Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18:20:23 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: ./TlFeS2.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 58 45 12 2204 1490 222 Max 59 46 13 2207 1508 229 Sum 2103 1635 459 79389 53941 8121 bravais-lattice index = 14 lattice parameter (alat) = 12.1269 a.u. unit-cell volume = 1278.9064 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 66.00 number of Kohn-Sham states= 80 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 238.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.126859 celldm(2)= 1.000000 celldm(3)= 1.066011 celldm(4)= 0.411957 celldm(5)= 0.411957 celldm(6)= 0.656367 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.656367 0.754441 0.000000 ) a(3) = ( 0.439151 0.200024 0.950535 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.870005 -0.278926 ) b(2) = ( 0.000000 1.325484 -0.278926 ) b(3) = ( 0.000000 0.000000 1.052039 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 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 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential S 6.00 32.06500 S( 1.00) Tl 13.00 204.38330 Tl( 1.00) Fe 8.00 55.84500 Fe( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 283 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 2) = ( 0.0161290 0.0073464 -0.0089976), wk = 0.0035336 k( 3) = ( 0.0322581 0.0146929 -0.0179952), wk = 0.0035336 k( 4) = ( 0.0483871 0.0220393 -0.0269928), wk = 0.0035336 k( 5) = ( 0.0645161 0.0293858 -0.0359904), wk = 0.0035336 k( 6) = ( 0.0806452 0.0367322 -0.0449880), wk = 0.0035336 k( 7) = ( 0.0967742 0.0440787 -0.0539856), wk = 0.0035336 k( 8) = ( 0.1129032 0.0514251 -0.0629832), wk = 0.0035336 k( 9) = ( 0.1290323 0.0587715 -0.0719808), wk = 0.0035336 k( 10) = ( 0.1451613 0.0661180 -0.0809784), wk = 0.0035336 k( 11) = ( 0.1612903 0.0734644 -0.0899760), wk = 0.0035336 k( 12) = ( 0.1774194 0.0808109 -0.0989737), wk = 0.0035336 k( 13) = ( 0.1935484 0.0881573 -0.1079713), wk = 0.0035336 k( 14) = ( 0.2096774 0.0955038 -0.1169689), wk = 0.0035336 k( 15) = ( 0.2258064 0.1028502 -0.1259665), wk = 0.0035336 k( 16) = ( 0.2419355 0.1101966 -0.1349641), wk = 0.0035336 k( 17) = ( 0.2580645 0.1175431 -0.1439617), wk = 0.0035336 k( 18) = ( 0.2741936 0.1248895 -0.1529593), wk = 0.0035336 k( 19) = ( 0.2903226 0.1322360 -0.1619569), wk = 0.0035336 k( 20) = ( 0.3064516 0.1395824 -0.1709545), wk = 0.0035336 k( 21) = ( 0.3225807 0.1469289 -0.1799521), wk = 0.0035336 k( 22) = ( 0.3387097 0.1542753 -0.1889497), wk = 0.0035336 k( 23) = ( 0.3548387 0.1616217 -0.1979473), wk = 0.0035336 k( 24) = ( 0.3709677 0.1689682 -0.2069449), wk = 0.0035336 k( 25) = ( 0.3870968 0.1763146 -0.2159425), wk = 0.0035336 k( 26) = ( 0.4032258 0.1836611 -0.2249401), wk = 0.0035336 k( 27) = ( 0.4193548 0.1910075 -0.2339377), wk = 0.0035336 k( 28) = ( 0.4354839 0.1983540 -0.2429353), wk = 0.0035336 k( 29) = ( 0.4516129 0.2057004 -0.2519329), wk = 0.0035336 k( 30) = ( 0.4677419 0.2130468 -0.2609305), wk = 0.0035336 k( 31) = ( 0.4838710 0.2203933 -0.2699281), wk = 0.0035336 k( 32) = ( 0.5000000 0.2277397 -0.2789258), wk = 0.0035336 k( 33) = ( 0.5000000 0.2277397 -0.2789258), wk = 0.0035336 k( 34) = ( 0.5081541 0.2314538 -0.2612762), wk = 0.0035336 k( 35) = ( 0.5163083 0.2351678 -0.2436267), wk = 0.0035336 k( 36) = ( 0.5244625 0.2388819 -0.2259771), wk = 0.0035336 k( 37) = ( 0.5326166 0.2425959 -0.2083276), wk = 0.0035336 k( 38) = ( 0.5407708 0.2463100 -0.1906780), wk = 0.0035336 k( 39) = ( 0.5489249 0.2500240 -0.1730285), wk = 0.0035336 k( 40) = ( 0.5570791 0.2537381 -0.1553789), wk = 0.0035336 k( 41) = ( 0.5652332 0.2574521 -0.1377294), wk = 0.0035336 k( 42) = ( 0.5733874 0.2611662 -0.1200799), wk = 0.0035336 k( 43) = ( 0.5815415 0.2648802 -0.1024303), wk = 0.0035336 k( 44) = ( 0.5896957 0.2685943 -0.0847808), wk = 0.0035336 k( 45) = ( 0.5978498 0.2723083 -0.0671312), wk = 0.0035336 k( 46) = ( 0.6060040 0.2760224 -0.0494817), wk = 0.0035336 k( 47) = ( 0.6141581 0.2797364 -0.0318322), wk = 0.0035336 k( 48) = ( 0.6141581 0.2797364 -0.0318322), wk = 0.0035336 k( 49) = ( 0.6065476 0.2762700 -0.0132371), wk = 0.0035336 k( 50) = ( 0.5989370 0.2728035 0.0053580), wk = 0.0035336 k( 51) = ( 0.5913265 0.2693371 0.0239530), wk = 0.0035336 k( 52) = ( 0.5837159 0.2658706 0.0425481), wk = 0.0035336 k( 53) = ( 0.5761054 0.2624042 0.0611431), wk = 0.0035336 k( 54) = ( 0.5684949 0.2589377 0.0797381), wk = 0.0035336 k( 55) = ( 0.5608843 0.2554713 0.0983332), wk = 0.0035336 k( 56) = ( 0.5532738 0.2520048 0.1169282), wk = 0.0035336 k( 57) = ( 0.5456633 0.2485384 0.1355233), wk = 0.0035336 k( 58) = ( 0.5380527 0.2450720 0.1541183), wk = 0.0035336 k( 59) = ( 0.5304422 0.2416055 0.1727134), wk = 0.0035336 k( 60) = ( 0.5228316 0.2381391 0.1913084), wk = 0.0035336 k( 61) = ( 0.5152211 0.2346726 0.2099035), wk = 0.0035336 k( 62) = ( 0.5076105 0.2312062 0.2284985), wk = 0.0035336 k( 63) = ( 0.5000000 0.2277397 0.2470936), wk = 0.0035336 k( 64) = ( 0.5000000 0.2277397 0.2470936), wk = 0.0035336 k( 65) = ( 0.5083995 0.2092988 0.2470936), wk = 0.0035336 k( 66) = ( 0.5167989 0.1908578 0.2470936), wk = 0.0035336 k( 67) = ( 0.5251984 0.1724169 0.2470936), wk = 0.0035336 k( 68) = ( 0.5335979 0.1539759 0.2470936), wk = 0.0035336 k( 69) = ( 0.5419974 0.1355350 0.2470936), wk = 0.0035336 k( 70) = ( 0.5503968 0.1170940 0.2470936), wk = 0.0035336 k( 71) = ( 0.5587963 0.0986531 0.2470936), wk = 0.0035336 k( 72) = ( 0.5671958 0.0802121 0.2470936), wk = 0.0035336 k( 73) = ( 0.5755953 0.0617712 0.2470936), wk = 0.0035336 k( 74) = ( 0.5839947 0.0433302 0.2470936), wk = 0.0035336 k( 75) = ( 0.5923942 0.0248893 0.2470936), wk = 0.0035336 k( 76) = ( 0.6007937 0.0064483 0.2470936), wk = 0.0035336 k( 77) = ( 0.6091932 -0.0119926 0.2470936), wk = 0.0035336 k( 78) = ( 0.6175926 -0.0304336 0.2470936), wk = 0.0035336 k( 79) = ( 0.6259921 -0.0488745 0.2470936), wk = 0.0035336 k( 80) = ( 0.6343916 -0.0673155 0.2470936), wk = 0.0035336 k( 81) = ( 0.6427911 -0.0857564 0.2470936), wk = 0.0035336 k( 82) = ( 0.6511905 -0.1041974 0.2470936), wk = 0.0035336 k( 83) = ( 0.6595900 -0.1226383 0.2470936), wk = 0.0035336 k( 84) = ( 0.6679895 -0.1410793 0.2470936), wk = 0.0035336 k( 85) = ( 0.6763889 -0.1595202 0.2470936), wk = 0.0035336 k( 86) = ( 0.6847884 -0.1779612 0.2470936), wk = 0.0035336 k( 87) = ( 0.6931879 -0.1964021 0.2470936), wk = 0.0035336 k( 88) = ( 0.7015874 -0.2148431 0.2470936), wk = 0.0035336 k( 89) = ( 0.7099868 -0.2332840 0.2470936), wk = 0.0035336 k( 90) = ( 0.7183863 -0.2517250 0.2470936), wk = 0.0035336 k( 91) = ( 0.7267858 -0.2701659 0.2470936), wk = 0.0035336 k( 92) = ( 0.7351853 -0.2886069 0.2470936), wk = 0.0035336 k( 93) = ( 0.2648147 -0.5813978 0.5260193), wk = 0.0035336 k( 94) = ( 0.2565393 -0.5632291 0.5260193), wk = 0.0035336 k( 95) = ( 0.2482638 -0.5450604 0.5260193), wk = 0.0035336 k( 96) = ( 0.2399883 -0.5268917 0.5260193), wk = 0.0035336 k( 97) = ( 0.2317129 -0.5087230 0.5260193), wk = 0.0035336 k( 98) = ( 0.2234374 -0.4905544 0.5260193), wk = 0.0035336 k( 99) = ( 0.2151620 -0.4723857 0.5260193), wk = 0.0035336 k( 100) = ( 0.2068865 -0.4542170 0.5260193), wk = 0.0035336 k( 101) = ( 0.1986111 -0.4360483 0.5260193), wk = 0.0035336 k( 102) = ( 0.1903356 -0.4178796 0.5260193), wk = 0.0035336 k( 103) = ( 0.1820601 -0.3997110 0.5260193), wk = 0.0035336 k( 104) = ( 0.1737847 -0.3815423 0.5260193), wk = 0.0035336 k( 105) = ( 0.1655092 -0.3633736 0.5260193), wk = 0.0035336 k( 106) = ( 0.1572338 -0.3452049 0.5260193), wk = 0.0035336 k( 107) = ( 0.1489583 -0.3270362 0.5260193), wk = 0.0035336 k( 108) = ( 0.1406828 -0.3088676 0.5260193), wk = 0.0035336 k( 109) = ( 0.1324074 -0.2906989 0.5260193), wk = 0.0035336 k( 110) = ( 0.1241319 -0.2725302 0.5260193), wk = 0.0035336 k( 111) = ( 0.1158564 -0.2543615 0.5260193), wk = 0.0035336 k( 112) = ( 0.1075810 -0.2361929 0.5260193), wk = 0.0035336 k( 113) = ( 0.0993055 -0.2180241 0.5260193), wk = 0.0035336 k( 114) = ( 0.0910301 -0.1998555 0.5260193), wk = 0.0035336 k( 115) = ( 0.0827546 -0.1816868 0.5260193), wk = 0.0035336 k( 116) = ( 0.0744791 -0.1635181 0.5260193), wk = 0.0035336 k( 117) = ( 0.0662037 -0.1453494 0.5260193), wk = 0.0035336 k( 118) = ( 0.0579282 -0.1271808 0.5260193), wk = 0.0035336 k( 119) = ( 0.0496528 -0.1090121 0.5260193), wk = 0.0035336 k( 120) = ( 0.0413773 -0.0908434 0.5260193), wk = 0.0035336 k( 121) = ( 0.0331018 -0.0726747 0.5260193), wk = 0.0035336 k( 122) = ( 0.0248264 -0.0545060 0.5260193), wk = 0.0035336 k( 123) = ( 0.0165509 -0.0363374 0.5260193), wk = 0.0035336 k( 124) = ( 0.0082755 -0.0181687 0.5260193), wk = 0.0035336 k( 125) = ( 0.0000000 0.0000000 0.5260193), wk = 0.0035336 k( 126) = ( 0.0000000 0.0000000 0.5260193), wk = 0.0035336 k( 127) = ( 0.0183734 0.0083687 0.5260194), wk = 0.0035336 k( 128) = ( 0.0367468 0.0167374 0.5260193), wk = 0.0035336 k( 129) = ( 0.0551203 0.0251062 0.5260193), wk = 0.0035336 k( 130) = ( 0.0734937 0.0334749 0.5260194), wk = 0.0035336 k( 131) = ( 0.0918671 0.0418436 0.5260193), wk = 0.0035336 k( 132) = ( 0.1102405 0.0502123 0.5260193), wk = 0.0035336 k( 133) = ( 0.1286140 0.0585810 0.5260193), wk = 0.0035336 k( 134) = ( 0.1469874 0.0669497 0.5260194), wk = 0.0035336 k( 135) = ( 0.1653608 0.0753185 0.5260193), wk = 0.0035336 k( 136) = ( 0.1837342 0.0836872 0.5260193), wk = 0.0035336 k( 137) = ( 0.2021076 0.0920559 0.5260194), wk = 0.0035336 k( 138) = ( 0.2204811 0.1004246 0.5260193), wk = 0.0035336 k( 139) = ( 0.2388545 0.1087933 0.5260193), wk = 0.0035336 k( 140) = ( 0.2572279 0.1171620 0.5260194), wk = 0.0035336 k( 141) = ( 0.2756014 0.1255308 0.5260193), wk = 0.0035336 k( 142) = ( 0.2939748 0.1338995 0.5260193), wk = 0.0035336 k( 143) = ( 0.3123482 0.1422682 0.5260194), wk = 0.0035336 k( 144) = ( 0.3307216 0.1506369 0.5260194), wk = 0.0035336 k( 145) = ( 0.3490950 0.1590056 0.5260193), wk = 0.0035336 k( 146) = ( 0.3674685 0.1673743 0.5260193), wk = 0.0035336 k( 147) = ( 0.3858419 0.1757430 0.5260194), wk = 0.0035336 k( 148) = ( 0.5000000 0.2277397 -0.2789258), wk = 0.0035336 k( 149) = ( 0.5083985 0.2093009 -0.2789258), wk = 0.0035336 k( 150) = ( 0.5167970 0.1908620 -0.2789258), wk = 0.0035336 k( 151) = ( 0.5251955 0.1724232 -0.2789258), wk = 0.0035336 k( 152) = ( 0.5335941 0.1539843 -0.2789258), wk = 0.0035336 k( 153) = ( 0.5419926 0.1355455 -0.2789258), wk = 0.0035336 k( 154) = ( 0.5503911 0.1171066 -0.2789258), wk = 0.0035336 k( 155) = ( 0.5587896 0.0986678 -0.2789258), wk = 0.0035336 k( 156) = ( 0.5671881 0.0802289 -0.2789258), wk = 0.0035336 k( 157) = ( 0.5755867 0.0617901 -0.2789258), wk = 0.0035336 k( 158) = ( 0.5839852 0.0433512 -0.2789258), wk = 0.0035336 k( 159) = ( 0.5923837 0.0249124 -0.2789258), wk = 0.0035336 k( 160) = ( 0.6007822 0.0064735 -0.2789258), wk = 0.0035336 k( 161) = ( 0.6091807 -0.0119653 -0.2789258), wk = 0.0035336 k( 162) = ( 0.6175792 -0.0304042 -0.2789258), wk = 0.0035336 k( 163) = ( 0.6259778 -0.0488430 -0.2789258), wk = 0.0035336 k( 164) = ( 0.6343763 -0.0672819 -0.2789258), wk = 0.0035336 k( 165) = ( 0.6427748 -0.0857207 -0.2789258), wk = 0.0035336 k( 166) = ( 0.6511733 -0.1041596 -0.2789258), wk = 0.0035336 k( 167) = ( 0.6595718 -0.1225984 -0.2789258), wk = 0.0035336 k( 168) = ( 0.6679704 -0.1410373 -0.2789258), wk = 0.0035336 k( 169) = ( 0.6763689 -0.1594761 -0.2789258), wk = 0.0035336 k( 170) = ( 0.6847674 -0.1779150 -0.2789258), wk = 0.0035336 k( 171) = ( 0.3152326 -0.6920897 -0.0000000), wk = 0.0035336 k( 172) = ( 0.3069370 -0.6738768 -0.0000000), wk = 0.0035336 k( 173) = ( 0.2986414 -0.6556639 0.0000000), wk = 0.0035336 k( 174) = ( 0.2903458 -0.6374510 -0.0000000), wk = 0.0035336 k( 175) = ( 0.2820502 -0.6192381 -0.0000000), wk = 0.0035336 k( 176) = ( 0.2737546 -0.6010252 0.0000000), wk = 0.0035336 k( 177) = ( 0.2654590 -0.5828123 -0.0000000), wk = 0.0035336 k( 178) = ( 0.2571635 -0.5645995 -0.0000000), wk = 0.0035336 k( 179) = ( 0.2488679 -0.5463866 0.0000000), wk = 0.0035336 k( 180) = ( 0.2405723 -0.5281737 -0.0000000), wk = 0.0035336 k( 181) = ( 0.2322767 -0.5099608 0.0000000), wk = 0.0035336 k( 182) = ( 0.2239811 -0.4917479 -0.0000000), wk = 0.0035336 k( 183) = ( 0.2156855 -0.4735350 0.0000000), wk = 0.0035336 k( 184) = ( 0.2073899 -0.4553221 -0.0000000), wk = 0.0035336 k( 185) = ( 0.1990943 -0.4371092 -0.0000000), wk = 0.0035336 k( 186) = ( 0.1907987 -0.4188964 -0.0000000), wk = 0.0035336 k( 187) = ( 0.1825031 -0.4006835 -0.0000000), wk = 0.0035336 k( 188) = ( 0.1742075 -0.3824706 0.0000000), wk = 0.0035336 k( 189) = ( 0.1659119 -0.3642577 0.0000000), wk = 0.0035336 k( 190) = ( 0.1576163 -0.3460448 -0.0000000), wk = 0.0035336 k( 191) = ( 0.1493207 -0.3278319 0.0000000), wk = 0.0035336 k( 192) = ( 0.1410251 -0.3096191 -0.0000000), wk = 0.0035336 k( 193) = ( 0.1327295 -0.2914062 -0.0000000), wk = 0.0035336 k( 194) = ( 0.1244339 -0.2731933 -0.0000000), wk = 0.0035336 k( 195) = ( 0.1161383 -0.2549804 0.0000000), wk = 0.0035336 k( 196) = ( 0.1078427 -0.2367675 -0.0000000), wk = 0.0035336 k( 197) = ( 0.0995471 -0.2185546 -0.0000000), wk = 0.0035336 k( 198) = ( 0.0912516 -0.2003417 0.0000000), wk = 0.0035336 k( 199) = ( 0.0829560 -0.1821289 0.0000000), wk = 0.0035336 k( 200) = ( 0.0746604 -0.1639160 -0.0000000), wk = 0.0035336 k( 201) = ( 0.0663648 -0.1457031 -0.0000000), wk = 0.0035336 k( 202) = ( 0.0580692 -0.1274902 0.0000000), wk = 0.0035336 k( 203) = ( 0.0497736 -0.1092773 -0.0000000), wk = 0.0035336 k( 204) = ( 0.0414780 -0.0910644 0.0000000), wk = 0.0035336 k( 205) = ( 0.0331824 -0.0728515 -0.0000000), wk = 0.0035336 k( 206) = ( 0.0248868 -0.0546387 -0.0000000), wk = 0.0035336 k( 207) = ( 0.0165912 -0.0364258 -0.0000000), wk = 0.0035336 k( 208) = ( 0.0082956 -0.0182129 0.0000000), wk = 0.0035336 k( 209) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 211) = ( 0.0147059 -0.0127942 -0.0041018), wk = 0.0035336 k( 212) = ( 0.0294118 -0.0255884 -0.0082037), wk = 0.0035336 k( 213) = ( 0.0441177 -0.0383826 -0.0123055), wk = 0.0035336 k( 214) = ( 0.0588235 -0.0511767 -0.0164074), wk = 0.0035336 k( 215) = ( 0.0735294 -0.0639709 -0.0205092), wk = 0.0035336 k( 216) = ( 0.0882353 -0.0767651 -0.0246111), wk = 0.0035336 k( 217) = ( 0.1029412 -0.0895593 -0.0287129), wk = 0.0035336 k( 218) = ( 0.1176471 -0.1023535 -0.0328148), wk = 0.0035336 k( 219) = ( 0.1323529 -0.1151477 -0.0369166), wk = 0.0035336 k( 220) = ( 0.1470588 -0.1279419 -0.0410185), wk = 0.0035336 k( 221) = ( 0.1617647 -0.1407360 -0.0451203), wk = 0.0035336 k( 222) = ( 0.1764706 -0.1535302 -0.0492222), wk = 0.0035336 k( 223) = ( 0.1911765 -0.1663244 -0.0533240), wk = 0.0035336 k( 224) = ( 0.2058823 -0.1791186 -0.0574259), wk = 0.0035336 k( 225) = ( 0.2205882 -0.1919128 -0.0615277), wk = 0.0035336 k( 226) = ( 0.2352941 -0.2047070 -0.0656296), wk = 0.0035336 k( 227) = ( 0.2500000 -0.2175012 -0.0697314), wk = 0.0035336 k( 228) = ( 0.2647059 -0.2302953 -0.0738333), wk = 0.0035336 k( 229) = ( 0.2794118 -0.2430895 -0.0779351), wk = 0.0035336 k( 230) = ( 0.2941177 -0.2558837 -0.0820370), wk = 0.0035336 k( 231) = ( 0.3088235 -0.2686779 -0.0861388), wk = 0.0035336 k( 232) = ( 0.3235294 -0.2814721 -0.0902407), wk = 0.0035336 k( 233) = ( 0.3382353 -0.2942663 -0.0943425), wk = 0.0035336 k( 234) = ( 0.3529412 -0.3070605 -0.0984444), wk = 0.0035336 k( 235) = ( 0.3676471 -0.3198546 -0.1025462), wk = 0.0035336 k( 236) = ( 0.3823529 -0.3326488 -0.1066481), wk = 0.0035336 k( 237) = ( 0.3970588 -0.3454430 -0.1107499), wk = 0.0035336 k( 238) = ( 0.4117647 -0.3582372 -0.1148518), wk = 0.0035336 k( 239) = ( 0.4264706 -0.3710314 -0.1189536), wk = 0.0035336 k( 240) = ( 0.4411765 -0.3838256 -0.1230555), wk = 0.0035336 k( 241) = ( 0.4558823 -0.3966198 -0.1271573), wk = 0.0035336 k( 242) = ( 0.4705882 -0.4094139 -0.1312592), wk = 0.0035336 k( 243) = ( 0.4852941 -0.4222081 -0.1353610), wk = 0.0035336 k( 244) = ( 0.5000000 -0.4350023 -0.1394629), wk = 0.0035336 k( 245) = ( 0.5000000 -0.4350023 0.3865565), wk = 0.0035336 k( 246) = ( 0.4868421 -0.4235549 0.3763839), wk = 0.0035336 k( 247) = ( 0.4736842 -0.4121075 0.3662114), wk = 0.0035336 k( 248) = ( 0.4605263 -0.4006600 0.3560389), wk = 0.0035336 k( 249) = ( 0.4473684 -0.3892126 0.3458663), wk = 0.0035336 k( 250) = ( 0.4342105 -0.3777652 0.3356938), wk = 0.0035336 k( 251) = ( 0.4210526 -0.3663177 0.3255212), wk = 0.0035336 k( 252) = ( 0.4078947 -0.3548703 0.3153487), wk = 0.0035336 k( 253) = ( 0.3947368 -0.3434229 0.3051762), wk = 0.0035336 k( 254) = ( 0.3815789 -0.3319755 0.2950036), wk = 0.0035336 k( 255) = ( 0.3684211 -0.3205280 0.2848311), wk = 0.0035336 k( 256) = ( 0.3552632 -0.3090806 0.2746585), wk = 0.0035336 k( 257) = ( 0.3421053 -0.2976332 0.2644860), wk = 0.0035336 k( 258) = ( 0.3289474 -0.2861857 0.2543135), wk = 0.0035336 k( 259) = ( 0.3157895 -0.2747383 0.2441409), wk = 0.0035336 k( 260) = ( 0.3026316 -0.2632909 0.2339684), wk = 0.0035336 k( 261) = ( 0.2894737 -0.2518434 0.2237958), wk = 0.0035336 k( 262) = ( 0.2763158 -0.2403960 0.2136233), wk = 0.0035336 k( 263) = ( 0.2631579 -0.2289486 0.2034508), wk = 0.0035336 k( 264) = ( 0.2500000 -0.2175012 0.1932782), wk = 0.0035336 k( 265) = ( 0.2368421 -0.2060537 0.1831057), wk = 0.0035336 k( 266) = ( 0.2236842 -0.1946063 0.1729332), wk = 0.0035336 k( 267) = ( 0.2105263 -0.1831589 0.1627606), wk = 0.0035336 k( 268) = ( 0.1973684 -0.1717114 0.1525881), wk = 0.0035336 k( 269) = ( 0.1842105 -0.1602640 0.1424155), wk = 0.0035336 k( 270) = ( 0.1710526 -0.1488166 0.1322430), wk = 0.0035336 k( 271) = ( 0.1578947 -0.1373692 0.1220705), wk = 0.0035336 k( 272) = ( 0.1447368 -0.1259217 0.1118979), wk = 0.0035336 k( 273) = ( 0.1315790 -0.1144743 0.1017254), wk = 0.0035336 k( 274) = ( 0.1184210 -0.1030269 0.0915528), wk = 0.0035336 k( 275) = ( 0.1052632 -0.0915794 0.0813803), wk = 0.0035336 k( 276) = ( 0.0921053 -0.0801320 0.0712078), wk = 0.0035336 k( 277) = ( 0.0789474 -0.0686846 0.0610352), wk = 0.0035336 k( 278) = ( 0.0657895 -0.0572371 0.0508627), wk = 0.0035336 k( 279) = ( 0.0526316 -0.0457897 0.0406902), wk = 0.0035336 k( 280) = ( 0.0394737 -0.0343423 0.0305176), wk = 0.0035336 k( 281) = ( 0.0263158 -0.0228949 0.0203451), wk = 0.0035336 k( 282) = ( 0.0131579 -0.0114474 0.0101725), wk = 0.0035336 k( 283) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 2) = ( 0.0161290 0.0161290 0.0000000), wk = 0.0035336 k( 3) = ( 0.0322581 0.0322581 0.0000000), wk = 0.0035336 k( 4) = ( 0.0483871 0.0483871 -0.0000000), wk = 0.0035336 k( 5) = ( 0.0645161 0.0645161 -0.0000000), wk = 0.0035336 k( 6) = ( 0.0806452 0.0806452 -0.0000000), wk = 0.0035336 k( 7) = ( 0.0967742 0.0967742 -0.0000000), wk = 0.0035336 k( 8) = ( 0.1129032 0.1129032 -0.0000000), wk = 0.0035336 k( 9) = ( 0.1290323 0.1290323 -0.0000000), wk = 0.0035336 k( 10) = ( 0.1451613 0.1451613 -0.0000000), wk = 0.0035336 k( 11) = ( 0.1612903 0.1612903 -0.0000000), wk = 0.0035336 k( 12) = ( 0.1774194 0.1774193 -0.0000000), wk = 0.0035336 k( 13) = ( 0.1935484 0.1935484 -0.0000000), wk = 0.0035336 k( 14) = ( 0.2096774 0.2096774 -0.0000000), wk = 0.0035336 k( 15) = ( 0.2258064 0.2258064 0.0000000), wk = 0.0035336 k( 16) = ( 0.2419355 0.2419355 0.0000000), wk = 0.0035336 k( 17) = ( 0.2580645 0.2580645 -0.0000000), wk = 0.0035336 k( 18) = ( 0.2741936 0.2741936 -0.0000000), wk = 0.0035336 k( 19) = ( 0.2903226 0.2903226 -0.0000000), wk = 0.0035336 k( 20) = ( 0.3064516 0.3064516 -0.0000000), wk = 0.0035336 k( 21) = ( 0.3225807 0.3225806 -0.0000000), wk = 0.0035336 k( 22) = ( 0.3387097 0.3387097 0.0000000), wk = 0.0035336 k( 23) = ( 0.3548387 0.3548387 0.0000000), wk = 0.0035336 k( 24) = ( 0.3709677 0.3709677 -0.0000000), wk = 0.0035336 k( 25) = ( 0.3870968 0.3870968 -0.0000000), wk = 0.0035336 k( 26) = ( 0.4032258 0.4032258 0.0000000), wk = 0.0035336 k( 27) = ( 0.4193548 0.4193548 -0.0000000), wk = 0.0035336 k( 28) = ( 0.4354839 0.4354839 -0.0000000), wk = 0.0035336 k( 29) = ( 0.4516129 0.4516129 0.0000000), wk = 0.0035336 k( 30) = ( 0.4677419 0.4677419 -0.0000000), wk = 0.0035336 k( 31) = ( 0.4838710 0.4838710 -0.0000000), wk = 0.0035336 k( 32) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035336 k( 33) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035336 k( 34) = ( 0.5081541 0.5081541 0.0211003), wk = 0.0035336 k( 35) = ( 0.5163083 0.5163083 0.0422006), wk = 0.0035336 k( 36) = ( 0.5244625 0.5244625 0.0633010), wk = 0.0035336 k( 37) = ( 0.5326166 0.5326166 0.0844013), wk = 0.0035336 k( 38) = ( 0.5407708 0.5407708 0.1055016), wk = 0.0035336 k( 39) = ( 0.5489249 0.5489249 0.1266019), wk = 0.0035336 k( 40) = ( 0.5570791 0.5570791 0.1477022), wk = 0.0035336 k( 41) = ( 0.5652332 0.5652332 0.1688025), wk = 0.0035336 k( 42) = ( 0.5733874 0.5733874 0.1899028), wk = 0.0035336 k( 43) = ( 0.5815415 0.5815415 0.2110032), wk = 0.0035336 k( 44) = ( 0.5896957 0.5896957 0.2321035), wk = 0.0035336 k( 45) = ( 0.5978498 0.5978498 0.2532038), wk = 0.0035336 k( 46) = ( 0.6060040 0.6060040 0.2743041), wk = 0.0035336 k( 47) = ( 0.6141581 0.6141581 0.2954044), wk = 0.0035336 k( 48) = ( 0.6141581 0.6141581 0.2954044), wk = 0.0035336 k( 49) = ( 0.6065476 0.6065476 0.3090441), wk = 0.0035336 k( 50) = ( 0.5989370 0.5989370 0.3226838), wk = 0.0035336 k( 51) = ( 0.5913265 0.5913265 0.3363235), wk = 0.0035336 k( 52) = ( 0.5837159 0.5837159 0.3499632), wk = 0.0035336 k( 53) = ( 0.5761054 0.5761054 0.3636029), wk = 0.0035336 k( 54) = ( 0.5684949 0.5684949 0.3772427), wk = 0.0035336 k( 55) = ( 0.5608843 0.5608843 0.3908823), wk = 0.0035336 k( 56) = ( 0.5532738 0.5532738 0.4045221), wk = 0.0035336 k( 57) = ( 0.5456633 0.5456632 0.4181618), wk = 0.0035336 k( 58) = ( 0.5380527 0.5380527 0.4318015), wk = 0.0035336 k( 59) = ( 0.5304422 0.5304422 0.4454412), wk = 0.0035336 k( 60) = ( 0.5228316 0.5228316 0.4590809), wk = 0.0035336 k( 61) = ( 0.5152211 0.5152211 0.4727206), wk = 0.0035336 k( 62) = ( 0.5076105 0.5076105 0.4863603), wk = 0.0035336 k( 63) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035336 k( 64) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0035336 k( 65) = ( 0.5083995 0.4916005 0.5000000), wk = 0.0035336 k( 66) = ( 0.5167989 0.4832010 0.5000000), wk = 0.0035336 k( 67) = ( 0.5251984 0.4748016 0.5000000), wk = 0.0035336 k( 68) = ( 0.5335979 0.4664021 0.5000000), wk = 0.0035336 k( 69) = ( 0.5419974 0.4580026 0.5000000), wk = 0.0035336 k( 70) = ( 0.5503968 0.4496032 0.5000000), wk = 0.0035336 k( 71) = ( 0.5587963 0.4412037 0.5000000), wk = 0.0035336 k( 72) = ( 0.5671958 0.4328042 0.5000000), wk = 0.0035336 k( 73) = ( 0.5755953 0.4244047 0.5000000), wk = 0.0035336 k( 74) = ( 0.5839947 0.4160053 0.5000000), wk = 0.0035336 k( 75) = ( 0.5923942 0.4076058 0.5000000), wk = 0.0035336 k( 76) = ( 0.6007937 0.3992063 0.5000000), wk = 0.0035336 k( 77) = ( 0.6091932 0.3908068 0.5000000), wk = 0.0035336 k( 78) = ( 0.6175926 0.3824074 0.5000000), wk = 0.0035336 k( 79) = ( 0.6259921 0.3740079 0.5000000), wk = 0.0035336 k( 80) = ( 0.6343916 0.3656084 0.5000000), wk = 0.0035336 k( 81) = ( 0.6427911 0.3572089 0.5000000), wk = 0.0035336 k( 82) = ( 0.6511905 0.3488095 0.5000000), wk = 0.0035336 k( 83) = ( 0.6595900 0.3404100 0.5000000), wk = 0.0035336 k( 84) = ( 0.6679895 0.3320105 0.5000000), wk = 0.0035336 k( 85) = ( 0.6763889 0.3236110 0.5000000), wk = 0.0035336 k( 86) = ( 0.6847884 0.3152116 0.5000000), wk = 0.0035336 k( 87) = ( 0.6931879 0.3068121 0.5000000), wk = 0.0035336 k( 88) = ( 0.7015874 0.2984126 0.5000000), wk = 0.0035336 k( 89) = ( 0.7099868 0.2900131 0.5000000), wk = 0.0035336 k( 90) = ( 0.7183863 0.2816137 0.5000000), wk = 0.0035336 k( 91) = ( 0.7267858 0.2732142 0.5000000), wk = 0.0035336 k( 92) = ( 0.7351853 0.2648147 0.5000000), wk = 0.0035336 k( 93) = ( 0.2648147 -0.2648147 0.5000000), wk = 0.0035336 k( 94) = ( 0.2565393 -0.2565393 0.5000000), wk = 0.0035336 k( 95) = ( 0.2482638 -0.2482638 0.5000000), wk = 0.0035336 k( 96) = ( 0.2399883 -0.2399883 0.5000000), wk = 0.0035336 k( 97) = ( 0.2317129 -0.2317129 0.5000000), wk = 0.0035336 k( 98) = ( 0.2234374 -0.2234374 0.5000000), wk = 0.0035336 k( 99) = ( 0.2151620 -0.2151620 0.5000000), wk = 0.0035336 k( 100) = ( 0.2068865 -0.2068865 0.5000000), wk = 0.0035336 k( 101) = ( 0.1986111 -0.1986111 0.5000000), wk = 0.0035336 k( 102) = ( 0.1903356 -0.1903356 0.5000000), wk = 0.0035336 k( 103) = ( 0.1820601 -0.1820601 0.5000000), wk = 0.0035336 k( 104) = ( 0.1737847 -0.1737847 0.5000000), wk = 0.0035336 k( 105) = ( 0.1655092 -0.1655092 0.5000000), wk = 0.0035336 k( 106) = ( 0.1572338 -0.1572338 0.5000000), wk = 0.0035336 k( 107) = ( 0.1489583 -0.1489583 0.5000000), wk = 0.0035336 k( 108) = ( 0.1406828 -0.1406828 0.5000000), wk = 0.0035336 k( 109) = ( 0.1324074 -0.1324074 0.5000000), wk = 0.0035336 k( 110) = ( 0.1241319 -0.1241319 0.5000000), wk = 0.0035336 k( 111) = ( 0.1158564 -0.1158565 0.5000000), wk = 0.0035336 k( 112) = ( 0.1075810 -0.1075810 0.5000000), wk = 0.0035336 k( 113) = ( 0.0993055 -0.0993055 0.5000000), wk = 0.0035336 k( 114) = ( 0.0910301 -0.0910301 0.5000000), wk = 0.0035336 k( 115) = ( 0.0827546 -0.0827546 0.5000000), wk = 0.0035336 k( 116) = ( 0.0744791 -0.0744791 0.5000000), wk = 0.0035336 k( 117) = ( 0.0662037 -0.0662037 0.5000000), wk = 0.0035336 k( 118) = ( 0.0579282 -0.0579282 0.5000000), wk = 0.0035336 k( 119) = ( 0.0496528 -0.0496528 0.5000000), wk = 0.0035336 k( 120) = ( 0.0413773 -0.0413773 0.5000000), wk = 0.0035336 k( 121) = ( 0.0331018 -0.0331018 0.5000000), wk = 0.0035336 k( 122) = ( 0.0248264 -0.0248264 0.5000000), wk = 0.0035336 k( 123) = ( 0.0165509 -0.0165509 0.5000000), wk = 0.0035336 k( 124) = ( 0.0082755 -0.0082755 0.5000000), wk = 0.0035336 k( 125) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035336 k( 126) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0035336 k( 127) = ( 0.0183734 0.0183734 0.5097426), wk = 0.0035336 k( 128) = ( 0.0367468 0.0367468 0.5194853), wk = 0.0035336 k( 129) = ( 0.0551203 0.0551203 0.5292279), wk = 0.0035336 k( 130) = ( 0.0734937 0.0734937 0.5389706), wk = 0.0035336 k( 131) = ( 0.0918671 0.0918671 0.5487132), wk = 0.0035336 k( 132) = ( 0.1102405 0.1102405 0.5584559), wk = 0.0035336 k( 133) = ( 0.1286140 0.1286140 0.5681985), wk = 0.0035336 k( 134) = ( 0.1469874 0.1469874 0.5779412), wk = 0.0035336 k( 135) = ( 0.1653608 0.1653608 0.5876838), wk = 0.0035336 k( 136) = ( 0.1837342 0.1837342 0.5974265), wk = 0.0035336 k( 137) = ( 0.2021076 0.2021076 0.6071691), wk = 0.0035336 k( 138) = ( 0.2204811 0.2204811 0.6169118), wk = 0.0035336 k( 139) = ( 0.2388545 0.2388545 0.6266544), wk = 0.0035336 k( 140) = ( 0.2572279 0.2572279 0.6363971), wk = 0.0035336 k( 141) = ( 0.2756014 0.2756014 0.6461397), wk = 0.0035336 k( 142) = ( 0.2939748 0.2939748 0.6558823), wk = 0.0035336 k( 143) = ( 0.3123482 0.3123482 0.6656250), wk = 0.0035336 k( 144) = ( 0.3307216 0.3307216 0.6753677), wk = 0.0035336 k( 145) = ( 0.3490950 0.3490950 0.6851103), wk = 0.0035336 k( 146) = ( 0.3674685 0.3674685 0.6948529), wk = 0.0035336 k( 147) = ( 0.3858419 0.3858419 0.7045956), wk = 0.0035336 k( 148) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0035336 k( 149) = ( 0.5083985 0.4916015 -0.0000000), wk = 0.0035336 k( 150) = ( 0.5167970 0.4832030 -0.0000000), wk = 0.0035336 k( 151) = ( 0.5251955 0.4748044 -0.0000000), wk = 0.0035336 k( 152) = ( 0.5335941 0.4664059 -0.0000000), wk = 0.0035336 k( 153) = ( 0.5419926 0.4580074 -0.0000000), wk = 0.0035336 k( 154) = ( 0.5503911 0.4496089 -0.0000000), wk = 0.0035336 k( 155) = ( 0.5587896 0.4412104 -0.0000000), wk = 0.0035336 k( 156) = ( 0.5671881 0.4328119 -0.0000000), wk = 0.0035336 k( 157) = ( 0.5755867 0.4244133 -0.0000000), wk = 0.0035336 k( 158) = ( 0.5839852 0.4160148 0.0000000), wk = 0.0035336 k( 159) = ( 0.5923837 0.4076163 -0.0000000), wk = 0.0035336 k( 160) = ( 0.6007822 0.3992178 -0.0000000), wk = 0.0035336 k( 161) = ( 0.6091807 0.3908193 -0.0000000), wk = 0.0035336 k( 162) = ( 0.6175792 0.3824208 -0.0000000), wk = 0.0035336 k( 163) = ( 0.6259778 0.3740222 0.0000000), wk = 0.0035336 k( 164) = ( 0.6343763 0.3656237 -0.0000000), wk = 0.0035336 k( 165) = ( 0.6427748 0.3572252 -0.0000000), wk = 0.0035336 k( 166) = ( 0.6511733 0.3488267 -0.0000000), wk = 0.0035336 k( 167) = ( 0.6595718 0.3404282 -0.0000000), wk = 0.0035336 k( 168) = ( 0.6679704 0.3320296 0.0000000), wk = 0.0035336 k( 169) = ( 0.6763689 0.3236311 -0.0000000), wk = 0.0035336 k( 170) = ( 0.6847674 0.3152326 -0.0000000), wk = 0.0035336 k( 171) = ( 0.3152326 -0.3152326 0.0000000), wk = 0.0035336 k( 172) = ( 0.3069370 -0.3069370 0.0000000), wk = 0.0035336 k( 173) = ( 0.2986414 -0.2986414 -0.0000000), wk = 0.0035336 k( 174) = ( 0.2903458 -0.2903458 -0.0000000), wk = 0.0035336 k( 175) = ( 0.2820502 -0.2820502 -0.0000000), wk = 0.0035336 k( 176) = ( 0.2737546 -0.2737546 0.0000000), wk = 0.0035336 k( 177) = ( 0.2654590 -0.2654590 0.0000000), wk = 0.0035336 k( 178) = ( 0.2571635 -0.2571635 -0.0000000), wk = 0.0035336 k( 179) = ( 0.2488679 -0.2488679 -0.0000000), wk = 0.0035336 k( 180) = ( 0.2405723 -0.2405723 -0.0000000), wk = 0.0035336 k( 181) = ( 0.2322767 -0.2322767 -0.0000000), wk = 0.0035336 k( 182) = ( 0.2239811 -0.2239811 -0.0000000), wk = 0.0035336 k( 183) = ( 0.2156855 -0.2156855 -0.0000000), wk = 0.0035336 k( 184) = ( 0.2073899 -0.2073899 -0.0000000), wk = 0.0035336 k( 185) = ( 0.1990943 -0.1990943 -0.0000000), wk = 0.0035336 k( 186) = ( 0.1907987 -0.1907987 -0.0000000), wk = 0.0035336 k( 187) = ( 0.1825031 -0.1825031 0.0000000), wk = 0.0035336 k( 188) = ( 0.1742075 -0.1742075 -0.0000000), wk = 0.0035336 k( 189) = ( 0.1659119 -0.1659119 0.0000000), wk = 0.0035336 k( 190) = ( 0.1576163 -0.1576163 0.0000000), wk = 0.0035336 k( 191) = ( 0.1493207 -0.1493207 -0.0000000), wk = 0.0035336 k( 192) = ( 0.1410251 -0.1410251 -0.0000000), wk = 0.0035336 k( 193) = ( 0.1327295 -0.1327295 0.0000000), wk = 0.0035336 k( 194) = ( 0.1244339 -0.1244339 -0.0000000), wk = 0.0035336 k( 195) = ( 0.1161383 -0.1161383 -0.0000000), wk = 0.0035336 k( 196) = ( 0.1078427 -0.1078427 -0.0000000), wk = 0.0035336 k( 197) = ( 0.0995471 -0.0995471 -0.0000000), wk = 0.0035336 k( 198) = ( 0.0912516 -0.0912516 -0.0000000), wk = 0.0035336 k( 199) = ( 0.0829560 -0.0829560 0.0000000), wk = 0.0035336 k( 200) = ( 0.0746604 -0.0746604 -0.0000000), wk = 0.0035336 k( 201) = ( 0.0663648 -0.0663648 0.0000000), wk = 0.0035336 k( 202) = ( 0.0580692 -0.0580692 -0.0000000), wk = 0.0035336 k( 203) = ( 0.0497736 -0.0497736 -0.0000000), wk = 0.0035336 k( 204) = ( 0.0414780 -0.0414780 0.0000000), wk = 0.0035336 k( 205) = ( 0.0331824 -0.0331824 0.0000000), wk = 0.0035336 k( 206) = ( 0.0248868 -0.0248868 -0.0000000), wk = 0.0035336 k( 207) = ( 0.0165912 -0.0165912 0.0000000), wk = 0.0035336 k( 208) = ( 0.0082956 -0.0082956 0.0000000), wk = 0.0035336 k( 209) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 210) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 k( 211) = ( 0.0147059 -0.0000000 0.0000000), wk = 0.0035336 k( 212) = ( 0.0294118 -0.0000000 0.0000000), wk = 0.0035336 k( 213) = ( 0.0441177 -0.0000000 -0.0000000), wk = 0.0035336 k( 214) = ( 0.0588235 -0.0000000 -0.0000000), wk = 0.0035336 k( 215) = ( 0.0735294 -0.0000000 0.0000000), wk = 0.0035336 k( 216) = ( 0.0882353 -0.0000000 0.0000000), wk = 0.0035336 k( 217) = ( 0.1029412 -0.0000000 -0.0000000), wk = 0.0035336 k( 218) = ( 0.1176471 -0.0000000 -0.0000000), wk = 0.0035336 k( 219) = ( 0.1323529 -0.0000000 0.0000000), wk = 0.0035336 k( 220) = ( 0.1470588 -0.0000000 0.0000000), wk = 0.0035336 k( 221) = ( 0.1617647 -0.0000000 -0.0000000), wk = 0.0035336 k( 222) = ( 0.1764706 -0.0000000 0.0000000), wk = 0.0035336 k( 223) = ( 0.1911765 -0.0000000 -0.0000000), wk = 0.0035336 k( 224) = ( 0.2058823 -0.0000000 -0.0000000), wk = 0.0035336 k( 225) = ( 0.2205882 -0.0000000 -0.0000000), wk = 0.0035336 k( 226) = ( 0.2352941 -0.0000000 -0.0000000), wk = 0.0035336 k( 227) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0035336 k( 228) = ( 0.2647059 -0.0000000 0.0000000), wk = 0.0035336 k( 229) = ( 0.2794118 -0.0000000 0.0000000), wk = 0.0035336 k( 230) = ( 0.2941177 -0.0000000 -0.0000000), wk = 0.0035336 k( 231) = ( 0.3088235 -0.0000000 -0.0000000), wk = 0.0035336 k( 232) = ( 0.3235294 -0.0000000 0.0000000), wk = 0.0035336 k( 233) = ( 0.3382353 -0.0000000 -0.0000000), wk = 0.0035336 k( 234) = ( 0.3529412 -0.0000000 0.0000000), wk = 0.0035336 k( 235) = ( 0.3676471 -0.0000000 -0.0000000), wk = 0.0035336 k( 236) = ( 0.3823529 -0.0000000 -0.0000000), wk = 0.0035336 k( 237) = ( 0.3970588 -0.0000000 -0.0000000), wk = 0.0035336 k( 238) = ( 0.4117647 -0.0000000 -0.0000000), wk = 0.0035336 k( 239) = ( 0.4264706 -0.0000000 -0.0000000), wk = 0.0035336 k( 240) = ( 0.4411765 -0.0000000 -0.0000000), wk = 0.0035336 k( 241) = ( 0.4558823 -0.0000000 -0.0000000), wk = 0.0035336 k( 242) = ( 0.4705882 -0.0000000 -0.0000000), wk = 0.0035336 k( 243) = ( 0.4852941 -0.0000000 -0.0000000), wk = 0.0035336 k( 244) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0035336 k( 245) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0035336 k( 246) = ( 0.4868421 -0.0000000 0.4868421), wk = 0.0035336 k( 247) = ( 0.4736842 0.0000000 0.4736842), wk = 0.0035336 k( 248) = ( 0.4605263 -0.0000000 0.4605263), wk = 0.0035336 k( 249) = ( 0.4473684 -0.0000000 0.4473684), wk = 0.0035336 k( 250) = ( 0.4342105 -0.0000000 0.4342105), wk = 0.0035336 k( 251) = ( 0.4210526 -0.0000000 0.4210526), wk = 0.0035336 k( 252) = ( 0.4078947 -0.0000000 0.4078947), wk = 0.0035336 k( 253) = ( 0.3947368 -0.0000000 0.3947368), wk = 0.0035336 k( 254) = ( 0.3815789 -0.0000000 0.3815790), wk = 0.0035336 k( 255) = ( 0.3684211 -0.0000000 0.3684211), wk = 0.0035336 k( 256) = ( 0.3552632 -0.0000000 0.3552632), wk = 0.0035336 k( 257) = ( 0.3421053 -0.0000000 0.3421053), wk = 0.0035336 k( 258) = ( 0.3289474 -0.0000000 0.3289474), wk = 0.0035336 k( 259) = ( 0.3157895 -0.0000000 0.3157895), wk = 0.0035336 k( 260) = ( 0.3026316 -0.0000000 0.3026316), wk = 0.0035336 k( 261) = ( 0.2894737 0.0000000 0.2894737), wk = 0.0035336 k( 262) = ( 0.2763158 -0.0000000 0.2763158), wk = 0.0035336 k( 263) = ( 0.2631579 -0.0000000 0.2631579), wk = 0.0035336 k( 264) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0035336 k( 265) = ( 0.2368421 -0.0000000 0.2368421), wk = 0.0035336 k( 266) = ( 0.2236842 -0.0000000 0.2236842), wk = 0.0035336 k( 267) = ( 0.2105263 -0.0000000 0.2105263), wk = 0.0035336 k( 268) = ( 0.1973684 -0.0000000 0.1973684), wk = 0.0035336 k( 269) = ( 0.1842105 -0.0000000 0.1842105), wk = 0.0035336 k( 270) = ( 0.1710526 -0.0000000 0.1710526), wk = 0.0035336 k( 271) = ( 0.1578947 -0.0000000 0.1578947), wk = 0.0035336 k( 272) = ( 0.1447368 0.0000000 0.1447368), wk = 0.0035336 k( 273) = ( 0.1315790 -0.0000000 0.1315790), wk = 0.0035336 k( 274) = ( 0.1184210 -0.0000000 0.1184211), wk = 0.0035336 k( 275) = ( 0.1052632 -0.0000000 0.1052632), wk = 0.0035336 k( 276) = ( 0.0921053 -0.0000000 0.0921053), wk = 0.0035336 k( 277) = ( 0.0789474 -0.0000000 0.0789474), wk = 0.0035336 k( 278) = ( 0.0657895 -0.0000000 0.0657895), wk = 0.0035336 k( 279) = ( 0.0526316 -0.0000000 0.0526316), wk = 0.0035336 k( 280) = ( 0.0394737 0.0000000 0.0394737), wk = 0.0035336 k( 281) = ( 0.0263158 -0.0000000 0.0263158), wk = 0.0035336 k( 282) = ( 0.0131579 -0.0000000 0.0131579), wk = 0.0035336 k( 283) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0035336 Dense grid: 79389 G-vectors FFT dimensions: ( 60, 60, 64) Smooth grid: 53941 G-vectors FFT dimensions: ( 54, 54, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.46 Mb ( 380, 80) NL pseudopotentials 0.79 Mb ( 190, 272) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2205) G-vector shells 0.02 Mb ( 2142) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.86 Mb ( 380, 320) Each subspace H/S matrix 0.10 Mb ( 80, 80) Each matrix 0.66 Mb ( 272, 2, 80) The potential is recalculated from file : ./TlFeS2.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.3 secs Computing kpt #: 2 total cpu time spent up to now is 5.5 secs Computing kpt #: 3 total cpu time spent up to now is 6.7 secs Computing kpt #: 4 total cpu time spent up to now is 7.9 secs Computing kpt #: 5 total cpu time spent up to now is 9.3 secs Computing kpt #: 6 total cpu time spent up to now is 10.6 secs Computing kpt #: 7 total cpu time spent up to now is 12.0 secs Computing kpt #: 8 total cpu time spent up to now is 13.4 secs Computing kpt #: 9 total cpu time spent up to now is 14.7 secs Computing kpt #: 10 total cpu time spent up to now is 16.1 secs Computing kpt #: 11 total cpu time spent up to now is 17.5 secs Computing kpt #: 12 total cpu time spent up to now is 18.9 secs Computing kpt #: 13 total cpu time spent up to now is 20.3 secs Computing kpt #: 14 total cpu time spent up to now is 21.5 secs Computing kpt #: 15 total cpu time spent up to now is 22.7 secs Computing kpt #: 16 total cpu time spent up to now is 23.9 secs Computing kpt #: 17 total cpu time spent up to now is 25.1 secs Computing kpt #: 18 total cpu time spent up to now is 26.3 secs Computing kpt #: 19 total cpu time spent up to now is 27.5 secs Computing kpt #: 20 total cpu time spent up to now is 28.6 secs Computing kpt #: 21 total cpu time spent up to now is 29.8 secs Computing kpt #: 22 total cpu time spent up to now is 30.9 secs Computing kpt #: 23 total cpu time spent up to now is 32.1 secs Computing kpt #: 24 total cpu time spent up to now is 33.2 secs Computing kpt #: 25 total cpu time spent up to now is 34.3 secs Computing kpt #: 26 total cpu time spent up to now is 35.5 secs Computing kpt #: 27 total cpu time spent up to now is 36.6 secs Computing kpt #: 28 total cpu time spent up to now is 37.7 secs Computing kpt #: 29 total cpu time spent up to now is 38.9 secs Computing kpt #: 30 total cpu time spent up to now is 40.0 secs Computing kpt #: 31 total cpu time spent up to now is 41.1 secs Computing kpt #: 32 total cpu time spent up to now is 42.2 secs Computing kpt #: 33 total cpu time spent up to now is 43.4 secs Computing kpt #: 34 total cpu time spent up to now is 44.5 secs Computing kpt #: 35 total cpu time spent up to now is 45.7 secs Computing kpt #: 36 total cpu time spent up to now is 46.8 secs Computing kpt #: 37 total cpu time spent up to now is 48.0 secs Computing kpt #: 38 total cpu time spent up to now is 49.1 secs Computing kpt #: 39 total cpu time spent up to now is 50.3 secs Computing kpt #: 40 total cpu time spent up to now is 51.4 secs Computing kpt #: 41 total cpu time spent up to now is 52.5 secs Computing kpt #: 42 total cpu time spent up to now is 53.7 secs Computing kpt #: 43 total cpu time spent up to now is 54.8 secs Computing kpt #: 44 total cpu time spent up to now is 56.0 secs Computing kpt #: 45 total cpu time spent up to now is 57.1 secs Computing kpt #: 46 total cpu time spent up to now is 58.2 secs Computing kpt #: 47 total cpu time spent up to now is 59.3 secs Computing kpt #: 48 total cpu time spent up to now is 60.4 secs Computing kpt #: 49 total cpu time spent up to now is 61.5 secs Computing kpt #: 50 total cpu time spent up to now is 62.6 secs Computing kpt #: 51 total cpu time spent up to now is 63.8 secs Computing kpt #: 52 total cpu time spent up to now is 64.9 secs Computing kpt #: 53 total cpu time spent up to now is 66.0 secs Computing kpt #: 54 total cpu time spent up to now is 67.1 secs Computing kpt #: 55 total cpu time spent up to now is 68.2 secs Computing kpt #: 56 total cpu time spent up to now is 69.4 secs Computing kpt #: 57 total cpu time spent up to now is 70.5 secs Computing kpt #: 58 total cpu time spent up to now is 71.6 secs Computing kpt #: 59 total cpu time spent up to now is 72.7 secs Computing kpt #: 60 total cpu time spent up to now is 73.8 secs Computing kpt #: 61 total cpu time spent up to now is 74.9 secs Computing kpt #: 62 total cpu time spent up to now is 76.0 secs Computing kpt #: 63 total cpu time spent up to now is 77.1 secs Computing kpt #: 64 total cpu time spent up to now is 78.2 secs Computing kpt #: 65 total cpu time spent up to now is 79.3 secs Computing kpt #: 66 total cpu time spent up to now is 80.4 secs Computing kpt #: 67 total cpu time spent up to now is 81.6 secs Computing kpt #: 68 total cpu time spent up to now is 82.7 secs Computing kpt #: 69 total cpu time spent up to now is 83.8 secs Computing kpt #: 70 total cpu time spent up to now is 84.9 secs Computing kpt #: 71 total cpu time spent up to now is 86.0 secs Computing kpt #: 72 total cpu time spent up to now is 87.1 secs Computing kpt #: 73 total cpu time spent up to now is 88.2 secs Computing kpt #: 74 total cpu time spent up to now is 89.3 secs Computing kpt #: 75 total cpu time spent up to now is 90.5 secs Computing kpt #: 76 total cpu time spent up to now is 91.6 secs Computing kpt #: 77 total cpu time spent up to now is 92.7 secs Computing kpt #: 78 total cpu time spent up to now is 93.9 secs Computing kpt #: 79 total cpu time spent up to now is 95.1 secs Computing kpt #: 80 total cpu time spent up to now is 96.2 secs Computing kpt #: 81 total cpu time spent up to now is 97.4 secs Computing kpt #: 82 total cpu time spent up to now is 98.5 secs Computing kpt #: 83 total cpu time spent up to now is 99.7 secs Computing kpt #: 84 total cpu time spent up to now is 100.9 secs Computing kpt #: 85 total cpu time spent up to now is 102.0 secs Computing kpt #: 86 total cpu time spent up to now is 103.2 secs Computing kpt #: 87 total cpu time spent up to now is 104.3 secs Computing kpt #: 88 total cpu time spent up to now is 105.5 secs Computing kpt #: 89 total cpu time spent up to now is 106.6 secs Computing kpt #: 90 total cpu time spent up to now is 107.7 secs Computing kpt #: 91 total cpu time spent up to now is 108.9 secs Computing kpt #: 92 total cpu time spent up to now is 110.1 secs Computing kpt #: 93 total cpu time spent up to now is 111.2 secs Computing kpt #: 94 total cpu time spent up to now is 112.4 secs Computing kpt #: 95 total cpu time spent up to now is 114.0 secs Computing kpt #: 96 total cpu time spent up to now is 115.1 secs Computing kpt #: 97 total cpu time spent up to now is 116.3 secs Computing kpt #: 98 total cpu time spent up to now is 117.4 secs Computing kpt #: 99 total cpu time spent up to now is 118.6 secs Computing kpt #: 100 total cpu time spent up to now is 119.7 secs Computing kpt #: 101 total cpu time spent up to now is 120.9 secs Computing kpt #: 102 total cpu time spent up to now is 122.1 secs Computing kpt #: 103 total cpu time spent up to now is 123.2 secs Computing kpt #: 104 total cpu time spent up to now is 124.3 secs Computing kpt #: 105 total cpu time spent up to now is 125.5 secs Computing kpt #: 106 total cpu time spent up to now is 126.6 secs Computing kpt #: 107 total cpu time spent up to now is 127.8 secs Computing kpt #: 108 total cpu time spent up to now is 128.9 secs Computing kpt #: 109 total cpu time spent up to now is 130.1 secs Computing kpt #: 110 total cpu time spent up to now is 131.3 secs Computing kpt #: 111 total cpu time spent up to now is 132.5 secs Computing kpt #: 112 total cpu time spent up to now is 133.7 secs Computing kpt #: 113 total cpu time spent up to now is 134.9 secs Computing kpt #: 114 total cpu time spent up to now is 136.1 secs Computing kpt #: 115 total cpu time spent up to now is 137.4 secs Computing kpt #: 116 total cpu time spent up to now is 138.6 secs Computing kpt #: 117 total cpu time spent up to now is 139.8 secs Computing kpt #: 118 total cpu time spent up to now is 141.1 secs Computing kpt #: 119 total cpu time spent up to now is 142.3 secs Computing kpt #: 120 total cpu time spent up to now is 143.5 secs Computing kpt #: 121 total cpu time spent up to now is 144.7 secs Computing kpt #: 122 total cpu time spent up to now is 145.9 secs Computing kpt #: 123 total cpu time spent up to now is 147.2 secs Computing kpt #: 124 total cpu time spent up to now is 148.3 secs Computing kpt #: 125 total cpu time spent up to now is 149.5 secs Computing kpt #: 126 total cpu time spent up to now is 150.6 secs Computing kpt #: 127 total cpu time spent up to now is 151.8 secs Computing kpt #: 128 total cpu time spent up to now is 153.0 secs Computing kpt #: 129 total cpu time spent up to now is 154.1 secs Computing kpt #: 130 total cpu time spent up to now is 155.3 secs Computing kpt #: 131 total cpu time spent up to now is 156.5 secs Computing kpt #: 132 total cpu time spent up to now is 157.6 secs Computing kpt #: 133 total cpu time spent up to now is 158.8 secs Computing kpt #: 134 total cpu time spent up to now is 160.0 secs Computing kpt #: 135 total cpu time spent up to now is 161.1 secs Computing kpt #: 136 total cpu time spent up to now is 162.3 secs Computing kpt #: 137 total cpu time spent up to now is 163.4 secs Computing kpt #: 138 total cpu time spent up to now is 164.6 secs Computing kpt #: 139 total cpu time spent up to now is 165.7 secs Computing kpt #: 140 total cpu time spent up to now is 166.8 secs Computing kpt #: 141 total cpu time spent up to now is 168.0 secs Computing kpt #: 142 total cpu time spent up to now is 169.1 secs Computing kpt #: 143 total cpu time spent up to now is 170.2 secs Computing kpt #: 144 total cpu time spent up to now is 171.3 secs Computing kpt #: 145 total cpu time spent up to now is 172.5 secs Computing kpt #: 146 total cpu time spent up to now is 173.6 secs Computing kpt #: 147 total cpu time spent up to now is 174.7 secs Computing kpt #: 148 total cpu time spent up to now is 175.8 secs Computing kpt #: 149 total cpu time spent up to now is 177.0 secs Computing kpt #: 150 total cpu time spent up to now is 178.1 secs Computing kpt #: 151 total cpu time spent up to now is 179.3 secs Computing kpt #: 152 total cpu time spent up to now is 180.4 secs Computing kpt #: 153 total cpu time spent up to now is 181.5 secs Computing kpt #: 154 total cpu time spent up to now is 182.7 secs Computing kpt #: 155 total cpu time spent up to now is 183.9 secs Computing kpt #: 156 total cpu time spent up to now is 185.0 secs Computing kpt #: 157 total cpu time spent up to now is 186.2 secs Computing kpt #: 158 total cpu time spent up to now is 187.3 secs Computing kpt #: 159 total cpu time spent up to now is 188.5 secs Computing kpt #: 160 total cpu time spent up to now is 189.6 secs Computing kpt #: 161 total cpu time spent up to now is 190.7 secs Computing kpt #: 162 total cpu time spent up to now is 191.9 secs Computing kpt #: 163 total cpu time spent up to now is 193.0 secs Computing kpt #: 164 total cpu time spent up to now is 194.2 secs Computing kpt #: 165 total cpu time spent up to now is 195.3 secs Computing kpt #: 166 total cpu time spent up to now is 196.4 secs Computing kpt #: 167 total cpu time spent up to now is 197.5 secs Computing kpt #: 168 total cpu time spent up to now is 198.7 secs Computing kpt #: 169 total cpu time spent up to now is 199.8 secs Computing kpt #: 170 total cpu time spent up to now is 200.9 secs Computing kpt #: 171 total cpu time spent up to now is 202.1 secs Computing kpt #: 172 total cpu time spent up to now is 203.2 secs Computing kpt #: 173 total cpu time spent up to now is 204.4 secs Computing kpt #: 174 total cpu time spent up to now is 205.5 secs Computing kpt #: 175 total cpu time spent up to now is 206.6 secs Computing kpt #: 176 total cpu time spent up to now is 207.8 secs Computing kpt #: 177 total cpu time spent up to now is 208.9 secs Computing kpt #: 178 total cpu time spent up to now is 210.1 secs Computing kpt #: 179 total cpu time spent up to now is 211.2 secs Computing kpt #: 180 total cpu time spent up to now is 212.3 secs Computing kpt #: 181 total cpu time spent up to now is 213.4 secs Computing kpt #: 182 total cpu time spent up to now is 214.5 secs Computing kpt #: 183 total cpu time spent up to now is 215.6 secs Computing kpt #: 184 total cpu time spent up to now is 216.8 secs Computing kpt #: 185 total cpu time spent up to now is 217.9 secs Computing kpt #: 186 total cpu time spent up to now is 219.1 secs Computing kpt #: 187 total cpu time spent up to now is 220.2 secs Computing kpt #: 188 total cpu time spent up to now is 221.4 secs Computing kpt #: 189 total cpu time spent up to now is 222.5 secs Computing kpt #: 190 total cpu time spent up to now is 223.7 secs Computing kpt #: 191 total cpu time spent up to now is 224.9 secs Computing kpt #: 192 total cpu time spent up to now is 226.1 secs Computing kpt #: 193 total cpu time spent up to now is 227.3 secs Computing kpt #: 194 total cpu time spent up to now is 228.5 secs Computing kpt #: 195 total cpu time spent up to now is 229.9 secs Computing kpt #: 196 total cpu time spent up to now is 231.2 secs Computing kpt #: 197 total cpu time spent up to now is 232.6 secs Computing kpt #: 198 total cpu time spent up to now is 233.9 secs Computing kpt #: 199 total cpu time spent up to now is 235.3 secs Computing kpt #: 200 total cpu time spent up to now is 236.7 secs Computing kpt #: 201 total cpu time spent up to now is 238.0 secs Computing kpt #: 202 total cpu time spent up to now is 239.4 secs Computing kpt #: 203 total cpu time spent up to now is 240.8 secs Computing kpt #: 204 total cpu time spent up to now is 242.2 secs Computing kpt #: 205 total cpu time spent up to now is 243.5 secs Computing kpt #: 206 total cpu time spent up to now is 244.9 secs Computing kpt #: 207 total cpu time spent up to now is 246.2 secs Computing kpt #: 208 total cpu time spent up to now is 247.4 secs Computing kpt #: 209 total cpu time spent up to now is 248.6 secs Computing kpt #: 210 total cpu time spent up to now is 249.8 secs Computing kpt #: 211 total cpu time spent up to now is 251.0 secs Computing kpt #: 212 total cpu time spent up to now is 252.2 secs Computing kpt #: 213 total cpu time spent up to now is 254.0 secs Computing kpt #: 214 total cpu time spent up to now is 255.3 secs Computing kpt #: 215 total cpu time spent up to now is 256.7 secs Computing kpt #: 216 total cpu time spent up to now is 258.1 secs Computing kpt #: 217 total cpu time spent up to now is 259.4 secs Computing kpt #: 218 total cpu time spent up to now is 260.8 secs Computing kpt #: 219 total cpu time spent up to now is 262.2 secs Computing kpt #: 220 total cpu time spent up to now is 263.4 secs Computing kpt #: 221 total cpu time spent up to now is 264.6 secs Computing kpt #: 222 total cpu time spent up to now is 265.8 secs Computing kpt #: 223 total cpu time spent up to now is 267.0 secs Computing kpt #: 224 total cpu time spent up to now is 268.1 secs Computing kpt #: 225 total cpu time spent up to now is 269.3 secs Computing kpt #: 226 total cpu time spent up to now is 270.4 secs Computing kpt #: 227 total cpu time spent up to now is 271.5 secs Computing kpt #: 228 total cpu time spent up to now is 272.7 secs Computing kpt #: 229 total cpu time spent up to now is 273.8 secs Computing kpt #: 230 total cpu time spent up to now is 275.0 secs Computing kpt #: 231 total cpu time spent up to now is 276.1 secs Computing kpt #: 232 total cpu time spent up to now is 277.3 secs Computing kpt #: 233 total cpu time spent up to now is 278.4 secs Computing kpt #: 234 total cpu time spent up to now is 279.6 secs Computing kpt #: 235 total cpu time spent up to now is 280.7 secs Computing kpt #: 236 total cpu time spent up to now is 281.8 secs Computing kpt #: 237 total cpu time spent up to now is 283.0 secs Computing kpt #: 238 total cpu time spent up to now is 284.1 secs Computing kpt #: 239 total cpu time spent up to now is 285.2 secs Computing kpt #: 240 total cpu time spent up to now is 286.4 secs Computing kpt #: 241 total cpu time spent up to now is 287.5 secs Computing kpt #: 242 total cpu time spent up to now is 288.8 secs Computing kpt #: 243 total cpu time spent up to now is 289.9 secs Computing kpt #: 244 total cpu time spent up to now is 291.0 secs Computing kpt #: 245 total cpu time spent up to now is 292.1 secs Computing kpt #: 246 total cpu time spent up to now is 293.3 secs Computing kpt #: 247 total cpu time spent up to now is 294.4 secs Computing kpt #: 248 total cpu time spent up to now is 295.5 secs Computing kpt #: 249 total cpu time spent up to now is 296.6 secs Computing kpt #: 250 total cpu time spent up to now is 297.7 secs Computing kpt #: 251 total cpu time spent up to now is 298.8 secs Computing kpt #: 252 total cpu time spent up to now is 300.0 secs Computing kpt #: 253 total cpu time spent up to now is 301.1 secs Computing kpt #: 254 total cpu time spent up to now is 302.3 secs Computing kpt #: 255 total cpu time spent up to now is 303.4 secs Computing kpt #: 256 total cpu time spent up to now is 304.5 secs Computing kpt #: 257 total cpu time spent up to now is 305.7 secs Computing kpt #: 258 total cpu time spent up to now is 306.8 secs Computing kpt #: 259 total cpu time spent up to now is 308.0 secs Computing kpt #: 260 total cpu time spent up to now is 309.1 secs Computing kpt #: 261 total cpu time spent up to now is 310.3 secs Computing kpt #: 262 total cpu time spent up to now is 311.5 secs Computing kpt #: 263 total cpu time spent up to now is 312.7 secs Computing kpt #: 264 total cpu time spent up to now is 313.8 secs Computing kpt #: 265 total cpu time spent up to now is 315.0 secs Computing kpt #: 266 total cpu time spent up to now is 316.2 secs Computing kpt #: 267 total cpu time spent up to now is 317.4 secs Computing kpt #: 268 total cpu time spent up to now is 318.6 secs Computing kpt #: 269 total cpu time spent up to now is 320.0 secs Computing kpt #: 270 total cpu time spent up to now is 321.3 secs Computing kpt #: 271 total cpu time spent up to now is 322.5 secs Computing kpt #: 272 total cpu time spent up to now is 324.0 secs Computing kpt #: 273 total cpu time spent up to now is 325.2 secs Computing kpt #: 274 total cpu time spent up to now is 326.4 secs Computing kpt #: 275 total cpu time spent up to now is 327.6 secs Computing kpt #: 276 total cpu time spent up to now is 329.0 secs Computing kpt #: 277 total cpu time spent up to now is 330.4 secs Computing kpt #: 278 total cpu time spent up to now is 331.7 secs Computing kpt #: 279 total cpu time spent up to now is 333.1 secs Computing kpt #: 280 total cpu time spent up to now is 334.5 secs Computing kpt #: 281 total cpu time spent up to now is 335.8 secs Computing kpt #: 282 total cpu time spent up to now is 337.0 secs Computing kpt #: 283 total cpu time spent up to now is 338.2 secs ethr = 1.52E-08, avg # of iterations = 17.9 total cpu time spent up to now is 338.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6731 PWs) bands (ev): -6.8340 -6.8340 -6.0300 -6.0300 -5.9062 -5.9062 -5.8189 -5.8189 -5.6208 -5.6208 -5.5365 -5.5365 -5.5265 -5.5265 -5.3613 -5.3613 -3.4732 -3.4732 -3.4529 -3.4529 -3.4434 -3.4434 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6133 0.6133 1.4878 1.4878 2.0088 2.0088 2.5429 2.5429 2.6293 2.6293 2.9142 2.9142 3.0463 3.0463 3.0761 3.0761 3.2958 3.2958 3.3252 3.3252 3.4675 3.4675 3.8286 3.8286 4.6312 4.6312 4.7586 4.7586 5.0538 5.0538 5.5785 5.5785 5.7115 5.7115 6.0628 6.0628 6.2510 6.2510 6.3547 6.3547 6.9257 6.9257 7.2135 7.2135 7.3046 7.3046 7.5326 7.5326 9.1804 9.1804 10.1915 10.1915 k = 0.0161 0.0073-0.0090 ( 6736 PWs) bands (ev): -6.8335 -6.8335 -6.0302 -6.0302 -5.9065 -5.9065 -5.8189 -5.8189 -5.6208 -5.6208 -5.5369 -5.5369 -5.5263 -5.5263 -5.3615 -5.3615 -3.4732 -3.4732 -3.4529 -3.4529 -3.4434 -3.4434 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6132 0.6132 1.4850 1.4850 2.0096 2.0096 2.5387 2.5387 2.6275 2.6275 2.9161 2.9161 3.0475 3.0475 3.0801 3.0801 3.2962 3.2962 3.3256 3.3256 3.4709 3.4709 3.8287 3.8287 4.6291 4.6291 4.7590 4.7590 5.0552 5.0552 5.5785 5.5785 5.7112 5.7112 6.0632 6.0632 6.2523 6.2523 6.3549 6.3549 6.9261 6.9261 7.2130 7.2130 7.3032 7.3032 7.5326 7.5326 9.1787 9.1787 10.1888 10.1888 k = 0.0323 0.0147-0.0180 ( 6739 PWs) bands (ev): -6.8318 -6.8318 -6.0309 -6.0309 -5.9072 -5.9072 -5.8187 -5.8187 -5.6208 -5.6208 -5.5379 -5.5379 -5.5256 -5.5256 -5.3621 -5.3621 -3.4732 -3.4732 -3.4529 -3.4529 -3.4433 -3.4433 -3.3943 -3.3943 -3.3705 -3.3705 -3.3365 -3.3365 0.6127 0.6127 1.4767 1.4767 2.0120 2.0120 2.5268 2.5268 2.6220 2.6220 2.9217 2.9217 3.0515 3.0515 3.0916 3.0916 3.2976 3.2976 3.3269 3.3269 3.4812 3.4812 3.8292 3.8292 4.6229 4.6229 4.7604 4.7604 5.0589 5.0589 5.5786 5.5786 5.7102 5.7102 6.0647 6.0647 6.2563 6.2563 6.3556 6.3556 6.9273 6.9273 7.2116 7.2116 7.2994 7.2994 7.5327 7.5327 9.1737 9.1737 10.1809 10.1809 k = 0.0484 0.0220-0.0270 ( 6739 PWs) bands (ev): -6.8290 -6.8290 -6.0322 -6.0322 -5.9083 -5.9083 -5.8184 -5.8184 -5.6206 -5.6206 -5.5394 -5.5394 -5.5248 -5.5248 -5.3630 -5.3630 -3.4733 -3.4733 -3.4530 -3.4530 -3.4432 -3.4432 -3.3941 -3.3941 -3.3706 -3.3706 -3.3366 -3.3366 0.6119 0.6119 1.4632 1.4632 2.0159 2.0159 2.5082 2.5082 2.6131 2.6131 2.9305 2.9305 3.0587 3.0587 3.1093 3.1093 3.2999 3.2999 3.3288 3.3288 3.4983 3.4983 3.8300 3.8300 4.6129 4.6129 4.7627 4.7627 5.0647 5.0647 5.5787 5.5787 5.7088 5.7088 6.0670 6.0670 6.2627 6.2627 6.3567 6.3567 6.9292 6.9292 7.2093 7.2093 7.2930 7.2930 7.5328 7.5328 9.1652 9.1652 10.1678 10.1678 k = 0.0645 0.0294-0.0360 ( 6734 PWs) bands (ev): -6.8250 -6.8250 -6.0338 -6.0338 -5.9100 -5.9100 -5.8179 -5.8179 -5.6205 -5.6205 -5.5411 -5.5411 -5.5239 -5.5239 -5.3643 -5.3643 -3.4734 -3.4734 -3.4531 -3.4531 -3.4431 -3.4431 -3.3940 -3.3940 -3.3707 -3.3707 -3.3368 -3.3368 0.6109 0.6109 1.4450 1.4450 2.0209 2.0209 2.4844 2.4844 2.6013 2.6013 2.9418 2.9418 3.0693 3.0693 3.1318 3.1318 3.3032 3.3032 3.3312 3.3312 3.5218 3.5218 3.8312 3.8312 4.5996 4.5996 4.7658 4.7658 5.0716 5.0716 5.5789 5.5789 5.7072 5.7072 6.0702 6.0702 6.2717 6.2717 6.3585 6.3585 6.9319 6.9319 7.2061 7.2061 7.2845 7.2845 7.5330 7.5330 9.1535 9.1535 10.1499 10.1499 k = 0.0806 0.0367-0.0450 ( 6730 PWs) bands (ev): -6.8200 -6.8200 -6.0360 -6.0360 -5.9121 -5.9121 -5.8173 -5.8173 -5.6203 -5.6203 -5.5431 -5.5431 -5.5230 -5.5230 -5.3659 -5.3659 -3.4734 -3.4734 -3.4533 -3.4533 -3.4429 -3.4429 -3.3938 -3.3938 -3.3709 -3.3709 -3.3371 -3.3371 0.6096 0.6096 1.4227 1.4227 2.0267 2.0267 2.4567 2.4567 2.5872 2.5872 2.9548 2.9548 3.0837 3.0837 3.1576 3.1576 3.3077 3.3077 3.3340 3.3340 3.5513 3.5513 3.8327 3.8327 4.5837 4.5837 4.7698 4.7698 5.0788 5.0788 5.5791 5.5791 5.7058 5.7058 6.0743 6.0743 6.2827 6.2827 6.3611 6.3611 6.9352 6.9352 7.2018 7.2018 7.2740 7.2740 7.5333 7.5333 9.1385 9.1385 10.1274 10.1274 k = 0.0968 0.0441-0.0540 ( 6729 PWs) bands (ev): -6.8139 -6.8139 -6.0387 -6.0387 -5.9147 -5.9147 -5.8166 -5.8166 -5.6201 -5.6201 -5.5451 -5.5451 -5.5223 -5.5223 -5.3679 -5.3679 -3.4735 -3.4735 -3.4536 -3.4536 -3.4427 -3.4427 -3.3935 -3.3935 -3.3712 -3.3712 -3.3374 -3.3374 0.6082 0.6082 1.3969 1.3969 2.0331 2.0331 2.4264 2.4264 2.5713 2.5713 2.9685 2.9685 3.1020 3.1020 3.1850 3.1850 3.3139 3.3139 3.3374 3.3374 3.5862 3.5862 3.8344 3.8344 4.5656 4.5656 4.7745 4.7745 5.0853 5.0853 5.5794 5.5794 5.7049 5.7049 6.0793 6.0793 6.2955 6.2955 6.3649 6.3649 6.9390 6.9390 7.1962 7.1962 7.2620 7.2620 7.5335 7.5335 9.1203 9.1203 10.1008 10.1008 k = 0.1129 0.0514-0.0630 ( 6730 PWs) bands (ev): -6.8068 -6.8068 -6.0419 -6.0419 -5.9177 -5.9177 -5.8156 -5.8156 -5.6199 -5.6199 -5.5473 -5.5473 -5.5216 -5.5216 -5.3702 -5.3702 -3.4736 -3.4736 -3.4539 -3.4539 -3.4424 -3.4424 -3.3933 -3.3933 -3.3714 -3.3714 -3.3377 -3.3377 0.6068 0.6068 1.3683 1.3683 2.0395 2.0395 2.3943 2.3943 2.5546 2.5546 2.9825 2.9825 3.1242 3.1242 3.2120 3.2120 3.3225 3.3225 3.3416 3.3416 3.6259 3.6259 3.8365 3.8365 4.5457 4.5457 4.7799 4.7799 5.0904 5.0904 5.5797 5.5797 5.7050 5.7050 6.0850 6.0850 6.3090 6.3090 6.3708 6.3708 6.9430 6.9430 7.1890 7.1890 7.2493 7.2493 7.5338 7.5338 9.0991 9.0991 10.0705 10.0705 k = 0.1290 0.0588-0.0720 ( 6727 PWs) bands (ev): -6.7986 -6.7986 -6.0456 -6.0456 -5.9213 -5.9213 -5.8144 -5.8144 -5.6196 -5.6196 -5.5495 -5.5495 -5.5211 -5.5211 -5.3728 -5.3728 -3.4737 -3.4737 -3.4543 -3.4543 -3.4421 -3.4421 -3.3930 -3.3930 -3.3718 -3.3718 -3.3381 -3.3381 0.6053 0.6053 1.3375 1.3375 2.0455 2.0455 2.3611 2.3611 2.5376 2.5376 2.9963 2.9963 3.1499 3.1499 3.2365 3.2365 3.3340 3.3340 3.3482 3.3482 3.6697 3.6697 3.8390 3.8390 4.5244 4.5244 4.7861 4.7861 5.0933 5.0933 5.5799 5.5799 5.7065 5.7065 6.0916 6.0916 6.3218 6.3218 6.3800 6.3800 6.9471 6.9471 7.1797 7.1797 7.2368 7.2368 7.5341 7.5341 9.0751 9.0751 10.0370 10.0370 k = 0.1452 0.0661-0.0810 ( 6727 PWs) bands (ev): -6.7894 -6.7894 -6.0498 -6.0498 -5.9253 -5.9253 -5.8129 -5.8129 -5.6193 -5.6193 -5.5517 -5.5517 -5.5208 -5.5208 -5.3756 -5.3756 -3.4738 -3.4738 -3.4547 -3.4547 -3.4417 -3.4417 -3.3927 -3.3927 -3.3722 -3.3722 -3.3384 -3.3384 0.6038 0.6038 1.3052 1.3052 2.0508 2.0508 2.3274 2.3274 2.5212 2.5212 3.0098 3.0098 3.1781 3.1781 3.2565 3.2565 3.3455 3.3455 3.3615 3.3615 3.7171 3.7171 3.8418 3.8418 4.5019 4.5019 4.7929 4.7929 5.0935 5.0935 5.5802 5.5802 5.7097 5.7097 6.0989 6.0989 6.3323 6.3323 6.3936 6.3936 6.9510 6.9510 7.1675 7.1675 7.2258 7.2258 7.5345 7.5345 9.0485 9.0485 10.0007 10.0007 k = 0.1613 0.0735-0.0900 ( 6728 PWs) bands (ev): -6.7792 -6.7792 -6.0547 -6.0547 -5.9298 -5.9298 -5.8111 -5.8111 -5.6190 -5.6190 -5.5538 -5.5538 -5.5207 -5.5207 -5.3788 -5.3788 -3.4738 -3.4738 -3.4553 -3.4553 -3.4412 -3.4412 -3.3925 -3.3925 -3.3726 -3.3726 -3.3388 -3.3388 0.6024 0.6024 1.2718 1.2718 2.0547 2.0547 2.2936 2.2936 2.5059 2.5059 3.0232 3.0232 3.2075 3.2075 3.2712 3.2712 3.3552 3.3552 3.3844 3.3844 3.7673 3.7673 3.8451 3.8451 4.4785 4.4785 4.8003 4.8003 5.0906 5.0906 5.5806 5.5806 5.7148 5.7148 6.1069 6.1069 6.3400 6.3400 6.4120 6.4120 6.9544 6.9544 7.1523 7.1523 7.2170 7.2170 7.5348 7.5348 9.0196 9.0196 9.9623 9.9623 k = 0.1774 0.0808-0.0990 ( 6723 PWs) bands (ev): -6.7681 -6.7681 -6.0600 -6.0600 -5.9347 -5.9347 -5.8091 -5.8091 -5.6187 -5.6187 -5.5560 -5.5560 -5.5207 -5.5207 -5.3822 -5.3822 -3.4738 -3.4738 -3.4558 -3.4558 -3.4407 -3.4407 -3.3922 -3.3922 -3.3731 -3.3731 -3.3392 -3.3392 0.6011 0.6011 1.2380 1.2380 2.0567 2.0567 2.2601 2.2601 2.4924 2.4924 3.0365 3.0365 3.2363 3.2363 3.2820 3.2820 3.3668 3.3668 3.4127 3.4127 3.8185 3.8185 3.8506 3.8506 4.4543 4.4543 4.8083 4.8083 5.0845 5.0845 5.5809 5.5809 5.7220 5.7220 6.1157 6.1157 6.3456 6.3456 6.4339 6.4339 6.9567 6.9567 7.1342 7.1342 7.2108 7.2108 7.5351 7.5351 8.9888 8.9888 9.9221 9.9221 k = 0.1935 0.0882-0.1080 ( 6723 PWs) bands (ev): -6.7561 -6.7561 -6.0661 -6.0661 -5.9400 -5.9400 -5.8067 -5.8067 -5.6184 -5.6184 -5.5582 -5.5582 -5.5209 -5.5209 -5.3857 -5.3857 -3.4737 -3.4737 -3.4565 -3.4565 -3.4402 -3.4402 -3.3920 -3.3920 -3.3737 -3.3737 -3.3395 -3.3395 0.5999 0.5999 1.2043 1.2043 2.0565 2.0565 2.2271 2.2271 2.4812 2.4812 3.0499 3.0499 3.2622 3.2622 3.2902 3.2902 3.3826 3.3826 3.4438 3.4438 3.8464 3.8464 3.8820 3.8820 4.4294 4.4294 4.8168 4.8168 5.0755 5.0755 5.5812 5.5812 5.7311 5.7311 6.1251 6.1251 6.3499 6.3499 6.4579 6.4579 6.9577 6.9577 7.1139 7.1139 7.2072 7.2072 7.5355 7.5355 8.9566 8.9566 9.8806 9.8806 k = 0.2097 0.0955-0.1170 ( 6715 PWs) bands (ev): -6.7433 -6.7433 -6.0727 -6.0727 -5.9455 -5.9455 -5.8040 -5.8040 -5.6181 -5.6181 -5.5603 -5.5603 -5.5213 -5.5213 -5.3894 -5.3894 -3.4737 -3.4737 -3.4572 -3.4572 -3.4396 -3.4396 -3.3919 -3.3919 -3.3742 -3.3742 -3.3398 -3.3398 0.5989 0.5989 1.1710 1.1710 2.0536 2.0536 2.1949 2.1949 2.4728 2.4728 3.0637 3.0637 3.2832 3.2832 3.2972 3.2972 3.4042 3.4042 3.4759 3.4759 3.8520 3.8520 3.9382 3.9382 4.4038 4.4038 4.8257 4.8257 5.0637 5.0637 5.5815 5.5815 5.7419 5.7419 6.1352 6.1352 6.3534 6.3534 6.4830 6.4830 6.9569 6.9569 7.0921 7.0921 7.2061 7.2061 7.5358 7.5358 8.9234 8.9234 9.8384 9.8384 k = 0.2258 0.1029-0.1260 ( 6722 PWs) bands (ev): -6.7297 -6.7297 -6.0800 -6.0800 -5.9513 -5.9513 -5.8010 -5.8010 -5.6179 -5.6179 -5.5624 -5.5624 -5.5218 -5.5218 -5.3933 -5.3933 -3.4735 -3.4735 -3.4579 -3.4579 -3.4389 -3.4389 -3.3919 -3.3919 -3.3749 -3.3749 -3.3401 -3.3401 0.5980 0.5980 1.1387 1.1387 2.0477 2.0477 2.1637 2.1637 2.4674 2.4674 3.0780 3.0780 3.2980 3.2980 3.3043 3.3043 3.4312 3.4312 3.5080 3.5080 3.8562 3.8562 3.9980 3.9980 4.3776 4.3776 4.8350 4.8350 5.0497 5.0497 5.5818 5.5818 5.7543 5.7543 6.1459 6.1459 6.3564 6.3564 6.5081 6.5081 6.9539 6.9539 7.0695 7.0695 7.2075 7.2075 7.5359 7.5359 8.8898 8.8898 9.7957 9.7957 k = 0.2419 0.1102-0.1350 ( 6722 PWs) bands (ev): -6.7153 -6.7153 -6.0881 -6.0881 -5.9572 -5.9572 -5.7977 -5.7977 -5.6176 -5.6176 -5.5646 -5.5646 -5.5226 -5.5226 -5.3972 -5.3972 -3.4734 -3.4734 -3.4587 -3.4587 -3.4383 -3.4383 -3.3919 -3.3919 -3.3755 -3.3755 -3.3404 -3.3404 0.5971 0.5971 1.1077 1.1077 2.0388 2.0388 2.1336 2.1336 2.4650 2.4650 3.0930 3.0930 3.3059 3.3059 3.3138 3.3138 3.4622 3.4622 3.5396 3.5396 3.8603 3.8603 4.0596 4.0596 4.3508 4.3508 4.8446 4.8446 5.0340 5.0340 5.5820 5.5820 5.7677 5.7677 6.1572 6.1572 6.3592 6.3592 6.5325 6.5325 6.9484 6.9484 7.0465 7.0465 7.2112 7.2112 7.5359 7.5359 8.8563 8.8563 9.7530 9.7530 k = 0.2581 0.1175-0.1440 ( 6722 PWs) bands (ev): -6.7003 -6.7003 -6.0969 -6.0969 -5.9632 -5.9632 -5.7941 -5.7941 -5.6174 -5.6174 -5.5667 -5.5667 -5.5235 -5.5235 -5.4011 -5.4011 -3.4732 -3.4732 -3.4594 -3.4594 -3.4376 -3.4376 -3.3920 -3.3920 -3.3761 -3.3761 -3.3407 -3.3407 0.5963 0.5963 1.0784 1.0784 2.0272 2.0272 2.1048 2.1048 2.4654 2.4654 3.1087 3.1087 3.3111 3.3111 3.3229 3.3229 3.4951 3.4951 3.5703 3.5703 3.8644 3.8644 4.1226 4.1226 4.3236 4.3236 4.8542 4.8542 5.0172 5.0172 5.5822 5.5822 5.7820 5.7820 6.1690 6.1690 6.3618 6.3618 6.5554 6.5554 6.9405 6.9405 7.0235 7.0235 7.2173 7.2173 7.5356 7.5356 8.8235 8.8235 9.7106 9.7106 k = 0.2742 0.1249-0.1530 ( 6719 PWs) bands (ev): -6.6847 -6.6847 -6.1065 -6.1065 -5.9691 -5.9691 -5.7901 -5.7901 -5.6172 -5.6172 -5.5689 -5.5689 -5.5245 -5.5245 -5.4050 -5.4050 -3.4730 -3.4730 -3.4602 -3.4602 -3.4369 -3.4369 -3.3922 -3.3922 -3.3767 -3.3767 -3.3409 -3.3409 0.5953 0.5953 1.0510 1.0510 2.0131 2.0131 2.0773 2.0773 2.4682 2.4682 3.1252 3.1252 3.3156 3.3156 3.3311 3.3311 3.5284 3.5284 3.5995 3.5995 3.8686 3.8686 4.1860 4.1860 4.2964 4.2964 4.8638 4.8638 5.0001 5.0001 5.5824 5.5824 5.7967 5.7967 6.1813 6.1813 6.3643 6.3643 6.5764 6.5764 6.9302 6.9302 7.0007 7.0007 7.2253 7.2253 7.5347 7.5347 8.7918 8.7918 9.6688 9.6688 k = 0.2903 0.1322-0.1620 ( 6716 PWs) bands (ev): -6.6686 -6.6686 -6.1168 -6.1168 -5.9748 -5.9748 -5.7859 -5.7859 -5.6170 -5.6170 -5.5711 -5.5711 -5.5256 -5.5256 -5.4088 -5.4088 -3.4727 -3.4727 -3.4610 -3.4610 -3.4362 -3.4362 -3.3924 -3.3924 -3.3773 -3.3773 -3.3410 -3.3410 0.5942 0.5942 1.0259 1.0259 1.9971 1.9971 2.0513 2.0513 2.4730 2.4730 3.1425 3.1425 3.3198 3.3198 3.3387 3.3387 3.5608 3.5608 3.6272 3.6272 3.8730 3.8730 4.2434 4.2434 4.2752 4.2752 4.8729 4.8729 4.9834 4.9834 5.5825 5.5825 5.8115 5.8115 6.1941 6.1941 6.3667 6.3667 6.5950 6.5950 6.9177 6.9177 6.9785 6.9785 7.2351 7.2351 7.5332 7.5332 8.7617 8.7617 9.6280 9.6280 k = 0.3065 0.1396-0.1710 ( 6724 PWs) bands (ev): -6.6521 -6.6521 -6.1278 -6.1278 -5.9804 -5.9804 -5.7814 -5.7814 -5.6168 -5.6168 -5.5735 -5.5735 -5.5269 -5.5269 -5.4125 -5.4125 -3.4724 -3.4724 -3.4617 -3.4617 -3.4355 -3.4355 -3.3928 -3.3928 -3.3779 -3.3779 -3.3412 -3.3412 0.5927 0.5927 1.0033 1.0033 1.9796 1.9796 2.0269 2.0269 2.4791 2.4791 3.1606 3.1606 3.3237 3.3237 3.3462 3.3462 3.5915 3.5915 3.6530 3.6530 3.8776 3.8776 4.2346 4.2346 4.3199 4.3199 4.8809 4.8809 4.9683 4.9683 5.5826 5.5826 5.8261 5.8261 6.2071 6.2071 6.3689 6.3689 6.6108 6.6108 6.9033 6.9033 6.9571 6.9571 7.2462 7.2462 7.5307 7.5307 8.7334 8.7334 9.5886 9.5886 k = 0.3226 0.1469-0.1800 ( 6728 PWs) bands (ev): -6.6353 -6.6353 -6.1396 -6.1396 -5.9856 -5.9856 -5.7767 -5.7767 -5.6167 -5.6167 -5.5760 -5.5760 -5.5281 -5.5281 -5.4160 -5.4160 -3.4721 -3.4721 -3.4625 -3.4625 -3.4348 -3.4348 -3.3932 -3.3932 -3.3785 -3.3785 -3.3413 -3.3413 0.5909 0.5909 0.9834 0.9834 1.9613 1.9613 2.0042 2.0042 2.4862 2.4862 3.1793 3.1793 3.3274 3.3274 3.3540 3.3540 3.6199 3.6199 3.6769 3.6769 3.8823 3.8823 4.2070 4.2070 4.3826 4.3826 4.8863 4.8863 4.9564 4.9564 5.5827 5.5827 5.8403 5.8403 6.2203 6.2203 6.3712 6.3712 6.6238 6.6238 6.8874 6.8874 6.9365 6.9365 7.2582 7.2582 7.5272 7.5272 8.7071 8.7071 9.5508 9.5508 k = 0.3387 0.1543-0.1889 ( 6728 PWs) bands (ev): -6.6183 -6.6183 -6.1519 -6.1519 -5.9906 -5.9906 -5.7719 -5.7719 -5.6166 -5.6166 -5.5786 -5.5786 -5.5294 -5.5294 -5.4193 -5.4193 -3.4718 -3.4718 -3.4632 -3.4632 -3.4341 -3.4341 -3.3937 -3.3937 -3.3790 -3.3790 -3.3414 -3.3414 0.5887 0.5887 0.9661 0.9661 1.9425 1.9425 1.9832 1.9832 2.4937 2.4937 3.1983 3.1983 3.3307 3.3307 3.3624 3.3624 3.6454 3.6454 3.6986 3.6986 3.8871 3.8871 4.1788 4.1788 4.4448 4.4448 4.8871 4.8871 4.9502 4.9502 5.5827 5.5827 5.8538 5.8538 6.2336 6.2336 6.3733 6.3733 6.6339 6.6339 6.8706 6.8706 6.9169 6.9169 7.2707 7.2707 7.5227 7.5227 8.6828 8.6828 9.5152 9.5152 k = 0.3548 0.1616-0.1979 ( 6728 PWs) bands (ev): -6.6012 -6.6012 -6.1647 -6.1647 -5.9951 -5.9951 -5.7669 -5.7669 -5.6165 -5.6165 -5.5814 -5.5814 -5.5307 -5.5307 -5.4223 -5.4223 -3.4715 -3.4715 -3.4639 -3.4639 -3.4335 -3.4335 -3.3942 -3.3942 -3.3795 -3.3795 -3.3414 -3.3414 0.5861 0.5861 0.9516 0.9516 1.9239 1.9239 1.9640 1.9640 2.5013 2.5013 3.2171 3.2171 3.3339 3.3339 3.3720 3.3720 3.6674 3.6674 3.7180 3.7180 3.8921 3.8921 4.1510 4.1510 4.5048 4.5048 4.8821 4.8821 4.9511 4.9511 5.5828 5.5828 5.8664 5.8664 6.2468 6.2468 6.3753 6.3753 6.6413 6.6413 6.8535 6.8535 6.8982 6.8982 7.2834 7.2834 7.5171 7.5171 8.6604 8.6604 9.4822 9.4822 k = 0.3710 0.1690-0.2069 ( 6726 PWs) bands (ev): -6.5844 -6.5844 -6.1778 -6.1778 -5.9991 -5.9991 -5.7620 -5.7620 -5.6164 -5.6164 -5.5843 -5.5843 -5.5319 -5.5319 -5.4251 -5.4251 -3.4712 -3.4712 -3.4646 -3.4646 -3.4329 -3.4329 -3.3948 -3.3948 -3.3799 -3.3799 -3.3414 -3.3414 0.5832 0.5832 0.9397 0.9397 1.9058 1.9058 1.9467 1.9467 2.5086 2.5086 3.2352 3.2352 3.3367 3.3367 3.3830 3.3830 3.6854 3.6854 3.7352 3.7352 3.8971 3.8971 4.1242 4.1242 4.5617 4.5617 4.8734 4.8734 4.9573 4.9573 5.5828 5.5828 5.8779 5.8779 6.2597 6.2597 6.3774 6.3774 6.6462 6.6462 6.8365 6.8365 6.8805 6.8805 7.2958 7.2958 7.5107 7.5107 8.6399 8.6399 9.4522 9.4522 k = 0.3871 0.1763-0.2159 ( 6729 PWs) bands (ev): -6.5679 -6.5679 -6.1910 -6.1910 -6.0028 -6.0028 -5.7572 -5.7572 -5.6164 -5.6164 -5.5873 -5.5873 -5.5330 -5.5330 -5.4275 -5.4275 -3.4708 -3.4708 -3.4652 -3.4652 -3.4323 -3.4323 -3.3953 -3.3953 -3.3803 -3.3803 -3.3415 -3.3415 0.5799 0.5799 0.9302 0.9302 1.8887 1.8887 1.9312 1.9312 2.5155 2.5155 3.2519 3.2519 3.3393 3.3393 3.3960 3.3960 3.6988 3.6988 3.7501 3.7501 3.9021 3.9021 4.0993 4.0993 4.6141 4.6141 4.8634 4.8634 4.9664 4.9664 5.5828 5.5828 5.8882 5.8882 6.2720 6.2720 6.3793 6.3793 6.6489 6.6489 6.8202 6.8202 6.8640 6.8640 7.3077 7.3077 7.5037 7.5037 8.6211 8.6211 9.4255 9.4255 k = 0.4032 0.1837-0.2249 ( 6736 PWs) bands (ev): -6.5520 -6.5520 -6.2040 -6.2040 -6.0059 -6.0059 -5.7525 -5.7525 -5.6163 -5.6163 -5.5903 -5.5903 -5.5340 -5.5340 -5.4297 -5.4297 -3.4705 -3.4705 -3.4657 -3.4657 -3.4318 -3.4318 -3.3958 -3.3958 -3.3806 -3.3806 -3.3415 -3.3415 0.5766 0.5766 0.9229 0.9229 1.8730 1.8730 1.9178 1.9178 2.5217 2.5217 3.2665 3.2665 3.3415 3.3415 3.4111 3.4111 3.7074 3.7074 3.7627 3.7627 3.9070 3.9070 4.0769 4.0769 4.6612 4.6612 4.8536 4.8536 4.9771 4.9771 5.5827 5.5827 5.8971 5.8971 6.2835 6.2835 6.3812 6.3812 6.6500 6.6500 6.8049 6.8049 6.8487 6.8487 7.3186 7.3186 7.4966 7.4966 8.6040 8.6040 9.4023 9.4023 k = 0.4194 0.1910-0.2339 ( 6743 PWs) bands (ev): -6.5372 -6.5372 -6.2164 -6.2164 -6.0086 -6.0086 -5.7482 -5.7482 -5.6163 -5.6163 -5.5932 -5.5932 -5.5348 -5.5348 -5.4315 -5.4315 -3.4703 -3.4703 -3.4662 -3.4662 -3.4314 -3.4314 -3.3962 -3.3962 -3.3809 -3.3809 -3.3415 -3.3415 0.5733 0.5733 0.9174 0.9174 1.8590 1.8590 1.9064 1.9064 2.5271 2.5271 3.2786 3.2786 3.3434 3.3434 3.4281 3.4281 3.7109 3.7109 3.7731 3.7731 3.9117 3.9117 4.0576 4.0576 4.7019 4.7019 4.8448 4.8448 4.9885 4.9885 5.5826 5.5826 5.9047 5.9047 6.2938 6.2938 6.3831 6.3831 6.6497 6.6497 6.7911 6.7911 6.8351 6.8351 7.3283 7.3283 7.4897 7.4897 8.5888 8.5888 9.3829 9.3829 k = 0.4355 0.1984-0.2429 ( 6741 PWs) bands (ev): -6.5238 -6.5238 -6.2279 -6.2279 -6.0108 -6.0108 -5.7444 -5.7444 -5.6163 -5.6163 -5.5959 -5.5959 -5.5355 -5.5355 -5.4330 -5.4330 -3.4700 -3.4700 -3.4667 -3.4667 -3.4310 -3.4310 -3.3966 -3.3966 -3.3812 -3.3812 -3.3414 -3.3414 0.5703 0.5703 0.9136 0.9136 1.8470 1.8470 1.8970 1.8970 2.5316 2.5316 3.2881 3.2881 3.3449 3.3449 3.4464 3.4464 3.7098 3.7098 3.7814 3.7814 3.9159 3.9159 4.0420 4.0420 4.7355 4.7355 4.8373 4.8373 4.9999 4.9999 5.5826 5.5826 5.9108 5.9108 6.3028 6.3028 6.3848 6.3848 6.6486 6.6486 6.7792 6.7792 6.8234 6.8234 7.3366 7.3366 7.4834 7.4834 8.5756 8.5756 9.3672 9.3672 k = 0.4516 0.2057-0.2519 ( 6725 PWs) bands (ev): -6.5124 -6.5124 -6.2378 -6.2378 -6.0125 -6.0125 -5.7412 -5.7412 -5.6162 -5.6162 -5.5982 -5.5982 -5.5360 -5.5360 -5.4341 -5.4341 -3.4697 -3.4697 -3.4671 -3.4671 -3.4307 -3.4307 -3.3969 -3.3969 -3.3814 -3.3814 -3.3414 -3.3414 0.5677 0.5677 0.9109 0.9109 1.8374 1.8374 1.8897 1.8897 2.5352 2.5352 3.2951 3.2951 3.3462 3.3462 3.4645 3.4645 3.7051 3.7051 3.7876 3.7876 3.9196 3.9196 4.0302 4.0302 4.7615 4.7615 4.8313 4.8313 5.0103 5.0103 5.5826 5.5826 5.9155 5.9155 6.3100 6.3100 6.3864 6.3864 6.6472 6.6472 6.7695 6.7695 6.8139 6.8139 7.3434 7.3434 7.4782 7.4782 8.5649 8.5649 9.3551 9.3551 k = 0.4677 0.2130-0.2609 ( 6721 PWs) bands (ev): -6.5036 -6.5036 -6.2455 -6.2455 -6.0137 -6.0137 -5.7388 -5.7388 -5.6162 -5.6162 -5.6000 -5.6000 -5.5364 -5.5364 -5.4349 -5.4349 -3.4695 -3.4695 -3.4674 -3.4674 -3.4305 -3.4305 -3.3972 -3.3972 -3.3816 -3.3816 -3.3414 -3.3414 0.5658 0.5658 0.9093 0.9093 1.8304 1.8304 1.8844 1.8844 2.5378 2.5378 3.2998 3.2998 3.3471 3.3471 3.4805 3.4805 3.6986 3.6986 3.7920 3.7920 3.9224 3.9224 4.0222 4.0222 4.7798 4.7798 4.8270 4.8270 5.0189 5.0189 5.5826 5.5826 5.9187 5.9187 6.3153 6.3153 6.3876 6.3876 6.6459 6.6459 6.7623 6.7623 6.8068 6.8068 7.3483 7.3483 7.4743 7.4743 8.5568 8.5568 9.3467 9.3467 k = 0.4839 0.2204-0.2699 ( 6725 PWs) bands (ev): -6.4980 -6.4980 -6.2505 -6.2505 -6.0145 -6.0145 -5.7373 -5.7373 -5.6162 -5.6162 -5.6012 -5.6012 -5.5366 -5.5366 -5.4354 -5.4354 -3.4694 -3.4694 -3.4676 -3.4676 -3.4304 -3.4304 -3.3973 -3.3973 -3.3816 -3.3816 -3.3414 -3.3414 0.5646 0.5646 0.9083 0.9083 1.8261 1.8261 1.8813 1.8813 2.5393 2.5393 3.3025 3.3025 3.3476 3.3476 3.4917 3.4917 3.6929 3.6929 3.7945 3.7945 3.9241 3.9241 4.0175 4.0175 4.7906 4.7906 4.8244 4.8244 5.0245 5.0245 5.5826 5.5826 5.9206 5.9206 6.3185 6.3185 6.3884 6.3884 6.6450 6.6450 6.7578 6.7578 6.8025 6.8025 7.3513 7.3513 7.4718 7.4718 8.5519 8.5519 9.3416 9.3416 k = 0.5000 0.2277-0.2789 ( 6722 PWs) bands (ev): -6.4961 -6.4961 -6.2522 -6.2522 -6.0147 -6.0147 -5.7367 -5.7367 -5.6162 -5.6162 -5.6015 -5.6015 -5.5367 -5.5367 -5.4356 -5.4356 -3.4693 -3.4693 -3.4677 -3.4677 -3.4303 -3.4303 -3.3974 -3.3974 -3.3817 -3.3817 -3.3414 -3.3414 0.5641 0.5641 0.9081 0.9081 1.8247 1.8247 1.8802 1.8802 2.5399 2.5399 3.3034 3.3034 3.3478 3.3478 3.4958 3.4958 3.6907 3.6907 3.7954 3.7954 3.9247 3.9247 4.0160 4.0160 4.7942 4.7942 4.8236 4.8236 5.0265 5.0265 5.5826 5.5826 5.9213 5.9213 6.3196 6.3196 6.3887 6.3887 6.6447 6.6447 6.7563 6.7563 6.8011 6.8011 7.3523 7.3523 7.4710 7.4710 8.5502 8.5502 9.3400 9.3400 k = 0.5000 0.2277-0.2789 ( 6722 PWs) bands (ev): -6.4961 -6.4961 -6.2522 -6.2522 -6.0147 -6.0147 -5.7367 -5.7367 -5.6162 -5.6162 -5.6015 -5.6015 -5.5367 -5.5367 -5.4356 -5.4356 -3.4693 -3.4693 -3.4677 -3.4677 -3.4303 -3.4303 -3.3974 -3.3974 -3.3817 -3.3817 -3.3414 -3.3414 0.5641 0.5641 0.9081 0.9081 1.8247 1.8247 1.8802 1.8802 2.5399 2.5399 3.3034 3.3034 3.3478 3.3478 3.4958 3.4958 3.6907 3.6907 3.7954 3.7954 3.9247 3.9247 4.0160 4.0160 4.7942 4.7942 4.8236 4.8236 5.0265 5.0265 5.5826 5.5826 5.9213 5.9213 6.3196 6.3196 6.3887 6.3887 6.6447 6.6447 6.7563 6.7563 6.8011 6.8011 7.3523 7.3523 7.4710 7.4710 8.5502 8.5502 9.3400 9.3400 k = 0.5082 0.2315-0.2613 ( 6722 PWs) bands (ev): -6.4959 -6.4959 -6.2519 -6.2519 -6.0150 -6.0150 -5.7367 -5.7367 -5.6162 -5.6162 -5.6015 -5.6015 -5.5370 -5.5370 -5.4356 -5.4356 -3.4694 -3.4694 -3.4676 -3.4676 -3.4303 -3.4303 -3.3974 -3.3974 -3.3817 -3.3817 -3.3415 -3.3415 0.5630 0.5630 0.9083 0.9083 1.8248 1.8248 1.8811 1.8811 2.5429 2.5429 3.3005 3.3005 3.3477 3.3477 3.4959 3.4959 3.6919 3.6919 3.7945 3.7945 3.9240 3.9240 4.0176 4.0176 4.7957 4.7957 4.8234 4.8234 5.0254 5.0254 5.5826 5.5826 5.9204 5.9204 6.3191 6.3191 6.3874 6.3874 6.6446 6.6446 6.7584 6.7584 6.8028 6.8028 7.3527 7.3527 7.4692 7.4692 8.5500 8.5500 9.3387 9.3387 k = 0.5163 0.2352-0.2436 ( 6727 PWs) bands (ev): -6.4953 -6.4953 -6.2510 -6.2510 -6.0158 -6.0158 -5.7367 -5.7367 -5.6162 -5.6162 -5.6014 -5.6014 -5.5378 -5.5378 -5.4356 -5.4356 -3.4696 -3.4696 -3.4674 -3.4674 -3.4304 -3.4304 -3.3976 -3.3976 -3.3819 -3.3819 -3.3419 -3.3419 0.5598 0.5598 0.9090 0.9090 1.8252 1.8252 1.8838 1.8838 2.5521 2.5521 3.2920 3.2920 3.3475 3.3475 3.4957 3.4957 3.6955 3.6955 3.7919 3.7919 3.9220 3.9220 4.0223 4.0223 4.8001 4.8001 4.8229 4.8229 5.0225 5.0225 5.5825 5.5825 5.9176 5.9176 6.3173 6.3173 6.3836 6.3836 6.6446 6.6446 6.7644 6.7644 6.8078 6.8078 7.3541 7.3541 7.4639 7.4639 8.5493 8.5493 9.3350 9.3350 k = 0.5245 0.2389-0.2260 ( 6735 PWs) bands (ev): -6.4944 -6.4944 -6.2495 -6.2495 -6.0172 -6.0172 -5.7367 -5.7367 -5.6161 -5.6161 -5.6012 -5.6012 -5.5391 -5.5391 -5.4357 -5.4357 -3.4699 -3.4699 -3.4671 -3.4671 -3.4305 -3.4305 -3.3979 -3.3979 -3.3822 -3.3822 -3.3425 -3.3425 0.5544 0.5544 0.9102 0.9102 1.8259 1.8259 1.8883 1.8883 2.5673 2.5673 3.2790 3.2790 3.3471 3.3471 3.4945 3.4945 3.7013 3.7013 3.7874 3.7874 3.9188 3.9188 4.0302 4.0302 4.8073 4.8073 4.8222 4.8222 5.0175 5.0175 5.5824 5.5824 5.9130 5.9130 6.3144 6.3144 6.3776 6.3776 6.6451 6.6451 6.7738 6.7738 6.8159 6.8159 7.3563 7.3563 7.4552 7.4552 8.5482 8.5482 9.3286 9.3286 k = 0.5326 0.2426-0.2083 ( 6737 PWs) bands (ev): -6.4931 -6.4931 -6.2475 -6.2475 -6.0191 -6.0191 -5.7367 -5.7367 -5.6161 -5.6161 -5.6009 -5.6009 -5.5408 -5.5408 -5.4359 -5.4359 -3.4703 -3.4703 -3.4669 -3.4669 -3.4307 -3.4307 -3.3983 -3.3983 -3.3826 -3.3826 -3.3433 -3.3433 0.5471 0.5471 0.9119 0.9119 1.8272 1.8272 1.8946 1.8946 2.5879 2.5879 3.2628 3.2628 3.3466 3.3466 3.4913 3.4913 3.7089 3.7089 3.7812 3.7812 3.9145 3.9145 4.0411 4.0411 4.8164 4.8164 4.8221 4.8221 5.0107 5.0107 5.5822 5.5822 5.9065 5.9065 6.3101 6.3101 6.3701 6.3701 6.6466 6.6466 6.7860 6.7860 6.8267 6.8267 7.3594 7.3594 7.4432 7.4432 8.5464 8.5464 9.3197 9.3197 k = 0.5408 0.2463-0.1907 ( 6742 PWs) bands (ev): -6.4915 -6.4915 -6.2449 -6.2449 -6.0215 -6.0215 -5.7367 -5.7367 -5.6160 -5.6160 -5.6006 -5.6006 -5.5428 -5.5428 -5.4362 -5.4362 -3.4706 -3.4706 -3.4666 -3.4666 -3.4309 -3.4309 -3.3988 -3.3988 -3.3831 -3.3831 -3.3443 -3.3443 0.5380 0.5380 0.9140 0.9140 1.8292 1.8292 1.9026 1.9026 2.6138 2.6138 3.2445 3.2445 3.3458 3.3458 3.4855 3.4855 3.7175 3.7175 3.7731 3.7731 3.9093 3.9093 4.0550 4.0550 4.8186 4.8186 4.8311 4.8311 5.0020 5.0020 5.5820 5.5820 5.8983 5.8983 6.3043 6.3043 6.3617 6.3617 6.6498 6.6498 6.8003 6.8003 6.8398 6.8398 7.3631 7.3631 7.4283 7.4283 8.5441 8.5441 9.3080 9.3080 k = 0.5489 0.2500-0.1730 ( 6743 PWs) bands (ev): -6.4898 -6.4898 -6.2417 -6.2417 -6.0244 -6.0244 -5.7366 -5.7366 -5.6159 -5.6159 -5.6002 -5.6002 -5.5451 -5.5451 -5.4366 -5.4366 -3.4710 -3.4710 -3.4663 -3.4663 -3.4311 -3.4311 -3.3995 -3.3995 -3.3836 -3.3836 -3.3456 -3.3456 0.5274 0.5274 0.9165 0.9165 1.8320 1.8320 1.9122 1.9122 2.6443 2.6443 3.2250 3.2250 3.3449 3.3449 3.4771 3.4771 3.7263 3.7263 3.7634 3.7634 3.9035 3.9035 4.0716 4.0716 4.8173 4.8173 4.8459 4.8459 4.9918 4.9918 5.5817 5.5817 5.8882 5.8882 6.2970 6.2970 6.3530 6.3530 6.6549 6.6549 6.8159 6.8159 6.8547 6.8547 7.3675 7.3675 7.4109 7.4109 8.5409 8.5409 9.2934 9.2934 k = 0.5571 0.2537-0.1554 ( 6734 PWs) bands (ev): -6.4879 -6.4879 -6.2380 -6.2380 -6.0277 -6.0277 -5.7365 -5.7365 -5.6158 -5.6158 -5.5998 -5.5998 -5.5475 -5.5475 -5.4373 -5.4373 -3.4714 -3.4714 -3.4660 -3.4660 -3.4314 -3.4314 -3.4002 -3.4002 -3.3841 -3.3841 -3.3470 -3.3470 0.5154 0.5154 0.9193 0.9193 1.8359 1.8359 1.9235 1.9235 2.6790 2.6790 3.2048 3.2048 3.3438 3.3438 3.4663 3.4663 3.7337 3.7337 3.7527 3.7527 3.8972 3.8972 4.0906 4.0906 4.8154 4.8154 4.8630 4.8630 4.9802 4.9802 5.5814 5.5814 5.8763 5.8763 6.2880 6.2880 6.3445 6.3445 6.6624 6.6624 6.8324 6.8324 6.8711 6.8711 7.3716 7.3716 7.3919 7.3919 8.5367 8.5367 9.2759 9.2759 k = 0.5652 0.2575-0.1377 ( 6733 PWs) bands (ev): -6.4860 -6.4860 -6.2339 -6.2339 -6.0313 -6.0313 -5.7364 -5.7364 -5.6156 -5.6156 -5.5993 -5.5993 -5.5499 -5.5499 -5.4382 -5.4382 -3.4719 -3.4719 -3.4657 -3.4657 -3.4318 -3.4318 -3.4011 -3.4011 -3.3846 -3.3846 -3.3486 -3.3486 0.5025 0.5025 0.9223 0.9223 1.8409 1.8409 1.9363 1.9363 2.7172 2.7172 3.1845 3.1845 3.3424 3.3424 3.4534 3.4534 3.7318 3.7318 3.7487 3.7487 3.8907 3.8907 4.1114 4.1114 4.8132 4.8132 4.8817 4.8817 4.9677 4.9677 5.5811 5.5811 5.8626 5.8626 6.2776 6.2776 6.3365 6.3365 6.6722 6.6722 6.8492 6.8492 6.8887 6.8887 7.3653 7.3653 7.3820 7.3820 8.5313 8.5313 9.2554 9.2554 k = 0.5734 0.2612-0.1201 ( 6738 PWs) bands (ev): -6.4843 -6.4843 -6.2292 -6.2292 -6.0351 -6.0351 -5.7362 -5.7362 -5.6154 -5.6154 -5.5989 -5.5989 -5.5522 -5.5522 -5.4393 -5.4393 -3.4723 -3.4723 -3.4654 -3.4654 -3.4322 -3.4322 -3.4020 -3.4020 -3.3850 -3.3850 -3.3503 -3.3503 0.4889 0.4889 0.9254 0.9254 1.8473 1.8473 1.9507 1.9507 2.7583 2.7583 3.1641 3.1641 3.3409 3.3409 3.4390 3.4390 3.7177 3.7177 3.7536 3.7536 3.8841 3.8841 4.1335 4.1335 4.8105 4.8105 4.9007 4.9007 4.9556 4.9556 5.5808 5.5808 5.8470 5.8470 6.2661 6.2661 6.3289 6.3289 6.6846 6.6846 6.8659 6.8659 6.9072 6.9072 7.3434 7.3434 7.3865 7.3865 8.5244 8.5244 9.2320 9.2320 k = 0.5815 0.2649-0.1024 ( 6736 PWs) bands (ev): -6.4828 -6.4828 -6.2241 -6.2241 -6.0390 -6.0390 -5.7360 -5.7360 -5.6152 -5.6152 -5.5986 -5.5986 -5.5543 -5.5543 -5.4407 -5.4407 -3.4727 -3.4727 -3.4652 -3.4652 -3.4326 -3.4326 -3.4030 -3.4030 -3.3854 -3.3854 -3.3522 -3.3522 0.4750 0.4750 0.9286 0.9286 1.8551 1.8551 1.9665 1.9665 2.8019 2.8019 3.1441 3.1441 3.3391 3.3391 3.4233 3.4233 3.6999 3.6999 3.7589 3.7589 3.8775 3.8775 4.1560 4.1560 4.8070 4.8070 4.9151 4.9151 4.9492 4.9492 5.5804 5.5804 5.8297 5.8297 6.2540 6.2540 6.3216 6.3216 6.6997 6.6997 6.8822 6.8822 6.9263 6.9263 7.3192 7.3192 7.3926 7.3926 8.5156 8.5156 9.2062 9.2062 k = 0.5897 0.2686-0.0848 ( 6739 PWs) bands (ev): -6.4817 -6.4817 -6.2185 -6.2185 -6.0430 -6.0430 -5.7359 -5.7359 -5.6149 -5.6149 -5.5983 -5.5983 -5.5560 -5.5560 -5.4424 -5.4424 -3.4732 -3.4732 -3.4650 -3.4650 -3.4331 -3.4331 -3.4040 -3.4040 -3.3857 -3.3857 -3.3541 -3.3541 0.4609 0.4609 0.9318 0.9318 1.8643 1.8643 1.9837 1.9837 2.8471 2.8471 3.1244 3.1244 3.3371 3.3371 3.4070 3.4070 3.6801 3.6801 3.7631 3.7631 3.8710 3.8710 4.1783 4.1783 4.8023 4.8023 4.9131 4.9131 4.9606 4.9606 5.5800 5.5800 5.8107 5.8107 6.2417 6.2417 6.3146 6.3146 6.7173 6.7173 6.8979 6.8979 6.9456 6.9456 7.2944 7.2944 7.3990 7.3990 8.5046 8.5046 9.1787 9.1787 k = 0.5978 0.2723-0.0671 ( 6743 PWs) bands (ev): -6.4812 -6.4812 -6.2125 -6.2125 -6.0467 -6.0467 -5.7357 -5.7357 -5.6146 -5.6146 -5.5981 -5.5981 -5.5573 -5.5573 -5.4443 -5.4443 -3.4736 -3.4736 -3.4648 -3.4648 -3.4336 -3.4336 -3.4051 -3.4051 -3.3859 -3.3859 -3.3562 -3.3562 0.4471 0.4471 0.9348 0.9348 1.8750 1.8750 2.0021 2.0021 2.8932 2.8932 3.1054 3.1054 3.3348 3.3348 3.3904 3.3904 3.6586 3.6586 3.7658 3.7658 3.8646 3.8646 4.1995 4.1995 4.7957 4.7957 4.9027 4.9027 4.9824 4.9824 5.5797 5.5797 5.7902 5.7902 6.2294 6.2294 6.3076 6.3076 6.7373 6.7373 6.9129 6.9129 6.9646 6.9646 7.2696 7.2696 7.4055 7.4055 8.4912 8.4912 9.1505 9.1505 k = 0.6060 0.2760-0.0495 ( 6744 PWs) bands (ev): -6.4815 -6.4815 -6.2061 -6.2061 -6.0502 -6.0502 -5.7356 -5.7356 -5.6143 -5.6143 -5.5980 -5.5980 -5.5581 -5.5581 -5.4464 -5.4464 -3.4741 -3.4741 -3.4646 -3.4646 -3.4341 -3.4341 -3.4060 -3.4060 -3.3861 -3.3861 -3.3582 -3.3582 0.4337 0.4337 0.9377 0.9377 1.8870 1.8870 2.0218 2.0218 2.9391 2.9391 3.0875 3.0875 3.3323 3.3323 3.3740 3.3740 3.6356 3.6356 3.7672 3.7672 3.8584 3.8584 4.2190 4.2190 4.7862 4.7862 4.8924 4.8924 5.0068 5.0068 5.5793 5.5793 5.7682 5.7682 6.2174 6.2174 6.3008 6.3008 6.7596 6.7596 6.9271 6.9271 6.9827 6.9827 7.2459 7.2459 7.4117 7.4117 8.4751 8.4751 9.1229 9.1229 k = 0.6142 0.2797-0.0318 ( 6745 PWs) bands (ev): -6.4827 -6.4827 -6.1993 -6.1993 -6.0532 -6.0532 -5.7356 -5.7356 -5.6140 -5.6140 -5.5980 -5.5980 -5.5583 -5.5583 -5.4488 -5.4488 -3.4745 -3.4745 -3.4645 -3.4645 -3.4346 -3.4346 -3.4070 -3.4070 -3.3861 -3.3861 -3.3603 -3.3603 0.4211 0.4211 0.9403 0.9403 1.9004 1.9004 2.0425 2.0425 2.9819 2.9819 3.0733 3.0733 3.3293 3.3293 3.3582 3.3582 3.6114 3.6114 3.7671 3.7671 3.8525 3.8525 4.2360 4.2360 4.7733 4.7733 4.8845 4.8845 5.0321 5.0321 5.5790 5.5790 5.7452 5.7452 6.2060 6.2060 6.2939 6.2939 6.7838 6.7838 6.9404 6.9404 6.9989 6.9989 7.2241 7.2241 7.4176 7.4176 8.4564 8.4564 9.0972 9.0972 k = 0.6142 0.2797-0.0318 ( 6745 PWs) bands (ev): -6.4827 -6.4827 -6.1993 -6.1993 -6.0532 -6.0532 -5.7356 -5.7356 -5.6140 -5.6140 -5.5980 -5.5980 -5.5583 -5.5583 -5.4488 -5.4488 -3.4745 -3.4745 -3.4645 -3.4645 -3.4346 -3.4346 -3.4070 -3.4070 -3.3861 -3.3861 -3.3603 -3.3603 0.4211 0.4211 0.9403 0.9403 1.9004 1.9004 2.0425 2.0425 2.9819 2.9819 3.0733 3.0733 3.3293 3.3293 3.3582 3.3582 3.6114 3.6114 3.7671 3.7671 3.8525 3.8525 4.2360 4.2360 4.7733 4.7733 4.8845 4.8845 5.0321 5.0321 5.5790 5.5790 5.7452 5.7452 6.2060 6.2060 6.2939 6.2939 6.7838 6.7838 6.9404 6.9404 6.9989 6.9989 7.2241 7.2241 7.4176 7.4176 8.4564 8.4564 9.0972 9.0972 k = 0.6065 0.2763-0.0132 ( 6745 PWs) bands (ev): -6.4783 -6.4783 -6.2042 -6.2042 -6.0501 -6.0501 -5.7334 -5.7334 -5.6138 -5.6138 -5.5977 -5.5977 -5.5591 -5.5591 -5.4524 -5.4524 -3.4750 -3.4750 -3.4643 -3.4643 -3.4351 -3.4351 -3.4079 -3.4079 -3.3864 -3.3864 -3.3617 -3.3617 0.4182 0.4182 0.9206 0.9206 1.9157 1.9157 2.0558 2.0558 3.0035 3.0035 3.0642 3.0642 3.3216 3.3216 3.3476 3.3476 3.5848 3.5848 3.7860 3.7860 3.8656 3.8656 4.2337 4.2337 4.7727 4.7727 4.8870 4.8870 5.0487 5.0487 5.5794 5.5794 5.7247 5.7247 6.1945 6.1945 6.2997 6.2997 6.8116 6.8116 6.9492 6.9492 7.0175 7.0175 7.2101 7.2101 7.4017 7.4017 8.4536 8.4536 9.0794 9.0794 k = 0.5989 0.2728 0.0054 ( 6746 PWs) bands (ev): -6.4748 -6.4748 -6.2088 -6.2088 -6.0463 -6.0463 -5.7315 -5.7315 -5.6136 -5.6136 -5.5971 -5.5971 -5.5596 -5.5596 -5.4561 -5.4561 -3.4754 -3.4754 -3.4642 -3.4642 -3.4357 -3.4357 -3.4088 -3.4088 -3.3866 -3.3866 -3.3630 -3.3630 0.4159 0.4159 0.9012 0.9012 1.9324 1.9324 2.0702 2.0702 2.9896 2.9896 3.0901 3.0901 3.3136 3.3136 3.3374 3.3374 3.5577 3.5577 3.8033 3.8033 3.8784 3.8784 4.2318 4.2318 4.7695 4.7695 4.8832 4.8832 5.0695 5.0695 5.5799 5.5799 5.7041 5.7041 6.1827 6.1827 6.3067 6.3067 6.8401 6.8401 6.9572 6.9572 7.0360 7.0360 7.1984 7.1984 7.3849 7.3849 8.4527 8.4527 9.0617 9.0617 k = 0.5913 0.2693 0.0240 ( 6745 PWs) bands (ev): -6.4722 -6.4722 -6.2132 -6.2132 -6.0417 -6.0417 -5.7299 -5.7299 -5.6135 -5.6135 -5.5964 -5.5964 -5.5599 -5.5599 -5.4599 -5.4599 -3.4759 -3.4759 -3.4639 -3.4639 -3.4363 -3.4363 -3.4096 -3.4096 -3.3866 -3.3866 -3.3644 -3.3644 0.4142 0.4142 0.8822 0.8822 1.9503 1.9503 2.0855 2.0855 2.9614 2.9614 3.1296 3.1296 3.3053 3.3053 3.3278 3.3278 3.5305 3.5305 3.8181 3.8181 3.8907 3.8907 4.2312 4.2312 4.7634 4.7634 4.8751 4.8751 5.0927 5.0927 5.5804 5.5804 5.6839 5.6839 6.1712 6.1712 6.3147 6.3147 6.8682 6.8682 6.9641 6.9641 7.0540 7.0540 7.1894 7.1894 7.3679 7.3679 8.4539 8.4539 9.0435 9.0435 k = 0.5837 0.2659 0.0425 ( 6745 PWs) bands (ev): -6.4704 -6.4704 -6.2173 -6.2173 -6.0366 -6.0366 -5.7287 -5.7287 -5.6133 -5.6133 -5.5955 -5.5955 -5.5598 -5.5598 -5.4636 -5.4636 -3.4764 -3.4764 -3.4637 -3.4637 -3.4369 -3.4369 -3.4104 -3.4104 -3.3866 -3.3866 -3.3658 -3.3658 0.4129 0.4129 0.8637 0.8637 1.9693 1.9693 2.1014 2.1014 2.9299 2.9299 3.1720 3.1720 3.2970 3.2970 3.3188 3.3188 3.5037 3.5037 3.8297 3.8297 3.9025 3.9025 4.2324 4.2324 4.7539 4.7539 4.8649 4.8649 5.1168 5.1168 5.5808 5.5808 5.6645 5.6645 6.1601 6.1601 6.3233 6.3233 6.8945 6.8945 6.9701 6.9701 7.0713 7.0713 7.1836 7.1836 7.3511 7.3511 8.4577 8.4577 9.0244 9.0244 k = 0.5761 0.2624 0.0611 ( 6749 PWs) bands (ev): -6.4693 -6.4693 -6.2212 -6.2212 -6.0311 -6.0311 -5.7278 -5.7278 -5.6132 -5.6132 -5.5946 -5.5946 -5.5594 -5.5594 -5.4674 -5.4674 -3.4770 -3.4770 -3.4634 -3.4634 -3.4376 -3.4376 -3.4110 -3.4110 -3.3865 -3.3865 -3.3672 -3.3672 0.4122 0.4122 0.8461 0.8461 1.9891 1.9891 2.1178 2.1178 2.8974 2.8974 3.2145 3.2145 3.2889 3.2889 3.3105 3.3105 3.4780 3.4780 3.8375 3.8375 3.9137 3.9137 4.2362 4.2362 4.7405 4.7405 4.8542 4.8542 5.1405 5.1405 5.5813 5.5813 5.6459 5.6459 6.1496 6.1496 6.3322 6.3322 6.9174 6.9174 6.9752 6.9752 7.0879 7.0879 7.1815 7.1815 7.3351 7.3351 8.4642 8.4642 9.0039 9.0039 k = 0.5685 0.2589 0.0797 ( 6757 PWs) bands (ev): -6.4687 -6.4687 -6.2247 -6.2247 -6.0254 -6.0254 -5.7271 -5.7271 -5.6131 -5.6131 -5.5936 -5.5936 -5.5586 -5.5586 -5.4711 -5.4711 -3.4775 -3.4775 -3.4631 -3.4631 -3.4382 -3.4382 -3.4117 -3.4117 -3.3862 -3.3862 -3.3686 -3.3686 0.4118 0.4118 0.8294 0.8294 2.0095 2.0095 2.1343 2.1343 2.8646 2.8646 3.2523 3.2523 3.2842 3.2842 3.3041 3.3041 3.4538 3.4538 3.8407 3.8407 3.9241 3.9241 4.2432 4.2432 4.7232 4.7232 4.8442 4.8442 5.1632 5.1632 5.5817 5.5817 5.6288 5.6288 6.1399 6.1399 6.3413 6.3413 6.9351 6.9351 6.9799 6.9799 7.1040 7.1040 7.1831 7.1831 7.3203 7.3203 8.4739 8.4739 8.9818 8.9818 k = 0.5609 0.2555 0.0983 ( 6751 PWs) bands (ev): -6.4686 -6.4686 -6.2280 -6.2280 -6.0198 -6.0198 -5.7268 -5.7268 -5.6130 -5.6130 -5.5928 -5.5928 -5.5576 -5.5576 -5.4748 -5.4748 -3.4780 -3.4780 -3.4629 -3.4629 -3.4389 -3.4389 -3.4122 -3.4122 -3.3859 -3.3859 -3.3699 -3.3699 0.4118 0.4118 0.8139 0.8139 2.0302 2.0302 2.1506 2.1506 2.8324 2.8324 3.2613 3.2613 3.2906 3.2906 3.3153 3.3153 3.4320 3.4320 3.8391 3.8391 3.9337 3.9337 4.2536 4.2536 4.7023 4.7023 4.8353 4.8353 5.1843 5.1843 5.5820 5.5820 5.6132 5.6132 6.1311 6.1311 6.3504 6.3504 6.9462 6.9462 6.9847 6.9847 7.1203 7.1203 7.1875 7.1875 7.3072 7.3072 8.4868 8.4868 8.9577 8.9577 k = 0.5533 0.2520 0.1169 ( 6747 PWs) bands (ev): -6.4687 -6.4687 -6.2310 -6.2310 -6.0142 -6.0142 -5.7266 -5.7266 -5.6129 -5.6129 -5.5921 -5.5921 -5.5562 -5.5562 -5.4784 -5.4784 -3.4785 -3.4785 -3.4626 -3.4626 -3.4395 -3.4395 -3.4127 -3.4127 -3.3854 -3.3854 -3.3713 -3.3713 0.4120 0.4120 0.7997 0.7997 2.0508 2.0508 2.1663 2.1663 2.8011 2.8011 3.2532 3.2532 3.2865 3.2865 3.3531 3.3531 3.4137 3.4137 3.8324 3.8324 3.9423 3.9423 4.2675 4.2675 4.6784 4.6784 4.8277 4.8277 5.2034 5.2034 5.5819 5.5819 5.5998 5.5998 6.1233 6.1233 6.3593 6.3593 6.9515 6.9515 6.9888 6.9888 7.1373 7.1373 7.1938 7.1938 7.2962 7.2962 8.5030 8.5030 8.9314 8.9314 k = 0.5457 0.2485 0.1355 ( 6744 PWs) bands (ev): -6.4690 -6.4690 -6.2336 -6.2336 -6.0091 -6.0091 -5.7266 -5.7266 -5.6128 -5.6128 -5.5915 -5.5915 -5.5545 -5.5545 -5.4818 -5.4818 -3.4790 -3.4790 -3.4623 -3.4623 -3.4401 -3.4401 -3.4131 -3.4131 -3.3849 -3.3849 -3.3726 -3.3726 0.4124 0.4124 0.7870 0.7870 2.0708 2.0708 2.1811 2.1811 2.7716 2.7716 3.2429 3.2429 3.2814 3.2814 3.3829 3.3829 3.4095 3.4095 3.8208 3.8208 3.9499 3.9499 4.2847 4.2847 4.6522 4.6522 4.8212 4.8212 5.2202 5.2202 5.5801 5.5801 5.5897 5.5897 6.1164 6.1164 6.3678 6.3678 6.9527 6.9527 6.9914 6.9914 7.1545 7.1545 7.2005 7.2005 7.2875 7.2875 8.5226 8.5226 8.9030 8.9030 k = 0.5381 0.2451 0.1541 ( 6735 PWs) bands (ev): -6.4694 -6.4694 -6.2358 -6.2358 -6.0044 -6.0044 -5.7267 -5.7267 -5.6127 -5.6127 -5.5910 -5.5910 -5.5528 -5.5528 -5.4849 -5.4849 -3.4794 -3.4794 -3.4620 -3.4620 -3.4406 -3.4406 -3.4135 -3.4135 -3.3842 -3.3842 -3.3739 -3.3739 0.4130 0.4130 0.7760 0.7760 2.0898 2.0898 2.1946 2.1946 2.7444 2.7444 3.2322 3.2322 3.2768 3.2768 3.3772 3.3772 3.4435 3.4435 3.8049 3.8049 3.9565 3.9565 4.3045 4.3045 4.6247 4.6247 4.8158 4.8158 5.2346 5.2346 5.5738 5.5738 5.5862 5.5862 6.1106 6.1106 6.3756 6.3756 6.9517 6.9517 6.9923 6.9923 7.1711 7.1711 7.2066 7.2066 7.2813 7.2813 8.5454 8.5454 8.8725 8.8725 k = 0.5304 0.2416 0.1727 ( 6733 PWs) bands (ev): -6.4699 -6.4699 -6.2376 -6.2376 -6.0004 -6.0004 -5.7269 -5.7269 -5.6126 -5.6126 -5.5907 -5.5907 -5.5510 -5.5510 -5.4877 -5.4877 -3.4797 -3.4797 -3.4617 -3.4617 -3.4411 -3.4411 -3.4138 -3.4138 -3.3835 -3.3835 -3.3752 -3.3752 0.4136 0.4136 0.7667 0.7667 2.1070 2.1070 2.2063 2.2063 2.7204 2.7204 3.2220 3.2220 3.2729 3.2729 3.3675 3.3675 3.4833 3.4833 3.7852 3.7852 3.9620 3.9620 4.3263 4.3263 4.5967 4.5967 4.8114 4.8114 5.2464 5.2464 5.5664 5.5664 5.5856 5.5856 6.1058 6.1058 6.3824 6.3824 6.9496 6.9496 6.9919 6.9919 7.1862 7.1862 7.2114 7.2114 7.2773 7.2773 8.5712 8.5712 8.8403 8.8403 k = 0.5228 0.2381 0.1913 ( 6737 PWs) bands (ev): -6.4703 -6.4703 -6.2391 -6.2391 -5.9971 -5.9971 -5.7271 -5.7271 -5.6126 -5.6126 -5.5905 -5.5905 -5.5494 -5.5494 -5.4901 -5.4901 -3.4800 -3.4800 -3.4615 -3.4615 -3.4414 -3.4414 -3.4140 -3.4140 -3.3827 -3.3827 -3.3764 -3.3764 0.4141 0.4141 0.7594 0.7594 2.1216 2.1216 2.2159 2.2159 2.7004 2.7004 3.2131 3.2131 3.2699 3.2699 3.3597 3.3597 3.5218 3.5218 3.7628 3.7628 3.9662 3.9662 4.3490 4.3490 4.5692 4.5692 4.8079 4.8079 5.2555 5.2555 5.5603 5.5603 5.5855 5.5855 6.1020 6.1020 6.3880 6.3880 6.9473 6.9473 6.9909 6.9909 7.1987 7.1987 7.2148 7.2148 7.2752 7.2752 8.5997 8.5997 8.8069 8.8069 k = 0.5152 0.2347 0.2099 ( 6742 PWs) bands (ev): -6.4707 -6.4707 -6.2401 -6.2401 -5.9947 -5.9947 -5.7272 -5.7272 -5.6125 -5.6125 -5.5903 -5.5903 -5.5481 -5.5481 -5.4920 -5.4920 -3.4802 -3.4802 -3.4614 -3.4614 -3.4417 -3.4417 -3.4142 -3.4142 -3.3819 -3.3819 -3.3776 -3.3776 0.4146 0.4146 0.7540 0.7540 2.1329 2.1329 2.2230 2.2230 2.6852 2.6852 3.2061 3.2061 3.2677 3.2677 3.3542 3.3542 3.5566 3.5566 3.7393 3.7393 3.9693 3.9693 4.3707 4.3707 4.5441 4.5441 4.8054 4.8054 5.2621 5.2621 5.5560 5.5560 5.5855 5.5855 6.0994 6.0994 6.3923 6.3923 6.9452 6.9452 6.9897 6.9897 7.2080 7.2080 7.2169 7.2169 7.2744 7.2744 8.6301 8.6301 8.7728 8.7728 k = 0.5076 0.2312 0.2285 ( 6741 PWs) bands (ev): -6.4709 -6.4709 -6.2408 -6.2408 -5.9933 -5.9933 -5.7274 -5.7274 -5.6125 -5.6125 -5.5902 -5.5902 -5.5472 -5.5472 -5.4931 -5.4931 -3.4803 -3.4803 -3.4613 -3.4613 -3.4419 -3.4419 -3.4143 -3.4143 -3.3810 -3.3810 -3.3786 -3.3786 0.4148 0.4148 0.7508 0.7508 2.1401 2.1401 2.2273 2.2273 2.6757 2.6757 3.2017 3.2017 3.2664 3.2664 3.3510 3.3510 3.5841 3.5841 3.7187 3.7187 3.9712 3.9712 4.3881 4.3881 4.5248 4.5248 4.8039 4.8039 5.2660 5.2660 5.5534 5.5534 5.5856 5.5856 6.0978 6.0978 6.3949 6.3949 6.9438 6.9438 6.9889 6.9889 7.2136 7.2136 7.2182 7.2182 7.2742 7.2742 8.6610 8.6610 8.7397 8.7397 k = 0.5000 0.2277 0.2471 ( 6746 PWs) bands (ev): -6.4710 -6.4710 -6.2410 -6.2410 -5.9928 -5.9928 -5.7274 -5.7274 -5.6125 -5.6125 -5.5902 -5.5902 -5.5469 -5.5469 -5.4935 -5.4935 -3.4804 -3.4804 -3.4613 -3.4613 -3.4419 -3.4419 -3.4143 -3.4143 -3.3803 -3.3803 -3.3793 -3.3793 0.4149 0.4149 0.7497 0.7497 2.1425 2.1425 2.2288 2.2288 2.6725 2.6725 3.2002 3.2002 3.2660 3.2660 3.3500 3.3500 3.5957 3.5957 3.7094 3.7094 3.9718 3.9718 4.3952 4.3952 4.5170 4.5170 4.8034 4.8034 5.2672 5.2672 5.5525 5.5525 5.5856 5.5856 6.0972 6.0972 6.3957 6.3957 6.9433 6.9433 6.9886 6.9886 7.2154 7.2154 7.2187 7.2187 7.2742 7.2742 8.6815 8.6815 8.7185 8.7185 k = 0.5000 0.2277 0.2471 ( 6746 PWs) bands (ev): -6.4710 -6.4710 -6.2410 -6.2410 -5.9928 -5.9928 -5.7274 -5.7274 -5.6125 -5.6125 -5.5902 -5.5902 -5.5469 -5.5469 -5.4935 -5.4935 -3.4804 -3.4804 -3.4613 -3.4613 -3.4419 -3.4419 -3.4143 -3.4143 -3.3803 -3.3803 -3.3793 -3.3793 0.4149 0.4149 0.7497 0.7497 2.1425 2.1425 2.2288 2.2288 2.6725 2.6725 3.2002 3.2002 3.2660 3.2660 3.3500 3.3500 3.5957 3.5957 3.7094 3.7094 3.9718 3.9718 4.3952 4.3952 4.5170 4.5170 4.8034 4.8034 5.2672 5.2672 5.5525 5.5525 5.5856 5.5856 6.0972 6.0972 6.3957 6.3957 6.9433 6.9433 6.9886 6.9886 7.2154 7.2154 7.2187 7.2187 7.2742 7.2742 8.6815 8.6815 8.7185 8.7185 k = 0.5084 0.2093 0.2471 ( 6740 PWs) bands (ev): -6.4705 -6.4705 -6.2407 -6.2407 -5.9929 -5.9929 -5.7282 -5.7282 -5.6124 -5.6124 -5.5901 -5.5901 -5.5469 -5.5469 -5.4935 -5.4935 -3.4803 -3.4803 -3.4612 -3.4612 -3.4419 -3.4419 -3.4143 -3.4143 -3.3811 -3.3811 -3.3786 -3.3786 0.4158 0.4158 0.7483 0.7483 2.1328 2.1328 2.2379 2.2379 2.6727 2.6727 3.1645 3.1645 3.3023 3.3023 3.3491 3.3491 3.5961 3.5961 3.7097 3.7097 3.9708 3.9708 4.3950 4.3950 4.5174 4.5174 4.8037 4.8037 5.2607 5.2607 5.5503 5.5503 5.5946 5.5946 6.0977 6.0977 6.3950 6.3950 6.9441 6.9441 6.9895 6.9895 7.2053 7.2053 7.2256 7.2256 7.2783 7.2783 8.6810 8.6810 8.7205 8.7205 k = 0.5168 0.1909 0.2471 ( 6740 PWs) bands (ev): -6.4691 -6.4691 -6.2400 -6.2400 -5.9933 -5.9933 -5.7304 -5.7304 -5.6121 -5.6121 -5.5897 -5.5897 -5.5467 -5.5467 -5.4934 -5.4934 -3.4801 -3.4801 -3.4609 -3.4609 -3.4417 -3.4417 -3.4142 -3.4142 -3.3821 -3.3821 -3.3775 -3.3775 0.4183 0.4183 0.7442 0.7442 2.1106 2.1106 2.2579 2.2579 2.6734 2.6734 3.1095 3.1095 3.3411 3.3411 3.3643 3.3643 3.5975 3.5975 3.7104 3.7104 3.9678 3.9678 4.3941 4.3941 4.5186 4.5186 4.8045 4.8045 5.2425 5.2425 5.5476 5.5476 5.6163 5.6163 6.0989 6.0989 6.3928 6.3928 6.9463 6.9463 6.9924 6.9924 7.1918 7.1918 7.2308 7.2308 7.2895 7.2895 8.6795 8.6795 8.7266 8.7266 k = 0.5252 0.1724 0.2471 ( 6744 PWs) bands (ev): -6.4668 -6.4668 -6.2388 -6.2388 -5.9940 -5.9940 -5.7342 -5.7342 -5.6116 -5.6116 -5.5891 -5.5891 -5.5464 -5.5464 -5.4933 -5.4933 -3.4799 -3.4799 -3.4604 -3.4604 -3.4414 -3.4414 -3.4140 -3.4140 -3.3832 -3.3832 -3.3763 -3.3763 0.4225 0.4225 0.7373 0.7373 2.0836 2.0836 2.2813 2.2813 2.6745 2.6745 3.0538 3.0538 3.3370 3.3370 3.4225 3.4225 3.5995 3.5995 3.7119 3.7119 3.9632 3.9632 4.3927 4.3927 4.5205 4.5205 4.8055 4.8055 5.2158 5.2158 5.5468 5.5468 5.6452 5.6452 6.1009 6.1009 6.3893 6.3893 6.9499 6.9499 6.9971 6.9971 7.1774 7.1774 7.2343 7.2343 7.3053 7.3053 8.6771 8.6771 8.7366 8.7366 k = 0.5336 0.1540 0.2471 ( 6740 PWs) bands (ev): -6.4635 -6.4635 -6.2370 -6.2370 -5.9949 -5.9949 -5.7393 -5.7393 -5.6108 -5.6108 -5.5884 -5.5884 -5.5460 -5.5460 -5.4931 -5.4931 -3.4795 -3.4795 -3.4598 -3.4598 -3.4410 -3.4410 -3.4138 -3.4138 -3.3842 -3.3842 -3.3751 -3.3751 0.4283 0.4283 0.7278 0.7278 2.0550 2.0550 2.3049 2.3049 2.6760 2.6760 2.9996 2.9996 3.3295 3.3295 3.4818 3.4818 3.6020 3.6020 3.7142 3.7142 3.9571 3.9571 4.3908 4.3908 4.5232 4.5232 4.8063 4.8063 5.1840 5.1840 5.5476 5.5476 5.6785 5.6785 6.1039 6.1039 6.3846 6.3846 6.9543 6.9543 7.0036 7.0036 7.1627 7.1627 7.2369 7.2369 7.3242 7.3242 8.6737 8.6737 8.7501 8.7501 k = 0.5420 0.1355 0.2471 ( 6732 PWs) bands (ev): -6.4594 -6.4594 -6.2348 -6.2348 -5.9961 -5.9961 -5.7459 -5.7459 -5.6098 -5.6098 -5.5876 -5.5876 -5.5454 -5.5454 -5.4929 -5.4929 -3.4790 -3.4790 -3.4590 -3.4590 -3.4404 -3.4404 -3.4135 -3.4135 -3.3853 -3.3853 -3.3739 -3.3739 0.4357 0.4357 0.7157 0.7157 2.0258 2.0258 2.3276 2.3276 2.6778 2.6778 2.9475 2.9475 3.3210 3.3210 3.5378 3.5378 3.6052 3.6052 3.7182 3.7182 3.9502 3.9502 4.3885 4.3885 4.5265 4.5265 4.8063 4.8063 5.1499 5.1499 5.5494 5.5494 5.7145 5.7145 6.1078 6.1078 6.3789 6.3789 6.9593 6.9593 7.0118 7.0118 7.1482 7.1482 7.2395 7.2395 7.3453 7.3453 8.6694 8.6694 8.7667 8.7667 k = 0.5504 0.1171 0.2471 ( 6740 PWs) bands (ev): -6.4544 -6.4544 -6.2322 -6.2322 -5.9975 -5.9975 -5.7537 -5.7537 -5.6086 -5.6086 -5.5869 -5.5869 -5.5446 -5.5446 -5.4927 -5.4927 -3.4785 -3.4785 -3.4580 -3.4580 -3.4398 -3.4398 -3.4131 -3.4131 -3.3863 -3.3863 -3.3726 -3.3726 0.4447 0.4447 0.7012 0.7012 1.9968 1.9968 2.3488 2.3488 2.6798 2.6798 2.8980 2.8980 3.3122 3.3122 3.5818 3.5818 3.6141 3.6141 3.7256 3.7256 3.9433 3.9433 4.3857 4.3857 4.5302 4.5302 4.8043 4.8043 5.1160 5.1160 5.5519 5.5519 5.7519 5.7519 6.1126 6.1126 6.3724 6.3724 6.9642 6.9642 7.0213 7.0213 7.1346 7.1346 7.2420 7.2420 7.3681 7.3681 8.6644 8.6644 8.7859 8.7859 k = 0.5588 0.0987 0.2471 ( 6742 PWs) bands (ev): -6.4486 -6.4486 -6.2291 -6.2291 -5.9990 -5.9990 -5.7627 -5.7627 -5.6072 -5.6072 -5.5861 -5.5861 -5.5436 -5.5436 -5.4926 -5.4926 -3.4779 -3.4779 -3.4569 -3.4569 -3.4391 -3.4391 -3.4126 -3.4126 -3.3872 -3.3872 -3.3714 -3.3714 0.4551 0.4551 0.6843 0.6843 1.9685 1.9685 2.3679 2.3679 2.6818 2.6818 2.8515 2.8515 3.3038 3.3038 3.5956 3.5956 3.6404 3.6404 3.7409 3.7409 3.9379 3.9379 4.3828 4.3828 4.5343 4.5343 4.7990 4.7990 5.0845 5.0845 5.5545 5.5545 5.7900 5.7900 6.1183 6.1183 6.3654 6.3654 6.9683 6.9683 7.0315 7.0315 7.1229 7.1229 7.2445 7.2445 7.3925 7.3925 8.6587 8.6587 8.8068 8.8068 k = 0.5672 0.0802 0.2471 ( 6746 PWs) bands (ev): -6.4419 -6.4419 -6.2256 -6.2256 -6.0007 -6.0007 -5.7728 -5.7728 -5.6057 -5.6057 -5.5855 -5.5855 -5.5423 -5.5423 -5.4926 -5.4926 -3.4774 -3.4774 -3.4556 -3.4556 -3.4383 -3.4383 -3.4120 -3.4120 -3.3882 -3.3882 -3.3701 -3.3701 0.4669 0.4669 0.6654 0.6654 1.9410 1.9410 2.3849 2.3849 2.6830 2.6830 2.8088 2.8088 3.2966 3.2966 3.5962 3.5962 3.6608 3.6608 3.7673 3.7673 3.9361 3.9361 4.3798 4.3798 4.5386 4.5386 4.7886 4.7886 5.0578 5.0578 5.5570 5.5570 5.8284 5.8284 6.1248 6.1248 6.3582 6.3582 6.9702 6.9702 7.0418 7.0418 7.1146 7.1146 7.2472 7.2472 7.4182 7.4182 8.6525 8.6525 8.8288 8.8288 k = 0.5756 0.0618 0.2471 ( 6738 PWs) bands (ev): -6.4346 -6.4346 -6.2217 -6.2217 -6.0025 -6.0025 -5.7839 -5.7839 -5.6041 -5.6041 -5.5850 -5.5850 -5.5408 -5.5408 -5.4926 -5.4926 -3.4768 -3.4768 -3.4543 -3.4543 -3.4374 -3.4374 -3.4114 -3.4114 -3.3890 -3.3890 -3.3689 -3.3689 0.4801 0.4801 0.6445 0.6445 1.9149 1.9149 2.3994 2.3994 2.6820 2.6820 2.7715 2.7715 3.2909 3.2909 3.5935 3.5935 3.6680 3.6680 3.7976 3.7976 3.9420 3.9420 4.3771 4.3771 4.5430 4.5430 4.7715 4.7715 5.0378 5.0378 5.5590 5.5590 5.8667 5.8667 6.1320 6.1320 6.3512 6.3512 6.9684 6.9684 7.0514 7.0514 7.1116 7.1116 7.2499 7.2499 7.4448 7.4448 8.6458 8.6458 8.8507 8.8507 k = 0.5840 0.0433 0.2471 ( 6734 PWs) bands (ev): -6.4265 -6.4265 -6.2174 -6.2174 -6.0044 -6.0044 -5.7958 -5.7958 -5.6024 -5.6024 -5.5845 -5.5845 -5.5390 -5.5390 -5.4927 -5.4927 -3.4763 -3.4763 -3.4528 -3.4528 -3.4364 -3.4364 -3.4107 -3.4107 -3.3899 -3.3899 -3.3676 -3.3676 0.4945 0.4945 0.6219 0.6219 1.8903 1.8903 2.4114 2.4114 2.6746 2.6746 2.7438 2.7438 3.2872 3.2872 3.5885 3.5885 3.6672 3.6672 3.8209 3.8209 3.9597 3.9597 4.3751 4.3751 4.5470 4.5470 4.7471 4.7471 5.0256 5.0256 5.5603 5.5603 5.9048 5.9048 6.1396 6.1396 6.3447 6.3447 6.9614 6.9614 7.0607 7.0607 7.1148 7.1148 7.2526 7.2526 7.4721 7.4721 8.6388 8.6388 8.8718 8.8718 k = 0.5924 0.0249 0.2471 ( 6744 PWs) bands (ev): -6.4177 -6.4177 -6.2128 -6.2128 -6.0064 -6.0064 -5.8086 -5.8086 -5.6009 -5.6009 -5.5842 -5.5842 -5.5369 -5.5369 -5.4929 -5.4929 -3.4758 -3.4758 -3.4512 -3.4512 -3.4355 -3.4355 -3.4098 -3.4098 -3.3907 -3.3907 -3.3664 -3.3664 0.5099 0.5099 0.5978 0.5978 1.8676 1.8676 2.4210 2.4210 2.6558 2.6558 2.7304 2.7304 3.2859 3.2859 3.5813 3.5813 3.6611 3.6611 3.8337 3.8337 3.9888 3.9888 4.3743 4.3743 4.5503 4.5503 4.7164 4.7164 5.0205 5.0205 5.5607 5.5607 5.9423 5.9423 6.1470 6.1470 6.3392 6.3392 6.9488 6.9488 7.0705 7.0705 7.1229 7.1229 7.2553 7.2553 7.4996 7.4996 8.6315 8.6315 8.8911 8.8911 k = 0.6008 0.0064 0.2471 ( 6744 PWs) bands (ev): -6.4084 -6.4084 -6.2078 -6.2078 -6.0083 -6.0083 -5.8221 -5.8221 -5.5994 -5.5994 -5.5840 -5.5840 -5.5345 -5.5345 -5.4932 -5.4932 -3.4754 -3.4754 -3.4497 -3.4497 -3.4345 -3.4345 -3.4089 -3.4089 -3.3915 -3.3915 -3.3651 -3.3651 0.5263 0.5263 0.5725 0.5725 1.8469 1.8469 2.4282 2.4282 2.6291 2.6291 2.7280 2.7280 3.2870 3.2870 3.5719 3.5719 3.6511 3.6511 3.8400 3.8400 4.0233 4.0233 4.3755 4.3755 4.5521 4.5521 4.6816 4.6816 5.0213 5.0213 5.5600 5.5600 5.9792 5.9792 6.1536 6.1536 6.3354 6.3354 6.9315 6.9315 7.0816 7.0816 7.1340 7.1340 7.2580 7.2580 7.5269 7.5269 8.6238 8.6238 8.9080 8.9080 k = 0.6092-0.0120 0.2471 ( 6742 PWs) bands (ev): -6.3986 -6.3986 -6.2026 -6.2026 -6.0102 -6.0102 -5.8361 -5.8361 -5.5981 -5.5981 -5.5838 -5.5838 -5.5319 -5.5319 -5.4936 -5.4936 -3.4750 -3.4750 -3.4481 -3.4481 -3.4335 -3.4335 -3.4078 -3.4078 -3.3922 -3.3922 -3.3639 -3.3639 0.5424 0.5424 0.5472 0.5472 1.8287 1.8287 2.4332 2.4332 2.6004 2.6004 2.7306 2.7306 3.2906 3.2906 3.5605 3.5605 3.6378 3.6378 3.8437 3.8437 4.0575 4.0575 4.3796 4.3796 4.5503 4.5503 4.6462 4.6462 5.0264 5.0264 5.5581 5.5581 6.0154 6.0154 6.1587 6.1587 6.3340 6.3340 6.9105 6.9105 7.0941 7.0941 7.1465 7.1465 7.2607 7.2607 7.5535 7.5535 8.6159 8.6159 8.9220 8.9220 k = 0.6176-0.0304 0.2471 ( 6748 PWs) bands (ev): -6.3883 -6.3883 -6.1972 -6.1972 -6.0121 -6.0121 -5.8507 -5.8507 -5.5970 -5.5970 -5.5838 -5.5838 -5.5291 -5.5291 -5.4940 -5.4940 -3.4746 -3.4746 -3.4466 -3.4466 -3.4325 -3.4325 -3.4067 -3.4067 -3.3928 -3.3928 -3.3627 -3.3627 0.5190 0.5190 0.5616 0.5616 1.8130 1.8130 2.4365 2.4365 2.5722 2.5722 2.7355 2.7355 3.2966 3.2966 3.5469 3.5469 3.6217 3.6217 3.8471 3.8471 4.0876 4.0876 4.3877 4.3877 4.5396 4.5396 4.6169 4.6169 5.0346 5.0346 5.5550 5.5550 6.0507 6.0507 6.1614 6.1614 6.3354 6.3354 6.8868 6.8868 7.1073 7.1073 7.1595 7.1595 7.2635 7.2635 7.5789 7.5789 8.6074 8.6074 8.9337 8.9337 k = 0.6260-0.0489 0.2471 ( 6750 PWs) bands (ev): -6.3778 -6.3778 -6.1915 -6.1915 -6.0139 -6.0139 -5.8655 -5.8655 -5.5962 -5.5962 -5.5837 -5.5837 -5.5262 -5.5262 -5.4945 -5.4945 -3.4743 -3.4743 -3.4452 -3.4452 -3.4316 -3.4316 -3.4055 -3.4055 -3.3934 -3.3934 -3.3615 -3.3615 0.4915 0.4915 0.5799 0.5799 1.8002 1.8002 2.4382 2.4382 2.5455 2.5455 2.7417 2.7417 3.3047 3.3047 3.5312 3.5312 3.6035 3.6035 3.8510 3.8510 4.1115 4.1115 4.4004 4.4004 4.5135 4.5135 4.6010 4.6010 5.0451 5.0451 5.5506 5.5506 6.0850 6.0850 6.1612 6.1612 6.3400 6.3400 6.8610 6.8610 7.1205 7.1205 7.1726 7.1726 7.2663 7.2663 7.6026 7.6026 8.5982 8.5982 8.9438 8.9438 k = 0.6344-0.0673 0.2471 ( 6744 PWs) bands (ev): -6.3671 -6.3671 -6.1857 -6.1857 -6.0157 -6.0157 -5.8805 -5.8805 -5.5956 -5.5956 -5.5836 -5.5836 -5.5234 -5.5234 -5.4948 -5.4948 -3.4740 -3.4740 -3.4439 -3.4439 -3.4306 -3.4306 -3.4042 -3.4042 -3.3939 -3.3939 -3.3603 -3.3603 0.4638 0.4638 0.5985 0.5985 1.7905 1.7905 2.4389 2.4389 2.5205 2.5205 2.7488 2.7488 3.3148 3.3148 3.5136 3.5136 3.5836 3.5836 3.8557 3.8557 4.1284 4.1284 4.4170 4.4170 4.4763 4.4763 4.5957 4.5957 5.0571 5.0571 5.5451 5.5451 6.1179 6.1179 6.1581 6.1581 6.3474 6.3474 6.8336 6.8336 7.1330 7.1330 7.1858 7.1858 7.2693 7.2693 7.6239 7.6239 8.5882 8.5882 8.9539 8.9539 k = 0.6428-0.0858 0.2471 ( 6748 PWs) bands (ev): -6.3563 -6.3563 -6.1797 -6.1797 -6.0173 -6.0173 -5.8956 -5.8956 -5.5953 -5.5953 -5.5835 -5.5835 -5.5208 -5.5208 -5.4949 -5.4949 -3.4738 -3.4738 -3.4427 -3.4427 -3.4298 -3.4298 -3.4029 -3.4029 -3.3942 -3.3942 -3.3593 -3.3593 0.4362 0.4362 0.6173 0.6173 1.7841 1.7841 2.4388 2.4388 2.4973 2.4973 2.7566 2.7566 3.3263 3.3263 3.4941 3.4941 3.5624 3.5624 3.8612 3.8612 4.1386 4.1386 4.4217 4.4217 4.4502 4.4502 4.5947 4.5947 5.0705 5.0705 5.5384 5.5384 6.1442 6.1442 6.1576 6.1576 6.3569 6.3569 6.8049 6.8049 7.1439 7.1439 7.1990 7.1990 7.2723 7.2723 7.6426 7.6426 8.5773 8.5773 8.9656 8.9656 k = 0.6512-0.1042 0.2471 ( 6756 PWs) bands (ev): -6.3457 -6.3457 -6.1736 -6.1736 -6.0189 -6.0189 -5.9105 -5.9105 -5.5952 -5.5952 -5.5833 -5.5833 -5.5186 -5.5186 -5.4946 -5.4946 -3.4736 -3.4736 -3.4417 -3.4417 -3.4289 -3.4289 -3.4018 -3.4018 -3.3943 -3.3943 -3.3582 -3.3582 0.4088 0.4088 0.6361 0.6361 1.7813 1.7813 2.4384 2.4384 2.4760 2.4760 2.7651 2.7651 3.3387 3.3387 3.4730 3.4730 3.5405 3.5405 3.8674 3.8674 4.1433 4.1433 4.3818 4.3818 4.4698 4.4698 4.5949 4.5949 5.0847 5.0847 5.5307 5.5307 6.1399 6.1399 6.1838 6.1838 6.3675 6.3675 6.7751 6.7751 7.1528 7.1528 7.2120 7.2120 7.2757 7.2757 7.6583 7.6583 8.5657 8.5657 8.9804 8.9804 k = 0.6596-0.1226 0.2471 ( 6756 PWs) bands (ev): -6.3355 -6.3355 -6.1675 -6.1675 -6.0204 -6.0204 -5.9250 -5.9250 -5.5953 -5.5953 -5.5832 -5.5832 -5.5171 -5.5171 -5.4936 -5.4936 -3.4734 -3.4734 -3.4409 -3.4409 -3.4281 -3.4281 -3.4008 -3.4008 -3.3942 -3.3942 -3.3573 -3.3573 0.3820 0.3820 0.6546 0.6546 1.7822 1.7822 2.4375 2.4375 2.4571 2.4571 2.7741 2.7741 3.3511 3.3511 3.4510 3.4510 3.5180 3.5180 3.8742 3.8742 4.1437 4.1437 4.3360 4.3360 4.4962 4.4962 4.5955 4.5955 5.0996 5.0996 5.5221 5.5221 6.1289 6.1289 6.2134 6.2134 6.3781 6.3781 6.7446 6.7446 7.1594 7.1594 7.2244 7.2244 7.2795 7.2795 7.6708 7.6708 8.5542 8.5542 8.9993 8.9993 k = 0.6680-0.1411 0.2471 ( 6758 PWs) bands (ev): -6.3257 -6.3257 -6.1614 -6.1614 -6.0219 -6.0219 -5.9387 -5.9387 -5.5956 -5.5956 -5.5830 -5.5830 -5.5164 -5.5164 -5.4919 -5.4919 -3.4733 -3.4733 -3.4402 -3.4402 -3.4272 -3.4272 -3.4003 -3.4003 -3.3936 -3.3936 -3.3564 -3.3564 0.3560 0.3560 0.6728 0.6728 1.7869 1.7869 2.4321 2.4321 2.4448 2.4448 2.7836 2.7836 3.3614 3.3614 3.4297 3.4297 3.4953 3.4953 3.8815 3.8815 4.1410 4.1410 4.2897 4.2897 4.5239 4.5239 4.5961 4.5961 5.1152 5.1152 5.5128 5.5128 6.1159 6.1159 6.2420 6.2420 6.3875 6.3875 6.7134 6.7134 7.1639 7.1639 7.2357 7.2357 7.2839 7.2839 7.6800 7.6800 8.5434 8.5434 9.0229 9.0229 k = 0.6764-0.1595 0.2471 ( 6756 PWs) bands (ev): -6.3169 -6.3169 -6.1553 -6.1553 -6.0234 -6.0234 -5.9515 -5.9515 -5.5960 -5.5960 -5.5828 -5.5828 -5.5165 -5.5165 -5.4895 -5.4895 -3.4731 -3.4731 -3.4398 -3.4398 -3.4264 -3.4264 -3.4001 -3.4001 -3.3926 -3.3926 -3.3556 -3.3556 0.3309 0.3309 0.6905 0.6905 1.7955 1.7955 2.4182 2.4182 2.4434 2.4434 2.7936 2.7936 3.3637 3.3637 3.4150 3.4150 3.4726 3.4726 3.8891 3.8891 4.1362 4.1362 4.2436 4.2436 4.5515 4.5515 4.5964 4.5964 5.1311 5.1311 5.5029 5.5029 6.1014 6.1014 6.2695 6.2695 6.3947 6.3947 6.6818 6.6818 7.1663 7.1663 7.2452 7.2452 7.2893 7.2893 7.6857 7.6857 8.5345 8.5345 9.0512 9.0512 k = 0.6848-0.1780 0.2471 ( 6754 PWs) bands (ev): -6.3091 -6.3091 -6.1493 -6.1493 -6.0250 -6.0250 -5.9628 -5.9628 -5.5966 -5.5966 -5.5826 -5.5826 -5.5173 -5.5173 -5.4865 -5.4865 -3.4730 -3.4730 -3.4395 -3.4395 -3.4256 -3.4256 -3.4001 -3.4001 -3.3915 -3.3915 -3.3549 -3.3549 0.3069 0.3069 0.7076 0.7076 1.8082 1.8082 2.4034 2.4034 2.4456 2.4456 2.8041 2.8041 3.3496 3.3496 3.4142 3.4142 3.4506 3.4506 3.8971 3.8971 4.1298 4.1298 4.1982 4.1982 4.5782 4.5782 4.5968 4.5968 5.1475 5.1475 5.4926 5.4926 6.0859 6.0859 6.2956 6.2956 6.3989 6.3989 6.6500 6.6500 7.1666 7.1666 7.2528 7.2528 7.2956 7.2956 7.6882 7.6882 8.5284 8.5284 9.0838 9.0838 k = 0.6932-0.1964 0.2471 ( 6756 PWs) bands (ev): -6.3029 -6.3029 -6.1434 -6.1434 -6.0269 -6.0269 -5.9722 -5.9722 -5.5972 -5.5972 -5.5825 -5.5825 -5.5186 -5.5186 -5.4832 -5.4832 -3.4729 -3.4729 -3.4394 -3.4394 -3.4248 -3.4248 -3.4003 -3.4003 -3.3902 -3.3902 -3.3543 -3.3543 0.2843 0.2843 0.7242 0.7242 1.8249 1.8249 2.3896 2.3896 2.4495 2.4495 2.8151 2.8151 3.3249 3.3249 3.4172 3.4172 3.4337 3.4337 3.9052 3.9052 4.1222 4.1222 4.1538 4.1538 4.5948 4.5948 4.6059 4.6059 5.1640 5.1640 5.4820 5.4820 6.0696 6.0696 6.3203 6.3203 6.3992 6.3992 6.6181 6.6181 7.1650 7.1650 7.2590 7.2590 7.3023 7.3023 7.6874 7.6874 8.5260 8.5260 9.1201 9.1201 k = 0.7016-0.2148 0.2471 ( 6764 PWs) bands (ev): -6.2985 -6.2985 -6.1377 -6.1377 -6.0291 -6.0291 -5.9793 -5.9793 -5.5978 -5.5978 -5.5823 -5.5823 -5.5202 -5.5202 -5.4797 -5.4797 -3.4729 -3.4729 -3.4395 -3.4395 -3.4240 -3.4240 -3.4006 -3.4006 -3.3890 -3.3890 -3.3538 -3.3538 0.2631 0.2631 0.7401 0.7401 1.8454 1.8454 2.3770 2.3770 2.4551 2.4551 2.8266 2.8266 3.2962 3.2962 3.4016 3.4016 3.4373 3.4373 3.9135 3.9135 4.1083 4.1083 4.1161 4.1161 4.5954 4.5954 4.6297 4.6297 5.1805 5.1805 5.4715 5.4715 6.0529 6.0529 6.3434 6.3434 6.3953 6.3953 6.5865 6.5865 7.1615 7.1615 7.2644 7.2644 7.3087 7.3087 7.6835 7.6835 8.5279 8.5279 9.1594 9.1594 k = 0.7100-0.2333 0.2471 ( 6752 PWs) bands (ev): -6.2962 -6.2962 -6.1322 -6.1322 -6.0316 -6.0316 -5.9839 -5.9839 -5.5985 -5.5985 -5.5820 -5.5820 -5.5221 -5.5221 -5.4761 -5.4761 -3.4728 -3.4728 -3.4398 -3.4398 -3.4232 -3.4232 -3.4009 -3.4009 -3.3878 -3.3878 -3.3534 -3.3534 0.2436 0.2436 0.7554 0.7554 1.8698 1.8698 2.3656 2.3656 2.4626 2.4626 2.8385 2.8385 3.2658 3.2658 3.3806 3.3806 3.4461 3.4461 3.9219 3.9219 4.0677 4.0677 4.1062 4.1062 4.5954 4.5954 4.6525 4.6525 5.1969 5.1969 5.4612 5.4612 6.0361 6.0361 6.3647 6.3647 6.3872 6.3872 6.5553 6.5553 7.1561 7.1561 7.2697 7.2697 7.3142 7.3142 7.6769 7.6769 8.5345 8.5345 9.2008 9.2008 k = 0.7184-0.2517 0.2471 ( 6748 PWs) bands (ev): -6.2964 -6.2964 -6.1270 -6.1270 -6.0339 -6.0339 -5.9859 -5.9859 -5.5992 -5.5992 -5.5818 -5.5818 -5.5241 -5.5241 -5.4725 -5.4725 -3.4728 -3.4728 -3.4401 -3.4401 -3.4225 -3.4225 -3.4012 -3.4012 -3.3867 -3.3867 -3.3531 -3.3531 0.2257 0.2257 0.7702 0.7702 1.8976 1.8976 2.3554 2.3554 2.4718 2.4718 2.8509 2.8509 3.2345 3.2345 3.3593 3.3593 3.4538 3.4538 3.9303 3.9303 4.0273 4.0273 4.0972 4.0972 4.5956 4.5956 4.6736 4.6736 5.2128 5.2128 5.4514 5.4514 6.0194 6.0194 6.3719 6.3719 6.3864 6.3864 6.5251 6.5251 7.1490 7.1490 7.2752 7.2752 7.3186 7.3186 7.6676 7.6676 8.5459 8.5459 9.2433 9.2433 k = 0.7268-0.2702 0.2471 ( 6754 PWs) bands (ev): -6.2992 -6.2992 -6.1221 -6.1221 -6.0358 -6.0358 -5.9858 -5.9858 -5.5999 -5.5999 -5.5815 -5.5815 -5.5263 -5.5263 -5.4689 -5.4689 -3.4727 -3.4727 -3.4406 -3.4406 -3.4217 -3.4217 -3.4016 -3.4016 -3.3858 -3.3858 -3.3528 -3.3528 0.2096 0.2096 0.7846 0.7846 1.9287 1.9287 2.3464 2.3464 2.4830 2.4830 2.8637 2.8637 3.2030 3.2030 3.3384 3.3384 3.4592 3.4592 3.9386 3.9386 3.9886 3.9886 4.0880 4.0880 4.5963 4.5963 4.6928 4.6928 5.2280 5.2280 5.4424 5.4424 6.0032 6.0032 6.3551 6.3551 6.4020 6.4020 6.4972 6.4972 7.1405 7.1405 7.2809 7.2809 7.3216 7.3216 7.6561 7.6561 8.5619 8.5619 9.2862 9.2862 k = 0.7352-0.2886 0.2471 ( 6744 PWs) bands (ev): -6.3045 -6.3045 -6.1175 -6.1175 -6.0369 -6.0369 -5.9837 -5.9837 -5.6007 -5.6007 -5.5810 -5.5810 -5.5286 -5.5286 -5.4655 -5.4655 -3.4727 -3.4727 -3.4411 -3.4411 -3.4211 -3.4211 -3.4019 -3.4019 -3.3851 -3.3851 -3.3527 -3.3527 0.1955 0.1955 0.7987 0.7987 1.9626 1.9626 2.3386 2.3386 2.4961 2.4961 2.8770 2.8770 3.1717 3.1717 3.3180 3.3180 3.4618 3.4618 3.9461 3.9461 3.9526 3.9526 4.0786 4.0786 4.5978 4.5978 4.7099 4.7099 5.2420 5.2420 5.4347 5.4347 5.9878 5.9878 6.3335 6.3335 6.4113 6.4113 6.4756 6.4756 7.1307 7.1307 7.2867 7.2867 7.3234 7.3234 7.6426 7.6426 8.5821 8.5821 9.3285 9.3285 k = 0.2648-0.5814 0.5260 ( 6744 PWs) bands (ev): -6.3045 -6.3045 -6.1175 -6.1175 -6.0369 -6.0369 -5.9837 -5.9837 -5.6007 -5.6007 -5.5810 -5.5810 -5.5286 -5.5286 -5.4655 -5.4655 -3.4727 -3.4727 -3.4411 -3.4411 -3.4211 -3.4211 -3.4019 -3.4019 -3.3851 -3.3851 -3.3527 -3.3527 0.1955 0.1955 0.7987 0.7987 1.9626 1.9626 2.3386 2.3386 2.4961 2.4961 2.8770 2.8770 3.1717 3.1717 3.3180 3.3180 3.4618 3.4618 3.9461 3.9461 3.9526 3.9526 4.0786 4.0786 4.5978 4.5978 4.7099 4.7099 5.2420 5.2420 5.4347 5.4347 5.9878 5.9878 6.3335 6.3335 6.4113 6.4113 6.4756 6.4756 7.1307 7.1307 7.2867 7.2867 7.3234 7.3234 7.6426 7.6426 8.5821 8.5821 9.3285 9.3285 k = 0.2565-0.5632 0.5260 ( 6742 PWs) bands (ev): -6.3121 -6.3121 -6.1134 -6.1134 -6.0370 -6.0370 -5.9800 -5.9800 -5.6014 -5.6014 -5.5805 -5.5805 -5.5309 -5.5309 -5.4622 -5.4622 -3.4727 -3.4727 -3.4417 -3.4417 -3.4204 -3.4204 -3.4022 -3.4022 -3.3846 -3.3846 -3.3526 -3.3526 0.1834 0.1834 0.8125 0.8125 1.9983 1.9983 2.3321 2.3321 2.5109 2.5109 2.8905 2.8905 3.1416 3.1416 3.2985 3.2985 3.4611 3.4611 3.9172 3.9172 3.9551 3.9551 4.0691 4.0691 4.6001 4.6001 4.7245 4.7245 5.2540 5.2540 5.4288 5.4288 5.9736 5.9736 6.3088 6.3088 6.4046 6.4046 6.4696 6.4696 7.1202 7.1202 7.2917 7.2917 7.3242 7.3242 7.6279 7.6279 8.6057 8.6057 9.3687 9.3687 k = 0.2483-0.5451 0.5260 ( 6748 PWs) bands (ev): -6.3218 -6.3218 -6.1098 -6.1098 -6.0362 -6.0362 -5.9751 -5.9751 -5.6022 -5.6022 -5.5798 -5.5798 -5.5332 -5.5332 -5.4590 -5.4590 -3.4727 -3.4727 -3.4424 -3.4424 -3.4198 -3.4198 -3.4025 -3.4025 -3.3842 -3.3842 -3.3526 -3.3526 0.1732 0.1732 0.8263 0.8263 2.0356 2.0356 2.3268 2.3268 2.5276 2.5276 2.9043 2.9043 3.1126 3.1126 3.2797 3.2797 3.4570 3.4570 3.8849 3.8849 3.9627 3.9627 4.0593 4.0593 4.6036 4.6036 4.7368 4.7368 5.2636 5.2636 5.4253 5.4253 5.9608 5.9608 6.2814 6.2814 6.3836 6.3836 6.4773 6.4773 7.1091 7.1091 7.2950 7.2950 7.3250 7.3250 7.6121 7.6121 8.6322 8.6322 9.4068 9.4068 k = 0.2400-0.5269 0.5260 ( 6746 PWs) bands (ev): -6.3332 -6.3332 -6.1067 -6.1067 -6.0345 -6.0345 -5.9691 -5.9691 -5.6030 -5.6030 -5.5789 -5.5789 -5.5356 -5.5356 -5.4560 -5.4560 -3.4727 -3.4727 -3.4431 -3.4431 -3.4193 -3.4193 -3.4028 -3.4028 -3.3840 -3.3840 -3.3527 -3.3527 0.1649 0.1649 0.8404 0.8404 2.0740 2.0740 2.3226 2.3226 2.5462 2.5462 2.9183 2.9183 3.0853 3.0853 3.2617 3.2617 3.4494 3.4494 3.8545 3.8545 3.9699 3.9699 4.0493 4.0493 4.6085 4.6085 4.7465 4.7465 5.2702 5.2702 5.4247 5.4247 5.9497 5.9497 6.2521 6.2521 6.3574 6.3574 6.4896 6.4896 7.0977 7.0977 7.2954 7.2954 7.3267 7.3267 7.5958 7.5958 8.6607 8.6607 9.4419 9.4419 k = 0.2317-0.5087 0.5260 ( 6738 PWs) bands (ev): -6.3460 -6.3460 -6.1043 -6.1043 -6.0320 -6.0320 -5.9622 -5.9622 -5.6039 -5.6039 -5.5777 -5.5777 -5.5379 -5.5379 -5.4531 -5.4531 -3.4728 -3.4728 -3.4439 -3.4439 -3.4189 -3.4189 -3.4031 -3.4031 -3.3839 -3.3839 -3.3528 -3.3528 0.1585 0.1585 0.8548 0.8548 2.1124 2.1124 2.3196 2.3196 2.5667 2.5667 2.9325 2.9325 3.0603 3.0603 3.2446 3.2446 3.4384 3.4384 3.8258 3.8258 3.9766 3.9766 4.0390 4.0390 4.6148 4.6148 4.7536 4.7536 5.2733 5.2733 5.4274 5.4274 5.9404 5.9404 6.2217 6.2217 6.3299 6.3299 6.5027 6.5027 7.0862 7.0862 7.2922 7.2922 7.3297 7.3297 7.5795 7.5795 8.6906 8.6906 9.4734 9.4734 k = 0.2234-0.4906 0.5260 ( 6746 PWs) bands (ev): -6.3599 -6.3599 -6.1025 -6.1025 -6.0288 -6.0288 -5.9547 -5.9547 -5.6049 -5.6049 -5.5763 -5.5763 -5.5403 -5.5403 -5.4504 -5.4504 -3.4728 -3.4728 -3.4447 -3.4447 -3.4185 -3.4185 -3.4034 -3.4034 -3.3840 -3.3840 -3.3530 -3.3530 0.1541 0.1541 0.8697 0.8697 2.1500 2.1500 2.3178 2.3178 2.5894 2.5894 2.9468 2.9468 3.0381 3.0381 3.2287 3.2287 3.4244 3.4244 3.7985 3.7985 3.9823 3.9823 4.0286 4.0286 4.6226 4.6226 4.7580 4.7580 5.2731 5.2731 5.4331 5.4331 5.9332 5.9332 6.1908 6.1908 6.3019 6.3019 6.5158 6.5158 7.0749 7.0749 7.2856 7.2856 7.3333 7.3333 7.5637 7.5637 8.7208 8.7208 9.5008 9.5008 k = 0.2152-0.4724 0.5260 ( 6742 PWs) bands (ev): -6.3747 -6.3747 -6.1014 -6.1014 -6.0248 -6.0248 -5.9468 -5.9468 -5.6059 -5.6059 -5.5747 -5.5747 -5.5426 -5.5426 -5.4479 -5.4479 -3.4729 -3.4729 -3.4455 -3.4455 -3.4182 -3.4182 -3.4037 -3.4037 -3.3842 -3.3842 -3.3533 -3.3533 0.1515 0.1515 0.8852 0.8852 2.1854 2.1854 2.3173 2.3173 2.6145 2.6145 2.9608 2.9608 3.0193 3.0193 3.2142 3.2142 3.4078 3.4078 3.7722 3.7722 3.9861 3.9861 4.0187 4.0187 4.6320 4.6320 4.7596 4.7596 5.2701 5.2701 5.4415 5.4415 5.9283 5.9283 6.1602 6.1602 6.2741 6.2741 6.5285 6.5285 7.0639 7.0639 7.2762 7.2762 7.3368 7.3368 7.5491 7.5491 8.7505 8.7505 9.5237 9.5237 k = 0.2069-0.4542 0.5260 ( 6740 PWs) bands (ev): -6.3900 -6.3900 -6.1011 -6.1011 -6.0203 -6.0203 -5.9386 -5.9386 -5.6070 -5.6070 -5.5728 -5.5728 -5.5449 -5.5449 -5.4456 -5.4456 -3.4731 -3.4731 -3.4463 -3.4463 -3.4179 -3.4179 -3.4039 -3.4039 -3.3845 -3.3845 -3.3536 -3.3536 0.1507 0.1507 0.9015 0.9015 2.2173 2.2173 2.3179 2.3179 2.6423 2.6423 2.9742 2.9742 3.0044 3.0044 3.2016 3.2016 3.3894 3.3894 3.7466 3.7466 3.9856 3.9856 4.0113 4.0113 4.6430 4.6430 4.7585 4.7585 5.2648 5.2648 5.4517 5.4517 5.9256 5.9256 6.1306 6.1306 6.2464 6.2464 6.5406 6.5406 7.0534 7.0534 7.2644 7.2644 7.3395 7.3395 7.5360 7.5360 8.7787 8.7787 9.5418 9.5418 k = 0.1986-0.4360 0.5260 ( 6740 PWs) bands (ev): -6.4057 -6.4057 -6.1014 -6.1014 -6.0152 -6.0152 -5.9303 -5.9303 -5.6082 -5.6082 -5.5707 -5.5707 -5.5470 -5.5470 -5.4434 -5.4434 -3.4732 -3.4732 -3.4471 -3.4471 -3.4178 -3.4178 -3.4041 -3.4041 -3.3849 -3.3849 -3.3539 -3.3539 0.1517 0.1517 0.9186 0.9186 2.2445 2.2445 2.3199 2.3199 2.6733 2.6733 2.9864 2.9864 2.9939 2.9939 3.1912 3.1912 3.3699 3.3699 3.7213 3.7213 3.9781 3.9781 4.0090 4.0090 4.6553 4.6553 4.7548 4.7548 5.2579 5.2579 5.4631 5.4631 5.9252 5.9252 6.1026 6.1026 6.2189 6.2189 6.5521 6.5521 7.0435 7.0435 7.2504 7.2504 7.3411 7.3411 7.5250 7.5250 8.8045 8.8045 9.5551 9.5551 k = 0.1903-0.4179 0.5260 ( 6740 PWs) bands (ev): -6.4215 -6.4215 -6.1022 -6.1022 -6.0096 -6.0096 -5.9222 -5.9222 -5.6094 -5.6094 -5.5685 -5.5685 -5.5490 -5.5490 -5.4414 -5.4414 -3.4735 -3.4735 -3.4480 -3.4480 -3.4178 -3.4178 -3.4044 -3.4044 -3.3852 -3.3852 -3.3543 -3.3543 0.1544 0.1544 0.9366 0.9366 2.2660 2.2660 2.3231 2.3231 2.7077 2.7077 2.9866 2.9866 2.9978 2.9978 3.1839 3.1839 3.3502 3.3502 3.6959 3.6959 3.9652 3.9652 4.0098 4.0098 4.6689 4.6689 4.7490 4.7490 5.2499 5.2499 5.4751 5.4751 5.9268 5.9268 6.0769 6.0769 6.1917 6.1917 6.5630 6.5630 7.0345 7.0345 7.2347 7.2347 7.3411 7.3411 7.5162 7.5162 8.8270 8.8270 9.5637 9.5637 k = 0.1821-0.3997 0.5260 ( 6740 PWs) bands (ev): -6.4374 -6.4374 -6.1037 -6.1037 -6.0036 -6.0036 -5.9142 -5.9142 -5.6106 -5.6106 -5.5664 -5.5664 -5.5507 -5.5507 -5.4396 -5.4396 -3.4737 -3.4737 -3.4488 -3.4488 -3.4178 -3.4178 -3.4047 -3.4047 -3.3856 -3.3856 -3.3547 -3.3547 0.1587 0.1587 0.9555 0.9555 2.2813 2.2813 2.3273 2.3273 2.7454 2.7454 2.9838 2.9838 3.0061 3.0061 3.1804 3.1804 3.3314 3.3314 3.6704 3.6704 3.9494 3.9494 4.0107 4.0107 4.6832 4.6832 4.7414 4.7414 5.2411 5.2411 5.4874 5.4874 5.9302 5.9302 6.0543 6.0543 6.1648 6.1648 6.5735 6.5735 7.0264 7.0264 7.2176 7.2176 7.3393 7.3393 7.5097 7.5097 8.8453 8.8453 9.5680 9.5680 k = 0.1738-0.3815 0.5260 ( 6742 PWs) bands (ev): -6.4532 -6.4532 -6.1055 -6.1055 -5.9973 -5.9973 -5.9066 -5.9066 -5.6119 -5.6119 -5.5647 -5.5647 -5.5516 -5.5516 -5.4379 -5.4379 -3.4740 -3.4740 -3.4496 -3.4496 -3.4178 -3.4178 -3.4050 -3.4050 -3.3859 -3.3859 -3.3551 -3.3551 0.1644 0.1644 0.9755 0.9755 2.2907 2.2907 2.3324 2.3324 2.7858 2.7858 2.9842 2.9842 3.0116 3.0116 3.1814 3.1814 3.3147 3.3147 3.6446 3.6446 3.9313 3.9313 4.0107 4.0107 4.6970 4.6970 4.7338 4.7338 5.2320 5.2320 5.4996 5.4996 5.9347 5.9347 6.0354 6.0354 6.1381 6.1381 6.5834 6.5834 7.0191 7.0191 7.1997 7.1997 7.3355 7.3355 7.5058 7.5058 8.8586 8.8586 9.5681 9.5681 k = 0.1655-0.3634 0.5260 ( 6740 PWs) bands (ev): -6.4688 -6.4688 -6.1078 -6.1078 -5.9908 -5.9908 -5.8994 -5.8994 -5.6132 -5.6132 -5.5641 -5.5641 -5.5513 -5.5513 -5.4364 -5.4364 -3.4744 -3.4744 -3.4505 -3.4505 -3.4180 -3.4180 -3.4055 -3.4055 -3.3861 -3.3861 -3.3556 -3.3556 0.1715 0.1715 0.9964 0.9964 2.2947 2.2947 2.3384 2.3384 2.8271 2.8271 2.9873 2.9873 3.0139 3.0139 3.1871 3.1871 3.3014 3.3014 3.6185 3.6185 3.9110 3.9110 4.0094 4.0094 4.7046 4.7046 4.7320 4.7320 5.2226 5.2226 5.5117 5.5117 5.9391 5.9391 6.0217 6.0217 6.1115 6.1115 6.5928 6.5928 7.0128 7.0128 7.1814 7.1814 7.3293 7.3293 7.5042 7.5042 8.8663 8.8663 9.5647 9.5647 k = 0.1572-0.3452 0.5260 ( 6742 PWs) bands (ev): -6.4841 -6.4841 -6.1104 -6.1104 -5.9840 -5.9840 -5.8926 -5.8926 -5.6144 -5.6144 -5.5648 -5.5648 -5.5494 -5.5494 -5.4350 -5.4350 -3.4747 -3.4747 -3.4514 -3.4514 -3.4182 -3.4182 -3.4059 -3.4059 -3.3862 -3.3862 -3.3560 -3.3560 0.1798 0.1798 1.0182 1.0182 2.2941 2.2941 2.3455 2.3455 2.8658 2.8658 2.9938 2.9938 3.0137 3.0137 3.1973 3.1973 3.2930 3.2930 3.5924 3.5924 3.8886 3.8886 4.0065 4.0065 4.6994 4.6994 4.7430 4.7430 5.2132 5.2132 5.5235 5.5235 5.9418 5.9418 6.0145 6.0145 6.0850 6.0850 6.6018 6.6018 7.0073 7.0073 7.1633 7.1633 7.3207 7.3207 7.5051 7.5051 8.8679 8.8679 9.5581 9.5581 k = 0.1490-0.3270 0.5260 ( 6740 PWs) bands (ev): -6.4990 -6.4990 -6.1133 -6.1133 -5.9770 -5.9770 -5.8864 -5.8864 -5.6156 -5.6156 -5.5664 -5.5664 -5.5465 -5.5465 -5.4338 -5.4338 -3.4752 -3.4752 -3.4523 -3.4523 -3.4183 -3.4183 -3.4065 -3.4065 -3.3861 -3.3861 -3.3565 -3.3565 0.1891 0.1891 1.0409 1.0409 2.2897 2.2897 2.3540 2.3540 2.8950 2.8950 3.0033 3.0033 3.0161 3.0161 3.2113 3.2113 3.2908 3.2908 3.5664 3.5664 3.8639 3.8639 4.0017 4.0017 4.6889 4.6889 4.7595 4.7595 5.2039 5.2039 5.5349 5.5349 5.9415 5.9415 6.0149 6.0149 6.0588 6.0588 6.6104 6.6104 7.0025 7.0025 7.1458 7.1458 7.3095 7.3095 7.5084 7.5084 8.8631 8.8631 9.5485 9.5485 k = 0.1407-0.3089 0.5260 ( 6742 PWs) bands (ev): -6.5134 -6.5134 -6.1163 -6.1163 -5.9700 -5.9700 -5.8807 -5.8807 -5.6168 -5.6168 -5.5685 -5.5685 -5.5431 -5.5431 -5.4327 -5.4327 -3.4756 -3.4756 -3.4532 -3.4532 -3.4186 -3.4186 -3.4072 -3.4072 -3.3860 -3.3860 -3.3570 -3.3570 0.1994 0.1994 1.0644 1.0644 2.2827 2.2827 2.3638 2.3638 2.9075 2.9075 3.0027 3.0027 3.0401 3.0401 3.2283 3.2283 3.2954 3.2954 3.5410 3.5410 3.8368 3.8368 3.9950 3.9950 4.6774 4.6774 4.7776 4.7776 5.1949 5.1949 5.5460 5.5460 5.9388 5.9388 6.0202 6.0202 6.0347 6.0347 6.6186 6.6186 6.9983 6.9983 7.1295 7.1295 7.2958 7.2958 7.5138 7.5138 8.8521 8.8521 9.5361 9.5361 k = 0.1324-0.2907 0.5260 ( 6730 PWs) bands (ev): -6.5274 -6.5274 -6.1195 -6.1195 -5.9628 -5.9628 -5.8755 -5.8755 -5.6179 -5.6179 -5.5709 -5.5709 -5.5393 -5.5393 -5.4317 -5.4317 -3.4761 -3.4761 -3.4542 -3.4542 -3.4188 -3.4188 -3.4079 -3.4079 -3.3857 -3.3857 -3.3574 -3.3574 0.2105 0.2105 1.0886 1.0886 2.2739 2.2739 2.3749 2.3749 2.9043 2.9043 2.9979 2.9979 3.0776 3.0776 3.2475 3.2475 3.3069 3.3069 3.5167 3.5167 3.8071 3.8071 3.9864 3.9864 4.6662 4.6662 4.7963 4.7963 5.1862 5.1862 5.5568 5.5568 5.9351 5.9351 6.0043 6.0043 6.0369 6.0369 6.6265 6.6265 6.9945 6.9945 7.1147 7.1147 7.2795 7.2795 7.5214 7.5214 8.8350 8.8350 9.5206 9.5206 k = 0.1241-0.2725 0.5260 ( 6738 PWs) bands (ev): -6.5407 -6.5407 -6.1228 -6.1228 -5.9556 -5.9556 -5.8710 -5.8710 -5.6189 -5.6189 -5.5734 -5.5734 -5.5355 -5.5355 -5.4309 -5.4309 -3.4766 -3.4766 -3.4552 -3.4552 -3.4190 -3.4190 -3.4086 -3.4086 -3.3852 -3.3852 -3.3579 -3.3579 0.2221 0.2221 1.1133 1.1133 2.2645 2.2645 2.3871 2.3871 2.8907 2.8907 2.9926 2.9926 3.1192 3.1192 3.2685 3.2685 3.3244 3.3244 3.4945 3.4945 3.7750 3.7750 3.9758 3.9758 4.6557 4.6557 4.8153 4.8153 5.1779 5.1779 5.5675 5.5675 5.9304 5.9304 5.9805 5.9805 6.0518 6.0518 6.6340 6.6340 6.9906 6.9906 7.1017 7.1017 7.2607 7.2607 7.5309 7.5309 8.8125 8.8125 9.5014 9.5014 k = 0.1159-0.2544 0.5260 ( 6728 PWs) bands (ev): -6.5534 -6.5534 -6.1261 -6.1261 -5.9484 -5.9484 -5.8670 -5.8670 -5.6198 -5.6198 -5.5761 -5.5761 -5.5315 -5.5315 -5.4301 -5.4301 -3.4771 -3.4771 -3.4563 -3.4563 -3.4192 -3.4192 -3.4094 -3.4094 -3.3846 -3.3846 -3.3584 -3.3584 0.2341 0.2341 1.1384 1.1384 2.2552 2.2552 2.4004 2.4004 2.8702 2.8702 2.9875 2.9875 3.1597 3.1597 3.2907 3.2907 3.3467 3.3467 3.4760 3.4760 3.7405 3.7405 3.9635 3.9635 4.6463 4.6463 4.8342 4.8342 5.1703 5.1703 5.5779 5.5779 5.9216 5.9216 5.9618 5.9618 6.0691 6.0691 6.6411 6.6411 6.9865 6.9865 7.0906 7.0906 7.2400 7.2400 7.5422 7.5422 8.7855 8.7855 9.4776 9.4776 k = 0.1076-0.2362 0.5260 ( 6722 PWs) bands (ev): -6.5654 -6.5654 -6.1294 -6.1294 -5.9412 -5.9412 -5.8635 -5.8635 -5.6206 -5.6206 -5.5788 -5.5788 -5.5276 -5.5276 -5.4294 -5.4294 -3.4776 -3.4776 -3.4573 -3.4573 -3.4194 -3.4194 -3.4102 -3.4102 -3.3840 -3.3840 -3.3589 -3.3589 0.2463 0.2463 1.1636 1.1636 2.2466 2.2466 2.4146 2.4146 2.8451 2.8451 2.9833 2.9833 3.1955 3.1955 3.3138 3.3138 3.3710 3.3710 3.4642 3.4642 3.7036 3.7036 3.9494 3.9494 4.6381 4.6381 4.8530 4.8530 5.1635 5.1635 5.5882 5.5882 5.9035 5.9035 5.9540 5.9540 6.0880 6.0880 6.6479 6.6479 6.9819 6.9819 7.0816 7.0816 7.2174 7.2174 7.5550 7.5550 8.7548 8.7548 9.4488 9.4488 k = 0.0993-0.2180 0.5260 ( 6710 PWs) bands (ev): -6.5767 -6.5767 -6.1327 -6.1327 -5.9341 -5.9341 -5.8607 -5.8607 -5.6213 -5.6213 -5.5816 -5.5816 -5.5238 -5.5238 -5.4288 -5.4288 -3.4781 -3.4781 -3.4584 -3.4584 -3.4196 -3.4196 -3.4110 -3.4110 -3.3832 -3.3832 -3.3594 -3.3594 0.2586 0.2586 1.1886 1.1886 2.2394 2.2394 2.4297 2.4297 2.8165 2.8165 2.9802 2.9802 3.2237 3.2237 3.3376 3.3376 3.3928 3.3928 3.4648 3.4648 3.6648 3.6648 3.9338 3.9338 4.6312 4.6312 4.8713 4.8713 5.1579 5.1579 5.5982 5.5982 5.8786 5.8786 5.9545 5.9545 6.1080 6.1080 6.6544 6.6544 6.9766 6.9766 7.0744 7.0744 7.1935 7.1935 7.5691 7.5691 8.7216 8.7216 9.4154 9.4154 k = 0.0910-0.1999 0.5260 ( 6706 PWs) bands (ev): -6.5873 -6.5873 -6.1358 -6.1358 -5.9272 -5.9272 -5.8583 -5.8583 -5.6218 -5.6218 -5.5844 -5.5844 -5.5202 -5.5202 -5.4283 -5.4283 -3.4785 -3.4785 -3.4595 -3.4595 -3.4198 -3.4198 -3.4117 -3.4117 -3.3824 -3.3824 -3.3599 -3.3599 0.2707 0.2707 1.2132 1.2132 2.2340 2.2340 2.4453 2.4453 2.7853 2.7853 2.9786 2.9786 3.2417 3.2417 3.3621 3.3621 3.4080 3.4080 3.4823 3.4823 3.6242 3.6242 3.9167 3.9167 4.6256 4.6256 4.8890 4.8890 5.1535 5.1535 5.6078 5.6078 5.8513 5.8513 5.9592 5.9592 6.1286 6.1286 6.6604 6.6604 6.9706 6.9706 7.0686 7.0686 7.1689 7.1689 7.5842 7.5842 8.6871 8.6871 9.3787 9.3787 k = 0.0828-0.1817 0.5260 ( 6696 PWs) bands (ev): -6.5970 -6.5970 -6.1388 -6.1388 -5.9203 -5.9203 -5.8565 -5.8565 -5.6221 -5.6221 -5.5872 -5.5872 -5.5167 -5.5167 -5.4279 -5.4279 -3.4790 -3.4790 -3.4606 -3.4606 -3.4200 -3.4200 -3.4124 -3.4124 -3.3815 -3.3815 -3.3604 -3.3604 0.2825 0.2825 1.2372 1.2372 2.2309 2.2309 2.4612 2.4612 2.7521 2.7521 2.9788 2.9788 3.2488 3.2488 3.3871 3.3871 3.4211 3.4211 3.5115 3.5115 3.5828 3.5828 3.8985 3.8985 4.6211 4.6211 4.9058 4.9058 5.1509 5.1509 5.6168 5.6168 5.8235 5.8235 5.9662 5.9662 6.1495 6.1495 6.6660 6.6660 6.9640 6.9640 7.0636 7.0636 7.1444 7.1444 7.6000 7.6000 8.6523 8.6523 9.3406 9.3406 k = 0.0745-0.1635 0.5260 ( 6698 PWs) bands (ev): -6.6059 -6.6059 -6.1417 -6.1417 -5.9137 -5.9137 -5.8553 -5.8553 -5.6222 -5.6222 -5.5901 -5.5901 -5.5135 -5.5135 -5.4274 -5.4274 -3.4794 -3.4794 -3.4617 -3.4617 -3.4202 -3.4202 -3.4130 -3.4130 -3.3806 -3.3806 -3.3609 -3.3609 0.2938 0.2938 1.2600 1.2600 2.2304 2.2304 2.4772 2.4772 2.7174 2.7174 2.9811 2.9811 3.2472 3.2472 3.4120 3.4120 3.4359 3.4359 3.5353 3.5353 3.5510 3.5510 3.8792 3.8792 4.6176 4.6176 4.9214 4.9214 5.1503 5.1503 5.6245 5.6245 5.7963 5.7963 5.9749 5.9749 6.1704 6.1704 6.6712 6.6712 6.9568 6.9568 7.0584 7.0584 7.1211 7.1211 7.6161 7.6161 8.6184 8.6184 9.3032 9.3032 k = 0.0662-0.1453 0.5260 ( 6708 PWs) bands (ev): -6.6139 -6.6139 -6.1443 -6.1443 -5.9073 -5.9073 -5.8545 -5.8545 -5.6221 -5.6221 -5.5930 -5.5930 -5.5105 -5.5105 -5.4271 -5.4271 -3.4798 -3.4798 -3.4627 -3.4627 -3.4204 -3.4204 -3.4135 -3.4135 -3.3796 -3.3796 -3.3614 -3.3614 0.3044 0.3044 1.2815 1.2815 2.2329 2.2329 2.4929 2.4929 2.6817 2.6817 2.9859 2.9859 3.2403 3.2403 3.4352 3.4352 3.4501 3.4501 3.5014 3.5014 3.5813 3.5813 3.8590 3.8590 4.6148 4.6148 4.9353 4.9353 5.1522 5.1522 5.6301 5.6301 5.7707 5.7707 5.9847 5.9847 6.1909 6.1909 6.6759 6.6759 6.9489 6.9489 7.0516 7.0516 7.1008 7.1008 7.6321 7.6321 8.5862 8.5862 9.2681 9.2681 k = 0.0579-0.1272 0.5260 ( 6724 PWs) bands (ev): -6.6210 -6.6210 -6.1467 -6.1467 -5.9012 -5.9012 -5.8543 -5.8543 -5.6219 -5.6219 -5.5958 -5.5958 -5.5079 -5.5079 -5.4268 -5.4268 -3.4801 -3.4801 -3.4637 -3.4637 -3.4206 -3.4206 -3.4140 -3.4140 -3.3787 -3.3787 -3.3619 -3.3619 0.3141 0.3141 1.3014 1.3014 2.2385 2.2385 2.5078 2.5078 2.6455 2.6455 2.9935 2.9935 3.2309 3.2309 3.4323 3.4323 3.4637 3.4637 3.4905 3.4905 3.6139 3.6139 3.8380 3.8380 4.6128 4.6128 4.9472 4.9472 5.1568 5.1568 5.6320 5.6320 5.7487 5.7487 5.9950 5.9950 6.2108 6.2108 6.6802 6.6802 6.9404 6.9404 7.0415 7.0415 7.0858 7.0858 7.6475 7.6475 8.5566 8.5566 9.2367 9.2367 k = 0.0497-0.1090 0.5260 ( 6726 PWs) bands (ev): -6.6273 -6.6273 -6.1489 -6.1489 -5.8954 -5.8954 -5.8545 -5.8545 -5.6214 -5.6214 -5.5986 -5.5986 -5.5055 -5.5055 -5.4265 -5.4265 -3.4805 -3.4805 -3.4646 -3.4646 -3.4209 -3.4209 -3.4143 -3.4143 -3.3778 -3.3778 -3.3625 -3.3625 0.3229 0.3229 1.3192 1.3192 2.2474 2.2474 2.5213 2.5213 2.6094 2.6094 3.0041 3.0041 3.2210 3.2210 3.3950 3.3950 3.4830 3.4830 3.5075 3.5075 3.6438 3.6438 3.8165 3.8165 4.6114 4.6114 4.9568 4.9568 5.1642 5.1642 5.6282 5.6282 5.7326 5.7326 6.0054 6.0054 6.2295 6.2295 6.6840 6.6840 6.9312 6.9312 7.0281 7.0281 7.0765 7.0765 7.6621 7.6621 8.5302 8.5302 9.2098 9.2098 k = 0.0414-0.0908 0.5260 ( 6728 PWs) bands (ev): -6.6326 -6.6326 -6.1507 -6.1507 -5.8899 -5.8899 -5.8551 -5.8551 -5.6207 -5.6207 -5.6013 -5.6013 -5.5035 -5.5035 -5.4263 -5.4263 -3.4807 -3.4807 -3.4654 -3.4654 -3.4211 -3.4211 -3.4146 -3.4146 -3.3769 -3.3769 -3.3630 -3.3630 0.3306 0.3306 1.3347 1.3347 2.2594 2.2594 2.5322 2.5322 2.5749 2.5749 3.0180 3.0180 3.2116 3.2116 3.3530 3.3530 3.4999 3.4999 3.5303 3.5303 3.6702 3.6702 3.7945 3.7945 4.6103 4.6103 4.9642 4.9642 5.1738 5.1738 5.6179 5.6179 5.7235 5.7235 6.0154 6.0154 6.2467 6.2467 6.6872 6.6872 6.9215 6.9215 7.0141 7.0141 7.0710 7.0710 7.6751 7.6751 8.5075 8.5075 9.1883 9.1883 k = 0.0331-0.0727 0.5260 ( 6720 PWs) bands (ev): -6.6369 -6.6369 -6.1523 -6.1523 -5.8848 -5.8848 -5.8563 -5.8563 -5.6198 -5.6198 -5.6038 -5.6038 -5.5019 -5.5019 -5.4261 -5.4261 -3.4809 -3.4809 -3.4660 -3.4660 -3.4213 -3.4213 -3.4148 -3.4148 -3.3761 -3.3761 -3.3635 -3.3635 0.3370 0.3370 1.3477 1.3477 2.2744 2.2744 2.5287 2.5287 2.5540 2.5540 3.0352 3.0352 3.2033 3.2033 3.3112 3.3112 3.5137 3.5137 3.5546 3.5546 3.6924 3.6924 3.7723 3.7723 4.6097 4.6097 4.9696 4.9696 5.1849 5.1849 5.6029 5.6029 5.7203 5.7203 6.0245 6.0245 6.2618 6.2618 6.6900 6.6900 6.9117 6.9117 7.0018 7.0018 7.0675 7.0675 7.6864 7.6864 8.4889 8.4889 9.1723 9.1723 k = 0.0248-0.0545 0.5260 ( 6720 PWs) bands (ev): -6.6403 -6.6403 -6.1535 -6.1535 -5.8802 -5.8802 -5.8577 -5.8577 -5.6187 -5.6187 -5.6063 -5.6063 -5.5006 -5.5006 -5.4259 -5.4259 -3.4811 -3.4811 -3.4666 -3.4666 -3.4214 -3.4214 -3.4149 -3.4149 -3.3754 -3.3754 -3.3639 -3.3639 0.3421 0.3421 1.3580 1.3580 2.2917 2.2917 2.5002 2.5002 2.5578 2.5578 3.0555 3.0555 3.1963 3.1963 3.2711 3.2711 3.5247 3.5247 3.5787 3.5787 3.7097 3.7097 3.7506 3.7506 4.6092 4.6092 4.9732 4.9732 5.1961 5.1961 5.5869 5.5869 5.7203 5.7203 6.0322 6.0322 6.2743 6.2743 6.6922 6.6922 6.9025 6.9025 6.9921 6.9921 7.0651 7.0651 7.6956 7.6956 8.4744 8.4744 9.1617 9.1617 k = 0.0166-0.0363 0.5260 ( 6722 PWs) bands (ev): -6.6428 -6.6428 -6.1544 -6.1544 -5.8763 -5.8763 -5.8595 -5.8595 -5.6175 -5.6175 -5.6085 -5.6085 -5.4997 -5.4997 -5.4258 -5.4258 -3.4812 -3.4812 -3.4669 -3.4669 -3.4216 -3.4216 -3.4150 -3.4150 -3.3749 -3.3749 -3.3643 -3.3643 0.3458 0.3458 1.3655 1.3655 2.3099 2.3099 2.4711 2.4711 2.5633 2.5633 3.0783 3.0783 3.1905 3.1905 3.2345 3.2345 3.5326 3.5326 3.6013 3.6013 3.7200 3.7200 3.7322 3.7322 4.6089 4.6089 4.9754 4.9754 5.2060 5.2060 5.5729 5.5729 5.7214 5.7214 6.0381 6.0381 6.2836 6.2836 6.6937 6.6937 6.8950 6.8950 6.9852 6.9852 7.0635 7.0635 7.7023 7.7023 8.4641 8.4641 9.1557 9.1557 k = 0.0083-0.0182 0.5260 ( 6716 PWs) bands (ev): -6.6443 -6.6443 -6.1549 -6.1549 -5.8732 -5.8732 -5.8612 -5.8612 -5.6163 -5.6163 -5.6102 -5.6102 -5.4991 -5.4991 -5.4257 -5.4257 -3.4813 -3.4813 -3.4672 -3.4672 -3.4216 -3.4216 -3.4151 -3.4151 -3.3745 -3.3745 -3.3645 -3.3645 0.3481 0.3481 1.3700 1.3700 2.3259 2.3259 2.4483 2.4483 2.5670 2.5670 3.1008 3.1008 3.1841 3.1841 3.2064 3.2064 3.5374 3.5374 3.6198 3.6198 3.7099 3.7099 3.7325 3.7325 4.6087 4.6087 4.9767 4.9767 5.2127 5.2127 5.5634 5.5634 5.7224 5.7224 6.0417 6.0417 6.2894 6.2894 6.6947 6.6947 6.8901 6.8901 6.9812 6.9812 7.0626 7.0626 7.7063 7.7063 8.4580 8.4580 9.1530 9.1530 k = 0.0000 0.0000 0.5260 ( 6726 PWs) bands (ev): -6.6447 -6.6447 -6.1551 -6.1551 -5.8719 -5.8719 -5.8620 -5.8620 -5.6156 -5.6156 -5.6111 -5.6111 -5.4989 -5.4989 -5.4257 -5.4257 -3.4813 -3.4813 -3.4673 -3.4673 -3.4217 -3.4217 -3.4151 -3.4151 -3.3744 -3.3744 -3.3646 -3.3646 0.3488 0.3488 1.3715 1.3715 2.3330 2.3330 2.4390 2.4390 2.5682 2.5682 3.1128 3.1128 3.1771 3.1771 3.1974 3.1974 3.5390 3.5390 3.6279 3.6279 3.7026 3.7026 3.7347 3.7347 4.6087 4.6087 4.9770 4.9770 5.2152 5.2152 5.5600 5.5600 5.7228 5.7228 6.0430 6.0430 6.2913 6.2913 6.6950 6.6950 6.8884 6.8884 6.9798 6.9798 7.0622 7.0622 7.7077 7.7077 8.4560 8.4560 9.1524 9.1524 k = 0.0000 0.0000 0.5260 ( 6726 PWs) bands (ev): -6.6447 -6.6447 -6.1551 -6.1551 -5.8719 -5.8719 -5.8620 -5.8620 -5.6156 -5.6156 -5.6111 -5.6111 -5.4989 -5.4989 -5.4257 -5.4257 -3.4813 -3.4813 -3.4673 -3.4673 -3.4217 -3.4217 -3.4151 -3.4151 -3.3744 -3.3744 -3.3646 -3.3646 0.3488 0.3488 1.3715 1.3715 2.3330 2.3330 2.4390 2.4390 2.5682 2.5682 3.1128 3.1128 3.1771 3.1771 3.1974 3.1974 3.5390 3.5390 3.6279 3.6279 3.7026 3.7026 3.7347 3.7347 4.6087 4.6087 4.9770 4.9770 5.2152 5.2152 5.5600 5.5600 5.7228 5.7228 6.0430 6.0430 6.2913 6.2913 6.6950 6.6950 6.8884 6.8884 6.9798 6.9798 7.0622 7.0622 7.7077 7.7077 8.4560 8.4560 9.1524 9.1524 k = 0.0184 0.0084 0.5260 ( 6716 PWs) bands (ev): -6.6443 -6.6443 -6.1548 -6.1548 -5.8784 -5.8784 -5.8561 -5.8561 -5.6156 -5.6156 -5.6111 -5.6111 -5.4992 -5.4992 -5.4258 -5.4258 -3.4813 -3.4813 -3.4673 -3.4673 -3.4219 -3.4219 -3.4148 -3.4148 -3.3744 -3.3744 -3.3647 -3.3647 0.3489 0.3489 1.3699 1.3699 2.3241 2.3241 2.4364 2.4364 2.5779 2.5779 3.1152 3.1152 3.1736 3.1736 3.2005 3.2005 3.5391 3.5391 3.6278 3.6278 3.7058 3.7058 3.7358 3.7358 4.6080 4.6080 4.9760 4.9760 5.2146 5.2146 5.5601 5.5601 5.7226 5.7226 6.0435 6.0435 6.2911 6.2911 6.6953 6.6953 6.8898 6.8898 6.9806 6.9806 7.0623 7.0623 7.7071 7.7071 8.4560 8.4560 9.1464 9.1464 k = 0.0367 0.0167 0.5260 ( 6711 PWs) bands (ev): -6.6428 -6.6428 -6.1540 -6.1540 -5.8887 -5.8887 -5.8475 -5.8475 -5.6153 -5.6153 -5.6110 -5.6110 -5.4999 -5.4999 -5.4259 -5.4259 -3.4811 -3.4811 -3.4673 -3.4673 -3.4226 -3.4226 -3.4142 -3.4142 -3.3744 -3.3744 -3.3649 -3.3649 0.3491 0.3491 1.3650 1.3650 2.3013 2.3013 2.4288 2.4288 2.6035 2.6035 3.1217 3.1217 3.1669 3.1669 3.2065 3.2065 3.5393 3.5393 3.6276 3.6276 3.7129 3.7129 3.7414 3.7414 4.6059 4.6059 4.9731 4.9731 5.2128 5.2128 5.5604 5.5604 5.7220 5.7220 6.0451 6.0451 6.2904 6.2904 6.6962 6.6962 6.8938 6.8938 6.9829 6.9829 7.0627 7.0627 7.7053 7.7053 8.4563 8.4563 9.1303 9.1303 k = 0.0551 0.0251 0.5260 ( 6715 PWs) bands (ev): -6.6404 -6.6404 -6.1527 -6.1527 -5.8999 -5.8999 -5.8391 -5.8391 -5.6150 -5.6150 -5.6110 -5.6110 -5.5012 -5.5012 -5.4262 -5.4262 -3.4809 -3.4809 -3.4672 -3.4672 -3.4235 -3.4235 -3.4133 -3.4133 -3.3745 -3.3745 -3.3652 -3.3652 0.3495 0.3495 1.3570 1.3570 2.2708 2.2708 2.4163 2.4163 2.6388 2.6388 3.1282 3.1282 3.1635 3.1635 3.2128 3.2128 3.5397 3.5397 3.6273 3.6273 3.7171 3.7171 3.7578 3.7578 4.6024 4.6024 4.9682 4.9682 5.2100 5.2100 5.5607 5.5607 5.7210 5.7210 6.0478 6.0478 6.2893 6.2893 6.6976 6.6976 6.8998 6.8998 6.9868 6.9868 7.0635 7.0635 7.7021 7.7021 8.4564 8.4564 9.1079 9.1079 k = 0.0735 0.0335 0.5260 ( 6717 PWs) bands (ev): -6.6370 -6.6370 -6.1508 -6.1508 -5.9119 -5.9119 -5.8310 -5.8310 -5.6146 -5.6146 -5.6110 -5.6110 -5.5029 -5.5029 -5.4266 -5.4266 -3.4805 -3.4805 -3.4672 -3.4672 -3.4246 -3.4246 -3.4123 -3.4123 -3.3746 -3.3746 -3.3656 -3.3656 0.3500 0.3500 1.3461 1.3461 2.2372 2.2372 2.3996 2.3996 2.6791 2.6791 3.1272 3.1272 3.1710 3.1710 3.2190 3.2190 3.5405 3.5405 3.6269 3.6269 3.7170 3.7170 3.7859 3.7859 4.5975 4.5975 4.9615 4.9615 5.2063 5.2063 5.5612 5.5612 5.7198 5.7198 6.0515 6.0515 6.2877 6.2877 6.6996 6.6996 6.9070 6.9070 6.9923 6.9923 7.0651 7.0651 7.6977 7.6977 8.4560 8.4560 9.0828 9.0828 k = 0.0919 0.0418 0.5260 ( 6722 PWs) bands (ev): -6.6327 -6.6327 -6.1484 -6.1484 -5.9245 -5.9245 -5.8233 -5.8233 -5.6141 -5.6141 -5.6108 -5.6108 -5.5051 -5.5051 -5.4271 -5.4271 -3.4801 -3.4801 -3.4672 -3.4672 -3.4257 -3.4257 -3.4113 -3.4113 -3.3748 -3.3748 -3.3661 -3.3661 0.3507 0.3507 1.3323 1.3323 2.2027 2.2027 2.3798 2.3798 2.7218 2.7218 3.1194 3.1194 3.1876 3.1876 3.2255 3.2255 3.5420 3.5420 3.6265 3.6265 3.7147 3.7147 3.8226 3.8226 4.5912 4.5912 4.9533 4.9533 5.2017 5.2017 5.5619 5.5619 5.7184 5.7184 6.0563 6.0563 6.2857 6.2857 6.7023 6.7023 6.9146 6.9146 6.9989 6.9989 7.0680 7.0680 7.6920 7.6920 8.4548 8.4548 9.0576 9.0576 k = 0.1102 0.0502 0.5260 ( 6726 PWs) bands (ev): -6.6274 -6.6274 -6.1456 -6.1456 -5.9378 -5.9378 -5.8160 -5.8160 -5.6135 -5.6135 -5.6106 -5.6106 -5.5077 -5.5077 -5.4278 -5.4278 -3.4796 -3.4796 -3.4671 -3.4671 -3.4268 -3.4268 -3.4103 -3.4103 -3.3750 -3.3750 -3.3666 -3.3666 0.3516 0.3516 1.3159 1.3159 2.1688 2.1688 2.3575 2.3575 2.7653 2.7653 3.1095 3.1095 3.2065 3.2065 3.2339 3.2339 3.5443 3.5443 3.6261 3.6261 3.7114 3.7114 3.8662 3.8662 4.5834 4.5834 4.9438 4.9438 5.1965 5.1965 5.5626 5.5626 5.7170 5.7170 6.0622 6.0622 6.2834 6.2834 6.7057 6.7057 6.9218 6.9218 7.0058 7.0058 7.0733 7.0733 7.6848 7.6848 8.4522 8.4522 9.0347 9.0347 k = 0.1286 0.0586 0.5260 ( 6731 PWs) bands (ev): -6.6213 -6.6213 -6.1424 -6.1424 -5.9517 -5.9517 -5.8090 -5.8090 -5.6131 -5.6131 -5.6102 -5.6102 -5.5106 -5.5106 -5.4286 -5.4286 -3.4790 -3.4790 -3.4671 -3.4671 -3.4279 -3.4279 -3.4093 -3.4093 -3.3754 -3.3754 -3.3671 -3.3671 0.3527 0.3527 1.2973 1.2973 2.1361 2.1361 2.3335 2.3335 2.8085 2.8085 3.0993 3.0993 3.2214 3.2214 3.2479 3.2479 3.5479 3.5479 3.6259 3.6259 3.7075 3.7075 3.9153 3.9153 4.5743 4.5743 4.9334 4.9334 5.1907 5.1907 5.5635 5.5635 5.7156 5.7156 6.0691 6.0691 6.2808 6.2808 6.7098 6.7098 6.9280 6.9280 7.0116 7.0116 7.0819 7.0819 7.6763 7.6763 8.4478 8.4478 9.0156 9.0156 k = 0.1470 0.0669 0.5260 ( 6728 PWs) bands (ev): -6.6143 -6.6143 -6.1388 -6.1388 -5.9661 -5.9661 -5.8023 -5.8023 -5.6128 -5.6128 -5.6095 -5.6095 -5.5139 -5.5139 -5.4296 -5.4296 -3.4785 -3.4785 -3.4670 -3.4670 -3.4289 -3.4289 -3.4085 -3.4085 -3.3759 -3.3759 -3.3675 -3.3675 0.3541 0.3541 1.2766 1.2766 2.1050 2.1050 2.3085 2.3085 2.8506 2.8506 3.0896 3.0896 3.2304 3.2304 3.2677 3.2677 3.5532 3.5532 3.6258 3.6258 3.7032 3.7032 3.9689 3.9689 4.5640 4.5640 4.9224 4.9224 5.1843 5.1843 5.5646 5.5646 5.7145 5.7145 6.0772 6.0772 6.2779 6.2779 6.7146 6.7146 6.9332 6.9332 7.0152 7.0152 7.0941 7.0941 7.6663 7.6663 8.4416 8.4416 9.0013 9.0013 k = 0.1654 0.0753 0.5260 ( 6734 PWs) bands (ev): -6.6065 -6.6065 -6.1348 -6.1348 -5.9812 -5.9812 -5.7958 -5.7958 -5.6127 -5.6127 -5.6086 -5.6086 -5.5174 -5.5174 -5.4307 -5.4307 -3.4779 -3.4779 -3.4668 -3.4668 -3.4299 -3.4299 -3.4077 -3.4077 -3.3766 -3.3766 -3.3677 -3.3677 0.3558 0.3558 1.2542 1.2542 2.0758 2.0758 2.2829 2.2829 2.8909 2.8909 3.0804 3.0804 3.2371 3.2371 3.2886 3.2886 3.5608 3.5608 3.6262 3.6262 3.6989 3.6989 4.0258 4.0258 4.5528 4.5528 4.9112 4.9112 5.1774 5.1774 5.5656 5.5656 5.7136 5.7136 6.0862 6.0862 6.2749 6.2749 6.7200 6.7200 6.9375 6.9375 7.0165 7.0165 7.1092 7.1092 7.6547 7.6547 8.4337 8.4337 8.9925 8.9925 k = 0.1837 0.0837 0.5260 ( 6733 PWs) bands (ev): -6.5980 -6.5980 -6.1307 -6.1307 -5.9967 -5.9967 -5.7896 -5.7896 -5.6127 -5.6127 -5.6076 -5.6076 -5.5211 -5.5211 -5.4320 -5.4320 -3.4773 -3.4773 -3.4667 -3.4667 -3.4309 -3.4309 -3.4070 -3.4070 -3.3774 -3.3774 -3.3677 -3.3677 0.3579 0.3579 1.2304 1.2304 2.0485 2.0485 2.2573 2.2573 2.9286 2.9286 3.0721 3.0721 3.2435 3.2435 3.3076 3.3076 3.5709 3.5709 3.6274 3.6274 3.6949 3.6949 4.0847 4.0847 4.5412 4.5412 4.9001 4.9001 5.1700 5.1700 5.5667 5.5667 5.7132 5.7132 6.0963 6.0963 6.2718 6.2718 6.7259 6.7259 6.9409 6.9409 7.0160 7.0160 7.1258 7.1258 7.6417 7.6417 8.4246 8.4246 8.9891 8.9891 k = 0.2021 0.0921 0.5260 ( 6729 PWs) bands (ev): -6.5887 -6.5887 -6.1264 -6.1264 -6.0125 -6.0125 -5.7836 -5.7836 -5.6127 -5.6127 -5.6065 -5.6065 -5.5250 -5.5250 -5.4334 -5.4334 -3.4768 -3.4768 -3.4664 -3.4664 -3.4318 -3.4318 -3.4065 -3.4065 -3.3783 -3.3783 -3.3676 -3.3676 0.3603 0.3603 1.2055 1.2055 2.0235 2.0235 2.2320 2.2320 2.9630 2.9630 3.0648 3.0648 3.2504 3.2504 3.3234 3.3234 3.5829 3.5829 3.6305 3.6305 3.6914 3.6914 4.1439 4.1439 4.5302 4.5302 4.8897 4.8897 5.1620 5.1620 5.5679 5.5679 5.7133 5.7133 6.1073 6.1073 6.2687 6.2687 6.7323 6.7323 6.9438 6.9438 7.0141 7.0141 7.1424 7.1424 7.6272 7.6272 8.4151 8.4151 8.9908 8.9908 k = 0.2205 0.1004 0.5260 ( 6725 PWs) bands (ev): -6.5788 -6.5788 -6.1223 -6.1223 -6.0284 -6.0284 -5.7778 -5.7778 -5.6128 -5.6128 -5.6053 -5.6053 -5.5291 -5.5291 -5.4348 -5.4348 -3.4763 -3.4763 -3.4662 -3.4662 -3.4325 -3.4325 -3.4061 -3.4061 -3.3793 -3.3793 -3.3673 -3.3673 0.3632 0.3632 1.1797 1.1797 2.0006 2.0006 2.2073 2.2073 2.9926 2.9926 3.0592 3.0592 3.2581 3.2581 3.3354 3.3354 3.5946 3.5946 3.6377 3.6377 3.6888 3.6888 4.2009 4.2009 4.5217 4.5217 4.8800 4.8800 5.1534 5.1534 5.5691 5.5691 5.7140 5.7140 6.1192 6.1192 6.2656 6.2656 6.7390 6.7390 6.9462 6.9462 7.0113 7.0113 7.1580 7.1580 7.6112 7.6112 8.4063 8.4063 8.9967 8.9967 k = 0.2389 0.1088 0.5260 ( 6723 PWs) bands (ev): -6.5684 -6.5684 -6.1188 -6.1188 -6.0438 -6.0438 -5.7722 -5.7722 -5.6128 -5.6128 -5.6042 -5.6042 -5.5331 -5.5331 -5.4364 -5.4364 -3.4759 -3.4759 -3.4659 -3.4659 -3.4332 -3.4332 -3.4059 -3.4059 -3.3804 -3.3804 -3.3668 -3.3668 0.3665 0.3665 1.1533 1.1533 1.9799 1.9799 2.1835 2.1835 3.0143 3.0143 3.0575 3.0575 3.2671 3.2671 3.3435 3.3435 3.6028 3.6028 3.6515 3.6515 3.6876 3.6876 4.2516 4.2516 4.5187 4.5187 4.8715 4.8715 5.1439 5.1439 5.5703 5.5703 5.7152 5.7152 6.1319 6.1319 6.2627 6.2627 6.7458 6.7458 6.9483 6.9483 7.0079 7.0079 7.1718 7.1718 7.5938 7.5938 8.3991 8.3991 9.0059 9.0059 k = 0.2572 0.1172 0.5260 ( 6729 PWs) bands (ev): -6.5575 -6.5575 -6.1169 -6.1169 -6.0579 -6.0579 -5.7667 -5.7667 -5.6129 -5.6129 -5.6030 -5.6030 -5.5372 -5.5372 -5.4380 -5.4380 -3.4756 -3.4756 -3.4656 -3.4656 -3.4337 -3.4337 -3.4058 -3.4058 -3.3814 -3.3814 -3.3663 -3.3663 0.3705 0.3705 1.1265 1.1265 1.9616 1.9616 2.1607 2.1607 3.0234 3.0234 3.0639 3.0639 3.2776 3.2776 3.3483 3.3483 3.6071 3.6071 3.6709 3.6709 3.6888 3.6888 4.2901 4.2901 4.5267 4.5267 4.8643 4.8643 5.1335 5.1335 5.5715 5.5715 5.7171 5.7171 6.1450 6.1450 6.2602 6.2602 6.7526 6.7526 6.9501 6.9501 7.0042 7.0042 7.1833 7.1833 7.5750 7.5750 8.3945 8.3945 9.0173 9.0173 k = 0.2756 0.1255 0.5260 ( 6723 PWs) bands (ev): -6.5462 -6.5462 -6.1185 -6.1185 -6.0685 -6.0685 -5.7614 -5.7614 -5.6131 -5.6131 -5.6020 -5.6020 -5.5412 -5.5412 -5.4397 -5.4397 -3.4753 -3.4753 -3.4653 -3.4653 -3.4342 -3.4342 -3.4058 -3.4058 -3.3823 -3.3823 -3.3656 -3.3656 0.3751 0.3751 1.0994 1.0994 1.9456 1.9456 2.1392 2.1392 3.0222 3.0222 3.0753 3.0753 3.2894 3.2894 3.3503 3.3503 3.6092 3.6092 3.6861 3.6861 3.7005 3.7005 4.3112 4.3112 4.5499 4.5499 4.8586 4.8586 5.1220 5.1220 5.5726 5.5726 5.7197 5.7197 6.1585 6.1585 6.2584 6.2584 6.7593 6.7593 6.9515 6.9515 7.0005 7.0005 7.1925 7.1925 7.5550 7.5550 8.3930 8.3930 9.0299 9.0299 k = 0.2940 0.1339 0.5260 ( 6721 PWs) bands (ev): -6.5348 -6.5348 -6.1257 -6.1257 -6.0734 -6.0734 -5.7562 -5.7562 -5.6132 -5.6132 -5.6010 -5.6010 -5.5451 -5.5451 -5.4413 -5.4413 -3.4751 -3.4751 -3.4650 -3.4650 -3.4345 -3.4345 -3.4059 -3.4059 -3.3832 -3.3832 -3.3649 -3.3649 0.3804 0.3804 1.0723 1.0723 1.9319 1.9319 2.1190 2.1190 3.0174 3.0174 3.0850 3.0850 3.3021 3.3021 3.3501 3.3501 3.6103 3.6103 3.6927 3.6927 3.7253 3.7253 4.3154 4.3154 4.5870 4.5870 4.8547 4.8547 5.1094 5.1094 5.5738 5.5738 5.7229 5.7229 6.1716 6.1716 6.2577 6.2577 6.7655 6.7655 6.9524 6.9524 6.9972 6.9972 7.1995 7.1995 7.5339 7.5339 8.3950 8.3950 9.0429 9.0429 k = 0.3123 0.1423 0.5260 ( 6729 PWs) bands (ev): -6.5233 -6.5233 -6.1381 -6.1381 -6.0730 -6.0730 -5.7513 -5.7513 -5.6133 -5.6133 -5.6001 -5.6001 -5.5486 -5.5486 -5.4430 -5.4430 -3.4749 -3.4749 -3.4648 -3.4648 -3.4347 -3.4347 -3.4061 -3.4061 -3.3839 -3.3839 -3.3641 -3.3641 0.3865 0.3865 1.0453 1.0453 1.9208 1.9208 2.1003 2.1003 3.0112 3.0112 3.0908 3.0908 3.3149 3.3149 3.3484 3.3484 3.6109 3.6109 3.7009 3.7009 3.7521 3.7521 4.3080 4.3080 4.6314 4.6314 4.8531 4.8531 5.0956 5.0956 5.5749 5.5749 5.7266 5.7266 6.1837 6.1837 6.2588 6.2588 6.7711 6.7711 6.9524 6.9524 6.9948 6.9948 7.2048 7.2048 7.5118 7.5118 8.4007 8.4007 9.0556 9.0556 k = 0.3307 0.1506 0.5260 ( 6732 PWs) bands (ev): -6.5120 -6.5120 -6.1531 -6.1531 -6.0696 -6.0696 -5.7467 -5.7467 -5.6135 -5.6135 -5.5994 -5.5994 -5.5519 -5.5519 -5.4446 -5.4446 -3.4748 -3.4748 -3.4646 -3.4646 -3.4348 -3.4348 -3.4064 -3.4064 -3.3846 -3.3846 -3.3632 -3.3632 0.3936 0.3936 1.0185 1.0185 1.9120 1.9120 2.0833 2.0833 3.0045 3.0045 3.0921 3.0921 3.3267 3.3267 3.3460 3.3460 3.6113 3.6113 3.7122 3.7122 3.7789 3.7789 4.2940 4.2940 4.6767 4.6767 4.8544 4.8544 5.0806 5.0806 5.5759 5.5759 5.7309 5.7309 6.1937 6.1937 6.2626 6.2626 6.7759 6.7759 6.9513 6.9513 6.9938 6.9938 7.2090 7.2090 7.4889 7.4889 8.4099 8.4099 9.0675 9.0675 k = 0.3491 0.1590 0.5260 ( 6741 PWs) bands (ev): -6.5013 -6.5013 -6.1689 -6.1689 -6.0648 -6.0648 -5.7425 -5.7425 -5.6136 -5.6136 -5.5988 -5.5988 -5.5546 -5.5546 -5.4461 -5.4461 -3.4747 -3.4747 -3.4645 -3.4645 -3.4348 -3.4348 -3.4066 -3.4066 -3.3852 -3.3852 -3.3623 -3.3623 0.4016 0.4016 0.9920 0.9920 1.9057 1.9057 2.0679 2.0679 2.9973 2.9973 3.0894 3.0894 3.3344 3.3344 3.3456 3.3456 3.6114 3.6114 3.7271 3.7271 3.8049 3.8049 4.2764 4.2764 4.7176 4.7176 4.8598 4.8598 5.0645 5.0645 5.5770 5.5770 5.7354 5.7354 6.2006 6.2006 6.2700 6.2700 6.7797 6.7797 6.9487 6.9487 6.9944 6.9944 7.2130 7.2130 7.4655 7.4655 8.4225 8.4225 9.0783 9.0783 k = 0.3675 0.1674 0.5260 ( 6748 PWs) bands (ev): -6.4913 -6.4913 -6.1846 -6.1846 -6.0592 -6.0592 -5.7388 -5.7388 -5.6138 -5.6138 -5.5984 -5.5984 -5.5568 -5.5568 -5.4475 -5.4475 -3.4746 -3.4746 -3.4645 -3.4645 -3.4347 -3.4347 -3.4068 -3.4068 -3.3857 -3.3857 -3.3613 -3.3613 0.4108 0.4108 0.9659 0.9659 1.9019 1.9019 2.0543 2.0543 2.9898 2.9898 3.0830 3.0830 3.3335 3.3335 3.3514 3.3514 3.6115 3.6115 3.7454 3.7454 3.8296 3.8296 4.2567 4.2567 4.7504 4.7504 4.8703 4.8703 5.0478 5.0478 5.5779 5.5779 5.7403 5.7403 6.2045 6.2045 6.2807 6.2807 6.7823 6.7823 6.9449 6.9449 6.9963 6.9963 7.2178 7.2178 7.4416 7.4416 8.4381 8.4381 9.0882 9.0882 k = 0.3858 0.1757 0.5260 ( 6745 PWs) bands (ev): -6.4827 -6.4827 -6.1993 -6.1993 -6.0532 -6.0532 -5.7356 -5.7356 -5.6140 -5.6140 -5.5980 -5.5980 -5.5583 -5.5583 -5.4488 -5.4488 -3.4745 -3.4745 -3.4645 -3.4645 -3.4346 -3.4346 -3.4070 -3.4070 -3.3861 -3.3861 -3.3603 -3.3603 0.4211 0.4211 0.9403 0.9403 1.9004 1.9004 2.0425 2.0425 2.9819 2.9819 3.0733 3.0733 3.3293 3.3293 3.3582 3.3582 3.6114 3.6114 3.7671 3.7671 3.8525 3.8525 4.2360 4.2360 4.7733 4.7733 4.8845 4.8845 5.0321 5.0321 5.5790 5.5790 5.7452 5.7452 6.2060 6.2060 6.2939 6.2939 6.7838 6.7838 6.9404 6.9404 6.9989 6.9989 7.2241 7.2241 7.4176 7.4176 8.4564 8.4564 9.0972 9.0972 k = 0.5000 0.2277-0.2789 ( 6722 PWs) bands (ev): -6.4961 -6.4961 -6.2522 -6.2522 -6.0147 -6.0147 -5.7367 -5.7367 -5.6162 -5.6162 -5.6015 -5.6015 -5.5367 -5.5367 -5.4356 -5.4356 -3.4693 -3.4693 -3.4677 -3.4677 -3.4303 -3.4303 -3.3974 -3.3974 -3.3817 -3.3817 -3.3414 -3.3414 0.5641 0.5641 0.9081 0.9081 1.8247 1.8247 1.8802 1.8802 2.5399 2.5399 3.3034 3.3034 3.3478 3.3478 3.4958 3.4958 3.6907 3.6907 3.7954 3.7954 3.9247 3.9247 4.0160 4.0160 4.7942 4.7942 4.8236 4.8236 5.0265 5.0265 5.5826 5.5826 5.9213 5.9213 6.3196 6.3196 6.3887 6.3887 6.6447 6.6447 6.7563 6.7563 6.8011 6.8011 7.3523 7.3523 7.4710 7.4710 8.5502 8.5502 9.3400 9.3400 k = 0.5084 0.2093-0.2789 ( 6720 PWs) bands (ev): -6.4958 -6.4958 -6.2520 -6.2520 -6.0150 -6.0150 -5.7369 -5.7369 -5.6162 -5.6162 -5.6014 -5.6014 -5.5367 -5.5367 -5.4357 -5.4357 -3.4697 -3.4697 -3.4672 -3.4672 -3.4303 -3.4303 -3.3974 -3.3974 -3.3815 -3.3815 -3.3415 -3.3415 0.5621 0.5621 0.9081 0.9081 1.8249 1.8249 1.8841 1.8841 2.5399 2.5399 3.2971 3.2971 3.3496 3.3496 3.4933 3.4933 3.6932 3.6932 3.7949 3.7949 3.9250 3.9250 4.0179 4.0179 4.7921 4.7921 4.8226 4.8226 5.0253 5.0253 5.5856 5.5856 5.9191 5.9191 6.3183 6.3183 6.3861 6.3861 6.6435 6.6435 6.7585 6.7585 6.8025 6.8025 7.3523 7.3523 7.4714 7.4714 8.5524 8.5524 9.3439 9.3439 k = 0.5168 0.1909-0.2789 ( 6724 PWs) bands (ev): -6.4948 -6.4948 -6.2513 -6.2513 -6.0158 -6.0158 -5.7373 -5.7373 -5.6163 -5.6163 -5.6008 -5.6008 -5.5366 -5.5366 -5.4360 -5.4360 -3.4704 -3.4704 -3.4664 -3.4664 -3.4302 -3.4302 -3.3975 -3.3975 -3.3812 -3.3812 -3.3417 -3.3417 0.5559 0.5559 0.9081 0.9081 1.8256 1.8256 1.8955 1.8955 2.5400 2.5400 3.2809 3.2809 3.3522 3.3522 3.4859 3.4859 3.7007 3.7007 3.7933 3.7933 3.9262 3.9262 4.0231 4.0231 4.7839 4.7839 4.8217 4.8217 5.0217 5.0217 5.5941 5.5941 5.9125 5.9125 6.3134 6.3134 6.3797 6.3797 6.6399 6.6399 6.7644 6.7644 6.8070 6.8070 7.3526 7.3526 7.4725 7.4725 8.5591 8.5591 9.3555 9.3555 k = 0.5252 0.1724-0.2789 ( 6720 PWs) bands (ev): -6.4931 -6.4931 -6.2503 -6.2503 -6.0173 -6.0173 -5.7379 -5.7379 -5.6165 -5.6165 -5.5999 -5.5999 -5.5364 -5.5364 -5.4365 -5.4365 -3.4711 -3.4711 -3.4654 -3.4654 -3.4300 -3.4300 -3.3977 -3.3977 -3.3806 -3.3806 -3.3420 -3.3420 0.5461 0.5461 0.9081 0.9081 1.8273 1.8273 1.9135 1.9135 2.5402 2.5402 3.2588 3.2588 3.3524 3.3524 3.4742 3.4742 3.7125 3.7125 3.7900 3.7900 3.9293 3.9293 4.0309 4.0309 4.7672 4.7672 4.8239 4.8239 5.0159 5.0159 5.6077 5.6077 5.9018 5.9018 6.3024 6.3024 6.3734 6.3734 6.6342 6.6342 6.7715 6.7715 6.8156 6.8156 7.3529 7.3529 7.4746 7.4746 8.5702 8.5702 9.3744 9.3744 k = 0.5336 0.1540-0.2789 ( 6724 PWs) bands (ev): -6.4908 -6.4908 -6.2488 -6.2488 -6.0192 -6.0192 -5.7387 -5.7387 -5.6167 -5.6167 -5.5988 -5.5988 -5.5361 -5.5361 -5.4371 -5.4371 -3.4717 -3.4717 -3.4643 -3.4643 -3.4297 -3.4297 -3.3979 -3.3979 -3.3797 -3.3797 -3.3425 -3.3425 0.5329 0.5329 0.9082 0.9082 1.8301 1.8301 1.9374 1.9374 2.5405 2.5405 3.2326 3.2326 3.3491 3.3491 3.4588 3.4588 3.7279 3.7279 3.7847 3.7847 3.9349 3.9349 4.0404 4.0404 4.7425 4.7425 4.8292 4.8292 5.0078 5.0078 5.6254 5.6254 5.8875 5.8875 6.2834 6.2834 6.3707 6.3707 6.6269 6.6269 6.7777 6.7777 6.8282 6.8282 7.3532 7.3532 7.4779 7.4779 8.5856 8.5856 9.4001 9.4001 k = 0.5420 0.1355-0.2789 ( 6722 PWs) bands (ev): -6.4878 -6.4878 -6.2469 -6.2469 -6.0218 -6.0218 -5.7398 -5.7398 -5.6169 -5.6169 -5.5973 -5.5973 -5.5359 -5.5359 -5.4379 -5.4379 -3.4723 -3.4723 -3.4631 -3.4631 -3.4294 -3.4294 -3.3981 -3.3981 -3.3787 -3.3787 -3.3431 -3.3431 0.5170 0.5170 0.9083 0.9083 1.8340 1.8340 1.9665 1.9665 2.5408 2.5408 3.2036 3.2036 3.3423 3.3423 3.4404 3.4404 3.7459 3.7459 3.7777 3.7777 3.9431 3.9431 4.0506 4.0506 4.7114 4.7114 4.8370 4.8370 4.9975 4.9975 5.6464 5.6464 5.8702 5.8702 6.2577 6.2577 6.3720 6.3720 6.6183 6.6183 6.7826 6.7826 6.8439 6.8439 7.3535 7.3535 7.4827 7.4827 8.6052 8.6052 9.4316 9.4316 k = 0.5504 0.1171-0.2789 ( 6724 PWs) bands (ev): -6.4842 -6.4842 -6.2447 -6.2447 -6.0250 -6.0250 -5.7411 -5.7411 -5.6170 -5.6170 -5.5957 -5.5957 -5.5356 -5.5356 -5.4388 -5.4388 -3.4729 -3.4729 -3.4619 -3.4619 -3.4290 -3.4290 -3.3984 -3.3984 -3.3775 -3.3775 -3.3438 -3.3438 0.4991 0.4991 0.9084 0.9084 1.8389 1.8389 1.9999 1.9999 2.5413 2.5413 3.1725 3.1725 3.3321 3.3321 3.4197 3.4197 3.7618 3.7618 3.7733 3.7733 3.9535 3.9535 4.0611 4.0611 4.6750 4.6750 4.8467 4.8467 4.9851 4.9851 5.6694 5.6694 5.8507 5.8507 6.2276 6.2276 6.3762 6.3762 6.6087 6.6087 6.7866 6.7866 6.8610 6.8610 7.3536 7.3536 7.4890 7.4890 8.6288 8.6288 9.4680 9.4680 k = 0.5588 0.0987-0.2789 ( 6726 PWs) bands (ev): -6.4799 -6.4799 -6.2421 -6.2421 -6.0289 -6.0289 -5.7426 -5.7426 -5.6171 -5.6171 -5.5939 -5.5939 -5.5353 -5.5353 -5.4396 -5.4396 -3.4734 -3.4734 -3.4606 -3.4606 -3.4285 -3.4285 -3.3987 -3.3987 -3.3761 -3.3761 -3.3446 -3.3446 0.4797 0.4797 0.9087 0.9087 1.8446 1.8446 2.0370 2.0370 2.5418 2.5418 3.1401 3.1401 3.3188 3.3188 3.3971 3.3971 3.7561 3.7561 3.7911 3.7911 3.9655 3.9655 4.0713 4.0713 4.6342 4.6342 4.8580 4.8580 4.9707 4.9707 5.6927 5.6927 5.8305 5.8305 6.1951 6.1951 6.3825 6.3825 6.5983 6.5983 6.7901 6.7901 6.8784 6.8784 7.3536 7.3536 7.4971 7.4971 8.6561 8.6561 9.5085 9.5085 k = 0.5672 0.0802-0.2789 ( 6726 PWs) bands (ev): -6.4751 -6.4751 -6.2391 -6.2391 -6.0334 -6.0334 -5.7443 -5.7443 -5.6171 -5.6171 -5.5920 -5.5920 -5.5350 -5.5350 -5.4404 -5.4404 -3.4738 -3.4738 -3.4593 -3.4593 -3.4279 -3.4279 -3.3989 -3.3989 -3.3746 -3.3746 -3.3455 -3.3455 0.4595 0.4595 0.9090 0.9090 1.8509 1.8509 2.0768 2.0768 2.5423 2.5423 3.1069 3.1069 3.3026 3.3026 3.3731 3.3731 3.7455 3.7455 3.8143 3.8143 3.9785 3.9785 4.0810 4.0810 4.5898 4.5898 4.8707 4.8707 4.9546 4.9546 5.7135 5.7135 5.8125 5.8125 6.1615 6.1615 6.3902 6.3902 6.5874 6.5874 6.7934 6.7934 6.8953 6.8953 7.3534 7.3534 7.5070 7.5070 8.6867 8.6867 9.5519 9.5519 k = 0.5756 0.0618-0.2789 ( 6729 PWs) bands (ev): -6.4696 -6.4696 -6.2358 -6.2358 -6.0386 -6.0386 -5.7461 -5.7461 -5.6171 -5.6171 -5.5900 -5.5900 -5.5348 -5.5348 -5.4412 -5.4412 -3.4742 -3.4742 -3.4580 -3.4580 -3.4273 -3.4273 -3.3991 -3.3991 -3.3730 -3.3730 -3.3465 -3.3465 0.4391 0.4391 0.9095 0.9095 1.8576 1.8576 2.1185 2.1185 2.5429 2.5429 3.0736 3.0736 3.2840 3.2840 3.3481 3.3481 3.7343 3.7343 3.8387 3.8387 3.9920 3.9920 4.0898 4.0898 4.5425 4.5425 4.8841 4.8841 4.9372 4.9372 5.7246 5.7246 5.8039 5.8039 6.1278 6.1278 6.3990 6.3990 6.5762 6.5762 6.7970 6.7970 6.9114 6.9114 7.3529 7.3529 7.5185 7.5185 8.7203 8.7203 9.5975 9.5975 k = 0.5840 0.0434-0.2789 ( 6733 PWs) bands (ev): -6.4635 -6.4635 -6.2322 -6.2322 -6.0445 -6.0445 -5.7480 -5.7480 -5.6171 -5.6171 -5.5880 -5.5880 -5.5346 -5.5346 -5.4418 -5.4418 -3.4746 -3.4746 -3.4566 -3.4566 -3.4266 -3.4266 -3.3993 -3.3993 -3.3713 -3.3713 -3.3475 -3.3475 0.4189 0.4189 0.9101 0.9101 1.8644 1.8644 2.1613 2.1613 2.5436 2.5436 3.0407 3.0407 3.2632 3.2632 3.3224 3.3224 3.7230 3.7230 3.8639 3.8639 4.0053 4.0053 4.0976 4.0976 4.4928 4.4928 4.8959 4.8959 4.9209 4.9209 5.7181 5.7181 5.8126 5.8126 6.0949 6.0949 6.4087 6.4087 6.5650 6.5650 6.8009 6.8009 6.9268 6.9268 7.3522 7.3522 7.5315 7.5315 8.7563 8.7563 9.6442 9.6442 k = 0.5924 0.0249-0.2789 ( 6735 PWs) bands (ev): -6.4569 -6.4569 -6.2284 -6.2284 -6.0513 -6.0513 -5.7501 -5.7501 -5.6169 -5.6169 -5.5859 -5.5859 -5.5344 -5.5344 -5.4422 -5.4422 -3.4748 -3.4748 -3.4552 -3.4552 -3.4259 -3.4259 -3.3995 -3.3995 -3.3695 -3.3695 -3.3486 -3.3486 0.3995 0.3995 0.9109 0.9109 1.8710 1.8710 2.2043 2.2043 2.5443 2.5443 3.0089 3.0089 3.2409 3.2409 3.2963 3.2963 3.7120 3.7120 3.8896 3.8896 4.0183 4.0183 4.1043 4.1043 4.4411 4.4411 4.8897 4.8897 4.9220 4.9220 5.6995 5.6995 5.8332 5.8332 6.0634 6.0634 6.4191 6.4191 6.5539 6.5539 6.8055 6.8055 6.9416 6.9416 7.3512 7.3512 7.5457 7.5457 8.7942 8.7942 9.6914 9.6914 k = 0.6008 0.0065-0.2789 ( 6741 PWs) bands (ev): -6.4497 -6.4497 -6.2242 -6.2242 -6.0588 -6.0588 -5.7523 -5.7523 -5.6167 -5.6167 -5.5839 -5.5839 -5.5342 -5.5342 -5.4423 -5.4423 -3.4750 -3.4750 -3.4538 -3.4538 -3.4251 -3.4251 -3.3995 -3.3995 -3.3676 -3.3676 -3.3497 -3.3497 0.3812 0.3812 0.9119 0.9119 1.8771 1.8771 2.2464 2.2464 2.5452 2.5452 2.9787 2.9787 3.2174 3.2174 3.2700 3.2700 3.7014 3.7014 3.9153 3.9153 4.0304 4.0304 4.1098 4.1098 4.3879 4.3879 4.8689 4.8689 4.9370 4.9370 5.6767 5.6767 5.8578 5.8578 6.0339 6.0339 6.4300 6.4300 6.5430 6.5430 6.8111 6.8111 6.9561 6.9561 7.3500 7.3500 7.5605 7.5605 8.8334 8.8334 9.7383 9.7383 k = 0.6092-0.0120-0.2789 ( 6745 PWs) bands (ev): -6.4420 -6.4420 -6.2199 -6.2199 -6.0671 -6.0671 -5.7545 -5.7545 -5.6165 -5.6165 -5.5819 -5.5819 -5.5339 -5.5339 -5.4423 -5.4423 -3.4752 -3.4752 -3.4524 -3.4524 -3.4243 -3.4243 -3.3996 -3.3996 -3.3658 -3.3658 -3.3508 -3.3508 0.3644 0.3644 0.9133 0.9133 1.8824 1.8824 2.2866 2.2866 2.5461 2.5461 2.9508 2.9508 3.1936 3.1936 3.2436 3.2436 3.6914 3.6914 3.9409 3.9409 4.0414 4.0414 4.1142 4.1142 4.3337 4.3337 4.8451 4.8451 4.9543 4.9543 5.6527 5.6527 5.8835 5.8835 6.0069 6.0069 6.4412 6.4412 6.5325 6.5325 6.8180 6.8180 6.9707 6.9707 7.3485 7.3485 7.5757 7.5757 8.8732 8.8732 9.7845 9.7845 k = 0.6176-0.0304-0.2789 ( 6735 PWs) bands (ev): -6.4338 -6.4338 -6.2154 -6.2154 -6.0763 -6.0763 -5.7569 -5.7569 -5.6162 -5.6162 -5.5801 -5.5801 -5.5334 -5.5334 -5.4419 -5.4419 -3.4753 -3.4753 -3.4509 -3.4509 -3.4235 -3.4235 -3.3995 -3.3995 -3.3639 -3.3639 -3.3518 -3.3518 0.3494 0.3494 0.9150 0.9150 1.8866 1.8866 2.3234 2.3234 2.5472 2.5472 2.9259 2.9259 3.1703 3.1703 3.2173 3.2173 3.6820 3.6820 3.9657 3.9657 4.0511 4.0511 4.1175 4.1175 4.2791 4.2791 4.8198 4.8198 4.9727 4.9727 5.6286 5.6286 5.9091 5.9091 5.9830 5.9830 6.4528 6.4528 6.5226 6.5226 6.8264 6.8264 6.9855 6.9855 7.3469 7.3469 7.5907 7.5907 8.9130 8.9130 9.8293 9.8293 k = 0.6260-0.0488-0.2789 ( 6729 PWs) bands (ev): -6.4251 -6.4251 -6.2107 -6.2107 -6.0864 -6.0864 -5.7593 -5.7593 -5.6159 -5.6159 -5.5784 -5.5784 -5.5328 -5.5328 -5.4413 -5.4413 -3.4753 -3.4753 -3.4495 -3.4495 -3.4227 -3.4227 -3.3994 -3.3994 -3.3623 -3.3623 -3.3527 -3.3527 0.3365 0.3365 0.9170 0.9170 1.8895 1.8895 2.3553 2.3553 2.5485 2.5485 2.9049 2.9049 3.1484 3.1484 3.1913 3.1913 3.6734 3.6734 3.9889 3.9889 4.0593 4.0593 4.1197 4.1197 4.2251 4.2251 4.7932 4.7932 4.9917 4.9917 5.6050 5.6050 5.9331 5.9331 5.9634 5.9634 6.4644 6.4644 6.5134 6.5134 6.8365 6.8365 7.0009 7.0009 7.3452 7.3452 7.6052 7.6052 8.9521 8.9521 9.8723 9.8723 k = 0.6344-0.0673-0.2789 ( 6733 PWs) bands (ev): -6.4160 -6.4160 -6.2059 -6.2059 -6.0973 -6.0973 -5.7617 -5.7617 -5.6156 -5.6156 -5.5769 -5.5769 -5.5318 -5.5318 -5.4405 -5.4405 -3.4753 -3.4753 -3.4481 -3.4481 -3.4220 -3.4220 -3.3992 -3.3992 -3.3609 -3.3609 -3.3532 -3.3532 0.3258 0.3258 0.9195 0.9195 1.8908 1.8908 2.3807 2.3807 2.5499 2.5499 2.8887 2.8887 3.1291 3.1291 3.1656 3.1656 3.6655 3.6655 4.0080 4.0080 4.0656 4.0656 4.1208 4.1208 4.1745 4.1745 4.7656 4.7656 5.0113 5.0113 5.5819 5.5819 5.9408 5.9408 5.9628 5.9628 6.4756 6.4756 6.5054 6.5054 6.8488 6.8488 7.0170 7.0170 7.3433 7.3433 7.6187 7.6187 8.9898 8.9898 9.9129 9.9129 k = 0.6428-0.0857-0.2789 ( 6735 PWs) bands (ev): -6.4065 -6.4065 -6.2011 -6.2011 -6.1090 -6.1090 -5.7642 -5.7642 -5.6152 -5.6152 -5.5756 -5.5756 -5.5305 -5.5305 -5.4395 -5.4395 -3.4753 -3.4753 -3.4468 -3.4468 -3.4212 -3.4212 -3.3988 -3.3988 -3.3602 -3.3602 -3.3531 -3.3531 0.3174 0.3174 0.9225 0.9225 1.8902 1.8902 2.3977 2.3977 2.5514 2.5514 2.8781 2.8781 3.1136 3.1136 3.1406 3.1406 3.6583 3.6583 4.0157 4.0157 4.0699 4.0699 4.1184 4.1184 4.1374 4.1374 4.7371 4.7371 5.0313 5.0313 5.5594 5.5594 5.9293 5.9293 5.9843 5.9843 6.4840 6.4840 6.5010 6.5010 6.8635 6.8635 7.0341 7.0341 7.3414 7.3414 7.6311 7.6311 9.0254 9.0254 9.9507 9.9507 k = 0.6512-0.1042-0.2789 ( 6729 PWs) bands (ev): -6.3967 -6.3967 -6.1964 -6.1964 -6.1215 -6.1215 -5.7667 -5.7667 -5.6148 -5.6148 -5.5744 -5.5744 -5.5288 -5.5288 -5.4383 -5.4383 -3.4752 -3.4752 -3.4454 -3.4454 -3.4206 -3.4206 -3.3984 -3.3984 -3.3602 -3.3602 -3.3522 -3.3522 0.3116 0.3116 0.9260 0.9260 1.8878 1.8878 2.4051 2.4051 2.5529 2.5529 2.8735 2.8735 3.1023 3.1023 3.1172 3.1172 3.6518 3.6518 3.9972 3.9972 4.0707 4.0707 4.1125 4.1125 4.1300 4.1300 4.7081 4.7081 5.0516 5.0516 5.5376 5.5376 5.9201 5.9201 6.0063 6.0063 6.4830 6.4830 6.5067 6.5067 6.8808 6.8808 7.0521 7.0521 7.3396 7.3396 7.6420 7.6420 9.0584 9.0584 9.9850 9.9850 k = 0.6596-0.1226-0.2789 ( 6733 PWs) bands (ev): -6.3866 -6.3866 -6.1919 -6.1919 -6.1345 -6.1345 -5.7692 -5.7692 -5.6145 -5.6145 -5.5734 -5.5734 -5.5267 -5.5267 -5.4370 -5.4370 -3.4751 -3.4751 -3.4441 -3.4441 -3.4200 -3.4200 -3.3979 -3.3979 -3.3608 -3.3608 -3.3508 -3.3508 0.3084 0.3084 0.9302 0.9302 1.8834 1.8834 2.4022 2.4022 2.5544 2.5544 2.8745 2.8745 3.0875 3.0875 3.1043 3.1043 3.6460 3.6460 3.9542 3.9542 4.0684 4.0684 4.1185 4.1185 4.1349 4.1349 4.6786 4.6786 5.0723 5.0723 5.5162 5.5162 5.9147 5.9147 6.0273 6.0273 6.4770 6.4770 6.5178 6.5178 6.9010 6.9010 7.0712 7.0712 7.3378 7.3378 7.6513 7.6513 9.0880 9.0880 10.0151 10.0151 k = 0.6680-0.1410-0.2789 ( 6735 PWs) bands (ev): -6.3763 -6.3763 -6.1882 -6.1882 -6.1475 -6.1475 -5.7717 -5.7717 -5.6142 -5.6142 -5.5724 -5.5724 -5.5242 -5.5242 -5.4357 -5.4357 -3.4749 -3.4749 -3.4428 -3.4428 -3.4195 -3.4195 -3.3972 -3.3972 -3.3615 -3.3615 -3.3491 -3.3491 0.3079 0.3079 0.9350 0.9350 1.8772 1.8772 2.3892 2.3892 2.5558 2.5558 2.8803 2.8803 3.0653 3.0653 3.1068 3.1068 3.6408 3.6408 3.9015 3.9015 4.0643 4.0643 4.1230 4.1230 4.1497 4.1497 4.6491 4.6491 5.0932 5.0932 5.4951 5.4951 5.9132 5.9132 6.0472 6.0472 6.4703 6.4703 6.5300 6.5300 6.9242 6.9242 7.0913 7.0913 7.3362 7.3362 7.6587 7.6587 9.1138 9.1138 10.0403 10.0403 k = 0.6764-0.1595-0.2789 ( 6727 PWs) bands (ev): -6.3660 -6.3660 -6.1871 -6.1871 -6.1585 -6.1585 -5.7742 -5.7742 -5.6140 -5.6140 -5.5713 -5.5713 -5.5213 -5.5213 -5.4342 -5.4342 -3.4747 -3.4747 -3.4416 -3.4416 -3.4191 -3.4191 -3.3965 -3.3965 -3.3624 -3.3624 -3.3474 -3.3474 0.3102 0.3102 0.9406 0.9406 1.8693 1.8693 2.3671 2.3671 2.5576 2.5576 2.8895 2.8895 3.0426 3.0426 3.1180 3.1180 3.6360 3.6360 3.8457 3.8457 4.0583 4.0583 4.1246 4.1246 4.1694 4.1694 4.6197 4.6197 5.1143 5.1143 5.4742 5.4742 5.9157 5.9157 6.0660 6.0660 6.4635 6.4635 6.5423 6.5423 6.9506 6.9506 7.1124 7.1124 7.3348 7.3348 7.6643 7.6643 9.1354 9.1354 10.0596 10.0596 k = 0.6848-0.1779-0.2789 ( 6723 PWs) bands (ev): -6.3559 -6.3559 -6.1925 -6.1925 -6.1633 -6.1633 -5.7767 -5.7767 -5.6138 -5.6138 -5.5701 -5.5701 -5.5182 -5.5182 -5.4328 -5.4328 -3.4744 -3.4744 -3.4404 -3.4404 -3.4188 -3.4188 -3.3957 -3.3957 -3.3633 -3.3633 -3.3457 -3.3457 0.3152 0.3152 0.9470 0.9470 1.8600 1.8600 2.3374 2.3374 2.5596 2.5596 2.9009 2.9009 3.0206 3.0206 3.1362 3.1362 3.6315 3.6315 3.7891 3.7891 4.0507 4.0507 4.1251 4.1251 4.1903 4.1903 4.5908 4.5908 5.1355 5.1355 5.4535 5.4535 5.9220 5.9220 6.0835 6.0835 6.4565 6.4565 6.5544 6.5544 6.9803 6.9803 7.1346 7.1346 7.3337 7.3337 7.6679 7.6679 9.1523 9.1523 10.0722 10.0722 k = 0.3152-0.6921-0.0000 ( 6723 PWs) bands (ev): -6.3559 -6.3559 -6.1925 -6.1925 -6.1633 -6.1633 -5.7767 -5.7767 -5.6138 -5.6138 -5.5701 -5.5701 -5.5182 -5.5182 -5.4328 -5.4328 -3.4744 -3.4744 -3.4404 -3.4404 -3.4188 -3.4188 -3.3957 -3.3957 -3.3633 -3.3633 -3.3457 -3.3457 0.3152 0.3152 0.9470 0.9470 1.8600 1.8600 2.3374 2.3374 2.5596 2.5596 2.9009 2.9009 3.0206 3.0206 3.1362 3.1362 3.6315 3.6315 3.7891 3.7891 4.0507 4.0507 4.1251 4.1251 4.1903 4.1903 4.5908 4.5908 5.1355 5.1355 5.4535 5.4535 5.9220 5.9220 6.0835 6.0835 6.4565 6.4565 6.5544 6.5544 6.9803 6.9803 7.1346 7.1346 7.3337 7.3337 7.6679 7.6679 9.1523 9.1523 10.0722 10.0722 k = 0.3069-0.6739-0.0000 ( 6723 PWs) bands (ev): -6.3463 -6.3463 -6.2041 -6.2041 -6.1620 -6.1620 -5.7791 -5.7791 -5.6138 -5.6138 -5.5687 -5.5687 -5.5148 -5.5148 -5.4313 -5.4313 -3.4741 -3.4741 -3.4392 -3.4392 -3.4186 -3.4186 -3.3948 -3.3948 -3.3641 -3.3641 -3.3441 -3.3441 0.3227 0.3227 0.9542 0.9542 1.8498 1.8498 2.3020 2.3020 2.5621 2.5621 2.9136 2.9136 2.9998 2.9998 3.1599 3.1599 3.6273 3.6273 3.7331 3.7331 4.0415 4.0415 4.1250 4.1250 4.2109 4.2109 4.5631 4.5631 5.1564 5.1564 5.4331 5.4331 5.9318 5.9318 6.0996 6.0996 6.4493 6.4493 6.5661 6.5661 7.0126 7.0126 7.1574 7.1574 7.3329 7.3329 7.6697 7.6697 9.1642 9.1642 10.0772 10.0772 k = 0.2986-0.6557 0.0000 ( 6723 PWs) bands (ev): -6.3379 -6.3379 -6.2176 -6.2176 -6.1582 -6.1582 -5.7814 -5.7814 -5.6138 -5.6138 -5.5672 -5.5672 -5.5113 -5.5113 -5.4299 -5.4299 -3.4738 -3.4738 -3.4381 -3.4381 -3.4185 -3.4185 -3.3940 -3.3940 -3.3650 -3.3650 -3.3425 -3.3425 0.3329 0.3329 0.9623 0.9623 1.8388 1.8388 2.2621 2.2621 2.5649 2.5649 2.9268 2.9268 2.9808 2.9808 3.1877 3.1877 3.6231 3.6231 3.6779 3.6779 4.0311 4.0311 4.1243 4.1243 4.2310 4.2310 4.5365 4.5365 5.1772 5.1772 5.4128 5.4128 5.9449 5.9449 6.1146 6.1146 6.4416 6.4416 6.5772 6.5772 7.0477 7.0477 7.1811 7.1811 7.3327 7.3327 7.6696 7.6696 9.1710 9.1710 10.0740 10.0740 k = 0.2903-0.6375-0.0000 ( 6731 PWs) bands (ev): -6.3317 -6.3317 -6.2301 -6.2301 -6.1536 -6.1536 -5.7838 -5.7838 -5.6139 -5.6139 -5.5654 -5.5654 -5.5076 -5.5076 -5.4286 -5.4286 -3.4735 -3.4735 -3.4370 -3.4370 -3.4185 -3.4185 -3.3931 -3.3931 -3.3657 -3.3657 -3.3411 -3.3411 0.3457 0.3457 0.9713 0.9713 1.8275 1.8275 2.2189 2.2189 2.5679 2.5679 2.9374 2.9374 2.9668 2.9668 3.2181 3.2181 3.6164 3.6164 3.6264 3.6264 4.0194 4.0194 4.1231 4.1231 4.2503 4.2503 4.5114 4.5114 5.1976 5.1976 5.3929 5.3929 5.9610 5.9610 6.1284 6.1284 6.4333 6.4333 6.5875 6.5875 7.0850 7.0850 7.2059 7.2059 7.3330 7.3330 7.6677 7.6677 9.1727 9.1727 10.0624 10.0624 k = 0.2821-0.6192-0.0000 ( 6731 PWs) bands (ev): -6.3296 -6.3296 -6.2394 -6.2394 -6.1486 -6.1486 -5.7860 -5.7860 -5.6142 -5.6142 -5.5634 -5.5634 -5.5038 -5.5038 -5.4274 -5.4274 -3.4732 -3.4732 -3.4359 -3.4359 -3.4186 -3.4186 -3.3922 -3.3922 -3.3664 -3.3664 -3.3398 -3.3398 0.3609 0.3609 0.9814 0.9814 1.8163 1.8163 2.1734 2.1734 2.5711 2.5711 2.9336 2.9336 2.9696 2.9696 3.2492 3.2492 3.5712 3.5712 3.6154 3.6154 4.0067 4.0067 4.1215 4.1215 4.2687 4.2687 4.4881 4.4881 5.2173 5.2173 5.3737 5.3737 5.9798 5.9798 6.1410 6.1410 6.4243 6.4243 6.5969 6.5969 7.1236 7.1236 7.2319 7.2319 7.3341 7.3341 7.6643 7.6643 9.1692 9.1692 10.0424 10.0424 k = 0.2738-0.6010 0.0000 ( 6743 PWs) bands (ev): -6.3338 -6.3338 -6.2430 -6.2430 -6.1435 -6.1435 -5.7883 -5.7883 -5.6145 -5.6145 -5.5612 -5.5612 -5.4999 -5.4999 -5.4262 -5.4262 -3.4729 -3.4729 -3.4349 -3.4349 -3.4187 -3.4187 -3.3914 -3.3914 -3.3671 -3.3671 -3.3386 -3.3386 0.3785 0.3785 0.9924 0.9924 1.8053 1.8053 2.1265 2.1265 2.5744 2.5744 2.9203 2.9203 2.9842 2.9842 3.2784 3.2784 3.5237 3.5237 3.6104 3.6104 3.9929 3.9929 4.1195 4.1195 4.2862 4.2862 4.4668 4.4668 5.2353 5.2353 5.3561 5.3561 6.0009 6.0009 6.1525 6.1525 6.4142 6.4142 6.6051 6.6051 7.1621 7.1621 7.2597 7.2597 7.3365 7.3365 7.6594 7.6594 9.1608 9.1608 10.0144 10.0144 k = 0.2655-0.5828-0.0000 ( 6755 PWs) bands (ev): -6.3444 -6.3444 -6.2406 -6.2406 -6.1383 -6.1383 -5.7905 -5.7905 -5.6148 -5.6148 -5.5589 -5.5589 -5.4961 -5.4961 -5.4251 -5.4251 -3.4726 -3.4726 -3.4339 -3.4339 -3.4189 -3.4189 -3.3906 -3.3906 -3.3678 -3.3678 -3.3375 -3.3375 0.3982 0.3982 1.0046 1.0046 1.7950 1.7950 2.0791 2.0791 2.5774 2.5774 2.9067 2.9067 3.0016 3.0016 3.3007 3.3007 3.4848 3.4848 3.6050 3.6050 3.9782 3.9782 4.1172 4.1172 4.3027 4.3027 4.4478 4.4478 5.2497 5.2497 5.3422 5.3422 6.0240 6.0240 6.1629 6.1629 6.4031 6.4031 6.6118 6.6118 7.1984 7.1984 7.2895 7.2895 7.3415 7.3415 7.6531 7.6531 9.1474 9.1474 9.9795 9.9795 k = 0.2572-0.5646-0.0000 ( 6749 PWs) bands (ev): -6.3599 -6.3599 -6.2337 -6.2337 -6.1330 -6.1330 -5.7926 -5.7926 -5.6152 -5.6152 -5.5564 -5.5564 -5.4922 -5.4922 -5.4241 -5.4241 -3.4724 -3.4724 -3.4330 -3.4330 -3.4192 -3.4192 -3.3898 -3.3898 -3.3684 -3.3684 -3.3366 -3.3366 0.4200 0.4200 1.0179 1.0179 1.7856 1.7856 2.0318 2.0318 2.5799 2.5799 2.8949 2.8949 3.0197 3.0197 3.3061 3.3061 3.4641 3.4641 3.5991 3.5991 3.9626 3.9626 4.1146 4.1146 4.3182 4.3182 4.4315 4.4315 5.2564 5.2564 5.3361 5.3361 6.0487 6.0487 6.1722 6.1722 6.3909 6.3909 6.6171 6.6171 7.2296 7.2296 7.3188 7.3188 7.3532 7.3532 7.6458 7.6458 9.1295 9.1295 9.9390 9.9390 k = 0.2489-0.5464 0.0000 ( 6745 PWs) bands (ev): -6.3785 -6.3785 -6.2241 -6.2241 -6.1278 -6.1278 -5.7947 -5.7947 -5.6156 -5.6156 -5.5540 -5.5540 -5.4883 -5.4883 -5.4231 -5.4231 -3.4721 -3.4721 -3.4321 -3.4321 -3.4195 -3.4195 -3.3891 -3.3891 -3.3690 -3.3690 -3.3359 -3.3359 0.4436 0.4436 1.0323 1.0323 1.7772 1.7772 1.9856 1.9856 2.5817 2.5817 2.8854 2.8854 3.0378 3.0378 3.2874 3.2874 3.4686 3.4686 3.5925 3.5925 3.9463 3.9463 4.1118 4.1118 4.3328 4.3328 4.4178 4.4178 5.2522 5.2522 5.3411 5.3411 6.0745 6.0745 6.1805 6.1805 6.3774 6.3774 6.6207 6.6207 7.2536 7.2536 7.3392 7.3392 7.3812 7.3812 7.6377 7.6377 9.1074 9.1074 9.8943 9.8943 k = 0.2406-0.5282-0.0000 ( 6743 PWs) bands (ev): -6.3988 -6.3988 -6.2128 -6.2128 -6.1225 -6.1225 -5.7967 -5.7967 -5.6161 -5.6161 -5.5515 -5.5515 -5.4845 -5.4845 -5.4222 -5.4222 -3.4719 -3.4719 -3.4313 -3.4313 -3.4199 -3.4199 -3.3885 -3.3885 -3.3697 -3.3697 -3.3352 -3.3352 0.4687 0.4687 1.0478 1.0478 1.7698 1.7698 1.9412 1.9412 2.5825 2.5825 2.8787 2.8787 3.0553 3.0553 3.2525 3.2525 3.4902 3.4902 3.5852 3.5852 3.9293 3.9293 4.1088 4.1088 4.3465 4.3465 4.4068 4.4068 5.2399 5.2399 5.3542 5.3542 6.1009 6.1009 6.1879 6.1879 6.3627 6.3627 6.6225 6.6225 7.2696 7.2696 7.3543 7.3543 7.4216 7.4216 7.6288 7.6288 9.0816 9.0816 9.8471 9.8471 k = 0.2323-0.5100 0.0000 ( 6747 PWs) bands (ev): -6.4201 -6.4201 -6.2006 -6.2006 -6.1172 -6.1172 -5.7986 -5.7986 -5.6165 -5.6165 -5.5492 -5.5492 -5.4809 -5.4809 -5.4213 -5.4213 -3.4718 -3.4718 -3.4305 -3.4305 -3.4202 -3.4202 -3.3879 -3.3879 -3.3704 -3.3704 -3.3347 -3.3347 0.4949 0.4949 1.0645 1.0645 1.7631 1.7631 1.8997 1.8997 2.5822 2.5822 2.8752 2.8752 3.0714 3.0714 3.2116 3.2116 3.5189 3.5189 3.5771 3.5771 3.9117 3.9117 4.1055 4.1055 4.3594 4.3594 4.3987 4.3987 5.2241 5.2241 5.3712 5.3712 6.1274 6.1274 6.1944 6.1944 6.3466 6.3466 6.6223 6.6223 7.2785 7.2785 7.3702 7.3702 7.4659 7.4659 7.6196 7.6196 9.0528 9.0528 9.7992 9.7992 k = 0.2240-0.4917-0.0000 ( 6743 PWs) bands (ev): -6.4422 -6.4422 -6.1879 -6.1879 -6.1120 -6.1120 -5.8005 -5.8005 -5.6169 -5.6169 -5.5469 -5.5469 -5.4775 -5.4775 -5.4204 -5.4204 -3.4716 -3.4716 -3.4298 -3.4298 -3.4206 -3.4206 -3.3873 -3.3873 -3.3711 -3.3711 -3.3344 -3.3344 0.5221 0.5221 1.0822 1.0822 1.7560 1.7560 1.8629 1.8629 2.5807 2.5807 2.8750 2.8750 3.0841 3.0841 3.1712 3.1712 3.5494 3.5494 3.5686 3.5686 3.8939 3.8939 4.1019 4.1019 4.3715 4.3715 4.3935 4.3935 5.2070 5.2070 5.3896 5.3896 6.1532 6.1532 6.2004 6.2004 6.3294 6.3294 6.6204 6.6204 7.2822 7.2822 7.3871 7.3871 7.5105 7.5105 7.6105 7.6105 9.0217 9.0217 9.7522 9.7522 k = 0.2157-0.4735 0.0000 ( 6743 PWs) bands (ev): -6.4646 -6.4646 -6.1747 -6.1747 -6.1067 -6.1067 -5.8024 -5.8024 -5.6173 -5.6173 -5.5449 -5.5449 -5.4743 -5.4743 -5.4194 -5.4194 -3.4716 -3.4716 -3.4293 -3.4293 -3.4209 -3.4209 -3.3868 -3.3868 -3.3719 -3.3719 -3.3342 -3.3342 0.5496 0.5496 1.1009 1.1009 1.7463 1.7463 1.8337 1.8337 2.5781 2.5781 2.8781 2.8781 3.0848 3.0848 3.1413 3.1413 3.5583 3.5583 3.5810 3.5810 3.8758 3.8758 4.0976 4.0976 4.3821 4.3821 4.3922 4.3922 5.1898 5.1898 5.4084 5.4084 6.1769 6.1769 6.2068 6.2068 6.3110 6.3110 6.6166 6.6166 7.2820 7.2820 7.4037 7.4037 7.5527 7.5527 7.6023 7.6023 8.9893 8.9893 9.7079 9.7079 k = 0.2074-0.4553-0.0000 ( 6743 PWs) bands (ev): -6.4871 -6.4871 -6.1614 -6.1614 -6.1014 -6.1014 -5.8041 -5.8041 -5.6177 -5.6177 -5.5431 -5.5431 -5.4714 -5.4714 -5.4182 -5.4182 -3.4716 -3.4716 -3.4290 -3.4290 -3.4212 -3.4212 -3.3865 -3.3865 -3.3727 -3.3727 -3.3341 -3.3341 0.5770 0.5770 1.1206 1.1206 1.7312 1.7312 1.8159 1.8159 2.5746 2.5746 2.8843 2.8843 3.0593 3.0593 3.1367 3.1367 3.5485 3.5485 3.6102 3.6102 3.8579 3.8579 4.0926 4.0926 4.3873 4.3873 4.3987 4.3987 5.1728 5.1728 5.4270 5.4270 6.1948 6.1948 6.2164 6.2164 6.2917 6.2917 6.6113 6.6113 7.2789 7.2789 7.4188 7.4188 7.5826 7.5826 7.6036 7.6036 8.9565 8.9565 9.6678 9.6678 k = 0.1991-0.4371-0.0000 ( 6739 PWs) bands (ev): -6.5097 -6.5097 -6.1480 -6.1480 -6.0960 -6.0960 -5.8058 -5.8058 -5.6180 -5.6180 -5.5416 -5.5416 -5.4689 -5.4689 -5.4169 -5.4169 -3.4716 -3.4716 -3.4288 -3.4288 -3.4214 -3.4214 -3.3862 -3.3862 -3.3735 -3.3735 -3.3341 -3.3341 0.6038 0.6038 1.1412 1.1412 1.7109 1.7109 1.8097 1.8097 2.5706 2.5706 2.8933 2.8933 3.0212 3.0212 3.1442 3.1442 3.5380 3.5380 3.6376 3.6376 3.8402 3.8402 4.0866 4.0866 4.3902 4.3902 4.4101 4.4101 5.1565 5.1565 5.4450 5.4450 6.2032 6.2032 6.2316 6.2316 6.2725 6.2725 6.6047 6.6047 7.2735 7.2735 7.4314 7.4314 7.5812 7.5812 7.6324 7.6324 8.9247 8.9247 9.6334 9.6334 k = 0.1908-0.4189-0.0000 ( 6741 PWs) bands (ev): -6.5321 -6.5321 -6.1346 -6.1346 -6.0906 -6.0906 -5.8074 -5.8074 -5.6183 -5.6183 -5.5404 -5.5404 -5.4669 -5.4669 -5.4152 -5.4152 -3.4717 -3.4717 -3.4290 -3.4290 -3.4214 -3.4214 -3.3861 -3.3861 -3.3742 -3.3742 -3.3341 -3.3341 0.6292 0.6292 1.1625 1.1625 1.6897 1.6897 1.8118 1.8118 2.5667 2.5667 2.9045 2.9045 2.9814 2.9814 3.1530 3.1530 3.5272 3.5272 3.6622 3.6622 3.8231 3.8231 4.0793 4.0793 4.3948 4.3948 4.4226 4.4226 5.1408 5.1408 5.4622 5.4622 6.2064 6.2064 6.2392 6.2392 6.2615 6.2615 6.5972 6.5972 7.2658 7.2658 7.4407 7.4407 7.5756 7.5756 7.6605 7.6605 8.8951 8.8951 9.6059 9.6059 k = 0.1825-0.4007-0.0000 ( 6739 PWs) bands (ev): -6.5543 -6.5543 -6.1215 -6.1215 -6.0849 -6.0849 -5.8089 -5.8089 -5.6186 -5.6186 -5.5395 -5.5395 -5.4655 -5.4655 -5.4133 -5.4133 -3.4718 -3.4718 -3.4293 -3.4293 -3.4214 -3.4214 -3.3862 -3.3862 -3.3748 -3.3748 -3.3343 -3.3343 0.6526 0.6526 1.1845 1.1845 1.6708 1.6708 1.8195 1.8195 2.5632 2.5632 2.9166 2.9166 2.9433 2.9433 3.1608 3.1608 3.5161 3.5161 3.6834 3.6834 3.8069 3.8069 4.0706 4.0706 4.4011 4.4011 4.4362 4.4362 5.1261 5.1261 5.4782 5.4782 6.2055 6.2055 6.2254 6.2254 6.2712 6.2712 6.5892 6.5892 7.2559 7.2559 7.4461 7.4461 7.5709 7.5709 7.6816 7.6816 8.8692 8.8692 9.5864 9.5864 k = 0.1742-0.3825 0.0000 ( 6741 PWs) bands (ev): -6.5761 -6.5761 -6.1089 -6.1089 -6.0789 -6.0789 -5.8102 -5.8102 -5.6188 -5.6188 -5.5390 -5.5390 -5.4646 -5.4646 -5.4110 -5.4110 -3.4720 -3.4720 -3.4299 -3.4299 -3.4213 -3.4213 -3.3866 -3.3866 -3.3753 -3.3753 -3.3345 -3.3345 0.6734 0.6734 1.2068 1.2068 1.6564 1.6564 1.8313 1.8313 2.5606 2.5606 2.9016 2.9016 2.9352 2.9352 3.1669 3.1669 3.5050 3.5050 3.7007 3.7007 3.7916 3.7916 4.0601 4.0601 4.4093 4.4093 4.4511 4.4511 5.1122 5.1122 5.4928 5.4928 6.1928 6.1928 6.2166 6.2166 6.2824 6.2824 6.5812 6.5812 7.2441 7.2441 7.4477 7.4477 7.5675 7.5675 7.6943 7.6943 8.8482 8.8482 9.5757 9.5757 k = 0.1659-0.3643 0.0000 ( 6737 PWs) bands (ev): -6.5975 -6.5975 -6.0972 -6.0972 -6.0720 -6.0720 -5.8115 -5.8115 -5.6190 -5.6190 -5.5388 -5.5388 -5.4643 -5.4643 -5.4084 -5.4084 -3.4722 -3.4722 -3.4307 -3.4307 -3.4212 -3.4212 -3.3872 -3.3872 -3.3755 -3.3755 -3.3348 -3.3348 0.6910 0.6910 1.2295 1.2295 1.6476 1.6476 1.8468 1.8468 2.5593 2.5593 2.8662 2.8662 2.9502 2.9502 3.1708 3.1708 3.4939 3.4939 3.7137 3.7137 3.7777 3.7777 4.0476 4.0476 4.4191 4.4191 4.4675 4.4675 5.0992 5.0992 5.5059 5.5059 6.1709 6.1709 6.2151 6.2151 6.2900 6.2900 6.5734 6.5734 7.2304 7.2304 7.4457 7.4457 7.5649 7.5649 7.6980 7.6980 8.8331 8.8331 9.5742 9.5742 k = 0.1576-0.3460-0.0000 ( 6731 PWs) bands (ev): -6.6184 -6.6184 -6.0871 -6.0871 -6.0639 -6.0639 -5.8126 -5.8126 -5.6192 -5.6192 -5.5389 -5.5389 -5.4646 -5.4646 -5.4056 -5.4056 -3.4725 -3.4725 -3.4317 -3.4317 -3.4212 -3.4212 -3.3881 -3.3881 -3.3754 -3.3754 -3.3351 -3.3351 0.7047 0.7047 1.2523 1.2523 1.6450 1.6450 1.8655 1.8655 2.5599 2.5599 2.8320 2.8320 2.9666 2.9666 3.1724 3.1724 3.4830 3.4830 3.7219 3.7219 3.7653 3.7653 4.0330 4.0330 4.4302 4.4302 4.4855 4.4855 5.0872 5.0872 5.5172 5.5172 6.1467 6.1467 6.2144 6.2144 6.2935 6.2935 6.5661 6.5661 7.2150 7.2150 7.4409 7.4409 7.5624 7.5624 7.6924 7.6924 8.8247 8.8247 9.5820 9.5820 k = 0.1493-0.3278 0.0000 ( 6741 PWs) bands (ev): -6.6386 -6.6386 -6.0789 -6.0789 -6.0541 -6.0541 -5.8136 -5.8136 -5.6193 -5.6193 -5.5393 -5.5393 -5.4655 -5.4655 -5.4024 -5.4024 -3.4728 -3.4728 -3.4328 -3.4328 -3.4213 -3.4213 -3.3892 -3.3892 -3.3752 -3.3752 -3.3354 -3.3354 0.7145 0.7145 1.2749 1.2749 1.6489 1.6489 1.8873 1.8873 2.5626 2.5626 2.8000 2.8000 2.9833 2.9833 3.1716 3.1716 3.4723 3.4723 3.7253 3.7253 3.7547 3.7547 4.0160 4.0160 4.4425 4.4425 4.5052 4.5052 5.0761 5.0761 5.5265 5.5265 6.1218 6.1218 6.2133 6.2133 6.2928 6.2928 6.5591 6.5591 7.1981 7.1981 7.4340 7.4340 7.5592 7.5592 7.6784 7.6784 8.8231 8.8231 9.5988 9.5988 k = 0.1410-0.3096-0.0000 ( 6733 PWs) bands (ev): -6.6581 -6.6581 -6.0723 -6.0723 -6.0431 -6.0431 -5.8145 -5.8145 -5.6195 -5.6195 -5.5399 -5.5399 -5.4669 -5.4669 -5.3992 -5.3992 -3.4730 -3.4730 -3.4340 -3.4340 -3.4216 -3.4216 -3.3904 -3.3904 -3.3748 -3.3748 -3.3357 -3.3357 0.7201 0.7201 1.2971 1.2971 1.6591 1.6591 1.9120 1.9120 2.5678 2.5678 2.7704 2.7704 2.9997 2.9997 3.1682 3.1682 3.4619 3.4619 3.7236 3.7236 3.7461 3.7461 3.9966 3.9966 4.4558 4.4558 4.5264 4.5264 5.0659 5.0659 5.5338 5.5338 6.0965 6.0965 6.2115 6.2115 6.2886 6.2886 6.5521 6.5521 7.1800 7.1800 7.4258 7.4258 7.5547 7.5547 7.6573 7.6573 8.8282 8.8282 9.6241 9.6241 k = 0.1327-0.2914-0.0000 ( 6745 PWs) bands (ev): -6.6769 -6.6769 -6.0668 -6.0668 -6.0313 -6.0313 -5.8152 -5.8152 -5.6195 -5.6195 -5.5408 -5.5408 -5.4687 -5.4687 -5.3958 -5.3958 -3.4733 -3.4733 -3.4353 -3.4353 -3.4222 -3.4222 -3.3915 -3.3915 -3.3744 -3.3744 -3.3360 -3.3360 0.7218 0.7218 1.3188 1.3188 1.6752 1.6752 1.9396 1.9396 2.5757 2.5757 2.7434 2.7434 3.0155 3.0155 3.1624 3.1624 3.4519 3.4519 3.7171 3.7171 3.7395 3.7395 3.9746 3.9746 4.4696 4.4696 4.5489 4.5489 5.0567 5.0567 5.5390 5.5390 6.0710 6.0710 6.2084 6.2084 6.2820 6.2820 6.5444 6.5444 7.1610 7.1610 7.4167 7.4167 7.5482 7.5482 7.6309 7.6309 8.8394 8.8394 9.6568 9.6568 k = 0.1244-0.2732-0.0000 ( 6735 PWs) bands (ev): -6.6949 -6.6949 -6.0620 -6.0620 -6.0193 -6.0193 -5.8158 -5.8158 -5.6196 -5.6196 -5.5417 -5.5417 -5.4711 -5.4711 -5.3923 -5.3923 -3.4736 -3.4736 -3.4366 -3.4366 -3.4230 -3.4230 -3.3926 -3.3926 -3.3739 -3.3739 -3.3363 -3.3363 0.7201 0.7201 1.3396 1.3396 1.6965 1.6965 1.9700 1.9700 2.5866 2.5866 2.7195 2.7195 3.0303 3.0303 3.1539 3.1539 3.4424 3.4424 3.7058 3.7058 3.7352 3.7352 3.9500 3.9500 4.4840 4.4840 4.5724 4.5724 5.0485 5.0485 5.5422 5.5422 6.0455 6.0455 6.2038 6.2038 6.2743 6.2743 6.5357 6.5357 7.1414 7.1414 7.4070 7.4070 7.5384 7.5384 7.6026 7.6026 8.8559 8.8559 9.6958 9.6958 k = 0.1161-0.2550 0.0000 ( 6731 PWs) bands (ev): -6.7119 -6.7119 -6.0577 -6.0577 -6.0074 -6.0074 -5.8163 -5.8163 -5.6197 -5.6197 -5.5428 -5.5428 -5.4738 -5.4738 -5.3889 -5.3889 -3.4738 -3.4738 -3.4380 -3.4380 -3.4240 -3.4240 -3.3935 -3.3935 -3.3733 -3.3733 -3.3365 -3.3365 0.7154 0.7154 1.3594 1.3594 1.7220 1.7220 2.0031 2.0031 2.6003 2.6003 2.6990 2.6990 3.0438 3.0438 3.1431 3.1431 3.4332 3.4332 3.6901 3.6901 3.7332 3.7332 3.9227 3.9227 4.4986 4.4986 4.5963 4.5963 5.0414 5.0414 5.5436 5.5436 6.0200 6.0200 6.1970 6.1970 6.2669 6.2669 6.5254 6.5254 7.1215 7.1215 7.3969 7.3969 7.5219 7.5219 7.5777 7.5777 8.8769 8.8769 9.7397 9.7397 k = 0.1078-0.2368-0.0000 ( 6735 PWs) bands (ev): -6.7280 -6.7280 -6.0538 -6.0538 -5.9957 -5.9957 -5.8167 -5.8167 -5.6197 -5.6197 -5.5439 -5.5439 -5.4769 -5.4769 -5.3856 -5.3856 -3.4741 -3.4741 -3.4394 -3.4394 -3.4254 -3.4254 -3.3942 -3.3942 -3.3728 -3.3728 -3.3367 -3.3367 0.7084 0.7084 1.3780 1.3780 1.7507 1.7507 2.0388 2.0388 2.6163 2.6163 2.6830 2.6830 3.0556 3.0556 3.1299 3.1299 3.4246 3.4246 3.6701 3.6701 3.7333 3.7333 3.8930 3.8930 4.5133 4.5133 4.6202 4.6202 5.0355 5.0355 5.5435 5.5435 5.9946 5.9946 6.1876 6.1876 6.2608 6.2608 6.5134 6.5134 7.1015 7.1015 7.3863 7.3863 7.4958 7.4958 7.5608 7.5608 8.9015 8.9015 9.7871 9.7871 k = 0.0995-0.2186-0.0000 ( 6731 PWs) bands (ev): -6.7432 -6.7432 -6.0502 -6.0502 -5.9844 -5.9844 -5.8170 -5.8170 -5.6197 -5.6197 -5.5449 -5.5449 -5.4803 -5.4803 -5.3823 -5.3823 -3.4742 -3.4742 -3.4408 -3.4408 -3.4269 -3.4269 -3.3947 -3.3947 -3.3724 -3.3724 -3.3368 -3.3368 0.6997 0.6997 1.3953 1.3953 1.7813 1.7813 2.0768 2.0768 2.6318 2.6318 2.6743 2.6743 3.0653 3.0653 3.1148 3.1148 3.4163 3.4163 3.6462 3.6462 3.7353 3.7353 3.8611 3.8611 4.5278 4.5278 4.6433 4.6433 5.0310 5.0310 5.5422 5.5422 5.9692 5.9692 6.1761 6.1761 6.2564 6.2564 6.4997 6.4997 7.0817 7.0817 7.3752 7.3752 7.4634 7.4634 7.5507 7.5507 8.9288 8.9288 9.8363 9.8363 k = 0.0913-0.2003 0.0000 ( 6725 PWs) bands (ev): -6.7573 -6.7573 -6.0470 -6.0470 -5.9735 -5.9735 -5.8172 -5.8172 -5.6198 -5.6198 -5.5459 -5.5459 -5.4840 -5.4840 -5.3792 -5.3792 -3.4744 -3.4744 -3.4422 -3.4422 -3.4287 -3.4287 -3.3951 -3.3951 -3.3720 -3.3720 -3.3369 -3.3369 0.6898 0.6898 1.4111 1.4111 1.8128 1.8128 2.1169 2.1169 2.6388 2.6388 2.6815 2.6815 3.0714 3.0714 3.0994 3.0994 3.4084 3.4084 3.6189 3.6189 3.7382 3.7382 3.8280 3.8280 4.5419 4.5419 4.6652 4.6652 5.0280 5.0280 5.5403 5.5403 5.9437 5.9437 6.1630 6.1630 6.2536 6.2536 6.4844 6.4844 7.0621 7.0621 7.3633 7.3633 7.4299 7.4299 7.5441 7.5441 8.9578 8.9578 9.8857 9.8857 k = 0.0830-0.1821 0.0000 ( 6723 PWs) bands (ev): -6.7703 -6.7703 -6.0440 -6.0440 -5.9632 -5.9632 -5.8174 -5.8174 -5.6198 -5.6198 -5.5466 -5.5466 -5.4879 -5.4879 -5.3763 -5.3763 -3.4744 -3.4744 -3.4436 -3.4436 -3.4306 -3.4306 -3.3953 -3.3953 -3.3716 -3.3716 -3.3370 -3.3370 0.6794 0.6794 1.4253 1.4253 1.8441 1.8441 2.1589 2.1589 2.6376 2.6376 2.7040 2.7040 3.0664 3.0664 3.0915 3.0915 3.4007 3.4007 3.5886 3.5886 3.7386 3.7386 3.7969 3.7969 4.5555 4.5555 4.6852 4.6852 5.0266 5.0266 5.5383 5.5383 5.9183 5.9183 6.1491 6.1491 6.2520 6.2520 6.4680 6.4680 7.0431 7.0431 7.3498 7.3498 7.3989 7.3989 7.5394 7.5394 8.9878 8.9878 9.9340 9.9340 k = 0.0747-0.1639-0.0000 ( 6719 PWs) bands (ev): -6.7821 -6.7821 -6.0413 -6.0413 -5.9534 -5.9534 -5.8175 -5.8175 -5.6199 -5.6199 -5.5470 -5.5470 -5.4920 -5.4920 -5.3736 -5.3736 -3.4744 -3.4744 -3.4450 -3.4450 -3.4326 -3.4326 -3.3953 -3.3953 -3.3713 -3.3713 -3.3370 -3.3370 0.6689 0.6689 1.4380 1.4380 1.8742 1.8742 2.2024 2.2024 2.6364 2.6364 2.7335 2.7335 3.0486 3.0486 3.0933 3.0933 3.3934 3.3934 3.5557 3.5557 3.7252 3.7252 3.7792 3.7792 4.5685 4.5685 4.7028 4.7028 5.0269 5.0269 5.5367 5.5367 5.8927 5.8927 6.1351 6.1351 6.2512 6.2512 6.4509 6.4509 7.0247 7.0247 7.3330 7.3330 7.3733 7.3733 7.5362 7.5362 9.0178 9.0178 9.9798 9.9798 k = 0.0664-0.1457-0.0000 ( 6721 PWs) bands (ev): -6.7929 -6.7929 -6.0389 -6.0389 -5.9443 -5.9443 -5.8177 -5.8177 -5.6200 -5.6200 -5.5472 -5.5472 -5.4964 -5.4964 -5.3711 -5.3711 -3.4744 -3.4744 -3.4463 -3.4463 -3.4345 -3.4345 -3.3953 -3.3953 -3.3710 -3.3710 -3.3369 -3.3369 0.6586 0.6586 1.4491 1.4491 1.9022 1.9022 2.2469 2.2469 2.6378 2.6378 2.7670 2.7670 3.0268 3.0268 3.0965 3.0965 3.3861 3.3861 3.5209 3.5209 3.6933 3.6933 3.7796 3.7796 4.5806 4.5806 4.7178 4.7178 5.0287 5.0287 5.5362 5.5362 5.8671 5.8671 6.1216 6.1216 6.2510 6.2510 6.4337 6.4337 7.0070 7.0070 7.3123 7.3123 7.3550 7.3550 7.5340 7.5340 9.0472 9.0472 10.0227 10.0227 k = 0.0581-0.1275 0.0000 ( 6721 PWs) bands (ev): -6.8024 -6.8024 -6.0368 -6.0368 -5.9360 -5.9360 -5.8178 -5.8178 -5.6201 -5.6201 -5.5469 -5.5469 -5.5008 -5.5008 -5.3689 -5.3689 -3.4743 -3.4743 -3.4475 -3.4475 -3.4364 -3.4364 -3.3952 -3.3952 -3.3708 -3.3708 -3.3368 -3.3368 0.6489 0.6489 1.4586 1.4586 1.9275 1.9275 2.2920 2.2920 2.6419 2.6419 2.8031 2.8031 3.0041 3.0041 3.0989 3.0989 3.3788 3.3788 3.4848 3.4848 3.6546 3.6546 3.7866 3.7866 4.5917 4.5917 4.7300 4.7300 5.0318 5.0318 5.5372 5.5372 5.8415 5.8415 6.1089 6.1089 6.2510 6.2510 6.4171 6.4171 6.9903 6.9903 7.2905 7.2905 7.3419 7.3419 7.5328 7.5328 9.0751 9.0751 10.0618 10.0618 k = 0.0498-0.1093-0.0000 ( 6723 PWs) bands (ev): -6.8107 -6.8107 -6.0350 -6.0350 -5.9286 -5.9286 -5.8180 -5.8180 -5.6202 -5.6202 -5.5463 -5.5463 -5.5053 -5.5053 -5.3669 -5.3669 -3.4741 -3.4741 -3.4487 -3.4487 -3.4382 -3.4382 -3.3950 -3.3950 -3.3707 -3.3707 -3.3368 -3.3368 0.6400 0.6400 1.4667 1.4667 1.9495 1.9495 2.3370 2.3370 2.6477 2.6477 2.8408 2.8408 2.9823 2.9823 3.1003 3.1003 3.3710 3.3710 3.4484 3.4484 3.6145 3.6145 3.7953 3.7953 4.6016 4.6016 4.7395 4.7395 5.0358 5.0358 5.5401 5.5401 5.8162 5.8162 6.0974 6.0974 6.2512 6.2512 6.4017 6.4017 6.9748 6.9748 7.2701 7.2701 7.3317 7.3317 7.5321 7.5321 9.1009 9.1009 10.0965 10.0965 k = 0.0415-0.0911 0.0000 ( 6729 PWs) bands (ev): -6.8178 -6.8178 -6.0335 -6.0335 -5.9220 -5.9220 -5.8182 -5.8182 -5.6204 -5.6204 -5.5452 -5.5452 -5.5097 -5.5097 -5.3652 -5.3652 -3.4739 -3.4739 -3.4499 -3.4499 -3.4397 -3.4397 -3.3949 -3.3949 -3.3706 -3.3706 -3.3367 -3.3367 0.6321 0.6321 1.4733 1.4733 1.9681 1.9681 2.3813 2.3813 2.6536 2.6536 2.8782 2.8782 2.9639 2.9639 3.1005 3.1005 3.3624 3.3624 3.4129 3.4129 3.5753 3.5753 3.8041 3.8041 4.6104 4.6104 4.7465 4.7465 5.0402 5.0402 5.5452 5.5452 5.7915 5.7915 6.0873 6.0873 6.2513 6.2513 6.3878 6.3878 6.9609 6.9609 7.2526 7.2526 7.3234 7.3234 7.5319 7.5319 9.1239 9.1239 10.1261 10.1261 k = 0.0332-0.0729-0.0000 ( 6737 PWs) bands (ev): -6.8236 -6.8236 -6.0322 -6.0322 -5.9165 -5.9165 -5.8184 -5.8184 -5.6205 -5.6205 -5.5436 -5.5436 -5.5141 -5.5141 -5.3638 -5.3638 -3.4737 -3.4737 -3.4508 -3.4508 -3.4410 -3.4410 -3.3947 -3.3947 -3.3705 -3.3705 -3.3366 -3.3366 0.6255 0.6255 1.4787 1.4787 1.9831 1.9831 2.4243 2.4243 2.6570 2.6570 2.9090 2.9090 2.9559 2.9559 3.0993 3.0993 3.3516 3.3516 3.3804 3.3804 3.5392 3.5392 3.8122 3.8122 4.6177 4.6177 4.7516 4.7516 5.0446 5.0446 5.5522 5.5522 5.7680 5.7680 6.0787 6.0787 6.2514 6.2514 6.3761 6.3761 6.9488 6.9488 7.2383 7.2383 7.3166 7.3166 7.5319 7.5319 9.1436 9.1436 10.1501 10.1501 k = 0.0249-0.0546-0.0000 ( 6739 PWs) bands (ev): -6.8282 -6.8282 -6.0312 -6.0312 -5.9121 -5.9121 -5.8186 -5.8186 -5.6207 -5.6207 -5.5417 -5.5417 -5.5183 -5.5183 -5.3627 -5.3627 -3.4735 -3.4735 -3.4517 -3.4517 -3.4420 -3.4420 -3.3946 -3.3946 -3.3704 -3.3704 -3.3365 -3.3365 0.6203 0.6203 1.4827 1.4827 1.9945 1.9945 2.4649 2.4649 2.6554 2.6554 2.9175 2.9175 2.9741 2.9741 3.0963 3.0963 3.3360 3.3360 3.3552 3.3552 3.5086 3.5086 3.8191 3.8191 4.6235 4.6235 4.7549 4.7549 5.0484 5.0484 5.5605 5.5605 5.7466 5.7466 6.0718 6.0718 6.2513 6.2513 6.3668 6.3668 6.9389 6.9389 7.2273 7.2273 7.3114 7.3114 7.5321 7.5321 9.1594 9.1594 10.1685 10.1685 k = 0.0166-0.0364-0.0000 ( 6735 PWs) bands (ev): -6.8314 -6.8314 -6.0305 -6.0305 -5.9089 -5.9089 -5.8188 -5.8188 -5.6208 -5.6208 -5.5395 -5.5395 -5.5221 -5.5221 -5.3620 -5.3620 -3.4733 -3.4733 -3.4523 -3.4523 -3.4428 -3.4428 -3.3945 -3.3945 -3.3704 -3.3704 -3.3364 -3.3364 0.6164 0.6164 1.4855 1.4855 2.0025 2.0025 2.5015 2.5015 2.6476 2.6476 2.9155 2.9155 3.0050 3.0050 3.0909 3.0909 3.3164 3.3164 3.3393 3.3393 3.4858 3.4858 3.8243 3.8243 4.6278 4.6278 4.7571 4.7571 5.0514 5.0514 5.5691 5.5691 5.7286 5.7286 6.0668 6.0668 6.2512 6.2512 6.3601 6.3601 6.9317 6.9317 7.2196 7.2196 7.3076 7.3076 7.5323 7.5323 9.1710 9.1710 10.1814 10.1814 k = 0.0083-0.0182 0.0000 ( 6735 PWs) bands (ev): -6.8334 -6.8334 -6.0301 -6.0301 -5.9069 -5.9069 -5.8189 -5.8189 -5.6208 -5.6208 -5.5375 -5.5375 -5.5252 -5.5252 -5.3615 -5.3615 -3.4732 -3.4732 -3.4527 -3.4527 -3.4432 -3.4432 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6141 0.6141 1.4872 1.4872 2.0072 2.0072 2.5305 2.5305 2.6360 2.6360 2.9143 2.9143 3.0325 3.0325 3.0827 3.0827 3.3013 3.3013 3.3290 3.3290 3.4720 3.4720 3.8275 3.8275 4.6304 4.6304 4.7582 4.7582 5.0532 5.0532 5.5758 5.5758 5.7161 5.7161 6.0638 6.0638 6.2511 6.2511 6.3561 6.3561 6.9272 6.9272 7.2150 7.2150 7.3053 7.3053 7.5325 7.5325 9.1780 9.1780 10.1889 10.1889 k = 0.0000 0.0000 0.0000 ( 6731 PWs) bands (ev): -6.8340 -6.8340 -6.0300 -6.0300 -5.9062 -5.9062 -5.8189 -5.8189 -5.6208 -5.6208 -5.5365 -5.5365 -5.5265 -5.5265 -5.3613 -5.3613 -3.4732 -3.4732 -3.4529 -3.4529 -3.4434 -3.4434 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6133 0.6133 1.4878 1.4878 2.0088 2.0088 2.5429 2.5429 2.6293 2.6293 2.9142 2.9142 3.0463 3.0463 3.0761 3.0761 3.2958 3.2958 3.3252 3.3252 3.4675 3.4675 3.8286 3.8286 4.6312 4.6312 4.7586 4.7586 5.0538 5.0538 5.5785 5.5785 5.7115 5.7115 6.0628 6.0628 6.2510 6.2510 6.3547 6.3547 6.9257 6.9257 7.2135 7.2135 7.3046 7.3046 7.5326 7.5326 9.1804 9.1804 10.1915 10.1915 k = 0.0000 0.0000 0.0000 ( 6731 PWs) bands (ev): -6.8340 -6.8340 -6.0300 -6.0300 -5.9062 -5.9062 -5.8189 -5.8189 -5.6208 -5.6208 -5.5365 -5.5365 -5.5265 -5.5265 -5.3613 -5.3613 -3.4732 -3.4732 -3.4529 -3.4529 -3.4434 -3.4434 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6133 0.6133 1.4878 1.4878 2.0088 2.0088 2.5429 2.5429 2.6293 2.6293 2.9142 2.9142 3.0463 3.0463 3.0761 3.0761 3.2958 3.2958 3.3252 3.3252 3.4675 3.4675 3.8286 3.8286 4.6312 4.6312 4.7586 4.7586 5.0538 5.0538 5.5785 5.5785 5.7115 5.7115 6.0628 6.0628 6.2510 6.2510 6.3547 6.3547 6.9257 6.9257 7.2135 7.2135 7.3046 7.3046 7.5326 7.5326 9.1804 9.1804 10.1915 10.1915 k = 0.0147-0.0128-0.0041 ( 6734 PWs) bands (ev): -6.8334 -6.8334 -6.0301 -6.0301 -5.9068 -5.9068 -5.8189 -5.8189 -5.6208 -5.6208 -5.5374 -5.5374 -5.5254 -5.5254 -5.3615 -5.3615 -3.4732 -3.4732 -3.4527 -3.4527 -3.4433 -3.4433 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6139 0.6139 1.4868 1.4868 2.0077 2.0077 2.5322 2.5322 2.6343 2.6343 2.9146 2.9146 3.0356 3.0356 3.0823 3.0823 3.3002 3.3002 3.3284 3.3284 3.4717 3.4717 3.8277 3.8277 4.6301 4.6301 4.7584 4.7584 5.0536 5.0536 5.5764 5.5764 5.7151 5.7151 6.0637 6.0637 6.2513 6.2513 6.3558 6.3558 6.9269 6.9269 7.2146 7.2146 7.3049 7.3049 7.5325 7.5325 9.1782 9.1782 10.1889 10.1889 k = 0.0294-0.0256-0.0082 ( 6738 PWs) bands (ev): -6.8315 -6.8315 -6.0306 -6.0306 -5.9085 -5.9085 -5.8188 -5.8188 -5.6208 -5.6208 -5.5393 -5.5393 -5.5228 -5.5228 -5.3620 -5.3620 -3.4733 -3.4733 -3.4524 -3.4524 -3.4429 -3.4429 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6156 0.6156 1.4837 1.4837 2.0045 2.0045 2.5064 2.5064 2.6431 2.6431 2.9153 2.9153 3.0151 3.0151 3.0912 3.0912 3.3122 3.3122 3.3375 3.3375 3.4845 3.4845 3.8253 3.8253 4.6268 4.6268 4.7578 4.7578 5.0529 5.0529 5.5709 5.5709 5.7249 5.7249 6.0664 6.0664 6.2522 6.2522 6.3592 6.3592 6.9307 6.9307 7.2178 7.2178 7.3059 7.3059 7.5324 7.5324 9.1716 9.1716 10.1814 10.1814 k = 0.0441-0.0384-0.0123 ( 6736 PWs) bands (ev): -6.8284 -6.8284 -6.0314 -6.0314 -5.9113 -5.9113 -5.8185 -5.8185 -5.6206 -5.6206 -5.5413 -5.5413 -5.5195 -5.5195 -5.3628 -5.3628 -3.4735 -3.4735 -3.4519 -3.4519 -3.4423 -3.4423 -3.3945 -3.3945 -3.3705 -3.3705 -3.3365 -3.3365 0.6184 0.6184 1.4785 1.4785 1.9990 1.9990 2.4735 2.4735 2.6492 2.6492 2.9131 2.9131 2.9960 2.9960 3.0983 3.0983 3.3277 3.3277 3.3531 3.3531 3.5053 3.5053 3.8214 3.8214 4.6213 4.6213 4.7567 4.7567 5.0518 5.0518 5.5637 5.5637 5.7393 5.7393 6.0708 6.0708 6.2533 6.2533 6.3649 6.3649 6.9368 6.9368 7.2231 7.2231 7.3079 7.3079 7.5322 7.5322 9.1606 9.1606 10.1687 10.1687 k = 0.0588-0.0512-0.0164 ( 6734 PWs) bands (ev): -6.8240 -6.8240 -6.0325 -6.0325 -5.9151 -5.9151 -5.8183 -5.8183 -5.6205 -5.6205 -5.5433 -5.5433 -5.5160 -5.5160 -5.3639 -5.3639 -3.4737 -3.4737 -3.4513 -3.4513 -3.4415 -3.4415 -3.3945 -3.3945 -3.3705 -3.3705 -3.3366 -3.3366 0.6222 0.6222 1.4712 1.4712 1.9910 1.9910 2.4374 2.4374 2.6507 2.6507 2.9004 2.9004 2.9881 2.9881 3.1035 3.1035 3.3421 3.3421 3.3762 3.3762 3.5329 3.5329 3.8163 3.8163 4.6139 4.6139 4.7549 4.7549 5.0500 5.0500 5.5564 5.5564 5.7566 5.7566 6.0769 6.0769 6.2546 6.2546 6.3731 6.3731 6.9450 6.9450 7.2302 7.2302 7.3110 7.3110 7.5321 7.5321 9.1455 9.1455 10.1512 10.1512 k = 0.0735-0.0640-0.0205 ( 6735 PWs) bands (ev): -6.8184 -6.8184 -6.0339 -6.0339 -5.9198 -5.9198 -5.8180 -5.8180 -5.6204 -5.6204 -5.5450 -5.5450 -5.5123 -5.5123 -5.3654 -5.3654 -3.4738 -3.4738 -3.4505 -3.4505 -3.4405 -3.4405 -3.3946 -3.3946 -3.3706 -3.3706 -3.3368 -3.3368 0.6269 0.6269 1.4618 1.4618 1.9803 1.9803 2.3999 2.3999 2.6489 2.6489 2.8751 2.8751 2.9943 2.9943 3.1074 3.1074 3.3543 3.3543 3.4053 3.4053 3.5657 3.5657 3.8102 3.8102 4.6048 4.6048 4.7523 4.7523 5.0477 5.0477 5.5501 5.5501 5.7758 5.7758 6.0846 6.0846 6.2556 6.2556 6.3838 6.3838 6.9550 6.9550 7.2387 7.2387 7.3159 7.3159 7.5319 7.5319 9.1266 9.1266 10.1290 10.1290 k = 0.0882-0.0768-0.0246 ( 6727 PWs) bands (ev): -6.8116 -6.8116 -6.0357 -6.0357 -5.9255 -5.9255 -5.8178 -5.8178 -5.6202 -5.6202 -5.5463 -5.5463 -5.5085 -5.5085 -5.3671 -5.3671 -3.4740 -3.4740 -3.4496 -3.4496 -3.4393 -3.4393 -3.3947 -3.3947 -3.3707 -3.3707 -3.3369 -3.3369 0.6322 0.6322 1.4501 1.4501 1.9669 1.9669 2.3623 2.3623 2.6458 2.6458 2.8430 2.8430 3.0085 3.0085 3.1106 3.1106 3.3652 3.3652 3.4377 3.4377 3.6015 3.6015 3.8038 3.8038 4.5940 4.5940 4.7486 4.7486 5.0449 5.0449 5.5454 5.5454 5.7960 5.7960 6.0938 6.0938 6.2564 6.2564 6.3969 6.3969 6.9665 6.9665 7.2477 7.2477 7.3234 7.3234 7.5319 7.5319 9.1043 9.1043 10.1027 10.1027 k = 0.1029-0.0896-0.0287 ( 6722 PWs) bands (ev): -6.8035 -6.8035 -6.0377 -6.0377 -5.9319 -5.9319 -5.8175 -5.8175 -5.6200 -5.6200 -5.5473 -5.5473 -5.5048 -5.5048 -5.3692 -5.3692 -3.4742 -3.4742 -3.4487 -3.4487 -3.4380 -3.4380 -3.3947 -3.3947 -3.3708 -3.3708 -3.3371 -3.3371 0.6380 0.6380 1.4363 1.4363 1.9509 1.9509 2.3256 2.3256 2.6432 2.6432 2.8084 2.8084 3.0261 3.0261 3.1134 3.1134 3.3755 3.3755 3.4715 3.4715 3.6385 3.6385 3.7978 3.7978 4.5818 4.5818 4.7435 4.7435 5.0417 5.0417 5.5426 5.5426 5.8168 5.8168 6.1041 6.1041 6.2570 6.2570 6.4119 6.4119 6.9790 6.9790 7.2563 7.2563 7.3346 7.3346 7.5320 7.5320 9.0793 9.0793 10.0731 10.0731 k = 0.1176-0.1024-0.0328 ( 6720 PWs) bands (ev): -6.7944 -6.7944 -6.0401 -6.0401 -5.9391 -5.9391 -5.8173 -5.8173 -5.6198 -5.6198 -5.5479 -5.5479 -5.5011 -5.5011 -5.3715 -5.3715 -3.4743 -3.4743 -3.4477 -3.4477 -3.4365 -3.4365 -3.3947 -3.3947 -3.3710 -3.3710 -3.3373 -3.3373 0.6441 0.6441 1.4203 1.4203 1.9324 1.9324 2.2904 2.2904 2.6424 2.6424 2.7733 2.7733 3.0445 3.0445 3.1161 3.1161 3.3856 3.3856 3.5053 3.5053 3.6747 3.6747 3.7933 3.7933 4.5684 4.5684 4.7370 4.7370 5.0384 5.0384 5.5417 5.5417 5.8377 5.8377 6.1155 6.1155 6.2575 6.2575 6.4285 6.4285 6.9922 6.9922 7.2635 7.2635 7.3501 7.3501 7.5323 7.5323 9.0523 9.0523 10.0405 10.0405 k = 0.1324-0.1151-0.0369 ( 6724 PWs) bands (ev): -6.7841 -6.7841 -6.0428 -6.0428 -5.9470 -5.9470 -5.8171 -5.8171 -5.6196 -5.6196 -5.5482 -5.5482 -5.4976 -5.4976 -5.3741 -5.3741 -3.4743 -3.4743 -3.4467 -3.4467 -3.4350 -3.4350 -3.3946 -3.3946 -3.3712 -3.3712 -3.3375 -3.3375 0.6501 0.6501 1.4023 1.4023 1.9117 1.9117 2.2575 2.2575 2.6438 2.6438 2.7390 2.7390 3.0626 3.0626 3.1190 3.1190 3.3953 3.3953 3.5377 3.5377 3.7073 3.7073 3.7930 3.7930 4.5539 4.5539 4.7287 4.7287 5.0354 5.0354 5.5425 5.5425 5.8586 5.8586 6.1273 6.1273 6.2584 6.2584 6.4462 6.4462 7.0058 7.0058 7.2690 7.2690 7.3698 7.3698 7.5330 7.5330 9.0244 9.0244 10.0050 10.0050 k = 0.1471-0.1279-0.0410 ( 6724 PWs) bands (ev): -6.7726 -6.7726 -6.0457 -6.0457 -5.9555 -5.9555 -5.8169 -5.8169 -5.6194 -5.6194 -5.5482 -5.5482 -5.4943 -5.4943 -5.3769 -5.3769 -3.4743 -3.4743 -3.4456 -3.4456 -3.4335 -3.4335 -3.3944 -3.3944 -3.3714 -3.3714 -3.3377 -3.3377 0.6556 0.6556 1.3827 1.3827 1.8893 1.8893 2.2274 2.2274 2.6466 2.6466 2.7070 2.7070 3.0797 3.0797 3.1225 3.1225 3.4048 3.4048 3.5674 3.5674 3.7323 3.7323 3.8012 3.8012 4.5385 4.5385 4.7187 4.7187 5.0328 5.0328 5.5445 5.5445 5.8794 5.8794 6.1390 6.1390 6.2602 6.2602 6.4643 6.4643 7.0194 7.0194 7.2732 7.2732 7.3931 7.3931 7.5342 7.5342 8.9969 8.9969 9.9664 9.9664 k = 0.1618-0.1407-0.0451 ( 6721 PWs) bands (ev): -6.7602 -6.7602 -6.0490 -6.0490 -5.9645 -5.9645 -5.8167 -5.8167 -5.6192 -5.6192 -5.5479 -5.5479 -5.4911 -5.4911 -5.3800 -5.3800 -3.4742 -3.4742 -3.4446 -3.4446 -3.4320 -3.4320 -3.3941 -3.3941 -3.3716 -3.3716 -3.3379 -3.3379 0.6603 0.6603 1.3616 1.3616 1.8657 1.8657 2.2006 2.2006 2.6459 2.6459 2.6825 2.6825 3.0950 3.0950 3.1271 3.1271 3.4140 3.4140 3.5926 3.5926 3.7477 3.7477 3.8206 3.8206 4.5222 4.5222 4.7070 4.7070 5.0310 5.0310 5.5473 5.5473 5.9000 5.9000 6.1501 6.1501 6.2636 6.2636 6.4823 6.4823 7.0327 7.0327 7.2764 7.2764 7.4185 7.4185 7.5362 7.5362 8.9709 8.9709 9.9247 9.9247 k = 0.1765-0.1535-0.0492 ( 6727 PWs) bands (ev): -6.7467 -6.7467 -6.0525 -6.0525 -5.9740 -5.9740 -5.8165 -5.8165 -5.6190 -5.6190 -5.5475 -5.5475 -5.4881 -5.4881 -5.3833 -5.3833 -3.4741 -3.4741 -3.4437 -3.4437 -3.4305 -3.4305 -3.3938 -3.3938 -3.3718 -3.3718 -3.3382 -3.3382 0.6639 0.6639 1.3395 1.3395 1.8415 1.8415 2.1772 2.1772 2.6293 2.6293 2.6777 2.6777 3.1080 3.1080 3.1334 3.1334 3.4226 3.4226 3.6117 3.6117 3.7592 3.7592 3.8464 3.8464 4.5053 4.5053 4.6937 4.6937 5.0302 5.0302 5.5502 5.5502 5.9202 5.9202 6.1595 6.1595 6.2694 6.2694 6.4998 6.4998 7.0456 7.0456 7.2789 7.2789 7.4440 7.4440 7.5401 7.5401 8.9480 8.9480 9.8809 9.8809 k = 0.1912-0.1663-0.0533 ( 6726 PWs) bands (ev): -6.7322 -6.7322 -6.0563 -6.0563 -5.9839 -5.9839 -5.8163 -5.8163 -5.6188 -5.6188 -5.5469 -5.5469 -5.4854 -5.4854 -5.3867 -5.3867 -3.4739 -3.4739 -3.4428 -3.4428 -3.4291 -3.4291 -3.3933 -3.3933 -3.3720 -3.3720 -3.3384 -3.3384 0.6657 0.6657 1.3169 1.3169 1.8172 1.8172 2.1575 2.1575 2.6042 2.6042 2.6850 2.6850 3.1187 3.1187 3.1419 3.1419 3.4307 3.4307 3.6236 3.6236 3.7727 3.7727 3.8736 3.8736 4.4878 4.4878 4.6790 4.6790 5.0306 5.0306 5.5528 5.5528 5.9399 5.9399 6.1667 6.1667 6.2780 6.2780 6.5162 6.5162 7.0579 7.0579 7.2812 7.2812 7.4667 7.4667 7.5474 7.5474 8.9292 8.9292 9.8362 9.8362 k = 0.2059-0.1791-0.0574 ( 6727 PWs) bands (ev): -6.7168 -6.7168 -6.0604 -6.0604 -5.9941 -5.9941 -5.8160 -5.8160 -5.6185 -5.6185 -5.5462 -5.5462 -5.4830 -5.4830 -5.3902 -5.3902 -3.4736 -3.4736 -3.4421 -3.4421 -3.4277 -3.4277 -3.3928 -3.3928 -3.3721 -3.3721 -3.3386 -3.3386 0.6656 0.6656 1.2941 1.2941 1.7936 1.7936 2.1411 2.1411 2.5793 2.5793 2.6952 2.6952 3.1279 3.1279 3.1520 3.1520 3.4383 3.4383 3.6288 3.6288 3.7895 3.7895 3.8995 3.8995 4.4701 4.4701 4.6631 4.6631 5.0323 5.0323 5.5546 5.5546 5.9589 5.9589 6.1715 6.1715 6.2897 6.2897 6.5311 6.5311 7.0694 7.0694 7.2833 7.2833 7.4832 7.4832 7.5605 7.5605 8.9157 8.9157 9.7923 9.7923 k = 0.2206-0.1919-0.0615 ( 6730 PWs) bands (ev): -6.7005 -6.7005 -6.0648 -6.0648 -6.0047 -6.0047 -5.8158 -5.8158 -5.6182 -5.6182 -5.5456 -5.5456 -5.4807 -5.4807 -5.3938 -5.3938 -3.4733 -3.4733 -3.4415 -3.4415 -3.4263 -3.4263 -3.3922 -3.3922 -3.3721 -3.3721 -3.3388 -3.3388 0.6631 0.6631 1.2715 1.2715 1.7715 1.7715 2.1277 2.1277 2.5567 2.5567 2.7059 2.7059 3.1368 3.1368 3.1627 3.1627 3.4455 3.4455 3.6288 3.6288 3.8087 3.8087 3.9233 3.9233 4.4522 4.4522 4.6465 4.6465 5.0352 5.0352 5.5552 5.5552 5.9770 5.9770 6.1743 6.1743 6.3041 6.3041 6.5444 6.5444 7.0800 7.0800 7.2854 7.2854 7.4925 7.4925 7.5794 7.5794 8.9083 8.9083 9.7506 9.7506 k = 0.2353-0.2047-0.0656 ( 6730 PWs) bands (ev): -6.6834 -6.6834 -6.0694 -6.0694 -6.0154 -6.0154 -5.8154 -5.8154 -5.6179 -5.6179 -5.5451 -5.5451 -5.4788 -5.4788 -5.3974 -5.3974 -3.4729 -3.4729 -3.4411 -3.4411 -3.4250 -3.4250 -3.3915 -3.3915 -3.3721 -3.3721 -3.3391 -3.3391 0.6582 0.6582 1.2494 1.2494 1.7517 1.7517 2.1168 2.1168 2.5371 2.5371 2.7160 2.7160 3.1463 3.1463 3.1732 3.1732 3.4526 3.4526 3.6250 3.6250 3.8287 3.8287 3.9448 3.9448 4.4345 4.4345 4.6294 4.6294 5.0394 5.0394 5.5541 5.5541 5.9937 5.9937 6.1758 6.1758 6.3204 6.3204 6.5559 6.5559 7.0894 7.0894 7.2874 7.2874 7.4969 7.4969 7.6009 7.6009 8.9075 8.9075 9.7127 9.7127 k = 0.2500-0.2175-0.0697 ( 6735 PWs) bands (ev): -6.6656 -6.6656 -6.0745 -6.0745 -6.0262 -6.0262 -5.8151 -5.8151 -5.6175 -5.6175 -5.5447 -5.5447 -5.4770 -5.4770 -5.4010 -5.4010 -3.4725 -3.4725 -3.4409 -3.4409 -3.4236 -3.4236 -3.3910 -3.3910 -3.3719 -3.3719 -3.3393 -3.3393 0.6507 0.6507 1.2277 1.2277 1.7348 1.7348 2.1079 2.1079 2.5212 2.5212 2.7248 2.7248 3.1566 3.1566 3.1835 3.1835 3.4598 3.4598 3.6186 3.6186 3.8482 3.8482 3.9637 3.9637 4.4172 4.4172 4.6121 4.6121 5.0448 5.0448 5.5513 5.5513 6.0085 6.0085 6.1768 6.1768 6.3380 6.3380 6.5656 6.5656 7.0976 7.0976 7.2894 7.2894 7.4991 7.4991 7.6217 7.6217 8.9132 8.9132 9.6795 9.6795 k = 0.2647-0.2303-0.0738 ( 6737 PWs) bands (ev): -6.6470 -6.6470 -6.0800 -6.0800 -6.0370 -6.0370 -5.8147 -5.8147 -5.6170 -5.6170 -5.5446 -5.5446 -5.4755 -5.4755 -5.4045 -5.4045 -3.4720 -3.4720 -3.4408 -3.4408 -3.4223 -3.4223 -3.3905 -3.3905 -3.3715 -3.3715 -3.3396 -3.3396 0.6407 0.6407 1.2064 1.2064 1.7214 1.7214 2.1002 2.1002 2.5092 2.5092 2.7320 2.7320 3.1671 3.1671 3.1937 3.1937 3.4676 3.4676 3.6100 3.6100 3.8663 3.8663 3.9804 3.9804 4.4006 4.4006 4.5947 4.5947 5.0515 5.0515 5.5466 5.5466 6.0207 6.0207 6.1780 6.1780 6.3561 6.3561 6.5735 6.5735 7.1044 7.1044 7.2911 7.2911 7.5009 7.5009 7.6394 7.6394 8.9252 8.9252 9.6522 9.6522 k = 0.2794-0.2431-0.0779 ( 6739 PWs) bands (ev): -6.6279 -6.6279 -6.0861 -6.0861 -6.0474 -6.0474 -5.8143 -5.8143 -5.6164 -5.6164 -5.5448 -5.5448 -5.4741 -5.4741 -5.4078 -5.4078 -3.4715 -3.4715 -3.4410 -3.4410 -3.4209 -3.4209 -3.3901 -3.3901 -3.3709 -3.3709 -3.3399 -3.3399 0.6285 0.6285 1.1854 1.1854 1.7120 1.7120 2.0932 2.0932 2.5016 2.5016 2.7373 2.7373 3.1767 3.1767 3.2044 3.2044 3.4766 3.4766 3.5994 3.5994 3.8824 3.8824 3.9949 3.9949 4.3850 4.3850 4.5774 4.5774 5.0593 5.0593 5.5400 5.5400 6.0298 6.0298 6.1801 6.1801 6.3741 6.3741 6.5799 6.5799 7.1098 7.1098 7.2924 7.2924 7.5037 7.5037 7.6528 7.6528 8.9427 8.9427 9.6313 9.6313 k = 0.2941-0.2559-0.0820 ( 6735 PWs) bands (ev): -6.6082 -6.6082 -6.0932 -6.0932 -6.0573 -6.0573 -5.8139 -5.8139 -5.6157 -5.6157 -5.5454 -5.5454 -5.4728 -5.4728 -5.4110 -5.4110 -3.4710 -3.4710 -3.4414 -3.4414 -3.4194 -3.4194 -3.3899 -3.3899 -3.3701 -3.3701 -3.3402 -3.3402 0.6145 0.6145 1.1647 1.1647 1.7066 1.7066 2.0865 2.0865 2.4984 2.4984 2.7409 2.7409 3.1842 3.1842 3.2160 3.2160 3.4871 3.4871 3.5870 3.5870 3.8962 3.8962 4.0078 4.0078 4.3705 4.3705 4.5603 4.5603 5.0683 5.0683 5.5316 5.5316 6.0354 6.0354 6.1835 6.1835 6.3917 6.3917 6.5851 6.5851 7.1139 7.1139 7.2932 7.2932 7.5082 7.5082 7.6610 7.6610 8.9647 8.9647 9.6172 9.6172 k = 0.3088-0.2687-0.0861 ( 6735 PWs) bands (ev): -6.5880 -6.5880 -6.1014 -6.1014 -6.0663 -6.0663 -5.8135 -5.8135 -5.6150 -5.6150 -5.5464 -5.5464 -5.4715 -5.4715 -5.4140 -5.4140 -3.4705 -3.4705 -3.4420 -3.4420 -3.4180 -3.4180 -3.3898 -3.3898 -3.3692 -3.3692 -3.3406 -3.3406 0.5992 0.5992 1.1442 1.1442 1.7052 1.7052 2.0799 2.0799 2.4996 2.4996 2.7429 2.7429 3.1888 3.1888 3.2284 3.2284 3.4998 3.4998 3.5730 3.5730 3.9077 3.9077 4.0192 4.0192 4.3574 4.3574 4.5434 4.5434 5.0784 5.0784 5.5214 5.5214 6.0373 6.0373 6.1882 6.1882 6.4085 6.4085 6.5893 6.5893 7.1169 7.1169 7.2932 7.2932 7.5148 7.5148 7.6637 7.6637 8.9901 8.9901 9.6099 9.6099 k = 0.3235-0.2815-0.0902 ( 6736 PWs) bands (ev): -6.5675 -6.5675 -6.1111 -6.1111 -6.0740 -6.0740 -5.8131 -5.8131 -5.6141 -5.6141 -5.5479 -5.5479 -5.4703 -5.4703 -5.4169 -5.4169 -3.4699 -3.4699 -3.4427 -3.4427 -3.4165 -3.4165 -3.3899 -3.3899 -3.3681 -3.3681 -3.3410 -3.3410 0.5829 0.5829 1.1239 1.1239 1.7074 1.7074 2.0731 2.0731 2.5051 2.5051 2.7439 2.7439 3.1901 3.1901 3.2406 3.2406 3.5147 3.5147 3.5579 3.5579 3.9167 3.9167 4.0295 4.0295 4.3456 4.3456 4.5267 4.5267 5.0896 5.0896 5.5097 5.5097 6.0358 6.0358 6.1937 6.1937 6.4243 6.4243 6.5930 6.5930 7.1189 7.1189 7.2926 7.2926 7.5235 7.5235 7.6611 7.6611 9.0176 9.0176 9.6090 9.6090 k = 0.3382-0.2943-0.0943 ( 6736 PWs) bands (ev): -6.5466 -6.5466 -6.1221 -6.1221 -6.0806 -6.0806 -5.8127 -5.8127 -5.6131 -5.6131 -5.5499 -5.5499 -5.4691 -5.4691 -5.4195 -5.4195 -3.4693 -3.4693 -3.4435 -3.4435 -3.4150 -3.4150 -3.3902 -3.3902 -3.3669 -3.3669 -3.3414 -3.3414 0.5664 0.5664 1.1040 1.1040 1.7127 1.7127 2.0663 2.0663 2.5146 2.5146 2.7443 2.7443 3.1880 3.1880 3.2519 3.2519 3.5304 3.5304 3.5437 3.5437 3.9237 3.9237 4.0386 4.0386 4.3351 4.3351 4.5104 4.5104 5.1019 5.1019 5.4967 5.4967 6.0315 6.0315 6.1996 6.1996 6.4388 6.4388 6.5963 6.5963 7.1205 7.1205 7.2914 7.2914 7.5341 7.5341 7.6538 7.6538 9.0459 9.0459 9.6139 9.6139 k = 0.3529-0.3071-0.0984 ( 6738 PWs) bands (ev): -6.5256 -6.5256 -6.1344 -6.1344 -6.0862 -6.0862 -5.8123 -5.8123 -5.6120 -5.6120 -5.5523 -5.5523 -5.4678 -5.4678 -5.4219 -5.4219 -3.4687 -3.4687 -3.4444 -3.4444 -3.4135 -3.4135 -3.3905 -3.3905 -3.3656 -3.3656 -3.3418 -3.3418 0.5499 0.5499 1.0846 1.0846 1.7205 1.7205 2.0596 2.0596 2.5273 2.5273 2.7447 2.7447 3.1821 3.1821 3.2617 3.2617 3.5231 3.5231 3.5546 3.5546 3.9289 3.9289 4.0468 4.0468 4.3259 4.3259 4.4943 4.4943 5.1152 5.1152 5.4824 5.4824 6.0251 6.0251 6.2054 6.2054 6.4522 6.4522 6.5994 6.5994 7.1219 7.1219 7.2895 7.2895 7.5458 7.5458 7.6426 7.6426 9.0738 9.0738 9.6237 9.6237 k = 0.3676-0.3199-0.1025 ( 6737 PWs) bands (ev): -6.5044 -6.5044 -6.1475 -6.1475 -6.0910 -6.0910 -5.8120 -5.8120 -5.6107 -5.6107 -5.5552 -5.5552 -5.4664 -5.4664 -5.4242 -5.4242 -3.4682 -3.4682 -3.4453 -3.4453 -3.4120 -3.4120 -3.3910 -3.3910 -3.3643 -3.3643 -3.3423 -3.3423 0.5339 0.5339 1.0661 1.0661 1.7299 1.7299 2.0531 2.0531 2.5426 2.5426 2.7458 2.7458 3.1721 3.1721 3.2698 3.2698 3.5073 3.5073 3.5763 3.5763 3.9327 3.9327 4.0541 4.0541 4.3181 4.3181 4.4785 4.4785 5.1295 5.1295 5.4672 5.4672 6.0171 6.0171 6.2107 6.2107 6.4643 6.4643 6.6022 6.6022 7.1237 7.1237 7.2868 7.2868 7.5580 7.5580 7.6289 7.6289 9.1003 9.1003 9.6374 9.6374 k = 0.3824-0.3326-0.1066 ( 6725 PWs) bands (ev): -6.4833 -6.4833 -6.1614 -6.1614 -6.0951 -6.0951 -5.8117 -5.8117 -5.6093 -5.6093 -5.5583 -5.5583 -5.4650 -5.4650 -5.4263 -5.4263 -3.4676 -3.4676 -3.4463 -3.4463 -3.4105 -3.4105 -3.3916 -3.3916 -3.3630 -3.3630 -3.3428 -3.3428 0.5187 0.5187 1.0488 1.0488 1.7403 1.7403 2.0471 2.0471 2.5596 2.5596 2.7486 2.7486 3.1577 3.1577 3.2761 3.2761 3.4923 3.4923 3.5997 3.5997 3.9354 3.9354 4.0604 4.0604 4.3114 4.3114 4.4631 4.4631 5.1448 5.1448 5.4512 5.4512 6.0082 6.0082 6.2152 6.2152 6.4753 6.4753 6.6048 6.6048 7.1264 7.1264 7.2831 7.2831 7.5690 7.5690 7.6149 7.6149 9.1248 9.1248 9.6536 9.6536 k = 0.3971-0.3454-0.1107 ( 6727 PWs) bands (ev): -6.4623 -6.4623 -6.1759 -6.1759 -6.0986 -6.0986 -5.8114 -5.8114 -5.6077 -5.6077 -5.5616 -5.5616 -5.4634 -5.4634 -5.4283 -5.4283 -3.4670 -3.4670 -3.4473 -3.4473 -3.4090 -3.4090 -3.3923 -3.3923 -3.3617 -3.3617 -3.3433 -3.3433 0.5047 0.5047 1.0328 1.0328 1.7509 1.7509 2.0418 2.0418 2.5771 2.5771 2.7539 2.7539 3.1387 3.1387 3.2808 3.2808 3.4789 3.4789 3.6236 3.6236 3.9372 3.9372 4.0659 4.0659 4.3058 4.3058 4.4481 4.4481 5.1608 5.1608 5.4345 5.4345 5.9990 5.9990 6.2189 6.2189 6.4852 6.4852 6.6069 6.6069 7.1302 7.1302 7.2782 7.2782 7.5744 7.5744 7.6055 7.6055 9.1467 9.1467 9.6711 9.6711 k = 0.4118-0.3582-0.1149 ( 6728 PWs) bands (ev): -6.4416 -6.4416 -6.1909 -6.1909 -6.1016 -6.1016 -5.8111 -5.8111 -5.6060 -5.6060 -5.5651 -5.5651 -5.4619 -5.4619 -5.4302 -5.4302 -3.4664 -3.4664 -3.4482 -3.4482 -3.4076 -3.4076 -3.3930 -3.3930 -3.3605 -3.3605 -3.3438 -3.3438 0.4922 0.4922 1.0184 1.0184 1.7612 1.7612 2.0373 2.0373 2.5936 2.5936 2.7630 2.7630 3.1154 3.1154 3.2841 3.2841 3.4675 3.4675 3.6471 3.6471 3.9384 3.9384 4.0704 4.0704 4.3014 4.3014 4.4338 4.4338 5.1774 5.1774 5.4174 5.4174 5.9898 5.9898 6.2218 6.2218 6.4941 6.4941 6.6086 6.6086 7.1355 7.1355 7.2717 7.2717 7.5678 7.5678 7.6079 7.6079 9.1657 9.1657 9.6887 9.6887 k = 0.4265-0.3710-0.1190 ( 6727 PWs) bands (ev): -6.4215 -6.4215 -6.2061 -6.2061 -6.1042 -6.1042 -5.8110 -5.8110 -5.6042 -5.6042 -5.5687 -5.5687 -5.4604 -5.4604 -5.4319 -5.4319 -3.4659 -3.4659 -3.4491 -3.4491 -3.4062 -3.4062 -3.3938 -3.3938 -3.3594 -3.3594 -3.3443 -3.3443 0.4812 0.4812 1.0058 1.0058 1.7706 1.7706 2.0336 2.0336 2.6080 2.6080 2.7770 2.7770 3.0881 3.0881 3.2863 3.2863 3.4584 3.4584 3.6692 3.6692 3.9391 3.9391 4.0741 4.0741 4.2980 4.2980 4.4204 4.4204 5.1945 5.1945 5.4000 5.4000 5.9811 5.9811 6.2240 6.2240 6.5020 6.5020 6.6096 6.6096 7.1424 7.1424 7.2635 7.2635 7.5557 7.5557 7.6162 7.6162 9.1818 9.1818 9.7052 9.7052 k = 0.4412-0.3838-0.1231 ( 6735 PWs) bands (ev): -6.4021 -6.4021 -6.2212 -6.2212 -6.1063 -6.1063 -5.8108 -5.8108 -5.6022 -5.6022 -5.5721 -5.5721 -5.4589 -5.4589 -5.4335 -5.4335 -3.4654 -3.4654 -3.4499 -3.4499 -3.4048 -3.4048 -3.3947 -3.3947 -3.3584 -3.3584 -3.3448 -3.3448 0.4721 0.4721 0.9953 0.9953 1.7787 1.7787 2.0308 2.0308 2.6193 2.6193 2.7963 2.7963 3.0576 3.0576 3.2876 3.2876 3.4514 3.4514 3.6889 3.6889 3.9395 3.9395 4.0770 4.0770 4.2957 4.2957 4.4082 4.4082 5.2117 5.2117 5.3827 5.3827 5.9735 5.9735 6.2256 6.2256 6.5087 6.5087 6.6102 6.6102 7.1510 7.1510 7.2534 7.2534 7.5440 7.5440 7.6247 7.6247 9.1948 9.1948 9.7199 9.7199 k = 0.4559-0.3966-0.1272 ( 6733 PWs) bands (ev): -6.3841 -6.3841 -6.2360 -6.2360 -6.1079 -6.1079 -5.8107 -5.8107 -5.6003 -5.6003 -5.5754 -5.5754 -5.4576 -5.4576 -5.4349 -5.4349 -3.4650 -3.4650 -3.4506 -3.4506 -3.4035 -3.4035 -3.3956 -3.3956 -3.3575 -3.3575 -3.3452 -3.3452 0.4648 0.4648 0.9870 0.9870 1.7852 1.7852 2.0289 2.0289 2.6273 2.6273 2.8206 2.8206 3.0247 3.0247 3.2883 3.2883 3.4463 3.4463 3.7054 3.7054 3.9396 3.9396 4.0792 4.0792 4.2944 4.2944 4.3978 4.3978 5.2287 5.2287 5.3657 5.3657 5.9671 5.9671 6.2267 6.2267 6.5142 6.5142 6.6103 6.6103 7.1612 7.1612 7.2417 7.2417 7.5345 7.5345 7.6319 7.6319 9.2048 9.2048 9.7319 9.7319 k = 0.4706-0.4094-0.1313 ( 6739 PWs) bands (ev): -6.3684 -6.3684 -6.2493 -6.2493 -6.1091 -6.1091 -5.8106 -5.8106 -5.5984 -5.5984 -5.5781 -5.5781 -5.4565 -5.4565 -5.4360 -5.4360 -3.4646 -3.4646 -3.4511 -3.4511 -3.4023 -3.4023 -3.3965 -3.3965 -3.3569 -3.3569 -3.3456 -3.3456 0.4596 0.4596 0.9810 0.9810 1.7899 1.7899 2.0276 2.0276 2.6325 2.6325 2.8490 2.8490 2.9904 2.9904 3.2887 3.2887 3.4429 3.4429 3.7179 3.7179 3.9395 3.9395 4.0808 4.0808 4.2938 4.2938 4.3897 4.3897 5.2443 5.2443 5.3501 5.3501 5.9624 5.9624 6.2274 6.2274 6.5183 6.5183 6.6102 6.6102 7.1729 7.1729 7.2287 7.2287 7.5275 7.5275 7.6374 7.6374 9.2119 9.2119 9.7408 9.7408 k = 0.4853-0.4222-0.1354 ( 6735 PWs) bands (ev): -6.3569 -6.3569 -6.2594 -6.2594 -6.1098 -6.1098 -5.8105 -5.8105 -5.5970 -5.5970 -5.5802 -5.5802 -5.4558 -5.4558 -5.4367 -5.4367 -3.4644 -3.4644 -3.4514 -3.4514 -3.4013 -3.4013 -3.3973 -3.3973 -3.3565 -3.3565 -3.3458 -3.3458 0.4564 0.4564 0.9773 0.9773 1.7928 1.7928 2.0269 2.0269 2.6353 2.6353 2.8795 2.8795 2.9566 2.9566 3.2888 3.2888 3.4410 3.4410 3.7257 3.7257 3.9394 3.9394 4.0817 4.0817 4.2936 4.2936 4.3846 4.3846 5.2567 5.2567 5.3377 5.3377 5.9595 5.9595 6.2278 6.2278 6.5209 6.5209 6.6101 6.6101 7.1856 7.1856 7.2151 7.2151 7.5233 7.5233 7.6407 7.6407 9.2162 9.2162 9.7462 9.7462 k = 0.5000-0.4350-0.1395 ( 6734 PWs) bands (ev): -6.3524 -6.3524 -6.2633 -6.2633 -6.1100 -6.1100 -5.8105 -5.8105 -5.5964 -5.5964 -5.5809 -5.5809 -5.4556 -5.4556 -5.4369 -5.4369 -3.4644 -3.4644 -3.4516 -3.4516 -3.4009 -3.4009 -3.3977 -3.3977 -3.3563 -3.3563 -3.3459 -3.3459 0.4553 0.4553 0.9761 0.9761 1.7937 1.7937 2.0267 2.0267 2.6362 2.6362 2.9011 2.9011 2.9339 2.9339 3.2888 3.2888 3.4403 3.4403 3.7283 3.7283 3.9394 3.9394 4.0820 4.0820 4.2936 4.2936 4.3828 4.3828 5.2619 5.2619 5.3325 5.3325 5.9585 5.9585 6.2279 6.2279 6.5217 6.5217 6.6100 6.6100 7.1955 7.1955 7.2048 7.2048 7.5219 7.5219 7.6419 7.6419 9.2176 9.2176 9.7481 9.7481 k = 0.5000-0.4350 0.3866 ( 6774 PWs) bands (ev): -6.3221 -6.3221 -6.1090 -6.1090 -6.0325 -6.0325 -5.9816 -5.9816 -5.5902 -5.5902 -5.5890 -5.5890 -5.4987 -5.4987 -5.4941 -5.4941 -3.4700 -3.4700 -3.4454 -3.4454 -3.4090 -3.4090 -3.4047 -3.4047 -3.3731 -3.3731 -3.3720 -3.3720 0.2029 0.2029 0.7566 0.7566 2.1637 2.1637 2.1856 2.1856 2.6320 2.6320 2.9328 2.9328 2.9707 2.9707 3.1641 3.1641 3.7418 3.7418 3.8486 3.8486 3.9562 3.9562 4.0629 4.0629 4.6447 4.6447 4.6972 4.6972 5.2577 5.2577 5.4181 5.4181 5.9265 5.9265 6.1374 6.1374 6.4353 6.4353 6.4907 6.4907 7.1092 7.1092 7.2496 7.2496 7.4235 7.4235 7.5615 7.5615 8.9540 8.9540 9.2453 9.2453 k = 0.4868-0.4236 0.3764 ( 6778 PWs) bands (ev): -6.3237 -6.3237 -6.1084 -6.1084 -6.0335 -6.0335 -5.9801 -5.9801 -5.5931 -5.5931 -5.5858 -5.5858 -5.5003 -5.5003 -5.4924 -5.4924 -3.4700 -3.4700 -3.4453 -3.4453 -3.4090 -3.4090 -3.4047 -3.4047 -3.3734 -3.3734 -3.3717 -3.3717 0.2041 0.2041 0.7577 0.7577 2.1529 2.1529 2.1931 2.1931 2.6322 2.6322 2.9347 2.9347 2.9707 2.9707 3.1656 3.1656 3.7366 3.7366 3.8526 3.8526 3.9556 3.9556 4.0628 4.0628 4.6429 4.6429 4.6958 4.6958 5.2569 5.2569 5.4189 5.4189 5.9279 5.9279 6.1373 6.1373 6.4349 6.4349 6.4899 6.4899 7.1108 7.1108 7.2509 7.2509 7.4222 7.4222 7.5627 7.5627 8.9538 8.9538 9.2456 9.2456 k = 0.4737-0.4121 0.3662 ( 6771 PWs) bands (ev): -6.3283 -6.3283 -6.1066 -6.1066 -6.0360 -6.0360 -5.9760 -5.9760 -5.5962 -5.5962 -5.5818 -5.5818 -5.5030 -5.5030 -5.4894 -5.4894 -3.4700 -3.4700 -3.4452 -3.4452 -3.4093 -3.4093 -3.4045 -3.4045 -3.3740 -3.3740 -3.3710 -3.3710 0.2079 0.2079 0.7612 0.7612 2.1331 2.1331 2.2029 2.2029 2.6330 2.6330 2.9404 2.9404 2.9708 2.9708 3.1702 3.1702 3.7227 3.7227 3.8627 3.8627 3.9539 3.9539 4.0624 4.0624 4.6374 4.6374 4.6915 4.6915 5.2545 5.2545 5.4215 5.4215 5.9321 5.9321 6.1369 6.1369 6.4338 6.4338 6.4875 6.4875 7.1157 7.1157 7.2547 7.2547 7.4187 7.4187 7.5662 7.5662 8.9530 8.9530 9.2465 9.2465 k = 0.4605-0.4007 0.3560 ( 6768 PWs) bands (ev): -6.3358 -6.3358 -6.1038 -6.1038 -6.0394 -6.0394 -5.9700 -5.9700 -5.5991 -5.5991 -5.5776 -5.5776 -5.5058 -5.5058 -5.4862 -5.4862 -3.4701 -3.4701 -3.4450 -3.4450 -3.4096 -3.4096 -3.4044 -3.4044 -3.3746 -3.3746 -3.3702 -3.3702 0.2141 0.2141 0.7669 0.7669 2.1103 2.1103 2.2097 2.2097 2.6342 2.6342 2.9496 2.9496 2.9710 2.9710 3.1777 3.1777 3.7038 3.7038 3.8753 3.8753 3.9507 3.9507 4.0619 4.0619 4.6286 4.6286 4.6847 4.6847 5.2508 5.2508 5.4257 5.4257 5.9390 5.9390 6.1363 6.1363 6.4320 6.4320 6.4838 6.4838 7.1232 7.1232 7.2608 7.2608 7.4134 7.4134 7.5716 7.5716 8.9517 8.9517 9.2480 9.2480 k = 0.4474-0.3892 0.3459 ( 6766 PWs) bands (ev): -6.3459 -6.3459 -6.1003 -6.1003 -6.0427 -6.0427 -5.9629 -5.9629 -5.6017 -5.6017 -5.5731 -5.5731 -5.5086 -5.5086 -5.4828 -5.4828 -3.4701 -3.4701 -3.4447 -3.4447 -3.4100 -3.4100 -3.4042 -3.4042 -3.3751 -3.3751 -3.3694 -3.3694 0.2228 0.2228 0.7748 0.7748 2.0855 2.0855 2.2127 2.2127 2.6358 2.6358 2.9614 2.9614 2.9719 2.9719 3.1880 3.1880 3.6819 3.6819 3.8879 3.8879 3.9460 3.9460 4.0615 4.0615 4.6168 4.6168 4.6759 4.6759 5.2457 5.2457 5.4311 5.4311 5.9483 5.9483 6.1353 6.1353 6.4295 6.4295 6.4789 6.4789 7.1331 7.1331 7.2688 7.2688 7.4070 7.4070 7.5783 7.5783 8.9498 8.9498 9.2499 9.2499 k = 0.4342-0.3778 0.3357 ( 6763 PWs) bands (ev): -6.3583 -6.3583 -6.0964 -6.0964 -6.0455 -6.0455 -5.9551 -5.9551 -5.6041 -5.6041 -5.5684 -5.5684 -5.5112 -5.5112 -5.4793 -5.4793 -3.4702 -3.4702 -3.4444 -3.4444 -3.4105 -3.4105 -3.4040 -3.4040 -3.3756 -3.3756 -3.3686 -3.3686 0.2337 0.2337 0.7850 0.7850 2.0597 2.0597 2.2121 2.2121 2.6375 2.6375 2.9688 2.9688 2.9800 2.9800 3.2008 3.2008 3.6584 3.6584 3.8992 3.8992 3.9395 3.9395 4.0612 4.0612 4.6022 4.6022 4.6657 4.6657 5.2395 5.2395 5.4375 5.4375 5.9596 5.9596 6.1342 6.1342 6.4263 6.4263 6.4733 6.4733 7.1445 7.1445 7.2784 7.2784 7.4001 7.4001 7.5859 7.5859 8.9474 8.9474 9.2519 9.2519 k = 0.4211-0.3663 0.3255 ( 6760 PWs) bands (ev): -6.3726 -6.3726 -6.0926 -6.0926 -6.0473 -6.0473 -5.9471 -5.9471 -5.6063 -5.6063 -5.5635 -5.5635 -5.5138 -5.5138 -5.4757 -5.4757 -3.4703 -3.4703 -3.4440 -3.4440 -3.4110 -3.4110 -3.4039 -3.4039 -3.3761 -3.3761 -3.3677 -3.3677 0.2468 0.2468 0.7973 0.7973 2.0334 2.0334 2.2084 2.2084 2.6391 2.6391 2.9696 2.9696 2.9970 2.9970 3.2157 3.2157 3.6338 3.6338 3.9079 3.9079 3.9313 3.9313 4.0613 4.0613 4.5852 4.5852 4.6552 4.6552 5.2324 5.2324 5.4448 5.4448 5.9726 5.9726 6.1329 6.1329 6.4223 6.4223 6.4673 6.4673 7.1567 7.1567 7.2887 7.2887 7.3937 7.3937 7.5938 7.5938 8.9443 8.9443 9.2541 9.2541 k = 0.4079-0.3549 0.3153 ( 6762 PWs) bands (ev): -6.3885 -6.3885 -6.0893 -6.0893 -6.0476 -6.0476 -5.9391 -5.9391 -5.6082 -5.6082 -5.5585 -5.5585 -5.5162 -5.5162 -5.4721 -5.4721 -3.4704 -3.4704 -3.4436 -3.4436 -3.4115 -3.4115 -3.4037 -3.4037 -3.3766 -3.3766 -3.3667 -3.3667 0.2620 0.2620 0.8118 0.8118 2.0070 2.0070 2.2022 2.2022 2.6403 2.6403 2.9695 2.9695 3.0169 3.0169 3.2322 3.2322 3.6087 3.6087 3.9097 3.9097 3.9250 3.9250 4.0616 4.0616 4.5659 4.5659 4.6453 4.6453 5.2244 5.2244 5.4526 5.4526 5.9866 5.9866 6.1317 6.1317 6.4171 6.4171 6.4617 6.4617 7.1688 7.1688 7.2989 7.2989 7.3886 7.3886 7.6017 7.6017 8.9405 8.9405 9.2564 9.2564 k = 0.3947-0.3434 0.3052 ( 6760 PWs) bands (ev): -6.4057 -6.4057 -6.0868 -6.0868 -6.0463 -6.0463 -5.9311 -5.9311 -5.6099 -5.6099 -5.5535 -5.5535 -5.5183 -5.5183 -5.4685 -5.4685 -3.4705 -3.4705 -3.4432 -3.4432 -3.4121 -3.4121 -3.4036 -3.4036 -3.3770 -3.3770 -3.3658 -3.3658 0.2790 0.2790 0.8283 0.8283 1.9811 1.9811 2.1943 2.1943 2.6409 2.6409 2.9691 2.9691 3.0384 3.0384 3.2499 3.2499 3.5832 3.5832 3.8983 3.8983 3.9269 3.9269 4.0621 4.0621 4.5447 4.5447 4.6372 4.6372 5.2157 5.2157 5.4607 5.4607 6.0008 6.0008 6.1310 6.1310 6.4106 6.4106 6.4569 6.4569 7.1801 7.1801 7.3077 7.3077 7.3859 7.3859 7.6092 7.6092 8.9359 8.9359 9.2589 9.2589 k = 0.3816-0.3320 0.2950 ( 6761 PWs) bands (ev): -6.4241 -6.4241 -6.0852 -6.0852 -6.0434 -6.0434 -5.9233 -5.9233 -5.6114 -5.6114 -5.5487 -5.5487 -5.5201 -5.5201 -5.4649 -5.4649 -3.4707 -3.4707 -3.4428 -3.4428 -3.4126 -3.4126 -3.4036 -3.4036 -3.3774 -3.3774 -3.3648 -3.3648 0.2976 0.2976 0.8468 0.8468 1.9560 1.9560 2.1852 2.1852 2.6407 2.6407 2.9684 2.9684 3.0609 3.0609 3.2682 3.2682 3.5576 3.5576 3.8803 3.8803 3.9302 3.9302 4.0623 4.0623 4.5218 4.5218 4.6316 4.6316 5.2064 5.2064 5.4690 5.4690 6.0141 6.0141 6.1312 6.1312 6.4028 6.4028 6.4532 6.4532 7.1898 7.1898 7.3141 7.3141 7.3863 7.3863 7.6161 7.6161 8.9306 8.9306 9.2617 9.2617 k = 0.3684-0.3205 0.2848 ( 6760 PWs) bands (ev): -6.4432 -6.4432 -6.0842 -6.0842 -6.0391 -6.0391 -5.9157 -5.9157 -5.6127 -5.6127 -5.5444 -5.5444 -5.5213 -5.5213 -5.4612 -5.4612 -3.4709 -3.4709 -3.4424 -3.4424 -3.4132 -3.4132 -3.4035 -3.4035 -3.3778 -3.3778 -3.3637 -3.3637 0.3177 0.3177 0.8671 0.8671 1.9323 1.9323 2.1757 2.1757 2.6398 2.6398 2.9676 2.9676 3.0835 3.0835 3.2867 3.2867 3.5319 3.5319 3.8586 3.8586 3.9328 3.9328 4.0617 4.0617 4.4977 4.4977 4.6291 4.6291 5.1965 5.1965 5.4773 5.4773 6.0255 6.0255 6.1331 6.1331 6.3942 6.3942 6.4504 6.4504 7.1973 7.1973 7.3182 7.3182 7.3899 7.3899 7.6221 7.6221 8.9244 8.9244 9.2651 9.2651 k = 0.3553-0.3091 0.2747 ( 6754 PWs) bands (ev): -6.4631 -6.4631 -6.0835 -6.0835 -6.0339 -6.0339 -5.9085 -5.9085 -5.6139 -5.6139 -5.5410 -5.5410 -5.5214 -5.5214 -5.4575 -5.4575 -3.4710 -3.4710 -3.4420 -3.4420 -3.4138 -3.4138 -3.4034 -3.4034 -3.3780 -3.3780 -3.3627 -3.3627 0.3389 0.3389 0.8890 0.8890 1.9102 1.9102 2.1664 2.1664 2.6382 2.6382 2.9665 2.9665 3.1054 3.1054 3.3050 3.3050 3.5065 3.5065 3.8340 3.8340 3.9345 3.9345 4.0599 4.0599 4.4730 4.4730 4.6301 4.6301 5.1861 5.1861 5.4854 5.4854 6.0336 6.0336 6.1371 6.1371 6.3854 6.3854 6.4482 6.4482 7.2019 7.2019 7.3208 7.3208 7.3956 7.3956 7.6269 7.6269 8.9175 8.9175 9.2697 9.2697 k = 0.3421-0.2976 0.2645 ( 6749 PWs) bands (ev): -6.4834 -6.4834 -6.0829 -6.0829 -6.0279 -6.0279 -5.9016 -5.9016 -5.6149 -5.6149 -5.5391 -5.5391 -5.5200 -5.5200 -5.4537 -5.4537 -3.4712 -3.4712 -3.4417 -3.4417 -3.4143 -3.4143 -3.4034 -3.4034 -3.3782 -3.3782 -3.3616 -3.3616 0.3611 0.3611 0.9124 0.9124 1.8902 1.8902 2.1576 2.1576 2.6363 2.6363 2.9652 2.9652 3.1251 3.1251 3.3229 3.3229 3.4817 3.4817 3.8073 3.8073 3.9351 3.9351 4.0565 4.0565 4.4484 4.4484 4.6344 4.6344 5.1753 5.1753 5.4932 5.4932 6.0378 6.0378 6.1431 6.1431 6.3773 6.3773 6.4463 6.4463 7.2035 7.2035 7.3229 7.3229 7.4018 7.4018 7.6300 7.6300 8.9100 8.9100 9.2757 9.2757 k = 0.3289-0.2862 0.2543 ( 6746 PWs) bands (ev): -6.5040 -6.5040 -6.0821 -6.0821 -6.0216 -6.0216 -5.8950 -5.8950 -5.6157 -5.6157 -5.5388 -5.5388 -5.5171 -5.5171 -5.4500 -5.4500 -3.4714 -3.4714 -3.4415 -3.4415 -3.4150 -3.4150 -3.4034 -3.4034 -3.3784 -3.3784 -3.3605 -3.3605 0.3838 0.3838 0.9371 0.9371 1.8728 1.8728 2.1499 2.1499 2.6342 2.6342 2.9637 2.9637 3.1412 3.1412 3.3402 3.3402 3.4579 3.4579 3.7794 3.7794 3.9346 3.9346 4.0510 4.0510 4.4247 4.4247 4.6419 4.6419 5.1641 5.1641 5.5007 5.5007 6.0382 6.0382 6.1501 6.1501 6.3707 6.3707 6.4443 6.4443 7.2023 7.2023 7.3254 7.3254 7.4075 7.4075 7.6313 7.6313 8.9022 8.9022 9.2838 9.2838 k = 0.3158-0.2747 0.2441 ( 6748 PWs) bands (ev): -6.5247 -6.5247 -6.0812 -6.0812 -6.0151 -6.0151 -5.8887 -5.8887 -5.6164 -5.6164 -5.5396 -5.5396 -5.5132 -5.5132 -5.4461 -5.4461 -3.4717 -3.4717 -3.4414 -3.4414 -3.4156 -3.4156 -3.4033 -3.4033 -3.3784 -3.3784 -3.3594 -3.3594 0.4070 0.4070 0.9627 0.9627 1.8583 1.8583 2.1435 2.1435 2.6323 2.6323 2.9621 2.9621 3.1517 3.1517 3.3569 3.3569 3.4362 3.4362 3.7513 3.7513 3.9327 3.9327 4.0433 4.0433 4.4028 4.4028 4.6523 4.6523 5.1526 5.1526 5.5075 5.5075 6.0355 6.0355 6.1565 6.1565 6.3661 6.3661 6.4419 6.4419 7.1988 7.1988 7.3282 7.3282 7.4118 7.4118 7.6305 7.6305 8.8943 8.8943 9.2942 9.2942 k = 0.3026-0.2633 0.2340 ( 6746 PWs) bands (ev): -6.5455 -6.5455 -6.0799 -6.0799 -6.0085 -6.0085 -5.8828 -5.8828 -5.6170 -5.6170 -5.5409 -5.5409 -5.5091 -5.5091 -5.4422 -5.4422 -3.4719 -3.4719 -3.4414 -3.4414 -3.4163 -3.4163 -3.4033 -3.4033 -3.3783 -3.3783 -3.3582 -3.3582 0.4301 0.4301 0.9890 0.9890 1.8472 1.8472 2.1387 2.1387 2.6309 2.6309 2.9602 2.9602 3.1548 3.1548 3.3723 3.3723 3.4181 3.4181 3.7240 3.7240 3.9288 3.9288 4.0331 4.0331 4.3838 4.3838 4.6651 4.6651 5.1408 5.1408 5.5138 5.5138 6.0302 6.0302 6.1610 6.1610 6.3642 6.3642 6.4389 6.4389 7.1934 7.1934 7.3312 7.3312 7.4146 7.4146 7.6272 7.6272 8.8867 8.8867 9.3075 9.3075 k = 0.2895-0.2518 0.2238 ( 6738 PWs) bands (ev): -6.5662 -6.5662 -6.0784 -6.0784 -6.0018 -6.0018 -5.8772 -5.8772 -5.6175 -5.6175 -5.5425 -5.5425 -5.5050 -5.5050 -5.4382 -5.4382 -3.4722 -3.4722 -3.4415 -3.4415 -3.4170 -3.4170 -3.4032 -3.4032 -3.3782 -3.3782 -3.3571 -3.3571 0.4530 0.4530 1.0156 1.0156 1.8399 1.8399 2.1356 2.1356 2.6302 2.6302 2.9582 2.9582 3.1491 3.1491 3.3814 3.3814 3.4091 3.4091 3.6985 3.6985 3.9224 3.9224 4.0201 4.0201 4.3685 4.3685 4.6799 4.6799 5.1289 5.1289 5.5193 5.5193 6.0229 6.0229 6.1629 6.1629 6.3648 6.3648 6.4353 6.4353 7.1867 7.1867 7.3344 7.3344 7.4156 7.4156 7.6213 7.6213 8.8799 8.8799 9.3238 9.3238 k = 0.2763-0.2404 0.2136 ( 6738 PWs) bands (ev): -6.5867 -6.5867 -6.0765 -6.0765 -5.9952 -5.9952 -5.8718 -5.8718 -5.6179 -5.6179 -5.5441 -5.5441 -5.5012 -5.5012 -5.4341 -5.4341 -3.4724 -3.4724 -3.4417 -3.4417 -3.4178 -3.4178 -3.4031 -3.4031 -3.3779 -3.3779 -3.3559 -3.3559 0.4754 0.4754 1.0422 1.0422 1.8368 1.8368 2.1345 2.1345 2.6305 2.6305 2.9560 2.9560 3.1343 3.1343 3.3765 3.3765 3.4166 3.4166 3.6759 3.6759 3.9128 3.9128 4.0045 4.0045 4.3577 4.3577 4.6963 4.6963 5.1168 5.1168 5.5241 5.5241 6.0138 6.0138 6.1622 6.1622 6.3672 6.3672 6.4309 6.4309 7.1791 7.1791 7.3377 7.3377 7.4149 7.4149 7.6127 7.6127 8.8743 8.8743 9.3434 9.3434 k = 0.2632-0.2289 0.2035 ( 6741 PWs) bands (ev): -6.6068 -6.6068 -6.0744 -6.0744 -5.9887 -5.9887 -5.8668 -5.8668 -5.6183 -5.6183 -5.5458 -5.5458 -5.4978 -5.4978 -5.4299 -5.4299 -3.4727 -3.4727 -3.4421 -3.4421 -3.4187 -3.4187 -3.4029 -3.4029 -3.3776 -3.3776 -3.3548 -3.3548 0.4968 0.4968 1.0686 1.0686 1.8383 1.8383 2.1355 2.1355 2.6321 2.6321 2.9535 2.9535 3.1112 3.1112 3.3668 3.3668 3.4297 3.4297 3.6574 3.6574 3.8995 3.8995 3.9863 3.9863 4.3518 4.3518 4.7138 4.7138 5.1046 5.1046 5.5280 5.5280 6.0032 6.0032 6.1593 6.1593 6.3704 6.3704 6.4258 6.4258 7.1708 7.1708 7.3411 7.3411 7.4127 7.4127 7.6012 7.6012 8.8705 8.8705 9.3666 9.3666 k = 0.2500-0.2175 0.1933 ( 6731 PWs) bands (ev): -6.6265 -6.6265 -6.0720 -6.0720 -5.9823 -5.9823 -5.8619 -5.8619 -5.6185 -5.6185 -5.5474 -5.5474 -5.4950 -5.4950 -5.4254 -5.4254 -3.4730 -3.4730 -3.4425 -3.4425 -3.4197 -3.4197 -3.4027 -3.4027 -3.3771 -3.3771 -3.3536 -3.3536 0.5170 0.5170 1.0944 1.0944 1.8445 1.8445 2.1385 2.1385 2.6351 2.6351 2.9506 2.9506 3.0819 3.0819 3.3568 3.3568 3.4416 3.4416 3.6441 3.6441 3.8820 3.8820 3.9659 3.9659 4.3509 4.3509 4.7320 4.7320 5.0926 5.0926 5.5311 5.5311 5.9911 5.9911 6.1550 6.1550 6.3730 6.3730 6.4205 6.4205 7.1619 7.1619 7.3451 7.3451 7.4092 7.4092 7.5869 7.5869 8.8689 8.8689 9.3935 9.3935 k = 0.2368-0.2061 0.1831 ( 6733 PWs) bands (ev): -6.6457 -6.6457 -6.0693 -6.0693 -5.9761 -5.9761 -5.8574 -5.8574 -5.6187 -5.6187 -5.5489 -5.5489 -5.4927 -5.4927 -5.4209 -5.4209 -3.4732 -3.4732 -3.4430 -3.4430 -3.4208 -3.4208 -3.4024 -3.4024 -3.3766 -3.3766 -3.3524 -3.3524 0.5358 0.5358 1.1196 1.1196 1.8553 1.8553 2.1438 2.1438 2.6396 2.6396 2.9471 2.9471 3.0484 3.0484 3.3465 3.3465 3.4497 3.4497 3.6370 3.6370 3.8601 3.8601 3.9437 3.9437 4.3546 4.3546 4.7505 4.7505 5.0807 5.0807 5.5332 5.5332 5.9777 5.9777 6.1499 6.1499 6.3734 6.3734 6.4156 6.4156 7.1523 7.1523 7.3497 7.3497 7.4046 7.4046 7.5698 7.5698 8.8699 8.8699 9.4243 9.4243 k = 0.2237-0.1946 0.1729 ( 6735 PWs) bands (ev): -6.6644 -6.6644 -6.0665 -6.0665 -5.9700 -5.9700 -5.8530 -5.8530 -5.6188 -5.6188 -5.5503 -5.5503 -5.4911 -5.4911 -5.4162 -5.4162 -3.4735 -3.4735 -3.4436 -3.4436 -3.4220 -3.4220 -3.4021 -3.4021 -3.3761 -3.3761 -3.3512 -3.3512 0.5528 0.5528 1.1442 1.1442 1.8707 1.8707 2.1513 2.1513 2.6458 2.6458 2.9421 2.9421 3.0134 3.0134 3.3356 3.3356 3.4529 3.4529 3.6365 3.6365 3.8343 3.8343 3.9199 3.9199 4.3624 4.3624 4.7689 4.7689 5.0691 5.0691 5.5346 5.5346 5.9630 5.9630 6.1446 6.1446 6.3704 6.3704 6.4116 6.4116 7.1420 7.1420 7.3549 7.3549 7.3992 7.3992 7.5503 7.5503 8.8740 8.8740 9.4591 9.4591 k = 0.2105-0.1832 0.1628 ( 6733 PWs) bands (ev): -6.6823 -6.6823 -6.0635 -6.0635 -5.9641 -5.9641 -5.8489 -5.8489 -5.6190 -5.6190 -5.5516 -5.5516 -5.4902 -5.4902 -5.4114 -5.4114 -3.4737 -3.4737 -3.4443 -3.4443 -3.4233 -3.4233 -3.4017 -3.4017 -3.3755 -3.3755 -3.3500 -3.3500 0.5679 0.5679 1.1681 1.1681 1.8901 1.8901 2.1610 2.1610 2.6536 2.6536 2.9330 2.9330 2.9811 2.9811 3.3238 3.3238 3.4514 3.4514 3.6417 3.6417 3.8051 3.8051 3.8947 3.8947 4.3736 4.3736 4.7866 4.7866 5.0583 5.0583 5.5352 5.5352 5.9474 5.9474 6.1393 6.1393 6.3639 6.3639 6.4088 6.4088 7.1309 7.1309 7.3604 7.3604 7.3939 7.3939 7.5287 7.5287 8.8814 8.8814 9.4978 9.4978 k = 0.1974-0.1717 0.1526 ( 6728 PWs) bands (ev): -6.6995 -6.6995 -6.0605 -6.0605 -5.9583 -5.9583 -5.8451 -5.8451 -5.6190 -5.6190 -5.5526 -5.5526 -5.4898 -5.4898 -5.4066 -5.4066 -3.4739 -3.4739 -3.4451 -3.4451 -3.4248 -3.4248 -3.4012 -3.4012 -3.3749 -3.3749 -3.3487 -3.3487 0.5810 0.5810 1.1917 1.1917 1.9129 1.9129 2.1730 2.1730 2.6628 2.6628 2.9131 2.9131 2.9597 2.9597 3.3109 3.3109 3.4463 3.4463 3.6504 3.6504 3.7740 3.7740 3.8681 3.8681 4.3875 4.3875 4.8030 4.8030 5.0483 5.0483 5.5353 5.5353 5.9310 5.9310 6.1342 6.1342 6.3545 6.3545 6.4063 6.4063 7.1191 7.1191 7.3643 7.3643 7.3900 7.3900 7.5060 7.5060 8.8923 8.8923 9.5402 9.5402 k = 0.1842-0.1603 0.1424 ( 6728 PWs) bands (ev): -6.7159 -6.7159 -6.0574 -6.0574 -5.9528 -5.9528 -5.8415 -5.8415 -5.6191 -5.6191 -5.5535 -5.5535 -5.4901 -5.4901 -5.4018 -5.4018 -3.4740 -3.4740 -3.4458 -3.4458 -3.4262 -3.4262 -3.4007 -3.4007 -3.3743 -3.3743 -3.3475 -3.3475 0.5919 0.5919 1.2151 1.2151 1.9379 1.9379 2.1873 2.1873 2.6727 2.6727 2.8837 2.8837 2.9497 2.9497 3.2970 3.2970 3.4388 3.4388 3.6589 3.6589 3.7437 3.7437 3.8399 3.8399 4.4035 4.4035 4.8176 4.8176 5.0396 5.0396 5.5348 5.5348 5.9140 5.9140 6.1293 6.1293 6.3434 6.3434 6.4035 6.4035 7.1064 7.1064 7.3632 7.3632 7.3901 7.3901 7.4834 7.4834 8.9067 8.9067 9.5861 9.5861 k = 0.1711-0.1488 0.1322 ( 6729 PWs) bands (ev): -6.7314 -6.7314 -6.0542 -6.0542 -5.9474 -5.9474 -5.8381 -5.8381 -5.6192 -5.6192 -5.5541 -5.5541 -5.4909 -5.4909 -5.3970 -5.3970 -3.4742 -3.4742 -3.4466 -3.4466 -3.4278 -3.4278 -3.4001 -3.4001 -3.3737 -3.3737 -3.3463 -3.3463 0.6007 0.6007 1.2385 1.2385 1.9638 1.9638 2.2042 2.2042 2.6825 2.6825 2.8541 2.8541 2.9439 2.9439 3.2822 3.2822 3.4300 3.4300 3.6583 3.6583 3.7222 3.7222 3.8103 3.8103 4.4210 4.4210 4.8295 4.8295 5.0327 5.0327 5.5341 5.5341 5.8966 5.8966 6.1244 6.1244 6.3313 6.3313 6.4001 6.4001 7.0929 7.0929 7.3571 7.3571 7.3920 7.3920 7.4639 7.4639 8.9245 8.9245 9.6352 9.6352 k = 0.1579-0.1374 0.1221 ( 6729 PWs) bands (ev): -6.7460 -6.7460 -6.0512 -6.0512 -5.9422 -5.9422 -5.8351 -5.8351 -5.6192 -5.6192 -5.5544 -5.5544 -5.4923 -5.4923 -5.3924 -5.3924 -3.4742 -3.4742 -3.4474 -3.4474 -3.4294 -3.4294 -3.3995 -3.3995 -3.3732 -3.3732 -3.3451 -3.3451 0.6075 0.6075 1.2621 1.2621 1.9892 1.9892 2.2236 2.2236 2.6902 2.6902 2.8301 2.8301 2.9394 2.9394 3.2666 3.2666 3.4207 3.4207 3.6374 3.6374 3.7201 3.7201 3.7795 3.7795 4.4395 4.4395 4.8381 4.8381 5.0281 5.0281 5.5335 5.5335 5.8791 5.8791 6.1196 6.1196 6.3190 6.3190 6.3960 6.3960 7.0787 7.0787 7.3478 7.3478 7.3888 7.3888 7.4530 7.4530 8.9453 8.9453 9.6869 9.6869 k = 0.1447-0.1259 0.1119 ( 6725 PWs) bands (ev): -6.7596 -6.7596 -6.0482 -6.0482 -5.9373 -5.9373 -5.8322 -5.8322 -5.6193 -5.6193 -5.5544 -5.5544 -5.4941 -5.4941 -5.3879 -5.3879 -3.4743 -3.4743 -3.4482 -3.4482 -3.4311 -3.4311 -3.3989 -3.3989 -3.3727 -3.3727 -3.3439 -3.3439 0.6125 0.6125 1.2860 1.2860 2.0123 2.0123 2.2460 2.2460 2.6928 2.6928 2.8161 2.8161 2.9357 2.9357 3.2504 3.2504 3.4114 3.4114 3.6039 3.6039 3.7273 3.7273 3.7498 3.7498 4.4587 4.4587 4.8428 4.8428 5.0260 5.0260 5.5331 5.5331 5.8614 5.8614 6.1145 6.1145 6.3070 6.3070 6.3913 6.3913 7.0638 7.0638 7.3360 7.3360 7.3775 7.3775 7.4535 7.4535 8.9687 8.9687 9.7405 9.7405 k = 0.1316-0.1145 0.1017 ( 6721 PWs) bands (ev): -6.7722 -6.7722 -6.0453 -6.0453 -5.9326 -5.9326 -5.8297 -5.8297 -5.6195 -5.6195 -5.5541 -5.5541 -5.4964 -5.4964 -5.3837 -5.3837 -3.4743 -3.4743 -3.4490 -3.4490 -3.4327 -3.4327 -3.3983 -3.3983 -3.3722 -3.3722 -3.3428 -3.3428 0.6158 0.6158 1.3102 1.3102 2.0313 2.0313 2.2712 2.2712 2.6892 2.6892 2.8144 2.8144 2.9326 2.9326 3.2337 3.2337 3.4021 3.4021 3.5665 3.5665 3.7097 3.7097 3.7471 3.7471 4.4783 4.4783 4.8434 4.8434 5.0264 5.0264 5.5334 5.5334 5.8438 5.8438 6.1092 6.1092 6.2958 6.2958 6.3863 6.3863 7.0481 7.0481 7.3214 7.3214 7.3632 7.3632 7.4610 7.4610 8.9941 8.9941 9.7955 9.7955 k = 0.1184-0.1030 0.0916 ( 6726 PWs) bands (ev): -6.7837 -6.7837 -6.0426 -6.0426 -5.9281 -5.9281 -5.8275 -5.8275 -5.6196 -5.6196 -5.5534 -5.5534 -5.4990 -5.4990 -5.3797 -5.3797 -3.4742 -3.4742 -3.4497 -3.4497 -3.4343 -3.4343 -3.3977 -3.3977 -3.3718 -3.3718 -3.3417 -3.3417 0.6177 0.6177 1.3346 1.3346 2.0451 2.0451 2.2993 2.2993 2.6818 2.6818 2.8223 2.8223 2.9308 2.9308 3.2167 3.2167 3.3930 3.3930 3.5281 3.5281 3.6767 3.6767 3.7597 3.7597 4.4980 4.4980 4.8402 4.8402 5.0289 5.0289 5.5346 5.5346 5.8264 5.8264 6.1034 6.1034 6.2857 6.2857 6.3812 6.3812 7.0318 7.0318 7.3044 7.3044 7.3505 7.3505 7.4712 7.4712 9.0206 9.0206 9.8509 9.8509 k = 0.1053-0.0916 0.0814 ( 6730 PWs) bands (ev): -6.7941 -6.7941 -6.0401 -6.0401 -5.9240 -5.9240 -5.8255 -5.8255 -5.6198 -5.6198 -5.5524 -5.5524 -5.5020 -5.5020 -5.3760 -5.3760 -3.4741 -3.4741 -3.4504 -3.4504 -3.4359 -3.4359 -3.3971 -3.3971 -3.3715 -3.3715 -3.3407 -3.3407 0.6185 0.6185 1.3590 1.3590 2.0528 2.0528 2.3297 2.3297 2.6745 2.6745 2.8352 2.8352 2.9316 2.9316 3.1996 3.1996 3.3841 3.3841 3.4900 3.4900 3.6425 3.6425 3.7727 3.7727 4.5177 4.5177 4.8338 4.8338 5.0327 5.0327 5.5369 5.5369 5.8091 5.8091 6.0974 6.0974 6.2770 6.2770 6.3761 6.3761 7.0151 7.0151 7.2866 7.2866 7.3400 7.3400 7.4821 7.4821 9.0476 9.0476 9.9059 9.9059 k = 0.0921-0.0801 0.0712 ( 6735 PWs) bands (ev): -6.8033 -6.8033 -6.0378 -6.0378 -5.9202 -5.9202 -5.8238 -5.8238 -5.6199 -5.6199 -5.5510 -5.5510 -5.5052 -5.5052 -5.3727 -5.3727 -3.4740 -3.4740 -3.4510 -3.4510 -3.4374 -3.4374 -3.3965 -3.3965 -3.3712 -3.3712 -3.3397 -3.3397 0.6185 0.6185 1.3830 1.3830 2.0546 2.0546 2.3618 2.3618 2.6692 2.6692 2.8487 2.8487 2.9368 2.9368 3.1824 3.1824 3.3751 3.3751 3.4530 3.4530 3.6086 3.6086 3.7849 3.7849 4.5371 4.5371 4.8249 4.8249 5.0371 5.0371 5.5405 5.5405 5.7921 5.7921 6.0911 6.0911 6.2697 6.2697 6.3714 6.3714 6.9983 6.9983 7.2696 7.2696 7.3314 7.3314 7.4927 7.4927 9.0741 9.0741 9.9596 9.9596 k = 0.0789-0.0687 0.0610 ( 6735 PWs) bands (ev): -6.8114 -6.8114 -6.0358 -6.0358 -5.9167 -5.9167 -5.8224 -5.8224 -5.6201 -5.6201 -5.5493 -5.5493 -5.5086 -5.5086 -5.3698 -5.3698 -3.4739 -3.4739 -3.4515 -3.4515 -3.4388 -3.4388 -3.3960 -3.3960 -3.3710 -3.3710 -3.3389 -3.3389 0.6179 0.6179 1.4062 1.4062 2.0512 2.0512 2.3945 2.3945 2.6661 2.6661 2.8603 2.8603 2.9480 2.9480 3.1651 3.1651 3.3658 3.3658 3.4182 3.4182 3.5759 3.5759 3.7959 3.7959 4.5560 4.5560 4.8142 4.8142 5.0414 5.0414 5.5454 5.5454 5.7756 5.7756 6.0848 6.0848 6.2639 6.2639 6.3671 6.3671 6.9820 6.9820 7.2544 7.2544 7.3242 7.3242 7.5026 7.5026 9.0992 9.0992 10.0108 10.0108 k = 0.0658-0.0572 0.0509 ( 6733 PWs) bands (ev): -6.8183 -6.8183 -6.0340 -6.0340 -5.9136 -5.9136 -5.8213 -5.8213 -5.6203 -5.6203 -5.5473 -5.5473 -5.5121 -5.5121 -5.3673 -5.3673 -3.4737 -3.4737 -3.4519 -3.4519 -3.4401 -3.4401 -3.3955 -3.3955 -3.3708 -3.3708 -3.3381 -3.3381 0.6170 0.6170 1.4279 1.4279 2.0440 2.0440 2.4271 2.4271 2.6636 2.6636 2.8698 2.8698 2.9649 2.9649 3.1477 3.1477 3.3554 3.3554 3.3872 3.3872 3.5455 3.5455 3.8056 3.8056 4.5742 4.5742 4.8025 4.8025 5.0453 5.0453 5.5516 5.5516 5.7597 5.7597 6.0789 6.0789 6.2594 6.2594 6.3634 6.3634 6.9666 6.9666 7.2416 7.2416 7.3182 7.3182 7.5114 7.5114 9.1222 9.1222 10.0584 10.0584 k = 0.0526-0.0458 0.0407 ( 6737 PWs) bands (ev): -6.8239 -6.8239 -6.0326 -6.0326 -5.9111 -5.9111 -5.8204 -5.8204 -5.6205 -5.6205 -5.5450 -5.5450 -5.5157 -5.5157 -5.3651 -5.3651 -3.4735 -3.4735 -3.4523 -3.4523 -3.4412 -3.4412 -3.3951 -3.3951 -3.3706 -3.3706 -3.3375 -3.3375 0.6159 0.6159 1.4476 1.4476 2.0347 2.0347 2.4588 2.4588 2.6598 2.6598 2.8792 2.8792 2.9853 2.9853 3.1301 3.1301 3.3421 3.3421 3.3625 3.3625 3.5186 3.5186 3.8137 3.8137 4.5913 4.5913 4.7904 4.7904 5.0485 5.0485 5.5585 5.5585 5.7450 5.7450 6.0735 6.0735 6.2561 6.2561 6.3603 6.3603 6.9529 6.9529 7.2312 7.2312 7.3133 7.3133 7.5188 7.5188 9.1421 9.1421 10.1011 10.1011 k = 0.0395-0.0343 0.0305 ( 6736 PWs) bands (ev): -6.8283 -6.8283 -6.0315 -6.0315 -5.9090 -5.9090 -5.8197 -5.8197 -5.6206 -5.6206 -5.5424 -5.5424 -5.5192 -5.5192 -5.3635 -5.3635 -3.4734 -3.4734 -3.4525 -3.4525 -3.4421 -3.4421 -3.3948 -3.3948 -3.3705 -3.3705 -3.3370 -3.3370 0.6149 0.6149 1.4642 1.4642 2.0249 2.0249 2.4885 2.4885 2.6532 2.6532 2.8899 2.8899 3.0064 3.0064 3.1125 3.1125 3.3251 3.3251 3.3463 3.3463 3.4966 3.4966 3.8201 3.8201 4.6067 4.6067 4.7786 4.7786 5.0509 5.0509 5.5657 5.5657 5.7318 5.7318 6.0690 6.0690 6.2537 6.2537 6.3578 6.3578 6.9414 6.9414 7.2233 7.2233 7.3095 7.3095 7.5248 7.5248 9.1584 9.1584 10.1376 10.1376 k = 0.0263-0.0229 0.0203 ( 6736 PWs) bands (ev): -6.8315 -6.8315 -6.0306 -6.0306 -5.9075 -5.9075 -5.8193 -5.8193 -5.6207 -5.6207 -5.5399 -5.5399 -5.5226 -5.5226 -5.3623 -5.3623 -3.4733 -3.4733 -3.4527 -3.4527 -3.4428 -3.4428 -3.3946 -3.3946 -3.3704 -3.3704 -3.3367 -3.3367 0.6140 0.6140 1.4770 1.4770 2.0165 2.0165 2.5148 2.5148 2.6438 2.6438 2.9012 2.9012 3.0254 3.0254 3.0959 3.0959 3.3095 3.3095 3.3352 3.3352 3.4804 3.4804 3.8248 3.8248 4.6194 4.6194 4.7684 4.7684 5.0526 5.0526 5.5721 5.5721 5.7212 5.7212 6.0656 6.0656 6.2522 6.2522 6.3561 6.3561 6.9328 6.9328 7.2178 7.2178 7.3067 7.3067 7.5291 7.5291 9.1705 9.1705 10.1662 10.1662 k = 0.0132-0.0114 0.0102 ( 6735 PWs) bands (ev): -6.8334 -6.8334 -6.0301 -6.0301 -5.9066 -5.9066 -5.8190 -5.8190 -5.6208 -5.6208 -5.5375 -5.5375 -5.5253 -5.5253 -5.3616 -5.3616 -3.4732 -3.4732 -3.4528 -3.4528 -3.4432 -3.4432 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6135 0.6135 1.4850 1.4850 2.0108 2.0108 2.5348 2.5348 2.6340 2.6340 2.9105 2.9105 3.0400 3.0400 3.0823 3.0823 3.2993 3.2993 3.3279 3.3279 3.4707 3.4707 3.8276 3.8276 4.6281 4.6281 4.7612 4.7612 5.0535 5.0535 5.5768 5.5768 5.7140 5.7140 6.0635 6.0635 6.2513 6.2513 6.3551 6.3551 6.9275 6.9275 7.2146 7.2146 7.3051 7.3051 7.5317 7.5317 9.1779 9.1779 10.1849 10.1849 k = 0.0000 0.0000 0.0000 ( 6731 PWs) bands (ev): -6.8340 -6.8340 -6.0300 -6.0300 -5.9062 -5.9062 -5.8189 -5.8189 -5.6208 -5.6208 -5.5365 -5.5365 -5.5265 -5.5265 -5.3613 -5.3613 -3.4732 -3.4732 -3.4529 -3.4529 -3.4434 -3.4434 -3.3944 -3.3944 -3.3704 -3.3704 -3.3364 -3.3364 0.6133 0.6133 1.4878 1.4878 2.0088 2.0088 2.5429 2.5429 2.6293 2.6293 2.9142 2.9142 3.0463 3.0463 3.0761 3.0761 3.2958 3.2958 3.3252 3.3252 3.4675 3.4675 3.8286 3.8286 4.6312 4.6312 4.7586 4.7586 5.0538 5.0538 5.5785 5.5785 5.7115 5.7115 6.0628 6.0628 6.2510 6.2510 6.3547 6.3547 6.9257 6.9257 7.2135 7.2135 7.3046 7.3046 7.5326 7.5326 9.1804 9.1804 10.1915 10.1915 Writing output data file TlFeS2.save init_run : 0.55s CPU 0.72s WALL ( 1 calls) electrons : 331.58s CPU 335.16s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 331.58s CPU 335.15s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.14s CPU 0.18s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.15s WALL ( 283 calls) cegterg : 298.25s CPU 300.92s WALL ( 317 calls) Called by sum_band: Called by *egterg: h_psi : 176.14s CPU 177.92s WALL ( 5657 calls) s_psi : 21.96s CPU 21.94s WALL ( 5657 calls) g_psi : 0.41s CPU 0.45s WALL ( 5057 calls) cdiaghg : 87.75s CPU 88.92s WALL ( 5340 calls) cegterg:over : 15.02s CPU 15.00s WALL ( 5057 calls) cegterg:upda : 12.13s CPU 12.13s WALL ( 5057 calls) cegterg:last : 6.36s CPU 6.38s WALL ( 883 calls) cdiaghg:chol : 5.26s CPU 5.29s WALL ( 5340 calls) cdiaghg:inve : 3.72s CPU 3.89s WALL ( 5340 calls) cdiaghg:para : 6.77s CPU 6.87s WALL ( 10680 calls) Called by h_psi: h_psi:vloc : 143.34s CPU 144.82s WALL ( 5657 calls) h_psi:vnl : 32.24s CPU 32.59s WALL ( 5657 calls) add_vuspsi : 18.13s CPU 18.04s WALL ( 5657 calls) General routines calbec : 14.08s CPU 14.53s WALL ( 5657 calls) fft : 0.03s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 135.53s CPU 136.90s WALL ( 972856 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.26s CPU 0.38s WALL ( 566 calls) Parallel routines fft_scatter : 39.48s CPU 39.55s WALL ( 972879 calls) PWSCF : 6m 0.24s CPU 6m20.43s WALL This run was terminated on: 18:26:43 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=