Program PWSCF v.5.1.1 starts on 9Jun2016 at 9:16:49 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./InAgS2.save/ file In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 4D 4D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 58 49 13 1406 1084 162 Max 59 50 14 1409 1111 166 Sum 2807 2385 669 67549 52705 7889 bravais-lattice index = 14 lattice parameter (alat) = 13.0844 a.u. unit-cell volume = 1248.8409 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 217.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.084352 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.655774 celldm(5)= -0.655774 celldm(6)= 0.311549 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.311549 0.950230 0.000000 ) a(3) = ( -0.655774 -0.475115 0.586708 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.327866 0.852213 ) b(2) = ( 0.000000 1.052377 0.852213 ) b(3) = ( 0.000000 0.000000 1.704427 ) PseudoPot. # 1 for S read from file: /home/autes/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 In read from file: /home/autes/Pseudo/In.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 52ff8a85f9af3f41268f91f861ab85bf 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 1241 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 Ag read from file: /home/autes/Pseudo/Ag.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 30ab375624a706b88a092e30a79375fd Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1237 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) In 13.00 114.81800 In( 1.00) Ag 11.00 107.86820 Ag( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) f =( 0.2500000 ) ( 0 1 0 ) ( -0.2500000 ) ( -1 -1 -1 ) ( -0.5000000 ) cart. s( 2) = ( 1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -0.2933538 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 273 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 2) = ( 0.0000000 0.0000000 0.0218516), wk = 0.0036630 k( 3) = ( 0.0000000 0.0000000 0.0437033), wk = 0.0036630 k( 4) = ( 0.0000000 0.0000000 0.0655549), wk = 0.0036630 k( 5) = ( 0.0000000 0.0000000 0.0874065), wk = 0.0036630 k( 6) = ( 0.0000000 0.0000000 0.1092581), wk = 0.0036630 k( 7) = ( 0.0000000 0.0000000 0.1311098), wk = 0.0036630 k( 8) = ( 0.0000000 0.0000000 0.1529614), wk = 0.0036630 k( 9) = ( 0.0000000 0.0000000 0.1748130), wk = 0.0036630 k( 10) = ( 0.0000000 0.0000000 0.1966646), wk = 0.0036630 k( 11) = ( 0.0000000 0.0000000 0.2185162), wk = 0.0036630 k( 12) = ( 0.0000000 0.0000000 0.2403679), wk = 0.0036630 k( 13) = ( 0.0000000 0.0000000 0.2622195), wk = 0.0036630 k( 14) = ( 0.0000000 0.0000000 0.2840711), wk = 0.0036630 k( 15) = ( 0.0000000 0.0000000 0.3059227), wk = 0.0036630 k( 16) = ( 0.0000000 0.0000000 0.3277744), wk = 0.0036630 k( 17) = ( 0.0000000 0.0000000 0.3496260), wk = 0.0036630 k( 18) = ( 0.0000000 0.0000000 0.3714776), wk = 0.0036630 k( 19) = ( 0.0000000 0.0000000 0.3933292), wk = 0.0036630 k( 20) = ( 0.0000000 0.0000000 0.4151809), wk = 0.0036630 k( 21) = ( 0.0000000 0.0000000 0.4370325), wk = 0.0036630 k( 22) = ( 0.0000000 0.0000000 0.4588841), wk = 0.0036630 k( 23) = ( 0.0000000 0.0000000 0.4807357), wk = 0.0036630 k( 24) = ( 0.0000000 0.0000000 0.5025874), wk = 0.0036630 k( 25) = ( 0.0000000 0.0000000 0.5244390), wk = 0.0036630 k( 26) = ( 0.0000000 0.0000000 0.5462906), wk = 0.0036630 k( 27) = ( 0.0000000 0.0000000 0.5681422), wk = 0.0036630 k( 28) = ( 0.0000000 0.0000000 0.5899939), wk = 0.0036630 k( 29) = ( 0.0000000 0.0000000 0.6118455), wk = 0.0036630 k( 30) = ( 0.0000000 0.0000000 0.6336971), wk = 0.0036630 k( 31) = ( 0.0000000 0.0000000 0.6555487), wk = 0.0036630 k( 32) = ( 0.0000000 0.0000000 0.6774004), wk = 0.0036630 k( 33) = ( 0.0000000 0.0000000 0.6992520), wk = 0.0036630 k( 34) = ( 0.0000000 0.0000000 0.7211036), wk = 0.0036630 k( 35) = ( 0.0000000 0.0000000 0.7429552), wk = 0.0036630 k( 36) = ( 0.0000000 0.0000000 0.7648069), wk = 0.0036630 k( 37) = ( 0.0000000 0.0000000 0.7866585), wk = 0.0036630 k( 38) = ( 0.0000000 0.0000000 0.8085101), wk = 0.0036630 k( 39) = ( 0.0000000 0.0000000 0.8303617), wk = 0.0036630 k( 40) = ( 0.0000000 0.0000000 0.8522134), wk = 0.0036630 k( 41) = ( 0.0000000 0.0000000 0.8522134), wk = 0.0036630 k( 42) = ( -0.0119299 0.0164661 0.8522134), wk = 0.0036630 k( 43) = ( -0.0238598 0.0329323 0.8522134), wk = 0.0036630 k( 44) = ( -0.0357897 0.0493984 0.8522134), wk = 0.0036630 k( 45) = ( -0.0477195 0.0658646 0.8522134), wk = 0.0036630 k( 46) = ( -0.0596494 0.0823307 0.8522134), wk = 0.0036630 k( 47) = ( -0.0715793 0.0987968 0.8522134), wk = 0.0036630 k( 48) = ( -0.0835092 0.1152630 0.8522134), wk = 0.0036630 k( 49) = ( -0.0954391 0.1317291 0.8522134), wk = 0.0036630 k( 50) = ( -0.1073690 0.1481953 0.8522134), wk = 0.0036630 k( 51) = ( -0.1192989 0.1646614 0.8522134), wk = 0.0036630 k( 52) = ( -0.1312287 0.1811275 0.8522134), wk = 0.0036630 k( 53) = ( -0.1312287 0.1811275 0.8522134), wk = 0.0036630 k( 54) = ( -0.1400090 0.1932464 0.8372480), wk = 0.0036630 k( 55) = ( -0.1487893 0.2053653 0.8222827), wk = 0.0036630 k( 56) = ( -0.1575696 0.2174843 0.8073174), wk = 0.0036630 k( 57) = ( -0.1663498 0.2296031 0.7923521), wk = 0.0036630 k( 58) = ( -0.1751301 0.2417220 0.7773867), wk = 0.0036630 k( 59) = ( -0.1839104 0.2538410 0.7624214), wk = 0.0036630 k( 60) = ( -0.1926906 0.2659599 0.7474561), wk = 0.0036630 k( 61) = ( -0.2014709 0.2780788 0.7324908), wk = 0.0036630 k( 62) = ( -0.2102511 0.2901977 0.7175255), wk = 0.0036630 k( 63) = ( -0.2190314 0.3023166 0.7025601), wk = 0.0036630 k( 64) = ( -0.2278117 0.3144355 0.6875948), wk = 0.0036630 k( 65) = ( -0.2365920 0.3265544 0.6726295), wk = 0.0036630 k( 66) = ( -0.2453722 0.3386733 0.6576642), wk = 0.0036630 k( 67) = ( -0.2541525 0.3507922 0.6426988), wk = 0.0036630 k( 68) = ( -0.2629328 0.3629111 0.6277335), wk = 0.0036630 k( 69) = ( -0.2717130 0.3750300 0.6127682), wk = 0.0036630 k( 70) = ( -0.2804933 0.3871489 0.5978029), wk = 0.0036630 k( 71) = ( -0.2892736 0.3992678 0.5828375), wk = 0.0036630 k( 72) = ( -0.2980538 0.4113867 0.5678722), wk = 0.0036630 k( 73) = ( -0.3068341 0.4235056 0.5529069), wk = 0.0036630 k( 74) = ( -0.3156144 0.4356245 0.5379416), wk = 0.0036630 k( 75) = ( -0.3156144 0.4356245 0.5379416), wk = 0.0036630 k( 76) = ( -0.3065968 0.4231781 0.5225718), wk = 0.0036630 k( 77) = ( -0.2975793 0.4107317 0.5072020), wk = 0.0036630 k( 78) = ( -0.2885617 0.3982853 0.4918323), wk = 0.0036630 k( 79) = ( -0.2795442 0.3858388 0.4764625), wk = 0.0036630 k( 80) = ( -0.2705266 0.3733924 0.4610928), wk = 0.0036630 k( 81) = ( -0.2615091 0.3609460 0.4457230), wk = 0.0036630 k( 82) = ( -0.2524915 0.3484996 0.4303533), wk = 0.0036630 k( 83) = ( -0.2434739 0.3360532 0.4149835), wk = 0.0036630 k( 84) = ( -0.2344564 0.3236068 0.3996137), wk = 0.0036630 k( 85) = ( -0.2254388 0.3111604 0.3842440), wk = 0.0036630 k( 86) = ( -0.2164213 0.2987139 0.3688742), wk = 0.0036630 k( 87) = ( -0.2074037 0.2862675 0.3535045), wk = 0.0036630 k( 88) = ( -0.1983862 0.2738211 0.3381347), wk = 0.0036630 k( 89) = ( -0.1893686 0.2613747 0.3227649), wk = 0.0036630 k( 90) = ( -0.1803511 0.2489283 0.3073952), wk = 0.0036630 k( 91) = ( -0.1713335 0.2364819 0.2920254), wk = 0.0036630 k( 92) = ( -0.1623160 0.2240355 0.2766557), wk = 0.0036630 k( 93) = ( -0.1532984 0.2115890 0.2612859), wk = 0.0036630 k( 94) = ( -0.1442809 0.1991426 0.2459162), wk = 0.0036630 k( 95) = ( -0.1352633 0.1866962 0.2305464), wk = 0.0036630 k( 96) = ( -0.1262457 0.1742498 0.2151766), wk = 0.0036630 k( 97) = ( -0.1172282 0.1618034 0.1998069), wk = 0.0036630 k( 98) = ( -0.1082106 0.1493570 0.1844371), wk = 0.0036630 k( 99) = ( -0.0991931 0.1369106 0.1690674), wk = 0.0036630 k( 100) = ( -0.0901755 0.1244641 0.1536976), wk = 0.0036630 k( 101) = ( -0.0811580 0.1120177 0.1383278), wk = 0.0036630 k( 102) = ( -0.0721404 0.0995713 0.1229581), wk = 0.0036630 k( 103) = ( -0.0631229 0.0871249 0.1075883), wk = 0.0036630 k( 104) = ( -0.0541053 0.0746785 0.0922186), wk = 0.0036630 k( 105) = ( -0.0450878 0.0622321 0.0768488), wk = 0.0036630 k( 106) = ( -0.0360702 0.0497857 0.0614790), wk = 0.0036630 k( 107) = ( -0.0270527 0.0373392 0.0461093), wk = 0.0036630 k( 108) = ( -0.0180351 0.0248928 0.0307395), wk = 0.0036630 k( 109) = ( -0.0090175 0.0124464 0.0153698), wk = 0.0036630 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 112) = ( 0.0172414 0.0124916 0.0000000), wk = 0.0036630 k( 113) = ( 0.0344828 0.0249831 0.0000000), wk = 0.0036630 k( 114) = ( 0.0517241 0.0374747 0.0000000), wk = 0.0036630 k( 115) = ( 0.0689655 0.0499662 0.0000000), wk = 0.0036630 k( 116) = ( 0.0862069 0.0624578 0.0000000), wk = 0.0036630 k( 117) = ( 0.1034483 0.0749493 0.0000000), wk = 0.0036630 k( 118) = ( 0.1206897 0.0874409 0.0000000), wk = 0.0036630 k( 119) = ( 0.1379310 0.0999324 0.0000000), wk = 0.0036630 k( 120) = ( 0.1551724 0.1124240 0.0000000), wk = 0.0036630 k( 121) = ( 0.1724138 0.1249155 0.0000000), wk = 0.0036630 k( 122) = ( 0.1896552 0.1374071 0.0000000), wk = 0.0036630 k( 123) = ( 0.2068966 0.1498987 0.0000000), wk = 0.0036630 k( 124) = ( 0.2241379 0.1623902 -0.0000000), wk = 0.0036630 k( 125) = ( 0.2413793 0.1748818 0.0000000), wk = 0.0036630 k( 126) = ( 0.2586207 0.1873733 0.0000000), wk = 0.0036630 k( 127) = ( 0.2758621 0.1998649 0.0000000), wk = 0.0036630 k( 128) = ( 0.2931034 0.2123564 0.0000000), wk = 0.0036630 k( 129) = ( 0.3103448 0.2248480 0.0000000), wk = 0.0036630 k( 130) = ( 0.3275862 0.2373395 -0.0000000), wk = 0.0036630 k( 131) = ( 0.3448276 0.2498311 0.0000000), wk = 0.0036630 k( 132) = ( 0.3620690 0.2623226 0.0000000), wk = 0.0036630 k( 133) = ( 0.3793103 0.2748142 0.0000000), wk = 0.0036630 k( 134) = ( 0.3965517 0.2873057 0.0000000), wk = 0.0036630 k( 135) = ( 0.4137931 0.2997973 0.0000000), wk = 0.0036630 k( 136) = ( 0.4310345 0.3122889 0.0000000), wk = 0.0036630 k( 137) = ( 0.4482759 0.3247804 -0.0000000), wk = 0.0036630 k( 138) = ( 0.4655172 0.3372720 0.0000000), wk = 0.0036630 k( 139) = ( 0.4827586 0.3497635 0.0000000), wk = 0.0036630 k( 140) = ( 0.5000000 0.3622551 0.0000000), wk = 0.0036630 k( 141) = ( 0.5000000 0.3622551 0.0000000), wk = 0.0036630 k( 142) = ( 0.4912197 0.3743740 0.0149653), wk = 0.0036630 k( 143) = ( 0.4824395 0.3864929 0.0299307), wk = 0.0036630 k( 144) = ( 0.4736592 0.3986118 0.0448960), wk = 0.0036630 k( 145) = ( 0.4648789 0.4107307 0.0598613), wk = 0.0036630 k( 146) = ( 0.4560987 0.4228496 0.0748266), wk = 0.0036630 k( 147) = ( 0.4473184 0.4349685 0.0897919), wk = 0.0036630 k( 148) = ( 0.4385381 0.4470874 0.1047573), wk = 0.0036630 k( 149) = ( 0.4297579 0.4592063 0.1197226), wk = 0.0036630 k( 150) = ( 0.4209776 0.4713252 0.1346879), wk = 0.0036630 k( 151) = ( 0.4121973 0.4834441 0.1496532), wk = 0.0036630 k( 152) = ( 0.4034170 0.4955630 0.1646186), wk = 0.0036630 k( 153) = ( 0.3946368 0.5076819 0.1795839), wk = 0.0036630 k( 154) = ( 0.3858565 0.5198008 0.1945492), wk = 0.0036630 k( 155) = ( 0.3770763 0.5319197 0.2095145), wk = 0.0036630 k( 156) = ( 0.3682960 0.5440386 0.2244799), wk = 0.0036630 k( 157) = ( 0.3595157 0.5561575 0.2394452), wk = 0.0036630 k( 158) = ( 0.3507354 0.5682764 0.2544105), wk = 0.0036630 k( 159) = ( 0.3419552 0.5803953 0.2693758), wk = 0.0036630 k( 160) = ( 0.3331749 0.5925142 0.2843411), wk = 0.0036630 k( 161) = ( 0.3243946 0.6046331 0.2993065), wk = 0.0036630 k( 162) = ( 0.3156144 0.6167520 0.3142718), wk = 0.0036630 k( 163) = ( 0.3156144 0.6167520 0.3142718), wk = 0.0036630 k( 164) = ( 0.2958885 0.6110918 0.3212615), wk = 0.0036630 k( 165) = ( 0.2761626 0.6054316 0.3282512), wk = 0.0036630 k( 166) = ( 0.2564367 0.5997713 0.3352408), wk = 0.0036630 k( 167) = ( 0.2367108 0.5941111 0.3422305), wk = 0.0036630 k( 168) = ( 0.2169849 0.5884509 0.3492202), wk = 0.0036630 k( 169) = ( 0.1972590 0.5827906 0.3562099), wk = 0.0036630 k( 170) = ( 0.1775331 0.5771304 0.3631996), wk = 0.0036630 k( 171) = ( 0.1578072 0.5714701 0.3701892), wk = 0.0036630 k( 172) = ( 0.1380813 0.5658099 0.3771789), wk = 0.0036630 k( 173) = ( 0.1183554 0.5601497 0.3841686), wk = 0.0036630 k( 174) = ( 0.0986295 0.5544894 0.3911583), wk = 0.0036630 k( 175) = ( 0.0789036 0.5488292 0.3981480), wk = 0.0036630 k( 176) = ( 0.0591777 0.5431690 0.4051376), wk = 0.0036630 k( 177) = ( 0.0394518 0.5375087 0.4121273), wk = 0.0036630 k( 178) = ( 0.0197259 0.5318485 0.4191170), wk = 0.0036630 k( 179) = ( 0.0000000 0.5261883 0.4261067), wk = 0.0036630 k( 180) = ( 0.0000000 0.5261883 0.4261067), wk = 0.0036630 k( 181) = ( 0.0089286 0.5138647 0.4413248), wk = 0.0036630 k( 182) = ( 0.0178571 0.5015411 0.4565429), wk = 0.0036630 k( 183) = ( 0.0267857 0.4892175 0.4717610), wk = 0.0036630 k( 184) = ( 0.0357143 0.4768939 0.4869791), wk = 0.0036630 k( 185) = ( 0.0446429 0.4645703 0.5021972), wk = 0.0036630 k( 186) = ( 0.0535714 0.4522467 0.5174153), wk = 0.0036630 k( 187) = ( 0.0625000 0.4399231 0.5326334), wk = 0.0036630 k( 188) = ( 0.0714286 0.4275995 0.5478514), wk = 0.0036630 k( 189) = ( 0.0803571 0.4152759 0.5630695), wk = 0.0036630 k( 190) = ( 0.0892857 0.4029523 0.5782876), wk = 0.0036630 k( 191) = ( 0.0982143 0.3906287 0.5935057), wk = 0.0036630 k( 192) = ( 0.1071429 0.3783051 0.6087238), wk = 0.0036630 k( 193) = ( 0.1160714 0.3659815 0.6239419), wk = 0.0036630 k( 194) = ( 0.1250000 0.3536579 0.6391600), wk = 0.0036630 k( 195) = ( 0.1339286 0.3413343 0.6543781), wk = 0.0036630 k( 196) = ( 0.1428571 0.3290107 0.6695962), wk = 0.0036630 k( 197) = ( 0.1517857 0.3166871 0.6848143), wk = 0.0036630 k( 198) = ( 0.1607143 0.3043635 0.7000324), wk = 0.0036630 k( 199) = ( 0.1696429 0.2920399 0.7152505), wk = 0.0036630 k( 200) = ( 0.1785714 0.2797163 0.7304686), wk = 0.0036630 k( 201) = ( 0.1875000 0.2673927 0.7456867), wk = 0.0036630 k( 202) = ( 0.1964286 0.2550691 0.7609048), wk = 0.0036630 k( 203) = ( 0.2053571 0.2427455 0.7761229), wk = 0.0036630 k( 204) = ( 0.2142857 0.2304219 0.7913410), wk = 0.0036630 k( 205) = ( 0.2232143 0.2180983 0.8065591), wk = 0.0036630 k( 206) = ( 0.2321429 0.2057747 0.8217772), wk = 0.0036630 k( 207) = ( 0.2410714 0.1934511 0.8369953), wk = 0.0036630 k( 208) = ( 0.2500000 0.1811275 0.8522134), wk = 0.0036630 k( 209) = ( 0.2500000 0.1811275 0.8522134), wk = 0.0036630 k( 210) = ( 0.2638889 0.1911902 0.8397873), wk = 0.0036630 k( 211) = ( 0.2777778 0.2012528 0.8273612), wk = 0.0036630 k( 212) = ( 0.2916667 0.2113155 0.8149351), wk = 0.0036630 k( 213) = ( 0.3055556 0.2213781 0.8025090), wk = 0.0036630 k( 214) = ( 0.3194444 0.2314407 0.7900829), wk = 0.0036630 k( 215) = ( 0.3333333 0.2415034 0.7776568), wk = 0.0036630 k( 216) = ( 0.3472222 0.2515660 0.7652307), wk = 0.0036630 k( 217) = ( 0.3611111 0.2616287 0.7528046), wk = 0.0036630 k( 218) = ( 0.3750000 0.2716913 0.7403785), wk = 0.0036630 k( 219) = ( 0.3888889 0.2817540 0.7279524), wk = 0.0036630 k( 220) = ( 0.4027778 0.2918166 0.7155263), wk = 0.0036630 k( 221) = ( 0.4166667 0.3018792 0.7031002), wk = 0.0036630 k( 222) = ( 0.4305556 0.3119419 0.6906741), wk = 0.0036630 k( 223) = ( 0.4444444 0.3220045 0.6782480), wk = 0.0036630 k( 224) = ( 0.4583333 0.3320672 0.6658219), wk = 0.0036630 k( 225) = ( 0.4722222 0.3421298 0.6533958), wk = 0.0036630 k( 226) = ( 0.4861111 0.3521924 0.6409697), wk = 0.0036630 k( 227) = ( 0.5000000 0.3622551 0.6285436), wk = 0.0036630 k( 228) = ( 0.5000000 0.3622551 0.6285436), wk = 0.0036630 k( 229) = ( 0.5000000 0.3622551 0.6068697), wk = 0.0036630 k( 230) = ( 0.5000000 0.3622551 0.5851958), wk = 0.0036630 k( 231) = ( 0.5000000 0.3622551 0.5635218), wk = 0.0036630 k( 232) = ( 0.5000000 0.3622551 0.5418479), wk = 0.0036630 k( 233) = ( 0.5000000 0.3622551 0.5201740), wk = 0.0036630 k( 234) = ( 0.5000000 0.3622551 0.4985001), wk = 0.0036630 k( 235) = ( 0.5000000 0.3622551 0.4768262), wk = 0.0036630 k( 236) = ( 0.5000000 0.3622551 0.4551523), wk = 0.0036630 k( 237) = ( 0.5000000 0.3622551 0.4334783), wk = 0.0036630 k( 238) = ( 0.5000000 0.3622551 0.4118044), wk = 0.0036630 k( 239) = ( 0.5000000 0.3622551 0.3901305), wk = 0.0036630 k( 240) = ( 0.5000000 0.3622551 0.3684566), wk = 0.0036630 k( 241) = ( 0.5000000 0.3622551 0.3467827), wk = 0.0036630 k( 242) = ( 0.5000000 0.3622551 0.3251087), wk = 0.0036630 k( 243) = ( 0.5000000 0.3622551 0.3034348), wk = 0.0036630 k( 244) = ( 0.5000000 0.3622551 0.2817609), wk = 0.0036630 k( 245) = ( 0.5000000 0.3622551 0.2600870), wk = 0.0036630 k( 246) = ( 0.5000000 0.3622551 0.2384131), wk = 0.0036630 k( 247) = ( 0.5000000 0.3622551 0.2167392), wk = 0.0036630 k( 248) = ( 0.5000000 0.3622551 0.1950652), wk = 0.0036630 k( 249) = ( 0.5000000 0.3622551 0.1733913), wk = 0.0036630 k( 250) = ( 0.5000000 0.3622551 0.1517174), wk = 0.0036630 k( 251) = ( 0.5000000 0.3622551 0.1300435), wk = 0.0036630 k( 252) = ( 0.5000000 0.3622551 0.1083696), wk = 0.0036630 k( 253) = ( 0.5000000 0.3622551 0.0866957), wk = 0.0036630 k( 254) = ( 0.5000000 0.3622551 0.0650217), wk = 0.0036630 k( 255) = ( 0.5000000 0.3622551 0.0433478), wk = 0.0036630 k( 256) = ( 0.5000000 0.3622551 0.0216739), wk = 0.0036630 k( 257) = ( 0.5000000 0.3622551 0.0000000), wk = 0.0036630 k( 258) = ( 0.0000000 0.0000000 0.8522134), wk = 0.0036630 k( 259) = ( 0.0166667 0.0120752 0.8522134), wk = 0.0036630 k( 260) = ( 0.0333333 0.0241503 0.8522134), wk = 0.0036630 k( 261) = ( 0.0500000 0.0362255 0.8522134), wk = 0.0036630 k( 262) = ( 0.0666667 0.0483007 0.8522134), wk = 0.0036630 k( 263) = ( 0.0833333 0.0603758 0.8522134), wk = 0.0036630 k( 264) = ( 0.1000000 0.0724510 0.8522134), wk = 0.0036630 k( 265) = ( 0.1166667 0.0845262 0.8522134), wk = 0.0036630 k( 266) = ( 0.1333333 0.0966014 0.8522134), wk = 0.0036630 k( 267) = ( 0.1500000 0.1086765 0.8522134), wk = 0.0036630 k( 268) = ( 0.1666667 0.1207517 0.8522134), wk = 0.0036630 k( 269) = ( 0.1833333 0.1328269 0.8522134), wk = 0.0036630 k( 270) = ( 0.2000000 0.1449020 0.8522134), wk = 0.0036630 k( 271) = ( 0.2166667 0.1569772 0.8522134), wk = 0.0036630 k( 272) = ( 0.2333333 0.1690524 0.8522134), wk = 0.0036630 k( 273) = ( 0.2500000 0.1811275 0.8522134), wk = 0.0036630 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 2) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0036630 k( 3) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0036630 k( 4) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0036630 k( 5) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0036630 k( 6) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0036630 k( 7) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0036630 k( 8) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0036630 k( 9) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0036630 k( 10) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0036630 k( 11) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0036630 k( 12) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0036630 k( 13) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0036630 k( 14) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0036630 k( 15) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0036630 k( 16) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0036630 k( 17) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0036630 k( 18) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0036630 k( 19) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0036630 k( 20) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0036630 k( 21) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0036630 k( 22) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0036630 k( 23) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0036630 k( 24) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0036630 k( 25) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0036630 k( 26) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0036630 k( 27) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0036630 k( 28) = ( 0.0000000 0.0000000 0.3461539), wk = 0.0036630 k( 29) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0036630 k( 30) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0036630 k( 31) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0036630 k( 32) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0036630 k( 33) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0036630 k( 34) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0036630 k( 35) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0036630 k( 36) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0036630 k( 37) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0036630 k( 38) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0036630 k( 39) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0036630 k( 40) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036630 k( 41) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036630 k( 42) = ( -0.0119299 0.0119299 0.5000000), wk = 0.0036630 k( 43) = ( -0.0238598 0.0238598 0.5000000), wk = 0.0036630 k( 44) = ( -0.0357897 0.0357897 0.5000000), wk = 0.0036630 k( 45) = ( -0.0477195 0.0477195 0.5000000), wk = 0.0036630 k( 46) = ( -0.0596494 0.0596494 0.5000000), wk = 0.0036630 k( 47) = ( -0.0715793 0.0715793 0.5000000), wk = 0.0036630 k( 48) = ( -0.0835092 0.0835092 0.5000000), wk = 0.0036630 k( 49) = ( -0.0954391 0.0954391 0.5000000), wk = 0.0036630 k( 50) = ( -0.1073690 0.1073690 0.5000000), wk = 0.0036630 k( 51) = ( -0.1192989 0.1192989 0.5000000), wk = 0.0036630 k( 52) = ( -0.1312287 0.1312287 0.5000000), wk = 0.0036630 k( 53) = ( -0.1312287 0.1312287 0.5000000), wk = 0.0036630 k( 54) = ( -0.1400090 0.1400090 0.4912197), wk = 0.0036630 k( 55) = ( -0.1487893 0.1487893 0.4824395), wk = 0.0036630 k( 56) = ( -0.1575696 0.1575696 0.4736592), wk = 0.0036630 k( 57) = ( -0.1663498 0.1663498 0.4648789), wk = 0.0036630 k( 58) = ( -0.1751301 0.1751301 0.4560987), wk = 0.0036630 k( 59) = ( -0.1839104 0.1839104 0.4473184), wk = 0.0036630 k( 60) = ( -0.1926906 0.1926906 0.4385381), wk = 0.0036630 k( 61) = ( -0.2014709 0.2014709 0.4297579), wk = 0.0036630 k( 62) = ( -0.2102511 0.2102511 0.4209776), wk = 0.0036630 k( 63) = ( -0.2190314 0.2190314 0.4121973), wk = 0.0036630 k( 64) = ( -0.2278117 0.2278117 0.4034170), wk = 0.0036630 k( 65) = ( -0.2365920 0.2365920 0.3946368), wk = 0.0036630 k( 66) = ( -0.2453722 0.2453722 0.3858565), wk = 0.0036630 k( 67) = ( -0.2541525 0.2541525 0.3770763), wk = 0.0036630 k( 68) = ( -0.2629328 0.2629328 0.3682960), wk = 0.0036630 k( 69) = ( -0.2717130 0.2717130 0.3595157), wk = 0.0036630 k( 70) = ( -0.2804933 0.2804933 0.3507354), wk = 0.0036630 k( 71) = ( -0.2892736 0.2892736 0.3419552), wk = 0.0036630 k( 72) = ( -0.2980538 0.2980538 0.3331749), wk = 0.0036630 k( 73) = ( -0.3068341 0.3068341 0.3243946), wk = 0.0036630 k( 74) = ( -0.3156144 0.3156144 0.3156144), wk = 0.0036630 k( 75) = ( -0.3156144 0.3156144 0.3156144), wk = 0.0036630 k( 76) = ( -0.3065968 0.3065968 0.3065968), wk = 0.0036630 k( 77) = ( -0.2975793 0.2975793 0.2975793), wk = 0.0036630 k( 78) = ( -0.2885617 0.2885617 0.2885617), wk = 0.0036630 k( 79) = ( -0.2795442 0.2795442 0.2795442), wk = 0.0036630 k( 80) = ( -0.2705266 0.2705266 0.2705266), wk = 0.0036630 k( 81) = ( -0.2615091 0.2615091 0.2615091), wk = 0.0036630 k( 82) = ( -0.2524915 0.2524915 0.2524915), wk = 0.0036630 k( 83) = ( -0.2434739 0.2434739 0.2434739), wk = 0.0036630 k( 84) = ( -0.2344564 0.2344564 0.2344564), wk = 0.0036630 k( 85) = ( -0.2254388 0.2254388 0.2254388), wk = 0.0036630 k( 86) = ( -0.2164213 0.2164213 0.2164213), wk = 0.0036630 k( 87) = ( -0.2074037 0.2074037 0.2074037), wk = 0.0036630 k( 88) = ( -0.1983862 0.1983862 0.1983862), wk = 0.0036630 k( 89) = ( -0.1893686 0.1893686 0.1893686), wk = 0.0036630 k( 90) = ( -0.1803511 0.1803511 0.1803511), wk = 0.0036630 k( 91) = ( -0.1713335 0.1713335 0.1713335), wk = 0.0036630 k( 92) = ( -0.1623160 0.1623160 0.1623160), wk = 0.0036630 k( 93) = ( -0.1532984 0.1532984 0.1532984), wk = 0.0036630 k( 94) = ( -0.1442809 0.1442809 0.1442809), wk = 0.0036630 k( 95) = ( -0.1352633 0.1352633 0.1352633), wk = 0.0036630 k( 96) = ( -0.1262457 0.1262457 0.1262457), wk = 0.0036630 k( 97) = ( -0.1172282 0.1172282 0.1172282), wk = 0.0036630 k( 98) = ( -0.1082106 0.1082106 0.1082106), wk = 0.0036630 k( 99) = ( -0.0991931 0.0991931 0.0991931), wk = 0.0036630 k( 100) = ( -0.0901755 0.0901755 0.0901755), wk = 0.0036630 k( 101) = ( -0.0811580 0.0811580 0.0811580), wk = 0.0036630 k( 102) = ( -0.0721404 0.0721404 0.0721404), wk = 0.0036630 k( 103) = ( -0.0631229 0.0631229 0.0631229), wk = 0.0036630 k( 104) = ( -0.0541053 0.0541053 0.0541053), wk = 0.0036630 k( 105) = ( -0.0450878 0.0450878 0.0450878), wk = 0.0036630 k( 106) = ( -0.0360702 0.0360702 0.0360702), wk = 0.0036630 k( 107) = ( -0.0270527 0.0270527 0.0270527), wk = 0.0036630 k( 108) = ( -0.0180351 0.0180351 0.0180351), wk = 0.0036630 k( 109) = ( -0.0090175 0.0090175 0.0090175), wk = 0.0036630 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0036630 k( 112) = ( 0.0172414 0.0172414 -0.0172414), wk = 0.0036630 k( 113) = ( 0.0344828 0.0344828 -0.0344828), wk = 0.0036630 k( 114) = ( 0.0517241 0.0517241 -0.0517241), wk = 0.0036630 k( 115) = ( 0.0689655 0.0689655 -0.0689655), wk = 0.0036630 k( 116) = ( 0.0862069 0.0862069 -0.0862069), wk = 0.0036630 k( 117) = ( 0.1034483 0.1034483 -0.1034483), wk = 0.0036630 k( 118) = ( 0.1206897 0.1206897 -0.1206897), wk = 0.0036630 k( 119) = ( 0.1379310 0.1379310 -0.1379310), wk = 0.0036630 k( 120) = ( 0.1551724 0.1551724 -0.1551724), wk = 0.0036630 k( 121) = ( 0.1724138 0.1724138 -0.1724138), wk = 0.0036630 k( 122) = ( 0.1896552 0.1896552 -0.1896552), wk = 0.0036630 k( 123) = ( 0.2068966 0.2068966 -0.2068966), wk = 0.0036630 k( 124) = ( 0.2241379 0.2241379 -0.2241379), wk = 0.0036630 k( 125) = ( 0.2413793 0.2413793 -0.2413793), wk = 0.0036630 k( 126) = ( 0.2586207 0.2586207 -0.2586207), wk = 0.0036630 k( 127) = ( 0.2758621 0.2758621 -0.2758621), wk = 0.0036630 k( 128) = ( 0.2931034 0.2931034 -0.2931034), wk = 0.0036630 k( 129) = ( 0.3103448 0.3103448 -0.3103448), wk = 0.0036630 k( 130) = ( 0.3275862 0.3275862 -0.3275862), wk = 0.0036630 k( 131) = ( 0.3448276 0.3448276 -0.3448276), wk = 0.0036630 k( 132) = ( 0.3620690 0.3620690 -0.3620690), wk = 0.0036630 k( 133) = ( 0.3793103 0.3793103 -0.3793103), wk = 0.0036630 k( 134) = ( 0.3965517 0.3965517 -0.3965517), wk = 0.0036630 k( 135) = ( 0.4137931 0.4137931 -0.4137931), wk = 0.0036630 k( 136) = ( 0.4310345 0.4310345 -0.4310345), wk = 0.0036630 k( 137) = ( 0.4482759 0.4482759 -0.4482759), wk = 0.0036630 k( 138) = ( 0.4655172 0.4655172 -0.4655172), wk = 0.0036630 k( 139) = ( 0.4827586 0.4827586 -0.4827586), wk = 0.0036630 k( 140) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036630 k( 141) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036630 k( 142) = ( 0.4912197 0.5087803 -0.4912197), wk = 0.0036630 k( 143) = ( 0.4824395 0.5175605 -0.4824395), wk = 0.0036630 k( 144) = ( 0.4736592 0.5263408 -0.4736592), wk = 0.0036630 k( 145) = ( 0.4648789 0.5351211 -0.4648789), wk = 0.0036630 k( 146) = ( 0.4560987 0.5439013 -0.4560987), wk = 0.0036630 k( 147) = ( 0.4473184 0.5526816 -0.4473184), wk = 0.0036630 k( 148) = ( 0.4385381 0.5614619 -0.4385381), wk = 0.0036630 k( 149) = ( 0.4297579 0.5702421 -0.4297579), wk = 0.0036630 k( 150) = ( 0.4209776 0.5790224 -0.4209776), wk = 0.0036630 k( 151) = ( 0.4121973 0.5878027 -0.4121973), wk = 0.0036630 k( 152) = ( 0.4034170 0.5965829 -0.4034171), wk = 0.0036630 k( 153) = ( 0.3946368 0.6053632 -0.3946368), wk = 0.0036630 k( 154) = ( 0.3858565 0.6141435 -0.3858565), wk = 0.0036630 k( 155) = ( 0.3770763 0.6229237 -0.3770763), wk = 0.0036630 k( 156) = ( 0.3682960 0.6317040 -0.3682960), wk = 0.0036630 k( 157) = ( 0.3595157 0.6404843 -0.3595157), wk = 0.0036630 k( 158) = ( 0.3507354 0.6492646 -0.3507354), wk = 0.0036630 k( 159) = ( 0.3419552 0.6580448 -0.3419552), wk = 0.0036630 k( 160) = ( 0.3331749 0.6668251 -0.3331749), wk = 0.0036630 k( 161) = ( 0.3243946 0.6756054 -0.3243946), wk = 0.0036630 k( 162) = ( 0.3156144 0.6843856 -0.3156144), wk = 0.0036630 k( 163) = ( 0.3156144 0.6843856 -0.3156144), wk = 0.0036630 k( 164) = ( 0.2958885 0.6728615 -0.2958885), wk = 0.0036630 k( 165) = ( 0.2761626 0.6613374 -0.2761626), wk = 0.0036630 k( 166) = ( 0.2564367 0.6498133 -0.2564367), wk = 0.0036630 k( 167) = ( 0.2367108 0.6382892 -0.2367108), wk = 0.0036630 k( 168) = ( 0.2169849 0.6267651 -0.2169849), wk = 0.0036630 k( 169) = ( 0.1972590 0.6152410 -0.1972590), wk = 0.0036630 k( 170) = ( 0.1775331 0.6037169 -0.1775331), wk = 0.0036630 k( 171) = ( 0.1578072 0.5921928 -0.1578072), wk = 0.0036630 k( 172) = ( 0.1380813 0.5806687 -0.1380813), wk = 0.0036630 k( 173) = ( 0.1183554 0.5691446 -0.1183554), wk = 0.0036630 k( 174) = ( 0.0986295 0.5576205 -0.0986295), wk = 0.0036630 k( 175) = ( 0.0789036 0.5460964 -0.0789036), wk = 0.0036630 k( 176) = ( 0.0591777 0.5345723 -0.0591777), wk = 0.0036630 k( 177) = ( 0.0394518 0.5230482 -0.0394518), wk = 0.0036630 k( 178) = ( 0.0197259 0.5115241 -0.0197259), wk = 0.0036630 k( 179) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036630 k( 180) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0036630 k( 181) = ( 0.0089286 0.4910714 0.0089286), wk = 0.0036630 k( 182) = ( 0.0178571 0.4821429 0.0178571), wk = 0.0036630 k( 183) = ( 0.0267857 0.4732143 0.0267857), wk = 0.0036630 k( 184) = ( 0.0357143 0.4642857 0.0357143), wk = 0.0036630 k( 185) = ( 0.0446429 0.4553571 0.0446429), wk = 0.0036630 k( 186) = ( 0.0535714 0.4464286 0.0535714), wk = 0.0036630 k( 187) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0036630 k( 188) = ( 0.0714286 0.4285714 0.0714286), wk = 0.0036630 k( 189) = ( 0.0803571 0.4196429 0.0803571), wk = 0.0036630 k( 190) = ( 0.0892857 0.4107143 0.0892857), wk = 0.0036630 k( 191) = ( 0.0982143 0.4017857 0.0982143), wk = 0.0036630 k( 192) = ( 0.1071429 0.3928571 0.1071429), wk = 0.0036630 k( 193) = ( 0.1160714 0.3839286 0.1160714), wk = 0.0036630 k( 194) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0036630 k( 195) = ( 0.1339286 0.3660714 0.1339286), wk = 0.0036630 k( 196) = ( 0.1428571 0.3571429 0.1428571), wk = 0.0036630 k( 197) = ( 0.1517857 0.3482143 0.1517857), wk = 0.0036630 k( 198) = ( 0.1607143 0.3392857 0.1607143), wk = 0.0036630 k( 199) = ( 0.1696429 0.3303571 0.1696429), wk = 0.0036630 k( 200) = ( 0.1785714 0.3214286 0.1785714), wk = 0.0036630 k( 201) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0036630 k( 202) = ( 0.1964286 0.3035714 0.1964286), wk = 0.0036630 k( 203) = ( 0.2053571 0.2946429 0.2053571), wk = 0.0036630 k( 204) = ( 0.2142857 0.2857143 0.2142857), wk = 0.0036630 k( 205) = ( 0.2232143 0.2767857 0.2232143), wk = 0.0036630 k( 206) = ( 0.2321429 0.2678571 0.2321429), wk = 0.0036630 k( 207) = ( 0.2410714 0.2589286 0.2410714), wk = 0.0036630 k( 208) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036630 k( 209) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036630 k( 210) = ( 0.2638889 0.2638889 0.2288206), wk = 0.0036630 k( 211) = ( 0.2777778 0.2777778 0.2076412), wk = 0.0036630 k( 212) = ( 0.2916667 0.2916667 0.1864619), wk = 0.0036630 k( 213) = ( 0.3055556 0.3055556 0.1652825), wk = 0.0036630 k( 214) = ( 0.3194444 0.3194444 0.1441031), wk = 0.0036630 k( 215) = ( 0.3333333 0.3333333 0.1229238), wk = 0.0036630 k( 216) = ( 0.3472222 0.3472222 0.1017444), wk = 0.0036630 k( 217) = ( 0.3611111 0.3611111 0.0805650), wk = 0.0036630 k( 218) = ( 0.3750000 0.3750000 0.0593856), wk = 0.0036630 k( 219) = ( 0.3888889 0.3888889 0.0382062), wk = 0.0036630 k( 220) = ( 0.4027778 0.4027778 0.0170269), wk = 0.0036630 k( 221) = ( 0.4166667 0.4166667 -0.0041525), wk = 0.0036630 k( 222) = ( 0.4305556 0.4305556 -0.0253319), wk = 0.0036630 k( 223) = ( 0.4444444 0.4444444 -0.0465112), wk = 0.0036630 k( 224) = ( 0.4583333 0.4583333 -0.0676906), wk = 0.0036630 k( 225) = ( 0.4722222 0.4722222 -0.0888700), wk = 0.0036630 k( 226) = ( 0.4861111 0.4861111 -0.1100494), wk = 0.0036630 k( 227) = ( 0.5000000 0.5000000 -0.1312287), wk = 0.0036630 k( 228) = ( 0.5000000 0.5000000 -0.1312287), wk = 0.0036630 k( 229) = ( 0.5000000 0.5000000 -0.1439450), wk = 0.0036630 k( 230) = ( 0.5000000 0.5000000 -0.1566612), wk = 0.0036630 k( 231) = ( 0.5000000 0.5000000 -0.1693775), wk = 0.0036630 k( 232) = ( 0.5000000 0.5000000 -0.1820937), wk = 0.0036630 k( 233) = ( 0.5000000 0.5000000 -0.1948100), wk = 0.0036630 k( 234) = ( 0.5000000 0.5000000 -0.2075262), wk = 0.0036630 k( 235) = ( 0.5000000 0.5000000 -0.2202425), wk = 0.0036630 k( 236) = ( 0.5000000 0.5000000 -0.2329587), wk = 0.0036630 k( 237) = ( 0.5000000 0.5000000 -0.2456750), wk = 0.0036630 k( 238) = ( 0.5000000 0.5000000 -0.2583912), wk = 0.0036630 k( 239) = ( 0.5000000 0.5000000 -0.2711075), wk = 0.0036630 k( 240) = ( 0.5000000 0.5000000 -0.2838237), wk = 0.0036630 k( 241) = ( 0.5000000 0.5000000 -0.2965400), wk = 0.0036630 k( 242) = ( 0.5000000 0.5000000 -0.3092563), wk = 0.0036630 k( 243) = ( 0.5000000 0.5000000 -0.3219725), wk = 0.0036630 k( 244) = ( 0.5000000 0.5000000 -0.3346887), wk = 0.0036630 k( 245) = ( 0.5000000 0.5000000 -0.3474050), wk = 0.0036630 k( 246) = ( 0.5000000 0.5000000 -0.3601213), wk = 0.0036630 k( 247) = ( 0.5000000 0.5000000 -0.3728375), wk = 0.0036630 k( 248) = ( 0.5000000 0.5000000 -0.3855537), wk = 0.0036630 k( 249) = ( 0.5000000 0.5000000 -0.3982700), wk = 0.0036630 k( 250) = ( 0.5000000 0.5000000 -0.4109862), wk = 0.0036630 k( 251) = ( 0.5000000 0.5000000 -0.4237025), wk = 0.0036630 k( 252) = ( 0.5000000 0.5000000 -0.4364188), wk = 0.0036630 k( 253) = ( 0.5000000 0.5000000 -0.4491350), wk = 0.0036630 k( 254) = ( 0.5000000 0.5000000 -0.4618512), wk = 0.0036630 k( 255) = ( 0.5000000 0.5000000 -0.4745675), wk = 0.0036630 k( 256) = ( 0.5000000 0.5000000 -0.4872838), wk = 0.0036630 k( 257) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0036630 k( 258) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0036630 k( 259) = ( 0.0166667 0.0166667 0.4833333), wk = 0.0036630 k( 260) = ( 0.0333333 0.0333333 0.4666667), wk = 0.0036630 k( 261) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0036630 k( 262) = ( 0.0666667 0.0666667 0.4333333), wk = 0.0036630 k( 263) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0036630 k( 264) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0036630 k( 265) = ( 0.1166667 0.1166667 0.3833333), wk = 0.0036630 k( 266) = ( 0.1333333 0.1333333 0.3666667), wk = 0.0036630 k( 267) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0036630 k( 268) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0036630 k( 269) = ( 0.1833333 0.1833333 0.3166667), wk = 0.0036630 k( 270) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0036630 k( 271) = ( 0.2166667 0.2166667 0.2833333), wk = 0.0036630 k( 272) = ( 0.2333333 0.2333333 0.2666667), wk = 0.0036630 k( 273) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0036630 Dense grid: 67549 G-vectors FFT dimensions: ( 64, 64, 64) Smooth grid: 52705 G-vectors FFT dimensions: ( 60, 60, 60) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.37 Mb ( 280, 86) NL pseudopotentials 0.58 Mb ( 140, 272) Each V/rho on FFT grid 0.12 Mb ( 8192) Each G-vector array 0.01 Mb ( 1407) G-vector shells 0.01 Mb ( 660) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.47 Mb ( 280, 344) Each subspace H/S matrix 1.81 Mb ( 344, 344) Each matrix 0.71 Mb ( 272, 2, 86) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./InAgS2.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 49.3 secs Computing kpt #: 2 total cpu time spent up to now is 55.6 secs Computing kpt #: 3 total cpu time spent up to now is 62.0 secs Computing kpt #: 4 total cpu time spent up to now is 68.4 secs Computing kpt #: 5 total cpu time spent up to now is 74.7 secs Computing kpt #: 6 total cpu time spent up to now is 80.9 secs Computing kpt #: 7 total cpu time spent up to now is 87.2 secs Computing kpt #: 8 total cpu time spent up to now is 94.2 secs Computing kpt #: 9 total cpu time spent up to now is 100.6 secs Computing kpt #: 10 total cpu time spent up to now is 107.0 secs Computing kpt #: 11 total cpu time spent up to now is 115.5 secs Computing kpt #: 12 total cpu time spent up to now is 122.0 secs Computing kpt #: 13 total cpu time spent up to now is 128.4 secs Computing kpt #: 14 total cpu time spent up to now is 134.8 secs Computing kpt #: 15 total cpu time spent up to now is 141.0 secs Computing kpt #: 16 total cpu time spent up to now is 147.3 secs Computing kpt #: 17 total cpu time spent up to now is 153.7 secs Computing kpt #: 18 total cpu time spent up to now is 159.9 secs Computing kpt #: 19 total cpu time spent up to now is 166.2 secs Computing kpt #: 20 total cpu time spent up to now is 172.8 secs Computing kpt #: 21 total cpu time spent up to now is 180.1 secs Computing kpt #: 22 total cpu time spent up to now is 187.2 secs Computing kpt #: 23 total cpu time spent up to now is 194.1 secs Computing kpt #: 24 total cpu time spent up to now is 200.6 secs Computing kpt #: 25 total cpu time spent up to now is 207.4 secs Computing kpt #: 26 total cpu time spent up to now is 214.3 secs Computing kpt #: 27 total cpu time spent up to now is 220.9 secs Computing kpt #: 28 total cpu time spent up to now is 227.7 secs Computing kpt #: 29 total cpu time spent up to now is 235.1 secs Computing kpt #: 30 total cpu time spent up to now is 242.4 secs Computing kpt #: 31 total cpu time spent up to now is 250.1 secs Computing kpt #: 32 total cpu time spent up to now is 258.0 secs Computing kpt #: 33 total cpu time spent up to now is 265.8 secs Computing kpt #: 34 total cpu time spent up to now is 273.9 secs Computing kpt #: 35 total cpu time spent up to now is 281.8 secs Computing kpt #: 36 total cpu time spent up to now is 289.6 secs Computing kpt #: 37 total cpu time spent up to now is 296.1 secs Computing kpt #: 38 total cpu time spent up to now is 302.8 secs Computing kpt #: 39 total cpu time spent up to now is 309.3 secs Computing kpt #: 40 total cpu time spent up to now is 315.7 secs Computing kpt #: 41 total cpu time spent up to now is 322.4 secs Computing kpt #: 42 total cpu time spent up to now is 328.9 secs Computing kpt #: 43 total cpu time spent up to now is 335.8 secs Computing kpt #: 44 total cpu time spent up to now is 343.2 secs Computing kpt #: 45 total cpu time spent up to now is 349.9 secs Computing kpt #: 46 total cpu time spent up to now is 356.7 secs Computing kpt #: 47 total cpu time spent up to now is 363.3 secs Computing kpt #: 48 total cpu time spent up to now is 371.0 secs Computing kpt #: 49 total cpu time spent up to now is 377.4 secs Computing kpt #: 50 total cpu time spent up to now is 384.0 secs Computing kpt #: 51 total cpu time spent up to now is 390.6 secs Computing kpt #: 52 total cpu time spent up to now is 397.3 secs Computing kpt #: 53 total cpu time spent up to now is 404.1 secs Computing kpt #: 54 total cpu time spent up to now is 411.5 secs Computing kpt #: 55 total cpu time spent up to now is 418.9 secs Computing kpt #: 56 total cpu time spent up to now is 426.1 secs Computing kpt #: 57 total cpu time spent up to now is 433.6 secs Computing kpt #: 58 total cpu time spent up to now is 440.4 secs Computing kpt #: 59 total cpu time spent up to now is 448.1 secs Computing kpt #: 60 total cpu time spent up to now is 456.7 secs Computing kpt #: 61 total cpu time spent up to now is 464.5 secs Computing kpt #: 62 total cpu time spent up to now is 473.3 secs Computing kpt #: 63 total cpu time spent up to now is 481.5 secs Computing kpt #: 64 total cpu time spent up to now is 488.9 secs Computing kpt #: 65 total cpu time spent up to now is 496.7 secs Computing kpt #: 66 total cpu time spent up to now is 504.3 secs Computing kpt #: 67 total cpu time spent up to now is 511.7 secs Computing kpt #: 68 total cpu time spent up to now is 518.5 secs Computing kpt #: 69 total cpu time spent up to now is 525.1 secs Computing kpt #: 70 total cpu time spent up to now is 531.9 secs Computing kpt #: 71 total cpu time spent up to now is 538.5 secs Computing kpt #: 72 total cpu time spent up to now is 545.1 secs Computing kpt #: 73 total cpu time spent up to now is 551.8 secs Computing kpt #: 74 total cpu time spent up to now is 558.5 secs Computing kpt #: 75 total cpu time spent up to now is 565.8 secs Computing kpt #: 76 total cpu time spent up to now is 572.5 secs Computing kpt #: 77 total cpu time spent up to now is 579.4 secs Computing kpt #: 78 total cpu time spent up to now is 586.2 secs Computing kpt #: 79 total cpu time spent up to now is 592.8 secs Computing kpt #: 80 total cpu time spent up to now is 600.3 secs Computing kpt #: 81 total cpu time spent up to now is 607.4 secs Computing kpt #: 82 total cpu time spent up to now is 615.4 secs Computing kpt #: 83 total cpu time spent up to now is 622.4 secs Computing kpt #: 84 total cpu time spent up to now is 629.5 secs Computing kpt #: 85 total cpu time spent up to now is 636.8 secs Computing kpt #: 86 total cpu time spent up to now is 644.3 secs Computing kpt #: 87 total cpu time spent up to now is 651.2 secs Computing kpt #: 88 total cpu time spent up to now is 658.5 secs Computing kpt #: 89 total cpu time spent up to now is 665.4 secs Computing kpt #: 90 total cpu time spent up to now is 671.9 secs Computing kpt #: 91 total cpu time spent up to now is 678.3 secs Computing kpt #: 92 total cpu time spent up to now is 684.7 secs Computing kpt #: 93 total cpu time spent up to now is 691.2 secs Computing kpt #: 94 total cpu time spent up to now is 698.1 secs Computing kpt #: 95 total cpu time spent up to now is 704.7 secs Computing kpt #: 96 total cpu time spent up to now is 711.9 secs Computing kpt #: 97 total cpu time spent up to now is 720.1 secs Computing kpt #: 98 total cpu time spent up to now is 726.7 secs Computing kpt #: 99 total cpu time spent up to now is 733.2 secs Computing kpt #: 100 total cpu time spent up to now is 739.6 secs Computing kpt #: 101 total cpu time spent up to now is 746.3 secs Computing kpt #: 102 total cpu time spent up to now is 752.9 secs Computing kpt #: 103 total cpu time spent up to now is 759.4 secs Computing kpt #: 104 total cpu time spent up to now is 765.8 secs Computing kpt #: 105 total cpu time spent up to now is 773.1 secs Computing kpt #: 106 total cpu time spent up to now is 779.8 secs Computing kpt #: 107 total cpu time spent up to now is 786.3 secs Computing kpt #: 108 total cpu time spent up to now is 792.8 secs Computing kpt #: 109 total cpu time spent up to now is 799.3 secs Computing kpt #: 110 total cpu time spent up to now is 806.4 secs Computing kpt #: 111 total cpu time spent up to now is 812.9 secs Computing kpt #: 112 total cpu time spent up to now is 819.3 secs Computing kpt #: 113 total cpu time spent up to now is 825.5 secs Computing kpt #: 114 total cpu time spent up to now is 831.7 secs Computing kpt #: 115 total cpu time spent up to now is 838.1 secs Computing kpt #: 116 total cpu time spent up to now is 845.0 secs Computing kpt #: 117 total cpu time spent up to now is 851.9 secs Computing kpt #: 118 total cpu time spent up to now is 859.1 secs Computing kpt #: 119 total cpu time spent up to now is 866.2 secs Computing kpt #: 120 total cpu time spent up to now is 873.0 secs Computing kpt #: 121 total cpu time spent up to now is 879.5 secs Computing kpt #: 122 total cpu time spent up to now is 886.0 secs Computing kpt #: 123 total cpu time spent up to now is 892.9 secs Computing kpt #: 124 total cpu time spent up to now is 899.6 secs Computing kpt #: 125 total cpu time spent up to now is 906.3 secs Computing kpt #: 126 total cpu time spent up to now is 913.2 secs Computing kpt #: 127 total cpu time spent up to now is 920.7 secs Computing kpt #: 128 total cpu time spent up to now is 927.3 secs Computing kpt #: 129 total cpu time spent up to now is 935.1 secs Computing kpt #: 130 total cpu time spent up to now is 941.8 secs Computing kpt #: 131 total cpu time spent up to now is 950.7 secs Computing kpt #: 132 total cpu time spent up to now is 957.8 secs Computing kpt #: 133 total cpu time spent up to now is 964.7 secs Computing kpt #: 134 total cpu time spent up to now is 971.5 secs Computing kpt #: 135 total cpu time spent up to now is 978.7 secs Computing kpt #: 136 total cpu time spent up to now is 986.1 secs Computing kpt #: 137 total cpu time spent up to now is 993.0 secs Computing kpt #: 138 total cpu time spent up to now is 999.6 secs Computing kpt #: 139 total cpu time spent up to now is 1006.6 secs Computing kpt #: 140 total cpu time spent up to now is 1013.4 secs Computing kpt #: 141 total cpu time spent up to now is 1020.3 secs Computing kpt #: 142 total cpu time spent up to now is 1027.8 secs Computing kpt #: 143 total cpu time spent up to now is 1034.8 secs Computing kpt #: 144 total cpu time spent up to now is 1043.1 secs Computing kpt #: 145 total cpu time spent up to now is 1050.4 secs Computing kpt #: 146 total cpu time spent up to now is 1057.3 secs Computing kpt #: 147 total cpu time spent up to now is 1064.5 secs Computing kpt #: 148 total cpu time spent up to now is 1071.7 secs Computing kpt #: 149 total cpu time spent up to now is 1078.4 secs Computing kpt #: 150 total cpu time spent up to now is 1086.3 secs Computing kpt #: 151 total cpu time spent up to now is 1093.4 secs Computing kpt #: 152 total cpu time spent up to now is 1100.9 secs Computing kpt #: 153 total cpu time spent up to now is 1108.6 secs Computing kpt #: 154 total cpu time spent up to now is 1115.7 secs Computing kpt #: 155 total cpu time spent up to now is 1122.7 secs Computing kpt #: 156 total cpu time spent up to now is 1129.8 secs Computing kpt #: 157 total cpu time spent up to now is 1138.2 secs Computing kpt #: 158 total cpu time spent up to now is 1144.9 secs Computing kpt #: 159 total cpu time spent up to now is 1151.5 secs Computing kpt #: 160 total cpu time spent up to now is 1158.7 secs Computing kpt #: 161 total cpu time spent up to now is 1165.6 secs Computing kpt #: 162 total cpu time spent up to now is 1172.3 secs Computing kpt #: 163 total cpu time spent up to now is 1179.2 secs Computing kpt #: 164 total cpu time spent up to now is 1186.3 secs Computing kpt #: 165 total cpu time spent up to now is 1194.2 secs Computing kpt #: 166 total cpu time spent up to now is 1201.4 secs Computing kpt #: 167 total cpu time spent up to now is 1209.1 secs Computing kpt #: 168 total cpu time spent up to now is 1216.3 secs Computing kpt #: 169 total cpu time spent up to now is 1223.2 secs Computing kpt #: 170 total cpu time spent up to now is 1230.3 secs Computing kpt #: 171 total cpu time spent up to now is 1237.5 secs Computing kpt #: 172 total cpu time spent up to now is 1244.9 secs Computing kpt #: 173 total cpu time spent up to now is 1252.0 secs Computing kpt #: 174 total cpu time spent up to now is 1258.6 secs Computing kpt #: 175 total cpu time spent up to now is 1266.4 secs Computing kpt #: 176 total cpu time spent up to now is 1273.6 secs Computing kpt #: 177 total cpu time spent up to now is 1281.1 secs Computing kpt #: 178 total cpu time spent up to now is 1288.9 secs Computing kpt #: 179 total cpu time spent up to now is 1295.9 secs Computing kpt #: 180 total cpu time spent up to now is 1302.8 secs Computing kpt #: 181 total cpu time spent up to now is 1310.4 secs Computing kpt #: 182 total cpu time spent up to now is 1318.5 secs Computing kpt #: 183 total cpu time spent up to now is 1325.7 secs Computing kpt #: 184 total cpu time spent up to now is 1333.5 secs Computing kpt #: 185 total cpu time spent up to now is 1340.3 secs Computing kpt #: 186 total cpu time spent up to now is 1347.8 secs Computing kpt #: 187 total cpu time spent up to now is 1355.2 secs Computing kpt #: 188 total cpu time spent up to now is 1363.2 secs Computing kpt #: 189 total cpu time spent up to now is 1369.9 secs Computing kpt #: 190 total cpu time spent up to now is 1376.9 secs Computing kpt #: 191 total cpu time spent up to now is 1383.4 secs Computing kpt #: 192 total cpu time spent up to now is 1390.3 secs Computing kpt #: 193 total cpu time spent up to now is 1397.0 secs Computing kpt #: 194 total cpu time spent up to now is 1403.9 secs Computing kpt #: 195 total cpu time spent up to now is 1410.5 secs Computing kpt #: 196 total cpu time spent up to now is 1417.6 secs Computing kpt #: 197 total cpu time spent up to now is 1424.6 secs Computing kpt #: 198 total cpu time spent up to now is 1431.4 secs Computing kpt #: 199 total cpu time spent up to now is 1438.4 secs Computing kpt #: 200 total cpu time spent up to now is 1445.0 secs Computing kpt #: 201 total cpu time spent up to now is 1451.5 secs Computing kpt #: 202 total cpu time spent up to now is 1457.9 secs Computing kpt #: 203 total cpu time spent up to now is 1464.6 secs Computing kpt #: 204 total cpu time spent up to now is 1471.3 secs Computing kpt #: 205 total cpu time spent up to now is 1477.8 secs Computing kpt #: 206 total cpu time spent up to now is 1484.8 secs Computing kpt #: 207 total cpu time spent up to now is 1491.6 secs Computing kpt #: 208 total cpu time spent up to now is 1499.4 secs Computing kpt #: 209 total cpu time spent up to now is 1506.1 secs Computing kpt #: 210 total cpu time spent up to now is 1513.9 secs Computing kpt #: 211 total cpu time spent up to now is 1520.5 secs Computing kpt #: 212 total cpu time spent up to now is 1527.3 secs Computing kpt #: 213 total cpu time spent up to now is 1534.0 secs Computing kpt #: 214 total cpu time spent up to now is 1540.9 secs Computing kpt #: 215 total cpu time spent up to now is 1547.6 secs Computing kpt #: 216 total cpu time spent up to now is 1554.0 secs Computing kpt #: 217 total cpu time spent up to now is 1560.7 secs Computing kpt #: 218 total cpu time spent up to now is 1567.4 secs Computing kpt #: 219 total cpu time spent up to now is 1574.1 secs Computing kpt #: 220 total cpu time spent up to now is 1581.1 secs Computing kpt #: 221 total cpu time spent up to now is 1588.2 secs Computing kpt #: 222 total cpu time spent up to now is 1595.3 secs Computing kpt #: 223 total cpu time spent up to now is 1602.3 secs Computing kpt #: 224 total cpu time spent up to now is 1610.9 secs Computing kpt #: 225 total cpu time spent up to now is 1619.6 secs Computing kpt #: 226 total cpu time spent up to now is 1627.2 secs Computing kpt #: 227 total cpu time spent up to now is 1634.6 secs Computing kpt #: 228 total cpu time spent up to now is 1641.5 secs Computing kpt #: 229 total cpu time spent up to now is 1648.5 secs Computing kpt #: 230 total cpu time spent up to now is 1655.4 secs Computing kpt #: 231 total cpu time spent up to now is 1662.8 secs Computing kpt #: 232 total cpu time spent up to now is 1669.8 secs Computing kpt #: 233 total cpu time spent up to now is 1676.6 secs Computing kpt #: 234 total cpu time spent up to now is 1683.9 secs Computing kpt #: 235 total cpu time spent up to now is 1691.0 secs Computing kpt #: 236 total cpu time spent up to now is 1698.4 secs Computing kpt #: 237 total cpu time spent up to now is 1706.7 secs Computing kpt #: 238 total cpu time spent up to now is 1714.6 secs Computing kpt #: 239 total cpu time spent up to now is 1721.7 secs Computing kpt #: 240 total cpu time spent up to now is 1728.6 secs Computing kpt #: 241 total cpu time spent up to now is 1735.8 secs Computing kpt #: 242 total cpu time spent up to now is 1745.9 secs Computing kpt #: 243 total cpu time spent up to now is 1752.7 secs Computing kpt #: 244 total cpu time spent up to now is 1760.4 secs Computing kpt #: 245 total cpu time spent up to now is 1767.2 secs Computing kpt #: 246 total cpu time spent up to now is 1774.1 secs Computing kpt #: 247 total cpu time spent up to now is 1780.8 secs Computing kpt #: 248 total cpu time spent up to now is 1787.4 secs Computing kpt #: 249 total cpu time spent up to now is 1794.6 secs Computing kpt #: 250 total cpu time spent up to now is 1801.4 secs Computing kpt #: 251 total cpu time spent up to now is 1808.3 secs Computing kpt #: 252 total cpu time spent up to now is 1814.9 secs Computing kpt #: 253 total cpu time spent up to now is 1822.2 secs Computing kpt #: 254 total cpu time spent up to now is 1828.7 secs Computing kpt #: 255 total cpu time spent up to now is 1835.4 secs Computing kpt #: 256 total cpu time spent up to now is 1842.0 secs Computing kpt #: 257 total cpu time spent up to now is 1848.5 secs Computing kpt #: 258 total cpu time spent up to now is 1855.5 secs Computing kpt #: 259 total cpu time spent up to now is 1862.0 secs Computing kpt #: 260 total cpu time spent up to now is 1869.3 secs Computing kpt #: 261 total cpu time spent up to now is 1876.2 secs Computing kpt #: 262 total cpu time spent up to now is 1882.9 secs Computing kpt #: 263 total cpu time spent up to now is 1890.2 secs Computing kpt #: 264 total cpu time spent up to now is 1898.4 secs Computing kpt #: 265 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1911.9 secs Computing kpt #: 266 total cpu time spent up to now is 1921.7 secs Computing kpt #: 267 total cpu time spent up to now is 1930.1 secs Computing kpt #: 268 total cpu time spent up to now is 1938.2 secs Computing kpt #: 269 total cpu time spent up to now is 1945.1 secs Computing kpt #: 270 total cpu time spent up to now is 1952.0 secs Computing kpt #: 271 total cpu time spent up to now is 1958.8 secs Computing kpt #: 272 total cpu time spent up to now is 1965.5 secs Computing kpt #: 273 total cpu time spent up to now is 1972.2 secs ethr = 1.39E-11, avg # of iterations = 31.1 total cpu time spent up to now is 1972.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6571 PWs) bands (ev): -8.1720 -8.1720 -8.1518 -8.1518 -8.0109 -8.0109 -7.9496 -7.9496 -7.5269 -7.5269 -7.2811 -7.2811 -7.1986 -7.1986 -7.1142 -7.1142 -7.1040 -7.1040 -7.0746 -7.0746 -6.5757 -6.5757 -4.9978 -4.9978 -4.9867 -4.9867 -4.9310 -4.9310 0.4002 0.4002 1.7640 1.7640 2.3029 2.3029 2.4738 2.4738 2.6689 2.6689 2.7950 2.7950 2.8292 2.8292 3.0339 3.0339 3.0537 3.0537 3.1180 3.1180 3.4713 3.4713 3.4808 3.4808 3.8536 3.8536 3.9775 3.9775 4.0880 4.0880 4.6845 4.6845 5.0458 5.0458 5.0901 5.0901 5.1537 5.1537 6.9074 6.9074 6.9343 6.9343 7.0916 7.0916 7.5045 7.5045 9.7502 9.7502 10.3672 10.3672 11.5823 11.5823 11.7363 11.7363 12.0636 12.0636 12.2411 12.2411 k = 0.0000 0.0000 0.0219 ( 6561 PWs) bands (ev): -8.1720 -8.1720 -8.1530 -8.1504 -8.0136 -8.0081 -7.9497 -7.9496 -7.5307 -7.5228 -7.2845 -7.2779 -7.1986 -7.1986 -7.1155 -7.1131 -7.1045 -7.1035 -7.0747 -7.0746 -6.5747 -6.5746 -4.9985 -4.9984 -4.9869 -4.9868 -4.9325 -4.9300 0.4010 0.4011 1.7604 1.7642 2.3002 2.3057 2.4731 2.4745 2.6676 2.6704 2.7887 2.7994 2.8175 2.8319 3.0246 3.0388 3.0426 3.0684 3.1100 3.1377 3.4617 3.4763 3.4785 3.4894 3.8496 3.8597 3.9726 3.9855 4.0815 4.0950 4.6700 4.6949 5.0351 5.0483 5.0883 5.1015 5.1547 5.1565 6.8921 6.9007 6.9263 6.9300 7.0882 7.0911 7.5189 7.5227 9.7521 9.7566 10.3685 10.3688 11.5818 11.5819 11.7358 11.7365 12.0506 12.0508 12.2445 12.2518 k = 0.0000 0.0000 0.0437 ( 6567 PWs) bands (ev): -8.1720 -8.1719 -8.1542 -8.1491 -8.0165 -8.0056 -7.9500 -7.9497 -7.5345 -7.5187 -7.2881 -7.2749 -7.1987 -7.1986 -7.1169 -7.1123 -7.1052 -7.1032 -7.0750 -7.0748 -6.5715 -6.5712 -5.0002 -5.0000 -4.9875 -4.9873 -4.9347 -4.9297 0.4033 0.4036 1.7534 1.7608 2.2975 2.3086 2.4721 2.4751 2.6667 2.6715 2.7786 2.8010 2.8013 2.8263 3.0048 3.0350 3.0477 3.0847 3.1181 3.1618 3.4524 3.4742 3.4816 3.5029 3.8479 3.8675 3.9713 3.9964 4.0760 4.1025 4.6525 4.7002 5.0184 5.0485 5.0895 5.1201 5.1612 5.1626 6.8473 6.8641 6.9194 6.9249 7.0816 7.0863 7.5621 7.5683 9.7623 9.7711 10.3728 10.3736 11.5802 11.5806 11.7352 11.7365 12.0181 12.0181 12.2568 12.2681 k = 0.0000 0.0000 0.0656 ( 6567 PWs) bands (ev): -8.1720 -8.1717 -8.1553 -8.1477 -8.0194 -8.0030 -7.9504 -7.9500 -7.5381 -7.5145 -7.2919 -7.2720 -7.1987 -7.1986 -7.1186 -7.1117 -7.1060 -7.1030 -7.0753 -7.0752 -6.5661 -6.5657 -5.0032 -5.0026 -4.9884 -4.9883 -4.9374 -4.9299 0.4072 0.4077 1.7433 1.7539 2.2947 2.3117 2.4709 2.4757 2.6660 2.6711 2.7612 2.7880 2.7935 2.8219 2.9814 3.0249 3.0618 3.1064 3.1336 3.1872 3.4436 3.4754 3.4820 3.5188 3.8484 3.8764 3.9741 4.0095 4.0722 4.1106 4.6331 4.7000 4.9981 5.0526 5.0871 5.1416 5.1731 5.1741 6.7815 6.8031 6.9144 6.9227 7.0715 7.0773 7.6249 7.6319 9.7804 9.7931 10.3802 10.3815 11.5774 11.5781 11.7342 11.7360 11.9759 11.9759 12.2686 12.2785 k = 0.0000 0.0000 0.0874 ( 6565 PWs) bands (ev): -8.1720 -8.1715 -8.1563 -8.1462 -8.0223 -8.0006 -7.9510 -7.9505 -7.5416 -7.5102 -7.2960 -7.2693 -7.1988 -7.1987 -7.1205 -7.1113 -7.1066 -7.1029 -7.0757 -7.0756 -6.5585 -6.5581 -5.0074 -5.0062 -4.9899 -4.9897 -4.9405 -4.9305 0.4126 0.4133 1.7301 1.7436 2.2919 2.3148 2.4692 2.4762 2.6653 2.6673 2.7392 2.7748 2.7785 2.8247 2.9575 3.0156 3.0795 3.1304 3.1509 3.2118 3.4353 3.4802 3.4805 3.5358 3.8508 3.8858 3.9814 4.0234 4.0718 4.1194 4.6125 4.6943 4.9756 5.0626 5.0801 5.1609 5.1914 5.1926 6.7042 6.7288 6.9093 6.9206 7.0577 7.0644 7.6992 7.7060 9.8057 9.8215 10.3907 10.3929 11.5728 11.5740 11.7329 11.7349 11.9304 11.9307 12.2742 12.2773 k = 0.0000 0.0000 0.1093 ( 6571 PWs) bands (ev): -8.1720 -8.1713 -8.1572 -8.1447 -8.0253 -7.9983 -7.9518 -7.9511 -7.5449 -7.5058 -7.3002 -7.2668 -7.1990 -7.1988 -7.1227 -7.1114 -7.1073 -7.1028 -7.0764 -7.0759 -6.5489 -6.5485 -5.0127 -5.0108 -4.9922 -4.9916 -4.9440 -4.9315 0.4196 0.4203 1.7142 1.7301 2.2888 2.3179 2.4668 2.4763 2.6572 2.6641 2.7186 2.7518 2.7711 2.8308 2.9343 3.0098 3.0976 3.1536 3.1693 3.2344 3.4281 3.4763 3.4898 3.5528 3.8545 3.8949 3.9939 4.0355 4.0784 4.1292 4.5916 4.6841 4.9517 5.0689 5.0790 5.1769 5.2151 5.2181 6.6203 6.6470 6.9034 6.9179 7.0403 7.0479 7.7802 7.7860 9.8371 9.8552 10.4046 10.4078 11.5655 11.5674 11.7307 11.7326 11.8862 11.8870 12.2647 12.2715 k = 0.0000 0.0000 0.1311 ( 6579 PWs) bands (ev): -8.1720 -8.1709 -8.1580 -8.1432 -8.0283 -7.9961 -7.9527 -7.9517 -7.5481 -7.5014 -7.3047 -7.2645 -7.1991 -7.1988 -7.1252 -7.1119 -7.1080 -7.1027 -7.0773 -7.0762 -6.5373 -6.5369 -5.0191 -5.0165 -4.9953 -4.9940 -4.9477 -4.9328 0.4280 0.4288 1.6959 1.7137 2.2854 2.3210 2.4636 2.4758 2.6393 2.6619 2.7020 2.7284 2.7659 2.8379 2.9129 3.0081 3.1142 3.1729 3.1898 3.2541 3.4223 3.4709 3.5031 3.5690 3.8588 3.9029 4.0120 4.0441 4.0945 4.1404 4.5707 4.6705 4.9272 5.0561 5.0999 5.1927 5.2406 5.2493 6.5329 6.5609 6.8965 6.9145 7.0192 7.0280 7.8647 7.8693 9.8733 9.8925 10.4219 10.4266 11.5542 11.5565 11.7269 11.7279 11.8483 11.8488 12.2440 12.2605 k = 0.0000 0.0000 0.1530 ( 6577 PWs) bands (ev): -8.1721 -8.1706 -8.1586 -8.1417 -8.0313 -7.9941 -7.9539 -7.9525 -7.5510 -7.4968 -7.3094 -7.2622 -7.1993 -7.1989 -7.1279 -7.1130 -7.1085 -7.1024 -7.0782 -7.0763 -6.5238 -6.5234 -5.0267 -5.0231 -4.9992 -4.9969 -4.9514 -4.9343 0.4377 0.4386 1.6753 1.6945 2.2816 2.3237 2.4594 2.4744 2.6159 2.6582 2.6885 2.7067 2.7630 2.8437 2.8955 3.0101 3.1281 3.1879 3.2119 3.2702 3.4182 3.4644 3.5199 3.5835 3.8630 3.9093 4.0359 4.0522 4.1179 4.1532 4.5503 4.6547 4.9033 5.0416 5.1251 5.2102 5.2685 5.2829 6.4437 6.4726 6.8884 6.9103 6.9946 7.0050 7.9510 7.9542 9.9126 9.9319 10.4430 10.4493 11.5369 11.5389 11.7201 11.7209 11.8202 11.8213 12.2181 12.2432 k = 0.0000 0.0000 0.1748 ( 6573 PWs) bands (ev): -8.1722 -8.1701 -8.1591 -8.1401 -8.0342 -7.9921 -7.9551 -7.9533 -7.5538 -7.4921 -7.3142 -7.2601 -7.1996 -7.1990 -7.1308 -7.1146 -7.1090 -7.1019 -7.0792 -7.0763 -6.5084 -6.5081 -5.0354 -5.0307 -5.0041 -5.0005 -4.9549 -4.9359 0.4487 0.4496 1.6527 1.6729 2.2773 2.3258 2.4541 2.4715 2.5904 2.6518 2.6764 2.6889 2.7621 2.8431 2.8875 3.0152 3.1388 3.1994 3.2339 3.2827 3.4156 3.4572 3.5398 3.5959 3.8668 3.9140 4.0631 4.0654 4.1461 4.1679 4.5308 4.6377 4.8809 5.0265 5.1537 5.2301 5.2984 5.3179 6.3540 6.3832 6.8786 6.9051 6.9669 6.9796 8.0379 8.0397 9.9533 9.9716 10.4678 10.4761 11.5120 11.5123 11.7111 11.7131 11.8035 11.8072 12.1891 12.2219 k = 0.0000 0.0000 0.1967 ( 6567 PWs) bands (ev): -8.1724 -8.1696 -8.1594 -8.1385 -8.0372 -7.9904 -7.9566 -7.9543 -7.5564 -7.4874 -7.3192 -7.2581 -7.1998 -7.1991 -7.1338 -7.1165 -7.1094 -7.1013 -7.0802 -7.0762 -6.4913 -6.4911 -5.0451 -5.0394 -5.0100 -5.0048 -4.9582 -4.9375 0.4609 0.4617 1.6285 1.6491 2.2725 2.3269 2.4478 2.4667 2.5649 2.6421 2.6654 2.6765 2.7623 2.8332 2.8912 3.0223 3.1459 3.2073 3.2553 3.2920 3.4136 3.4498 3.5618 3.6061 3.8700 3.9173 4.0780 4.1000 4.1777 4.1847 4.5124 4.6203 4.8612 5.0115 5.1850 5.2523 5.3298 5.3535 6.2647 6.2936 6.8664 6.8988 6.9364 6.9527 8.1248 8.1251 9.9935 10.0099 10.4963 10.5066 11.4762 11.4790 11.7050 11.7066 11.7974 11.8032 12.1588 12.1984 k = 0.0000 0.0000 0.2185 ( 6571 PWs) bands (ev): -8.1727 -8.1690 -8.1595 -8.1369 -8.0401 -7.9888 -7.9582 -7.9553 -7.5588 -7.4826 -7.3245 -7.2563 -7.2002 -7.1991 -7.1371 -7.1189 -7.1098 -7.1006 -7.0813 -7.0761 -6.4725 -6.4724 -5.0559 -5.0491 -5.0167 -5.0096 -4.9612 -4.9392 0.4742 0.4748 1.6028 1.6235 2.2671 2.3263 2.4408 2.4598 2.5407 2.6303 2.6560 2.6689 2.7631 2.8195 2.9010 3.0306 3.1495 3.2106 3.2765 3.2984 3.4116 3.4424 3.5855 3.6140 3.8724 3.9201 4.0972 4.1387 4.2038 4.2117 4.4955 4.6033 4.8455 4.9977 5.2183 5.2768 5.3625 5.3894 6.1765 6.2044 6.8506 6.8893 6.9055 6.9257 8.2099 8.2110 10.0315 10.0452 10.5279 10.5400 11.4326 11.4392 11.7041 11.7047 11.7986 11.8056 12.1288 12.1744 k = 0.0000 0.0000 0.2404 ( 6583 PWs) bands (ev): -8.1731 -8.1683 -8.1596 -8.1353 -8.0430 -7.9874 -7.9599 -7.9563 -7.5610 -7.4778 -7.3300 -7.2546 -7.2006 -7.1992 -7.1406 -7.1215 -7.1101 -7.0998 -7.0824 -7.0759 -6.4523 -6.4522 -5.0676 -5.0598 -5.0241 -5.0151 -4.9641 -4.9409 0.4883 0.4888 1.5758 1.5963 2.2610 2.3233 2.4334 2.4508 2.5187 2.6187 2.6486 2.6645 2.7641 2.8056 2.9125 3.0393 3.1499 3.2089 3.2974 3.3018 3.4094 3.4352 3.6100 3.6201 3.8743 3.9233 4.1202 4.1798 4.2255 4.2474 4.4801 4.5873 4.8351 4.9858 5.2532 5.3035 5.3959 5.4252 6.0902 6.1163 6.8292 6.8627 6.8886 6.9011 8.2937 8.2960 10.0659 10.0767 10.5619 10.5749 11.3839 11.3948 11.7067 11.7104 11.8049 11.8125 12.1004 12.1517 k = 0.0000 0.0000 0.2622 ( 6583 PWs) bands (ev): -8.1735 -8.1676 -8.1595 -8.1337 -8.0458 -7.9862 -7.9618 -7.9573 -7.5629 -7.4728 -7.3356 -7.2530 -7.2010 -7.1993 -7.1441 -7.1243 -7.1104 -7.0989 -7.0834 -7.0756 -6.4307 -6.4304 -5.0803 -5.0715 -5.0321 -5.0210 -4.9668 -4.9426 0.5033 0.5035 1.5479 1.5679 2.2542 2.3175 2.4263 2.4402 2.4998 2.6081 2.6433 2.6621 2.7649 2.7926 2.9242 3.0478 3.1477 3.2017 3.3009 3.3178 3.4081 3.4287 3.6246 3.6349 3.8760 3.9274 4.1463 4.2190 4.2526 4.2841 4.4669 4.5728 4.8311 4.9767 5.2891 5.3320 5.4297 5.4605 6.0064 6.0299 6.8010 6.8255 6.8793 6.8803 8.3762 8.3797 10.0955 10.1033 10.5968 10.6098 11.3326 11.3477 11.7143 11.7218 11.8155 11.8228 12.0752 12.1316 k = 0.0000 0.0000 0.2841 ( 6587 PWs) bands (ev): -8.1740 -8.1668 -8.1593 -8.1322 -8.0485 -7.9852 -7.9639 -7.9584 -7.5646 -7.4678 -7.3413 -7.2516 -7.2015 -7.1994 -7.1477 -7.1271 -7.1105 -7.0980 -7.0845 -7.0753 -6.4078 -6.4073 -5.0939 -5.0842 -5.0406 -5.0273 -4.9695 -4.9445 0.5188 0.5188 1.5190 1.5384 2.2468 2.3085 2.4193 2.4288 2.4848 2.5985 2.6399 2.6614 2.7655 2.7807 2.9353 3.0555 3.1433 3.1893 3.2941 3.3365 3.4092 3.4234 3.6282 3.6598 3.8778 3.9328 4.1749 4.2488 4.2909 4.3208 4.4561 4.5606 4.8346 4.9712 5.3258 5.3619 5.4636 5.4950 5.9261 5.9456 6.7668 6.7859 6.8630 6.8701 8.4571 8.4616 10.1194 10.1246 10.6311 10.6427 11.2801 11.2993 11.7264 11.7384 11.8302 11.8364 12.0547 12.1155 k = 0.0000 0.0000 0.3059 ( 6587 PWs) bands (ev): -8.1745 -8.1659 -8.1590 -8.1306 -8.0511 -7.9845 -7.9660 -7.9594 -7.5660 -7.4627 -7.3473 -7.2503 -7.2020 -7.1994 -7.1514 -7.1301 -7.1106 -7.0970 -7.0855 -7.0750 -6.3836 -6.3828 -5.1082 -5.0978 -5.0493 -5.0340 -4.9723 -4.9464 0.5345 0.5349 1.4896 1.5081 2.2387 2.2965 2.4123 2.4173 2.4744 2.5899 2.6382 2.6619 2.7659 2.7698 2.9454 3.0620 3.1372 3.1721 3.2811 3.3513 3.4135 3.4211 3.6313 3.6846 3.8799 3.9394 4.2050 4.2703 4.3372 4.3563 4.4483 4.5513 4.8464 4.9704 5.3626 5.3930 5.4970 5.5282 5.8502 5.8643 6.7287 6.7451 6.8478 6.8604 8.5362 8.5413 10.1369 10.1400 10.6632 10.6720 11.2273 11.2507 11.7422 11.7593 11.8492 11.8533 12.0400 12.1047 k = 0.0000 0.0000 0.3278 ( 6575 PWs) bands (ev): -8.1750 -8.1649 -8.1586 -8.1291 -8.0536 -7.9840 -7.9683 -7.9603 -7.5672 -7.4576 -7.3533 -7.2491 -7.2026 -7.1994 -7.1550 -7.1331 -7.1107 -7.0960 -7.0865 -7.0746 -6.3583 -6.3572 -5.1233 -5.1122 -5.0581 -5.0409 -4.9752 -4.9486 0.5505 0.5513 1.4596 1.4773 2.2300 2.2821 2.4051 2.4067 2.4687 2.5819 2.6378 2.6631 2.7598 2.7659 2.9542 3.0668 3.1298 3.1512 3.2628 3.3590 3.4206 3.4241 3.6344 3.7089 3.8825 3.9470 4.2355 4.2876 4.3855 4.3890 4.4445 4.5458 4.8669 4.9752 5.3990 5.4246 5.5295 5.5596 5.7800 5.7869 6.6883 6.7038 6.8334 6.8500 8.6131 8.6187 10.1474 10.1490 10.6920 10.6968 11.1749 11.2023 11.7607 11.7836 11.8728 11.8740 12.0325 12.1004 k = 0.0000 0.0000 0.3496 ( 6567 PWs) bands (ev): -8.1755 -8.1638 -8.1582 -8.1276 -8.0559 -7.9837 -7.9707 -7.9613 -7.5680 -7.4523 -7.3594 -7.2480 -7.2033 -7.1994 -7.1587 -7.1361 -7.1107 -7.0950 -7.0875 -7.0742 -6.3318 -6.3305 -5.1392 -5.1275 -5.0670 -5.0480 -4.9783 -4.9509 0.5666 0.5679 1.4294 1.4461 2.2207 2.2661 2.3976 2.3984 2.4668 2.5747 2.6384 2.6644 2.7505 2.7658 2.9617 3.0683 3.1210 3.1288 3.2416 3.3589 3.4293 3.4324 3.6379 3.7326 3.8856 3.9554 4.2654 4.3016 4.4172 4.4270 4.4511 4.5448 4.8962 4.9863 5.4341 5.4559 5.5607 5.5887 5.7147 5.7172 6.6471 6.6627 6.8193 6.8391 8.6876 8.6934 10.1500 10.1508 10.7168 10.7170 11.1232 11.1548 11.7807 11.8097 11.8990 11.9010 12.0331 12.1034 k = 0.0000 0.0000 0.3715 ( 6571 PWs) bands (ev): -8.1760 -8.1626 -8.1578 -8.1261 -8.0581 -7.9836 -7.9733 -7.9621 -7.5686 -7.4471 -7.3657 -7.2472 -7.2040 -7.1995 -7.1623 -7.1391 -7.1107 -7.0941 -7.0884 -7.0739 -6.3044 -6.3028 -5.1556 -5.1435 -5.0759 -5.0551 -4.9817 -4.9536 0.5827 0.5845 1.3990 1.4147 2.2108 2.2490 2.3905 2.3930 2.4674 2.5681 2.6393 2.6649 2.7416 2.7655 2.9675 3.0621 3.1102 3.1109 3.2197 3.3541 3.4384 3.4424 3.6422 3.7552 3.8891 3.9641 4.2938 4.3131 4.4385 4.4397 4.4897 4.5485 4.9340 5.0045 5.4662 5.4850 5.5900 5.6150 5.6505 5.6647 6.6059 6.6228 6.8053 6.8275 8.7592 8.7649 10.1442 10.1446 10.7328 10.7385 11.0727 11.1083 11.8012 11.8360 11.9280 11.9333 12.0428 12.1144 k = 0.0000 0.0000 0.3933 ( 6565 PWs) bands (ev): -8.1764 -8.1614 -8.1573 -8.1247 -8.0602 -7.9838 -7.9759 -7.9629 -7.5689 -7.4417 -7.3721 -7.2466 -7.2047 -7.1994 -7.1658 -7.1420 -7.1106 -7.0930 -7.0894 -7.0736 -6.2760 -6.2742 -5.1726 -5.1601 -5.0846 -5.0623 -4.9854 -4.9565 0.5987 0.6010 1.3686 1.3833 2.2005 2.2315 2.3861 2.3896 2.4696 2.5621 2.6401 2.6639 2.7332 2.7651 2.9718 3.0432 3.0993 3.1015 3.1996 3.3470 3.4470 3.4512 3.6473 3.7763 3.8930 3.9732 4.3199 4.3228 4.4437 4.4566 4.5343 4.5550 4.9795 5.0303 5.4921 5.5052 5.6020 5.6159 5.6279 5.6379 6.5660 6.5848 6.7911 6.8154 8.8276 8.8329 10.1292 10.1296 10.7461 10.7577 11.0236 11.0634 11.8216 11.8614 11.9596 11.9681 12.0626 12.1338 k = 0.0000 0.0000 0.4152 ( 6559 PWs) bands (ev): -8.1768 -8.1601 -8.1570 -8.1234 -8.0620 -7.9842 -7.9787 -7.9637 -7.5689 -7.4363 -7.3785 -7.2463 -7.2054 -7.1993 -7.1692 -7.1449 -7.1105 -7.0920 -7.0903 -7.0733 -6.2468 -6.2448 -5.1902 -5.1774 -5.0931 -5.0693 -4.9895 -4.9599 0.6144 0.6173 1.3383 1.3520 2.1898 2.2139 2.3845 2.3888 2.4724 2.5568 2.6402 2.6604 2.7251 2.7649 2.9745 3.0160 3.0866 3.0995 3.1828 3.3393 3.4547 3.4572 3.6533 3.7952 3.8969 3.9823 4.3315 4.3433 4.4499 4.4699 4.5608 4.5755 5.0318 5.0637 5.4973 5.5057 5.5903 5.6097 5.6425 5.6567 6.5284 6.5497 6.7769 6.8028 8.8922 8.8969 10.1047 10.1051 10.7583 10.7756 10.9763 11.0204 11.8416 11.8859 11.9916 12.0042 12.0927 12.1612 k = 0.0000 0.0000 0.4370 ( 6561 PWs) bands (ev): -8.1772 -8.1587 -8.1566 -8.1221 -8.0636 -7.9847 -7.9815 -7.9645 -7.5686 -7.4309 -7.3850 -7.2463 -7.2062 -7.1993 -7.1724 -7.1478 -7.1104 -7.0911 -7.0910 -7.0730 -6.2168 -6.2146 -5.2082 -5.1952 -5.1013 -5.0761 -4.9940 -4.9636 0.6297 0.6332 1.3082 1.3210 2.1788 2.1965 2.3861 2.3908 2.4751 2.5519 2.6391 2.6535 2.7174 2.7650 2.9757 2.9867 3.0737 3.0994 3.1701 3.3316 3.4598 3.4609 3.6597 3.8111 3.9007 3.9916 4.3398 4.3641 4.4571 4.4820 4.5622 4.6109 5.0898 5.1045 5.4689 5.5067 5.6094 5.6159 5.6647 5.6708 6.4940 6.5185 6.7624 6.7898 8.9524 8.9562 10.0709 10.0712 10.7707 10.7936 10.9312 10.9797 11.8611 11.9098 12.0232 12.0406 12.1312 12.1956 k = 0.0000 0.0000 0.4589 ( 6567 PWs) bands (ev): -8.1775 -8.1572 -8.1564 -8.1209 -8.0649 -7.9854 -7.9845 -7.9653 -7.5679 -7.4254 -7.3916 -7.2467 -7.2070 -7.1991 -7.1755 -7.1506 -7.1103 -7.0920 -7.0900 -7.0728 -6.1862 -6.1839 -5.2267 -5.2135 -5.1091 -5.0826 -4.9989 -4.9678 0.6446 0.6487 1.2785 1.2904 2.1676 2.1797 2.3910 2.3957 2.4772 2.5471 2.6360 2.6426 2.7105 2.7657 2.9587 2.9757 3.0621 3.0996 3.1612 3.3243 3.4592 3.4655 3.6661 3.8233 3.9040 4.0011 4.3476 4.3821 4.4646 4.4945 4.5566 4.6388 5.1521 5.1524 5.4456 5.5072 5.6316 5.6361 5.6799 5.6858 6.4641 6.4920 6.7480 6.7765 9.0077 9.0102 10.0280 10.0280 10.7842 10.8124 10.8889 10.9420 11.8800 11.9333 12.0551 12.0771 12.1748 12.2348 k = 0.0000 0.0000 0.4807 ( 6567 PWs) bands (ev): -8.1778 -8.1563 -8.1557 -8.1199 -8.0660 -7.9875 -7.9861 -7.9661 -7.5670 -7.4198 -7.3982 -7.2474 -7.2077 -7.1990 -7.1783 -7.1534 -7.1101 -7.0928 -7.0890 -7.0726 -6.1550 -6.1526 -5.2455 -5.2322 -5.1166 -5.0888 -5.0042 -4.9724 0.6590 0.6637 1.2492 1.2603 2.1565 2.1635 2.3992 2.4032 2.4781 2.5419 2.6279 2.6306 2.7044 2.7672 2.9337 2.9749 3.0528 3.0993 3.1557 3.3177 3.4557 3.4683 3.6719 3.8309 3.9066 4.0109 4.3543 4.3975 4.4717 4.5083 4.5437 4.6585 5.2053 5.2186 5.4355 5.5155 5.6461 5.6636 5.6839 5.7073 6.4393 6.4709 6.7335 6.7630 9.0571 9.0583 9.9764 9.9769 10.7990 10.8317 10.8511 10.9085 11.8984 11.9563 12.0883 12.1141 12.2205 12.2766 k = 0.0000 0.0000 0.5026 ( 6568 PWs) bands (ev): -8.1780 -8.1562 -8.1541 -8.1189 -8.0669 -7.9906 -7.9869 -7.9669 -7.5657 -7.4141 -7.4049 -7.2486 -7.2084 -7.1988 -7.1809 -7.1560 -7.1099 -7.0936 -7.0880 -7.0724 -6.1233 -6.1208 -5.2647 -5.2514 -5.1235 -5.0946 -5.0100 -4.9775 0.6729 0.6781 1.2204 1.2308 2.1455 2.1482 2.4105 2.4128 2.4771 2.5349 2.6110 2.6232 2.6993 2.7698 2.9134 2.9739 3.0459 3.0984 3.1529 3.3120 3.4497 3.4693 3.6769 3.8332 3.9085 4.0209 4.3585 4.4100 4.4775 4.5165 4.5318 4.6713 5.2628 5.2871 5.4408 5.5336 5.6550 5.6805 5.6928 5.7305 6.4203 6.4556 6.7191 6.7493 9.0996 9.1000 9.9173 9.9187 10.8136 10.8142 10.8558 10.8813 11.9160 11.9786 12.1231 12.1518 12.2660 12.3192 k = 0.0000 0.0000 0.5244 ( 6576 PWs) bands (ev): -8.1781 -8.1564 -8.1524 -8.1180 -8.0674 -7.9938 -7.9877 -7.9678 -7.5642 -7.4116 -7.4085 -7.2504 -7.2089 -7.1985 -7.1833 -7.1586 -7.1097 -7.0944 -7.0870 -7.0723 -6.0911 -6.0887 -5.2843 -5.2710 -5.1298 -5.0999 -5.0162 -4.9830 0.6862 0.6919 1.1922 1.2019 2.1338 2.1350 2.4226 2.4245 2.4746 2.5240 2.5951 2.6150 2.6952 2.7733 2.8983 2.9735 3.0411 3.0968 3.1525 3.3071 3.4416 3.4686 3.6807 3.8298 3.9096 4.0313 4.3582 4.4184 4.4816 4.4960 4.5469 4.6799 5.3234 5.3565 5.4614 5.5597 5.6590 5.6755 5.7181 5.7552 6.4075 6.4461 6.7049 6.7357 9.1333 9.1353 9.8521 9.8547 10.7851 10.8217 10.8675 10.8788 11.9330 12.0001 12.1597 12.1900 12.3099 12.3611 k = 0.0000 0.0000 0.5463 ( 6584 PWs) bands (ev): -8.1782 -8.1566 -8.1507 -8.1173 -8.0677 -7.9970 -7.9885 -7.9688 -7.5623 -7.4182 -7.4027 -7.2526 -7.2093 -7.1983 -7.1854 -7.1611 -7.1095 -7.0952 -7.0861 -7.0722 -6.0587 -6.0564 -5.3041 -5.2910 -5.1356 -5.1046 -5.0229 -4.9890 0.6990 0.7052 1.1647 1.1738 2.1206 2.1249 2.4275 2.4400 2.4744 2.5074 2.5840 2.6076 2.6921 2.7777 2.8890 2.9738 3.0377 3.0943 3.1542 3.3033 3.4320 3.4663 3.6829 3.8205 3.9099 4.0417 4.3504 4.4189 4.4743 4.4845 4.5676 4.6878 5.3852 5.4248 5.4955 5.5877 5.6637 5.6665 5.7430 5.7809 6.4005 6.4419 6.6911 6.7222 9.1589 9.1623 9.7820 9.7859 10.7617 10.8150 10.8755 10.9032 11.9494 12.0206 12.1974 12.2280 12.3515 12.4019 k = 0.0000 0.0000 0.5681 ( 6584 PWs) bands (ev): -8.1781 -8.1570 -8.1489 -8.1167 -8.0676 -8.0003 -7.9892 -7.9699 -7.5600 -7.4249 -7.3969 -7.2553 -7.2095 -7.1979 -7.1874 -7.1636 -7.1092 -7.0959 -7.0851 -7.0722 -6.0261 -6.0239 -5.3243 -5.3113 -5.1407 -5.1088 -5.0300 -4.9955 0.7113 0.7179 1.1380 1.1465 2.1086 2.1156 2.4200 2.4510 2.4831 2.4903 2.5787 2.6024 2.6905 2.7829 2.8852 2.9749 3.0354 3.0910 3.1579 3.3005 3.4210 3.4623 3.6832 3.8049 3.9096 4.0522 4.3329 4.4030 4.4656 4.4882 4.5898 4.6972 5.4462 5.4887 5.5411 5.6036 5.6565 5.6829 5.7673 5.8076 6.3989 6.4426 6.6776 6.7090 9.1758 9.1804 9.7084 9.7138 10.7453 10.8047 10.8946 10.9283 11.9654 12.0401 12.2351 12.2645 12.3905 12.4416 k = 0.0000 0.0000 0.5900 ( 6584 PWs) bands (ev): -8.1780 -8.1575 -8.1470 -8.1163 -8.0672 -8.0036 -7.9899 -7.9710 -7.5575 -7.4316 -7.3911 -7.2585 -7.2095 -7.1975 -7.1891 -7.1659 -7.1089 -7.0967 -7.0842 -7.0721 -5.9933 -5.9913 -5.3448 -5.3321 -5.1450 -5.1123 -5.0375 -5.0023 0.7232 0.7302 1.1120 1.1201 2.0980 2.1072 2.4016 2.4384 2.4932 2.4992 2.5780 2.5998 2.6911 2.7887 2.8865 2.9766 3.0337 3.0867 3.1634 3.2988 3.4091 3.4569 3.6814 3.7832 3.9088 4.0624 4.3056 4.3750 4.4683 4.4942 4.6121 4.7087 5.5042 5.5437 5.5933 5.6015 5.6514 5.7225 5.7922 5.8359 6.4019 6.4471 6.6645 6.6961 9.1838 9.1893 9.6325 9.6394 10.7365 10.7987 10.9168 10.9535 11.9810 12.0586 12.2710 12.2973 12.4273 12.4810 k = 0.0000 0.0000 0.6118 ( 6588 PWs) bands (ev): -8.1778 -8.1582 -8.1451 -8.1160 -8.0665 -8.0069 -7.9904 -7.9722 -7.5547 -7.4382 -7.3852 -7.2621 -7.2094 -7.1971 -7.1907 -7.1682 -7.1086 -7.0974 -7.0833 -7.0722 -5.9605 -5.9588 -5.3657 -5.3532 -5.1486 -5.1151 -5.0453 -5.0095 0.7347 0.7420 1.0868 1.0945 2.0888 2.0999 2.3771 2.4100 2.5087 2.5183 2.5808 2.5998 2.6950 2.7954 2.8924 2.9787 3.0324 3.0816 3.1706 3.2983 3.3963 3.4502 3.6770 3.7552 3.9078 4.0723 4.2705 4.3442 4.4753 4.5029 4.6334 4.7211 5.5563 5.5801 5.5915 5.6342 5.6746 5.7726 5.8199 5.8670 6.4086 6.4548 6.6521 6.6837 9.1832 9.1891 9.5556 9.5639 10.7357 10.7988 10.9399 10.9782 11.9964 12.0763 12.3024 12.3238 12.4628 12.5216 k = 0.0000 0.0000 0.6337 ( 6592 PWs) bands (ev): -8.1775 -8.1589 -8.1432 -8.1159 -8.0655 -8.0103 -7.9908 -7.9734 -7.5515 -7.4448 -7.3793 -7.2662 -7.2092 -7.1966 -7.1922 -7.1704 -7.1083 -7.0981 -7.0824 -7.0723 -5.9277 -5.9264 -5.3869 -5.3748 -5.1514 -5.1171 -5.0534 -5.0171 0.7460 0.7536 1.0625 1.0699 2.0812 2.0938 2.3495 2.3784 2.5240 2.5380 2.5861 2.6018 2.7042 2.8035 2.9024 2.9811 3.0313 3.0757 3.1793 3.2989 3.3830 3.4422 3.6695 3.7213 3.9068 4.0817 4.2307 4.3146 4.4841 4.5138 4.6525 4.7330 5.5791 5.5875 5.6005 5.6664 5.7288 5.8272 5.8535 5.9023 6.4181 6.4649 6.6402 6.6719 9.1744 9.1804 9.4790 9.4886 10.7426 10.8052 10.9628 11.0019 12.0118 12.0933 12.3261 12.3414 12.4978 12.5646 k = 0.0000 0.0000 0.6555 ( 6584 PWs) bands (ev): -8.1771 -8.1598 -8.1412 -8.1160 -8.0642 -8.0137 -7.9910 -7.9747 -7.5481 -7.4513 -7.3733 -7.2706 -7.2088 -7.1960 -7.1935 -7.1725 -7.1079 -7.0987 -7.0815 -7.0724 -5.8951 -5.8942 -5.4084 -5.3967 -5.1533 -5.1184 -5.0617 -5.0249 0.7572 0.7649 1.0391 1.0462 2.0752 2.0890 2.3205 2.3463 2.5359 2.5566 2.5921 2.6053 2.7206 2.8135 2.9161 2.9835 3.0306 3.0690 3.1894 3.3008 3.3691 3.4331 3.6584 3.6818 3.9061 4.0906 4.1888 4.2874 4.4943 4.5265 4.6686 4.7431 5.5682 5.5835 5.6337 5.6955 5.7874 5.8837 5.8950 5.9424 6.4296 6.4766 6.6289 6.6607 9.1586 9.1643 9.4039 9.4147 10.7568 10.8177 10.9846 11.0236 12.0272 12.1097 12.3396 12.3485 12.5325 12.6105 k = 0.0000 0.0000 0.6774 ( 6578 PWs) bands (ev): -8.1766 -8.1607 -8.1392 -8.1163 -8.0627 -8.0171 -7.9911 -7.9760 -7.5444 -7.4578 -7.3673 -7.2753 -7.2083 -7.1953 -7.1947 -7.1745 -7.1076 -7.0994 -7.0807 -7.0725 -5.8627 -5.8623 -5.4304 -5.4192 -5.1544 -5.1188 -5.0702 -5.0328 0.7684 0.7761 1.0165 1.0234 2.0710 2.0858 2.2913 2.3149 2.5447 2.5728 2.5969 2.6100 2.7453 2.8256 2.9333 2.9858 3.0304 3.0618 3.2006 3.3040 3.3548 3.4229 3.6373 3.6430 3.9058 4.0990 4.1474 4.2633 4.5058 4.5407 4.6808 4.7502 5.5597 5.5794 5.6565 5.7144 5.8461 5.9404 5.9426 5.9864 6.4423 6.4894 6.6181 6.6502 9.1372 9.1425 9.3316 9.3432 10.7775 10.8354 11.0048 11.0428 12.0428 12.1255 12.3420 12.3451 12.5654 12.6588 k = 0.0000 0.0000 0.6993 ( 6586 PWs) bands (ev): -8.1760 -8.1618 -8.1373 -8.1167 -8.0609 -8.0205 -7.9911 -7.9774 -7.5404 -7.4642 -7.3613 -7.2802 -7.2077 -7.1958 -7.1946 -7.1764 -7.1072 -7.1000 -7.0800 -7.0728 -5.8307 -5.8306 -5.4528 -5.4421 -5.1546 -5.1185 -5.0787 -5.0410 0.7796 0.7874 0.9949 1.0017 2.0686 2.0842 2.2627 2.2847 2.5513 2.5860 2.5994 2.6153 2.7772 2.8399 2.9534 2.9880 3.0310 3.0547 3.2126 3.3086 3.3400 3.4118 3.5887 3.6230 3.9063 4.1069 4.1082 4.2423 4.5185 4.5561 4.6885 4.7535 5.5547 5.5781 5.6697 5.7237 5.9038 5.9920 5.9957 6.0322 6.4558 6.5027 6.6079 6.6404 9.1120 9.1168 9.2633 9.2755 10.8035 10.8574 11.0225 11.0585 12.0583 12.1405 12.3327 12.3346 12.5939 12.7075 k = 0.0000 0.0000 0.7211 ( 6578 PWs) bands (ev): -8.1754 -8.1629 -8.1353 -8.1173 -8.0589 -8.0238 -7.9909 -7.9788 -7.5362 -7.4706 -7.3553 -7.2854 -7.2071 -7.1969 -7.1938 -7.1782 -7.1068 -7.1006 -7.0792 -7.0730 -5.7996 -5.7988 -5.4757 -5.4657 -5.1539 -5.1173 -5.0872 -5.0491 0.7910 0.7988 0.9743 0.9809 2.0682 2.0845 2.2352 2.2561 2.5567 2.5962 2.5998 2.6207 2.8144 2.8559 2.9749 2.9898 3.0330 3.0492 3.2253 3.3148 3.3247 3.3999 3.5369 3.5982 3.9077 4.0725 4.1143 4.2242 4.5325 4.5726 4.6916 4.7529 5.5537 5.5807 5.6750 5.7257 5.9591 6.0393 6.0481 6.0773 6.4696 6.5161 6.5981 6.6313 9.0849 9.0892 9.2002 9.2127 10.8335 10.8825 11.0370 11.0700 12.0739 12.1546 12.3137 12.3203 12.6164 12.7153 k = 0.0000 0.0000 0.7430 ( 6592 PWs) bands (ev): -8.1747 -8.1641 -8.1333 -8.1181 -8.0567 -8.0272 -7.9906 -7.9803 -7.5318 -7.4769 -7.3493 -7.2907 -7.2064 -7.1979 -7.1930 -7.1800 -7.1064 -7.1013 -7.0785 -7.0733 -5.7691 -5.7676 -5.4992 -5.4898 -5.1524 -5.1153 -5.0955 -5.0572 0.8027 0.8104 0.9545 0.9611 2.0698 2.0866 2.2094 2.2294 2.5614 2.5986 2.6041 2.6252 2.8543 2.8729 2.9910 2.9927 3.0375 3.0505 3.2381 3.3085 3.3227 3.3871 3.4832 3.5690 3.9102 4.0411 4.1214 4.2087 4.5476 4.5898 4.6901 4.7483 5.5569 5.5870 5.6740 5.7221 6.0105 6.0816 6.0959 6.1193 6.4832 6.5294 6.5886 6.6228 9.0579 9.0620 9.1437 9.1561 10.8662 10.9094 11.0477 11.0766 12.0896 12.1677 12.2906 12.3023 12.6332 12.7072 k = 0.0000 0.0000 0.7648 ( 6594 PWs) bands (ev): -8.1739 -8.1653 -8.1315 -8.1191 -8.0543 -8.0305 -7.9901 -7.9816 -7.5271 -7.4830 -7.3433 -7.2962 -7.2057 -7.1989 -7.1920 -7.1817 -7.1060 -7.1018 -7.0778 -7.0736 -5.7391 -5.7369 -5.5232 -5.5145 -5.1500 -5.1124 -5.1037 -5.0651 0.8149 0.8225 0.9357 0.9423 2.0735 2.0907 2.1854 2.2049 2.5659 2.5963 2.6105 2.6284 2.8901 2.8936 2.9914 2.9974 3.0469 3.0673 3.2504 3.2910 3.3328 3.3730 3.4294 3.5364 3.9140 4.0143 4.1283 4.1953 4.5637 4.6078 4.6844 4.7401 5.5639 5.5969 5.6681 5.7142 6.0566 6.1168 6.1379 6.1563 6.4964 6.5421 6.5793 6.6149 9.0331 9.0372 9.0949 9.1068 10.9002 10.9369 11.0540 11.0777 12.1053 12.1797 12.2658 12.2832 12.6458 12.6995 k = 0.0000 0.0000 0.7867 ( 6584 PWs) bands (ev): -8.1730 -8.1664 -8.1296 -8.1202 -8.0517 -8.0338 -7.9894 -7.9829 -7.5222 -7.4891 -7.3372 -7.3018 -7.2049 -7.1998 -7.1910 -7.1832 -7.1055 -7.1024 -7.0771 -7.0740 -5.7097 -5.7067 -5.5478 -5.5399 -5.1467 -5.1115 -5.1088 -5.0728 0.8275 0.8350 0.9177 0.9244 2.0795 2.0970 2.1634 2.1825 2.5702 2.5934 2.6158 2.6300 2.9070 2.9281 2.9907 2.9913 3.0647 3.0963 3.2603 3.2718 3.3455 3.3547 3.3815 3.5018 3.9192 3.9917 4.1351 4.1838 4.5805 4.6262 4.6751 4.7286 5.5742 5.6097 5.6585 5.7031 6.0961 6.1435 6.1726 6.1864 6.5089 6.5541 6.5702 6.6073 9.0124 9.0170 9.0547 9.0658 10.9342 10.9637 11.0554 11.0729 12.1213 12.1907 12.2409 12.2649 12.6557 12.6927 k = 0.0000 0.0000 0.8085 ( 6592 PWs) bands (ev): -8.1720 -8.1676 -8.1278 -8.1215 -8.0490 -8.0370 -7.9886 -7.9843 -7.5171 -7.4950 -7.3312 -7.3076 -7.2041 -7.2007 -7.1899 -7.1847 -7.1050 -7.1030 -7.0765 -7.0744 -5.6810 -5.6772 -5.5731 -5.5659 -5.1426 -5.1189 -5.1044 -5.0802 0.8407 0.8481 0.9007 0.9075 2.0877 2.1055 2.1437 2.1624 2.5744 2.5900 2.6203 2.6302 2.9235 2.9535 2.9807 2.9887 3.0941 3.1299 3.2500 3.2589 3.3266 3.3545 3.3614 3.4672 3.9259 3.9730 4.1420 4.1737 4.5978 4.6448 4.6628 4.7147 5.5870 5.6246 5.6461 5.6895 6.1278 6.1606 6.1990 6.2082 6.5207 6.5611 6.5651 6.5998 8.9977 9.0030 9.0239 9.0339 10.9669 10.9886 11.0517 11.0621 12.1379 12.2010 12.2170 12.2485 12.6637 12.6867 k = 0.0000 0.0000 0.8304 ( 6596 PWs) bands (ev): -8.1710 -8.1688 -8.1261 -8.1229 -8.0462 -8.0402 -7.9877 -7.9855 -7.5119 -7.5008 -7.3252 -7.3134 -7.2033 -7.2016 -7.1888 -7.1862 -7.1045 -7.1035 -7.0759 -7.0749 -5.6530 -5.6483 -5.5990 -5.5927 -5.1377 -5.1257 -5.0992 -5.0871 0.8546 0.8618 0.8845 0.8914 2.0982 2.1162 2.1262 2.1446 2.5785 2.5864 2.6241 2.6291 2.9392 2.9680 2.9695 2.9850 3.1345 3.1639 3.2248 3.2283 3.3178 3.3389 3.3812 3.4346 3.9343 3.9575 4.1490 4.1646 4.6151 4.6482 4.6633 4.6988 5.6015 5.6319 5.6408 5.6740 6.1508 6.1675 6.2161 6.2208 6.5317 6.5517 6.5750 6.5922 8.9905 8.9968 9.0030 9.0117 10.9971 11.0107 11.0429 11.0455 12.1554 12.1947 12.2113 12.2344 12.6703 12.6813 k = 0.0000 0.0000 0.8522 ( 6600 PWs) bands (ev): -8.1699 -8.1699 -8.1244 -8.1244 -8.0432 -8.0432 -7.9867 -7.9867 -7.5064 -7.5064 -7.3193 -7.3193 -7.2025 -7.2025 -7.1875 -7.1875 -7.1040 -7.1040 -7.0754 -7.0754 -5.6256 -5.6256 -5.6201 -5.6201 -5.1320 -5.1320 -5.0934 -5.0934 0.8692 0.8692 0.8762 0.8762 2.1110 2.1110 2.1292 2.1292 2.5825 2.5825 2.6270 2.6270 2.9541 2.9541 2.9791 2.9791 3.1815 3.1815 3.1960 3.1960 3.3261 3.3261 3.4056 3.4056 3.9447 3.9447 4.1565 4.1565 4.6322 4.6322 4.6815 4.6815 5.6167 5.6167 5.6576 5.6576 6.1642 6.1642 6.2235 6.2235 6.5420 6.5420 6.5840 6.5840 8.9920 8.9920 8.9994 8.9994 11.0236 11.0236 11.0290 11.0290 12.1742 12.1742 12.2221 12.2221 12.6760 12.6760 k = 0.0000 0.0000 0.8522 ( 6600 PWs) bands (ev): -8.1699 -8.1699 -8.1244 -8.1244 -8.0432 -8.0432 -7.9867 -7.9867 -7.5064 -7.5064 -7.3193 -7.3193 -7.2025 -7.2025 -7.1875 -7.1875 -7.1040 -7.1040 -7.0754 -7.0754 -5.6256 -5.6256 -5.6201 -5.6201 -5.1320 -5.1320 -5.0934 -5.0934 0.8692 0.8692 0.8762 0.8762 2.1110 2.1110 2.1292 2.1292 2.5825 2.5825 2.6270 2.6270 2.9541 2.9541 2.9791 2.9791 3.1815 3.1815 3.1960 3.1960 3.3261 3.3261 3.4056 3.4056 3.9447 3.9447 4.1565 4.1565 4.6322 4.6322 4.6815 4.6815 5.6167 5.6167 5.6576 5.6576 6.1642 6.1642 6.2235 6.2235 6.5420 6.5420 6.5840 6.5840 8.9920 8.9920 8.9994 8.9994 11.0236 11.0236 11.0290 11.0290 12.1742 12.1742 12.2221 12.2221 12.6760 12.6760 k =-0.0119 0.0165 0.8522 ( 6592 PWs) bands (ev): -8.1699 -8.1699 -8.1243 -8.1243 -8.0434 -8.0434 -7.9866 -7.9866 -7.5063 -7.5063 -7.3194 -7.3194 -7.2025 -7.2025 -7.1874 -7.1874 -7.1040 -7.1040 -7.0754 -7.0754 -5.6260 -5.6260 -5.6198 -5.6198 -5.1322 -5.1322 -5.0936 -5.0936 0.8695 0.8695 0.8766 0.8766 2.1115 2.1115 2.1297 2.1297 2.5827 2.5827 2.6273 2.6273 2.9537 2.9537 2.9801 2.9801 3.1809 3.1809 3.1968 3.1968 3.3261 3.3261 3.4064 3.4064 3.9448 3.9448 4.1566 4.1566 4.6316 4.6316 4.6809 4.6809 5.6152 5.6152 5.6566 5.6566 6.1639 6.1639 6.2232 6.2232 6.5401 6.5401 6.5821 6.5821 8.9936 8.9936 9.0012 9.0012 11.0267 11.0267 11.0335 11.0335 12.1676 12.1676 12.2162 12.2162 12.6758 12.6758 k =-0.0239 0.0329 0.8522 ( 6584 PWs) bands (ev): -8.1700 -8.1700 -8.1239 -8.1239 -8.0439 -8.0439 -7.9863 -7.9863 -7.5060 -7.5060 -7.3196 -7.3196 -7.2025 -7.2025 -7.1872 -7.1872 -7.1039 -7.1039 -7.0754 -7.0754 -5.6270 -5.6270 -5.6190 -5.6190 -5.1327 -5.1327 -5.0940 -5.0940 0.8707 0.8707 0.8778 0.8778 2.1129 2.1129 2.1311 2.1311 2.5832 2.5832 2.6282 2.6282 2.9529 2.9529 2.9831 2.9831 3.1795 3.1795 3.1988 3.1988 3.3264 3.3264 3.4085 3.4085 3.9452 3.9452 4.1567 4.1567 4.6298 4.6298 4.6792 4.6792 5.6107 5.6107 5.6537 5.6537 6.1628 6.1628 6.2224 6.2224 6.5345 6.5345 6.5763 6.5763 8.9985 8.9985 9.0064 9.0064 11.0364 11.0364 11.0462 11.0462 12.1483 12.1483 12.1985 12.1985 12.6753 12.6753 k =-0.0358 0.0494 0.8522 ( 6576 PWs) bands (ev): -8.1701 -8.1701 -8.1232 -8.1232 -8.0447 -8.0447 -7.9859 -7.9859 -7.5056 -7.5056 -7.3200 -7.3200 -7.2025 -7.2025 -7.1868 -7.1868 -7.1038 -7.1038 -7.0755 -7.0755 -5.6282 -5.6282 -5.6180 -5.6180 -5.1336 -5.1336 -5.0946 -5.0946 0.8726 0.8726 0.8797 0.8797 2.1153 2.1153 2.1334 2.1334 2.5840 2.5840 2.6297 2.6297 2.9519 2.9519 2.9875 2.9875 3.1777 3.1777 3.2016 3.2016 3.3268 3.3268 3.4119 3.4119 3.9458 3.9458 4.1568 4.1568 4.6268 4.6268 4.6764 4.6764 5.6033 5.6033 5.6487 5.6487 6.1610 6.1610 6.2211 6.2211 6.5255 6.5255 6.5670 6.5670 9.0067 9.0067 9.0151 9.0151 11.0527 11.0527 11.0662 11.0662 12.1172 12.1172 12.1695 12.1695 12.6742 12.6742 k =-0.0477 0.0659 0.8522 ( 6576 PWs) bands (ev): -8.1703 -8.1703 -8.1224 -8.1224 -8.0459 -8.0459 -7.9854 -7.9854 -7.5051 -7.5051 -7.3206 -7.3206 -7.2025 -7.2025 -7.1864 -7.1864 -7.1037 -7.1037 -7.0756 -7.0756 -5.6297 -5.6297 -5.6170 -5.6170 -5.1347 -5.1347 -5.0955 -5.0955 0.8752 0.8752 0.8823 0.8823 2.1186 2.1186 2.1367 2.1367 2.5852 2.5852 2.6316 2.6316 2.9511 2.9511 2.9932 2.9932 3.1757 3.1757 3.2047 3.2047 3.3274 3.3274 3.4166 3.4166 3.9466 3.9466 4.1570 4.1570 4.6227 4.6227 4.6726 4.6726 5.5928 5.5928 5.6418 5.6418 6.1585 6.1585 6.2193 6.2193 6.5132 6.5132 6.5544 6.5544 9.0181 9.0181 9.0271 9.0271 11.0751 11.0751 11.0926 11.0926 12.0756 12.0756 12.1301 12.1301 12.6724 12.6724 k =-0.0596 0.0823 0.8522 ( 6572 PWs) bands (ev): -8.1705 -8.1705 -8.1213 -8.1213 -8.0473 -8.0473 -7.9848 -7.9848 -7.5043 -7.5043 -7.3213 -7.3213 -7.2025 -7.2025 -7.1858 -7.1858 -7.1035 -7.1035 -7.0757 -7.0757 -5.6313 -5.6313 -5.6160 -5.6160 -5.1360 -5.1360 -5.0966 -5.0966 0.8784 0.8784 0.8856 0.8856 2.1228 2.1228 2.1409 2.1409 2.5868 2.5868 2.6341 2.6341 2.9507 2.9507 2.9998 2.9998 3.1738 3.1738 3.2081 3.2081 3.3283 3.3283 3.4226 3.4226 3.9477 3.9477 4.1573 4.1573 4.6176 4.6176 4.6678 4.6678 5.5793 5.5793 5.6327 5.6327 6.1552 6.1552 6.2169 6.2169 6.4981 6.4981 6.5390 6.5390 9.0325 9.0325 9.0422 9.0422 11.1025 11.1025 11.1244 11.1244 12.0252 12.0252 12.0815 12.0815 12.6697 12.6697 k =-0.0716 0.0988 0.8522 ( 6580 PWs) bands (ev): -8.1708 -8.1708 -8.1200 -8.1200 -8.0490 -8.0490 -7.9841 -7.9841 -7.5035 -7.5035 -7.3223 -7.3223 -7.2025 -7.2025 -7.1852 -7.1852 -7.1033 -7.1033 -7.0759 -7.0759 -5.6330 -5.6330 -5.6152 -5.6152 -5.1376 -5.1376 -5.0978 -5.0978 0.8822 0.8822 0.8895 0.8895 2.1279 2.1279 2.1460 2.1460 2.5886 2.5886 2.6371 2.6371 2.9508 2.9508 3.0073 3.0073 3.1719 3.1719 3.2114 3.2114 3.3295 3.3295 3.4296 3.4296 3.9491 3.9491 4.1577 4.1577 4.6115 4.6115 4.6623 4.6623 5.5628 5.5628 5.6215 5.6215 6.1514 6.1514 6.2140 6.2140 6.4806 6.4806 6.5212 6.5212 9.0499 9.0499 9.0604 9.0604 11.1332 11.1332 11.1603 11.1603 11.9676 11.9676 12.0256 12.0256 12.6665 12.6665 k =-0.0835 0.1153 0.8522 ( 6592 PWs) bands (ev): -8.1711 -8.1711 -8.1185 -8.1185 -8.0510 -8.0510 -7.9834 -7.9834 -7.5024 -7.5024 -7.3234 -7.3234 -7.2025 -7.2025 -7.1845 -7.1845 -7.1030 -7.1030 -7.0761 -7.0761 -5.6350 -5.6350 -5.6146 -5.6146 -5.1392 -5.1392 -5.0991 -5.0991 0.8865 0.8865 0.8938 0.8938 2.1339 2.1339 2.1520 2.1520 2.5908 2.5908 2.6404 2.6404 2.9514 2.9514 3.0157 3.0157 3.1701 3.1701 3.2148 3.2148 3.3312 3.3312 3.4377 3.4377 3.9509 3.9509 4.1581 4.1581 4.6045 4.6045 4.6560 4.6560 5.5435 5.5435 5.6082 5.6082 6.1468 6.1468 6.2105 6.2105 6.4612 6.4612 6.5016 6.5016 9.0702 9.0702 9.0814 9.0814 11.1653 11.1653 11.1986 11.1986 11.9044 11.9044 11.9642 11.9642 12.6631 12.6631 k =-0.0954 0.1317 0.8522 ( 6584 PWs) bands (ev): -8.1713 -8.1713 -8.1169 -8.1169 -8.0531 -8.0531 -7.9826 -7.9826 -7.5013 -7.5013 -7.3245 -7.3245 -7.2024 -7.2024 -7.1837 -7.1837 -7.1027 -7.1027 -7.0763 -7.0763 -5.6372 -5.6372 -5.6143 -5.6143 -5.1408 -5.1408 -5.1004 -5.1004 0.8912 0.8912 0.8986 0.8986 2.1406 2.1406 2.1589 2.1589 2.5933 2.5933 2.6441 2.6441 2.9527 2.9527 3.0248 3.0248 3.1683 3.1683 3.2181 3.2181 3.3335 3.3335 3.4466 3.4466 3.9531 3.9531 4.1586 4.1586 4.5968 4.5968 4.6494 4.6494 5.5214 5.5214 5.5926 5.5926 6.1416 6.1416 6.2065 6.2065 6.4404 6.4404 6.4808 6.4808 9.0930 9.0930 9.1051 9.1051 11.1960 11.1960 11.2373 11.2373 11.8377 11.8377 11.8998 11.8998 12.6604 12.6604 k =-0.1074 0.1482 0.8522 ( 6590 PWs) bands (ev): -8.1716 -8.1716 -8.1151 -8.1151 -8.0554 -8.0554 -7.9819 -7.9819 -7.5000 -7.5000 -7.3259 -7.3259 -7.2023 -7.2023 -7.1829 -7.1829 -7.1024 -7.1024 -7.0765 -7.0765 -5.6396 -5.6396 -5.6143 -5.6143 -5.1424 -5.1424 -5.1016 -5.1016 0.8962 0.8962 0.9037 0.9037 2.1482 2.1482 2.1667 2.1667 2.5960 2.5960 2.6482 2.6482 2.9547 2.9547 3.0345 3.0345 3.1664 3.1664 3.2213 3.2213 3.3365 3.3365 3.4563 3.4563 3.9558 3.9558 4.1593 4.1593 4.5884 4.5884 4.6424 4.6424 5.4967 5.4967 5.5748 5.5748 6.1357 6.1357 6.2020 6.2020 6.4187 6.4187 6.4592 6.4592 9.1183 9.1183 9.1311 9.1311 11.2218 11.2218 11.2735 11.2735 11.7694 11.7694 11.8353 11.8353 12.6589 12.6589 k =-0.1193 0.1647 0.8522 ( 6578 PWs) bands (ev): -8.1718 -8.1718 -8.1131 -8.1131 -8.0577 -8.0577 -7.9812 -7.9812 -7.4985 -7.4985 -7.3274 -7.3274 -7.2021 -7.2021 -7.1820 -7.1820 -7.1020 -7.1020 -7.0767 -7.0767 -5.6424 -5.6424 -5.6147 -5.6147 -5.1437 -5.1437 -5.1026 -5.1026 0.9014 0.9014 0.9090 0.9090 2.1565 2.1565 2.1754 2.1754 2.5989 2.5989 2.6525 2.6525 2.9572 2.9572 3.0450 3.0450 3.1645 3.1645 3.2243 3.2243 3.3402 3.3402 3.4666 3.4666 3.9590 3.9590 4.1600 4.1600 4.5795 4.5795 4.6352 4.6352 5.4697 5.4697 5.5548 5.5548 6.1293 6.1293 6.1970 6.1970 6.3966 6.3966 6.4375 6.4375 9.1458 9.1458 9.1593 9.1593 11.2384 11.2384 11.3032 11.3032 11.7026 11.7026 11.7746 11.7746 12.6595 12.6595 k =-0.1312 0.1811 0.8522 ( 6574 PWs) bands (ev): -8.1719 -8.1719 -8.1110 -8.1110 -8.0602 -8.0602 -7.9805 -7.9805 -7.4969 -7.4969 -7.3289 -7.3289 -7.2018 -7.2018 -7.1811 -7.1811 -7.1016 -7.1016 -7.0769 -7.0769 -5.6454 -5.6454 -5.6156 -5.6156 -5.1448 -5.1448 -5.1035 -5.1035 0.9067 0.9067 0.9144 0.9144 2.1654 2.1654 2.1849 2.1849 2.6020 2.6020 2.6571 2.6571 2.9604 2.9604 3.0560 3.0560 3.1625 3.1625 3.2271 3.2271 3.3448 3.3448 3.4773 3.4773 3.9627 3.9627 4.1608 4.1608 4.5701 4.5701 4.6281 4.6281 5.4408 5.4408 5.5328 5.5328 6.1222 6.1222 6.1916 6.1916 6.3744 6.3744 6.4159 6.4159 9.1753 9.1753 9.1894 9.1894 11.2408 11.2408 11.3208 11.3208 11.6417 11.6417 11.7217 11.7217 12.6624 12.6624 k =-0.1312 0.1811 0.8522 ( 6574 PWs) bands (ev): -8.1719 -8.1719 -8.1110 -8.1110 -8.0602 -8.0602 -7.9805 -7.9805 -7.4969 -7.4969 -7.3289 -7.3289 -7.2018 -7.2018 -7.1811 -7.1811 -7.1016 -7.1016 -7.0769 -7.0769 -5.6454 -5.6454 -5.6156 -5.6156 -5.1448 -5.1448 -5.1035 -5.1035 0.9067 0.9067 0.9144 0.9144 2.1654 2.1654 2.1849 2.1849 2.6020 2.6020 2.6571 2.6571 2.9604 2.9604 3.0560 3.0560 3.1625 3.1625 3.2271 3.2271 3.3448 3.3448 3.4773 3.4773 3.9627 3.9627 4.1608 4.1608 4.5701 4.5701 4.6281 4.6281 5.4408 5.4408 5.5328 5.5328 6.1222 6.1222 6.1916 6.1916 6.3744 6.3744 6.4159 6.4159 9.1753 9.1753 9.1894 9.1894 11.2408 11.2408 11.3208 11.3208 11.6417 11.6417 11.7217 11.7217 12.6624 12.6624 k =-0.1400 0.1932 0.8372 ( 6575 PWs) bands (ev): -8.1726 -8.1714 -8.1106 -8.1083 -8.0640 -8.0602 -7.9808 -7.9793 -7.4992 -7.4920 -7.3336 -7.3269 -7.2018 -7.2013 -7.1816 -7.1793 -7.1015 -7.1009 -7.0775 -7.0769 -5.6606 -5.6442 -5.6212 -5.6035 -5.1506 -5.1402 -5.1093 -5.0978 0.9022 0.9098 0.9198 0.9269 2.1631 2.1823 2.1836 2.2025 2.6016 2.6069 2.6582 2.6626 2.9537 2.9717 3.0530 3.0724 3.1342 3.1880 3.2038 3.2537 3.3472 3.3528 3.4797 3.4932 3.9617 3.9707 4.1567 4.1665 4.5494 4.5692 4.6183 4.6343 5.4079 5.4288 5.5081 5.5216 6.1097 6.1156 6.1765 6.1953 6.3511 6.3643 6.3974 6.4079 9.1964 9.2034 9.2102 9.2187 11.1891 11.2655 11.2901 11.3595 11.5954 11.6117 11.6857 11.6973 12.6566 12.6740 k =-0.1488 0.2054 0.8223 ( 6570 PWs) bands (ev): -8.1732 -8.1709 -8.1102 -8.1056 -8.0676 -8.0602 -7.9810 -7.9781 -7.5013 -7.4870 -7.3381 -7.3250 -7.2017 -7.2009 -7.1821 -7.1774 -7.1015 -7.1003 -7.0780 -7.0768 -5.6767 -5.6563 -5.6146 -5.5914 -5.1565 -5.1360 -5.1140 -5.0913 0.8983 0.9063 0.9323 0.9394 2.1620 2.1828 2.2012 2.2213 2.6013 2.6118 2.6589 2.6681 2.9467 2.9818 3.0452 3.0866 3.1090 3.1774 3.2170 3.2771 3.3522 3.3655 3.4860 3.5094 3.9624 3.9793 4.1530 4.1727 4.5246 4.5586 4.6185 4.6433 5.3753 5.4148 5.4827 5.5075 6.0882 6.1006 6.1577 6.1958 6.3278 6.3531 6.3862 6.4045 9.2219 9.2343 9.2366 9.2523 11.1255 11.2212 11.3020 11.3889 11.5608 11.5878 11.6589 11.6803 12.6491 12.6863 k =-0.1576 0.2175 0.8073 ( 6571 PWs) bands (ev): -8.1737 -8.1704 -8.1098 -8.1030 -8.0711 -8.0602 -7.9813 -7.9769 -7.5033 -7.4820 -7.3425 -7.3234 -7.2016 -7.2005 -7.1825 -7.1755 -7.1014 -7.0996 -7.0785 -7.0768 -5.6927 -5.6713 -5.6060 -5.5804 -5.1622 -5.1345 -5.1151 -5.0838 0.8950 0.9033 0.9447 0.9517 2.1623 2.1839 2.2206 2.2410 2.6009 2.6166 2.6592 2.6736 2.9395 2.9885 3.0330 3.0881 3.0988 3.1556 3.2431 3.2950 3.3595 3.3846 3.4955 3.5259 3.9647 3.9884 4.1497 4.1793 4.4980 4.5418 4.6250 4.6530 5.3436 5.3984 5.4569 5.4901 6.0591 6.0769 6.1355 6.1898 6.3081 6.3414 6.3827 6.4049 9.2509 9.2633 9.2726 9.2897 11.0540 11.1523 11.3145 11.4007 11.5435 11.5719 11.6388 11.6708 12.6400 12.6980 k =-0.1663 0.2296 0.7924 ( 6569 PWs) bands (ev): -8.1741 -8.1700 -8.1095 -8.1005 -8.0744 -8.0602 -7.9815 -7.9758 -7.5051 -7.4770 -7.3469 -7.3220 -7.2014 -7.2001 -7.1830 -7.1734 -7.1013 -7.0990 -7.0791 -7.0769 -5.7083 -5.6864 -5.5980 -5.5707 -5.1679 -5.1373 -5.1111 -5.0757 0.8922 0.9009 0.9569 0.9637 2.1640 2.1863 2.2408 2.2614 2.6005 2.6210 2.6590 2.6791 2.9320 2.9855 3.0238 3.0708 3.1067 3.1399 3.2682 3.3075 3.3691 3.4097 3.5078 3.5425 3.9684 3.9980 4.1467 4.1864 4.4707 4.5231 4.6338 4.6622 5.3137 5.3797 5.4311 5.4692 6.0240 6.0455 6.1093 6.1747 6.2951 6.3322 6.3845 6.4086 9.2830 9.2948 9.3125 9.3305 10.9777 11.0748 11.3156 11.3908 11.5386 11.5692 11.6235 11.6700 12.6295 12.7079 k =-0.1751 0.2417 0.7774 ( 6566 PWs) bands (ev): -8.1744 -8.1695 -8.1092 -8.0984 -8.0773 -8.0603 -7.9818 -7.9747 -7.5067 -7.4720 -7.3511 -7.3208 -7.2011 -7.1997 -7.1835 -7.1714 -7.1011 -7.0983 -7.0796 -7.0770 -5.7234 -5.7013 -5.5910 -5.5623 -5.1734 -5.1425 -5.1041 -5.0669 0.8899 0.8991 0.9688 0.9753 2.1668 2.1900 2.2615 2.2822 2.5999 2.6247 2.6585 2.6849 2.9241 2.9693 3.0225 3.0552 3.1057 3.1366 3.2915 3.3162 3.3808 3.4385 3.5222 3.5594 3.9732 4.0084 4.1439 4.1941 4.4436 4.5042 4.6433 4.6704 5.2859 5.3586 5.4058 5.4448 5.9844 6.0080 6.0793 6.1508 6.2888 6.3265 6.3898 6.4150 9.3174 9.3284 9.3554 9.3742 10.8989 10.9929 11.3061 11.3676 11.5325 11.5773 11.6166 11.6777 12.6178 12.7150 k =-0.1839 0.2538 0.7624 ( 6572 PWs) bands (ev): -8.1747 -8.1690 -8.1089 -8.0967 -8.0797 -8.0604 -7.9820 -7.9737 -7.5082 -7.4671 -7.3552 -7.3199 -7.2009 -7.1994 -7.1839 -7.1693 -7.1010 -7.0977 -7.0802 -7.0771 -5.7378 -5.7157 -5.5850 -5.5552 -5.1788 -5.1483 -5.0958 -5.0577 0.8882 0.8978 0.9802 0.9866 2.1709 2.1948 2.2826 2.3032 2.5989 2.6270 2.6583 2.6911 2.9155 2.9487 3.0170 3.0465 3.0990 3.1425 3.3121 3.3234 3.3941 3.4690 3.5381 3.5769 3.9783 4.0196 4.1411 4.2025 4.4174 4.4860 4.6529 4.6770 5.2607 5.3352 5.3812 5.4168 5.9415 5.9659 6.0464 6.1209 6.2868 6.3241 6.3974 6.4234 9.3533 9.3635 9.4009 9.4201 10.8194 10.9095 11.2892 11.3393 11.5256 11.5758 11.6281 11.6917 12.6048 12.7063 k =-0.1927 0.2660 0.7475 ( 6572 PWs) bands (ev): -8.1748 -8.1686 -8.1087 -8.0958 -8.0812 -8.0604 -7.9823 -7.9727 -7.5096 -7.4622 -7.3592 -7.3192 -7.2005 -7.1990 -7.1844 -7.1672 -7.1008 -7.0970 -7.0807 -7.0773 -5.7516 -5.7296 -5.5799 -5.5493 -5.1839 -5.1543 -5.0868 -5.0482 0.8869 0.8969 0.9912 0.9973 2.1762 2.2008 2.3036 2.3239 2.5969 2.6269 2.6590 2.6978 2.9055 2.9294 3.0023 3.0469 3.0931 3.1501 3.3255 3.3344 3.4089 3.4998 3.5542 3.5959 3.9833 4.0320 4.1382 4.2115 4.3930 4.4692 4.6620 4.6818 5.2383 5.3098 5.3578 5.3855 5.8966 5.9203 6.0115 6.0876 6.2870 6.3242 6.4069 6.4335 9.3901 9.3994 9.4482 9.4679 10.7406 10.8263 11.2678 11.3098 11.5194 11.5670 11.6497 11.7095 12.5904 12.6884 k =-0.2015 0.2781 0.7325 ( 6568 PWs) bands (ev): -8.1749 -8.1682 -8.1086 -8.0960 -8.0814 -8.0605 -7.9825 -7.9717 -7.5107 -7.4574 -7.3629 -7.3186 -7.2001 -7.1987 -7.1849 -7.1651 -7.1005 -7.0964 -7.0813 -7.0775 -5.7646 -5.7429 -5.5756 -5.5444 -5.1888 -5.1603 -5.0774 -5.0385 0.8859 0.8964 1.0017 1.0076 2.1826 2.2079 2.3243 2.3442 2.5933 2.6241 2.6612 2.7054 2.8928 2.9146 2.9858 3.0484 3.0900 3.1572 3.3315 3.3497 3.4247 3.5304 3.5693 3.6170 3.9872 4.0458 4.1352 4.2211 4.3715 4.4543 4.6705 4.6845 5.2182 5.2829 5.3357 5.3511 5.8506 5.8726 5.9758 6.0528 6.2880 6.3259 6.4177 6.4448 9.4270 9.4354 9.4968 9.5167 10.6636 10.7445 11.2442 11.2807 11.5148 11.5586 11.6725 11.7288 12.5747 12.6686 k =-0.2103 0.2902 0.7175 ( 6574 PWs) bands (ev): -8.1748 -8.1678 -8.1086 -8.0971 -8.0806 -8.0606 -7.9828 -7.9709 -7.5118 -7.4527 -7.3666 -7.3183 -7.1998 -7.1984 -7.1854 -7.1631 -7.1003 -7.0958 -7.0818 -7.0777 -5.7769 -5.7555 -5.5722 -5.5404 -5.1934 -5.1662 -5.0679 -5.0289 0.8853 0.8963 1.0116 1.0172 2.1902 2.2160 2.3442 2.3635 2.5873 2.6190 2.6645 2.7140 2.8782 2.9048 2.9711 3.0476 3.0900 3.1633 3.3362 3.3630 3.4413 3.5601 3.5825 3.6404 3.9891 4.0608 4.1319 4.2314 4.3538 4.4416 4.6779 4.6853 5.1989 5.2560 5.3140 5.3153 5.8044 5.8237 5.9403 6.0175 6.2894 6.3286 6.4294 6.4569 9.4634 9.4708 9.5461 9.5660 10.5893 10.6653 11.2200 11.2527 11.5122 11.5528 11.6939 11.7483 12.5576 12.6470 k =-0.2190 0.3023 0.7026 ( 6570 PWs) bands (ev): -8.1747 -8.1675 -8.1088 -8.0986 -8.0791 -8.0607 -7.9830 -7.9701 -7.5127 -7.4482 -7.3700 -7.3181 -7.1994 -7.1981 -7.1858 -7.1611 -7.1000 -7.0951 -7.0824 -7.0780 -5.7883 -5.7673 -5.5694 -5.5373 -5.1976 -5.1718 -5.0585 -5.0194 0.8850 0.8965 1.0209 1.0262 2.1987 2.2249 2.3631 2.3817 2.5781 2.6126 2.6684 2.7238 2.8641 2.8988 2.9592 3.0442 3.0925 3.1679 3.3405 3.3736 3.4583 3.5871 3.5957 3.6656 3.9883 4.0766 4.1291 4.2421 4.3414 4.4312 4.6821 4.6864 5.1774 5.2313 5.2759 5.2965 5.7590 5.7748 5.9056 5.9825 6.2909 6.3318 6.4418 6.4694 9.4986 9.5049 9.5954 9.6150 10.5185 10.5893 11.1962 11.2263 11.5123 11.5504 11.7135 11.7672 12.5392 12.6237 k =-0.2278 0.3144 0.6876 ( 6576 PWs) bands (ev): -8.1745 -8.1672 -8.1093 -8.1001 -8.0774 -8.0608 -7.9833 -7.9694 -7.5135 -7.4438 -7.3733 -7.3180 -7.1990 -7.1978 -7.1863 -7.1592 -7.0998 -7.0946 -7.0829 -7.0783 -5.7989 -5.7783 -5.5671 -5.5349 -5.2016 -5.1772 -5.0493 -5.0102 0.8850 0.8969 1.0296 1.0345 2.2083 2.2347 2.3805 2.3985 2.5655 2.6050 2.6723 2.7346 2.8519 2.8961 2.9502 3.0393 3.0960 3.1711 3.3441 3.3813 3.4753 3.5998 3.6204 3.6916 3.9845 4.0906 4.1289 4.2532 4.3352 4.4233 4.6799 4.6911 5.1503 5.2073 5.2416 5.2793 5.7150 5.7267 5.8726 5.9482 6.2923 6.3351 6.4544 6.4822 9.5321 9.5373 9.6439 9.6632 10.4518 10.5172 11.1733 11.2017 11.5152 11.5519 11.7311 11.7852 12.5196 12.5989 k =-0.2366 0.3266 0.6726 ( 6572 PWs) bands (ev): -8.1743 -8.1669 -8.1101 -8.1013 -8.0756 -8.0608 -7.9835 -7.9687 -7.5141 -7.4397 -7.3763 -7.3180 -7.1986 -7.1974 -7.1868 -7.1574 -7.0995 -7.0940 -7.0834 -7.0786 -5.8085 -5.7884 -5.5654 -5.5331 -5.2052 -5.1822 -5.0405 -5.0015 0.8851 0.8975 1.0375 1.0421 2.2188 2.2452 2.3961 2.4136 2.5503 2.5961 2.6759 2.7464 2.8421 2.8971 2.9440 3.0338 3.0997 3.1727 3.3471 3.3864 3.4920 3.6067 3.6484 3.7175 3.9778 4.0965 4.1371 4.2644 4.3359 4.4177 4.6759 4.6954 5.1179 5.1734 5.2221 5.2637 5.6727 5.6810 5.8417 5.9151 6.2936 6.3384 6.4670 6.4949 9.5634 9.5675 9.6911 9.7099 10.3898 10.4496 11.1519 11.1791 11.5213 11.5572 11.7469 11.8022 12.4989 12.5725 k =-0.2454 0.3387 0.6577 ( 6573 PWs) bands (ev): -8.1740 -8.1667 -8.1112 -8.1021 -8.0738 -8.0609 -7.9838 -7.9681 -7.5147 -7.4358 -7.3792 -7.3182 -7.1983 -7.1970 -7.1872 -7.1557 -7.0992 -7.0934 -7.0839 -7.0790 -5.8172 -5.7977 -5.5640 -5.5317 -5.2084 -5.1869 -5.0322 -4.9934 0.8854 0.8982 1.0447 1.0489 2.2303 2.2564 2.4095 2.4267 2.5334 2.5854 2.6791 2.7583 2.8353 2.9016 2.9405 3.0282 3.1029 3.1729 3.3492 3.3887 3.5081 3.6116 3.6760 3.7426 3.9687 4.0935 4.1543 4.2758 4.3433 4.4142 4.6710 4.6988 5.0821 5.1310 5.2141 5.2496 5.6316 5.6398 5.8135 5.8835 6.2948 6.3415 6.4792 6.5071 9.5919 9.5950 9.7362 9.7543 10.3331 10.3871 11.1322 11.1586 11.5305 11.5661 11.7612 11.8183 12.4771 12.5447 k =-0.2542 0.3508 0.6427 ( 6578 PWs) bands (ev): -8.1736 -8.1666 -8.1126 -8.1027 -8.0722 -8.0610 -7.9840 -7.9676 -7.5152 -7.4322 -7.3818 -7.3184 -7.1981 -7.1966 -7.1877 -7.1541 -7.0989 -7.0929 -7.0843 -7.0793 -5.8249 -5.8059 -5.5630 -5.5308 -5.2112 -5.1912 -5.0246 -4.9859 0.8858 0.8989 1.0512 1.0550 2.2426 2.2680 2.4207 2.4376 2.5161 2.5731 2.6819 2.7695 2.8320 2.9084 2.9400 3.0228 3.1055 3.1716 3.3502 3.3886 3.5231 3.6150 3.7027 3.7662 3.9579 4.0866 4.1753 4.2879 4.3560 4.4125 4.6659 4.7010 5.0449 5.0862 5.2104 5.2372 5.5921 5.6040 5.7883 5.8537 6.2959 6.3443 6.4908 6.5187 9.6174 9.6196 9.7785 9.7959 10.2820 10.3301 11.1145 11.1404 11.5425 11.5781 11.7741 11.8337 12.4545 12.5158 k =-0.2629 0.3629 0.6277 ( 6577 PWs) bands (ev): -8.1732 -8.1665 -8.1140 -8.1029 -8.0707 -8.0610 -7.9842 -7.9672 -7.5156 -7.4288 -7.3842 -7.3186 -7.1979 -7.1963 -7.1881 -7.1527 -7.0986 -7.0925 -7.0848 -7.0796 -5.8316 -5.8132 -5.5622 -5.5301 -5.2136 -5.1951 -5.0178 -4.9793 0.8862 0.8997 1.0568 1.0603 2.2557 2.2798 2.4290 2.4456 2.4999 2.5595 2.6844 2.7784 2.8329 2.9151 2.9439 3.0182 3.1073 3.1687 3.3503 3.3863 3.5367 3.6173 3.7282 3.7879 3.9462 4.0784 4.1971 4.3007 4.3724 4.4129 4.6609 4.7023 5.0074 5.0414 5.2082 5.2266 5.5561 5.5732 5.7665 5.8261 6.2968 6.3468 6.5014 6.5293 9.6395 9.6410 9.8173 9.8339 10.2370 10.2789 11.0989 11.1245 11.5568 11.5924 11.7859 11.8485 12.4314 12.4861 k =-0.2717 0.3750 0.6128 ( 6575 PWs) bands (ev): -8.1728 -8.1665 -8.1153 -8.1031 -8.0693 -8.0611 -7.9844 -7.9668 -7.5159 -7.4259 -7.3864 -7.3189 -7.1977 -7.1959 -7.1885 -7.1515 -7.0984 -7.0921 -7.0851 -7.0799 -5.8373 -5.8194 -5.5617 -5.5296 -5.2156 -5.1985 -5.0119 -4.9735 0.8867 0.9005 1.0617 1.0647 2.2695 2.2916 2.4328 2.4501 2.4880 2.5454 2.6865 2.7839 2.8381 2.9195 2.9528 3.0149 3.1085 3.1644 3.3497 3.3822 3.5488 3.6187 3.7521 3.8073 3.9344 4.0701 4.2183 4.3132 4.3906 4.4161 4.6563 4.7028 4.9707 4.9985 5.2059 5.2181 5.5249 5.5471 5.7485 5.8011 6.2976 6.3489 6.5109 6.5388 9.6581 9.6593 9.8519 9.8679 10.1985 10.2341 11.0856 11.1109 11.5725 11.6080 11.7967 11.8626 12.4084 12.4565 k =-0.2805 0.3871 0.5978 ( 6578 PWs) bands (ev): -8.1724 -8.1665 -8.1165 -8.1031 -8.0682 -8.0611 -7.9846 -7.9665 -7.5161 -7.4233 -7.3882 -7.3191 -7.1976 -7.1955 -7.1889 -7.1505 -7.0982 -7.0917 -7.0854 -7.0802 -5.8420 -5.8246 -5.5613 -5.5294 -5.2172 -5.2013 -5.0070 -4.9687 0.8871 0.9012 1.0657 1.0683 2.2838 2.3029 2.4280 2.4530 2.4830 2.5315 2.6883 2.7864 2.8463 2.9220 2.9640 3.0136 3.1093 3.1586 3.3485 3.3769 3.5589 3.6195 3.7741 3.8239 3.9228 4.0624 4.2380 4.3238 4.4079 4.4237 4.6523 4.7024 4.9358 4.9592 5.2025 5.2122 5.4993 5.5258 5.7345 5.7789 6.2982 6.3507 6.5190 6.5469 9.6731 9.6742 9.8817 9.8973 10.1668 10.1958 11.0746 11.0998 11.5883 11.6235 11.8063 11.8759 12.3864 12.4281 k =-0.2893 0.3993 0.5828 ( 6588 PWs) bands (ev): -8.1721 -8.1665 -8.1174 -8.1032 -8.0674 -8.0612 -7.9847 -7.9663 -7.5163 -7.4212 -7.3898 -7.3194 -7.1975 -7.1952 -7.1892 -7.1497 -7.0980 -7.0915 -7.0857 -7.0805 -5.8457 -5.8287 -5.5610 -5.5292 -5.2184 -5.2036 -5.0031 -4.9649 0.8874 0.9017 1.0689 1.0711 2.2985 2.3133 2.4155 2.4564 2.4825 2.5190 2.6897 2.7872 2.8552 2.9238 2.9735 3.0157 3.1104 3.1514 3.3472 3.3713 3.5670 3.6198 3.7937 3.8371 3.9121 4.0557 4.2553 4.3306 4.4222 4.4365 4.6489 4.7015 4.9042 4.9258 5.1989 5.2080 5.4796 5.5091 5.7247 5.7599 6.2987 6.3520 6.5256 6.5534 9.6846 9.6859 9.9061 9.9215 10.1421 10.1643 11.0659 11.0911 11.6030 11.6377 11.8146 11.8878 12.3667 12.4026 k =-0.2981 0.4114 0.5679 ( 6576 PWs) bands (ev): -8.1718 -8.1665 -8.1181 -8.1032 -8.0667 -8.0612 -7.9848 -7.9661 -7.5164 -7.4196 -7.3909 -7.3195 -7.1974 -7.1950 -7.1894 -7.1491 -7.0978 -7.0913 -7.0858 -7.0806 -5.8483 -5.8316 -5.5609 -5.5291 -5.2193 -5.2053 -5.0002 -4.9621 0.8877 0.9022 1.0712 1.0731 2.3127 2.3220 2.4006 2.4597 2.4826 2.5093 2.6908 2.7873 2.8627 2.9253 2.9788 3.0211 3.1124 3.1432 3.3461 3.3662 3.5729 3.6200 3.8103 3.8463 3.9028 4.0506 4.2695 4.3333 4.4348 4.4497 4.6464 4.7004 4.8779 4.9005 5.1963 5.2045 5.4658 5.4972 5.7190 5.7446 6.2991 6.3530 6.5304 6.5581 9.6926 9.6941 9.9244 9.9398 10.1249 10.1400 11.0597 11.0848 11.6148 11.6491 11.8211 11.8975 12.3510 12.3819 k =-0.3068 0.4235 0.5529 ( 6572 PWs) bands (ev): -8.1716 -8.1666 -8.1185 -8.1032 -8.0663 -8.0612 -7.9848 -7.9660 -7.5165 -7.4186 -7.3916 -7.3196 -7.1973 -7.1948 -7.1896 -7.1487 -7.0977 -7.0911 -7.0859 -7.0807 -5.8498 -5.8333 -5.5608 -5.5291 -5.2198 -5.2063 -4.9985 -4.9604 0.8879 0.9024 1.0726 1.0743 2.3238 2.3290 2.3873 2.4622 2.4817 2.5037 2.6914 2.7872 2.8677 2.9264 2.9809 3.0266 3.1158 3.1350 3.3454 3.3626 3.5765 3.6201 3.8223 3.8513 3.8960 4.0474 4.2793 4.3332 4.4448 4.4587 4.6448 4.6995 4.8600 4.8847 5.1952 5.2016 5.4578 5.4900 5.7172 5.7338 6.2993 6.3536 6.5333 6.5610 9.6974 9.6991 9.9357 9.9514 10.1157 10.1234 11.0560 11.0811 11.6226 11.6564 11.8254 11.9039 12.3407 12.3682 k =-0.3156 0.4356 0.5379 ( 6566 PWs) bands (ev): -8.1715 -8.1666 -8.1187 -8.1031 -8.0662 -8.0612 -7.9848 -7.9660 -7.5165 -7.4182 -7.3919 -7.3197 -7.1973 -7.1947 -7.1896 -7.1486 -7.0977 -7.0910 -7.0859 -7.0807 -5.8504 -5.8339 -5.5607 -5.5290 -5.2199 -5.2066 -4.9979 -4.9599 0.8880 0.9025 1.0731 1.0746 2.3274 2.3331 2.3812 2.4633 2.4809 2.5020 2.6916 2.7872 2.8694 2.9268 2.9814 3.0289 3.1186 3.1305 3.3452 3.3613 3.5777 3.6201 3.8271 3.8525 3.8935 4.0463 4.2829 4.3327 4.4488 4.4617 4.6443 4.6991 4.8536 4.8794 5.1951 5.2003 5.4552 5.4876 5.7174 5.7293 6.2994 6.3538 6.5343 6.5620 9.6990 9.7007 9.9396 9.9555 10.1148 10.1156 11.0548 11.0798 11.6254 11.6590 11.8269 11.9062 12.3372 12.3634 k =-0.3156 0.4356 0.5379 ( 6566 PWs) bands (ev): -8.1715 -8.1666 -8.1187 -8.1031 -8.0662 -8.0612 -7.9848 -7.9660 -7.5165 -7.4182 -7.3919 -7.3197 -7.1973 -7.1947 -7.1896 -7.1486 -7.0977 -7.0910 -7.0859 -7.0807 -5.8504 -5.8339 -5.5607 -5.5290 -5.2199 -5.2066 -4.9979 -4.9599 0.8880 0.9025 1.0731 1.0746 2.3274 2.3331 2.3812 2.4633 2.4809 2.5020 2.6916 2.7872 2.8694 2.9268 2.9814 3.0289 3.1186 3.1305 3.3452 3.3613 3.5777 3.6201 3.8271 3.8525 3.8935 4.0463 4.2829 4.3327 4.4488 4.4617 4.6443 4.6991 4.8536 4.8794 5.1951 5.2003 5.4552 5.4876 5.7174 5.7293 6.2994 6.3538 6.5343 6.5620 9.6990 9.7007 9.9396 9.9555 10.1148 10.1156 11.0548 11.0798 11.6254 11.6590 11.8269 11.9062 12.3372 12.3634 k =-0.3066 0.4232 0.5226 ( 6568 PWs) bands (ev): -8.1718 -8.1674 -8.1179 -8.1059 -8.0690 -8.0564 -7.9834 -7.9651 -7.5215 -7.4164 -7.3935 -7.3147 -7.1980 -7.1956 -7.1904 -7.1470 -7.0984 -7.0910 -7.0861 -7.0805 -5.8658 -5.8504 -5.5393 -5.5075 -5.2244 -5.2095 -4.9965 -4.9574 0.8803 0.8940 1.0878 1.0888 2.2995 2.3114 2.3844 2.4693 2.4903 2.5029 2.6799 2.7661 2.8730 2.9234 2.9801 3.0255 3.1226 3.1319 3.3439 3.3585 3.5727 3.6218 3.8054 3.8377 3.8983 4.0437 4.2936 4.3503 4.4693 4.4806 4.6586 4.7107 4.8396 4.8721 5.1564 5.1615 5.4473 5.4803 5.7228 5.7390 6.3010 6.3524 6.5471 6.5740 9.6877 9.6895 9.9595 9.9748 10.1467 10.1468 11.1320 11.1486 11.7230 11.7467 11.9330 12.0146 12.3417 12.3787 k =-0.2976 0.4107 0.5072 ( 6564 PWs) bands (ev): -8.1720 -8.1681 -8.1183 -8.1074 -8.0719 -8.0514 -7.9821 -7.9644 -7.5263 -7.4144 -7.3954 -7.3097 -7.1986 -7.1962 -7.1911 -7.1454 -7.0991 -7.0910 -7.0864 -7.0803 -5.8834 -5.8692 -5.5174 -5.4856 -5.2269 -5.2104 -4.9950 -4.9550 0.8716 0.8843 1.1031 1.1035 2.2721 2.2888 2.3885 2.4741 2.4962 2.5095 2.6700 2.7454 2.8779 2.9199 2.9791 3.0219 3.1245 3.1322 3.3450 3.3594 3.5669 3.6228 3.7824 3.8222 3.9031 4.0419 4.3003 4.3620 4.4869 4.4964 4.6699 4.7191 4.8343 4.8725 5.1195 5.1245 5.4410 5.4738 5.7338 5.7548 6.2987 6.3467 6.5578 6.5836 9.6743 9.6763 9.9811 9.9958 10.1792 10.1802 11.2018 11.2101 11.8217 11.8362 12.0364 12.1207 12.3313 12.3804 k =-0.2886 0.3983 0.4918 ( 6572 PWs) bands (ev): -8.1721 -8.1688 -8.1200 -8.1073 -8.0748 -8.0465 -7.9807 -7.9638 -7.5309 -7.4122 -7.3976 -7.3048 -7.1993 -7.1966 -7.1919 -7.1438 -7.0999 -7.0909 -7.0867 -7.0801 -5.9031 -5.8900 -5.4952 -5.4635 -5.2273 -5.2094 -4.9936 -4.9527 0.8618 0.8734 1.1189 1.1192 2.2458 2.2664 2.3933 2.4771 2.4990 2.5199 2.6628 2.7265 2.8830 2.9163 2.9768 3.0194 3.1253 3.1316 3.3482 3.3635 3.5601 3.6228 3.7582 3.8060 3.9077 4.0410 4.3026 4.3669 4.5003 4.5083 4.6782 4.7265 4.8388 4.8793 5.0847 5.0900 5.4367 5.4689 5.7498 5.7760 6.2927 6.3365 6.5666 6.5911 9.6584 9.6606 10.0046 10.0184 10.2129 10.2150 11.2633 11.2638 11.9189 11.9265 12.1348 12.2229 12.3061 12.3677 k =-0.2795 0.3858 0.4765 ( 6570 PWs) bands (ev): -8.1722 -8.1694 -8.1227 -8.1060 -8.0778 -8.0415 -7.9794 -7.9634 -7.5353 -7.4098 -7.4000 -7.2998 -7.2001 -7.1968 -7.1926 -7.1422 -7.1006 -7.0908 -7.0871 -7.0800 -5.9246 -5.9127 -5.4726 -5.4411 -5.2258 -5.2065 -4.9922 -4.9505 0.8509 0.8614 1.1350 1.1360 2.2212 2.2450 2.3988 2.4779 2.5014 2.5304 2.6588 2.7102 2.8858 2.9149 2.9710 3.0203 3.1259 3.1305 3.3528 3.3699 3.5523 3.6218 3.7333 3.7893 3.9119 4.0412 4.3009 4.3646 4.5086 4.5159 4.6832 4.7344 4.8536 4.8907 5.0524 5.0590 5.4343 5.4658 5.7704 5.8020 6.2828 6.3220 6.5737 6.5970 9.6397 9.6421 10.0298 10.0427 10.2479 10.2511 11.3096 11.3158 12.0096 12.0142 12.2231 12.2699 12.3187 12.3441 k =-0.2705 0.3734 0.4611 ( 6570 PWs) bands (ev): -8.1722 -8.1699 -8.1258 -8.1042 -8.0808 -8.0365 -7.9781 -7.9632 -7.5394 -7.4072 -7.4026 -7.2949 -7.2009 -7.1968 -7.1932 -7.1407 -7.1014 -7.0907 -7.0874 -7.0798 -5.9478 -5.9370 -5.4497 -5.4187 -5.2225 -5.2020 -4.9908 -4.9485 0.8388 0.8481 1.1517 1.1536 2.1985 2.2250 2.4047 2.4762 2.5036 2.5395 2.6583 2.6970 2.8827 2.9194 2.9609 3.0254 3.1268 3.1290 3.3583 3.3778 3.5436 3.6195 3.7078 3.7725 3.9155 4.0425 4.2955 4.3559 4.5115 4.5193 4.6851 4.7426 4.8779 4.9053 5.0229 5.0329 5.4337 5.4649 5.7951 5.8323 6.2693 6.3032 6.5794 6.6015 9.6177 9.6204 10.0569 10.0687 10.2842 10.2887 11.3475 11.3595 12.0815 12.0870 12.2291 12.2989 12.3214 12.4036 k =-0.2615 0.3609 0.4457 ( 6580 PWs) bands (ev): -8.1721 -8.1704 -8.1289 -8.1020 -8.0838 -8.0316 -7.9768 -7.9631 -7.5433 -7.4055 -7.4043 -7.2900 -7.2017 -7.1966 -7.1939 -7.1391 -7.1021 -7.0906 -7.0879 -7.0797 -5.9726 -5.9628 -5.4267 -5.3961 -5.2176 -5.1960 -4.9895 -4.9466 0.8256 0.8337 1.1691 1.1719 2.1782 2.2070 2.4111 2.4723 2.5055 2.5464 2.6609 2.6874 2.8742 2.9297 2.9473 3.0341 3.1272 3.1286 3.3640 3.3864 3.5338 3.6157 3.6822 3.7557 3.9181 4.0448 4.2876 4.3416 4.5095 4.5190 4.6840 4.7490 4.9096 4.9207 4.9969 5.0150 5.4345 5.4660 5.8235 5.8663 6.2522 6.2802 6.5842 6.6052 9.5919 9.5951 10.0856 10.0963 10.3218 10.3276 11.3774 11.3944 12.0929 12.1069 12.2438 12.3275 12.3374 12.4031 k =-0.2525 0.3485 0.4304 ( 6582 PWs) bands (ev): -8.1720 -8.1708 -8.1321 -8.0996 -8.0869 -8.0268 -7.9755 -7.9631 -7.5469 -7.4085 -7.4013 -7.2853 -7.2024 -7.1962 -7.1945 -7.1376 -7.1028 -7.0904 -7.0883 -7.0795 -5.9985 -5.9898 -5.4036 -5.3736 -5.2112 -5.1888 -4.9882 -4.9449 0.8112 0.8182 1.1872 1.1909 2.1604 2.1913 2.4178 2.4668 2.5067 2.5505 2.6661 2.6817 2.8631 2.9315 2.9438 3.0454 3.1253 3.1313 3.3696 3.3949 3.5229 3.6102 3.6567 3.7397 3.9195 4.0480 4.2780 4.3231 4.5038 4.5157 4.6801 4.7514 4.9298 4.9429 4.9784 5.0129 5.4359 5.4688 5.8551 5.9036 6.2321 6.2535 6.5884 6.6088 9.5620 9.5656 10.1158 10.1253 10.3609 10.3680 11.3994 11.4209 12.0322 12.0752 12.3090 12.3317 12.3525 12.3749 k =-0.2435 0.3361 0.4150 ( 6582 PWs) bands (ev): -8.1719 -8.1712 -8.1352 -8.0970 -8.0899 -8.0220 -7.9742 -7.9633 -7.5503 -7.4118 -7.3980 -7.2807 -7.2031 -7.1956 -7.1951 -7.1360 -7.1035 -7.0903 -7.0887 -7.0794 -6.0256 -6.0178 -5.3805 -5.3511 -5.2035 -5.1804 -4.9869 -4.9434 0.7958 0.8016 1.2060 1.2107 2.1454 2.1782 2.4248 2.4602 2.5067 2.5522 2.6732 2.6794 2.8507 2.9143 2.9606 3.0586 3.1233 3.1352 3.3745 3.4027 3.5111 3.6025 3.6319 3.7248 3.9195 4.0520 4.2677 4.3015 4.4951 4.5103 4.6737 4.7488 4.9268 4.9438 5.0000 5.0323 5.4373 5.4729 5.8894 5.9437 6.2093 6.2232 6.5926 6.6127 9.5275 9.5316 10.1473 10.1557 10.4016 10.4100 11.4128 11.4388 11.9530 12.0141 12.2984 12.3027 12.3795 12.4346 k =-0.2345 0.3236 0.3996 ( 6588 PWs) bands (ev): -8.1717 -8.1715 -8.1382 -8.0943 -8.0929 -8.0172 -7.9730 -7.9636 -7.5533 -7.4152 -7.3946 -7.2763 -7.2037 -7.1956 -7.1947 -7.1344 -7.1042 -7.0903 -7.0890 -7.0793 -6.0534 -6.0465 -5.3574 -5.3288 -5.1948 -5.1712 -4.9857 -4.9420 0.7793 0.7840 1.2255 1.2313 2.1334 2.1679 2.4318 2.4533 2.5049 2.5524 2.6797 2.6816 2.8380 2.8964 2.9796 3.0729 3.1215 3.1400 3.3784 3.4089 3.4985 3.5925 3.6081 3.7117 3.9180 4.0563 4.2576 4.2780 4.4843 4.5035 4.6650 4.7412 4.9169 4.9274 5.0450 5.0666 5.4379 5.4776 5.9255 5.9864 6.1848 6.1898 6.5974 6.6175 9.4881 9.4927 10.1800 10.1871 10.4440 10.4537 11.4164 11.4468 11.8689 11.9430 12.2525 12.2564 12.4423 12.4925 k =-0.2254 0.3112 0.3842 ( 6568 PWs) bands (ev): -8.1718 -8.1713 -8.1410 -8.0959 -8.0914 -8.0125 -7.9717 -7.9640 -7.5560 -7.4188 -7.3909 -7.2721 -7.2042 -7.1961 -7.1935 -7.1328 -7.1048 -7.0905 -7.0890 -7.0792 -6.0818 -6.0757 -5.3345 -5.3068 -5.1852 -5.1611 -4.9846 -4.9407 0.7618 0.7655 1.2457 1.2526 2.1245 2.1607 2.4375 2.4476 2.5012 2.5521 2.6816 2.6907 2.8258 2.8783 3.0002 3.0873 3.1204 3.1461 3.3811 3.4124 3.4857 3.5803 3.5860 3.7006 3.9149 4.0605 4.2483 4.2538 4.4720 4.4958 4.6541 4.7299 4.9052 4.9118 5.0941 5.1088 5.4371 5.4824 5.9618 6.0312 6.1538 6.1604 6.6033 6.6240 9.4435 9.4486 10.2133 10.2193 10.4882 10.4992 11.4076 11.4411 11.7883 11.8719 12.2024 12.2107 12.4958 12.5430 k =-0.2164 0.2987 0.3689 ( 6574 PWs) bands (ev): -8.1720 -8.1710 -8.1438 -8.0989 -8.0885 -8.0080 -7.9704 -7.9647 -7.5584 -7.4225 -7.3871 -7.2683 -7.2045 -7.1966 -7.1921 -7.1313 -7.1055 -7.0909 -7.0889 -7.0791 -6.1107 -6.1053 -5.3118 -5.2850 -5.1748 -5.1505 -4.9835 -4.9397 0.7435 0.7463 1.2665 1.2746 2.1187 2.1566 2.4357 2.4496 2.4955 2.5517 2.6842 2.7002 2.8145 2.8602 3.0217 3.0990 3.1224 3.1534 3.3821 3.4115 3.4740 3.5659 3.5660 3.6918 3.9101 4.0638 4.2300 4.2402 4.4585 4.4877 4.6413 4.7159 4.8933 4.8982 5.1450 5.1554 5.4342 5.4865 5.9945 6.0777 6.1159 6.1402 6.6107 6.6324 9.3936 9.3991 10.2471 10.2519 10.5344 10.5466 11.3823 11.4145 11.7215 11.8090 12.1525 12.1634 12.5390 12.5849 k =-0.2074 0.2863 0.3535 ( 6570 PWs) bands (ev): -8.1721 -8.1707 -8.1464 -8.1018 -8.0854 -8.0036 -7.9692 -7.9654 -7.5605 -7.4264 -7.3831 -7.2648 -7.2048 -7.1970 -7.1904 -7.1297 -7.1061 -7.0915 -7.0887 -7.0790 -6.1398 -6.1350 -5.2894 -5.2636 -5.1638 -5.1394 -4.9824 -4.9387 0.7244 0.7264 1.2881 1.2974 2.1161 2.1556 2.4297 2.4562 2.4882 2.5516 2.6868 2.7098 2.8046 2.8426 3.0429 3.1034 3.1315 3.1622 3.3815 3.4042 3.4651 3.5483 3.5503 3.6851 3.9041 4.0653 4.2076 4.2335 4.4441 4.4797 4.6265 4.7001 4.8816 4.8869 5.1962 5.2046 5.4292 5.4895 6.0141 6.0770 6.1257 6.1343 6.6202 6.6432 9.3382 9.3442 10.2807 10.2845 10.5827 10.5960 11.3368 11.3602 11.6775 11.7605 12.1032 12.1155 12.5683 12.6000 k =-0.1984 0.2738 0.3381 ( 6558 PWs) bands (ev): -8.1722 -8.1702 -8.1489 -8.1047 -8.0823 -7.9993 -7.9680 -7.9662 -7.5622 -7.4304 -7.3790 -7.2617 -7.2048 -7.1973 -7.1883 -7.1281 -7.1066 -7.0921 -7.0884 -7.0789 -6.1689 -6.1648 -5.2673 -5.2426 -5.1524 -5.1280 -4.9814 -4.9380 0.7048 0.7060 1.3104 1.3209 2.1167 2.1578 2.4238 2.4631 2.4799 2.5515 2.6889 2.7192 2.7966 2.8260 3.0629 3.1025 3.1450 3.1727 3.3790 3.3906 3.4592 3.5337 3.5339 3.6803 3.8971 4.0638 4.1882 4.2280 4.4289 4.4721 4.6099 4.6833 4.8706 4.8780 5.2463 5.2546 5.4224 5.4910 6.0108 6.0381 6.1532 6.1747 6.6321 6.6566 9.2775 9.2839 10.3137 10.3166 10.6332 10.6476 11.2712 11.2810 11.6557 11.7285 12.0546 12.0679 12.5712 12.5787 k =-0.1894 0.2614 0.3228 ( 6558 PWs) bands (ev): -8.1723 -8.1697 -8.1513 -8.1076 -8.0790 -7.9952 -7.9672 -7.9668 -7.5636 -7.4345 -7.3747 -7.2590 -7.2047 -7.1977 -7.1860 -7.1265 -7.1072 -7.0927 -7.0880 -7.0788 -6.1979 -6.1944 -5.2457 -5.2222 -5.1406 -5.1164 -4.9804 -4.9373 0.6847 0.6852 1.3333 1.3451 2.1204 2.1632 2.4186 2.4698 2.4708 2.5513 2.6901 2.7280 2.7905 2.8106 3.0804 3.0999 3.1586 3.1848 3.3726 3.3747 3.4539 3.5174 3.5228 3.6774 3.8896 4.0582 4.1729 4.2233 4.4127 4.4651 4.5914 4.6658 4.8606 4.8717 5.2925 5.3039 5.4149 5.4904 5.9927 6.0007 6.1897 6.2245 6.6465 6.6727 9.2116 9.2184 10.3456 10.3477 10.6857 10.7014 11.1865 11.1895 11.6479 11.7102 12.0072 12.0211 12.5522 12.5539 k =-0.1804 0.2489 0.3074 ( 6552 PWs) bands (ev): -8.1723 -8.1692 -8.1535 -8.1104 -8.0757 -7.9912 -7.9682 -7.9656 -7.5647 -7.4387 -7.3703 -7.2569 -7.2046 -7.1979 -7.1832 -7.1249 -7.1076 -7.0934 -7.0876 -7.0788 -6.2267 -6.2237 -5.2246 -5.2024 -5.1287 -5.1047 -4.9795 -4.9368 0.6643 0.6643 1.3568 1.3699 2.1269 2.1717 2.4145 2.4615 2.4760 2.5509 2.6905 2.7356 2.7866 2.7975 3.0950 3.0966 3.1707 3.1977 3.3529 3.3688 3.4474 3.5012 3.5165 3.6760 3.8819 4.0481 4.1619 4.2192 4.3956 4.4584 4.5714 4.6476 4.8524 4.8682 5.3286 5.3505 5.4115 5.4878 5.9671 5.9715 6.2340 6.2747 6.6636 6.6914 9.1408 9.1479 10.3756 10.3770 10.7401 10.7573 11.0848 11.0974 11.6473 11.7012 11.9617 11.9757 12.5233 12.5300 k =-0.1713 0.2365 0.2920 ( 6562 PWs) bands (ev): -8.1724 -8.1687 -8.1556 -8.1132 -8.0724 -7.9876 -7.9692 -7.9644 -7.5655 -7.4430 -7.3658 -7.2552 -7.2043 -7.1982 -7.1802 -7.1234 -7.1081 -7.0941 -7.0872 -7.0787 -6.2551 -6.2526 -5.2041 -5.1832 -5.1167 -5.0931 -4.9786 -4.9365 0.6433 0.6437 1.3810 1.3952 2.1361 2.1831 2.4115 2.4519 2.4816 2.5504 2.6900 2.7407 2.7847 2.7881 3.0929 3.1065 3.1800 3.2095 3.3332 3.3617 3.4388 3.4858 3.5152 3.6760 3.8745 4.0345 4.1544 4.2149 4.3772 4.4516 4.5505 4.6292 4.8467 4.8677 5.3427 5.3914 5.4221 5.4829 5.9402 5.9539 6.2815 6.3251 6.6832 6.7126 9.0654 9.0729 10.4032 10.4041 10.7949 10.8154 10.9818 10.9994 11.6504 11.6976 11.9188 11.9326 12.4935 12.5038 k =-0.1623 0.2240 0.2767 ( 6562 PWs) bands (ev): -8.1723 -8.1681 -8.1576 -8.1159 -8.0690 -7.9843 -7.9702 -7.9633 -7.5659 -7.4474 -7.3612 -7.2540 -7.2039 -7.1984 -7.1767 -7.1219 -7.1085 -7.0949 -7.0867 -7.0786 -6.2830 -6.2809 -5.1843 -5.1647 -5.1047 -5.0816 -4.9776 -4.9362 0.6224 0.6232 1.4056 1.4211 2.1478 2.1973 2.4100 2.4425 2.4863 2.5500 2.6888 2.7410 2.7843 2.7846 3.0887 3.1153 3.1858 3.2174 3.3157 3.3542 3.4285 3.4712 3.5189 3.6773 3.8677 4.0190 4.1488 4.2101 4.3573 4.4430 4.5306 4.6108 4.8439 4.8704 5.3352 5.4231 5.4432 5.4759 5.9238 5.9447 6.3307 6.3752 6.7053 6.7358 8.9858 8.9936 10.4278 10.4281 10.8314 10.8753 10.8989 10.8989 11.6551 11.6969 11.8793 11.8924 12.4642 12.4773 k =-0.1533 0.2116 0.2613 ( 6568 PWs) bands (ev): -8.1723 -8.1675 -8.1594 -8.1186 -8.0656 -7.9816 -7.9709 -7.9621 -7.5660 -7.4518 -7.3565 -7.2533 -7.2034 -7.1986 -7.1729 -7.1204 -7.1089 -7.0957 -7.0862 -7.0786 -6.3102 -6.3085 -5.1652 -5.1471 -5.0928 -5.0704 -4.9766 -4.9360 0.6017 0.6028 1.4307 1.4474 2.1614 2.2140 2.4102 2.4334 2.4900 2.5498 2.6870 2.7364 2.7851 2.7874 3.0842 3.1218 3.1876 3.2186 3.3020 3.3469 3.4176 3.4574 3.5270 3.6792 3.8618 4.0031 4.1434 4.2041 4.3356 4.4298 4.5151 4.5930 4.8444 4.8761 5.3184 5.4416 5.4601 5.4669 5.9222 5.9478 6.3804 6.4250 6.7296 6.7609 8.9024 8.9105 10.4485 10.4486 10.7569 10.7972 10.9300 10.9378 11.6603 11.6973 11.8443 11.8561 12.4362 12.4516 k =-0.1443 0.1991 0.2459 ( 6564 PWs) bands (ev): -8.1723 -8.1669 -8.1610 -8.1212 -8.0622 -7.9798 -7.9708 -7.9610 -7.5658 -7.4563 -7.3517 -7.2530 -7.2029 -7.1988 -7.1688 -7.1189 -7.1092 -7.0964 -7.0856 -7.0785 -6.3367 -6.3354 -5.1469 -5.1302 -5.0811 -5.0594 -4.9756 -4.9359 0.5815 0.5828 1.4561 1.4739 2.1766 2.2328 2.4126 2.4248 2.4928 2.5501 2.6851 2.7296 2.7866 2.7936 3.0790 3.1261 3.1854 3.2125 3.2925 3.3403 3.4073 3.4445 3.5389 3.6814 3.8569 3.9877 4.1374 4.1965 4.3120 4.4094 4.5071 4.5767 4.8483 4.8847 5.2975 5.4445 5.4563 5.4661 5.9377 5.9656 6.4301 6.4739 6.7557 6.7874 8.8158 8.8242 10.4647 10.4651 10.6571 10.6969 10.9908 11.0015 11.6653 11.6972 11.8149 11.8244 12.4100 12.4275 k =-0.1353 0.1867 0.2305 ( 6567 PWs) bands (ev): -8.1722 -8.1662 -8.1626 -8.1237 -8.0587 -7.9795 -7.9697 -7.9599 -7.5652 -7.4608 -7.3469 -7.2530 -7.2024 -7.1989 -7.1645 -7.1175 -7.1095 -7.0972 -7.0850 -7.0784 -6.3623 -6.3613 -5.1294 -5.1143 -5.0698 -5.0489 -4.9744 -4.9358 0.5618 0.5633 1.4818 1.5007 2.1926 2.2532 2.4170 2.4177 2.4944 2.5512 2.6830 2.7227 2.7883 2.8013 3.0732 3.1278 3.1794 3.2014 3.2848 3.3346 3.3985 3.4324 3.5534 3.6831 3.8532 3.9735 4.1301 4.1866 4.2867 4.3824 4.5067 4.5625 4.8555 4.8958 5.2744 5.4354 5.4416 5.4603 5.9699 5.9981 6.4793 6.5217 6.7832 6.8148 8.7264 8.7350 10.4760 10.4770 10.5581 10.5988 11.0554 11.0667 11.6694 11.6957 11.7922 11.7981 12.3862 12.4056 k =-0.1262 0.1742 0.2152 ( 6567 PWs) bands (ev): -8.1721 -8.1656 -8.1638 -8.1262 -8.0553 -7.9803 -7.9677 -7.9588 -7.5644 -7.4654 -7.3420 -7.2534 -7.2019 -7.1990 -7.1601 -7.1161 -7.1097 -7.0981 -7.0843 -7.0783 -6.3869 -6.3863 -5.1129 -5.0993 -5.0588 -5.0390 -4.9731 -4.9357 0.5428 0.5443 1.5076 1.5274 2.2088 2.2743 2.4107 2.4260 2.4951 2.5533 2.6810 2.7165 2.7898 2.8093 3.0665 3.1262 3.1706 3.1890 3.2765 3.3298 3.3918 3.4213 3.5691 3.6835 3.8507 3.9607 4.1211 4.1738 4.2603 4.3514 4.5123 4.5511 4.8655 4.9091 5.2498 5.4199 5.4209 5.4448 6.0157 6.0430 6.5275 6.5682 6.8116 6.8428 8.6347 8.6435 10.4616 10.4793 10.4846 10.5067 11.1219 11.1328 11.6723 11.6922 11.7766 11.7776 12.3650 12.3864 k =-0.1172 0.1618 0.1998 ( 6563 PWs) bands (ev): -8.1721 -8.1656 -8.1643 -8.1285 -8.0518 -7.9817 -7.9654 -7.9577 -7.5632 -7.4699 -7.3371 -7.2540 -7.2014 -7.1990 -7.1555 -7.1148 -7.1098 -7.0988 -7.0835 -7.0782 -6.4105 -6.4101 -5.0973 -5.0854 -5.0484 -5.0297 -4.9715 -4.9356 0.5246 0.5262 1.5335 1.5540 2.2243 2.2947 2.4066 2.4381 2.4948 2.5571 2.6792 2.7113 2.7908 2.8172 3.0590 3.1207 3.1599 3.1779 3.2667 3.3255 3.3877 3.4113 3.5843 3.6816 3.8496 3.9495 4.1103 4.1577 4.2341 4.3187 4.5223 4.5430 4.8780 4.9241 5.2244 5.3926 5.4035 5.4226 6.0715 6.0975 6.5744 6.6130 6.8407 6.8710 8.5411 8.5501 10.3700 10.4088 10.4866 10.4872 11.1893 11.1994 11.6739 11.6873 11.7632 11.7676 12.3467 12.3702 k =-0.1082 0.1494 0.1844 ( 6561 PWs) bands (ev): -8.1720 -8.1665 -8.1637 -8.1308 -8.0484 -7.9833 -7.9631 -7.9567 -7.5618 -7.4745 -7.3322 -7.2550 -7.2010 -7.1990 -7.1509 -7.1136 -7.1098 -7.0995 -7.0827 -7.0781 -6.4329 -6.4328 -5.0827 -5.0724 -5.0385 -5.0212 -4.9696 -4.9354 0.5073 0.5089 1.5591 1.5803 2.2383 2.3122 2.4062 2.4545 2.4938 2.5631 2.6778 2.7071 2.7912 2.8245 3.0505 3.1115 3.1480 3.1687 3.2558 3.3213 3.3862 3.4030 3.5972 3.6767 3.8498 3.9396 4.0978 4.1381 4.2092 4.2861 4.5360 4.5384 4.8925 4.9402 5.1987 5.3623 5.3842 5.3962 6.1344 6.1590 6.6196 6.6559 6.8698 6.8988 8.4461 8.4552 10.2828 10.3216 10.4841 10.4843 11.2568 11.2655 11.6748 11.6829 11.7544 11.7635 12.3312 12.3572 k =-0.0992 0.1369 0.1691 ( 6565 PWs) bands (ev): -8.1720 -8.1675 -8.1630 -8.1331 -8.0450 -7.9851 -7.9610 -7.9557 -7.5601 -7.4791 -7.3273 -7.2561 -7.2005 -7.1990 -7.1463 -7.1126 -7.1098 -7.1002 -7.0818 -7.0779 -6.4541 -6.4541 -5.0693 -5.0605 -5.0294 -5.0137 -4.9673 -4.9352 0.4910 0.4926 1.5844 1.6059 2.2505 2.3243 2.4110 2.4751 2.4925 2.5721 2.6767 2.7036 2.7907 2.8309 3.0415 3.0998 3.1357 3.1602 3.2444 3.3166 3.3873 3.3968 3.6059 3.6681 3.8513 3.9310 4.0837 4.1163 4.1859 4.2549 4.5373 4.5526 4.9084 4.9570 5.1731 5.3311 5.3631 5.3678 6.2024 6.2257 6.6627 6.6964 6.8986 6.9261 8.3501 8.3595 10.2008 10.2385 10.4775 10.4781 11.3232 11.3302 11.6763 11.6809 11.7503 11.7627 12.3187 12.3474 k =-0.0902 0.1245 0.1537 ( 6573 PWs) bands (ev): -8.1719 -8.1684 -8.1622 -8.1352 -8.0416 -7.9871 -7.9590 -7.9548 -7.5581 -7.4837 -7.3225 -7.2575 -7.2002 -7.1990 -7.1419 -7.1117 -7.1096 -7.1009 -7.0809 -7.0778 -6.4741 -6.4738 -5.0569 -5.0496 -5.0210 -5.0072 -4.9644 -4.9348 0.4758 0.4773 1.6091 1.6307 2.2605 2.3299 2.4208 2.4887 2.5022 2.5850 2.6762 2.7009 2.7895 2.8361 3.0321 3.0873 3.1233 3.1511 3.2331 3.3108 3.3908 3.3932 3.6094 3.6554 3.8535 3.9233 4.0684 4.0942 4.1641 4.2262 4.5399 4.5717 4.9252 4.9737 5.1483 5.3006 5.3385 5.3405 6.2741 6.2962 6.7034 6.7344 6.9267 6.9522 8.2537 8.2632 10.1245 10.1606 10.4677 10.4687 11.3867 11.3915 11.6803 11.6830 11.7498 11.7643 12.3089 12.3409 k =-0.0812 0.1120 0.1383 ( 6569 PWs) bands (ev): -8.1719 -8.1691 -8.1613 -8.1373 -8.0383 -7.9892 -7.9572 -7.9539 -7.5559 -7.4882 -7.3178 -7.2590 -7.1998 -7.1990 -7.1376 -7.1110 -7.1094 -7.1014 -7.0799 -7.0775 -6.4925 -6.4921 -5.0457 -5.0398 -5.0136 -5.0018 -4.9610 -4.9342 0.4619 0.4633 1.6330 1.6544 2.2687 2.3307 2.4328 2.4870 2.5309 2.6024 2.6767 2.6988 2.7877 2.8398 3.0232 3.0751 3.1112 3.1408 3.2219 3.3030 3.3929 3.3967 3.6069 3.6387 3.8557 3.9163 4.0522 4.0743 4.1432 4.2007 4.5458 4.5926 4.9424 4.9897 5.1251 5.2719 5.3095 5.3165 6.3485 6.3694 6.7414 6.7696 6.9535 6.9770 8.1574 8.1670 10.0542 10.0882 10.4556 10.4568 11.4445 11.4469 11.6886 11.6901 11.7529 11.7687 12.3015 12.3372 k =-0.0721 0.0996 0.1230 ( 6565 PWs) bands (ev): -8.1719 -8.1698 -8.1604 -8.1392 -8.0350 -7.9913 -7.9555 -7.9530 -7.5534 -7.4927 -7.3131 -7.2607 -7.1995 -7.1990 -7.1335 -7.1105 -7.1090 -7.1018 -7.0790 -7.0772 -6.5093 -6.5089 -5.0357 -5.0310 -5.0071 -4.9976 -4.9571 -4.9335 0.4492 0.4505 1.6558 1.6765 2.2753 2.3289 2.4441 2.4847 2.5631 2.6236 2.6789 2.6971 2.7857 2.8416 3.0154 3.0636 3.0995 3.1295 3.2105 3.2927 3.3959 3.4047 3.5984 3.6184 3.8570 3.9098 4.0357 4.0585 4.1230 4.1786 4.5550 4.6145 4.9595 5.0039 5.1045 5.2457 5.2813 5.2913 6.4247 6.4446 6.7764 6.8018 6.9789 7.0001 8.0616 8.0713 9.9905 10.0219 10.4420 10.4433 11.4928 11.4929 11.7018 11.7023 11.7615 11.7783 12.2961 12.3357 k =-0.0631 0.0871 0.1076 ( 6573 PWs) bands (ev): -8.1719 -8.1704 -8.1595 -8.1411 -8.0317 -7.9935 -7.9541 -7.9523 -7.5507 -7.4972 -7.3086 -7.2627 -7.1993 -7.1989 -7.1298 -7.1102 -7.1086 -7.1022 -7.0781 -7.0769 -6.5245 -6.5240 -5.0268 -5.0233 -5.0016 -4.9944 -4.9530 -4.9327 0.4379 0.4391 1.6773 1.6969 2.2805 2.3258 2.4533 2.4825 2.5972 2.6447 2.6863 2.6962 2.7837 2.8415 3.0095 3.0530 3.0885 3.1178 3.1982 3.2794 3.4018 3.4143 3.5849 3.5956 3.8567 3.9035 4.0195 4.0473 4.1038 4.1599 4.5670 4.6365 4.9761 5.0148 5.0885 5.2223 5.2544 5.2652 6.5020 6.5209 6.8081 6.8306 7.0024 7.0211 7.9670 7.9768 9.9336 9.9620 10.4278 10.4291 11.5271 11.5283 11.7160 11.7161 11.7820 11.7979 12.2918 12.3354 k =-0.0541 0.0747 0.0922 ( 6575 PWs) bands (ev): -8.1719 -8.1708 -8.1585 -8.1429 -8.0286 -7.9958 -7.9529 -7.9516 -7.5478 -7.5017 -7.3042 -7.2648 -7.1991 -7.1989 -7.1265 -7.1103 -7.1081 -7.1024 -7.0772 -7.0765 -6.5378 -6.5373 -5.0191 -5.0166 -4.9971 -4.9919 -4.9487 -4.9318 0.4280 0.4290 1.6971 1.7152 2.2849 2.3222 2.4601 2.4805 2.6309 2.6576 2.6972 2.7053 2.7825 2.8392 3.0060 3.0436 3.0784 3.1065 3.1844 3.2628 3.4102 3.4250 3.5676 3.5718 3.8550 3.8972 4.0043 4.0393 4.0872 4.1443 4.5816 4.6574 4.9918 5.0201 5.0797 5.2018 5.2294 5.2386 6.5795 6.5973 6.8363 6.8560 7.0236 7.0399 7.8745 7.8843 9.8839 9.9090 10.4138 10.4151 11.5497 11.5513 11.7252 11.7262 11.8190 11.8315 12.2878 12.3341 k =-0.0451 0.0622 0.0768 ( 6567 PWs) bands (ev): -8.1720 -8.1712 -8.1575 -8.1445 -8.0254 -7.9981 -7.9519 -7.9509 -7.5447 -7.5060 -7.2999 -7.2670 -7.1989 -7.1988 -7.1235 -7.1105 -7.1074 -7.1025 -7.0764 -7.0761 -6.5493 -6.5488 -5.0126 -5.0109 -4.9935 -4.9901 -4.9446 -4.9310 0.4195 0.4204 1.7150 1.7310 2.2886 2.3186 2.4650 2.4787 2.6583 2.6625 2.7048 2.7337 2.7827 2.8349 3.0056 3.0354 3.0693 3.0964 3.1687 3.2426 3.4202 3.4362 3.5484 3.5488 3.8525 3.8906 3.9910 4.0316 4.0755 4.1313 4.5982 4.6757 5.0064 5.0199 5.0789 5.1838 5.2068 5.2125 6.6560 6.6728 6.8607 6.8778 7.0423 7.0561 7.7853 7.7950 9.8416 9.8631 10.4007 10.4019 11.5637 11.5651 11.7300 11.7318 11.8673 11.8759 12.2830 12.3289 k =-0.0361 0.0498 0.0615 ( 6563 PWs) bands (ev): -8.1720 -8.1715 -8.1564 -8.1461 -8.0224 -8.0005 -7.9510 -7.9504 -7.5415 -7.5104 -7.2958 -7.2695 -7.1987 -7.1987 -7.1209 -7.1109 -7.1067 -7.1027 -7.0757 -7.0757 -6.5587 -6.5583 -5.0073 -5.0062 -4.9908 -4.9887 -4.9408 -4.9302 0.4125 0.4133 1.7305 1.7441 2.2918 2.3151 2.4683 2.4773 2.6645 2.6705 2.7269 2.7623 2.7863 2.8292 3.0084 3.0287 3.0612 3.0882 3.1512 3.2188 3.4310 3.4471 3.5281 3.5291 3.8499 3.8833 3.9807 4.0210 4.0708 4.1203 4.6162 4.6897 5.0183 5.0197 5.0824 5.1660 5.1871 5.1892 6.7298 6.7455 6.8812 6.8959 7.0583 7.0695 7.7012 7.7104 9.8072 9.8247 10.3891 10.3903 11.5722 11.5731 11.7326 11.7346 11.9200 11.9251 12.2764 12.3165 k =-0.0271 0.0373 0.0461 ( 6561 PWs) bands (ev): -8.1720 -8.1717 -8.1553 -8.1476 -8.0194 -8.0030 -7.9504 -7.9500 -7.5380 -7.5146 -7.2918 -7.2721 -7.1987 -7.1986 -7.1188 -7.1115 -7.1060 -7.1029 -7.0753 -7.0751 -6.5662 -6.5658 -5.0032 -5.0026 -4.9889 -4.9878 -4.9375 -4.9297 0.4071 0.4077 1.7435 1.7541 2.2947 2.3117 2.4705 2.4761 2.6656 2.6726 2.7565 2.7780 2.8017 2.8227 3.0146 3.0245 3.0541 3.0820 3.1326 3.1921 3.4418 3.4572 3.5109 3.5112 3.8481 3.8753 3.9741 4.0084 4.0719 4.1109 4.6348 4.6979 5.0198 5.0315 5.0861 5.1451 5.1713 5.1726 6.7978 6.8123 6.8978 6.9103 7.0713 7.0799 7.6251 7.6334 9.7806 9.7940 10.3797 10.3806 11.5773 11.5778 11.7342 11.7359 11.9715 11.9739 12.2670 12.2969 k =-0.0180 0.0249 0.0307 ( 6569 PWs) bands (ev): -8.1721 -8.1719 -8.1542 -8.1491 -8.0165 -8.0056 -7.9500 -7.9497 -7.5344 -7.5188 -7.2881 -7.2749 -7.1987 -7.1986 -7.1170 -7.1123 -7.1052 -7.1031 -7.0750 -7.0748 -6.5715 -6.5713 -5.0002 -5.0000 -4.9876 -4.9871 -4.9347 -4.9296 0.4032 0.4036 1.7535 1.7608 2.2975 2.3086 2.4720 2.4752 2.6665 2.6719 2.7837 2.7840 2.8169 2.8212 3.0240 3.0243 3.0477 3.0768 3.1161 3.1642 3.4522 3.4659 3.4957 3.4976 3.8479 3.8672 3.9714 3.9960 4.0760 4.1026 4.6531 4.6996 5.0261 5.0412 5.0878 5.1222 5.1602 5.1626 6.8551 6.8678 6.9110 6.9215 7.0813 7.0873 7.5618 7.5684 9.7622 9.7712 10.3727 10.3733 11.5802 11.5805 11.7352 11.7364 12.0172 12.0177 12.2552 12.2736 k =-0.0090 0.0124 0.0154 ( 6563 PWs) bands (ev): -8.1720 -8.1720 -8.1530 -8.1505 -8.0136 -8.0082 -7.9497 -7.9496 -7.5307 -7.5229 -7.2845 -7.2779 -7.1986 -7.1986 -7.1154 -7.1131 -7.1045 -7.1035 -7.0747 -7.0746 -6.5747 -6.5746 -4.9984 -4.9984 -4.9869 -4.9867 -4.9325 -4.9300 0.4009 0.4011 1.7605 1.7642 2.3002 2.3057 2.4731 2.4745 2.6676 2.6704 2.7895 2.7977 2.8190 2.8313 3.0277 3.0360 3.0427 3.0681 3.1093 3.1381 3.4619 3.4730 3.4831 3.4879 3.8496 3.8597 3.9726 3.9855 4.0816 4.0950 4.6701 4.6948 5.0363 5.0473 5.0878 5.1020 5.1546 5.1565 6.8934 6.9013 6.9241 6.9306 7.0882 7.0913 7.5188 7.5226 9.7520 9.7566 10.3685 10.3688 11.5818 11.5819 11.7358 11.7365 12.0506 12.0508 12.2441 12.2524 k = 0.0000 0.0000 0.0000 ( 6571 PWs) bands (ev): -8.1720 -8.1720 -8.1518 -8.1518 -8.0109 -8.0109 -7.9496 -7.9496 -7.5269 -7.5269 -7.2811 -7.2811 -7.1986 -7.1986 -7.1142 -7.1142 -7.1040 -7.1040 -7.0746 -7.0746 -6.5757 -6.5757 -4.9978 -4.9978 -4.9867 -4.9867 -4.9310 -4.9310 0.4002 0.4002 1.7640 1.7640 2.3029 2.3029 2.4738 2.4738 2.6689 2.6689 2.7950 2.7950 2.8292 2.8292 3.0339 3.0339 3.0537 3.0537 3.1180 3.1180 3.4713 3.4713 3.4808 3.4808 3.8536 3.8536 3.9775 3.9775 4.0880 4.0880 4.6845 4.6845 5.0458 5.0458 5.0901 5.0901 5.1537 5.1537 6.9074 6.9074 6.9343 6.9343 7.0916 7.0916 7.5045 7.5045 9.7502 9.7502 10.3672 10.3672 11.5823 11.5823 11.7363 11.7363 12.0636 12.0636 12.2411 12.2411 k = 0.0000 0.0000 0.0000 ( 6571 PWs) bands (ev): -8.1720 -8.1720 -8.1518 -8.1518 -8.0109 -8.0109 -7.9496 -7.9496 -7.5269 -7.5269 -7.2811 -7.2811 -7.1986 -7.1986 -7.1142 -7.1142 -7.1040 -7.1040 -7.0746 -7.0746 -6.5757 -6.5757 -4.9978 -4.9978 -4.9867 -4.9867 -4.9310 -4.9310 0.4002 0.4002 1.7640 1.7640 2.3029 2.3029 2.4738 2.4738 2.6689 2.6689 2.7950 2.7950 2.8292 2.8292 3.0339 3.0339 3.0537 3.0537 3.1180 3.1180 3.4713 3.4713 3.4808 3.4808 3.8536 3.8536 3.9775 3.9775 4.0880 4.0880 4.6845 4.6845 5.0458 5.0458 5.0901 5.0901 5.1537 5.1537 6.9074 6.9074 6.9343 6.9343 7.0916 7.0916 7.5045 7.5045 9.7502 9.7502 10.3672 10.3672 11.5823 11.5823 11.7363 11.7363 12.0636 12.0636 12.2411 12.2411 k = 0.0172 0.0125 0.0000 ( 6551 PWs) bands (ev): -8.1720 -8.1720 -8.1516 -8.1516 -8.0110 -8.0110 -7.9495 -7.9495 -7.5266 -7.5266 -7.2813 -7.2813 -7.1985 -7.1985 -7.1144 -7.1144 -7.1041 -7.1041 -7.0745 -7.0745 -6.5744 -6.5744 -4.9979 -4.9979 -4.9875 -4.9875 -4.9316 -4.9316 0.4011 0.4011 1.7613 1.7613 2.3040 2.3040 2.4752 2.4752 2.6685 2.6685 2.7944 2.7944 2.8287 2.8287 3.0332 3.0332 3.0555 3.0555 3.1198 3.1198 3.4707 3.4707 3.4817 3.4817 3.8522 3.8522 3.9775 3.9775 4.0911 4.0911 4.6835 4.6835 5.0474 5.0474 5.0911 5.0911 5.1548 5.1548 6.9053 6.9053 6.9320 6.9320 7.0747 7.0747 7.5237 7.5237 9.7512 9.7512 10.3670 10.3670 11.5723 11.5723 11.7219 11.7219 12.0519 12.0519 12.2495 12.2495 k = 0.0345 0.0250 0.0000 ( 6547 PWs) bands (ev): -8.1720 -8.1720 -8.1512 -8.1512 -8.0116 -8.0116 -7.9497 -7.9497 -7.5261 -7.5261 -7.2820 -7.2820 -7.1982 -7.1982 -7.1150 -7.1150 -7.1045 -7.1045 -7.0745 -7.0745 -6.5704 -6.5704 -4.9981 -4.9981 -4.9900 -4.9900 -4.9336 -4.9336 0.4036 0.4036 1.7531 1.7531 2.3072 2.3072 2.4791 2.4791 2.6674 2.6674 2.7925 2.7925 2.8271 2.8271 3.0316 3.0316 3.0600 3.0600 3.1254 3.1254 3.4694 3.4694 3.4839 3.4839 3.8482 3.8482 3.9772 3.9772 4.0999 4.0999 4.6805 4.6805 5.0523 5.0523 5.0937 5.0937 5.1582 5.1582 6.8993 6.8993 6.9246 6.9246 7.0318 7.0318 7.5740 7.5740 9.7542 9.7542 10.3663 10.3663 11.5434 11.5434 11.6814 11.6814 12.0196 12.0196 12.2713 12.2713 k = 0.0517 0.0375 0.0000 ( 6559 PWs) bands (ev): -8.1721 -8.1721 -8.1506 -8.1506 -8.0125 -8.0125 -7.9500 -7.9500 -7.5253 -7.5253 -7.2831 -7.2831 -7.1977 -7.1977 -7.1162 -7.1162 -7.1051 -7.1051 -7.0745 -7.0745 -6.5637 -6.5637 -4.9986 -4.9986 -4.9943 -4.9943 -4.9366 -4.9366 0.4078 0.4078 1.7399 1.7399 2.3123 2.3123 2.4856 2.4856 2.6656 2.6656 2.7890 2.7890 2.8246 2.8246 3.0298 3.0298 3.0664 3.0664 3.1346 3.1346 3.4679 3.4679 3.4872 3.4872 3.8424 3.8424 3.9766 3.9766 4.1138 4.1138 4.6754 4.6754 5.0602 5.0602 5.0979 5.0979 5.1641 5.1641 6.8892 6.8892 6.9097 6.9097 6.9776 6.9776 7.6430 7.6430 9.7592 9.7592 10.3652 10.3652 11.4976 11.4976 11.6209 11.6209 11.9719 11.9719 12.3005 12.3005 k = 0.0690 0.0500 0.0000 ( 6551 PWs) bands (ev): -8.1721 -8.1721 -8.1497 -8.1497 -8.0137 -8.0137 -7.9504 -7.9504 -7.5240 -7.5240 -7.2846 -7.2846 -7.1971 -7.1971 -7.1178 -7.1178 -7.1056 -7.1056 -7.0745 -7.0745 -6.5545 -6.5545 -5.0018 -5.0018 -4.9982 -4.9982 -4.9402 -4.9402 0.4136 0.4136 1.7222 1.7222 2.3190 2.3190 2.4945 2.4945 2.6632 2.6632 2.7838 2.7838 2.8217 2.8217 3.0280 3.0280 3.0741 3.0741 3.1476 3.1476 3.4667 3.4667 3.4915 3.4915 3.8356 3.8356 3.9757 3.9757 4.1316 4.1316 4.6682 4.6682 5.0711 5.0711 5.1036 5.1036 5.1729 5.1729 6.8751 6.8751 6.8771 6.8771 6.9307 6.9307 7.7227 7.7227 9.7661 9.7661 10.3635 10.3635 11.4379 11.4379 11.5461 11.5461 11.9132 11.9132 12.3329 12.3329 k = 0.0862 0.0625 0.0000 ( 6567 PWs) bands (ev): -8.1721 -8.1721 -8.1487 -8.1487 -8.0152 -8.0152 -7.9509 -7.9509 -7.5225 -7.5225 -7.2865 -7.2865 -7.1964 -7.1964 -7.1202 -7.1202 -7.1060 -7.1060 -7.0745 -7.0745 -6.5428 -6.5428 -5.0108 -5.0108 -4.9991 -4.9991 -4.9441 -4.9441 0.4210 0.4210 1.7006 1.7006 2.3268 2.3268 2.5056 2.5056 2.6605 2.6605 2.7767 2.7767 2.8185 2.8185 3.0261 3.0261 3.0824 3.0824 3.1643 3.1643 3.4661 3.4661 3.4971 3.4971 3.8284 3.8284 3.9745 3.9745 4.1523 4.1523 4.6587 4.6587 5.0843 5.0843 5.1106 5.1106 5.1848 5.1848 6.8194 6.8194 6.8575 6.8575 6.9024 6.9024 7.8087 7.8087 9.7751 9.7751 10.3610 10.3610 11.3672 11.3672 11.4616 11.4616 11.8470 11.8470 12.3597 12.3597 k = 0.1034 0.0749 0.0000 ( 6571 PWs) bands (ev): -8.1721 -8.1721 -8.1474 -8.1474 -8.0170 -8.0170 -7.9516 -7.9516 -7.5206 -7.5206 -7.2889 -7.2889 -7.1956 -7.1956 -7.1230 -7.1230 -7.1062 -7.1062 -7.0746 -7.0746 -6.5287 -6.5287 -5.0229 -5.0229 -4.9999 -4.9999 -4.9480 -4.9480 0.4300 0.4300 1.6757 1.6757 2.3353 2.3353 2.5188 2.5188 2.6576 2.6576 2.7677 2.7677 2.8153 2.8153 3.0237 3.0237 3.0907 3.0907 3.1848 3.1848 3.4666 3.4666 3.5041 3.5041 3.8214 3.8214 3.9729 3.9729 4.1751 4.1751 4.6468 4.6468 5.0990 5.0990 5.1199 5.1199 5.2000 5.2000 6.7532 6.7532 6.8363 6.8363 6.8790 6.8790 7.8987 7.8987 9.7861 9.7861 10.3578 10.3578 11.2880 11.2880 11.3706 11.3706 11.7758 11.7758 12.3193 12.3193 k = 0.1207 0.0874 0.0000 ( 6579 PWs) bands (ev): -8.1720 -8.1720 -8.1460 -8.1460 -8.0190 -8.0190 -7.9526 -7.9526 -7.5183 -7.5183 -7.2916 -7.2916 -7.1947 -7.1947 -7.1263 -7.1263 -7.1063 -7.1063 -7.0747 -7.0747 -6.5124 -6.5124 -5.0379 -5.0379 -5.0006 -5.0006 -4.9517 -4.9517 0.4404 0.4404 1.6482 1.6482 2.3440 2.3440 2.5339 2.5339 2.6547 2.6547 2.7571 2.7571 2.8122 2.8122 3.0204 3.0204 3.0987 3.0987 3.2092 3.2092 3.4685 3.4685 3.5129 3.5129 3.8150 3.8150 3.9710 3.9710 4.1990 4.1990 4.6324 4.6324 5.1124 5.1124 5.1338 5.1338 5.2184 5.2184 6.6856 6.6856 6.8117 6.8117 6.8545 6.8545 7.9914 7.9914 9.7991 9.7991 10.3534 10.3534 11.2025 11.2025 11.2755 11.2755 11.7014 11.7014 12.2736 12.2736 k = 0.1379 0.0999 0.0000 ( 6555 PWs) bands (ev): -8.1717 -8.1717 -8.1444 -8.1444 -8.0210 -8.0210 -7.9536 -7.9536 -7.5157 -7.5157 -7.2946 -7.2946 -7.1937 -7.1937 -7.1297 -7.1297 -7.1061 -7.1061 -7.0747 -7.0747 -6.4941 -6.4941 -5.0557 -5.0557 -5.0014 -5.0014 -4.9551 -4.9551 0.4523 0.4523 1.6185 1.6185 2.3524 2.3524 2.5507 2.5507 2.6522 2.6522 2.7455 2.7455 2.8094 2.8094 3.0160 3.0160 3.1056 3.1056 3.2371 3.2371 3.4721 3.4721 3.5236 3.5236 3.8094 3.8094 3.9689 3.9689 4.2232 4.2232 4.6155 4.6155 5.1235 5.1235 5.1536 5.1536 5.2400 5.2400 6.6186 6.6186 6.7841 6.7841 6.8278 6.8278 8.0861 8.0861 9.8140 9.8140 10.3478 10.3478 11.1128 11.1128 11.1780 11.1780 11.6251 11.6251 12.2257 12.2257 k = 0.1552 0.1124 0.0000 ( 6555 PWs) bands (ev): -8.1714 -8.1714 -8.1429 -8.1429 -8.0232 -8.0232 -7.9549 -7.9549 -7.5128 -7.5128 -7.2980 -7.2980 -7.1927 -7.1927 -7.1334 -7.1334 -7.1059 -7.1059 -7.0748 -7.0748 -6.4737 -6.4737 -5.0762 -5.0762 -5.0023 -5.0023 -4.9584 -4.9584 0.4656 0.4656 1.5872 1.5872 2.3603 2.3603 2.5684 2.5684 2.6503 2.6503 2.7338 2.7338 2.8068 2.8068 3.0103 3.0103 3.1110 3.1110 3.2684 3.2684 3.4781 3.4781 3.5363 3.5363 3.8048 3.8048 3.9666 3.9666 4.2471 4.2471 4.5960 4.5960 5.1339 5.1339 5.1774 5.1774 5.2642 5.2642 6.5532 6.5532 6.7536 6.7536 6.7986 6.7986 8.1821 8.1821 9.8310 9.8310 10.3407 10.3407 11.0202 11.0202 11.0793 11.0793 11.5480 11.5480 12.1770 12.1770 k = 0.1724 0.1249 0.0000 ( 6567 PWs) bands (ev): -8.1711 -8.1711 -8.1413 -8.1413 -8.0254 -8.0254 -7.9565 -7.9565 -7.5096 -7.5096 -7.3018 -7.3018 -7.1917 -7.1917 -7.1371 -7.1371 -7.1056 -7.1056 -7.0751 -7.0751 -6.4515 -6.4515 -5.0991 -5.0991 -5.0033 -5.0033 -4.9616 -4.9616 0.4802 0.4802 1.5546 1.5546 2.3673 2.3673 2.5857 2.5857 2.6495 2.6495 2.7234 2.7234 2.8044 2.8044 3.0031 3.0031 3.1145 3.1145 3.3026 3.3026 3.4865 3.4865 3.5510 3.5510 3.8011 3.8011 3.9639 3.9639 4.2698 4.2698 4.5739 4.5739 5.1448 5.1448 5.2042 5.2042 5.2909 5.2909 6.4897 6.4897 6.7205 6.7205 6.7671 6.7671 8.2788 8.2788 9.8498 9.8498 10.3319 10.3319 10.9262 10.9262 10.9804 10.9804 11.4710 11.4710 12.1286 12.1286 k = 0.1897 0.1374 0.0000 ( 6583 PWs) bands (ev): -8.1706 -8.1706 -8.1397 -8.1397 -8.0277 -8.0277 -7.9583 -7.9583 -7.5062 -7.5062 -7.3059 -7.3059 -7.1907 -7.1907 -7.1409 -7.1409 -7.1053 -7.1053 -7.0753 -7.0753 -6.4275 -6.4275 -5.1244 -5.1244 -5.0043 -5.0043 -4.9646 -4.9646 0.4960 0.4960 1.5210 1.5210 2.3733 2.3733 2.5994 2.5994 2.6502 2.6502 2.7175 2.7175 2.8024 2.8024 2.9947 2.9947 3.1159 3.1159 3.3393 3.3393 3.4977 3.4977 3.5675 3.5675 3.7985 3.7985 3.9611 3.9611 4.2909 4.2909 4.5493 4.5493 5.1570 5.1570 5.2331 5.2331 5.3197 5.3197 6.4284 6.4284 6.6851 6.6851 6.7335 6.7335 8.3760 8.3760 9.8706 9.8706 10.3212 10.3212 10.8319 10.8319 10.8823 10.8823 11.3948 11.3948 12.0814 12.0814 k = 0.2069 0.1499 0.0000 ( 6591 PWs) bands (ev): -8.1700 -8.1700 -8.1381 -8.1381 -8.0299 -8.0299 -7.9603 -7.9603 -7.5024 -7.5024 -7.3103 -7.3103 -7.1897 -7.1897 -7.1445 -7.1445 -7.1048 -7.1048 -7.0755 -7.0755 -6.4019 -6.4019 -5.1518 -5.1518 -5.0053 -5.0053 -4.9676 -4.9676 0.5129 0.5129 1.4869 1.4869 2.3783 2.3783 2.6063 2.6063 2.6505 2.6505 2.7214 2.7214 2.8008 2.8008 2.9850 2.9850 3.1150 3.1150 3.3781 3.3781 3.5117 3.5117 3.5857 3.5857 3.7969 3.7969 3.9583 3.9583 4.3096 4.3096 4.5226 4.5226 5.1708 5.1708 5.2639 5.2639 5.3502 5.3502 6.3695 6.3695 6.6479 6.6479 6.6981 6.6981 8.4732 8.4732 9.8932 9.8932 10.3084 10.3084 10.7383 10.7383 10.7856 10.7856 11.3199 11.3199 12.0363 12.0363 k = 0.2241 0.1624-0.0000 ( 6591 PWs) bands (ev): -8.1693 -8.1693 -8.1366 -8.1366 -8.0319 -8.0319 -7.9626 -7.9626 -7.4983 -7.4983 -7.3149 -7.3149 -7.1888 -7.1888 -7.1480 -7.1480 -7.1042 -7.1042 -7.0758 -7.0758 -6.3748 -6.3748 -5.1811 -5.1811 -5.0063 -5.0063 -4.9706 -4.9706 0.5310 0.5310 1.4523 1.4523 2.3823 2.3823 2.6057 2.6057 2.6483 2.6483 2.7380 2.7380 2.7996 2.7996 2.9743 2.9743 3.1121 3.1121 3.4183 3.4183 3.5284 3.5284 3.6052 3.6052 3.7964 3.7964 3.9554 3.9554 4.3251 4.3251 4.4940 4.4940 5.1865 5.1865 5.2962 5.2962 5.3822 5.3822 6.3129 6.3129 6.6091 6.6091 6.6610 6.6610 8.5701 8.5701 9.9176 9.9176 10.2934 10.2934 10.6462 10.6462 10.6909 10.6909 11.2468 11.2468 11.9939 11.9939 k = 0.2414 0.1749 0.0000 ( 6599 PWs) bands (ev): -8.1685 -8.1685 -8.1352 -8.1352 -8.0338 -8.0338 -7.9651 -7.9651 -7.4940 -7.4940 -7.3198 -7.3198 -7.1879 -7.1879 -7.1513 -7.1513 -7.1035 -7.1035 -7.0761 -7.0761 -6.3461 -6.3461 -5.2122 -5.2122 -5.0073 -5.0073 -4.9735 -4.9735 0.5501 0.5501 1.4175 1.4175 2.3854 2.3854 2.5989 2.5989 2.6453 2.6453 2.7642 2.7642 2.7991 2.7991 2.9629 2.9629 3.1075 3.1075 3.4594 3.4594 3.5474 3.5474 3.6257 3.6257 3.7968 3.7968 3.9527 3.9527 4.3362 4.3362 4.4645 4.4645 5.2041 5.2041 5.3297 5.3297 5.4152 5.4152 6.2586 6.2586 6.5690 6.5690 6.6227 6.6227 8.6663 8.6663 9.9437 9.9437 10.2760 10.2760 10.5565 10.5565 10.5987 10.5987 11.1759 11.1759 11.9547 11.9547 k = 0.2586 0.1874 0.0000 ( 6603 PWs) bands (ev): -8.1675 -8.1675 -8.1339 -8.1339 -8.0354 -8.0354 -7.9677 -7.9677 -7.4895 -7.4895 -7.3249 -7.3249 -7.1870 -7.1870 -7.1543 -7.1543 -7.1028 -7.1028 -7.0765 -7.0765 -6.3162 -6.3162 -5.2449 -5.2449 -5.0082 -5.0082 -4.9764 -4.9764 0.5702 0.5702 1.3826 1.3826 2.3877 2.3877 2.5879 2.5879 2.6435 2.6435 2.7930 2.7930 2.8018 2.8018 2.9513 2.9513 3.1017 3.1017 3.5008 3.5008 3.5684 3.5684 3.6468 3.6468 3.7982 3.7982 3.9503 3.9503 4.3406 4.3406 4.4363 4.4363 5.2238 5.2238 5.3641 5.3641 5.4490 5.4490 6.2068 6.2068 6.5280 6.5280 6.5834 6.5834 8.7614 8.7614 9.9714 9.9714 10.2563 10.2563 10.4697 10.4697 10.5097 10.5097 11.1075 11.1075 11.9190 11.9190 k = 0.2759 0.1999 0.0000 ( 6599 PWs) bands (ev): -8.1664 -8.1664 -8.1329 -8.1329 -8.0367 -8.0367 -7.9706 -7.9706 -7.4847 -7.4847 -7.3302 -7.3302 -7.1862 -7.1862 -7.1572 -7.1572 -7.1019 -7.1019 -7.0770 -7.0770 -6.2849 -6.2849 -5.2791 -5.2791 -5.0090 -5.0090 -4.9793 -4.9793 0.5912 0.5912 1.3478 1.3478 2.3895 2.3895 2.5743 2.5743 2.6433 2.6433 2.7978 2.7978 2.8311 2.8311 2.9402 2.9402 3.0956 3.0956 3.5417 3.5417 3.5910 3.5910 3.6682 3.6682 3.8005 3.8005 3.9484 3.9484 4.3340 4.3340 4.4138 4.4138 5.2456 5.2456 5.3990 5.3990 5.4833 5.4833 6.1572 6.1572 6.4866 6.4866 6.5435 6.5435 8.8551 8.8551 10.0004 10.0004 10.2341 10.2341 10.3867 10.3867 10.4242 10.4242 11.0421 11.0421 11.8870 11.8870 k = 0.2931 0.2124 0.0000 ( 6591 PWs) bands (ev): -8.1652 -8.1652 -8.1320 -8.1320 -8.0376 -8.0376 -7.9737 -7.9737 -7.4797 -7.4797 -7.3356 -7.3356 -7.1855 -7.1855 -7.1598 -7.1598 -7.1010 -7.1010 -7.0774 -7.0774 -6.2525 -6.2525 -5.3146 -5.3146 -5.0098 -5.0098 -4.9821 -4.9821 0.6130 0.6130 1.3131 1.3131 2.3908 2.3908 2.5596 2.5596 2.6444 2.6444 2.7985 2.7985 2.8632 2.8632 2.9318 2.9318 3.0903 3.0903 3.5812 3.5812 3.6149 3.6149 3.6893 3.6893 3.8037 3.8037 3.9477 3.9477 4.3128 4.3128 4.4006 4.4006 5.2693 5.2693 5.4344 5.4344 5.5177 5.5177 6.1097 6.1097 6.4450 6.4450 6.5031 6.5031 8.9469 8.9469 10.0303 10.0303 10.2096 10.2096 10.3082 10.3082 10.3429 10.3429 10.9797 10.9797 11.8588 11.8588 k = 0.3103 0.2248 0.0000 ( 6607 PWs) bands (ev): -8.1639 -8.1639 -8.1315 -8.1315 -8.0383 -8.0383 -7.9770 -7.9770 -7.4745 -7.4745 -7.3413 -7.3413 -7.1848 -7.1848 -7.1623 -7.1623 -7.1000 -7.1000 -7.0780 -7.0780 -6.2189 -6.2189 -5.3513 -5.3513 -5.0105 -5.0105 -4.9849 -4.9849 0.6356 0.6356 1.2787 1.2787 2.3918 2.3918 2.5445 2.5445 2.6465 2.6465 2.7992 2.7992 2.8838 2.8838 2.9338 2.9338 3.0882 3.0882 3.6178 3.6178 3.6400 3.6400 3.7095 3.7095 3.8080 3.8080 3.9487 3.9487 4.2807 4.2807 4.3934 4.3934 5.2948 5.2948 5.4698 5.4698 5.5519 5.5519 6.0643 6.0643 6.4036 6.4036 6.4628 6.4628 9.0364 9.0364 10.0601 10.0601 10.1827 10.1827 10.2356 10.2356 10.2664 10.2664 10.9206 10.9206 11.8344 11.8344 k = 0.3276 0.2373-0.0000 ( 6603 PWs) bands (ev): -8.1624 -8.1624 -8.1313 -8.1313 -8.0384 -8.0384 -7.9804 -7.9804 -7.4691 -7.4691 -7.3471 -7.3471 -7.1841 -7.1841 -7.1645 -7.1645 -7.0990 -7.0990 -7.0785 -7.0785 -6.1843 -6.1843 -5.3891 -5.3891 -5.0111 -5.0111 -4.9876 -4.9876 0.6590 0.6590 1.2445 1.2445 2.3927 2.3927 2.5295 2.5295 2.6497 2.6497 2.7997 2.7997 2.8846 2.8846 2.9507 2.9507 3.0931 3.0931 3.6494 3.6494 3.6666 3.6666 3.7282 3.7282 3.8134 3.8134 3.9524 3.9524 4.2431 4.2431 4.3871 4.3871 5.3220 5.3220 5.5050 5.5050 5.5856 5.5856 6.0208 6.0208 6.3628 6.3628 6.4228 6.4228 9.1233 9.1233 10.0847 10.0847 10.1535 10.1535 10.1728 10.1728 10.1966 10.1966 10.8648 10.8648 11.8135 11.8135 k = 0.3448 0.2498 0.0000 ( 6607 PWs) bands (ev): -8.1608 -8.1608 -8.1314 -8.1314 -8.0381 -8.0381 -7.9839 -7.9839 -7.4636 -7.4636 -7.3530 -7.3530 -7.1835 -7.1835 -7.1665 -7.1665 -7.0979 -7.0979 -7.0792 -7.0792 -6.1487 -6.1487 -5.4277 -5.4277 -5.0116 -5.0116 -4.9903 -4.9903 0.6830 0.6830 1.2107 1.2107 2.3937 2.3937 2.5150 2.5150 2.6537 2.6537 2.7996 2.7996 2.8776 2.8776 2.9660 2.9660 3.1102 3.1102 3.6754 3.6754 3.6932 3.6932 3.7446 3.7446 3.8202 3.8202 3.9597 3.9597 4.2033 4.2033 4.3793 4.3793 5.3507 5.3507 5.5397 5.5397 5.6185 5.6185 5.9791 5.9791 6.3231 6.3231 6.3834 6.3834 9.2072 9.2072 10.0741 10.0741 10.1175 10.1175 10.1308 10.1308 10.1578 10.1578 10.8124 10.8124 11.7960 11.7960 k = 0.3621 0.2623 0.0000 ( 6615 PWs) bands (ev): -8.1592 -8.1592 -8.1318 -8.1318 -8.0374 -8.0374 -7.9876 -7.9876 -7.4580 -7.4580 -7.3591 -7.3591 -7.1829 -7.1829 -7.1684 -7.1684 -7.0968 -7.0968 -7.0799 -7.0799 -6.1122 -6.1122 -5.4671 -5.4671 -5.0119 -5.0119 -4.9928 -4.9928 0.7077 0.7077 1.1773 1.1773 2.3947 2.3947 2.5010 2.5010 2.6587 2.6587 2.7982 2.7982 2.8703 2.8703 2.9712 2.9712 3.1409 3.1409 3.6962 3.6962 3.7162 3.7162 3.7586 3.7586 3.8291 3.8291 3.9719 3.9719 4.1627 4.1627 4.3691 4.3691 5.3805 5.3805 5.5736 5.5736 5.6501 5.6501 5.9389 5.9389 6.2850 6.2850 6.3450 6.3450 9.2876 9.2876 10.0264 10.0264 10.0605 10.0605 10.0973 10.0973 10.1793 10.1793 10.7633 10.7633 11.7818 11.7818 k = 0.3793 0.2748 0.0000 ( 6631 PWs) bands (ev): -8.1575 -8.1575 -8.1325 -8.1325 -8.0362 -8.0362 -7.9914 -7.9914 -7.4522 -7.4522 -7.3652 -7.3652 -7.1824 -7.1824 -7.1700 -7.1700 -7.0957 -7.0957 -7.0807 -7.0807 -6.0748 -6.0748 -5.5072 -5.5072 -5.0121 -5.0121 -4.9953 -4.9953 0.7331 0.7331 1.1443 1.1443 2.3960 2.3960 2.4878 2.4878 2.6645 2.6645 2.7947 2.7947 2.8652 2.8652 2.9685 2.9685 3.1815 3.1815 3.7093 3.7093 3.7350 3.7350 3.7713 3.7713 3.8400 3.8400 3.9894 3.9894 4.1228 4.1228 4.3562 4.3562 5.4114 5.4114 5.6065 5.6065 5.6799 5.6799 5.9003 5.9003 6.2489 6.2489 6.3079 6.3079 9.3643 9.3643 9.9766 9.9766 10.0058 10.0058 10.0637 10.0637 10.2118 10.2118 10.7174 10.7174 11.7708 11.7708 k = 0.3966 0.2873 0.0000 ( 6607 PWs) bands (ev): -8.1556 -8.1556 -8.1335 -8.1335 -8.0345 -8.0345 -7.9951 -7.9951 -7.4462 -7.4462 -7.3714 -7.3714 -7.1818 -7.1818 -7.1715 -7.1715 -7.0945 -7.0945 -7.0814 -7.0814 -6.0367 -6.0367 -5.5477 -5.5477 -5.0121 -5.0121 -4.9976 -4.9976 0.7591 0.7591 1.1117 1.1117 2.3977 2.3977 2.4754 2.4754 2.6711 2.6711 2.7887 2.7887 2.8634 2.8634 2.9614 2.9614 3.2278 3.2278 3.7105 3.7105 3.7523 3.7523 3.7832 3.7832 3.8524 3.8524 4.0120 4.0120 4.0850 4.0850 4.3406 4.3406 5.4430 5.4430 5.6379 5.6379 5.7074 5.7074 5.8633 5.8633 6.2156 6.2156 6.2725 6.2725 9.4370 9.4370 9.9317 9.9317 9.9570 9.9570 10.0291 10.0291 10.2464 10.2464 10.6745 10.6745 11.7628 11.7628 k = 0.4138 0.2998 0.0000 ( 6607 PWs) bands (ev): -8.1537 -8.1537 -8.1347 -8.1347 -8.0325 -8.0325 -7.9990 -7.9990 -7.4402 -7.4402 -7.3776 -7.3776 -7.1812 -7.1812 -7.1728 -7.1728 -7.0933 -7.0933 -7.0823 -7.0823 -5.9978 -5.9978 -5.5887 -5.5887 -5.0119 -5.0119 -4.9998 -4.9998 0.7856 0.7856 1.0796 1.0796 2.3999 2.3999 2.4640 2.4640 2.6786 2.6786 2.7803 2.7803 2.8646 2.8646 2.9520 2.9520 3.2773 3.2773 3.6999 3.6999 3.7686 3.7686 3.7940 3.7940 3.8654 3.8654 4.0350 4.0350 4.0536 4.0536 4.3222 4.3222 5.4753 5.4753 5.6671 5.6671 5.7315 5.7315 5.8282 5.8282 6.1857 6.1857 6.2391 6.2391 9.5055 9.5055 9.8930 9.8930 9.9146 9.9146 9.9935 9.9935 10.2817 10.2817 10.6342 10.6342 11.7580 11.7580 k = 0.4310 0.3123 0.0000 ( 6615 PWs) bands (ev): -8.1517 -8.1517 -8.1362 -8.1362 -8.0301 -8.0301 -8.0029 -8.0029 -7.4341 -7.4341 -7.3839 -7.3839 -7.1806 -7.1806 -7.1740 -7.1740 -7.0921 -7.0921 -7.0833 -7.0833 -5.9584 -5.9584 -5.6300 -5.6300 -5.0116 -5.0116 -5.0018 -5.0018 0.8127 0.8127 1.0480 1.0480 2.4026 2.4026 2.4534 2.4534 2.6867 2.6867 2.7703 2.7703 2.8685 2.8685 2.9416 2.9416 3.3283 3.3283 3.6795 3.6795 3.7832 3.7832 3.8030 3.8030 3.8783 3.8783 4.0157 4.0157 4.0712 4.0712 4.3013 4.3013 5.5079 5.5079 5.6928 5.6928 5.7500 5.7500 5.7972 5.7972 6.1604 6.1604 6.2084 6.2084 9.5697 9.5697 9.8611 9.8611 9.8790 9.8790 9.9565 9.9565 10.3171 10.3171 10.5960 10.5960 11.7563 11.7563 k = 0.4483 0.3248-0.0000 ( 6630 PWs) bands (ev): -8.1498 -8.1498 -8.1379 -8.1379 -8.0274 -8.0274 -8.0067 -8.0067 -7.4280 -7.4280 -7.3903 -7.3903 -7.1800 -7.1800 -7.1751 -7.1751 -7.0909 -7.0909 -7.0842 -7.0842 -5.9184 -5.9184 -5.6714 -5.6714 -5.0110 -5.0110 -5.0037 -5.0037 0.8403 0.8403 1.0168 1.0168 2.4060 2.4060 2.4438 2.4438 2.6956 2.6956 2.7594 2.7594 2.8742 2.8742 2.9307 2.9307 3.3799 3.3799 3.6510 3.6510 3.7954 3.7954 3.8099 3.8099 3.8909 3.8909 3.9889 3.9889 4.1019 4.1019 4.2780 4.2780 5.5409 5.5409 5.7094 5.7094 5.7548 5.7548 5.7820 5.7820 6.1408 6.1408 6.1809 6.1809 9.6295 9.6295 9.8361 9.8361 9.8507 9.8507 9.9182 9.9182 10.3523 10.3523 10.5596 10.5596 11.7581 11.7581 k = 0.4655 0.3373 0.0000 ( 6614 PWs) bands (ev): -8.1477 -8.1477 -8.1397 -8.1397 -8.0244 -8.0244 -8.0104 -8.0104 -7.4217 -7.4217 -7.3965 -7.3965 -7.1793 -7.1793 -7.1761 -7.1761 -7.0897 -7.0897 -7.0852 -7.0852 -5.8779 -5.8779 -5.7130 -5.7130 -5.0103 -5.0103 -5.0054 -5.0054 0.8684 0.8684 0.9862 0.9862 2.4102 2.4102 2.4353 2.4353 2.7051 2.7051 2.7481 2.7481 2.8816 2.8816 2.9199 2.9199 3.4313 3.4313 3.6157 3.6157 3.8050 3.8050 3.8144 3.8144 3.9036 3.9036 3.9661 3.9661 4.1336 4.1336 4.2525 4.2525 5.5740 5.5740 5.6999 5.6999 5.7583 5.7583 5.7853 5.7853 6.1283 6.1283 6.1576 6.1576 9.6851 9.6851 9.8182 9.8182 9.8300 9.8300 9.8784 9.8784 10.3871 10.3871 10.5244 10.5244 11.7636 11.7636 k = 0.4828 0.3498 0.0000 ( 6614 PWs) bands (ev): -8.1456 -8.1456 -8.1416 -8.1416 -8.0211 -8.0211 -8.0141 -8.0141 -7.4155 -7.4155 -7.4029 -7.4029 -7.1786 -7.1786 -7.1770 -7.1770 -7.0885 -7.0885 -7.0863 -7.0863 -5.8370 -5.8370 -5.7545 -5.7545 -5.0093 -5.0093 -5.0069 -5.0069 0.8971 0.8971 0.9560 0.9560 2.4151 2.4151 2.4276 2.4276 2.7152 2.7152 2.7369 2.7369 2.8900 2.8900 2.9094 2.9094 3.4815 3.4815 3.5748 3.5748 3.8117 3.8117 3.8164 3.8164 3.9166 3.9166 3.9469 3.9469 4.1651 4.1651 4.2249 4.2249 5.6072 5.6072 5.6720 5.6720 5.7711 5.7711 5.7867 5.7867 6.1238 6.1238 6.1394 6.1394 9.7362 9.7362 9.8054 9.8054 9.8174 9.8174 9.8389 9.8389 10.4216 10.4216 10.4900 10.4900 11.7732 11.7732 k = 0.5000 0.3623 0.0000 ( 6622 PWs) bands (ev): -8.1436 -8.1436 -8.1436 -8.1436 -8.0177 -8.0177 -8.0177 -8.0177 -7.4092 -7.4092 -7.4092 -7.4092 -7.1779 -7.1779 -7.1779 -7.1779 -7.0874 -7.0874 -7.0874 -7.0874 -5.7958 -5.7958 -5.7958 -5.7958 -5.0082 -5.0082 -5.0082 -5.0082 0.9263 0.9263 0.9263 0.9263 2.4209 2.4209 2.4209 2.4209 2.7259 2.7259 2.7259 2.7259 2.8994 2.8994 2.8994 2.8994 3.5297 3.5297 3.5297 3.5297 3.8155 3.8155 3.8155 3.8155 3.9307 3.9307 3.9307 3.9307 4.1957 4.1957 4.1957 4.1957 5.6400 5.6400 5.6400 5.6400 5.7817 5.7817 5.7817 5.7817 6.1278 6.1278 6.1278 6.1278 9.7810 9.7810 9.7810 9.7810 9.8156 9.8156 9.8156 9.8156 10.4558 10.4558 10.4558 10.4558 11.7871 11.7871 k = 0.5000 0.3623 0.0000 ( 6622 PWs) bands (ev): -8.1436 -8.1436 -8.1436 -8.1436 -8.0177 -8.0177 -8.0177 -8.0177 -7.4092 -7.4092 -7.4092 -7.4092 -7.1779 -7.1779 -7.1779 -7.1779 -7.0874 -7.0874 -7.0874 -7.0874 -5.7958 -5.7958 -5.7958 -5.7958 -5.0082 -5.0082 -5.0082 -5.0082 0.9263 0.9263 0.9263 0.9263 2.4209 2.4209 2.4209 2.4209 2.7259 2.7259 2.7259 2.7259 2.8994 2.8994 2.8994 2.8994 3.5297 3.5297 3.5297 3.5297 3.8155 3.8155 3.8155 3.8155 3.9307 3.9307 3.9307 3.9307 4.1957 4.1957 4.1957 4.1957 5.6400 5.6400 5.6400 5.6400 5.7817 5.7817 5.7817 5.7817 6.1278 6.1278 6.1278 6.1278 9.7810 9.7810 9.7810 9.7810 9.8156 9.8156 9.8156 9.8156 10.4558 10.4558 10.4558 10.4558 11.7871 11.7871 k = 0.4912 0.3744 0.0150 ( 6612 PWs) bands (ev): -8.1461 -8.1447 -8.1425 -8.1409 -8.0215 -8.0195 -8.0159 -8.0140 -7.4135 -7.4111 -7.4072 -7.4050 -7.1789 -7.1780 -7.1778 -7.1767 -7.0877 -7.0877 -7.0871 -7.0870 -5.7969 -5.7968 -5.7944 -5.7937 -5.0096 -5.0092 -5.0087 -5.0069 0.9256 0.9264 0.9269 0.9272 2.4165 2.4190 2.4222 2.4250 2.7203 2.7261 2.7265 2.7302 2.8940 2.8976 2.9015 2.9058 3.5259 3.5282 3.5310 3.5331 3.7787 3.7938 3.8263 3.8347 3.9186 3.9195 3.9506 3.9642 4.1913 4.1947 4.1970 4.1991 5.6230 5.6262 5.6411 5.6457 5.7699 5.7733 5.7967 5.8040 6.1244 6.1250 6.1309 6.1313 9.7746 9.7769 9.7843 9.7857 9.8098 9.8143 9.8208 9.8289 10.4553 10.4571 10.4625 10.4641 11.7889 11.7889 k = 0.4824 0.3865 0.0299 ( 6618 PWs) bands (ev): -8.1486 -8.1459 -8.1414 -8.1381 -8.0254 -8.0214 -8.0142 -8.0104 -7.4179 -7.4130 -7.4051 -7.4009 -7.1800 -7.1783 -7.1779 -7.1756 -7.0881 -7.0880 -7.0869 -7.0867 -5.7976 -5.7967 -5.7924 -5.7903 -5.0120 -5.0119 -5.0096 -5.0055 0.9249 0.9273 0.9281 0.9281 2.4119 2.4165 2.4228 2.4288 2.7135 2.7273 2.7279 2.7333 2.8899 2.8965 2.9040 2.9132 3.5216 3.5259 3.5326 3.5364 3.7337 3.7566 3.8339 3.8395 3.9125 3.9256 3.9827 4.0061 4.1861 4.1934 4.1991 4.2018 5.5946 5.5981 5.6363 5.6452 5.7622 5.7660 5.8205 5.8354 6.1179 6.1193 6.1373 6.1382 9.7685 9.7717 9.7872 9.7873 9.8103 9.8150 9.8326 9.8484 10.4625 10.4664 10.4772 10.4799 11.7942 11.7943 k = 0.4737 0.3986 0.0449 ( 6620 PWs) bands (ev): -8.1509 -8.1470 -8.1403 -8.1351 -8.0294 -8.0233 -8.0124 -8.0068 -7.4225 -7.4148 -7.4031 -7.3969 -7.1811 -7.1786 -7.1780 -7.1744 -7.0884 -7.0883 -7.0866 -7.0863 -5.7979 -5.7956 -5.7898 -5.7858 -5.0162 -5.0161 -5.0104 -5.0040 0.9244 0.9288 0.9293 0.9301 2.4072 2.4134 2.4229 2.4322 2.7055 2.7292 2.7294 2.7355 2.8871 2.8963 2.9069 2.9214 3.5167 3.5219 3.5347 3.5397 3.6864 3.7099 3.8412 3.8425 3.9079 3.9373 4.0230 4.0493 4.1804 4.1914 4.2024 4.2044 5.5595 5.5615 5.6286 5.6412 5.7534 5.7571 5.8500 5.8713 6.1077 6.1101 6.1480 6.1488 9.7636 9.7666 9.7879 9.7904 9.8135 9.8173 9.8516 9.8737 10.4774 10.4836 10.4997 10.5031 11.8030 11.8031 k = 0.4649 0.4107 0.0599 ( 6608 PWs) bands (ev): -8.1530 -8.1482 -8.1392 -8.1319 -8.0334 -8.0252 -8.0107 -8.0034 -7.4271 -7.4165 -7.4010 -7.3929 -7.1821 -7.1791 -7.1783 -7.1732 -7.0887 -7.0886 -7.0864 -7.0860 -5.7979 -5.7937 -5.7865 -5.7800 -5.0221 -5.0219 -5.0109 -5.0022 0.9240 0.9303 0.9312 0.9327 2.4025 2.4100 2.4224 2.4353 2.6963 2.7285 2.7322 2.7381 2.8856 2.8976 2.9102 2.9304 3.5110 3.5143 3.5375 3.5427 3.6406 3.6590 3.8471 3.8489 3.9050 3.9500 4.0661 4.0901 4.1755 4.1882 4.2076 4.2080 5.5206 5.5208 5.6192 5.6347 5.7422 5.7456 5.8818 5.9091 6.0941 6.0976 6.1625 6.1629 9.7597 9.7621 9.7891 9.7940 9.8178 9.8209 9.8771 9.9046 10.4997 10.5086 10.5299 10.5332 11.8152 11.8154 k = 0.4561 0.4228 0.0748 ( 6608 PWs) bands (ev): -8.1550 -8.1494 -8.1381 -8.1287 -8.0375 -8.0272 -8.0090 -8.0001 -7.4319 -7.4180 -7.3991 -7.3889 -7.1831 -7.1796 -7.1786 -7.1720 -7.0890 -7.0890 -7.0862 -7.0856 -5.7977 -5.7913 -5.7821 -5.7730 -5.0296 -5.0292 -5.0112 -5.0004 0.9237 0.9314 0.9341 0.9360 2.3978 2.4064 2.4216 2.4379 2.6857 2.7247 2.7357 2.7421 2.8848 2.9012 2.9141 2.9400 3.4994 3.5045 3.5410 3.5447 3.6017 3.6062 3.8535 3.8569 3.9034 3.9636 4.1086 4.1227 4.1745 4.1843 4.2119 4.2179 5.4777 5.4794 5.6087 5.6260 5.7279 5.7312 5.9140 5.9471 6.0774 6.0822 6.1798 6.1806 9.7568 9.7584 9.7911 9.7980 9.8234 9.8258 9.9087 9.9412 10.5291 10.5412 10.5675 10.5698 11.8309 11.8311 k = 0.4473 0.4350 0.0898 ( 6604 PWs) bands (ev): -8.1569 -8.1506 -8.1370 -8.1253 -8.0417 -8.0292 -8.0074 -7.9969 -7.4368 -7.4194 -7.3972 -7.3850 -7.1841 -7.1803 -7.1790 -7.1707 -7.0894 -7.0893 -7.0860 -7.0852 -5.7972 -5.7888 -5.7766 -5.7648 -5.0385 -5.0380 -5.0114 -4.9984 0.9234 0.9326 0.9378 0.9400 2.3933 2.4028 2.4205 2.4401 2.6736 2.7178 2.7395 2.7472 2.8844 2.9074 2.9187 2.9503 3.4714 3.4971 3.5435 3.5450 3.5530 3.5776 3.8615 3.8646 3.9032 3.9781 4.1380 4.1454 4.1828 4.1834 4.2182 4.2365 5.4334 5.4368 5.5976 5.6157 5.7106 5.7138 5.9447 5.9837 6.0589 6.0652 6.1993 6.2018 9.7545 9.7555 9.7939 9.8025 9.8304 9.8320 9.9463 9.9835 10.5651 10.5813 10.6124 10.6124 11.8498 11.8501 k = 0.4385 0.4471 0.1048 ( 6608 PWs) bands (ev): -8.1587 -8.1518 -8.1360 -8.1218 -8.0459 -8.0313 -8.0057 -7.9939 -7.4419 -7.4207 -7.3954 -7.3811 -7.1851 -7.1810 -7.1795 -7.1694 -7.0898 -7.0896 -7.0858 -7.0849 -5.7966 -5.7862 -5.7698 -5.7556 -5.0489 -5.0480 -5.0113 -4.9962 0.9232 0.9336 0.9421 0.9447 2.3890 2.3993 2.4193 2.4419 2.6600 2.7080 2.7435 2.7531 2.8843 2.9165 2.9239 2.9610 3.4306 3.4889 3.4993 3.5370 3.5500 3.5703 3.8706 3.8712 3.9045 3.9934 4.1396 4.1582 4.1952 4.2004 4.2299 4.2659 5.3883 5.3932 5.5863 5.6043 5.6902 5.6934 5.9699 6.0104 6.0470 6.0505 6.2207 6.2254 9.7527 9.7531 9.7976 9.8075 9.8387 9.8397 9.9902 10.0316 10.6073 10.6284 10.6605 10.6643 11.8721 11.8723 k = 0.4298 0.4592 0.1197 ( 6600 PWs) bands (ev): -8.1603 -8.1530 -8.1349 -8.1181 -8.0501 -8.0334 -8.0041 -7.9909 -7.4470 -7.4218 -7.3938 -7.3771 -7.1860 -7.1818 -7.1800 -7.1680 -7.0902 -7.0898 -7.0857 -7.0845 -5.7960 -5.7838 -5.7617 -5.7451 -5.0604 -5.0593 -5.0111 -4.9940 0.9229 0.9346 0.9471 0.9500 2.3850 2.3962 2.4183 2.4434 2.6447 2.6957 2.7474 2.7595 2.8844 2.9280 2.9299 2.9722 3.3832 3.4466 3.4799 3.5282 3.5552 3.5710 3.8757 3.8805 3.9074 4.0092 4.1384 4.1539 4.2062 4.2193 4.2567 4.3016 5.3429 5.3489 5.5753 5.5921 5.6670 5.6700 5.9785 5.9999 6.0493 6.0691 6.2438 6.2510 9.7511 9.7513 9.8020 9.8131 9.8485 9.8488 10.0401 10.0854 10.6552 10.6824 10.7137 10.7228 11.8974 11.8977 k = 0.4210 0.4713 0.1347 ( 6596 PWs) bands (ev): -8.1618 -8.1541 -8.1338 -8.1144 -8.0544 -8.0356 -8.0025 -7.9881 -7.4523 -7.4227 -7.3923 -7.3731 -7.1870 -7.1826 -7.1806 -7.1666 -7.0907 -7.0900 -7.0855 -7.0842 -5.7954 -5.7816 -5.7524 -5.7336 -5.0729 -5.0715 -5.0108 -4.9916 0.9225 0.9353 0.9529 0.9559 2.3813 2.3936 2.4177 2.4447 2.6279 2.6812 2.7510 2.7664 2.8848 2.9366 2.9415 2.9838 3.3333 3.3949 3.4700 3.5186 3.5609 3.5739 3.8780 3.8904 3.9116 4.0252 4.1379 4.1471 4.2170 4.2313 4.2934 4.3395 5.2975 5.3044 5.5648 5.5794 5.6410 5.6439 5.9645 5.9747 6.0679 6.1029 6.2681 6.2781 9.7493 9.7500 9.8072 9.8192 9.8595 9.8598 10.0960 10.1446 10.7083 10.7429 10.7712 10.7876 11.9257 11.9260 k = 0.4122 0.4834 0.1497 ( 6590 PWs) bands (ev): -8.1631 -8.1553 -8.1327 -8.1105 -8.0587 -8.0379 -8.0010 -7.9855 -7.4576 -7.4234 -7.3910 -7.3690 -7.1879 -7.1836 -7.1812 -7.1652 -7.0911 -7.0902 -7.0854 -7.0838 -5.7950 -5.7797 -5.7418 -5.7211 -5.0863 -5.0845 -5.0102 -4.9891 0.9220 0.9358 0.9593 0.9625 2.3781 2.3916 2.4174 2.4457 2.6096 2.6649 2.7540 2.7737 2.8853 2.9438 2.9566 2.9956 3.2829 3.3450 3.4594 3.5081 3.5668 3.5773 3.8784 3.8997 3.9162 4.0405 4.1394 4.1411 4.2288 4.2429 4.3316 4.3775 5.2522 5.2598 5.5550 5.5664 5.6125 5.6151 5.9402 5.9464 6.0941 6.1369 6.2933 6.3061 9.7476 9.7487 9.8131 9.8260 9.8717 9.8727 10.1576 10.2091 10.7662 10.8096 10.8328 10.8583 11.9567 11.9571 k = 0.4034 0.4956 0.1646 ( 6602 PWs) bands (ev): -8.1644 -8.1565 -8.1316 -8.1065 -8.0630 -8.0402 -7.9994 -7.9830 -7.4630 -7.4240 -7.3899 -7.3650 -7.1889 -7.1846 -7.1819 -7.1638 -7.0916 -7.0905 -7.0854 -7.0835 -5.7948 -5.7784 -5.7301 -5.7076 -5.1004 -5.0981 -5.0096 -4.9866 0.9212 0.9359 0.9663 0.9697 2.3753 2.3903 2.4178 2.4465 2.5897 2.6471 2.7562 2.7812 2.8859 2.9514 2.9729 3.0074 3.2330 3.2974 3.4480 3.4964 3.5729 3.5806 3.8777 3.9077 3.9200 4.0538 4.1381 4.1434 4.2423 4.2560 4.3692 4.4150 5.2074 5.2156 5.5462 5.5529 5.5823 5.5839 5.9122 5.9167 6.1218 6.1697 6.3189 6.3346 9.7458 9.7472 9.8197 9.8334 9.8856 9.8872 10.2248 10.2784 10.8282 10.8820 10.8977 10.9345 11.9904 11.9908 k = 0.3946 0.5077 0.1796 ( 6604 PWs) bands (ev): -8.1656 -8.1577 -8.1304 -8.1024 -8.0673 -8.0425 -7.9979 -7.9807 -7.4685 -7.4243 -7.3890 -7.3608 -7.1899 -7.1856 -7.1827 -7.1623 -7.0922 -7.0907 -7.0853 -7.0832 -5.7952 -5.7777 -5.7172 -5.6932 -5.1149 -5.1120 -5.0088 -4.9840 0.9203 0.9357 0.9741 0.9775 2.3730 2.3898 2.4188 2.4472 2.5684 2.6282 2.7573 2.7888 2.8866 2.9592 2.9898 3.0190 3.1845 3.2528 3.4361 3.4833 3.5791 3.5835 3.8766 3.9135 3.9222 4.0633 4.1406 4.1500 4.2577 4.2710 4.4055 4.4516 5.1633 5.1719 5.5360 5.5384 5.5504 5.5537 5.8828 5.8865 6.1491 6.2008 6.3447 6.3631 9.7439 9.7455 9.8272 9.8415 9.9012 9.9033 10.2970 10.3521 10.8941 10.9598 10.9656 11.0159 12.0263 12.0268 k = 0.3859 0.5198 0.1945 ( 6604 PWs) bands (ev): -8.1667 -8.1588 -8.1292 -8.0982 -8.0716 -8.0449 -7.9964 -7.9784 -7.4740 -7.4245 -7.3883 -7.3565 -7.1908 -7.1867 -7.1834 -7.1609 -7.0927 -7.0908 -7.0852 -7.0829 -5.7961 -5.7778 -5.7034 -5.6778 -5.1295 -5.1260 -5.0079 -4.9813 0.9189 0.9349 0.9825 0.9860 2.3712 2.3898 2.4207 2.4478 2.5458 2.6085 2.7571 2.7963 2.8873 2.9669 3.0068 3.0299 3.1381 3.2123 3.4237 3.4690 3.5852 3.5859 3.8755 3.9166 3.9222 4.0677 4.1502 4.1593 4.2750 4.2881 4.4403 4.4871 5.1202 5.1290 5.5071 5.5150 5.5317 5.5356 5.8532 5.8565 6.1751 6.2298 6.3703 6.3912 9.7418 9.7435 9.8354 9.8503 9.9185 9.9209 10.3737 10.4297 10.9635 11.0361 11.0427 11.1021 12.0642 12.0649 k = 0.3771 0.5319 0.2095 ( 6598 PWs) bands (ev): -8.1676 -8.1599 -8.1280 -8.0938 -8.0758 -8.0474 -7.9949 -7.9763 -7.4794 -7.4244 -7.3879 -7.3521 -7.1917 -7.1877 -7.1842 -7.1594 -7.0932 -7.0909 -7.0852 -7.0826 -5.7979 -5.7790 -5.6885 -5.6616 -5.1441 -5.1398 -5.0069 -4.9786 0.9172 0.9336 0.9915 0.9950 2.3700 2.3903 2.4233 2.4484 2.5219 2.5884 2.7553 2.8036 2.8879 2.9740 3.0226 3.0394 3.0953 3.1771 3.4111 3.4535 3.5876 3.5910 3.8749 3.9166 3.9195 4.0680 4.1663 4.1711 4.2941 4.3073 4.4735 4.5212 5.0783 5.0875 5.4714 5.4780 5.5232 5.5259 5.8244 5.8275 6.1995 6.2564 6.3954 6.4186 9.7392 9.7410 9.8445 9.8599 9.9374 9.9402 10.4545 10.5105 11.0361 11.1086 11.1301 11.1926 12.1036 12.1046 k = 0.3683 0.5440 0.2245 ( 6602 PWs) bands (ev): -8.1684 -8.1610 -8.1267 -8.0894 -8.0801 -8.0499 -7.9934 -7.9744 -7.4849 -7.4242 -7.3877 -7.3477 -7.1927 -7.1888 -7.1850 -7.1579 -7.0938 -7.0910 -7.0852 -7.0823 -5.8007 -5.7815 -5.6726 -5.6446 -5.1583 -5.1530 -5.0058 -4.9758 0.9150 0.9316 1.0012 1.0046 2.3693 2.3907 2.4268 2.4493 2.4969 2.5687 2.7515 2.8104 2.8880 2.9803 3.0298 3.0461 3.0638 3.1489 3.3984 3.4374 3.5886 3.5966 3.8750 3.9136 3.9141 4.0660 4.1851 4.1869 4.3147 4.3282 4.5047 4.5539 5.0380 5.0476 5.4334 5.4396 5.5123 5.5208 5.7973 5.8003 6.2218 6.2803 6.4196 6.4447 9.7361 9.7379 9.8545 9.8704 9.9580 9.9609 10.5386 10.5936 11.1116 11.1829 11.2216 11.2870 12.1439 12.1455 k = 0.3595 0.5562 0.2394 ( 6598 PWs) bands (ev): -8.1691 -8.1621 -8.1254 -8.0849 -8.0842 -8.0524 -7.9919 -7.9727 -7.4904 -7.4237 -7.3878 -7.3432 -7.1936 -7.1898 -7.1857 -7.1564 -7.0944 -7.0911 -7.0853 -7.0821 -5.8048 -5.7855 -5.6558 -5.6269 -5.1718 -5.1655 -5.0046 -4.9731 0.9123 0.9290 1.0116 1.0148 2.3692 2.3900 2.4310 2.4506 2.4713 2.5500 2.7457 2.8164 2.8872 2.9851 3.0065 3.0482 3.0660 3.1304 3.3861 3.4210 3.5889 3.6018 3.8758 3.9060 3.9078 4.0631 4.2009 4.2102 4.3365 4.3503 4.5340 4.5849 4.9995 5.0098 5.3942 5.4002 5.5022 5.5163 5.7727 5.7759 6.2419 6.3013 6.4428 6.4694 9.7324 9.7342 9.8655 9.8817 9.9803 9.9832 10.6252 10.6782 11.1900 11.2587 11.3168 11.3849 12.1844 12.1870 k = 0.3507 0.5683 0.2544 ( 6596 PWs) bands (ev): -8.1698 -8.1631 -8.1241 -8.0883 -8.0804 -8.0550 -7.9905 -7.9710 -7.4958 -7.4231 -7.3881 -7.3386 -7.1944 -7.1909 -7.1866 -7.1548 -7.0951 -7.0911 -7.0854 -7.0818 -5.8103 -5.7911 -5.6382 -5.6084 -5.1843 -5.1768 -5.0034 -4.9703 0.9089 0.9255 1.0226 1.0256 2.3696 2.3870 2.4337 2.4471 2.4531 2.5335 2.7377 2.8209 2.8845 2.9768 2.9878 3.0451 3.0790 3.1224 3.3746 3.4051 3.5883 3.6066 3.8772 3.8955 3.8997 4.0597 4.2180 4.2354 4.3590 4.3732 4.5610 4.6138 4.9632 4.9747 5.3542 5.3601 5.4923 5.5118 5.7517 5.7553 6.2594 6.3191 6.4646 6.4922 9.7279 9.7297 9.8777 9.8941 10.0042 10.0069 10.7132 10.7631 11.2712 11.3359 11.4150 11.4857 12.2240 12.2283 k = 0.3420 0.5804 0.2694 ( 6586 PWs) bands (ev): -8.1703 -8.1640 -8.1227 -8.0923 -8.0757 -8.0577 -7.9890 -7.9696 -7.5011 -7.4222 -7.3886 -7.3340 -7.1952 -7.1919 -7.1873 -7.1533 -7.0957 -7.0912 -7.0855 -7.0815 -5.8174 -5.7987 -5.6199 -5.5894 -5.1956 -5.1868 -5.0021 -4.9676 0.9049 0.9212 1.0342 1.0370 2.3701 2.3800 2.4152 2.4445 2.4572 2.5201 2.7278 2.8225 2.8789 2.9535 2.9881 3.0397 3.0920 3.1219 3.3642 3.3904 3.5869 3.6109 3.8763 3.8856 3.8898 4.0562 4.2357 4.2613 4.3818 4.3964 4.5857 4.6402 4.9298 4.9431 5.3139 5.3197 5.4827 5.5069 5.7351 5.7396 6.2741 6.3334 6.4848 6.5131 9.7225 9.7242 9.8911 9.9075 10.0296 10.0321 10.8016 10.8471 11.3553 11.4143 11.5159 11.5889 12.2612 12.2683 k = 0.3332 0.5925 0.2843 ( 6580 PWs) bands (ev): -8.1708 -8.1649 -8.1213 -8.0962 -8.0710 -8.0603 -7.9876 -7.9682 -7.5064 -7.4211 -7.3895 -7.3293 -7.1960 -7.1929 -7.1881 -7.1517 -7.0964 -7.0911 -7.0856 -7.0812 -5.8264 -5.8083 -5.6008 -5.5698 -5.2055 -5.1952 -5.0007 -4.9650 0.9001 0.9160 1.0465 1.0489 2.3684 2.3688 2.3907 2.4503 2.4634 2.5105 2.7163 2.8183 2.8721 2.9389 2.9862 3.0352 3.1033 3.1247 3.3556 3.3777 3.5847 3.6146 3.8639 3.8785 3.8857 4.0527 4.2531 4.2870 4.4047 4.4192 4.6079 4.6637 4.8998 4.9159 5.2737 5.2794 5.4732 5.5013 5.7236 5.7297 6.2858 6.3441 6.5032 6.5317 9.7160 9.7177 9.9058 9.9222 10.0565 10.0586 10.8890 10.9287 11.4424 11.4942 11.6187 11.6938 12.2941 12.3056 k = 0.3244 0.6046 0.2993 ( 6576 PWs) bands (ev): -8.1712 -8.1658 -8.1199 -8.0998 -8.0664 -8.0629 -7.9862 -7.9670 -7.5115 -7.4198 -7.3905 -7.3245 -7.1967 -7.1938 -7.1889 -7.1502 -7.0970 -7.0911 -7.0857 -7.0810 -5.8374 -5.8200 -5.5811 -5.5496 -5.2136 -5.2019 -4.9993 -4.9624 0.8945 0.9098 1.0595 1.0615 2.3524 2.3535 2.3802 2.4568 2.4715 2.5046 2.7040 2.8058 2.8686 2.9311 2.9836 3.0318 3.1122 3.1279 3.3492 3.3678 3.5816 3.6177 3.8465 3.8660 3.8892 4.0493 4.2691 4.3112 4.4272 4.4412 4.6275 4.6835 4.8740 4.8942 5.2340 5.2395 5.4639 5.4947 5.7177 5.7262 6.2943 6.3509 6.5198 6.5480 9.7082 9.7099 9.9220 9.9381 10.0849 10.0864 10.9739 11.0068 11.5325 11.5756 11.7227 11.7999 12.3204 12.3382 k = 0.3156 0.6168 0.3143 ( 6566 PWs) bands (ev): -8.1715 -8.1666 -8.1187 -8.1031 -8.0662 -8.0612 -7.9848 -7.9660 -7.5165 -7.4182 -7.3919 -7.3197 -7.1973 -7.1947 -7.1896 -7.1486 -7.0977 -7.0910 -7.0859 -7.0807 -5.8504 -5.8339 -5.5607 -5.5290 -5.2199 -5.2066 -4.9979 -4.9599 0.8880 0.9025 1.0731 1.0746 2.3274 2.3331 2.3812 2.4633 2.4809 2.5020 2.6916 2.7872 2.8694 2.9268 2.9814 3.0289 3.1186 3.1305 3.3452 3.3613 3.5777 3.6201 3.8271 3.8525 3.8935 4.0463 4.2829 4.3327 4.4488 4.4617 4.6443 4.6991 4.8536 4.8794 5.1951 5.2003 5.4552 5.4876 5.7174 5.7293 6.2994 6.3538 6.5343 6.5620 9.6990 9.7007 9.9396 9.9555 10.1148 10.1156 11.0548 11.0798 11.6254 11.6590 11.8269 11.9062 12.3372 12.3634 k = 0.3156 0.6168 0.3143 ( 6566 PWs) bands (ev): -8.1715 -8.1666 -8.1187 -8.1031 -8.0662 -8.0612 -7.9848 -7.9660 -7.5165 -7.4182 -7.3919 -7.3197 -7.1973 -7.1947 -7.1896 -7.1486 -7.0977 -7.0910 -7.0859 -7.0807 -5.8504 -5.8339 -5.5607 -5.5290 -5.2199 -5.2066 -4.9979 -4.9599 0.8880 0.9025 1.0731 1.0746 2.3274 2.3331 2.3812 2.4633 2.4809 2.5020 2.6916 2.7872 2.8694 2.9268 2.9814 3.0289 3.1186 3.1305 3.3452 3.3613 3.5777 3.6201 3.8271 3.8525 3.8935 4.0463 4.2829 4.3327 4.4488 4.4617 4.6443 4.6991 4.8536 4.8794 5.1951 5.2003 5.4552 5.4876 5.7174 5.7293 6.2994 6.3538 6.5343 6.5620 9.6990 9.7007 9.9396 9.9555 10.1148 10.1156 11.0548 11.0798 11.6254 11.6590 11.8269 11.9062 12.3372 12.3634 k = 0.2959 0.6111 0.3213 ( 6574 PWs) bands (ev): -8.1718 -8.1668 -8.1184 -8.1047 -8.0671 -8.0590 -7.9844 -7.9654 -7.5187 -7.4191 -7.3910 -7.3175 -7.1977 -7.1953 -7.1897 -7.1479 -7.0985 -7.0907 -7.0862 -7.0806 -5.8586 -5.8426 -5.5499 -5.5184 -5.2219 -5.2070 -4.9975 -4.9588 0.8834 0.8975 1.0807 1.0825 2.3146 2.3232 2.3821 2.4662 2.4855 2.5020 2.6856 2.7768 2.8712 2.9249 2.9809 3.0277 3.1213 3.1316 3.3410 3.3613 3.5770 3.6225 3.8147 3.8430 3.8994 4.0454 4.2852 4.3415 4.4507 4.4756 4.6454 4.7044 4.8510 4.8799 5.1774 5.1835 5.4522 5.4866 5.7190 5.7336 6.2936 6.3471 6.5445 6.5731 9.6890 9.6919 9.9519 9.9678 10.1295 10.1359 11.0906 11.1119 11.6692 11.6985 11.8742 11.9536 12.3432 12.3731 k = 0.2762 0.6054 0.3283 ( 6577 PWs) bands (ev): -8.1723 -8.1667 -8.1186 -8.1064 -8.0674 -8.0566 -7.9844 -7.9646 -7.5205 -7.4225 -7.3877 -7.3156 -7.1982 -7.1959 -7.1892 -7.1471 -7.0999 -7.0898 -7.0867 -7.0803 -5.8694 -5.8537 -5.5376 -5.5069 -5.2226 -5.2047 -4.9974 -4.9581 0.8768 0.8901 1.0902 1.0927 2.3016 2.3127 2.3825 2.4692 2.4892 2.5039 2.6792 2.7650 2.8744 2.9228 2.9814 3.0273 3.1245 3.1330 3.3336 3.3634 3.5789 3.6269 3.7979 3.8303 3.9087 4.0455 4.2827 4.3471 4.4473 4.4878 4.6355 4.7062 4.8603 4.8915 5.1622 5.1692 5.4513 5.4899 5.7212 5.7396 6.2762 6.3293 6.5603 6.5907 9.6719 9.6762 9.9696 9.9860 10.1506 10.1633 11.1247 11.1425 11.7130 11.7382 11.9179 11.9951 12.3513 12.3820 k = 0.2564 0.5998 0.3352 ( 6574 PWs) bands (ev): -8.1728 -8.1664 -8.1191 -8.1082 -8.0672 -8.0541 -7.9845 -7.9636 -7.5219 -7.4273 -7.3831 -7.3138 -7.1989 -7.1964 -7.1883 -7.1462 -7.1016 -7.0887 -7.0873 -7.0799 -5.8818 -5.8663 -5.5252 -5.4956 -5.2215 -5.1996 -4.9977 -4.9577 0.8690 0.8815 1.1009 1.1040 2.2887 2.3017 2.3821 2.4716 2.4903 2.5089 2.6729 2.7524 2.8788 2.9207 2.9831 3.0280 3.1278 3.1348 3.3260 3.3657 3.5826 3.6319 3.7787 3.8161 3.9185 4.0462 4.2773 4.3469 4.4432 4.4929 4.6210 4.7033 4.8806 4.9110 5.1516 5.1588 5.4527 5.4968 5.7237 5.7461 6.2515 6.3044 6.5776 6.6096 9.6517 9.6568 9.9901 10.0070 10.1786 10.1969 11.1573 11.1721 11.7564 11.7778 11.9563 12.0284 12.3613 12.3888 k = 0.2367 0.5941 0.3422 ( 6570 PWs) bands (ev): -8.1733 -8.1661 -8.1201 -8.1099 -8.0666 -8.0516 -7.9847 -7.9627 -7.5229 -7.4328 -7.3779 -7.3124 -7.1996 -7.1969 -7.1870 -7.1454 -7.1035 -7.0886 -7.0872 -7.0794 -5.8947 -5.8797 -5.5135 -5.4854 -5.2184 -5.1921 -4.9985 -4.9578 0.8606 0.8721 1.1122 1.1158 2.2759 2.2903 2.3809 2.4723 2.4903 2.5161 2.6675 2.7400 2.8844 2.9189 2.9861 3.0297 3.1302 3.1378 3.3190 3.3679 3.5874 3.6363 3.7584 3.8008 3.9274 4.0471 4.2699 4.3402 4.4395 4.4886 4.6092 4.6968 4.9072 4.9344 5.1465 5.1548 5.4565 5.5062 5.7261 5.7525 6.2224 6.2752 6.5935 6.6266 9.6311 9.6361 10.0117 10.0288 10.2129 10.2361 11.1887 11.2010 11.7990 11.8168 11.9880 12.0519 12.3708 12.3930 k = 0.2170 0.5885 0.3492 ( 6572 PWs) bands (ev): -8.1738 -8.1658 -8.1213 -8.1116 -8.0656 -8.0493 -7.9850 -7.9618 -7.5236 -7.4387 -7.3726 -7.3113 -7.2004 -7.1973 -7.1856 -7.1447 -7.1054 -7.0895 -7.0860 -7.0790 -5.9077 -5.8933 -5.5032 -5.4767 -5.2130 -5.1824 -4.9998 -4.9583 0.8519 0.8625 1.1236 1.1275 2.2632 2.2785 2.3790 2.4693 2.4917 2.5239 2.6635 2.7285 2.8908 2.9180 2.9908 3.0323 3.1311 3.1423 3.3131 3.3696 3.5925 3.6395 3.7378 3.7850 3.9347 4.0478 4.2611 4.3281 4.4362 4.4750 4.6035 4.6891 4.9339 4.9581 5.1479 5.1604 5.4624 5.5176 5.7284 5.7585 6.1909 6.2433 6.6062 6.6402 9.6114 9.6161 10.0336 10.0502 10.2530 10.2804 11.2192 11.2295 11.8402 11.8544 12.0121 12.0654 12.3726 12.3973 k = 0.1973 0.5828 0.3562 ( 6574 PWs) bands (ev): -8.1742 -8.1656 -8.1227 -8.1132 -8.0643 -8.0471 -7.9851 -7.9612 -7.5237 -7.4446 -7.3672 -7.3105 -7.2011 -7.1976 -7.1838 -7.1441 -7.1072 -7.0907 -7.0849 -7.0786 -5.9204 -5.9066 -5.4945 -5.4698 -5.2054 -5.1709 -5.0016 -4.9595 0.8433 0.8530 1.1347 1.1389 2.2510 2.2664 2.3766 2.4625 2.4949 2.5316 2.6613 2.7186 2.8978 2.9184 2.9972 3.0358 3.1309 3.1479 3.3083 3.3708 3.5965 3.6410 3.7176 3.7695 3.9400 4.0475 4.2512 4.3126 4.4328 4.4558 4.6030 4.6816 4.9553 4.9795 5.1583 5.1765 5.4703 5.5300 5.7303 5.7639 6.1579 6.2099 6.6148 6.6496 9.5937 9.5978 10.0550 10.0707 10.2982 10.3288 11.2495 11.2583 11.8791 11.8894 12.0284 12.0702 12.3628 12.4014 k = 0.1775 0.5771 0.3632 ( 6576 PWs) bands (ev): -8.1744 -8.1654 -8.1240 -8.1147 -8.0628 -8.0452 -7.9850 -7.9609 -7.5234 -7.4507 -7.3619 -7.3101 -7.2017 -7.1980 -7.1819 -7.1436 -7.1088 -7.0920 -7.0838 -7.0782 -5.9323 -5.9194 -5.4874 -5.4647 -5.1959 -5.1580 -5.0040 -4.9612 0.8352 0.8439 1.1454 1.1496 2.2391 2.2544 2.3740 2.4530 2.4993 2.5385 2.6608 2.7106 2.9046 2.9208 3.0051 3.0400 3.1300 3.1542 3.3045 3.3712 3.5983 3.6407 3.6986 3.7549 3.9432 4.0458 4.2407 4.2958 4.4280 4.4361 4.6055 4.6748 4.9696 4.9960 5.1798 5.2020 5.4798 5.5429 5.7322 5.7688 6.1244 6.1756 6.6192 6.6545 9.5785 9.5817 10.0754 10.0900 10.3474 10.3806 11.2800 11.2875 11.9145 11.9203 12.0372 12.0686 12.3450 12.3992 k = 0.1578 0.5715 0.3702 ( 6576 PWs) bands (ev): -8.1745 -8.1654 -8.1253 -8.1161 -8.0611 -8.0437 -7.9845 -7.9608 -7.5226 -7.4567 -7.3568 -7.3101 -7.2021 -7.1984 -7.1797 -7.1435 -7.1102 -7.0934 -7.0828 -7.0779 -5.9433 -5.9314 -5.4818 -5.4612 -5.1847 -5.1442 -5.0069 -4.9637 0.8275 0.8353 1.1553 1.1594 2.2279 2.2424 2.3712 2.4420 2.5043 2.5443 2.6618 2.7045 2.9106 2.9256 3.0145 3.0447 3.1286 3.1612 3.3017 3.3703 3.5962 3.6386 3.6821 3.7416 3.9442 4.0422 4.2305 4.2794 4.4149 4.4259 4.6092 4.6689 4.9786 5.0062 5.2115 5.2344 5.4903 5.5555 5.7340 5.7731 6.0911 6.1409 6.6196 6.6550 9.5659 9.5683 10.0945 10.1076 10.3998 10.4348 11.3110 11.3176 11.9438 11.9452 12.0393 12.0626 12.3228 12.3885 k = 0.1381 0.5658 0.3772 ( 6579 PWs) bands (ev): -8.1745 -8.1656 -8.1264 -8.1175 -8.0594 -8.0426 -7.9838 -7.9610 -7.5213 -7.4627 -7.3518 -7.3104 -7.2024 -7.1988 -7.1774 -7.1438 -7.1112 -7.0950 -7.0819 -7.0777 -5.9532 -5.9424 -5.4775 -5.4592 -5.1724 -5.1301 -5.0104 -4.9669 0.8206 0.8274 1.1644 1.1683 2.2175 2.2309 2.3686 2.4305 2.5095 2.5485 2.6640 2.7001 2.9160 2.9323 3.0248 3.0500 3.1276 3.1690 3.2994 3.3675 3.5898 3.6336 3.6703 3.7296 3.9436 4.0362 4.2214 4.2644 4.3999 4.4203 4.6134 4.6639 4.9845 5.0115 5.2499 5.2708 5.5015 5.5671 5.7360 5.7768 6.0587 6.1063 6.6167 6.6515 9.5559 9.5576 10.1120 10.1236 10.4541 10.4900 11.3427 11.3490 11.9598 11.9655 12.0359 12.0540 12.3002 12.3717 k = 0.1184 0.5601 0.3842 ( 6585 PWs) bands (ev): -8.1743 -8.1659 -8.1273 -8.1190 -8.0575 -8.0419 -7.9827 -7.9616 -7.5196 -7.4686 -7.3470 -7.3112 -7.2026 -7.1992 -7.1748 -7.1445 -7.1117 -7.0966 -7.0810 -7.0775 -5.9619 -5.9524 -5.4741 -5.4582 -5.1593 -5.1162 -5.0141 -4.9709 0.8144 0.8203 1.1725 1.1760 2.2080 2.2200 2.3663 2.4190 2.5149 2.5512 2.6669 2.6971 2.9216 2.9396 3.0349 3.0559 3.1279 3.1775 3.2972 3.3621 3.5803 3.6247 3.6644 3.7186 3.9421 4.0280 4.2141 4.2513 4.3884 4.4145 4.6175 4.6595 4.9887 5.0138 5.2914 5.3089 5.5129 5.5769 5.7384 5.7800 6.0278 6.0723 6.6114 6.6447 9.5482 9.5493 10.1276 10.1376 10.5089 10.5446 11.3751 11.3818 11.9628 11.9726 12.0286 12.0431 12.2825 12.3539 k = 0.0986 0.5545 0.3912 ( 6582 PWs) bands (ev): -8.1740 -8.1664 -8.1278 -8.1203 -8.0556 -8.0417 -7.9812 -7.9625 -7.5174 -7.4743 -7.3424 -7.3123 -7.2027 -7.1997 -7.1721 -7.1457 -7.1118 -7.0982 -7.0803 -7.0773 -5.9692 -5.9611 -5.4714 -5.4580 -5.1460 -5.1033 -5.0179 -4.9757 0.8092 0.8141 1.1795 1.1827 2.1997 2.2100 2.3646 2.4081 2.5202 2.5525 2.6703 2.6950 2.9277 2.9465 3.0436 3.0620 3.1313 3.1867 3.2946 3.3532 3.5701 3.6135 3.6624 3.7082 3.9407 4.0178 4.2090 4.2403 4.3806 4.4084 4.6216 4.6556 4.9921 5.0142 5.3330 5.3468 5.5239 5.5843 5.7412 5.7823 5.9996 6.0398 6.6047 6.6354 9.5425 9.5433 10.1413 10.1496 10.5625 10.5967 11.4084 11.4160 11.9518 11.9610 12.0195 12.0299 12.2754 12.3417 k = 0.0789 0.5488 0.3981 ( 6581 PWs) bands (ev): -8.1735 -8.1671 -8.1280 -8.1216 -8.0536 -8.0420 -7.9795 -7.9637 -7.5147 -7.4799 -7.3381 -7.3138 -7.2026 -7.2001 -7.1693 -7.1474 -7.1114 -7.0999 -7.0796 -7.0773 -5.9751 -5.9685 -5.4693 -5.4584 -5.1328 -5.0923 -5.0211 -4.9814 0.8049 0.8088 1.1855 1.1881 2.1928 2.2012 2.3637 2.3981 2.5254 2.5525 2.6738 2.6934 2.9341 2.9522 3.0502 3.0668 3.1400 3.1964 3.2914 3.3402 3.5617 3.6020 3.6619 3.6984 3.9405 4.0063 4.2061 4.2313 4.3761 4.4021 4.6255 4.6521 4.9952 5.0137 5.3723 5.3826 5.5343 5.5886 5.7445 5.7834 5.9750 6.0095 6.5979 6.6247 9.5385 9.5391 10.1527 10.1594 10.6128 10.6439 11.4426 11.4510 11.9254 11.9326 12.0092 12.0165 12.2806 12.3394 k = 0.0592 0.5432 0.4051 ( 6587 PWs) bands (ev): -8.1729 -8.1679 -8.1279 -8.1229 -8.0517 -8.0426 -7.9775 -7.9652 -7.5116 -7.4853 -7.3340 -7.3157 -7.2025 -7.2005 -7.1664 -7.1495 -7.1107 -7.1016 -7.0790 -7.0773 -5.9796 -5.9745 -5.4675 -5.4593 -5.1201 -5.0844 -5.0227 -4.9878 0.8016 0.8045 1.1902 1.1922 2.1874 2.1938 2.3638 2.3892 2.5304 2.5514 2.6772 2.6918 2.9406 2.9562 3.0551 3.0690 3.1547 3.2059 3.2872 3.3236 3.5566 3.5909 3.6620 3.6892 3.9421 3.9942 4.2051 4.2240 4.3742 4.3959 4.6292 4.6488 4.9982 5.0125 5.4069 5.4145 5.5439 5.5894 5.7485 5.7827 5.9553 5.9828 6.5921 6.6138 9.5359 9.5363 10.1619 10.1669 10.6574 10.6834 11.4772 11.4858 11.8865 11.8943 11.9990 12.0056 12.2954 12.3470 k = 0.0395 0.5375 0.4121 ( 6589 PWs) bands (ev): -8.1722 -8.1687 -8.1276 -8.1241 -8.0498 -8.0436 -7.9754 -7.9670 -7.5081 -7.4904 -7.3302 -7.3179 -7.2023 -7.2009 -7.1634 -7.1519 -7.1096 -7.1034 -7.0785 -7.0774 -5.9825 -5.9791 -5.4659 -5.4604 -5.1083 -5.0812 -5.0214 -4.9950 0.7993 0.8013 1.1937 1.1951 2.1838 2.1881 2.3649 2.3817 2.5351 2.5495 2.6804 2.6902 2.9467 2.9581 3.0590 3.0688 3.1738 3.2138 3.2825 3.3049 3.5555 3.5806 3.6630 3.6809 3.9461 3.9822 4.2056 4.2182 4.3746 4.3901 4.6327 4.6456 5.0010 5.0108 5.4347 5.4400 5.5529 5.5866 5.7534 5.7795 5.9418 5.9609 6.5884 6.6036 9.5342 9.5346 10.1688 10.1721 10.6937 10.7125 11.5105 11.5181 11.8453 11.8528 11.9913 11.9968 12.3160 12.3618 k = 0.0197 0.5318 0.4191 ( 6585 PWs) bands (ev): -8.1714 -8.1696 -8.1270 -8.1252 -8.0480 -8.0449 -7.9732 -7.9689 -7.5042 -7.4953 -7.3266 -7.3205 -7.2020 -7.2013 -7.1604 -7.1546 -7.1082 -7.1051 -7.0781 -7.0775 -5.9840 -5.9822 -5.4644 -5.4616 -5.0977 -5.0830 -5.0169 -5.0026 0.7982 0.7992 1.1960 1.1967 2.1820 2.1842 2.3671 2.3755 2.5395 2.5468 2.6834 2.6882 2.9519 2.9580 3.0621 3.0672 3.1940 3.2169 3.2786 3.2880 3.5580 3.5714 3.6650 3.6740 3.9524 3.9709 4.2073 4.2136 4.3768 4.3848 4.6360 4.6424 5.0038 5.0087 5.4534 5.4564 5.5620 5.5802 5.7596 5.7739 5.9354 5.9451 6.5875 6.5954 9.5334 9.5336 10.1733 10.1749 10.7190 10.7289 11.5378 11.5426 11.8133 11.8180 11.9874 11.9905 12.3396 12.3778 k = 0.0000 0.5262 0.4261 ( 6578 PWs) bands (ev): -8.1705 -8.1705 -8.1262 -8.1262 -8.0463 -8.0463 -7.9710 -7.9710 -7.4999 -7.4999 -7.3234 -7.3234 -7.2017 -7.2017 -7.1574 -7.1574 -7.1067 -7.1067 -7.0778 -7.0778 -5.9839 -5.9839 -5.4630 -5.4630 -5.0890 -5.0890 -5.0101 -5.0101 0.7981 0.7981 1.1970 1.1970 2.1821 2.1821 2.3707 2.3707 2.5434 2.5434 2.6860 2.6860 2.9558 2.9558 3.0649 3.0649 3.2104 3.2104 3.2788 3.2788 3.5636 3.5636 3.6687 3.6687 3.9608 3.9608 4.2100 4.2100 4.3803 4.3803 4.6393 4.6393 5.0064 5.0064 5.4611 5.4611 5.5715 5.5715 5.7668 5.7668 5.9365 5.9365 6.5899 6.5899 9.5333 9.5333 10.1753 10.1753 10.7311 10.7311 11.5506 11.5506 11.8023 11.8023 11.9871 11.9871 12.3640 12.3640 k = 0.0000 0.5262 0.4261 ( 6578 PWs) bands (ev): -8.1705 -8.1705 -8.1262 -8.1262 -8.0463 -8.0463 -7.9710 -7.9710 -7.4999 -7.4999 -7.3234 -7.3234 -7.2017 -7.2017 -7.1574 -7.1574 -7.1067 -7.1067 -7.0778 -7.0778 -5.9839 -5.9839 -5.4630 -5.4630 -5.0890 -5.0890 -5.0101 -5.0101 0.7981 0.7981 1.1970 1.1970 2.1821 2.1821 2.3707 2.3707 2.5434 2.5434 2.6860 2.6860 2.9558 2.9558 3.0649 3.0649 3.2104 3.2104 3.2788 3.2788 3.5636 3.5636 3.6687 3.6687 3.9608 3.9608 4.2100 4.2100 4.3803 4.3803 4.6393 4.6393 5.0064 5.0064 5.4611 5.4611 5.5715 5.5715 5.7668 5.7668 5.9365 5.9365 6.5899 6.5899 9.5333 9.5333 10.1753 10.1753 10.7311 10.7311 11.5506 11.5506 11.8023 11.8023 11.9871 11.9871 12.3640 12.3640 k = 0.0089 0.5139 0.4413 ( 6578 PWs) bands (ev): -8.1711 -8.1698 -8.1275 -8.1247 -8.0471 -8.0456 -7.9718 -7.9703 -7.5026 -7.4971 -7.3275 -7.3194 -7.2018 -7.2016 -7.1576 -7.1573 -7.1084 -7.1051 -7.0778 -7.0777 -5.9836 -5.9829 -5.4630 -5.4628 -5.0899 -5.0887 -5.0110 -5.0095 0.7978 0.7985 1.1961 1.1965 2.1815 2.1826 2.3695 2.3705 2.5415 2.5447 2.6827 2.6896 2.9482 2.9616 3.0582 3.0668 3.2081 3.2127 3.2769 3.2842 3.5612 3.5651 3.6603 3.6756 3.9594 3.9636 4.2019 4.2181 4.3768 4.3853 4.6247 4.6505 4.9920 5.0275 5.4608 5.4662 5.5635 5.5792 5.7637 5.7725 5.9322 5.9457 6.5886 6.5893 9.5304 9.5308 10.1723 10.1724 10.7286 10.7346 11.5520 11.5528 11.8021 11.8091 11.9869 11.9869 12.3548 12.3635 k = 0.0179 0.5015 0.4565 ( 6586 PWs) bands (ev): -8.1718 -8.1692 -8.1288 -8.1232 -8.0479 -8.0450 -7.9727 -7.9697 -7.5052 -7.4941 -7.3318 -7.3156 -7.2020 -7.2015 -7.1578 -7.1573 -7.1102 -7.1037 -7.0779 -7.0776 -5.9821 -5.9807 -5.4628 -5.4623 -5.0916 -5.0890 -5.0122 -5.0092 0.7973 0.7987 1.1939 1.1947 2.1806 2.1830 2.3669 2.3688 2.5389 2.5453 2.6798 2.6934 2.9389 2.9651 3.0478 3.0636 3.2060 3.2147 3.2788 3.2918 3.5573 3.5659 3.6518 3.6798 3.9599 3.9671 4.1942 4.2259 4.3749 4.3914 4.6088 4.6572 4.9861 5.0534 5.4653 5.4760 5.5559 5.5860 5.7636 5.7800 5.9335 5.9589 6.5855 6.5867 9.5225 9.5231 10.1634 10.1637 10.7272 10.7391 11.5570 11.5585 11.8075 11.8223 11.9858 11.9868 12.3372 12.3535 k = 0.0268 0.4892 0.4718 ( 6584 PWs) bands (ev): -8.1724 -8.1686 -8.1301 -8.1216 -8.0488 -8.0444 -7.9737 -7.9691 -7.5077 -7.4911 -7.3362 -7.3120 -7.2022 -7.2014 -7.1580 -7.1573 -7.1120 -7.1024 -7.0779 -7.0774 -5.9794 -5.9774 -5.4623 -5.4617 -5.0939 -5.0901 -5.0136 -5.0092 0.7969 0.7990 1.1904 1.1916 2.1797 2.1831 2.3629 2.3657 2.5358 2.5454 2.6771 2.6974 2.9285 2.9661 3.0350 3.0557 3.2046 3.2164 3.2842 3.3005 3.5514 3.5663 3.6446 3.6805 3.9627 3.9700 4.1875 4.2333 4.3742 4.3972 4.5938 4.6602 4.9893 5.0821 5.4738 5.4902 5.5497 5.5915 5.7667 5.7887 5.9415 5.9755 6.5805 6.5823 9.5097 9.5106 10.1489 10.1495 10.7268 10.7443 11.5655 11.5675 11.8158 11.8404 11.9842 11.9885 12.3132 12.3359 k = 0.0357 0.4769 0.4870 ( 6586 PWs) bands (ev): -8.1729 -8.1680 -8.1313 -8.1200 -8.0498 -8.0438 -7.9747 -7.9688 -7.5100 -7.4880 -7.3408 -7.3085 -7.2024 -7.2013 -7.1583 -7.1573 -7.1141 -7.1012 -7.0779 -7.0772 -5.9755 -5.9728 -5.4618 -5.4609 -5.0969 -5.0917 -5.0154 -5.0095 0.7965 0.7992 1.1856 1.1872 2.1785 2.1829 2.3577 2.3610 2.5324 2.5450 2.6746 2.7016 2.9171 2.9642 3.0210 3.0440 3.2041 3.2177 3.2920 3.3091 3.5431 3.5664 3.6394 3.6773 3.9674 3.9713 4.1829 4.2402 4.3738 4.4012 4.5823 4.6612 5.0014 5.1124 5.4844 5.5082 5.5468 5.5955 5.7731 5.7981 5.9566 5.9952 6.5736 6.5760 9.4926 9.4937 10.1291 10.1302 10.7270 10.7499 11.5773 11.5796 11.8222 11.8587 11.9845 11.9950 12.2848 12.3145 k = 0.0446 0.4646 0.5022 ( 6584 PWs) bands (ev): -8.1735 -8.1674 -8.1325 -8.1182 -8.0507 -8.0432 -7.9757 -7.9685 -7.5122 -7.4848 -7.3454 -7.3051 -7.2026 -7.2013 -7.1586 -7.1573 -7.1162 -7.1000 -7.0778 -7.0770 -5.9704 -5.9670 -5.4611 -5.4599 -5.1005 -5.0940 -5.0174 -5.0101 0.7961 0.7994 1.1796 1.1816 2.1770 2.1823 2.3512 2.3549 2.5288 2.5441 2.6723 2.7057 2.9053 2.9593 3.0072 3.0298 3.2047 3.2188 3.3010 3.3168 3.5325 3.5662 3.6365 3.6706 3.9702 3.9734 4.1813 4.2467 4.3726 4.4018 4.5765 4.6632 5.0211 5.1435 5.4928 5.5287 5.5515 5.5984 5.7827 5.8083 5.9784 6.0176 6.5649 6.5678 9.4720 9.4730 10.1046 10.1063 10.7277 10.7556 11.5919 11.5944 11.8208 11.8679 11.9933 12.0099 12.2540 12.2933 k = 0.0536 0.4522 0.5174 ( 6574 PWs) bands (ev): -8.1739 -8.1669 -8.1336 -8.1163 -8.0518 -8.0427 -7.9768 -7.9684 -7.5142 -7.4815 -7.3501 -7.3020 -7.2028 -7.2014 -7.1590 -7.1573 -7.1183 -7.0990 -7.0777 -7.0767 -5.9641 -5.9602 -5.4603 -5.4588 -5.1046 -5.0967 -5.0196 -5.0109 0.7957 0.7996 1.1724 1.1748 2.1753 2.1812 2.3436 2.3474 2.5251 2.5430 2.6701 2.7097 2.8932 2.9513 2.9944 3.0141 3.2066 3.2195 3.3102 3.3232 3.5202 3.5655 3.6355 3.6610 3.9659 3.9794 4.1831 4.2523 4.3705 4.3985 4.5779 4.6680 5.0474 5.1750 5.4946 5.5486 5.5676 5.6028 5.7952 5.8198 6.0060 6.0425 6.5545 6.5578 9.4485 9.4493 10.0758 10.0783 10.7283 10.7610 11.6090 11.6115 11.8072 11.8585 12.0173 12.0350 12.2222 12.2745 k = 0.0625 0.4399 0.5326 ( 6566 PWs) bands (ev): -8.1743 -8.1664 -8.1347 -8.1143 -8.0528 -8.0422 -7.9778 -7.9684 -7.5160 -7.4782 -7.3548 -7.2990 -7.2030 -7.2014 -7.1593 -7.1574 -7.1206 -7.0980 -7.0775 -7.0765 -5.9566 -5.9522 -5.4596 -5.4578 -5.1092 -5.1000 -5.0221 -5.0121 0.7955 0.7999 1.1641 1.1669 2.1731 2.1795 2.3347 2.3384 2.5215 2.5417 2.6678 2.7134 2.8814 2.9406 2.9832 2.9979 3.2096 3.2198 3.3187 3.3278 3.5065 3.5639 3.6357 3.6497 3.9585 3.9846 4.1879 4.2564 4.3688 4.3922 4.5865 4.6764 5.0792 5.2069 5.4913 5.5609 5.5930 5.6152 5.8103 5.8328 6.0384 6.0695 6.5423 6.5460 9.4229 9.4234 10.0434 10.0468 10.7286 10.7658 11.6275 11.6304 11.7817 11.8307 12.0538 12.0676 12.1909 12.2511 k = 0.0714 0.4276 0.5479 ( 6570 PWs) bands (ev): -8.1746 -8.1660 -8.1358 -8.1122 -8.0540 -8.0417 -7.9789 -7.9686 -7.5178 -7.4749 -7.3597 -7.2962 -7.2033 -7.2015 -7.1597 -7.1575 -7.1229 -7.0971 -7.0774 -7.0763 -5.9480 -5.9431 -5.4590 -5.4568 -5.1143 -5.1036 -5.0249 -5.0135 0.7954 0.8003 1.1548 1.1578 2.1705 2.1772 2.3248 2.3282 2.5182 2.5403 2.6654 2.7167 2.8700 2.9284 2.9735 2.9817 3.2135 3.2195 3.3258 3.3306 3.4919 3.5608 3.6364 3.6380 3.9487 3.9880 4.1939 4.2574 4.3703 4.3854 4.6010 4.6876 5.1161 5.2393 5.4856 5.5618 5.6242 5.6391 5.8277 5.8476 6.0743 6.0984 6.5285 6.5325 9.3960 9.3961 10.0078 10.0123 10.7282 10.7696 11.6446 11.6502 11.7487 11.7902 12.0954 12.0995 12.1642 12.2228 k = 0.0804 0.4153 0.5631 ( 6570 PWs) bands (ev): -8.1749 -8.1657 -8.1369 -8.1101 -8.0552 -8.0413 -7.9800 -7.9689 -7.5193 -7.4715 -7.3646 -7.2935 -7.2036 -7.2017 -7.1602 -7.1576 -7.1252 -7.0963 -7.0772 -7.0761 -5.9384 -5.9331 -5.4586 -5.4560 -5.1197 -5.1076 -5.0279 -5.0152 0.7954 0.8008 1.1445 1.1478 2.1674 2.1741 2.3139 2.3168 2.5153 2.5390 2.6630 2.7195 2.8593 2.9157 2.9651 2.9662 3.2179 3.2186 3.3312 3.3316 3.4768 3.5554 3.6276 3.6372 3.9373 3.9893 4.1984 4.2542 4.3780 4.3817 4.6197 4.7005 5.1576 5.2727 5.4793 5.5560 5.6587 5.6696 5.8471 5.8642 6.1127 6.1287 6.5132 6.5174 9.3680 9.3685 9.9697 9.9752 10.7267 10.7722 11.6483 11.6676 11.7224 11.7441 12.1071 12.1353 12.1609 12.1956 k = 0.0893 0.4030 0.5783 ( 6570 PWs) bands (ev): -8.1751 -8.1654 -8.1381 -8.1079 -8.0564 -8.0408 -7.9810 -7.9694 -7.5207 -7.4681 -7.3694 -7.2911 -7.2038 -7.2019 -7.1607 -7.1578 -7.1276 -7.0955 -7.0771 -7.0758 -5.9277 -5.9220 -5.4586 -5.4555 -5.1252 -5.1118 -5.0311 -5.0172 0.7957 0.8015 1.1333 1.1370 2.1637 2.1702 2.3022 2.3044 2.5129 2.5376 2.6604 2.7216 2.8497 2.9035 2.9517 2.9577 3.2168 3.2222 3.3308 3.3344 3.4616 3.5469 3.6198 3.6375 3.9255 3.9883 4.1984 4.2467 4.3848 4.3928 4.6409 4.7139 5.2032 5.3071 5.4735 5.5469 5.6951 5.7031 5.8683 5.8826 6.1525 6.1599 6.4966 6.5010 9.3400 9.3411 9.9296 9.9361 10.7239 10.7731 11.6167 11.6587 11.7191 11.7267 12.0871 12.1663 12.1736 12.1806 k = 0.0982 0.3906 0.5935 ( 6576 PWs) bands (ev): -8.1751 -8.1651 -8.1392 -8.1056 -8.0577 -8.0404 -7.9820 -7.9701 -7.5219 -7.4648 -7.3743 -7.2888 -7.2041 -7.2021 -7.1612 -7.1579 -7.1299 -7.0948 -7.0769 -7.0757 -5.9160 -5.9100 -5.4589 -5.4554 -5.1309 -5.1160 -5.0347 -5.0195 0.7963 0.8025 1.1214 1.1252 2.1594 2.1655 2.2897 2.2912 2.5111 2.5364 2.6578 2.7230 2.8412 2.8926 2.9384 2.9514 3.2139 3.2258 3.3285 3.3350 3.4467 3.5356 3.6151 3.6371 3.9142 3.9854 4.1923 4.2362 4.3964 4.4141 4.6629 4.7270 5.2524 5.3419 5.4691 5.5362 5.7321 5.7378 5.8909 5.9025 6.1914 6.1928 6.4791 6.4835 9.3126 9.3145 9.8878 9.8953 10.7196 10.7722 11.5646 11.6064 11.7342 11.7485 12.0648 12.1514 12.1940 12.1988 k = 0.1071 0.3783 0.6087 ( 6582 PWs) bands (ev): -8.1751 -8.1649 -8.1404 -8.1033 -8.0590 -8.0399 -7.9830 -7.9710 -7.5229 -7.4615 -7.3792 -7.2868 -7.2043 -7.2024 -7.1617 -7.1581 -7.1323 -7.0942 -7.0767 -7.0755 -5.9033 -5.8971 -5.4599 -5.4560 -5.1364 -5.1203 -5.0385 -5.0220 0.7972 0.8037 1.1087 1.1128 2.1545 2.1600 2.2766 2.2773 2.5099 2.5353 2.6550 2.7235 2.8340 2.8835 2.9268 2.9463 3.2097 3.2280 3.3245 3.3328 3.4329 3.5230 3.6131 3.6358 3.9039 3.9810 4.1806 4.2244 4.4162 4.4404 4.6847 4.7392 5.3043 5.3750 5.4688 5.5248 5.7690 5.7726 5.9147 5.9236 6.2225 6.2327 6.4610 6.4653 9.2865 9.2891 9.8448 9.8533 10.7137 10.7694 11.5057 11.5435 11.7583 11.7755 12.0462 12.1369 12.2136 12.2138 k = 0.1161 0.3660 0.6239 ( 6580 PWs) bands (ev): -8.1750 -8.1647 -8.1416 -8.1009 -8.0603 -8.0394 -7.9839 -7.9719 -7.5238 -7.4582 -7.3840 -7.2849 -7.2046 -7.2027 -7.1623 -7.1582 -7.1346 -7.0935 -7.0765 -7.0754 -5.8898 -5.8834 -5.4615 -5.4572 -5.1417 -5.1243 -5.0425 -5.0248 0.7986 0.8052 1.0955 1.0998 2.1491 2.1539 2.2629 2.2630 2.5094 2.5344 2.6522 2.7230 2.8282 2.8765 2.9168 2.9424 3.2040 3.2278 3.3187 3.3273 3.4212 3.5109 3.6128 3.6337 3.8952 3.9757 4.1651 4.2121 4.4421 4.4703 4.7055 4.7502 5.3581 5.4010 5.4781 5.5135 5.8049 5.8069 5.9395 5.9456 6.2523 6.2712 6.4431 6.4470 9.2621 9.2655 9.8011 9.8104 10.7061 10.7645 11.4440 11.4777 11.7847 11.8044 12.0332 12.1280 12.2265 12.2310 k = 0.1250 0.3537 0.6392 ( 6578 PWs) bands (ev): -8.1748 -8.1646 -8.1428 -8.0986 -8.0615 -8.0389 -7.9848 -7.9730 -7.5245 -7.4549 -7.3887 -7.2831 -7.2048 -7.2030 -7.1628 -7.1584 -7.1367 -7.0929 -7.0764 -7.0752 -5.8754 -5.8689 -5.4641 -5.4594 -5.1465 -5.1281 -5.0468 -5.0278 0.8003 0.8072 1.0818 1.0863 2.1433 2.1472 2.2483 2.2491 2.5095 2.5338 2.6493 2.7217 2.8237 2.8719 2.9087 2.9397 3.1966 3.2247 3.3105 3.3182 3.4128 3.5006 3.6135 3.6308 3.8883 3.9698 4.1476 4.2000 4.4720 4.5026 4.7249 4.7602 5.4119 5.4137 5.5030 5.5037 5.8393 5.8400 5.9647 5.9684 6.2793 6.3068 6.4268 6.4299 9.2399 9.2439 9.7571 9.7670 10.6971 10.7576 11.3811 11.4109 11.8126 11.8340 12.0270 12.1249 12.2385 12.2470 k = 0.1339 0.3413 0.6544 ( 6580 PWs) bands (ev): -8.1745 -8.1645 -8.1440 -8.0962 -8.0628 -8.0383 -7.9856 -7.9743 -7.5251 -7.4518 -7.3933 -7.2816 -7.2051 -7.2033 -7.1634 -7.1585 -7.1388 -7.0924 -7.0762 -7.0751 -5.8602 -5.8536 -5.4676 -5.4626 -5.1507 -5.1314 -5.0513 -5.0311 0.8025 0.8095 1.0677 1.0723 2.1371 2.1400 2.2336 2.2350 2.5102 2.5333 2.6464 2.7197 2.8207 2.8696 2.9026 2.9385 3.1877 3.2183 3.2993 3.3052 3.4088 3.4934 3.6147 3.6272 3.8833 3.9638 4.1293 4.1885 4.5045 4.5364 4.7424 4.7691 5.4174 5.4590 5.5015 5.5391 5.8714 5.8718 5.9900 5.9916 6.3013 6.3367 6.4142 6.4166 9.2201 9.2249 9.7130 9.7235 10.6869 10.7491 11.3182 11.3441 11.8416 11.8632 12.0286 12.1278 12.2501 12.2621 k = 0.1429 0.3290 0.6696 ( 6588 PWs) bands (ev): -8.1741 -8.1644 -8.1453 -8.0940 -8.0641 -8.0377 -7.9864 -7.9757 -7.5255 -7.4488 -7.3977 -7.2803 -7.2053 -7.2037 -7.1640 -7.1587 -7.1408 -7.0918 -7.0760 -7.0750 -5.8443 -5.8378 -5.4722 -5.4671 -5.1542 -5.1342 -5.0561 -5.0346 0.8053 0.8124 1.0532 1.0581 2.1306 2.1327 2.2190 2.2209 2.5114 2.5330 2.6434 2.7170 2.8191 2.8695 2.8984 2.9385 3.1771 3.2088 3.2850 3.2887 3.4094 3.4895 3.6160 3.6231 3.8800 3.9578 4.1108 4.1778 4.5381 4.5709 4.7582 4.7771 5.4184 5.4718 5.5335 5.5792 5.9008 5.9022 6.0149 6.0149 6.3149 6.3535 6.4089 6.4148 9.2032 9.2085 9.6692 9.6800 10.6760 10.7392 11.2561 11.2782 11.8718 11.8913 12.0387 12.1365 12.2610 12.2763 k = 0.1518 0.3167 0.6848 ( 6592 PWs) bands (ev): -8.1736 -8.1644 -8.1466 -8.0917 -8.0653 -8.0370 -7.9871 -7.9772 -7.5258 -7.4458 -7.4020 -7.2791 -7.2055 -7.2041 -7.1646 -7.1588 -7.1427 -7.0913 -7.0759 -7.0750 -5.8278 -5.8213 -5.4780 -5.4728 -5.1569 -5.1363 -5.0612 -5.0383 0.8086 0.8157 1.0386 1.0436 2.1241 2.1253 2.2047 2.2070 2.5131 2.5329 2.6404 2.7139 2.8188 2.8717 2.8962 2.9398 3.1652 3.1965 3.2681 3.2693 3.4139 3.4889 3.6172 3.6186 3.8784 3.9522 4.0927 4.1679 4.5718 4.6051 4.7721 4.7844 5.4196 5.4676 5.5814 5.6195 5.9283 5.9302 6.0380 6.0387 6.3183 6.3525 6.4133 6.4294 9.1894 9.1951 9.6260 9.6370 10.6647 10.7284 11.1953 11.2135 11.9032 11.9174 12.0576 12.1505 12.2712 12.2897 k = 0.1607 0.3044 0.7000 ( 6592 PWs) bands (ev): -8.1730 -8.1644 -8.1479 -8.0896 -8.0664 -8.0363 -7.9878 -7.9787 -7.5260 -7.4430 -7.4060 -7.2781 -7.2057 -7.2045 -7.1652 -7.1590 -7.1444 -7.0908 -7.0757 -7.0749 -5.8106 -5.8043 -5.4850 -5.4800 -5.1585 -5.1378 -5.0665 -5.0422 0.8125 0.8196 1.0239 1.0290 2.1177 2.1181 2.1908 2.1933 2.5152 2.5330 2.6373 2.7105 2.8198 2.8759 2.8960 2.9425 3.1521 3.1821 3.2478 3.2492 3.4215 3.4909 3.6138 3.6181 3.8784 3.9469 4.0752 4.1588 4.6047 4.6383 4.7843 4.7911 5.4225 5.4633 5.6268 5.6574 5.9543 5.9562 6.0606 6.0609 6.3153 6.3445 6.4242 6.4499 9.1788 9.1847 9.5838 9.5947 10.6539 10.7174 11.1364 11.1506 11.9358 11.9419 12.0849 12.1696 12.2803 12.3018 k = 0.1696 0.2920 0.7153 ( 6594 PWs) bands (ev): -8.1723 -8.1644 -8.1492 -8.0876 -8.0674 -8.0355 -7.9884 -7.9804 -7.5260 -7.4404 -7.4098 -7.2772 -7.2059 -7.2049 -7.1658 -7.1591 -7.1459 -7.0904 -7.0756 -7.0749 -5.7930 -5.7869 -5.4934 -5.4886 -5.1591 -5.1386 -5.0720 -5.0462 0.8170 0.8241 1.0092 1.0144 2.1113 2.1115 2.1775 2.1801 2.5176 2.5332 2.6342 2.7072 2.8220 2.8819 2.8978 2.9464 3.1382 3.1661 3.2250 3.2290 3.4311 3.4951 3.6086 3.6186 3.8796 3.9421 4.0584 4.1507 4.6359 4.6699 4.7948 4.7974 5.4278 5.4612 5.6653 5.6903 5.9796 5.9803 6.0814 6.0825 6.3111 6.3369 6.4367 6.4693 9.1715 9.1775 9.5427 9.5534 10.6440 10.7067 11.0799 11.0900 11.9653 11.9693 12.1191 12.1932 12.2880 12.3125 k = 0.1786 0.2797 0.7305 ( 6588 PWs) bands (ev): -8.1715 -8.1644 -8.1505 -8.0857 -8.0684 -8.0346 -7.9889 -7.9820 -7.5260 -7.4380 -7.4134 -7.2765 -7.2061 -7.2053 -7.1663 -7.1592 -7.1472 -7.0900 -7.0754 -7.0749 -5.7750 -5.7691 -5.5030 -5.4986 -5.1587 -5.1386 -5.0777 -5.0503 0.8223 0.8293 0.9945 1.0000 2.1050 2.1058 2.1650 2.1675 2.5202 2.5336 2.6311 2.7039 2.8252 2.8896 2.9016 2.9516 3.1238 3.1490 3.2016 3.2082 3.4421 3.5008 3.6031 3.6186 3.8821 3.9379 4.0425 4.1434 4.6647 4.6991 4.8036 4.8040 5.4362 5.4621 5.6943 5.7159 6.0032 6.0056 6.1001 6.1034 6.3093 6.3320 6.4479 6.4851 9.1676 9.1736 9.5029 9.5132 10.6357 10.6972 11.0260 11.0319 11.9886 12.0035 12.1585 12.2204 12.2943 12.3219 k = 0.1875 0.2674 0.7457 ( 6582 PWs) bands (ev): -8.1706 -8.1644 -8.1519 -8.0840 -8.0693 -8.0337 -7.9893 -7.9836 -7.5259 -7.4357 -7.4166 -7.2759 -7.2062 -7.2056 -7.1668 -7.1593 -7.1484 -7.0896 -7.0753 -7.0749 -5.7566 -5.7511 -5.5138 -5.5099 -5.1573 -5.1380 -5.0836 -5.0545 0.8282 0.8351 0.9800 0.9856 2.0995 2.1006 2.1533 2.1557 2.5229 2.5340 2.6280 2.7009 2.8292 2.8987 2.9072 2.9580 3.1090 3.1312 3.1782 3.1871 3.4540 3.5076 3.5972 3.6180 3.8857 3.9341 4.0274 4.1371 4.6903 4.7254 4.8096 4.8119 5.4479 5.4665 5.7119 5.7320 6.0257 6.0334 6.1172 6.1230 6.3112 6.3308 6.4561 6.4967 9.1672 9.1729 9.4648 9.4744 10.6297 10.6893 10.9752 10.9768 12.0122 12.0381 12.2013 12.2501 12.2995 12.3305 k = 0.1964 0.2551 0.7609 ( 6578 PWs) bands (ev): -8.1697 -8.1644 -8.1532 -8.0824 -8.0701 -8.0328 -7.9897 -7.9852 -7.5257 -7.4337 -7.4195 -7.2755 -7.2064 -7.2059 -7.1673 -7.1594 -7.1494 -7.0893 -7.0752 -7.0749 -5.7380 -5.7329 -5.5258 -5.5225 -5.1550 -5.1369 -5.0896 -5.0587 0.8348 0.8415 0.9658 0.9716 2.0948 2.0962 2.1426 2.1447 2.5257 2.5344 2.6250 2.6982 2.8339 2.9092 2.9145 2.9654 3.0942 3.1130 3.1554 3.1662 3.4664 3.5150 3.5909 3.6169 3.8901 3.9309 4.0131 4.1316 4.7122 4.7483 4.8156 4.8187 5.4631 5.4748 5.7177 5.7375 6.0481 6.0627 6.1331 6.1410 6.3170 6.3333 6.4608 6.5037 9.1702 9.1754 9.4284 9.4372 10.6264 10.6838 10.9250 10.9278 12.0360 12.0725 12.2442 12.2784 12.3056 12.3413 k = 0.2054 0.2427 0.7761 ( 6582 PWs) bands (ev): -8.1687 -8.1645 -8.1546 -8.0811 -8.0708 -8.0319 -7.9900 -7.9867 -7.5256 -7.4320 -7.4220 -7.2751 -7.2065 -7.2062 -7.1678 -7.1595 -7.1502 -7.0890 -7.0751 -7.0749 -5.7194 -5.7147 -5.5388 -5.5362 -5.1519 -5.1354 -5.0958 -5.0626 0.8421 0.8486 0.9519 0.9579 2.0911 2.0925 2.1331 2.1349 2.5284 2.5348 2.6221 2.6958 2.8388 2.9207 2.9235 2.9740 3.0795 3.0947 3.1340 3.1459 3.4789 3.5225 3.5840 3.6152 3.8954 3.9281 3.9998 4.1270 4.7301 4.7676 4.8215 4.8245 5.4819 5.4869 5.7131 5.7329 6.0699 6.0923 6.1477 6.1568 6.3261 6.3393 6.4615 6.5060 9.1766 9.1811 9.3940 9.4017 10.6265 10.6812 10.8769 10.8841 12.0596 12.1063 12.2748 12.2972 12.3246 12.3620 k = 0.2143 0.2304 0.7913 ( 6584 PWs) bands (ev): -8.1677 -8.1645 -8.1559 -8.0800 -8.0714 -8.0311 -7.9903 -7.9881 -7.5254 -7.4306 -7.4241 -7.2749 -7.2066 -7.2064 -7.1681 -7.1595 -7.1509 -7.0888 -7.0751 -7.0749 -5.7008 -5.6966 -5.5527 -5.5507 -5.1480 -5.1336 -5.1021 -5.0664 0.8501 0.8564 0.9384 0.9446 2.0883 2.0897 2.1249 2.1262 2.5308 2.5351 2.6195 2.6938 2.8437 2.9332 2.9340 2.9834 3.0650 3.0766 3.1146 3.1264 3.4914 3.5298 3.5766 3.6132 3.9013 3.9259 3.9873 4.1232 4.7440 4.7829 4.8271 4.8294 5.5028 5.5041 5.7002 5.7195 6.0900 6.1201 6.1609 6.1701 6.3381 6.3485 6.4585 6.5040 9.1863 9.1899 9.3616 9.3682 10.6303 10.6820 10.8328 10.8443 12.0822 12.1386 12.2818 12.3020 12.3670 12.3962 k = 0.2232 0.2181 0.8066 ( 6588 PWs) bands (ev): -8.1667 -8.1645 -8.1572 -8.0792 -8.0718 -8.0304 -7.9905 -7.9892 -7.5252 -7.4295 -7.4258 -7.2747 -7.2067 -7.2066 -7.1685 -7.1596 -7.1515 -7.0886 -7.0750 -7.0749 -5.6825 -5.6788 -5.5672 -5.5659 -5.1434 -5.1318 -5.1084 -5.0696 0.8588 0.8648 0.9253 0.9319 2.0865 2.0877 2.1180 2.1189 2.5329 2.5354 2.6172 2.6923 2.8481 2.9457 2.9463 2.9934 3.0505 3.0592 3.0984 3.1084 3.5035 3.5365 3.5686 3.6109 3.9076 3.9241 3.9760 4.1203 4.7542 4.7945 4.8320 4.8334 5.5219 5.5291 5.6815 5.6994 6.1069 6.1442 6.1722 6.1803 6.3520 6.3600 6.4519 6.4984 9.1991 9.2017 9.3314 9.3368 10.6379 10.6866 10.7931 10.8087 12.1029 12.1690 12.2796 12.2979 12.4184 12.4382 k = 0.2321 0.2058 0.8218 ( 6584 PWs) bands (ev): -8.1657 -8.1645 -8.1583 -8.0785 -8.0721 -8.0298 -7.9907 -7.9901 -7.5251 -7.4286 -7.4270 -7.2746 -7.2067 -7.2067 -7.1687 -7.1596 -7.1518 -7.0884 -7.0750 -7.0750 -5.6651 -5.6619 -5.5818 -5.5812 -5.1384 -5.1303 -5.1146 -5.0722 0.8683 0.8736 0.9127 0.9199 2.0855 2.0865 2.1129 2.1133 2.5345 2.5357 2.6155 2.6912 2.8517 2.9578 2.9593 3.0035 3.0365 3.0429 3.0862 3.0927 3.5150 3.5418 3.5602 3.6087 3.9140 3.9228 3.9660 4.1182 4.7610 4.8023 4.8359 4.8365 5.5433 5.5565 5.6596 5.6747 6.1195 6.1632 6.1809 6.1867 6.3669 6.3725 6.4425 6.4907 9.2150 9.2165 9.3035 9.3076 10.6492 10.6951 10.7585 10.7777 12.1201 12.1965 12.2751 12.2886 12.4713 12.4829 k = 0.2411 0.1935 0.8370 ( 6580 PWs) bands (ev): -8.1649 -8.1645 -8.1592 -8.0782 -8.0723 -8.0294 -7.9907 -7.9906 -7.5250 -7.4281 -7.4277 -7.2746 -7.2068 -7.2068 -7.1688 -7.1596 -7.1520 -7.0883 -7.0750 -7.0750 -5.6502 -5.6473 -5.5950 -5.5949 -5.1331 -5.1292 -5.1206 -5.0738 0.8784 0.8825 0.9007 0.9091 2.0852 2.0859 2.1096 2.1097 2.5355 2.5358 2.6145 2.6905 2.8540 2.9688 2.9705 3.0125 3.0243 3.0291 3.0788 3.0809 3.5254 3.5454 3.5517 3.6071 3.9195 3.9221 3.9585 4.1169 4.7650 4.8069 4.8384 4.8385 5.5643 5.5849 5.6378 5.6474 6.1272 6.1765 6.1864 6.1890 6.3805 6.3829 6.4323 6.4834 9.2336 9.2339 9.2782 9.2811 10.6628 10.7074 10.7308 10.7518 12.1318 12.2192 12.2709 12.2766 12.5204 12.5247 k = 0.2500 0.1811 0.8522 ( 6584 PWs) bands (ev): -8.1646 -8.1646 -8.1595 -8.0781 -8.0724 -8.0293 -7.9908 -7.9908 -7.5250 -7.4280 -7.4280 -7.2746 -7.2068 -7.2068 -7.1688 -7.1596 -7.1521 -7.0883 -7.0750 -7.0750 -5.6430 -5.6403 -5.6016 -5.6016 -5.1288 -5.1288 -5.1252 -5.0744 0.8880 0.8880 0.8905 0.9030 2.0851 2.0858 2.1085 2.1085 2.5359 2.5359 2.6141 2.6903 2.8548 2.9739 2.9756 3.0187 3.0187 3.0206 3.0762 3.0762 3.5311 3.5467 3.5467 3.6065 3.9218 3.9218 3.9555 4.1165 4.7662 4.8084 4.8392 4.8392 5.5758 5.6067 5.6260 5.6260 6.1298 6.1824 6.1882 6.1882 6.3871 6.3871 6.4269 6.4802 9.2503 9.2503 9.2593 9.2618 10.6711 10.7178 10.7178 10.7368 12.1360 12.2303 12.2691 12.2691 12.5461 12.5461 k = 0.2500 0.1811 0.8522 ( 6584 PWs) bands (ev): -8.1646 -8.1646 -8.1595 -8.0781 -8.0724 -8.0293 -7.9908 -7.9908 -7.5250 -7.4280 -7.4280 -7.2746 -7.2068 -7.2068 -7.1688 -7.1596 -7.1521 -7.0883 -7.0750 -7.0750 -5.6430 -5.6403 -5.6016 -5.6016 -5.1288 -5.1288 -5.1252 -5.0744 0.8880 0.8880 0.8905 0.9030 2.0851 2.0858 2.1085 2.1085 2.5359 2.5359 2.6141 2.6903 2.8548 2.9739 2.9756 3.0187 3.0187 3.0206 3.0762 3.0762 3.5311 3.5467 3.5467 3.6065 3.9218 3.9218 3.9555 4.1165 4.7662 4.8084 4.8392 4.8392 5.5758 5.6067 5.6260 5.6260 6.1298 6.1824 6.1882 6.1882 6.3871 6.3871 6.4269 6.4802 9.2503 9.2503 9.2593 9.2618 10.6711 10.7178 10.7178 10.7368 12.1360 12.2303 12.2691 12.2691 12.5461 12.5461 k = 0.2639 0.1912 0.8398 ( 6584 PWs) bands (ev): -8.1658 -8.1634 -8.1594 -8.0780 -8.0728 -8.0290 -7.9929 -7.9887 -7.5249 -7.4339 -7.4219 -7.2747 -7.2073 -7.2062 -7.1689 -7.1608 -7.1509 -7.0883 -7.0758 -7.0742 -5.6453 -5.6425 -5.5998 -5.5991 -5.1302 -5.1298 -5.1227 -5.0743 0.8830 0.8856 0.8955 0.9051 2.0852 2.0860 2.1078 2.1105 2.5345 2.5377 2.6141 2.6902 2.8551 2.9695 2.9778 3.0128 3.0232 3.0250 3.0745 3.0813 3.5289 3.5359 3.5563 3.6055 3.9070 3.9364 3.9574 4.1169 4.7648 4.8064 4.8347 4.8407 5.5711 5.5961 5.6289 5.6392 6.1295 6.1774 6.1844 6.1956 6.3803 6.3927 6.4296 6.4816 9.2380 9.2397 9.2676 9.2690 10.6714 10.7159 10.7253 10.7447 12.1340 12.2239 12.2643 12.2761 12.5305 12.5478 k = 0.2778 0.2013 0.8274 ( 6584 PWs) bands (ev): -8.1669 -8.1626 -8.1589 -8.0777 -8.0739 -8.0280 -7.9951 -7.9868 -7.5248 -7.4397 -7.4157 -7.2751 -7.2077 -7.2055 -7.1691 -7.1634 -7.1483 -7.0881 -7.0768 -7.0735 -5.6506 -5.6476 -5.5955 -5.5941 -5.1321 -5.1316 -5.1189 -5.0740 0.8774 0.8813 0.9011 0.9090 2.0852 2.0861 2.1088 2.1142 2.5337 2.5399 2.6143 2.6898 2.8559 2.9622 2.9809 3.0072 3.0268 3.0348 3.0753 3.0891 3.5229 3.5244 3.5639 3.6023 3.8936 3.9463 3.9660 4.1181 4.7607 4.8002 4.8281 4.8393 5.5592 5.5783 5.6404 5.6595 6.1288 6.1668 6.1852 6.2015 6.3747 6.3973 6.4357 6.4850 9.2168 9.2202 9.2775 9.2778 10.6760 10.7189 10.7430 10.7614 12.1273 12.2061 12.2642 12.2811 12.5082 12.5378 k = 0.2917 0.2113 0.8149 ( 6582 PWs) bands (ev): -8.1679 -8.1624 -8.1577 -8.0772 -8.0755 -8.0268 -7.9973 -7.9849 -7.5245 -7.4454 -7.4093 -7.2758 -7.2081 -7.2048 -7.1695 -7.1662 -7.1453 -7.0878 -7.0778 -7.0729 -5.6567 -5.6533 -5.5906 -5.5883 -5.1343 -5.1331 -5.1151 -5.0738 0.8723 0.8766 0.9060 0.9131 2.0848 2.0857 2.1121 2.1198 2.5333 2.5426 2.6146 2.6894 2.8573 2.9552 2.9846 3.0033 3.0310 3.0456 3.0782 3.0985 3.5082 3.5184 3.5684 3.5970 3.8819 3.9512 3.9809 4.1200 4.7540 4.7894 4.8203 4.8353 5.5446 5.5590 5.6548 5.6804 6.1276 6.1552 6.1868 6.2056 6.3724 6.4028 6.4430 6.4890 9.1909 9.1958 9.2845 9.2853 10.6882 10.7303 10.7675 10.7834 12.1159 12.1823 12.2624 12.2831 12.4866 12.5271 k = 0.3056 0.2214 0.8025 ( 6584 PWs) bands (ev): -8.1688 -8.1627 -8.1560 -8.0776 -8.0766 -8.0253 -7.9994 -7.9832 -7.5240 -7.4509 -7.4030 -7.2769 -7.2083 -7.2040 -7.1700 -7.1691 -7.1422 -7.0874 -7.0790 -7.0725 -5.6627 -5.6587 -5.5862 -5.5829 -5.1363 -5.1345 -5.1116 -5.0737 0.8678 0.8723 0.9103 0.9167 2.0843 2.0849 2.1173 2.1271 2.5333 2.5457 2.6150 2.6888 2.8594 2.9493 2.9889 3.0013 3.0360 3.0562 3.0835 3.1090 3.4923 3.5110 3.5694 3.5895 3.8725 3.9551 3.9975 4.1226 4.7450 4.7751 4.8112 4.8289 5.5300 5.5397 5.6686 5.6997 6.1258 6.1433 6.1892 6.2078 6.3744 6.4097 6.4503 6.4928 9.1616 9.1678 9.2888 9.2907 10.7084 10.7500 10.7973 10.8100 12.1002 12.1555 12.2546 12.2791 12.4716 12.5222 k = 0.3194 0.2314 0.7901 ( 6586 PWs) bands (ev): -8.1697 -8.1631 -8.1540 -8.0799 -8.0758 -8.0241 -8.0011 -7.9817 -7.5234 -7.4562 -7.3966 -7.2784 -7.2084 -7.2033 -7.1719 -7.1706 -7.1390 -7.0869 -7.0802 -7.0721 -5.6681 -5.6634 -5.5826 -5.5782 -5.1381 -5.1359 -5.1083 -5.0738 0.8640 0.8685 0.9140 0.9199 2.0839 2.0841 2.1240 2.1355 2.5338 2.5494 2.6155 2.6881 2.8624 2.9448 2.9935 3.0010 3.0420 3.0658 3.0916 3.1205 3.4753 3.5023 3.5668 3.5802 3.8657 3.9593 4.0142 4.1257 4.7342 4.7584 4.8004 4.8201 5.5169 5.5213 5.6797 5.7160 6.1234 6.1319 6.1920 6.2084 6.3809 6.4171 6.4576 6.4959 9.1307 9.1376 9.2905 9.2937 10.7361 10.7774 10.8316 10.8407 12.0812 12.1271 12.2393 12.2657 12.4670 12.5255 k = 0.3333 0.2415 0.7777 ( 6580 PWs) bands (ev): -8.1704 -8.1637 -8.1517 -8.0824 -8.0749 -8.0235 -8.0022 -7.9803 -7.5225 -7.4612 -7.3902 -7.2802 -7.2085 -7.2024 -7.1746 -7.1713 -7.1359 -7.0863 -7.0814 -7.0719 -5.6727 -5.6671 -5.5799 -5.5743 -5.1396 -5.1372 -5.1056 -5.0742 0.8610 0.8654 0.9171 0.9225 2.0839 2.0840 2.1315 2.1446 2.5348 2.5535 2.6160 2.6872 2.8662 2.9417 2.9984 3.0023 3.0493 3.0747 3.1021 3.1326 3.4576 3.4923 3.5608 3.5693 3.8617 3.9637 4.0304 4.1295 4.7219 4.7405 4.7875 4.8090 5.5045 5.5061 5.6866 5.7280 6.1202 6.1217 6.1953 6.2080 6.3910 6.4237 6.4656 6.4983 9.0997 9.1068 9.2898 9.2943 10.7705 10.8113 10.8697 10.8751 12.0595 12.0976 12.2165 12.2426 12.4734 12.5367 k = 0.3472 0.2516 0.7652 ( 6579 PWs) bands (ev): -8.1711 -8.1643 -8.1493 -8.0851 -8.0738 -8.0237 -8.0025 -7.9791 -7.5215 -7.4660 -7.3840 -7.2823 -7.2084 -7.2016 -7.1771 -7.1722 -7.1327 -7.0858 -7.0827 -7.0718 -5.6764 -5.6698 -5.5783 -5.5714 -5.1409 -5.1383 -5.1033 -5.0751 0.8588 0.8631 0.9196 0.9246 2.0846 2.0848 2.1392 2.1538 2.5364 2.5583 2.6167 2.6860 2.8709 2.9400 3.0032 3.0047 3.0579 3.0835 3.1143 3.1452 3.4393 3.4811 3.5518 3.5572 3.8606 3.9682 4.0459 4.1337 4.7087 4.7220 4.7727 4.7957 5.4897 5.4979 5.6888 5.7351 6.1133 6.1163 6.1987 6.2073 6.4029 6.4281 6.4746 6.5003 9.0705 9.0774 9.2870 9.2927 10.8102 10.8506 10.9108 10.9126 12.0359 12.0674 12.1875 12.2115 12.4881 12.5544 k = 0.3611 0.2616 0.7528 ( 6586 PWs) bands (ev): -8.1717 -8.1650 -8.1467 -8.0878 -8.0727 -8.0250 -8.0019 -7.9781 -7.5202 -7.4705 -7.3779 -7.2849 -7.2082 -7.2009 -7.1793 -7.1731 -7.1296 -7.0855 -7.0837 -7.0718 -5.6791 -5.6714 -5.5776 -5.5695 -5.1420 -5.1394 -5.1016 -5.0765 0.8577 0.8618 0.9215 0.9260 2.0864 2.0866 2.1468 2.1627 2.5388 2.5636 2.6174 2.6845 2.8765 2.9395 3.0078 3.0079 3.0681 3.0927 3.1273 3.1581 3.4209 3.4689 3.5403 3.5441 3.8622 3.9726 4.0606 4.1382 4.6948 4.7035 4.7564 4.7803 5.4771 5.4925 5.6860 5.7369 6.1069 6.1121 6.2020 6.2068 6.4142 6.4296 6.4844 6.5022 9.0448 9.0509 9.2822 9.2891 10.8542 10.8939 10.9527 10.9544 12.0107 12.0365 12.1537 12.1748 12.5079 12.5765 k = 0.3750 0.2717 0.7404 ( 6591 PWs) bands (ev): -8.1721 -8.1657 -8.1439 -8.0905 -8.0715 -8.0271 -8.0005 -7.9773 -7.5188 -7.4746 -7.3719 -7.2879 -7.2079 -7.2002 -7.1813 -7.1741 -7.1265 -7.0862 -7.0836 -7.0719 -5.6807 -5.6719 -5.5781 -5.5687 -5.1429 -5.1402 -5.1005 -5.0783 0.8576 0.8614 0.9228 0.9270 2.0895 2.0896 2.1539 2.1707 2.5421 2.5695 2.6181 2.6826 2.8830 2.9402 3.0116 3.0123 3.0798 3.1025 3.1407 3.1711 3.4026 3.4556 3.5273 3.5305 3.8662 3.9765 4.0746 4.1431 4.6807 4.6852 4.7392 4.7633 5.4669 5.4899 5.6781 5.7334 6.1027 6.1082 6.2050 6.2067 6.4227 6.4283 6.4936 6.5047 9.0242 9.0290 9.2756 9.2836 10.9012 10.9401 10.9947 10.9998 11.9840 12.0048 12.1159 12.1339 12.5304 12.6013 k = 0.3889 0.2818 0.7280 ( 6589 PWs) bands (ev): -8.1725 -8.1664 -8.1409 -8.0931 -8.0702 -8.0299 -7.9985 -7.9768 -7.5171 -7.4785 -7.3661 -7.2912 -7.2075 -7.1998 -7.1828 -7.1751 -7.1235 -7.0876 -7.0829 -7.0721 -5.6812 -5.6711 -5.5797 -5.5690 -5.1436 -5.1409 -5.0999 -5.0807 0.8586 0.8621 0.9237 0.9274 2.0937 2.0939 2.1601 2.1776 2.5464 2.5761 2.6190 2.6805 2.8904 2.9418 3.0156 3.0165 3.0927 3.1128 3.1542 3.1840 3.3849 3.4416 3.5138 3.5169 3.8723 3.9799 4.0877 4.1480 4.6664 4.6674 4.7216 4.7450 5.4589 5.4897 5.6655 5.7249 6.1010 6.1049 6.2070 6.2076 6.4248 6.4265 6.5007 6.5078 9.0100 9.0131 9.2676 9.2766 10.9500 10.9878 11.0379 11.0460 11.9557 11.9721 12.0748 12.0896 12.5533 12.6270 k = 0.4028 0.2918 0.7155 ( 6583 PWs) bands (ev): -8.1727 -8.1672 -8.1377 -8.0957 -8.0689 -8.0331 -7.9963 -7.9765 -7.5152 -7.4819 -7.3605 -7.2949 -7.2070 -7.1995 -7.1839 -7.1762 -7.1205 -7.0892 -7.0821 -7.0724 -5.6805 -5.6691 -5.5824 -5.5704 -5.1441 -5.1415 -5.0998 -5.0834 0.8609 0.8639 0.9240 0.9273 2.0990 2.0998 2.1653 2.1831 2.5517 2.5830 2.6200 2.6780 2.8987 2.9441 3.0198 3.0205 3.1065 3.1232 3.1673 3.1962 3.3682 3.4268 3.5007 3.5038 3.8803 3.9824 4.1000 4.1529 4.6502 4.6522 4.7045 4.7260 5.4529 5.4916 5.6485 5.7118 6.1014 6.1028 6.2075 6.2096 6.4197 6.4254 6.5043 6.5104 9.0034 9.0045 9.2584 9.2683 10.9994 11.0357 11.0818 11.0925 11.9254 11.9379 12.0309 12.0426 12.5751 12.6520 k = 0.4167 0.3019 0.7031 ( 6590 PWs) bands (ev): -8.1729 -8.1679 -8.1344 -8.0982 -8.0675 -8.0366 -7.9940 -7.9764 -7.5131 -7.4851 -7.3551 -7.2990 -7.2065 -7.1994 -7.1846 -7.1772 -7.1176 -7.0908 -7.0813 -7.0729 -5.6787 -5.6660 -5.5863 -5.5731 -5.1444 -5.1419 -5.1001 -5.0865 0.8643 0.8669 0.9237 0.9267 2.1057 2.1072 2.1693 2.1869 2.5580 2.5899 2.6214 2.6752 2.9076 2.9471 3.0242 3.0244 3.1204 3.1334 3.1798 3.2073 3.3535 3.4116 3.4891 3.4918 3.8897 3.9838 4.1114 4.1575 4.6337 4.6383 4.6883 4.7070 5.4485 5.4952 5.6277 5.6947 6.1022 6.1039 6.2080 6.2105 6.4136 6.4204 6.5033 6.5107 9.0039 9.0051 9.2483 9.2589 11.0482 11.0827 11.1254 11.1383 11.8925 11.9015 11.9845 11.9933 12.5944 12.6743 k = 0.4306 0.3119 0.6907 ( 6594 PWs) bands (ev): -8.1729 -8.1687 -8.1309 -8.1007 -8.0662 -8.0403 -7.9916 -7.9766 -7.5108 -7.4879 -7.3501 -7.3034 -7.2058 -7.1996 -7.1847 -7.1782 -7.1147 -7.0925 -7.0805 -7.0734 -5.6757 -5.6617 -5.5915 -5.5770 -5.1445 -5.1422 -5.1008 -5.0899 0.8690 0.8711 0.9230 0.9256 2.1135 2.1160 2.1720 2.1892 2.5651 2.5962 2.6238 2.6722 2.9170 2.9504 3.0285 3.0286 3.1338 3.1428 3.1913 3.2163 3.3416 3.3962 3.4798 3.4816 3.9003 3.9839 4.1219 4.1614 4.6183 4.6248 4.6737 4.6886 5.4455 5.5000 5.6034 5.6741 6.1032 6.1083 6.2082 6.2102 6.4072 6.4127 6.4969 6.5070 9.0120 9.0155 9.2373 9.2485 11.0950 11.1272 11.1679 11.1825 11.8564 11.8623 11.9365 11.9426 12.6103 12.6920 k = 0.4444 0.3220 0.6782 ( 6584 PWs) bands (ev): -8.1729 -8.1694 -8.1272 -8.1030 -8.0648 -8.0442 -7.9893 -7.9770 -7.5083 -7.4903 -7.3452 -7.3081 -7.2051 -7.1999 -7.1845 -7.1791 -7.1119 -7.0942 -7.0797 -7.0739 -5.6714 -5.6564 -5.5978 -5.5822 -5.1446 -5.1425 -5.1016 -5.0933 0.8749 0.8765 0.9217 0.9239 2.1225 2.1261 2.1736 2.1899 2.5727 2.6010 2.6277 2.6691 2.9268 2.9539 3.0328 3.0333 3.1457 3.1509 3.2016 3.2226 3.3338 3.3815 3.4734 3.4739 3.9119 3.9827 4.1315 4.1644 4.6043 4.6120 4.6607 4.6715 5.4435 5.5054 5.5764 5.6504 6.1058 6.1139 6.2078 6.2082 6.4013 6.4036 6.4852 6.4982 9.0290 9.0347 9.2258 9.2375 11.1385 11.1678 11.2082 11.2239 11.8164 11.8194 11.8882 11.8918 12.6228 12.7018 k = 0.4583 0.3321 0.6658 ( 6580 PWs) bands (ev): -8.1728 -8.1701 -8.1234 -8.1052 -8.0636 -8.0481 -7.9869 -7.9776 -7.5057 -7.4924 -7.3407 -7.3131 -7.2042 -7.2004 -7.1839 -7.1799 -7.1092 -7.0960 -7.0789 -7.0746 -5.6661 -5.6502 -5.6052 -5.5888 -5.1446 -5.1429 -5.1025 -5.0966 0.8821 0.8830 0.9199 0.9218 2.1325 2.1374 2.1743 2.1895 2.5805 2.6037 2.6335 2.6659 2.9366 2.9570 3.0376 3.0382 3.1549 3.1572 3.2104 3.2259 3.3306 3.3682 3.4694 3.4700 3.9241 3.9800 4.1401 4.1661 4.5922 4.5999 4.6497 4.6564 5.4423 5.5102 5.5478 5.6241 6.1098 6.1202 6.2043 6.2062 6.3944 6.3964 6.4683 6.4840 9.0545 9.0623 9.2139 9.2258 11.1770 11.2024 11.2453 11.2612 11.7726 11.7731 11.8411 11.8424 12.6328 12.6988 k = 0.4722 0.3421 0.6534 ( 6576 PWs) bands (ev): -8.1726 -8.1707 -8.1194 -8.1072 -8.0623 -8.0521 -7.9847 -7.9784 -7.5028 -7.4942 -7.3365 -7.3182 -7.2034 -7.2009 -7.1831 -7.1805 -7.1066 -7.0978 -7.0782 -7.0753 -5.6597 -5.6437 -5.6132 -5.5968 -5.1446 -5.1433 -5.1031 -5.0995 0.8903 0.8907 0.9175 0.9191 2.1433 2.1494 2.1747 2.1880 2.5882 2.6044 2.6408 2.6628 2.9459 2.9594 3.0430 3.0436 3.1608 3.1613 3.2176 3.2271 3.3320 3.3571 3.4685 3.4698 3.9369 3.9757 4.1478 4.1662 4.5824 4.5888 4.6405 4.6438 5.4416 5.5049 5.5271 5.5955 6.1147 6.1255 6.1991 6.2029 6.3862 6.3928 6.4476 6.4645 9.0881 9.0977 9.2016 9.2138 11.2085 11.2285 11.2776 11.2921 11.7251 11.7268 11.7961 11.7965 12.6417 12.6853 k = 0.4861 0.3522 0.6410 ( 6579 PWs) bands (ev): -8.1723 -8.1713 -8.1153 -8.1092 -8.0612 -8.0562 -7.9825 -7.9794 -7.4999 -7.4957 -7.3326 -7.3235 -7.2026 -7.2014 -7.1822 -7.1809 -7.1040 -7.0997 -7.0775 -7.0761 -5.6525 -5.6399 -5.6188 -5.6060 -5.1447 -5.1439 -5.1035 -5.1019 0.8992 0.8994 0.9149 0.9161 2.1546 2.1605 2.1765 2.1861 2.5955 2.6037 2.6489 2.6598 2.9540 2.9606 3.0492 3.0495 3.1629 3.1629 3.2230 3.2272 3.3370 3.3492 3.4712 3.4724 3.9498 3.9699 4.1547 4.1645 4.5750 4.5788 4.6332 4.6343 5.4412 5.4757 5.5282 5.5649 6.1196 6.1274 6.1941 6.1977 6.3800 6.3881 6.4268 6.4407 9.1289 9.1400 9.1892 9.2014 11.2308 11.2425 11.3036 11.3134 11.6793 11.6819 11.7548 11.7560 12.6512 12.6718 k = 0.5000 0.3623 0.6285 ( 6574 PWs) bands (ev): -8.1719 -8.1719 -8.1110 -8.1110 -8.0602 -8.0602 -7.9805 -7.9805 -7.4969 -7.4969 -7.3289 -7.3289 -7.2018 -7.2018 -7.1811 -7.1811 -7.1016 -7.1016 -7.0769 -7.0769 -5.6454 -5.6454 -5.6156 -5.6156 -5.1448 -5.1448 -5.1035 -5.1035 0.9067 0.9067 0.9144 0.9144 2.1654 2.1654 2.1849 2.1849 2.6020 2.6020 2.6571 2.6571 2.9604 2.9604 3.0560 3.0560 3.1625 3.1625 3.2271 3.2271 3.3448 3.3448 3.4773 3.4773 3.9627 3.9627 4.1608 4.1608 4.5701 4.5701 4.6281 4.6281 5.4408 5.4408 5.5328 5.5328 6.1222 6.1222 6.1916 6.1916 6.3744 6.3744 6.4159 6.4159 9.1753 9.1753 9.1894 9.1894 11.2408 11.2408 11.3208 11.3208 11.6417 11.6417 11.7217 11.7217 12.6624 12.6624 k = 0.5000 0.3623 0.6285 ( 6574 PWs) bands (ev): -8.1719 -8.1719 -8.1110 -8.1110 -8.0602 -8.0602 -7.9805 -7.9805 -7.4969 -7.4969 -7.3289 -7.3289 -7.2018 -7.2018 -7.1811 -7.1811 -7.1016 -7.1016 -7.0769 -7.0769 -5.6454 -5.6454 -5.6156 -5.6156 -5.1448 -5.1448 -5.1035 -5.1035 0.9067 0.9067 0.9144 0.9144 2.1654 2.1654 2.1849 2.1849 2.6020 2.6020 2.6571 2.6571 2.9604 2.9604 3.0560 3.0560 3.1625 3.1625 3.2271 3.2271 3.3448 3.3448 3.4773 3.4773 3.9627 3.9627 4.1608 4.1608 4.5701 4.5701 4.6281 4.6281 5.4408 5.4408 5.5328 5.5328 6.1222 6.1222 6.1916 6.1916 6.3744 6.3744 6.4159 6.4159 9.1753 9.1753 9.1894 9.1894 11.2408 11.2408 11.3208 11.3208 11.6417 11.6417 11.7217 11.7217 12.6624 12.6624 k = 0.5000 0.3623 0.6069 ( 6560 PWs) bands (ev): -8.1720 -8.1720 -8.1087 -8.1087 -8.0629 -8.0629 -7.9798 -7.9798 -7.4950 -7.4950 -7.3307 -7.3307 -7.2014 -7.2014 -7.1802 -7.1802 -7.1011 -7.1011 -7.0772 -7.0772 -5.6491 -5.6491 -5.6171 -5.6171 -5.1455 -5.1455 -5.1040 -5.1040 0.9124 0.9124 0.9202 0.9202 2.1756 2.1756 2.1959 2.1959 2.6053 2.6053 2.6622 2.6622 2.9644 2.9644 3.0682 3.0682 3.1602 3.1602 3.2298 3.2298 3.3507 3.3507 3.4890 3.4890 3.9673 3.9673 4.1617 4.1617 4.5599 4.5599 4.6206 4.6206 5.4083 5.4083 5.5071 5.5071 6.1141 6.1141 6.1852 6.1852 6.3512 6.3512 6.3935 6.3935 9.2086 9.2086 9.2232 9.2232 11.2231 11.2231 11.3171 11.3171 11.5906 11.5906 11.6779 11.6779 12.6681 12.6681 k = 0.5000 0.3623 0.5852 ( 6562 PWs) bands (ev): -8.1721 -8.1721 -8.1062 -8.1062 -8.0658 -8.0658 -7.9793 -7.9793 -7.4930 -7.4930 -7.3327 -7.3327 -7.2010 -7.2010 -7.1792 -7.1792 -7.1006 -7.1006 -7.0775 -7.0775 -5.6532 -5.6532 -5.6193 -5.6193 -5.1457 -5.1457 -5.1042 -5.1042 0.9178 0.9178 0.9259 0.9259 2.1864 2.1864 2.2078 2.2078 2.6088 2.6088 2.6674 2.6674 2.9689 2.9689 3.0805 3.0805 3.1581 3.1581 3.2325 3.2325 3.3577 3.3577 3.5009 3.5009 3.9725 3.9725 4.1627 4.1627 4.5495 4.5495 4.6133 4.6133 5.3747 5.3747 5.4796 5.4796 6.1054 6.1054 6.1784 6.1784 6.3287 6.3287 6.3719 6.3719 9.2434 9.2434 9.2585 9.2585 11.1836 11.1836 11.2830 11.2830 11.5596 11.5596 11.6472 11.6472 12.6755 12.6755 k = 0.5000 0.3623 0.5635 ( 6566 PWs) bands (ev): -8.1721 -8.1721 -8.1038 -8.1038 -8.0686 -8.0686 -7.9789 -7.9789 -7.4909 -7.4909 -7.3348 -7.3348 -7.2006 -7.2006 -7.1783 -7.1783 -7.1001 -7.1001 -7.0779 -7.0779 -5.6578 -5.6578 -5.6222 -5.6222 -5.1453 -5.1453 -5.1039 -5.1039 0.9231 0.9231 0.9314 0.9314 2.1977 2.1977 2.2204 2.2204 2.6122 2.6122 2.6727 2.6727 2.9737 2.9737 3.0923 3.0923 3.1567 3.1567 3.2352 3.2352 3.3658 3.3658 3.5127 3.5127 3.9784 3.9784 4.1638 4.1638 4.5392 4.5392 4.6062 4.6062 5.3407 5.3407 5.4506 5.4506 6.0962 6.0962 6.1710 6.1710 6.3073 6.3073 6.3513 6.3513 9.2795 9.2795 9.2949 9.2949 11.1263 11.1263 11.2232 11.2232 11.5433 11.5433 11.6252 11.6252 12.6830 12.6830 k = 0.5000 0.3623 0.5418 ( 6566 PWs) bands (ev): -8.1721 -8.1721 -8.1013 -8.1013 -8.0714 -8.0714 -7.9786 -7.9786 -7.4886 -7.4886 -7.3369 -7.3369 -7.2001 -7.2001 -7.1775 -7.1775 -7.0995 -7.0995 -7.0783 -7.0783 -5.6629 -5.6629 -5.6258 -5.6258 -5.1441 -5.1441 -5.1030 -5.1030 0.9280 0.9280 0.9365 0.9365 2.2094 2.2094 2.2337 2.2337 2.6156 2.6156 2.6781 2.6781 2.9786 2.9786 3.1022 3.1022 3.1571 3.1571 3.2383 3.2383 3.3748 3.3748 3.5243 3.5243 3.9849 3.9849 4.1650 4.1650 4.5289 4.5289 4.5993 4.5993 5.3071 5.3071 5.4206 5.4206 6.0864 6.0864 6.1633 6.1633 6.2872 6.2872 6.3317 6.3317 9.3165 9.3165 9.3320 9.3320 11.0569 11.0569 11.1486 11.1486 11.5310 11.5310 11.6058 11.6058 12.6881 12.6881 k = 0.5000 0.3623 0.5202 ( 6562 PWs) bands (ev): -8.1719 -8.1719 -8.0989 -8.0989 -8.0740 -8.0740 -7.9784 -7.9784 -7.4862 -7.4862 -7.3392 -7.3392 -7.1995 -7.1995 -7.1767 -7.1767 -7.0989 -7.0989 -7.0786 -7.0786 -5.6685 -5.6685 -5.6303 -5.6303 -5.1422 -5.1422 -5.1016 -5.1016 0.9324 0.9324 0.9413 0.9413 2.2214 2.2214 2.2476 2.2476 2.6189 2.6189 2.6834 2.6834 2.9832 2.9832 3.1084 3.1084 3.1613 3.1613 3.2422 3.2422 3.3848 3.3848 3.5356 3.5356 3.9921 3.9921 4.1661 4.1661 4.5188 4.5188 4.5924 4.5924 5.2748 5.2748 5.3902 5.3902 6.0761 6.0761 6.1551 6.1551 6.2684 6.2684 6.3133 6.3133 9.3539 9.3539 9.3694 9.3694 10.9805 10.9805 11.0669 11.0669 11.5155 11.5155 11.5845 11.5845 12.6883 12.6883 k = 0.5000 0.3623 0.4985 ( 6568 PWs) bands (ev): -8.1717 -8.1717 -8.0967 -8.0967 -8.0765 -8.0765 -7.9784 -7.9784 -7.4837 -7.4837 -7.3415 -7.3415 -7.1988 -7.1988 -7.1759 -7.1759 -7.0984 -7.0984 -7.0790 -7.0790 -5.6746 -5.6746 -5.6355 -5.6355 -5.1394 -5.1394 -5.0995 -5.0995 0.9363 0.9363 0.9455 0.9455 2.2335 2.2335 2.2620 2.2620 2.6221 2.6221 2.6886 2.6886 2.9871 2.9871 3.1095 3.1095 3.1702 3.1702 3.2474 3.2474 3.3955 3.3955 3.5464 3.5464 3.9997 3.9997 4.1673 4.1673 4.5090 4.5090 4.5849 4.5849 5.2449 5.2449 5.3602 5.3602 6.0654 6.0654 6.1465 6.1465 6.2510 6.2510 6.2960 6.2960 9.3914 9.3914 9.4067 9.4067 10.9005 10.9005 10.9824 10.9824 11.4940 11.4940 11.5587 11.5587 12.6814 12.6814 k = 0.5000 0.3623 0.4768 ( 6558 PWs) bands (ev): -8.1713 -8.1713 -8.0949 -8.0949 -8.0784 -8.0784 -7.9784 -7.9784 -7.4811 -7.4811 -7.3439 -7.3439 -7.1981 -7.1981 -7.1752 -7.1752 -7.0978 -7.0978 -7.0794 -7.0794 -5.6811 -5.6811 -5.6415 -5.6415 -5.1359 -5.1359 -5.0969 -5.0969 0.9397 0.9397 0.9492 0.9492 2.2458 2.2458 2.2766 2.2766 2.6254 2.6254 2.6938 2.6938 2.9899 2.9899 3.1064 3.1064 3.1832 3.1832 3.2545 3.2545 3.4066 3.4066 3.5566 3.5566 4.0079 4.0079 4.1685 4.1685 4.4993 4.4993 4.5765 4.5765 5.2183 5.2183 5.3314 5.3314 6.0543 6.0543 6.1376 6.1376 6.2349 6.2349 6.2797 6.2797 9.4285 9.4285 9.4436 9.4436 10.8191 10.8191 10.8971 10.8971 11.4656 11.4656 11.5272 11.5272 12.6659 12.6659 k = 0.5000 0.3623 0.4552 ( 6572 PWs) bands (ev): -8.1710 -8.1710 -8.0940 -8.0940 -8.0794 -8.0794 -7.9787 -7.9787 -7.4784 -7.4784 -7.3464 -7.3464 -7.1974 -7.1974 -7.1746 -7.1746 -7.0972 -7.0972 -7.0798 -7.0798 -5.6881 -5.6881 -5.6482 -5.6482 -5.1316 -5.1316 -5.0936 -5.0936 0.9425 0.9425 0.9523 0.9523 2.2581 2.2581 2.2914 2.2914 2.6285 2.6285 2.6988 2.6988 2.9913 2.9913 3.1004 3.1004 3.1986 3.1986 3.2639 3.2639 3.4180 3.4180 3.5660 3.5660 4.0164 4.0164 4.1696 4.1696 4.4896 4.4896 4.5665 4.5665 5.1963 5.1963 5.3045 5.3045 6.0429 6.0429 6.1283 6.1283 6.2202 6.2202 6.2645 6.2645 9.4650 9.4650 9.4797 9.4797 10.7379 10.7379 10.8126 10.8126 11.4304 11.4304 11.4900 11.4900 12.6411 12.6411 k = 0.5000 0.3623 0.4335 ( 6572 PWs) bands (ev): -8.1705 -8.1705 -8.0944 -8.0944 -8.0790 -8.0790 -7.9791 -7.9791 -7.4756 -7.4756 -7.3489 -7.3489 -7.1966 -7.1966 -7.1740 -7.1740 -7.0966 -7.0966 -7.0802 -7.0802 -5.6954 -5.6954 -5.6555 -5.6555 -5.1265 -5.1265 -5.0898 -5.0898 0.9446 0.9446 0.9548 0.9548 2.2702 2.2702 2.3061 2.3061 2.6318 2.6318 2.7038 2.7038 2.9908 2.9908 3.0926 3.0926 3.2156 3.2156 3.2760 3.2760 3.4294 3.4294 3.5748 3.5748 4.0253 4.0253 4.1707 4.1707 4.4795 4.4795 4.5542 4.5542 5.1797 5.1797 5.2806 5.2806 6.0311 6.0311 6.1186 6.1186 6.2068 6.2068 6.2504 6.2504 9.5003 9.5003 9.5145 9.5145 10.6578 10.6578 10.7295 10.7295 11.3891 11.3891 11.4474 11.4474 12.6068 12.6068 k = 0.5000 0.3623 0.4118 ( 6580 PWs) bands (ev): -8.1699 -8.1699 -8.0959 -8.0959 -8.0775 -8.0775 -7.9797 -7.9797 -7.4727 -7.4727 -7.3515 -7.3515 -7.1958 -7.1958 -7.1735 -7.1735 -7.0960 -7.0960 -7.0806 -7.0806 -5.7030 -5.7030 -5.6634 -5.6634 -5.1208 -5.1208 -5.0855 -5.0855 0.9461 0.9461 0.9566 0.9566 2.2821 2.2821 2.3207 2.3207 2.6351 2.6351 2.7085 2.7085 2.9884 2.9884 3.0834 3.0834 3.2339 3.2339 3.2907 3.2907 3.4405 3.4405 3.5827 3.5827 4.0343 4.0343 4.1718 4.1718 4.4687 4.4687 4.5392 4.5392 5.1693 5.1693 5.2605 5.2605 6.0190 6.0190 6.1085 6.1085 6.1945 6.1945 6.2372 6.2372 9.5342 9.5342 9.5479 9.5479 10.5795 10.5795 10.6486 10.6486 11.3422 11.3422 11.3998 11.3998 12.5636 12.5636 k = 0.5000 0.3623 0.3901 ( 6588 PWs) bands (ev): -8.1693 -8.1693 -8.0981 -8.0981 -8.0752 -8.0752 -7.9805 -7.9805 -7.4698 -7.4698 -7.3542 -7.3542 -7.1949 -7.1949 -7.1731 -7.1731 -7.0954 -7.0954 -7.0810 -7.0810 -5.7107 -5.7107 -5.6718 -5.6718 -5.1144 -5.1144 -5.0806 -5.0806 0.9470 0.9470 0.9578 0.9578 2.2937 2.2937 2.3349 2.3349 2.6386 2.6386 2.7131 2.7131 2.9842 2.9842 3.0732 3.0732 3.2536 3.2536 3.3078 3.3078 3.4513 3.4513 3.5899 3.5899 4.0435 4.0435 4.1729 4.1729 4.4565 4.4565 4.5209 4.5209 5.1658 5.1658 5.2452 5.2452 6.0066 6.0066 6.0980 6.0980 6.1833 6.1833 6.2251 6.2251 9.5663 9.5663 9.5794 9.5794 10.5038 10.5038 10.5704 10.5704 11.2905 11.2905 11.3478 11.3478 12.5128 12.5128 k = 0.5000 0.3623 0.3685 ( 6590 PWs) bands (ev): -8.1685 -8.1685 -8.1006 -8.1006 -8.0725 -8.0725 -7.9813 -7.9813 -7.4667 -7.4667 -7.3569 -7.3569 -7.1940 -7.1940 -7.1727 -7.1727 -7.0949 -7.0949 -7.0815 -7.0815 -5.7187 -5.7187 -5.6805 -5.6805 -5.1076 -5.1076 -5.0754 -5.0754 0.9473 0.9473 0.9583 0.9583 2.3048 2.3048 2.3486 2.3486 2.6424 2.6424 2.7175 2.7175 2.9782 2.9782 3.0620 3.0620 3.2747 3.2747 3.3270 3.3270 3.4614 3.4614 3.5963 3.5963 4.0527 4.0527 4.1739 4.1739 4.4425 4.4425 4.4995 4.4995 5.1691 5.1691 5.2353 5.2353 5.9939 5.9939 6.0869 6.0869 6.1732 6.1732 6.2140 6.2140 9.5963 9.5963 9.6088 9.6088 10.4309 10.4309 10.4951 10.4951 11.2347 11.2347 11.2920 11.2920 12.4559 12.4559 k = 0.5000 0.3623 0.3468 ( 6596 PWs) bands (ev): -8.1677 -8.1677 -8.1033 -8.1033 -8.0695 -8.0695 -7.9824 -7.9824 -7.4636 -7.4636 -7.3597 -7.3597 -7.1931 -7.1931 -7.1724 -7.1724 -7.0943 -7.0943 -7.0819 -7.0819 -5.7266 -5.7266 -5.6896 -5.6896 -5.1003 -5.1003 -5.0699 -5.0699 0.9471 0.9471 0.9583 0.9583 2.3155 2.3155 2.3615 2.3615 2.6465 2.6465 2.7217 2.7217 2.9709 2.9709 3.0503 3.0503 3.2972 3.2972 3.3479 3.3479 3.4708 3.4708 3.6021 3.6021 4.0619 4.0619 4.1749 4.1749 4.4260 4.4260 4.4751 4.4751 5.1791 5.1791 5.2316 5.2316 5.9810 5.9810 6.0752 6.0752 6.1641 6.1641 6.2038 6.2038 9.6240 9.6240 9.6359 9.6359 10.3613 10.3613 10.4232 10.4232 11.1755 11.1755 11.2330 11.2330 12.3949 12.3949 k = 0.5000 0.3623 0.3251 ( 6592 PWs) bands (ev): -8.1668 -8.1668 -8.1060 -8.1060 -8.0664 -8.0664 -7.9836 -7.9836 -7.4604 -7.4604 -7.3624 -7.3624 -7.1921 -7.1921 -7.1722 -7.1722 -7.0937 -7.0937 -7.0823 -7.0823 -5.7345 -5.7345 -5.6987 -5.6987 -5.0927 -5.0927 -5.0641 -5.0641 0.9464 0.9464 0.9576 0.9576 2.3257 2.3257 2.3736 2.3736 2.6509 2.6509 2.7257 2.7257 2.9624 2.9624 3.0381 3.0381 3.3212 3.3212 3.3701 3.3701 3.4795 3.4795 3.6073 3.6073 4.0710 4.0710 4.1759 4.1759 4.4064 4.4064 4.4483 4.4483 5.1952 5.1952 5.2345 5.2345 5.9677 5.9677 6.0629 6.0629 6.1559 6.1559 6.1946 6.1946 9.6491 9.6491 9.6606 9.6606 10.2953 10.2953 10.3550 10.3550 11.1137 11.1137 11.1713 11.1713 12.3318 12.3318 k = 0.5000 0.3623 0.3034 ( 6586 PWs) bands (ev): -8.1657 -8.1657 -8.1088 -8.1088 -8.0632 -8.0632 -7.9849 -7.9849 -7.4571 -7.4571 -7.3653 -7.3653 -7.1911 -7.1911 -7.1721 -7.1721 -7.0932 -7.0932 -7.0826 -7.0826 -5.7423 -5.7423 -5.7080 -5.7080 -5.0849 -5.0849 -5.0581 -5.0581 0.9453 0.9453 0.9564 0.9564 2.3354 2.3354 2.3847 2.3847 2.6557 2.6557 2.7294 2.7294 2.9532 2.9532 3.0258 3.0258 3.3466 3.3466 3.3932 3.3932 3.4874 3.4874 3.6121 3.6121 4.0799 4.0799 4.1768 4.1768 4.3834 4.3834 4.4198 4.4198 5.2164 5.2164 5.2442 5.2442 5.9543 5.9543 6.0499 6.0499 6.1486 6.1486 6.1864 6.1864 9.6716 9.6716 9.6827 9.6827 10.2331 10.2331 10.2905 10.2905 11.0500 11.0500 11.1075 11.1075 12.2684 12.2684 k = 0.5000 0.3623 0.2818 ( 6594 PWs) bands (ev): -8.1647 -8.1647 -8.1116 -8.1116 -8.0600 -8.0600 -7.9865 -7.9865 -7.4539 -7.4539 -7.3681 -7.3681 -7.1902 -7.1902 -7.1720 -7.1720 -7.0927 -7.0927 -7.0830 -7.0830 -5.7498 -5.7498 -5.7172 -5.7172 -5.0770 -5.0770 -5.0522 -5.0522 0.9438 0.9438 0.9548 0.9548 2.3444 2.3444 2.3946 2.3946 2.6609 2.6609 2.7328 2.7328 2.9436 2.9436 3.0133 3.0133 3.3732 3.3732 3.4168 3.4168 3.4946 3.4946 3.6169 3.6169 4.0884 4.0884 4.1776 4.1776 4.3568 4.3568 4.3902 4.3902 5.2416 5.2416 5.2607 5.2607 5.9405 5.9405 6.0362 6.0362 6.1422 6.1422 6.1790 6.1790 9.6912 9.6912 9.7021 9.7021 10.1749 10.1749 10.2301 10.2301 10.9851 10.9851 11.0424 11.0424 12.2062 12.2062 k = 0.5000 0.3623 0.2601 ( 6598 PWs) bands (ev): -8.1635 -8.1635 -8.1144 -8.1144 -8.0567 -8.0567 -7.9881 -7.9881 -7.4505 -7.4505 -7.3710 -7.3710 -7.1892 -7.1892 -7.1721 -7.1721 -7.0922 -7.0922 -7.0834 -7.0834 -5.7570 -5.7570 -5.7262 -5.7262 -5.0692 -5.0692 -5.0462 -5.0462 0.9421 0.9421 0.9527 0.9527 2.3530 2.3530 2.4033 2.4033 2.6664 2.6664 2.7359 2.7359 2.9340 2.9340 3.0011 3.0011 3.4005 3.4005 3.4405 3.4405 3.5013 3.5013 3.6221 3.6221 4.0964 4.0964 4.1782 4.1782 4.3270 4.3270 4.3600 4.3600 5.2693 5.2693 5.2844 5.2844 5.9264 5.9264 6.0217 6.0217 6.1367 6.1367 6.1725 6.1725 9.7080 9.7080 9.7189 9.7189 10.1209 10.1209 10.1739 10.1739 10.9200 10.9200 10.9767 10.9767 12.1464 12.1464 k = 0.5000 0.3623 0.2384 ( 6598 PWs) bands (ev): -8.1622 -8.1622 -8.1171 -8.1171 -8.0534 -8.0534 -7.9899 -7.9899 -7.4471 -7.4471 -7.3740 -7.3740 -7.1882 -7.1882 -7.1722 -7.1722 -7.0917 -7.0917 -7.0837 -7.0837 -5.7638 -5.7638 -5.7350 -5.7350 -5.0614 -5.0614 -5.0404 -5.0404 0.9401 0.9401 0.9504 0.9504 2.3609 2.3609 2.4107 2.4107 2.6721 2.6721 2.7384 2.7384 2.9246 2.9246 2.9892 2.9892 3.4281 3.4281 3.4639 3.4639 3.5077 3.5077 3.6283 3.6283 4.1036 4.1036 4.1782 4.1782 4.2951 4.2951 4.3294 4.3294 5.2985 5.2985 5.3144 5.3144 5.9121 5.9121 6.0063 6.0063 6.1319 6.1319 6.1667 6.1667 9.7221 9.7221 9.7331 9.7331 10.0712 10.0712 10.1220 10.1220 10.8556 10.8556 10.9112 10.9112 12.0899 12.0899 k = 0.5000 0.3623 0.2167 ( 6594 PWs) bands (ev): -8.1609 -8.1609 -8.1197 -8.1197 -8.0501 -8.0501 -7.9919 -7.9919 -7.4437 -7.4437 -7.3770 -7.3770 -7.1872 -7.1872 -7.1724 -7.1724 -7.0912 -7.0912 -7.0841 -7.0841 -5.7701 -5.7701 -5.7435 -5.7435 -5.0539 -5.0539 -5.0349 -5.0349 0.9380 0.9380 0.9478 0.9478 2.3684 2.3684 2.4168 2.4168 2.6780 2.6780 2.7404 2.7404 2.9158 2.9158 2.9777 2.9777 3.4545 3.4545 3.4869 3.4869 3.5147 3.5147 3.6365 3.6365 4.1092 4.1092 4.1773 4.1773 4.2623 4.2623 4.2988 4.2988 5.3298 5.3298 5.3487 5.3487 5.8973 5.8973 5.9900 5.9900 6.1280 6.1280 6.1616 6.1616 9.7334 9.7334 9.7448 9.7448 10.0260 10.0260 10.0744 10.0744 10.7929 10.7929 10.8467 10.8467 12.0376 12.0376 k = 0.5000 0.3623 0.1951 ( 6602 PWs) bands (ev): -8.1595 -8.1595 -8.1224 -8.1224 -8.0468 -8.0468 -7.9940 -7.9940 -7.4403 -7.4403 -7.3800 -7.3800 -7.1862 -7.1862 -7.1726 -7.1726 -7.0907 -7.0907 -7.0845 -7.0845 -5.7759 -5.7759 -5.7516 -5.7516 -5.0467 -5.0467 -5.0296 -5.0296 0.9359 0.9359 0.9451 0.9451 2.3754 2.3754 2.4217 2.4217 2.6839 2.6839 2.7418 2.7418 2.9080 2.9080 2.9669 2.9669 3.4767 3.4767 3.5086 3.5086 3.5248 3.5248 3.6478 3.6478 4.1118 4.1118 4.1744 4.1744 4.2304 4.2304 4.2693 4.2693 5.3634 5.3634 5.3853 5.3853 5.8822 5.8822 5.9728 5.9728 6.1249 6.1249 6.1570 6.1570 9.7424 9.7424 9.7542 9.7542 9.9852 9.9852 10.0313 10.0313 10.7328 10.7328 10.7842 10.7842 11.9899 11.9899 k = 0.5000 0.3623 0.1734 ( 6608 PWs) bands (ev): -8.1580 -8.1580 -8.1250 -8.1250 -8.0434 -8.0434 -7.9962 -7.9962 -7.4368 -7.4368 -7.3831 -7.3831 -7.1852 -7.1852 -7.1730 -7.1730 -7.0903 -7.0903 -7.0848 -7.0848 -5.7812 -5.7812 -5.7592 -5.7592 -5.0399 -5.0399 -5.0248 -5.0248 0.9338 0.9338 0.9422 0.9422 2.3819 2.3819 2.4254 2.4254 2.6897 2.6897 2.7425 2.7425 2.9012 2.9012 2.9567 2.9567 3.4922 3.4922 3.5222 3.5222 3.5464 3.5464 3.6630 3.6630 4.1083 4.1083 4.1672 4.1672 4.2029 4.2029 4.2434 4.2434 5.3989 5.3989 5.4232 5.4232 5.8667 5.8667 5.9545 5.9545 6.1226 6.1226 6.1528 6.1528 9.7491 9.7491 9.7615 9.7615 9.9488 9.9488 9.9924 9.9924 10.6764 10.6764 10.7248 10.7248 11.9470 11.9470 k = 0.5000 0.3623 0.1517 ( 6620 PWs) bands (ev): -8.1565 -8.1565 -8.1276 -8.1276 -8.0401 -8.0401 -7.9985 -7.9985 -7.4334 -7.4334 -7.3863 -7.3863 -7.1843 -7.1843 -7.1734 -7.1734 -7.0899 -7.0899 -7.0852 -7.0852 -5.7857 -5.7857 -5.7662 -5.7662 -5.0336 -5.0336 -5.0204 -5.0204 0.9318 0.9318 0.9394 0.9394 2.3881 2.3881 2.4279 2.4279 2.6953 2.6953 2.7425 2.7425 2.8959 2.8959 2.9472 2.9472 3.5020 3.5020 3.5296 3.5296 3.5765 3.5765 3.6825 3.6825 4.0945 4.0945 4.1511 4.1511 4.1854 4.1854 4.2246 4.2246 5.4354 5.4354 5.4614 5.4614 5.8509 5.8509 5.9351 5.9351 6.1210 6.1210 6.1490 6.1490 9.7541 9.7541 9.7671 9.7671 9.9168 9.9168 9.9577 9.9577 10.6247 10.6247 10.6692 10.6692 11.9092 11.9092 k = 0.5000 0.3623 0.1300 ( 6622 PWs) bands (ev): -8.1549 -8.1549 -8.1300 -8.1300 -8.0368 -8.0368 -8.0010 -8.0010 -7.4299 -7.4299 -7.3894 -7.3894 -7.1833 -7.1833 -7.1739 -7.1739 -7.0895 -7.0895 -7.0855 -7.0855 -5.7895 -5.7895 -5.7727 -5.7727 -5.0279 -5.0279 -5.0166 -5.0166 0.9300 0.9300 0.9368 0.9368 2.3938 2.3938 2.4294 2.4294 2.7005 2.7005 2.7418 2.7418 2.8921 2.8921 2.9384 2.9384 3.5084 3.5084 3.5342 3.5342 3.6097 3.6097 3.7060 3.7060 4.0695 4.0695 4.1249 4.1249 4.1795 4.1795 4.2141 4.2141 5.4720 5.4720 5.4994 5.4994 5.8346 5.8346 5.9145 5.9145 6.1202 6.1202 6.1455 6.1455 9.7579 9.7579 9.7713 9.7713 9.8890 9.8890 9.9270 9.9270 10.5787 10.5787 10.6185 10.6185 11.8765 11.8765 k = 0.5000 0.3623 0.1084 ( 6610 PWs) bands (ev): -8.1531 -8.1531 -8.1324 -8.1324 -8.0335 -8.0335 -8.0035 -8.0035 -7.4264 -7.4264 -7.3926 -7.3926 -7.1823 -7.1823 -7.1744 -7.1744 -7.0891 -7.0891 -7.0858 -7.0858 -5.7926 -5.7926 -5.7784 -5.7784 -5.0228 -5.0228 -5.0134 -5.0134 0.9285 0.9285 0.9342 0.9342 2.3993 2.3993 2.4299 2.4299 2.7055 2.7055 2.7404 2.7404 2.8899 2.8899 2.9303 2.9303 3.5132 3.5132 3.5365 3.5365 3.6444 3.6444 3.7325 3.7325 4.0378 4.0378 4.0932 4.0932 4.1796 4.1796 4.2087 4.2087 5.5079 5.5079 5.5363 5.5363 5.8182 5.8182 5.8928 5.8928 6.1201 6.1201 6.1422 6.1422 9.7608 9.7608 9.7748 9.7748 9.8652 9.8652 9.9001 9.9001 10.5391 10.5391 10.5735 10.5735 11.8489 11.8489 k = 0.5000 0.3623 0.0867 ( 6606 PWs) bands (ev): -8.1513 -8.1513 -8.1348 -8.1348 -8.0303 -8.0303 -8.0062 -8.0062 -7.4229 -7.4229 -7.3958 -7.3958 -7.1813 -7.1813 -7.1750 -7.1750 -7.0888 -7.0888 -7.0861 -7.0861 -5.7949 -5.7949 -5.7835 -5.7835 -5.0183 -5.0183 -5.0108 -5.0108 0.9273 0.9273 0.9320 0.9320 2.4043 2.4043 2.4295 2.4295 2.7100 2.7100 2.7383 2.7383 2.8892 2.8892 2.9229 2.9229 3.5171 3.5171 3.5370 3.5370 3.6800 3.6800 3.7609 3.7609 4.0033 4.0033 4.0592 4.0592 4.1822 4.1822 4.2055 4.2055 5.5422 5.5422 5.5713 5.5713 5.8020 5.8020 5.8699 5.8699 6.1206 6.1206 6.1391 6.1391 9.7637 9.7637 9.7779 9.7779 9.8452 9.8452 9.8766 9.8766 10.5066 10.5066 10.5350 10.5350 11.8265 11.8265 k = 0.5000 0.3623 0.0650 ( 6610 PWs) bands (ev): -8.1495 -8.1495 -8.1371 -8.1371 -8.0270 -8.0270 -8.0089 -8.0089 -7.4195 -7.4195 -7.3991 -7.3991 -7.1804 -7.1804 -7.1756 -7.1756 -7.0884 -7.0884 -7.0864 -7.0864 -5.7964 -5.7964 -5.7878 -5.7878 -5.0146 -5.0146 -5.0090 -5.0090 0.9264 0.9264 0.9300 0.9300 2.4091 2.4091 2.4284 2.4284 2.7143 2.7143 2.7357 2.7357 2.8900 2.8900 2.9161 2.9161 3.5205 3.5205 3.5362 3.5362 3.7160 3.7160 3.7896 3.7896 3.9690 3.9690 4.0243 4.0243 4.1856 4.1856 4.2031 4.2031 5.5740 5.5740 5.6028 5.6028 5.7871 5.7871 5.8463 5.8463 6.1218 6.1218 6.1361 6.1361 9.7668 9.7668 9.7812 9.7812 9.8289 9.8289 9.8563 9.8563 10.4817 10.4817 10.5036 10.5036 11.8092 11.8092 k = 0.5000 0.3623 0.0433 ( 6618 PWs) bands (ev): -8.1476 -8.1476 -8.1393 -8.1393 -8.0239 -8.0239 -8.0118 -8.0118 -7.4160 -7.4160 -7.4024 -7.4024 -7.1796 -7.1796 -7.1764 -7.1764 -7.0881 -7.0881 -7.0868 -7.0868 -5.7971 -5.7971 -5.7913 -5.7913 -5.0117 -5.0117 -5.0080 -5.0080 0.9260 0.9260 0.9284 0.9284 2.4134 2.4134 2.4265 2.4265 2.7183 2.7183 2.7327 2.7327 2.8921 2.8921 2.9098 2.9098 3.5237 3.5237 3.5345 3.5345 3.7519 3.7519 3.8154 3.8154 3.9383 3.9383 3.9899 3.9899 4.1892 4.1892 4.2008 4.2008 5.6023 5.6023 5.6278 5.6278 5.7760 5.7760 5.8224 5.8224 6.1234 6.1234 6.1331 6.1331 9.7708 9.7708 9.7842 9.7842 9.8170 9.8170 9.8393 9.8393 10.4649 10.4649 10.4797 10.4797 11.7968 11.7968 k = 0.5000 0.3623 0.0217 ( 6612 PWs) bands (ev): -8.1456 -8.1456 -8.1415 -8.1415 -8.0208 -8.0208 -8.0147 -8.0147 -7.4126 -7.4126 -7.4058 -7.4058 -7.1787 -7.1787 -7.1771 -7.1771 -7.0877 -7.0877 -7.0871 -7.0871 -5.7969 -5.7969 -5.7940 -5.7940 -5.0096 -5.0096 -5.0077 -5.0077 0.9259 0.9259 0.9271 0.9271 2.4174 2.4174 2.4240 2.4240 2.7222 2.7222 2.7294 2.7294 2.8953 2.8953 2.9043 2.9043 3.5268 3.5268 3.5323 3.5323 3.7863 3.7863 3.8284 3.8284 3.9212 3.9212 3.9574 3.9574 4.1926 4.1926 4.1984 4.1984 5.6254 5.6254 5.6416 5.6416 5.7730 5.7730 5.7998 5.7998 6.1254 6.1254 6.1304 6.1304 9.7757 9.7757 9.7847 9.7847 9.8119 9.8119 9.8254 9.8254 10.4562 10.4562 10.4637 10.4637 11.7895 11.7895 k = 0.5000 0.3623 0.0000 ( 6622 PWs) bands (ev): -8.1436 -8.1436 -8.1436 -8.1436 -8.0177 -8.0177 -8.0177 -8.0177 -7.4092 -7.4092 -7.4092 -7.4092 -7.1779 -7.1779 -7.1779 -7.1779 -7.0874 -7.0874 -7.0874 -7.0874 -5.7958 -5.7958 -5.7958 -5.7958 -5.0082 -5.0082 -5.0082 -5.0082 0.9263 0.9263 0.9263 0.9263 2.4209 2.4209 2.4209 2.4209 2.7259 2.7259 2.7259 2.7259 2.8994 2.8994 2.8994 2.8994 3.5297 3.5297 3.5297 3.5297 3.8155 3.8155 3.8155 3.8155 3.9307 3.9307 3.9307 3.9307 4.1957 4.1957 4.1957 4.1957 5.6400 5.6400 5.6400 5.6400 5.7817 5.7817 5.7817 5.7817 6.1278 6.1278 6.1278 6.1278 9.7810 9.7810 9.7810 9.7810 9.8156 9.8156 9.8156 9.8156 10.4558 10.4558 10.4558 10.4558 11.7871 11.7871 k = 0.0000 0.0000 0.8522 ( 6600 PWs) bands (ev): -8.1699 -8.1699 -8.1244 -8.1244 -8.0432 -8.0432 -7.9867 -7.9867 -7.5064 -7.5064 -7.3193 -7.3193 -7.2025 -7.2025 -7.1875 -7.1875 -7.1040 -7.1040 -7.0754 -7.0754 -5.6256 -5.6256 -5.6201 -5.6201 -5.1320 -5.1320 -5.0934 -5.0934 0.8692 0.8692 0.8762 0.8762 2.1110 2.1110 2.1292 2.1292 2.5825 2.5825 2.6270 2.6270 2.9541 2.9541 2.9791 2.9791 3.1815 3.1815 3.1960 3.1960 3.3261 3.3261 3.4056 3.4056 3.9447 3.9447 4.1565 4.1565 4.6322 4.6322 4.6815 4.6815 5.6167 5.6167 5.6576 5.6576 6.1642 6.1642 6.2235 6.2235 6.5420 6.5420 6.5840 6.5840 8.9920 8.9920 8.9994 8.9994 11.0236 11.0236 11.0290 11.0290 12.1742 12.1742 12.2221 12.2221 12.6760 12.6760 k = 0.0167 0.0121 0.8522 ( 6600 PWs) bands (ev): -8.1705 -8.1692 -8.1281 -8.1206 -8.0469 -8.0395 -7.9890 -7.9846 -7.5092 -7.5033 -7.3255 -7.3134 -7.2039 -7.2008 -7.1892 -7.1858 -7.1069 -7.1013 -7.0764 -7.0745 -5.6276 -5.6236 -5.6223 -5.6180 -5.1327 -5.1314 -5.0959 -5.0911 0.8692 0.8695 0.8757 0.8771 2.1102 2.1114 2.1271 2.1308 2.5777 2.5870 2.6197 2.6342 2.9459 2.9620 2.9775 2.9807 3.1648 3.1856 3.1934 3.2002 3.3172 3.3406 3.4061 3.4125 3.9350 3.9533 4.1525 4.1583 4.6335 4.6345 4.6787 4.6872 5.6147 5.6186 5.6532 5.6612 6.1620 6.1660 6.2223 6.2246 6.5366 6.5437 6.5817 6.5831 8.9934 8.9958 9.0015 9.0026 11.0185 11.0218 11.0253 11.0268 12.1694 12.1768 12.2167 12.2262 12.6684 12.6876 k = 0.0333 0.0242 0.8522 ( 6600 PWs) bands (ev): -8.1709 -8.1685 -8.1317 -8.1167 -8.0505 -8.0357 -7.9915 -7.9829 -7.5117 -7.4999 -7.3320 -7.3079 -7.2052 -7.1989 -7.1909 -7.1840 -7.1098 -7.0987 -7.0774 -7.0737 -5.6296 -5.6244 -5.6215 -5.6159 -5.1333 -5.1307 -5.0984 -5.0889 0.8697 0.8703 0.8756 0.8785 2.1091 2.1115 2.1245 2.1317 2.5726 2.5912 2.6122 2.6410 2.9375 2.9697 2.9759 2.9823 3.1458 3.1706 3.1977 3.1977 3.3169 3.3584 3.4141 3.4249 3.9245 3.9605 4.1459 4.1580 4.6382 4.6405 4.6791 4.6957 5.6127 5.6202 5.6481 5.6640 6.1595 6.1671 6.2209 6.2258 6.5278 6.5419 6.5762 6.5794 8.9999 9.0046 9.0088 9.0107 11.0065 11.0133 11.0157 11.0186 12.1628 12.1773 12.2104 12.2287 12.6644 12.7026 k = 0.0500 0.0362 0.8522 ( 6600 PWs) bands (ev): -8.1713 -8.1677 -8.1351 -8.1127 -8.0540 -8.0319 -7.9944 -7.9816 -7.5140 -7.4962 -7.3388 -7.3028 -7.2062 -7.1968 -7.1926 -7.1823 -7.1128 -7.0962 -7.0785 -7.0730 -5.6314 -5.6264 -5.6194 -5.6138 -5.1338 -5.1300 -5.1009 -5.0869 0.8705 0.8715 0.8759 0.8802 2.1075 2.1112 2.1214 2.1320 2.5675 2.5951 2.6046 2.6476 2.9288 2.9743 2.9770 2.9840 3.1260 3.1531 3.1896 3.1939 3.3256 3.3777 3.4286 3.4411 3.9135 3.9661 4.1370 4.1560 4.6459 4.6502 4.6825 4.7066 5.6108 5.6215 5.6423 5.6658 6.1570 6.1675 6.2194 6.2269 6.5157 6.5368 6.5677 6.5730 9.0113 9.0183 9.0209 9.0237 10.9882 10.9984 11.0005 11.0049 12.1549 12.1765 12.2041 12.2301 12.6624 12.7191 k = 0.0667 0.0483 0.8522 ( 6594 PWs) bands (ev): -8.1715 -8.1668 -8.1384 -8.1086 -8.0573 -8.0280 -7.9975 -7.9805 -7.5159 -7.4921 -7.3458 -7.2981 -7.2070 -7.1944 -7.1942 -7.1805 -7.1159 -7.0937 -7.0796 -7.0724 -5.6332 -5.6284 -5.6173 -5.6118 -5.1342 -5.1293 -5.1035 -5.0849 0.8717 0.8730 0.8766 0.8822 2.1057 2.1107 2.1179 2.1318 2.5623 2.5970 2.5986 2.6539 2.9201 2.9728 2.9841 2.9857 3.1062 3.1347 3.1776 3.1845 3.3409 3.3976 3.4473 3.4595 3.9024 3.9701 4.1257 4.1528 4.6560 4.6632 4.6890 4.7196 5.6090 5.6225 5.6361 5.6665 6.1546 6.1671 6.2175 6.2281 6.5009 6.5289 6.5564 6.5645 9.0273 9.0362 9.0376 9.0408 10.9642 10.9779 10.9802 10.9860 12.1469 12.1754 12.1987 12.2312 12.6602 12.7347 k = 0.0833 0.0604 0.8522 ( 6586 PWs) bands (ev): -8.1716 -8.1659 -8.1416 -8.1044 -8.0605 -8.0242 -8.0007 -7.9798 -7.5177 -7.4877 -7.3530 -7.2938 -7.2077 -7.1957 -7.1917 -7.1788 -7.1191 -7.0914 -7.0808 -7.0720 -5.6348 -5.6303 -5.6153 -5.6099 -5.1346 -5.1286 -5.1061 -5.0831 0.8732 0.8748 0.8775 0.8845 2.1036 2.1099 2.1141 2.1309 2.5573 2.5895 2.6017 2.6598 2.9113 2.9714 2.9875 2.9909 3.0871 3.1163 3.1635 3.1724 3.3599 3.4174 3.4682 3.4789 3.8916 3.9725 4.1123 4.1487 4.6680 4.6790 4.6983 4.7342 5.6074 5.6231 5.6294 5.6662 6.1524 6.1656 6.2152 6.2292 6.4838 6.5186 6.5428 6.5545 9.0471 9.0577 9.0581 9.0616 10.9354 10.9525 10.9555 10.9627 12.1395 12.1749 12.1949 12.2329 12.6555 12.7464 k = 0.1000 0.0725 0.8522 ( 6584 PWs) bands (ev): -8.1716 -8.1650 -8.1446 -8.1002 -8.0635 -8.0203 -8.0041 -7.9795 -7.5192 -7.4830 -7.3604 -7.2900 -7.2082 -7.1972 -7.1889 -7.1772 -7.1224 -7.0892 -7.0819 -7.0717 -5.6363 -5.6321 -5.6133 -5.6082 -5.1348 -5.1280 -5.1088 -5.0815 0.8750 0.8768 0.8787 0.8870 2.1012 2.1090 2.1102 2.1295 2.5524 2.5821 2.6044 2.6653 2.9026 2.9701 2.9893 2.9974 3.0691 3.0989 3.1485 3.1595 3.3805 3.4365 3.4898 3.4986 3.8818 3.9734 4.0970 4.1441 4.6812 4.6970 4.7098 4.7498 5.6062 5.6224 5.6233 5.6648 6.1508 6.1632 6.2125 6.2302 6.4653 6.5066 6.5272 6.5435 9.0701 9.0819 9.0821 9.0851 10.9029 10.9236 10.9274 10.9358 12.1334 12.1760 12.1932 12.2357 12.6469 12.7519 k = 0.1167 0.0845 0.8522 ( 6578 PWs) bands (ev): -8.1714 -8.1640 -8.1474 -8.0960 -8.0663 -8.0166 -8.0077 -7.9795 -7.5205 -7.4780 -7.3678 -7.2866 -7.2085 -7.1986 -7.1858 -7.1757 -7.1258 -7.0871 -7.0831 -7.0714 -5.6376 -5.6337 -5.6113 -5.6066 -5.1348 -5.1275 -5.1114 -5.0800 0.8769 0.8789 0.8801 0.8896 2.0987 2.1061 2.1081 2.1277 2.5479 2.5749 2.6067 2.6703 2.8941 2.9690 2.9914 3.0035 3.0522 3.0827 3.1335 3.1466 3.4019 3.4547 3.5105 3.5179 3.8735 3.9728 4.0801 4.1393 4.6950 4.7166 4.7232 4.7659 5.6053 5.6152 5.6232 5.6624 6.1500 6.1598 6.2093 6.2309 6.4462 6.4936 6.5102 6.5322 9.0954 9.1079 9.1085 9.1106 10.8679 10.8922 10.8968 10.9065 12.1291 12.1792 12.1937 12.2401 12.6340 12.7487 k = 0.1333 0.0966 0.8522 ( 6584 PWs) bands (ev): -8.1711 -8.1631 -8.1502 -8.0919 -8.0689 -8.0129 -8.0113 -7.9798 -7.5216 -7.4727 -7.3754 -7.2837 -7.2088 -7.1999 -7.1825 -7.1742 -7.1292 -7.0852 -7.0841 -7.0714 -5.6389 -5.6352 -5.6095 -5.6052 -5.1347 -5.1269 -5.1139 -5.0787 0.8788 0.8811 0.8816 0.8922 2.0962 2.1021 2.1072 2.1255 2.5438 2.5680 2.6086 2.6748 2.8859 2.9680 2.9936 3.0092 3.0369 3.0683 3.1191 3.1343 3.4233 3.4714 3.5292 3.5362 3.8673 3.9712 4.0619 4.1346 4.7089 4.7370 4.7377 4.7820 5.6048 5.6080 5.6227 5.6589 6.1501 6.1556 6.2055 6.2309 6.4275 6.4803 6.4923 6.5212 9.1220 9.1352 9.1358 9.1368 10.8318 10.8597 10.8650 10.8759 12.1268 12.1848 12.1964 12.2461 12.6174 12.7240 k = 0.1500 0.1087 0.8522 ( 6582 PWs) bands (ev): -8.1706 -8.1623 -8.1527 -8.0879 -8.0712 -8.0149 -8.0093 -7.9805 -7.5226 -7.4671 -7.3830 -7.2812 -7.2088 -7.2011 -7.1791 -7.1729 -7.1328 -7.0851 -7.0833 -7.0715 -5.6400 -5.6365 -5.6078 -5.6039 -5.1345 -5.1265 -5.1165 -5.0776 0.8808 0.8831 0.8832 0.8947 2.0937 2.0983 2.1064 2.1229 2.5403 2.5615 2.6102 2.6788 2.8784 2.9674 2.9961 3.0145 3.0231 3.0556 3.1059 3.1229 3.4443 3.4865 3.5449 3.5532 3.8641 3.9688 4.0427 4.1302 4.7223 4.7527 4.7574 4.7974 5.6009 5.6047 5.6221 5.6545 6.1508 6.1514 6.2014 6.2299 6.4103 6.4676 6.4742 6.5109 9.1488 9.1626 9.1629 9.1630 10.7962 10.8275 10.8332 10.8454 12.1262 12.1930 12.2010 12.2536 12.5984 12.6962 k = 0.1667 0.1208 0.8522 ( 6570 PWs) bands (ev): -8.1700 -8.1615 -8.1551 -8.0839 -8.0732 -8.0184 -8.0058 -7.9814 -7.5233 -7.4612 -7.3906 -7.2791 -7.2087 -7.2023 -7.1755 -7.1716 -7.1363 -7.0860 -7.0816 -7.0717 -5.6409 -5.6376 -5.6063 -5.6029 -5.1340 -5.1261 -5.1189 -5.0766 0.8826 0.8845 0.8852 0.8970 2.0913 2.0948 2.1058 2.1203 2.5375 2.5555 2.6115 2.6823 2.8717 2.9672 2.9990 3.0111 3.0191 3.0449 3.0941 3.1124 3.4647 3.4997 3.5565 3.5685 3.8644 3.9658 4.0228 4.1262 4.7346 4.7673 4.7771 4.8114 5.5942 5.6049 5.6215 5.6496 6.1457 6.1540 6.1970 6.2273 6.3959 6.4559 6.4563 6.5018 9.1747 9.1875 9.1888 9.1889 10.7624 10.7972 10.8029 10.8162 12.1271 12.2035 12.2068 12.2619 12.5788 12.6668 k = 0.1833 0.1328 0.8522 ( 6574 PWs) bands (ev): -8.1692 -8.1608 -8.1573 -8.0804 -8.0749 -8.0218 -8.0025 -7.9828 -7.5239 -7.4550 -7.3983 -7.2774 -7.2086 -7.2034 -7.1719 -7.1707 -7.1400 -7.0868 -7.0800 -7.0720 -5.6416 -5.6386 -5.6049 -5.6022 -5.1334 -5.1257 -5.1211 -5.0758 0.8843 0.8858 0.8870 0.8990 2.0892 2.0917 2.1056 2.1175 2.5355 2.5501 2.6125 2.6851 2.8658 2.9673 3.0007 3.0023 3.0226 3.0361 3.0844 3.1029 3.4841 3.5108 3.5635 3.5816 3.8687 3.9627 4.0023 4.1228 4.7454 4.7808 4.7953 4.8233 5.5881 5.6052 5.6211 5.6443 6.1408 6.1580 6.1926 6.2228 6.3853 6.4392 6.4458 6.4941 9.1985 9.2095 9.2122 9.2129 10.7320 10.7700 10.7753 10.7899 12.1291 12.2134 12.2161 12.2698 12.5607 12.6373 k = 0.2000 0.1449 0.8522 ( 6574 PWs) bands (ev): -8.1683 -8.1603 -8.1593 -8.0772 -8.0762 -8.0247 -7.9993 -7.9843 -7.5244 -7.4486 -7.4058 -7.2761 -7.2083 -7.2044 -7.1699 -7.1682 -7.1436 -7.0874 -7.0785 -7.0726 -5.6422 -5.6393 -5.6038 -5.6017 -5.1326 -5.1255 -5.1233 -5.0752 0.8857 0.8868 0.8885 0.9007 2.0875 2.0892 2.1056 2.1149 2.5342 2.5454 2.6132 2.6874 2.8611 2.9680 2.9920 3.0060 3.0246 3.0293 3.0774 3.0945 3.5023 3.5196 3.5657 3.5922 3.8771 3.9599 3.9816 4.1201 4.7542 4.7922 4.8112 4.8325 5.5830 5.6057 5.6211 5.6390 6.1363 6.1635 6.1885 6.2161 6.3792 6.4233 6.4377 6.4881 9.2189 9.2276 9.2319 9.2332 10.7065 10.7475 10.7519 10.7677 12.1315 12.2198 12.2300 12.2759 12.5464 12.6089 k = 0.2167 0.1570 0.8522 ( 6574 PWs) bands (ev): -8.1672 -8.1612 -8.1598 -8.0772 -8.0746 -8.0271 -7.9962 -7.9862 -7.5247 -7.4419 -7.4133 -7.2752 -7.2079 -7.2053 -7.1693 -7.1645 -7.1472 -7.0879 -7.0772 -7.0732 -5.6426 -5.6398 -5.6028 -5.6014 -5.1315 -5.1253 -5.1253 -5.0747 0.8868 0.8876 0.8896 0.9020 2.0862 2.0873 2.1061 2.1124 2.5339 2.5414 2.6137 2.6890 2.8577 2.9693 2.9848 3.0101 3.0245 3.0246 3.0738 3.0871 3.5190 3.5259 3.5632 3.6001 3.8892 3.9575 3.9610 4.1181 4.7608 4.8010 4.8241 4.8385 5.5791 5.6062 5.6219 5.6339 6.1328 6.1706 6.1853 6.2076 6.3778 6.4090 6.4317 6.4837 9.2349 9.2410 9.2468 9.2487 10.6872 10.7307 10.7339 10.7509 12.1338 12.2253 12.2444 12.2785 12.5383 12.5832 k = 0.2333 0.1691 0.8522 ( 6582 PWs) bands (ev): -8.1660 -8.1630 -8.1596 -8.0779 -8.0730 -8.0287 -7.9934 -7.9884 -7.5249 -7.4350 -7.4207 -7.2747 -7.2074 -7.2061 -7.1690 -7.1613 -7.1504 -7.0882 -7.0760 -7.0740 -5.6429 -5.6402 -5.6021 -5.6014 -5.1303 -5.1272 -5.1252 -5.0745 0.8876 0.8879 0.8903 0.9028 2.0853 2.0862 2.1071 2.1103 2.5344 2.5382 2.6140 2.6900 2.8555 2.9715 2.9792 3.0144 3.0216 3.0224 3.0736 3.0810 3.5298 3.5340 3.5567 3.6049 3.9043 3.9409 3.9560 4.1169 4.7649 4.8065 4.8336 4.8409 5.5766 5.6066 5.6234 5.6296 6.1306 6.1789 6.1831 6.1981 6.3806 6.3968 6.4281 6.4811 9.2456 9.2487 9.2561 9.2584 10.6752 10.7206 10.7223 10.7404 12.1354 12.2290 12.2580 12.2763 12.5380 12.5617 k = 0.2500 0.1811 0.8522 ( 6584 PWs) bands (ev): -8.1646 -8.1646 -8.1595 -8.0781 -8.0724 -8.0293 -7.9908 -7.9908 -7.5250 -7.4280 -7.4280 -7.2746 -7.2068 -7.2068 -7.1688 -7.1596 -7.1521 -7.0883 -7.0750 -7.0750 -5.6430 -5.6403 -5.6016 -5.6016 -5.1288 -5.1288 -5.1252 -5.0744 0.8880 0.8880 0.8905 0.9030 2.0851 2.0858 2.1085 2.1085 2.5359 2.5359 2.6141 2.6903 2.8548 2.9739 2.9756 3.0187 3.0187 3.0206 3.0762 3.0762 3.5311 3.5467 3.5467 3.6065 3.9218 3.9218 3.9555 4.1165 4.7662 4.8084 4.8392 4.8392 5.5758 5.6067 5.6260 5.6260 6.1298 6.1824 6.1882 6.1882 6.3871 6.3871 6.4269 6.4802 9.2503 9.2503 9.2593 9.2618 10.6711 10.7178 10.7178 10.7368 12.1360 12.2303 12.2691 12.2691 12.5461 12.5461 Writing output data file InAgS2.save init_run : 4.28s CPU 13.89s WALL ( 1 calls) electrons : 1917.64s CPU 1931.85s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.17s CPU 1.60s WALL ( 1 calls) Called by electrons: c_bands : 1917.57s CPU 1931.54s WALL ( 1 calls) v_of_rho : 0.05s CPU 1.04s WALL ( 1 calls) v_h : 0.00s CPU 0.09s WALL ( 1 calls) v_xc : 0.05s CPU 0.63s WALL ( 1 calls) newd : 0.76s CPU 0.87s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.17s WALL ( 273 calls) cegterg : 1737.51s CPU 1748.25s WALL ( 571 calls) Called by sum_band: Called by *egterg: h_psi : 828.45s CPU 836.93s WALL ( 9339 calls) s_psi : 95.23s CPU 95.49s WALL ( 9339 calls) g_psi : 1.25s CPU 1.27s WALL ( 8495 calls) cdiaghg : 639.54s CPU 638.46s WALL ( 8768 calls) cegterg:over : 122.77s CPU 121.16s WALL ( 8495 calls) cegterg:upda : 41.28s CPU 43.15s WALL ( 8495 calls) cegterg:last : 29.32s CPU 29.74s WALL ( 1431 calls) Called by h_psi: h_psi:vloc : 657.24s CPU 663.32s WALL ( 9339 calls) h_psi:vnl : 170.55s CPU 172.27s WALL ( 9339 calls) add_vuspsi : 71.75s CPU 74.29s WALL ( 9339 calls) General routines calbec : 98.74s CPU 97.78s WALL ( 9339 calls) fft : 0.18s CPU 0.99s WALL ( 19 calls) ffts : 0.01s CPU 0.10s WALL ( 4 calls) fftw : 625.66s CPU 627.83s WALL ( 1554492 calls) interpolate : 0.03s CPU 0.11s WALL ( 4 calls) davcio : 0.03s CPU 3.66s WALL ( 546 calls) Parallel routines fft_scatter : 332.67s CPU 343.37s WALL ( 1554515 calls) PWSCF : 33m34.61s CPU 37m23.90s WALL This run was terminated on: 9:54:11 9Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=