Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:30:59 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./ZrNi2.save/ file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 38 32 9 951 734 114 Max 39 33 10 956 745 116 Sum 1393 1165 349 34327 26565 4111 bravais-lattice index = 14 lattice parameter (alat) = 9.2408 a.u. unit-cell volume = 557.9654 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 236.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.240754 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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 Zr 4.00 91.22400 Zr( 1.00) Ni 10.00 58.69340 Ni( 1.00) 2 Sym. Ops. (no inversion) found (note: 10 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) 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 - cryst. axis [0,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 2) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 and the name of the first element: E 1 identity -E -1 identity E s 2 inv. 180 deg rotation - cryst. axis [0,1,0] -s -2 inv. 180 deg rotation - cryst. axis [0,1,0] E Cartesian axes number of k points= 308 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0108696 -0.0062755 0.0088750), wk = 0.0032468 k( 3) = ( 0.0217391 -0.0125511 0.0177499), wk = 0.0032468 k( 4) = ( 0.0326087 -0.0188266 0.0266249), wk = 0.0032468 k( 5) = ( 0.0434783 -0.0251022 0.0354999), wk = 0.0032468 k( 6) = ( 0.0543478 -0.0313777 0.0443748), wk = 0.0032468 k( 7) = ( 0.0652174 -0.0376533 0.0532498), wk = 0.0032468 k( 8) = ( 0.0760870 -0.0439288 0.0621247), wk = 0.0032468 k( 9) = ( 0.0869565 -0.0502044 0.0709997), wk = 0.0032468 k( 10) = ( 0.0978261 -0.0564799 0.0798747), wk = 0.0032468 k( 11) = ( 0.1086957 -0.0627555 0.0887496), wk = 0.0032468 k( 12) = ( 0.1195652 -0.0690310 0.0976246), wk = 0.0032468 k( 13) = ( 0.1304348 -0.0753066 0.1064996), wk = 0.0032468 k( 14) = ( 0.1413043 -0.0815821 0.1153745), wk = 0.0032468 k( 15) = ( 0.1521739 -0.0878576 0.1242495), wk = 0.0032468 k( 16) = ( 0.1630435 -0.0941332 0.1331244), wk = 0.0032468 k( 17) = ( 0.1739130 -0.1004087 0.1419994), wk = 0.0032468 k( 18) = ( 0.1847826 -0.1066843 0.1508744), wk = 0.0032468 k( 19) = ( 0.1956522 -0.1129598 0.1597493), wk = 0.0032468 k( 20) = ( 0.2065217 -0.1192354 0.1686243), wk = 0.0032468 k( 21) = ( 0.2173913 -0.1255109 0.1774993), wk = 0.0032468 k( 22) = ( 0.2282609 -0.1317865 0.1863742), wk = 0.0032468 k( 23) = ( 0.2391304 -0.1380620 0.1952492), wk = 0.0032468 k( 24) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0032468 k( 25) = ( 0.2608696 -0.1506131 0.2129991), wk = 0.0032468 k( 26) = ( 0.2717391 -0.1568887 0.2218741), wk = 0.0032468 k( 27) = ( 0.2826087 -0.1631642 0.2307490), wk = 0.0032468 k( 28) = ( 0.2934783 -0.1694398 0.2396240), wk = 0.0032468 k( 29) = ( 0.3043478 -0.1757153 0.2484990), wk = 0.0032468 k( 30) = ( 0.3152174 -0.1819908 0.2573739), wk = 0.0032468 k( 31) = ( 0.3260870 -0.1882664 0.2662489), wk = 0.0032468 k( 32) = ( 0.3369565 -0.1945419 0.2751238), wk = 0.0032468 k( 33) = ( 0.3478261 -0.2008175 0.2839988), wk = 0.0032468 k( 34) = ( 0.3586956 -0.2070930 0.2928738), wk = 0.0032468 k( 35) = ( 0.3695652 -0.2133686 0.3017487), wk = 0.0032468 k( 36) = ( 0.3804348 -0.2196441 0.3106237), wk = 0.0032468 k( 37) = ( 0.3913044 -0.2259197 0.3194987), wk = 0.0032468 k( 38) = ( 0.4021739 -0.2321952 0.3283736), wk = 0.0032468 k( 39) = ( 0.4130435 -0.2384708 0.3372486), wk = 0.0032468 k( 40) = ( 0.4239130 -0.2447463 0.3461235), wk = 0.0032468 k( 41) = ( 0.4347826 -0.2510219 0.3549985), wk = 0.0032468 k( 42) = ( 0.4456522 -0.2572974 0.3638735), wk = 0.0032468 k( 43) = ( 0.4565217 -0.2635729 0.3727484), wk = 0.0032468 k( 44) = ( 0.4673913 -0.2698485 0.3816234), wk = 0.0032468 k( 45) = ( 0.4782609 -0.2761240 0.3904984), wk = 0.0032468 k( 46) = ( 0.4891304 -0.2823996 0.3993733), wk = 0.0032468 k( 47) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 k( 48) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 k( 49) = ( 0.5000000 -0.2761240 0.4171233), wk = 0.0032468 k( 50) = ( 0.5000000 -0.2635729 0.4259982), wk = 0.0032468 k( 51) = ( 0.5000000 -0.2510219 0.4348732), wk = 0.0032468 k( 52) = ( 0.5000000 -0.2384708 0.4437481), wk = 0.0032468 k( 53) = ( 0.5000000 -0.2259197 0.4526231), wk = 0.0032468 k( 54) = ( 0.5000000 -0.2133686 0.4614981), wk = 0.0032468 k( 55) = ( 0.5000000 -0.2008175 0.4703730), wk = 0.0032468 k( 56) = ( 0.5000000 -0.1882664 0.4792480), wk = 0.0032468 k( 57) = ( 0.5000000 -0.1757153 0.4881230), wk = 0.0032468 k( 58) = ( 0.5000000 -0.1631642 0.4969979), wk = 0.0032468 k( 59) = ( 0.5000000 -0.1506131 0.5058729), wk = 0.0032468 k( 60) = ( 0.5000000 -0.1380620 0.5147478), wk = 0.0032468 k( 61) = ( 0.5000000 -0.1255109 0.5236228), wk = 0.0032468 k( 62) = ( 0.5000000 -0.1129598 0.5324978), wk = 0.0032468 k( 63) = ( 0.5000000 -0.1004087 0.5413727), wk = 0.0032468 k( 64) = ( 0.5000000 -0.0878577 0.5502477), wk = 0.0032468 k( 65) = ( 0.5000000 -0.0753066 0.5591227), wk = 0.0032468 k( 66) = ( 0.5000000 -0.0627555 0.5679976), wk = 0.0032468 k( 67) = ( 0.5000000 -0.0502044 0.5768726), wk = 0.0032468 k( 68) = ( 0.5000000 -0.0376533 0.5857475), wk = 0.0032468 k( 69) = ( 0.5000000 -0.0251022 0.5946225), wk = 0.0032468 k( 70) = ( 0.5000000 -0.0125511 0.6034975), wk = 0.0032468 k( 71) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0032468 k( 72) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0032468 k( 73) = ( 0.4926471 0.0127357 0.6123724), wk = 0.0032468 k( 74) = ( 0.4852941 0.0254713 0.6123724), wk = 0.0032468 k( 75) = ( 0.4779412 0.0382070 0.6123724), wk = 0.0032468 k( 76) = ( 0.4705882 0.0509427 0.6123724), wk = 0.0032468 k( 77) = ( 0.4632353 0.0636783 0.6123724), wk = 0.0032468 k( 78) = ( 0.4558823 0.0764140 0.6123724), wk = 0.0032468 k( 79) = ( 0.4485294 0.0891497 0.6123724), wk = 0.0032468 k( 80) = ( 0.4411765 0.1018853 0.6123724), wk = 0.0032468 k( 81) = ( 0.4338235 0.1146210 0.6123724), wk = 0.0032468 k( 82) = ( 0.4264706 0.1273567 0.6123724), wk = 0.0032468 k( 83) = ( 0.4191177 0.1400923 0.6123724), wk = 0.0032468 k( 84) = ( 0.4117647 0.1528280 0.6123724), wk = 0.0032468 k( 85) = ( 0.4044118 0.1655637 0.6123724), wk = 0.0032468 k( 86) = ( 0.3970588 0.1782994 0.6123724), wk = 0.0032468 k( 87) = ( 0.3897059 0.1910350 0.6123724), wk = 0.0032468 k( 88) = ( 0.3823529 0.2037707 0.6123724), wk = 0.0032468 k( 89) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 90) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 91) = ( 0.3673469 0.2120879 0.5998750), wk = 0.0032468 k( 92) = ( 0.3596939 0.2076694 0.5873776), wk = 0.0032468 k( 93) = ( 0.3520408 0.2032509 0.5748802), wk = 0.0032468 k( 94) = ( 0.3443878 0.1988324 0.5623828), wk = 0.0032468 k( 95) = ( 0.3367347 0.1944139 0.5498855), wk = 0.0032468 k( 96) = ( 0.3290816 0.1899954 0.5373881), wk = 0.0032468 k( 97) = ( 0.3214286 0.1855769 0.5248907), wk = 0.0032468 k( 98) = ( 0.3137755 0.1811584 0.5123933), wk = 0.0032468 k( 99) = ( 0.3061224 0.1767399 0.4998959), wk = 0.0032468 k( 100) = ( 0.2984694 0.1723214 0.4873985), wk = 0.0032468 k( 101) = ( 0.2908163 0.1679029 0.4749011), wk = 0.0032468 k( 102) = ( 0.2831633 0.1634844 0.4624037), wk = 0.0032468 k( 103) = ( 0.2755102 0.1590659 0.4499063), wk = 0.0032468 k( 104) = ( 0.2678571 0.1546474 0.4374089), wk = 0.0032468 k( 105) = ( 0.2602041 0.1502289 0.4249115), wk = 0.0032468 k( 106) = ( 0.2525510 0.1458104 0.4124141), wk = 0.0032468 k( 107) = ( 0.2448980 0.1413919 0.3999167), wk = 0.0032468 k( 108) = ( 0.2372449 0.1369734 0.3874193), wk = 0.0032468 k( 109) = ( 0.2295918 0.1325549 0.3749219), wk = 0.0032468 k( 110) = ( 0.2219388 0.1281364 0.3624245), wk = 0.0032468 k( 111) = ( 0.2142857 0.1237179 0.3499271), wk = 0.0032468 k( 112) = ( 0.2066327 0.1192994 0.3374297), wk = 0.0032468 k( 113) = ( 0.1989796 0.1148809 0.3249323), wk = 0.0032468 k( 114) = ( 0.1913265 0.1104624 0.3124349), wk = 0.0032468 k( 115) = ( 0.1836735 0.1060439 0.2999375), wk = 0.0032468 k( 116) = ( 0.1760204 0.1016254 0.2874401), wk = 0.0032468 k( 117) = ( 0.1683673 0.0972069 0.2749427), wk = 0.0032468 k( 118) = ( 0.1607143 0.0927884 0.2624453), wk = 0.0032468 k( 119) = ( 0.1530612 0.0883699 0.2499479), wk = 0.0032468 k( 120) = ( 0.1454082 0.0839514 0.2374505), wk = 0.0032468 k( 121) = ( 0.1377551 0.0795329 0.2249531), wk = 0.0032468 k( 122) = ( 0.1301020 0.0751144 0.2124557), wk = 0.0032468 k( 123) = ( 0.1224490 0.0706960 0.1999583), wk = 0.0032468 k( 124) = ( 0.1147959 0.0662775 0.1874610), wk = 0.0032468 k( 125) = ( 0.1071429 0.0618590 0.1749635), wk = 0.0032468 k( 126) = ( 0.0994898 0.0574405 0.1624662), wk = 0.0032468 k( 127) = ( 0.0918367 0.0530220 0.1499688), wk = 0.0032468 k( 128) = ( 0.0841837 0.0486035 0.1374714), wk = 0.0032468 k( 129) = ( 0.0765306 0.0441850 0.1249740), wk = 0.0032468 k( 130) = ( 0.0688775 0.0397665 0.1124766), wk = 0.0032468 k( 131) = ( 0.0612245 0.0353480 0.0999792), wk = 0.0032468 k( 132) = ( 0.0535714 0.0309295 0.0874818), wk = 0.0032468 k( 133) = ( 0.0459184 0.0265110 0.0749844), wk = 0.0032468 k( 134) = ( 0.0382653 0.0220925 0.0624870), wk = 0.0032468 k( 135) = ( 0.0306122 0.0176740 0.0499896), wk = 0.0032468 k( 136) = ( 0.0229592 0.0132555 0.0374922), wk = 0.0032468 k( 137) = ( 0.0153061 0.0088370 0.0249948), wk = 0.0032468 k( 138) = ( 0.0076531 0.0044185 0.0124974), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 141) = ( 0.0125000 0.0072169 0.0051031), wk = 0.0032468 k( 142) = ( 0.0250000 0.0144338 0.0102062), wk = 0.0032468 k( 143) = ( 0.0375000 0.0216506 0.0153093), wk = 0.0032468 k( 144) = ( 0.0500000 0.0288675 0.0204124), wk = 0.0032468 k( 145) = ( 0.0625000 0.0360844 0.0255155), wk = 0.0032468 k( 146) = ( 0.0750000 0.0433013 0.0306186), wk = 0.0032468 k( 147) = ( 0.0875000 0.0505181 0.0357217), wk = 0.0032468 k( 148) = ( 0.1000000 0.0577350 0.0408248), wk = 0.0032468 k( 149) = ( 0.1125000 0.0649519 0.0459279), wk = 0.0032468 k( 150) = ( 0.1250000 0.0721688 0.0510310), wk = 0.0032468 k( 151) = ( 0.1375000 0.0793857 0.0561341), wk = 0.0032468 k( 152) = ( 0.1500000 0.0866025 0.0612372), wk = 0.0032468 k( 153) = ( 0.1625000 0.0938194 0.0663403), wk = 0.0032468 k( 154) = ( 0.1750000 0.1010363 0.0714435), wk = 0.0032468 k( 155) = ( 0.1875000 0.1082532 0.0765466), wk = 0.0032468 k( 156) = ( 0.2000000 0.1154701 0.0816497), wk = 0.0032468 k( 157) = ( 0.2125000 0.1226869 0.0867528), wk = 0.0032468 k( 158) = ( 0.2250000 0.1299038 0.0918559), wk = 0.0032468 k( 159) = ( 0.2375000 0.1371207 0.0969590), wk = 0.0032468 k( 160) = ( 0.2500000 0.1443376 0.1020621), wk = 0.0032468 k( 161) = ( 0.2625000 0.1515544 0.1071652), wk = 0.0032468 k( 162) = ( 0.2750000 0.1587713 0.1122683), wk = 0.0032468 k( 163) = ( 0.2875000 0.1659882 0.1173714), wk = 0.0032468 k( 164) = ( 0.3000000 0.1732051 0.1224745), wk = 0.0032468 k( 165) = ( 0.3125000 0.1804220 0.1275776), wk = 0.0032468 k( 166) = ( 0.3250000 0.1876388 0.1326807), wk = 0.0032468 k( 167) = ( 0.3375000 0.1948557 0.1377838), wk = 0.0032468 k( 168) = ( 0.3500000 0.2020726 0.1428869), wk = 0.0032468 k( 169) = ( 0.3625000 0.2092895 0.1479900), wk = 0.0032468 k( 170) = ( 0.3750000 0.2165064 0.1530931), wk = 0.0032468 k( 171) = ( 0.3875000 0.2237232 0.1581962), wk = 0.0032468 k( 172) = ( 0.4000000 0.2309401 0.1632993), wk = 0.0032468 k( 173) = ( 0.4125000 0.2381570 0.1684024), wk = 0.0032468 k( 174) = ( 0.4250000 0.2453739 0.1735055), wk = 0.0032468 k( 175) = ( 0.4375000 0.2525907 0.1786086), wk = 0.0032468 k( 176) = ( 0.4500000 0.2598076 0.1837117), wk = 0.0032468 k( 177) = ( 0.4625000 0.2670245 0.1888148), wk = 0.0032468 k( 178) = ( 0.4750000 0.2742414 0.1939179), wk = 0.0032468 k( 179) = ( 0.4875000 0.2814583 0.1990210), wk = 0.0032468 k( 180) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 181) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 182) = ( 0.5044643 0.2757879 0.2114143), wk = 0.0032468 k( 183) = ( 0.5089286 0.2629006 0.2187044), wk = 0.0032468 k( 184) = ( 0.5133929 0.2500133 0.2259946), wk = 0.0032468 k( 185) = ( 0.5178571 0.2371260 0.2332847), wk = 0.0032468 k( 186) = ( 0.5223214 0.2242387 0.2405749), wk = 0.0032468 k( 187) = ( 0.5267857 0.2113514 0.2478650), wk = 0.0032468 k( 188) = ( 0.5312500 0.1984642 0.2551552), wk = 0.0032468 k( 189) = ( 0.5357143 0.1855769 0.2624453), wk = 0.0032468 k( 190) = ( 0.5401786 0.1726896 0.2697355), wk = 0.0032468 k( 191) = ( 0.5446429 0.1598023 0.2770256), wk = 0.0032468 k( 192) = ( 0.5491071 0.1469150 0.2843158), wk = 0.0032468 k( 193) = ( 0.5535714 0.1340277 0.2916059), wk = 0.0032468 k( 194) = ( 0.5580357 0.1211405 0.2988961), wk = 0.0032468 k( 195) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0032468 k( 196) = ( 0.5669643 0.0953659 0.3134764), wk = 0.0032468 k( 197) = ( 0.5714286 0.0824786 0.3207665), wk = 0.0032468 k( 198) = ( 0.5758929 0.0695913 0.3280567), wk = 0.0032468 k( 199) = ( 0.5803571 0.0567040 0.3353468), wk = 0.0032468 k( 200) = ( 0.5848214 0.0438168 0.3426370), wk = 0.0032468 k( 201) = ( 0.5892857 0.0309295 0.3499271), wk = 0.0032468 k( 202) = ( 0.5937500 0.0180422 0.3572173), wk = 0.0032468 k( 203) = ( 0.5982143 0.0051549 0.3645074), wk = 0.0032468 k( 204) = ( 0.6026786 -0.0077324 0.3717975), wk = 0.0032468 k( 205) = ( 0.6071429 -0.0206196 0.3790877), wk = 0.0032468 k( 206) = ( 0.6116071 -0.0335069 0.3863778), wk = 0.0032468 k( 207) = ( 0.6160714 -0.0463942 0.3936680), wk = 0.0032468 k( 208) = ( 0.6205357 -0.0592815 0.4009581), wk = 0.0032468 k( 209) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 210) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 211) = ( 0.6176471 -0.0679236 0.4202556), wk = 0.0032468 k( 212) = ( 0.6102941 -0.0636783 0.4322629), wk = 0.0032468 k( 213) = ( 0.6029412 -0.0594331 0.4442702), wk = 0.0032468 k( 214) = ( 0.5955882 -0.0551879 0.4562775), wk = 0.0032468 k( 215) = ( 0.5882353 -0.0509427 0.4682848), wk = 0.0032468 k( 216) = ( 0.5808823 -0.0466974 0.4802921), wk = 0.0032468 k( 217) = ( 0.5735294 -0.0424522 0.4922994), wk = 0.0032468 k( 218) = ( 0.5661765 -0.0382070 0.5043067), wk = 0.0032468 k( 219) = ( 0.5588235 -0.0339618 0.5163140), wk = 0.0032468 k( 220) = ( 0.5514706 -0.0297166 0.5283213), wk = 0.0032468 k( 221) = ( 0.5441177 -0.0254713 0.5403286), wk = 0.0032468 k( 222) = ( 0.5367647 -0.0212261 0.5523359), wk = 0.0032468 k( 223) = ( 0.5294118 -0.0169809 0.5643432), wk = 0.0032468 k( 224) = ( 0.5220588 -0.0127357 0.5763505), wk = 0.0032468 k( 225) = ( 0.5147059 -0.0084904 0.5883578), wk = 0.0032468 k( 226) = ( 0.5073529 -0.0042452 0.6003651), wk = 0.0032468 k( 227) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0032468 k( 228) = ( 0.5000000 0.0000000 0.6123724), wk = 0.0032468 k( 229) = ( 0.5000000 0.0087477 0.6000013), wk = 0.0032468 k( 230) = ( 0.5000000 0.0174955 0.5876301), wk = 0.0032468 k( 231) = ( 0.5000000 0.0262432 0.5752590), wk = 0.0032468 k( 232) = ( 0.5000000 0.0349909 0.5628878), wk = 0.0032468 k( 233) = ( 0.5000000 0.0437387 0.5505166), wk = 0.0032468 k( 234) = ( 0.5000000 0.0524864 0.5381455), wk = 0.0032468 k( 235) = ( 0.5000000 0.0612341 0.5257743), wk = 0.0032468 k( 236) = ( 0.5000000 0.0699819 0.5134032), wk = 0.0032468 k( 237) = ( 0.5000000 0.0787296 0.5010320), wk = 0.0032468 k( 238) = ( 0.5000000 0.0874773 0.4886608), wk = 0.0032468 k( 239) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0032468 k( 240) = ( 0.5000000 0.1049728 0.4639185), wk = 0.0032468 k( 241) = ( 0.5000000 0.1137205 0.4515473), wk = 0.0032468 k( 242) = ( 0.5000000 0.1224682 0.4391762), wk = 0.0032468 k( 243) = ( 0.5000000 0.1312160 0.4268050), wk = 0.0032468 k( 244) = ( 0.5000000 0.1399637 0.4144339), wk = 0.0032468 k( 245) = ( 0.5000000 0.1487114 0.4020627), wk = 0.0032468 k( 246) = ( 0.5000000 0.1574592 0.3896915), wk = 0.0032468 k( 247) = ( 0.5000000 0.1662069 0.3773204), wk = 0.0032468 k( 248) = ( 0.5000000 0.1749546 0.3649492), wk = 0.0032468 k( 249) = ( 0.5000000 0.1837024 0.3525781), wk = 0.0032468 k( 250) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0032468 k( 251) = ( 0.5000000 0.2011978 0.3278358), wk = 0.0032468 k( 252) = ( 0.5000000 0.2099456 0.3154646), wk = 0.0032468 k( 253) = ( 0.5000000 0.2186933 0.3030934), wk = 0.0032468 k( 254) = ( 0.5000000 0.2274410 0.2907223), wk = 0.0032468 k( 255) = ( 0.5000000 0.2361887 0.2783511), wk = 0.0032468 k( 256) = ( 0.5000000 0.2449365 0.2659800), wk = 0.0032468 k( 257) = ( 0.5000000 0.2536842 0.2536088), wk = 0.0032468 k( 258) = ( 0.5000000 0.2624319 0.2412376), wk = 0.0032468 k( 259) = ( 0.5000000 0.2711797 0.2288665), wk = 0.0032468 k( 260) = ( 0.5000000 0.2799274 0.2164953), wk = 0.0032468 k( 261) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 262) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0032468 k( 263) = ( 0.4955357 0.2860977 0.2187044), wk = 0.0032468 k( 264) = ( 0.4910714 0.2835202 0.2332847), wk = 0.0032468 k( 265) = ( 0.4866071 0.2809428 0.2478650), wk = 0.0032468 k( 266) = ( 0.4821429 0.2783653 0.2624453), wk = 0.0032468 k( 267) = ( 0.4776786 0.2757879 0.2770256), wk = 0.0032468 k( 268) = ( 0.4732143 0.2732104 0.2916059), wk = 0.0032468 k( 269) = ( 0.4687500 0.2706329 0.3061862), wk = 0.0032468 k( 270) = ( 0.4642857 0.2680555 0.3207665), wk = 0.0032468 k( 271) = ( 0.4598214 0.2654780 0.3353468), wk = 0.0032468 k( 272) = ( 0.4553571 0.2629006 0.3499271), wk = 0.0032468 k( 273) = ( 0.4508929 0.2603231 0.3645074), wk = 0.0032468 k( 274) = ( 0.4464286 0.2577457 0.3790877), wk = 0.0032468 k( 275) = ( 0.4419643 0.2551682 0.3936680), wk = 0.0032468 k( 276) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0032468 k( 277) = ( 0.4330357 0.2500133 0.4228286), wk = 0.0032468 k( 278) = ( 0.4285714 0.2474358 0.4374089), wk = 0.0032468 k( 279) = ( 0.4241071 0.2448584 0.4519892), wk = 0.0032468 k( 280) = ( 0.4196429 0.2422809 0.4665695), wk = 0.0032468 k( 281) = ( 0.4151786 0.2397035 0.4811498), wk = 0.0032468 k( 282) = ( 0.4107143 0.2371260 0.4957301), wk = 0.0032468 k( 283) = ( 0.4062500 0.2345485 0.5103104), wk = 0.0032468 k( 284) = ( 0.4017857 0.2319711 0.5248907), wk = 0.0032468 k( 285) = ( 0.3973214 0.2293936 0.5394710), wk = 0.0032468 k( 286) = ( 0.3928571 0.2268162 0.5540512), wk = 0.0032468 k( 287) = ( 0.3883929 0.2242387 0.5686316), wk = 0.0032468 k( 288) = ( 0.3839286 0.2216613 0.5832118), wk = 0.0032468 k( 289) = ( 0.3794643 0.2190838 0.5977921), wk = 0.0032468 k( 290) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0032468 k( 291) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0032468 k( 292) = ( 0.6176471 -0.0849044 0.4082483), wk = 0.0032468 k( 293) = ( 0.6102941 -0.0976401 0.4082483), wk = 0.0032468 k( 294) = ( 0.6029412 -0.1103758 0.4082483), wk = 0.0032468 k( 295) = ( 0.5955882 -0.1231115 0.4082483), wk = 0.0032468 k( 296) = ( 0.5882353 -0.1358471 0.4082483), wk = 0.0032468 k( 297) = ( 0.5808823 -0.1485828 0.4082483), wk = 0.0032468 k( 298) = ( 0.5735294 -0.1613185 0.4082483), wk = 0.0032468 k( 299) = ( 0.5661765 -0.1740541 0.4082483), wk = 0.0032468 k( 300) = ( 0.5588235 -0.1867898 0.4082483), wk = 0.0032468 k( 301) = ( 0.5514706 -0.1995255 0.4082483), wk = 0.0032468 k( 302) = ( 0.5441177 -0.2122611 0.4082483), wk = 0.0032468 k( 303) = ( 0.5367647 -0.2249968 0.4082483), wk = 0.0032468 k( 304) = ( 0.5294118 -0.2377325 0.4082483), wk = 0.0032468 k( 305) = ( 0.5220588 -0.2504681 0.4082483), wk = 0.0032468 k( 306) = ( 0.5147059 -0.2632038 0.4082483), wk = 0.0032468 k( 307) = ( 0.5073529 -0.2759395 0.4082483), wk = 0.0032468 k( 308) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0032468 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 2) = ( 0.0108696 -0.0000000 0.0108696), wk = 0.0032468 k( 3) = ( 0.0217391 -0.0000000 0.0217391), wk = 0.0032468 k( 4) = ( 0.0326087 -0.0000000 0.0326087), wk = 0.0032468 k( 5) = ( 0.0434783 -0.0000000 0.0434783), wk = 0.0032468 k( 6) = ( 0.0543478 0.0000000 0.0543478), wk = 0.0032468 k( 7) = ( 0.0652174 -0.0000000 0.0652174), wk = 0.0032468 k( 8) = ( 0.0760870 -0.0000000 0.0760870), wk = 0.0032468 k( 9) = ( 0.0869565 -0.0000000 0.0869565), wk = 0.0032468 k( 10) = ( 0.0978261 0.0000000 0.0978261), wk = 0.0032468 k( 11) = ( 0.1086957 -0.0000000 0.1086956), wk = 0.0032468 k( 12) = ( 0.1195652 -0.0000000 0.1195652), wk = 0.0032468 k( 13) = ( 0.1304348 -0.0000000 0.1304348), wk = 0.0032468 k( 14) = ( 0.1413043 -0.0000000 0.1413043), wk = 0.0032468 k( 15) = ( 0.1521739 -0.0000000 0.1521739), wk = 0.0032468 k( 16) = ( 0.1630435 -0.0000000 0.1630435), wk = 0.0032468 k( 17) = ( 0.1739130 -0.0000000 0.1739130), wk = 0.0032468 k( 18) = ( 0.1847826 -0.0000000 0.1847826), wk = 0.0032468 k( 19) = ( 0.1956522 -0.0000000 0.1956522), wk = 0.0032468 k( 20) = ( 0.2065217 -0.0000000 0.2065217), wk = 0.0032468 k( 21) = ( 0.2173913 -0.0000000 0.2173913), wk = 0.0032468 k( 22) = ( 0.2282609 0.0000000 0.2282609), wk = 0.0032468 k( 23) = ( 0.2391304 0.0000000 0.2391304), wk = 0.0032468 k( 24) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0032468 k( 25) = ( 0.2608696 -0.0000000 0.2608696), wk = 0.0032468 k( 26) = ( 0.2717391 -0.0000000 0.2717391), wk = 0.0032468 k( 27) = ( 0.2826087 -0.0000000 0.2826087), wk = 0.0032468 k( 28) = ( 0.2934783 -0.0000000 0.2934783), wk = 0.0032468 k( 29) = ( 0.3043478 -0.0000000 0.3043478), wk = 0.0032468 k( 30) = ( 0.3152174 -0.0000000 0.3152174), wk = 0.0032468 k( 31) = ( 0.3260870 -0.0000000 0.3260870), wk = 0.0032468 k( 32) = ( 0.3369565 -0.0000000 0.3369565), wk = 0.0032468 k( 33) = ( 0.3478261 -0.0000000 0.3478261), wk = 0.0032468 k( 34) = ( 0.3586956 -0.0000000 0.3586956), wk = 0.0032468 k( 35) = ( 0.3695652 -0.0000000 0.3695652), wk = 0.0032468 k( 36) = ( 0.3804348 -0.0000000 0.3804348), wk = 0.0032468 k( 37) = ( 0.3913044 -0.0000000 0.3913044), wk = 0.0032468 k( 38) = ( 0.4021739 -0.0000000 0.4021739), wk = 0.0032468 k( 39) = ( 0.4130435 -0.0000000 0.4130435), wk = 0.0032468 k( 40) = ( 0.4239130 -0.0000000 0.4239130), wk = 0.0032468 k( 41) = ( 0.4347826 -0.0000000 0.4347826), wk = 0.0032468 k( 42) = ( 0.4456522 -0.0000000 0.4456522), wk = 0.0032468 k( 43) = ( 0.4565217 0.0000000 0.4565217), wk = 0.0032468 k( 44) = ( 0.4673913 0.0000000 0.4673913), wk = 0.0032468 k( 45) = ( 0.4782609 -0.0000000 0.4782609), wk = 0.0032468 k( 46) = ( 0.4891304 -0.0000000 0.4891304), wk = 0.0032468 k( 47) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 48) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 k( 49) = ( 0.5000000 0.0108696 0.5108696), wk = 0.0032468 k( 50) = ( 0.5000000 0.0217391 0.5217391), wk = 0.0032468 k( 51) = ( 0.5000000 0.0326087 0.5326087), wk = 0.0032468 k( 52) = ( 0.5000000 0.0434783 0.5434783), wk = 0.0032468 k( 53) = ( 0.5000000 0.0543478 0.5543478), wk = 0.0032468 k( 54) = ( 0.5000000 0.0652174 0.5652174), wk = 0.0032468 k( 55) = ( 0.5000000 0.0760870 0.5760870), wk = 0.0032468 k( 56) = ( 0.5000000 0.0869565 0.5869565), wk = 0.0032468 k( 57) = ( 0.5000000 0.0978261 0.5978261), wk = 0.0032468 k( 58) = ( 0.5000000 0.1086956 0.6086956), wk = 0.0032468 k( 59) = ( 0.5000000 0.1195652 0.6195652), wk = 0.0032468 k( 60) = ( 0.5000000 0.1304348 0.6304348), wk = 0.0032468 k( 61) = ( 0.5000000 0.1413043 0.6413043), wk = 0.0032468 k( 62) = ( 0.5000000 0.1521739 0.6521739), wk = 0.0032468 k( 63) = ( 0.5000000 0.1630435 0.6630435), wk = 0.0032468 k( 64) = ( 0.5000000 0.1739130 0.6739130), wk = 0.0032468 k( 65) = ( 0.5000000 0.1847826 0.6847826), wk = 0.0032468 k( 66) = ( 0.5000000 0.1956522 0.6956522), wk = 0.0032468 k( 67) = ( 0.5000000 0.2065217 0.7065217), wk = 0.0032468 k( 68) = ( 0.5000000 0.2173913 0.7173913), wk = 0.0032468 k( 69) = ( 0.5000000 0.2282609 0.7282609), wk = 0.0032468 k( 70) = ( 0.5000000 0.2391304 0.7391304), wk = 0.0032468 k( 71) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 72) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 73) = ( 0.4926471 0.2573529 0.7500000), wk = 0.0032468 k( 74) = ( 0.4852941 0.2647059 0.7500000), wk = 0.0032468 k( 75) = ( 0.4779412 0.2720588 0.7500000), wk = 0.0032468 k( 76) = ( 0.4705882 0.2794118 0.7500000), wk = 0.0032468 k( 77) = ( 0.4632353 0.2867647 0.7500000), wk = 0.0032468 k( 78) = ( 0.4558823 0.2941177 0.7500000), wk = 0.0032468 k( 79) = ( 0.4485294 0.3014706 0.7500000), wk = 0.0032468 k( 80) = ( 0.4411765 0.3088235 0.7500000), wk = 0.0032468 k( 81) = ( 0.4338235 0.3161765 0.7500000), wk = 0.0032468 k( 82) = ( 0.4264706 0.3235294 0.7500000), wk = 0.0032468 k( 83) = ( 0.4191177 0.3308823 0.7500000), wk = 0.0032468 k( 84) = ( 0.4117647 0.3382353 0.7500000), wk = 0.0032468 k( 85) = ( 0.4044118 0.3455882 0.7500000), wk = 0.0032468 k( 86) = ( 0.3970588 0.3529412 0.7500000), wk = 0.0032468 k( 87) = ( 0.3897059 0.3602941 0.7500000), wk = 0.0032468 k( 88) = ( 0.3823529 0.3676471 0.7500000), wk = 0.0032468 k( 89) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 90) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 91) = ( 0.3673469 0.3673469 0.7346939), wk = 0.0032468 k( 92) = ( 0.3596939 0.3596939 0.7193878), wk = 0.0032468 k( 93) = ( 0.3520408 0.3520408 0.7040816), wk = 0.0032468 k( 94) = ( 0.3443878 0.3443878 0.6887755), wk = 0.0032468 k( 95) = ( 0.3367347 0.3367347 0.6734694), wk = 0.0032468 k( 96) = ( 0.3290816 0.3290816 0.6581633), wk = 0.0032468 k( 97) = ( 0.3214286 0.3214286 0.6428571), wk = 0.0032468 k( 98) = ( 0.3137755 0.3137755 0.6275510), wk = 0.0032468 k( 99) = ( 0.3061224 0.3061224 0.6122449), wk = 0.0032468 k( 100) = ( 0.2984694 0.2984694 0.5969388), wk = 0.0032468 k( 101) = ( 0.2908163 0.2908163 0.5816326), wk = 0.0032468 k( 102) = ( 0.2831633 0.2831633 0.5663265), wk = 0.0032468 k( 103) = ( 0.2755102 0.2755102 0.5510204), wk = 0.0032468 k( 104) = ( 0.2678571 0.2678571 0.5357143), wk = 0.0032468 k( 105) = ( 0.2602041 0.2602041 0.5204082), wk = 0.0032468 k( 106) = ( 0.2525510 0.2525510 0.5051020), wk = 0.0032468 k( 107) = ( 0.2448980 0.2448980 0.4897959), wk = 0.0032468 k( 108) = ( 0.2372449 0.2372449 0.4744898), wk = 0.0032468 k( 109) = ( 0.2295918 0.2295918 0.4591837), wk = 0.0032468 k( 110) = ( 0.2219388 0.2219388 0.4438776), wk = 0.0032468 k( 111) = ( 0.2142857 0.2142857 0.4285714), wk = 0.0032468 k( 112) = ( 0.2066327 0.2066327 0.4132653), wk = 0.0032468 k( 113) = ( 0.1989796 0.1989796 0.3979592), wk = 0.0032468 k( 114) = ( 0.1913265 0.1913265 0.3826531), wk = 0.0032468 k( 115) = ( 0.1836735 0.1836735 0.3673469), wk = 0.0032468 k( 116) = ( 0.1760204 0.1760204 0.3520408), wk = 0.0032468 k( 117) = ( 0.1683673 0.1683673 0.3367347), wk = 0.0032468 k( 118) = ( 0.1607143 0.1607143 0.3214286), wk = 0.0032468 k( 119) = ( 0.1530612 0.1530612 0.3061224), wk = 0.0032468 k( 120) = ( 0.1454082 0.1454082 0.2908163), wk = 0.0032468 k( 121) = ( 0.1377551 0.1377551 0.2755102), wk = 0.0032468 k( 122) = ( 0.1301020 0.1301020 0.2602041), wk = 0.0032468 k( 123) = ( 0.1224490 0.1224490 0.2448980), wk = 0.0032468 k( 124) = ( 0.1147959 0.1147959 0.2295918), wk = 0.0032468 k( 125) = ( 0.1071429 0.1071429 0.2142857), wk = 0.0032468 k( 126) = ( 0.0994898 0.0994898 0.1989796), wk = 0.0032468 k( 127) = ( 0.0918367 0.0918367 0.1836735), wk = 0.0032468 k( 128) = ( 0.0841837 0.0841837 0.1683673), wk = 0.0032468 k( 129) = ( 0.0765306 0.0765306 0.1530612), wk = 0.0032468 k( 130) = ( 0.0688775 0.0688775 0.1377551), wk = 0.0032468 k( 131) = ( 0.0612245 0.0612245 0.1224490), wk = 0.0032468 k( 132) = ( 0.0535714 0.0535714 0.1071429), wk = 0.0032468 k( 133) = ( 0.0459184 0.0459184 0.0918367), wk = 0.0032468 k( 134) = ( 0.0382653 0.0382653 0.0765306), wk = 0.0032468 k( 135) = ( 0.0306122 0.0306122 0.0612245), wk = 0.0032468 k( 136) = ( 0.0229592 0.0229592 0.0459184), wk = 0.0032468 k( 137) = ( 0.0153061 0.0153061 0.0306122), wk = 0.0032468 k( 138) = ( 0.0076531 0.0076531 0.0153061), wk = 0.0032468 k( 139) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0032468 k( 141) = ( 0.0125000 0.0125000 0.0125000), wk = 0.0032468 k( 142) = ( 0.0250000 0.0250000 0.0250000), wk = 0.0032468 k( 143) = ( 0.0375000 0.0375000 0.0375000), wk = 0.0032468 k( 144) = ( 0.0500000 0.0500000 0.0500000), wk = 0.0032468 k( 145) = ( 0.0625000 0.0625000 0.0625000), wk = 0.0032468 k( 146) = ( 0.0750000 0.0750000 0.0750000), wk = 0.0032468 k( 147) = ( 0.0875000 0.0875000 0.0875000), wk = 0.0032468 k( 148) = ( 0.1000000 0.1000000 0.1000000), wk = 0.0032468 k( 149) = ( 0.1125000 0.1125000 0.1125000), wk = 0.0032468 k( 150) = ( 0.1250000 0.1250000 0.1250000), wk = 0.0032468 k( 151) = ( 0.1375000 0.1375000 0.1375000), wk = 0.0032468 k( 152) = ( 0.1500000 0.1500000 0.1500000), wk = 0.0032468 k( 153) = ( 0.1625000 0.1625000 0.1625000), wk = 0.0032468 k( 154) = ( 0.1750000 0.1750000 0.1750000), wk = 0.0032468 k( 155) = ( 0.1875000 0.1875000 0.1875000), wk = 0.0032468 k( 156) = ( 0.2000000 0.2000000 0.2000000), wk = 0.0032468 k( 157) = ( 0.2125000 0.2125000 0.2125000), wk = 0.0032468 k( 158) = ( 0.2250000 0.2250000 0.2250000), wk = 0.0032468 k( 159) = ( 0.2375000 0.2375000 0.2375000), wk = 0.0032468 k( 160) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0032468 k( 161) = ( 0.2625000 0.2625000 0.2625000), wk = 0.0032468 k( 162) = ( 0.2750000 0.2750000 0.2750000), wk = 0.0032468 k( 163) = ( 0.2875000 0.2875000 0.2875000), wk = 0.0032468 k( 164) = ( 0.3000000 0.3000000 0.3000000), wk = 0.0032468 k( 165) = ( 0.3125000 0.3125000 0.3125000), wk = 0.0032468 k( 166) = ( 0.3250000 0.3250000 0.3250000), wk = 0.0032468 k( 167) = ( 0.3375000 0.3375000 0.3375000), wk = 0.0032468 k( 168) = ( 0.3500000 0.3500000 0.3500000), wk = 0.0032468 k( 169) = ( 0.3625000 0.3625000 0.3625000), wk = 0.0032468 k( 170) = ( 0.3750000 0.3750000 0.3750000), wk = 0.0032468 k( 171) = ( 0.3875000 0.3875000 0.3875000), wk = 0.0032468 k( 172) = ( 0.4000000 0.4000000 0.4000000), wk = 0.0032468 k( 173) = ( 0.4125000 0.4125000 0.4125000), wk = 0.0032468 k( 174) = ( 0.4250000 0.4250000 0.4250000), wk = 0.0032468 k( 175) = ( 0.4375000 0.4375000 0.4375000), wk = 0.0032468 k( 176) = ( 0.4500000 0.4500000 0.4500000), wk = 0.0032468 k( 177) = ( 0.4625000 0.4625000 0.4625000), wk = 0.0032468 k( 178) = ( 0.4750000 0.4750000 0.4750000), wk = 0.0032468 k( 179) = ( 0.4875000 0.4875000 0.4875000), wk = 0.0032468 k( 180) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 181) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 182) = ( 0.5044643 0.4910714 0.5044643), wk = 0.0032468 k( 183) = ( 0.5089286 0.4821429 0.5089286), wk = 0.0032468 k( 184) = ( 0.5133929 0.4732143 0.5133929), wk = 0.0032468 k( 185) = ( 0.5178571 0.4642857 0.5178571), wk = 0.0032468 k( 186) = ( 0.5223214 0.4553571 0.5223214), wk = 0.0032468 k( 187) = ( 0.5267857 0.4464286 0.5267857), wk = 0.0032468 k( 188) = ( 0.5312500 0.4375000 0.5312500), wk = 0.0032468 k( 189) = ( 0.5357143 0.4285714 0.5357143), wk = 0.0032468 k( 190) = ( 0.5401786 0.4196429 0.5401786), wk = 0.0032468 k( 191) = ( 0.5446429 0.4107143 0.5446429), wk = 0.0032468 k( 192) = ( 0.5491071 0.4017857 0.5491071), wk = 0.0032468 k( 193) = ( 0.5535714 0.3928571 0.5535714), wk = 0.0032468 k( 194) = ( 0.5580357 0.3839286 0.5580357), wk = 0.0032468 k( 195) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0032468 k( 196) = ( 0.5669643 0.3660714 0.5669643), wk = 0.0032468 k( 197) = ( 0.5714286 0.3571429 0.5714286), wk = 0.0032468 k( 198) = ( 0.5758929 0.3482143 0.5758929), wk = 0.0032468 k( 199) = ( 0.5803571 0.3392857 0.5803571), wk = 0.0032468 k( 200) = ( 0.5848214 0.3303571 0.5848214), wk = 0.0032468 k( 201) = ( 0.5892857 0.3214286 0.5892857), wk = 0.0032468 k( 202) = ( 0.5937500 0.3125000 0.5937500), wk = 0.0032468 k( 203) = ( 0.5982143 0.3035714 0.5982143), wk = 0.0032468 k( 204) = ( 0.6026786 0.2946429 0.6026786), wk = 0.0032468 k( 205) = ( 0.6071429 0.2857143 0.6071429), wk = 0.0032468 k( 206) = ( 0.6116071 0.2767857 0.6116071), wk = 0.0032468 k( 207) = ( 0.6160714 0.2678571 0.6160714), wk = 0.0032468 k( 208) = ( 0.6205357 0.2589286 0.6205357), wk = 0.0032468 k( 209) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 210) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 211) = ( 0.6176471 0.2500000 0.6323529), wk = 0.0032468 k( 212) = ( 0.6102941 0.2500000 0.6397059), wk = 0.0032468 k( 213) = ( 0.6029412 0.2500000 0.6470588), wk = 0.0032468 k( 214) = ( 0.5955882 0.2500000 0.6544118), wk = 0.0032468 k( 215) = ( 0.5882353 0.2500000 0.6617647), wk = 0.0032468 k( 216) = ( 0.5808823 0.2500000 0.6691177), wk = 0.0032468 k( 217) = ( 0.5735294 0.2500000 0.6764706), wk = 0.0032468 k( 218) = ( 0.5661765 0.2500000 0.6838235), wk = 0.0032468 k( 219) = ( 0.5588235 0.2500000 0.6911765), wk = 0.0032468 k( 220) = ( 0.5514706 0.2500000 0.6985294), wk = 0.0032468 k( 221) = ( 0.5441177 0.2500000 0.7058823), wk = 0.0032468 k( 222) = ( 0.5367647 0.2500000 0.7132353), wk = 0.0032468 k( 223) = ( 0.5294118 0.2500000 0.7205882), wk = 0.0032468 k( 224) = ( 0.5220588 0.2500000 0.7279412), wk = 0.0032468 k( 225) = ( 0.5147059 0.2500000 0.7352941), wk = 0.0032468 k( 226) = ( 0.5073529 0.2500000 0.7426471), wk = 0.0032468 k( 227) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 228) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0032468 k( 229) = ( 0.5000000 0.2575758 0.7424242), wk = 0.0032468 k( 230) = ( 0.5000000 0.2651515 0.7348485), wk = 0.0032468 k( 231) = ( 0.5000000 0.2727273 0.7272727), wk = 0.0032468 k( 232) = ( 0.5000000 0.2803030 0.7196970), wk = 0.0032468 k( 233) = ( 0.5000000 0.2878788 0.7121212), wk = 0.0032468 k( 234) = ( 0.5000000 0.2954545 0.7045455), wk = 0.0032468 k( 235) = ( 0.5000000 0.3030303 0.6969697), wk = 0.0032468 k( 236) = ( 0.5000000 0.3106061 0.6893939), wk = 0.0032468 k( 237) = ( 0.5000000 0.3181818 0.6818182), wk = 0.0032468 k( 238) = ( 0.5000000 0.3257576 0.6742424), wk = 0.0032468 k( 239) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0032468 k( 240) = ( 0.5000000 0.3409091 0.6590909), wk = 0.0032468 k( 241) = ( 0.5000000 0.3484849 0.6515152), wk = 0.0032468 k( 242) = ( 0.5000000 0.3560606 0.6439394), wk = 0.0032468 k( 243) = ( 0.5000000 0.3636364 0.6363636), wk = 0.0032468 k( 244) = ( 0.5000000 0.3712121 0.6287879), wk = 0.0032468 k( 245) = ( 0.5000000 0.3787879 0.6212121), wk = 0.0032468 k( 246) = ( 0.5000000 0.3863636 0.6136364), wk = 0.0032468 k( 247) = ( 0.5000000 0.3939394 0.6060606), wk = 0.0032468 k( 248) = ( 0.5000000 0.4015151 0.5984848), wk = 0.0032468 k( 249) = ( 0.5000000 0.4090909 0.5909091), wk = 0.0032468 k( 250) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0032468 k( 251) = ( 0.5000000 0.4242424 0.5757576), wk = 0.0032468 k( 252) = ( 0.5000000 0.4318182 0.5681818), wk = 0.0032468 k( 253) = ( 0.5000000 0.4393939 0.5606061), wk = 0.0032468 k( 254) = ( 0.5000000 0.4469697 0.5530303), wk = 0.0032468 k( 255) = ( 0.5000000 0.4545455 0.5454545), wk = 0.0032468 k( 256) = ( 0.5000000 0.4621212 0.5378788), wk = 0.0032468 k( 257) = ( 0.5000000 0.4696970 0.5303030), wk = 0.0032468 k( 258) = ( 0.5000000 0.4772727 0.5227273), wk = 0.0032468 k( 259) = ( 0.5000000 0.4848485 0.5151515), wk = 0.0032468 k( 260) = ( 0.5000000 0.4924242 0.5075758), wk = 0.0032468 k( 261) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0032468 k( 263) = ( 0.4955357 0.4955357 0.5089286), wk = 0.0032468 k( 264) = ( 0.4910714 0.4910714 0.5178571), wk = 0.0032468 k( 265) = ( 0.4866071 0.4866071 0.5267857), wk = 0.0032468 k( 266) = ( 0.4821429 0.4821429 0.5357143), wk = 0.0032468 k( 267) = ( 0.4776786 0.4776786 0.5446429), wk = 0.0032468 k( 268) = ( 0.4732143 0.4732143 0.5535714), wk = 0.0032468 k( 269) = ( 0.4687500 0.4687500 0.5625000), wk = 0.0032468 k( 270) = ( 0.4642857 0.4642857 0.5714286), wk = 0.0032468 k( 271) = ( 0.4598214 0.4598214 0.5803571), wk = 0.0032468 k( 272) = ( 0.4553571 0.4553571 0.5892857), wk = 0.0032468 k( 273) = ( 0.4508929 0.4508929 0.5982143), wk = 0.0032468 k( 274) = ( 0.4464286 0.4464286 0.6071429), wk = 0.0032468 k( 275) = ( 0.4419643 0.4419643 0.6160714), wk = 0.0032468 k( 276) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0032468 k( 277) = ( 0.4330357 0.4330357 0.6339286), wk = 0.0032468 k( 278) = ( 0.4285714 0.4285714 0.6428571), wk = 0.0032468 k( 279) = ( 0.4241071 0.4241071 0.6517857), wk = 0.0032468 k( 280) = ( 0.4196429 0.4196429 0.6607143), wk = 0.0032468 k( 281) = ( 0.4151786 0.4151786 0.6696429), wk = 0.0032468 k( 282) = ( 0.4107143 0.4107143 0.6785714), wk = 0.0032468 k( 283) = ( 0.4062500 0.4062500 0.6875000), wk = 0.0032468 k( 284) = ( 0.4017857 0.4017857 0.6964286), wk = 0.0032468 k( 285) = ( 0.3973214 0.3973214 0.7053571), wk = 0.0032468 k( 286) = ( 0.3928571 0.3928571 0.7142857), wk = 0.0032468 k( 287) = ( 0.3883929 0.3883929 0.7232143), wk = 0.0032468 k( 288) = ( 0.3839286 0.3839286 0.7321429), wk = 0.0032468 k( 289) = ( 0.3794643 0.3794643 0.7410714), wk = 0.0032468 k( 290) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0032468 k( 291) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0032468 k( 292) = ( 0.6176471 0.2352941 0.6176471), wk = 0.0032468 k( 293) = ( 0.6102941 0.2205882 0.6102941), wk = 0.0032468 k( 294) = ( 0.6029412 0.2058823 0.6029412), wk = 0.0032468 k( 295) = ( 0.5955882 0.1911765 0.5955882), wk = 0.0032468 k( 296) = ( 0.5882353 0.1764706 0.5882353), wk = 0.0032468 k( 297) = ( 0.5808823 0.1617647 0.5808823), wk = 0.0032468 k( 298) = ( 0.5735294 0.1470588 0.5735294), wk = 0.0032468 k( 299) = ( 0.5661765 0.1323529 0.5661765), wk = 0.0032468 k( 300) = ( 0.5588235 0.1176471 0.5588235), wk = 0.0032468 k( 301) = ( 0.5514706 0.1029412 0.5514706), wk = 0.0032468 k( 302) = ( 0.5441177 0.0882353 0.5441177), wk = 0.0032468 k( 303) = ( 0.5367647 0.0735294 0.5367647), wk = 0.0032468 k( 304) = ( 0.5294118 0.0588235 0.5294118), wk = 0.0032468 k( 305) = ( 0.5220588 0.0441176 0.5220588), wk = 0.0032468 k( 306) = ( 0.5147059 0.0294118 0.5147059), wk = 0.0032468 k( 307) = ( 0.5073529 0.0147059 0.5073529), wk = 0.0032468 k( 308) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0032468 Dense grid: 34327 G-vectors FFT dimensions: ( 45, 45, 45) Smooth grid: 26565 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.17 Mb ( 190, 58) NL pseudopotentials 0.24 Mb ( 95, 168) Each V/rho on FFT grid 0.06 Mb ( 4050) Each G-vector array 0.01 Mb ( 952) G-vector shells 0.00 Mb ( 293) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.67 Mb ( 190, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.30 Mb ( 168, 2, 58) The potential is recalculated from file : ./ZrNi2.save/charge-density.dat Starting wfc are 108 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.1 secs Computing kpt #: 2 total cpu time spent up to now is 2.8 secs Computing kpt #: 3 total cpu time spent up to now is 3.4 secs Computing kpt #: 4 total cpu time spent up to now is 4.1 secs Computing kpt #: 5 total cpu time spent up to now is 4.7 secs Computing kpt #: 6 total cpu time spent up to now is 5.3 secs Computing kpt #: 7 total cpu time spent up to now is 5.9 secs Computing kpt #: 8 total cpu time spent up to now is 6.5 secs Computing kpt #: 9 total cpu time spent up to now is 7.1 secs Computing kpt #: 10 total cpu time spent up to now is 7.6 secs Computing kpt #: 11 total cpu time spent up to now is 8.2 secs Computing kpt #: 12 total cpu time spent up to now is 8.8 secs Computing kpt #: 13 total cpu time spent up to now is 9.4 secs Computing kpt #: 14 total cpu time spent up to now is 9.9 secs Computing kpt #: 15 total cpu time spent up to now is 10.5 secs Computing kpt #: 16 total cpu time spent up to now is 11.0 secs Computing kpt #: 17 total cpu time spent up to now is 11.6 secs Computing kpt #: 18 total cpu time spent up to now is 12.1 secs Computing kpt #: 19 total cpu time spent up to now is 12.7 secs Computing kpt #: 20 total cpu time spent up to now is 13.2 secs Computing kpt #: 21 total cpu time spent up to now is 13.7 secs Computing kpt #: 22 total cpu time spent up to now is 14.3 secs Computing kpt #: 23 total cpu time spent up to now is 14.8 secs Computing kpt #: 24 total cpu time spent up to now is 15.4 secs Computing kpt #: 25 total cpu time spent up to now is 16.0 secs Computing kpt #: 26 total cpu time spent up to now is 16.5 secs Computing kpt #: 27 total cpu time spent up to now is 17.1 secs Computing kpt #: 28 total cpu time spent up to now is 17.6 secs Computing kpt #: 29 total cpu time spent up to now is 18.2 secs Computing kpt #: 30 total cpu time spent up to now is 18.8 secs Computing kpt #: 31 total cpu time spent up to now is 19.3 secs Computing kpt #: 32 total cpu time spent up to now is 19.9 secs Computing kpt #: 33 total cpu time spent up to now is 20.4 secs Computing kpt #: 34 total cpu time spent up to now is 21.0 secs Computing kpt #: 35 total cpu time spent up to now is 21.6 secs Computing kpt #: 36 total cpu time spent up to now is 22.1 secs Computing kpt #: 37 total cpu time spent up to now is 22.7 secs Computing kpt #: 38 total cpu time spent up to now is 23.3 secs Computing kpt #: 39 total cpu time spent up to now is 23.9 secs Computing kpt #: 40 total cpu time spent up to now is 24.5 secs Computing kpt #: 41 total cpu time spent up to now is 25.0 secs Computing kpt #: 42 total cpu time spent up to now is 25.7 secs Computing kpt #: 43 total cpu time spent up to now is 26.4 secs Computing kpt #: 44 total cpu time spent up to now is 27.2 secs Computing kpt #: 45 total cpu time spent up to now is 28.1 secs Computing kpt #: 46 total cpu time spent up to now is 28.9 secs Computing kpt #: 47 total cpu time spent up to now is 29.9 secs Computing kpt #: 48 total cpu time spent up to now is 30.9 secs Computing kpt #: 49 total cpu time spent up to now is 31.9 secs Computing kpt #: 50 total cpu time spent up to now is 33.0 secs Computing kpt #: 51 total cpu time spent up to now is 34.0 secs Computing kpt #: 52 total cpu time spent up to now is 35.1 secs Computing kpt #: 53 total cpu time spent up to now is 36.2 secs Computing kpt #: 54 total cpu time spent up to now is 37.4 secs Computing kpt #: 55 total cpu time spent up to now is 38.2 secs Computing kpt #: 56 total cpu time spent up to now is 38.9 secs Computing kpt #: 57 total cpu time spent up to now is 39.7 secs Computing kpt #: 58 total cpu time spent up to now is 41.1 secs Computing kpt #: 59 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 42.8 secs Computing kpt #: 60 total cpu time spent up to now is 43.5 secs Computing kpt #: 61 total cpu time spent up to now is 44.2 secs Computing kpt #: 62 total cpu time spent up to now is 45.0 secs Computing kpt #: 63 total cpu time spent up to now is 45.7 secs Computing kpt #: 64 total cpu time spent up to now is 46.4 secs Computing kpt #: 65 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 48.0 secs Computing kpt #: 66 total cpu time spent up to now is 48.8 secs Computing kpt #: 67 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 50.5 secs Computing kpt #: 68 total cpu time spent up to now is 51.9 secs Computing kpt #: 69 total cpu time spent up to now is 53.3 secs Computing kpt #: 70 total cpu time spent up to now is 54.7 secs Computing kpt #: 71 total cpu time spent up to now is 56.3 secs Computing kpt #: 72 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 58.0 secs Computing kpt #: 73 total cpu time spent up to now is 58.9 secs Computing kpt #: 74 total cpu time spent up to now is 59.8 secs Computing kpt #: 75 total cpu time spent up to now is 60.5 secs Computing kpt #: 76 total cpu time spent up to now is 61.2 secs Computing kpt #: 77 total cpu time spent up to now is 61.8 secs Computing kpt #: 78 total cpu time spent up to now is 62.4 secs Computing kpt #: 79 total cpu time spent up to now is 63.0 secs Computing kpt #: 80 total cpu time spent up to now is 63.7 secs Computing kpt #: 81 total cpu time spent up to now is 64.3 secs Computing kpt #: 82 total cpu time spent up to now is 64.9 secs Computing kpt #: 83 total cpu time spent up to now is 65.6 secs Computing kpt #: 84 total cpu time spent up to now is 66.4 secs Computing kpt #: 85 total cpu time spent up to now is 67.1 secs Computing kpt #: 86 total cpu time spent up to now is 67.8 secs Computing kpt #: 87 total cpu time spent up to now is 68.4 secs Computing kpt #: 88 total cpu time spent up to now is 68.9 secs Computing kpt #: 89 total cpu time spent up to now is 69.6 secs Computing kpt #: 90 total cpu time spent up to now is 70.3 secs Computing kpt #: 91 total cpu time spent up to now is 70.9 secs Computing kpt #: 92 total cpu time spent up to now is 71.5 secs Computing kpt #: 93 total cpu time spent up to now is 72.1 secs Computing kpt #: 94 total cpu time spent up to now is 72.7 secs Computing kpt #: 95 total cpu time spent up to now is 73.3 secs Computing kpt #: 96 total cpu time spent up to now is 74.1 secs Computing kpt #: 97 total cpu time spent up to now is 75.5 secs Computing kpt #: 98 total cpu time spent up to now is 76.7 secs Computing kpt #: 99 total cpu time spent up to now is 77.5 secs Computing kpt #: 100 total cpu time spent up to now is 78.2 secs Computing kpt #: 101 total cpu time spent up to now is 78.9 secs Computing kpt #: 102 total cpu time spent up to now is 79.5 secs Computing kpt #: 103 total cpu time spent up to now is 80.2 secs Computing kpt #: 104 total cpu time spent up to now is 80.8 secs Computing kpt #: 105 total cpu time spent up to now is 81.4 secs Computing kpt #: 106 total cpu time spent up to now is 82.1 secs Computing kpt #: 107 total cpu time spent up to now is 82.7 secs Computing kpt #: 108 total cpu time spent up to now is 83.2 secs Computing kpt #: 109 total cpu time spent up to now is 83.8 secs Computing kpt #: 110 total cpu time spent up to now is 84.4 secs Computing kpt #: 111 total cpu time spent up to now is 85.0 secs Computing kpt #: 112 total cpu time spent up to now is 85.5 secs Computing kpt #: 113 total cpu time spent up to now is 86.0 secs Computing kpt #: 114 total cpu time spent up to now is 86.6 secs Computing kpt #: 115 total cpu time spent up to now is 87.1 secs Computing kpt #: 116 total cpu time spent up to now is 87.7 secs Computing kpt #: 117 total cpu time spent up to now is 88.2 secs Computing kpt #: 118 total cpu time spent up to now is 88.7 secs Computing kpt #: 119 total cpu time spent up to now is 89.3 secs Computing kpt #: 120 total cpu time spent up to now is 89.8 secs Computing kpt #: 121 total cpu time spent up to now is 90.4 secs Computing kpt #: 122 total cpu time spent up to now is 90.9 secs Computing kpt #: 123 total cpu time spent up to now is 91.5 secs Computing kpt #: 124 total cpu time spent up to now is 92.0 secs Computing kpt #: 125 total cpu time spent up to now is 92.6 secs Computing kpt #: 126 total cpu time spent up to now is 93.1 secs Computing kpt #: 127 total cpu time spent up to now is 93.7 secs Computing kpt #: 128 total cpu time spent up to now is 94.3 secs Computing kpt #: 129 total cpu time spent up to now is 94.8 secs Computing kpt #: 130 total cpu time spent up to now is 95.5 secs Computing kpt #: 131 total cpu time spent up to now is 96.1 secs Computing kpt #: 132 total cpu time spent up to now is 96.7 secs Computing kpt #: 133 total cpu time spent up to now is 97.3 secs Computing kpt #: 134 total cpu time spent up to now is 97.9 secs Computing kpt #: 135 total cpu time spent up to now is 98.5 secs Computing kpt #: 136 total cpu time spent up to now is 99.1 secs Computing kpt #: 137 total cpu time spent up to now is 99.8 secs Computing kpt #: 138 total cpu time spent up to now is 100.5 secs Computing kpt #: 139 total cpu time spent up to now is 101.3 secs Computing kpt #: 140 total cpu time spent up to now is 102.1 secs Computing kpt #: 141 total cpu time spent up to now is 102.7 secs Computing kpt #: 142 total cpu time spent up to now is 103.3 secs Computing kpt #: 143 total cpu time spent up to now is 104.0 secs Computing kpt #: 144 total cpu time spent up to now is 104.6 secs Computing kpt #: 145 total cpu time spent up to now is 105.2 secs Computing kpt #: 146 total cpu time spent up to now is 105.8 secs Computing kpt #: 147 total cpu time spent up to now is 106.4 secs Computing kpt #: 148 total cpu time spent up to now is 106.9 secs Computing kpt #: 149 total cpu time spent up to now is 107.6 secs Computing kpt #: 150 total cpu time spent up to now is 108.1 secs Computing kpt #: 151 total cpu time spent up to now is 108.7 secs Computing kpt #: 152 total cpu time spent up to now is 109.2 secs Computing kpt #: 153 total cpu time spent up to now is 109.8 secs Computing kpt #: 154 total cpu time spent up to now is 110.3 secs Computing kpt #: 155 total cpu time spent up to now is 111.9 secs Computing kpt #: 156 total cpu time spent up to now is 112.4 secs Computing kpt #: 157 total cpu time spent up to now is 113.0 secs Computing kpt #: 158 total cpu time spent up to now is 113.5 secs Computing kpt #: 159 total cpu time spent up to now is 114.0 secs Computing kpt #: 160 total cpu time spent up to now is 114.6 secs Computing kpt #: 161 total cpu time spent up to now is 115.1 secs Computing kpt #: 162 total cpu time spent up to now is 115.7 secs Computing kpt #: 163 total cpu time spent up to now is 116.2 secs Computing kpt #: 164 total cpu time spent up to now is 116.7 secs Computing kpt #: 165 total cpu time spent up to now is 117.3 secs Computing kpt #: 166 total cpu time spent up to now is 117.8 secs Computing kpt #: 167 total cpu time spent up to now is 118.4 secs Computing kpt #: 168 total cpu time spent up to now is 119.0 secs Computing kpt #: 169 total cpu time spent up to now is 119.5 secs Computing kpt #: 170 total cpu time spent up to now is 120.1 secs Computing kpt #: 171 total cpu time spent up to now is 120.7 secs Computing kpt #: 172 total cpu time spent up to now is 121.3 secs Computing kpt #: 173 total cpu time spent up to now is 122.0 secs Computing kpt #: 174 total cpu time spent up to now is 122.6 secs Computing kpt #: 175 total cpu time spent up to now is 123.3 secs Computing kpt #: 176 total cpu time spent up to now is 124.0 secs Computing kpt #: 177 total cpu time spent up to now is 124.6 secs Computing kpt #: 178 total cpu time spent up to now is 125.4 secs Computing kpt #: 179 total cpu time spent up to now is 126.0 secs Computing kpt #: 180 total cpu time spent up to now is 126.6 secs Computing kpt #: 181 total cpu time spent up to now is 127.2 secs Computing kpt #: 182 total cpu time spent up to now is 127.8 secs Computing kpt #: 183 total cpu time spent up to now is 128.3 secs Computing kpt #: 184 total cpu time spent up to now is 129.0 secs Computing kpt #: 185 total cpu time spent up to now is 129.9 secs Computing kpt #: 186 total cpu time spent up to now is 130.8 secs Computing kpt #: 187 total cpu time spent up to now is 131.8 secs Computing kpt #: 188 total cpu time spent up to now is 132.6 secs Computing kpt #: 189 total cpu time spent up to now is 133.3 secs Computing kpt #: 190 total cpu time spent up to now is 134.1 secs Computing kpt #: 191 total cpu time spent up to now is 134.8 secs Computing kpt #: 192 total cpu time spent up to now is 135.4 secs Computing kpt #: 193 total cpu time spent up to now is 136.0 secs Computing kpt #: 194 total cpu time spent up to now is 136.7 secs Computing kpt #: 195 total cpu time spent up to now is 137.3 secs Computing kpt #: 196 total cpu time spent up to now is 137.9 secs Computing kpt #: 197 total cpu time spent up to now is 138.5 secs Computing kpt #: 198 total cpu time spent up to now is 139.2 secs Computing kpt #: 199 total cpu time spent up to now is 139.8 secs Computing kpt #: 200 total cpu time spent up to now is 140.4 secs Computing kpt #: 201 total cpu time spent up to now is 141.0 secs Computing kpt #: 202 total cpu time spent up to now is 141.6 secs Computing kpt #: 203 total cpu time spent up to now is 142.2 secs Computing kpt #: 204 total cpu time spent up to now is 142.8 secs Computing kpt #: 205 total cpu time spent up to now is 143.4 secs Computing kpt #: 206 total cpu time spent up to now is 144.0 secs Computing kpt #: 207 total cpu time spent up to now is 144.7 secs Computing kpt #: 208 total cpu time spent up to now is 145.3 secs Computing kpt #: 209 total cpu time spent up to now is 145.9 secs Computing kpt #: 210 total cpu time spent up to now is 146.5 secs Computing kpt #: 211 total cpu time spent up to now is 147.1 secs Computing kpt #: 212 total cpu time spent up to now is 147.7 secs Computing kpt #: 213 total cpu time spent up to now is 148.3 secs Computing kpt #: 214 total cpu time spent up to now is 148.9 secs Computing kpt #: 215 total cpu time spent up to now is 149.5 secs Computing kpt #: 216 total cpu time spent up to now is 150.1 secs Computing kpt #: 217 total cpu time spent up to now is 150.7 secs Computing kpt #: 218 total cpu time spent up to now is 151.3 secs Computing kpt #: 219 total cpu time spent up to now is 151.9 secs Computing kpt #: 220 total cpu time spent up to now is 152.5 secs Computing kpt #: 221 total cpu time spent up to now is 153.1 secs Computing kpt #: 222 total cpu time spent up to now is 153.8 secs Computing kpt #: 223 total cpu time spent up to now is 154.4 secs Computing kpt #: 224 total cpu time spent up to now is 155.1 secs Computing kpt #: 225 total cpu time spent up to now is 156.0 secs Computing kpt #: 226 total cpu time spent up to now is 157.2 secs Computing kpt #: 227 total cpu time spent up to now is 158.6 secs Computing kpt #: 228 total cpu time spent up to now is 160.1 secs Computing kpt #: 229 total cpu time spent up to now is 161.1 secs Computing kpt #: 230 total cpu time spent up to now is 161.9 secs Computing kpt #: 231 total cpu time spent up to now is 162.6 secs Computing kpt #: 232 total cpu time spent up to now is 163.3 secs Computing kpt #: 233 total cpu time spent up to now is 164.0 secs Computing kpt #: 234 total cpu time spent up to now is 164.7 secs Computing kpt #: 235 total cpu time spent up to now is 165.4 secs Computing kpt #: 236 total cpu time spent up to now is 166.0 secs Computing kpt #: 237 total cpu time spent up to now is 166.6 secs Computing kpt #: 238 total cpu time spent up to now is 167.2 secs Computing kpt #: 239 total cpu time spent up to now is 167.8 secs Computing kpt #: 240 total cpu time spent up to now is 168.4 secs Computing kpt #: 241 total cpu time spent up to now is 169.0 secs Computing kpt #: 242 total cpu time spent up to now is 169.6 secs Computing kpt #: 243 total cpu time spent up to now is 170.2 secs Computing kpt #: 244 total cpu time spent up to now is 170.8 secs Computing kpt #: 245 total cpu time spent up to now is 171.3 secs Computing kpt #: 246 total cpu time spent up to now is 172.0 secs Computing kpt #: 247 total cpu time spent up to now is 172.7 secs Computing kpt #: 248 total cpu time spent up to now is 173.3 secs Computing kpt #: 249 total cpu time spent up to now is 173.9 secs Computing kpt #: 250 total cpu time spent up to now is 174.6 secs Computing kpt #: 251 total cpu time spent up to now is 175.2 secs Computing kpt #: 252 total cpu time spent up to now is 175.9 secs Computing kpt #: 253 total cpu time spent up to now is 176.7 secs Computing kpt #: 254 total cpu time spent up to now is 177.4 secs Computing kpt #: 255 total cpu time spent up to now is 178.4 secs Computing kpt #: 256 total cpu time spent up to now is 179.3 secs Computing kpt #: 257 total cpu time spent up to now is 180.0 secs Computing kpt #: 258 total cpu time spent up to now is 180.7 secs Computing kpt #: 259 total cpu time spent up to now is 181.3 secs Computing kpt #: 260 total cpu time spent up to now is 181.8 secs Computing kpt #: 261 total cpu time spent up to now is 182.4 secs Computing kpt #: 262 total cpu time spent up to now is 183.0 secs Computing kpt #: 263 total cpu time spent up to now is 183.5 secs Computing kpt #: 264 total cpu time spent up to now is 184.1 secs Computing kpt #: 265 total cpu time spent up to now is 184.7 secs Computing kpt #: 266 total cpu time spent up to now is 185.3 secs Computing kpt #: 267 total cpu time spent up to now is 186.2 secs Computing kpt #: 268 total cpu time spent up to now is 186.9 secs Computing kpt #: 269 total cpu time spent up to now is 187.6 secs Computing kpt #: 270 total cpu time spent up to now is 188.3 secs Computing kpt #: 271 total cpu time spent up to now is 189.1 secs Computing kpt #: 272 total cpu time spent up to now is 189.8 secs Computing kpt #: 273 total cpu time spent up to now is 190.6 secs Computing kpt #: 274 total cpu time spent up to now is 191.3 secs Computing kpt #: 275 total cpu time spent up to now is 192.0 secs Computing kpt #: 276 total cpu time spent up to now is 192.5 secs Computing kpt #: 277 total cpu time spent up to now is 193.1 secs Computing kpt #: 278 total cpu time spent up to now is 193.7 secs Computing kpt #: 279 total cpu time spent up to now is 194.4 secs Computing kpt #: 280 total cpu time spent up to now is 195.0 secs Computing kpt #: 281 total cpu time spent up to now is 195.6 secs Computing kpt #: 282 total cpu time spent up to now is 196.2 secs Computing kpt #: 283 total cpu time spent up to now is 196.8 secs Computing kpt #: 284 total cpu time spent up to now is 197.4 secs Computing kpt #: 285 total cpu time spent up to now is 198.0 secs Computing kpt #: 286 total cpu time spent up to now is 198.6 secs Computing kpt #: 287 total cpu time spent up to now is 199.2 secs Computing kpt #: 288 total cpu time spent up to now is 199.8 secs Computing kpt #: 289 total cpu time spent up to now is 200.4 secs Computing kpt #: 290 total cpu time spent up to now is 201.0 secs Computing kpt #: 291 total cpu time spent up to now is 201.6 secs Computing kpt #: 292 total cpu time spent up to now is 202.2 secs Computing kpt #: 293 total cpu time spent up to now is 202.9 secs Computing kpt #: 294 total cpu time spent up to now is 203.5 secs Computing kpt #: 295 total cpu time spent up to now is 204.2 secs Computing kpt #: 296 total cpu time spent up to now is 204.9 secs Computing kpt #: 297 total cpu time spent up to now is 205.5 secs Computing kpt #: 298 total cpu time spent up to now is 206.2 secs Computing kpt #: 299 total cpu time spent up to now is 206.9 secs Computing kpt #: 300 total cpu time spent up to now is 207.6 secs Computing kpt #: 301 total cpu time spent up to now is 208.3 secs Computing kpt #: 302 total cpu time spent up to now is 209.1 secs Computing kpt #: 303 total cpu time spent up to now is 209.9 secs Computing kpt #: 304 total cpu time spent up to now is 210.7 secs Computing kpt #: 305 total cpu time spent up to now is 211.6 secs Computing kpt #: 306 total cpu time spent up to now is 212.6 secs Computing kpt #: 307 total cpu time spent up to now is 213.3 secs Computing kpt #: 308 total cpu time spent up to now is 214.3 secs ethr = 2.08E-08, avg # of iterations = 24.4 total cpu time spent up to now is 214.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3383 PWs) bands (ev): 4.0502 4.0502 7.9001 7.9001 8.1597 8.1597 8.2003 8.2003 8.2004 8.2004 9.1567 9.1567 9.1568 9.1568 9.1941 9.1941 9.2843 9.2843 9.2843 9.2843 10.2562 10.2562 10.2562 10.2562 10.7764 10.7764 10.7765 10.7765 10.8982 10.8982 10.9182 10.9182 10.9184 10.9184 11.0050 11.0050 11.0052 11.0052 11.0406 11.0406 11.2875 11.2875 11.3704 11.3704 11.3704 11.3704 12.0078 12.0078 12.0606 12.0606 12.0608 12.0608 12.8361 12.8361 13.0010 13.0010 13.0653 13.0653 k = 0.0109-0.0063 0.0089 ( 3363 PWs) bands (ev): 4.0520 4.0520 7.9007 7.9007 8.1598 8.1598 8.1997 8.1997 8.2012 8.2012 9.1558 9.1558 9.1569 9.1569 9.1938 9.1938 9.2846 9.2846 9.2848 9.2848 10.2546 10.2546 10.2572 10.2572 10.7756 10.7756 10.7775 10.7775 10.8982 10.8982 10.9172 10.9172 10.9190 10.9190 11.0037 11.0037 11.0049 11.0049 11.0396 11.0396 11.2877 11.2877 11.3694 11.3694 11.3700 11.3700 12.0093 12.0093 12.0616 12.0616 12.0629 12.0629 12.7956 12.7956 13.0119 13.0119 13.0650 13.0650 k = 0.0217-0.0126 0.0177 ( 3343 PWs) bands (ev): 4.0574 4.0574 7.9023 7.9023 8.1596 8.1596 8.1981 8.1981 8.2037 8.2037 9.1529 9.1529 9.1573 9.1573 9.1930 9.1930 9.2855 9.2855 9.2857 9.2857 10.2501 10.2501 10.2599 10.2599 10.7731 10.7731 10.7808 10.7808 10.8982 10.8982 10.9136 10.9136 10.9208 10.9208 10.9996 10.9996 11.0044 11.0044 11.0367 11.0367 11.2878 11.2878 11.3668 11.3668 11.3690 11.3690 12.0134 12.0134 12.0643 12.0643 12.0691 12.0691 12.7146 12.7146 13.0180 13.0180 13.0642 13.0642 k = 0.0326-0.0188 0.0266 ( 3343 PWs) bands (ev): 4.0665 4.0665 7.9047 7.9047 8.1578 8.1578 8.1966 8.1966 8.2077 8.2077 9.1477 9.1477 9.1578 9.1578 9.1919 9.1919 9.2867 9.2867 9.2872 9.2872 10.2427 10.2427 10.2642 10.2642 10.7688 10.7688 10.7859 10.7859 10.8976 10.8976 10.9082 10.9082 10.9216 10.9216 10.9928 10.9928 11.0038 11.0038 11.0334 11.0334 11.2876 11.2876 11.3631 11.3631 11.3673 11.3673 12.0193 12.0193 12.0694 12.0694 12.0792 12.0792 12.6230 12.6230 13.0189 13.0189 13.0629 13.0629 k = 0.0435-0.0251 0.0355 ( 3335 PWs) bands (ev): 4.0791 4.0791 7.9082 7.9082 8.1526 8.1526 8.1973 8.1973 8.2134 8.2134 9.1403 9.1403 9.1587 9.1587 9.1912 9.1912 9.2883 9.2883 9.2894 9.2894 10.2327 10.2327 10.2693 10.2693 10.7626 10.7626 10.7924 10.7924 10.8934 10.8934 10.9047 10.9047 10.9193 10.9193 10.9835 10.9835 11.0034 11.0034 11.0322 11.0322 11.2865 11.2865 11.3590 11.3590 11.3651 11.3651 12.0260 12.0260 12.0778 12.0778 12.0929 12.0929 12.5280 12.5280 13.0183 13.0183 13.0611 13.0611 k = 0.0543-0.0314 0.0444 ( 3347 PWs) bands (ev): 4.0954 4.0954 7.9127 7.9127 8.1431 8.1431 8.2010 8.2010 8.2207 8.2207 9.1308 9.1308 9.1597 9.1597 9.1910 9.1910 9.2904 9.2904 9.2922 9.2922 10.2206 10.2206 10.2747 10.2747 10.7543 10.7543 10.7991 10.7991 10.8831 10.8831 10.9059 10.9059 10.9108 10.9108 10.9715 10.9715 11.0038 11.0038 11.0358 11.0358 11.2838 11.2838 11.3555 11.3555 11.3625 11.3625 12.0324 12.0324 12.0902 12.0902 12.1097 12.1097 12.4320 12.4320 13.0170 13.0170 13.0590 13.0590 k = 0.0652-0.0377 0.0532 ( 3351 PWs) bands (ev): 4.1152 4.1152 7.9181 7.9181 8.1294 8.1294 8.2078 8.2078 8.2295 8.2295 9.1198 9.1198 9.1610 9.1610 9.1914 9.1914 9.2930 9.2930 9.2956 9.2956 10.2066 10.2066 10.2797 10.2797 10.7437 10.7437 10.8045 10.8045 10.8699 10.8699 10.8952 10.8952 10.9102 10.9102 10.9570 10.9570 11.0055 11.0055 11.0454 11.0454 11.2794 11.2794 11.3531 11.3531 11.3595 11.3595 12.0382 12.0382 12.1068 12.1068 12.1291 12.1291 12.3362 12.3362 13.0155 13.0155 13.0567 13.0567 k = 0.0761-0.0439 0.0621 ( 3351 PWs) bands (ev): 4.1386 4.1386 7.9245 7.9245 8.1122 8.1122 8.2170 8.2170 8.2400 8.2400 9.1076 9.1076 9.1627 9.1627 9.1923 9.1923 9.2959 9.2959 9.2996 9.2996 10.1911 10.1911 10.2836 10.2836 10.7302 10.7302 10.8060 10.8060 10.8560 10.8560 10.8729 10.8729 10.9168 10.9168 10.9404 10.9404 11.0095 11.0095 11.0601 11.0601 11.2736 11.2736 11.3522 11.3522 11.3563 11.3563 12.0436 12.0436 12.1272 12.1272 12.1495 12.1495 12.2424 12.2424 13.0140 13.0140 13.0543 13.0543 k = 0.0870-0.0502 0.0710 ( 3347 PWs) bands (ev): 4.1654 4.1654 7.9319 7.9319 8.0921 8.0921 8.2283 8.2283 8.2519 8.2519 9.0950 9.0950 9.1647 9.1647 9.1939 9.1939 9.2992 9.2992 9.3043 9.3043 10.1745 10.1745 10.2859 10.2859 10.7134 10.7134 10.8000 10.8000 10.8446 10.8446 10.8450 10.8450 10.9224 10.9224 10.9250 10.9250 11.0170 11.0170 11.0784 11.0784 11.2670 11.2670 11.3523 11.3523 11.3528 11.3528 12.0491 12.0491 12.1365 12.1365 12.1505 12.1505 12.1851 12.1851 13.0126 13.0126 13.0521 13.0521 k = 0.0978-0.0565 0.0799 ( 3355 PWs) bands (ev): 4.1958 4.1958 7.9403 7.9403 8.0692 8.0692 8.2413 8.2413 8.2653 8.2653 9.0820 9.0820 9.1671 9.1671 9.1959 9.1959 9.3029 9.3029 9.3096 9.3096 10.1571 10.1571 10.2863 10.2863 10.6925 10.6925 10.7847 10.7847 10.8125 10.8125 10.8374 10.8374 10.9040 10.9040 10.9330 10.9330 11.0289 11.0289 11.0989 11.0989 11.2602 11.2602 11.3491 11.3491 11.3533 11.3533 12.0494 12.0494 12.0550 12.0550 12.1759 12.1759 12.2052 12.2052 13.0117 13.0117 13.0501 13.0501 k = 0.1087-0.0628 0.0887 ( 3355 PWs) bands (ev): 4.2296 4.2296 7.9497 7.9497 8.0440 8.0440 8.2560 8.2560 8.2802 8.2802 9.0692 9.0692 9.1699 9.1699 9.1986 9.1986 9.3067 9.3067 9.3155 9.3155 10.1391 10.1391 10.2845 10.2845 10.6666 10.6666 10.7628 10.7628 10.7768 10.7768 10.8325 10.8325 10.8857 10.8857 10.9394 10.9394 11.0459 11.0459 11.1207 11.1207 11.2539 11.2539 11.3451 11.3451 11.3548 11.3548 11.9599 11.9599 12.0620 12.0620 12.2030 12.2030 12.2312 12.2312 13.0115 13.0115 13.0487 13.0487 k = 0.1196-0.0690 0.0976 ( 3347 PWs) bands (ev): 4.2668 4.2668 7.9600 7.9600 8.0168 8.0168 8.2723 8.2723 8.2965 8.2965 9.0569 9.0569 9.1733 9.1733 9.2018 9.2018 9.3109 9.3109 9.3219 9.3219 10.1207 10.1207 10.2803 10.2803 10.6345 10.6345 10.7369 10.7369 10.7396 10.7396 10.8278 10.8278 10.8682 10.8682 10.9436 10.9436 11.0667 11.0667 11.1428 11.1428 11.2483 11.2483 11.3409 11.3409 11.3565 11.3565 11.8733 11.8733 12.0703 12.0703 12.2311 12.2311 12.2583 12.2583 13.0122 13.0122 13.0481 13.0481 k = 0.1304-0.0753 0.1065 ( 3347 PWs) bands (ev): 4.3074 4.3074 7.9712 7.9712 7.9878 7.9878 8.2900 8.2900 8.3142 8.3142 9.0450 9.0450 9.1772 9.1772 9.2056 9.2056 9.3151 9.3151 9.3289 9.3289 10.1021 10.1021 10.2737 10.2737 10.5954 10.5954 10.7022 10.7022 10.7084 10.7084 10.8226 10.8226 10.8514 10.8514 10.9459 10.9459 11.0887 11.0887 11.1646 11.1646 11.2438 11.2438 11.3364 11.3364 11.3583 11.3583 11.7914 11.7914 12.0802 12.0802 12.2598 12.2598 12.2858 12.2858 13.0142 13.0142 13.0486 13.0486 k = 0.1413-0.0816 0.1154 ( 3347 PWs) bands (ev): 4.3513 4.3513 7.9572 7.9572 7.9834 7.9834 8.3091 8.3091 8.3332 8.3332 9.0338 9.0338 9.1818 9.1818 9.2101 9.2101 9.3195 9.3195 9.3365 9.3365 10.0836 10.0836 10.2648 10.2648 10.5492 10.5492 10.6656 10.6656 10.6779 10.6779 10.8167 10.8167 10.8357 10.8357 10.9469 10.9469 11.1086 11.1086 11.1851 11.1851 11.2404 11.2404 11.3316 11.3316 11.3602 11.3602 11.7164 11.7164 12.0922 12.0922 12.2886 12.2886 12.3133 12.3133 13.0175 13.0175 13.0503 13.0503 k = 0.1522-0.0879 0.1242 ( 3331 PWs) bands (ev): 4.3984 4.3984 7.9255 7.9255 7.9965 7.9965 8.3296 8.3296 8.3535 8.3535 9.0232 9.0232 9.1870 9.1870 9.2154 9.2154 9.3239 9.3239 9.3445 9.3445 10.0652 10.0652 10.2535 10.2535 10.4968 10.4968 10.6297 10.6297 10.6457 10.6457 10.8102 10.8102 10.8208 10.8208 10.9470 10.9470 11.1220 11.1220 11.2036 11.2036 11.2385 11.2385 11.3265 11.3265 11.3622 11.3622 11.6515 11.6515 12.1066 12.1066 12.3173 12.3173 12.3403 12.3403 13.0226 13.0226 13.0537 13.0537 k = 0.1630-0.0941 0.1331 ( 3339 PWs) bands (ev): 4.4486 4.4486 7.8927 7.8927 8.0105 8.0105 8.3512 8.3512 8.3749 8.3749 9.0133 9.0133 9.1929 9.1929 9.2214 9.2214 9.3280 9.3280 9.3529 9.3529 10.0470 10.0470 10.2399 10.2399 10.4396 10.4396 10.5939 10.5939 10.6120 10.6120 10.8029 10.8029 10.8064 10.8064 10.9464 10.9464 11.1235 11.1235 11.2186 11.2186 11.2387 11.2387 11.3210 11.3210 11.3642 11.3642 11.6012 11.6012 12.1236 12.1236 12.3454 12.3454 12.3667 12.3667 13.0296 13.0296 13.0589 13.0589 k = 0.1739-0.1004 0.1420 ( 3335 PWs) bands (ev): 4.5020 4.5020 7.8593 7.8593 8.0254 8.0254 8.3741 8.3741 8.3975 8.3975 9.0040 9.0040 9.1998 9.1998 9.2283 9.2283 9.3320 9.3320 9.3618 9.3618 10.0292 10.0292 10.2240 10.2240 10.3791 10.3791 10.5580 10.5580 10.5772 10.5772 10.7927 10.7927 10.7951 10.7951 10.9455 10.9455 11.1084 11.1084 11.2275 11.2275 11.2434 11.2434 11.3152 11.3152 11.3664 11.3664 11.5697 11.5697 12.1435 12.1435 12.3727 12.3727 12.3922 12.3922 13.0387 13.0387 13.0661 13.0661 k = 0.1848-0.1067 0.1509 ( 3335 PWs) bands (ev): 4.5584 4.5584 7.8253 7.8253 8.0411 8.0411 8.3980 8.3980 8.4212 8.4212 8.9952 8.9952 9.2075 9.2075 9.2361 9.2361 9.3357 9.3357 9.3711 9.3711 10.0117 10.0117 10.2059 10.2059 10.3162 10.3162 10.5216 10.5216 10.5411 10.5411 10.7792 10.7792 10.7866 10.7866 10.9443 10.9443 11.0750 11.0750 11.2310 11.2310 11.2514 11.2514 11.3088 11.3088 11.3687 11.3687 11.5580 11.5580 12.1665 12.1665 12.3991 12.3991 12.4167 12.4167 13.0501 13.0501 13.0755 13.0755 k = 0.1957-0.1130 0.1597 ( 3335 PWs) bands (ev): 4.6178 4.6178 7.7911 7.7911 8.0577 8.0577 8.4230 8.4230 8.4459 8.4459 8.9868 8.9868 9.2162 9.2162 9.2449 9.2449 9.3388 9.3388 9.3808 9.3808 9.9947 9.9947 10.1857 10.1857 10.2519 10.2519 10.4845 10.4845 10.5042 10.5042 10.7660 10.7660 10.7773 10.7773 10.9428 10.9428 11.0266 11.0266 11.2334 11.2334 11.2580 11.2580 11.3015 11.3015 11.3711 11.3711 11.5631 11.5631 12.1930 12.1930 12.4244 12.4244 12.4400 12.4400 13.0637 13.0637 13.0871 13.0871 k = 0.2065-0.1192 0.1686 ( 3335 PWs) bands (ev): 4.6799 4.6799 7.7569 7.7569 8.0751 8.0751 8.4489 8.4489 8.4715 8.4715 8.9788 8.9788 9.2259 9.2259 9.2548 9.2548 9.3411 9.3411 9.3909 9.3909 9.9782 9.9782 10.1633 10.1633 10.1870 10.1870 10.4469 10.4469 10.4663 10.4663 10.7527 10.7527 10.7673 10.7673 10.9394 10.9394 10.9697 10.9697 11.2362 11.2362 11.2620 11.2620 11.2934 11.2934 11.3734 11.3734 11.5796 11.5796 12.2228 12.2228 12.4486 12.4486 12.4623 12.4623 13.0796 13.0796 13.1011 13.1011 k = 0.2174-0.1255 0.1775 ( 3343 PWs) bands (ev): 4.7449 4.7449 7.7228 7.7228 8.0932 8.0932 8.4756 8.4756 8.4979 8.4979 8.9707 8.9707 9.2368 9.2368 9.2658 9.2658 9.3425 9.3425 9.4013 9.4013 9.9622 9.9622 10.1224 10.1224 10.1388 10.1388 10.4086 10.4086 10.4277 10.4277 10.7393 10.7393 10.7560 10.7560 10.8997 10.8997 10.9434 10.9434 11.2398 11.2398 11.2631 11.2631 11.2843 11.2843 11.3752 11.3752 11.6028 11.6028 12.2561 12.2561 12.4718 12.4718 12.4837 12.4837 13.0977 13.0977 13.1174 13.1174 k = 0.2283-0.1318 0.1864 ( 3343 PWs) bands (ev): 4.8125 4.8125 7.6890 7.6890 8.1122 8.1122 8.5031 8.5031 8.5250 8.5250 8.9629 8.9629 9.2490 9.2490 9.2781 9.2781 9.3427 9.3427 9.4120 9.4120 9.9467 9.9467 10.0586 10.0586 10.1122 10.1122 10.3697 10.3697 10.3883 10.3883 10.7258 10.7258 10.7427 10.7427 10.8343 10.8343 10.9411 10.9411 11.2442 11.2442 11.2615 11.2615 11.2745 11.2745 11.3762 11.3762 11.6295 11.6295 12.2927 12.2927 12.4940 12.4940 12.5042 12.5042 13.1177 13.1177 13.1358 13.1358 k = 0.2391-0.1381 0.1952 ( 3343 PWs) bands (ev): 4.8826 4.8826 7.6556 7.6556 8.1318 8.1318 8.5314 8.5314 8.5529 8.5529 8.9549 8.9549 9.2623 9.2623 9.2916 9.2916 9.3413 9.3413 9.4230 9.4230 9.9317 9.9317 9.9966 9.9966 10.0837 10.0837 10.3302 10.3302 10.3484 10.3484 10.7118 10.7118 10.7221 10.7221 10.7730 10.7730 10.9398 10.9398 11.2493 11.2493 11.2576 11.2576 11.2640 11.2640 11.3763 11.3763 11.6576 11.6576 12.3326 12.3326 12.5155 12.5155 12.5241 12.5241 13.1395 13.1395 13.1561 13.1561 k = 0.2500-0.1443 0.2041 ( 3359 PWs) bands (ev): 4.9551 4.9551 7.6227 7.6227 8.1521 8.1521 8.5602 8.5602 8.5813 8.5813 8.9466 8.9466 9.2768 9.2768 9.3065 9.3065 9.3379 9.3379 9.4342 9.4342 9.9171 9.9171 9.9374 9.9374 10.0530 10.0530 10.2903 10.2903 10.3079 10.3079 10.6760 10.6760 10.6973 10.6973 10.7360 10.7360 10.9387 10.9387 11.2516 11.2516 11.2527 11.2527 11.2554 11.2554 11.3753 11.3753 11.6856 11.6856 12.3756 12.3756 12.5365 12.5365 12.5435 12.5435 13.1629 13.1629 13.1782 13.1782 k = 0.2609-0.1506 0.2130 ( 3343 PWs) bands (ev): 5.0299 5.0299 7.5905 7.5905 8.1731 8.1731 8.5896 8.5896 8.6103 8.6103 8.9381 8.9381 9.2921 9.2921 9.3229 9.3229 9.3327 9.3327 9.4456 9.4456 9.8807 9.8807 9.9040 9.9040 10.0205 10.0205 10.2500 10.2500 10.2670 10.2670 10.6118 10.6118 10.6824 10.6824 10.7169 10.7169 10.9381 10.9381 11.2409 11.2409 11.2442 11.2442 11.2620 11.2620 11.3733 11.3733 11.7126 11.7126 12.4214 12.4214 12.5573 12.5573 12.5628 12.5628 13.1876 13.1876 13.2017 13.2017 k = 0.2717-0.1569 0.2219 ( 3343 PWs) bands (ev): 5.1068 5.1068 7.5589 7.5589 8.1946 8.1946 8.6193 8.6193 8.6397 8.6397 8.9289 8.9289 9.3050 9.3050 9.3281 9.3281 9.3407 9.3407 9.4572 9.4572 9.8292 9.8292 9.8906 9.8906 9.9860 9.9860 10.2093 10.2093 10.2256 10.2256 10.5449 10.5449 10.6668 10.6668 10.7005 10.7005 10.9377 10.9377 11.2286 11.2286 11.2352 11.2352 11.2691 11.2691 11.3705 11.3705 11.7379 11.7379 12.4695 12.4695 12.5783 12.5783 12.5820 12.5820 13.2132 13.2132 13.2265 13.2265 k = 0.2826-0.1632 0.2307 ( 3343 PWs) bands (ev): 5.1857 5.1857 7.5280 7.5280 8.2166 8.2166 8.6495 8.6495 8.6694 8.6694 8.9190 8.9190 9.3022 9.3022 9.3370 9.3370 9.3599 9.3599 9.4689 9.4689 9.7829 9.7829 9.8779 9.8779 9.9497 9.9497 10.1682 10.1682 10.1840 10.1840 10.4788 10.4788 10.6503 10.6503 10.6839 10.6839 10.9376 10.9376 11.2159 11.2159 11.2250 11.2250 11.2763 11.2763 11.3673 11.3673 11.7611 11.7611 12.5193 12.5193 12.6002 12.6002 12.6014 12.6014 13.2395 13.2395 13.2521 13.2521 k = 0.2935-0.1694 0.2396 ( 3343 PWs) bands (ev): 5.2664 5.2664 7.4977 7.4977 8.2389 8.2389 8.6799 8.6799 8.6994 8.6994 8.9082 8.9082 9.2864 9.2864 9.3561 9.3561 9.3806 9.3806 9.4808 9.4808 9.7428 9.7428 9.8657 9.8657 9.9116 9.9116 10.1270 10.1270 10.1422 10.1422 10.4142 10.4142 10.6329 10.6329 10.6664 10.6664 10.9379 10.9379 11.2031 11.2031 11.2138 11.2138 11.2828 11.2828 11.3647 11.3647 11.7820 11.7820 12.5690 12.5690 12.6210 12.6210 12.6246 12.6246 13.2663 13.2663 13.2784 13.2784 k = 0.3043-0.1757 0.2485 ( 3331 PWs) bands (ev): 5.3487 5.3487 7.4682 7.4682 8.2616 8.2616 8.7105 8.7105 8.7297 8.7297 8.8965 8.8965 9.2648 9.2648 9.3783 9.3783 9.4028 9.4028 9.4928 9.4928 9.7092 9.7092 9.8541 9.8541 9.8719 9.8719 10.0856 10.0856 10.1003 10.1003 10.3517 10.3517 10.6146 10.6146 10.6478 10.6478 10.9386 10.9386 11.1903 11.1903 11.2019 11.2019 11.2874 11.2874 11.3638 11.3638 11.8001 11.8001 12.6129 12.6129 12.6409 12.6409 12.6573 12.6573 13.2934 13.2934 13.3050 13.3050 k = 0.3152-0.1820 0.2574 ( 3339 PWs) bands (ev): 5.4324 5.4324 7.4391 7.4391 8.2845 8.2845 8.7412 8.7412 8.7600 8.7600 8.8836 8.8836 9.2386 9.2386 9.4024 9.4024 9.4262 9.4262 9.5049 9.5049 9.6822 9.6822 9.8307 9.8307 9.8429 9.8429 10.0442 10.0442 10.0583 10.0583 10.2915 10.2915 10.5950 10.5950 10.6276 10.6276 10.9395 10.9395 11.1775 11.1775 11.1895 11.1895 11.2889 11.2889 11.3662 11.3662 11.8155 11.8155 12.6445 12.6445 12.6612 12.6612 12.7045 12.7045 13.3205 13.3205 13.3318 13.3318 k = 0.3261-0.1883 0.2662 ( 3347 PWs) bands (ev): 5.5173 5.5173 7.4106 7.4106 8.3074 8.3074 8.7719 8.7719 8.7905 8.7905 8.8695 8.8695 9.2091 9.2091 9.4283 9.4283 9.4506 9.4506 9.5175 9.5175 9.6614 9.6614 9.7883 9.7883 9.8323 9.8323 10.0027 10.0027 10.0164 10.0164 10.2338 10.2338 10.5741 10.5741 10.6058 10.6058 10.9409 10.9409 11.1652 11.1652 11.1767 11.1767 11.2864 11.2864 11.3726 11.3726 11.8280 11.8280 12.6691 12.6691 12.6818 12.6818 12.7607 12.7607 13.3474 13.3474 13.3585 13.3585 k = 0.3370-0.1945 0.2751 ( 3347 PWs) bands (ev): 5.6033 5.6033 7.3824 7.3824 8.3301 8.3301 8.8021 8.8021 8.8211 8.8211 8.8547 8.8547 9.1775 9.1775 9.4559 9.4559 9.4754 9.4754 9.5308 9.5308 9.6460 9.6460 9.7450 9.7450 9.8220 9.8220 9.9614 9.9614 9.9747 9.9747 10.1789 10.1789 10.5519 10.5519 10.5824 10.5824 10.9428 10.9428 11.1534 11.1534 11.1637 11.1637 11.2804 11.2804 11.3830 11.3830 11.8377 11.8377 12.6918 12.6918 12.7026 12.7026 12.8208 12.8208 13.3740 13.3740 13.3849 13.3849 k = 0.3478-0.2008 0.2840 ( 3347 PWs) bands (ev): 5.6899 5.6899 7.3544 7.3544 8.3525 8.3525 8.8257 8.8257 8.8451 8.8451 8.8517 8.8517 9.1452 9.1452 9.4849 9.4849 9.4993 9.4993 9.5457 9.5457 9.6351 9.6351 9.7014 9.7014 9.8121 9.8121 9.9204 9.9204 9.9334 9.9334 10.1268 10.1268 10.5283 10.5283 10.5573 10.5573 10.9451 10.9451 11.1422 11.1422 11.1508 11.1508 11.2718 11.2718 11.3964 11.3964 11.8444 11.8444 12.7138 12.7138 12.7236 12.7236 12.8833 12.8833 13.4002 13.4002 13.4109 13.4109 k = 0.3587-0.2071 0.2929 ( 3338 PWs) bands (ev): 5.7771 5.7771 7.3264 7.3264 8.3742 8.3742 8.8152 8.8152 8.8681 8.8681 8.8824 8.8824 9.1135 9.1135 9.5151 9.5151 9.5197 9.5197 9.5639 9.5639 9.6280 9.6280 9.6586 9.6586 9.8024 9.8024 9.8800 9.8800 9.8925 9.8925 10.0776 10.0776 10.5033 10.5033 10.5304 10.5304 10.9479 10.9479 11.1319 11.1319 11.1381 11.1381 11.2613 11.2613 11.4121 11.4121 11.8483 11.8483 12.7354 12.7354 12.7445 12.7445 12.9476 12.9476 13.4256 13.4256 13.4362 13.4362 k = 0.3696-0.2134 0.3017 ( 3346 PWs) bands (ev): 5.8645 5.8645 7.2980 7.2980 8.3950 8.3950 8.7959 8.7959 8.8984 8.8984 8.9131 8.9131 9.0838 9.0838 9.5332 9.5332 9.5460 9.5460 9.5829 9.5829 9.6224 9.6224 9.6241 9.6241 9.7924 9.7924 9.8408 9.8408 9.8524 9.8524 10.0313 10.0313 10.4767 10.4767 10.5018 10.5018 10.9512 10.9512 11.1225 11.1225 11.1257 11.1257 11.2497 11.2497 11.4294 11.4294 11.8494 11.8494 12.7567 12.7567 12.7653 12.7653 13.0134 13.0134 13.4504 13.4504 13.4607 13.4607 k = 0.3804-0.2196 0.3106 ( 3346 PWs) bands (ev): 5.9518 5.9518 7.2691 7.2691 8.4146 8.4146 8.7746 8.7746 8.9292 8.9292 8.9437 8.9437 9.0572 9.0572 9.5316 9.5316 9.5763 9.5763 9.5775 9.5775 9.6242 9.6242 9.6264 9.6264 9.7791 9.7791 9.8061 9.8061 9.8131 9.8131 9.9880 9.9880 10.4488 10.4488 10.4715 10.4715 10.9550 10.9550 11.1136 11.1136 11.1142 11.1142 11.2372 11.2372 11.4482 11.4482 11.8477 11.8477 12.7774 12.7774 12.7856 12.7856 13.0806 13.0806 13.4742 13.4742 13.4842 13.4842 k = 0.3913-0.2259 0.3195 ( 3346 PWs) bands (ev): 6.0387 6.0387 7.2392 7.2392 8.4326 8.4326 8.7520 8.7520 8.9600 8.9600 8.9741 8.9741 9.0348 9.0348 9.5027 9.5027 9.5746 9.5746 9.6005 9.6005 9.6323 9.6323 9.6557 9.6557 9.7526 9.7526 9.7753 9.7753 9.7866 9.7866 9.9477 9.9477 10.4193 10.4193 10.4396 10.4396 10.9592 10.9592 11.1022 11.1022 11.1070 11.1070 11.2243 11.2243 11.4682 11.4682 11.8435 11.8435 12.7975 12.7975 12.8053 12.8053 13.1489 13.1489 13.4969 13.4969 13.5065 13.5065 k = 0.4022-0.2322 0.3284 ( 3326 PWs) bands (ev): 6.1248 6.1248 7.2080 7.2080 8.4487 8.4487 8.7284 8.7284 8.9907 8.9907 9.0028 9.0028 9.0192 9.0192 9.4626 9.4626 9.5788 9.5788 9.6107 9.6107 9.6538 9.6538 9.6891 9.6891 9.7194 9.7194 9.7399 9.7399 9.7781 9.7781 9.9103 9.9103 10.3885 10.3885 10.4063 10.4063 10.9639 10.9639 11.0913 11.0913 11.1010 11.1010 11.2112 11.2112 11.4891 11.4891 11.8369 11.8369 12.8167 12.8167 12.8241 12.8241 13.2183 13.2183 13.5184 13.5184 13.5276 13.5276 k = 0.4130-0.2385 0.3372 ( 3326 PWs) bands (ev): 6.2099 6.2099 7.1752 7.1752 8.4628 8.4628 8.7041 8.7041 9.0034 9.0034 9.0211 9.0211 9.0370 9.0370 9.4206 9.4206 9.5814 9.5814 9.6140 9.6140 9.6654 9.6654 9.7012 9.7012 9.7079 9.7079 9.7245 9.7245 9.7746 9.7746 9.8758 9.8758 10.3565 10.3565 10.3716 10.3716 10.9690 10.9690 11.0810 11.0810 11.0963 11.0963 11.1979 11.1979 11.5108 11.5108 11.8279 11.8279 12.8349 12.8349 12.8417 12.8417 13.2888 13.2888 13.5385 13.5385 13.5472 13.5472 k = 0.4239-0.2447 0.3461 ( 3326 PWs) bands (ev): 6.2934 6.2934 7.1402 7.1402 8.4748 8.4748 8.6796 8.6796 8.9978 8.9978 9.0510 9.0510 9.0667 9.0667 9.3790 9.3790 9.5783 9.5783 9.6113 9.6113 9.6449 9.6449 9.6832 9.6832 9.7158 9.7158 9.7604 9.7604 9.7797 9.7797 9.8443 9.8443 10.3233 10.3233 10.3358 10.3358 10.9744 10.9744 11.0713 11.0713 11.0928 11.0928 11.1848 11.1848 11.5331 11.5331 11.8167 11.8167 12.8516 12.8516 12.8579 12.8579 13.3600 13.3600 13.5571 13.5571 13.5650 13.5650 k = 0.4348-0.2510 0.3550 ( 3326 PWs) bands (ev): 6.3751 6.3751 7.1027 7.1027 8.4850 8.4850 8.6553 8.6553 8.9980 8.9980 9.0799 9.0799 9.0964 9.0964 9.3387 9.3387 9.5661 9.5661 9.5907 9.5907 9.6365 9.6365 9.6686 9.6686 9.7243 9.7243 9.7954 9.7954 9.7998 9.7998 9.8174 9.8174 10.2891 10.2891 10.2991 10.2991 10.9802 10.9802 11.0623 11.0623 11.0908 11.0908 11.1720 11.1720 11.5558 11.5558 11.8036 11.8036 12.8668 12.8668 12.8725 12.8725 13.4321 13.4321 13.5739 13.5739 13.5810 13.5810 k = 0.4457-0.2573 0.3639 ( 3318 PWs) bands (ev): 6.4546 6.4546 7.0623 7.0623 8.4938 8.4938 8.6318 8.6318 9.0040 9.0040 9.1071 9.1071 9.1254 9.1254 9.3005 9.3005 9.5453 9.5453 9.5601 9.5601 9.6398 9.6398 9.6640 9.6640 9.7235 9.7235 9.7874 9.7874 9.8309 9.8309 9.8365 9.8365 10.2544 10.2544 10.2618 10.2618 10.9863 10.9863 11.0539 11.0539 11.0901 11.0901 11.1596 11.1596 11.5789 11.5789 11.7886 11.7886 12.8802 12.8802 12.8851 12.8851 13.5049 13.5049 13.5887 13.5887 13.5949 13.5949 k = 0.4565-0.2636 0.3727 ( 3318 PWs) bands (ev): 6.5314 6.5314 7.0186 7.0186 8.5018 8.5018 8.6096 8.6096 9.0155 9.0155 9.1306 9.1306 9.1531 9.1531 9.2657 9.2657 9.5204 9.5204 9.5293 9.5293 9.6462 9.6462 9.6655 9.6655 9.7191 9.7191 9.7643 9.7643 9.8661 9.8661 9.8730 9.8730 10.2194 10.2194 10.2245 10.2245 10.9925 10.9925 11.0460 11.0460 11.0909 11.0909 11.1477 11.1477 11.6021 11.6021 11.7720 11.7720 12.8916 12.8916 12.8956 12.8956 13.5783 13.5783 13.6013 13.6013 13.6064 13.6064 k = 0.4674-0.2698 0.3816 ( 3314 PWs) bands (ev): 6.6053 6.6053 6.9713 6.9713 8.5097 8.5097 8.5890 8.5890 9.0318 9.0318 9.1462 9.1462 9.1786 9.1786 9.2380 9.2380 9.4957 9.4957 9.5010 9.5010 9.6543 9.6543 9.6700 9.6700 9.7133 9.7133 9.7432 9.7432 9.9020 9.9020 9.9087 9.9087 10.1851 10.1851 10.1880 10.1880 10.9989 10.9989 11.0386 11.0386 11.0933 11.0933 11.1366 11.1366 11.6252 11.6252 11.7540 11.7540 12.9008 12.9008 12.9039 12.9039 13.6116 13.6116 13.6155 13.6155 13.6525 13.6525 k = 0.4783-0.2761 0.3905 ( 3314 PWs) bands (ev): 6.6758 6.6758 6.9201 6.9201 8.5184 8.5184 8.5705 8.5705 9.0522 9.0522 9.1450 9.1450 9.2003 9.2003 9.2249 9.2249 9.4744 9.4744 9.4775 9.4775 9.6638 9.6638 9.6755 9.6755 9.7072 9.7072 9.7247 9.7247 9.9361 9.9361 9.9416 9.9416 10.1529 10.1529 10.1540 10.1540 11.0053 11.0053 11.0315 11.0315 11.0971 11.0971 11.1263 11.1263 11.6482 11.6482 11.7346 11.7346 12.9076 12.9076 12.9097 12.9097 13.6192 13.6192 13.6219 13.6219 13.7271 13.7271 k = 0.4891-0.2824 0.3994 ( 3306 PWs) bands (ev): 6.7428 6.7428 6.8650 6.8650 8.5284 8.5284 8.5542 8.5542 9.0757 9.0757 9.1264 9.1264 9.2161 9.2161 9.2246 9.2246 9.4597 9.4597 9.4612 9.4612 9.6741 9.6741 9.6808 9.6808 9.7015 9.7015 9.7091 9.7091 9.9640 9.9640 9.9674 9.9674 10.1269 10.1269 10.1272 10.1272 11.0117 11.0117 11.0248 11.0248 11.1024 11.1024 11.1172 11.1172 11.6708 11.6708 11.7142 11.7142 12.9120 12.9120 12.9131 12.9131 13.6242 13.6242 13.6255 13.6255 13.8021 13.8021 k = 0.5000-0.2887 0.4082 ( 3306 PWs) bands (ev): 6.8058 6.8058 6.8059 6.8059 8.5402 8.5402 8.5403 8.5403 9.1011 9.1011 9.1014 9.1014 9.2239 9.2239 9.2242 9.2242 9.4548 9.4548 9.4550 9.4550 9.6818 9.6818 9.6821 9.6821 9.6997 9.6997 9.7000 9.7000 9.9769 9.9769 9.9771 9.9771 10.1157 10.1157 10.1161 10.1161 11.0180 11.0180 11.0184 11.0184 11.1090 11.1090 11.1093 11.1093 11.6927 11.6927 11.6929 11.6929 12.9138 12.9138 12.9139 12.9139 13.6262 13.6262 13.6264 13.6264 13.8776 13.8776 k = 0.5000-0.2887 0.4082 ( 3306 PWs) bands (ev): 6.8058 6.8058 6.8059 6.8059 8.5402 8.5402 8.5403 8.5403 9.1011 9.1011 9.1014 9.1014 9.2239 9.2239 9.2242 9.2242 9.4548 9.4548 9.4550 9.4550 9.6818 9.6818 9.6821 9.6821 9.6997 9.6997 9.7000 9.7000 9.9769 9.9769 9.9771 9.9771 10.1157 10.1157 10.1161 10.1161 11.0180 11.0180 11.0184 11.0184 11.1090 11.1090 11.1093 11.1093 11.6927 11.6927 11.6929 11.6929 12.9138 12.9138 12.9139 12.9139 13.6262 13.6262 13.6264 13.6264 13.8776 13.8776 k = 0.5000-0.2761 0.4171 ( 3306 PWs) bands (ev): 6.8060 6.8060 6.8071 6.8071 8.5376 8.5376 8.5400 8.5400 9.0982 9.0982 9.1036 9.1036 9.2243 9.2243 9.2259 9.2259 9.4459 9.4459 9.4578 9.4578 9.6758 9.6758 9.6852 9.6852 9.6974 9.6974 9.7059 9.7059 9.9748 9.9748 9.9836 9.9836 10.1156 10.1156 10.1183 10.1183 11.0090 11.0090 11.0250 11.0250 11.1045 11.1045 11.1149 11.1149 11.6937 11.6937 11.6940 11.6940 12.9119 12.9119 12.9151 12.9151 13.6205 13.6205 13.6239 13.6239 13.8811 13.8812 k = 0.5000-0.2636 0.4260 ( 3314 PWs) bands (ev): 6.8073 6.8073 6.8095 6.8095 8.5321 8.5321 8.5370 8.5370 9.0945 9.0945 9.1049 9.1049 9.2270 9.2270 9.2296 9.2296 9.4317 9.4317 9.4539 9.4539 9.6694 9.6694 9.6845 9.6845 9.6970 9.6971 9.7153 9.7153 9.9773 9.9773 9.9934 9.9934 10.1177 10.1177 10.1227 10.1227 10.9978 10.9978 11.0284 11.0284 11.1018 11.1018 11.1214 11.1214 11.6965 11.6965 11.6970 11.6970 12.9095 12.9095 12.9156 12.9156 13.6074 13.6074 13.6140 13.6140 13.8927 13.8927 k = 0.5000-0.2510 0.4349 ( 3322 PWs) bands (ev): 6.8099 6.8099 6.8132 6.8132 8.5241 8.5241 8.5313 8.5313 9.0903 9.0903 9.1051 9.1051 9.2318 9.2318 9.2349 9.2349 9.4135 9.4135 9.4435 9.4435 9.6641 9.6641 9.6808 9.6808 9.6989 9.6989 9.7263 9.7263 9.9841 9.9841 10.0050 10.0050 10.1227 10.1227 10.1290 10.1290 10.9850 10.9850 11.0280 11.0280 11.1019 11.1019 11.1283 11.1283 11.7012 11.7012 11.7019 11.7019 12.9066 12.9066 12.9155 12.9155 13.5882 13.5882 13.5979 13.5979 13.9109 13.9112 k = 0.5000-0.2385 0.4437 ( 3328 PWs) bands (ev): 6.8136 6.8136 6.8180 6.8180 8.5137 8.5137 8.5231 8.5231 9.0859 9.0859 9.1042 9.1042 9.2386 9.2386 9.2412 9.2412 9.3922 9.3922 9.4276 9.4276 9.6593 9.6593 9.6752 9.6752 9.7034 9.7034 9.7382 9.7382 9.9941 9.9941 10.0166 10.0166 10.1312 10.1312 10.1375 10.1375 10.9707 10.9707 11.0234 11.0234 11.1051 11.1051 11.1356 11.1356 11.7076 11.7076 11.7085 11.7085 12.9033 12.9033 12.9147 12.9147 13.5643 13.5643 13.5770 13.5770 13.9345 13.9347 k = 0.5000-0.2259 0.4526 ( 3328 PWs) bands (ev): 6.8185 6.8185 6.8240 6.8240 8.5012 8.5012 8.5126 8.5126 9.0811 9.0811 9.1021 9.1021 9.2470 9.2470 9.2479 9.2479 9.3688 9.3688 9.4080 9.4080 9.6546 9.6546 9.6683 9.6683 9.7109 9.7109 9.7508 9.7508 10.0060 10.0060 10.0272 10.0272 10.1432 10.1432 10.1483 10.1483 10.9552 10.9552 11.0155 11.0155 11.1110 11.1110 11.1434 11.1434 11.7154 11.7154 11.7165 11.7165 12.8998 12.8998 12.9134 12.9134 13.5369 13.5369 13.5523 13.5523 13.9625 13.9628 k = 0.5000-0.2134 0.4615 ( 3330 PWs) bands (ev): 6.8245 6.8245 6.8311 6.8311 8.4868 8.4868 8.5000 8.5000 9.0759 9.0759 9.0989 9.0989 9.2540 9.2540 9.2566 9.2566 9.3442 9.3442 9.3870 9.3870 9.6495 9.6495 9.6604 9.6604 9.7212 9.7212 9.7641 9.7641 10.0185 10.0185 10.0359 10.0359 10.1587 10.1587 10.1613 10.1613 10.9385 10.9385 11.0049 11.0049 11.1189 11.1189 11.1517 11.1517 11.7244 11.7244 11.7257 11.7257 12.8961 12.8961 12.9115 12.9115 13.5068 13.5068 13.5247 13.5247 13.9940 13.9945 k = 0.5000-0.2008 0.4704 ( 3330 PWs) bands (ev): 6.8314 6.8314 6.8392 6.8392 8.4709 8.4709 8.4857 8.4857 9.0703 9.0703 9.0945 9.0945 9.2581 9.2581 9.2666 9.2666 9.3197 9.3197 9.3671 9.3671 9.6440 9.6440 9.6521 9.6521 9.7338 9.7338 9.7781 9.7781 10.0306 10.0306 10.0427 10.0427 10.1764 10.1764 10.1769 10.1769 10.9208 10.9208 10.9926 10.9926 11.1282 11.1282 11.1606 11.1606 11.7343 11.7343 11.7359 11.7359 12.8926 12.8926 12.9092 12.9092 13.4745 13.4745 13.4947 13.4947 14.0286 14.0286 k = 0.5000-0.1883 0.4792 ( 3336 PWs) bands (ev): 6.8393 6.8393 6.8482 6.8482 8.4538 8.4538 8.4700 8.4700 9.0640 9.0640 9.0886 9.0886 9.2577 9.2577 9.2741 9.2741 9.2986 9.2986 9.3517 9.3517 9.6380 9.6380 9.6435 9.6435 9.7483 9.7483 9.7930 9.7930 10.0418 10.0418 10.0481 10.0481 10.1934 10.1934 10.1967 10.1967 10.9023 10.9023 10.9790 10.9790 11.1387 11.1387 11.1700 11.1700 11.7448 11.7448 11.7467 11.7467 12.8892 12.8892 12.9067 12.9067 13.4405 13.4405 13.4627 13.4627 14.0659 14.0659 k = 0.5000-0.1757 0.4881 ( 3336 PWs) bands (ev): 6.8480 6.8480 6.8579 6.8579 8.4358 8.4358 8.4532 8.4532 9.0569 9.0569 9.0811 9.0811 9.2507 9.2507 9.2647 9.2647 9.2960 9.2960 9.3437 9.3437 9.6316 9.6316 9.6348 9.6348 9.7643 9.7643 9.8087 9.8087 10.0517 10.0517 10.0523 10.0523 10.2117 10.2117 10.2174 10.2174 10.8833 10.8833 10.9646 10.9646 11.1501 11.1501 11.1799 11.1799 11.7557 11.7557 11.7580 11.7580 12.8862 12.8862 12.9041 12.9041 13.4050 13.4050 13.4291 13.4291 14.1055 14.1055 k = 0.5000-0.1632 0.4970 ( 3332 PWs) bands (ev): 6.8573 6.8573 6.8683 6.8683 8.4171 8.4171 8.4357 8.4357 9.0489 9.0489 9.0717 9.0717 9.2377 9.2377 9.2453 9.2453 9.3056 9.3056 9.3432 9.3432 9.6249 9.6249 9.6261 9.6261 9.7815 9.7815 9.8251 9.8251 10.0555 10.0555 10.0605 10.0605 10.2307 10.2307 10.2382 10.2382 10.8639 10.8639 10.9497 10.9497 11.1622 11.1622 11.1903 11.1903 11.7667 11.7667 11.7695 11.7695 12.8836 12.8836 12.9015 12.9015 13.3685 13.3685 13.3942 13.3942 14.1470 14.1473 k = 0.5000-0.1506 0.5059 ( 3338 PWs) bands (ev): 6.8671 6.8671 6.8792 6.8792 8.3981 8.3981 8.4177 8.4177 9.0396 9.0396 9.0603 9.0603 9.2217 9.2217 9.2269 9.2269 9.3166 9.3166 9.3477 9.3477 9.6174 9.6174 9.6178 9.6178 9.7997 9.7997 9.8422 9.8422 10.0581 10.0581 10.0681 10.0681 10.2499 10.2499 10.2584 10.2584 10.8444 10.8444 10.9346 10.9346 11.1750 11.1750 11.2012 11.2012 11.7776 11.7776 11.7809 11.7809 12.8817 12.8817 12.8991 12.8991 13.3313 13.3313 13.3583 13.3583 14.1903 14.1915 k = 0.5000-0.1381 0.5147 ( 3330 PWs) bands (ev): 6.8772 6.8772 6.8904 6.8904 8.3790 8.3790 8.3995 8.3995 9.0291 9.0291 9.0470 9.0470 9.2056 9.2056 9.2113 9.2113 9.3278 9.3278 9.3547 9.3547 9.6088 9.6088 9.6105 9.6105 9.8187 9.8187 9.8597 9.8597 10.0600 10.0600 10.0747 10.0747 10.2688 10.2688 10.2777 10.2777 10.8249 10.8249 10.9196 10.9196 11.1883 11.1883 11.2124 11.2124 11.7882 11.7882 11.7922 11.7922 12.8805 12.8805 12.8972 12.8972 13.2939 13.2939 13.3219 13.3220 14.2342 14.2342 k = 0.5000-0.1255 0.5236 ( 3334 PWs) bands (ev): 6.8875 6.8875 6.9017 6.9017 8.3602 8.3602 8.3815 8.3815 9.0175 9.0175 9.0322 9.0322 9.1908 9.1908 9.1985 9.1985 9.3387 9.3387 9.3629 9.3629 9.6004 9.6004 9.6030 9.6030 9.8381 9.8381 9.8775 9.8775 10.0612 10.0612 10.0804 10.0804 10.2869 10.2869 10.2957 10.2957 10.8057 10.8057 10.9049 10.9049 11.2016 11.2016 11.2236 11.2236 11.7983 11.7983 11.8031 11.8031 12.8803 12.8803 12.8959 12.8959 13.2565 13.2565 13.2854 13.2854 14.2790 14.2793 k = 0.5000-0.1130 0.5325 ( 3326 PWs) bands (ev): 6.8977 6.8977 6.9129 6.9129 8.3420 8.3420 8.3640 8.3640 9.0050 9.0050 9.0165 9.0165 9.1781 9.1781 9.1883 9.1883 9.3493 9.3493 9.3715 9.3715 9.5921 9.5921 9.5955 9.5955 9.8577 9.8577 9.8954 9.8954 10.0617 10.0617 10.0853 10.0853 10.3040 10.3040 10.3123 10.3123 10.7871 10.7871 10.8907 10.8907 11.2151 11.2151 11.2348 11.2348 11.8079 11.8079 11.8134 11.8134 12.8810 12.8810 12.8954 12.8954 13.2197 13.2197 13.2491 13.2491 14.3213 14.3213 k = 0.5000-0.1004 0.5414 ( 3330 PWs) bands (ev): 6.9077 6.9077 6.9239 6.9239 8.3245 8.3245 8.3471 8.3471 8.9922 8.9922 9.0005 9.0005 9.1675 9.1675 9.1804 9.1804 9.3593 9.3593 9.3802 9.3802 9.5840 9.5840 9.5879 9.5879 9.8774 9.8774 9.9130 9.9130 10.0613 10.0613 10.0893 10.0893 10.3198 10.3198 10.3273 10.3273 10.7693 10.7693 10.8773 10.8773 11.2282 11.2282 11.2456 11.2456 11.8166 11.8166 11.8231 11.8231 12.8830 12.8830 12.8959 12.8959 13.1837 13.1837 13.2134 13.2134 14.3624 14.3624 k = 0.5000-0.0879 0.5502 ( 3332 PWs) bands (ev): 6.9172 6.9172 6.9343 6.9343 8.3082 8.3082 8.3314 8.3314 8.9794 8.9794 8.9851 8.9851 9.1590 9.1590 9.1743 9.1743 9.3687 9.3687 9.3887 9.3887 9.5763 9.5763 9.5804 9.5804 9.8968 9.8968 9.9301 9.9301 10.0600 10.0600 10.0925 10.0925 10.3340 10.3340 10.3405 10.3405 10.7526 10.7526 10.8649 10.8649 11.2408 11.2408 11.2560 11.2560 11.8245 11.8245 11.8320 11.8320 12.8862 12.8862 12.8975 12.8975 13.1489 13.1489 13.1788 13.1788 14.4018 14.4018 k = 0.5000-0.0753 0.5591 ( 3322 PWs) bands (ev): 6.9260 6.9260 6.9439 6.9439 8.2933 8.2933 8.3170 8.3170 8.9674 8.9674 8.9708 8.9708 9.1523 9.1523 9.1697 9.1697 9.3774 9.3774 9.3968 9.3968 9.5691 9.5691 9.5733 9.5733 9.9158 9.9158 9.9464 9.9464 10.0577 10.0577 10.0948 10.0948 10.3465 10.3465 10.3520 10.3520 10.7372 10.7372 10.8537 10.8537 11.2526 11.2526 11.2658 11.2658 11.8315 11.8315 11.8400 11.8400 12.8908 12.8908 12.9007 12.9007 13.1158 13.1158 13.1457 13.1457 14.4388 14.4400 k = 0.5000-0.0628 0.5680 ( 3318 PWs) bands (ev): 6.9339 6.9339 6.9526 6.9526 8.2800 8.2800 8.3042 8.3042 8.9564 8.9564 8.9581 8.9581 9.1470 9.1470 9.1661 9.1661 9.3852 9.3852 9.4042 9.4042 9.5623 9.5623 9.5665 9.5665 9.9340 9.9340 9.9614 9.9614 10.0543 10.0543 10.0964 10.0964 10.3574 10.3574 10.3616 10.3616 10.7236 10.7236 10.8438 10.8438 11.2633 11.2633 11.2745 11.2745 11.8374 11.8374 11.8470 11.8470 12.8969 12.8969 12.9054 12.9054 13.0846 13.0846 13.1145 13.1145 14.4724 14.4724 k = 0.5000-0.0502 0.5769 ( 3320 PWs) bands (ev): 6.9407 6.9407 6.9600 6.9600 8.2688 8.2688 8.2933 8.2933 8.9469 8.9469 8.9473 8.9473 9.1430 9.1430 9.1634 9.1634 9.3921 9.3921 9.4109 9.4109 9.5564 9.5564 9.5604 9.5604 9.9512 9.9512 9.9746 9.9746 10.0496 10.0496 10.0973 10.0973 10.3663 10.3663 10.3695 10.3695 10.7118 10.7118 10.8354 10.8354 11.2726 11.2726 11.2820 11.2820 11.8424 11.8424 11.8528 11.8528 12.9044 12.9044 12.9119 12.9119 13.0556 13.0556 13.0858 13.0858 14.5018 14.5023 k = 0.5000-0.0377 0.5857 ( 3324 PWs) bands (ev): 6.9462 6.9462 6.9660 6.9660 8.2598 8.2598 8.2846 8.2846 8.9386 8.9386 8.9393 8.9393 9.1401 9.1401 9.1615 9.1615 9.3978 9.3978 9.4164 9.4164 9.5513 9.5513 9.5552 9.5552 9.9671 9.9671 9.9857 9.9857 10.0438 10.0438 10.0975 10.0975 10.3733 10.3733 10.3756 10.3756 10.7023 10.7023 10.8288 10.8288 11.2801 11.2801 11.2881 11.2881 11.8462 11.8462 11.8575 11.8575 12.9129 12.9129 12.9204 12.9204 13.0292 13.0292 13.0602 13.0602 14.5260 14.5261 k = 0.5000-0.0251 0.5946 ( 3324 PWs) bands (ev): 6.9503 6.9503 6.9704 6.9704 8.2532 8.2532 8.2782 8.2782 8.9323 8.9323 8.9337 8.9337 9.1381 9.1381 9.1602 9.1602 9.4020 9.4020 9.4207 9.4207 9.5475 9.5475 9.5512 9.5512 9.9812 9.9812 9.9942 9.9942 10.0371 10.0371 10.0974 10.0974 10.3784 10.3784 10.3799 10.3799 10.6953 10.6953 10.8239 10.8239 11.2856 11.2856 11.2926 11.2926 11.8490 11.8490 11.8609 11.8609 12.9219 12.9219 12.9308 12.9308 13.0058 13.0058 13.0388 13.0388 14.5441 14.5441 k = 0.5000-0.0126 0.6035 ( 3316 PWs) bands (ev): 6.9528 6.9528 6.9731 6.9731 8.2491 8.2491 8.2743 8.2743 8.9285 8.9285 8.9304 8.9304 9.1370 9.1370 9.1594 9.1594 9.4047 9.4047 9.4234 9.4234 9.5451 9.5451 9.5486 9.5486 9.9923 9.9923 9.9996 9.9996 10.0305 10.0305 10.0972 10.0972 10.3814 10.3814 10.3825 10.3825 10.6911 10.6911 10.8210 10.8210 11.2890 11.2890 11.2953 11.2953 11.8507 11.8507 11.8629 11.8629 12.9295 12.9295 12.9424 12.9424 12.9863 12.9863 13.0237 13.0237 14.5552 14.5553 k = 0.5000 0.0000 0.6124 ( 3316 PWs) bands (ev): 6.9536 6.9536 6.9740 6.9741 8.2478 8.2478 8.2730 8.2730 8.9273 8.9273 8.9292 8.9292 9.1366 9.1366 9.1592 9.1592 9.4056 9.4056 9.4244 9.4244 9.5443 9.5443 9.5477 9.5477 9.9972 9.9972 10.0015 10.0015 10.0272 10.0272 10.0971 10.0971 10.3824 10.3824 10.3833 10.3833 10.6896 10.6896 10.8200 10.8200 11.2902 11.2902 11.2962 11.2962 11.8512 11.8512 11.8636 11.8636 12.9327 12.9327 12.9498 12.9498 12.9762 12.9762 13.0180 13.0180 14.5590 14.5591 k = 0.5000 0.0000 0.6124 ( 3316 PWs) bands (ev): 6.9536 6.9536 6.9740 6.9741 8.2478 8.2478 8.2730 8.2730 8.9273 8.9273 8.9292 8.9292 9.1366 9.1366 9.1592 9.1592 9.4056 9.4056 9.4244 9.4244 9.5443 9.5443 9.5477 9.5477 9.9972 9.9972 10.0015 10.0015 10.0272 10.0272 10.0971 10.0971 10.3824 10.3824 10.3833 10.3833 10.6896 10.6896 10.8200 10.8200 11.2902 11.2902 11.2962 11.2962 11.8512 11.8512 11.8636 11.8636 12.9327 12.9327 12.9498 12.9498 12.9762 12.9762 13.0180 13.0180 14.5590 14.5590 k = 0.4926 0.0127 0.6124 ( 3316 PWs) bands (ev): 6.9368 6.9368 6.9897 6.9897 8.2397 8.2397 8.2814 8.2814 8.9102 8.9102 8.9465 8.9465 9.1345 9.1345 9.1625 9.1625 9.4047 9.4047 9.4243 9.4243 9.5382 9.5382 9.5558 9.5558 9.9875 9.9875 10.0014 10.0014 10.0335 10.0335 10.0996 10.0996 10.3690 10.3690 10.3961 10.3961 10.6904 10.6904 10.8205 10.8205 11.2828 11.2828 11.3029 11.3029 11.8415 11.8415 11.8735 11.8735 12.9221 12.9221 12.9476 12.9476 12.9846 12.9846 13.0239 13.0239 14.5379 14.5379 k = 0.4853 0.0255 0.6124 ( 3326 PWs) bands (ev): 6.9134 6.9134 7.0098 7.0098 8.2259 8.2259 8.2960 8.2960 8.8929 8.8929 8.9637 8.9637 9.1316 9.1316 9.1694 9.1694 9.4025 9.4025 9.4236 9.4236 9.5341 9.5341 9.5658 9.5658 9.9722 9.9722 9.9936 9.9937 10.0465 10.0465 10.1062 10.1062 10.3565 10.3565 10.4068 10.4068 10.6925 10.6925 10.8220 10.8220 11.2729 11.2729 11.3110 11.3110 11.8277 11.8277 11.8880 11.8880 12.8960 12.8960 12.9489 12.9489 13.0008 13.0008 13.0369 13.0369 14.4953 14.4953 k = 0.4779 0.0382 0.6124 ( 3320 PWs) bands (ev): 6.8903 6.8903 7.0280 7.0280 8.2118 8.2118 8.3111 8.3111 8.8765 8.8765 8.9786 8.9786 9.1317 9.1317 9.1774 9.1774 9.3996 9.3996 9.4215 9.4215 9.5336 9.5336 9.5764 9.5764 9.9552 9.9552 9.9819 9.9819 10.0597 10.0597 10.1163 10.1163 10.3452 10.3452 10.4155 10.4155 10.6959 10.6959 10.8243 10.8243 11.2626 11.2626 11.3182 11.3182 11.8140 11.8140 11.9031 11.9031 12.8664 12.8664 12.9511 12.9511 13.0192 13.0192 13.0544 13.0544 14.4421 14.4421 k = 0.4706 0.0509 0.6124 ( 3318 PWs) bands (ev): 6.8681 6.8681 7.0441 7.0441 8.1982 8.1982 8.3256 8.3256 8.8611 8.8611 8.9898 8.9898 9.1364 9.1364 9.1858 9.1858 9.3963 9.3963 9.4180 9.4180 9.5363 9.5363 9.5874 9.5874 9.9371 9.9371 9.9682 9.9682 10.0709 10.0709 10.1292 10.1292 10.3351 10.3351 10.4224 10.4224 10.7004 10.7004 10.8272 10.8272 11.2521 11.2521 11.3242 11.3242 11.8008 11.8008 11.9187 11.9187 12.8365 12.8365 12.9530 12.9530 13.0388 13.0388 13.0751 13.0751 14.3822 14.3822 k = 0.4632 0.0637 0.6124 ( 3316 PWs) bands (ev): 6.8469 6.8469 7.0582 7.0582 8.1854 8.1854 8.3389 8.3389 8.8466 8.8466 8.9965 8.9965 9.1462 9.1462 9.1947 9.1947 9.3929 9.3929 9.4135 9.4135 9.5415 9.5415 9.5988 9.5988 9.9181 9.9181 9.9535 9.9535 10.0790 10.0790 10.1446 10.1446 10.3262 10.3262 10.4277 10.4277 10.7057 10.7057 10.8304 10.8304 11.2415 11.2415 11.3291 11.3291 11.7883 11.7883 11.9344 11.9344 12.8073 12.8073 12.9545 12.9545 13.0600 13.0600 13.0982 13.0982 14.3179 14.3179 k = 0.4559 0.0764 0.6124 ( 3320 PWs) bands (ev): 6.8270 6.8270 7.0706 7.0706 8.1734 8.1734 8.3510 8.3510 8.8331 8.8331 8.9992 8.9992 9.1602 9.1602 9.2041 9.2041 9.3897 9.3897 9.4085 9.4085 9.5485 9.5485 9.6106 9.6106 9.8982 9.8982 9.9384 9.9384 10.0843 10.0843 10.1619 10.1619 10.3181 10.3181 10.4317 10.4317 10.7119 10.7119 10.8337 10.8337 11.2308 11.2308 11.3329 11.3329 11.7765 11.7765 11.9503 11.9503 12.7794 12.7794 12.9557 12.9557 13.0830 13.0830 13.1230 13.1230 14.2510 14.2510 k = 0.4485 0.0891 0.6124 ( 3322 PWs) bands (ev): 6.8085 6.8085 7.0813 7.0813 8.1624 8.1624 8.3617 8.3617 8.8206 8.8206 8.9988 8.9988 9.1762 9.1762 9.2151 9.2151 9.3865 9.3865 9.4034 9.4034 9.5567 9.5567 9.6226 9.6226 9.8777 9.8777 9.9233 9.9233 10.0872 10.0872 10.1803 10.1803 10.3108 10.3108 10.4347 10.4347 10.7188 10.7188 10.8370 10.8370 11.2202 11.2202 11.3356 11.3356 11.7656 11.7656 11.9661 11.9661 12.7529 12.7529 12.9566 12.9566 13.1080 13.1080 13.1490 13.1491 14.1829 14.1829 k = 0.4412 0.1019 0.6124 ( 3322 PWs) bands (ev): 6.7914 6.7914 7.0907 7.0907 8.1524 8.1524 8.3710 8.3710 8.8091 8.8091 8.9967 8.9967 9.1911 9.1911 9.2290 9.2290 9.3838 9.3838 9.3987 9.3987 9.5656 9.5656 9.6346 9.6346 9.8569 9.8569 9.9084 9.9084 10.0885 10.0885 10.1990 10.1990 10.3041 10.3041 10.4367 10.4367 10.7262 10.7262 10.8399 10.8399 11.2098 11.2098 11.3375 11.3375 11.7557 11.7557 11.9816 11.9816 12.7283 12.7283 12.9573 12.9573 13.1352 13.1352 13.1758 13.1758 14.1144 14.1144 k = 0.4338 0.1146 0.6124 ( 3321 PWs) bands (ev): 6.7759 6.7759 7.0988 7.0988 8.1433 8.1433 8.3789 8.3789 8.7988 8.7988 8.9935 8.9935 9.2026 9.2026 9.2468 9.2468 9.3813 9.3813 9.3945 9.3945 9.5748 9.5748 9.6465 9.6465 9.8359 9.8359 9.8939 9.8939 10.0886 10.0886 10.2172 10.2172 10.2981 10.2981 10.4379 10.4379 10.7341 10.7341 10.8424 10.8424 11.1996 11.1996 11.3385 11.3385 11.7467 11.7467 11.9966 11.9966 12.7056 12.7056 12.9578 12.9578 13.1645 13.1645 13.2028 13.2028 14.0465 14.0465 k = 0.4265 0.1274 0.6124 ( 3323 PWs) bands (ev): 6.7620 6.7620 7.1057 7.1057 8.1353 8.1353 8.3856 8.3856 8.7895 8.7895 8.9899 8.9899 9.2110 9.2110 9.2674 9.2674 9.3792 9.3792 9.3911 9.3911 9.5841 9.5841 9.6579 9.6579 9.8153 9.8153 9.8798 9.8798 10.0880 10.0880 10.2342 10.2342 10.2929 10.2929 10.4385 10.4385 10.7423 10.7423 10.8442 10.8442 11.1900 11.1900 11.3390 11.3390 11.7388 11.7388 12.0109 12.0109 12.6850 12.6850 12.9581 12.9581 13.1956 13.1956 13.2296 13.2296 13.9798 13.9798 k = 0.4191 0.1401 0.6124 ( 3320 PWs) bands (ev): 6.7499 6.7499 7.1115 7.1115 8.1283 8.1283 8.3910 8.3910 8.7814 8.7814 8.9863 8.9863 9.2172 9.2172 9.2885 9.2885 9.3774 9.3774 9.3886 9.3886 9.5935 9.5935 9.6684 9.6684 9.7954 9.7954 9.8663 9.8663 10.0871 10.0871 10.2488 10.2488 10.2894 10.2894 10.4384 10.4384 10.7504 10.7504 10.8454 10.8454 11.1811 11.1811 11.3391 11.3391 11.7318 11.7318 12.0240 12.0240 12.6668 12.6668 12.9583 12.9583 13.2279 13.2279 13.2561 13.2561 13.9149 13.9149 k = 0.4118 0.1528 0.6124 ( 3322 PWs) bands (ev): 6.7395 6.7395 7.1163 7.1163 8.1224 8.1224 8.3953 8.3953 8.7745 8.7745 8.9830 8.9830 9.2219 9.2219 9.3087 9.3087 9.3761 9.3761 9.3869 9.3869 9.6027 9.6027 9.6773 9.6773 9.7771 9.7771 9.8536 9.8536 10.0861 10.0861 10.2584 10.2584 10.2898 10.2898 10.4378 10.4378 10.7583 10.7583 10.8460 10.8460 11.1729 11.1729 11.3388 11.3388 11.7260 11.7260 12.0358 12.0358 12.6510 12.6510 12.9585 12.9585 13.2595 13.2595 13.2832 13.2832 13.8524 13.8524 k = 0.4044 0.1656 0.6124 ( 3319 PWs) bands (ev): 6.7310 6.7310 7.1202 7.1202 8.1176 8.1176 8.3986 8.3986 8.7687 8.7687 8.9801 8.9801 9.2255 9.2255 9.3265 9.3265 9.3754 9.3754 9.3863 9.3863 9.6120 9.6120 9.6833 9.6833 9.7618 9.7618 9.8419 9.8419 10.0853 10.0853 10.2612 10.2612 10.2956 10.2956 10.4369 10.4369 10.7655 10.7655 10.8461 10.8461 11.1659 11.1659 11.3383 11.3383 11.7211 11.7211 12.0459 12.0459 12.6379 12.6379 12.9586 12.9586 13.2863 13.2863 13.3136 13.3136 13.7932 13.7932 k = 0.3971 0.1783 0.6124 ( 3315 PWs) bands (ev): 6.7243 6.7243 7.1232 7.1232 8.1138 8.1138 8.4011 8.4011 8.7642 8.7642 8.9778 8.9778 9.2282 9.2282 9.3405 9.3405 9.3754 9.3754 9.3866 9.3866 9.6212 9.6212 9.6847 9.6847 9.7513 9.7513 9.8316 9.8316 10.0846 10.0846 10.2601 10.2601 10.3039 10.3039 10.4357 10.4357 10.7718 10.7718 10.8458 10.8458 11.1601 11.1601 11.3379 11.3379 11.7174 11.7174 12.0540 12.0540 12.6274 12.6274 12.9587 12.9587 13.3062 13.3062 13.3476 13.3476 13.7387 13.7387 k = 0.3897 0.1910 0.6124 ( 3315 PWs) bands (ev): 6.7195 6.7195 7.1253 7.1253 8.1111 8.1111 8.4028 8.4028 8.7610 8.7610 8.9761 8.9761 9.2300 9.2300 9.3496 9.3496 9.3761 9.3761 9.3881 9.3881 9.6304 9.6304 9.6806 9.6806 9.7466 9.7466 9.8233 9.8233 10.0841 10.0841 10.2582 10.2582 10.3112 10.3112 10.4346 10.4346 10.7767 10.7767 10.8454 10.8454 11.1558 11.1558 11.3375 11.3375 11.7147 11.7147 12.0600 12.0600 12.6199 12.6199 12.9587 12.9587 13.3200 13.3200 13.3810 13.3810 13.6914 13.6914 k = 0.3824 0.2038 0.6124 ( 3316 PWs) bands (ev): 6.7166 6.7166 7.1266 7.1266 8.1094 8.1094 8.4038 8.4038 8.7590 8.7590 8.9751 8.9751 9.2311 9.2311 9.3541 9.3541 9.3768 9.3768 9.3900 9.3900 9.6389 9.6389 9.6734 9.6734 9.7457 9.7457 9.8176 9.8176 10.0838 10.0838 10.2567 10.2567 10.3161 10.3161 10.4338 10.4338 10.7798 10.7798 10.8450 10.8450 11.1532 11.1532 11.3372 11.3372 11.7131 11.7131 12.0637 12.0637 12.6153 12.6153 12.9588 12.9588 13.3284 13.3284 13.4077 13.4077 13.6565 13.6565 k = 0.3750 0.2165 0.6124 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7583 8.7583 8.9747 8.9747 9.2314 9.2314 9.3553 9.3553 9.3771 9.3771 9.3910 9.3910 9.6431 9.6431 9.6692 9.6692 9.7459 9.7459 9.8156 9.8156 10.0837 10.0837 10.2561 10.2561 10.3177 10.3177 10.4335 10.4335 10.7809 10.7809 10.8448 10.8448 11.1523 11.1523 11.3371 11.3371 11.7126 11.7126 12.0649 12.0649 12.6138 12.6138 12.9588 12.9588 13.3312 13.3312 13.4185 13.4185 13.6430 13.6430 k = 0.3750 0.2165 0.6124 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7583 8.7583 8.9747 8.9747 9.2314 9.2314 9.3553 9.3553 9.3771 9.3771 9.3910 9.3910 9.6431 9.6431 9.6692 9.6692 9.7459 9.7459 9.8156 9.8156 10.0837 10.0837 10.2561 10.2561 10.3177 10.3177 10.4335 10.4335 10.7809 10.7809 10.8448 10.8448 11.1523 11.1523 11.3371 11.3371 11.7126 11.7126 12.0649 12.0649 12.6138 12.6138 12.9588 12.9588 13.3312 13.3312 13.4185 13.4185 13.6430 13.6430 k = 0.3673 0.2121 0.5999 ( 3318 PWs) bands (ev): 6.6904 6.6904 7.1645 7.1645 8.0691 8.0691 8.3998 8.3998 8.7106 8.7106 8.9706 8.9706 9.2475 9.2475 9.3708 9.3708 9.3794 9.3794 9.3838 9.3838 9.6397 9.6398 9.6704 9.6704 9.7399 9.7399 9.8390 9.8390 10.0841 10.0841 10.2770 10.2770 10.3341 10.3341 10.4632 10.4632 10.7687 10.7687 10.8326 10.8326 11.1597 11.1597 11.3545 11.3545 11.7089 11.7089 12.1033 12.1033 12.5994 12.5994 12.9282 12.9282 13.3062 13.3062 13.3774 13.3774 13.7025 13.7025 k = 0.3597 0.2077 0.5874 ( 3324 PWs) bands (ev): 6.6603 6.6603 7.2033 7.2033 8.0319 8.0319 8.3968 8.3968 8.6639 8.6639 8.9671 8.9671 9.2637 9.2637 9.3708 9.3708 9.3833 9.3833 9.3925 9.3925 9.6354 9.6354 9.6717 9.6717 9.7328 9.7328 9.8634 9.8634 10.0819 10.0819 10.2991 10.2991 10.3493 10.3493 10.4929 10.4929 10.7585 10.7585 10.8219 10.8219 11.1668 11.1668 11.3719 11.3719 11.7041 11.7041 12.1414 12.1414 12.5866 12.5866 12.8977 12.8977 13.2797 13.2797 13.3364 13.3364 13.7670 13.7670 k = 0.3520 0.2033 0.5749 ( 3324 PWs) bands (ev): 6.6248 6.6248 7.2435 7.2435 7.9983 7.9983 8.3952 8.3952 8.6185 8.6185 8.9639 8.9639 9.2790 9.2790 9.3632 9.3632 9.3885 9.3885 9.4107 9.4107 9.6302 9.6302 9.6732 9.6732 9.7246 9.7246 9.8884 9.8884 10.0768 10.0768 10.3220 10.3220 10.3638 10.3638 10.5223 10.5223 10.7509 10.7509 10.8126 10.8126 11.1738 11.1738 11.3893 11.3893 11.6979 11.6979 12.1789 12.1789 12.5756 12.5756 12.8684 12.8684 13.2516 13.2516 13.2957 13.2957 13.8357 13.8357 k = 0.3444 0.1988 0.5624 ( 3318 PWs) bands (ev): 6.5837 6.5837 7.2848 7.2848 7.9686 7.9686 8.3951 8.3951 8.5745 8.5745 8.9607 8.9607 9.2920 9.2920 9.3573 9.3573 9.3957 9.3957 9.4307 9.4307 9.6242 9.6242 9.6751 9.6751 9.7154 9.7154 9.9137 9.9137 10.0688 10.0688 10.3451 10.3451 10.3781 10.3781 10.5506 10.5506 10.7465 10.7465 10.8047 10.8047 11.1805 11.1805 11.4066 11.4066 11.6903 11.6903 12.2150 12.2150 12.5662 12.5662 12.8408 12.8408 13.2219 13.2219 13.2555 13.2555 13.9080 13.9080 k = 0.3367 0.1944 0.5499 ( 3318 PWs) bands (ev): 6.5369 6.5369 7.3269 7.3269 7.9434 7.9434 8.3964 8.3964 8.5321 8.5321 8.9573 8.9573 9.3002 9.3002 9.3553 9.3553 9.4060 9.4060 9.4518 9.4518 9.6174 9.6174 9.6773 9.6773 9.7055 9.7055 9.9389 9.9389 10.0579 10.0579 10.3668 10.3668 10.3938 10.3938 10.5772 10.5772 10.7462 10.7462 10.7984 10.7984 11.1867 11.1867 11.4237 11.4237 11.6811 11.6811 12.2491 12.2491 12.5585 12.5585 12.8155 12.8155 13.1905 13.1905 13.2161 13.2161 13.9834 13.9834 k = 0.3291 0.1900 0.5374 ( 3318 PWs) bands (ev): 6.4845 6.4845 7.3698 7.3698 7.9229 7.9229 8.3988 8.3988 8.4918 8.4918 8.9532 8.9532 9.3019 9.3019 9.3586 9.3586 9.4202 9.4202 9.4739 9.4739 9.6100 9.6100 9.6791 9.6791 9.6956 9.6956 9.9636 9.9636 10.0444 10.0444 10.3843 10.3843 10.4135 10.4135 10.6009 10.6009 10.7509 10.7509 10.7936 10.7936 11.1924 11.1924 11.4405 11.4405 11.6704 11.6704 12.2808 12.2808 12.5525 12.5525 12.7929 12.7929 13.1575 13.1575 13.1774 13.1774 14.0607 14.0608 k = 0.3214 0.1856 0.5249 ( 3318 PWs) bands (ev): 6.4267 6.4267 7.4132 7.4132 7.9070 7.9070 8.4014 8.4014 8.4544 8.4544 8.9483 8.9483 9.2986 9.2986 9.3658 9.3658 9.4386 9.4386 9.4967 9.4967 9.6022 9.6022 9.6761 9.6761 9.6905 9.6905 9.9862 9.9862 10.0300 10.0300 10.3969 10.3969 10.4378 10.4378 10.6210 10.6210 10.7610 10.7610 10.7905 10.7905 11.1975 11.1975 11.4569 11.4569 11.6580 11.6580 12.3093 12.3093 12.5482 12.5482 12.7732 12.7732 13.1229 13.1229 13.1396 13.1396 14.1311 14.1312 k = 0.3138 0.1812 0.5124 ( 3314 PWs) bands (ev): 6.3638 6.3638 7.4569 7.4569 7.8956 7.8956 8.3972 8.3972 8.4270 8.4270 8.9423 8.9423 9.2931 9.2931 9.3752 9.3752 9.4607 9.4607 9.5200 9.5200 9.5943 9.5943 9.6657 9.6657 9.6930 9.6930 9.9948 9.9948 10.0268 10.0268 10.4065 10.4065 10.4647 10.4647 10.6371 10.6371 10.7755 10.7755 10.7905 10.7905 11.2021 11.2021 11.4729 11.4729 11.6440 11.6440 12.3342 12.3342 12.5455 12.5455 12.7566 12.7566 13.0865 13.0865 13.1027 13.1027 14.0803 14.0803 k = 0.3061 0.1767 0.4999 ( 3320 PWs) bands (ev): 6.2965 6.2965 7.5006 7.5006 7.8884 7.8884 8.3714 8.3714 8.4246 8.4246 8.9348 8.9348 9.2871 9.2871 9.3856 9.3856 9.4858 9.4858 9.5422 9.5422 9.5874 9.5874 9.6534 9.6534 9.6981 9.6981 9.9793 9.9793 10.0454 10.0454 10.4142 10.4142 10.4928 10.4928 10.6497 10.6497 10.7836 10.7836 10.8030 10.8030 11.2060 11.2060 11.4882 11.4882 11.6285 11.6285 12.3550 12.3550 12.5445 12.5445 12.7432 12.7432 13.0486 13.0486 13.0669 13.0669 13.9903 13.9903 k = 0.2985 0.1723 0.4874 ( 3320 PWs) bands (ev): 6.2251 6.2251 7.5442 7.5442 7.8849 7.8849 8.3395 8.3395 8.4318 8.4318 8.9257 8.9257 9.2814 9.2814 9.3971 9.3971 9.5128 9.5128 9.5568 9.5568 9.5874 9.5874 9.6422 9.6422 9.7043 9.7043 9.9577 9.9577 10.0685 10.0685 10.4203 10.4203 10.5217 10.5217 10.6600 10.6600 10.7855 10.7855 10.8267 10.8267 11.2093 11.2093 11.5028 11.5028 11.6116 11.6116 12.3711 12.3711 12.5450 12.5450 12.7330 12.7330 13.0090 13.0090 13.0322 13.0322 13.8986 13.8986 k = 0.2908 0.1679 0.4749 ( 3316 PWs) bands (ev): 6.1504 6.1504 7.5873 7.5873 7.8847 7.8847 8.3081 8.3081 8.4418 8.4418 8.9148 8.9148 9.2764 9.2764 9.4100 9.4100 9.5398 9.5398 9.5551 9.5551 9.5994 9.5994 9.6374 9.6374 9.7112 9.7112 9.9348 9.9348 10.0921 10.0921 10.4250 10.4250 10.5511 10.5511 10.6693 10.6693 10.7876 10.7876 10.8538 10.8538 11.2119 11.2119 11.5164 11.5164 11.5938 11.5938 12.3825 12.3825 12.5471 12.5471 12.7260 12.7260 12.9678 12.9678 12.9986 12.9986 13.8067 13.8067 k = 0.2832 0.1635 0.4624 ( 3316 PWs) bands (ev): 6.0729 6.0729 7.6298 7.6298 7.8874 7.8874 8.2783 8.2783 8.4535 8.4535 8.9021 8.9021 9.2721 9.2721 9.4243 9.4243 9.5463 9.5463 9.5602 9.5602 9.6099 9.6099 9.6495 9.6495 9.7183 9.7183 9.9127 9.9127 10.1157 10.1157 10.4284 10.4284 10.5805 10.5805 10.6783 10.6783 10.7908 10.7908 10.8821 10.8821 11.2139 11.2139 11.5278 11.5278 11.5761 11.5761 12.3889 12.3889 12.5507 12.5507 12.7221 12.7221 12.9250 12.9250 12.9661 12.9661 13.7150 13.7150 k = 0.2755 0.1591 0.4499 ( 3324 PWs) bands (ev): 5.9932 5.9932 7.6714 7.6714 7.8924 7.8924 8.2504 8.2504 8.4668 8.4668 8.8876 8.8876 9.2687 9.2687 9.4401 9.4401 9.5356 9.5356 9.5624 9.5624 9.6291 9.6291 9.6736 9.6736 9.7254 9.7254 9.8933 9.8933 10.1390 10.1390 10.4304 10.4304 10.6097 10.6097 10.6875 10.6875 10.7948 10.7948 10.9112 10.9112 11.2154 11.2154 11.5325 11.5325 11.5633 11.5633 12.3904 12.3904 12.5557 12.5557 12.7209 12.7209 12.8807 12.8807 12.9346 12.9346 13.6238 13.6238 k = 0.2679 0.1546 0.4374 ( 3328 PWs) bands (ev): 5.9117 5.9117 7.7118 7.7118 7.8992 7.8992 8.2244 8.2244 8.4814 8.4814 8.8713 8.8713 9.2659 9.2659 9.4571 9.4571 9.5238 9.5238 9.5526 9.5526 9.6559 9.6559 9.7007 9.7007 9.7342 9.7342 9.8795 9.8795 10.1621 10.1621 10.4312 10.4312 10.6383 10.6383 10.6975 10.6975 10.7997 10.7997 10.9402 10.9402 11.2162 11.2162 11.5216 11.5216 11.5645 11.5645 12.3872 12.3872 12.5622 12.5622 12.7224 12.7224 12.8351 12.8351 12.9043 12.9043 13.5334 13.5334 k = 0.2602 0.1502 0.4249 ( 3328 PWs) bands (ev): 5.8291 5.8291 7.7510 7.7510 7.9074 7.9074 8.2004 8.2004 8.4973 8.4973 8.8534 8.8534 9.2637 9.2637 9.4742 9.4742 9.5122 9.5122 9.5397 9.5397 9.6746 9.6746 9.7275 9.7275 9.7523 9.7523 9.8739 9.8739 10.1850 10.1850 10.4307 10.4307 10.6652 10.6652 10.7092 10.7092 10.8055 10.8055 10.9689 10.9689 11.2166 11.2166 11.5023 11.5023 11.5726 11.5726 12.3793 12.3793 12.5700 12.5700 12.7261 12.7261 12.7883 12.7883 12.8749 12.8749 13.4441 13.4441 k = 0.2526 0.1458 0.4124 ( 3318 PWs) bands (ev): 5.7457 5.7457 7.7886 7.7886 7.9165 7.9165 8.1785 8.1785 8.5145 8.5145 8.8340 8.8340 9.2618 9.2618 9.4828 9.4828 9.5087 9.5087 9.5271 9.5271 9.6738 9.6738 9.7589 9.7589 9.7834 9.7834 9.8779 9.8779 10.2076 10.2076 10.4292 10.4292 10.6890 10.6890 10.7238 10.7238 10.8121 10.8121 10.9969 10.9969 11.2167 11.2167 11.4810 11.4810 11.5814 11.5814 12.3671 12.3671 12.5790 12.5790 12.7307 12.7307 12.7417 12.7417 12.8466 12.8466 13.3563 13.3563 k = 0.2449 0.1414 0.3999 ( 3332 PWs) bands (ev): 5.6620 5.6620 7.8245 7.8245 7.9262 7.9262 8.1586 8.1586 8.5327 8.5327 8.8132 8.8132 9.2600 9.2600 9.4723 9.4723 9.5100 9.5100 9.5294 9.5294 9.6593 9.6593 9.7943 9.7943 9.8220 9.8220 9.8907 9.8907 10.2302 10.2302 10.4267 10.4267 10.7076 10.7076 10.7430 10.7430 10.8196 10.8196 11.0239 11.0239 11.2163 11.2163 11.4590 11.4590 11.5894 11.5894 12.3508 12.3508 12.5893 12.5893 12.6909 12.6909 12.7404 12.7404 12.8192 12.8192 13.2702 13.2702 k = 0.2372 0.1370 0.3874 ( 3344 PWs) bands (ev): 5.5783 5.5783 7.8585 7.8585 7.9360 7.9360 8.1408 8.1408 8.5521 8.5521 8.7911 8.7911 9.2582 9.2582 9.4561 9.4561 9.4986 9.4986 9.5513 9.5513 9.6383 9.6383 9.8306 9.8306 9.8654 9.8654 9.9113 9.9113 10.2526 10.2526 10.4232 10.4232 10.7219 10.7219 10.7654 10.7654 10.8281 10.8281 11.0498 11.0498 11.2161 11.2161 11.4370 11.4370 11.5962 11.5962 12.3308 12.3308 12.6008 12.6008 12.6416 12.6416 12.7489 12.7489 12.7931 12.7931 13.1862 13.1862 k = 0.2296 0.1326 0.3749 ( 3344 PWs) bands (ev): 5.4950 5.4950 7.8906 7.8906 7.9458 7.9458 8.1251 8.1251 8.5724 8.5724 8.7679 8.7679 9.2562 9.2562 9.4384 9.4384 9.4867 9.4867 9.5767 9.5767 9.6146 9.6146 9.8671 9.8671 9.9096 9.9096 9.9407 9.9407 10.2751 10.2751 10.4191 10.4191 10.7341 10.7341 10.7878 10.7878 10.8384 10.8384 11.0742 11.0742 11.2162 11.2162 11.4154 11.4154 11.6015 11.6015 12.3072 12.3072 12.5915 12.5915 12.6135 12.6135 12.7536 12.7536 12.7731 12.7731 13.1049 13.1049 k = 0.2219 0.1281 0.3624 ( 3344 PWs) bands (ev): 5.4123 5.4123 7.9204 7.9204 7.9554 7.9554 8.1114 8.1114 8.5936 8.5936 8.7438 8.7438 9.2538 9.2538 9.4200 9.4200 9.4750 9.4750 9.5898 9.5898 9.6039 9.6039 9.9040 9.9040 9.9486 9.9486 9.9831 9.9831 10.2977 10.2977 10.4142 10.4142 10.7455 10.7455 10.8077 10.8077 10.8513 10.8513 11.0969 11.0969 11.2171 11.2171 11.3943 11.3943 11.6051 11.6051 12.2804 12.2804 12.5417 12.5417 12.6269 12.6269 12.7361 12.7361 12.7769 12.7769 13.0265 13.0265 k = 0.2143 0.1237 0.3499 ( 3348 PWs) bands (ev): 5.3307 5.3307 7.9476 7.9476 7.9649 7.9649 8.0997 8.0997 8.6156 8.6156 8.7187 8.7187 9.2511 9.2511 9.4015 9.4015 9.4636 9.4636 9.5651 9.5651 9.6325 9.6325 9.9414 9.9414 9.9840 9.9840 10.0355 10.0355 10.3206 10.3206 10.4089 10.4089 10.7563 10.7563 10.8234 10.8235 10.8677 10.8677 11.1173 11.1173 11.2194 11.2194 11.3741 11.3741 11.6067 11.6067 12.2504 12.2504 12.4920 12.4920 12.6410 12.6410 12.7120 12.7120 12.7886 12.7886 12.9518 12.9518 k = 0.2066 0.1193 0.3374 ( 3348 PWs) bands (ev): 5.2502 5.2502 7.9673 7.9673 7.9789 7.9789 8.0900 8.0900 8.6383 8.6383 8.6929 8.6929 9.2479 9.2479 9.3830 9.3830 9.4525 9.4525 9.5411 9.5411 9.6623 9.6623 9.9795 9.9795 10.0201 10.0201 10.0924 10.0924 10.3440 10.3440 10.4033 10.4033 10.7668 10.7668 10.8356 10.8356 10.8867 10.8867 11.1348 11.1348 11.2241 11.2241 11.3550 11.3550 11.6059 11.6059 12.2172 12.2172 12.4431 12.4431 12.6545 12.6545 12.6885 12.6885 12.8011 12.8011 12.8820 12.8820 k = 0.1990 0.1149 0.3249 ( 3355 PWs) bands (ev): 5.1711 5.1711 7.9762 7.9762 8.0005 8.0005 8.0824 8.0824 8.6613 8.6613 8.6669 8.6669 9.2442 9.2442 9.3647 9.3647 9.4416 9.4416 9.5181 9.5181 9.6931 9.6931 10.0183 10.0183 10.0582 10.0582 10.1512 10.1512 10.3680 10.3680 10.3980 10.3980 10.7769 10.7769 10.8454 10.8454 10.9063 10.9063 11.1489 11.1489 11.2319 11.2319 11.3371 11.3371 11.6024 11.6024 12.1811 12.1811 12.3955 12.3955 12.6549 12.6549 12.6779 12.6779 12.8020 12.8020 12.8295 12.8295 k = 0.1913 0.1105 0.3124 ( 3355 PWs) bands (ev): 5.0937 5.0937 7.9822 7.9822 8.0216 8.0216 8.0768 8.0768 8.6393 8.6393 8.6858 8.6858 9.2401 9.2401 9.3469 9.3469 9.4310 9.4310 9.4963 9.4963 9.7248 9.7248 10.0578 10.0578 10.0984 10.0984 10.2107 10.2107 10.3854 10.3854 10.4008 10.4008 10.7866 10.7866 10.8541 10.8541 10.9253 10.9253 11.1596 11.1596 11.2435 11.2435 11.3207 11.3207 11.5959 11.5959 12.1419 12.1419 12.3497 12.3497 12.6328 12.6328 12.6869 12.6869 12.7533 12.7533 12.8351 12.8351 k = 0.1837 0.1060 0.2999 ( 3353 PWs) bands (ev): 5.0181 5.0181 7.9867 7.9867 8.0404 8.0404 8.0738 8.0738 8.6119 8.6119 8.7103 8.7103 9.2356 9.2356 9.3297 9.3297 9.4205 9.4205 9.4761 9.4761 9.7571 9.7571 10.0980 10.0980 10.1404 10.1404 10.2687 10.2687 10.3821 10.3821 10.4274 10.4274 10.7961 10.7961 10.8619 10.8619 10.9426 10.9426 11.1674 11.1674 11.2581 11.2581 11.3064 11.3064 11.5860 11.5860 12.0999 12.0999 12.3063 12.3063 12.6075 12.6075 12.6743 12.6743 12.7262 12.7262 12.8493 12.8493 k = 0.1760 0.1016 0.2874 ( 3357 PWs) bands (ev): 4.9446 4.9446 7.9899 7.9899 8.0549 8.0549 8.0748 8.0748 8.5842 8.5842 8.7353 8.7353 9.2307 9.2307 9.3131 9.3131 9.4104 9.4104 9.4573 9.4573 9.7898 9.7898 10.1388 10.1388 10.1842 10.1842 10.3228 10.3228 10.3760 10.3760 10.4618 10.4618 10.8052 10.8052 10.8693 10.8693 10.9579 10.9579 11.1738 11.1738 11.2733 11.2733 11.2960 11.2960 11.5723 11.5723 12.0552 12.0552 12.2658 12.2658 12.5811 12.5811 12.6298 12.6298 12.7364 12.7364 12.8642 12.8642 k = 0.1684 0.0972 0.2749 ( 3349 PWs) bands (ev): 4.8732 4.8732 7.9917 7.9917 8.0618 8.0618 8.0834 8.0834 8.5564 8.5564 8.7606 8.7606 9.2256 9.2256 9.2973 9.2973 9.4006 9.4006 9.4400 9.4400 9.8229 9.8229 10.1801 10.1801 10.2295 10.2295 10.3684 10.3684 10.3716 10.3716 10.5037 10.5037 10.8139 10.8139 10.8762 10.8762 10.9709 10.9709 11.1796 11.1796 11.2764 11.2764 11.3024 11.3024 11.5546 11.5546 12.0082 12.0082 12.2289 12.2289 12.5533 12.5533 12.5845 12.5845 12.7532 12.7532 12.8793 12.8793 k = 0.1607 0.0928 0.2624 ( 3345 PWs) bands (ev): 4.8041 4.8041 7.9923 7.9923 8.0646 8.0646 8.0960 8.0960 8.5285 8.5285 8.7862 8.7862 9.2203 9.2203 9.2825 9.2825 9.3910 9.3910 9.4241 9.4241 9.8560 9.8560 10.2214 10.2214 10.2759 10.2759 10.3635 10.3635 10.4104 10.4104 10.5530 10.5530 10.8222 10.8222 10.8829 10.8829 10.9813 10.9813 11.1851 11.1851 11.2700 11.2700 11.3231 11.3231 11.5328 11.5328 11.9596 11.9596 12.1958 12.1958 12.5225 12.5225 12.5449 12.5449 12.7715 12.7715 12.8942 12.8942 k = 0.1531 0.0884 0.2499 ( 3349 PWs) bands (ev): 4.7374 4.7374 7.9917 7.9917 8.0672 8.0672 8.1085 8.1085 8.5009 8.5009 8.8118 8.8118 9.2148 9.2148 9.2686 9.2686 9.3817 9.3817 9.4095 9.4095 9.8888 9.8888 10.2619 10.2619 10.3230 10.3230 10.3586 10.3586 10.4445 10.4445 10.6067 10.6067 10.8301 10.8301 10.8892 10.8892 10.9892 10.9892 11.1901 11.1901 11.2650 11.2650 11.3478 11.3478 11.5070 11.5070 11.9100 11.9100 12.1668 12.1668 12.4882 12.4882 12.5118 12.5118 12.7903 12.7903 12.9089 12.9089 k = 0.1454 0.0840 0.2375 ( 3351 PWs) bands (ev): 4.6733 4.6733 7.9900 7.9900 8.0708 8.0708 8.1199 8.1199 8.4736 8.4736 8.8376 8.8376 9.2093 9.2093 9.2558 9.2558 9.3728 9.3728 9.3960 9.3960 9.9213 9.9213 10.2991 10.2991 10.3555 10.3555 10.3723 10.3723 10.4752 10.4752 10.6614 10.6614 10.8379 10.8379 10.8953 10.8953 10.9950 10.9950 11.1942 11.1942 11.2633 11.2633 11.3752 11.3752 11.4782 11.4782 11.8604 11.8604 12.1420 12.1420 12.4533 12.4533 12.4821 12.4821 12.8093 12.8093 12.9231 12.9231 k = 0.1378 0.0795 0.2250 ( 3351 PWs) bands (ev): 4.6119 4.6119 7.9872 7.9872 8.0753 8.0753 8.1302 8.1302 8.4469 8.4469 8.8633 8.8633 9.2038 9.2038 9.2442 9.2442 9.3642 9.3642 9.3837 9.3837 9.9532 9.9532 10.3216 10.3216 10.3694 10.3694 10.4192 10.4192 10.5045 10.5045 10.7136 10.7136 10.8457 10.8457 10.9012 10.9012 10.9989 10.9989 11.1970 11.1970 11.2651 11.2651 11.4015 11.4015 11.4507 11.4507 11.8122 11.8122 12.1211 12.1211 12.4198 12.4198 12.4533 12.4533 12.8283 12.8283 12.9369 12.9369 k = 0.1301 0.0751 0.2125 ( 3343 PWs) bands (ev): 4.5533 4.5533 7.9835 7.9835 8.0807 8.0807 8.1394 8.1394 8.4210 8.4210 8.8888 8.8888 9.1982 9.1982 9.2339 9.2339 9.3560 9.3560 9.3724 9.3724 9.9843 9.9843 10.3239 10.3239 10.4028 10.4028 10.4659 10.4659 10.5336 10.5336 10.7604 10.7604 10.8542 10.8542 10.9071 10.9071 11.0016 11.0016 11.1987 11.1987 11.2699 11.2699 11.3960 11.3960 11.4560 11.4560 11.7671 11.7671 12.1038 12.1038 12.3881 12.3881 12.4247 12.4247 12.8471 12.8471 12.9501 12.9501 k = 0.1224 0.0707 0.2000 ( 3343 PWs) bands (ev): 4.4975 4.4975 7.9789 7.9789 8.0869 8.0869 8.1474 8.1474 8.3959 8.3959 8.9141 8.9141 9.1927 9.1927 9.2249 9.2249 9.3482 9.3482 9.3619 9.3619 10.0144 10.0144 10.3200 10.3200 10.4420 10.4420 10.5105 10.5105 10.5640 10.5640 10.7985 10.7985 10.8647 10.8647 10.9132 10.9132 11.0032 11.0032 11.2001 11.2001 11.2759 11.2759 11.3628 11.3628 11.4887 11.4887 11.7290 11.7290 12.0896 12.0896 12.3579 12.3579 12.3959 12.3959 12.8656 12.8656 12.9627 12.9627 k = 0.1148 0.0663 0.1875 ( 3331 PWs) bands (ev): 4.4448 4.4448 7.9737 7.9737 8.0938 8.0938 8.1546 8.1546 8.3718 8.3718 8.9390 8.9390 9.1873 9.1873 9.2172 9.2172 9.3407 9.3407 9.3523 9.3523 10.0432 10.0432 10.3146 10.3146 10.4821 10.4821 10.5518 10.5518 10.5969 10.5969 10.8250 10.8250 10.8789 10.8789 10.9204 10.9204 11.0043 11.0043 11.2018 11.2018 11.2792 11.2792 11.3290 11.3290 11.5181 11.5181 11.7069 11.7069 12.0783 12.0783 12.3290 12.3290 12.3671 12.3671 12.8835 12.8835 12.9746 12.9746 k = 0.1071 0.0619 0.1750 ( 3335 PWs) bands (ev): 4.3950 4.3950 7.9679 7.9679 8.1012 8.1012 8.1607 8.1607 8.3490 8.3490 8.9634 8.9634 9.1821 9.1821 9.2107 9.2107 9.3337 9.3337 9.3434 9.3434 10.0705 10.0705 10.3088 10.3088 10.5215 10.5215 10.5887 10.5887 10.6327 10.6327 10.8401 10.8401 10.8945 10.8945 10.9297 10.9297 11.0048 11.0048 11.2045 11.2045 11.2644 11.2644 11.3123 11.3123 11.5267 11.5267 11.7158 11.7158 12.0692 12.0692 12.3010 12.3010 12.3383 12.3383 12.9009 12.9009 12.9857 12.9857 k = 0.0995 0.0574 0.1625 ( 3347 PWs) bands (ev): 4.3484 4.3484 7.9615 7.9615 8.1089 8.1089 8.1661 8.1661 8.3274 8.3274 8.9871 8.9871 9.1772 9.1772 9.2053 9.2053 9.3270 9.3270 9.3351 9.3351 10.0962 10.0962 10.3030 10.3030 10.5596 10.5596 10.6222 10.6222 10.6701 10.6701 10.8487 10.8487 10.9064 10.9064 10.9422 10.9422 11.0051 11.0051 11.2079 11.2079 11.2304 11.2304 11.3153 11.3153 11.5114 11.5114 11.7586 11.7586 12.0619 12.0619 12.2736 12.2736 12.3097 12.3097 12.9174 12.9174 12.9961 12.9961 k = 0.0918 0.0530 0.1500 ( 3347 PWs) bands (ev): 4.3050 4.3050 7.9549 7.9549 8.1167 8.1167 8.1708 8.1708 8.3074 8.3074 9.0100 9.0100 9.1727 9.1727 9.2009 9.2009 9.3208 9.3208 9.3275 9.3275 10.1201 10.1201 10.2973 10.2973 10.5954 10.5954 10.6541 10.6541 10.7069 10.7069 10.8545 10.8545 10.9139 10.9139 10.9556 10.9556 11.0050 11.0050 11.1900 11.1900 11.2157 11.2157 11.3225 11.3225 11.4851 11.4851 11.8221 11.8221 12.0562 12.0562 12.2469 12.2469 12.2814 12.2814 12.9331 12.9331 13.0057 13.0057 k = 0.0842 0.0486 0.1375 ( 3339 PWs) bands (ev): 4.2648 4.2648 7.9482 7.9482 8.1245 8.1245 8.1750 8.1750 8.2888 8.2888 9.0319 9.0319 9.1689 9.1689 9.1974 9.1974 9.3151 9.3151 9.3206 9.3206 10.1421 10.1421 10.2917 10.2917 10.6284 10.6284 10.6853 10.6853 10.7413 10.7413 10.8590 10.8590 10.9188 10.9188 10.9675 10.9675 11.0047 11.0047 11.1530 11.1530 11.2226 11.2226 11.3301 11.3301 11.4570 11.4570 11.8967 11.8967 12.0517 12.0517 12.2207 12.2207 12.2537 12.2537 12.9478 12.9478 13.0145 13.0145 k = 0.0765 0.0442 0.1250 ( 3343 PWs) bands (ev): 4.2280 4.2280 7.9414 7.9414 8.1320 8.1320 8.1786 8.1786 8.2720 8.2720 9.0527 9.0527 9.1657 9.1657 9.1946 9.1946 9.3098 9.3098 9.3143 9.3143 10.1622 10.1622 10.2864 10.2864 10.6579 10.6579 10.7156 10.7156 10.7723 10.7723 10.8633 10.8633 10.9224 10.9224 10.9767 10.9767 11.0041 11.0041 11.1179 11.1179 11.2316 11.2316 11.3371 11.3371 11.4307 11.4307 11.9778 11.9778 12.0483 12.0483 12.1951 12.1951 12.2267 12.2267 12.9613 12.9613 13.0227 13.0227 k = 0.0689 0.0398 0.1125 ( 3353 PWs) bands (ev): 4.1945 4.1945 7.9347 7.9347 8.1389 8.1389 8.1818 8.1818 8.2568 8.2568 9.0720 9.0720 9.1630 9.1630 9.1924 9.1924 9.3050 9.3050 9.3085 9.3085 10.1803 10.1803 10.2813 10.2813 10.6839 10.6839 10.7435 10.7435 10.7995 10.7995 10.8680 10.8680 10.9250 10.9250 10.9830 10.9830 11.0037 11.0037 11.0865 11.0865 11.2420 11.2420 11.3432 11.3432 11.4080 11.4080 12.0419 12.0419 12.0666 12.0666 12.1708 12.1708 12.2008 12.2008 12.9735 12.9735 13.0301 13.0301 k = 0.0612 0.0353 0.1000 ( 3355 PWs) bands (ev): 4.1644 4.1644 7.9283 7.9283 8.1452 8.1452 8.1848 8.1848 8.2435 8.2435 9.0899 9.0899 9.1610 9.1610 9.1908 9.1908 9.3007 9.3007 9.3034 9.3034 10.1965 10.1965 10.2766 10.2766 10.7063 10.7063 10.7668 10.7668 10.8234 10.8234 10.8739 10.8739 10.9268 10.9268 10.9860 10.9860 11.0039 11.0039 11.0605 11.0605 11.2531 11.2531 11.3483 11.3483 11.3899 11.3899 12.0408 12.0408 12.1380 12.1380 12.1609 12.1609 12.1786 12.1786 12.9844 12.9844 13.0369 13.0369 k = 0.0536 0.0309 0.0875 ( 3353 PWs) bands (ev): 4.1378 4.1378 7.9223 7.9223 8.1504 8.1504 8.1876 8.1876 8.2320 8.2320 9.1060 9.1060 9.1595 9.1595 9.1898 9.1898 9.2969 9.2969 9.2989 9.2989 10.2106 10.2106 10.2722 10.2722 10.7252 10.7252 10.7826 10.7826 10.8455 10.8455 10.8809 10.8809 10.9275 10.9275 10.9867 10.9867 11.0042 11.0042 11.0415 11.0415 11.2641 11.2641 11.3520 11.3520 11.3771 11.3771 12.0381 12.0381 12.1230 12.1230 12.1513 12.1513 12.2498 12.2498 12.9938 12.9938 13.0430 13.0430 k = 0.0459 0.0265 0.0750 ( 3351 PWs) bands (ev): 4.1146 4.1146 7.9168 7.9168 8.1545 8.1545 8.1903 8.1903 8.2224 8.2224 9.1201 9.1201 9.1585 9.1585 9.1895 9.1895 9.2937 9.2937 9.2950 9.2950 10.2228 10.2228 10.2682 10.2682 10.7407 10.7407 10.7903 10.7903 10.8659 10.8659 10.8881 10.8881 10.9271 10.9271 10.9868 10.9868 11.0032 11.0032 11.0313 11.0313 11.2738 11.2738 11.3542 11.3542 11.3700 11.3700 12.0347 12.0347 12.1042 12.1042 12.1299 12.1299 12.3427 12.3427 13.0017 13.0017 13.0485 13.0485 k = 0.0383 0.0221 0.0625 ( 3351 PWs) bands (ev): 4.0950 4.0950 7.9120 7.9120 8.1573 8.1573 8.1929 8.1929 8.2148 8.2148 9.1319 9.1319 9.1578 9.1578 9.1897 9.1897 9.2909 9.2909 9.2917 9.2917 10.2331 10.2331 10.2647 10.2647 10.7529 10.7529 10.7915 10.7915 10.8831 10.8831 10.8947 10.8947 10.9255 10.9255 10.9879 10.9879 11.0015 11.0015 11.0288 11.0288 11.2810 11.2810 11.3558 11.3558 11.3677 11.3677 12.0305 12.0305 12.0884 12.0884 12.1104 12.1104 12.4369 12.4369 13.0081 13.0081 13.0534 13.0534 k = 0.0306 0.0177 0.0500 ( 3343 PWs) bands (ev): 4.0789 4.0789 7.9079 7.9079 8.1590 8.1590 8.1953 8.1953 8.2090 8.2090 9.1415 9.1415 9.1574 9.1574 9.1905 9.1905 9.2886 9.2886 9.2891 9.2891 10.2414 10.2414 10.2617 10.2617 10.7621 10.7621 10.7889 10.7889 10.8934 10.8934 10.9020 10.9020 10.9234 10.9234 10.9912 10.9912 11.0011 11.0011 11.0302 11.0302 11.2854 11.2854 11.3585 11.3585 11.3679 11.3679 12.0250 12.0250 12.0766 12.0766 12.0934 12.0934 12.5316 12.5316 13.0130 13.0130 13.0575 13.0575 k = 0.0230 0.0133 0.0375 ( 3343 PWs) bands (ev): 4.0663 4.0663 7.9046 7.9046 8.1598 8.1598 8.1974 8.1974 8.2050 8.2050 9.1485 9.1485 9.1571 9.1571 9.1917 9.1917 9.2868 9.2868 9.2871 9.2871 10.2479 10.2479 10.2594 10.2594 10.7688 10.7688 10.7846 10.7846 10.8969 10.8969 10.9098 10.9098 10.9213 10.9213 10.9960 10.9960 11.0021 11.0021 11.0333 11.0333 11.2873 11.2873 11.3624 11.3624 11.3687 11.3687 12.0189 12.0189 12.0687 12.0687 12.0796 12.0796 12.6252 12.6252 13.0161 13.0161 13.0609 13.0609 k = 0.0153 0.0088 0.0250 ( 3343 PWs) bands (ev): 4.0574 4.0574 7.9022 7.9022 8.1599 8.1599 8.1990 8.1990 8.2023 8.2023 9.1533 9.1533 9.1569 9.1569 9.1929 9.1929 9.2855 9.2855 9.2856 9.2856 10.2525 10.2525 10.2576 10.2576 10.7732 10.7732 10.7805 10.7805 10.8980 10.8980 10.9149 10.9149 10.9197 10.9197 11.0007 11.0007 11.0036 11.0036 11.0368 11.0368 11.2878 11.2878 11.3664 11.3664 11.3696 11.3696 12.0133 12.0133 12.0640 12.0640 12.0693 12.0693 12.7158 12.7158 13.0168 13.0168 13.0633 13.0633 k = 0.0077 0.0044 0.0125 ( 3355 PWs) bands (ev): 4.0520 4.0520 7.9007 7.9007 8.1598 8.1598 8.2000 8.2000 8.2009 8.2009 9.1559 9.1559 9.1568 9.1568 9.1938 9.1938 9.2847 9.2847 9.2847 9.2847 10.2553 10.2553 10.2565 10.2565 10.7756 10.7756 10.7775 10.7775 10.8982 10.8982 10.9176 10.9176 10.9188 10.9188 11.0040 11.0040 11.0047 11.0047 11.0397 11.0397 11.2877 11.2877 11.3693 11.3693 11.3702 11.3702 12.0093 12.0093 12.0616 12.0616 12.0630 12.0630 12.7959 12.7959 13.0117 13.0117 13.0648 13.0648 k = 0.0000 0.0000 0.0000 ( 3383 PWs) bands (ev): 4.0502 4.0502 7.9001 7.9001 8.1597 8.1597 8.2003 8.2003 8.2004 8.2004 9.1567 9.1567 9.1568 9.1568 9.1941 9.1941 9.2843 9.2843 9.2843 9.2843 10.2562 10.2562 10.2562 10.2562 10.7764 10.7764 10.7765 10.7765 10.8982 10.8982 10.9182 10.9182 10.9184 10.9184 11.0050 11.0050 11.0052 11.0052 11.0406 11.0406 11.2875 11.2875 11.3704 11.3704 11.3704 11.3704 12.0078 12.0078 12.0606 12.0606 12.0608 12.0608 12.8361 12.8361 13.0010 13.0010 13.0653 13.0653 k = 0.0000 0.0000 0.0000 ( 3383 PWs) bands (ev): 4.0502 4.0502 7.9001 7.9001 8.1597 8.1597 8.2003 8.2003 8.2004 8.2004 9.1567 9.1567 9.1568 9.1568 9.1941 9.1941 9.2843 9.2843 9.2843 9.2843 10.2562 10.2562 10.2562 10.2562 10.7764 10.7764 10.7765 10.7765 10.8982 10.8982 10.9182 10.9182 10.9184 10.9184 11.0050 11.0050 11.0052 11.0052 11.0406 11.0406 11.2875 11.2875 11.3704 11.3704 11.3704 11.3704 12.0078 12.0078 12.0606 12.0606 12.0608 12.0608 12.8361 12.8361 13.0010 13.0010 13.0653 13.0653 k = 0.0125 0.0072 0.0051 ( 3350 PWs) bands (ev): 4.0520 4.0520 7.9007 7.9007 8.1599 8.1599 8.2003 8.2003 8.2006 8.2006 9.1559 9.1559 9.1569 9.1569 9.1938 9.1938 9.2847 9.2847 9.2847 9.2847 10.2558 10.2558 10.2560 10.2560 10.7757 10.7757 10.7775 10.7775 10.8982 10.8982 10.9179 10.9179 10.9185 10.9185 11.0042 11.0042 11.0046 11.0046 11.0397 11.0397 11.2876 11.2876 11.3693 11.3693 11.3702 11.3702 12.0093 12.0093 12.0615 12.0615 12.0631 12.0631 12.7959 12.7959 13.0116 13.0116 13.0647 13.0647 k = 0.0250 0.0144 0.0102 ( 3344 PWs) bands (ev): 4.0574 4.0574 7.9022 7.9022 8.1600 8.1600 8.2000 8.2000 8.2012 8.2012 9.1533 9.1533 9.1569 9.1569 9.1929 9.1929 9.2855 9.2855 9.2855 9.2855 10.2545 10.2545 10.2556 10.2556 10.7731 10.7731 10.7804 10.7804 10.8978 10.8978 10.9159 10.9159 10.9190 10.9190 11.0009 11.0009 11.0034 11.0034 11.0369 11.0369 11.2877 11.2877 11.3663 11.3663 11.3698 11.3698 12.0133 12.0133 12.0639 12.0639 12.0695 12.0695 12.7159 12.7159 13.0165 13.0165 13.0630 13.0630 k = 0.0375 0.0217 0.0153 ( 3338 PWs) bands (ev): 4.0663 4.0663 7.9046 7.9046 8.1603 8.1603 8.1995 8.1995 8.2024 8.2024 9.1487 9.1487 9.1569 9.1569 9.1916 9.1916 9.2869 9.2869 9.2870 9.2870 10.2524 10.2524 10.2549 10.2549 10.7682 10.7682 10.7848 10.7848 10.8963 10.8963 10.9116 10.9116 10.9203 10.9203 10.9952 10.9952 11.0030 11.0030 11.0335 11.0335 11.2872 11.2872 11.3621 11.3621 11.3692 11.3692 12.0188 12.0188 12.0685 12.0685 12.0799 12.0799 12.6255 12.6255 13.0155 13.0155 13.0601 13.0601 k = 0.0500 0.0289 0.0204 ( 3338 PWs) bands (ev): 4.0789 4.0789 7.9079 7.9079 8.1606 8.1606 8.1988 8.1988 8.2040 8.2040 9.1418 9.1418 9.1570 9.1570 9.1902 9.1902 9.2887 9.2887 9.2890 9.2890 10.2496 10.2496 10.2539 10.2539 10.7604 10.7604 10.7897 10.7897 10.8919 10.8919 10.9043 10.9043 10.9228 10.9228 10.9880 10.9880 11.0048 11.0048 11.0307 11.0307 11.2849 11.2849 11.3582 11.3582 11.3688 11.3688 12.0247 12.0247 12.0763 12.0763 12.0938 12.0938 12.5320 12.5320 13.0120 13.0120 13.0561 13.0561 k = 0.0625 0.0361 0.0255 ( 3344 PWs) bands (ev): 4.0950 4.0950 7.9118 7.9118 8.1609 8.1609 8.1980 8.1980 8.2064 8.2064 9.1324 9.1324 9.1571 9.1571 9.1891 9.1891 9.2911 9.2911 9.2916 9.2916 10.2461 10.2461 10.2524 10.2524 10.7491 10.7491 10.7936 10.7936 10.8831 10.8831 10.8939 10.8939 10.9263 10.9263 10.9817 10.9817 11.0105 11.0105 11.0289 11.0289 11.2797 11.2797 11.3562 11.3562 11.3688 11.3688 12.0296 12.0296 12.0880 12.0880 12.1107 12.1107 12.4376 12.4376 13.0071 13.0071 13.0512 13.0512 k = 0.0750 0.0433 0.0306 ( 3356 PWs) bands (ev): 4.1147 4.1147 7.9164 7.9164 8.1611 8.1611 8.1970 8.1970 8.2095 8.2095 9.1205 9.1205 9.1574 9.1574 9.1885 9.1885 9.2940 9.2940 9.2947 9.2947 10.2420 10.2420 10.2505 10.2505 10.7338 10.7338 10.7943 10.7943 10.8685 10.8685 10.8821 10.8821 10.9289 10.9289 10.9794 10.9794 11.0203 11.0203 11.0281 11.0281 11.2709 11.2709 11.3575 11.3575 11.3699 11.3699 12.0331 12.0331 12.1035 12.1035 12.1300 12.1300 12.3436 12.3436 13.0010 13.0010 13.0452 13.0452 k = 0.0875 0.0505 0.0357 ( 3356 PWs) bands (ev): 4.1378 4.1378 7.9215 7.9215 8.1612 8.1612 8.1959 8.1959 8.2135 8.2135 9.1062 9.1062 9.1580 9.1580 9.1884 9.1884 9.2975 9.2975 9.2984 9.2984 10.2372 10.2372 10.2481 10.2481 10.7146 10.7146 10.7886 10.7886 10.8477 10.8477 10.8720 10.8720 10.9299 10.9299 10.9823 10.9823 11.0287 11.0287 11.0343 11.0343 11.2586 11.2586 11.3625 11.3625 11.3725 11.3725 12.0353 12.0353 12.1219 12.1219 12.1511 12.1511 12.2511 12.2511 12.9939 12.9939 13.0385 13.0385 k = 0.1000 0.0577 0.0408 ( 3350 PWs) bands (ev): 4.1645 4.1645 7.9268 7.9268 8.1611 8.1611 8.1948 8.1948 8.2186 8.2186 9.0895 9.0895 9.1589 9.1589 9.1888 9.1888 9.3016 9.3016 9.3028 9.3028 10.2318 10.2318 10.2450 10.2450 10.6914 10.6914 10.7742 10.7742 10.8215 10.8215 10.8665 10.8665 10.9294 10.9294 10.9887 10.9887 11.0311 11.0311 11.0514 11.0514 11.2431 11.2431 11.3716 11.3716 11.3773 11.3773 12.0364 12.0364 12.1392 12.1392 12.1644 12.1644 12.1735 12.1735 12.9860 12.9860 13.0311 13.0311 k = 0.1125 0.0650 0.0459 ( 3353 PWs) bands (ev): 4.1946 4.1946 7.9320 7.9320 8.1610 8.1610 8.1936 8.1936 8.2249 8.2249 9.0707 9.0707 9.1602 9.1602 9.1899 9.1899 9.3061 9.3061 9.3076 9.3076 10.2258 10.2259 10.2411 10.2411 10.6646 10.6646 10.7517 10.7517 10.7909 10.7909 10.8652 10.8652 10.9284 10.9284 10.9954 10.9954 11.0358 11.0358 11.0705 11.0705 11.2247 11.2247 11.3848 11.3848 11.3854 11.3854 12.0341 12.0341 12.0749 12.0749 12.1666 12.1666 12.1964 12.1964 12.9774 12.9774 13.0232 13.0232 k = 0.1250 0.0722 0.0510 ( 3341 PWs) bands (ev): 4.2280 4.2280 7.9369 7.9369 8.1607 8.1607 8.1925 8.1925 8.2325 8.2325 9.0498 9.0498 9.1621 9.1621 9.1916 9.1916 9.3113 9.3113 9.3131 9.3131 10.2193 10.2193 10.2364 10.2364 10.6345 10.6345 10.7237 10.7237 10.7570 10.7570 10.8663 10.8663 10.9272 10.9272 11.0005 11.0005 11.0429 11.0429 11.0901 11.0901 11.2030 11.2030 11.3977 11.3977 11.4025 11.4025 11.9846 11.9846 12.0430 12.0430 12.1888 12.1888 12.2194 12.2194 12.9684 12.9684 13.0149 13.0149 k = 0.1375 0.0794 0.0561 ( 3341 PWs) bands (ev): 4.2649 4.2649 7.9411 7.9411 8.1605 8.1605 8.1914 8.1914 8.2415 8.2415 9.0271 9.0271 9.1643 9.1643 9.1939 9.1939 9.3169 9.3169 9.3190 9.3190 10.2121 10.2121 10.2306 10.2306 10.6013 10.6013 10.6921 10.6921 10.7205 10.7205 10.8685 10.8685 10.9260 10.9260 11.0036 11.0036 11.0514 11.0514 11.1088 11.1088 11.1770 11.1770 11.4155 11.4155 11.4251 11.4251 11.9104 11.9104 12.0418 12.0418 12.2112 12.2112 12.2418 12.2418 12.9592 12.9592 13.0066 13.0066 k = 0.1500 0.0866 0.0612 ( 3341 PWs) bands (ev): 4.3051 4.3051 7.9442 7.9442 8.1602 8.1602 8.1904 8.1904 8.2520 8.2520 9.0027 9.0027 9.1672 9.1672 9.1969 9.1969 9.3230 9.3230 9.3254 9.3254 10.2042 10.2042 10.2235 10.2235 10.5655 10.5655 10.6584 10.6584 10.6823 10.6823 10.8710 10.8710 10.9248 10.9248 11.0052 11.0052 11.0597 11.0597 11.1251 11.1251 11.1458 11.1458 11.4395 11.4395 11.4528 11.4528 11.8434 11.8434 12.0419 12.0419 12.2330 12.2330 12.2632 12.2632 12.9500 12.9500 12.9985 12.9985 k = 0.1625 0.0938 0.0663 ( 3341 PWs) bands (ev): 4.3485 4.3485 7.9459 7.9459 8.1600 8.1600 8.1897 8.1897 8.2642 8.2642 8.9768 8.9768 9.1707 9.1707 9.2006 9.2006 9.3296 9.3296 9.3323 9.3323 10.1955 10.1955 10.2149 10.2149 10.5270 10.5270 10.6232 10.6232 10.6432 10.6432 10.8735 10.8735 10.9236 10.9236 11.0058 11.0058 11.0667 11.0667 11.1082 11.1082 11.1383 11.1383 11.4702 11.4702 11.4855 11.4855 11.7866 11.7866 12.0421 12.0421 12.2536 12.2536 12.2829 12.2829 12.9411 12.9411 12.9908 12.9908 k = 0.1750 0.1010 0.0714 ( 3341 PWs) bands (ev): 4.3951 4.3951 7.9458 7.9458 8.1599 8.1599 8.1891 8.1891 8.2781 8.2781 8.9496 8.9496 9.1749 9.1749 9.2051 9.2051 9.3366 9.3366 9.3396 9.3396 10.1859 10.1859 10.2046 10.2046 10.4862 10.4862 10.5872 10.5872 10.6040 10.6040 10.8759 10.8759 10.9224 10.9224 11.0042 11.0042 11.0628 11.0628 11.0741 11.0741 11.1483 11.1483 11.5074 11.5074 11.5232 11.5232 11.7418 11.7418 12.0424 12.0424 12.2724 12.2724 12.3007 12.3007 12.9329 12.9329 12.9839 12.9839 k = 0.1875 0.1083 0.0765 ( 3341 PWs) bands (ev): 4.4449 4.4449 7.9434 7.9434 8.1599 8.1599 8.1888 8.1888 8.2938 8.2938 8.9213 8.9213 9.1797 9.1797 9.2102 9.2102 9.3441 9.3441 9.3474 9.3474 10.1753 10.1753 10.1922 10.1922 10.4430 10.4430 10.5510 10.5510 10.5656 10.5656 10.8781 10.8781 10.9211 10.9211 10.9891 10.9891 11.0263 11.0263 11.0768 11.0768 11.1552 11.1552 11.5505 11.5505 11.5652 11.5652 11.7095 11.7095 12.0427 12.0427 12.2890 12.2890 12.3160 12.3160 12.9256 12.9256 12.9779 12.9779 k = 0.2000 0.1155 0.0816 ( 3341 PWs) bands (ev): 4.4977 4.4977 7.9385 7.9385 8.1601 8.1601 8.1888 8.1888 8.3113 8.3113 8.8921 8.8921 9.1852 9.1852 9.2161 9.2161 9.3520 9.3520 9.3556 9.3556 10.1636 10.1636 10.1774 10.1774 10.3976 10.3976 10.5148 10.5148 10.5288 10.5288 10.8801 10.8801 10.9189 10.9189 10.9395 10.9395 11.0171 11.0171 11.0791 11.0791 11.1598 11.1598 11.5987 11.5987 11.6110 11.6110 11.6894 11.6894 12.0430 12.0430 12.3030 12.3030 12.3285 12.3285 12.9195 12.9195 12.9733 12.9733 k = 0.2125 0.1227 0.0868 ( 3335 PWs) bands (ev): 4.5535 4.5535 7.9306 7.9306 8.1607 8.1607 8.1891 8.1891 8.3306 8.3306 8.8622 8.8622 9.1915 9.1915 9.2227 9.2227 9.3603 9.3603 9.3642 9.3642 10.1507 10.1507 10.1600 10.1600 10.3502 10.3502 10.4792 10.4792 10.4941 10.4941 10.8738 10.8738 10.8819 10.8819 10.9195 10.9195 11.0162 11.0162 11.0803 11.0803 11.1626 11.1626 11.6509 11.6509 11.6588 11.6588 11.6816 11.6816 12.0433 12.0433 12.3141 12.3141 12.3378 12.3378 12.9149 12.9149 12.9701 12.9701 k = 0.2250 0.1299 0.0919 ( 3341 PWs) bands (ev): 4.6121 4.6121 7.9195 7.9195 8.1614 8.1614 8.1898 8.1898 8.3514 8.3514 8.8318 8.8318 9.1983 9.1983 9.2300 9.2300 9.3690 9.3690 9.3731 9.3731 10.1363 10.1363 10.1395 10.1395 10.3012 10.3012 10.4443 10.4443 10.4619 10.4619 10.8058 10.8058 10.8835 10.8835 10.9179 10.9179 11.0166 11.0166 11.0806 11.0806 11.1641 11.1641 11.6783 11.6783 11.7064 11.7064 11.7144 11.7144 12.0436 12.0436 12.3219 12.3219 12.3440 12.3440 12.9119 12.9119 12.9685 12.9685 k = 0.2375 0.1371 0.0970 ( 3347 PWs) bands (ev): 4.6736 4.6736 7.9050 7.9050 8.1625 8.1625 8.1909 8.1909 8.3736 8.3736 8.8010 8.8010 9.2058 9.2058 9.2379 9.2379 9.3781 9.3781 9.3824 9.3824 10.1156 10.1156 10.1203 10.1203 10.2515 10.2515 10.4105 10.4105 10.4322 10.4322 10.7356 10.7356 10.8850 10.8850 10.9165 10.9165 11.0173 11.0173 11.0803 11.0803 11.1650 11.1650 11.6875 11.6875 11.7644 11.7644 11.7679 11.7679 12.0441 12.0441 12.3266 12.3266 12.3469 12.3469 12.9108 12.9108 12.9686 12.9686 k = 0.2500 0.1443 0.1021 ( 3353 PWs) bands (ev): 4.7378 4.7378 7.8867 7.8867 8.1639 8.1639 8.1923 8.1923 8.3971 8.3971 8.7703 8.7703 9.2139 9.2139 9.2465 9.2465 9.3875 9.3875 9.3920 9.3920 10.0880 10.0880 10.1027 10.1027 10.2019 10.2019 10.3782 10.3782 10.4051 10.4051 10.6652 10.6652 10.8862 10.8862 10.9151 10.9151 11.0182 11.0182 11.0796 11.0796 11.1653 11.1653 11.7033 11.7033 11.8233 11.8233 11.8243 11.8243 12.0447 12.0447 12.3283 12.3283 12.3467 12.3467 12.9114 12.9114 12.9703 12.9703 k = 0.2625 0.1516 0.1072 ( 3353 PWs) bands (ev): 4.8046 4.8046 7.8644 7.8644 8.1656 8.1656 8.1942 8.1942 8.4213 8.4213 8.7401 8.7401 9.2226 9.2226 9.2556 9.2556 9.3973 9.3973 9.4020 9.4020 10.0563 10.0563 10.0834 10.0834 10.1538 10.1538 10.3474 10.3474 10.3803 10.3803 10.5958 10.5958 10.8872 10.8872 10.9136 10.9136 11.0190 11.0190 11.0791 11.0791 11.1656 11.1656 11.7253 11.7253 11.8795 11.8795 11.8853 11.8853 12.0455 12.0455 12.3271 12.3271 12.3436 12.3436 12.9137 12.9137 12.9734 12.9734 k = 0.2750 0.1588 0.1123 ( 3353 PWs) bands (ev): 4.8739 4.8739 7.8380 7.8380 8.1677 8.1677 8.1965 8.1965 8.4456 8.4456 8.7110 8.7110 9.2317 9.2317 9.2651 9.2651 9.4075 9.4075 9.4123 9.4123 10.0203 10.0203 10.0623 10.0623 10.1085 10.1085 10.3184 10.3184 10.3574 10.3574 10.5282 10.5282 10.8881 10.8881 10.9122 10.9122 11.0197 11.0197 11.0788 11.0788 11.1660 11.1660 11.7530 11.7530 11.9352 11.9352 11.9466 11.9466 12.0471 12.0471 12.3239 12.3239 12.3383 12.3383 12.9174 12.9174 12.9778 12.9778 k = 0.2875 0.1660 0.1174 ( 3353 PWs) bands (ev): 4.9455 4.9455 7.8073 7.8073 8.1701 8.1701 8.1991 8.1991 8.4686 8.4686 8.6841 8.6841 9.2412 9.2412 9.2752 9.2752 9.4180 9.4180 9.4229 9.4229 9.9802 9.9802 10.0396 10.0396 10.0666 10.0666 10.2912 10.2912 10.3359 10.3359 10.4631 10.4631 10.8888 10.8888 10.9107 10.9107 11.0202 11.0202 11.0790 11.0790 11.1666 11.1666 11.7857 11.7857 11.9879 11.9879 12.0075 12.0075 12.0508 12.0508 12.3195 12.3195 12.3315 12.3315 12.9223 12.9223 12.9829 12.9829 k = 0.3000 0.1732 0.1225 ( 3359 PWs) bands (ev): 5.0193 5.0193 7.7721 7.7721 8.1728 8.1728 8.2022 8.2022 8.4881 8.4881 8.6620 8.6620 9.2511 9.2511 9.2855 9.2855 9.4288 9.4288 9.4337 9.4337 9.9374 9.9374 10.0155 10.0155 10.0281 10.0281 10.2658 10.2658 10.3149 10.3149 10.4013 10.4013 10.8893 10.8893 10.9092 10.9092 11.0204 11.0204 11.0798 11.0798 11.1676 11.1676 11.8231 11.8231 12.0267 12.0267 12.0662 12.0662 12.0664 12.0664 12.3156 12.3156 12.3247 12.3247 12.9279 12.9279 12.9887 12.9887 k = 0.3125 0.1804 0.1276 ( 3347 PWs) bands (ev): 5.0951 5.0951 7.7324 7.7324 8.1758 8.1758 8.2055 8.2055 8.4996 8.4996 8.6489 8.6489 9.2612 9.2612 9.2962 9.2962 9.4400 9.4400 9.4449 9.4449 9.8939 9.8939 9.9902 9.9902 9.9922 9.9922 10.2420 10.2420 10.2923 10.2923 10.3447 10.3447 10.8898 10.8898 10.9078 10.9078 11.0203 11.0203 11.0812 11.0812 11.1690 11.1690 11.8647 11.8647 12.0389 12.0389 12.1032 12.1032 12.1209 12.1209 12.3150 12.3150 12.3205 12.3205 12.9340 12.9340 12.9946 12.9946 k = 0.3250 0.1876 0.1327 ( 3350 PWs) bands (ev): 5.1728 5.1728 7.6881 7.6881 8.1791 8.1791 8.2092 8.2092 8.4985 8.4985 8.6496 8.6496 9.2714 9.2714 9.3069 9.3069 9.4515 9.4515 9.4563 9.4563 9.8512 9.8512 9.9579 9.9579 9.9640 9.9640 10.2197 10.2197 10.2604 10.2604 10.3008 10.3008 10.8901 10.8901 10.9064 10.9064 11.0199 11.0199 11.0833 11.0833 11.1708 11.1708 11.9098 11.9098 12.0430 12.0430 12.1389 12.1389 12.1652 12.1652 12.3227 12.3227 12.3245 12.3245 12.9401 12.9401 13.0003 13.0003 k = 0.3375 0.1949 0.1378 ( 3332 PWs) bands (ev): 5.2522 5.2522 7.6394 7.6394 8.1826 8.1826 8.2131 8.2131 8.4852 8.4852 8.6636 8.6636 9.2817 9.2817 9.3178 9.3178 9.4634 9.4634 9.4679 9.4679 9.8107 9.8107 9.9251 9.9251 9.9374 9.9374 10.1988 10.1988 10.2139 10.2139 10.2747 10.2747 10.8904 10.8904 10.9050 10.9050 11.0194 11.0194 11.0861 11.0861 11.1731 11.1731 11.9572 11.9572 12.0473 12.0473 12.1613 12.1613 12.1914 12.1914 12.3437 12.3437 12.3449 12.3449 12.9459 12.9459 13.0055 13.0055 k = 0.3500 0.2021 0.1429 ( 3326 PWs) bands (ev): 5.3329 5.3329 7.5862 7.5862 8.1862 8.1862 8.2172 8.2172 8.4647 8.4647 8.6863 8.6863 9.2920 9.2920 9.3286 9.3286 9.4755 9.4755 9.4797 9.4797 9.7730 9.7730 9.8934 9.8934 9.9106 9.9106 10.1636 10.1636 10.1791 10.1791 10.2557 10.2557 10.8906 10.8906 10.9037 10.9037 11.0188 11.0188 11.0894 11.0894 11.1757 11.1757 12.0011 12.0011 12.0575 12.0575 12.1695 12.1695 12.1977 12.1977 12.3784 12.3784 12.3832 12.3832 12.9511 12.9511 13.0099 13.0099 k = 0.3625 0.2093 0.1480 ( 3320 PWs) bands (ev): 5.4148 5.4148 7.5288 7.5288 8.1898 8.1898 8.2214 8.2214 8.4411 8.4411 8.7132 8.7132 9.3020 9.3021 9.3393 9.3393 9.4880 9.4880 9.4916 9.4916 9.7388 9.7388 9.8629 9.8629 9.8839 9.8839 10.1141 10.1141 10.1605 10.1605 10.2388 10.2388 10.8909 10.8909 10.9025 10.9025 11.0181 11.0181 11.0930 11.0930 11.1786 11.1786 12.0258 12.0258 12.0880 12.0880 12.1701 12.1701 12.1923 12.1923 12.4218 12.4218 12.4317 12.4317 12.9553 12.9553 13.0132 13.0132 k = 0.3750 0.2165 0.1531 ( 3332 PWs) bands (ev): 5.4975 5.4975 7.4676 7.4676 8.1935 8.1935 8.2256 8.2256 8.4168 8.4168 8.7422 8.7422 9.3118 9.3118 9.3497 9.3497 9.5006 9.5006 9.5036 9.5036 9.7081 9.7081 9.8334 9.8334 9.8577 9.8577 10.0667 10.0667 10.1429 10.1429 10.2230 10.2230 10.8910 10.8910 10.9012 10.9012 11.0173 11.0173 11.0968 11.0968 11.1817 11.1817 12.0331 12.0331 12.1245 12.1245 12.1799 12.1799 12.1815 12.1815 12.4691 12.4691 12.4837 12.4837 12.9583 12.9583 13.0150 13.0150 k = 0.3875 0.2237 0.1582 ( 3332 PWs) bands (ev): 5.5805 5.5805 7.4032 7.4032 8.1971 8.1971 8.2298 8.2298 8.3932 8.3932 8.7719 8.7719 9.3211 9.3211 9.3598 9.3598 9.5136 9.5136 9.5156 9.5156 9.6812 9.6812 9.8051 9.8051 9.8321 9.8321 10.0218 10.0218 10.1264 10.1264 10.2082 10.2082 10.8912 10.8912 10.9002 10.9002 11.0166 11.0166 11.1008 11.1008 11.1850 11.1850 12.0359 12.0359 12.1302 12.1302 12.1687 12.1687 12.2257 12.2257 12.5173 12.5173 12.5362 12.5362 12.9598 12.9598 13.0151 13.0151 k = 0.4000 0.2309 0.1633 ( 3332 PWs) bands (ev): 5.6633 5.6633 7.3361 7.3361 8.2004 8.2004 8.2339 8.2339 8.3711 8.3711 8.8015 8.8015 9.3300 9.3300 9.3695 9.3695 9.5268 9.5268 9.5276 9.5276 9.6579 9.6579 9.7780 9.7780 9.8074 9.8074 9.9798 9.9798 10.1110 10.1110 10.1942 10.1942 10.8914 10.8914 10.8992 10.8992 11.0160 11.0160 11.1049 11.1049 11.1884 11.1884 12.0373 12.0373 12.1217 12.1217 12.1553 12.1553 12.2887 12.2887 12.5648 12.5648 12.5876 12.5876 12.9596 12.9596 13.0134 13.0134 k = 0.4125 0.2382 0.1684 ( 3338 PWs) bands (ev): 5.7452 5.7452 7.2675 7.2675 8.2036 8.2036 8.2377 8.2377 8.3509 8.3509 8.8300 8.8300 9.3382 9.3382 9.3786 9.3786 9.5394 9.5394 9.5401 9.5401 9.6383 9.6383 9.7522 9.7522 9.7837 9.7837 9.9409 9.9409 10.0968 10.0968 10.1813 10.1813 10.8916 10.8916 10.8983 10.8983 11.0155 11.0155 11.1088 11.1088 11.1917 11.1917 12.0383 12.0383 12.1107 12.1107 12.1422 12.1422 12.3571 12.3571 12.6106 12.6106 12.6370 12.6370 12.9575 12.9575 13.0095 13.0095 k = 0.4250 0.2454 0.1735 ( 3332 PWs) bands (ev): 5.8251 5.8251 7.1983 7.1983 8.2063 8.2063 8.2412 8.2412 8.3331 8.3331 8.8570 8.8570 9.3457 9.3457 9.3870 9.3870 9.5510 9.5510 9.5536 9.5536 9.6221 9.6221 9.7278 9.7278 9.7612 9.7612 9.9056 9.9056 10.0840 10.0840 10.1696 10.1696 10.8918 10.8918 10.8975 10.8975 11.0151 11.0151 11.1126 11.1126 11.1950 11.1950 12.0390 12.0390 12.0995 12.0995 12.1299 12.1299 12.4278 12.4278 12.6541 12.6541 12.6841 12.6841 12.9534 12.9534 13.0032 13.0032 k = 0.4375 0.2526 0.1786 ( 3329 PWs) bands (ev): 5.9017 5.9017 7.1304 7.1304 8.2087 8.2087 8.2444 8.2444 8.3178 8.3178 8.8817 8.8817 9.3523 9.3523 9.3946 9.3946 9.5623 9.5623 9.5671 9.5671 9.6092 9.6092 9.7050 9.7050 9.7400 9.7400 9.8744 9.8744 10.0726 10.0726 10.1591 10.1591 10.8921 10.8921 10.8969 10.8969 11.0147 11.0147 11.1161 11.1161 11.1979 11.1979 12.0396 12.0396 12.0891 12.0891 12.1190 12.1190 12.4991 12.4991 12.6948 12.6948 12.7282 12.7282 12.9470 12.9470 12.9944 12.9944 k = 0.4500 0.2598 0.1837 ( 3323 PWs) bands (ev): 5.9730 5.9730 7.0659 7.0659 8.2105 8.2105 8.2470 8.2470 8.3053 8.3053 8.9034 8.9034 9.3579 9.3579 9.4012 9.4012 9.5734 9.5734 9.5807 9.5807 9.5994 9.5994 9.6838 9.6838 9.7202 9.7202 9.8478 9.8478 10.0630 10.0630 10.1502 10.1502 10.8922 10.8922 10.8964 10.8964 11.0145 11.0145 11.1190 11.1190 11.2005 11.2005 12.0401 12.0401 12.0799 12.0799 12.1096 12.1096 12.5687 12.5687 12.7321 12.7321 12.7693 12.7693 12.9384 12.9384 12.9830 12.9830 k = 0.4625 0.2670 0.1888 ( 3329 PWs) bands (ev): 6.0360 6.0360 7.0079 7.0079 8.2119 8.2119 8.2492 8.2492 8.2956 8.2956 8.9213 8.9213 9.3625 9.3625 9.4066 9.4066 9.5840 9.5840 9.5923 9.5923 9.5941 9.5941 9.6645 9.6645 9.7020 9.7020 9.8262 9.8262 10.0553 10.0553 10.1430 10.1430 10.8924 10.8924 10.8960 10.8960 11.0143 11.0143 11.1213 11.1213 11.2025 11.2025 12.0407 12.0407 12.0722 12.0722 12.1021 12.1021 12.6333 12.6333 12.7656 12.7656 12.8068 12.8068 12.9278 12.9278 12.9688 12.9688 k = 0.4750 0.2742 0.1939 ( 3323 PWs) bands (ev): 6.0868 6.0868 6.9605 6.9605 8.2127 8.2127 8.2508 8.2508 8.2887 8.2887 8.9347 8.9347 9.3658 9.3658 9.4106 9.4106 9.5877 9.5877 9.5948 9.5948 9.6069 9.6069 9.6473 9.6473 9.6858 9.6858 9.8103 9.8103 10.0496 10.0496 10.1378 10.1378 10.8926 10.8926 10.8957 10.8957 11.0142 11.0142 11.1231 11.1231 11.2040 11.2040 12.0413 12.0413 12.0665 12.0665 12.0966 12.0966 12.6880 12.6880 12.7941 12.7941 12.8405 12.8405 12.9157 12.9157 12.9521 12.9521 k = 0.4875 0.2815 0.1990 ( 3317 PWs) bands (ev): 6.1204 6.1204 6.9289 6.9289 8.2132 8.2132 8.2518 8.2518 8.2847 8.2847 8.9431 8.9431 9.3679 9.3679 9.4131 9.4131 9.5852 9.5852 9.6054 9.6054 9.6177 9.6177 9.6324 9.6324 9.6729 9.6729 9.8005 9.8005 10.0462 10.0462 10.1346 10.1346 10.8926 10.8926 10.8956 10.8956 11.0141 11.0141 11.1242 11.1242 11.2050 11.2050 12.0418 12.0418 12.0628 12.0628 12.0932 12.0932 12.7258 12.7258 12.8155 12.8155 12.8689 12.8689 12.9044 12.9044 12.9339 12.9339 k = 0.5000 0.2887 0.2041 ( 3316 PWs) bands (ev): 6.1323 6.1323 6.9177 6.9177 8.2134 8.2134 8.2521 8.2521 8.2833 8.2833 8.9459 8.9459 9.3685 9.3685 9.4140 9.4140 9.5844 9.5844 9.6135 9.6135 9.6226 9.6226 9.6229 9.6229 9.6673 9.6673 9.7972 9.7972 10.0450 10.0450 10.1335 10.1335 10.8927 10.8927 10.8955 10.8955 11.0141 11.0141 11.1246 11.1246 11.2053 11.2053 12.0420 12.0420 12.0616 12.0616 12.0921 12.0921 12.7395 12.7395 12.8242 12.8242 12.8839 12.8839 12.8991 12.8991 12.9223 12.9223 k = 0.5000 0.2887 0.2041 ( 3316 PWs) bands (ev): 6.1323 6.1323 6.9177 6.9177 8.2134 8.2134 8.2521 8.2521 8.2833 8.2833 8.9459 8.9459 9.3685 9.3685 9.4140 9.4140 9.5844 9.5844 9.6135 9.6135 9.6226 9.6226 9.6229 9.6229 9.6673 9.6673 9.7972 9.7972 10.0450 10.0450 10.1335 10.1335 10.8927 10.8927 10.8955 10.8955 11.0141 11.0141 11.1246 11.1246 11.2053 11.2053 12.0420 12.0420 12.0616 12.0616 12.0921 12.0921 12.7395 12.7395 12.8242 12.8242 12.8839 12.8839 12.8991 12.8991 12.9223 12.9223 k = 0.5045 0.2758 0.2114 ( 3324 PWs) bands (ev): 6.1333 6.1333 6.9189 6.9189 8.2134 8.2134 8.2521 8.2521 8.2836 8.2836 8.9462 8.9462 9.3682 9.3682 9.4137 9.4137 9.5828 9.5828 9.6098 9.6098 9.6213 9.6213 9.6276 9.6276 9.6697 9.6697 9.7971 9.7971 10.0447 10.0447 10.1332 10.1332 10.8916 10.8916 10.8948 10.8948 11.0131 11.0131 11.1243 11.1243 11.2051 11.2051 12.0310 12.0310 12.0689 12.0689 12.0970 12.0970 12.6905 12.6905 12.8438 12.8438 12.8962 12.8962 12.9171 12.9171 12.9223 12.9223 k = 0.5089 0.2629 0.2187 ( 3330 PWs) bands (ev): 6.1362 6.1362 6.9224 6.9224 8.2132 8.2132 8.2521 8.2521 8.2844 8.2844 8.9471 8.9471 9.3673 9.3673 9.4128 9.4128 9.5781 9.5781 9.6053 9.6053 9.6176 9.6176 9.6361 9.6361 9.6760 9.6760 9.7968 9.7968 10.0438 10.0438 10.1324 10.1324 10.8883 10.8883 10.8926 10.8926 11.0101 11.0101 11.1236 11.1236 11.2044 11.2044 12.0112 12.0112 12.0798 12.0798 12.1094 12.1094 12.6121 12.6121 12.8511 12.8511 12.8913 12.8913 12.9252 12.9252 12.9928 12.9928 k = 0.5134 0.2500 0.2260 ( 3329 PWs) bands (ev): 6.1411 6.1411 6.9281 6.9281 8.2125 8.2125 8.2528 8.2528 8.2859 8.2859 8.9485 8.9485 9.3656 9.3656 9.4115 9.4115 9.5708 9.5708 9.6018 9.6018 9.6132 9.6132 9.6453 9.6453 9.6850 9.6850 9.7964 9.7964 10.0423 10.0423 10.1311 10.1311 10.8830 10.8830 10.8890 10.8890 11.0052 11.0052 11.1223 11.1223 11.2033 11.2033 11.9883 11.9883 12.0925 12.0925 12.1255 12.1255 12.5317 12.5317 12.8526 12.8526 12.8789 12.8789 12.9342 12.9342 13.0802 13.0802 k = 0.5179 0.2371 0.2333 ( 3323 PWs) bands (ev): 6.1479 6.1479 6.9362 6.9362 8.2103 8.2103 8.2548 8.2548 8.2881 8.2881 8.9506 8.9506 9.3628 9.3628 9.4102 9.4102 9.5617 9.5617 9.5988 9.5988 9.6094 9.6094 9.6548 9.6548 9.6956 9.6956 9.7959 9.7959 10.0404 10.0404 10.1293 10.1293 10.8756 10.8756 10.8841 10.8841 10.9984 10.9984 11.1206 11.1206 11.2018 11.2018 11.9630 11.9630 12.1077 12.1077 12.1433 12.1433 12.4535 12.4535 12.8480 12.8480 12.8653 12.8653 12.9482 12.9482 13.1709 13.1709 k = 0.5223 0.2242 0.2406 ( 3329 PWs) bands (ev): 6.1566 6.1566 6.9463 6.9463 8.2062 8.2062 8.2586 8.2586 8.2910 8.2910 8.9532 8.9532 9.3585 9.3585 9.4091 9.4091 9.5512 9.5512 9.5956 9.5956 9.6068 9.6068 9.6641 9.6641 9.7072 9.7072 9.7954 9.7954 10.0379 10.0379 10.1272 10.1272 10.8662 10.8662 10.8778 10.8778 10.9897 10.9897 11.1182 11.1182 11.1999 11.1999 11.9356 11.9356 12.1242 12.1242 12.1619 12.1619 12.3803 12.3803 12.8276 12.8276 12.8631 12.8631 12.9660 12.9660 13.2626 13.2626 k = 0.5268 0.2114 0.2479 ( 3327 PWs) bands (ev): 6.1672 6.1672 6.9586 6.9586 8.1999 8.1999 8.2643 8.2643 8.2948 8.2948 8.9564 8.9564 9.3526 9.3526 9.4085 9.4085 9.5399 9.5399 9.5924 9.5924 9.6054 9.6054 9.6730 9.6730 9.7191 9.7191 9.7955 9.7955 10.0351 10.0351 10.1247 10.1247 10.8550 10.8550 10.8703 10.8703 10.9793 10.9793 11.1152 11.1152 11.1976 11.1976 11.9065 11.9065 12.1376 12.1376 12.1812 12.1812 12.3171 12.3171 12.7994 12.7994 12.8656 12.8656 12.9866 12.9866 13.3544 13.3544 k = 0.5312 0.1985 0.2552 ( 3327 PWs) bands (ev): 6.1798 6.1798 6.9728 6.9728 8.1915 8.1915 8.2719 8.2719 8.2995 8.2995 8.9601 8.9601 9.3450 9.3450 9.4085 9.4085 9.5280 9.5280 9.5896 9.5896 9.6048 9.6048 9.6812 9.6812 9.7303 9.7303 9.7969 9.7969 10.0319 10.0319 10.1221 10.1221 10.8420 10.8420 10.8615 10.8615 10.9675 10.9675 11.1113 11.1113 11.1950 11.1950 11.8759 11.8759 12.1344 12.1344 12.2015 12.2015 12.2772 12.2772 12.7676 12.7676 12.8697 12.8697 13.0094 13.0094 13.4453 13.4453 k = 0.5357 0.1856 0.2624 ( 3325 PWs) bands (ev): 6.1941 6.1941 6.9889 6.9889 8.1814 8.1814 8.2807 8.2807 8.3054 8.3054 8.9642 8.9642 9.3358 9.3358 9.4091 9.4091 9.5157 9.5157 9.5872 9.5872 9.6046 9.6046 9.6885 9.6885 9.7395 9.7395 9.8010 9.8010 10.0284 10.0284 10.1195 10.1195 10.8275 10.8275 10.8515 10.8515 10.9542 10.9542 11.1062 11.1062 11.1921 11.1921 11.8443 11.8443 12.1007 12.1007 12.2241 12.2241 12.2730 12.2730 12.7337 12.7337 12.8750 12.8750 13.0337 13.0337 13.5317 13.5317 k = 0.5402 0.1727 0.2697 ( 3323 PWs) bands (ev): 6.2103 6.2103 7.0067 7.0067 8.1698 8.1698 8.2902 8.2902 8.3129 8.3129 8.9687 8.9687 9.3253 9.3253 9.4101 9.4101 9.5032 9.5032 9.5855 9.5855 9.6045 9.6045 9.6945 9.6945 9.7455 9.7455 9.8090 9.8090 10.0245 10.0245 10.1171 10.1171 10.8117 10.8117 10.8403 10.8403 10.9399 10.9399 11.0995 11.0995 11.1890 11.1890 11.8118 11.8118 12.0497 12.0497 12.2487 12.2487 12.2918 12.2918 12.6983 12.6983 12.8816 12.8816 13.0591 13.0591 13.5864 13.5864 k = 0.5446 0.1598 0.2770 ( 3325 PWs) bands (ev): 6.2282 6.2282 7.0259 7.0259 8.1570 8.1570 8.2995 8.2995 8.3227 8.3227 8.9734 8.9734 9.3140 9.3140 9.4111 9.4111 9.4908 9.4908 9.5843 9.5843 9.6042 9.6042 9.6989 9.6989 9.7482 9.7482 9.8209 9.8209 10.0204 10.0204 10.1152 10.1152 10.7947 10.7947 10.8279 10.8279 10.9247 10.9247 11.0908 11.0908 11.1858 11.1858 11.7788 11.7788 11.9956 11.9956 12.2741 12.2741 12.3200 12.3200 12.6625 12.6625 12.8896 12.8896 13.0850 13.0850 13.6129 13.6129 k = 0.5491 0.1469 0.2843 ( 3320 PWs) bands (ev): 6.2479 6.2479 7.0464 7.0464 8.1430 8.1430 8.3080 8.3080 8.3352 8.3352 8.9783 8.9783 9.3021 9.3021 9.4120 9.4120 9.4788 9.4788 9.5837 9.5837 9.6033 9.6033 9.7017 9.7017 9.7491 9.7491 9.8357 9.8357 10.0159 10.0159 10.1141 10.1141 10.7767 10.7767 10.8141 10.8141 10.9090 10.9090 11.0795 11.0795 11.1828 11.1828 11.7457 11.7457 11.9437 11.9437 12.2996 12.2996 12.3524 12.3524 12.6271 12.6271 12.8991 12.8991 13.1112 13.1112 13.6362 13.6362 k = 0.5536 0.1340 0.2916 ( 3319 PWs) bands (ev): 6.2693 6.2693 7.0678 7.0678 8.1283 8.1283 8.3158 8.3158 8.3504 8.3504 8.9832 8.9832 9.2901 9.2901 9.4122 9.4122 9.4675 9.4675 9.5836 9.5836 9.6013 9.6013 9.7028 9.7028 9.7492 9.7492 9.8521 9.8521 10.0110 10.0110 10.1140 10.1140 10.7579 10.7579 10.7988 10.7988 10.8932 10.8932 11.0651 11.0651 11.1800 11.1800 11.7127 11.7127 11.8960 11.8960 12.3251 12.3251 12.3856 12.3856 12.5937 12.5937 12.9104 12.9104 13.1373 13.1373 13.6587 13.6587 k = 0.5580 0.1211 0.2989 ( 3318 PWs) bands (ev): 6.2922 6.2922 7.0898 7.0898 8.1130 8.1130 8.3231 8.3231 8.3676 8.3676 8.9878 8.9878 9.2784 9.2784 9.4111 9.4111 9.4575 9.4575 9.5836 9.5836 9.5980 9.5980 9.7027 9.7027 9.7491 9.7491 9.8690 9.8690 10.0058 10.0058 10.1154 10.1154 10.7384 10.7384 10.7818 10.7818 10.8778 10.8778 11.0475 11.0475 11.1775 11.1775 11.6802 11.6802 11.8536 11.8536 12.3503 12.3503 12.4156 12.4156 12.5658 12.5658 12.9235 12.9235 13.1628 13.1628 13.6808 13.6808 k = 0.5625 0.1083 0.3062 ( 3318 PWs) bands (ev): 6.3168 6.3168 7.1121 7.1121 8.0974 8.0974 8.3303 8.3303 8.3865 8.3865 8.9920 8.9920 9.2677 9.2677 9.4081 9.4081 9.4493 9.4493 9.5823 9.5823 9.5945 9.5945 9.7022 9.7022 9.7489 9.7489 9.8854 9.8854 10.0005 10.0005 10.1183 10.1183 10.7182 10.7182 10.7629 10.7629 10.8632 10.8632 11.0266 11.0266 11.1755 11.1755 11.6482 11.6482 11.8169 11.8169 12.3749 12.3749 12.4333 12.4333 12.5519 12.5519 12.9386 12.9386 13.1877 13.1877 13.7020 13.7020 k = 0.5670 0.0954 0.3135 ( 3324 PWs) bands (ev): 6.3427 6.3427 7.1340 7.1340 8.0819 8.0819 8.3374 8.3374 8.4070 8.4070 8.9955 8.9955 9.2583 9.2583 9.4027 9.4027 9.4432 9.4432 9.5767 9.5767 9.5933 9.5933 9.7016 9.7016 9.7483 9.7483 9.9003 9.9003 9.9958 9.9958 10.1229 10.1229 10.6975 10.6975 10.7421 10.7421 10.8497 10.8497 11.0027 11.0027 11.1738 11.1738 11.6170 11.6170 11.7859 11.7859 12.3975 12.3975 12.4294 12.4294 12.5623 12.5623 12.9560 12.9560 13.2116 13.2116 13.7222 13.7222 k = 0.5714 0.0825 0.3208 ( 3322 PWs) bands (ev): 6.3700 6.3700 7.1552 7.1552 8.0669 8.0669 8.3444 8.3444 8.4290 8.4290 8.9980 8.9980 9.2507 9.2507 9.3952 9.3952 9.4389 9.4389 9.5668 9.5668 9.5948 9.5948 9.7013 9.7013 9.7475 9.7475 9.9120 9.9120 9.9931 9.9931 10.1293 10.1293 10.6759 10.6759 10.7197 10.7197 10.8376 10.8376 10.9765 10.9765 11.1725 11.1725 11.5869 11.5869 11.7606 11.7606 12.3992 12.3992 12.4285 12.4285 12.5905 12.5905 12.9757 12.9757 13.2344 13.2344 13.7407 13.7407 k = 0.5759 0.0696 0.3281 ( 3324 PWs) bands (ev): 6.3986 6.3986 7.1748 7.1748 8.0529 8.0529 8.3512 8.3512 8.4522 8.4522 8.9993 8.9993 9.2454 9.2454 9.3863 9.3863 9.4354 9.4354 9.5540 9.5540 9.5978 9.5978 9.7011 9.7011 9.7464 9.7464 9.9186 9.9186 9.9941 9.9941 10.1373 10.1373 10.6532 10.6532 10.6961 10.6961 10.8268 10.8268 10.9490 10.9490 11.1714 11.1714 11.5578 11.5578 11.7405 11.7405 12.3727 12.3727 12.4485 12.4485 12.6257 12.6257 12.9979 12.9979 13.2558 13.2558 13.7571 13.7571 k = 0.5804 0.0567 0.3353 ( 3320 PWs) bands (ev): 6.4283 6.4283 7.1923 7.1923 8.0404 8.0404 8.3580 8.3580 8.4765 8.4765 8.9992 8.9992 9.2425 9.2425 9.3768 9.3768 9.4318 9.4318 9.5393 9.5393 9.6015 9.6015 9.7007 9.7007 9.7450 9.7450 9.9191 9.9191 9.9999 9.9999 10.1467 10.1467 10.6289 10.6289 10.6720 10.6720 10.8173 10.8173 10.9213 10.9213 11.1705 11.1705 11.5300 11.5300 11.7253 11.7253 12.3422 12.3422 12.4695 12.4695 12.6630 12.6630 13.0226 13.0226 13.2758 13.2758 13.7706 13.7706 k = 0.5848 0.0438 0.3426 ( 3320 PWs) bands (ev): 6.4589 6.4589 7.2067 7.2067 8.0301 8.0301 8.3646 8.3646 8.5020 8.5020 8.9977 8.9977 9.2422 9.2422 9.3672 9.3672 9.4278 9.4278 9.5234 9.5234 9.6059 9.6059 9.6997 9.6997 9.7435 9.7435 9.9145 9.9145 10.0095 10.0095 10.1574 10.1574 10.6023 10.6023 10.6479 10.6479 10.8087 10.8087 10.8950 10.8950 11.1696 11.1696 11.5036 11.5036 11.7143 11.7143 12.3111 12.3111 12.4895 12.4895 12.7004 12.7004 13.0497 13.0497 13.2944 13.2944 13.7804 13.7804 k = 0.5893 0.0309 0.3499 ( 3316 PWs) bands (ev): 6.4903 6.4903 7.2172 7.2172 8.0228 8.0228 8.3709 8.3709 8.5285 8.5285 8.9950 8.9950 9.2442 9.2442 9.3579 9.3579 9.4229 9.4229 9.5069 9.5069 9.6107 9.6107 9.6979 9.6979 9.7420 9.7420 9.9068 9.9068 10.0209 10.0209 10.1692 10.1692 10.5732 10.5732 10.6241 10.6241 10.8006 10.8006 10.8717 10.8717 11.1688 11.1688 11.4785 11.4785 11.7068 11.7068 12.2803 12.2803 12.5083 12.5083 12.7371 12.7371 13.0792 13.0792 13.3112 13.3112 13.7858 13.7858 k = 0.5938 0.0180 0.3572 ( 3318 PWs) bands (ev): 6.5222 6.5222 7.2231 7.2231 8.0190 8.0190 8.3768 8.3768 8.5558 8.5558 8.9912 8.9912 9.2480 9.2480 9.3492 9.3492 9.4171 9.4171 9.4901 9.4901 9.6158 9.6158 9.6952 9.6952 9.7407 9.7407 9.8975 9.8975 10.0327 10.0327 10.1818 10.1818 10.5419 10.5419 10.6001 10.6001 10.7925 10.7925 10.8532 10.8532 11.1680 11.1680 11.4550 11.4550 11.7025 11.7025 12.2501 12.2501 12.5257 12.5257 12.7724 12.7724 13.1109 13.1109 13.3265 13.3265 13.7859 13.7859 k = 0.5982 0.0052 0.3645 ( 3314 PWs) bands (ev): 6.5543 6.5543 7.2237 7.2237 8.0193 8.0193 8.3822 8.3822 8.5839 8.5839 8.9869 8.9869 9.2526 9.2526 9.3421 9.3421 9.4102 9.4102 9.4735 9.4735 9.6210 9.6210 9.6915 9.6915 9.7396 9.7396 9.8874 9.8874 10.0441 10.0441 10.1950 10.1950 10.5088 10.5088 10.5757 10.5757 10.7844 10.7844 10.8403 10.8403 11.1669 11.1669 11.4329 11.4329 11.7006 11.7006 12.2208 12.2208 12.5418 12.5418 12.8059 12.8059 13.1443 13.1443 13.3401 13.3401 13.7804 13.7804 k = 0.6027-0.0077 0.3718 ( 3316 PWs) bands (ev): 6.5863 6.5863 7.2186 7.2186 8.0242 8.0242 8.3872 8.3872 8.6126 8.6126 8.9825 8.9825 9.2564 9.2564 9.3376 9.3376 9.4024 9.4024 9.4574 9.4574 9.6261 9.6261 9.6870 9.6870 9.7390 9.7390 9.8766 9.8766 10.0549 10.0549 10.2087 10.2087 10.4744 10.4744 10.5505 10.5505 10.7772 10.7772 10.8330 10.8330 11.1656 11.1656 11.4124 11.4124 11.7006 11.7006 12.1923 12.1923 12.5566 12.5566 12.8375 12.8375 13.1792 13.1792 13.3522 13.3522 13.7692 13.7692 k = 0.6071-0.0206 0.3791 ( 3316 PWs) bands (ev): 6.6175 6.6175 7.2079 7.2079 8.0336 8.0336 8.3915 8.3915 8.6418 8.6418 8.9784 8.9784 9.2576 9.2576 9.3376 9.3376 9.3938 9.3938 9.4418 9.4418 9.6308 9.6308 9.6822 9.6822 9.7388 9.7388 9.8654 9.8654 10.0645 10.0645 10.2225 10.2225 10.4391 10.4391 10.5250 10.5250 10.7720 10.7720 10.8300 10.8300 11.1640 11.1640 11.3936 11.3936 11.7021 11.7021 12.1647 12.1647 12.5702 12.5702 12.8668 12.8668 13.2148 13.2148 13.3631 13.3631 13.7524 13.7524 k = 0.6116-0.0335 0.3864 ( 3318 PWs) bands (ev): 6.6474 6.6474 7.1920 7.1920 8.0474 8.0474 8.3953 8.3953 8.6712 8.6712 8.9752 8.9752 9.2550 9.2550 9.3429 9.3429 9.3846 9.3846 9.4268 9.4268 9.6350 9.6350 9.6775 9.6775 9.7394 9.7394 9.8537 9.8537 10.0727 10.0727 10.2362 10.2362 10.4037 10.4037 10.4995 10.4995 10.7697 10.7697 10.8303 10.8303 11.1619 11.1619 11.3765 11.3765 11.7046 11.7046 12.1381 12.1381 12.5827 12.5827 12.8937 12.8937 13.2502 13.2502 13.3733 13.3733 13.7306 13.7306 k = 0.6161-0.0464 0.3937 ( 3319 PWs) bands (ev): 6.6748 6.6748 7.1720 7.1720 8.0650 8.0650 8.3985 8.3985 8.7006 8.7006 8.9733 8.9733 9.2490 9.2490 9.3532 9.3532 9.3750 9.3750 9.4123 9.4123 9.6385 9.6385 9.6735 9.6735 9.7408 9.7408 9.8415 9.8415 10.0790 10.0790 10.2488 10.2488 10.3690 10.3690 10.4751 10.4751 10.7706 10.7706 10.8332 10.8332 11.1593 11.1593 11.3614 11.3614 11.7075 11.7075 12.1125 12.1125 12.5941 12.5941 12.9180 12.9180 13.2836 13.2836 13.3842 13.3842 13.7045 13.7045 k = 0.6205-0.0593 0.4010 ( 3314 PWs) bands (ev): 6.6982 6.6982 7.1495 7.1495 8.0858 8.0858 8.4013 8.4013 8.7298 8.7298 8.9729 8.9729 9.2408 9.2408 9.3645 9.3645 9.3676 9.3676 9.3986 9.3986 9.6411 9.6411 9.6706 9.6706 9.7430 9.7430 9.8288 9.8288 10.0830 10.0830 10.2582 10.2582 10.3377 10.3377 10.4527 10.4527 10.7745 10.7745 10.8381 10.8381 11.1561 11.1561 11.3483 11.3483 11.7104 11.7104 12.0881 12.0881 12.6044 12.6044 12.9398 12.9398 13.3118 13.3118 13.3981 13.3981 13.6751 13.6751 k = 0.6250-0.0722 0.4082 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7584 8.7584 8.9745 8.9745 9.2316 9.2316 9.3555 9.3555 9.3772 9.3772 9.3909 9.3909 9.6431 9.6431 9.6692 9.6692 9.7458 9.7458 9.8156 9.8156 10.0838 10.0838 10.2562 10.2562 10.3178 10.3178 10.4334 10.4334 10.7809 10.7809 10.8448 10.8448 11.1521 11.1521 11.3371 11.3371 11.7126 11.7126 12.0650 12.0650 12.6137 12.6137 12.9588 12.9588 13.3311 13.3311 13.4184 13.4184 13.6430 13.6430 k = 0.6250-0.0722 0.4082 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7584 8.7584 8.9745 8.9745 9.2316 9.2316 9.3555 9.3555 9.3772 9.3772 9.3909 9.3909 9.6431 9.6431 9.6692 9.6692 9.7458 9.7458 9.8156 9.8156 10.0838 10.0838 10.2562 10.2562 10.3178 10.3178 10.4334 10.4334 10.7809 10.7809 10.8448 10.8448 11.1521 11.1521 11.3371 11.3371 11.7126 11.7126 12.0650 12.0650 12.6137 12.6137 12.9588 12.9588 13.3311 13.3311 13.4184 13.4185 13.6430 13.6430 k = 0.6176-0.0679 0.4203 ( 3316 PWs) bands (ev): 6.7165 6.7165 7.1266 7.1266 8.1094 8.1094 8.4038 8.4038 8.7590 8.7590 8.9749 8.9749 9.2312 9.2312 9.3543 9.3543 9.3769 9.3769 9.3900 9.3900 9.6389 9.6389 9.6733 9.6733 9.7457 9.7457 9.8176 9.8176 10.0839 10.0839 10.2568 10.2568 10.3161 10.3161 10.4337 10.4337 10.7798 10.7798 10.8450 10.8450 11.1530 11.1530 11.3372 11.3372 11.7132 11.7132 12.0638 12.0638 12.6153 12.6153 12.9588 12.9588 13.3283 13.3283 13.4076 13.4076 13.6566 13.6566 k = 0.6103-0.0637 0.4323 ( 3315 PWs) bands (ev): 6.7194 6.7194 7.1254 7.1254 8.1110 8.1110 8.4028 8.4028 8.7610 8.7610 8.9759 8.9759 9.2302 9.2302 9.3498 9.3498 9.3761 9.3761 9.3881 9.3881 9.6304 9.6304 9.6805 9.6805 9.7465 9.7465 9.8233 9.8233 10.0842 10.0842 10.2583 10.2583 10.3112 10.3112 10.4345 10.4345 10.7767 10.7767 10.8454 10.8454 11.1556 11.1556 11.3375 11.3375 11.7148 11.7148 12.0601 12.0601 12.6199 12.6199 12.9588 12.9588 13.3199 13.3199 13.3809 13.3809 13.6914 13.6914 k = 0.6029-0.0594 0.4443 ( 3315 PWs) bands (ev): 6.7242 6.7242 7.1233 7.1233 8.1138 8.1138 8.4011 8.4011 8.7642 8.7642 8.9776 8.9776 9.2284 9.2284 9.3406 9.3406 9.3754 9.3754 9.3867 9.3867 9.6212 9.6212 9.6846 9.6846 9.7512 9.7512 9.8316 9.8316 10.0847 10.0847 10.2602 10.2602 10.3039 10.3039 10.4357 10.4357 10.7718 10.7718 10.8459 10.8459 11.1599 11.1599 11.3379 11.3379 11.7175 11.7175 12.0541 12.0541 12.6274 12.6274 12.9588 12.9588 13.3061 13.3061 13.3475 13.3475 13.7387 13.7387 k = 0.5956-0.0552 0.4563 ( 3319 PWs) bands (ev): 6.7309 6.7309 7.1203 7.1203 8.1175 8.1175 8.3986 8.3986 8.7687 8.7687 8.9800 8.9800 9.2257 9.2257 9.3266 9.3266 9.3754 9.3754 9.3863 9.3863 9.6120 9.6120 9.6833 9.6833 9.7617 9.7617 9.8419 9.8419 10.0854 10.0854 10.2613 10.2613 10.2957 10.2957 10.4368 10.4368 10.7655 10.7655 10.8461 10.8461 11.1657 11.1657 11.3383 11.3383 11.7212 11.7212 12.0459 12.0459 12.6378 12.6378 12.9587 12.9587 13.2862 13.2862 13.3135 13.3135 13.7932 13.7932 k = 0.5882-0.0509 0.4683 ( 3322 PWs) bands (ev): 6.7395 6.7395 7.1164 7.1164 8.1224 8.1224 8.3952 8.3952 8.7745 8.7745 8.9829 8.9829 9.2221 9.2221 9.3088 9.3088 9.3761 9.3761 9.3870 9.3870 9.6027 9.6027 9.6772 9.6772 9.7771 9.7771 9.8536 9.8536 10.0863 10.0863 10.2585 10.2585 10.2898 10.2898 10.4378 10.4378 10.7583 10.7583 10.8460 10.8460 11.1728 11.1728 11.3388 11.3388 11.7260 11.7260 12.0358 12.0358 12.6510 12.6510 12.9586 12.9586 13.2595 13.2595 13.2831 13.2831 13.8524 13.8524 k = 0.5809-0.0467 0.4803 ( 3320 PWs) bands (ev): 6.7498 6.7498 7.1115 7.1115 8.1283 8.1283 8.3909 8.3909 8.7814 8.7814 8.9862 8.9862 9.2174 9.2174 9.2886 9.2886 9.3775 9.3775 9.3887 9.3887 9.5935 9.5935 9.6684 9.6684 9.7953 9.7953 9.8663 9.8663 10.0873 10.0873 10.2488 10.2488 10.2894 10.2894 10.4383 10.4383 10.7504 10.7504 10.8454 10.8454 11.1809 11.1809 11.3391 11.3391 11.7319 11.7319 12.0240 12.0240 12.6668 12.6668 12.9584 12.9584 13.2279 13.2279 13.2560 13.2560 13.9149 13.9149 k = 0.5735-0.0425 0.4923 ( 3323 PWs) bands (ev): 6.7620 6.7620 7.1057 7.1057 8.1353 8.1353 8.3855 8.3855 8.7895 8.7895 8.9897 8.9897 9.2111 9.2111 9.2674 9.2674 9.3792 9.3792 9.3912 9.3912 9.5842 9.5842 9.6579 9.6579 9.8152 9.8152 9.8798 9.8798 10.0882 10.0882 10.2343 10.2343 10.2929 10.2929 10.4384 10.4384 10.7423 10.7423 10.8442 10.8442 11.1898 11.1898 11.3390 11.3390 11.7388 11.7388 12.0109 12.0109 12.6850 12.6850 12.9582 12.9582 13.1955 13.1955 13.2295 13.2295 13.9798 13.9798 k = 0.5662-0.0382 0.5043 ( 3321 PWs) bands (ev): 6.7758 6.7758 7.0988 7.0988 8.1433 8.1433 8.3789 8.3789 8.7988 8.7988 8.9933 8.9933 9.2028 9.2028 9.2469 9.2469 9.3813 9.3813 9.3947 9.3947 9.5748 9.5748 9.6464 9.6464 9.8358 9.8358 9.8939 9.8939 10.0887 10.0887 10.2173 10.2173 10.2981 10.2981 10.4379 10.4379 10.7342 10.7342 10.8423 10.8423 11.1995 11.1995 11.3386 11.3386 11.7468 11.7468 11.9967 11.9967 12.7056 12.7056 12.9578 12.9578 13.1644 13.1644 13.2027 13.2027 14.0466 14.0466 k = 0.5588-0.0340 0.5163 ( 3322 PWs) bands (ev): 6.7913 6.7913 7.0907 7.0907 8.1524 8.1524 8.3710 8.3710 8.8092 8.8092 8.9965 8.9965 9.1912 9.1912 9.2290 9.2290 9.3838 9.3838 9.3988 9.3988 9.5656 9.5656 9.6346 9.6346 9.8568 9.8568 9.9084 9.9084 10.0886 10.0886 10.1990 10.1990 10.3042 10.3042 10.4367 10.4367 10.7262 10.7262 10.8399 10.8399 11.2096 11.2096 11.3375 11.3375 11.7557 11.7557 11.9817 11.9817 12.7282 12.7282 12.9573 12.9573 13.1352 13.1352 13.1757 13.1757 14.1144 14.1144 k = 0.5515-0.0297 0.5283 ( 3322 PWs) bands (ev): 6.8084 6.8084 7.0814 7.0814 8.1624 8.1624 8.3617 8.3617 8.8206 8.8206 8.9987 8.9987 9.1763 9.1763 9.2152 9.2152 9.3866 9.3866 9.4035 9.4035 9.5567 9.5567 9.6225 9.6225 9.8776 9.8776 9.9233 9.9233 10.0874 10.0874 10.1804 10.1804 10.3109 10.3109 10.4346 10.4346 10.7188 10.7188 10.8369 10.8369 11.2201 11.2201 11.3356 11.3356 11.7657 11.7657 11.9661 11.9661 12.7529 12.7529 12.9567 12.9567 13.1080 13.1080 13.1490 13.1490 14.1829 14.1829 k = 0.5441-0.0255 0.5403 ( 3320 PWs) bands (ev): 6.8270 6.8270 7.0706 7.0706 8.1734 8.1734 8.3510 8.3510 8.8331 8.8331 8.9991 8.9991 9.1602 9.1602 9.2042 9.2042 9.3897 9.3897 9.4086 9.4086 9.5486 9.5486 9.6105 9.6105 9.8981 9.8981 9.9384 9.9384 10.0844 10.0844 10.1620 10.1620 10.3182 10.3182 10.4317 10.4317 10.7119 10.7119 10.8337 10.8337 11.2307 11.2307 11.3329 11.3329 11.7766 11.7766 11.9503 11.9503 12.7794 12.7794 12.9557 12.9557 13.0830 13.0830 13.1229 13.1229 14.2510 14.2510 k = 0.5368-0.0212 0.5523 ( 3316 PWs) bands (ev): 6.8469 6.8469 7.0582 7.0582 8.1854 8.1854 8.3389 8.3389 8.8466 8.8466 8.9964 8.9964 9.1462 9.1462 9.1948 9.1948 9.3930 9.3930 9.4136 9.4136 9.5416 9.5416 9.5988 9.5988 9.9180 9.9180 9.9534 9.9534 10.0791 10.0791 10.1447 10.1447 10.3262 10.3262 10.4277 10.4277 10.7057 10.7057 10.8304 10.8304 11.2414 11.2414 11.3291 11.3291 11.7883 11.7883 11.9344 11.9344 12.8073 12.8073 12.9546 12.9546 13.0600 13.0600 13.0981 13.0981 14.3179 14.3179 k = 0.5294-0.0170 0.5643 ( 3318 PWs) bands (ev): 6.8680 6.8680 7.0441 7.0441 8.1982 8.1982 8.3255 8.3255 8.8611 8.8611 8.9897 8.9897 9.1363 9.1363 9.1860 9.1860 9.3963 9.3963 9.4180 9.4180 9.5363 9.5363 9.5873 9.5873 9.9370 9.9370 9.9681 9.9681 10.0710 10.0710 10.1292 10.1292 10.3352 10.3352 10.4224 10.4224 10.7004 10.7004 10.8271 10.8271 11.2520 11.2520 11.3242 11.3242 11.8009 11.8009 11.9186 11.9186 12.8365 12.8365 12.9530 12.9530 13.0388 13.0388 13.0750 13.0750 14.3822 14.3822 k = 0.5221-0.0127 0.5764 ( 3320 PWs) bands (ev): 6.8903 6.8903 7.0280 7.0280 8.2118 8.2118 8.3111 8.3111 8.8766 8.8766 8.9785 8.9785 9.1316 9.1316 9.1775 9.1775 9.3996 9.3996 9.4215 9.4215 9.5336 9.5336 9.5763 9.5763 9.9552 9.9552 9.9818 9.9818 10.0598 10.0598 10.1163 10.1163 10.3452 10.3452 10.4155 10.4155 10.6959 10.6959 10.8242 10.8242 11.2626 11.2626 11.3182 11.3182 11.8141 11.8141 11.9031 11.9031 12.8664 12.8664 12.9511 12.9511 13.0191 13.0191 13.0543 13.0543 14.4421 14.4421 k = 0.5147-0.0085 0.5884 ( 3326 PWs) bands (ev): 6.9134 6.9134 7.0098 7.0098 8.2259 8.2259 8.2960 8.2960 8.8929 8.8929 8.9636 8.9636 9.1315 9.1315 9.1695 9.1695 9.4025 9.4025 9.4236 9.4236 9.5341 9.5341 9.5657 9.5657 9.9722 9.9722 9.9936 9.9936 10.0466 10.0466 10.1063 10.1063 10.3565 10.3565 10.4068 10.4068 10.6925 10.6925 10.8220 10.8220 11.2728 11.2728 11.3110 11.3110 11.8278 11.8278 11.8880 11.8880 12.8960 12.8960 12.9490 12.9490 13.0008 13.0008 13.0369 13.0369 14.4953 14.4953 k = 0.5074-0.0042 0.6004 ( 3316 PWs) bands (ev): 6.9367 6.9367 6.9898 6.9898 8.2397 8.2397 8.2814 8.2814 8.9102 8.9102 8.9465 8.9465 9.1344 9.1344 9.1626 9.1626 9.4047 9.4047 9.4243 9.4243 9.5382 9.5382 9.5557 9.5557 9.9874 9.9874 10.0013 10.0013 10.0336 10.0336 10.0996 10.0996 10.3691 10.3691 10.3960 10.3960 10.6904 10.6904 10.8205 10.8205 11.2828 11.2828 11.3030 11.3030 11.8415 11.8415 11.8735 11.8735 12.9221 12.9221 12.9476 12.9476 12.9845 12.9845 13.0238 13.0238 14.5379 14.5379 k = 0.5000 0.0000 0.6124 ( 3316 PWs) bands (ev): 6.9536 6.9536 6.9740 6.9741 8.2478 8.2478 8.2730 8.2730 8.9273 8.9273 8.9292 8.9292 9.1366 9.1366 9.1592 9.1592 9.4056 9.4056 9.4244 9.4244 9.5443 9.5443 9.5477 9.5477 9.9972 9.9972 10.0015 10.0015 10.0272 10.0272 10.0971 10.0971 10.3824 10.3824 10.3833 10.3833 10.6896 10.6896 10.8200 10.8200 11.2902 11.2902 11.2962 11.2962 11.8512 11.8512 11.8636 11.8636 12.9327 12.9327 12.9498 12.9498 12.9762 12.9762 13.0180 13.0180 14.5590 14.5590 k = 0.5000 0.0000 0.6124 ( 3316 PWs) bands (ev): 6.9536 6.9536 6.9740 6.9741 8.2478 8.2478 8.2730 8.2730 8.9273 8.9273 8.9292 8.9292 9.1366 9.1366 9.1592 9.1592 9.4056 9.4056 9.4244 9.4244 9.5443 9.5443 9.5477 9.5477 9.9972 9.9972 10.0015 10.0015 10.0272 10.0272 10.0971 10.0971 10.3824 10.3824 10.3833 10.3833 10.6896 10.6896 10.8200 10.8200 11.2902 11.2902 11.2962 11.2962 11.8512 11.8512 11.8636 11.8636 12.9327 12.9327 12.9498 12.9498 12.9762 12.9762 13.0180 13.0180 14.5590 14.5591 k = 0.5000 0.0087 0.6000 ( 3316 PWs) bands (ev): 6.9251 6.9251 7.0016 7.0016 8.2320 8.2320 8.2870 8.2870 8.9007 8.9007 8.9542 8.9542 9.1314 9.1314 9.1660 9.1660 9.4046 9.4046 9.4255 9.4255 9.5336 9.5336 9.5607 9.5607 9.9829 9.9829 10.0025 10.0025 10.0363 10.0363 10.1023 10.1023 10.3620 10.3620 10.4041 10.4041 10.6899 10.6899 10.8202 10.8202 11.2791 11.2791 11.3081 11.3081 11.8358 11.8358 11.8806 11.8806 12.9223 12.9223 12.9428 12.9428 12.9822 12.9822 13.0272 13.0272 14.5321 14.5321 k = 0.5000 0.0175 0.5876 ( 3320 PWs) bands (ev): 6.8877 6.8877 7.0360 7.0360 8.2070 8.2070 8.3070 8.3070 8.8717 8.8717 8.9784 8.9784 9.1223 9.1223 9.1798 9.1798 9.4019 9.4019 9.4283 9.4283 9.5238 9.5238 9.5771 9.5771 9.9637 9.9637 9.9937 9.9937 10.0531 10.0531 10.1167 10.1167 10.3413 10.3413 10.4257 10.4257 10.6907 10.6907 10.8207 10.8207 11.2662 11.2662 11.3231 11.3231 11.8170 11.8170 11.9039 11.9039 12.9016 12.9016 12.9243 12.9243 12.9952 12.9952 13.0466 13.0466 14.4899 14.4899 k = 0.5000 0.0262 0.5753 ( 3328 PWs) bands (ev): 6.8495 6.8495 7.0692 7.0692 8.1805 8.1805 8.3253 8.3253 8.8418 8.8418 9.0005 9.0005 9.1131 9.1131 9.1966 9.1966 9.3986 9.3986 9.4322 9.4322 9.5165 9.5165 9.5949 9.5949 9.9450 9.9450 9.9804 9.9804 10.0689 10.0689 10.1383 10.1383 10.3208 10.3208 10.4479 10.4479 10.6923 10.6923 10.8216 10.8216 11.2542 11.2542 11.3389 11.3389 11.7996 11.7996 11.9288 11.9288 12.8777 12.8777 12.9014 12.9014 13.0084 13.0084 13.0689 13.0689 14.4419 14.4419 k = 0.5000 0.0350 0.5629 ( 3322 PWs) bands (ev): 6.8110 6.8110 7.1004 7.1004 8.1539 8.1539 8.3411 8.3411 8.8110 8.8110 9.0208 9.0208 9.1046 9.1046 9.2156 9.2156 9.3951 9.3951 9.4370 9.4370 9.5117 9.5117 9.6134 9.6134 9.9275 9.9275 9.9653 9.9653 10.0818 10.0818 10.1654 10.1654 10.3004 10.3004 10.4708 10.4708 10.6947 10.6947 10.8230 10.8230 11.2432 11.2432 11.3552 11.3552 11.7839 11.7839 11.9552 11.9552 12.8523 12.8523 12.8766 12.8766 13.0200 13.0200 13.0914 13.0914 14.3898 14.3898 k = 0.5000 0.0437 0.5505 ( 3326 PWs) bands (ev): 6.7725 6.7725 7.1290 7.1290 8.1280 8.1280 8.3541 8.3541 8.7797 8.7797 9.0391 9.0391 9.0967 9.0967 9.2364 9.2364 9.3920 9.3920 9.4425 9.4425 9.5089 9.5089 9.6321 9.6321 9.9115 9.9115 9.9497 9.9497 10.0918 10.0918 10.1961 10.1961 10.2804 10.2804 10.4942 10.4942 10.6983 10.6983 10.8247 10.8247 11.2330 11.2330 11.3719 11.3719 11.7699 11.7699 11.9830 11.9830 12.8261 12.8261 12.8507 12.8507 13.0293 13.0293 13.1131 13.1131 14.3350 14.3350 k = 0.5000 0.0525 0.5381 ( 3322 PWs) bands (ev): 6.7342 6.7342 7.1544 7.1544 8.1037 8.1037 8.3641 8.3641 8.7481 8.7481 9.0554 9.0554 9.0899 9.0899 9.2585 9.2585 9.3896 9.3896 9.4487 9.4487 9.5075 9.5075 9.6506 9.6506 9.8967 9.8967 9.9348 9.9348 10.0992 10.0992 10.2266 10.2266 10.2635 10.2635 10.5181 10.5181 10.7033 10.7033 10.8269 10.8269 11.2239 11.2239 11.3890 11.3890 11.7579 11.7579 12.0119 12.0119 12.7994 12.7994 12.8240 12.8240 13.0360 13.0360 13.1334 13.1334 14.2787 14.2787 k = 0.5000 0.0612 0.5258 ( 3320 PWs) bands (ev): 6.6962 6.6962 7.1762 7.1762 8.0818 8.0818 8.3714 8.3714 8.7164 8.7164 9.0678 9.0678 9.0862 9.0862 9.2815 9.2815 9.3882 9.3882 9.4558 9.4558 9.5071 9.5071 9.6682 9.6682 9.8827 9.8827 9.9216 9.9216 10.1042 10.1042 10.2304 10.2304 10.2755 10.2755 10.5424 10.5424 10.7100 10.7100 10.8298 10.8298 11.2156 11.2156 11.4062 11.4062 11.7480 11.7480 12.0420 12.0420 12.7724 12.7724 12.7967 12.7967 13.0401 13.0401 13.1516 13.1516 14.2221 14.2221 k = 0.5000 0.0700 0.5134 ( 3324 PWs) bands (ev): 6.6588 6.6588 7.1938 7.1938 8.0629 8.0629 8.3759 8.3759 8.6849 8.6849 9.0690 9.0690 9.0930 9.0930 9.3048 9.3048 9.3880 9.3880 9.4636 9.4636 9.5072 9.5072 9.6846 9.6846 9.8685 9.8685 9.9112 9.9112 10.1069 10.1069 10.2122 10.2122 10.3111 10.3111 10.5668 10.5668 10.7188 10.7188 10.8333 10.8333 11.2084 11.2084 11.4236 11.4236 11.7403 11.7403 12.0732 12.0732 12.7450 12.7450 12.7690 12.7690 13.0415 13.0415 13.1676 13.1676 14.1661 14.1661 k = 0.5000 0.0787 0.5010 ( 3322 PWs) bands (ev): 6.6219 6.6219 7.2067 7.2067 8.0477 8.0477 8.3779 8.3779 8.6537 8.6537 9.0637 9.0637 9.1061 9.1061 9.3277 9.3277 9.3893 9.3893 9.4724 9.4724 9.5073 9.5073 9.6995 9.6995 9.8537 9.8537 9.9044 9.9044 10.1072 10.1072 10.1923 10.1923 10.3501 10.3501 10.5909 10.5909 10.7300 10.7300 10.8380 10.8380 11.2020 11.2020 11.4410 11.4410 11.7351 11.7351 12.1054 12.1054 12.7171 12.7171 12.7412 12.7412 13.0400 13.0400 13.1808 13.1808 14.1116 14.1116 k = 0.5000 0.0875 0.4887 ( 3320 PWs) bands (ev): 6.5859 6.5859 7.2147 7.2147 8.0368 8.0368 8.3778 8.3778 8.6230 8.6230 9.0572 9.0572 9.1202 9.1202 9.3491 9.3491 9.3923 9.3923 9.4821 9.4821 9.5073 9.5073 9.7125 9.7125 9.8385 9.8386 9.9012 9.9012 10.1047 10.1047 10.1729 10.1729 10.3899 10.3899 10.6142 10.6142 10.7438 10.7438 10.8441 10.8441 11.1965 11.1965 11.4584 11.4584 11.7326 11.7326 12.1385 12.1385 12.6886 12.6886 12.7135 12.7135 13.0359 13.0359 13.1911 13.1911 14.0593 14.0593 k = 0.5000 0.0962 0.4763 ( 3314 PWs) bands (ev): 6.5506 6.5506 7.2175 7.2175 8.0303 8.0303 8.3759 8.3759 8.5929 8.5929 9.0505 9.0505 9.1345 9.1345 9.3676 9.3676 9.3983 9.3983 9.4924 9.4924 9.5078 9.5078 9.7233 9.7233 9.8234 9.8234 9.9009 9.9009 10.0987 10.0987 10.1556 10.1556 10.4299 10.4299 10.6364 10.6364 10.7598 10.7598 10.8522 10.8522 11.1918 11.1918 11.4758 11.4758 11.7330 11.7330 12.1722 12.1722 12.6593 12.6593 12.6861 12.6861 13.0294 13.0294 13.1983 13.1983 14.0095 14.0095 k = 0.5000 0.1050 0.4639 ( 3316 PWs) bands (ev): 6.5164 6.5164 7.2153 7.2153 8.0282 8.0282 8.3723 8.3723 8.5636 8.5636 9.0436 9.0436 9.1490 9.1490 9.3808 9.3808 9.4085 9.4085 9.4999 9.4999 9.5121 9.5121 9.7314 9.7314 9.8089 9.8089 9.9031 9.9031 10.0882 10.0882 10.1418 10.1418 10.4695 10.4695 10.6572 10.6572 10.7772 10.7772 10.8634 10.8634 11.1878 11.1878 11.4933 11.4933 11.7367 11.7367 12.2065 12.2065 12.6292 12.6292 12.6589 12.6589 13.0205 13.0205 13.2023 13.2023 13.9627 13.9627 k = 0.5000 0.1137 0.4515 ( 3322 PWs) bands (ev): 6.4832 6.4832 7.2085 7.2085 8.0303 8.0303 8.3675 8.3675 8.5352 8.5352 9.0367 9.0367 9.1638 9.1638 9.3893 9.3893 9.4221 9.4221 9.5009 9.5009 9.5243 9.5243 9.7363 9.7363 9.7959 9.7959 9.9067 9.9067 10.0734 10.0734 10.1322 10.1322 10.5080 10.5080 10.6767 10.6767 10.7944 10.7944 10.8787 10.8787 11.1845 11.1845 11.5109 11.5109 11.7438 11.7438 12.2410 12.2410 12.5987 12.5987 12.6321 12.6321 13.0097 13.0097 13.2029 13.2029 13.9190 13.9190 k = 0.5000 0.1225 0.4392 ( 3322 PWs) bands (ev): 6.4511 6.4511 7.1975 7.1975 8.0361 8.0361 8.3617 8.3617 8.5078 8.5078 9.0298 9.0298 9.1788 9.1788 9.3955 9.3955 9.4360 9.4360 9.4999 9.4999 9.5399 9.5399 9.7369 9.7369 9.7857 9.7857 9.9110 9.9110 10.0561 10.0561 10.1255 10.1255 10.5453 10.5453 10.6953 10.6953 10.8103 10.8103 10.8987 10.8987 11.1819 11.1819 11.5291 11.5291 11.7545 11.7545 12.2753 12.2753 12.5677 12.5677 12.6058 12.6058 12.9975 12.9975 13.2004 13.2004 13.8785 13.8785 k = 0.5000 0.1312 0.4268 ( 3322 PWs) bands (ev): 6.4202 6.4202 7.1831 7.1831 8.0451 8.0451 8.3552 8.3552 8.4815 8.4815 9.0229 9.0229 9.1940 9.1940 9.4009 9.4009 9.4487 9.4487 9.4988 9.4988 9.5570 9.5570 9.7325 9.7325 9.7791 9.7791 9.9146 9.9146 10.0387 10.0387 10.1207 10.1207 10.5808 10.5808 10.7130 10.7130 10.8243 10.8243 10.9230 10.9230 11.1800 11.1800 11.5483 11.5483 11.7689 11.7689 12.3083 12.3083 12.5365 12.5365 12.5806 12.5806 12.9843 12.9843 13.1946 13.1946 13.8409 13.8409 k = 0.5000 0.1400 0.4144 ( 3320 PWs) bands (ev): 6.3907 6.3907 7.1660 7.1660 8.0566 8.0566 8.3482 8.3482 8.4565 8.4565 9.0161 9.0161 9.2094 9.2094 9.4056 9.4056 9.4598 9.4598 9.4985 9.4985 9.5749 9.5749 9.7241 9.7241 9.7754 9.7754 9.9159 9.9159 10.0233 10.0233 10.1170 10.1170 10.6145 10.6145 10.7302 10.7302 10.8370 10.8370 10.9498 10.9498 11.1787 11.1787 11.5690 11.5690 11.7872 11.7872 12.3383 12.3383 12.5052 12.5052 12.5580 12.5580 12.9706 12.9706 13.1859 13.1859 13.8061 13.8061 k = 0.5000 0.1487 0.4021 ( 3320 PWs) bands (ev): 6.3624 6.3624 7.1468 7.1468 8.0700 8.0700 8.3409 8.3409 8.4328 8.4328 9.0093 9.0093 9.2250 9.2250 9.4094 9.4094 9.4693 9.4693 9.4996 9.4996 9.5927 9.5927 9.7135 9.7135 9.7730 9.7730 9.9129 9.9129 10.0121 10.0121 10.1143 10.1143 10.6460 10.6460 10.7470 10.7470 10.8491 10.8491 10.9772 10.9772 11.1780 11.1780 11.5918 11.5918 11.8093 11.8093 12.3619 12.3619 12.4742 12.4742 12.5415 12.5415 12.9569 12.9569 13.1744 13.1744 13.7738 13.7738 k = 0.5000 0.1575 0.3897 ( 3322 PWs) bands (ev): 6.3356 6.3356 7.1263 7.1263 8.0845 8.0845 8.3334 8.3334 8.4105 8.4105 9.0027 9.0027 9.2406 9.2406 9.4123 9.4123 9.4772 9.4772 9.5027 9.5027 9.6099 9.6099 9.7023 9.7023 9.7708 9.7708 9.9044 9.9044 10.0064 10.0064 10.1125 10.1125 10.6755 10.6755 10.7632 10.7632 10.8613 10.8613 11.0036 11.0036 11.1779 11.1779 11.6171 11.6171 11.8354 11.8354 12.3730 12.3730 12.4435 12.4435 12.5367 12.5367 12.9437 12.9437 13.1604 13.1604 13.7437 13.7437 k = 0.5000 0.1662 0.3773 ( 3320 PWs) bands (ev): 6.3103 6.3103 7.1050 7.1050 8.0997 8.0997 8.3258 8.3258 8.3897 8.3897 8.9963 8.9963 9.2561 9.2561 9.4140 9.4140 9.4841 9.4841 9.5078 9.5078 9.6257 9.6257 9.6913 9.6913 9.7683 9.7683 9.8910 9.8910 10.0056 10.0056 10.1115 10.1115 10.7030 10.7030 10.7788 10.7788 10.8741 10.8741 11.0278 11.0278 11.1785 11.1785 11.6450 11.6450 11.8656 11.8656 12.3677 12.3677 12.4135 12.4135 12.5476 12.5476 12.9311 12.9311 13.1442 13.1442 13.7154 13.7154 k = 0.5000 0.1750 0.3649 ( 3318 PWs) bands (ev): 6.2864 6.2864 7.0835 7.0835 8.1151 8.1151 8.3182 8.3182 8.3706 8.3706 8.9900 8.9900 9.2714 9.2714 9.4146 9.4146 9.4906 9.4906 9.5145 9.5145 9.6393 9.6393 9.6811 9.6811 9.7655 9.7655 9.8745 9.8745 10.0079 10.0079 10.1113 10.1113 10.7285 10.7285 10.7937 10.7937 10.8874 10.8874 11.0490 11.0490 11.1798 11.1798 11.6755 11.6755 11.9001 11.9001 12.3493 12.3493 12.3843 12.3843 12.5712 12.5712 12.9195 12.9195 13.1260 13.1260 13.6887 13.6887 k = 0.5000 0.1837 0.3526 ( 3324 PWs) bands (ev): 6.2642 6.2642 7.0622 7.0622 8.1303 8.1303 8.3105 8.3105 8.3533 8.3533 8.9841 8.9841 9.2862 9.2862 9.4142 9.4142 9.4973 9.4973 9.5221 9.5221 9.6493 9.6493 9.6726 9.6726 9.7624 9.7624 9.8568 9.8568 10.0117 10.0117 10.1119 10.1119 10.7520 10.7520 10.8077 10.8077 10.9012 10.9012 11.0667 11.0667 11.1816 11.1816 11.7082 11.7082 11.9390 11.9390 12.3235 12.3235 12.3560 12.3560 12.6018 12.6018 12.9090 12.9090 13.1062 13.1062 13.6631 13.6631 k = 0.5000 0.1925 0.3402 ( 3320 PWs) bands (ev): 6.2435 6.2435 7.0415 7.0415 8.1450 8.1450 8.3028 8.3028 8.3380 8.3380 8.9784 8.9784 9.3003 9.3003 9.4131 9.4131 9.5046 9.5046 9.5303 9.5303 9.6519 9.6519 9.6696 9.6696 9.7592 9.7592 9.8394 9.8394 10.0161 10.0161 10.1132 10.1132 10.7737 10.7737 10.8207 10.8207 10.9154 10.9154 11.0809 11.0809 11.1840 11.1840 11.7423 11.7423 11.9825 11.9825 12.2945 12.2945 12.3291 12.3291 12.6355 12.6355 12.8997 12.8997 13.0852 13.0852 13.6386 13.6386 k = 0.5000 0.2012 0.3278 ( 3312 PWs) bands (ev): 6.2245 6.2245 7.0218 7.0218 8.1588 8.1588 8.2947 8.2947 8.3250 8.3250 8.9731 8.9731 9.3136 9.3136 9.4118 9.4118 9.5123 9.5123 9.5390 9.5390 9.6468 9.6468 9.6719 9.6719 9.7554 9.7554 9.8235 9.8235 10.0205 10.0205 10.1151 10.1151 10.7937 10.7937 10.8328 10.8328 10.9297 10.9297 11.0921 11.0921 11.1869 11.1869 11.7771 11.7771 12.0302 12.0302 12.2645 12.2645 12.3041 12.3041 12.6705 12.6705 12.8916 12.8916 13.0635 13.0635 13.6147 13.6148 k = 0.5000 0.2099 0.3155 ( 3316 PWs) bands (ev): 6.2072 6.2072 7.0033 7.0033 8.1715 8.1715 8.2864 8.2864 8.3144 8.3144 8.9682 8.9682 9.3257 9.3257 9.4104 9.4104 9.5205 9.5205 9.5479 9.5479 9.6400 9.6400 9.6735 9.6735 9.7501 9.7501 9.8107 9.8107 10.0248 10.0248 10.1173 10.1173 10.8118 10.8118 10.8440 10.8440 10.9436 10.9436 11.1006 11.1006 11.1898 11.1898 11.8116 11.8116 12.0804 12.0804 12.2348 12.2348 12.2825 12.2825 12.7054 12.7054 12.8846 12.8846 13.0413 13.0413 13.5903 13.5903 k = 0.5000 0.2187 0.3031 ( 3322 PWs) bands (ev): 6.1917 6.1917 6.9862 6.9862 8.1829 8.1829 8.2779 8.2779 8.3061 8.3061 8.9637 8.9637 9.3365 9.3365 9.4093 9.4093 9.5289 9.5289 9.5570 9.5570 9.6334 9.6334 9.6728 9.6728 9.7422 9.7422 9.8020 9.8020 10.0286 10.0286 10.1198 10.1198 10.8283 10.8283 10.8542 10.8542 10.9570 10.9570 11.1070 11.1070 11.1927 11.1927 11.8454 11.8454 12.1281 12.1281 12.2070 12.2070 12.2692 12.2692 12.7395 12.7395 12.8788 12.8788 13.0193 13.0193 13.5269 13.5269 k = 0.5000 0.2274 0.2907 ( 3322 PWs) bands (ev): 6.1779 6.1779 6.9707 6.9707 8.1927 8.1927 8.2700 8.2700 8.2997 8.2997 8.9596 8.9596 9.3458 9.3458 9.4086 9.4086 9.5377 9.5377 9.5662 9.5662 9.6275 9.6275 9.6700 9.6700 9.7316 9.7316 9.7974 9.7974 10.0322 10.0322 10.1225 10.1225 10.8430 10.8430 10.8634 10.8634 10.9695 10.9695 11.1119 11.1119 11.1955 11.1955 11.8779 11.8779 12.1552 12.1552 12.1847 12.1847 12.2786 12.2786 12.7719 12.7719 12.8740 12.8740 12.9980 12.9980 13.4367 13.4367 k = 0.5000 0.2362 0.2784 ( 3324 PWs) bands (ev): 6.1659 6.1659 6.9570 6.9570 8.2007 8.2007 8.2632 8.2632 8.2947 8.2947 8.9561 8.9561 9.3533 9.3533 9.4086 9.4086 9.5464 9.5464 9.5753 9.5753 9.6226 9.6226 9.6652 9.6652 9.7195 9.7195 9.7958 9.7958 10.0354 10.0354 10.1250 10.1250 10.8559 10.8559 10.8716 10.8716 10.9808 10.9808 11.1156 11.1156 11.1980 11.1980 11.9087 11.9087 12.1456 12.1456 12.1722 12.1722 12.3229 12.3229 12.8017 12.8017 12.8706 12.8706 12.9778 12.9778 13.3456 13.3456 k = 0.5000 0.2449 0.2660 ( 3324 PWs) bands (ev): 6.1556 6.1556 6.9452 6.9452 8.2067 8.2067 8.2580 8.2580 8.2908 8.2908 8.9530 8.9530 9.3590 9.3590 9.4091 9.4091 9.5552 9.5552 9.5842 9.5842 9.6189 9.6189 9.6591 9.6591 9.7070 9.7070 9.7956 9.7956 10.0382 10.0382 10.1274 10.1274 10.8670 10.8670 10.8787 10.8787 10.9907 10.9907 11.1185 11.1185 11.2002 11.2002 11.9378 11.9378 12.1258 12.1258 12.1578 12.1578 12.3870 12.3870 12.8275 12.8275 12.8691 12.8691 12.9596 12.9596 13.2545 13.2545 k = 0.5000 0.2537 0.2536 ( 3322 PWs) bands (ev): 6.1473 6.1473 6.9354 6.9354 8.2106 8.2106 8.2545 8.2545 8.2879 8.2879 8.9505 8.9505 9.3631 9.3631 9.4102 9.4102 9.5637 9.5637 9.5925 9.5925 9.6166 9.6166 9.6519 9.6519 9.6951 9.6951 9.7959 9.7959 10.0406 10.0406 10.1295 10.1295 10.8762 10.8762 10.8846 10.8846 10.9990 10.9990 11.1207 11.1207 11.2020 11.2020 11.9648 11.9648 12.1075 12.1075 12.1411 12.1411 12.4596 12.4596 12.8454 12.8454 12.8722 12.8722 12.9439 12.9439 13.1641 13.1641 k = 0.5000 0.2624 0.2412 ( 3326 PWs) bands (ev): 6.1407 6.1407 6.9277 6.9277 8.2126 8.2126 8.2527 8.2527 8.2858 8.2858 8.9485 8.9485 9.3658 9.3658 9.4116 9.4116 9.5717 9.5717 9.5995 9.5995 9.6163 9.6163 9.6439 9.6439 9.6845 9.6845 9.7964 9.7964 10.0424 10.0424 10.1312 10.1312 10.8833 10.8833 10.8893 10.8893 11.0055 11.0055 11.1224 11.1224 11.2034 11.2034 11.9897 11.9897 12.0920 12.0920 12.1243 12.1243 12.5365 12.5365 12.8515 12.8515 12.8825 12.8825 12.9317 12.9317 13.0751 13.0751 k = 0.5000 0.2712 0.2289 ( 3330 PWs) bands (ev): 6.1360 6.1360 6.9222 6.9222 8.2133 8.2133 8.2521 8.2521 8.2844 8.2844 8.9470 8.9470 9.3674 9.3674 9.4128 9.4128 9.5784 9.5784 9.6050 9.6050 9.6184 9.6184 9.6354 9.6354 9.6757 9.6757 9.7968 9.7968 10.0438 10.0438 10.1324 10.1324 10.8885 10.8885 10.8927 10.8927 11.0102 11.0102 11.1236 11.1236 11.2044 11.2044 12.0121 12.0121 12.0794 12.0794 12.1088 12.1088 12.6153 12.6153 12.8509 12.8509 12.8925 12.8925 12.9242 12.9242 12.9895 12.9895 k = 0.5000 0.2799 0.2165 ( 3322 PWs) bands (ev): 6.1332 6.1332 6.9189 6.9189 8.2134 8.2134 8.2521 8.2521 8.2835 8.2835 8.9462 8.9462 9.3683 9.3683 9.4137 9.4137 9.5829 9.5829 9.6100 9.6100 9.6214 9.6214 9.6274 9.6274 9.6696 9.6696 9.7971 9.7971 10.0447 10.0447 10.1332 10.1332 10.8916 10.8916 10.8948 10.8948 11.0131 11.0131 11.1243 11.1243 11.2051 11.2051 12.0313 12.0313 12.0687 12.0687 12.0968 12.0968 12.6919 12.6919 12.8435 12.8435 12.8962 12.8962 12.9156 12.9156 12.9225 12.9225 k = 0.5000 0.2887 0.2041 ( 3316 PWs) bands (ev): 6.1323 6.1323 6.9177 6.9177 8.2134 8.2134 8.2521 8.2521 8.2833 8.2833 8.9459 8.9459 9.3685 9.3685 9.4140 9.4140 9.5844 9.5844 9.6135 9.6135 9.6226 9.6226 9.6229 9.6229 9.6673 9.6673 9.7972 9.7972 10.0450 10.0450 10.1335 10.1335 10.8927 10.8927 10.8955 10.8955 11.0141 11.0141 11.1246 11.1246 11.2053 11.2053 12.0420 12.0420 12.0616 12.0616 12.0921 12.0921 12.7395 12.7395 12.8242 12.8242 12.8839 12.8839 12.8991 12.8991 12.9223 12.9223 k = 0.5000 0.2887 0.2041 ( 3316 PWs) bands (ev): 6.1323 6.1323 6.9177 6.9177 8.2134 8.2134 8.2521 8.2521 8.2833 8.2833 8.9459 8.9459 9.3685 9.3685 9.4140 9.4140 9.5844 9.5844 9.6135 9.6135 9.6226 9.6226 9.6229 9.6229 9.6673 9.6673 9.7972 9.7972 10.0450 10.0450 10.1335 10.1335 10.8927 10.8927 10.8955 10.8955 11.0141 11.0141 11.1246 11.1246 11.2053 11.2053 12.0420 12.0420 12.0616 12.0616 12.0921 12.0921 12.7395 12.7395 12.8242 12.8242 12.8839 12.8839 12.8991 12.8991 12.9223 12.9223 k = 0.4955 0.2861 0.2187 ( 3324 PWs) bands (ev): 6.1333 6.1333 6.9189 6.9189 8.2134 8.2134 8.2521 8.2521 8.2836 8.2836 8.9462 8.9462 9.3683 9.3683 9.4137 9.4137 9.5828 9.5828 9.6099 9.6099 9.6213 9.6213 9.6275 9.6275 9.6697 9.6697 9.7971 9.7971 10.0447 10.0447 10.1332 10.1332 10.8915 10.8915 10.8948 10.8948 11.0131 11.0131 11.1243 11.1243 11.2051 11.2051 12.0310 12.0310 12.0689 12.0689 12.0970 12.0970 12.6904 12.6904 12.8439 12.8439 12.8962 12.8962 12.9171 12.9171 12.9223 12.9223 k = 0.4911 0.2835 0.2333 ( 3330 PWs) bands (ev): 6.1362 6.1362 6.9224 6.9224 8.2132 8.2132 8.2521 8.2521 8.2844 8.2844 8.9471 8.9471 9.3673 9.3673 9.4128 9.4128 9.5781 9.5781 9.6053 9.6053 9.6176 9.6176 9.6360 9.6360 9.6760 9.6760 9.7968 9.7968 10.0438 10.0438 10.1324 10.1324 10.8883 10.8883 10.8926 10.8926 11.0101 11.0101 11.1235 11.1235 11.2044 11.2044 12.0112 12.0112 12.0798 12.0798 12.1094 12.1094 12.6120 12.6120 12.8512 12.8512 12.8914 12.8914 12.9251 12.9251 12.9927 12.9927 k = 0.4866 0.2809 0.2479 ( 3329 PWs) bands (ev): 6.1411 6.1411 6.9281 6.9281 8.2125 8.2125 8.2528 8.2528 8.2859 8.2859 8.9485 8.9485 9.3656 9.3656 9.4115 9.4115 9.5707 9.5707 9.6018 9.6018 9.6133 9.6133 9.6453 9.6453 9.6850 9.6850 9.7964 9.7964 10.0423 10.0423 10.1311 10.1311 10.8830 10.8830 10.8890 10.8890 11.0052 11.0052 11.1223 11.1223 11.2033 11.2033 11.9883 11.9883 12.0925 12.0925 12.1255 12.1255 12.5316 12.5316 12.8527 12.8527 12.8789 12.8789 12.9342 12.9342 13.0802 13.0802 k = 0.4821 0.2784 0.2624 ( 3323 PWs) bands (ev): 6.1479 6.1479 6.9362 6.9362 8.2103 8.2103 8.2548 8.2548 8.2881 8.2881 8.9506 8.9506 9.3628 9.3628 9.4101 9.4101 9.5615 9.5615 9.5988 9.5988 9.6095 9.6095 9.6548 9.6548 9.6956 9.6956 9.7959 9.7959 10.0404 10.0404 10.1293 10.1293 10.8756 10.8756 10.8841 10.8841 10.9984 10.9984 11.1206 11.1206 11.2018 11.2018 11.9630 11.9630 12.1077 12.1077 12.1433 12.1433 12.4535 12.4535 12.8481 12.8481 12.8654 12.8654 12.9482 12.9482 13.1708 13.1708 k = 0.4777 0.2758 0.2770 ( 3329 PWs) bands (ev): 6.1566 6.1566 6.9463 6.9463 8.2062 8.2062 8.2585 8.2585 8.2910 8.2910 8.9533 8.9533 9.3586 9.3586 9.4090 9.4090 9.5511 9.5511 9.5956 9.5956 9.6069 9.6069 9.6641 9.6641 9.7072 9.7072 9.7954 9.7954 10.0379 10.0379 10.1272 10.1272 10.8661 10.8661 10.8778 10.8778 10.9897 10.9897 11.1182 11.1182 11.1999 11.1999 11.9356 11.9356 12.1242 12.1242 12.1619 12.1619 12.3802 12.3802 12.8276 12.8276 12.8632 12.8632 12.9660 12.9660 13.2625 13.2625 k = 0.4732 0.2732 0.2916 ( 3327 PWs) bands (ev): 6.1672 6.1672 6.9586 6.9586 8.1999 8.1999 8.2643 8.2643 8.2948 8.2948 8.9564 8.9564 9.3527 9.3527 9.4084 9.4084 9.5398 9.5398 9.5925 9.5925 9.6056 9.6056 9.6730 9.6730 9.7190 9.7190 9.7955 9.7955 10.0351 10.0351 10.1247 10.1247 10.8549 10.8549 10.8703 10.8703 10.9794 10.9794 11.1152 11.1152 11.1977 11.1977 11.9065 11.9065 12.1376 12.1376 12.1812 12.1812 12.3171 12.3171 12.7994 12.7994 12.8657 12.8657 12.9866 12.9866 13.3544 13.3544 k = 0.4688 0.2706 0.3062 ( 3327 PWs) bands (ev): 6.1798 6.1798 6.9728 6.9728 8.1916 8.1916 8.2718 8.2718 8.2995 8.2995 8.9601 8.9601 9.3451 9.3451 9.4084 9.4084 9.5279 9.5279 9.5896 9.5896 9.6049 9.6049 9.6812 9.6812 9.7303 9.7303 9.7969 9.7969 10.0319 10.0319 10.1221 10.1221 10.8419 10.8419 10.8615 10.8615 10.9675 10.9675 11.1113 11.1113 11.1951 11.1951 11.8759 11.8759 12.1344 12.1344 12.2015 12.2015 12.2771 12.2771 12.7676 12.7676 12.8698 12.8698 13.0094 13.0094 13.4453 13.4453 k = 0.4643 0.2681 0.3208 ( 3325 PWs) bands (ev): 6.1941 6.1941 6.9889 6.9889 8.1815 8.1815 8.2807 8.2807 8.3054 8.3054 8.9642 8.9642 9.3359 9.3359 9.4090 9.4090 9.5156 9.5156 9.5872 9.5872 9.6048 9.6048 9.6885 9.6885 9.7395 9.7395 9.8009 9.8009 10.0284 10.0284 10.1195 10.1195 10.8275 10.8275 10.8516 10.8516 10.9543 10.9543 11.1062 11.1062 11.1922 11.1922 11.8442 11.8442 12.1007 12.1007 12.2242 12.2242 12.2730 12.2730 12.7337 12.7337 12.8751 12.8751 13.0337 13.0337 13.5317 13.5317 k = 0.4598 0.2655 0.3353 ( 3323 PWs) bands (ev): 6.2103 6.2103 7.0067 7.0067 8.1699 8.1699 8.2902 8.2902 8.3129 8.3129 8.9687 8.9687 9.3254 9.3254 9.4100 9.4100 9.5031 9.5031 9.5854 9.5854 9.6047 9.6047 9.6945 9.6945 9.7455 9.7455 9.8089 9.8089 10.0246 10.0246 10.1171 10.1171 10.8116 10.8116 10.8404 10.8404 10.9399 10.9399 11.0995 11.0995 11.1891 11.1891 11.8118 11.8118 12.0497 12.0497 12.2488 12.2488 12.2917 12.2917 12.6983 12.6983 12.8817 12.8817 13.0591 13.0591 13.5864 13.5864 k = 0.4554 0.2629 0.3499 ( 3325 PWs) bands (ev): 6.2282 6.2282 7.0259 7.0259 8.1570 8.1570 8.2994 8.2994 8.3227 8.3227 8.9734 8.9734 9.3140 9.3140 9.4110 9.4110 9.4907 9.4907 9.5843 9.5843 9.6044 9.6044 9.6990 9.6990 9.7483 9.7483 9.8209 9.8209 10.0204 10.0204 10.1152 10.1152 10.7946 10.7946 10.8279 10.8279 10.9247 10.9247 11.0907 11.0907 11.1859 11.1859 11.7788 11.7788 11.9956 11.9956 12.2741 12.2741 12.3199 12.3199 12.6625 12.6625 12.8897 12.8897 13.0851 13.0851 13.6129 13.6129 k = 0.4509 0.2603 0.3645 ( 3320 PWs) bands (ev): 6.2479 6.2479 7.0464 7.0464 8.1431 8.1431 8.3080 8.3080 8.3352 8.3352 8.9783 8.9783 9.3022 9.3022 9.4118 9.4118 9.4787 9.4787 9.5837 9.5837 9.6035 9.6035 9.7017 9.7017 9.7491 9.7491 9.8357 9.8357 10.0159 10.0159 10.1141 10.1141 10.7766 10.7766 10.8141 10.8141 10.9090 10.9090 11.0794 11.0794 11.1829 11.1829 11.7457 11.7457 11.9436 11.9436 12.2996 12.2996 12.3523 12.3523 12.6271 12.6271 12.8992 12.8992 13.1113 13.1113 13.6362 13.6362 k = 0.4464 0.2577 0.3791 ( 3319 PWs) bands (ev): 6.2693 6.2693 7.0678 7.0678 8.1284 8.1284 8.3158 8.3158 8.3503 8.3503 8.9832 8.9832 9.2901 9.2901 9.4120 9.4120 9.4674 9.4674 9.5836 9.5836 9.6014 9.6014 9.7028 9.7028 9.7492 9.7492 9.8521 9.8521 10.0110 10.0110 10.1140 10.1140 10.7578 10.7578 10.7988 10.7988 10.8933 10.8933 11.0650 11.0650 11.1801 11.1801 11.7127 11.7127 11.8960 11.8960 12.3251 12.3251 12.3856 12.3856 12.5937 12.5937 12.9104 12.9104 13.1373 13.1373 13.6588 13.6588 k = 0.4420 0.2552 0.3937 ( 3318 PWs) bands (ev): 6.2923 6.2923 7.0898 7.0898 8.1131 8.1131 8.3231 8.3231 8.3675 8.3675 8.9878 8.9878 9.2785 9.2785 9.4110 9.4110 9.4574 9.4574 9.5836 9.5836 9.5982 9.5982 9.7028 9.7028 9.7492 9.7492 9.8689 9.8689 10.0058 10.0058 10.1154 10.1154 10.7383 10.7383 10.7818 10.7818 10.8779 10.8779 11.0474 11.0474 11.1777 11.1777 11.6801 11.6801 11.8536 11.8536 12.3504 12.3504 12.4155 12.4155 12.5658 12.5658 12.9235 12.9235 13.1629 13.1629 13.6808 13.6808 k = 0.4375 0.2526 0.4082 ( 3318 PWs) bands (ev): 6.3168 6.3168 7.1121 7.1121 8.0975 8.0975 8.3303 8.3303 8.3865 8.3865 8.9921 8.9921 9.2678 9.2678 9.4080 9.4080 9.4492 9.4492 9.5823 9.5823 9.5945 9.5945 9.7022 9.7022 9.7489 9.7489 9.8854 9.8854 10.0005 10.0005 10.1183 10.1183 10.7181 10.7181 10.7628 10.7628 10.8632 10.8632 11.0265 11.0265 11.1756 11.1756 11.6482 11.6482 11.8168 11.8168 12.3750 12.3750 12.4333 12.4333 12.5519 12.5519 12.9387 12.9387 13.1877 13.1877 13.7020 13.7020 k = 0.4330 0.2500 0.4228 ( 3324 PWs) bands (ev): 6.3427 6.3427 7.1340 7.1340 8.0820 8.0820 8.3374 8.3374 8.4070 8.4070 8.9956 8.9956 9.2583 9.2583 9.4025 9.4025 9.4431 9.4431 9.5768 9.5768 9.5933 9.5933 9.7017 9.7017 9.7484 9.7484 9.9003 9.9003 9.9958 9.9958 10.1229 10.1229 10.6974 10.6974 10.7421 10.7421 10.8498 10.8498 11.0026 11.0026 11.1740 11.1740 11.6170 11.6170 11.7859 11.7859 12.3975 12.3975 12.4293 12.4293 12.5623 12.5623 12.9561 12.9561 13.2116 13.2116 13.7222 13.7222 k = 0.4286 0.2474 0.4374 ( 3322 PWs) bands (ev): 6.3701 6.3701 7.1552 7.1552 8.0669 8.0669 8.3444 8.3444 8.4289 8.4289 8.9981 8.9981 9.2508 9.2508 9.3950 9.3950 9.4388 9.4388 9.5668 9.5668 9.5949 9.5949 9.7014 9.7014 9.7476 9.7476 9.9120 9.9120 9.9931 9.9931 10.1293 10.1293 10.6759 10.6759 10.7197 10.7197 10.8377 10.8377 10.9764 10.9764 11.1726 11.1726 11.5868 11.5868 11.7605 11.7605 12.3992 12.3992 12.4285 12.4285 12.5905 12.5905 12.9758 12.9758 13.2344 13.2344 13.7408 13.7408 k = 0.4241 0.2449 0.4520 ( 3324 PWs) bands (ev): 6.3986 6.3986 7.1748 7.1748 8.0529 8.0529 8.3513 8.3513 8.4521 8.4521 8.9994 8.9994 9.2454 9.2454 9.3862 9.3862 9.4352 9.4352 9.5540 9.5540 9.5978 9.5978 9.7012 9.7012 9.7465 9.7465 9.9186 9.9186 9.9941 9.9941 10.1373 10.1373 10.6532 10.6532 10.6960 10.6960 10.8269 10.8269 10.9489 10.9489 11.1716 11.1716 11.5578 11.5578 11.7405 11.7405 12.3726 12.3726 12.4486 12.4486 12.6257 12.6257 12.9980 12.9980 13.2559 13.2559 13.7572 13.7572 k = 0.4196 0.2423 0.4666 ( 3320 PWs) bands (ev): 6.4283 6.4283 7.1923 7.1923 8.0404 8.0404 8.3580 8.3580 8.4765 8.4765 8.9993 8.9993 9.2425 9.2425 9.3767 9.3767 9.4317 9.4317 9.5394 9.5394 9.6015 9.6015 9.7008 9.7008 9.7451 9.7451 9.9191 9.9191 9.9999 9.9999 10.1468 10.1468 10.6288 10.6288 10.6719 10.6719 10.8173 10.8173 10.9212 10.9212 11.1707 11.1707 11.5300 11.5300 11.7252 11.7252 12.3421 12.3421 12.4696 12.4696 12.6629 12.6629 13.0227 13.0227 13.2759 13.2759 13.7707 13.7707 k = 0.4152 0.2397 0.4811 ( 3320 PWs) bands (ev): 6.4589 6.4589 7.2067 7.2067 8.0302 8.0302 8.3646 8.3646 8.5020 8.5020 8.9979 8.9979 9.2422 9.2422 9.3671 9.3671 9.4276 9.4276 9.5235 9.5235 9.6059 9.6059 9.6998 9.6998 9.7436 9.7436 9.9145 9.9145 10.0094 10.0094 10.1575 10.1575 10.6022 10.6022 10.6478 10.6478 10.8087 10.8087 10.8949 10.8949 11.1698 11.1698 11.5036 11.5036 11.7142 11.7142 12.3110 12.3110 12.4896 12.4896 12.7003 12.7003 13.0498 13.0498 13.2944 13.2944 13.7805 13.7805 k = 0.4107 0.2371 0.4957 ( 3316 PWs) bands (ev): 6.4903 6.4903 7.2172 7.2172 8.0228 8.0228 8.3709 8.3709 8.5285 8.5285 8.9951 8.9951 9.2442 9.2442 9.3577 9.3577 9.4228 9.4228 9.5070 9.5070 9.6107 9.6107 9.6980 9.6980 9.7421 9.7421 9.9069 9.9069 10.0208 10.0208 10.1692 10.1692 10.5732 10.5732 10.6240 10.6240 10.8006 10.8006 10.8716 10.8716 11.1690 11.1690 11.4785 11.4785 11.7068 11.7068 12.2803 12.2803 12.5083 12.5083 12.7370 12.7370 13.0793 13.0793 13.3113 13.3113 13.7858 13.7858 k = 0.4062 0.2345 0.5103 ( 3318 PWs) bands (ev): 6.5222 6.5222 7.2231 7.2231 8.0190 8.0190 8.3768 8.3768 8.5558 8.5558 8.9914 8.9914 9.2479 9.2479 9.3491 9.3491 9.4169 9.4169 9.4902 9.4902 9.6158 9.6158 9.6953 9.6953 9.7408 9.7408 9.8976 9.8976 10.0326 10.0326 10.1818 10.1818 10.5418 10.5418 10.6001 10.6001 10.7925 10.7925 10.8531 10.8531 11.1682 11.1682 11.4550 11.4550 11.7024 11.7024 12.2501 12.2501 12.5257 12.5257 12.7723 12.7723 13.1109 13.1109 13.3265 13.3265 13.7859 13.7859 k = 0.4018 0.2320 0.5249 ( 3314 PWs) bands (ev): 6.5543 6.5543 7.2236 7.2236 8.0194 8.0194 8.3823 8.3823 8.5839 8.5839 8.9871 8.9871 9.2525 9.2525 9.3420 9.3420 9.4100 9.4100 9.4736 9.4736 9.6210 9.6210 9.6915 9.6915 9.7397 9.7397 9.8874 9.8874 10.0441 10.0441 10.1951 10.1951 10.5087 10.5087 10.5756 10.5756 10.7845 10.7845 10.8402 10.8402 11.1671 11.1671 11.4329 11.4329 11.7005 11.7005 12.2207 12.2207 12.5419 12.5419 12.8059 12.8059 13.1444 13.1444 13.3402 13.3402 13.7804 13.7804 k = 0.3973 0.2294 0.5395 ( 3316 PWs) bands (ev): 6.5863 6.5863 7.2186 7.2186 8.0242 8.0242 8.3872 8.3872 8.6126 8.6126 8.9827 8.9827 9.2563 9.2563 9.3375 9.3375 9.4022 9.4022 9.4574 9.4574 9.6261 9.6261 9.6871 9.6871 9.7390 9.7390 9.8767 9.8767 10.0548 10.0548 10.2087 10.2087 10.4743 10.4743 10.5505 10.5505 10.7772 10.7772 10.8329 10.8329 11.1658 11.1658 11.4124 11.4124 11.7006 11.7006 12.1922 12.1922 12.5567 12.5567 12.8374 12.8374 13.1793 13.1793 13.3523 13.3523 13.7692 13.7692 k = 0.3929 0.2268 0.5541 ( 3316 PWs) bands (ev): 6.6176 6.6176 7.2078 7.2078 8.0336 8.0336 8.3915 8.3915 8.6417 8.6417 8.9786 8.9786 9.2575 9.2575 9.3375 9.3375 9.3936 9.3936 9.4418 9.4418 9.6308 9.6308 9.6823 9.6823 9.7389 9.7389 9.8654 9.8654 10.0644 10.0644 10.2226 10.2226 10.4390 10.4390 10.5250 10.5250 10.7720 10.7720 10.8300 10.8300 11.1642 11.1642 11.3936 11.3936 11.7021 11.7021 12.1646 12.1646 12.5703 12.5703 12.8667 12.8667 13.2149 13.2149 13.3632 13.3632 13.7524 13.7524 k = 0.3884 0.2242 0.5686 ( 3318 PWs) bands (ev): 6.6474 6.6474 7.1919 7.1919 8.0474 8.0474 8.3953 8.3953 8.6711 8.6711 8.9753 8.9753 9.2549 9.2549 9.3429 9.3429 9.3844 9.3844 9.4268 9.4268 9.6351 9.6351 9.6776 9.6776 9.7395 9.7395 9.8537 9.8537 10.0726 10.0726 10.2362 10.2362 10.4035 10.4035 10.4995 10.4995 10.7697 10.7697 10.8303 10.8303 11.1621 11.1621 11.3765 11.3765 11.7045 11.7045 12.1380 12.1380 12.5827 12.5827 12.8936 12.8936 13.2503 13.2503 13.3734 13.3734 13.7306 13.7306 k = 0.3839 0.2217 0.5832 ( 3319 PWs) bands (ev): 6.6748 6.6748 7.1719 7.1719 8.0651 8.0651 8.3985 8.3985 8.7006 8.7006 8.9734 8.9734 9.2488 9.2488 9.3531 9.3531 9.3748 9.3748 9.4124 9.4124 9.6385 9.6385 9.6736 9.6736 9.7409 9.7409 9.8415 9.8415 10.0789 10.0789 10.2489 10.2489 10.3689 10.3689 10.4751 10.4751 10.7706 10.7706 10.8332 10.8332 11.1595 11.1595 11.3614 11.3614 11.7074 11.7074 12.1124 12.1124 12.5941 12.5941 12.9180 12.9180 13.2837 13.2837 13.3842 13.3842 13.7045 13.7045 k = 0.3795 0.2191 0.5978 ( 3314 PWs) bands (ev): 6.6983 6.6983 7.1495 7.1495 8.0858 8.0858 8.4013 8.4013 8.7298 8.7298 8.9731 8.9731 9.2406 9.2406 9.3643 9.3643 9.3675 9.3675 9.3987 9.3987 9.6412 9.6412 9.6707 9.6707 9.7430 9.7430 9.8288 9.8288 10.0829 10.0829 10.2582 10.2582 10.3376 10.3376 10.4527 10.4527 10.7744 10.7744 10.8381 10.8381 11.1563 11.1563 11.3483 11.3483 11.7103 11.7103 12.0880 12.0880 12.6045 12.6045 12.9397 12.9397 13.3119 13.3119 13.3982 13.3982 13.6750 13.6750 k = 0.3750 0.2165 0.6124 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7583 8.7583 8.9747 8.9747 9.2314 9.2314 9.3553 9.3553 9.3771 9.3771 9.3910 9.3910 9.6431 9.6431 9.6692 9.6692 9.7459 9.7459 9.8156 9.8156 10.0837 10.0837 10.2561 10.2561 10.3177 10.3177 10.4335 10.4335 10.7809 10.7809 10.8448 10.8448 11.1523 11.1523 11.3371 11.3371 11.7126 11.7126 12.0649 12.0649 12.6138 12.6138 12.9588 12.9588 13.3312 13.3312 13.4185 13.4185 13.6430 13.6430 k = 0.6250-0.0722 0.4082 ( 3322 PWs) bands (ev): 6.7156 6.7156 7.1270 7.1270 8.1089 8.1089 8.4041 8.4041 8.7584 8.7584 8.9745 8.9745 9.2316 9.2316 9.3555 9.3555 9.3772 9.3772 9.3909 9.3909 9.6431 9.6431 9.6692 9.6692 9.7458 9.7458 9.8156 9.8156 10.0838 10.0838 10.2562 10.2562 10.3178 10.3178 10.4334 10.4334 10.7809 10.7809 10.8448 10.8448 11.1521 11.1521 11.3371 11.3371 11.7126 11.7126 12.0650 12.0650 12.6137 12.6137 12.9588 12.9588 13.3311 13.3311 13.4184 13.4184 13.6430 13.6430 k = 0.6176-0.0849 0.4082 ( 3306 PWs) bands (ev): 6.7355 6.7355 7.0925 7.0925 8.1489 8.1489 8.4096 8.4096 8.8051 8.8051 8.9793 8.9793 9.2166 9.2166 9.3406 9.3406 9.3744 9.3744 9.3996 9.3996 9.6456 9.6456 9.6682 9.6682 9.7507 9.7507 9.7944 9.7944 10.0814 10.0814 10.2374 10.2374 10.3010 10.3010 10.4051 10.4051 10.7940 10.7940 10.8579 10.8579 11.1448 11.1448 11.3205 11.3205 11.7152 11.7152 12.0284 12.0284 12.6292 12.6292 12.9873 12.9873 13.3538 13.3538 13.4576 13.4576 13.5919 13.5919 k = 0.6103-0.0976 0.4082 ( 3316 PWs) bands (ev): 6.7518 6.7518 7.0596 7.0596 8.1897 8.1897 8.4162 8.4162 8.8523 8.8523 8.9851 8.9851 9.2023 9.2023 9.3265 9.3265 9.3710 9.3710 9.4082 9.4082 9.6470 9.6470 9.6671 9.6671 9.7545 9.7545 9.7750 9.7750 10.0771 10.0771 10.2199 10.2199 10.2830 10.2830 10.3773 10.3773 10.8080 10.8080 10.8720 10.8720 11.1375 11.1375 11.3039 11.3039 11.7167 11.7167 11.9925 11.9925 12.6460 12.6460 13.0134 13.0134 13.3751 13.3751 13.4943 13.4943 13.5496 13.5496 k = 0.6029-0.1104 0.4082 ( 3314 PWs) bands (ev): 6.7650 6.7650 7.0283 7.0283 8.2306 8.2306 8.4239 8.4239 8.8997 8.8997 8.9922 8.9922 9.1888 9.1888 9.3133 9.3133 9.3667 9.3667 9.4166 9.4166 9.6477 9.6477 9.6661 9.6661 9.7561 9.7561 9.7589 9.7589 10.0713 10.0713 10.2039 10.2039 10.2637 10.2637 10.3501 10.3501 10.8227 10.8227 10.8874 10.8874 11.1303 11.1303 11.2876 11.2876 11.7175 11.7175 11.9576 11.9576 12.6642 12.6642 13.0354 13.0354 13.3951 13.3951 13.5017 13.5017 13.5445 13.5445 k = 0.5956-0.1231 0.4082 ( 3318 PWs) bands (ev): 6.7754 6.7754 6.9988 6.9988 8.2707 8.2707 8.4326 8.4326 8.9460 8.9460 9.0017 9.0017 9.1763 9.1763 9.3012 9.3012 9.3608 9.3608 9.4245 9.4245 9.6477 9.6477 9.6652 9.6652 9.7423 9.7423 9.7596 9.7596 10.0643 10.0643 10.1893 10.1893 10.2432 10.2432 10.3236 10.3236 10.8378 10.8378 10.9037 10.9037 11.1233 11.1233 11.2714 11.2714 11.7175 11.7175 11.9240 11.9240 12.6837 12.6837 13.0511 13.0511 13.4136 13.4136 13.4794 13.4794 13.5789 13.5789 k = 0.5882-0.1358 0.4082 ( 3326 PWs) bands (ev): 6.7835 6.7835 6.9712 6.9712 8.3094 8.3094 8.4422 8.4422 8.9856 8.9856 9.0190 9.0190 9.1649 9.1649 9.2901 9.2901 9.3532 9.3532 9.4318 9.4318 9.6474 9.6474 9.6643 9.6643 9.7297 9.7297 9.7606 9.7606 10.0564 10.0564 10.1762 10.1762 10.2214 10.2214 10.2981 10.2981 10.8532 10.8532 10.9207 10.9207 11.1166 11.1166 11.2555 11.2555 11.7168 11.7168 11.8920 11.8920 12.7044 12.7044 13.0587 13.0587 13.4300 13.4300 13.4667 13.4667 13.6156 13.6156 k = 0.5809-0.1486 0.4082 ( 3326 PWs) bands (ev): 6.7898 6.7898 6.9455 6.9455 8.3459 8.3459 8.4525 8.4525 9.0071 9.0071 9.0550 9.0550 9.1549 9.1549 9.2800 9.2800 9.3437 9.3437 9.4385 9.4385 9.6472 9.6472 9.6637 9.6637 9.7196 9.7196 9.7608 9.7608 10.0477 10.0477 10.1645 10.1645 10.1985 10.1985 10.2735 10.2735 10.8687 10.8687 10.9380 10.9380 11.1102 11.1102 11.2399 11.2399 11.7156 11.7156 11.8618 11.8618 12.7260 12.7260 13.0573 13.0573 13.4433 13.4433 13.4677 13.4677 13.6516 13.6516 k = 0.5735-0.1613 0.4082 ( 3326 PWs) bands (ev): 6.7946 6.7946 6.9218 6.9218 8.3798 8.3798 8.4633 8.4633 9.0200 9.0200 9.0984 9.0984 9.1474 9.1474 9.2711 9.2711 9.3324 9.3324 9.4445 9.4445 9.6475 9.6475 9.6634 9.6634 9.7116 9.7116 9.7601 9.7601 10.0385 10.0385 10.1541 10.1541 10.1747 10.1747 10.2501 10.2501 10.8841 10.8841 10.9553 10.9553 11.1043 11.1043 11.2246 11.2246 11.7138 11.7138 11.8337 11.8337 12.7484 12.7484 13.0480 13.0480 13.4562 13.4562 13.4792 13.4792 13.6862 13.6862 k = 0.5662-0.1741 0.4082 ( 3320 PWs) bands (ev): 6.7981 6.7981 6.9002 6.9002 8.4106 8.4106 8.4745 8.4745 9.0317 9.0317 9.1272 9.1272 9.1565 9.1565 9.2636 9.2636 9.3196 9.3196 9.4496 9.4496 9.6485 9.6485 9.6638 9.6638 9.7054 9.7054 9.7584 9.7584 10.0291 10.0291 10.1439 10.1439 10.1514 10.1514 10.2279 10.2279 10.8996 10.8996 10.9721 10.9721 11.0992 11.0992 11.2096 11.2096 11.7117 11.7117 11.8078 11.8078 12.7713 12.7713 13.0329 13.0329 13.4727 13.4727 13.4948 13.4948 13.7190 13.7190 k = 0.5588-0.1868 0.4082 ( 3316 PWs) bands (ev): 6.8006 6.8006 6.8807 6.8807 8.4381 8.4381 8.4857 8.4857 9.0431 9.0431 9.1255 9.1255 9.1952 9.1952 9.2586 9.2586 9.3057 9.3057 9.4538 9.4538 9.6503 9.6503 9.6649 9.6649 9.7008 9.7008 9.7558 9.7558 10.0195 10.0195 10.1232 10.1232 10.1392 10.1392 10.2071 10.2071 10.9150 10.9150 10.9880 10.9880 11.0949 11.0949 11.1950 11.1950 11.7092 11.7092 11.7842 11.7842 12.7944 12.7944 13.0145 13.0145 13.4924 13.4925 13.5121 13.5121 13.7496 13.7496 k = 0.5515-0.1995 0.4082 ( 3320 PWs) bands (ev): 6.8025 6.8025 6.8634 6.8634 8.4622 8.4622 8.4968 8.4968 9.0541 9.0541 9.1204 9.1204 9.2279 9.2279 9.2629 9.2629 9.2920 9.2920 9.4569 9.4569 9.6528 9.6528 9.6669 9.6669 9.6975 9.6975 9.7520 9.7520 10.0100 10.0100 10.0982 10.0982 10.1326 10.1326 10.1878 10.1878 10.9301 10.9301 11.0023 11.0023 11.0916 11.0916 11.1808 11.1808 11.7064 11.7064 11.7632 11.7632 12.8170 12.8170 12.9949 12.9949 13.5133 13.5133 13.5310 13.5310 13.7777 13.7777 k = 0.5441-0.2123 0.4082 ( 3320 PWs) bands (ev): 6.8037 6.8037 6.8483 6.8483 8.4828 8.4828 8.5075 8.5075 9.0646 9.0646 9.1157 9.1157 9.2348 9.2348 9.2729 9.2729 9.2981 9.2981 9.4590 9.4590 9.6556 9.6556 9.6699 9.6699 9.6954 9.6954 9.7471 9.7471 10.0009 10.0009 10.0733 10.0733 10.1275 10.1275 10.1704 10.1704 10.9451 10.9451 11.0142 11.0142 11.0900 11.0900 11.1672 11.1672 11.7036 11.7036 11.7448 11.7448 12.8388 12.8388 12.9757 12.9757 13.5336 13.5336 13.5511 13.5511 13.8029 13.8029 k = 0.5368-0.2250 0.4082 ( 3320 PWs) bands (ev): 6.8045 6.8045 6.8355 6.8355 8.4999 8.4999 8.5172 8.5172 9.0741 9.0741 9.1121 9.1121 9.2327 9.2327 9.2607 9.2607 9.3347 9.3347 9.4602 9.4602 9.6586 9.6586 9.6737 9.6737 9.6944 9.6944 9.7408 9.7408 9.9925 9.9925 10.0496 10.0496 10.1233 10.1233 10.1549 10.1549 10.9596 10.9596 11.0231 11.0231 11.0902 11.0902 11.1543 11.1543 11.7008 11.7008 11.7291 11.7291 12.8591 12.8591 12.9582 12.9582 13.5531 13.5531 13.5713 13.5713 13.8249 13.8249 k = 0.5294-0.2377 0.4082 ( 3320 PWs) bands (ev): 6.8050 6.8050 6.8250 6.8250 8.5138 8.5138 8.5258 8.5258 9.0822 9.0822 9.1093 9.1093 9.2297 9.2297 9.2486 9.2486 9.3709 9.3709 9.4607 9.4607 9.6618 9.6618 9.6779 9.6779 9.6943 9.6943 9.7331 9.7331 9.9852 9.9852 10.0279 10.0279 10.1201 10.1201 10.1418 10.1418 10.9735 10.9735 11.0284 11.0284 11.0923 11.0923 11.1422 11.1422 11.6981 11.6981 11.7162 11.7162 12.8772 12.8772 12.9430 12.9430 13.5723 13.5723 13.5900 13.5900 13.8435 13.8435 k = 0.5221-0.2505 0.4082 ( 3320 PWs) bands (ev): 6.8053 6.8053 6.8167 6.8167 8.5246 8.5246 8.5327 8.5327 9.0889 9.0889 9.1072 9.1072 9.2272 9.2272 9.2384 9.2384 9.4027 9.4027 9.4606 9.4606 9.6656 9.6656 9.6817 9.6817 9.6948 9.6948 9.7242 9.7242 9.9794 9.9794 10.0091 10.0091 10.1178 10.1178 10.1311 10.1311 10.9867 10.9867 11.0301 11.0301 11.0959 11.0959 11.1314 11.1314 11.6959 11.6959 11.7060 11.7060 12.8923 12.8923 12.9307 12.9307 13.5909 13.5909 13.6057 13.6057 13.8582 13.8582 k = 0.5147-0.2632 0.4082 ( 3314 PWs) bands (ev): 6.8055 6.8055 6.8109 6.8109 8.5325 8.5325 8.5376 8.5376 9.0942 9.0942 9.1054 9.1054 9.2253 9.2253 9.2307 9.2307 9.4281 9.4281 9.4600 9.4600 9.6703 9.6703 9.6845 9.6845 9.6959 9.6959 9.7145 9.7145 9.9756 9.9756 9.9941 9.9941 10.1162 10.1162 10.1232 10.1232 10.9988 10.9988 11.0288 11.0288 11.1001 11.1001 11.1222 11.1222 11.6942 11.6942 11.6988 11.6988 12.9037 12.9037 12.9217 12.9217 13.6078 13.6078 13.6175 13.6175 13.8689 13.8689 k = 0.5074-0.2759 0.4082 ( 3306 PWs) bands (ev): 6.8056 6.8056 6.8073 6.8073 8.5377 8.5377 8.5401 8.5401 9.0982 9.0982 9.1036 9.1036 9.2241 9.2241 9.2259 9.2259 9.4456 9.4456 9.4586 9.4586 9.6761 9.6761 9.6851 9.6851 9.6973 9.6973 9.7057 9.7057 9.9746 9.9746 9.9834 9.9834 10.1155 10.1155 10.1183 10.1183 11.0094 11.0094 11.0248 11.0248 11.1045 11.1045 11.1149 11.1149 11.6931 11.6931 11.6944 11.6944 12.9109 12.9109 12.9162 12.9162 13.6206 13.6206 13.6246 13.6246 13.8754 13.8754 k = 0.5000-0.2887 0.4082 ( 3306 PWs) bands (ev): 6.8058 6.8058 6.8059 6.8059 8.5402 8.5402 8.5403 8.5403 9.1011 9.1011 9.1014 9.1014 9.2239 9.2239 9.2242 9.2242 9.4548 9.4548 9.4550 9.4550 9.6818 9.6818 9.6821 9.6821 9.6997 9.6997 9.7000 9.7000 9.9769 9.9769 9.9771 9.9771 10.1157 10.1157 10.1161 10.1161 11.0180 11.0180 11.0184 11.0184 11.1090 11.1090 11.1093 11.1093 11.6927 11.6927 11.6929 11.6929 12.9138 12.9138 12.9139 12.9139 13.6262 13.6262 13.6264 13.6264 13.8776 13.8776 Writing output data file ZrNi2.save init_run : 0.12s CPU 0.24s WALL ( 1 calls) electrons : 210.10s CPU 213.02s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 210.09s CPU 213.01s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.04s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.04s WALL ( 308 calls) cegterg : 187.85s CPU 190.22s WALL ( 491 calls) Called by sum_band: Called by *egterg: h_psi : 119.64s CPU 121.54s WALL ( 8329 calls) s_psi : 6.93s CPU 6.87s WALL ( 8329 calls) g_psi : 0.18s CPU 0.23s WALL ( 7530 calls) cdiaghg : 62.66s CPU 63.57s WALL ( 7838 calls) cegterg:over : 6.35s CPU 6.45s WALL ( 7530 calls) cegterg:upda : 5.16s CPU 5.00s WALL ( 7530 calls) cegterg:last : 3.24s CPU 3.27s WALL ( 1387 calls) cdiaghg:chol : 3.40s CPU 3.54s WALL ( 7838 calls) cdiaghg:inve : 2.42s CPU 2.48s WALL ( 7838 calls) cdiaghg:para : 3.98s CPU 4.03s WALL ( 15676 calls) Called by h_psi: h_psi:vloc : 103.90s CPU 105.61s WALL ( 8329 calls) h_psi:vnl : 15.45s CPU 15.69s WALL ( 8329 calls) add_vuspsi : 8.33s CPU 8.56s WALL ( 8329 calls) General routines calbec : 7.10s CPU 7.10s WALL ( 8329 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 98.70s CPU 100.34s WALL ( 1001024 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.13s CPU 0.20s WALL ( 616 calls) Parallel routines fft_scatter : 30.25s CPU 30.67s WALL ( 1001047 calls) PWSCF : 3m44.43s CPU 3m58.96s WALL This run was terminated on: 20:34:58 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=