7715 10.5884 10.5884 k = 0.4362 0.3633 0.1620 ( 9492 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1232 -47.1232 -47.1131 -47.1131 -19.9989 -19.9989 -19.9978 -19.9978 -19.8446 -19.8446 -19.8419 -19.8419 -19.7712 -19.7712 -19.7666 -19.7666 -19.2283 -19.2283 -19.2089 -19.2089 -19.0807 -19.0807 -19.0695 -19.0695 -18.9208 -18.9208 -18.8912 -18.8912 -11.4621 -11.4621 -11.4590 -11.4590 -11.2577 -11.2577 -0.1318 -0.1318 0.0082 0.0082 0.3741 0.3741 0.5408 0.5408 0.6549 0.6549 0.9125 0.9125 2.6349 2.6349 2.9546 2.9546 3.0062 3.0062 6.5772 6.5772 6.8144 6.8144 8.1624 8.1624 8.2892 8.2892 9.7927 9.7927 10.5407 10.5407 k = 0.4291 0.3798 0.1800 ( 9503 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1231 -47.1231 -47.1132 -47.1132 -19.9990 -19.9990 -19.9979 -19.9979 -19.8446 -19.8446 -19.8420 -19.8420 -19.7714 -19.7714 -19.7666 -19.7666 -19.2281 -19.2281 -19.2091 -19.2091 -19.0805 -19.0805 -19.0695 -19.0695 -18.9212 -18.9212 -18.8920 -18.8920 -11.4580 -11.4580 -11.4563 -11.4563 -11.2578 -11.2578 -0.1364 -0.1364 -0.0099 -0.0099 0.3716 0.3716 0.5323 0.5323 0.6405 0.6405 0.9043 0.9043 2.6512 2.6512 2.9437 2.9437 3.0038 3.0038 6.6118 6.6118 6.8460 6.8460 8.1806 8.1806 8.3393 8.3393 9.8160 9.8160 10.4925 10.4925 k = 0.4220 0.3964 0.1980 ( 9501 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1230 -47.1230 -47.1133 -47.1133 -19.9990 -19.9990 -19.9980 -19.9980 -19.8447 -19.8447 -19.8421 -19.8421 -19.7715 -19.7715 -19.7665 -19.7665 -19.2279 -19.2279 -19.2091 -19.2091 -19.0803 -19.0803 -19.0696 -19.0696 -18.9216 -18.9216 -18.8929 -18.8929 -11.4535 -11.4535 -11.4533 -11.4533 -11.2579 -11.2579 -0.1427 -0.1427 -0.0291 -0.0291 0.3686 0.3686 0.5220 0.5220 0.6279 0.6279 0.8968 0.8968 2.6676 2.6676 2.9318 2.9318 3.0014 3.0014 6.6487 6.6487 6.8784 6.8784 8.2007 8.2007 8.3941 8.3941 9.8412 9.8412 10.4446 10.4446 k = 0.4149 0.4129 0.2160 ( 9507 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1229 -47.1229 -47.1134 -47.1134 -19.9990 -19.9990 -19.9981 -19.9981 -19.8447 -19.8447 -19.8423 -19.8423 -19.7717 -19.7717 -19.7664 -19.7664 -19.2276 -19.2276 -19.2093 -19.2093 -19.0801 -19.0801 -19.0696 -19.0696 -18.9220 -18.9220 -18.8938 -18.8938 -11.4501 -11.4501 -11.4488 -11.4488 -11.2581 -11.2581 -0.1510 -0.1510 -0.0489 -0.0489 0.3649 0.3649 0.5093 0.5093 0.6181 0.6181 0.8901 0.8901 2.6839 2.6839 2.9191 2.9191 2.9990 2.9990 6.6878 6.6878 6.9111 6.9111 8.2230 8.2230 8.4529 8.4529 9.8683 9.8683 10.3976 10.3976 k = 0.4078 0.4295 0.2340 ( 9511 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1227 -47.1227 -47.1136 -47.1136 -19.9990 -19.9990 -19.9982 -19.9982 -19.8447 -19.8447 -19.8424 -19.8424 -19.7718 -19.7718 -19.7663 -19.7663 -19.2273 -19.2273 -19.2094 -19.2094 -19.0798 -19.0798 -19.0697 -19.0697 -18.9225 -18.9225 -18.8947 -18.8947 -11.4466 -11.4466 -11.4438 -11.4438 -11.2584 -11.2584 -0.1618 -0.1618 -0.0689 -0.0689 0.3608 0.3608 0.4946 0.4946 0.6118 0.6118 0.8841 0.8841 2.6998 2.6998 2.9057 2.9057 2.9964 2.9964 6.7285 6.7285 6.9437 6.9437 8.2474 8.2474 8.5153 8.5153 9.8969 9.8969 10.3519 10.3519 k = 0.4007 0.4460 0.2520 ( 9505 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1226 -47.1226 -47.1137 -47.1137 -19.9990 -19.9990 -19.9983 -19.9983 -19.8447 -19.8447 -19.8425 -19.8425 -19.7720 -19.7720 -19.7663 -19.7663 -19.2270 -19.2270 -19.2096 -19.2096 -19.0796 -19.0796 -19.0698 -19.0698 -18.9229 -18.9229 -18.8956 -18.8956 -11.4430 -11.4430 -11.4386 -11.4386 -11.2588 -11.2588 -0.1755 -0.1755 -0.0889 -0.0889 0.3562 0.3562 0.4785 0.4785 0.6088 0.6088 0.8785 0.8785 2.7152 2.7152 2.8918 2.8918 2.9939 2.9939 6.7707 6.7707 6.9757 6.9757 8.2741 8.2741 8.5804 8.5804 9.9267 9.9267 10.3081 10.3081 k = 0.3936 0.4626 0.2700 ( 9513 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1224 -47.1224 -47.1139 -47.1139 -19.9990 -19.9990 -19.9984 -19.9984 -19.8448 -19.8448 -19.8426 -19.8426 -19.7722 -19.7722 -19.7662 -19.7662 -19.2266 -19.2266 -19.2098 -19.2098 -19.0793 -19.0793 -19.0699 -19.0699 -18.9234 -18.9234 -18.8966 -18.8966 -11.4392 -11.4392 -11.4332 -11.4332 -11.2592 -11.2592 -0.1920 -0.1920 -0.1085 -0.1085 0.3511 0.3511 0.4620 0.4620 0.6086 0.6086 0.8734 0.8734 2.7300 2.7300 2.8773 2.8773 2.9912 2.9912 6.8140 6.8140 7.0069 7.0069 8.3029 8.3029 8.6473 8.6473 9.9573 9.9573 10.2664 10.2664 k = 0.3865 0.4791 0.2880 ( 9517 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1223 -47.1223 -47.1140 -47.1140 -19.9990 -19.9990 -19.9986 -19.9986 -19.8448 -19.8448 -19.8428 -19.8428 -19.7724 -19.7724 -19.7661 -19.7661 -19.2263 -19.2263 -19.2100 -19.2100 -19.0790 -19.0790 -19.0699 -19.0699 -18.9240 -18.9240 -18.8976 -18.8976 -11.4353 -11.4353 -11.4277 -11.4277 -11.2597 -11.2597 -0.2113 -0.2113 -0.1279 -0.1279 0.3455 0.3455 0.4465 0.4465 0.6107 0.6107 0.8685 0.8685 2.7439 2.7439 2.8624 2.8624 2.9884 2.9884 6.8582 6.8582 7.0370 7.0370 8.3341 8.3341 8.7149 8.7149 9.9882 9.9882 10.2272 10.2272 k = 0.3794 0.4956 0.3060 ( 9517 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1221 -47.1221 -47.1142 -47.1142 -19.9990 -19.9990 -19.9987 -19.9987 -19.8448 -19.8448 -19.8429 -19.8429 -19.7725 -19.7725 -19.7661 -19.7661 -19.2259 -19.2259 -19.2102 -19.2102 -19.0787 -19.0787 -19.0700 -19.0700 -18.9245 -18.9245 -18.8986 -18.8986 -11.4312 -11.4312 -11.4221 -11.4221 -11.2603 -11.2603 -0.2327 -0.2327 -0.1474 -0.1474 0.3392 0.3392 0.4327 0.4327 0.6146 0.6146 0.8639 0.8639 2.7570 2.7570 2.8473 2.8473 2.9857 2.9857 6.9029 6.9029 7.0659 7.0659 8.3676 8.3676 8.7816 8.7816 10.0187 10.0187 10.1911 10.1911 k = 0.3723 0.5122 0.3240 ( 9521 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1220 -47.1220 -47.1144 -47.1144 -19.9991 -19.9991 -19.9988 -19.9988 -19.8448 -19.8448 -19.8431 -19.8431 -19.7727 -19.7727 -19.7660 -19.7660 -19.2255 -19.2255 -19.2104 -19.2104 -19.0784 -19.0784 -19.0701 -19.0701 -18.9250 -18.9250 -18.8996 -18.8996 -11.4271 -11.4271 -11.4165 -11.4165 -11.2610 -11.2610 -0.2556 -0.2556 -0.1672 -0.1672 0.3321 0.3321 0.4214 0.4214 0.6200 0.6200 0.8594 0.8594 2.7690 2.7690 2.8319 2.8319 2.9828 2.9828 6.9479 6.9479 7.0935 7.0935 8.4034 8.4034 8.8459 8.8459 10.0479 10.0479 10.1592 10.1592 k = 0.3652 0.5287 0.3420 ( 9521 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1218 -47.1218 -47.1145 -47.1145 -19.9991 -19.9991 -19.9990 -19.9990 -19.8449 -19.8449 -19.8432 -19.8432 -19.7729 -19.7729 -19.7659 -19.7659 -19.2250 -19.2250 -19.2106 -19.2106 -19.0781 -19.0781 -19.0702 -19.0702 -18.9256 -18.9256 -18.9006 -18.9006 -11.4228 -11.4228 -11.4109 -11.4109 -11.2617 -11.2617 -0.2794 -0.2794 -0.1876 -0.1876 0.3240 0.3240 0.4131 0.4131 0.6265 0.6265 0.8549 0.8549 2.7801 2.7801 2.8165 2.8165 2.9799 2.9799 6.9931 6.9931 7.1197 7.1197 8.4415 8.4415 8.9058 8.9058 10.0730 10.0730 10.1343 10.1343 k = 0.3581 0.5453 0.3600 ( 9513 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1216 -47.1216 -47.1147 -47.1147 -19.9991 -19.9991 -19.9991 -19.9991 -19.8449 -19.8449 -19.8433 -19.8433 -19.7731 -19.7731 -19.7657 -19.7657 -19.2246 -19.2246 -19.2109 -19.2109 -19.0778 -19.0778 -19.0703 -19.0703 -18.9261 -18.9261 -18.9016 -18.9016 -11.4185 -11.4185 -11.4054 -11.4054 -11.2625 -11.2625 -0.3035 -0.3035 -0.2086 -0.2086 0.3149 0.3149 0.4080 0.4080 0.6340 0.6340 0.8505 0.8505 2.7899 2.7899 2.8013 2.8013 2.9771 2.9771 7.0381 7.0381 7.1446 7.1446 8.4819 8.4819 8.9592 8.9592 10.0825 10.0825 10.1279 10.1279 k = 0.3510 0.5618 0.3780 ( 9515 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1214 -47.1214 -47.1149 -47.1149 -19.9992 -19.9992 -19.9990 -19.9990 -19.8449 -19.8449 -19.8435 -19.8435 -19.7733 -19.7733 -19.7656 -19.7656 -19.2241 -19.2241 -19.2112 -19.2112 -19.0774 -19.0774 -19.0704 -19.0704 -18.9267 -18.9267 -18.9025 -18.9025 -11.4141 -11.4141 -11.4001 -11.4001 -11.2634 -11.2634 -0.3276 -0.3276 -0.2302 -0.2302 0.3051 0.3051 0.4058 0.4058 0.6423 0.6423 0.8460 0.8460 2.7851 2.7851 2.7997 2.7997 2.9742 2.9742 7.0829 7.0829 7.1684 7.1684 8.5245 8.5245 9.0036 9.0036 10.0731 10.0731 10.1441 10.1441 k = 0.3439 0.5783 0.3960 ( 9513 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1212 -47.1212 -47.1151 -47.1151 -19.9993 -19.9993 -19.9991 -19.9991 -19.8449 -19.8449 -19.8436 -19.8436 -19.7735 -19.7735 -19.7656 -19.7656 -19.2236 -19.2236 -19.2115 -19.2115 -19.0771 -19.0771 -19.0705 -19.0705 -18.9272 -18.9272 -18.9034 -18.9034 -11.4097 -11.4097 -11.3950 -11.3950 -11.2643 -11.2643 -0.3512 -0.3512 -0.2520 -0.2520 0.2949 0.2949 0.4062 0.4062 0.6512 0.6512 0.8414 0.8414 2.7700 2.7700 2.8076 2.8076 2.9713 2.9713 7.1272 7.1272 7.1911 7.1911 8.5692 8.5692 9.0370 9.0370 10.0634 10.0634 10.1645 10.1645 k = 0.3368 0.5949 0.4140 ( 9529 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1210 -47.1210 -47.1153 -47.1153 -19.9995 -19.9995 -19.9991 -19.9991 -19.8450 -19.8450 -19.8437 -19.8437 -19.7737 -19.7737 -19.7655 -19.7655 -19.2232 -19.2232 -19.2118 -19.2118 -19.0768 -19.0768 -19.0706 -19.0706 -18.9278 -18.9278 -18.9043 -18.9043 -11.4053 -11.4053 -11.3901 -11.3901 -11.2653 -11.2653 -0.3741 -0.3741 -0.2739 -0.2739 0.2844 0.2844 0.4089 0.4089 0.6606 0.6606 0.8368 0.8368 2.7549 2.7549 2.8146 2.8146 2.9685 2.9685 7.1710 7.1710 7.2129 7.2129 8.6160 8.6160 9.0574 9.0574 10.0599 10.0599 10.1829 10.1829 k = 0.3297 0.6114 0.4320 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1208 -47.1208 -47.1155 -47.1155 -19.9996 -19.9996 -19.9991 -19.9991 -19.8450 -19.8450 -19.8439 -19.8439 -19.7739 -19.7739 -19.7654 -19.7654 -19.2227 -19.2227 -19.2122 -19.2122 -19.0765 -19.0765 -19.0707 -19.0707 -18.9283 -18.9283 -18.9051 -18.9051 -11.4009 -11.4009 -11.3857 -11.3857 -11.2662 -11.2662 -0.3959 -0.3959 -0.2954 -0.2954 0.2739 0.2739 0.4133 0.4133 0.6704 0.6704 0.8321 0.8321 2.7401 2.7401 2.8206 2.8206 2.9658 2.9658 7.2138 7.2138 7.2344 7.2344 8.6645 8.6645 9.0638 9.0638 10.0640 10.0640 10.1979 10.1979 k = 0.3226 0.6280 0.4500 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1206 -47.1206 -47.1157 -47.1157 -19.9998 -19.9998 -19.9991 -19.9991 -19.8450 -19.8450 -19.8440 -19.8440 -19.7741 -19.7741 -19.7653 -19.7653 -19.2222 -19.2222 -19.2125 -19.2125 -19.0762 -19.0762 -19.0708 -19.0708 -18.9288 -18.9288 -18.9059 -18.9059 -11.3965 -11.3965 -11.3817 -11.3817 -11.2670 -11.2670 -0.4166 -0.4166 -0.3164 -0.3164 0.2635 0.2635 0.4193 0.4193 0.6805 0.6805 0.8272 0.8272 2.7257 2.7257 2.8257 2.8257 2.9631 2.9631 7.2503 7.2503 7.2608 7.2608 8.7147 8.7147 9.0561 9.0561 10.0756 10.0756 10.2086 10.2086 k = 0.3156 0.6445 0.4679 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1203 -47.1203 -47.1159 -47.1159 -19.9999 -19.9999 -19.9991 -19.9991 -19.8450 -19.8450 -19.8441 -19.8441 -19.7743 -19.7743 -19.7652 -19.7652 -19.2217 -19.2217 -19.2129 -19.2129 -19.0759 -19.0759 -19.0710 -19.0710 -18.9293 -18.9293 -18.9066 -18.9066 -11.3922 -11.3922 -11.3782 -11.3782 -11.2677 -11.2677 -0.4359 -0.4359 -0.3366 -0.3366 0.2533 0.2533 0.4266 0.4266 0.6908 0.6908 0.8223 0.8223 2.7117 2.7117 2.8299 2.8299 2.9606 2.9606 7.2721 7.2721 7.3007 7.3007 8.7661 8.7661 9.0352 9.0352 10.0937 10.0937 10.2147 10.2147 k = 0.3085 0.6610 0.4859 ( 9533 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1201 -47.1201 -47.1162 -47.1162 -20.0000 -20.0000 -19.9990 -19.9990 -19.8450 -19.8450 -19.8442 -19.8442 -19.7745 -19.7745 -19.7651 -19.7651 -19.2212 -19.2212 -19.2133 -19.2133 -19.0756 -19.0756 -19.0711 -19.0711 -18.9297 -18.9297 -18.9072 -18.9072 -11.3879 -11.3879 -11.3754 -11.3754 -11.2683 -11.2683 -0.4537 -0.4537 -0.3555 -0.3555 0.2434 0.2434 0.4348 0.4348 0.7011 0.7011 0.8174 0.8174 2.6982 2.6982 2.8332 2.8332 2.9582 2.9582 7.2915 7.2915 7.3417 7.3417 8.8181 8.8181 9.0034 9.0034 10.1165 10.1165 10.2161 10.2161 k = 0.3014 0.6776 0.5039 ( 9537 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1199 -47.1199 -47.1164 -47.1164 -20.0001 -20.0001 -19.9990 -19.9990 -19.8450 -19.8450 -19.8444 -19.8444 -19.7746 -19.7746 -19.7650 -19.7650 -19.2207 -19.2207 -19.2137 -19.2137 -19.0753 -19.0753 -19.0712 -19.0712 -18.9302 -18.9302 -18.9078 -18.9078 -11.3838 -11.3838 -11.3733 -11.3733 -11.2687 -11.2687 -0.4699 -0.4699 -0.3731 -0.3731 0.2338 0.2338 0.4439 0.4439 0.7114 0.7114 0.8124 0.8124 2.6853 2.6853 2.8357 2.8357 2.9559 2.9559 7.3101 7.3101 7.3822 7.3822 8.8681 8.8681 8.9649 8.9649 10.1416 10.1416 10.2134 10.2134 k = 0.2943 0.6941 0.5219 ( 9527 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1196 -47.1196 -47.1166 -47.1166 -20.0002 -20.0002 -19.9990 -19.9990 -19.8449 -19.8449 -19.8445 -19.8445 -19.7748 -19.7748 -19.7648 -19.7648 -19.2201 -19.2201 -19.2141 -19.2141 -19.0750 -19.0750 -19.0713 -19.0713 -18.9305 -18.9305 -18.9083 -18.9083 -11.3798 -11.3798 -11.3720 -11.3720 -11.2688 -11.2688 -0.4844 -0.4844 -0.3890 -0.3890 0.2245 0.2245 0.4536 0.4536 0.7215 0.7215 0.8076 0.8076 2.6731 2.6731 2.8375 2.8375 2.9539 2.9539 7.3279 7.3279 7.4221 7.4221 8.8875 8.8875 8.9501 8.9501 10.1637 10.1637 10.2107 10.2107 k = 0.2872 0.7107 0.5399 ( 9539 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1194 -47.1194 -47.1169 -47.1169 -20.0003 -20.0003 -19.9990 -19.9990 -19.8449 -19.8449 -19.8446 -19.8446 -19.7749 -19.7749 -19.7648 -19.7648 -19.2197 -19.2197 -19.2145 -19.2145 -19.0748 -19.0748 -19.0715 -19.0715 -18.9309 -18.9309 -18.9087 -18.9087 -11.3759 -11.3759 -11.3715 -11.3715 -11.2686 -11.2686 -0.4971 -0.4971 -0.4030 -0.4030 0.2156 0.2156 0.4637 0.4637 0.7311 0.7311 0.8031 0.8031 2.6616 2.6616 2.8386 2.8386 2.9520 2.9520 7.3447 7.3447 7.4612 7.4612 8.8430 8.8430 8.9941 8.9941 10.1687 10.1687 10.2212 10.2212 k = 0.2801 0.7272 0.5579 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1192 -47.1192 -47.1171 -47.1171 -20.0004 -20.0004 -19.9989 -19.9989 -19.8449 -19.8449 -19.8447 -19.8447 -19.7750 -19.7750 -19.7647 -19.7647 -19.2191 -19.2191 -19.2149 -19.2149 -19.0745 -19.0745 -19.0716 -19.0716 -18.9311 -18.9311 -18.9091 -18.9091 -11.3721 -11.3721 -11.3719 -11.3719 -11.2682 -11.2682 -0.5081 -0.5081 -0.4150 -0.4150 0.2071 0.2071 0.4742 0.4742 0.7397 0.7397 0.7993 0.7993 2.6509 2.6509 2.8390 2.8390 2.9504 2.9504 7.3603 7.3603 7.4995 7.4995 8.7851 8.7851 9.0481 9.0481 10.1552 10.1552 10.2456 10.2456 k = 0.2730 0.7437 0.5759 ( 9533 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7752 -19.7752 -19.7646 -19.7646 -19.2186 -19.2186 -19.2154 -19.2154 -19.0743 -19.0743 -19.0718 -19.0718 -18.9313 -18.9313 -18.9094 -18.9094 -11.3731 -11.3731 -11.3685 -11.3685 -11.2675 -11.2675 -0.5172 -0.5172 -0.4249 -0.4249 0.1991 0.1991 0.4848 0.4848 0.7467 0.7467 0.7968 0.7968 2.6412 2.6412 2.8389 2.8389 2.9491 2.9491 7.3739 7.3739 7.5369 7.5369 8.7238 8.7238 9.1035 9.1035 10.1339 10.1339 10.2731 10.2731 k = 0.2730 0.7437 0.5759 ( 9533 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7752 -19.7752 -19.7646 -19.7646 -19.2186 -19.2186 -19.2154 -19.2154 -19.0743 -19.0743 -19.0718 -19.0718 -18.9313 -18.9313 -18.9094 -18.9094 -11.3731 -11.3731 -11.3685 -11.3685 -11.2675 -11.2675 -0.5172 -0.5172 -0.4249 -0.4249 0.1991 0.1991 0.4848 0.4848 0.7467 0.7467 0.7968 0.7968 2.6412 2.6412 2.8389 2.8389 2.9491 2.9491 7.3739 7.3739 7.5369 7.5369 8.7238 8.7238 9.1035 9.1035 10.1339 10.1339 10.2731 10.2731 k = 0.2502 0.7393 0.5808 ( 9529 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1174 -47.1174 -20.0005 -20.0005 -19.9989 -19.9989 -19.8448 -19.8448 -19.8448 -19.8448 -19.7752 -19.7752 -19.7645 -19.7645 -19.2185 -19.2185 -19.2155 -19.2155 -19.0743 -19.0743 -19.0718 -19.0718 -18.9314 -18.9314 -18.9094 -18.9094 -11.3739 -11.3739 -11.3673 -11.3673 -11.2673 -11.2673 -0.5196 -0.5196 -0.4270 -0.4270 0.1970 0.1970 0.4878 0.4878 0.7483 0.7483 0.7966 0.7966 2.6386 2.6386 2.8387 2.8387 2.9488 2.9488 7.3782 7.3782 7.5460 7.5460 8.7077 8.7077 9.1184 9.1184 10.1222 10.1222 10.2855 10.2855 k = 0.2275 0.7348 0.5857 ( 9527 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1175 -47.1175 -20.0005 -20.0005 -19.9989 -19.9989 -19.8449 -19.8449 -19.8448 -19.8448 -19.7752 -19.7752 -19.7645 -19.7645 -19.2183 -19.2183 -19.2156 -19.2156 -19.0742 -19.0742 -19.0718 -19.0718 -18.9314 -18.9314 -18.9095 -18.9095 -11.3750 -11.3750 -11.3659 -11.3659 -11.2669 -11.2669 -0.5222 -0.5222 -0.4288 -0.4288 0.1950 0.1950 0.4911 0.4911 0.7497 0.7497 0.7965 0.7965 2.6358 2.6358 2.8384 2.8384 2.9485 2.9485 7.3845 7.3845 7.5530 7.5530 8.6929 8.6929 9.1329 9.1329 10.1028 10.1028 10.3049 10.3049 k = 0.2047 0.7303 0.5905 ( 9526 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1175 -47.1175 -20.0005 -20.0005 -19.9988 -19.9988 -19.8448 -19.8448 -19.8448 -19.8448 -19.7753 -19.7753 -19.7645 -19.7645 -19.2182 -19.2182 -19.2157 -19.2157 -19.0742 -19.0742 -19.0718 -19.0718 -18.9315 -18.9315 -18.9095 -18.9095 -11.3760 -11.3760 -11.3647 -11.3647 -11.2665 -11.2665 -0.5250 -0.5250 -0.4302 -0.4302 0.1931 0.1931 0.4944 0.4944 0.7511 0.7511 0.7966 0.7966 2.6329 2.6329 2.8381 2.8381 2.9482 2.9482 7.3926 7.3926 7.5578 7.5578 8.6797 8.6797 9.1469 9.1469 10.0795 10.0795 10.3274 10.3274 k = 0.1820 0.7259 0.5954 ( 9525 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1176 -47.1176 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7753 -19.7753 -19.7644 -19.7644 -19.2180 -19.2180 -19.2159 -19.2159 -19.0742 -19.0742 -19.0718 -19.0718 -18.9315 -18.9315 -18.9096 -18.9096 -11.3770 -11.3770 -11.3636 -11.3636 -11.2661 -11.2661 -0.5279 -0.5279 -0.4313 -0.4313 0.1913 0.1913 0.4976 0.4976 0.7522 0.7522 0.7968 0.7968 2.6301 2.6301 2.8378 2.8378 2.9479 2.9479 7.4023 7.4023 7.5604 7.5604 8.6680 8.6680 9.1603 9.1603 10.0545 10.0545 10.3400 10.3405 k = 0.1592 0.7214 0.6002 ( 9510 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1177 -47.1177 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7753 -19.7753 -19.7643 -19.7643 -19.2178 -19.2178 -19.2160 -19.2160 -19.0741 -19.0741 -19.0718 -19.0718 -18.9315 -18.9315 -18.9096 -18.9096 -11.3780 -11.3780 -11.3626 -11.3626 -11.2656 -11.2656 -0.5307 -0.5307 -0.4322 -0.4322 0.1897 0.1897 0.5006 0.5006 0.7532 0.7532 0.7972 0.7972 2.6274 2.6274 2.8374 2.8374 2.9477 2.9477 7.4134 7.4134 7.5608 7.5608 8.6578 8.6578 9.1730 9.1730 10.0294 10.0294 10.3261 10.3261 k = 0.1365 0.7169 0.6051 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1177 -47.1177 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7753 -19.7753 -19.7644 -19.7644 -19.2177 -19.2177 -19.2161 -19.2161 -19.0741 -19.0741 -19.0719 -19.0719 -18.9316 -18.9316 -18.9097 -18.9097 -11.3788 -11.3788 -11.3618 -11.3618 -11.2652 -11.2652 -0.5334 -0.5334 -0.4327 -0.4327 0.1884 0.1884 0.5034 0.5034 0.7541 0.7541 0.7977 0.7977 2.6248 2.6248 2.8370 2.8370 2.9474 2.9474 7.4257 7.4257 7.5589 7.5589 8.6491 8.6491 9.1849 9.1849 10.0052 10.0052 10.3136 10.3136 k = 0.1137 0.7125 0.6100 ( 9534 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1178 -47.1178 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7644 -19.7644 -19.2176 -19.2176 -19.2163 -19.2163 -19.0741 -19.0741 -19.0719 -19.0719 -18.9316 -18.9316 -18.9097 -18.9097 -11.3795 -11.3795 -11.3612 -11.3612 -11.2647 -11.2647 -0.5359 -0.5359 -0.4331 -0.4331 0.1873 0.1873 0.5059 0.5059 0.7548 0.7548 0.7982 0.7982 2.6225 2.6225 2.8367 2.8367 2.9472 2.9472 7.4389 7.4389 7.5548 7.5548 8.6419 8.6419 9.1957 9.1957 9.9829 9.9829 10.3029 10.3029 k = 0.0910 0.7080 0.6148 ( 9526 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1179 -47.1179 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2175 -19.2175 -19.2164 -19.2164 -19.0740 -19.0740 -19.0719 -19.0719 -18.9316 -18.9316 -18.9097 -18.9097 -11.3801 -11.3801 -11.3607 -11.3607 -11.2644 -11.2644 -0.5381 -0.5381 -0.4334 -0.4334 0.1864 0.1864 0.5079 0.5079 0.7553 0.7553 0.7987 0.7987 2.6205 2.6205 2.8364 2.8364 2.9471 2.9471 7.4527 7.4527 7.5487 7.5487 8.6361 8.6361 9.2053 9.2053 9.9633 9.9633 10.2941 10.2941 k = 0.0682 0.7035 0.6197 ( 9531 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1183 -47.1183 -47.1179 -47.1179 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2174 -19.2174 -19.2165 -19.2165 -19.0740 -19.0740 -19.0719 -19.0719 -18.9316 -18.9316 -18.9098 -18.9098 -11.3806 -11.3806 -11.3603 -11.3603 -11.2641 -11.2641 -0.5398 -0.5398 -0.4336 -0.4336 0.1857 0.1857 0.5096 0.5096 0.7557 0.7557 0.7991 0.7991 2.6188 2.6188 2.8361 2.8361 2.9469 2.9469 7.4667 7.4667 7.5408 7.5408 8.6316 8.6316 9.2132 9.2132 9.9471 9.9471 10.2872 10.2872 k = 0.0455 0.6991 0.6245 ( 9523 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1183 -47.1183 -47.1180 -47.1180 -20.0006 -20.0006 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2172 -19.2172 -19.2166 -19.2166 -19.0740 -19.0740 -19.0719 -19.0719 -18.9317 -18.9317 -18.9098 -18.9098 -11.3809 -11.3809 -11.3601 -11.3601 -11.2638 -11.2638 -0.5412 -0.5412 -0.4337 -0.4337 0.1852 0.1852 0.5108 0.5108 0.7559 0.7559 0.7994 0.7994 2.6176 2.6176 2.8359 2.8359 2.9468 2.9468 7.4808 7.4808 7.5311 7.5311 8.6285 8.6285 9.2191 9.2191 9.9350 9.9350 10.2822 10.2822 k = 0.0227 0.6946 0.6294 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2171 -19.2171 -19.2168 -19.2168 -19.0740 -19.0740 -19.0719 -19.0719 -18.9317 -18.9317 -18.9098 -18.9098 -11.3811 -11.3811 -11.3599 -11.3599 -11.2637 -11.2637 -0.5420 -0.5420 -0.4337 -0.4337 0.1849 0.1849 0.5115 0.5115 0.7561 0.7561 0.7996 0.7996 2.6169 2.6169 2.8358 2.8358 2.9468 2.9468 7.4946 7.4946 7.5201 7.5201 8.6266 8.6266 9.2228 9.2228 9.9275 9.9275 10.2792 10.2792 k = 0.0000 0.6901 0.6343 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2170 -19.2170 -19.2168 -19.2168 -19.0740 -19.0740 -19.0719 -19.0719 -18.9317 -18.9317 -18.9098 -18.9098 -11.3812 -11.3812 -11.3599 -11.3599 -11.2636 -11.2636 -0.5422 -0.5422 -0.4337 -0.4337 0.1848 0.1848 0.5118 0.5118 0.7562 0.7562 0.7997 0.7997 2.6166 2.6166 2.8358 2.8358 2.9467 2.9467 7.5069 7.5069 7.5087 7.5087 8.6260 8.6260 9.2240 9.2240 9.9249 9.9249 10.2782 10.2782 k = 0.0000 0.6901 0.6343 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1182 -47.1182 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2170 -19.2170 -19.2168 -19.2168 -19.0740 -19.0740 -19.0719 -19.0719 -18.9317 -18.9317 -18.9098 -18.9098 -11.3812 -11.3812 -11.3599 -11.3599 -11.2636 -11.2636 -0.5422 -0.5422 -0.4337 -0.4337 0.1848 0.1848 0.5118 0.5118 0.7562 0.7562 0.7997 0.7997 2.6166 2.6166 2.8358 2.8358 2.9467 2.9467 7.5069 7.5069 7.5087 7.5087 8.6260 8.6260 9.2240 9.2240 9.9249 9.9249 10.2782 10.2782 k = 0.0071 0.6735 0.6524 ( 9530 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2177 -19.2177 -19.2162 -19.2162 -19.0745 -19.0745 -19.0714 -19.0714 -18.9321 -18.9321 -18.9094 -18.9094 -11.3811 -11.3811 -11.3598 -11.3598 -11.2634 -11.2634 -0.5416 -0.5416 -0.4334 -0.4334 0.1845 0.1845 0.5113 0.5113 0.7542 0.7542 0.7991 0.7991 2.6170 2.6170 2.8354 2.8354 2.9460 2.9460 7.5094 7.5094 7.5128 7.5128 8.6261 8.6261 9.2239 9.2239 9.9209 9.9209 10.2736 10.2736 k = 0.0143 0.6568 0.6705 ( 9530 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7754 -19.7754 -19.7643 -19.7643 -19.2185 -19.2185 -19.2155 -19.2155 -19.0754 -19.0754 -19.0705 -19.0705 -18.9334 -18.9334 -18.9081 -18.9081 -11.3808 -11.3808 -11.3596 -11.3596 -11.2628 -11.2628 -0.5399 -0.5399 -0.4327 -0.4327 0.1837 0.1837 0.5097 0.5097 0.7483 0.7483 0.7972 0.7972 2.6180 2.6180 2.8342 2.8342 2.9438 2.9438 7.5171 7.5171 7.5247 7.5247 8.6263 8.6263 9.2234 9.2234 9.9091 9.9091 10.2602 10.2602 k = 0.0214 0.6402 0.6886 ( 9522 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7755 -19.7755 -19.7642 -19.7642 -19.2193 -19.2193 -19.2149 -19.2149 -19.0764 -19.0764 -19.0694 -19.0694 -18.9353 -18.9353 -18.9063 -18.9063 -11.3804 -11.3804 -11.3593 -11.3593 -11.2619 -11.2619 -0.5370 -0.5370 -0.4313 -0.4313 0.1822 0.1822 0.5072 0.5072 0.7390 0.7390 0.7938 0.7938 2.6197 2.6197 2.8322 2.8322 2.9402 2.9402 7.5299 7.5299 7.5443 7.5443 8.6264 8.6264 9.2226 9.2226 9.8905 9.8905 10.2389 10.2389 k = 0.0286 0.6235 0.7068 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8449 -19.8449 -19.8448 -19.8448 -19.7755 -19.7755 -19.7642 -19.7642 -19.2201 -19.2201 -19.2143 -19.2143 -19.0774 -19.0774 -19.0683 -19.0683 -18.9376 -18.9376 -18.9042 -18.9042 -11.3799 -11.3799 -11.3588 -11.3588 -11.2605 -11.2605 -0.5329 -0.5329 -0.4295 -0.4295 0.1801 0.1801 0.5037 0.5037 0.7265 0.7265 0.7889 0.7889 2.6220 2.6220 2.8295 2.8295 2.9352 2.9352 7.5476 7.5476 7.5715 7.5715 8.6260 8.6260 9.2215 9.2215 9.8665 9.8665 10.2112 10.2112 k = 0.0357 0.6069 0.7249 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8450 -19.8450 -19.8448 -19.8448 -19.7756 -19.7756 -19.7642 -19.7642 -19.2209 -19.2209 -19.2137 -19.2137 -19.0784 -19.0784 -19.0672 -19.0672 -18.9402 -18.9402 -18.9019 -18.9019 -11.3791 -11.3791 -11.3582 -11.3582 -11.2588 -11.2588 -0.5278 -0.5278 -0.4272 -0.4272 0.1772 0.1772 0.4992 0.4992 0.7111 0.7111 0.7826 0.7826 2.6247 2.6247 2.8260 2.8260 2.9289 2.9289 7.5697 7.5697 7.6059 7.6059 8.6245 8.6245 9.2202 9.2202 9.8391 9.8391 10.1787 10.1787 k = 0.0429 0.5902 0.7430 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0007 -20.0007 -19.9988 -19.9988 -19.8450 -19.8450 -19.8448 -19.8448 -19.7757 -19.7757 -19.7642 -19.7642 -19.2218 -19.2218 -19.2131 -19.2131 -19.0794 -19.0794 -19.0660 -19.0660 -18.9429 -18.9429 -18.8994 -18.8994 -11.3783 -11.3783 -11.3575 -11.3575 -11.2567 -11.2567 -0.5216 -0.5216 -0.4245 -0.4245 0.1736 0.1736 0.4937 0.4937 0.6934 0.6934 0.7748 0.7748 2.6278 2.6278 2.8219 2.8219 2.9213 2.9213 7.5957 7.5957 7.6473 7.6473 8.6213 8.6213 9.2187 9.2187 9.8102 9.8102 10.1426 10.1426 k = 0.0500 0.5736 0.7611 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0008 -20.0008 -19.9988 -19.9988 -19.8451 -19.8451 -19.8448 -19.8448 -19.7758 -19.7758 -19.7642 -19.7642 -19.2227 -19.2227 -19.2127 -19.2127 -19.0804 -19.0804 -19.0649 -19.0649 -18.9458 -18.9458 -18.8969 -18.8969 -11.3773 -11.3773 -11.3567 -11.3567 -11.2543 -11.2543 -0.5143 -0.5143 -0.4214 -0.4214 0.1689 0.1689 0.4874 0.4874 0.6737 0.6737 0.7659 0.7659 2.6310 2.6310 2.8171 2.8171 2.9126 2.9126 7.6252 7.6252 7.6952 7.6952 8.6157 8.6157 9.2172 9.2172 9.7819 9.7819 10.1044 10.1044 k = 0.0571 0.5569 0.7792 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0008 -20.0008 -19.9988 -19.9988 -19.8451 -19.8451 -19.8448 -19.8448 -19.7759 -19.7759 -19.7641 -19.7641 -19.2236 -19.2236 -19.2122 -19.2122 -19.0813 -19.0813 -19.0638 -19.0638 -18.9486 -18.9486 -18.8943 -18.8943 -11.3761 -11.3761 -11.3558 -11.3558 -11.2516 -11.2516 -0.5061 -0.5061 -0.4179 -0.4179 0.1632 0.1632 0.4802 0.4802 0.6522 0.6522 0.7560 0.7560 2.6342 2.6342 2.8117 2.8117 2.9028 2.9028 7.6574 7.6574 7.7491 7.7491 8.6067 8.6067 9.2157 9.2157 9.7564 9.7564 10.0650 10.0650 k = 0.0643 0.5402 0.7974 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0009 -20.0009 -19.9988 -19.9988 -19.8452 -19.8452 -19.8448 -19.8448 -19.7760 -19.7760 -19.7641 -19.7641 -19.2245 -19.2245 -19.2117 -19.2117 -19.0822 -19.0822 -19.0627 -19.0627 -18.9515 -18.9515 -18.8918 -18.8918 -11.3749 -11.3749 -11.3548 -11.3548 -11.2486 -11.2486 -0.4971 -0.4971 -0.4140 -0.4140 0.1564 0.1564 0.4722 0.4722 0.6295 0.6295 0.7454 0.7454 2.6374 2.6374 2.8057 2.8057 2.8921 2.8921 7.6915 7.6915 7.8086 7.8086 8.5937 8.5937 9.2144 9.2144 9.7355 9.7355 10.0255 10.0255 k = 0.0714 0.5236 0.8155 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0009 -20.0009 -19.9988 -19.9988 -19.8452 -19.8452 -19.8448 -19.8448 -19.7761 -19.7761 -19.7641 -19.7641 -19.2254 -19.2254 -19.2114 -19.2114 -19.0831 -19.0831 -19.0616 -19.0616 -18.9544 -18.9544 -18.8894 -18.8894 -11.3735 -11.3735 -11.3537 -11.3537 -11.2453 -11.2453 -0.4873 -0.4873 -0.4100 -0.4100 0.1482 0.1482 0.4636 0.4636 0.6058 0.6058 0.7344 0.7344 2.6403 2.6403 2.7993 2.7993 2.8806 2.8806 7.7267 7.7267 7.8729 7.8729 8.5758 8.5758 9.2132 9.2132 9.7210 9.7210 9.9865 9.9865 k = 0.0786 0.5069 0.8336 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0010 -20.0010 -19.9988 -19.9988 -19.8453 -19.8453 -19.8448 -19.8448 -19.7763 -19.7763 -19.7640 -19.7640 -19.2263 -19.2263 -19.2110 -19.2110 -19.0840 -19.0840 -19.0605 -19.0605 -18.9573 -18.9573 -18.8870 -18.8870 -11.3720 -11.3720 -11.3525 -11.3525 -11.2417 -11.2417 -0.4768 -0.4768 -0.4057 -0.4057 0.1388 0.1388 0.4544 0.4544 0.5816 0.5816 0.7231 0.7231 2.6428 2.6428 2.7925 2.7925 2.8684 2.8684 7.7620 7.7620 7.9413 7.9413 8.5528 8.5528 9.2123 9.2123 9.7142 9.7142 9.9487 9.9487 k = 0.0857 0.4903 0.8517 ( 9518 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0010 -20.0010 -19.9988 -19.9988 -19.8453 -19.8453 -19.8448 -19.8448 -19.7764 -19.7764 -19.7640 -19.7640 -19.2273 -19.2273 -19.2107 -19.2107 -19.0848 -19.0848 -19.0595 -19.0595 -18.9601 -18.9601 -18.8846 -18.8846 -11.3704 -11.3704 -11.3512 -11.3512 -11.2380 -11.2380 -0.4658 -0.4658 -0.4012 -0.4012 0.1280 0.1280 0.4448 0.4448 0.5573 0.5573 0.7116 0.7116 2.6448 2.6448 2.7853 2.7853 2.8556 2.8556 7.7965 7.7965 8.0131 8.0131 8.5244 8.5244 9.2115 9.2115 9.7159 9.7159 9.9128 9.9128 k = 0.0929 0.4736 0.8699 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0011 -20.0011 -19.9988 -19.9988 -19.8454 -19.8454 -19.8449 -19.8449 -19.7766 -19.7766 -19.7639 -19.7639 -19.2282 -19.2282 -19.2104 -19.2104 -19.0856 -19.0856 -19.0585 -19.0585 -18.9629 -18.9629 -18.8823 -18.8823 -11.3687 -11.3687 -11.3499 -11.3499 -11.2340 -11.2340 -0.4545 -0.4545 -0.3966 -0.3966 0.1159 0.1159 0.4346 0.4346 0.5333 0.5333 0.7003 0.7003 2.6462 2.6462 2.7779 2.7779 2.8423 2.8423 7.8292 7.8292 8.0874 8.0874 8.4910 8.4910 9.2108 9.2108 9.7265 9.7265 9.8793 9.8793 k = 0.1000 0.4570 0.8880 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0012 -20.0012 -19.9988 -19.9988 -19.8454 -19.8454 -19.8449 -19.8449 -19.7767 -19.7767 -19.7639 -19.7639 -19.2291 -19.2291 -19.2101 -19.2101 -19.0863 -19.0863 -19.0575 -19.0575 -18.9656 -18.9656 -18.8801 -18.8801 -11.3670 -11.3670 -11.3485 -11.3485 -11.2299 -11.2299 -0.4431 -0.4431 -0.3918 -0.3918 0.1027 0.1027 0.4239 0.4239 0.5103 0.5103 0.6891 0.6891 2.6470 2.6470 2.7703 2.7703 2.8288 2.8288 7.8592 7.8592 8.1629 8.1629 8.4534 8.4534 9.2097 9.2097 9.7456 9.7456 9.8491 9.8491 k = 0.1071 0.4403 0.9061 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0012 -20.0012 -19.9989 -19.9989 -19.8455 -19.8455 -19.8449 -19.8449 -19.7769 -19.7769 -19.7639 -19.7639 -19.2300 -19.2300 -19.2099 -19.2099 -19.0870 -19.0870 -19.0566 -19.0566 -18.9682 -18.9682 -18.8779 -18.8779 -11.3652 -11.3652 -11.3471 -11.3471 -11.2256 -11.2256 -0.4320 -0.4320 -0.3869 -0.3869 0.0886 0.0886 0.4124 0.4124 0.4887 0.4887 0.6781 0.6781 2.6470 2.6470 2.7626 2.7626 2.8150 2.8150 7.8857 7.8857 8.2383 8.2383 8.4128 8.4128 9.2077 9.2077 9.7702 9.7702 9.8254 9.8254 k = 0.1143 0.4237 0.9242 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0013 -20.0013 -19.9989 -19.9989 -19.8456 -19.8456 -19.8449 -19.8449 -19.7771 -19.7771 -19.7638 -19.7638 -19.2309 -19.2309 -19.2097 -19.2097 -19.0877 -19.0877 -19.0556 -19.0556 -18.9707 -18.9707 -18.8759 -18.8759 -11.3634 -11.3634 -11.3457 -11.3457 -11.2213 -11.2213 -0.4215 -0.4215 -0.3817 -0.3817 0.0740 0.0740 0.3997 0.3997 0.4692 0.4692 0.6673 0.6673 2.6464 2.6464 2.7549 2.7549 2.8012 2.8012 7.9083 7.9083 8.3071 8.3071 8.3754 8.3754 9.2041 9.2041 9.7798 9.7798 9.8284 9.8284 k = 0.1214 0.4070 0.9423 ( 9534 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0014 -20.0014 -19.9989 -19.9989 -19.8457 -19.8457 -19.8449 -19.8449 -19.7773 -19.7773 -19.7638 -19.7638 -19.2318 -19.2318 -19.2096 -19.2096 -19.0884 -19.0884 -19.0548 -19.0548 -18.9732 -18.9732 -18.8739 -18.8739 -11.3616 -11.3616 -11.3442 -11.3442 -11.2169 -11.2169 -0.4123 -0.4123 -0.3761 -0.3761 0.0593 0.0593 0.3858 0.3858 0.4522 0.4522 0.6568 0.6568 2.6451 2.6451 2.7471 2.7471 2.7875 2.7875 7.9265 7.9265 8.3089 8.3089 8.4015 8.4015 9.1983 9.1983 9.7646 9.7646 9.8675 9.8675 k = 0.1286 0.3904 0.9605 ( 9534 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0014 -20.0014 -19.9989 -19.9989 -19.8457 -19.8457 -19.8450 -19.8450 -19.7774 -19.7774 -19.7637 -19.7637 -19.2327 -19.2327 -19.2095 -19.2095 -19.0890 -19.0890 -19.0540 -19.0540 -18.9755 -18.9755 -18.8721 -18.8721 -11.3597 -11.3597 -11.3428 -11.3428 -11.2124 -11.2124 -0.4047 -0.4047 -0.3700 -0.3700 0.0450 0.0450 0.3706 0.3706 0.4378 0.4378 0.6466 0.6466 2.6431 2.6431 2.7394 2.7394 2.7740 2.7740 7.9402 7.9402 8.2650 8.2650 8.4697 8.4697 9.1897 9.1897 9.7473 9.7473 9.9190 9.9190 k = 0.1357 0.3737 0.9786 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0015 -20.0015 -19.9989 -19.9989 -19.8458 -19.8458 -19.8450 -19.8450 -19.7776 -19.7776 -19.7637 -19.7637 -19.2335 -19.2335 -19.2093 -19.2093 -19.0895 -19.0895 -19.0532 -19.0532 -18.9777 -18.9777 -18.8703 -18.8703 -11.3579 -11.3579 -11.3413 -11.3413 -11.2080 -11.2080 -0.3990 -0.3990 -0.3635 -0.3635 0.0317 0.0317 0.3547 0.3547 0.4257 0.4257 0.6367 0.6367 2.6405 2.6405 2.7316 2.7316 2.7608 2.7608 7.9495 7.9495 8.2174 8.2174 8.5377 8.5377 9.1781 9.1781 9.7319 9.7319 9.9771 9.9771 k = 0.1429 0.3570 0.9967 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0015 -20.0015 -19.9989 -19.9989 -19.8458 -19.8458 -19.8450 -19.8450 -19.7778 -19.7778 -19.7636 -19.7636 -19.2343 -19.2343 -19.2093 -19.2093 -19.0900 -19.0900 -19.0525 -19.0525 -18.9798 -18.9798 -18.8686 -18.8686 -11.3561 -11.3561 -11.3399 -11.3399 -11.2037 -11.2037 -0.3952 -0.3952 -0.3571 -0.3571 0.0199 0.0199 0.3388 0.3388 0.4153 0.4153 0.6271 0.6271 2.6376 2.6376 2.7239 2.7239 2.7481 2.7481 7.9547 7.9547 8.1695 8.1695 8.6018 8.6018 9.1637 9.1637 9.7186 9.7186 10.0268 10.0268 k = 0.1500 0.3404 1.0148 ( 9526 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0016 -20.0016 -19.9989 -19.9989 -19.8459 -19.8459 -19.8450 -19.8450 -19.7779 -19.7779 -19.7636 -19.7636 -19.2350 -19.2350 -19.2092 -19.2092 -19.0905 -19.0905 -19.0518 -19.0518 -18.9818 -18.9818 -18.8670 -18.8670 -11.3543 -11.3543 -11.3385 -11.3385 -11.1994 -11.1994 -0.3930 -0.3930 -0.3515 -0.3515 0.0103 0.0103 0.3234 0.3234 0.4060 0.4060 0.6177 0.6177 2.6343 2.6343 2.7161 2.7161 2.7360 2.7360 7.9563 7.9563 8.1223 8.1223 8.6610 8.6610 9.1468 9.1468 9.7071 9.7071 10.0580 10.0580 k = 0.1571 0.3237 1.0330 ( 9522 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0017 -20.0017 -19.9989 -19.9989 -19.8460 -19.8460 -19.8450 -19.8450 -19.7781 -19.7781 -19.7635 -19.7635 -19.2357 -19.2357 -19.2091 -19.2091 -19.0910 -19.0910 -19.0512 -19.0512 -18.9837 -18.9837 -18.8656 -18.8656 -11.3525 -11.3525 -11.3371 -11.3371 -11.1952 -11.1952 -0.3922 -0.3922 -0.3471 -0.3471 0.0032 0.0032 0.3090 0.3090 0.3974 0.3974 0.6086 0.6086 2.6308 2.6308 2.7081 2.7081 2.7246 2.7246 7.9549 7.9549 8.0765 8.0765 8.7145 8.7145 9.1282 9.1282 9.6973 9.6973 10.0917 10.0917 k = 0.1643 0.3071 1.0511 ( 9524 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0017 -20.0017 -19.9989 -19.9989 -19.8460 -19.8460 -19.8450 -19.8450 -19.7782 -19.7782 -19.7635 -19.7635 -19.2364 -19.2364 -19.2091 -19.2091 -19.0914 -19.0914 -19.0506 -19.0506 -18.9854 -18.9854 -18.8642 -18.8642 -11.3509 -11.3509 -11.3358 -11.3358 -11.1912 -11.1912 -0.3927 -0.3927 -0.3444 -0.3444 -0.0011 -0.0011 0.2960 0.2960 0.3892 0.3892 0.5999 0.5999 2.6273 2.6273 2.6999 2.6999 2.7142 2.7142 7.9509 7.9509 8.0326 8.0326 8.7618 8.7618 9.1085 9.1085 9.6889 9.6889 10.1279 10.1279 k = 0.1714 0.2904 1.0692 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0018 -20.0018 -19.9990 -19.9990 -19.8461 -19.8461 -19.8451 -19.8451 -19.7784 -19.7784 -19.7635 -19.7635 -19.2371 -19.2371 -19.2091 -19.2091 -19.0918 -19.0918 -19.0501 -19.0501 -18.9870 -18.9870 -18.8630 -18.8630 -11.3493 -11.3493 -11.3345 -11.3345 -11.1874 -11.1874 -0.3941 -0.3941 -0.3434 -0.3434 -0.0024 -0.0024 0.2844 0.2844 0.3810 0.3810 0.5914 0.5914 2.6239 2.6239 2.6916 2.6916 2.7047 2.7047 7.9451 7.9451 7.9910 7.9910 8.8028 8.8028 9.0884 9.0884 9.6816 9.6816 10.1648 10.1648 k = 0.1786 0.2738 1.0873 ( 9538 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0019 -20.0019 -19.9990 -19.9990 -19.8462 -19.8462 -19.8451 -19.8451 -19.7785 -19.7785 -19.7634 -19.7634 -19.2377 -19.2377 -19.2091 -19.2091 -19.0922 -19.0922 -19.0496 -19.0496 -18.9885 -18.9885 -18.8618 -18.8618 -11.3478 -11.3478 -11.3334 -11.3334 -11.1838 -11.1838 -0.3964 -0.3964 -0.3440 -0.3440 -0.0008 -0.0008 0.2745 0.2745 0.3729 0.3729 0.5834 0.5834 2.6207 2.6207 2.6831 2.6831 2.6961 2.6961 7.9374 7.9374 7.9527 7.9527 8.8377 8.8377 9.0684 9.0684 9.6754 9.6754 10.2006 10.2006 k = 0.1857 0.2571 1.1054 ( 9544 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0019 -20.0019 -19.9990 -19.9990 -19.8462 -19.8462 -19.8451 -19.8451 -19.7787 -19.7787 -19.7634 -19.7634 -19.2383 -19.2383 -19.2091 -19.2091 -19.0925 -19.0925 -19.0492 -19.0492 -18.9898 -18.9898 -18.8608 -18.8608 -11.3464 -11.3464 -11.3323 -11.3323 -11.1804 -11.1804 -0.3995 -0.3995 -0.3460 -0.3460 0.0032 0.0032 0.2662 0.2662 0.3647 0.3647 0.5758 0.5758 2.6180 2.6180 2.6749 2.6749 2.6882 2.6882 7.9149 7.9149 7.9313 7.9313 8.8666 8.8666 9.0492 9.0492 9.6701 9.6701 10.2337 10.2337 k = 0.1929 0.2405 1.1236 ( 9548 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0020 -20.0020 -19.9990 -19.9990 -19.8463 -19.8463 -19.8451 -19.8451 -19.7788 -19.7788 -19.7634 -19.7634 -19.2388 -19.2388 -19.2091 -19.2091 -19.0928 -19.0928 -19.0489 -19.0489 -18.9910 -18.9910 -18.8598 -18.8598 -11.3451 -11.3451 -11.3312 -11.3312 -11.1773 -11.1773 -0.4031 -0.4031 -0.3490 -0.3490 0.0092 0.0092 0.2595 0.2595 0.3565 0.3565 0.5687 0.5687 2.6156 2.6156 2.6672 2.6672 2.6809 2.6809 7.8826 7.8826 7.9226 7.9226 8.8901 8.8901 9.0312 9.0312 9.6656 9.6656 10.2632 10.2632 k = 0.2000 0.2238 1.1417 ( 9552 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0020 -20.0020 -19.9990 -19.9990 -19.8463 -19.8463 -19.8451 -19.8451 -19.7789 -19.7789 -19.7633 -19.7633 -19.2392 -19.2392 -19.2091 -19.2091 -19.0930 -19.0930 -19.0486 -19.0486 -18.9920 -18.9920 -18.8590 -18.8590 -11.3439 -11.3439 -11.3303 -11.3303 -11.1746 -11.1746 -0.4070 -0.4070 -0.3526 -0.3526 0.0165 0.0165 0.2544 0.2544 0.3481 0.3481 0.5622 0.5622 2.6138 2.6138 2.6600 2.6600 2.6741 2.6741 7.8533 7.8533 7.9144 7.9144 8.9088 8.9088 9.0147 9.0147 9.6619 9.6619 10.2889 10.2889 k = 0.2071 0.2071 1.1598 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8451 -19.8451 -19.7790 -19.7790 -19.7633 -19.7633 -19.2396 -19.2396 -19.2092 -19.2092 -19.0932 -19.0932 -19.0483 -19.0483 -18.9929 -18.9929 -18.8583 -18.8583 -11.3429 -11.3429 -11.3295 -11.3295 -11.1721 -11.1721 -0.4111 -0.4111 -0.3563 -0.3563 0.0246 0.0246 0.2507 0.2507 0.3398 0.3398 0.5564 0.5564 2.6125 2.6125 2.6536 2.6536 2.6678 2.6678 7.8275 7.8275 7.9067 7.9067 8.9233 8.9233 8.9999 8.9999 9.6587 9.6587 10.3111 10.3111 k = 0.2143 0.1905 1.1779 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7791 -19.7791 -19.7633 -19.7633 -19.2400 -19.2400 -19.2092 -19.2092 -19.0934 -19.0934 -19.0481 -19.0481 -18.9936 -18.9936 -18.8577 -18.8577 -11.3420 -11.3420 -11.3288 -11.3288 -11.1700 -11.1700 -0.4150 -0.4150 -0.3599 -0.3599 0.0329 0.0329 0.2483 0.2483 0.3316 0.3316 0.5512 0.5512 2.6117 2.6117 2.6480 2.6480 2.6620 2.6620 7.8055 7.8055 7.8997 7.8997 8.9342 8.9342 8.9873 8.9873 9.6562 9.6562 10.3300 10.3300 k = 0.2214 0.1738 1.1961 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7633 -19.7633 -19.2402 -19.2402 -19.2092 -19.2092 -19.0936 -19.0936 -19.0479 -19.0479 -18.9943 -18.9943 -18.8572 -18.8572 -11.3413 -11.3413 -11.3283 -11.3283 -11.1682 -11.1682 -0.4186 -0.4186 -0.3631 -0.3631 0.0407 0.0407 0.2471 0.2471 0.3240 0.3240 0.5469 0.5469 2.6114 2.6114 2.6433 2.6433 2.6570 2.6570 7.7873 7.7873 7.8937 7.8937 8.9420 8.9420 8.9770 8.9770 9.6542 9.6542 10.3458 10.3458 k = 0.2286 0.1572 1.2142 ( 9558 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2404 -19.2404 -19.2092 -19.2092 -19.0937 -19.0937 -19.0478 -19.0478 -18.9947 -18.9947 -18.8568 -18.8568 -11.3407 -11.3407 -11.3278 -11.3278 -11.1668 -11.1668 -0.4217 -0.4217 -0.3657 -0.3657 0.0474 0.0474 0.2468 0.2468 0.3172 0.3172 0.5435 0.5435 2.6116 2.6116 2.6395 2.6395 2.6528 2.6528 7.7730 7.7730 7.8888 7.8888 8.9470 8.9470 8.9693 8.9693 9.6527 9.6527 10.3584 10.3584 k = 0.2357 0.1405 1.2323 ( 9560 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2406 -19.2406 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9951 -18.9951 -18.8566 -18.8566 -11.3403 -11.3403 -11.3275 -11.3275 -11.1658 -11.1658 -0.4240 -0.4240 -0.3677 -0.3677 0.0526 0.0526 0.2470 0.2470 0.3116 0.3116 0.5410 0.5410 2.6120 2.6120 2.6366 2.6366 2.6495 2.6495 7.7628 7.7628 7.8853 7.8853 8.9493 8.9493 8.9647 8.9647 9.6516 9.6516 10.3676 10.3676 k = 0.2429 0.1239 1.2504 ( 9566 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9953 -18.9953 -18.8564 -18.8564 -11.3400 -11.3400 -11.3273 -11.3273 -11.1652 -11.1652 -0.4254 -0.4254 -0.3689 -0.3689 0.0559 0.0559 0.2475 0.2475 0.3080 0.3080 0.5395 0.5395 2.6124 2.6124 2.6348 2.6348 2.6475 2.6475 7.7566 7.7566 7.8831 7.8831 8.9496 8.9496 8.9629 8.9629 9.6510 9.6510 10.3732 10.3732 k = 0.2500 0.1072 1.2685 ( 9564 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0939 -19.0939 -19.0477 -19.0477 -18.9953 -18.9953 -18.8563 -18.8563 -11.3399 -11.3399 -11.3272 -11.3272 -11.1650 -11.1650 -0.4259 -0.4259 -0.3693 -0.3693 0.0570 0.0570 0.2476 0.2476 0.3067 0.3067 0.5390 0.5390 2.6125 2.6125 2.6341 2.6341 2.6468 2.6468 7.7546 7.7546 7.8823 7.8823 8.9495 8.9495 8.9626 8.9626 9.6508 9.6508 10.3751 10.3751 k = 0.2500 0.1072 1.2685 ( 9564 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0939 -19.0939 -19.0477 -19.0477 -18.9953 -18.9953 -18.8563 -18.8563 -11.3399 -11.3399 -11.3272 -11.3272 -11.1650 -11.1650 -0.4259 -0.4259 -0.3693 -0.3693 0.0570 0.0570 0.2476 0.2476 0.3067 0.3067 0.5390 0.5390 2.6125 2.6125 2.6341 2.6341 2.6468 2.6468 7.7546 7.7546 7.8823 7.8823 8.9495 8.9495 8.9626 8.9626 9.6508 9.6508 10.3751 10.3751 k = 0.2708 0.1162 1.2588 ( 9562 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9953 -18.9953 -18.8564 -18.8564 -11.3400 -11.3400 -11.3272 -11.3272 -11.1651 -11.1651 -0.4266 -0.4266 -0.3684 -0.3684 0.0571 0.0571 0.2444 0.2444 0.3098 0.3098 0.5389 0.5389 2.6125 2.6125 2.6324 2.6324 2.6488 2.6488 7.7374 7.7374 7.9028 7.9028 8.9317 8.9317 8.9816 8.9816 9.6452 9.6452 10.3597 10.3597 k = 0.2917 0.1251 1.2491 ( 9562 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9953 -18.9953 -18.8564 -18.8564 -11.3400 -11.3400 -11.3272 -11.3272 -11.1652 -11.1652 -0.4283 -0.4283 -0.3658 -0.3658 0.0573 0.0573 0.2366 0.2366 0.3176 0.3176 0.5385 0.5385 2.6123 2.6123 2.6289 2.6289 2.6530 2.6530 7.7026 7.7026 7.9473 7.9473 8.9104 8.9104 9.0066 9.0066 9.6284 9.6284 10.3272 10.3272 k = 0.3125 0.1340 1.2394 ( 9550 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9952 -18.9952 -18.8564 -18.8564 -11.3401 -11.3401 -11.3272 -11.3272 -11.1653 -11.1653 -0.4307 -0.4307 -0.3619 -0.3619 0.0573 0.0573 0.2268 0.2268 0.3276 0.3276 0.5379 0.5379 2.6119 2.6119 2.6253 2.6253 2.6578 2.6578 7.6654 7.6654 8.0006 8.0006 8.8907 8.8907 9.0325 9.0325 9.6012 9.6012 10.2900 10.2900 k = 0.3333 0.1430 1.2297 ( 9556 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9952 -18.9952 -18.8565 -18.8565 -11.3403 -11.3403 -11.3272 -11.3272 -11.1655 -11.1655 -0.4334 -0.4334 -0.3573 -0.3573 0.0569 0.0569 0.2170 0.2170 0.3382 0.3382 0.5371 0.5371 2.6110 2.6110 2.6225 2.6225 2.6625 2.6625 7.6306 7.6306 8.0576 8.0576 8.8730 8.8730 9.0587 9.0587 9.5649 9.5649 10.2521 10.2521 k = 0.3542 0.1519 1.2199 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7793 -19.7793 -19.7633 -19.7633 -19.2406 -19.2406 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9951 -18.9951 -18.8565 -18.8565 -11.3404 -11.3404 -11.3272 -11.3272 -11.1658 -11.1658 -0.4361 -0.4361 -0.3524 -0.3524 0.0560 0.0560 0.2083 0.2083 0.3487 0.3487 0.5362 0.5362 2.6094 2.6094 2.6209 2.6209 2.6668 2.6668 7.5997 7.5997 8.1161 8.1161 8.8575 8.8575 9.0845 9.0845 9.5212 9.5212 10.2152 10.2152 k = 0.3750 0.1608 1.2102 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7632 -19.7632 -19.2406 -19.2406 -19.2092 -19.2092 -19.0937 -19.0937 -19.0477 -19.0477 -18.9950 -18.9950 -18.8566 -18.8566 -11.3405 -11.3405 -11.3273 -11.3273 -11.1662 -11.1662 -0.4385 -0.4385 -0.3475 -0.3475 0.0542 0.0542 0.2012 0.2012 0.3587 0.3587 0.5351 0.5351 2.6073 2.6073 2.6205 2.6205 2.6705 2.6705 7.5737 7.5737 8.1746 8.1746 8.8443 8.8443 9.1096 9.1096 9.4722 9.4722 10.1805 10.1805 k = 0.3958 0.1698 1.2005 ( 9548 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2405 -19.2405 -19.2092 -19.2092 -19.0937 -19.0937 -19.0478 -19.0478 -18.9949 -18.9949 -18.8567 -18.8567 -11.3406 -11.3406 -11.3274 -11.3274 -11.1666 -11.1666 -0.4405 -0.4405 -0.3429 -0.3429 0.0514 0.0514 0.1964 0.1964 0.3679 0.3679 0.5341 0.5341 2.6053 2.6053 2.6208 2.6208 2.6736 2.6736 7.5529 7.5529 8.2315 8.2315 8.8335 8.8335 9.1330 9.1330 9.4205 9.4205 10.1490 10.1490 k = 0.4167 0.1787 1.1908 ( 9537 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2404 -19.2404 -19.2092 -19.2092 -19.0936 -19.0936 -19.0478 -19.0478 -18.9947 -18.9947 -18.8568 -18.8568 -11.3407 -11.3407 -11.3276 -11.3276 -11.1671 -11.1671 -0.4419 -0.4419 -0.3389 -0.3389 0.0476 0.0476 0.1940 0.1940 0.3760 0.3760 0.5331 0.5331 2.6035 2.6035 2.6216 2.6216 2.6759 2.6759 7.5377 7.5377 8.2850 8.2850 8.8253 8.8253 9.1542 9.1542 9.3687 9.3687 10.1216 10.1216 k = 0.4375 0.1876 1.1810 ( 9530 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7791 -19.7791 -19.7632 -19.7632 -19.2403 -19.2403 -19.2091 -19.2091 -19.0936 -19.0936 -19.0478 -19.0478 -18.9945 -18.9945 -18.8569 -18.8569 -11.3408 -11.3408 -11.3278 -11.3278 -11.1676 -11.1676 -0.4426 -0.4426 -0.3357 -0.3357 0.0428 0.0428 0.1941 0.1941 0.3829 0.3829 0.5325 0.5325 2.6023 2.6023 2.6227 2.6227 2.6775 2.6775 7.5282 7.5282 8.3325 8.3325 8.8196 8.8196 9.1721 9.1721 9.3201 9.3201 10.0991 10.0991 k = 0.4583 0.1966 1.1713 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7791 -19.7791 -19.7633 -19.7633 -19.2402 -19.2402 -19.2091 -19.2091 -19.0936 -19.0936 -19.0479 -19.0479 -18.9943 -18.9943 -18.8571 -18.8571 -11.3408 -11.3408 -11.3281 -11.3281 -11.1682 -11.1682 -0.4426 -0.4426 -0.3332 -0.3332 0.0374 0.0374 0.1966 0.1966 0.3884 0.3884 0.5321 0.5321 2.6018 2.6018 2.6239 2.6239 2.6783 2.6783 7.5244 7.5244 8.3713 8.3713 8.8165 8.8165 9.1857 9.1857 9.2786 9.2786 10.0822 10.0822 k = 0.4792 0.2055 1.1616 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7790 -19.7790 -19.7633 -19.7633 -19.2402 -19.2402 -19.2091 -19.2091 -19.0935 -19.0935 -19.0479 -19.0479 -18.9941 -18.9941 -18.8572 -18.8572 -11.3409 -11.3409 -11.3285 -11.3285 -11.1689 -11.1689 -0.4419 -0.4419 -0.3317 -0.3317 0.0315 0.0315 0.2011 0.2011 0.3925 0.3925 0.5322 0.5322 2.6020 2.6020 2.6251 2.6251 2.6786 2.6786 7.5265 7.5265 8.3979 8.3979 8.8160 8.8160 9.1934 9.1934 9.2487 9.2487 10.0714 10.0714 k = 0.5000 0.2144 1.1519 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7790 -19.7790 -19.7633 -19.7633 -19.2401 -19.2401 -19.2091 -19.2091 -19.0934 -19.0934 -19.0480 -19.0480 -18.9939 -18.9939 -18.8574 -18.8574 -11.3409 -11.3409 -11.3289 -11.3289 -11.1696 -11.1696 -0.4404 -0.4404 -0.3310 -0.3310 0.0255 0.0255 0.2074 0.2074 0.3950 0.3950 0.5327 0.5327 2.6029 2.6029 2.6263 2.6263 2.6783 2.6783 7.5343 7.5343 8.4095 8.4095 8.8182 8.8182 9.1933 9.1933 9.2353 9.2353 10.0671 10.0671 k = 0.5000 0.2144 1.1519 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1182 -47.1182 -47.1180 -47.1180 -20.0021 -20.0021 -19.9990 -19.9990 -19.8464 -19.8464 -19.8452 -19.8452 -19.7790 -19.7790 -19.7633 -19.7633 -19.2401 -19.2401 -19.2091 -19.2091 -19.0934 -19.0934 -19.0480 -19.0480 -18.9939 -18.9939 -18.8574 -18.8574 -11.3409 -11.3409 -11.3289 -11.3289 -11.1696 -11.1696 -0.4404 -0.4404 -0.3310 -0.3310 0.0255 0.0255 0.2074 0.2074 0.3950 0.3950 0.5327 0.5327 2.6029 2.6029 2.6263 2.6263 2.6783 2.6783 7.5343 7.5343 8.4095 8.4095 8.8182 8.8182 9.1933 9.1933 9.2353 9.2353 10.0671 10.0671 k = 0.5000 0.2144 1.1263 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1183 -47.1183 -47.1179 -47.1179 -20.0020 -20.0020 -19.9990 -19.9990 -19.8463 -19.8463 -19.8451 -19.8451 -19.7789 -19.7789 -19.7633 -19.7633 -19.2398 -19.2398 -19.2091 -19.2091 -19.0933 -19.0933 -19.0482 -19.0482 -18.9932 -18.9932 -18.8580 -18.8580 -11.3409 -11.3409 -11.3302 -11.3302 -11.1718 -11.1718 -0.4350 -0.4350 -0.3303 -0.3303 0.0101 0.0101 0.2257 0.2257 0.4000 0.4000 0.5351 0.5351 2.6069 2.6069 2.6296 2.6296 2.6772 2.6772 7.5654 7.5654 8.4186 8.4186 8.8283 8.8283 9.1722 9.1722 9.2312 9.2312 10.0645 10.0645 k = 0.5000 0.2144 1.1007 ( 9516 PWs) bands (ev): -47.9378 -47.9378 -47.9377 -47.9377 -47.1183 -47.1183 -47.1179 -47.1179 -20.0020 -20.0020 -19.9990 -19.9990 -19.8463 -19.8463 -19.8451 -19.8451 -19.7788 -19.7788 -19.7634 -19.7634 -19.2394 -19.2394 -19.2091 -19.2091 -19.0931 -19.0931 -19.0484 -19.0484 -18.9924 -18.9924 -18.8586 -18.8586 -11.3410 -11.3410 -11.3318 -11.3318 -11.1743 -11.1743 -0.4286 -0.4286 -0.3293 -0.3293 -0.0044 -0.0044 0.2437 0.2437 0.4059 0.4059 0.5379 0.5379 2.6115 2.6115 2.6336 2.6336 2.6762 2.6762 7.6020 7.6020 8.4286 8.4286 8.8403 8.8403 9.1360 9.1360 9.2369 9.2369 10.0626 10.0626 k = 0.5000 0.2144 1.0751 ( 9532 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1184 -47.1184 -47.1178 -47.1178 -20.0019 -20.0019 -19.9990 -19.9990 -19.8463 -19.8463 -19.8452 -19.8452 -19.7787 -19.7787 -19.7634 -19.7634 -19.2390 -19.2390 -19.2091 -19.2091 -19.0929 -19.0929 -19.0487 -19.0487 -18.9914 -18.9914 -18.8594 -18.8594 -11.3411 -11.3411 -11.3336 -11.3336 -11.1772 -11.1772 -0.4213 -0.4213 -0.3280 -0.3280 -0.0177 -0.0177 0.2612 0.2612 0.4124 0.4124 0.5412 0.5412 2.6169 2.6169 2.6382 2.6382 2.6753 2.6753 7.6439 7.6439 8.4386 8.4386 8.8543 8.8543 9.0912 9.0912 9.2456 9.2456 10.0616 10.0616 k = 0.5000 0.2144 1.0495 ( 9544 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1185 -47.1185 -47.1177 -47.1177 -20.0019 -20.0019 -19.9990 -19.9990 -19.8462 -19.8462 -19.8452 -19.8452 -19.7786 -19.7786 -19.7635 -19.7635 -19.2386 -19.2386 -19.2091 -19.2091 -19.0926 -19.0926 -19.0491 -19.0491 -18.9903 -18.9903 -18.8602 -18.8602 -11.3413 -11.3413 -11.3357 -11.3357 -11.1804 -11.1804 -0.4132 -0.4132 -0.3263 -0.3263 -0.0297 -0.0297 0.2781 0.2781 0.4195 0.4195 0.5450 0.5450 2.6229 2.6229 2.6434 2.6434 2.6748 2.6748 7.6907 7.6907 8.4478 8.4478 8.8701 8.8701 9.0401 9.0401 9.2555 9.2555 10.0618 10.0618 k = 0.5000 0.2144 1.0239 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1186 -47.1186 -47.1176 -47.1176 -20.0018 -20.0018 -19.9990 -19.9990 -19.8461 -19.8461 -19.8451 -19.8451 -19.7784 -19.7784 -19.7636 -19.7636 -19.2381 -19.2381 -19.2090 -19.2090 -19.0924 -19.0924 -19.0494 -19.0494 -18.9891 -18.9891 -18.8611 -18.8611 -11.3416 -11.3416 -11.3380 -11.3380 -11.1840 -11.1840 -0.4043 -0.4043 -0.3243 -0.3243 -0.0401 -0.0401 0.2944 0.2944 0.4268 0.4268 0.5493 0.5493 2.6297 2.6297 2.6491 2.6491 2.6749 2.6749 7.7420 7.7420 8.4550 8.4550 8.8875 8.8875 8.9840 8.9840 9.2658 9.2658 10.0632 10.0632 k = 0.5000 0.2144 0.9983 ( 9544 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1187 -47.1187 -47.1175 -47.1175 -20.0017 -20.0017 -19.9991 -19.9991 -19.8460 -19.8460 -19.8452 -19.8452 -19.7783 -19.7783 -19.7637 -19.7637 -19.2376 -19.2376 -19.2090 -19.2090 -19.0921 -19.0921 -19.0499 -19.0499 -18.9877 -18.9877 -18.8621 -18.8621 -11.3420 -11.3420 -11.3405 -11.3405 -11.1878 -11.1878 -0.3947 -0.3947 -0.3217 -0.3217 -0.0489 -0.0489 0.3101 0.3101 0.4342 0.4342 0.5541 0.5541 2.6369 2.6369 2.6553 2.6553 2.6756 2.6756 7.7972 7.7972 8.4589 8.4589 8.9029 8.9029 8.9272 8.9272 9.2765 9.2765 10.0657 10.0657 k = 0.5000 0.2144 0.9727 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1188 -47.1188 -47.1174 -47.1174 -20.0016 -20.0016 -19.9991 -19.9991 -19.8459 -19.8459 -19.8452 -19.8452 -19.7781 -19.7781 -19.7638 -19.7638 -19.2370 -19.2370 -19.2090 -19.2090 -19.0917 -19.0917 -19.0503 -19.0503 -18.9861 -18.9861 -18.8632 -18.8632 -11.3432 -11.3432 -11.3425 -11.3425 -11.1918 -11.1918 -0.3846 -0.3846 -0.3186 -0.3186 -0.0558 -0.0558 0.3253 0.3253 0.4412 0.4412 0.5596 0.5596 2.6448 2.6448 2.6619 2.6619 2.6773 2.6773 7.8558 7.8558 8.4577 8.4577 8.8552 8.8552 8.9315 8.9315 9.2881 9.2881 10.0693 10.0693 k = 0.5000 0.2144 0.9471 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1189 -47.1189 -47.1173 -47.1173 -20.0015 -20.0015 -19.9991 -19.9991 -19.8458 -19.8458 -19.8451 -19.8451 -19.7779 -19.7779 -19.7639 -19.7639 -19.2364 -19.2364 -19.2090 -19.2090 -19.0914 -19.0914 -19.0508 -19.0508 -18.9845 -18.9845 -18.8643 -18.8643 -11.3462 -11.3462 -11.3431 -11.3431 -11.1960 -11.1960 -0.3739 -0.3739 -0.3150 -0.3150 -0.0607 -0.0607 0.3400 0.3400 0.4478 0.4478 0.5657 0.5657 2.6531 2.6531 2.6686 2.6686 2.6802 2.6802 7.9170 7.9170 8.4498 8.4498 8.7876 8.7876 8.9542 8.9542 9.3014 9.3014 10.0737 10.0737 k = 0.5000 0.2144 0.9215 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1191 -47.1191 -47.1172 -47.1172 -20.0014 -20.0014 -19.9991 -19.9991 -19.8457 -19.8457 -19.8451 -19.8451 -19.7777 -19.7777 -19.7639 -19.7639 -19.2358 -19.2358 -19.2090 -19.2090 -19.0910 -19.0910 -19.0514 -19.0514 -18.9827 -18.9827 -18.8655 -18.8655 -11.3494 -11.3494 -11.3439 -11.3439 -11.2004 -11.2004 -0.3630 -0.3630 -0.3107 -0.3107 -0.0636 -0.0636 0.3544 0.3544 0.4537 0.4537 0.5724 0.5724 2.6617 2.6617 2.6752 2.6752 2.6848 2.6848 7.9800 7.9800 8.4335 8.4335 8.7172 8.7172 8.9792 8.9792 9.3177 9.3177 10.0786 10.0786 k = 0.5000 0.2144 0.8959 ( 9552 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1192 -47.1192 -47.1170 -47.1170 -20.0014 -20.0014 -19.9991 -19.9991 -19.8457 -19.8457 -19.8452 -19.8452 -19.7775 -19.7775 -19.7640 -19.7640 -19.2352 -19.2352 -19.2090 -19.2090 -19.0906 -19.0906 -19.0521 -19.0521 -18.9807 -18.9807 -18.8668 -18.8668 -11.3527 -11.3527 -11.3450 -11.3450 -11.2049 -11.2049 -0.3517 -0.3517 -0.3059 -0.3059 -0.0642 -0.0642 0.3683 0.3683 0.4589 0.4589 0.5797 0.5797 2.6706 2.6706 2.6814 2.6814 2.6913 2.6913 8.0436 8.0436 8.4074 8.4074 8.6451 8.6451 9.0059 9.0059 9.3383 9.3383 10.0838 10.0838 k = 0.5000 0.2144 0.8703 ( 9548 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1194 -47.1194 -47.1169 -47.1169 -20.0012 -20.0012 -19.9991 -19.9991 -19.8455 -19.8455 -19.8451 -19.8451 -19.7772 -19.7772 -19.7641 -19.7641 -19.2346 -19.2346 -19.2090 -19.2090 -19.0901 -19.0901 -19.0527 -19.0527 -18.9787 -18.9787 -18.8681 -18.8681 -11.3563 -11.3563 -11.3463 -11.3463 -11.2094 -11.2094 -0.3403 -0.3403 -0.3004 -0.3004 -0.0625 -0.0625 0.3819 0.3819 0.4633 0.4633 0.5874 0.5874 2.6795 2.6795 2.6880 2.6880 2.6992 2.6992 8.1061 8.1061 8.3709 8.3709 8.5727 8.5727 9.0340 9.0340 9.3647 9.3647 10.0890 10.0890 k = 0.5000 0.2144 0.8447 ( 9548 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1195 -47.1195 -47.1167 -47.1167 -20.0012 -20.0012 -19.9991 -19.9991 -19.8455 -19.8455 -19.8451 -19.8451 -19.7770 -19.7770 -19.7642 -19.7642 -19.2340 -19.2340 -19.2091 -19.2091 -19.0897 -19.0897 -19.0534 -19.0534 -18.9765 -18.9765 -18.8694 -18.8694 -11.3600 -11.3600 -11.3479 -11.3479 -11.2138 -11.2138 -0.3288 -0.3288 -0.2942 -0.2942 -0.0584 -0.0584 0.3951 0.3951 0.4670 0.4670 0.5955 0.5955 2.6883 2.6883 2.6955 2.6955 2.7082 2.7082 8.1645 8.1645 8.3241 8.3241 8.5022 8.5022 9.0635 9.0635 9.3976 9.3976 10.0933 10.0933 k = 0.5000 0.2144 0.8191 ( 9550 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1197 -47.1197 -47.1166 -47.1166 -20.0010 -20.0010 -19.9991 -19.9991 -19.8453 -19.8453 -19.8451 -19.8451 -19.7767 -19.7767 -19.7643 -19.7643 -19.2334 -19.2334 -19.2091 -19.2091 -19.0892 -19.0892 -19.0542 -19.0542 -18.9742 -18.9742 -18.8708 -18.8708 -11.3639 -11.3639 -11.3498 -11.3498 -11.2182 -11.2182 -0.3174 -0.3174 -0.2874 -0.2874 -0.0519 -0.0519 0.4078 0.4078 0.4704 0.4704 0.6038 0.6038 2.6970 2.6970 2.7037 2.7037 2.7178 2.7178 8.2105 8.2105 8.2689 8.2689 8.4398 8.4398 9.0939 9.0939 9.4375 9.4375 10.0880 10.0880 k = 0.5000 0.2144 0.7935 ( 9562 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1198 -47.1198 -47.1165 -47.1165 -20.0009 -20.0009 -19.9991 -19.9991 -19.8452 -19.8452 -19.8451 -19.8451 -19.7765 -19.7765 -19.7645 -19.7645 -19.2328 -19.2328 -19.2091 -19.2091 -19.0887 -19.0887 -19.0550 -19.0550 -18.9718 -18.9718 -18.8722 -18.8722 -11.3679 -11.3679 -11.3521 -11.3521 -11.2225 -11.2225 -0.3060 -0.3060 -0.2798 -0.2798 -0.0430 -0.0430 0.4196 0.4196 0.4738 0.4738 0.6123 0.6123 2.7060 2.7060 2.7124 2.7124 2.7282 2.7282 8.1962 8.1962 8.2344 8.2344 8.4044 8.4044 9.1248 9.1248 9.4844 9.4844 10.0315 10.0315 k = 0.5000 0.2144 0.7679 ( 9550 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1200 -47.1200 -47.1163 -47.1163 -20.0007 -20.0007 -19.9991 -19.9991 -19.8451 -19.8451 -19.8450 -19.8450 -19.7762 -19.7762 -19.7645 -19.7645 -19.2322 -19.2322 -19.2091 -19.2091 -19.0882 -19.0882 -19.0558 -19.0558 -18.9693 -18.9693 -18.8737 -18.8737 -11.3721 -11.3721 -11.3547 -11.3547 -11.2266 -11.2266 -0.2949 -0.2949 -0.2714 -0.2714 -0.0318 -0.0318 0.4302 0.4302 0.4777 0.4777 0.6209 0.6209 2.7155 2.7155 2.7211 2.7211 2.7392 2.7392 8.1259 8.1259 8.1979 8.1979 8.4151 8.4151 9.1554 9.1554 9.5380 9.5380 9.9617 9.9617 k = 0.5000 0.2144 0.7423 ( 9554 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1201 -47.1201 -47.1161 -47.1161 -20.0006 -20.0006 -19.9991 -19.9991 -19.8451 -19.8451 -19.8449 -19.8449 -19.7760 -19.7760 -19.7647 -19.7647 -19.2316 -19.2316 -19.2092 -19.2092 -19.0877 -19.0877 -19.0566 -19.0566 -18.9667 -18.9667 -18.8751 -18.8751 -11.3764 -11.3764 -11.3578 -11.3578 -11.2305 -11.2305 -0.2840 -0.2840 -0.2621 -0.2621 -0.0185 -0.0185 0.4390 0.4390 0.4828 0.4828 0.6295 0.6295 2.7251 2.7251 2.7300 2.7300 2.7508 2.7508 8.0478 8.0478 8.1343 8.1343 8.4486 8.4486 9.1845 9.1845 9.5979 9.5979 9.8925 9.8925 k = 0.5000 0.2144 0.7167 ( 9538 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1203 -47.1203 -47.1160 -47.1160 -20.0004 -20.0004 -19.9991 -19.9991 -19.8451 -19.8451 -19.8447 -19.8447 -19.7757 -19.7757 -19.7648 -19.7648 -19.2310 -19.2310 -19.2092 -19.2092 -19.0871 -19.0871 -19.0574 -19.0574 -18.9640 -18.9640 -18.8764 -18.8764 -11.3807 -11.3807 -11.3612 -11.3612 -11.2341 -11.2341 -0.2734 -0.2734 -0.2519 -0.2519 -0.0031 -0.0031 0.4457 0.4457 0.4897 0.4897 0.6381 0.6381 2.7336 2.7336 2.7402 2.7402 2.7628 2.7628 7.9652 7.9652 8.0618 8.0618 8.4837 8.4837 9.2103 9.2103 9.6636 9.6636 9.8271 9.8271 k = 0.5000 0.2144 0.6911 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1205 -47.1205 -47.1158 -47.1158 -20.0003 -20.0003 -19.9991 -19.9991 -19.8451 -19.8451 -19.8446 -19.8446 -19.7754 -19.7754 -19.7649 -19.7649 -19.2305 -19.2305 -19.2092 -19.2092 -19.0866 -19.0866 -19.0583 -19.0583 -18.9613 -18.9613 -18.8779 -18.8779 -11.3852 -11.3852 -11.3651 -11.3651 -11.2373 -11.2373 -0.2631 -0.2631 -0.2409 -0.2409 0.0140 0.0140 0.4502 0.4502 0.4981 0.4981 0.6469 0.6469 2.7406 2.7406 2.7519 2.7519 2.7753 2.7753 7.8795 7.8795 7.9862 7.9862 8.5134 8.5134 9.2295 9.2295 9.7345 9.7345 9.7692 9.7692 k = 0.5000 0.2144 0.6655 ( 9542 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1207 -47.1207 -47.1156 -47.1156 -20.0001 -20.0001 -19.9992 -19.9992 -19.8451 -19.8451 -19.8444 -19.8444 -19.7751 -19.7751 -19.7651 -19.7651 -19.2300 -19.2300 -19.2093 -19.2093 -19.0861 -19.0861 -19.0592 -19.0592 -18.9585 -18.9585 -18.8793 -18.8793 -11.3897 -11.3897 -11.3694 -11.3694 -11.2403 -11.2403 -0.2530 -0.2530 -0.2290 -0.2290 0.0327 0.0327 0.4534 0.4534 0.5076 0.5076 0.6560 0.6560 2.7463 2.7463 2.7646 2.7646 2.7881 2.7881 7.7918 7.7918 7.9098 7.9098 8.5347 8.5347 9.2378 9.2378 9.7235 9.7235 9.8104 9.8104 k = 0.5000 0.2144 0.6399 ( 9546 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1208 -47.1208 -47.1155 -47.1155 -20.0000 -20.0000 -19.9992 -19.9992 -19.8451 -19.8451 -19.8442 -19.8442 -19.7749 -19.7749 -19.7652 -19.7652 -19.2296 -19.2296 -19.2094 -19.2094 -19.0856 -19.0856 -19.0601 -19.0601 -18.9557 -18.9557 -18.8806 -18.8806 -11.3943 -11.3943 -11.3741 -11.3741 -11.2430 -11.2430 -0.2429 -0.2429 -0.2166 -0.2166 0.0528 0.0528 0.4557 0.4557 0.5175 0.5175 0.6653 0.6653 2.7509 2.7509 2.7779 2.7779 2.8011 2.8011 7.7032 7.7032 7.8333 7.8333 8.5466 8.5466 9.2299 9.2299 9.6958 9.6958 9.8907 9.8907 k = 0.5000 0.2144 0.6143 ( 9546 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1210 -47.1210 -47.1153 -47.1153 -19.9998 -19.9998 -19.9992 -19.9992 -19.8451 -19.8451 -19.8441 -19.8441 -19.7746 -19.7746 -19.7653 -19.7653 -19.2292 -19.2292 -19.2094 -19.2094 -19.0850 -19.0850 -19.0610 -19.0610 -18.9529 -18.9529 -18.8819 -18.8819 -11.3989 -11.3989 -11.3791 -11.3791 -11.2453 -11.2453 -0.2327 -0.2327 -0.2036 -0.2036 0.0741 0.0741 0.4579 0.4579 0.5274 0.5274 0.6752 0.6752 2.7543 2.7543 2.7916 2.7916 2.8143 2.8143 7.6146 7.6146 7.7573 7.7573 8.5490 8.5490 9.2030 9.2030 9.6890 9.6890 9.9750 9.9750 k = 0.5000 0.2144 0.5887 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1212 -47.1212 -47.1151 -47.1151 -19.9996 -19.9996 -19.9992 -19.9992 -19.8450 -19.8450 -19.8439 -19.8439 -19.7743 -19.7743 -19.7654 -19.7654 -19.2288 -19.2288 -19.2094 -19.2094 -19.0845 -19.0845 -19.0618 -19.0618 -18.9501 -18.9501 -18.8832 -18.8832 -11.4036 -11.4036 -11.3845 -11.3845 -11.2474 -11.2474 -0.2226 -0.2226 -0.1902 -0.1902 0.0962 0.0962 0.4601 0.4601 0.5369 0.5369 0.6857 0.6857 2.7564 2.7564 2.8056 2.8056 2.8277 2.8277 7.5266 7.5266 7.6822 7.6822 8.5424 8.5424 9.1588 9.1588 9.7019 9.7019 10.0630 10.0630 k = 0.5000 0.2144 0.5631 ( 9534 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1214 -47.1214 -47.1149 -47.1149 -19.9995 -19.9995 -19.9991 -19.9991 -19.8450 -19.8450 -19.8437 -19.8437 -19.7740 -19.7740 -19.7655 -19.7655 -19.2285 -19.2285 -19.2095 -19.2095 -19.0840 -19.0840 -19.0627 -19.0627 -18.9473 -18.9473 -18.8844 -18.8844 -11.4082 -11.4082 -11.3901 -11.3901 -11.2491 -11.2491 -0.2124 -0.2124 -0.1765 -0.1765 0.1191 0.1191 0.4627 0.4627 0.5459 0.5459 0.6969 0.6969 2.7571 2.7571 2.8197 2.8197 2.8412 2.8412 7.4398 7.4398 7.6081 7.6081 8.5281 8.5281 9.1021 9.1021 9.7298 9.7298 10.1543 10.1543 k = 0.5000 0.2144 0.5375 ( 9528 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1215 -47.1215 -47.1148 -47.1148 -19.9993 -19.9993 -19.9991 -19.9991 -19.8450 -19.8450 -19.8436 -19.8436 -19.7737 -19.7737 -19.7656 -19.7656 -19.2283 -19.2283 -19.2095 -19.2095 -19.0835 -19.0835 -19.0635 -19.0635 -18.9446 -18.9446 -18.8855 -18.8855 -11.4128 -11.4128 -11.3958 -11.3958 -11.2506 -11.2506 -0.2023 -0.2023 -0.1626 -0.1626 0.1424 0.1424 0.4659 0.4659 0.5543 0.5543 0.7089 0.7089 2.7564 2.7564 2.8337 2.8337 2.8547 2.8547 7.3549 7.3549 7.5354 7.5354 8.5075 8.5075 9.0376 9.0376 9.7684 9.7684 10.1636 10.1636 k = 0.5000 0.2144 0.5119 ( 9522 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1217 -47.1217 -47.1146 -47.1146 -19.9992 -19.9992 -19.9991 -19.9991 -19.8450 -19.8450 -19.8434 -19.8434 -19.7735 -19.7735 -19.7657 -19.7657 -19.2281 -19.2281 -19.2095 -19.2095 -19.0831 -19.0831 -19.0643 -19.0643 -18.9419 -18.9419 -18.8865 -18.8865 -11.4173 -11.4173 -11.4018 -11.4018 -11.2519 -11.2519 -0.1924 -0.1924 -0.1484 -0.1484 0.1659 0.1659 0.4697 0.4697 0.5621 0.5621 0.7217 0.7217 2.7541 2.7541 2.8475 2.8475 2.8681 2.8681 7.2722 7.2722 7.4642 7.4642 8.4820 8.4820 8.9688 8.9688 9.8145 9.8145 10.1275 10.1275 k = 0.5000 0.2144 0.4863 ( 9522 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1219 -47.1219 -47.1144 -47.1144 -19.9991 -19.9991 -19.9990 -19.9990 -19.8449 -19.8449 -19.8433 -19.8433 -19.7732 -19.7732 -19.7658 -19.7658 -19.2279 -19.2279 -19.2094 -19.2094 -19.0827 -19.0827 -19.0650 -19.0650 -18.9393 -18.9393 -18.8875 -18.8875 -11.4218 -11.4218 -11.4078 -11.4078 -11.2530 -11.2530 -0.1829 -0.1829 -0.1339 -0.1339 0.1893 0.1893 0.4742 0.4742 0.5696 0.5696 0.7352 0.7352 2.7502 2.7502 2.8610 2.8610 2.8815 2.8815 7.1921 7.1921 7.3946 7.3946 8.4531 8.4531 8.8980 8.8980 9.8658 9.8658 10.0917 10.0917 k = 0.5000 0.2144 0.4607 ( 9520 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1220 -47.1220 -47.1143 -47.1143 -19.9991 -19.9991 -19.9989 -19.9989 -19.8449 -19.8449 -19.8431 -19.8431 -19.7730 -19.7730 -19.7659 -19.7659 -19.2278 -19.2278 -19.2094 -19.2094 -19.0823 -19.0823 -19.0657 -19.0657 -18.9368 -18.9368 -18.8884 -18.8884 -11.4262 -11.4262 -11.4139 -11.4139 -11.2539 -11.2539 -0.1739 -0.1739 -0.1192 -0.1192 0.2125 0.2125 0.4793 0.4793 0.5770 0.5770 0.7493 0.7493 2.7447 2.7447 2.8741 2.8741 2.8947 2.8947 7.1150 7.1150 7.3270 7.3270 8.4220 8.4220 8.8267 8.8267 9.9210 9.9210 10.0563 10.0563 k = 0.5000 0.2144 0.4352 ( 9522 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1222 -47.1222 -47.1141 -47.1141 -19.9991 -19.9991 -19.9988 -19.9988 -19.8449 -19.8449 -19.8430 -19.8430 -19.7728 -19.7728 -19.7660 -19.7660 -19.2278 -19.2278 -19.2094 -19.2094 -19.0819 -19.0819 -19.0664 -19.0664 -18.9345 -18.9345 -18.8891 -18.8891 -11.4305 -11.4305 -11.4199 -11.4199 -11.2546 -11.2546 -0.1655 -0.1655 -0.1043 -0.1043 0.2350 0.2350 0.4851 0.4851 0.5844 0.5844 0.7641 0.7641 2.7375 2.7375 2.8867 2.8867 2.9076 2.9076 7.0412 7.0412 7.2615 7.2615 8.3899 8.3899 8.7560 8.7560 9.9793 9.9793 10.0218 10.0218 k = 0.5000 0.2144 0.4096 ( 9526 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1223 -47.1223 -47.1140 -47.1140 -19.9991 -19.9991 -19.9986 -19.9986 -19.8448 -19.8448 -19.8429 -19.8429 -19.7725 -19.7725 -19.7661 -19.7661 -19.2278 -19.2278 -19.2094 -19.2094 -19.0817 -19.0817 -19.0670 -19.0670 -18.9323 -18.9323 -18.8897 -18.8897 -11.4347 -11.4347 -11.4258 -11.4258 -11.2552 -11.2552 -0.1580 -0.1580 -0.0891 -0.0891 0.2567 0.2567 0.4913 0.4913 0.5922 0.5922 0.7794 0.7794 2.7288 2.7288 2.8987 2.8987 2.9201 2.9201 6.9709 6.9709 7.1983 7.1983 8.3577 8.3577 8.6867 8.6867 9.9881 9.9881 10.0400 10.0400 k = 0.5000 0.2144 0.3840 ( 9520 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1225 -47.1225 -47.1138 -47.1138 -19.9990 -19.9990 -19.9985 -19.9985 -19.8448 -19.8448 -19.8427 -19.8427 -19.7723 -19.7723 -19.7661 -19.7661 -19.2278 -19.2278 -19.2093 -19.2093 -19.0814 -19.0814 -19.0675 -19.0675 -18.9302 -18.9302 -18.8902 -18.8902 -11.4387 -11.4387 -11.4317 -11.4317 -11.2557 -11.2557 -0.1512 -0.1512 -0.0737 -0.0737 0.2771 0.2771 0.4979 0.4979 0.6006 0.6006 0.7950 0.7950 2.7186 2.7186 2.9102 2.9102 2.9322 2.9322 6.9044 6.9044 7.1375 7.1375 8.3260 8.3260 8.6194 8.6194 9.9556 9.9556 10.1025 10.1025 k = 0.5000 0.2144 0.3584 ( 9524 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1226 -47.1226 -47.1137 -47.1137 -19.9990 -19.9990 -19.9984 -19.9984 -19.8448 -19.8448 -19.8426 -19.8426 -19.7721 -19.7721 -19.7662 -19.7662 -19.2279 -19.2279 -19.2093 -19.2093 -19.0813 -19.0813 -19.0679 -19.0679 -18.9283 -18.9283 -18.8906 -18.8906 -11.4426 -11.4426 -11.4373 -11.4373 -11.2561 -11.2561 -0.1453 -0.1453 -0.0581 -0.0581 0.2961 0.2961 0.5047 0.5047 0.6097 0.6097 0.8110 0.8110 2.7069 2.7069 2.9211 2.9211 2.9437 2.9437 6.8418 6.8418 7.0794 7.0794 8.2954 8.2954 8.5546 8.5546 9.9244 9.9244 10.1662 10.1662 k = 0.5000 0.2144 0.3328 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1228 -47.1228 -47.1136 -47.1136 -19.9990 -19.9990 -19.9983 -19.9983 -19.8447 -19.8447 -19.8424 -19.8424 -19.7719 -19.7719 -19.7663 -19.7663 -19.2280 -19.2280 -19.2092 -19.2092 -19.0811 -19.0811 -19.0683 -19.0683 -18.9266 -18.9266 -18.8907 -18.8907 -11.4463 -11.4463 -11.4428 -11.4428 -11.2564 -11.2564 -0.1403 -0.1403 -0.0425 -0.0425 0.3133 0.3133 0.5116 0.5116 0.6198 0.6198 0.8272 0.8272 2.6940 2.6940 2.9314 2.9314 2.9545 2.9545 6.7833 6.7833 7.0243 7.0243 8.2665 8.2665 8.4926 8.4926 9.8945 9.8945 10.2308 10.2308 k = 0.5000 0.2144 0.3072 ( 9510 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1229 -47.1229 -47.1134 -47.1134 -19.9990 -19.9990 -19.9981 -19.9981 -19.8447 -19.8447 -19.8423 -19.8423 -19.7717 -19.7717 -19.7664 -19.7664 -19.2281 -19.2281 -19.2091 -19.2091 -19.0810 -19.0810 -19.0686 -19.0686 -18.9251 -18.9251 -18.8908 -18.8908 -11.4498 -11.4498 -11.4480 -11.4480 -11.2567 -11.2567 -0.1361 -0.1361 -0.0270 -0.0270 0.3285 0.3285 0.5186 0.5186 0.6307 0.6307 0.8436 0.8436 2.6801 2.6801 2.9410 2.9410 2.9647 2.9647 6.7290 6.7290 6.9722 6.9722 8.2394 8.2394 8.4340 8.4340 9.8662 9.8662 10.2957 10.2957 k = 0.5000 0.2144 0.2816 ( 9524 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1230 -47.1230 -47.1133 -47.1133 -19.9990 -19.9990 -19.9980 -19.9980 -19.8447 -19.8447 -19.8422 -19.8422 -19.7716 -19.7716 -19.7665 -19.7665 -19.2283 -19.2283 -19.2090 -19.2090 -19.0810 -19.0810 -19.0689 -19.0689 -18.9239 -18.9239 -18.8908 -18.8908 -11.4530 -11.4530 -11.4529 -11.4529 -11.2569 -11.2569 -0.1327 -0.1327 -0.0117 -0.0117 0.3415 0.3415 0.5255 0.5255 0.6423 0.6423 0.8599 0.8599 2.6652 2.6652 2.9500 2.9500 2.9740 2.9740 6.6789 6.6789 6.9233 6.9233 8.2143 8.2143 8.3788 8.3788 9.8396 9.8396 10.3605 10.3605 k = 0.5000 0.2144 0.2560 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1231 -47.1231 -47.1132 -47.1132 -19.9990 -19.9990 -19.9979 -19.9979 -19.8447 -19.8447 -19.8421 -19.8421 -19.7714 -19.7714 -19.7666 -19.7666 -19.2284 -19.2284 -19.2090 -19.2090 -19.0810 -19.0810 -19.0690 -19.0690 -18.9228 -18.9228 -18.8905 -18.8905 -11.4575 -11.4575 -11.4561 -11.4561 -11.2571 -11.2571 -0.1299 -0.1299 0.0032 0.0032 0.3523 0.3523 0.5325 0.5325 0.6543 0.6543 0.8762 0.8762 2.6499 2.6499 2.9582 2.9582 2.9827 2.9827 6.6332 6.6332 6.8780 6.8780 8.1916 8.1916 8.3276 8.3276 9.8148 9.8148 10.4244 10.4244 k = 0.5000 0.2144 0.2304 ( 9508 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1232 -47.1232 -47.1131 -47.1131 -19.9989 -19.9989 -19.9978 -19.9978 -19.8446 -19.8446 -19.8420 -19.8420 -19.7712 -19.7712 -19.7666 -19.7666 -19.2286 -19.2286 -19.2089 -19.2089 -19.0811 -19.0811 -19.0691 -19.0691 -18.9219 -18.9219 -18.8902 -18.8902 -11.4617 -11.4617 -11.4589 -11.4589 -11.2572 -11.2572 -0.1278 -0.1278 0.0176 0.0176 0.3609 0.3609 0.5395 0.5395 0.6663 0.6663 0.8921 0.8921 2.6343 2.6343 2.9657 2.9657 2.9905 2.9905 6.5918 6.5918 6.8363 6.8363 8.1711 8.1711 8.2805 8.2805 9.7919 9.7919 10.4868 10.4868 k = 0.5000 0.2144 0.2048 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1233 -47.1233 -47.1130 -47.1130 -19.9990 -19.9990 -19.9977 -19.9977 -19.8446 -19.8446 -19.8419 -19.8419 -19.7711 -19.7711 -19.7667 -19.7667 -19.2287 -19.2287 -19.2088 -19.2088 -19.0811 -19.0811 -19.0693 -19.0693 -18.9212 -18.9212 -18.8899 -18.8899 -11.4656 -11.4656 -11.4614 -11.4614 -11.2573 -11.2573 -0.1261 -0.1261 0.0313 0.0313 0.3676 0.3676 0.5463 0.5463 0.6781 0.6781 0.9075 0.9075 2.6189 2.6189 2.9724 2.9724 2.9975 2.9975 6.5549 6.5549 6.7985 6.7985 8.1529 8.1529 8.2377 8.2377 9.7712 9.7712 10.5470 10.5470 k = 0.5000 0.2144 0.1792 ( 9508 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1234 -47.1234 -47.1129 -47.1129 -19.9989 -19.9989 -19.9976 -19.9976 -19.8446 -19.8446 -19.8418 -19.8418 -19.7710 -19.7710 -19.7668 -19.7668 -19.2288 -19.2288 -19.2088 -19.2088 -19.0812 -19.0812 -19.0693 -19.0693 -18.9206 -18.9206 -18.8895 -18.8895 -11.4691 -11.4691 -11.4637 -11.4637 -11.2574 -11.2574 -0.1249 -0.1249 0.0441 0.0441 0.3724 0.3724 0.5529 0.5529 0.6893 0.6893 0.9222 0.9222 2.6039 2.6039 2.9783 2.9783 3.0037 3.0037 6.5223 6.5223 6.7647 6.7647 8.1370 8.1370 8.1994 8.1994 9.7526 9.7526 10.6040 10.6040 k = 0.5000 0.2144 0.1536 ( 9514 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1235 -47.1235 -47.1129 -47.1129 -19.9989 -19.9989 -19.9976 -19.9976 -19.8446 -19.8446 -19.8417 -19.8417 -19.7709 -19.7709 -19.7668 -19.7668 -19.2290 -19.2290 -19.2087 -19.2087 -19.0813 -19.0813 -19.0693 -19.0693 -18.9202 -18.9202 -18.8891 -18.8891 -11.4721 -11.4721 -11.4657 -11.4657 -11.2575 -11.2575 -0.1241 -0.1241 0.0558 0.0558 0.3756 0.3756 0.5591 0.5591 0.6995 0.6995 0.9359 0.9359 2.5899 2.5899 2.9835 2.9835 3.0091 3.0091 6.4941 6.4941 6.7351 6.7351 8.1234 8.1234 8.1659 8.1659 9.7362 9.7362 10.6568 10.6568 k = 0.5000 0.2144 0.1280 ( 9518 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1235 -47.1235 -47.1128 -47.1128 -19.9990 -19.9990 -19.9975 -19.9975 -19.8446 -19.8446 -19.8416 -19.8416 -19.7708 -19.7708 -19.7668 -19.7668 -19.2291 -19.2291 -19.2087 -19.2087 -19.0814 -19.0814 -19.0693 -19.0693 -18.9199 -18.9199 -18.8887 -18.8887 -11.4748 -11.4748 -11.4674 -11.4674 -11.2575 -11.2575 -0.1235 -0.1235 0.0662 0.0662 0.3777 0.3777 0.5646 0.5646 0.7086 0.7086 0.9482 0.9482 2.5771 2.5771 2.9879 2.9879 3.0136 3.0136 6.4703 6.4703 6.7098 6.7098 8.1121 8.1121 8.1373 8.1373 9.7223 9.7223 10.7044 10.7044 k = 0.5000 0.2144 0.1024 ( 9520 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1128 -47.1128 -19.9990 -19.9990 -19.9975 -19.9975 -19.8446 -19.8446 -19.8416 -19.8416 -19.7707 -19.7707 -19.7669 -19.7669 -19.2292 -19.2292 -19.2086 -19.2086 -19.0815 -19.0815 -19.0694 -19.0694 -18.9196 -18.9196 -18.8884 -18.8884 -11.4769 -11.4769 -11.4688 -11.4688 -11.2575 -11.2575 -0.1231 -0.1231 0.0750 0.0750 0.3789 0.3789 0.5694 0.5694 0.7162 0.7162 0.9589 0.9589 2.5661 2.5661 2.9915 2.9915 3.0173 3.0173 6.4509 6.4509 6.6889 6.6889 8.1028 8.1028 8.1137 8.1137 9.7107 9.7107 10.7455 10.7455 k = 0.5000 0.2144 0.0768 ( 9518 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1127 -47.1127 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7707 -19.7707 -19.7669 -19.7669 -19.2293 -19.2293 -19.2086 -19.2086 -19.0816 -19.0816 -19.0693 -19.0693 -18.9195 -18.9195 -18.8881 -18.8881 -11.4786 -11.4786 -11.4699 -11.4699 -11.2576 -11.2576 -0.1228 -0.1228 0.0822 0.0822 0.3795 0.3795 0.5733 0.5733 0.7223 0.7223 0.9676 0.9676 2.5570 2.5570 2.9942 2.9942 3.0202 3.0202 6.4358 6.4358 6.6726 6.6726 8.0950 8.0950 8.0959 8.0959 9.7017 9.7017 10.7789 10.7789 k = 0.5000 0.2144 0.0512 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1236 -47.1236 -47.1127 -47.1127 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7706 -19.7706 -19.7670 -19.7670 -19.2294 -19.2294 -19.2086 -19.2086 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8879 -18.8879 -11.4798 -11.4798 -11.4707 -11.4707 -11.2576 -11.2576 -0.1227 -0.1227 0.0874 0.0874 0.3797 0.3797 0.5762 0.5762 0.7267 0.7267 0.9740 0.9740 2.5504 2.5504 2.9962 2.9962 3.0223 3.0223 6.4251 6.4251 6.6609 6.6609 8.0819 8.0819 8.0907 8.0907 9.6952 9.6952 10.8037 10.8037 k = 0.5000 0.2144 0.0256 ( 9512 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9989 -19.9989 -19.9974 -19.9974 -19.8446 -19.8446 -19.8415 -19.8415 -19.7706 -19.7706 -19.7670 -19.7670 -19.2294 -19.2294 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9193 -18.9193 -18.8877 -18.8877 -11.4805 -11.4805 -11.4712 -11.4712 -11.2576 -11.2576 -0.1226 -0.1226 0.0906 0.0906 0.3798 0.3798 0.5780 0.5780 0.7294 0.7294 0.9780 0.9780 2.5463 2.5463 2.9974 2.9974 3.0235 3.0235 6.4186 6.4186 6.6538 6.6538 8.0739 8.0739 8.0877 8.0877 9.6913 9.6913 10.8184 10.8184 k = 0.5000 0.2144 0.0000 ( 9516 PWs) bands (ev): -47.9379 -47.9379 -47.9378 -47.9378 -47.1237 -47.1237 -47.1127 -47.1127 -19.9990 -19.9990 -19.9974 -19.9974 -19.8446 -19.8446 -19.8414 -19.8414 -19.7706 -19.7706 -19.7670 -19.7670 -19.2295 -19.2295 -19.2085 -19.2085 -19.0816 -19.0816 -19.0693 -19.0693 -18.9192 -18.9192 -18.8877 -18.8877 -11.4808 -11.4808 -11.4714 -11.4714 -11.2576 -11.2576 -0.1226 -0.1226 0.0917 0.0917 0.3798 0.3798 0.5785 0.5785 0.7303 0.7303 0.9793 0.9793 2.5449 2.5449 2.9978 2.9978 3.0239 3.0239 6.4165 6.4165 6.6515 6.6515 8.0712 8.0712 8.0867 8.0867 9.6900 9.6900 10.8222 10.8222 k = 0.0000 0.0000 1.2685 ( 9560 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8466 -19.8466 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9954 -18.9954 -18.8564 -18.8564 -11.3409 -11.3409 -11.3262 -11.3262 -11.1651 -11.1651 -0.4517 -0.4517 -0.3322 -0.3322 0.0863 0.0863 0.1407 0.1407 0.3843 0.3843 0.5278 0.5278 2.5948 2.5948 2.6194 2.6194 2.6813 2.6813 7.4692 7.4692 8.3883 8.3883 8.7974 8.7974 9.1884 9.1884 9.2902 9.2902 10.0762 10.0762 k = 0.0227 0.0097 1.2685 ( 9562 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8466 -19.8466 -19.8452 -19.8452 -19.7793 -19.7793 -19.7632 -19.7632 -19.2408 -19.2408 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9954 -18.9954 -18.8564 -18.8564 -11.3408 -11.3408 -11.3262 -11.3262 -11.1651 -11.1651 -0.4513 -0.4513 -0.3328 -0.3328 0.0850 0.0850 0.1430 0.1430 0.3833 0.3833 0.5281 0.5281 2.5952 2.5952 2.6194 2.6194 2.6809 2.6809 7.4722 7.4722 8.3790 8.3790 8.7988 8.7988 9.1858 9.1858 9.2985 9.2985 10.0804 10.0804 k = 0.0455 0.0195 1.2685 ( 9542 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9954 -18.9954 -18.8563 -18.8563 -11.3408 -11.3408 -11.3263 -11.3263 -11.1651 -11.1651 -0.4502 -0.4502 -0.3346 -0.3346 0.0817 0.0817 0.1493 0.1493 0.3802 0.3802 0.5288 0.5288 2.5964 2.5964 2.6193 2.6193 2.6797 2.6797 7.4812 7.4812 8.3522 8.3522 8.8030 8.8030 9.1774 9.1774 9.3228 9.3228 10.0927 10.0927 k = 0.0682 0.0292 1.2685 ( 9540 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7792 -19.7792 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3407 -11.3407 -11.3264 -11.3264 -11.1651 -11.1651 -0.4484 -0.4484 -0.3375 -0.3375 0.0774 0.0774 0.1585 0.1585 0.3751 0.3751 0.5300 0.5300 2.5983 2.5983 2.6191 2.6191 2.6777 2.6777 7.4962 7.4962 8.3113 8.3113 8.8099 8.8099 9.1633 9.1633 9.3601 9.3601 10.1123 10.1123 k = 0.0909 0.0390 1.2685 ( 9548 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7793 -19.7793 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3406 -11.3406 -11.3265 -11.3265 -11.1651 -11.1651 -0.4460 -0.4460 -0.3414 -0.3414 0.0730 0.0730 0.1696 0.1696 0.3684 0.3684 0.5314 0.5314 2.6009 2.6009 2.6190 2.6190 2.6750 2.6750 7.5169 7.5169 8.2600 8.2600 8.8196 8.8196 9.1441 9.1441 9.4061 9.4061 10.1384 10.1384 k = 0.1136 0.0487 1.2685 ( 9546 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7793 -19.7793 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3405 -11.3405 -11.3266 -11.3266 -11.1651 -11.1651 -0.4430 -0.4430 -0.3459 -0.3459 0.0689 0.0689 0.1820 0.1820 0.3600 0.3600 0.5330 0.5330 2.6040 2.6040 2.6190 2.6190 2.6716 2.6716 7.5431 7.5431 8.2021 8.2021 8.8320 8.8320 9.1211 9.1211 9.4563 9.4563 10.1697 10.1697 k = 0.1364 0.0585 1.2685 ( 9536 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8451 -19.8451 -19.7793 -19.7793 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3403 -11.3403 -11.3268 -11.3268 -11.1651 -11.1651 -0.4395 -0.4395 -0.3510 -0.3510 0.0653 0.0653 0.1952 0.1952 0.3505 0.3505 0.5346 0.5346 2.6071 2.6071 2.6196 2.6196 2.6677 2.6677 7.5746 7.5746 8.1405 8.1405 8.8470 8.8470 9.0954 9.0954 9.5066 9.5066 10.2050 10.2050 k = 0.1591 0.0682 1.2685 ( 9550 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3402 -11.3402 -11.3269 -11.3269 -11.1651 -11.1651 -0.4359 -0.4359 -0.3562 -0.3562 0.0623 0.0623 0.2088 0.2088 0.3400 0.3400 0.5360 0.5360 2.6098 2.6098 2.6211 2.6211 2.6632 2.6632 7.6109 7.6109 8.0775 8.0775 8.8644 8.8644 9.0679 9.0679 9.5534 9.5534 10.2431 10.2431 k = 0.1818 0.0780 1.2685 ( 9550 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7632 -19.7632 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0476 -19.0476 -18.9953 -18.9953 -18.8563 -18.8563 -11.3401 -11.3401 -11.3270 -11.3270 -11.1650 -11.1650 -0.4322 -0.4322 -0.3611 -0.3611 0.0600 0.0600 0.2221 0.2221 0.3291 0.3291 0.5373 0.5373 2.6114 2.6114 2.6240 2.6240 2.6584 2.6584 7.6512 7.6512 8.0152 8.0152 8.8842 8.8842 9.0397 9.0397 9.5937 9.5937 10.2828 10.2828 k = 0.2045 0.0877 1.2685 ( 9564 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0939 -19.0939 -19.0477 -19.0477 -18.9953 -18.9953 -18.8564 -18.8564 -11.3400 -11.3400 -11.3271 -11.3271 -11.1650 -11.1650 -0.4290 -0.4290 -0.3654 -0.3654 0.0583 0.0583 0.2343 0.2343 0.3186 0.3186 0.5382 0.5382 2.6122 2.6122 2.6280 2.6280 2.6535 2.6535 7.6939 7.6939 7.9563 7.9563 8.9060 8.9060 9.0114 9.0114 9.6246 9.6246 10.3223 10.3223 k = 0.2273 0.0975 1.2685 ( 9560 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9990 -19.9990 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0938 -19.0938 -19.0477 -19.0477 -18.9953 -18.9953 -18.8563 -18.8563 -11.3399 -11.3399 -11.3272 -11.3272 -11.1650 -11.1650 -0.4268 -0.4268 -0.3683 -0.3683 0.0573 0.0573 0.2438 0.2438 0.3102 0.3102 0.5388 0.5388 2.6125 2.6125 2.6320 2.6320 2.6490 2.6490 7.7341 7.7341 7.9062 7.9062 8.9296 8.9296 8.9838 8.9838 9.6441 9.6441 10.3576 10.3576 k = 0.2500 0.1072 1.2685 ( 9564 PWs) bands (ev): -47.9378 -47.9378 -47.9378 -47.9378 -47.1181 -47.1181 -47.1181 -47.1181 -20.0022 -20.0022 -19.9991 -19.9991 -19.8465 -19.8465 -19.8452 -19.8452 -19.7793 -19.7793 -19.7633 -19.7633 -19.2407 -19.2407 -19.2092 -19.2092 -19.0939 -19.0939 -19.0477 -19.0477 -18.9953 -18.9953 -18.8563 -18.8563 -11.3399 -11.3399 -11.3272 -11.3272 -11.1650 -11.1650 -0.4259 -0.4259 -0.3693 -0.3693 0.0570 0.0570 0.2476 0.2476 0.3067 0.3067 0.5390 0.5390 2.6125 2.6125 2.6341 2.6341 2.6468 2.6468 7.7546 7.7546 7.8823 7.8823 8.9495 8.9495 8.9626 8.9626 9.6508 9.6508 10.3751 10.3751 Writing output data file Na4Br2O.save init_run : 0.28s CPU 0.61s WALL ( 1 calls) electrons : 517.39s CPU 523.08s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.09s WALL ( 1 calls) potinit : 0.06s CPU 0.11s WALL ( 1 calls) Called by electrons: c_bands : 517.38s CPU 523.07s 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 : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.11s WALL ( 305 calls) cegterg : 473.24s CPU 476.43s WALL ( 538 calls) Called by sum_band: Called by *egterg: h_psi : 392.70s CPU 395.41s WALL ( 8236 calls) s_psi : 4.30s CPU 4.31s WALL ( 8236 calls) g_psi : 0.58s CPU 0.54s WALL ( 7393 calls) cdiaghg : 70.70s CPU 71.54s WALL ( 7698 calls) cegterg:over : 14.61s CPU 14.74s WALL ( 7393 calls) cegterg:upda : 16.48s CPU 16.40s WALL ( 7393 calls) cegterg:last : 7.34s CPU 7.42s WALL ( 1148 calls) cdiaghg:chol : 4.24s CPU 4.20s WALL ( 7698 calls) cdiaghg:inve : 2.96s CPU 2.86s WALL ( 7698 calls) cdiaghg:para : 4.82s CPU 4.93s WALL ( 15396 calls) Called by h_psi: h_psi:vloc : 380.55s CPU 383.08s WALL ( 8236 calls) h_psi:vnl : 11.50s CPU 11.65s WALL ( 8236 calls) add_vuspsi : 4.65s CPU 4.56s WALL ( 8236 calls) General routines calbec : 6.83s CPU 7.06s WALL ( 8236 calls) fft : 0.00s CPU 0.02s WALL ( 19 calls) ffts : 0.01s CPU 0.00s WALL ( 4 calls) fftw : 356.90s CPU 360.03s WALL ( 850476 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.33s CPU 0.53s WALL ( 610 calls) Parallel routines fft_scatter : 85.48s CPU 85.87s WALL ( 850499 calls) PWSCF : 9m 9.56s CPU 10m 2.03s WALL This run was terminated on: 16:14: 5 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=