Program PWSCF v.5.1.1 starts on 13Jun2016 at 6:11: 8 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./MgCN2.save/ file Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2P 2P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 50 30 8 1150 541 84 Max 51 31 9 1152 556 88 Sum 2415 1465 425 55217 26275 4163 bravais-lattice index = 14 lattice parameter (alat) = 9.0118 a.u. unit-cell volume = 431.0095 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 59.0000 Ry charge density cutoff = 386.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.011836 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.628615 celldm(5)= -0.628615 celldm(6)= 0.257229 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.257229 0.966350 0.000000 ) a(3) = ( -0.628615 -0.483175 0.609414 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.266186 0.820460 ) b(2) = ( 0.000000 1.034821 0.820460 ) b(3) = ( 0.000000 0.000000 1.640921 ) PseudoPot. # 1 for Mg read from file: /home/autes/Pseudo/Mg.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 99618f2d1dea131ec68d28ce241ef835 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 1129 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for C read from file: /home/autes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Mg 10.00 24.30500 Mg( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 1.00) 2 Sym. Ops. (no inversion) found ( 1 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( 1 0 0 ) f =( 0.2500000 ) ( 0 1 0 ) ( -0.2500000 ) ( -1 -1 -1 ) ( 0.5000000 ) cart. s( 2) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( -0.1286146 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.4831752 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3047070 ) double point group C_s (m) there are 4 classes and 2 irreducible representations the character table: E -E s -s G_3 1.00 -1.00 0.00 0.00 G_4 1.00 -1.00 0.00 0.00 imaginary part E -E s -s G_3 0.00 0.00 1.00 -1.00 G_4 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 s 2 -E -1 -s -2 Cartesian axes number of k points= 378 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 2) = ( 0.0000000 0.0000000 0.0149175), wk = 0.0026455 k( 3) = ( 0.0000000 0.0000000 0.0298349), wk = 0.0026455 k( 4) = ( 0.0000000 0.0000000 0.0447524), wk = 0.0026455 k( 5) = ( 0.0000000 0.0000000 0.0596699), wk = 0.0026455 k( 6) = ( 0.0000000 0.0000000 0.0745873), wk = 0.0026455 k( 7) = ( 0.0000000 0.0000000 0.0895048), wk = 0.0026455 k( 8) = ( 0.0000000 0.0000000 0.1044222), wk = 0.0026455 k( 9) = ( 0.0000000 0.0000000 0.1193397), wk = 0.0026455 k( 10) = ( 0.0000000 0.0000000 0.1342571), wk = 0.0026455 k( 11) = ( 0.0000000 0.0000000 0.1491746), wk = 0.0026455 k( 12) = ( 0.0000000 0.0000000 0.1640921), wk = 0.0026455 k( 13) = ( 0.0000000 0.0000000 0.1790095), wk = 0.0026455 k( 14) = ( 0.0000000 0.0000000 0.1939270), wk = 0.0026455 k( 15) = ( 0.0000000 0.0000000 0.2088445), wk = 0.0026455 k( 16) = ( 0.0000000 0.0000000 0.2237619), wk = 0.0026455 k( 17) = ( 0.0000000 0.0000000 0.2386794), wk = 0.0026455 k( 18) = ( 0.0000000 0.0000000 0.2535968), wk = 0.0026455 k( 19) = ( 0.0000000 0.0000000 0.2685143), wk = 0.0026455 k( 20) = ( 0.0000000 0.0000000 0.2834318), wk = 0.0026455 k( 21) = ( 0.0000000 0.0000000 0.2983492), wk = 0.0026455 k( 22) = ( 0.0000000 0.0000000 0.3132667), wk = 0.0026455 k( 23) = ( 0.0000000 0.0000000 0.3281842), wk = 0.0026455 k( 24) = ( 0.0000000 0.0000000 0.3431016), wk = 0.0026455 k( 25) = ( 0.0000000 0.0000000 0.3580191), wk = 0.0026455 k( 26) = ( 0.0000000 0.0000000 0.3729365), wk = 0.0026455 k( 27) = ( 0.0000000 0.0000000 0.3878540), wk = 0.0026455 k( 28) = ( 0.0000000 0.0000000 0.4027715), wk = 0.0026455 k( 29) = ( 0.0000000 0.0000000 0.4176889), wk = 0.0026455 k( 30) = ( 0.0000000 0.0000000 0.4326064), wk = 0.0026455 k( 31) = ( 0.0000000 0.0000000 0.4475238), wk = 0.0026455 k( 32) = ( 0.0000000 0.0000000 0.4624413), wk = 0.0026455 k( 33) = ( 0.0000000 0.0000000 0.4773588), wk = 0.0026455 k( 34) = ( 0.0000000 0.0000000 0.4922762), wk = 0.0026455 k( 35) = ( 0.0000000 0.0000000 0.5071937), wk = 0.0026455 k( 36) = ( 0.0000000 0.0000000 0.5221112), wk = 0.0026455 k( 37) = ( 0.0000000 0.0000000 0.5370286), wk = 0.0026455 k( 38) = ( 0.0000000 0.0000000 0.5519461), wk = 0.0026455 k( 39) = ( 0.0000000 0.0000000 0.5668635), wk = 0.0026455 k( 40) = ( 0.0000000 0.0000000 0.5817810), wk = 0.0026455 k( 41) = ( 0.0000000 0.0000000 0.5966985), wk = 0.0026455 k( 42) = ( 0.0000000 0.0000000 0.6116159), wk = 0.0026455 k( 43) = ( 0.0000000 0.0000000 0.6265334), wk = 0.0026455 k( 44) = ( 0.0000000 0.0000000 0.6414508), wk = 0.0026455 k( 45) = ( 0.0000000 0.0000000 0.6563683), wk = 0.0026455 k( 46) = ( 0.0000000 0.0000000 0.6712858), wk = 0.0026455 k( 47) = ( 0.0000000 0.0000000 0.6862032), wk = 0.0026455 k( 48) = ( 0.0000000 0.0000000 0.7011207), wk = 0.0026455 k( 49) = ( 0.0000000 0.0000000 0.7160382), wk = 0.0026455 k( 50) = ( 0.0000000 0.0000000 0.7309556), wk = 0.0026455 k( 51) = ( 0.0000000 0.0000000 0.7458731), wk = 0.0026455 k( 52) = ( 0.0000000 0.0000000 0.7607905), wk = 0.0026455 k( 53) = ( 0.0000000 0.0000000 0.7757080), wk = 0.0026455 k( 54) = ( 0.0000000 0.0000000 0.7906255), wk = 0.0026455 k( 55) = ( 0.0000000 0.0000000 0.8055429), wk = 0.0026455 k( 56) = ( 0.0000000 0.0000000 0.8204604), wk = 0.0026455 k( 57) = ( 0.0000000 0.0000000 0.8204604), wk = 0.0026455 k( 58) = ( -0.0092312 0.0120099 0.8204604), wk = 0.0026455 k( 59) = ( -0.0184625 0.0240198 0.8204604), wk = 0.0026455 k( 60) = ( -0.0276937 0.0360298 0.8204604), wk = 0.0026455 k( 61) = ( -0.0369250 0.0480397 0.8204604), wk = 0.0026455 k( 62) = ( -0.0461562 0.0600496 0.8204604), wk = 0.0026455 k( 63) = ( -0.0553875 0.0720595 0.8204604), wk = 0.0026455 k( 64) = ( -0.0646187 0.0840694 0.8204604), wk = 0.0026455 k( 65) = ( -0.0738500 0.0960794 0.8204604), wk = 0.0026455 k( 66) = ( -0.0830812 0.1080893 0.8204604), wk = 0.0026455 k( 67) = ( -0.0923125 0.1200992 0.8204604), wk = 0.0026455 k( 68) = ( -0.1015437 0.1321091 0.8204604), wk = 0.0026455 k( 69) = ( -0.1107749 0.1441191 0.8204604), wk = 0.0026455 k( 70) = ( -0.1200062 0.1561290 0.8204604), wk = 0.0026455 k( 71) = ( -0.1292374 0.1681389 0.8204604), wk = 0.0026455 k( 72) = ( -0.1384687 0.1801488 0.8204604), wk = 0.0026455 k( 73) = ( -0.1476999 0.1921587 0.8204604), wk = 0.0026455 k( 74) = ( -0.1476999 0.1921587 0.8204604), wk = 0.0026455 k( 75) = ( -0.1542240 0.2006466 0.8097549), wk = 0.0026455 k( 76) = ( -0.1607481 0.2091345 0.7990494), wk = 0.0026455 k( 77) = ( -0.1672722 0.2176224 0.7883439), wk = 0.0026455 k( 78) = ( -0.1737962 0.2261102 0.7776384), wk = 0.0026455 k( 79) = ( -0.1803203 0.2345981 0.7669329), wk = 0.0026455 k( 80) = ( -0.1868444 0.2430860 0.7562274), wk = 0.0026455 k( 81) = ( -0.1933685 0.2515738 0.7455219), wk = 0.0026455 k( 82) = ( -0.1998925 0.2600617 0.7348165), wk = 0.0026455 k( 83) = ( -0.2064166 0.2685496 0.7241110), wk = 0.0026455 k( 84) = ( -0.2129407 0.2770375 0.7134055), wk = 0.0026455 k( 85) = ( -0.2194648 0.2855253 0.7027000), wk = 0.0026455 k( 86) = ( -0.2259888 0.2940132 0.6919945), wk = 0.0026455 k( 87) = ( -0.2325129 0.3025011 0.6812890), wk = 0.0026455 k( 88) = ( -0.2390370 0.3109890 0.6705835), wk = 0.0026455 k( 89) = ( -0.2455611 0.3194768 0.6598780), wk = 0.0026455 k( 90) = ( -0.2520851 0.3279647 0.6491725), wk = 0.0026455 k( 91) = ( -0.2586092 0.3364526 0.6384670), wk = 0.0026455 k( 92) = ( -0.2651333 0.3449404 0.6277615), wk = 0.0026455 k( 93) = ( -0.2716574 0.3534283 0.6170561), wk = 0.0026455 k( 94) = ( -0.2781814 0.3619162 0.6063506), wk = 0.0026455 k( 95) = ( -0.2847055 0.3704041 0.5956451), wk = 0.0026455 k( 96) = ( -0.2912296 0.3788919 0.5849396), wk = 0.0026455 k( 97) = ( -0.2977537 0.3873798 0.5742341), wk = 0.0026455 k( 98) = ( -0.3042777 0.3958677 0.5635286), wk = 0.0026455 k( 99) = ( -0.3108018 0.4043555 0.5528231), wk = 0.0026455 k( 100) = ( -0.3173259 0.4128434 0.5421176), wk = 0.0026455 k( 101) = ( -0.3238500 0.4213313 0.5314121), wk = 0.0026455 k( 102) = ( -0.3238500 0.4213313 0.5314121), wk = 0.0026455 k( 103) = ( -0.3173730 0.4129047 0.5207839), wk = 0.0026455 k( 104) = ( -0.3108960 0.4044780 0.5101557), wk = 0.0026455 k( 105) = ( -0.3044190 0.3960514 0.4995274), wk = 0.0026455 k( 106) = ( -0.2979420 0.3876248 0.4888992), wk = 0.0026455 k( 107) = ( -0.2914650 0.3791982 0.4782709), wk = 0.0026455 k( 108) = ( -0.2849880 0.3707715 0.4676427), wk = 0.0026455 k( 109) = ( -0.2785110 0.3623449 0.4570144), wk = 0.0026455 k( 110) = ( -0.2720340 0.3539183 0.4463862), wk = 0.0026455 k( 111) = ( -0.2655570 0.3454917 0.4357579), wk = 0.0026455 k( 112) = ( -0.2590800 0.3370650 0.4251297), wk = 0.0026455 k( 113) = ( -0.2526030 0.3286384 0.4145015), wk = 0.0026455 k( 114) = ( -0.2461260 0.3202118 0.4038732), wk = 0.0026455 k( 115) = ( -0.2396490 0.3117852 0.3932450), wk = 0.0026455 k( 116) = ( -0.2331720 0.3033585 0.3826167), wk = 0.0026455 k( 117) = ( -0.2266950 0.2949319 0.3719885), wk = 0.0026455 k( 118) = ( -0.2202180 0.2865053 0.3613603), wk = 0.0026455 k( 119) = ( -0.2137410 0.2780787 0.3507320), wk = 0.0026455 k( 120) = ( -0.2072640 0.2696520 0.3401038), wk = 0.0026455 k( 121) = ( -0.2007870 0.2612254 0.3294755), wk = 0.0026455 k( 122) = ( -0.1943100 0.2527988 0.3188473), wk = 0.0026455 k( 123) = ( -0.1878330 0.2443721 0.3082190), wk = 0.0026455 k( 124) = ( -0.1813560 0.2359455 0.2975908), wk = 0.0026455 k( 125) = ( -0.1748790 0.2275189 0.2869625), wk = 0.0026455 k( 126) = ( -0.1684020 0.2190923 0.2763343), wk = 0.0026455 k( 127) = ( -0.1619250 0.2106656 0.2657061), wk = 0.0026455 k( 128) = ( -0.1554480 0.2022390 0.2550778), wk = 0.0026455 k( 129) = ( -0.1489710 0.1938124 0.2444496), wk = 0.0026455 k( 130) = ( -0.1424940 0.1853858 0.2338213), wk = 0.0026455 k( 131) = ( -0.1360170 0.1769591 0.2231931), wk = 0.0026455 k( 132) = ( -0.1295400 0.1685325 0.2125649), wk = 0.0026455 k( 133) = ( -0.1230630 0.1601059 0.2019366), wk = 0.0026455 k( 134) = ( -0.1165860 0.1516793 0.1913084), wk = 0.0026455 k( 135) = ( -0.1101090 0.1432526 0.1806801), wk = 0.0026455 k( 136) = ( -0.1036320 0.1348260 0.1700519), wk = 0.0026455 k( 137) = ( -0.0971550 0.1263994 0.1594236), wk = 0.0026455 k( 138) = ( -0.0906780 0.1179728 0.1487954), wk = 0.0026455 k( 139) = ( -0.0842010 0.1095461 0.1381672), wk = 0.0026455 k( 140) = ( -0.0777240 0.1011195 0.1275389), wk = 0.0026455 k( 141) = ( -0.0712470 0.0926929 0.1169107), wk = 0.0026455 k( 142) = ( -0.0647700 0.0842663 0.1062824), wk = 0.0026455 k( 143) = ( -0.0582930 0.0758396 0.0956542), wk = 0.0026455 k( 144) = ( -0.0518160 0.0674130 0.0850259), wk = 0.0026455 k( 145) = ( -0.0453390 0.0589864 0.0743977), wk = 0.0026455 k( 146) = ( -0.0388620 0.0505598 0.0637695), wk = 0.0026455 k( 147) = ( -0.0323850 0.0421331 0.0531412), wk = 0.0026455 k( 148) = ( -0.0259080 0.0337065 0.0425130), wk = 0.0026455 k( 149) = ( -0.0194310 0.0252799 0.0318847), wk = 0.0026455 k( 150) = ( -0.0129540 0.0168533 0.0212565), wk = 0.0026455 k( 151) = ( -0.0064770 0.0084266 0.0106282), wk = 0.0026455 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 154) = ( 0.0119048 0.0091504 -0.0000000), wk = 0.0026455 k( 155) = ( 0.0238095 0.0183008 -0.0000000), wk = 0.0026455 k( 156) = ( 0.0357143 0.0274513 -0.0000000), wk = 0.0026455 k( 157) = ( 0.0476191 0.0366017 -0.0000000), wk = 0.0026455 k( 158) = ( 0.0595238 0.0457521 -0.0000000), wk = 0.0026455 k( 159) = ( 0.0714286 0.0549025 -0.0000000), wk = 0.0026455 k( 160) = ( 0.0833333 0.0640529 -0.0000000), wk = 0.0026455 k( 161) = ( 0.0952381 0.0732033 -0.0000000), wk = 0.0026455 k( 162) = ( 0.1071429 0.0823538 -0.0000000), wk = 0.0026455 k( 163) = ( 0.1190476 0.0915042 -0.0000000), wk = 0.0026455 k( 164) = ( 0.1309524 0.1006546 -0.0000000), wk = 0.0026455 k( 165) = ( 0.1428571 0.1098050 -0.0000000), wk = 0.0026455 k( 166) = ( 0.1547619 0.1189554 -0.0000000), wk = 0.0026455 k( 167) = ( 0.1666667 0.1281058 -0.0000000), wk = 0.0026455 k( 168) = ( 0.1785714 0.1372562 -0.0000000), wk = 0.0026455 k( 169) = ( 0.1904762 0.1464067 -0.0000000), wk = 0.0026455 k( 170) = ( 0.2023810 0.1555571 -0.0000000), wk = 0.0026455 k( 171) = ( 0.2142857 0.1647075 -0.0000000), wk = 0.0026455 k( 172) = ( 0.2261905 0.1738579 -0.0000000), wk = 0.0026455 k( 173) = ( 0.2380952 0.1830083 -0.0000000), wk = 0.0026455 k( 174) = ( 0.2500000 0.1921587 -0.0000000), wk = 0.0026455 k( 175) = ( 0.2619048 0.2013092 -0.0000000), wk = 0.0026455 k( 176) = ( 0.2738095 0.2104596 -0.0000000), wk = 0.0026455 k( 177) = ( 0.2857143 0.2196100 -0.0000000), wk = 0.0026455 k( 178) = ( 0.2976190 0.2287604 -0.0000000), wk = 0.0026455 k( 179) = ( 0.3095238 0.2379108 -0.0000000), wk = 0.0026455 k( 180) = ( 0.3214286 0.2470612 -0.0000000), wk = 0.0026455 k( 181) = ( 0.3333333 0.2562117 -0.0000000), wk = 0.0026455 k( 182) = ( 0.3452381 0.2653621 -0.0000000), wk = 0.0026455 k( 183) = ( 0.3571429 0.2745125 -0.0000000), wk = 0.0026455 k( 184) = ( 0.3690476 0.2836629 -0.0000000), wk = 0.0026455 k( 185) = ( 0.3809524 0.2928133 -0.0000000), wk = 0.0026455 k( 186) = ( 0.3928571 0.3019637 -0.0000000), wk = 0.0026455 k( 187) = ( 0.4047619 0.3111142 -0.0000000), wk = 0.0026455 k( 188) = ( 0.4166667 0.3202646 -0.0000000), wk = 0.0026455 k( 189) = ( 0.4285714 0.3294150 -0.0000000), wk = 0.0026455 k( 190) = ( 0.4404762 0.3385654 -0.0000000), wk = 0.0026455 k( 191) = ( 0.4523810 0.3477158 -0.0000000), wk = 0.0026455 k( 192) = ( 0.4642857 0.3568662 -0.0000000), wk = 0.0026455 k( 193) = ( 0.4761905 0.3660167 -0.0000000), wk = 0.0026455 k( 194) = ( 0.4880952 0.3751671 -0.0000000), wk = 0.0026455 k( 195) = ( 0.5000000 0.3843175 -0.0000000), wk = 0.0026455 k( 196) = ( 0.5000000 0.3843175 -0.0000000), wk = 0.0026455 k( 197) = ( 0.4934759 0.3928054 0.0107055), wk = 0.0026455 k( 198) = ( 0.4869519 0.4012932 0.0214110), wk = 0.0026455 k( 199) = ( 0.4804278 0.4097811 0.0321165), wk = 0.0026455 k( 200) = ( 0.4739037 0.4182690 0.0428220), wk = 0.0026455 k( 201) = ( 0.4673796 0.4267569 0.0535275), wk = 0.0026455 k( 202) = ( 0.4608556 0.4352447 0.0642329), wk = 0.0026455 k( 203) = ( 0.4543315 0.4437326 0.0749384), wk = 0.0026455 k( 204) = ( 0.4478074 0.4522205 0.0856439), wk = 0.0026455 k( 205) = ( 0.4412833 0.4607083 0.0963494), wk = 0.0026455 k( 206) = ( 0.4347592 0.4691962 0.1070549), wk = 0.0026455 k( 207) = ( 0.4282352 0.4776841 0.1177604), wk = 0.0026455 k( 208) = ( 0.4217111 0.4861720 0.1284659), wk = 0.0026455 k( 209) = ( 0.4151870 0.4946598 0.1391714), wk = 0.0026455 k( 210) = ( 0.4086630 0.5031477 0.1498769), wk = 0.0026455 k( 211) = ( 0.4021389 0.5116356 0.1605824), wk = 0.0026455 k( 212) = ( 0.3956148 0.5201234 0.1712878), wk = 0.0026455 k( 213) = ( 0.3890907 0.5286113 0.1819933), wk = 0.0026455 k( 214) = ( 0.3825666 0.5370992 0.1926988), wk = 0.0026455 k( 215) = ( 0.3760426 0.5455871 0.2034043), wk = 0.0026455 k( 216) = ( 0.3695185 0.5540749 0.2141098), wk = 0.0026455 k( 217) = ( 0.3629944 0.5625628 0.2248153), wk = 0.0026455 k( 218) = ( 0.3564703 0.5710507 0.2355208), wk = 0.0026455 k( 219) = ( 0.3499463 0.5795385 0.2462263), wk = 0.0026455 k( 220) = ( 0.3434222 0.5880264 0.2569318), wk = 0.0026455 k( 221) = ( 0.3368981 0.5965143 0.2676373), wk = 0.0026455 k( 222) = ( 0.3303740 0.6050022 0.2783428), wk = 0.0026455 k( 223) = ( 0.3238500 0.6134900 0.2890482), wk = 0.0026455 k( 224) = ( 0.3238500 0.6134900 0.2890482), wk = 0.0026455 k( 225) = ( 0.3103562 0.6094867 0.2940975), wk = 0.0026455 k( 226) = ( 0.2968625 0.6054834 0.2991467), wk = 0.0026455 k( 227) = ( 0.2833687 0.6014801 0.3041960), wk = 0.0026455 k( 228) = ( 0.2698750 0.5974768 0.3092452), wk = 0.0026455 k( 229) = ( 0.2563812 0.5934735 0.3142945), wk = 0.0026455 k( 230) = ( 0.2428875 0.5894702 0.3193437), wk = 0.0026455 k( 231) = ( 0.2293937 0.5854669 0.3243930), wk = 0.0026455 k( 232) = ( 0.2159000 0.5814636 0.3294422), wk = 0.0026455 k( 233) = ( 0.2024062 0.5774603 0.3344915), wk = 0.0026455 k( 234) = ( 0.1889125 0.5734570 0.3395407), wk = 0.0026455 k( 235) = ( 0.1754187 0.5694537 0.3445900), wk = 0.0026455 k( 236) = ( 0.1619250 0.5654504 0.3496392), wk = 0.0026455 k( 237) = ( 0.1484312 0.5614470 0.3546885), wk = 0.0026455 k( 238) = ( 0.1349375 0.5574437 0.3597377), wk = 0.0026455 k( 239) = ( 0.1214437 0.5534404 0.3647870), wk = 0.0026455 k( 240) = ( 0.1079500 0.5494371 0.3698362), wk = 0.0026455 k( 241) = ( 0.0944562 0.5454338 0.3748855), wk = 0.0026455 k( 242) = ( 0.0809625 0.5414305 0.3799347), wk = 0.0026455 k( 243) = ( 0.0674687 0.5374272 0.3849840), wk = 0.0026455 k( 244) = ( 0.0539750 0.5334239 0.3900332), wk = 0.0026455 k( 245) = ( 0.0404813 0.5294206 0.3950824), wk = 0.0026455 k( 246) = ( 0.0269875 0.5254173 0.4001317), wk = 0.0026455 k( 247) = ( 0.0134938 0.5214140 0.4051809), wk = 0.0026455 k( 248) = ( 0.0000000 0.5174107 0.4102302), wk = 0.0026455 k( 249) = ( 0.0000000 0.5174107 0.4102302), wk = 0.0026455 k( 250) = ( 0.0064103 0.5090709 0.4207489), wk = 0.0026455 k( 251) = ( 0.0128205 0.5007311 0.4312676), wk = 0.0026455 k( 252) = ( 0.0192308 0.4923913 0.4417864), wk = 0.0026455 k( 253) = ( 0.0256410 0.4840515 0.4523051), wk = 0.0026455 k( 254) = ( 0.0320513 0.4757117 0.4628238), wk = 0.0026455 k( 255) = ( 0.0384615 0.4673719 0.4733425), wk = 0.0026455 k( 256) = ( 0.0448718 0.4590321 0.4838612), wk = 0.0026455 k( 257) = ( 0.0512821 0.4506923 0.4943800), wk = 0.0026455 k( 258) = ( 0.0576923 0.4423525 0.5048987), wk = 0.0026455 k( 259) = ( 0.0641026 0.4340127 0.5154174), wk = 0.0026455 k( 260) = ( 0.0705128 0.4256729 0.5259361), wk = 0.0026455 k( 261) = ( 0.0769231 0.4173331 0.5364549), wk = 0.0026455 k( 262) = ( 0.0833333 0.4089934 0.5469736), wk = 0.0026455 k( 263) = ( 0.0897436 0.4006536 0.5574923), wk = 0.0026455 k( 264) = ( 0.0961538 0.3923138 0.5680110), wk = 0.0026455 k( 265) = ( 0.1025641 0.3839740 0.5785297), wk = 0.0026455 k( 266) = ( 0.1089744 0.3756342 0.5890485), wk = 0.0026455 k( 267) = ( 0.1153846 0.3672944 0.5995672), wk = 0.0026455 k( 268) = ( 0.1217949 0.3589546 0.6100859), wk = 0.0026455 k( 269) = ( 0.1282051 0.3506148 0.6206046), wk = 0.0026455 k( 270) = ( 0.1346154 0.3422750 0.6311234), wk = 0.0026455 k( 271) = ( 0.1410256 0.3339352 0.6416421), wk = 0.0026455 k( 272) = ( 0.1474359 0.3255954 0.6521608), wk = 0.0026455 k( 273) = ( 0.1538461 0.3172556 0.6626795), wk = 0.0026455 k( 274) = ( 0.1602564 0.3089158 0.6731983), wk = 0.0026455 k( 275) = ( 0.1666667 0.3005760 0.6837170), wk = 0.0026455 k( 276) = ( 0.1730769 0.2922363 0.6942357), wk = 0.0026455 k( 277) = ( 0.1794872 0.2838965 0.7047544), wk = 0.0026455 k( 278) = ( 0.1858974 0.2755567 0.7152732), wk = 0.0026455 k( 279) = ( 0.1923077 0.2672169 0.7257919), wk = 0.0026455 k( 280) = ( 0.1987180 0.2588771 0.7363106), wk = 0.0026455 k( 281) = ( 0.2051282 0.2505373 0.7468293), wk = 0.0026455 k( 282) = ( 0.2115385 0.2421975 0.7573480), wk = 0.0026455 k( 283) = ( 0.2179487 0.2338577 0.7678668), wk = 0.0026455 k( 284) = ( 0.2243590 0.2255179 0.7783855), wk = 0.0026455 k( 285) = ( 0.2307692 0.2171781 0.7889042), wk = 0.0026455 k( 286) = ( 0.2371795 0.2088383 0.7994229), wk = 0.0026455 k( 287) = ( 0.2435897 0.2004985 0.8099416), wk = 0.0026455 k( 288) = ( 0.2500000 0.1921587 0.8204604), wk = 0.0026455 k( 289) = ( 0.2500000 0.1921587 0.8204604), wk = 0.0026455 k( 290) = ( 0.2592593 0.1992757 0.8114839), wk = 0.0026455 k( 291) = ( 0.2685185 0.2063927 0.8025075), wk = 0.0026455 k( 292) = ( 0.2777778 0.2135097 0.7935311), wk = 0.0026455 k( 293) = ( 0.2870370 0.2206267 0.7845546), wk = 0.0026455 k( 294) = ( 0.2962963 0.2277437 0.7755782), wk = 0.0026455 k( 295) = ( 0.3055556 0.2348607 0.7666017), wk = 0.0026455 k( 296) = ( 0.3148148 0.2419777 0.7576253), wk = 0.0026455 k( 297) = ( 0.3240741 0.2490947 0.7486488), wk = 0.0026455 k( 298) = ( 0.3333333 0.2562117 0.7396724), wk = 0.0026455 k( 299) = ( 0.3425926 0.2633286 0.7306960), wk = 0.0026455 k( 300) = ( 0.3518519 0.2704456 0.7217195), wk = 0.0026455 k( 301) = ( 0.3611111 0.2775626 0.7127431), wk = 0.0026455 k( 302) = ( 0.3703704 0.2846796 0.7037667), wk = 0.0026455 k( 303) = ( 0.3796296 0.2917966 0.6947902), wk = 0.0026455 k( 304) = ( 0.3888889 0.2989136 0.6858138), wk = 0.0026455 k( 305) = ( 0.3981481 0.3060306 0.6768373), wk = 0.0026455 k( 306) = ( 0.4074074 0.3131476 0.6678609), wk = 0.0026455 k( 307) = ( 0.4166667 0.3202646 0.6588845), wk = 0.0026455 k( 308) = ( 0.4259259 0.3273816 0.6499080), wk = 0.0026455 k( 309) = ( 0.4351852 0.3344986 0.6409316), wk = 0.0026455 k( 310) = ( 0.4444444 0.3416155 0.6319551), wk = 0.0026455 k( 311) = ( 0.4537037 0.3487325 0.6229787), wk = 0.0026455 k( 312) = ( 0.4629630 0.3558495 0.6140022), wk = 0.0026455 k( 313) = ( 0.4722222 0.3629665 0.6050258), wk = 0.0026455 k( 314) = ( 0.4814815 0.3700835 0.5960494), wk = 0.0026455 k( 315) = ( 0.4907407 0.3772005 0.5870729), wk = 0.0026455 k( 316) = ( 0.5000000 0.3843175 0.5780965), wk = 0.0026455 k( 317) = ( 0.5000000 0.3843175 0.5780965), wk = 0.0026455 k( 318) = ( 0.5000000 0.3843175 0.5632735), wk = 0.0026455 k( 319) = ( 0.5000000 0.3843175 0.5484505), wk = 0.0026455 k( 320) = ( 0.5000000 0.3843175 0.5336275), wk = 0.0026455 k( 321) = ( 0.5000000 0.3843175 0.5188045), wk = 0.0026455 k( 322) = ( 0.5000000 0.3843175 0.5039816), wk = 0.0026455 k( 323) = ( 0.5000000 0.3843175 0.4891586), wk = 0.0026455 k( 324) = ( 0.5000000 0.3843175 0.4743356), wk = 0.0026455 k( 325) = ( 0.5000000 0.3843175 0.4595126), wk = 0.0026455 k( 326) = ( 0.5000000 0.3843175 0.4446896), wk = 0.0026455 k( 327) = ( 0.5000000 0.3843175 0.4298666), wk = 0.0026455 k( 328) = ( 0.5000000 0.3843175 0.4150436), wk = 0.0026455 k( 329) = ( 0.5000000 0.3843175 0.4002207), wk = 0.0026455 k( 330) = ( 0.5000000 0.3843175 0.3853977), wk = 0.0026455 k( 331) = ( 0.5000000 0.3843175 0.3705747), wk = 0.0026455 k( 332) = ( 0.5000000 0.3843175 0.3557517), wk = 0.0026455 k( 333) = ( 0.5000000 0.3843175 0.3409287), wk = 0.0026455 k( 334) = ( 0.5000000 0.3843175 0.3261057), wk = 0.0026455 k( 335) = ( 0.5000000 0.3843175 0.3112827), wk = 0.0026455 k( 336) = ( 0.5000000 0.3843175 0.2964597), wk = 0.0026455 k( 337) = ( 0.5000000 0.3843175 0.2816368), wk = 0.0026455 k( 338) = ( 0.5000000 0.3843175 0.2668138), wk = 0.0026455 k( 339) = ( 0.5000000 0.3843175 0.2519908), wk = 0.0026455 k( 340) = ( 0.5000000 0.3843175 0.2371678), wk = 0.0026455 k( 341) = ( 0.5000000 0.3843175 0.2223448), wk = 0.0026455 k( 342) = ( 0.5000000 0.3843175 0.2075218), wk = 0.0026455 k( 343) = ( 0.5000000 0.3843175 0.1926988), wk = 0.0026455 k( 344) = ( 0.5000000 0.3843175 0.1778758), wk = 0.0026455 k( 345) = ( 0.5000000 0.3843175 0.1630529), wk = 0.0026455 k( 346) = ( 0.5000000 0.3843175 0.1482299), wk = 0.0026455 k( 347) = ( 0.5000000 0.3843175 0.1334069), wk = 0.0026455 k( 348) = ( 0.5000000 0.3843175 0.1185839), wk = 0.0026455 k( 349) = ( 0.5000000 0.3843175 0.1037609), wk = 0.0026455 k( 350) = ( 0.5000000 0.3843175 0.0889379), wk = 0.0026455 k( 351) = ( 0.5000000 0.3843175 0.0741149), wk = 0.0026455 k( 352) = ( 0.5000000 0.3843175 0.0592919), wk = 0.0026455 k( 353) = ( 0.5000000 0.3843175 0.0444690), wk = 0.0026455 k( 354) = ( 0.5000000 0.3843175 0.0296460), wk = 0.0026455 k( 355) = ( 0.5000000 0.3843175 0.0148230), wk = 0.0026455 k( 356) = ( 0.5000000 0.3843175 -0.0000000), wk = 0.0026455 k( 357) = ( 0.0000000 0.0000000 0.8204604), wk = 0.0026455 k( 358) = ( 0.0119048 0.0091504 0.8204604), wk = 0.0026455 k( 359) = ( 0.0238095 0.0183008 0.8204604), wk = 0.0026455 k( 360) = ( 0.0357143 0.0274513 0.8204604), wk = 0.0026455 k( 361) = ( 0.0476191 0.0366017 0.8204604), wk = 0.0026455 k( 362) = ( 0.0595238 0.0457521 0.8204604), wk = 0.0026455 k( 363) = ( 0.0714286 0.0549025 0.8204604), wk = 0.0026455 k( 364) = ( 0.0833333 0.0640529 0.8204604), wk = 0.0026455 k( 365) = ( 0.0952381 0.0732033 0.8204604), wk = 0.0026455 k( 366) = ( 0.1071429 0.0823538 0.8204604), wk = 0.0026455 k( 367) = ( 0.1190476 0.0915042 0.8204604), wk = 0.0026455 k( 368) = ( 0.1309524 0.1006546 0.8204604), wk = 0.0026455 k( 369) = ( 0.1428571 0.1098050 0.8204604), wk = 0.0026455 k( 370) = ( 0.1547619 0.1189554 0.8204604), wk = 0.0026455 k( 371) = ( 0.1666667 0.1281058 0.8204604), wk = 0.0026455 k( 372) = ( 0.1785714 0.1372562 0.8204604), wk = 0.0026455 k( 373) = ( 0.1904762 0.1464067 0.8204604), wk = 0.0026455 k( 374) = ( 0.2023810 0.1555571 0.8204604), wk = 0.0026455 k( 375) = ( 0.2142857 0.1647075 0.8204604), wk = 0.0026455 k( 376) = ( 0.2261905 0.1738579 0.8204604), wk = 0.0026455 k( 377) = ( 0.2380952 0.1830083 0.8204604), wk = 0.0026455 k( 378) = ( 0.2500000 0.1921587 0.8204604), wk = 0.0026455 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 2) = ( 0.0000000 0.0000000 0.0090909), wk = 0.0026455 k( 3) = ( 0.0000000 0.0000000 0.0181818), wk = 0.0026455 k( 4) = ( 0.0000000 0.0000000 0.0272727), wk = 0.0026455 k( 5) = ( 0.0000000 0.0000000 0.0363636), wk = 0.0026455 k( 6) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0026455 k( 7) = ( 0.0000000 0.0000000 0.0545455), wk = 0.0026455 k( 8) = ( 0.0000000 0.0000000 0.0636364), wk = 0.0026455 k( 9) = ( 0.0000000 0.0000000 0.0727273), wk = 0.0026455 k( 10) = ( 0.0000000 0.0000000 0.0818182), wk = 0.0026455 k( 11) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0026455 k( 12) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0026455 k( 13) = ( 0.0000000 0.0000000 0.1090909), wk = 0.0026455 k( 14) = ( 0.0000000 0.0000000 0.1181818), wk = 0.0026455 k( 15) = ( 0.0000000 0.0000000 0.1272727), wk = 0.0026455 k( 16) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0026455 k( 17) = ( 0.0000000 0.0000000 0.1454545), wk = 0.0026455 k( 18) = ( 0.0000000 0.0000000 0.1545455), wk = 0.0026455 k( 19) = ( 0.0000000 0.0000000 0.1636364), wk = 0.0026455 k( 20) = ( 0.0000000 0.0000000 0.1727273), wk = 0.0026455 k( 21) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0026455 k( 22) = ( 0.0000000 0.0000000 0.1909091), wk = 0.0026455 k( 23) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0026455 k( 24) = ( 0.0000000 0.0000000 0.2090909), wk = 0.0026455 k( 25) = ( 0.0000000 0.0000000 0.2181818), wk = 0.0026455 k( 26) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0026455 k( 27) = ( 0.0000000 0.0000000 0.2363636), wk = 0.0026455 k( 28) = ( 0.0000000 0.0000000 0.2454546), wk = 0.0026455 k( 29) = ( 0.0000000 0.0000000 0.2545455), wk = 0.0026455 k( 30) = ( 0.0000000 0.0000000 0.2636364), wk = 0.0026455 k( 31) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0026455 k( 32) = ( 0.0000000 0.0000000 0.2818182), wk = 0.0026455 k( 33) = ( 0.0000000 0.0000000 0.2909091), wk = 0.0026455 k( 34) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0026455 k( 35) = ( 0.0000000 0.0000000 0.3090909), wk = 0.0026455 k( 36) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0026455 k( 37) = ( 0.0000000 0.0000000 0.3272727), wk = 0.0026455 k( 38) = ( 0.0000000 0.0000000 0.3363636), wk = 0.0026455 k( 39) = ( 0.0000000 0.0000000 0.3454546), wk = 0.0026455 k( 40) = ( 0.0000000 0.0000000 0.3545454), wk = 0.0026455 k( 41) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0026455 k( 42) = ( 0.0000000 0.0000000 0.3727273), wk = 0.0026455 k( 43) = ( 0.0000000 0.0000000 0.3818182), wk = 0.0026455 k( 44) = ( 0.0000000 0.0000000 0.3909091), wk = 0.0026455 k( 45) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0026455 k( 46) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0026455 k( 47) = ( 0.0000000 0.0000000 0.4181818), wk = 0.0026455 k( 48) = ( 0.0000000 0.0000000 0.4272727), wk = 0.0026455 k( 49) = ( 0.0000000 0.0000000 0.4363636), wk = 0.0026455 k( 50) = ( 0.0000000 0.0000000 0.4454546), wk = 0.0026455 k( 51) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0026455 k( 52) = ( 0.0000000 0.0000000 0.4636364), wk = 0.0026455 k( 53) = ( 0.0000000 0.0000000 0.4727273), wk = 0.0026455 k( 54) = ( 0.0000000 0.0000000 0.4818182), wk = 0.0026455 k( 55) = ( 0.0000000 0.0000000 0.4909091), wk = 0.0026455 k( 56) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026455 k( 57) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026455 k( 58) = ( -0.0092312 0.0092313 0.5000000), wk = 0.0026455 k( 59) = ( -0.0184625 0.0184625 0.5000000), wk = 0.0026455 k( 60) = ( -0.0276937 0.0276937 0.5000000), wk = 0.0026455 k( 61) = ( -0.0369250 0.0369250 0.5000000), wk = 0.0026455 k( 62) = ( -0.0461562 0.0461562 0.5000000), wk = 0.0026455 k( 63) = ( -0.0553875 0.0553875 0.5000000), wk = 0.0026455 k( 64) = ( -0.0646187 0.0646187 0.5000000), wk = 0.0026455 k( 65) = ( -0.0738500 0.0738500 0.5000000), wk = 0.0026455 k( 66) = ( -0.0830812 0.0830812 0.5000000), wk = 0.0026455 k( 67) = ( -0.0923125 0.0923125 0.5000000), wk = 0.0026455 k( 68) = ( -0.1015437 0.1015437 0.5000000), wk = 0.0026455 k( 69) = ( -0.1107749 0.1107750 0.5000000), wk = 0.0026455 k( 70) = ( -0.1200062 0.1200062 0.5000000), wk = 0.0026455 k( 71) = ( -0.1292374 0.1292374 0.5000000), wk = 0.0026455 k( 72) = ( -0.1384687 0.1384687 0.5000000), wk = 0.0026455 k( 73) = ( -0.1476999 0.1476999 0.5000000), wk = 0.0026455 k( 74) = ( -0.1476999 0.1476999 0.5000000), wk = 0.0026455 k( 75) = ( -0.1542240 0.1542240 0.4934759), wk = 0.0026455 k( 76) = ( -0.1607481 0.1607481 0.4869519), wk = 0.0026455 k( 77) = ( -0.1672722 0.1672722 0.4804278), wk = 0.0026455 k( 78) = ( -0.1737962 0.1737962 0.4739037), wk = 0.0026455 k( 79) = ( -0.1803203 0.1803203 0.4673796), wk = 0.0026455 k( 80) = ( -0.1868444 0.1868444 0.4608556), wk = 0.0026455 k( 81) = ( -0.1933685 0.1933685 0.4543315), wk = 0.0026455 k( 82) = ( -0.1998925 0.1998925 0.4478074), wk = 0.0026455 k( 83) = ( -0.2064166 0.2064166 0.4412833), wk = 0.0026455 k( 84) = ( -0.2129407 0.2129407 0.4347593), wk = 0.0026455 k( 85) = ( -0.2194648 0.2194648 0.4282352), wk = 0.0026455 k( 86) = ( -0.2259888 0.2259888 0.4217111), wk = 0.0026455 k( 87) = ( -0.2325129 0.2325129 0.4151870), wk = 0.0026455 k( 88) = ( -0.2390370 0.2390370 0.4086630), wk = 0.0026455 k( 89) = ( -0.2455611 0.2455611 0.4021389), wk = 0.0026455 k( 90) = ( -0.2520851 0.2520851 0.3956148), wk = 0.0026455 k( 91) = ( -0.2586092 0.2586092 0.3890907), wk = 0.0026455 k( 92) = ( -0.2651333 0.2651333 0.3825666), wk = 0.0026455 k( 93) = ( -0.2716574 0.2716574 0.3760426), wk = 0.0026455 k( 94) = ( -0.2781814 0.2781814 0.3695185), wk = 0.0026455 k( 95) = ( -0.2847055 0.2847055 0.3629944), wk = 0.0026455 k( 96) = ( -0.2912296 0.2912296 0.3564703), wk = 0.0026455 k( 97) = ( -0.2977537 0.2977537 0.3499463), wk = 0.0026455 k( 98) = ( -0.3042777 0.3042777 0.3434222), wk = 0.0026455 k( 99) = ( -0.3108018 0.3108018 0.3368981), wk = 0.0026455 k( 100) = ( -0.3173259 0.3173259 0.3303740), wk = 0.0026455 k( 101) = ( -0.3238500 0.3238500 0.3238500), wk = 0.0026455 k( 102) = ( -0.3238500 0.3238500 0.3238500), wk = 0.0026455 k( 103) = ( -0.3173730 0.3173730 0.3173730), wk = 0.0026455 k( 104) = ( -0.3108960 0.3108960 0.3108960), wk = 0.0026455 k( 105) = ( -0.3044190 0.3044190 0.3044190), wk = 0.0026455 k( 106) = ( -0.2979420 0.2979420 0.2979420), wk = 0.0026455 k( 107) = ( -0.2914650 0.2914650 0.2914650), wk = 0.0026455 k( 108) = ( -0.2849880 0.2849880 0.2849880), wk = 0.0026455 k( 109) = ( -0.2785110 0.2785110 0.2785110), wk = 0.0026455 k( 110) = ( -0.2720340 0.2720340 0.2720340), wk = 0.0026455 k( 111) = ( -0.2655570 0.2655570 0.2655570), wk = 0.0026455 k( 112) = ( -0.2590800 0.2590800 0.2590800), wk = 0.0026455 k( 113) = ( -0.2526030 0.2526030 0.2526030), wk = 0.0026455 k( 114) = ( -0.2461260 0.2461260 0.2461260), wk = 0.0026455 k( 115) = ( -0.2396490 0.2396490 0.2396490), wk = 0.0026455 k( 116) = ( -0.2331720 0.2331720 0.2331720), wk = 0.0026455 k( 117) = ( -0.2266950 0.2266950 0.2266950), wk = 0.0026455 k( 118) = ( -0.2202180 0.2202180 0.2202180), wk = 0.0026455 k( 119) = ( -0.2137410 0.2137410 0.2137410), wk = 0.0026455 k( 120) = ( -0.2072640 0.2072640 0.2072640), wk = 0.0026455 k( 121) = ( -0.2007870 0.2007870 0.2007870), wk = 0.0026455 k( 122) = ( -0.1943100 0.1943100 0.1943100), wk = 0.0026455 k( 123) = ( -0.1878330 0.1878330 0.1878330), wk = 0.0026455 k( 124) = ( -0.1813560 0.1813560 0.1813560), wk = 0.0026455 k( 125) = ( -0.1748790 0.1748790 0.1748790), wk = 0.0026455 k( 126) = ( -0.1684020 0.1684020 0.1684020), wk = 0.0026455 k( 127) = ( -0.1619250 0.1619250 0.1619250), wk = 0.0026455 k( 128) = ( -0.1554480 0.1554480 0.1554480), wk = 0.0026455 k( 129) = ( -0.1489710 0.1489710 0.1489710), wk = 0.0026455 k( 130) = ( -0.1424940 0.1424940 0.1424940), wk = 0.0026455 k( 131) = ( -0.1360170 0.1360170 0.1360170), wk = 0.0026455 k( 132) = ( -0.1295400 0.1295400 0.1295400), wk = 0.0026455 k( 133) = ( -0.1230630 0.1230630 0.1230630), wk = 0.0026455 k( 134) = ( -0.1165860 0.1165860 0.1165860), wk = 0.0026455 k( 135) = ( -0.1101090 0.1101090 0.1101090), wk = 0.0026455 k( 136) = ( -0.1036320 0.1036320 0.1036320), wk = 0.0026455 k( 137) = ( -0.0971550 0.0971550 0.0971550), wk = 0.0026455 k( 138) = ( -0.0906780 0.0906780 0.0906780), wk = 0.0026455 k( 139) = ( -0.0842010 0.0842010 0.0842010), wk = 0.0026455 k( 140) = ( -0.0777240 0.0777240 0.0777240), wk = 0.0026455 k( 141) = ( -0.0712470 0.0712470 0.0712470), wk = 0.0026455 k( 142) = ( -0.0647700 0.0647700 0.0647700), wk = 0.0026455 k( 143) = ( -0.0582930 0.0582930 0.0582930), wk = 0.0026455 k( 144) = ( -0.0518160 0.0518160 0.0518160), wk = 0.0026455 k( 145) = ( -0.0453390 0.0453390 0.0453390), wk = 0.0026455 k( 146) = ( -0.0388620 0.0388620 0.0388620), wk = 0.0026455 k( 147) = ( -0.0323850 0.0323850 0.0323850), wk = 0.0026455 k( 148) = ( -0.0259080 0.0259080 0.0259080), wk = 0.0026455 k( 149) = ( -0.0194310 0.0194310 0.0194310), wk = 0.0026455 k( 150) = ( -0.0129540 0.0129540 0.0129540), wk = 0.0026455 k( 151) = ( -0.0064770 0.0064770 0.0064770), wk = 0.0026455 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0026455 k( 154) = ( 0.0119048 0.0119048 -0.0119048), wk = 0.0026455 k( 155) = ( 0.0238095 0.0238095 -0.0238095), wk = 0.0026455 k( 156) = ( 0.0357143 0.0357143 -0.0357143), wk = 0.0026455 k( 157) = ( 0.0476191 0.0476190 -0.0476191), wk = 0.0026455 k( 158) = ( 0.0595238 0.0595238 -0.0595238), wk = 0.0026455 k( 159) = ( 0.0714286 0.0714286 -0.0714286), wk = 0.0026455 k( 160) = ( 0.0833333 0.0833333 -0.0833333), wk = 0.0026455 k( 161) = ( 0.0952381 0.0952381 -0.0952381), wk = 0.0026455 k( 162) = ( 0.1071429 0.1071429 -0.1071429), wk = 0.0026455 k( 163) = ( 0.1190476 0.1190476 -0.1190476), wk = 0.0026455 k( 164) = ( 0.1309524 0.1309524 -0.1309524), wk = 0.0026455 k( 165) = ( 0.1428571 0.1428571 -0.1428571), wk = 0.0026455 k( 166) = ( 0.1547619 0.1547619 -0.1547619), wk = 0.0026455 k( 167) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0026455 k( 168) = ( 0.1785714 0.1785714 -0.1785714), wk = 0.0026455 k( 169) = ( 0.1904762 0.1904762 -0.1904762), wk = 0.0026455 k( 170) = ( 0.2023810 0.2023809 -0.2023809), wk = 0.0026455 k( 171) = ( 0.2142857 0.2142857 -0.2142857), wk = 0.0026455 k( 172) = ( 0.2261905 0.2261905 -0.2261905), wk = 0.0026455 k( 173) = ( 0.2380952 0.2380952 -0.2380952), wk = 0.0026455 k( 174) = ( 0.2500000 0.2500000 -0.2500000), wk = 0.0026455 k( 175) = ( 0.2619048 0.2619048 -0.2619048), wk = 0.0026455 k( 176) = ( 0.2738095 0.2738095 -0.2738095), wk = 0.0026455 k( 177) = ( 0.2857143 0.2857143 -0.2857143), wk = 0.0026455 k( 178) = ( 0.2976190 0.2976190 -0.2976190), wk = 0.0026455 k( 179) = ( 0.3095238 0.3095238 -0.3095238), wk = 0.0026455 k( 180) = ( 0.3214286 0.3214286 -0.3214286), wk = 0.0026455 k( 181) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0026455 k( 182) = ( 0.3452381 0.3452381 -0.3452381), wk = 0.0026455 k( 183) = ( 0.3571429 0.3571429 -0.3571429), wk = 0.0026455 k( 184) = ( 0.3690476 0.3690476 -0.3690476), wk = 0.0026455 k( 185) = ( 0.3809524 0.3809524 -0.3809524), wk = 0.0026455 k( 186) = ( 0.3928571 0.3928571 -0.3928571), wk = 0.0026455 k( 187) = ( 0.4047619 0.4047619 -0.4047619), wk = 0.0026455 k( 188) = ( 0.4166667 0.4166667 -0.4166667), wk = 0.0026455 k( 189) = ( 0.4285714 0.4285714 -0.4285714), wk = 0.0026455 k( 190) = ( 0.4404762 0.4404762 -0.4404762), wk = 0.0026455 k( 191) = ( 0.4523810 0.4523809 -0.4523810), wk = 0.0026455 k( 192) = ( 0.4642857 0.4642857 -0.4642857), wk = 0.0026455 k( 193) = ( 0.4761905 0.4761905 -0.4761905), wk = 0.0026455 k( 194) = ( 0.4880952 0.4880952 -0.4880952), wk = 0.0026455 k( 195) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026455 k( 196) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026455 k( 197) = ( 0.4934759 0.5065241 -0.4934759), wk = 0.0026455 k( 198) = ( 0.4869519 0.5130481 -0.4869519), wk = 0.0026455 k( 199) = ( 0.4804278 0.5195722 -0.4804278), wk = 0.0026455 k( 200) = ( 0.4739037 0.5260963 -0.4739037), wk = 0.0026455 k( 201) = ( 0.4673796 0.5326204 -0.4673796), wk = 0.0026455 k( 202) = ( 0.4608556 0.5391444 -0.4608555), wk = 0.0026455 k( 203) = ( 0.4543315 0.5456685 -0.4543315), wk = 0.0026455 k( 204) = ( 0.4478074 0.5521926 -0.4478074), wk = 0.0026455 k( 205) = ( 0.4412833 0.5587167 -0.4412833), wk = 0.0026455 k( 206) = ( 0.4347592 0.5652407 -0.4347592), wk = 0.0026455 k( 207) = ( 0.4282352 0.5717648 -0.4282352), wk = 0.0026455 k( 208) = ( 0.4217111 0.5782889 -0.4217111), wk = 0.0026455 k( 209) = ( 0.4151870 0.5848130 -0.4151870), wk = 0.0026455 k( 210) = ( 0.4086630 0.5913371 -0.4086630), wk = 0.0026455 k( 211) = ( 0.4021389 0.5978611 -0.4021389), wk = 0.0026455 k( 212) = ( 0.3956148 0.6043852 -0.3956148), wk = 0.0026455 k( 213) = ( 0.3890907 0.6109093 -0.3890907), wk = 0.0026455 k( 214) = ( 0.3825666 0.6174334 -0.3825666), wk = 0.0026455 k( 215) = ( 0.3760426 0.6239574 -0.3760426), wk = 0.0026455 k( 216) = ( 0.3695185 0.6304815 -0.3695185), wk = 0.0026455 k( 217) = ( 0.3629944 0.6370056 -0.3629944), wk = 0.0026455 k( 218) = ( 0.3564703 0.6435297 -0.3564703), wk = 0.0026455 k( 219) = ( 0.3499463 0.6500537 -0.3499463), wk = 0.0026455 k( 220) = ( 0.3434222 0.6565778 -0.3434222), wk = 0.0026455 k( 221) = ( 0.3368981 0.6631019 -0.3368981), wk = 0.0026455 k( 222) = ( 0.3303740 0.6696260 -0.3303740), wk = 0.0026455 k( 223) = ( 0.3238500 0.6761500 -0.3238500), wk = 0.0026455 k( 224) = ( 0.3238500 0.6761500 -0.3238500), wk = 0.0026455 k( 225) = ( 0.3103562 0.6688104 -0.3103562), wk = 0.0026455 k( 226) = ( 0.2968625 0.6614709 -0.2968625), wk = 0.0026455 k( 227) = ( 0.2833687 0.6541313 -0.2833687), wk = 0.0026455 k( 228) = ( 0.2698750 0.6467917 -0.2698750), wk = 0.0026455 k( 229) = ( 0.2563812 0.6394521 -0.2563812), wk = 0.0026455 k( 230) = ( 0.2428875 0.6321125 -0.2428875), wk = 0.0026455 k( 231) = ( 0.2293937 0.6247729 -0.2293937), wk = 0.0026455 k( 232) = ( 0.2159000 0.6174334 -0.2159000), wk = 0.0026455 k( 233) = ( 0.2024062 0.6100938 -0.2024062), wk = 0.0026455 k( 234) = ( 0.1889125 0.6027542 -0.1889125), wk = 0.0026455 k( 235) = ( 0.1754187 0.5954146 -0.1754187), wk = 0.0026455 k( 236) = ( 0.1619250 0.5880750 -0.1619250), wk = 0.0026455 k( 237) = ( 0.1484312 0.5807354 -0.1484312), wk = 0.0026455 k( 238) = ( 0.1349375 0.5733959 -0.1349375), wk = 0.0026455 k( 239) = ( 0.1214437 0.5660563 -0.1214437), wk = 0.0026455 k( 240) = ( 0.1079500 0.5587167 -0.1079500), wk = 0.0026455 k( 241) = ( 0.0944562 0.5513771 -0.0944562), wk = 0.0026455 k( 242) = ( 0.0809625 0.5440375 -0.0809625), wk = 0.0026455 k( 243) = ( 0.0674687 0.5366979 -0.0674687), wk = 0.0026455 k( 244) = ( 0.0539750 0.5293583 -0.0539750), wk = 0.0026455 k( 245) = ( 0.0404813 0.5220187 -0.0404812), wk = 0.0026455 k( 246) = ( 0.0269875 0.5146792 -0.0269875), wk = 0.0026455 k( 247) = ( 0.0134938 0.5073396 -0.0134937), wk = 0.0026455 k( 248) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026455 k( 249) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0026455 k( 250) = ( 0.0064103 0.4935897 0.0064103), wk = 0.0026455 k( 251) = ( 0.0128205 0.4871795 0.0128205), wk = 0.0026455 k( 252) = ( 0.0192308 0.4807692 0.0192308), wk = 0.0026455 k( 253) = ( 0.0256410 0.4743590 0.0256410), wk = 0.0026455 k( 254) = ( 0.0320513 0.4679487 0.0320513), wk = 0.0026455 k( 255) = ( 0.0384615 0.4615385 0.0384615), wk = 0.0026455 k( 256) = ( 0.0448718 0.4551282 0.0448718), wk = 0.0026455 k( 257) = ( 0.0512821 0.4487179 0.0512821), wk = 0.0026455 k( 258) = ( 0.0576923 0.4423077 0.0576923), wk = 0.0026455 k( 259) = ( 0.0641026 0.4358974 0.0641026), wk = 0.0026455 k( 260) = ( 0.0705128 0.4294872 0.0705128), wk = 0.0026455 k( 261) = ( 0.0769231 0.4230769 0.0769231), wk = 0.0026455 k( 262) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0026455 k( 263) = ( 0.0897436 0.4102564 0.0897436), wk = 0.0026455 k( 264) = ( 0.0961538 0.4038462 0.0961539), wk = 0.0026455 k( 265) = ( 0.1025641 0.3974359 0.1025641), wk = 0.0026455 k( 266) = ( 0.1089744 0.3910256 0.1089744), wk = 0.0026455 k( 267) = ( 0.1153846 0.3846154 0.1153846), wk = 0.0026455 k( 268) = ( 0.1217949 0.3782051 0.1217949), wk = 0.0026455 k( 269) = ( 0.1282051 0.3717949 0.1282051), wk = 0.0026455 k( 270) = ( 0.1346154 0.3653846 0.1346154), wk = 0.0026455 k( 271) = ( 0.1410256 0.3589744 0.1410256), wk = 0.0026455 k( 272) = ( 0.1474359 0.3525641 0.1474359), wk = 0.0026455 k( 273) = ( 0.1538461 0.3461538 0.1538462), wk = 0.0026455 k( 274) = ( 0.1602564 0.3397436 0.1602564), wk = 0.0026455 k( 275) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0026455 k( 276) = ( 0.1730769 0.3269231 0.1730769), wk = 0.0026455 k( 277) = ( 0.1794872 0.3205128 0.1794872), wk = 0.0026455 k( 278) = ( 0.1858974 0.3141026 0.1858974), wk = 0.0026455 k( 279) = ( 0.1923077 0.3076923 0.1923077), wk = 0.0026455 k( 280) = ( 0.1987180 0.3012821 0.1987180), wk = 0.0026455 k( 281) = ( 0.2051282 0.2948718 0.2051282), wk = 0.0026455 k( 282) = ( 0.2115385 0.2884615 0.2115385), wk = 0.0026455 k( 283) = ( 0.2179487 0.2820513 0.2179487), wk = 0.0026455 k( 284) = ( 0.2243590 0.2756410 0.2243590), wk = 0.0026455 k( 285) = ( 0.2307692 0.2692308 0.2307692), wk = 0.0026455 k( 286) = ( 0.2371795 0.2628205 0.2371795), wk = 0.0026455 k( 287) = ( 0.2435897 0.2564103 0.2435897), wk = 0.0026455 k( 288) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026455 k( 289) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026455 k( 290) = ( 0.2592593 0.2592593 0.2352704), wk = 0.0026455 k( 291) = ( 0.2685185 0.2685185 0.2205408), wk = 0.0026455 k( 292) = ( 0.2777778 0.2777778 0.2058111), wk = 0.0026455 k( 293) = ( 0.2870370 0.2870370 0.1910815), wk = 0.0026455 k( 294) = ( 0.2962963 0.2962963 0.1763519), wk = 0.0026455 k( 295) = ( 0.3055556 0.3055556 0.1616222), wk = 0.0026455 k( 296) = ( 0.3148148 0.3148148 0.1468926), wk = 0.0026455 k( 297) = ( 0.3240741 0.3240741 0.1321630), wk = 0.0026455 k( 298) = ( 0.3333333 0.3333333 0.1174334), wk = 0.0026455 k( 299) = ( 0.3425926 0.3425926 0.1027037), wk = 0.0026455 k( 300) = ( 0.3518519 0.3518518 0.0879741), wk = 0.0026455 k( 301) = ( 0.3611111 0.3611111 0.0732445), wk = 0.0026455 k( 302) = ( 0.3703704 0.3703704 0.0585149), wk = 0.0026455 k( 303) = ( 0.3796296 0.3796296 0.0437852), wk = 0.0026455 k( 304) = ( 0.3888889 0.3888889 0.0290556), wk = 0.0026455 k( 305) = ( 0.3981481 0.3981481 0.0143260), wk = 0.0026455 k( 306) = ( 0.4074074 0.4074074 -0.0004037), wk = 0.0026455 k( 307) = ( 0.4166667 0.4166667 -0.0151333), wk = 0.0026455 k( 308) = ( 0.4259259 0.4259259 -0.0298629), wk = 0.0026455 k( 309) = ( 0.4351852 0.4351852 -0.0445925), wk = 0.0026455 k( 310) = ( 0.4444444 0.4444444 -0.0593222), wk = 0.0026455 k( 311) = ( 0.4537037 0.4537037 -0.0740518), wk = 0.0026455 k( 312) = ( 0.4629630 0.4629630 -0.0887814), wk = 0.0026455 k( 313) = ( 0.4722222 0.4722222 -0.1035110), wk = 0.0026455 k( 314) = ( 0.4814815 0.4814815 -0.1182407), wk = 0.0026455 k( 315) = ( 0.4907407 0.4907407 -0.1329703), wk = 0.0026455 k( 316) = ( 0.5000000 0.5000000 -0.1476999), wk = 0.0026455 k( 317) = ( 0.5000000 0.5000000 -0.1476999), wk = 0.0026455 k( 318) = ( 0.5000000 0.5000000 -0.1567333), wk = 0.0026455 k( 319) = ( 0.5000000 0.5000000 -0.1657666), wk = 0.0026455 k( 320) = ( 0.5000000 0.5000000 -0.1747999), wk = 0.0026455 k( 321) = ( 0.5000000 0.5000000 -0.1838333), wk = 0.0026455 k( 322) = ( 0.5000000 0.5000000 -0.1928666), wk = 0.0026455 k( 323) = ( 0.5000000 0.5000000 -0.2018999), wk = 0.0026455 k( 324) = ( 0.5000000 0.5000000 -0.2109333), wk = 0.0026455 k( 325) = ( 0.5000000 0.5000000 -0.2199666), wk = 0.0026455 k( 326) = ( 0.5000000 0.5000000 -0.2290000), wk = 0.0026455 k( 327) = ( 0.5000000 0.5000000 -0.2380333), wk = 0.0026455 k( 328) = ( 0.5000000 0.5000000 -0.2470666), wk = 0.0026455 k( 329) = ( 0.5000000 0.5000000 -0.2561000), wk = 0.0026455 k( 330) = ( 0.5000000 0.5000000 -0.2651333), wk = 0.0026455 k( 331) = ( 0.5000000 0.5000000 -0.2741666), wk = 0.0026455 k( 332) = ( 0.5000000 0.5000000 -0.2832000), wk = 0.0026455 k( 333) = ( 0.5000000 0.5000000 -0.2922333), wk = 0.0026455 k( 334) = ( 0.5000000 0.5000000 -0.3012666), wk = 0.0026455 k( 335) = ( 0.5000000 0.5000000 -0.3103000), wk = 0.0026455 k( 336) = ( 0.5000000 0.5000000 -0.3193333), wk = 0.0026455 k( 337) = ( 0.5000000 0.5000000 -0.3283666), wk = 0.0026455 k( 338) = ( 0.5000000 0.5000000 -0.3374000), wk = 0.0026455 k( 339) = ( 0.5000000 0.5000000 -0.3464333), wk = 0.0026455 k( 340) = ( 0.5000000 0.5000000 -0.3554666), wk = 0.0026455 k( 341) = ( 0.5000000 0.5000000 -0.3645000), wk = 0.0026455 k( 342) = ( 0.5000000 0.5000000 -0.3735333), wk = 0.0026455 k( 343) = ( 0.5000000 0.5000000 -0.3825666), wk = 0.0026455 k( 344) = ( 0.5000000 0.5000000 -0.3916000), wk = 0.0026455 k( 345) = ( 0.5000000 0.5000000 -0.4006333), wk = 0.0026455 k( 346) = ( 0.5000000 0.5000000 -0.4096667), wk = 0.0026455 k( 347) = ( 0.5000000 0.5000000 -0.4187000), wk = 0.0026455 k( 348) = ( 0.5000000 0.5000000 -0.4277333), wk = 0.0026455 k( 349) = ( 0.5000000 0.5000000 -0.4367666), wk = 0.0026455 k( 350) = ( 0.5000000 0.5000000 -0.4458000), wk = 0.0026455 k( 351) = ( 0.5000000 0.5000000 -0.4548333), wk = 0.0026455 k( 352) = ( 0.5000000 0.5000000 -0.4638667), wk = 0.0026455 k( 353) = ( 0.5000000 0.5000000 -0.4729000), wk = 0.0026455 k( 354) = ( 0.5000000 0.5000000 -0.4819333), wk = 0.0026455 k( 355) = ( 0.5000000 0.5000000 -0.4909667), wk = 0.0026455 k( 356) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0026455 k( 357) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0026455 k( 358) = ( 0.0119048 0.0119048 0.4880952), wk = 0.0026455 k( 359) = ( 0.0238095 0.0238095 0.4761905), wk = 0.0026455 k( 360) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0026455 k( 361) = ( 0.0476191 0.0476190 0.4523810), wk = 0.0026455 k( 362) = ( 0.0595238 0.0595238 0.4404762), wk = 0.0026455 k( 363) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0026455 k( 364) = ( 0.0833333 0.0833333 0.4166667), wk = 0.0026455 k( 365) = ( 0.0952381 0.0952381 0.4047619), wk = 0.0026455 k( 366) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0026455 k( 367) = ( 0.1190476 0.1190476 0.3809524), wk = 0.0026455 k( 368) = ( 0.1309524 0.1309524 0.3690476), wk = 0.0026455 k( 369) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0026455 k( 370) = ( 0.1547619 0.1547619 0.3452381), wk = 0.0026455 k( 371) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0026455 k( 372) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0026455 k( 373) = ( 0.1904762 0.1904762 0.3095238), wk = 0.0026455 k( 374) = ( 0.2023810 0.2023809 0.2976191), wk = 0.0026455 k( 375) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0026455 k( 376) = ( 0.2261905 0.2261905 0.2738095), wk = 0.0026455 k( 377) = ( 0.2380952 0.2380952 0.2619048), wk = 0.0026455 k( 378) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0026455 Dense grid: 55217 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 26275 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.13 Mb ( 146, 58) NL pseudopotentials 0.12 Mb ( 73, 112) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1152) G-vector shells 0.00 Mb ( 538) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.52 Mb ( 146, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.20 Mb ( 112, 2, 58) Check: negative/imaginary core charge= -0.000018 0.000000 The potential is recalculated from file : ./MgCN2.save/charge-density.dat Starting wfc are 68 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.2 secs Computing kpt #: 2 total cpu time spent up to now is 43.0 secs Computing kpt #: 3 total cpu time spent up to now is 44.9 secs Computing kpt #: 4 total cpu time spent up to now is 46.7 secs Computing kpt #: 5 total cpu time spent up to now is 48.5 secs Computing kpt #: 6 total cpu time spent up to now is 50.3 secs Computing kpt #: 7 total cpu time spent up to now is 52.0 secs Computing kpt #: 8 total cpu time spent up to now is 53.6 secs Computing kpt #: 9 total cpu time spent up to now is 55.4 secs Computing kpt #: 10 total cpu time spent up to now is 57.0 secs Computing kpt #: 11 total cpu time spent up to now is 58.8 secs Computing kpt #: 12 total cpu time spent up to now is 60.5 secs Computing kpt #: 13 total cpu time spent up to now is 62.3 secs Computing kpt #: 14 total cpu time spent up to now is 63.8 secs Computing kpt #: 15 total cpu time spent up to now is 65.5 secs Computing kpt #: 16 total cpu time spent up to now is 67.3 secs Computing kpt #: 17 total cpu time spent up to now is 69.3 secs Computing kpt #: 18 total cpu time spent up to now is 71.1 secs Computing kpt #: 19 total cpu time spent up to now is 73.0 secs Computing kpt #: 20 total cpu time spent up to now is 74.8 secs Computing kpt #: 21 total cpu time spent up to now is 76.7 secs Computing kpt #: 22 total cpu time spent up to now is 78.6 secs Computing kpt #: 23 total cpu time spent up to now is 80.4 secs Computing kpt #: 24 total cpu time spent up to now is 82.3 secs Computing kpt #: 25 total cpu time spent up to now is 84.2 secs Computing kpt #: 26 total cpu time spent up to now is 86.1 secs Computing kpt #: 27 total cpu time spent up to now is 87.9 secs Computing kpt #: 28 total cpu time spent up to now is 89.8 secs Computing kpt #: 29 total cpu time spent up to now is 91.7 secs Computing kpt #: 30 total cpu time spent up to now is 93.5 secs Computing kpt #: 31 total cpu time spent up to now is 95.4 secs Computing kpt #: 32 total cpu time spent up to now is 97.6 secs Computing kpt #: 33 total cpu time spent up to now is 99.4 secs Computing kpt #: 34 total cpu time spent up to now is 101.4 secs Computing kpt #: 35 total cpu time spent up to now is 103.5 secs Computing kpt #: 36 total cpu time spent up to now is 105.4 secs Computing kpt #: 37 total cpu time spent up to now is 107.3 secs Computing kpt #: 38 total cpu time spent up to now is 109.2 secs Computing kpt #: 39 total cpu time spent up to now is 111.0 secs Computing kpt #: 40 total cpu time spent up to now is 112.7 secs Computing kpt #: 41 total cpu time spent up to now is 114.6 secs Computing kpt #: 42 total cpu time spent up to now is 116.3 secs Computing kpt #: 43 total cpu time spent up to now is 117.8 secs Computing kpt #: 44 total cpu time spent up to now is 119.7 secs Computing kpt #: 45 total cpu time spent up to now is 121.9 secs Computing kpt #: 46 total cpu time spent up to now is 123.9 secs Computing kpt #: 47 total cpu time spent up to now is 126.0 secs Computing kpt #: 48 total cpu time spent up to now is 128.0 secs Computing kpt #: 49 total cpu time spent up to now is 130.0 secs Computing kpt #: 50 total cpu time spent up to now is 132.5 secs Computing kpt #: 51 total cpu time spent up to now is 135.1 secs Computing kpt #: 52 total cpu time spent up to now is 138.4 secs Computing kpt #: 53 total cpu time spent up to now is 140.1 secs Computing kpt #: 54 total cpu time spent up to now is 141.9 secs Computing kpt #: 55 total cpu time spent up to now is 145.6 secs Computing kpt #: 56 total cpu time spent up to now is 147.9 secs Computing kpt #: 57 total cpu time spent up to now is 150.2 secs Computing kpt #: 58 total cpu time spent up to now is 153.0 secs Computing kpt #: 59 total cpu time spent up to now is 155.4 secs Computing kpt #: 60 total cpu time spent up to now is 157.8 secs Computing kpt #: 61 total cpu time spent up to now is 160.2 secs Computing kpt #: 62 total cpu time spent up to now is 163.0 secs Computing kpt #: 63 total cpu time spent up to now is 165.4 secs Computing kpt #: 64 total cpu time spent up to now is 167.7 secs Computing kpt #: 65 total cpu time spent up to now is 170.3 secs Computing kpt #: 66 total cpu time spent up to now is 173.8 secs Computing kpt #: 67 total cpu time spent up to now is 176.5 secs Computing kpt #: 68 total cpu time spent up to now is 180.0 secs Computing kpt #: 69 total cpu time spent up to now is 183.3 secs Computing kpt #: 70 total cpu time spent up to now is 185.7 secs Computing kpt #: 71 total cpu time spent up to now is 189.2 secs Computing kpt #: 72 total cpu time spent up to now is 191.7 secs Computing kpt #: 73 total cpu time spent up to now is 194.3 secs Computing kpt #: 74 total cpu time spent up to now is 196.8 secs Computing kpt #: 75 total cpu time spent up to now is 200.4 secs Computing kpt #: 76 total cpu time spent up to now is 202.8 secs Computing kpt #: 77 total cpu time spent up to now is 206.0 secs Computing kpt #: 78 total cpu time spent up to now is 208.9 secs Computing kpt #: 79 total cpu time spent up to now is 211.3 secs Computing kpt #: 80 total cpu time spent up to now is 213.7 secs Computing kpt #: 81 total cpu time spent up to now is 216.3 secs Computing kpt #: 82 total cpu time spent up to now is 218.7 secs Computing kpt #: 83 total cpu time spent up to now is 221.1 secs Computing kpt #: 84 total cpu time spent up to now is 223.5 secs Computing kpt #: 85 total cpu time spent up to now is 225.9 secs Computing kpt #: 86 total cpu time spent up to now is 228.2 secs Computing kpt #: 87 total cpu time spent up to now is 230.6 secs Computing kpt #: 88 total cpu time spent up to now is 232.8 secs Computing kpt #: 89 total cpu time spent up to now is 235.1 secs Computing kpt #: 90 total cpu time spent up to now is 237.3 secs Computing kpt #: 91 total cpu time spent up to now is 239.3 secs Computing kpt #: 92 total cpu time spent up to now is 241.5 secs Computing kpt #: 93 total cpu time spent up to now is 243.3 secs Computing kpt #: 94 total cpu time spent up to now is 245.1 secs Computing kpt #: 95 total cpu time spent up to now is 247.6 secs Computing kpt #: 96 total cpu time spent up to now is 249.5 secs Computing kpt #: 97 total cpu time spent up to now is 252.0 secs Computing kpt #: 98 total cpu time spent up to now is 254.4 secs Computing kpt #: 99 total cpu time spent up to now is 256.2 secs Computing kpt #: 100 total cpu time spent up to now is 258.1 secs Computing kpt #: 101 total cpu time spent up to now is 259.9 secs Computing kpt #: 102 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 264.3 secs Computing kpt #: 103 total cpu time spent up to now is 266.2 secs Computing kpt #: 104 total cpu time spent up to now is 268.0 secs Computing kpt #: 105 total cpu time spent up to now is 269.8 secs Computing kpt #: 106 total cpu time spent up to now is 271.4 secs Computing kpt #: 107 total cpu time spent up to now is 273.1 secs Computing kpt #: 108 total cpu time spent up to now is 274.9 secs Computing kpt #: 109 total cpu time spent up to now is 276.7 secs Computing kpt #: 110 total cpu time spent up to now is 278.7 secs Computing kpt #: 111 total cpu time spent up to now is 280.6 secs Computing kpt #: 112 total cpu time spent up to now is 283.0 secs Computing kpt #: 113 total cpu time spent up to now is 285.5 secs Computing kpt #: 114 total cpu time spent up to now is 287.9 secs Computing kpt #: 115 total cpu time spent up to now is 290.2 secs Computing kpt #: 116 total cpu time spent up to now is 292.1 secs Computing kpt #: 117 total cpu time spent up to now is 294.0 secs Computing kpt #: 118 total cpu time spent up to now is 295.8 secs Computing kpt #: 119 total cpu time spent up to now is 297.6 secs Computing kpt #: 120 total cpu time spent up to now is 299.4 secs Computing kpt #: 121 total cpu time spent up to now is 301.3 secs Computing kpt #: 122 total cpu time spent up to now is 303.1 secs Computing kpt #: 123 total cpu time spent up to now is 304.9 secs Computing kpt #: 124 total cpu time spent up to now is 306.8 secs Computing kpt #: 125 total cpu time spent up to now is 308.6 secs Computing kpt #: 126 total cpu time spent up to now is 310.4 secs Computing kpt #: 127 total cpu time spent up to now is 312.2 secs Computing kpt #: 128 total cpu time spent up to now is 313.9 secs Computing kpt #: 129 total cpu time spent up to now is 315.7 secs Computing kpt #: 130 total cpu time spent up to now is 317.5 secs Computing kpt #: 131 total cpu time spent up to now is 319.3 secs Computing kpt #: 132 total cpu time spent up to now is 321.0 secs Computing kpt #: 133 total cpu time spent up to now is 322.8 secs Computing kpt #: 134 total cpu time spent up to now is 324.6 secs Computing kpt #: 135 total cpu time spent up to now is 326.5 secs Computing kpt #: 136 total cpu time spent up to now is 328.3 secs Computing kpt #: 137 total cpu time spent up to now is 330.0 secs Computing kpt #: 138 total cpu time spent up to now is 331.9 secs Computing kpt #: 139 total cpu time spent up to now is 333.7 secs Computing kpt #: 140 total cpu time spent up to now is 335.4 secs Computing kpt #: 141 total cpu time spent up to now is 337.1 secs Computing kpt #: 142 total cpu time spent up to now is 338.7 secs Computing kpt #: 143 total cpu time spent up to now is 340.4 secs Computing kpt #: 144 total cpu time spent up to now is 342.0 secs Computing kpt #: 145 total cpu time spent up to now is 343.8 secs Computing kpt #: 146 total cpu time spent up to now is 345.7 secs Computing kpt #: 147 total cpu time spent up to now is 347.4 secs Computing kpt #: 148 total cpu time spent up to now is 349.2 secs Computing kpt #: 149 total cpu time spent up to now is 351.0 secs Computing kpt #: 150 total cpu time spent up to now is 352.7 secs Computing kpt #: 151 total cpu time spent up to now is 354.6 secs Computing kpt #: 152 total cpu time spent up to now is 356.3 secs Computing kpt #: 153 total cpu time spent up to now is 358.0 secs Computing kpt #: 154 total cpu time spent up to now is 359.6 secs Computing kpt #: 155 total cpu time spent up to now is 361.4 secs Computing kpt #: 156 total cpu time spent up to now is 363.0 secs Computing kpt #: 157 total cpu time spent up to now is 364.7 secs Computing kpt #: 158 total cpu time spent up to now is 366.4 secs Computing kpt #: 159 total cpu time spent up to now is 368.1 secs Computing kpt #: 160 total cpu time spent up to now is 369.8 secs Computing kpt #: 161 total cpu time spent up to now is 371.3 secs Computing kpt #: 162 total cpu time spent up to now is 372.9 secs Computing kpt #: 163 total cpu time spent up to now is 374.5 secs Computing kpt #: 164 total cpu time spent up to now is 376.0 secs Computing kpt #: 165 total cpu time spent up to now is 377.6 secs Computing kpt #: 166 total cpu time spent up to now is 379.1 secs Computing kpt #: 167 total cpu time spent up to now is 380.7 secs Computing kpt #: 168 total cpu time spent up to now is 382.1 secs Computing kpt #: 169 total cpu time spent up to now is 383.7 secs Computing kpt #: 170 total cpu time spent up to now is 385.2 secs Computing kpt #: 171 total cpu time spent up to now is 386.7 secs Computing kpt #: 172 total cpu time spent up to now is 388.2 secs Computing kpt #: 173 total cpu time spent up to now is 389.7 secs Computing kpt #: 174 total cpu time spent up to now is 391.3 secs Computing kpt #: 175 total cpu time spent up to now is 392.9 secs Computing kpt #: 176 total cpu time spent up to now is 394.6 secs Computing kpt #: 177 total cpu time spent up to now is 396.2 secs Computing kpt #: 178 total cpu time spent up to now is 397.8 secs Computing kpt #: 179 total cpu time spent up to now is 399.3 secs Computing kpt #: 180 total cpu time spent up to now is 400.9 secs Computing kpt #: 181 total cpu time spent up to now is 402.4 secs Computing kpt #: 182 total cpu time spent up to now is 404.0 secs Computing kpt #: 183 total cpu time spent up to now is 405.6 secs Computing kpt #: 184 total cpu time spent up to now is 407.1 secs Computing kpt #: 185 total cpu time spent up to now is 408.7 secs Computing kpt #: 186 total cpu time spent up to now is 410.2 secs Computing kpt #: 187 total cpu time spent up to now is 411.8 secs Computing kpt #: 188 total cpu time spent up to now is 413.4 secs Computing kpt #: 189 total cpu time spent up to now is 415.1 secs Computing kpt #: 190 total cpu time spent up to now is 416.7 secs Computing kpt #: 191 total cpu time spent up to now is 418.4 secs Computing kpt #: 192 total cpu time spent up to now is 420.2 secs Computing kpt #: 193 total cpu time spent up to now is 422.0 secs Computing kpt #: 194 total cpu time spent up to now is 423.8 secs Computing kpt #: 195 total cpu time spent up to now is 425.2 secs Computing kpt #: 196 total cpu time spent up to now is 426.8 secs Computing kpt #: 197 total cpu time spent up to now is 428.7 secs Computing kpt #: 198 total cpu time spent up to now is 430.5 secs Computing kpt #: 199 total cpu time spent up to now is 432.3 secs Computing kpt #: 200 total cpu time spent up to now is 434.2 secs Computing kpt #: 201 total cpu time spent up to now is 436.0 secs Computing kpt #: 202 total cpu time spent up to now is 437.8 secs Computing kpt #: 203 total cpu time spent up to now is 439.6 secs Computing kpt #: 204 total cpu time spent up to now is 441.7 secs Computing kpt #: 205 total cpu time spent up to now is 443.5 secs Computing kpt #: 206 total cpu time spent up to now is 445.3 secs Computing kpt #: 207 total cpu time spent up to now is 447.1 secs Computing kpt #: 208 total cpu time spent up to now is 449.1 secs Computing kpt #: 209 total cpu time spent up to now is 450.9 secs Computing kpt #: 210 total cpu time spent up to now is 452.9 secs Computing kpt #: 211 total cpu time spent up to now is 454.6 secs Computing kpt #: 212 total cpu time spent up to now is 456.2 secs Computing kpt #: 213 total cpu time spent up to now is 457.9 secs Computing kpt #: 214 total cpu time spent up to now is 459.6 secs Computing kpt #: 215 total cpu time spent up to now is 461.4 secs Computing kpt #: 216 total cpu time spent up to now is 463.0 secs Computing kpt #: 217 total cpu time spent up to now is 464.5 secs Computing kpt #: 218 total cpu time spent up to now is 466.2 secs Computing kpt #: 219 total cpu time spent up to now is 468.0 secs Computing kpt #: 220 total cpu time spent up to now is 469.7 secs Computing kpt #: 221 total cpu time spent up to now is 471.3 secs Computing kpt #: 222 total cpu time spent up to now is 472.9 secs Computing kpt #: 223 total cpu time spent up to now is 474.7 secs Computing kpt #: 224 total cpu time spent up to now is 476.6 secs Computing kpt #: 225 total cpu time spent up to now is 479.4 secs Computing kpt #: 226 total cpu time spent up to now is 482.3 secs Computing kpt #: 227 total cpu time spent up to now is 484.4 secs Computing kpt #: 228 total cpu time spent up to now is 486.5 secs Computing kpt #: 229 total cpu time spent up to now is 488.4 secs Computing kpt #: 230 total cpu time spent up to now is 490.3 secs Computing kpt #: 231 total cpu time spent up to now is 492.3 secs Computing kpt #: 232 total cpu time spent up to now is 494.3 secs Computing kpt #: 233 total cpu time spent up to now is 496.5 secs Computing kpt #: 234 total cpu time spent up to now is 498.7 secs Computing kpt #: 235 total cpu time spent up to now is 501.0 secs Computing kpt #: 236 total cpu time spent up to now is 503.4 secs Computing kpt #: 237 total cpu time spent up to now is 505.8 secs Computing kpt #: 238 total cpu time spent up to now is 508.5 secs Computing kpt #: 239 total cpu time spent up to now is 511.0 secs Computing kpt #: 240 total cpu time spent up to now is 513.1 secs Computing kpt #: 241 total cpu time spent up to now is 515.3 secs Computing kpt #: 242 total cpu time spent up to now is 517.4 secs Computing kpt #: 243 total cpu time spent up to now is 519.4 secs Computing kpt #: 244 total cpu time spent up to now is 521.3 secs Computing kpt #: 245 total cpu time spent up to now is 523.3 secs Computing kpt #: 246 total cpu time spent up to now is 525.2 secs Computing kpt #: 247 total cpu time spent up to now is 527.1 secs Computing kpt #: 248 total cpu time spent up to now is 528.9 secs Computing kpt #: 249 total cpu time spent up to now is 530.6 secs Computing kpt #: 250 total cpu time spent up to now is 532.5 secs Computing kpt #: 251 total cpu time spent up to now is 534.2 secs Computing kpt #: 252 total cpu time spent up to now is 536.2 secs Computing kpt #: 253 total cpu time spent up to now is 538.1 secs Computing kpt #: 254 total cpu time spent up to now is 540.0 secs Computing kpt #: 255 total cpu time spent up to now is 541.8 secs Computing kpt #: 256 total cpu time spent up to now is 543.6 secs Computing kpt #: 257 total cpu time spent up to now is 545.5 secs Computing kpt #: 258 total cpu time spent up to now is 547.3 secs Computing kpt #: 259 total cpu time spent up to now is 549.1 secs Computing kpt #: 260 total cpu time spent up to now is 550.9 secs Computing kpt #: 261 total cpu time spent up to now is 552.7 secs Computing kpt #: 262 total cpu time spent up to now is 554.7 secs Computing kpt #: 263 total cpu time spent up to now is 556.6 secs Computing kpt #: 264 total cpu time spent up to now is 559.1 secs Computing kpt #: 265 total cpu time spent up to now is 561.2 secs Computing kpt #: 266 total cpu time spent up to now is 563.3 secs Computing kpt #: 267 total cpu time spent up to now is 565.5 secs Computing kpt #: 268 total cpu time spent up to now is 567.6 secs Computing kpt #: 269 total cpu time spent up to now is 570.0 secs Computing kpt #: 270 total cpu time spent up to now is 572.3 secs Computing kpt #: 271 total cpu time spent up to now is 574.6 secs Computing kpt #: 272 total cpu time spent up to now is 577.1 secs Computing kpt #: 273 total cpu time spent up to now is 579.5 secs Computing kpt #: 274 total cpu time spent up to now is 581.2 secs Computing kpt #: 275 total cpu time spent up to now is 583.1 secs Computing kpt #: 276 total cpu time spent up to now is 584.9 secs Computing kpt #: 277 total cpu time spent up to now is 586.6 secs Computing kpt #: 278 total cpu time spent up to now is 588.4 secs Computing kpt #: 279 total cpu time spent up to now is 590.2 secs Computing kpt #: 280 total cpu time spent up to now is 592.1 secs Computing kpt #: 281 total cpu time spent up to now is 593.8 secs Computing kpt #: 282 total cpu time spent up to now is 595.8 secs Computing kpt #: 283 total cpu time spent up to now is 597.7 secs Computing kpt #: 284 total cpu time spent up to now is 599.5 secs Computing kpt #: 285 total cpu time spent up to now is 601.4 secs Computing kpt #: 286 total cpu time spent up to now is 603.3 secs Computing kpt #: 287 total cpu time spent up to now is 605.1 secs Computing kpt #: 288 total cpu time spent up to now is 607.7 secs Computing kpt #: 289 total cpu time spent up to now is 610.4 secs Computing kpt #: 290 total cpu time spent up to now is 612.6 secs Computing kpt #: 291 total cpu time spent up to now is 614.7 secs Computing kpt #: 292 total cpu time spent up to now is 616.9 secs Computing kpt #: 293 total cpu time spent up to now is 619.0 secs Computing kpt #: 294 total cpu time spent up to now is 620.9 secs Computing kpt #: 295 total cpu time spent up to now is 622.9 secs Computing kpt #: 296 total cpu time spent up to now is 624.7 secs Computing kpt #: 297 total cpu time spent up to now is 626.8 secs Computing kpt #: 298 total cpu time spent up to now is 628.8 secs Computing kpt #: 299 total cpu time spent up to now is 630.7 secs Computing kpt #: 300 total cpu time spent up to now is 632.4 secs Computing kpt #: 301 total cpu time spent up to now is 634.3 secs Computing kpt #: 302 total cpu time spent up to now is 636.1 secs Computing kpt #: 303 total cpu time spent up to now is 638.0 secs Computing kpt #: 304 total cpu time spent up to now is 639.9 secs Computing kpt #: 305 total cpu time spent up to now is 641.8 secs Computing kpt #: 306 total cpu time spent up to now is 643.6 secs Computing kpt #: 307 total cpu time spent up to now is 645.7 secs Computing kpt #: 308 total cpu time spent up to now is 647.6 secs Computing kpt #: 309 total cpu time spent up to now is 649.4 secs Computing kpt #: 310 total cpu time spent up to now is 651.5 secs Computing kpt #: 311 total cpu time spent up to now is 653.6 secs Computing kpt #: 312 total cpu time spent up to now is 655.7 secs Computing kpt #: 313 total cpu time spent up to now is 657.8 secs Computing kpt #: 314 total cpu time spent up to now is 660.2 secs Computing kpt #: 315 total cpu time spent up to now is 662.6 secs Computing kpt #: 316 total cpu time spent up to now is 665.0 secs Computing kpt #: 317 total cpu time spent up to now is 667.4 secs Computing kpt #: 318 total cpu time spent up to now is 669.8 secs Computing kpt #: 319 total cpu time spent up to now is 673.3 secs Computing kpt #: 320 total cpu time spent up to now is 676.6 secs Computing kpt #: 321 total cpu time spent up to now is 680.6 secs Computing kpt #: 322 total cpu time spent up to now is 683.9 secs Computing kpt #: 323 total cpu time spent up to now is 687.3 secs Computing kpt #: 324 total cpu time spent up to now is 690.7 secs Computing kpt #: 325 total cpu time spent up to now is 694.0 secs Computing kpt #: 326 total cpu time spent up to now is 696.4 secs Computing kpt #: 327 total cpu time spent up to now is 699.3 secs Computing kpt #: 328 total cpu time spent up to now is 702.1 secs Computing kpt #: 329 total cpu time spent up to now is 704.5 secs Computing kpt #: 330 total cpu time spent up to now is 706.9 secs Computing kpt #: 331 total cpu time spent up to now is 709.4 secs Computing kpt #: 332 total cpu time spent up to now is 711.8 secs Computing kpt #: 333 total cpu time spent up to now is 714.5 secs Computing kpt #: 334 total cpu time spent up to now is 717.0 secs Computing kpt #: 335 total cpu time spent up to now is 719.4 secs Computing kpt #: 336 total cpu time spent up to now is 721.7 secs Computing kpt #: 337 total cpu time spent up to now is 724.0 secs Computing kpt #: 338 total cpu time spent up to now is 726.4 secs Computing kpt #: 339 total cpu time spent up to now is 728.7 secs Computing kpt #: 340 total cpu time spent up to now is 731.0 secs Computing kpt #: 341 total cpu time spent up to now is 733.3 secs Computing kpt #: 342 total cpu time spent up to now is 735.5 secs Computing kpt #: 343 total cpu time spent up to now is 737.8 secs Computing kpt #: 344 total cpu time spent up to now is 740.2 secs Computing kpt #: 345 total cpu time spent up to now is 742.4 secs Computing kpt #: 346 total cpu time spent up to now is 744.9 secs Computing kpt #: 347 total cpu time spent up to now is 747.2 secs Computing kpt #: 348 total cpu time spent up to now is 749.4 secs Computing kpt #: 349 total cpu time spent up to now is 751.7 secs Computing kpt #: 350 total cpu time spent up to now is 753.9 secs Computing kpt #: 351 total cpu time spent up to now is 756.3 secs Computing kpt #: 352 total cpu time spent up to now is 758.1 secs Computing kpt #: 353 total cpu time spent up to now is 760.4 secs Computing kpt #: 354 total cpu time spent up to now is 762.2 secs Computing kpt #: 355 total cpu time spent up to now is 764.0 secs Computing kpt #: 356 total cpu time spent up to now is 765.5 secs Computing kpt #: 357 total cpu time spent up to now is 767.3 secs Computing kpt #: 358 total cpu time spent up to now is 769.7 secs Computing kpt #: 359 total cpu time spent up to now is 772.2 secs Computing kpt #: 360 total cpu time spent up to now is 774.6 secs Computing kpt #: 361 total cpu time spent up to now is 777.5 secs Computing kpt #: 362 total cpu time spent up to now is 780.2 secs Computing kpt #: 363 total cpu time spent up to now is 782.8 secs Computing kpt #: 364 total cpu time spent up to now is 785.3 secs Computing kpt #: 365 total cpu time spent up to now is 787.9 secs Computing kpt #: 366 total cpu time spent up to now is 790.4 secs Computing kpt #: 367 total cpu time spent up to now is 793.5 secs Computing kpt #: 368 total cpu time spent up to now is 796.0 secs Computing kpt #: 369 total cpu time spent up to now is 798.5 secs Computing kpt #: 370 total cpu time spent up to now is 801.1 secs Computing kpt #: 371 total cpu time spent up to now is 803.5 secs Computing kpt #: 372 total cpu time spent up to now is 806.0 secs Computing kpt #: 373 total cpu time spent up to now is 808.5 secs Computing kpt #: 374 total cpu time spent up to now is 811.2 secs Computing kpt #: 375 total cpu time spent up to now is 813.7 secs Computing kpt #: 376 total cpu time spent up to now is 818.0 secs Computing kpt #: 377 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 822.7 secs Computing kpt #: 378 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 827.0 secs ethr = 2.08E-11, avg # of iterations = 35.3 total cpu time spent up to now is 827.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3281 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0737 -30.0246 -30.0246 -29.8054 -29.8054 -29.7552 -29.7552 -29.7508 -29.7508 -29.7213 -29.7213 -9.7064 -9.7064 -4.5943 -4.5943 -4.2771 -4.2771 -4.2747 -4.2747 -3.2953 -3.2953 2.2258 2.2258 2.2271 2.2271 2.6294 2.6294 4.0536 4.0536 4.9932 4.9932 6.1871 6.1871 7.7136 7.7136 7.7161 7.7161 9.0827 9.0827 9.2935 9.2935 9.3072 9.3072 13.1763 13.1763 15.4689 15.4689 15.7808 15.7808 15.7883 15.7883 17.5184 17.5184 k = 0.0000 0.0000 0.0149 ( 3279 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0736 -30.0247 -30.0245 -29.8055 -29.8053 -29.7553 -29.7553 -29.7509 -29.7507 -29.7213 -29.7213 -9.7056 -9.7056 -4.5947 -4.5946 -4.2820 -4.2819 -4.2764 -4.2763 -3.2894 -3.2894 2.2206 2.2208 2.2265 2.2266 2.6330 2.6331 4.0576 4.0578 4.9925 4.9928 6.1886 6.1887 7.7129 7.7133 7.7157 7.7158 9.0810 9.0815 9.2914 9.2919 9.3056 9.3056 13.1791 13.1792 15.4715 15.4715 15.7804 15.7804 15.7878 15.7880 17.5200 17.5202 k = 0.0000 0.0000 0.0298 ( 3275 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0735 -30.0248 -30.0244 -29.8056 -29.8052 -29.7554 -29.7554 -29.7507 -29.7505 -29.7213 -29.7213 -9.7032 -9.7032 -4.5958 -4.5956 -4.2987 -4.2985 -4.2789 -4.2787 -3.2721 -3.2721 2.2043 2.2046 2.2265 2.2266 2.6433 2.6435 4.0699 4.0704 4.9907 4.9913 6.1932 6.1934 7.7106 7.7114 7.7153 7.7154 9.0764 9.0774 9.2841 9.2851 9.3024 9.3026 13.1878 13.1880 15.4791 15.4791 15.7789 15.7790 15.7864 15.7867 17.5250 17.5254 k = 0.0000 0.0000 0.0448 ( 3279 PWs) bands (ev): -63.0902 -63.0902 -63.0758 -63.0758 -30.0738 -30.0734 -30.0250 -30.0244 -29.8057 -29.8050 -29.7557 -29.7557 -29.7505 -29.7502 -29.7213 -29.7213 -9.6992 -9.6992 -4.5977 -4.5974 -4.3255 -4.3252 -4.2826 -4.2825 -3.2445 -3.2445 2.1786 2.1791 2.2266 2.2267 2.6592 2.6596 4.0902 4.0909 4.9878 4.9887 6.2009 6.2013 7.7064 7.7074 7.7151 7.7152 9.0689 9.0704 9.2697 9.2713 9.2998 9.3000 13.2022 13.2025 15.4915 15.4916 15.7763 15.7765 15.7843 15.7847 17.5333 17.5338 k = 0.0000 0.0000 0.0597 ( 3277 PWs) bands (ev): -63.0902 -63.0902 -63.0758 -63.0758 -30.0738 -30.0733 -30.0252 -30.0244 -29.8057 -29.8049 -29.7561 -29.7560 -29.7503 -29.7499 -29.7213 -29.7213 -9.6935 -9.6935 -4.6005 -4.6002 -4.3605 -4.3602 -4.2879 -4.2876 -3.2082 -3.2081 2.1455 2.1460 2.2268 2.2270 2.6793 2.6797 4.1182 4.1190 4.9838 4.9849 6.2117 6.2122 7.7006 7.7019 7.7149 7.7149 9.0583 9.0605 9.2488 9.2509 9.2975 9.2977 13.2223 13.2227 15.5085 15.5086 15.7724 15.7729 15.7819 15.7823 17.5447 17.5454 k = 0.0000 0.0000 0.0746 ( 3289 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0738 -30.0732 -30.0255 -30.0244 -29.8058 -29.8047 -29.7565 -29.7564 -29.7500 -29.7495 -29.7214 -29.7214 -9.6863 -9.6863 -4.6048 -4.6044 -4.4018 -4.4014 -4.2945 -4.2942 -3.1646 -3.1645 2.1063 2.1070 2.2271 2.2273 2.7022 2.7028 4.1532 4.1543 4.9784 4.9798 6.2255 6.2261 7.6935 7.6950 7.7145 7.7145 9.0448 9.0477 9.2222 9.2250 9.2951 9.2953 13.2478 13.2483 15.5295 15.5297 15.7673 15.7679 15.7791 15.7794 17.5585 17.5593 k = 0.0000 0.0000 0.0895 ( 3289 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0738 -30.0731 -30.0257 -30.0245 -29.8058 -29.8045 -29.7570 -29.7568 -29.7496 -29.7491 -29.7215 -29.7215 -9.6775 -9.6775 -4.6113 -4.6109 -4.4470 -4.4466 -4.3025 -4.3021 -3.1152 -3.1151 2.0626 2.0633 2.2276 2.2278 2.7274 2.7281 4.1948 4.1961 4.9718 4.9733 6.2422 6.2430 7.6853 7.6870 7.7136 7.7137 9.0281 9.0319 9.1906 9.1943 9.2925 9.2926 13.2787 13.2793 15.5540 15.5541 15.7611 15.7618 15.7760 15.7762 17.5698 17.5711 k = 0.0000 0.0000 0.1044 ( 3293 PWs) bands (ev): -63.0901 -63.0901 -63.0759 -63.0759 -30.0737 -30.0729 -30.0260 -30.0246 -29.8058 -29.8043 -29.7575 -29.7572 -29.7493 -29.7487 -29.7215 -29.7215 -9.6670 -9.6670 -4.6221 -4.6218 -4.4927 -4.4924 -4.3118 -4.3114 -3.0613 -3.0612 2.0152 2.0160 2.2283 2.2286 2.7542 2.7551 4.2424 4.2438 4.9637 4.9655 6.2619 6.2628 7.6762 7.6781 7.7119 7.7121 9.0082 9.0131 9.1551 9.1597 9.2895 9.2896 13.3147 13.3153 15.5808 15.5809 15.7543 15.7551 15.7726 15.7728 17.5617 17.5645 k = 0.0000 0.0000 0.1193 ( 3289 PWs) bands (ev): -63.0901 -63.0901 -63.0760 -63.0760 -30.0737 -30.0727 -30.0263 -30.0246 -29.8057 -29.8040 -29.7580 -29.7576 -29.7489 -29.7482 -29.7216 -29.7216 -9.6550 -9.6550 -4.6420 -4.6418 -4.5332 -4.5331 -4.3224 -4.3219 -3.0038 -3.0038 1.9650 1.9658 2.2293 2.2296 2.7824 2.7833 4.2954 4.2970 4.9541 4.9561 6.2844 6.2854 7.6667 7.6688 7.7093 7.7096 8.9847 8.9909 9.1165 9.1224 9.2861 9.2863 13.3556 13.3563 15.6085 15.6087 15.7479 15.7485 15.7690 15.7692 17.5411 17.5445 k = 0.0000 0.0000 0.1343 ( 3285 PWs) bands (ev): -63.0900 -63.0900 -63.0760 -63.0760 -30.0736 -30.0725 -30.0266 -30.0248 -29.8056 -29.8038 -29.7585 -29.7581 -29.7485 -29.7478 -29.7217 -29.7217 -9.6415 -9.6414 -4.6769 -4.6768 -4.5620 -4.5618 -4.3342 -4.3337 -2.9436 -2.9436 1.9126 1.9135 2.2306 2.2309 2.8116 2.8127 4.3531 4.3549 4.9429 4.9450 6.3097 6.3108 7.6570 7.6592 7.7054 7.7057 8.9571 8.9649 9.0762 9.0837 9.2825 9.2826 13.4012 13.4019 15.6339 15.6347 15.7444 15.7444 15.7653 15.7655 17.5199 17.5234 k = 0.0000 0.0000 0.1492 ( 3289 PWs) bands (ev): -63.0900 -63.0900 -63.0761 -63.0761 -30.0735 -30.0723 -30.0270 -30.0249 -29.8056 -29.8035 -29.7590 -29.7585 -29.7481 -29.7473 -29.7218 -29.7218 -9.6263 -9.6263 -4.7263 -4.7260 -4.5792 -4.5787 -4.3472 -4.3467 -2.8812 -2.8812 1.8585 1.8594 2.2323 2.2326 2.8418 2.8430 4.4151 4.4170 4.9299 4.9322 6.3376 6.3388 7.6475 7.6498 7.6996 7.7000 8.9251 8.9344 9.0359 9.0448 9.2784 9.2786 13.4510 13.4518 15.6515 15.6533 15.7476 15.7486 15.7616 15.7617 17.5006 17.5041 k = 0.0000 0.0000 0.1641 ( 3285 PWs) bands (ev): -63.0899 -63.0899 -63.0761 -63.0761 -30.0734 -30.0721 -30.0273 -30.0251 -29.8055 -29.8032 -29.7596 -29.7590 -29.7476 -29.7469 -29.7218 -29.7218 -9.6096 -9.6096 -4.7840 -4.7836 -4.5900 -4.5894 -4.3613 -4.3607 -2.8172 -2.8172 1.8032 1.8041 2.2345 2.2348 2.8730 2.8743 4.4808 4.4828 4.9152 4.9175 6.3680 6.3693 7.6385 7.6408 7.6916 7.6921 8.8882 8.8987 8.9973 9.0073 9.2741 9.2743 13.5050 13.5058 15.6559 15.6586 15.7562 15.7563 15.7653 15.7670 17.4842 17.4876 k = 0.0000 0.0000 0.1790 ( 3289 PWs) bands (ev): -63.0899 -63.0899 -63.0762 -63.0762 -30.0733 -30.0719 -30.0277 -30.0253 -29.8054 -29.8029 -29.7602 -29.7595 -29.7472 -29.7464 -29.7220 -29.7219 -9.5914 -9.5914 -4.8462 -4.8457 -4.5981 -4.5974 -4.3764 -4.3757 -2.7518 -2.7518 1.7469 1.7478 2.2372 2.2375 2.9049 2.9063 4.5497 4.5519 4.8984 4.9008 6.4008 6.4022 7.6303 7.6326 7.6807 7.6813 8.8470 8.8579 8.9614 8.9718 9.2695 9.2697 13.5627 13.5635 15.6490 15.6521 15.7530 15.7531 15.7914 15.7939 17.4709 17.4742 k = 0.0000 0.0000 0.1939 ( 3293 PWs) bands (ev): -63.0898 -63.0898 -63.0763 -63.0763 -30.0732 -30.0716 -30.0282 -30.0255 -29.8052 -29.8026 -29.7608 -29.7600 -29.7468 -29.7460 -29.7221 -29.7220 -9.5716 -9.5716 -4.9109 -4.9103 -4.6051 -4.6043 -4.3924 -4.3917 -2.6855 -2.6854 1.6900 1.6909 2.2405 2.2408 2.9375 2.9390 4.6214 4.6237 4.8798 4.8821 6.4359 6.4374 7.6232 7.6254 7.6664 7.6671 8.8022 8.8131 8.9284 8.9385 9.2646 9.2648 13.6238 13.6246 15.6357 15.6390 15.7494 15.7496 15.8234 15.8262 17.4610 17.4641 k = 0.0000 0.0000 0.2088 ( 3299 PWs) bands (ev): -63.0897 -63.0897 -63.0764 -63.0764 -30.0730 -30.0714 -30.0286 -30.0258 -29.8051 -29.8023 -29.7613 -29.7605 -29.7464 -29.7455 -29.7222 -29.7222 -9.5504 -9.5504 -4.9772 -4.9766 -4.6116 -4.6108 -4.4092 -4.4085 -2.6183 -2.6183 1.6327 1.6337 2.2444 2.2448 2.9708 2.9723 4.6956 4.6979 4.8591 4.8614 6.4730 6.4747 7.6175 7.6196 7.6481 7.6489 8.7554 8.7658 8.8977 8.9074 9.2594 9.2596 13.6880 13.6889 15.6188 15.6222 15.7461 15.7464 15.8572 15.8603 17.4546 17.4575 k = 0.0000 0.0000 0.2238 ( 3299 PWs) bands (ev): -63.0896 -63.0896 -63.0765 -63.0765 -30.0729 -30.0711 -30.0291 -30.0261 -29.8049 -29.8019 -29.7619 -29.7610 -29.7460 -29.7451 -29.7223 -29.7223 -9.5276 -9.5276 -5.0446 -5.0440 -4.6181 -4.6172 -4.4268 -4.4261 -2.5506 -2.5506 1.5754 1.5763 2.2492 2.2495 3.0045 3.0061 4.7717 4.7742 4.8363 4.8386 6.5122 6.5140 7.6134 7.6156 7.6254 7.6262 8.7077 8.7175 8.8692 8.8782 9.2539 9.2542 13.7550 13.7559 15.5996 15.6030 15.7434 15.7437 15.8912 15.8945 17.4516 17.4543 k = 0.0000 0.0000 0.2387 ( 3291 PWs) bands (ev): -63.0895 -63.0895 -63.0765 -63.0765 -30.0727 -30.0708 -30.0295 -30.0264 -29.8047 -29.8016 -29.7625 -29.7614 -29.7456 -29.7446 -29.7224 -29.7224 -9.5034 -9.5034 -5.1127 -5.1121 -4.6246 -4.6236 -4.4451 -4.4444 -2.4825 -2.4825 1.5180 1.5189 2.2547 2.2550 3.0386 3.0403 4.8116 4.8138 4.8496 4.8522 6.5531 6.5550 7.5967 7.5982 7.6120 7.6134 8.6601 8.6694 8.8427 8.8511 9.2483 9.2486 13.8245 13.8253 15.5787 15.5821 15.7414 15.7418 15.9246 15.9282 17.4514 17.4533 k = 0.0000 0.0000 0.2536 ( 3295 PWs) bands (ev): -63.0894 -63.0894 -63.0766 -63.0766 -30.0725 -30.0705 -30.0300 -30.0267 -29.8045 -29.8012 -29.7631 -29.7619 -29.7452 -29.7442 -29.7226 -29.7225 -9.4777 -9.4777 -5.1815 -5.1809 -4.6312 -4.6302 -4.4640 -4.4632 -2.4141 -2.4140 1.4609 1.4617 2.2610 2.2614 3.0728 3.0745 4.7851 4.7872 4.9288 4.9315 6.5956 6.5976 7.5633 7.5647 7.6119 7.6133 8.6133 8.6221 8.8185 8.8263 9.2424 9.2428 13.8958 13.8966 15.5565 15.5598 15.7405 15.7410 15.9568 15.9606 17.4288 17.4314 k = 0.0000 0.0000 0.2685 ( 3299 PWs) bands (ev): -63.0893 -63.0893 -63.0767 -63.0767 -30.0723 -30.0702 -30.0305 -30.0271 -29.8043 -29.8008 -29.7637 -29.7625 -29.7448 -29.7438 -29.7227 -29.7227 -9.4507 -9.4506 -5.2506 -5.2500 -4.6381 -4.6371 -4.4833 -4.4826 -2.3455 -2.3454 1.4041 1.4049 2.2682 2.2686 3.1070 3.1088 4.7567 4.7587 5.0091 5.0119 6.6395 6.6416 7.5239 7.5255 7.6143 7.6155 8.5678 8.5761 8.7971 8.8043 9.2363 9.2367 13.9688 13.9696 15.5333 15.5366 15.7409 15.7415 15.9875 15.9916 17.4058 17.4083 k = 0.0000 0.0000 0.2834 ( 3295 PWs) bands (ev): -63.0892 -63.0892 -63.0768 -63.0768 -30.0721 -30.0699 -30.0311 -30.0274 -29.8041 -29.8004 -29.7643 -29.7629 -29.7443 -29.7433 -29.7229 -29.7228 -9.4221 -9.4221 -5.3200 -5.3194 -4.6452 -4.6442 -4.5031 -4.5023 -2.2768 -2.2767 1.3478 1.3486 2.2764 2.2768 3.1409 3.1428 4.7267 4.7285 5.0901 5.0931 6.6845 6.6867 7.4788 7.4806 7.6192 7.6201 8.5237 8.5316 8.7788 8.7854 9.2300 9.2305 14.0430 14.0438 15.5092 15.5125 15.7429 15.7436 16.0166 16.0209 17.3852 17.3875 k = 0.0000 0.0000 0.2983 ( 3291 PWs) bands (ev): -63.0891 -63.0891 -63.0769 -63.0769 -30.0718 -30.0695 -30.0316 -30.0278 -29.8038 -29.8000 -29.7649 -29.7634 -29.7439 -29.7429 -29.7230 -29.7230 -9.3923 -9.3922 -5.3895 -5.3889 -4.6526 -4.6516 -4.5232 -4.5224 -2.2081 -2.2080 1.2920 1.2928 2.2855 2.2859 3.1745 3.1763 4.6953 4.6969 5.1717 5.1748 6.7303 6.7327 7.4282 7.4301 7.6266 7.6272 8.4810 8.4884 8.7640 8.7701 9.2236 9.2242 14.1179 14.1186 15.4846 15.4878 15.7470 15.7477 16.0439 16.0484 17.3667 17.3689 k = 0.0000 0.0000 0.3133 ( 3287 PWs) bands (ev): -63.0890 -63.0890 -63.0771 -63.0771 -30.0716 -30.0691 -30.0322 -30.0282 -29.8035 -29.7996 -29.7655 -29.7639 -29.7435 -29.7425 -29.7232 -29.7231 -9.3610 -9.3610 -5.4591 -5.4586 -4.6603 -4.6593 -4.5435 -4.5428 -2.1394 -2.1394 1.2369 1.2377 2.2956 2.2960 3.2073 3.2092 4.6626 4.6640 5.2534 5.2566 6.7767 6.7792 7.3724 7.3745 7.6367 7.6369 8.4397 8.4465 8.7529 8.7585 9.2170 9.2177 14.1929 14.1937 15.4595 15.4626 15.7535 15.7543 16.0695 16.0742 17.3503 17.3524 k = 0.0000 0.0000 0.3282 ( 3291 PWs) bands (ev): -63.0889 -63.0889 -63.0772 -63.0772 -30.0713 -30.0687 -30.0328 -30.0287 -29.8032 -29.7992 -29.7662 -29.7645 -29.7431 -29.7421 -29.7234 -29.7233 -9.3284 -9.3284 -5.5288 -5.5282 -4.6683 -4.6673 -4.5640 -4.5632 -2.0709 -2.0709 1.1826 1.1833 2.3066 2.3070 3.2393 3.2411 4.6290 4.6302 5.3350 5.3383 6.8233 6.8260 7.3119 7.3142 7.6493 7.6494 8.3996 8.4059 8.7456 8.7508 9.2104 9.2111 14.2676 14.2683 15.4341 15.4372 15.7628 15.7639 16.0932 16.0981 17.3358 17.3378 k = 0.0000 0.0000 0.3431 ( 3291 PWs) bands (ev): -63.0888 -63.0888 -63.0773 -63.0773 -30.0710 -30.0684 -30.0333 -30.0291 -29.8029 -29.7988 -29.7668 -29.7650 -29.7427 -29.7416 -29.7236 -29.7234 -9.2945 -9.2944 -5.5984 -5.5978 -4.6766 -4.6756 -4.5846 -4.5838 -2.0026 -2.0025 1.1290 1.1297 2.3186 2.3190 3.2700 3.2718 4.5948 4.5957 5.4162 5.4197 6.8698 6.8726 7.2476 7.2500 7.6644 7.6650 8.3608 8.3667 8.7421 8.7468 9.2037 9.2044 14.3412 14.3418 15.4085 15.4116 15.7757 15.7768 16.1153 16.1204 17.3232 17.3251 k = 0.0000 0.0000 0.3580 ( 3291 PWs) bands (ev): -63.0886 -63.0886 -63.0774 -63.0774 -30.0708 -30.0680 -30.0339 -30.0296 -29.8026 -29.7983 -29.7674 -29.7655 -29.7423 -29.7412 -29.7237 -29.7236 -9.2593 -9.2592 -5.6679 -5.6674 -4.6852 -4.6842 -4.6051 -4.6043 -1.9345 -1.9344 1.0764 1.0770 2.3316 2.3319 3.2993 3.3011 4.5601 4.5608 5.4967 5.5003 6.9159 6.9188 7.1799 7.1825 7.6825 7.6834 8.3235 8.3290 8.7420 8.7463 9.1969 9.1977 14.4131 14.4138 15.3830 15.3860 15.7925 15.7939 16.1358 16.1411 17.3122 17.3140 k = 0.0000 0.0000 0.3729 ( 3283 PWs) bands (ev): -63.0885 -63.0885 -63.0776 -63.0776 -30.0704 -30.0675 -30.0345 -30.0301 -29.8023 -29.7979 -29.7680 -29.7660 -29.7419 -29.7408 -29.7239 -29.7237 -9.2229 -9.2228 -5.7373 -5.7368 -4.6941 -4.6930 -4.6255 -4.6248 -1.8667 -1.8666 1.0247 1.0252 2.3454 2.3458 3.3270 3.3287 4.5255 4.5259 5.5761 5.5799 6.9609 6.9640 7.1095 7.1123 7.7034 7.7047 8.2880 8.2931 8.7452 8.7491 9.1901 9.1910 14.4827 14.4833 15.3575 15.3605 15.8141 15.8155 16.1548 16.1602 17.3028 17.3044 k = 0.0000 0.0000 0.3879 ( 3279 PWs) bands (ev): -63.0884 -63.0884 -63.0777 -63.0777 -30.0701 -30.0671 -30.0352 -30.0306 -29.8019 -29.7974 -29.7686 -29.7665 -29.7415 -29.7404 -29.7241 -29.7239 -9.1852 -9.1851 -5.8065 -5.8061 -4.7032 -4.7021 -4.6458 -4.6451 -1.7992 -1.7991 0.9739 0.9744 2.3601 2.3604 3.3526 3.3543 4.4912 4.4914 5.6542 5.6581 7.0044 7.0079 7.0373 7.0400 7.7274 7.7290 8.2546 8.2594 8.7513 8.7549 9.1833 9.1844 14.5492 14.5498 15.3323 15.3351 15.8408 15.8425 16.1724 16.1779 17.2947 17.2961 k = 0.0000 0.0000 0.4028 ( 3283 PWs) bands (ev): -63.0882 -63.0882 -63.0778 -63.0778 -30.0698 -30.0667 -30.0358 -30.0311 -29.8015 -29.7969 -29.7693 -29.7671 -29.7411 -29.7400 -29.7243 -29.7241 -9.1463 -9.1462 -5.8756 -5.8752 -4.7125 -4.7115 -4.6658 -4.6651 -1.7322 -1.7319 0.9240 0.9245 2.3756 2.3759 3.3759 3.3776 4.4575 4.4576 5.7306 5.7346 6.9628 6.9661 7.0469 7.0499 7.7544 7.7563 8.2237 8.2282 8.7597 8.7631 9.1766 9.1778 14.6119 14.6125 15.3072 15.3100 15.8735 15.8753 16.1887 16.1943 17.2877 17.2890 k = 0.0000 0.0000 0.4177 ( 3283 PWs) bands (ev): -63.0881 -63.0881 -63.0780 -63.0780 -30.0694 -30.0662 -30.0365 -30.0317 -29.8012 -29.7964 -29.7699 -29.7676 -29.7407 -29.7396 -29.7245 -29.7243 -9.1062 -9.1061 -5.9444 -5.9440 -4.7221 -4.7211 -4.6855 -4.6849 -1.6655 -1.6652 0.8752 0.8756 2.3918 2.3921 3.3968 3.3983 4.4247 4.4250 5.8048 5.8090 6.8877 6.8912 7.0865 7.0897 7.7845 7.7867 8.1959 8.2001 8.7703 8.7734 9.1700 9.1713 14.6702 14.6708 15.2826 15.2853 15.9125 15.9144 16.2038 16.2096 17.2817 17.2829 k = 0.0000 0.0000 0.4326 ( 3275 PWs) bands (ev): -63.0879 -63.0879 -63.0781 -63.0781 -30.0690 -30.0657 -30.0371 -30.0322 -29.8008 -29.7959 -29.7705 -29.7681 -29.7403 -29.7392 -29.7247 -29.7245 -9.0650 -9.0649 -6.0131 -6.0127 -4.7319 -4.7309 -4.7049 -4.7043 -1.5993 -1.5990 0.8274 0.8278 2.4086 2.4089 3.4149 3.4164 4.3935 4.3940 5.8767 5.8810 6.8118 6.8155 7.1235 7.1267 7.8178 7.8202 8.1718 8.1757 8.7826 8.7855 9.1636 9.1650 14.7237 14.7243 15.2584 15.2610 15.9583 15.9604 16.2179 16.2237 17.2765 17.2775 k = 0.0000 0.0000 0.4475 ( 3275 PWs) bands (ev): -63.0878 -63.0878 -63.0783 -63.0783 -30.0687 -30.0652 -30.0378 -30.0328 -29.8003 -29.7955 -29.7712 -29.7686 -29.7399 -29.7389 -29.7249 -29.7247 -9.0227 -9.0226 -6.0814 -6.0811 -4.7419 -4.7409 -4.7238 -4.7232 -1.5336 -1.5332 0.7806 0.7809 2.4260 2.4262 3.4300 3.4313 4.3641 4.3649 5.9459 5.9503 6.7355 6.7394 7.1575 7.1607 7.8541 7.8567 8.1518 8.1555 8.7962 8.7989 9.1573 9.1589 14.7720 14.7725 15.2346 15.2372 16.0111 16.0133 16.2310 16.2369 17.2718 17.2725 k = 0.0000 0.0000 0.4624 ( 3287 PWs) bands (ev): -63.0876 -63.0876 -63.0784 -63.0784 -30.0683 -30.0648 -30.0385 -30.0334 -29.7999 -29.7950 -29.7718 -29.7692 -29.7396 -29.7385 -29.7252 -29.7249 -8.9793 -8.9791 -6.1496 -6.1493 -4.7520 -4.7511 -4.7422 -4.7416 -1.4685 -1.4681 0.7348 0.7351 2.4437 2.4439 3.4418 3.4431 4.3369 4.3379 6.0120 6.0166 6.6590 6.6630 7.1882 7.1913 7.8933 7.8960 8.1364 8.1400 8.8108 8.8134 9.1512 9.1530 14.8150 14.8154 15.2114 15.2139 16.0708 16.0731 16.2432 16.2492 17.2672 17.2678 k = 0.0000 0.0000 0.4774 ( 3288 PWs) bands (ev): -63.0874 -63.0874 -63.0786 -63.0786 -30.0679 -30.0642 -30.0392 -30.0340 -29.7995 -29.7945 -29.7725 -29.7697 -29.7392 -29.7381 -29.7254 -29.7251 -8.9349 -8.9347 -6.2174 -6.2172 -4.7624 -4.7614 -4.7599 -4.7595 -1.4040 -1.4035 0.6900 0.6903 2.4617 2.4620 3.4503 3.4514 4.3125 4.3137 6.0749 6.0796 6.5824 6.5866 7.2154 7.2184 7.9353 7.9380 8.1263 8.1297 8.8262 8.8287 9.1454 9.1473 14.8527 14.8531 15.1888 15.1913 16.1372 16.1397 16.2547 16.2608 17.2627 17.2630 k = 0.0000 0.0000 0.4923 ( 3288 PWs) bands (ev): -63.0873 -63.0873 -63.0788 -63.0788 -30.0675 -30.0637 -30.0399 -30.0346 -29.7991 -29.7940 -29.7731 -29.7703 -29.7388 -29.7378 -29.7256 -29.7253 -8.8894 -8.8892 -6.2850 -6.2848 -4.7774 -4.7769 -4.7725 -4.7717 -1.3402 -1.3396 0.6463 0.6464 2.4800 2.4802 3.4552 3.4562 4.2910 4.2925 6.1344 6.1391 6.5059 6.5103 7.2388 7.2417 7.9798 7.9825 8.1217 8.1250 8.8421 8.8446 9.1398 9.1419 14.8855 14.8858 15.1668 15.1692 16.2099 16.2125 16.2655 16.2717 17.2577 17.2578 k = 0.0000 0.0000 0.5072 ( 3288 PWs) bands (ev): -63.0871 -63.0871 -63.0789 -63.0789 -30.0670 -30.0632 -30.0405 -30.0353 -29.7986 -29.7935 -29.7738 -29.7708 -29.7385 -29.7374 -29.7259 -29.7256 -8.8430 -8.8427 -6.3523 -6.3522 -4.7940 -4.7935 -4.7829 -4.7822 -1.2770 -1.2764 0.6035 0.6036 2.4983 2.4985 3.4565 3.4574 4.2729 4.2746 6.1904 6.1952 6.4295 6.4340 7.2586 7.2612 8.0264 8.0290 8.1230 8.1261 8.8583 8.8607 9.1345 9.1368 14.9137 14.9139 15.1455 15.1479 16.2757 16.2816 16.2889 16.2912 17.2518 17.2520 k = 0.0000 0.0000 0.5221 ( 3292 PWs) bands (ev): -63.0869 -63.0869 -63.0791 -63.0791 -30.0666 -30.0627 -30.0413 -30.0359 -29.7982 -29.7930 -29.7744 -29.7713 -29.7381 -29.7371 -29.7261 -29.7258 -8.7956 -8.7953 -6.4193 -6.4192 -4.8099 -4.8094 -4.7934 -4.7927 -1.2146 -1.2139 0.5616 0.5616 2.5165 2.5167 3.4541 3.4548 4.2586 4.2604 6.2428 6.2477 6.3533 6.3579 7.2745 7.2770 8.0748 8.0773 8.1301 8.1332 8.8745 8.8768 9.1295 9.1320 14.9377 14.9378 15.1250 15.1273 16.2856 16.2919 16.3721 16.3748 17.2446 17.2450 k = 0.0000 0.0000 0.5370 ( 3292 PWs) bands (ev): -63.0867 -63.0867 -63.0793 -63.0793 -30.0661 -30.0621 -30.0420 -30.0366 -29.7977 -29.7925 -29.7751 -29.7719 -29.7378 -29.7367 -29.7264 -29.7260 -8.7472 -8.7470 -6.4861 -6.4860 -4.8251 -4.8247 -4.8038 -4.8032 -1.1530 -1.1522 0.5206 0.5206 2.5347 2.5348 3.4480 3.4486 4.2482 4.2502 6.2771 6.2816 6.2922 6.2969 7.2867 7.2889 8.1244 8.1268 8.1433 8.1462 8.8906 8.8929 9.1247 9.1274 14.9580 14.9580 15.1053 15.1075 16.2951 16.3015 16.4602 16.4630 17.2357 17.2364 k = 0.0000 0.0000 0.5519 ( 3294 PWs) bands (ev): -63.0866 -63.0866 -63.0795 -63.0795 -30.0657 -30.0616 -30.0427 -30.0372 -29.7972 -29.7920 -29.7757 -29.7724 -29.7374 -29.7364 -29.7266 -29.7262 -8.6980 -8.6978 -6.5525 -6.5525 -4.8395 -4.8391 -4.8142 -4.8136 -1.0922 -1.0914 0.4804 0.4805 2.5526 2.5527 3.4382 3.4387 4.2421 4.2443 6.2011 6.2058 6.3381 6.3429 7.2952 7.2972 8.1619 8.1648 8.1752 8.1774 8.9063 8.9086 9.1203 9.1232 14.9748 14.9750 15.0864 15.0886 16.3044 16.3108 16.5520 16.5548 17.2246 17.2257 k = 0.0000 0.0000 0.5669 ( 3290 PWs) bands (ev): -63.0864 -63.0864 -63.0796 -63.0796 -30.0652 -30.0610 -30.0434 -30.0379 -29.7967 -29.7914 -29.7763 -29.7729 -29.7370 -29.7360 -29.7268 -29.7265 -8.6480 -8.6477 -6.6186 -6.6186 -4.8531 -4.8527 -4.8245 -4.8240 -1.0323 -1.0314 0.4411 0.4412 2.5703 2.5704 3.4249 3.4252 4.2405 4.2428 6.1251 6.1299 6.3813 6.3860 7.3002 7.3020 8.1861 8.1891 8.2262 8.2282 8.9216 8.9239 9.1160 9.1191 14.9888 14.9891 15.0685 15.0707 16.3135 16.3200 16.6469 16.6498 17.2108 17.2123 k = 0.0000 0.0000 0.5818 ( 3286 PWs) bands (ev): -63.0862 -63.0862 -63.0798 -63.0798 -30.0647 -30.0604 -30.0441 -30.0385 -29.7962 -29.7909 -29.7770 -29.7735 -29.7367 -29.7357 -29.7271 -29.7267 -8.5971 -8.5968 -6.6845 -6.6844 -4.8658 -4.8655 -4.8347 -4.8342 -0.9734 -0.9725 0.4024 0.4026 2.5877 2.5878 3.4082 3.4084 4.2436 4.2460 6.0491 6.0540 6.4222 6.4268 7.3018 7.3033 8.2151 8.2181 8.2773 8.2790 8.9363 8.9385 9.1119 9.1153 15.0002 15.0006 15.0517 15.0538 16.3226 16.3291 16.7442 16.7471 17.1940 17.1958 k = 0.0000 0.0000 0.5967 ( 3280 PWs) bands (ev): -63.0860 -63.0860 -63.0800 -63.0800 -30.0642 -30.0598 -30.0448 -30.0392 -29.7956 -29.7903 -29.7776 -29.7740 -29.7363 -29.7353 -29.7274 -29.7269 -8.5454 -8.5451 -6.7500 -6.7499 -4.8777 -4.8774 -4.8447 -4.8442 -0.9155 -0.9145 0.3645 0.3648 2.6049 2.6050 3.3883 3.3884 4.2514 4.2539 5.9732 5.9780 6.4610 6.4655 7.3000 7.3014 8.2483 8.2513 8.3280 8.3294 8.9502 8.9525 9.1079 9.1115 15.0093 15.0099 15.0359 15.0380 16.3318 16.3384 16.8431 16.8459 17.1738 17.1760 k = 0.0000 0.0000 0.6116 ( 3280 PWs) bands (ev): -63.0858 -63.0858 -63.0802 -63.0802 -30.0636 -30.0592 -30.0455 -30.0399 -29.7951 -29.7898 -29.7783 -29.7745 -29.7360 -29.7350 -29.7276 -29.7272 -8.4930 -8.4926 -6.8153 -6.8152 -4.8887 -4.8884 -4.8545 -4.8541 -0.8586 -0.8575 0.3271 0.3275 2.6219 2.6220 3.3655 3.3655 4.2639 4.2666 5.8972 5.9020 6.4983 6.5026 7.2951 7.2962 8.2850 8.2881 8.3778 8.3789 8.9633 8.9655 9.1040 9.1077 15.0164 15.0170 15.0214 15.0235 16.3412 16.3478 16.9420 16.9446 17.1512 17.1536 k = 0.0000 0.0000 0.6265 ( 3288 PWs) bands (ev): -63.0856 -63.0856 -63.0804 -63.0804 -30.0631 -30.0585 -30.0463 -30.0406 -29.7946 -29.7893 -29.7789 -29.7751 -29.7356 -29.7347 -29.7279 -29.7274 -8.4398 -8.4395 -6.8802 -6.8801 -4.8988 -4.8986 -4.8641 -4.8637 -0.8028 -0.8017 0.2903 0.2907 2.6388 2.6389 3.3400 3.3400 4.2813 4.2842 5.8212 5.8260 6.5343 6.5384 7.2871 7.2880 8.3244 8.3276 8.4263 8.4272 8.9753 8.9776 9.1000 9.1039 15.0081 15.0101 15.0215 15.0224 16.3509 16.3575 17.0337 17.0351 17.1333 17.1349 k = 0.0000 0.0000 0.6415 ( 3292 PWs) bands (ev): -63.0854 -63.0854 -63.0806 -63.0806 -30.0626 -30.0579 -30.0470 -30.0413 -29.7941 -29.7887 -29.7796 -29.7756 -29.7353 -29.7344 -29.7282 -29.7277 -8.3860 -8.3856 -6.9449 -6.9447 -4.9080 -4.9078 -4.8734 -4.8730 -0.7482 -0.7470 0.2539 0.2544 2.6558 2.6558 3.3122 3.3123 4.3035 4.3064 5.7452 5.7500 6.5696 6.5735 7.2763 7.2770 8.3659 8.3692 8.4733 8.4739 8.9864 8.9886 9.0958 9.1000 14.9962 14.9982 15.0249 15.0259 16.3610 16.3678 17.0619 17.0650 17.1730 17.1755 k = 0.0000 0.0000 0.6564 ( 3290 PWs) bands (ev): -63.0852 -63.0852 -63.0808 -63.0808 -30.0620 -30.0573 -30.0477 -30.0420 -29.7935 -29.7882 -29.7802 -29.7762 -29.7350 -29.7341 -29.7284 -29.7279 -8.3314 -8.3311 -7.0092 -7.0090 -4.9162 -4.9161 -4.8823 -4.8820 -0.6947 -0.6935 0.2178 0.2184 2.6730 2.6730 3.2824 3.2826 4.3303 4.3334 5.6694 5.6741 6.6043 6.6080 7.2627 7.2632 8.4086 8.4120 8.5182 8.5187 8.9962 8.9985 9.0915 9.0958 14.9858 14.9878 15.0266 15.0277 16.3718 16.3786 17.0327 17.0368 17.2670 17.2702 k = 0.0000 0.0000 0.6713 ( 3296 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0615 -30.0567 -30.0484 -30.0428 -29.7930 -29.7877 -29.7809 -29.7767 -29.7347 -29.7338 -29.7287 -29.7282 -8.2763 -8.2759 -7.0732 -7.0729 -4.9236 -4.9234 -4.8908 -4.8906 -0.6424 -0.6412 0.1820 0.1826 2.6905 2.6905 3.2510 3.2512 4.3617 4.3648 5.5937 5.5984 6.6387 6.6422 7.2466 7.2469 8.4517 8.4552 8.5608 8.5610 9.0049 9.0072 9.0869 9.0913 14.9769 14.9789 15.0268 15.0280 16.3833 16.3901 16.9932 16.9978 17.3684 17.3716 k = 0.0000 0.0000 0.6862 ( 3292 PWs) bands (ev): -63.0848 -63.0848 -63.0812 -63.0812 -30.0609 -30.0560 -30.0491 -30.0435 -29.7924 -29.7871 -29.7815 -29.7773 -29.7344 -29.7335 -29.7290 -29.7284 -8.2205 -8.2201 -7.1369 -7.1366 -4.9299 -4.9299 -4.8990 -4.8987 -0.5914 -0.5901 0.1463 0.1470 2.7087 2.7087 3.2183 3.2186 4.3974 4.4006 5.5183 5.5229 6.6730 6.6762 7.2280 7.2282 8.4946 8.4982 8.6006 8.6007 9.0124 9.0146 9.0819 9.0865 14.9696 14.9716 15.0256 15.0269 16.3957 16.4025 16.9499 16.9548 17.4709 17.4742 k = 0.0000 0.0000 0.7011 ( 3292 PWs) bands (ev): -63.0846 -63.0846 -63.0814 -63.0814 -30.0603 -30.0554 -30.0498 -30.0442 -29.7918 -29.7866 -29.7821 -29.7778 -29.7340 -29.7332 -29.7292 -29.7287 -8.1641 -8.1637 -7.2003 -7.2000 -4.9354 -4.9353 -4.9066 -4.9064 -0.5416 -0.5403 0.1106 0.1114 2.7275 2.7275 3.1848 3.1851 4.4372 4.4405 5.4433 5.4479 6.7073 6.7103 7.2072 7.2073 8.5366 8.5403 8.6372 8.6373 9.0186 9.0207 9.0766 9.0812 14.9640 14.9660 15.0230 15.0245 16.4091 16.4160 16.9045 16.9097 17.5730 17.5763 k = 0.0000 0.0000 0.7160 ( 3284 PWs) bands (ev): -63.0844 -63.0844 -63.0816 -63.0816 -30.0597 -30.0547 -30.0505 -30.0449 -29.7913 -29.7860 -29.7827 -29.7784 -29.7337 -29.7328 -29.7295 -29.7289 -8.1072 -8.1068 -7.2633 -7.2630 -4.9399 -4.9398 -4.9137 -4.9136 -0.4930 -0.4917 0.0749 0.0757 2.7473 2.7473 3.1507 3.1510 4.4809 4.4843 5.3688 5.3733 6.7417 6.7445 7.1843 7.1844 8.5770 8.5807 8.6702 8.6705 9.0236 9.0256 9.0710 9.0755 14.9601 14.9621 15.0193 15.0208 16.4239 16.4308 16.8584 16.8639 17.6735 17.6769 k = 0.0000 0.0000 0.7310 ( 3288 PWs) bands (ev): -63.0842 -63.0842 -63.0818 -63.0818 -30.0591 -30.0540 -30.0512 -30.0456 -29.7907 -29.7855 -29.7834 -29.7789 -29.7334 -29.7326 -29.7298 -29.7292 -8.0497 -8.0493 -7.3260 -7.3257 -4.9435 -4.9434 -4.9203 -4.9202 -0.4458 -0.4445 0.0390 0.0399 2.7681 2.7681 3.1163 3.1166 4.5282 4.5317 5.2950 5.2994 6.7761 6.7787 7.1594 7.1597 8.6151 8.6188 8.6993 8.6996 9.0274 9.0292 9.0650 9.0695 14.9579 14.9599 15.0144 15.0161 16.4401 16.4470 16.8127 16.8184 17.7693 17.7730 k = 0.0000 0.0000 0.7459 ( 3288 PWs) bands (ev): -63.0840 -63.0840 -63.0820 -63.0820 -30.0585 -30.0533 -30.0519 -30.0463 -29.7901 -29.7849 -29.7840 -29.7795 -29.7331 -29.7323 -29.7301 -29.7294 -7.9918 -7.9914 -7.3884 -7.3881 -4.9461 -4.9461 -4.9263 -4.9262 -0.3997 -0.3984 0.0028 0.0037 2.7901 2.7902 3.0821 3.0824 4.5790 4.5825 5.2220 5.2263 6.8106 6.8129 7.1328 7.1333 8.6504 8.6540 8.7241 8.7242 9.0302 9.0318 9.0589 9.0632 14.9574 14.9594 15.0088 15.0105 16.4579 16.4648 16.7681 16.7740 17.8473 17.8519 k = 0.0000 0.0000 0.7608 ( 3284 PWs) bands (ev): -63.0838 -63.0838 -63.0822 -63.0822 -30.0579 -30.0526 -30.0526 -30.0470 -29.7895 -29.7846 -29.7844 -29.7800 -29.7328 -29.7319 -29.7304 -29.7297 -7.9333 -7.9329 -7.4505 -7.4501 -4.9479 -4.9478 -4.9317 -4.9316 -0.3549 -0.3536 -0.0339 -0.0329 2.8135 2.8135 3.0482 3.0485 4.6330 4.6366 5.1500 5.1542 6.8450 6.8472 7.1046 7.1053 8.6822 8.6858 8.7439 8.7439 9.0321 9.0334 9.0530 9.0569 14.9584 14.9604 15.0024 15.0043 16.4777 16.4846 16.7253 16.7314 17.8730 17.8776 k = 0.0000 0.0000 0.7757 ( 3278 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0572 -30.0533 -30.0519 -30.0477 -29.7889 -29.7852 -29.7838 -29.7805 -29.7324 -29.7316 -29.7306 -29.7299 -7.8744 -7.8740 -7.5122 -7.5118 -4.9487 -4.9487 -4.9364 -4.9363 -0.3113 -0.3100 -0.0711 -0.0701 2.8382 2.8382 3.0149 3.0151 4.6898 4.6935 5.0791 5.0833 6.8793 6.8813 7.0751 7.0760 8.7100 8.7133 8.7580 8.7584 9.0335 9.0343 9.0476 9.0510 14.9609 14.9629 14.9956 14.9975 16.4996 16.5064 16.6849 16.6912 17.8733 17.8788 k = 0.0000 0.0000 0.7906 ( 3276 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0566 -30.0539 -30.0512 -30.0484 -29.7883 -29.7858 -29.7833 -29.7811 -29.7321 -29.7313 -29.7309 -29.7302 -7.8151 -7.8146 -7.5735 -7.5731 -4.9487 -4.9487 -4.9404 -4.9404 -0.2688 -0.2675 -0.1090 -0.1079 2.8643 2.8644 2.9824 2.9827 4.7494 4.7532 5.0096 5.0137 6.9134 6.9152 7.0445 7.0455 8.7330 8.7360 8.7660 8.7668 9.0347 9.0349 9.0430 9.0458 14.9647 14.9667 14.9887 14.9907 16.5238 16.5306 16.6471 16.6535 17.8735 17.8787 k = 0.0000 0.0000 0.8055 ( 3272 PWs) bands (ev): -63.0832 -63.0832 -63.0828 -63.0828 -30.0559 -30.0546 -30.0505 -30.0491 -29.7877 -29.7864 -29.7827 -29.7816 -29.7318 -29.7312 -29.7310 -29.7305 -7.7553 -7.7549 -7.6345 -7.6341 -4.9478 -4.9478 -4.9436 -4.9436 -0.2274 -0.2262 -0.1476 -0.1464 2.8919 2.8920 2.9510 2.9512 4.8114 4.8152 4.9417 4.9457 6.9471 6.9487 7.0128 7.0140 8.7507 8.7531 8.7675 8.7688 9.0357 9.0362 9.0395 9.0415 14.9696 14.9716 14.9819 14.9839 16.5505 16.5572 16.6121 16.6186 17.8741 17.8766 k = 0.0000 0.0000 0.8205 ( 3274 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7871 -29.7871 -29.7822 -29.7822 -29.7315 -29.7315 -29.7308 -29.7308 -7.6951 -7.6951 -7.6947 -7.6947 -4.9461 -4.9461 -4.9461 -4.9461 -0.1870 -0.1870 -0.1858 -0.1858 2.9208 2.9208 2.9210 2.9210 4.8756 4.8756 4.8795 4.8795 6.9803 6.9803 6.9817 6.9817 8.7623 8.7623 8.7642 8.7642 9.0371 9.0371 9.0383 9.0383 14.9754 14.9754 14.9774 14.9774 16.5799 16.5799 16.5865 16.5865 17.8751 17.8751 k = 0.0000 0.0000 0.8205 ( 3274 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7871 -29.7871 -29.7822 -29.7822 -29.7315 -29.7315 -29.7308 -29.7308 -7.6951 -7.6951 -7.6947 -7.6947 -4.9461 -4.9461 -4.9461 -4.9461 -0.1870 -0.1870 -0.1858 -0.1858 2.9208 2.9208 2.9210 2.9210 4.8756 4.8756 4.8795 4.8795 6.9803 6.9803 6.9817 6.9817 8.7623 8.7623 8.7642 8.7642 9.0371 9.0371 9.0383 9.0383 14.9754 14.9754 14.9774 14.9774 16.5799 16.5799 16.5865 16.5865 17.8751 17.8751 k =-0.0092 0.0120 0.8205 ( 3270 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7871 -29.7871 -29.7821 -29.7821 -29.7316 -29.7316 -29.7306 -29.7306 -7.6953 -7.6953 -7.6949 -7.6949 -4.9463 -4.9462 -4.9462 -4.9462 -0.1856 -0.1856 -0.1844 -0.1844 2.9209 2.9209 2.9211 2.9211 4.8759 4.8759 4.8798 4.8798 6.9781 6.9781 6.9795 6.9795 8.7610 8.7610 8.7632 8.7632 9.0376 9.0376 9.0391 9.0391 14.9767 14.9767 14.9788 14.9788 16.5780 16.5780 16.5846 16.5846 17.8759 17.8759 k =-0.0185 0.0240 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7872 -29.7872 -29.7821 -29.7821 -29.7319 -29.7319 -29.7304 -29.7304 -7.6960 -7.6960 -7.6956 -7.6956 -4.9466 -4.9465 -4.9464 -4.9464 -0.1812 -0.1812 -0.1801 -0.1801 2.9214 2.9214 2.9216 2.9216 4.8767 4.8767 4.8807 4.8807 6.9716 6.9716 6.9731 6.9731 8.7569 8.7569 8.7598 8.7598 9.0391 9.0391 9.0414 9.0414 14.9806 14.9806 14.9826 14.9826 16.5722 16.5722 16.5788 16.5788 17.8785 17.8785 k =-0.0277 0.0360 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7874 -29.7874 -29.7819 -29.7819 -29.7322 -29.7322 -29.7301 -29.7301 -7.6972 -7.6972 -7.6968 -7.6968 -4.9470 -4.9470 -4.9468 -4.9468 -0.1740 -0.1740 -0.1729 -0.1729 2.9222 2.9222 2.9224 2.9224 4.8782 4.8782 4.8822 4.8822 6.9609 6.9609 6.9625 6.9625 8.7505 8.7505 8.7542 8.7542 9.0417 9.0417 9.0448 9.0448 14.9870 14.9870 14.9890 14.9890 16.5629 16.5629 16.5694 16.5694 17.8826 17.8826 k =-0.0369 0.0480 0.8205 ( 3290 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0499 -30.0499 -29.7876 -29.7876 -29.7817 -29.7817 -29.7326 -29.7326 -29.7298 -29.7298 -7.6989 -7.6989 -7.6985 -7.6985 -4.9476 -4.9476 -4.9474 -4.9474 -0.1640 -0.1640 -0.1629 -0.1629 2.9232 2.9232 2.9235 2.9235 4.8802 4.8802 4.8842 4.8842 6.9462 6.9462 6.9479 6.9479 8.7418 8.7418 8.7463 8.7463 9.0454 9.0454 9.0492 9.0492 14.9956 14.9956 14.9977 14.9977 16.5502 16.5502 16.5566 16.5566 17.8882 17.8882 k =-0.0462 0.0600 0.8205 ( 3280 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0552 -30.0552 -30.0498 -30.0498 -29.7878 -29.7878 -29.7815 -29.7815 -29.7329 -29.7329 -29.7295 -29.7295 -7.7010 -7.7010 -7.7006 -7.7006 -4.9482 -4.9482 -4.9480 -4.9480 -0.1513 -0.1513 -0.1501 -0.1501 2.9246 2.9246 2.9249 2.9249 4.8828 4.8828 4.8868 4.8868 6.9276 6.9276 6.9294 6.9294 8.7310 8.7310 8.7362 8.7362 9.0500 9.0500 9.0545 9.0545 15.0061 15.0061 15.0083 15.0083 16.5347 16.5347 16.5410 16.5410 17.8951 17.8951 k =-0.0554 0.0721 0.8205 ( 3284 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0552 -30.0552 -30.0498 -30.0498 -29.7880 -29.7880 -29.7812 -29.7812 -29.7332 -29.7332 -29.7292 -29.7292 -7.7037 -7.7037 -7.7033 -7.7033 -4.9489 -4.9489 -4.9486 -4.9486 -0.1359 -0.1359 -0.1348 -0.1348 2.9263 2.9263 2.9266 2.9266 4.8859 4.8859 4.8900 4.8900 6.9054 6.9054 6.9074 6.9074 8.7181 8.7181 8.7240 8.7240 9.0553 9.0553 9.0603 9.0603 15.0183 15.0183 15.0206 15.0206 16.5167 16.5167 16.5230 16.5230 17.9031 17.9031 k =-0.0646 0.0841 0.8205 ( 3286 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0552 -30.0552 -30.0498 -30.0498 -29.7883 -29.7883 -29.7810 -29.7810 -29.7335 -29.7335 -29.7289 -29.7289 -7.7068 -7.7068 -7.7064 -7.7064 -4.9496 -4.9496 -4.9492 -4.9492 -0.1181 -0.1181 -0.1169 -0.1169 2.9282 2.9282 2.9286 2.9286 4.8895 4.8895 4.8937 4.8937 6.8800 6.8800 6.8821 6.8821 8.7033 8.7033 8.7097 8.7097 9.0612 9.0612 9.0667 9.0667 15.0316 15.0316 15.0339 15.0339 16.4970 16.4970 16.5031 16.5031 17.9120 17.9120 k =-0.0738 0.0961 0.8205 ( 3288 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0552 -30.0552 -30.0498 -30.0498 -29.7886 -29.7886 -29.7807 -29.7807 -29.7338 -29.7338 -29.7286 -29.7286 -7.7105 -7.7105 -7.7101 -7.7101 -4.9501 -4.9501 -4.9497 -4.9497 -0.0978 -0.0978 -0.0967 -0.0967 2.9304 2.9304 2.9309 2.9309 4.8937 4.8937 4.8978 4.8978 6.8516 6.8516 6.8538 6.8538 8.6867 8.6867 8.6935 8.6935 9.0676 9.0676 9.0734 9.0734 15.0455 15.0455 15.0478 15.0478 16.4762 16.4762 16.4822 16.4822 17.9215 17.9215 k =-0.0831 0.1081 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0552 -30.0552 -30.0498 -30.0498 -29.7888 -29.7888 -29.7804 -29.7804 -29.7342 -29.7342 -29.7283 -29.7283 -7.7147 -7.7147 -7.7142 -7.7142 -4.9505 -4.9505 -4.9500 -4.9500 -0.0754 -0.0754 -0.0743 -0.0743 2.9329 2.9329 2.9335 2.9335 4.8982 4.8982 4.9025 4.9025 6.8206 6.8206 6.8229 6.8229 8.6682 8.6682 8.6753 8.6753 9.0742 9.0742 9.0804 9.0804 15.0592 15.0592 15.0617 15.0617 16.4551 16.4551 16.4610 16.4610 17.9316 17.9316 k =-0.0923 0.1201 0.8205 ( 3288 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0551 -30.0551 -30.0498 -30.0498 -29.7891 -29.7891 -29.7801 -29.7801 -29.7344 -29.7344 -29.7280 -29.7280 -7.7194 -7.7194 -7.7189 -7.7189 -4.9505 -4.9505 -4.9500 -4.9500 -0.0509 -0.0509 -0.0498 -0.0498 2.9357 2.9357 2.9363 2.9363 4.9032 4.9032 4.9075 4.9075 6.7874 6.7874 6.7899 6.7899 8.6480 8.6480 8.6554 8.6554 9.0811 9.0811 9.0875 9.0875 15.0722 15.0722 15.0747 15.0747 16.4345 16.4345 16.4402 16.4402 17.9419 17.9419 k =-0.1015 0.1321 0.8205 ( 3292 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0551 -30.0551 -30.0497 -30.0497 -29.7894 -29.7894 -29.7798 -29.7798 -29.7347 -29.7347 -29.7278 -29.7278 -7.7246 -7.7246 -7.7242 -7.7242 -4.9503 -4.9503 -4.9497 -4.9497 -0.0246 -0.0246 -0.0235 -0.0235 2.9387 2.9387 2.9394 2.9394 4.9086 4.9086 4.9130 4.9130 6.7524 6.7525 6.7550 6.7550 8.6261 8.6261 8.6337 8.6337 9.0880 9.0880 9.0946 9.0946 15.0834 15.0834 15.0860 15.0860 16.4152 16.4152 16.4208 16.4208 17.9523 17.9523 k =-0.1108 0.1441 0.8205 ( 3300 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0551 -30.0551 -30.0497 -30.0497 -29.7897 -29.7897 -29.7796 -29.7796 -29.7350 -29.7350 -29.7275 -29.7275 -7.7304 -7.7304 -7.7300 -7.7300 -4.9496 -4.9496 -4.9490 -4.9490 0.0034 0.0034 0.0044 0.0044 2.9419 2.9419 2.9427 2.9427 4.9143 4.9143 4.9188 4.9188 6.7160 6.7160 6.7187 6.7187 8.6025 8.6025 8.6103 8.6103 9.0950 9.0950 9.1016 9.1016 15.0922 15.0922 15.0948 15.0948 16.3981 16.3981 16.4035 16.4035 17.9625 17.9625 k =-0.1200 0.1561 0.8205 ( 3302 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0550 -30.0550 -30.0497 -30.0497 -29.7899 -29.7899 -29.7793 -29.7793 -29.7353 -29.7353 -29.7273 -29.7273 -7.7367 -7.7367 -7.7363 -7.7363 -4.9483 -4.9483 -4.9477 -4.9477 0.0328 0.0328 0.0338 0.0338 2.9454 2.9454 2.9463 2.9463 4.9204 4.9204 4.9249 4.9249 6.6786 6.6786 6.6814 6.6814 8.5773 8.5773 8.5852 8.5852 9.1019 9.1019 9.1086 9.1086 15.0976 15.0976 15.1003 15.1003 16.3840 16.3840 16.3892 16.3892 17.9724 17.9724 k =-0.1292 0.1681 0.8205 ( 3302 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0550 -30.0550 -30.0497 -30.0497 -29.7902 -29.7902 -29.7791 -29.7791 -29.7355 -29.7355 -29.7271 -29.7271 -7.7436 -7.7436 -7.7432 -7.7432 -4.9465 -4.9465 -4.9459 -4.9459 0.0634 0.0634 0.0643 0.0643 2.9491 2.9491 2.9501 2.9501 4.9267 4.9267 4.9313 4.9313 6.6406 6.6406 6.6434 6.6434 8.5505 8.5505 8.5585 8.5585 9.1088 9.1088 9.1155 9.1155 15.0989 15.0989 15.1016 15.1016 16.3735 16.3735 16.3786 16.3786 17.9816 17.9816 k =-0.1385 0.1801 0.8205 ( 3306 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0549 -30.0549 -30.0497 -30.0497 -29.7904 -29.7904 -29.7789 -29.7789 -29.7357 -29.7357 -29.7268 -29.7268 -7.7510 -7.7510 -7.7506 -7.7506 -4.9440 -4.9440 -4.9433 -4.9433 0.0949 0.0949 0.0958 0.0958 2.9531 2.9531 2.9542 2.9542 4.9332 4.9332 4.9379 4.9379 6.6023 6.6023 6.6052 6.6052 8.5221 8.5221 8.5301 8.5301 9.1156 9.1156 9.1223 9.1223 15.0953 15.0953 15.0981 15.0981 16.3671 16.3671 16.3721 16.3721 17.9900 17.9900 k =-0.1477 0.1922 0.8205 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0549 -30.0549 -30.0497 -30.0497 -29.7907 -29.7907 -29.7787 -29.7787 -29.7360 -29.7360 -29.7267 -29.7267 -7.7590 -7.7590 -7.7586 -7.7586 -4.9407 -4.9407 -4.9400 -4.9400 0.1271 0.1271 0.1280 0.1280 2.9573 2.9573 2.9585 2.9585 4.9400 4.9400 4.9448 4.9448 6.5642 6.5642 6.5671 6.5671 8.4922 8.4922 8.5002 8.5002 9.1223 9.1223 9.1289 9.1289 15.0866 15.0866 15.0893 15.0893 16.3651 16.3651 16.3699 16.3699 17.9973 17.9973 k =-0.1477 0.1922 0.8205 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0549 -30.0549 -30.0497 -30.0497 -29.7907 -29.7907 -29.7787 -29.7787 -29.7360 -29.7360 -29.7267 -29.7267 -7.7590 -7.7590 -7.7586 -7.7586 -4.9407 -4.9407 -4.9400 -4.9400 0.1271 0.1271 0.1280 0.1280 2.9573 2.9573 2.9585 2.9585 4.9400 4.9400 4.9448 4.9448 6.5642 6.5642 6.5671 6.5671 8.4922 8.4922 8.5002 8.5002 9.1223 9.1223 9.1289 9.1289 15.0866 15.0866 15.0893 15.0893 16.3651 16.3651 16.3699 16.3699 17.9973 17.9973 k =-0.1542 0.2006 0.8098 ( 3313 PWs) bands (ev): -63.0831 -63.0831 -63.0829 -63.0829 -30.0552 -30.0544 -30.0500 -30.0492 -29.7910 -29.7907 -29.7786 -29.7784 -29.7362 -29.7360 -29.7265 -29.7264 -7.7993 -7.7990 -7.7303 -7.7300 -4.9499 -4.9493 -4.9253 -4.9247 0.1163 0.1172 0.1835 0.1843 2.9451 2.9457 2.9768 2.9775 4.9100 4.9141 4.9812 4.9855 6.5236 6.5265 6.5517 6.5545 8.4474 8.4528 8.4944 8.4999 9.1087 9.1137 9.1457 9.1508 15.0443 15.0461 15.1109 15.1126 16.3396 16.3443 16.3947 16.3993 17.9937 17.9988 k =-0.1607 0.2091 0.7990 ( 3319 PWs) bands (ev): -63.0833 -63.0833 -63.0828 -63.0828 -30.0556 -30.0541 -30.0504 -30.0488 -29.7913 -29.7907 -29.7786 -29.7781 -29.7364 -29.7361 -29.7265 -29.7263 -7.8385 -7.8382 -7.7031 -7.7030 -4.9593 -4.9587 -4.9081 -4.9074 0.1044 0.1052 0.2401 0.2409 2.9337 2.9344 2.9956 2.9963 4.8828 4.8869 5.0206 5.0250 6.4857 6.4886 6.5379 6.5406 8.3989 8.4043 8.4941 8.4996 9.0924 9.0973 9.1679 9.1729 14.9958 14.9974 15.1355 15.1372 16.3192 16.3238 16.4263 16.4308 17.9896 17.9946 k =-0.1673 0.2176 0.7883 ( 3315 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0559 -30.0537 -30.0507 -30.0484 -29.7916 -29.7908 -29.7785 -29.7778 -29.7366 -29.7361 -29.7264 -29.7261 -7.8764 -7.8762 -7.6776 -7.6774 -4.9688 -4.9682 -4.8891 -4.8884 0.0913 0.0920 0.2969 0.2977 2.9233 2.9240 3.0139 3.0147 4.8591 4.8630 5.0580 5.0625 6.4511 6.4541 6.5228 6.5254 8.3483 8.3535 8.4929 8.4983 9.0740 9.0788 9.1897 9.1946 14.9419 14.9435 15.1607 15.1623 16.3036 16.3081 16.4596 16.4641 17.9851 17.9900 k =-0.1738 0.2261 0.7776 ( 3309 PWs) bands (ev): -63.0835 -63.0835 -63.0825 -63.0825 -30.0562 -30.0534 -30.0509 -30.0479 -29.7919 -29.7908 -29.7785 -29.7776 -29.7368 -29.7362 -29.7262 -29.7259 -7.9131 -7.9129 -7.6536 -7.6535 -4.9783 -4.9777 -4.8683 -4.8676 0.0770 0.0776 0.3538 0.3546 2.9139 2.9146 3.0318 3.0326 4.8389 4.8427 5.0930 5.0975 6.4203 6.4233 6.5063 6.5089 8.2956 8.3008 8.4909 8.4963 9.0539 9.0585 9.2111 9.2159 14.8836 14.8850 15.1862 15.1878 16.2926 16.2970 16.4942 16.4985 17.9802 17.9851 k =-0.1803 0.2346 0.7669 ( 3307 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0565 -30.0532 -30.0510 -30.0475 -29.7922 -29.7909 -29.7784 -29.7773 -29.7370 -29.7362 -29.7262 -29.7257 -7.9484 -7.9482 -7.6312 -7.6311 -4.9879 -4.9873 -4.8459 -4.8451 0.0614 0.0620 0.4107 0.4114 2.9051 2.9058 3.0492 3.0500 4.8224 4.8261 5.1251 5.1296 6.3939 6.3968 6.4885 6.4910 8.2412 8.2463 8.4881 8.4934 9.0320 9.0365 9.2321 9.2368 14.8216 14.8229 15.2119 15.2134 16.2856 16.2900 16.5294 16.5336 17.9753 17.9800 k =-0.1868 0.2431 0.7562 ( 3308 PWs) bands (ev): -63.0838 -63.0838 -63.0823 -63.0823 -30.0567 -30.0532 -30.0510 -30.0471 -29.7925 -29.7910 -29.7783 -29.7771 -29.7371 -29.7363 -29.7261 -29.7255 -7.9824 -7.9822 -7.6104 -7.6103 -4.9975 -4.9968 -4.8220 -4.8212 0.0445 0.0451 0.4674 0.4681 2.8969 2.8976 3.0660 3.0668 4.8098 4.8134 5.1538 5.1583 6.3722 6.3750 6.4695 6.4719 8.1853 8.1903 8.4846 8.4897 9.0087 9.0131 9.2525 9.2571 14.7568 14.7580 15.2373 15.2388 16.2825 16.2868 16.5649 16.5690 17.9703 17.9749 k =-0.1934 0.2516 0.7455 ( 3308 PWs) bands (ev): -63.0839 -63.0839 -63.0822 -63.0822 -30.0570 -30.0533 -30.0508 -30.0467 -29.7927 -29.7911 -29.7783 -29.7768 -29.7373 -29.7363 -29.7260 -29.7254 -8.0150 -8.0148 -7.5911 -7.5910 -5.0069 -5.0063 -4.7967 -4.7958 0.0265 0.0270 0.5238 0.5244 2.8890 2.8896 3.0822 3.0831 4.8012 4.8046 5.1787 5.1831 6.3556 6.3581 6.4494 6.4517 8.1283 8.1331 8.4803 8.4854 8.9842 8.9884 9.2724 9.2769 14.6900 14.6911 15.2623 15.2637 16.2826 16.2869 16.6001 16.6042 17.9654 17.9699 k =-0.1999 0.2601 0.7348 ( 3310 PWs) bands (ev): -63.0840 -63.0840 -63.0821 -63.0821 -30.0573 -30.0535 -30.0506 -30.0464 -29.7930 -29.7912 -29.7782 -29.7766 -29.7375 -29.7363 -29.7259 -29.7252 -8.0462 -8.0460 -7.5734 -7.5733 -5.0162 -5.0156 -4.7702 -4.7693 0.0074 0.0078 0.5798 0.5803 2.8811 2.8817 3.0978 3.0988 4.7966 4.7998 5.1996 5.2039 6.3440 6.3461 6.4286 6.4310 8.0703 8.0750 8.4755 8.4805 8.9587 8.9627 9.2917 9.2961 14.6220 14.6231 15.2866 15.2880 16.2859 16.2901 16.6347 16.6387 17.9608 17.9652 k =-0.2064 0.2685 0.7241 ( 3306 PWs) bands (ev): -63.0841 -63.0841 -63.0820 -63.0820 -30.0575 -30.0537 -30.0502 -30.0460 -29.7932 -29.7913 -29.7781 -29.7764 -29.7376 -29.7364 -29.7258 -29.7251 -8.0759 -8.0757 -7.5571 -7.5570 -5.0254 -5.0248 -4.7427 -4.7418 -0.0126 -0.0124 0.6351 0.6357 2.8731 2.8737 3.1130 3.1140 4.7961 4.7991 5.2162 5.2203 6.3366 6.3380 6.4083 6.4107 8.0116 8.0163 8.4702 8.4751 8.9325 8.9363 9.3105 9.3147 14.5536 14.5545 15.3100 15.3114 16.2919 16.2960 16.6683 16.6723 17.9565 17.9608 k =-0.2129 0.2770 0.7134 ( 3303 PWs) bands (ev): -63.0842 -63.0842 -63.0819 -63.0819 -30.0578 -30.0540 -30.0499 -30.0457 -29.7935 -29.7914 -29.7780 -29.7762 -29.7377 -29.7364 -29.7257 -29.7249 -8.1042 -8.1040 -7.5423 -7.5422 -5.0343 -5.0337 -4.7145 -4.7135 -0.0336 -0.0334 0.6897 0.6902 2.8649 2.8655 3.1276 3.1287 4.7995 4.8024 5.2285 5.2324 6.3305 6.3309 6.3911 6.3938 7.9524 7.9570 8.4644 8.4692 8.9058 8.9095 9.3287 9.3327 14.4854 14.4862 15.3322 15.3336 16.3004 16.3045 16.7005 16.7045 17.9526 17.9568 k =-0.2195 0.2855 0.7027 ( 3305 PWs) bands (ev): -63.0843 -63.0843 -63.0818 -63.0818 -30.0580 -30.0542 -30.0496 -30.0453 -29.7937 -29.7915 -29.7780 -29.7760 -29.7379 -29.7364 -29.7256 -29.7248 -8.1309 -8.1308 -7.5289 -7.5288 -5.0430 -5.0424 -4.6857 -4.6846 -0.0552 -0.0552 0.7432 0.7437 2.8562 2.8567 3.1417 3.1429 4.8069 4.8096 5.2367 5.2404 6.3185 6.3197 6.3832 6.3864 7.8930 7.8975 8.4583 8.4630 8.8790 8.8826 9.3462 9.3501 14.4180 14.4187 15.3531 15.3546 16.3111 16.3152 16.7311 16.7350 17.9492 17.9532 k =-0.2260 0.2940 0.6920 ( 3310 PWs) bands (ev): -63.0844 -63.0844 -63.0817 -63.0817 -30.0582 -30.0545 -30.0493 -30.0450 -29.7939 -29.7916 -29.7779 -29.7758 -29.7380 -29.7364 -29.7255 -29.7247 -8.1562 -8.1560 -7.5168 -7.5166 -5.0514 -5.0508 -4.6566 -4.6555 -0.0774 -0.0773 0.7956 0.7961 2.8469 2.8475 3.1554 3.1567 4.8180 4.8206 5.2412 5.2445 6.2979 6.2995 6.3885 6.3915 7.8335 7.8380 8.4520 8.4566 8.8522 8.8557 9.3630 9.3667 14.3520 14.3526 15.3725 15.3740 16.3240 16.3279 16.7597 16.7636 17.9461 17.9500 k =-0.2325 0.3025 0.6813 ( 3310 PWs) bands (ev): -63.0844 -63.0844 -63.0816 -63.0816 -30.0584 -30.0548 -30.0489 -30.0447 -29.7941 -29.7917 -29.7779 -29.7757 -29.7381 -29.7365 -29.7254 -29.7246 -8.1799 -8.1797 -7.5059 -7.5057 -5.0594 -5.0588 -4.6275 -4.6263 -0.0999 -0.0997 0.8466 0.8470 2.8371 2.8376 3.1687 3.1701 4.8327 4.8350 5.2424 5.2455 6.2714 6.2731 6.4037 6.4062 7.7743 7.7786 8.4455 8.4500 8.8259 8.8291 9.3791 9.3827 14.2879 14.2884 15.3903 15.3918 16.3386 16.3426 16.7862 16.7901 17.9434 17.9471 k =-0.2390 0.3110 0.6706 ( 3310 PWs) bands (ev): -63.0845 -63.0845 -63.0815 -63.0815 -30.0586 -30.0550 -30.0486 -30.0445 -29.7942 -29.7918 -29.7778 -29.7755 -29.7382 -29.7365 -29.7254 -29.7245 -8.2021 -8.2019 -7.4962 -7.4959 -5.0671 -5.0665 -4.5987 -4.5974 -0.1225 -0.1222 0.8960 0.8963 2.8267 2.8271 3.1814 3.1830 4.8506 4.8527 5.2410 5.2438 6.2415 6.2432 6.4255 6.4275 7.7154 7.7196 8.4390 8.4434 8.8001 8.8032 9.3945 9.3978 14.2261 14.2266 15.4064 15.4080 16.3549 16.3588 16.8105 16.8144 17.9409 17.9444 k =-0.2456 0.3195 0.6599 ( 3313 PWs) bands (ev): -63.0846 -63.0846 -63.0815 -63.0815 -30.0587 -30.0552 -30.0483 -30.0442 -29.7944 -29.7919 -29.7778 -29.7754 -29.7383 -29.7365 -29.7253 -29.7245 -8.2226 -8.2225 -7.4876 -7.4873 -5.0743 -5.0737 -4.5704 -4.5691 -0.1449 -0.1445 0.9435 0.9438 2.8157 2.8161 3.1937 3.1953 4.8713 4.8732 5.2376 5.2401 6.2093 6.2111 6.4523 6.4538 7.6570 7.6612 8.4326 8.4368 8.7752 8.7782 9.4090 9.4122 14.1672 14.1676 15.4208 15.4224 16.3726 16.3763 16.8323 16.8362 17.9385 17.9418 k =-0.2521 0.3280 0.6492 ( 3315 PWs) bands (ev): -63.0847 -63.0847 -63.0814 -63.0814 -30.0589 -30.0554 -30.0481 -30.0440 -29.7946 -29.7920 -29.7777 -29.7753 -29.7384 -29.7365 -29.7252 -29.7244 -8.2416 -8.2415 -7.4799 -7.4796 -5.0811 -5.0805 -4.5429 -4.5416 -0.1668 -0.1663 0.9888 0.9890 2.8043 2.8047 3.2054 3.2072 4.8944 4.8960 5.2328 5.2352 6.1756 6.1773 6.4828 6.4840 7.5994 7.6035 8.4263 8.4305 8.7514 8.7542 9.4227 9.4256 14.1114 14.1118 15.4336 15.4351 16.3913 16.3949 16.8518 16.8556 17.9360 17.9392 k =-0.2586 0.3365 0.6385 ( 3311 PWs) bands (ev): -63.0847 -63.0847 -63.0813 -63.0813 -30.0590 -30.0556 -30.0478 -30.0438 -29.7947 -29.7921 -29.7777 -29.7752 -29.7384 -29.7365 -29.7252 -29.7243 -8.2590 -8.2589 -7.4732 -7.4729 -5.0874 -5.0868 -4.5166 -4.5152 -0.1880 -0.1874 1.0316 1.0319 2.7927 2.7931 3.2166 3.2185 4.9193 4.9207 5.2275 5.2298 6.1408 6.1425 6.5165 6.5172 7.5427 7.5467 8.4203 8.4244 8.7288 8.7315 9.4355 9.4382 14.0592 14.0595 15.4446 15.4462 16.4107 16.4143 16.8687 16.8726 17.9334 17.9364 k =-0.2651 0.3449 0.6278 ( 3315 PWs) bands (ev): -63.0848 -63.0848 -63.0813 -63.0813 -30.0591 -30.0558 -30.0476 -30.0436 -29.7948 -29.7921 -29.7777 -29.7751 -29.7385 -29.7365 -29.7251 -29.7243 -8.2748 -8.2746 -7.4674 -7.4671 -5.0931 -5.0926 -4.4917 -4.4902 -0.2082 -0.2075 1.0718 1.0720 2.7810 2.7814 3.2270 3.2290 4.9453 4.9463 5.2222 5.2246 6.1053 6.1069 6.5525 6.5528 7.4871 7.4910 8.4147 8.4186 8.7077 8.7103 9.4473 9.4498 14.0109 14.0112 15.4542 15.4557 16.4305 16.4339 16.8832 16.8871 17.9305 17.9333 k =-0.2717 0.3534 0.6171 ( 3311 PWs) bands (ev): -63.0848 -63.0848 -63.0812 -63.0812 -30.0592 -30.0560 -30.0474 -30.0434 -29.7949 -29.7922 -29.7777 -29.7750 -29.7385 -29.7365 -29.7250 -29.7242 -8.2889 -8.2888 -7.4624 -7.4620 -5.0984 -5.0978 -4.4685 -4.4670 -0.2271 -0.2263 1.1089 1.1091 2.7695 2.7698 3.2366 3.2388 4.9714 4.9721 5.2178 5.2203 6.0696 6.0712 6.5901 6.5902 7.4328 7.4365 8.4095 8.4133 8.6883 8.6907 9.4581 9.4604 13.9668 13.9671 15.4622 15.4638 16.4503 16.4536 16.8954 16.8992 17.9274 17.9300 k =-0.2782 0.3619 0.6064 ( 3309 PWs) bands (ev): -63.0849 -63.0849 -63.0812 -63.0812 -30.0593 -30.0561 -30.0472 -30.0432 -29.7950 -29.7923 -29.7776 -29.7749 -29.7386 -29.7365 -29.7250 -29.7241 -8.3014 -8.3013 -7.4582 -7.4577 -5.1031 -5.1025 -4.4473 -4.4457 -0.2445 -0.2437 1.1426 1.1428 2.7584 2.7588 3.2454 3.2477 4.9966 4.9970 5.2150 5.2178 6.0343 6.0360 6.6287 6.6291 7.3800 7.3836 8.4048 8.4084 8.6708 8.6730 9.4678 9.4699 13.9273 13.9276 15.4689 15.4705 16.4695 16.4727 16.9053 16.9091 17.9241 17.9266 k =-0.2847 0.3704 0.5956 ( 3304 PWs) bands (ev): -63.0849 -63.0849 -63.0811 -63.0811 -30.0594 -30.0562 -30.0470 -30.0431 -29.7951 -29.7923 -29.7776 -29.7748 -29.7386 -29.7365 -29.7249 -29.7241 -8.3122 -8.3121 -7.4546 -7.4541 -5.1072 -5.1066 -4.4284 -4.4267 -0.2602 -0.2593 1.1727 1.1728 2.7481 2.7484 3.2532 3.2556 5.0194 5.0199 5.2146 5.2177 6.0002 6.0018 6.6678 6.6686 7.3291 7.3325 8.4007 8.4042 8.6552 8.6573 9.4764 9.4782 13.8924 13.8927 15.4744 15.4760 16.4878 16.4909 16.9131 16.9169 17.9208 17.9232 k =-0.2912 0.3789 0.5849 ( 3308 PWs) bands (ev): -63.0849 -63.0849 -63.0811 -63.0811 -30.0595 -30.0563 -30.0469 -30.0430 -29.7951 -29.7924 -29.7776 -29.7747 -29.7386 -29.7365 -29.7249 -29.7241 -8.3214 -8.3213 -7.4516 -7.4512 -5.1107 -5.1102 -4.4119 -4.4102 -0.2739 -0.2729 1.1988 1.1989 2.7387 2.7390 3.2600 3.2625 5.0387 5.0395 5.2171 5.2205 5.9681 5.9696 6.7068 6.7079 7.2804 7.2836 8.3971 8.4005 8.6418 8.6437 9.4837 9.4854 13.8625 13.8629 15.4788 15.4803 16.5045 16.5075 16.9190 16.9228 17.9177 17.9200 k =-0.2978 0.3874 0.5742 ( 3301 PWs) bands (ev): -63.0850 -63.0850 -63.0811 -63.0811 -30.0595 -30.0564 -30.0467 -30.0429 -29.7952 -29.7924 -29.7776 -29.7747 -29.7386 -29.7365 -29.7248 -29.7240 -8.3289 -8.3289 -7.4493 -7.4488 -5.1136 -5.1130 -4.3981 -4.3964 -0.2854 -0.2844 1.2206 1.2207 2.7307 2.7309 3.2656 3.2682 5.0538 5.0547 5.2225 5.2262 5.9391 5.9405 6.7448 6.7460 7.2349 7.2379 8.3942 8.3975 8.6306 8.6324 9.4898 9.4913 13.8378 13.8382 15.4823 15.4838 16.5192 16.5221 16.9234 16.9271 17.9149 17.9173 k =-0.3043 0.3959 0.5635 ( 3301 PWs) bands (ev): -63.0850 -63.0850 -63.0811 -63.0811 -30.0596 -30.0565 -30.0466 -30.0428 -29.7952 -29.7924 -29.7776 -29.7747 -29.7387 -29.7365 -29.7248 -29.7240 -8.3348 -8.3347 -7.4475 -7.4470 -5.1158 -5.1153 -4.3872 -4.3854 -0.2945 -0.2934 1.2378 1.2379 2.7241 2.7243 3.2701 3.2727 5.0644 5.0655 5.2298 5.2336 5.9144 5.9158 6.7802 6.7816 7.1938 7.1965 8.3920 8.3951 8.6218 8.6235 9.4946 9.4959 13.8184 13.8188 15.4848 15.4863 16.5313 16.5341 16.9263 16.9300 17.9129 17.9152 k =-0.3108 0.4044 0.5528 ( 3297 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0466 -30.0427 -29.7952 -29.7924 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7240 -8.3390 -8.3389 -7.4462 -7.4457 -5.1174 -5.1169 -4.3793 -4.3775 -0.3012 -0.3000 1.2503 1.2504 2.7193 2.7194 3.2733 3.2760 5.0712 5.0722 5.2374 5.2410 5.8955 5.8967 6.8106 6.8122 7.1594 7.1617 8.3904 8.3934 8.6154 8.6171 9.4981 9.4992 13.8045 13.8049 15.4866 15.4880 16.5403 16.5431 16.9282 16.9319 17.9118 17.9142 k =-0.3173 0.4128 0.5421 ( 3299 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0465 -30.0427 -29.7953 -29.7925 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7240 -8.3415 -8.3414 -7.4455 -7.4450 -5.1184 -5.1179 -4.3745 -4.3727 -0.3052 -0.3040 1.2579 1.2580 2.7163 2.7164 3.2753 3.2780 5.0748 5.0758 5.2429 5.2465 5.8835 5.8847 6.8323 6.8338 7.1356 7.1375 8.3894 8.3924 8.6116 8.6131 9.5002 9.5012 13.7961 13.7965 15.4876 15.4890 16.5459 16.5486 16.9292 16.9329 17.9119 17.9144 k =-0.3238 0.4213 0.5314 ( 3292 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0465 -30.0427 -29.7952 -29.7924 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7239 -8.3423 -8.3423 -7.4452 -7.4447 -5.1187 -5.1182 -4.3729 -4.3711 -0.3065 -0.3054 1.2605 1.2605 2.7153 2.7154 3.2759 3.2786 5.0760 5.0770 5.2450 5.2485 5.8794 5.8805 6.8403 6.8419 7.1269 7.1286 8.3891 8.3921 8.6103 8.6119 9.5009 9.5019 13.7933 13.7937 15.4880 15.4894 16.5479 16.5505 16.9296 16.9332 17.9126 17.9156 k =-0.3238 0.4213 0.5314 ( 3292 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0465 -30.0427 -29.7952 -29.7924 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7239 -8.3423 -8.3423 -7.4452 -7.4447 -5.1187 -5.1182 -4.3729 -4.3711 -0.3065 -0.3054 1.2605 1.2605 2.7153 2.7154 3.2759 3.2786 5.0760 5.0770 5.2450 5.2485 5.8794 5.8805 6.8403 6.8419 7.1269 7.1286 8.3891 8.3921 8.6103 8.6119 9.5009 9.5019 13.7933 13.7937 15.4880 15.4894 16.5479 16.5505 16.9296 16.9332 17.9126 17.9156 k =-0.3174 0.4129 0.5208 ( 3294 PWs) bands (ev): -63.0852 -63.0852 -63.0809 -63.0809 -30.0601 -30.0570 -30.0461 -30.0422 -29.7955 -29.7926 -29.7772 -29.7743 -29.7389 -29.7367 -29.7247 -29.7239 -8.3679 -8.3679 -7.3966 -7.3961 -5.1323 -5.1317 -4.3687 -4.3669 -0.3602 -0.3591 1.2784 1.2784 2.6790 2.6791 3.2811 3.2838 5.0985 5.0997 5.2261 5.2298 5.9174 5.9185 6.8204 6.8220 7.1608 7.1625 8.4297 8.4326 8.5643 8.5659 9.4940 9.4948 13.8120 13.8126 15.5297 15.5310 16.5603 16.5632 17.0144 17.0182 17.7988 17.7999 k =-0.3109 0.4045 0.5102 ( 3298 PWs) bands (ev): -63.0853 -63.0853 -63.0808 -63.0808 -30.0605 -30.0574 -30.0458 -30.0418 -29.7957 -29.7927 -29.7769 -29.7739 -29.7392 -29.7368 -29.7248 -29.7238 -8.3951 -8.3951 -7.3464 -7.3459 -5.1432 -5.1427 -4.3646 -4.3628 -0.4153 -0.4142 1.2938 1.2938 2.6428 2.6428 3.2868 3.2896 5.1015 5.1022 5.2334 5.2365 5.9560 5.9570 6.7987 6.8005 7.1955 7.1971 8.4674 8.4701 8.5180 8.5197 9.4855 9.4862 13.8339 13.8347 15.5679 15.5689 16.5642 16.5672 17.0985 17.1027 17.6833 17.6851 k =-0.3044 0.3961 0.4995 ( 3296 PWs) bands (ev): -63.0854 -63.0854 -63.0806 -63.0806 -30.0610 -30.0578 -30.0454 -30.0413 -29.7959 -29.7929 -29.7765 -29.7736 -29.7394 -29.7369 -29.7248 -29.7238 -8.4238 -8.4238 -7.2948 -7.2942 -5.1516 -5.1511 -4.3606 -4.3588 -0.4716 -0.4705 1.3071 1.3071 2.6067 2.6067 3.2930 3.2958 5.0846 5.0846 5.2666 5.2689 5.9952 5.9961 6.7756 6.7774 7.2309 7.2325 8.4716 8.4729 8.5022 8.5052 9.4755 9.4761 13.8588 13.8597 15.6024 15.6032 16.5603 16.5635 17.1759 17.1808 17.5770 17.5797 k =-0.2979 0.3876 0.4889 ( 3300 PWs) bands (ev): -63.0856 -63.0856 -63.0805 -63.0805 -30.0615 -30.0583 -30.0450 -30.0408 -29.7962 -29.7931 -29.7762 -29.7733 -29.7397 -29.7371 -29.7248 -29.7237 -8.4539 -8.4539 -7.2416 -7.2411 -5.1575 -5.1569 -4.3568 -4.3550 -0.5292 -0.5281 1.3183 1.3183 2.5709 2.5709 3.2994 3.3022 5.0589 5.0593 5.3130 5.3148 6.0348 6.0356 6.7513 6.7532 7.2669 7.2685 8.4253 8.4267 8.5339 8.5366 9.4641 9.4646 13.8865 13.8876 15.6334 15.6340 16.5499 16.5532 17.2250 17.2305 17.5021 17.5056 k =-0.2915 0.3792 0.4783 ( 3302 PWs) bands (ev): -63.0857 -63.0857 -63.0803 -63.0803 -30.0620 -30.0588 -30.0445 -30.0403 -29.7964 -29.7932 -29.7758 -29.7730 -29.7399 -29.7372 -29.7247 -29.7237 -8.4854 -8.4854 -7.1871 -7.1865 -5.1608 -5.1603 -4.3532 -4.3514 -0.5878 -0.5867 1.3277 1.3278 2.5354 2.5355 3.3061 3.3089 5.0313 5.0318 5.3660 5.3677 6.0750 6.0757 6.7262 6.7281 7.3034 7.3048 8.3791 8.3806 8.5625 8.5651 9.4514 9.4518 13.9167 13.9180 15.6611 15.6615 16.5341 16.5375 17.2000 17.2042 17.5063 17.5086 k =-0.2850 0.3708 0.4676 ( 3294 PWs) bands (ev): -63.0859 -63.0859 -63.0802 -63.0802 -30.0624 -30.0592 -30.0441 -30.0398 -29.7967 -29.7934 -29.7754 -29.7726 -29.7401 -29.7373 -29.7247 -29.7236 -8.5182 -8.5182 -7.1311 -7.1305 -5.1617 -5.1611 -4.3497 -4.3479 -0.6475 -0.6464 1.3356 1.3357 2.5005 2.5005 3.3129 3.3157 5.0038 5.0044 5.4229 5.4244 6.1157 6.1163 6.7008 6.7027 7.3400 7.3413 8.3333 8.3347 8.5880 8.5904 9.4376 9.4378 13.9494 13.9508 15.6857 15.6858 16.5141 16.5176 17.1128 17.1153 17.5761 17.5768 k =-0.2785 0.3623 0.4570 ( 3284 PWs) bands (ev): -63.0860 -63.0860 -63.0801 -63.0801 -30.0629 -30.0597 -30.0436 -30.0393 -29.7969 -29.7936 -29.7750 -29.7723 -29.7403 -29.7374 -29.7247 -29.7235 -8.5521 -8.5521 -7.0737 -7.0731 -5.1602 -5.1596 -4.3464 -4.3446 -0.7081 -0.7070 1.3421 1.3423 2.4660 2.4661 3.3196 3.3225 4.9774 4.9779 5.4819 5.4834 6.1567 6.1572 6.6756 6.6776 7.3765 7.3776 8.2881 8.2894 8.6103 8.6126 9.4227 9.4228 13.9842 13.9858 15.7072 15.7074 16.4910 16.4946 17.0046 17.0063 17.6688 17.6689 k =-0.2720 0.3539 0.4464 ( 3284 PWs) bands (ev): -63.0861 -63.0861 -63.0799 -63.0799 -30.0634 -30.0601 -30.0431 -30.0387 -29.7972 -29.7938 -29.7746 -29.7719 -29.7405 -29.7375 -29.7247 -29.7235 -8.5871 -8.5871 -7.0150 -7.0144 -5.1564 -5.1558 -4.3433 -4.3415 -0.7695 -0.7685 1.3477 1.3479 2.4322 2.4323 3.3261 3.3290 4.9524 4.9528 5.5415 5.5431 6.1981 6.1985 6.6516 6.6535 7.4125 7.4133 8.2439 8.2450 8.6293 8.6315 9.4069 9.4069 14.0209 14.0227 15.7258 15.7263 16.4656 16.4693 16.8902 16.8914 17.7696 17.7702 k =-0.2656 0.3455 0.4358 ( 3284 PWs) bands (ev): -63.0863 -63.0863 -63.0798 -63.0798 -30.0639 -30.0606 -30.0426 -30.0382 -29.7975 -29.7940 -29.7742 -29.7716 -29.7407 -29.7376 -29.7247 -29.7234 -8.6231 -8.6231 -6.9550 -6.9543 -5.1505 -5.1498 -4.3403 -4.3386 -0.8318 -0.8307 1.3525 1.3527 2.3991 2.3992 3.3323 3.3352 4.9290 4.9293 5.6003 5.6019 6.2398 6.2401 6.6298 6.6317 7.4473 7.4479 8.2011 8.2021 8.6452 8.6472 9.3902 9.3903 14.0592 14.0612 15.7418 15.7425 16.4389 16.4426 16.7741 16.7750 17.8748 17.8756 k =-0.2591 0.3371 0.4251 ( 3288 PWs) bands (ev): -63.0864 -63.0864 -63.0796 -63.0796 -30.0643 -30.0611 -30.0421 -30.0377 -29.7978 -29.7942 -29.7738 -29.7713 -29.7409 -29.7377 -29.7247 -29.7234 -8.6599 -8.6599 -6.8937 -6.8930 -5.1424 -5.1418 -4.3376 -4.3359 -0.8947 -0.8937 1.3567 1.3570 2.3668 2.3670 3.3380 3.3409 4.9073 4.9075 5.6564 5.6581 6.2818 6.2819 6.6117 6.6135 7.4802 7.4804 8.1607 8.1614 8.6579 8.6598 9.3731 9.3733 14.0990 14.1012 15.7550 15.7559 16.4115 16.4152 16.6581 16.6590 17.9822 17.9831 k =-0.2526 0.3286 0.4145 ( 3288 PWs) bands (ev): -63.0866 -63.0866 -63.0795 -63.0795 -30.0648 -30.0615 -30.0416 -30.0372 -29.7980 -29.7944 -29.7734 -29.7710 -29.7411 -29.7379 -29.7247 -29.7234 -8.6974 -8.6974 -6.8311 -6.8304 -5.1325 -5.1318 -4.3351 -4.3334 -0.9584 -0.9574 1.3607 1.3610 2.3354 2.3356 3.3431 3.3460 4.8874 4.8874 5.7076 5.7096 6.3240 6.3240 6.5991 6.6009 7.5099 7.5101 8.1235 8.1239 8.6676 8.6693 9.3557 9.3560 14.1401 14.1423 15.7651 15.7664 16.3839 16.3877 16.5437 16.5445 18.0905 18.0915 k =-0.2461 0.3202 0.4039 ( 3291 PWs) bands (ev): -63.0867 -63.0867 -63.0793 -63.0793 -30.0652 -30.0620 -30.0411 -30.0366 -29.7984 -29.7946 -29.7730 -29.7706 -29.7413 -29.7380 -29.7247 -29.7234 -8.7355 -8.7355 -6.7674 -6.7667 -5.1207 -5.1201 -4.3328 -4.3311 -1.0225 -1.0216 1.3647 1.3651 2.3050 2.3052 3.3475 3.3504 4.8692 4.8693 5.7516 5.7537 6.3662 6.3663 6.5943 6.5959 7.5346 7.5354 8.0912 8.0913 8.6741 8.6756 9.3382 9.3386 14.1821 14.1845 15.7716 15.7732 16.3566 16.3605 16.4323 16.4330 18.1066 18.1087 k =-0.2396 0.3118 0.3932 ( 3295 PWs) bands (ev): -63.0869 -63.0869 -63.0792 -63.0792 -30.0657 -30.0625 -30.0406 -30.0361 -29.7987 -29.7949 -29.7726 -29.7703 -29.7414 -29.7382 -29.7247 -29.7233 -8.7741 -8.7741 -6.7024 -6.7018 -5.1073 -5.1067 -4.3308 -4.3291 -1.0873 -1.0863 1.3689 1.3693 2.2757 2.2759 3.3510 3.3539 4.8528 4.8530 5.7856 5.7879 6.4085 6.4088 6.5995 6.6009 7.5526 7.5541 8.0652 8.0658 8.6777 8.6791 9.3209 9.3214 14.2248 14.2274 15.7729 15.7747 16.3236 16.3264 16.3323 16.3341 18.0623 18.0642 k =-0.2332 0.3034 0.3826 ( 3293 PWs) bands (ev): -63.0870 -63.0870 -63.0790 -63.0790 -30.0661 -30.0629 -30.0401 -30.0356 -29.7990 -29.7952 -29.7721 -29.7700 -29.7416 -29.7383 -29.7246 -29.7233 -8.8130 -8.8129 -6.6364 -6.6357 -5.0923 -5.0917 -4.3289 -4.3273 -1.1524 -1.1515 1.3736 1.3740 2.2475 2.2478 3.3535 3.3564 4.8383 4.8386 5.8075 5.8101 6.4509 6.4512 6.6167 6.6180 7.5617 7.5638 8.0482 8.0494 8.6786 8.6798 9.3041 9.3046 14.2681 14.2708 15.7663 15.7684 16.2270 16.2281 16.3050 16.3085 18.0169 18.0186 k =-0.2267 0.2949 0.3720 ( 3293 PWs) bands (ev): -63.0872 -63.0872 -63.0789 -63.0789 -30.0666 -30.0634 -30.0396 -30.0350 -29.7993 -29.7954 -29.7717 -29.7696 -29.7418 -29.7385 -29.7246 -29.7233 -8.8521 -8.8521 -6.5693 -6.5686 -5.0760 -5.0755 -4.3272 -4.3257 -1.2180 -1.2171 1.3789 1.3793 2.2205 2.2208 3.3549 3.3577 4.8255 4.8260 5.8161 5.8189 6.4931 6.4936 6.6468 6.6480 7.5600 7.5629 8.0421 8.0438 8.6768 8.6778 9.2878 9.2884 14.3116 14.3144 15.7471 15.7492 16.1419 16.1429 16.2805 16.2841 17.9712 17.9727 k =-0.2202 0.2865 0.3614 ( 3297 PWs) bands (ev): -63.0873 -63.0873 -63.0787 -63.0787 -30.0670 -30.0639 -30.0390 -30.0345 -29.7996 -29.7957 -29.7713 -29.7693 -29.7420 -29.7387 -29.7245 -29.7233 -8.8913 -8.8913 -6.5012 -6.5004 -5.0585 -5.0580 -4.3257 -4.3242 -1.2840 -1.2831 1.3850 1.3855 2.1948 2.1951 3.3550 3.3578 4.8146 4.8153 5.8116 5.8145 6.5351 6.5358 6.6894 6.6904 7.5472 7.5506 8.0474 8.0495 8.6725 8.6734 9.2723 9.2731 14.3552 14.3581 15.7091 15.7111 16.0766 16.0773 16.2574 16.2609 17.9254 17.9267 k =-0.2137 0.2781 0.3507 ( 3293 PWs) bands (ev): -63.0875 -63.0875 -63.0786 -63.0786 -30.0674 -30.0643 -30.0385 -30.0340 -29.7999 -29.7960 -29.7708 -29.7689 -29.7421 -29.7388 -29.7245 -29.7232 -8.9305 -8.9304 -6.4320 -6.4313 -5.0399 -5.0394 -4.3244 -4.3230 -1.3502 -1.3494 1.3921 1.3927 2.1704 2.1708 3.3537 3.3566 4.8055 4.8063 5.7952 5.7982 6.5768 6.5776 6.7429 6.7439 7.5242 7.5279 8.0632 8.0655 8.6661 8.6668 9.2579 9.2587 14.3983 14.4013 15.6497 15.6513 16.0345 16.0346 16.2356 16.2391 17.8802 17.8813 k =-0.2073 0.2697 0.3401 ( 3301 PWs) bands (ev): -63.0876 -63.0876 -63.0785 -63.0785 -30.0678 -30.0648 -30.0379 -30.0335 -29.8002 -29.7963 -29.7704 -29.7685 -29.7423 -29.7391 -29.7244 -29.7232 -8.9695 -8.9695 -6.3620 -6.3613 -5.0205 -5.0200 -4.3233 -4.3219 -1.4167 -1.4159 1.4004 1.4010 2.1475 2.1479 3.3510 3.3538 4.7981 4.7990 5.7687 5.7718 6.6179 6.6188 6.8053 6.8062 7.4931 7.4970 8.0877 8.0900 8.6578 8.6583 9.2446 9.2454 14.4406 14.4436 15.5725 15.5737 16.0114 16.0118 16.2150 16.2185 17.8358 17.8367 k =-0.2008 0.2612 0.3295 ( 3297 PWs) bands (ev): -63.0877 -63.0877 -63.0783 -63.0783 -30.0682 -30.0652 -30.0374 -30.0329 -29.8006 -29.7966 -29.7699 -29.7682 -29.7425 -29.7393 -29.7243 -29.7231 -9.0083 -9.0083 -6.2911 -6.2903 -5.0002 -4.9998 -4.3223 -4.3210 -1.4835 -1.4827 1.4100 1.4106 2.1260 2.1265 3.3467 3.3496 4.7924 4.7935 5.7340 5.7371 6.6581 6.6591 6.8743 6.8752 7.4562 7.4602 8.1186 8.1208 8.6478 8.6482 9.2326 9.2334 14.4814 14.4845 15.4851 15.4859 16.0010 16.0018 16.1958 16.1992 17.7926 17.7934 k =-0.1943 0.2528 0.3188 ( 3297 PWs) bands (ev): -63.0879 -63.0879 -63.0782 -63.0782 -30.0686 -30.0657 -30.0368 -30.0324 -29.8009 -29.7969 -29.7694 -29.7678 -29.7427 -29.7395 -29.7242 -29.7231 -9.0468 -9.0468 -6.2193 -6.2186 -4.9794 -4.9790 -4.3215 -4.3202 -1.5505 -1.5497 1.4211 1.4217 2.1061 2.1066 3.3408 3.3436 4.7884 4.7896 5.6927 5.6959 6.6970 6.6981 6.9479 6.9489 7.4157 7.4197 8.1542 8.1563 8.6367 8.6369 9.2221 9.2229 14.5196 14.5227 15.3940 15.3945 15.9978 15.9989 16.1778 16.1811 17.7510 17.7517 k =-0.1878 0.2444 0.3082 ( 3303 PWs) bands (ev): -63.0880 -63.0880 -63.0780 -63.0780 -30.0690 -30.0661 -30.0363 -30.0319 -29.8012 -29.7973 -29.7689 -29.7674 -29.7429 -29.7398 -29.7241 -29.7231 -9.0848 -9.0848 -6.1468 -6.1460 -4.9581 -4.9578 -4.3207 -4.3196 -1.6176 -1.6169 1.4336 1.4342 2.0878 2.0883 3.3332 3.3360 4.7859 4.7873 5.6462 5.6493 6.7340 6.7352 7.0246 7.0256 7.3735 7.3774 8.1932 8.1951 8.6247 8.6248 9.2130 9.2138 14.5535 14.5565 15.3041 15.3043 15.9983 15.9996 16.1608 16.1641 17.7113 17.7119 k =-0.1814 0.2359 0.2976 ( 3303 PWs) bands (ev): -63.0882 -63.0882 -63.0779 -63.0779 -30.0693 -30.0665 -30.0357 -30.0314 -29.8015 -29.7976 -29.7684 -29.7670 -29.7431 -29.7400 -29.7240 -29.7230 -9.1223 -9.1223 -6.0736 -6.0728 -4.9365 -4.9362 -4.3201 -4.3190 -1.6849 -1.6842 1.4478 1.4485 2.0711 2.0717 3.3238 3.3265 4.7850 4.7864 5.5954 5.5985 6.7682 6.7694 7.1029 7.1040 7.3315 7.3353 8.2344 8.2361 8.6124 8.6125 9.2055 9.2062 14.5802 14.5832 15.2203 15.2204 16.0006 16.0021 16.1448 16.1479 17.6738 17.6743 k =-0.1749 0.2275 0.2870 ( 3305 PWs) bands (ev): -63.0883 -63.0883 -63.0778 -63.0778 -30.0697 -30.0670 -30.0352 -30.0309 -29.8018 -29.7979 -29.7679 -29.7666 -29.7433 -29.7403 -29.7239 -29.7230 -9.1592 -9.1592 -5.9997 -5.9989 -4.9148 -4.9145 -4.3195 -4.3185 -1.7522 -1.7516 1.4638 1.4645 2.0562 2.0568 3.3126 3.3152 4.7854 4.7870 5.5411 5.5441 6.7983 6.7994 7.1815 7.1827 7.2918 7.2955 8.2773 8.2787 8.6004 8.6007 9.1996 9.2002 14.5952 14.5980 15.1481 15.1485 16.0034 16.0051 16.1296 16.1325 17.6388 17.6392 k =-0.1684 0.2191 0.2763 ( 3309 PWs) bands (ev): -63.0884 -63.0884 -63.0777 -63.0777 -30.0700 -30.0674 -30.0346 -30.0304 -29.8022 -29.7983 -29.7674 -29.7661 -29.7435 -29.7407 -29.7238 -29.7229 -9.1953 -9.1953 -5.9252 -5.9244 -4.8930 -4.8928 -4.3190 -4.3181 -1.8197 -1.8191 1.4815 1.4822 2.0429 2.0436 3.2995 3.3021 4.7871 4.7888 5.4839 5.4868 6.8220 6.8231 7.2567 7.2593 7.2606 7.2610 8.3211 8.3223 8.5894 8.5898 9.1953 9.1958 14.5921 14.5945 15.0948 15.0957 16.0058 16.0075 16.1149 16.1177 17.6067 17.6071 k =-0.1619 0.2107 0.2657 ( 3317 PWs) bands (ev): -63.0886 -63.0886 -63.0775 -63.0775 -30.0704 -30.0678 -30.0341 -30.0300 -29.8025 -29.7986 -29.7669 -29.7657 -29.7437 -29.7410 -29.7237 -29.7229 -9.2307 -9.2307 -5.8502 -5.8495 -4.8714 -4.8712 -4.3184 -4.3176 -1.8873 -1.8866 1.5011 1.5018 2.0315 2.0321 3.2845 3.2871 4.7900 4.7918 5.4244 5.4272 6.8367 6.8375 7.2308 7.2338 7.3350 7.3364 8.3655 8.3664 8.5802 8.5807 9.1924 9.1929 14.5656 14.5676 15.0661 15.0676 16.0071 16.0088 16.1006 16.1033 17.5777 17.5780 k =-0.1554 0.2022 0.2551 ( 3315 PWs) bands (ev): -63.0887 -63.0887 -63.0774 -63.0774 -30.0707 -30.0682 -30.0336 -30.0295 -29.8028 -29.7990 -29.7664 -29.7653 -29.7440 -29.7413 -29.7236 -29.7228 -9.2652 -9.2652 -5.7748 -5.7740 -4.8500 -4.8499 -4.3178 -4.3171 -1.9548 -1.9542 1.5226 1.5233 2.0218 2.0225 3.2676 3.2702 4.7939 4.7958 5.3629 5.3657 6.8394 6.8398 7.2161 7.2185 7.4077 7.4092 8.4101 8.4108 8.5738 8.5743 9.1911 9.1915 14.5159 14.5175 15.0623 15.0642 16.0066 16.0084 16.0866 16.0891 17.5521 17.5525 k =-0.1490 0.1938 0.2444 ( 3309 PWs) bands (ev): -63.0888 -63.0888 -63.0773 -63.0773 -30.0710 -30.0685 -30.0330 -30.0291 -29.8030 -29.7993 -29.7659 -29.7648 -29.7442 -29.7417 -29.7234 -29.7227 -9.2988 -9.2987 -5.6990 -5.6982 -4.8290 -4.8289 -4.3172 -4.3166 -2.0224 -2.0219 1.5459 1.5467 2.0141 2.0148 3.2489 3.2514 4.7987 4.8006 5.3000 5.3026 6.8286 6.8288 7.2145 7.2162 7.4760 7.4777 8.4547 8.4551 8.5710 8.5715 9.1912 9.1914 14.4489 14.4503 15.0777 15.0799 16.0040 16.0057 16.0726 16.0749 17.5303 17.5307 k =-0.1425 0.1854 0.2338 ( 3309 PWs) bands (ev): -63.0889 -63.0889 -63.0772 -63.0772 -30.0713 -30.0689 -30.0325 -30.0286 -29.8033 -29.7997 -29.7653 -29.7644 -29.7445 -29.7420 -29.7233 -29.7227 -9.3314 -9.3313 -5.6229 -5.6221 -4.8085 -4.8085 -4.3164 -4.3159 -2.0900 -2.0895 1.5711 1.5719 2.0082 2.0089 3.2284 3.2307 4.8041 4.8060 5.2360 5.2384 6.8053 6.8060 7.2250 7.2261 7.5389 7.5407 8.4990 8.4991 8.5730 8.5735 9.1926 9.1927 14.3715 14.3727 15.1056 15.1079 15.9987 16.0004 16.0584 16.0605 17.5124 17.5128 k =-0.1360 0.1770 0.2232 ( 3305 PWs) bands (ev): -63.0890 -63.0890 -63.0770 -63.0770 -30.0715 -30.0693 -30.0319 -30.0282 -29.8036 -29.8000 -29.7648 -29.7639 -29.7447 -29.7424 -29.7231 -29.7226 -9.3629 -9.3628 -5.5466 -5.5458 -4.7886 -4.7885 -4.3156 -4.3152 -2.1575 -2.1570 1.5982 1.5991 2.0042 2.0049 3.2060 3.2083 4.8097 4.8115 5.1715 5.1737 6.7729 6.7740 7.2448 7.2454 7.5950 7.5971 8.5426 8.5426 8.5809 8.5813 9.1951 9.1953 14.2886 14.2897 15.1411 15.1436 15.9903 15.9920 16.0441 16.0459 17.4986 17.4990 k =-0.1295 0.1685 0.2126 ( 3313 PWs) bands (ev): -63.0891 -63.0891 -63.0769 -63.0769 -30.0718 -30.0696 -30.0314 -30.0278 -29.8039 -29.8004 -29.7643 -29.7635 -29.7450 -29.7428 -29.7230 -29.7225 -9.3933 -9.3932 -5.4701 -5.4694 -4.7695 -4.7694 -4.3146 -4.3143 -2.2250 -2.2246 1.6271 1.6280 2.0021 2.0028 3.1819 3.1841 4.8148 4.8164 5.1072 5.1091 6.7347 6.7360 7.2707 7.2710 7.6435 7.6458 8.5845 8.5847 8.5963 8.5964 9.1987 9.1990 14.2033 14.2045 15.1813 15.1838 15.9786 15.9802 16.0293 16.0310 17.4891 17.4896 k =-0.1231 0.1601 0.2019 ( 3309 PWs) bands (ev): -63.0893 -63.0893 -63.0768 -63.0768 -30.0720 -30.0699 -30.0309 -30.0275 -29.8041 -29.8007 -29.7638 -29.7630 -29.7453 -29.7432 -29.7229 -29.7224 -9.4225 -9.4224 -5.3936 -5.3929 -4.7512 -4.7510 -4.3134 -4.3132 -2.2924 -2.2920 1.6578 1.6586 2.0019 2.0027 3.1561 3.1582 4.8182 4.8195 5.0448 5.0462 6.6932 6.6947 7.3004 7.3004 7.6837 7.6862 8.6150 8.6157 8.6286 8.6296 9.2032 9.2037 14.1178 14.1189 15.2242 15.2267 15.9634 15.9649 16.0142 16.0157 17.4840 17.4846 k =-0.1166 0.1517 0.1913 ( 3305 PWs) bands (ev): -63.0894 -63.0894 -63.0767 -63.0767 -30.0723 -30.0702 -30.0304 -30.0271 -29.8043 -29.8011 -29.7632 -29.7625 -29.7456 -29.7436 -29.7227 -29.7224 -9.4505 -9.4504 -5.3172 -5.3165 -4.7338 -4.7335 -4.3120 -4.3119 -2.3596 -2.3593 1.6901 1.6909 2.0037 2.0044 3.1287 3.1307 4.8169 4.8174 4.9877 4.9881 6.6502 6.6517 7.3320 7.3323 7.7155 7.7182 8.6444 8.6448 8.6692 8.6703 9.2085 9.2092 14.0332 14.0343 15.2686 15.2711 15.9444 15.9458 15.9986 15.9999 17.4835 17.4841 k =-0.1101 0.1433 0.1807 ( 3301 PWs) bands (ev): -63.0894 -63.0894 -63.0766 -63.0766 -30.0725 -30.0705 -30.0299 -30.0267 -29.8045 -29.8014 -29.7627 -29.7620 -29.7459 -29.7440 -29.7226 -29.7223 -9.4772 -9.4771 -5.2410 -5.2403 -4.7173 -4.7170 -4.3104 -4.3104 -2.4267 -2.4264 1.7239 1.7248 2.0074 2.0081 3.0998 3.1018 4.8027 4.8036 4.9421 4.9431 6.6068 6.6084 7.3647 7.3651 7.7391 7.7419 8.6800 8.6803 8.7090 8.7103 9.2145 9.2154 13.9503 13.9514 15.3136 15.3161 15.9217 15.9230 15.9826 15.9837 17.4874 17.4882 k =-0.1036 0.1348 0.1701 ( 3299 PWs) bands (ev): -63.0895 -63.0895 -63.0765 -63.0765 -30.0727 -30.0708 -30.0295 -30.0264 -29.8047 -29.8017 -29.7621 -29.7615 -29.7462 -29.7445 -29.7225 -29.7222 -9.5026 -9.5025 -5.1651 -5.1644 -4.7019 -4.7015 -4.3086 -4.3085 -2.4935 -2.4932 1.7591 1.7600 2.0129 2.0137 3.0696 3.0715 4.7673 4.7694 4.9173 4.9197 6.5639 6.5655 7.3978 7.3982 7.7553 7.7582 8.7213 8.7214 8.7476 8.7491 9.2210 9.2221 13.8700 13.8710 15.3587 15.3611 15.8955 15.8967 15.9663 15.9672 17.4959 17.4967 k =-0.0972 0.1264 0.1594 ( 3303 PWs) bands (ev): -63.0896 -63.0896 -63.0764 -63.0764 -30.0728 -30.0711 -30.0290 -30.0261 -29.8049 -29.8020 -29.7616 -29.7611 -29.7465 -29.7449 -29.7224 -29.7221 -9.5266 -9.5266 -5.0897 -5.0890 -4.6875 -4.6871 -4.3066 -4.3065 -2.5600 -2.5598 1.7956 1.7964 2.0203 2.0210 3.0382 3.0400 4.7148 4.7174 4.9108 4.9136 6.5220 6.5236 7.4306 7.4311 7.7652 7.7682 8.7669 8.7669 8.7852 8.7868 9.2279 9.2292 13.7925 13.7935 15.4031 15.4055 15.8661 15.8672 15.9497 15.9505 17.5086 17.5095 k =-0.0907 0.1180 0.1488 ( 3305 PWs) bands (ev): -63.0897 -63.0897 -63.0764 -63.0764 -30.0730 -30.0714 -30.0286 -30.0259 -29.8051 -29.8024 -29.7611 -29.7606 -29.7469 -29.7454 -29.7222 -29.7221 -9.5493 -9.5493 -5.0148 -5.0141 -4.6743 -4.6738 -4.3044 -4.3042 -2.6261 -2.6259 1.8330 1.8338 2.0295 2.0302 3.0058 3.0074 4.6546 4.6572 4.9131 4.9161 6.4817 6.4832 7.4627 7.4633 7.7698 7.7729 8.8130 8.8138 8.8238 8.8249 9.2351 9.2365 13.7184 13.7194 15.4466 15.4489 15.8338 15.8348 15.9331 15.9337 17.5253 17.5263 k =-0.0842 0.1095 0.1382 ( 3297 PWs) bands (ev): -63.0898 -63.0898 -63.0763 -63.0763 -30.0731 -30.0716 -30.0282 -30.0256 -29.8052 -29.8027 -29.7605 -29.7601 -29.7472 -29.7458 -29.7221 -29.7219 -9.5705 -9.5705 -4.9408 -4.9401 -4.6622 -4.6617 -4.3020 -4.3017 -2.6917 -2.6915 1.8711 1.8720 2.0405 2.0412 2.9725 2.9740 4.5917 4.5942 4.9192 4.9220 6.4432 6.4447 7.4938 7.4945 7.7706 7.7737 8.8509 8.8529 8.8709 8.8709 9.2423 9.2440 13.6480 13.6490 15.4886 15.4909 15.7994 15.8003 15.9165 15.9170 17.5304 17.5341 k =-0.0777 0.1011 0.1275 ( 3293 PWs) bands (ev): -63.0899 -63.0899 -63.0762 -63.0762 -30.0733 -30.0719 -30.0277 -30.0253 -29.8053 -29.8029 -29.7600 -29.7596 -29.7475 -29.7463 -29.7220 -29.7219 -9.5903 -9.5903 -4.8678 -4.8671 -4.6512 -4.6507 -4.2994 -4.2991 -2.7565 -2.7564 1.9097 1.9106 2.0531 2.0538 2.9386 2.9400 4.5284 4.5307 4.9268 4.9296 6.4069 6.4083 7.5237 7.5243 7.7684 7.7714 8.8835 8.8858 8.9220 8.9220 9.2496 9.2513 13.5816 13.5826 15.5289 15.5311 15.7634 15.7643 15.9001 15.9005 17.5243 17.5283 k =-0.0712 0.0927 0.1169 ( 3293 PWs) bands (ev): -63.0899 -63.0899 -63.0762 -63.0762 -30.0734 -30.0721 -30.0274 -30.0251 -29.8055 -29.8032 -29.7595 -29.7591 -29.7479 -29.7467 -29.7219 -29.7218 -9.6086 -9.6086 -4.7960 -4.7954 -4.6413 -4.6408 -4.2967 -4.2964 -2.8205 -2.8204 1.9484 1.9492 2.0672 2.0679 2.9043 2.9055 4.4660 4.4681 4.9351 4.9377 6.3729 6.3742 7.5520 7.5526 7.7641 7.7670 8.9136 8.9160 8.9732 8.9733 9.2567 9.2585 13.5195 13.5204 15.5671 15.5691 15.7267 15.7275 15.8842 15.8844 17.5247 17.5288 k =-0.0648 0.0843 0.1063 ( 3291 PWs) bands (ev): -63.0900 -63.0900 -63.0761 -63.0761 -30.0735 -30.0723 -30.0270 -30.0249 -29.8056 -29.8035 -29.7589 -29.7586 -29.7482 -29.7472 -29.7218 -29.7217 -9.6254 -9.6254 -4.7259 -4.7253 -4.6326 -4.6320 -4.2940 -4.2936 -2.8833 -2.8833 1.9867 1.9875 2.0828 2.0834 2.8698 2.8709 4.4053 4.4073 4.9435 4.9460 6.3415 6.3426 7.5785 7.5791 7.7585 7.7613 8.9414 8.9439 9.0231 9.0232 9.2635 9.2654 13.4619 13.4627 15.6027 15.6046 15.6900 15.6908 15.8688 15.8690 17.5311 17.5353 k =-0.0583 0.0758 0.0957 ( 3287 PWs) bands (ev): -63.0900 -63.0900 -63.0760 -63.0760 -30.0736 -30.0725 -30.0266 -30.0248 -29.8056 -29.8038 -29.7584 -29.7581 -29.7486 -29.7477 -29.7217 -29.7216 -9.6407 -9.6407 -4.6578 -4.6572 -4.6248 -4.6243 -4.2912 -4.2908 -2.9447 -2.9446 2.0242 2.0250 2.0995 2.1001 2.8355 2.8365 4.3471 4.3489 4.9518 4.9541 6.3127 6.3137 7.6032 7.6037 7.7522 7.7548 8.9670 8.9696 9.0708 9.0709 9.2699 9.2719 13.4091 13.4099 15.6342 15.6363 15.6553 15.6562 15.8543 15.8543 17.5429 17.5470 k =-0.0518 0.0674 0.0850 ( 3283 PWs) bands (ev): -63.0901 -63.0901 -63.0760 -63.0760 -30.0737 -30.0727 -30.0263 -30.0246 -29.8057 -29.8040 -29.7579 -29.7577 -29.7490 -29.7481 -29.7216 -29.7216 -9.6544 -9.6544 -4.6181 -4.6176 -4.5921 -4.5916 -4.2885 -4.2881 -3.0040 -3.0040 2.0604 2.0611 2.1172 2.1177 2.8018 2.8027 4.2921 4.2937 4.9596 4.9617 6.2867 6.2876 7.6257 7.6262 7.7456 7.7480 8.9903 8.9928 9.1154 9.1155 9.2760 9.2779 13.3612 13.3620 15.6186 15.6187 15.6673 15.6685 15.8407 15.8407 17.5594 17.5634 k =-0.0453 0.0590 0.0744 ( 3281 PWs) bands (ev): -63.0901 -63.0901 -63.0759 -63.0759 -30.0737 -30.0729 -30.0260 -30.0245 -29.8057 -29.8042 -29.7574 -29.7572 -29.7493 -29.7486 -29.7215 -29.7215 -9.6665 -9.6665 -4.6123 -4.6118 -4.5297 -4.5292 -4.2859 -4.2855 -3.0609 -3.0609 2.0947 2.0954 2.1355 2.1360 2.7691 2.7699 4.2410 4.2424 4.9669 4.9688 6.2635 6.2644 7.6460 7.6464 7.7392 7.7413 9.0112 9.0136 9.1562 9.1564 9.2815 9.2834 13.3186 13.3192 15.5866 15.5868 15.6938 15.6950 15.8283 15.8283 17.5796 17.5835 k =-0.0389 0.0506 0.0638 ( 3289 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0738 -30.0731 -30.0257 -30.0245 -29.8057 -29.8045 -29.7570 -29.7568 -29.7497 -29.7490 -29.7215 -29.7215 -9.6771 -9.6771 -4.6074 -4.6070 -4.4712 -4.4707 -4.2835 -4.2832 -3.1145 -3.1144 2.1264 2.1270 2.1540 2.1544 2.7379 2.7385 4.1945 4.1958 4.9734 4.9750 6.2433 6.2441 7.6638 7.6642 7.7331 7.7350 9.0296 9.0318 9.1927 9.1929 9.2864 9.2881 13.2812 13.2818 15.5573 15.5575 15.7174 15.7185 15.8172 15.8172 17.5760 17.5766 k =-0.0324 0.0421 0.0531 ( 3289 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0738 -30.0732 -30.0255 -30.0244 -29.8057 -29.8047 -29.7565 -29.7564 -29.7500 -29.7495 -29.7214 -29.7214 -9.6860 -9.6860 -4.6033 -4.6030 -4.4177 -4.4173 -4.2813 -4.2810 -3.1637 -3.1636 2.1549 2.1554 2.1721 2.1725 2.7088 2.7094 4.1535 4.1545 4.9792 4.9805 6.2262 6.2268 7.6791 7.6795 7.7277 7.7293 9.0454 9.0473 9.2243 9.2245 9.2908 9.2923 13.2494 13.2499 15.5314 15.5316 15.7375 15.7384 15.8076 15.8076 17.5593 17.5600 k =-0.0259 0.0337 0.0425 ( 3277 PWs) bands (ev): -63.0902 -63.0902 -63.0758 -63.0758 -30.0738 -30.0733 -30.0252 -30.0244 -29.8057 -29.8048 -29.7561 -29.7560 -29.7503 -29.7498 -29.7213 -29.7213 -9.6934 -9.6933 -4.6001 -4.5998 -4.3704 -4.3701 -4.2794 -4.2792 -3.2074 -3.2073 2.1795 2.1799 2.1892 2.1894 2.6828 2.6833 4.1186 4.1195 4.9840 4.9851 6.2121 6.2126 7.6918 7.6921 7.7232 7.7245 9.0585 9.0602 9.2506 9.2509 9.2948 9.2959 13.2232 13.2236 15.5095 15.5096 15.7542 15.7549 15.7996 15.7997 17.5450 17.5456 k =-0.0194 0.0253 0.0319 ( 3277 PWs) bands (ev): -63.0902 -63.0902 -63.0758 -63.0758 -30.0738 -30.0734 -30.0250 -30.0244 -29.8057 -29.8050 -29.7557 -29.7557 -29.7506 -29.7502 -29.7213 -29.7213 -9.6991 -9.6991 -4.5976 -4.5973 -4.3310 -4.3308 -4.2779 -4.2778 -3.2439 -3.2439 2.1994 2.1997 2.2042 2.2044 2.6608 2.6611 4.0906 4.0913 4.9879 4.9887 6.2011 6.2015 7.7017 7.7020 7.7195 7.7205 9.0688 9.0702 9.2709 9.2712 9.2983 9.2991 13.2027 13.2030 15.4920 15.4921 15.7670 15.7675 15.7935 15.7935 17.5334 17.5339 k =-0.0130 0.0169 0.0213 ( 3277 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0738 -30.0735 -30.0249 -30.0244 -29.8056 -29.8052 -29.7554 -29.7554 -29.7507 -29.7505 -29.7213 -29.7213 -9.7032 -9.7032 -4.5958 -4.5956 -4.3012 -4.3010 -4.2768 -4.2767 -3.2718 -3.2718 2.2141 2.2142 2.2163 2.2163 2.6438 2.6440 4.0701 4.0706 4.9907 4.9913 6.1933 6.1935 7.7088 7.7090 7.7170 7.7176 9.0764 9.0773 9.2845 9.2850 9.3020 9.3023 13.1880 13.1882 15.4792 15.4793 15.7759 15.7761 15.7894 15.7895 17.5251 17.5254 k =-0.0065 0.0084 0.0106 ( 3279 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0736 -30.0247 -30.0245 -29.8055 -29.8053 -29.7553 -29.7553 -29.7509 -29.7507 -29.7213 -29.7213 -9.7056 -9.7056 -4.5947 -4.5946 -4.2826 -4.2825 -4.2759 -4.2759 -3.2893 -3.2893 2.2229 2.2229 2.2243 2.2243 2.6330 2.6331 4.0577 4.0579 4.9925 4.9928 6.1886 6.1887 7.7127 7.7129 7.7159 7.7161 9.0810 9.0815 9.2915 9.2919 9.3055 9.3056 13.1792 13.1793 15.4715 15.4715 15.7801 15.7801 15.7880 15.7882 17.5201 17.5202 k = 0.0000 0.0000 0.0000 ( 3281 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0737 -30.0246 -30.0246 -29.8054 -29.8054 -29.7552 -29.7552 -29.7508 -29.7508 -29.7213 -29.7213 -9.7064 -9.7064 -4.5943 -4.5943 -4.2771 -4.2771 -4.2747 -4.2747 -3.2953 -3.2953 2.2258 2.2258 2.2271 2.2271 2.6294 2.6294 4.0536 4.0536 4.9932 4.9932 6.1871 6.1871 7.7136 7.7136 7.7161 7.7161 9.0827 9.0827 9.2935 9.2935 9.3072 9.3072 13.1763 13.1763 15.4689 15.4689 15.7808 15.7808 15.7883 15.7883 17.5184 17.5184 k = 0.0000 0.0000 0.0000 ( 3281 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0737 -30.0246 -30.0246 -29.8054 -29.8054 -29.7552 -29.7552 -29.7508 -29.7508 -29.7213 -29.7213 -9.7064 -9.7064 -4.5943 -4.5943 -4.2771 -4.2771 -4.2747 -4.2747 -3.2953 -3.2953 2.2258 2.2258 2.2271 2.2271 2.6294 2.6294 4.0536 4.0536 4.9932 4.9932 6.1871 6.1871 7.7136 7.7136 7.7161 7.7161 9.0827 9.0827 9.2935 9.2935 9.3072 9.3072 13.1763 13.1763 15.4689 15.4689 15.7808 15.7808 15.7883 15.7883 17.5184 17.5184 k = 0.0119 0.0092-0.0000 ( 3289 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0737 -30.0737 -30.0246 -30.0246 -29.8055 -29.8055 -29.7553 -29.7553 -29.7508 -29.7508 -29.7213 -29.7213 -9.7055 -9.7055 -4.6043 -4.6043 -4.2774 -4.2774 -4.2750 -4.2750 -3.2851 -3.2851 2.2270 2.2270 2.2284 2.2284 2.6255 2.6255 4.0578 4.0578 4.9927 4.9927 6.1874 6.1874 7.7131 7.7131 7.7156 7.7156 9.0790 9.0790 9.2927 9.2927 9.3063 9.3063 13.1797 13.1797 15.4722 15.4722 15.7799 15.7799 15.7874 15.7874 17.4711 17.4711 k = 0.0238 0.0183-0.0000 ( 3285 PWs) bands (ev): -63.0903 -63.0903 -63.0758 -63.0758 -30.0736 -30.0736 -30.0247 -30.0247 -29.8054 -29.8054 -29.7556 -29.7556 -29.7505 -29.7505 -29.7213 -29.7213 -9.7027 -9.7027 -4.6331 -4.6331 -4.2782 -4.2782 -4.2758 -4.2758 -3.2553 -3.2553 2.2309 2.2309 2.2323 2.2323 2.6143 2.6143 4.0703 4.0703 4.9913 4.9913 6.1883 6.1883 7.7118 7.7118 7.7143 7.7143 9.0679 9.0679 9.2903 9.2903 9.3039 9.3039 13.1899 13.1899 15.4820 15.4820 15.7772 15.7772 15.7845 15.7845 17.3818 17.3818 k = 0.0357 0.0275-0.0000 ( 3285 PWs) bands (ev): -63.0902 -63.0902 -63.0758 -63.0758 -30.0736 -30.0736 -30.0248 -30.0248 -29.8054 -29.8054 -29.7560 -29.7560 -29.7502 -29.7502 -29.7213 -29.7213 -9.6980 -9.6980 -4.6786 -4.6786 -4.2795 -4.2795 -4.2771 -4.2771 -3.2083 -3.2083 2.2373 2.2373 2.2387 2.2387 2.5959 2.5959 4.0906 4.0906 4.9890 4.9890 6.1900 6.1900 7.7095 7.7095 7.7120 7.7120 9.0496 9.0496 9.2864 9.2864 9.2999 9.2999 13.2069 13.2069 15.4980 15.4980 15.7725 15.7725 15.7796 15.7796 17.2840 17.2840 k = 0.0476 0.0366-0.0000 ( 3285 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0734 -30.0734 -30.0249 -30.0249 -29.8053 -29.8053 -29.7565 -29.7565 -29.7497 -29.7497 -29.7213 -29.7213 -9.6914 -9.6914 -4.7376 -4.7376 -4.2813 -4.2813 -4.2790 -4.2790 -3.1470 -3.1470 2.2463 2.2463 2.2476 2.2476 2.5711 2.5711 4.1182 4.1182 4.9858 4.9858 6.1923 6.1923 7.7062 7.7062 7.7086 7.7086 9.0243 9.0243 9.2810 9.2810 9.2944 9.2944 13.2307 13.2307 15.5200 15.5200 15.7657 15.7657 15.7726 15.7726 17.1847 17.1847 k = 0.0595 0.0458-0.0000 ( 3293 PWs) bands (ev): -63.0902 -63.0902 -63.0759 -63.0759 -30.0733 -30.0733 -30.0251 -30.0251 -29.8052 -29.8052 -29.7570 -29.7570 -29.7493 -29.7493 -29.7214 -29.7214 -9.6829 -9.6829 -4.8073 -4.8073 -4.2837 -4.2837 -4.2814 -4.2814 -3.0746 -3.0746 2.2577 2.2577 2.2590 2.2590 2.5405 2.5405 4.1522 4.1522 4.9817 4.9817 6.1953 6.1953 7.7018 7.7018 7.7042 7.7042 8.9920 8.9920 9.2744 9.2744 9.2876 9.2876 13.2610 13.2610 15.5475 15.5475 15.7567 15.7567 15.7633 15.7633 17.0860 17.0860 k = 0.0714 0.0549-0.0000 ( 3301 PWs) bands (ev): -63.0901 -63.0901 -63.0760 -63.0760 -30.0732 -30.0732 -30.0253 -30.0253 -29.8051 -29.8051 -29.7576 -29.7576 -29.7488 -29.7488 -29.7214 -29.7214 -9.6726 -9.6726 -4.8851 -4.8851 -4.2865 -4.2865 -4.2842 -4.2842 -2.9935 -2.9935 2.2716 2.2716 2.2729 2.2729 2.5050 2.5050 4.1918 4.1918 4.9769 4.9769 6.1989 6.1989 7.6962 7.6962 7.6986 7.6986 8.9532 8.9532 9.2666 9.2666 9.2797 9.2797 13.2979 13.2979 15.5798 15.5798 15.7453 15.7453 15.7516 15.7516 16.9892 16.9892 k = 0.0833 0.0641-0.0000 ( 3321 PWs) bands (ev): -63.0901 -63.0901 -63.0761 -63.0761 -30.0730 -30.0730 -30.0257 -30.0257 -29.8050 -29.8050 -29.7583 -29.7583 -29.7483 -29.7483 -29.7215 -29.7215 -9.6603 -9.6603 -4.9689 -4.9689 -4.2899 -4.2899 -4.2876 -4.2876 -2.9058 -2.9058 2.2879 2.2879 2.2892 2.2892 2.4652 2.4652 4.2363 4.2363 4.9713 4.9713 6.2033 6.2033 7.6892 7.6892 7.6917 7.6917 8.9081 8.9081 9.2580 9.2580 9.2709 9.2709 13.3411 13.3411 15.6160 15.6160 15.7312 15.7312 15.7371 15.7371 16.8952 16.8952 k = 0.0952 0.0732-0.0000 ( 3321 PWs) bands (ev): -63.0900 -63.0900 -63.0761 -63.0761 -30.0728 -30.0728 -30.0259 -30.0259 -29.8048 -29.8048 -29.7589 -29.7589 -29.7477 -29.7477 -29.7215 -29.7215 -9.6463 -9.6463 -5.0571 -5.0571 -4.2936 -4.2936 -4.2914 -4.2914 -2.8131 -2.8131 2.3066 2.3066 2.3079 2.3079 2.4220 2.4220 4.2847 4.2847 4.9652 4.9652 6.2084 6.2084 7.6809 7.6809 7.6834 7.6834 8.8572 8.8572 9.2487 9.2487 9.2614 9.2614 13.3906 13.3906 15.6549 15.6549 15.7142 15.7142 15.7197 15.7197 16.8054 16.8054 k = 0.1071 0.0824-0.0000 ( 3329 PWs) bands (ev): -63.0899 -63.0899 -63.0762 -63.0762 -30.0725 -30.0725 -30.0263 -30.0263 -29.8047 -29.8047 -29.7596 -29.7596 -29.7472 -29.7472 -29.7216 -29.7216 -9.6303 -9.6303 -5.1487 -5.1487 -4.2978 -4.2978 -4.2956 -4.2956 -2.7166 -2.7166 2.3276 2.3276 2.3288 2.3288 2.3759 2.3759 4.3365 4.3365 4.9585 4.9585 6.2143 6.2143 7.6710 7.6710 7.6735 7.6735 8.8009 8.8009 9.2391 9.2391 9.2515 9.2515 13.4462 13.4462 15.6941 15.6941 15.6949 15.6949 15.6991 15.6991 16.7209 16.7209 k = 0.1190 0.0915-0.0000 ( 3305 PWs) bands (ev): -63.0898 -63.0898 -63.0763 -63.0763 -30.0722 -30.0722 -30.0266 -30.0266 -29.8044 -29.8044 -29.7602 -29.7602 -29.7466 -29.7466 -29.7216 -29.7216 -9.6125 -9.6125 -5.2426 -5.2426 -4.3024 -4.3024 -4.3002 -4.3002 -2.6171 -2.6171 2.3274 2.3274 2.3508 2.3508 2.3521 2.3521 4.3910 4.3910 4.9515 4.9515 6.2209 6.2209 7.6594 7.6594 7.6619 7.6619 8.7396 8.7396 9.2295 9.2295 9.2416 9.2416 13.5077 13.5077 15.6708 15.6708 15.6753 15.6753 15.7338 15.7338 16.6440 16.6440 k = 0.1310 0.1007-0.0000 ( 3305 PWs) bands (ev): -63.0897 -63.0897 -63.0764 -63.0764 -30.0719 -30.0719 -30.0270 -30.0270 -29.8042 -29.8042 -29.7610 -29.7610 -29.7460 -29.7460 -29.7217 -29.7217 -9.5928 -9.5928 -5.3383 -5.3383 -4.3073 -4.3073 -4.3052 -4.3052 -2.5155 -2.5155 2.2770 2.2770 2.3762 2.3762 2.3774 2.3774 4.4475 4.4475 4.9442 4.9442 6.2283 6.2283 7.6459 7.6459 7.6484 7.6484 8.6737 8.6737 9.2200 9.2200 9.2318 9.2318 13.5749 13.5749 15.6439 15.6439 15.6479 15.6479 15.7685 15.7685 16.5774 16.5774 k = 0.1429 0.1098-0.0000 ( 3305 PWs) bands (ev): -63.0896 -63.0896 -63.0765 -63.0765 -30.0715 -30.0715 -30.0274 -30.0274 -29.8039 -29.8039 -29.7617 -29.7617 -29.7454 -29.7454 -29.7218 -29.7218 -9.5713 -9.5713 -5.4352 -5.4352 -4.3126 -4.3126 -4.3105 -4.3105 -2.4122 -2.4122 2.2251 2.2251 2.4036 2.4036 2.4048 2.4048 4.5055 4.5055 4.9367 4.9367 6.2364 6.2364 7.6303 7.6303 7.6329 7.6329 8.6036 8.6036 9.2110 9.2110 9.2225 9.2225 13.6475 13.6475 15.6135 15.6135 15.6170 15.6170 15.7948 15.7948 16.5249 16.5249 k = 0.1548 0.1190-0.0000 ( 3305 PWs) bands (ev): -63.0895 -63.0895 -63.0766 -63.0766 -30.0711 -30.0711 -30.0279 -30.0279 -29.8036 -29.8036 -29.7624 -29.7624 -29.7448 -29.7448 -29.7219 -29.7219 -9.5479 -9.5479 -5.5329 -5.5329 -4.3182 -4.3182 -4.3162 -4.3162 -2.3078 -2.3078 2.1721 2.1721 2.4330 2.4330 2.4341 2.4341 4.5647 4.5647 4.9291 4.9291 6.2452 6.2452 7.6126 7.6126 7.6153 7.6153 8.5299 8.5299 9.2028 9.2028 9.2139 9.2139 13.7253 13.7253 15.5794 15.5794 15.5824 15.5824 15.8080 15.8080 16.4910 16.4910 k = 0.1667 0.1281-0.0000 ( 3305 PWs) bands (ev): -63.0893 -63.0893 -63.0768 -63.0768 -30.0707 -30.0707 -30.0284 -30.0284 -29.8033 -29.8033 -29.7631 -29.7631 -29.7443 -29.7443 -29.7220 -29.7220 -9.5227 -9.5227 -5.6311 -5.6311 -4.3241 -4.3241 -4.3221 -4.3221 -2.2025 -2.2025 2.1181 2.1181 2.4642 2.4642 2.4653 2.4653 4.6244 4.6244 4.9218 4.9218 6.2548 6.2548 7.5926 7.5926 7.5954 7.5954 8.4530 8.4530 9.1956 9.1956 9.2063 9.2063 13.8081 13.8081 15.5417 15.5417 15.5442 15.5442 15.8043 15.8043 16.4789 16.4789 k = 0.1786 0.1373-0.0000 ( 3317 PWs) bands (ev): -63.0892 -63.0892 -63.0769 -63.0769 -30.0704 -30.0704 -30.0289 -30.0289 -29.8031 -29.8031 -29.7639 -29.7639 -29.7437 -29.7437 -29.7221 -29.7221 -9.4957 -9.4957 -5.7295 -5.7295 -4.3302 -4.3302 -4.3282 -4.3282 -2.0966 -2.0966 2.0634 2.0634 2.4972 2.4972 2.4982 2.4982 4.6844 4.6844 4.9146 4.9146 6.2651 6.2651 7.5703 7.5703 7.5732 7.5732 8.3732 8.3732 9.1897 9.1897 9.2000 9.2000 13.8955 13.8955 15.5004 15.5004 15.5025 15.5025 15.7831 15.7831 16.4892 16.4892 k = 0.1905 0.1464-0.0000 ( 3317 PWs) bands (ev): -63.0890 -63.0890 -63.0771 -63.0771 -30.0699 -30.0699 -30.0295 -30.0295 -29.8027 -29.8027 -29.7647 -29.7647 -29.7431 -29.7431 -29.7222 -29.7222 -9.4668 -9.4668 -5.8280 -5.8280 -4.3365 -4.3365 -4.3346 -4.3346 -1.9905 -1.9905 2.0081 2.0081 2.5318 2.5318 2.5328 2.5328 4.7444 4.7444 4.9079 4.9079 6.2761 6.2761 7.5456 7.5456 7.5486 7.5486 8.2912 8.2912 9.1852 9.1852 9.1952 9.1952 13.9873 13.9873 15.4557 15.4557 15.4574 15.4574 15.7469 15.7469 16.5188 16.5188 k = 0.2024 0.1556-0.0000 ( 3317 PWs) bands (ev): -63.0889 -63.0889 -63.0772 -63.0772 -30.0694 -30.0694 -30.0301 -30.0301 -29.8024 -29.8024 -29.7655 -29.7655 -29.7425 -29.7425 -29.7223 -29.7223 -9.4361 -9.4361 -5.9263 -5.9263 -4.3430 -4.3430 -4.3411 -4.3411 -1.8843 -1.8843 1.9524 1.9524 2.5679 2.5679 2.5688 2.5688 4.8038 4.8038 4.9019 4.9019 6.2878 6.2878 7.5185 7.5185 7.5216 7.5216 8.2073 8.2073 9.1824 9.1824 9.1919 9.1919 14.0832 14.0832 15.4079 15.4079 15.4091 15.4091 15.7002 15.7002 16.5630 16.5630 k = 0.2143 0.1647-0.0000 ( 3313 PWs) bands (ev): -63.0887 -63.0887 -63.0774 -63.0774 -30.0689 -30.0689 -30.0307 -30.0307 -29.8020 -29.8020 -29.7663 -29.7663 -29.7419 -29.7419 -29.7225 -29.7225 -9.4037 -9.4037 -6.0243 -6.0243 -4.3495 -4.3495 -4.3477 -4.3477 -1.7782 -1.7782 1.8964 1.8964 2.6053 2.6053 2.6062 2.6062 4.8624 4.8624 4.8966 4.8966 6.3001 6.3001 7.4891 7.4891 7.4923 7.4923 8.1220 8.1220 9.1814 9.1814 9.1905 9.1905 14.1830 14.1830 15.3571 15.3571 15.3580 15.3580 15.6471 15.6471 16.6171 16.6171 k = 0.2262 0.1739-0.0000 ( 3305 PWs) bands (ev): -63.0885 -63.0885 -63.0776 -63.0776 -30.0684 -30.0684 -30.0313 -30.0313 -29.8016 -29.8016 -29.7670 -29.7670 -29.7413 -29.7413 -29.7226 -29.7226 -9.3694 -9.3694 -6.1219 -6.1219 -4.3562 -4.3562 -4.3544 -4.3544 -1.6724 -1.6724 1.8402 1.8402 2.6439 2.6439 2.6448 2.6448 4.8920 4.8920 4.9201 4.9201 6.3130 6.3130 7.4575 7.4575 7.4608 7.4608 8.0356 8.0356 9.1821 9.1821 9.1908 9.1908 14.2861 14.2861 15.3037 15.3037 15.3042 15.3042 15.5909 15.5909 16.6776 16.6776 k = 0.2381 0.1830-0.0000 ( 3301 PWs) bands (ev): -63.0883 -63.0883 -63.0777 -63.0777 -30.0678 -30.0678 -30.0320 -30.0320 -29.8011 -29.8011 -29.7679 -29.7679 -29.7408 -29.7408 -29.7228 -29.7228 -9.3333 -9.3333 -6.2191 -6.2191 -4.3629 -4.3629 -4.3612 -4.3612 -1.5670 -1.5670 1.7838 1.7838 2.6836 2.6836 2.6844 2.6844 4.8888 4.8888 4.9761 4.9761 6.3264 6.3264 7.4237 7.4237 7.4271 7.4271 7.9486 7.9486 9.1847 9.1847 9.1930 9.1930 14.3923 14.3923 15.2481 15.2481 15.2484 15.2484 15.5338 15.5338 16.7418 16.7418 k = 0.2500 0.1922-0.0000 ( 3301 PWs) bands (ev): -63.0882 -63.0882 -63.0779 -63.0779 -30.0672 -30.0672 -30.0327 -30.0327 -29.8007 -29.8007 -29.7687 -29.7687 -29.7402 -29.7402 -29.7229 -29.7229 -9.2955 -9.2955 -6.3156 -6.3156 -4.3696 -4.3696 -4.3680 -4.3680 -1.4622 -1.4622 1.7272 1.7272 2.7241 2.7241 2.7248 2.7248 4.8867 4.8867 5.0303 5.0303 6.3402 6.3402 7.3880 7.3880 7.3915 7.3915 7.8615 7.8615 9.1891 9.1891 9.1970 9.1970 14.5011 14.5011 15.1906 15.1906 15.1907 15.1907 15.4773 15.4773 16.8078 16.8078 k = 0.2619 0.2013-0.0000 ( 3301 PWs) bands (ev): -63.0880 -63.0880 -63.0781 -63.0781 -30.0666 -30.0666 -30.0334 -30.0334 -29.8002 -29.8002 -29.7695 -29.7695 -29.7396 -29.7396 -29.7231 -29.7231 -9.2559 -9.2559 -6.4115 -6.4115 -4.3762 -4.3762 -4.3747 -4.3747 -1.3581 -1.3581 1.6705 1.6705 2.7652 2.7652 2.7660 2.7660 4.8861 4.8861 5.0825 5.0825 6.3545 6.3545 7.3505 7.3505 7.3541 7.3541 7.7746 7.7746 9.1952 9.1952 9.2028 9.2028 14.6119 14.6119 15.1316 15.1316 15.1319 15.1319 15.4225 15.4225 16.8739 16.8739 k = 0.2738 0.2105-0.0000 ( 3302 PWs) bands (ev): -63.0878 -63.0878 -63.0783 -63.0783 -30.0659 -30.0659 -30.0341 -30.0341 -29.7997 -29.7997 -29.7704 -29.7704 -29.7390 -29.7390 -29.7233 -29.7233 -9.2145 -9.2145 -6.5066 -6.5066 -4.3828 -4.3828 -4.3814 -4.3814 -1.2549 -1.2549 1.6137 1.6137 2.8068 2.8068 2.8075 2.8075 4.8869 4.8869 5.1321 5.1321 6.3691 6.3691 7.3116 7.3116 7.3152 7.3152 7.6884 7.6884 9.2030 9.2030 9.2102 9.2102 14.7243 14.7243 15.0717 15.0717 15.0721 15.0721 15.3703 15.3703 16.8687 16.8687 k = 0.2857 0.2196-0.0000 ( 3298 PWs) bands (ev): -63.0875 -63.0875 -63.0785 -63.0785 -30.0653 -30.0653 -30.0349 -30.0349 -29.7992 -29.7992 -29.7712 -29.7712 -29.7384 -29.7384 -29.7235 -29.7235 -9.1714 -9.1714 -6.6009 -6.6009 -4.3893 -4.3893 -4.3879 -4.3879 -1.1527 -1.1527 1.5567 1.5567 2.8487 2.8487 2.8494 2.8494 4.8895 4.8895 5.1790 5.1790 6.3840 6.3840 7.2715 7.2715 7.2751 7.2751 7.6033 7.6033 9.2123 9.2123 9.2191 9.2191 14.8377 14.8377 15.0113 15.0113 15.0119 15.0119 15.3212 15.3212 16.7818 16.7818 k = 0.2976 0.2288-0.0000 ( 3310 PWs) bands (ev): -63.0873 -63.0873 -63.0788 -63.0788 -30.0646 -30.0646 -30.0357 -30.0357 -29.7987 -29.7987 -29.7721 -29.7721 -29.7379 -29.7379 -29.7237 -29.7237 -9.1266 -9.1266 -6.6944 -6.6944 -4.3957 -4.3957 -4.3943 -4.3943 -1.0515 -1.0515 1.4994 1.4994 2.8906 2.8906 2.8913 2.8913 4.8939 4.8939 5.2228 5.2228 6.3991 6.3991 7.2305 7.2305 7.2340 7.2340 7.5197 7.5197 9.2230 9.2230 9.2293 9.2293 14.9485 14.9485 14.9513 14.9513 14.9538 14.9538 15.2757 15.2757 16.6964 16.6964 k = 0.3095 0.2379-0.0000 ( 3326 PWs) bands (ev): -63.0871 -63.0871 -63.0790 -63.0790 -30.0640 -30.0640 -30.0365 -30.0365 -29.7981 -29.7981 -29.7730 -29.7730 -29.7374 -29.7374 -29.7240 -29.7240 -9.0801 -9.0801 -6.7870 -6.7870 -4.4019 -4.4019 -4.4006 -4.4006 -0.9516 -0.9516 1.4420 1.4420 2.9323 2.9323 2.9329 2.9329 4.9001 4.9001 5.2630 5.2630 6.4143 6.4143 7.1889 7.1889 7.1924 7.1924 7.4382 7.4382 9.2347 9.2347 9.2407 9.2407 14.8908 14.8908 14.8917 14.8917 15.0637 15.0637 15.2341 15.2341 16.6134 16.6134 k = 0.3214 0.2471-0.0000 ( 3334 PWs) bands (ev): -63.0869 -63.0869 -63.0792 -63.0792 -30.0632 -30.0632 -30.0374 -30.0374 -29.7976 -29.7976 -29.7739 -29.7739 -29.7368 -29.7368 -29.7242 -29.7242 -9.0319 -9.0319 -6.8786 -6.8786 -4.4079 -4.4079 -4.4067 -4.4067 -0.8529 -0.8529 1.3842 1.3842 2.9736 2.9736 2.9742 2.9742 4.9084 4.9084 5.2994 5.2994 6.4296 6.4296 7.1471 7.1471 7.1505 7.1505 7.3591 7.3591 9.2474 9.2474 9.2531 9.2531 14.8318 14.8318 14.8327 14.8327 15.1738 15.1738 15.1969 15.1969 16.5344 16.5344 k = 0.3333 0.2562-0.0000 ( 3326 PWs) bands (ev): -63.0867 -63.0867 -63.0794 -63.0794 -30.0625 -30.0625 -30.0382 -30.0382 -29.7970 -29.7970 -29.7748 -29.7748 -29.7363 -29.7363 -29.7244 -29.7244 -8.9819 -8.9819 -6.9692 -6.9692 -4.4136 -4.4136 -4.4125 -4.4125 -0.7556 -0.7556 1.3262 1.3262 3.0143 3.0143 3.0148 3.0148 4.9188 4.9188 5.3315 5.3315 6.4450 6.4450 7.1055 7.1055 7.1089 7.1089 7.2829 7.2829 9.2610 9.2610 9.2662 9.2662 14.7741 14.7741 14.7750 14.7750 15.1642 15.1642 15.2797 15.2797 16.4613 16.4613 k = 0.3452 0.2654-0.0000 ( 3322 PWs) bands (ev): -63.0864 -63.0864 -63.0797 -63.0797 -30.0618 -30.0618 -30.0390 -30.0390 -29.7964 -29.7964 -29.7756 -29.7756 -29.7357 -29.7357 -29.7247 -29.7247 -8.9303 -8.9303 -7.0588 -7.0588 -4.4191 -4.4191 -4.4180 -4.4180 -0.6597 -0.6597 1.2677 1.2677 3.0540 3.0540 3.0545 3.0545 4.9314 4.9314 5.3591 5.3591 6.4603 6.4603 7.0645 7.0645 7.0677 7.0677 7.2101 7.2101 9.2749 9.2749 9.2798 9.2798 14.7181 14.7181 14.7191 14.7191 15.1362 15.1362 15.3782 15.3782 16.3969 16.3969 k = 0.3571 0.2745-0.0000 ( 3322 PWs) bands (ev): -63.0862 -63.0862 -63.0799 -63.0799 -30.0610 -30.0610 -30.0399 -30.0399 -29.7957 -29.7957 -29.7765 -29.7765 -29.7352 -29.7352 -29.7250 -29.7250 -8.8771 -8.8771 -7.1473 -7.1473 -4.4242 -4.4242 -4.4233 -4.4233 -0.5654 -0.5654 1.2088 1.2088 3.0924 3.0924 3.0928 3.0928 4.9462 4.9462 5.3818 5.3818 6.4755 6.4755 7.0243 7.0243 7.0275 7.0275 7.1411 7.1411 9.2892 9.2892 9.2937 9.2937 14.6644 14.6644 14.6653 14.6653 15.1132 15.1132 15.4650 15.4650 16.3456 16.3456 k = 0.3690 0.2837-0.0000 ( 3302 PWs) bands (ev): -63.0859 -63.0859 -63.0802 -63.0802 -30.0601 -30.0601 -30.0407 -30.0407 -29.7950 -29.7950 -29.7773 -29.7773 -29.7346 -29.7346 -29.7252 -29.7252 -8.8221 -8.8221 -7.2347 -7.2347 -4.4291 -4.4291 -4.4282 -4.4282 -0.4726 -0.4726 1.1493 1.1493 3.1293 3.1293 3.1297 3.1297 4.9633 4.9633 5.3994 5.3994 6.4906 6.4906 6.9856 6.9856 6.9886 6.9886 7.0763 7.0763 9.3035 9.3035 9.3077 9.3077 14.6133 14.6133 14.6142 14.6142 15.0952 15.0952 15.5340 15.5340 16.3134 16.3134 k = 0.3810 0.2928-0.0000 ( 3310 PWs) bands (ev): -63.0857 -63.0857 -63.0804 -63.0804 -30.0593 -30.0593 -30.0416 -30.0416 -29.7943 -29.7943 -29.7782 -29.7782 -29.7340 -29.7340 -29.7256 -29.7256 -8.7656 -8.7656 -7.3210 -7.3210 -4.4336 -4.4336 -4.4328 -4.4328 -0.3816 -0.3816 1.0892 1.0892 3.1643 3.1643 3.1647 3.1647 4.9824 4.9824 5.4114 5.4114 6.5055 6.5055 6.9484 6.9484 6.9513 6.9513 7.0160 7.0160 9.3175 9.3175 9.3213 9.3213 14.5652 14.5652 14.5660 14.5660 15.0824 15.0824 15.5784 15.5784 16.3069 16.3069 k = 0.3929 0.3020-0.0000 ( 3310 PWs) bands (ev): -63.0854 -63.0854 -63.0807 -63.0807 -30.0585 -30.0585 -30.0425 -30.0425 -29.7937 -29.7937 -29.7791 -29.7791 -29.7335 -29.7335 -29.7259 -29.7259 -8.7075 -8.7075 -7.4060 -7.4060 -4.4377 -4.4377 -4.4370 -4.4370 -0.2923 -0.2923 1.0283 1.0283 3.1973 3.1973 3.1976 3.1976 5.0038 5.0038 5.4179 5.4179 6.5203 6.5203 6.9133 6.9133 6.9161 6.9161 6.9605 6.9605 9.3310 9.3310 9.3345 9.3345 14.5204 14.5204 14.5212 14.5212 15.0748 15.0748 15.5945 15.5945 16.3296 16.3296 k = 0.4048 0.3111-0.0000 ( 3306 PWs) bands (ev): -63.0852 -63.0852 -63.0809 -63.0809 -30.0577 -30.0577 -30.0434 -30.0434 -29.7929 -29.7929 -29.7800 -29.7800 -29.7330 -29.7330 -29.7262 -29.7262 -8.6477 -8.6477 -7.4899 -7.4899 -4.4415 -4.4415 -4.4408 -4.4408 -0.2047 -0.2047 0.9666 0.9666 3.2278 3.2278 3.2281 3.2281 5.0273 5.0273 5.4189 5.4189 6.5349 6.5349 6.8805 6.8805 6.8833 6.8833 6.9100 6.9100 9.3439 9.3439 9.3469 9.3469 14.4793 14.4793 14.4801 14.4801 15.0725 15.0725 15.5846 15.5846 16.3789 16.3789 k = 0.4167 0.3203-0.0000 ( 3322 PWs) bands (ev): -63.0849 -63.0849 -63.0812 -63.0812 -30.0568 -30.0568 -30.0443 -30.0443 -29.7922 -29.7922 -29.7809 -29.7809 -29.7325 -29.7325 -29.7266 -29.7266 -8.5864 -8.5864 -7.5726 -7.5726 -4.4449 -4.4449 -4.4443 -4.4443 -0.1189 -0.1189 0.9039 0.9039 3.2555 3.2555 3.2558 3.2558 5.0527 5.0527 5.4142 5.4142 6.5494 6.5494 6.8502 6.8502 6.8534 6.8534 6.8649 6.8649 9.3558 9.3558 9.3585 9.3585 14.4422 14.4422 14.4429 14.4429 15.0755 15.0755 15.5559 15.5559 16.4475 16.4475 k = 0.4286 0.3294-0.0000 ( 3330 PWs) bands (ev): -63.0847 -63.0847 -63.0814 -63.0814 -30.0560 -30.0560 -30.0453 -30.0453 -29.7915 -29.7915 -29.7818 -29.7818 -29.7320 -29.7320 -29.7269 -29.7269 -8.5235 -8.5235 -7.6540 -7.6540 -4.4478 -4.4478 -4.4473 -4.4473 -0.0349 -0.0349 0.8402 0.8402 3.2802 3.2802 3.2805 3.2805 5.0798 5.0798 5.4044 5.4044 6.5638 6.5638 6.8195 6.8195 6.8265 6.8265 6.8281 6.8281 9.3666 9.3666 9.3689 9.3689 14.4095 14.4095 14.4101 14.4101 15.0838 15.0838 15.5156 15.5156 16.5276 16.5276 k = 0.4405 0.3386-0.0000 ( 3330 PWs) bands (ev): -63.0844 -63.0844 -63.0817 -63.0817 -30.0551 -30.0551 -30.0462 -30.0462 -29.7908 -29.7908 -29.7826 -29.7826 -29.7315 -29.7315 -29.7273 -29.7273 -8.4591 -8.4591 -7.7341 -7.7341 -4.4503 -4.4503 -4.4499 -4.4499 0.0472 0.0472 0.7754 0.7754 3.3017 3.3017 3.3019 3.3019 5.1086 5.1086 5.3897 5.3897 6.5782 6.5782 6.7853 6.7853 6.8028 6.8028 6.8034 6.8034 9.3761 9.3761 9.3781 9.3781 14.3813 14.3813 14.3818 14.3818 15.0973 15.0973 15.4693 15.4693 16.6136 16.6136 k = 0.4524 0.3477-0.0000 ( 3330 PWs) bands (ev): -63.0841 -63.0841 -63.0820 -63.0820 -30.0543 -30.0543 -30.0471 -30.0471 -29.7900 -29.7900 -29.7835 -29.7835 -29.7311 -29.7311 -29.7277 -29.7277 -8.3931 -8.3931 -7.8128 -7.8128 -4.4524 -4.4524 -4.4521 -4.4521 0.1276 0.1276 0.7094 0.7094 3.3196 3.3196 3.3198 3.3198 5.1386 5.1386 5.3707 5.3707 6.5929 6.5929 6.7536 6.7536 6.7831 6.7831 6.7839 6.7839 9.3842 9.3842 9.3858 9.3858 14.3580 14.3580 14.3584 14.3584 15.1160 15.1160 15.4207 15.4207 16.7014 16.7014 k = 0.4643 0.3569-0.0000 ( 3334 PWs) bands (ev): -63.0839 -63.0839 -63.0822 -63.0822 -30.0534 -30.0534 -30.0480 -30.0480 -29.7893 -29.7893 -29.7844 -29.7844 -29.7306 -29.7306 -29.7280 -29.7280 -8.3256 -8.3256 -7.8903 -7.8903 -4.4540 -4.4540 -4.4537 -4.4537 0.2061 0.2061 0.6421 0.6421 3.3338 3.3338 3.3340 3.3340 5.1695 5.1695 5.3479 5.3479 6.6080 6.6080 6.7255 6.7255 6.7678 6.7678 6.7684 6.7684 9.3907 9.3907 9.3919 9.3919 14.3396 14.3396 14.3399 14.3399 15.1397 15.1397 15.3720 15.3720 16.7880 16.7880 k = 0.4762 0.3660-0.0000 ( 3326 PWs) bands (ev): -63.0836 -63.0836 -63.0825 -63.0825 -30.0525 -30.0525 -30.0489 -30.0489 -29.7884 -29.7884 -29.7852 -29.7852 -29.7301 -29.7301 -29.7284 -29.7284 -8.2567 -8.2567 -7.9664 -7.9664 -4.4551 -4.4551 -4.4549 -4.4549 0.2829 0.2829 0.5733 0.5733 3.3441 3.3441 3.3442 3.3442 5.2010 5.2010 5.3220 5.3220 6.6238 6.6238 6.7007 6.7007 6.7567 6.7567 6.7572 6.7572 9.3955 9.3955 9.3963 9.3963 14.3264 14.3264 14.3267 14.3267 15.1683 15.1683 15.3248 15.3248 16.8720 16.8720 k = 0.4881 0.3752-0.0000 ( 3326 PWs) bands (ev): -63.0833 -63.0833 -63.0828 -63.0828 -30.0516 -30.0516 -30.0498 -30.0498 -29.7877 -29.7877 -29.7860 -29.7860 -29.7297 -29.7297 -29.7288 -29.7288 -8.1863 -8.1863 -8.0411 -8.0411 -4.4558 -4.4558 -4.4557 -4.4557 0.3580 0.3580 0.5031 0.5031 3.3504 3.3504 3.3504 3.3504 5.2326 5.2326 5.2937 5.2937 6.6406 6.6406 6.6785 6.6785 6.7501 6.7501 6.7503 6.7503 9.3985 9.3985 9.3988 9.3988 14.3185 14.3185 14.3186 14.3186 15.2014 15.2014 15.2801 15.2801 16.9515 16.9515 k = 0.5000 0.3843-0.0000 ( 3326 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0507 -30.0507 -30.0507 -30.0507 -29.7868 -29.7868 -29.7868 -29.7868 -29.7292 -29.7292 -29.7292 -29.7292 -8.1144 -8.1144 -8.1144 -8.1144 -4.4560 -4.4560 -4.4560 -4.4560 0.4314 0.4314 0.4314 0.4314 3.3525 3.3525 3.3525 3.3525 5.2637 5.2637 5.2637 5.2637 6.6587 6.6587 6.6587 6.6587 6.7479 6.7479 6.7479 6.7479 9.3996 9.3996 9.3996 9.3996 14.3159 14.3159 14.3159 14.3159 15.2388 15.2388 15.2388 15.2388 17.0256 17.0256 k = 0.5000 0.3843-0.0000 ( 3326 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0507 -30.0507 -30.0507 -30.0507 -29.7868 -29.7868 -29.7868 -29.7868 -29.7292 -29.7292 -29.7292 -29.7292 -8.1144 -8.1144 -8.1144 -8.1144 -4.4560 -4.4560 -4.4560 -4.4560 0.4314 0.4314 0.4314 0.4314 3.3525 3.3525 3.3525 3.3525 5.2637 5.2637 5.2637 5.2637 6.6587 6.6587 6.6587 6.6587 6.7479 6.7479 6.7479 6.7479 9.3996 9.3996 9.3996 9.3996 14.3159 14.3159 14.3159 14.3159 15.2388 15.2388 15.2388 15.2388 17.0256 17.0256 k = 0.4935 0.3928 0.0107 ( 3338 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0509 -30.0507 -30.0507 -30.0506 -29.7873 -29.7872 -29.7865 -29.7864 -29.7296 -29.7296 -29.7290 -29.7290 -8.1145 -8.1145 -8.1135 -8.1134 -4.4579 -4.4579 -4.4559 -4.4558 0.4304 0.4304 0.4338 0.4338 3.3513 3.3513 3.3519 3.3520 5.2613 5.2613 5.2647 5.2648 6.6235 6.6267 6.6594 6.6594 6.7493 6.7493 6.7805 6.7837 9.3981 9.3982 9.4000 9.4001 14.3107 14.3111 14.3182 14.3183 15.2418 15.2419 15.2450 15.2455 17.0269 17.0270 k = 0.4870 0.4013 0.0214 ( 3334 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0510 -30.0507 -30.0507 -30.0504 -29.7877 -29.7875 -29.7862 -29.7859 -29.7299 -29.7299 -29.7287 -29.7286 -8.1148 -8.1148 -8.1106 -8.1106 -4.4636 -4.4636 -4.4554 -4.4553 0.4274 0.4276 0.4409 0.4410 3.3479 3.3480 3.3503 3.3506 5.2543 5.2543 5.2679 5.2682 6.5661 6.5699 6.6613 6.6614 6.7537 6.7537 6.8394 6.8431 9.3940 9.3941 9.4013 9.4017 14.2962 14.2968 14.3253 14.3256 15.2509 15.2510 15.2637 15.2646 17.0309 17.0311 k = 0.4804 0.4098 0.0321 ( 3334 PWs) bands (ev): -63.0831 -63.0831 -63.0830 -63.0830 -30.0512 -30.0507 -30.0507 -30.0503 -29.7882 -29.7878 -29.7859 -29.7855 -29.7303 -29.7302 -29.7284 -29.7283 -8.1154 -8.1153 -8.1059 -8.1059 -4.4731 -4.4730 -4.4547 -4.4544 0.4226 0.4228 0.4528 0.4529 3.3423 3.3424 3.3477 3.3481 5.2429 5.2430 5.2732 5.2736 6.5055 6.5094 6.6645 6.6646 6.7607 6.7607 6.9032 6.9069 9.3870 9.3872 9.4036 9.4041 14.2734 14.2743 14.3372 14.3377 15.2660 15.2662 15.2935 15.2948 17.0376 17.0379 k = 0.4739 0.4183 0.0428 ( 3330 PWs) bands (ev): -63.0831 -63.0831 -63.0830 -63.0830 -30.0514 -30.0507 -30.0507 -30.0501 -29.7886 -29.7880 -29.7855 -29.7850 -29.7306 -29.7305 -29.7281 -29.7280 -8.1161 -8.1161 -8.0993 -8.0993 -4.4862 -4.4861 -4.4537 -4.4533 0.4158 0.4161 0.4692 0.4693 3.3344 3.3346 3.3442 3.3448 5.2276 5.2277 5.2806 5.2812 6.4444 6.4483 6.6690 6.6692 6.7702 6.7702 6.9688 6.9725 9.3774 9.3776 9.4069 9.4075 14.2440 14.2451 14.3538 14.3544 15.2870 15.2873 15.3329 15.3345 17.0469 17.0474 k = 0.4674 0.4268 0.0535 ( 3326 PWs) bands (ev): -63.0831 -63.0831 -63.0830 -63.0830 -30.0515 -30.0508 -30.0507 -30.0499 -29.7890 -29.7883 -29.7852 -29.7845 -29.7310 -29.7308 -29.7278 -29.7278 -8.1172 -8.1172 -8.0909 -8.0908 -4.5026 -4.5026 -4.4523 -4.4519 0.4070 0.4074 0.4899 0.4900 3.3245 3.3246 3.3399 3.3406 5.2088 5.2089 5.2901 5.2908 6.3834 6.3874 6.6748 6.6750 6.7816 6.7817 7.0354 7.0392 9.3651 9.3654 9.4110 9.4118 14.2098 14.2110 14.3751 14.3758 15.3138 15.3141 15.3801 15.3820 17.0589 17.0595 k = 0.4609 0.4352 0.0642 ( 3324 PWs) bands (ev): -63.0832 -63.0832 -63.0829 -63.0829 -30.0518 -30.0508 -30.0507 -30.0497 -29.7894 -29.7886 -29.7848 -29.7840 -29.7313 -29.7311 -29.7275 -29.7275 -8.1186 -8.1185 -8.0805 -8.0804 -4.5223 -4.5222 -4.4507 -4.4502 0.3962 0.3967 0.5146 0.5147 3.3124 3.3125 3.3348 3.3357 5.1871 5.1872 5.3016 5.3025 6.3228 6.3267 6.6819 6.6822 6.7946 6.7947 7.1029 7.1066 9.3502 9.3505 9.4159 9.4168 14.1724 14.1737 14.4009 14.4017 15.3463 15.3467 15.4334 15.4356 17.0735 17.0742 k = 0.4543 0.4437 0.0749 ( 3326 PWs) bands (ev): -63.0832 -63.0832 -63.0829 -63.0829 -30.0520 -30.0509 -30.0506 -30.0495 -29.7898 -29.7888 -29.7845 -29.7835 -29.7317 -29.7314 -29.7273 -29.7272 -8.1203 -8.1203 -8.0683 -8.0682 -4.5449 -4.5448 -4.4488 -4.4482 0.3835 0.3840 0.5430 0.5432 3.2982 3.2984 3.3291 3.3301 5.1632 5.1633 5.3151 5.3160 6.2625 6.2665 6.6902 6.6906 6.8087 6.8088 7.1709 7.1746 9.3328 9.3331 9.4216 9.4226 14.1331 14.1344 14.4310 14.4320 15.3843 15.3848 15.4916 15.4940 17.0905 17.0913 k = 0.4478 0.4522 0.0856 ( 3324 PWs) bands (ev): -63.0833 -63.0833 -63.0829 -63.0829 -30.0522 -30.0510 -30.0506 -30.0493 -29.7901 -29.7891 -29.7842 -29.7830 -29.7321 -29.7317 -29.7270 -29.7270 -8.1225 -8.1224 -8.0542 -8.0541 -4.5702 -4.5701 -4.4466 -4.4459 0.3687 0.3692 0.5748 0.5750 3.2821 3.2823 3.3230 3.3241 5.1378 5.1380 5.3304 5.3315 6.2028 6.2067 6.6999 6.7003 6.8233 6.8234 7.2393 7.2430 9.3129 9.3133 9.4278 9.4290 14.0930 14.0944 14.4654 14.4665 15.4275 15.4281 15.5534 15.5560 17.1100 17.1109 k = 0.4413 0.4607 0.0963 ( 3330 PWs) bands (ev): -63.0833 -63.0833 -63.0828 -63.0828 -30.0525 -30.0512 -30.0505 -30.0491 -29.7905 -29.7893 -29.7838 -29.7825 -29.7325 -29.7321 -29.7268 -29.7268 -8.1251 -8.1250 -8.0383 -8.0381 -4.5978 -4.5977 -4.4441 -4.4434 0.3518 0.3524 0.6096 0.6098 3.2641 3.2643 3.3164 3.3176 5.1116 5.1117 5.3475 5.3487 6.1435 6.1474 6.7109 6.7114 6.8381 6.8383 7.3080 7.3117 9.2906 9.2910 9.4346 9.4359 14.0530 14.0544 14.5038 14.5050 15.4758 15.4764 15.6179 15.6207 17.1318 17.1329 k = 0.4348 0.4692 0.1071 ( 3326 PWs) bands (ev): -63.0834 -63.0834 -63.0828 -63.0828 -30.0528 -30.0513 -30.0505 -30.0489 -29.7908 -29.7896 -29.7835 -29.7820 -29.7328 -29.7324 -29.7266 -29.7266 -8.1282 -8.1281 -8.0205 -8.0203 -4.6274 -4.6273 -4.4414 -4.4406 0.3329 0.3336 0.6470 0.6471 3.2442 3.2444 3.3097 3.3111 5.0852 5.0854 5.3663 5.3676 6.0848 6.0887 6.7232 6.7237 6.8527 6.8529 7.3768 7.3804 9.2661 9.2666 9.4419 9.4432 14.0139 14.0153 14.5460 14.5474 15.5289 15.5295 15.6845 15.6874 17.1559 17.1571 k = 0.4282 0.4777 0.1178 ( 3328 PWs) bands (ev): -63.0834 -63.0834 -63.0827 -63.0827 -30.0531 -30.0515 -30.0504 -30.0486 -29.7912 -29.7898 -29.7831 -29.7815 -29.7332 -29.7327 -29.7264 -29.7264 -8.1320 -8.1319 -8.0009 -8.0007 -4.6587 -4.6585 -4.4385 -4.4376 0.3118 0.3126 0.6864 0.6866 3.2226 3.2228 3.3029 3.3044 5.0593 5.0595 5.3868 5.3881 6.0268 6.0306 6.7368 6.7374 6.8666 6.8668 7.4455 7.4491 9.2394 9.2400 9.4494 9.4509 13.9763 13.9777 14.5919 14.5933 15.5863 15.5870 15.7524 15.7555 17.1821 17.1834 k = 0.4217 0.4862 0.1285 ( 3328 PWs) bands (ev): -63.0835 -63.0835 -63.0826 -63.0826 -30.0534 -30.0517 -30.0503 -30.0483 -29.7915 -29.7900 -29.7828 -29.7810 -29.7336 -29.7330 -29.7262 -29.7261 -8.1364 -8.1363 -7.9794 -7.9792 -4.6913 -4.6911 -4.4353 -4.4343 0.2887 0.2894 0.7275 0.7276 3.1993 3.1995 3.2962 3.2978 5.0345 5.0347 5.4088 5.4102 5.9693 5.9731 6.7516 6.7523 6.8795 6.8798 7.5139 7.5175 9.2106 9.2113 9.4572 9.4587 13.9405 13.9419 14.6410 14.6426 15.6478 15.6486 15.8213 15.8245 17.2104 17.2118 k = 0.4152 0.4947 0.1392 ( 3324 PWs) bands (ev): -63.0836 -63.0836 -63.0826 -63.0826 -30.0537 -30.0519 -30.0501 -30.0481 -29.7918 -29.7902 -29.7824 -29.7806 -29.7340 -29.7333 -29.7260 -29.7259 -8.1416 -8.1415 -7.9561 -7.9559 -4.7248 -4.7246 -4.4319 -4.4308 0.2634 0.2642 0.7697 0.7699 3.1745 3.1746 3.2898 3.2915 5.0114 5.0115 5.4323 5.4337 5.9126 5.9164 6.7678 6.7686 6.8912 6.8915 7.5819 7.5855 9.1799 9.1806 9.4649 9.4665 13.9072 13.9085 14.6931 14.6948 15.7129 15.7137 15.8908 15.8941 17.2406 17.2422 k = 0.4087 0.5031 0.1499 ( 3320 PWs) bands (ev): -63.0836 -63.0836 -63.0825 -63.0825 -30.0541 -30.0521 -30.0500 -30.0478 -29.7921 -29.7904 -29.7821 -29.7801 -29.7343 -29.7336 -29.7258 -29.7257 -8.1477 -8.1476 -7.9310 -7.9307 -4.7589 -4.7586 -4.4283 -4.4272 0.2359 0.2368 0.8127 0.8129 3.1482 3.1482 3.2837 3.2856 4.9905 4.9907 5.4572 5.4586 5.8566 5.8604 6.7853 6.7862 6.9013 6.9018 7.6493 7.6529 9.1474 9.1482 9.4726 9.4742 13.8765 13.8777 14.7479 14.7497 15.7810 15.7819 15.9606 15.9640 17.2727 17.2744 k = 0.4021 0.5116 0.1606 ( 3318 PWs) bands (ev): -63.0837 -63.0837 -63.0824 -63.0824 -30.0544 -30.0523 -30.0498 -30.0474 -29.7924 -29.7906 -29.7817 -29.7796 -29.7347 -29.7339 -29.7257 -29.7255 -8.1547 -8.1546 -7.9040 -7.9038 -4.7932 -4.7930 -4.4246 -4.4234 0.2063 0.2072 0.8559 0.8561 3.1204 3.1205 3.2782 3.2801 4.9723 4.9725 5.4833 5.4849 5.8015 5.8052 6.8041 6.8051 6.9097 6.9103 7.7159 7.7194 9.1132 9.1140 9.4800 9.4817 13.8487 13.8498 14.8050 14.8068 15.8517 15.8527 16.0306 16.0341 17.3066 17.3084 k = 0.3956 0.5201 0.1713 ( 3314 PWs) bands (ev): -63.0838 -63.0838 -63.0823 -63.0823 -30.0548 -30.0526 -30.0496 -30.0471 -29.7926 -29.7908 -29.7814 -29.7791 -29.7351 -29.7341 -29.7255 -29.7253 -8.1628 -8.1627 -7.8753 -7.8750 -4.8274 -4.8272 -4.4206 -4.4194 0.1745 0.1755 0.8990 0.8992 3.0914 3.0914 3.2733 3.2753 4.9574 4.9576 5.5108 5.5124 5.7472 5.7508 6.8242 6.8252 6.9163 6.9169 7.7815 7.7850 9.0774 9.0783 9.4871 9.4887 13.8240 13.8251 14.8639 14.8658 15.9243 15.9253 16.1007 16.1043 17.3423 17.3442 k = 0.3891 0.5286 0.1820 ( 3306 PWs) bands (ev): -63.0839 -63.0839 -63.0822 -63.0822 -30.0552 -30.0529 -30.0494 -30.0468 -29.7929 -29.7909 -29.7810 -29.7787 -29.7354 -29.7344 -29.7254 -29.7252 -8.1720 -8.1719 -7.8448 -7.8445 -4.8613 -4.8610 -4.4166 -4.4152 0.1406 0.1416 0.9414 0.9416 3.0611 3.0612 3.2691 3.2712 4.9461 4.9463 5.5395 5.5410 5.6939 5.6975 6.8456 6.8467 6.9208 6.9215 7.8460 7.8495 9.0401 9.0410 9.4936 9.4952 13.8028 13.8038 14.9242 14.9261 15.9980 15.9991 16.1710 16.1746 17.3796 17.3816 k = 0.3826 0.5371 0.1927 ( 3310 PWs) bands (ev): -63.0840 -63.0840 -63.0821 -63.0821 -30.0556 -30.0532 -30.0492 -30.0464 -29.7932 -29.7911 -29.7807 -29.7782 -29.7358 -29.7347 -29.7253 -29.7250 -8.1824 -8.1823 -7.8125 -7.8122 -4.8944 -4.8941 -4.4124 -4.4110 0.1046 0.1056 0.9827 0.9829 3.0298 3.0298 3.2657 3.2679 4.9388 4.9390 5.5692 5.5708 5.6416 5.6451 6.8683 6.8694 6.9231 6.9239 7.9091 7.9125 9.0014 9.0024 9.4994 9.5010 13.7851 13.7860 14.9854 14.9873 16.0719 16.0731 16.2415 16.2451 17.4188 17.4209 k = 0.3760 0.5456 0.2034 ( 3308 PWs) bands (ev): -63.0841 -63.0841 -63.0820 -63.0820 -30.0560 -30.0535 -30.0490 -30.0461 -29.7934 -29.7913 -29.7803 -29.7778 -29.7362 -29.7349 -29.7252 -29.7249 -8.1941 -8.1940 -7.7785 -7.7781 -4.9264 -4.9261 -4.4081 -4.4067 0.0665 0.0676 1.0226 1.0228 2.9974 2.9975 3.2632 3.2655 4.9359 4.9361 5.5904 5.5937 5.6004 5.6017 6.8922 6.8933 6.9231 6.9241 7.9706 7.9741 8.9615 8.9626 9.5044 9.5060 13.7710 13.7718 15.0470 15.0489 16.1450 16.1462 16.3124 16.3160 17.4599 17.4621 k = 0.3695 0.5541 0.2141 ( 3308 PWs) bands (ev): -63.0842 -63.0842 -63.0819 -63.0819 -30.0564 -30.0538 -30.0487 -30.0457 -29.7937 -29.7914 -29.7800 -29.7773 -29.7365 -29.7351 -29.7251 -29.7247 -8.2072 -8.2071 -7.7427 -7.7424 -4.9572 -4.9569 -4.4038 -4.4023 0.0264 0.0275 1.0608 1.0610 2.9642 2.9642 3.2616 3.2639 4.9375 4.9378 5.5406 5.5439 5.6320 5.6335 6.9174 6.9176 6.9209 6.9230 8.0305 8.0339 8.9204 8.9216 9.5084 9.5100 13.7607 13.7613 15.1084 15.1103 16.2160 16.2174 16.3840 16.3876 17.5034 17.5057 k = 0.3630 0.5626 0.2248 ( 3312 PWs) bands (ev): -63.0843 -63.0843 -63.0818 -63.0818 -30.0569 -30.0542 -30.0485 -30.0453 -29.7939 -29.7916 -29.7797 -29.7769 -29.7369 -29.7354 -29.7251 -29.7246 -8.2217 -8.2216 -7.7052 -7.7049 -4.9865 -4.9861 -4.3994 -4.3978 -0.0157 -0.0146 1.0968 1.0970 2.9301 2.9302 3.2609 3.2633 4.9440 4.9443 5.4920 5.4953 5.6648 5.6663 6.9163 6.9171 6.9438 6.9455 8.0885 8.0919 8.8783 8.8796 9.5114 9.5129 13.7541 13.7546 15.1690 15.1710 16.2839 16.2854 16.4566 16.4602 17.5495 17.5519 k = 0.3565 0.5711 0.2355 ( 3314 PWs) bands (ev): -63.0844 -63.0844 -63.0817 -63.0817 -30.0573 -30.0546 -30.0482 -30.0449 -29.7941 -29.7918 -29.7793 -29.7765 -29.7372 -29.7356 -29.7250 -29.7245 -8.2378 -8.2377 -7.6661 -7.6656 -5.0140 -5.0136 -4.3949 -4.3933 -0.0598 -0.0587 1.1306 1.1308 2.8954 2.8955 3.2612 3.2637 4.9554 4.9557 5.4449 5.4482 5.6985 5.7000 6.9093 6.9103 6.9715 6.9731 8.1445 8.1478 8.8353 8.8366 9.5132 9.5146 13.7513 13.7517 15.2283 15.2302 16.3470 16.3486 16.5305 16.5341 17.5989 17.6013 k = 0.3499 0.5795 0.2462 ( 3306 PWs) bands (ev): -63.0845 -63.0845 -63.0815 -63.0815 -30.0577 -30.0549 -30.0479 -30.0445 -29.7944 -29.7919 -29.7790 -29.7761 -29.7375 -29.7358 -29.7249 -29.7243 -8.2555 -8.2554 -7.6252 -7.6247 -5.0395 -5.0390 -4.3904 -4.3888 -0.1057 -0.1046 1.1619 1.1621 2.8601 2.8602 3.2624 3.2650 4.9717 4.9720 5.3995 5.4027 5.7332 5.7346 6.9000 6.9012 7.0003 7.0020 8.1984 8.2016 8.7916 8.7929 9.5136 9.5150 13.7524 13.7526 15.2858 15.2877 16.4040 16.4058 16.6061 16.6097 17.6522 17.6546 k = 0.3434 0.5880 0.2569 ( 3306 PWs) bands (ev): -63.0846 -63.0846 -63.0814 -63.0814 -30.0582 -30.0553 -30.0476 -30.0441 -29.7946 -29.7920 -29.7786 -29.7757 -29.7378 -29.7360 -29.7249 -29.7243 -8.2747 -8.2746 -7.5826 -7.5822 -5.0628 -5.0624 -4.3860 -4.3843 -0.1534 -0.1523 1.1906 1.1907 2.8243 2.8244 3.2645 3.2671 4.9927 4.9931 5.3560 5.3592 5.7686 5.7699 6.8884 6.8897 7.0303 7.0320 8.2499 8.2531 8.7471 8.7485 9.5127 9.5140 13.7572 13.7573 15.3409 15.3427 16.4535 16.4555 16.6837 16.6872 17.7100 17.7124 k = 0.3369 0.5965 0.2676 ( 3306 PWs) bands (ev): -63.0848 -63.0848 -63.0813 -63.0813 -30.0587 -30.0557 -30.0472 -30.0436 -29.7948 -29.7922 -29.7783 -29.7754 -29.7381 -29.7362 -29.7248 -29.7241 -8.2956 -8.2955 -7.5384 -7.5380 -5.0839 -5.0834 -4.3816 -4.3798 -0.2028 -0.2017 1.2166 1.2167 2.7882 2.7883 3.2675 3.2702 5.0181 5.0186 5.3148 5.3180 5.8048 5.8061 6.8745 6.8759 7.0615 7.0632 8.2989 8.3021 8.7019 8.7034 9.5103 9.5115 13.7657 13.7658 15.3932 15.3949 16.4943 16.4966 16.7634 16.7670 17.7728 17.7751 k = 0.3304 0.6050 0.2783 ( 3298 PWs) bands (ev): -63.0849 -63.0849 -63.0812 -63.0812 -30.0591 -30.0561 -30.0469 -30.0432 -29.7950 -29.7923 -29.7779 -29.7750 -29.7384 -29.7363 -29.7248 -29.7240 -8.3181 -8.3181 -7.4926 -7.4921 -5.1026 -5.1021 -4.3772 -4.3754 -0.2539 -0.2527 1.2399 1.2399 2.7518 2.7519 3.2714 3.2740 5.0467 5.0474 5.2770 5.2803 5.8417 5.8430 6.8584 6.8599 7.0937 7.0954 8.3453 8.3484 8.6563 8.6578 9.5064 9.5075 13.7778 13.7780 15.4423 15.4439 16.5259 16.5284 16.8455 16.8490 17.8408 17.8431 k = 0.3238 0.6135 0.2890 ( 3292 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0465 -30.0427 -29.7952 -29.7924 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7239 -8.3423 -8.3423 -7.4452 -7.4447 -5.1187 -5.1182 -4.3729 -4.3711 -0.3065 -0.3054 1.2605 1.2605 2.7153 2.7154 3.2759 3.2786 5.0760 5.0770 5.2450 5.2485 5.8794 5.8805 6.8403 6.8419 7.1269 7.1286 8.3891 8.3921 8.6103 8.6119 9.5009 9.5019 13.7933 13.7937 15.4880 15.4894 16.5479 16.5505 16.9296 16.9332 17.9126 17.9156 k = 0.3238 0.6135 0.2890 ( 3292 PWs) bands (ev): -63.0850 -63.0850 -63.0810 -63.0810 -30.0596 -30.0565 -30.0465 -30.0427 -29.7952 -29.7924 -29.7776 -29.7746 -29.7387 -29.7365 -29.7248 -29.7239 -8.3423 -8.3423 -7.4452 -7.4447 -5.1187 -5.1182 -4.3729 -4.3711 -0.3065 -0.3054 1.2605 1.2605 2.7153 2.7154 3.2759 3.2786 5.0760 5.0770 5.2450 5.2485 5.8794 5.8805 6.8403 6.8419 7.1269 7.1286 8.3891 8.3921 8.6103 8.6119 9.5009 9.5019 13.7933 13.7937 15.4880 15.4894 16.5479 16.5505 16.9296 16.9332 17.9126 17.9156 k = 0.3104 0.6095 0.2941 ( 3296 PWs) bands (ev): -63.0851 -63.0851 -63.0810 -63.0810 -30.0598 -30.0568 -30.0463 -30.0425 -29.7954 -29.7925 -29.7774 -29.7744 -29.7388 -29.7366 -29.7248 -29.7239 -8.3560 -8.3559 -7.4203 -7.4198 -5.1247 -5.1242 -4.3710 -4.3693 -0.3351 -0.3340 1.2721 1.2722 2.6977 2.6978 3.2768 3.2796 5.0896 5.0907 5.2346 5.2382 5.8961 5.8972 6.8298 6.8315 7.1431 7.1448 8.4091 8.4120 8.5902 8.5918 9.4970 9.4979 13.8039 13.8044 15.5083 15.5096 16.5472 16.5498 16.9754 16.9790 17.8568 17.8582 k = 0.2969 0.6055 0.2991 ( 3295 PWs) bands (ev): -63.0852 -63.0852 -63.0809 -63.0809 -30.0601 -30.0571 -30.0460 -30.0422 -29.7955 -29.7927 -29.7772 -29.7742 -29.7390 -29.7367 -29.7248 -29.7239 -8.3728 -8.3728 -7.3917 -7.3912 -5.1284 -5.1278 -4.3696 -4.3679 -0.3702 -0.3690 1.2886 1.2887 2.6795 2.6796 3.2750 3.2778 5.1032 5.1043 5.2300 5.2336 5.9103 5.9114 6.8164 6.8181 7.1602 7.1620 8.4286 8.4314 8.5743 8.5757 9.4910 9.4919 13.8195 13.8200 15.5280 15.5292 16.5330 16.5355 17.0274 17.0309 17.8015 17.8032 k = 0.2834 0.6015 0.3042 ( 3297 PWs) bands (ev): -63.0853 -63.0853 -63.0808 -63.0808 -30.0603 -30.0574 -30.0457 -30.0420 -29.7956 -29.7928 -29.7769 -29.7740 -29.7391 -29.7368 -29.7247 -29.7238 -8.3919 -8.3919 -7.3606 -7.3601 -5.1297 -5.1292 -4.3688 -4.3670 -0.4109 -0.4097 1.3094 1.3096 2.6608 2.6610 3.2706 3.2733 5.1151 5.1161 5.2325 5.2359 5.9220 5.9232 6.8000 6.8017 7.1784 7.1803 8.4457 8.4484 8.5638 8.5653 9.4831 9.4840 13.8398 13.8405 15.5471 15.5483 16.5104 16.5128 17.0777 17.0811 17.7523 17.7544 k = 0.2699 0.5975 0.3092 ( 3293 PWs) bands (ev): -63.0853 -63.0853 -63.0807 -63.0807 -30.0606 -30.0578 -30.0454 -30.0417 -29.7958 -29.7930 -29.7766 -29.7737 -29.7393 -29.7369 -29.7247 -29.7237 -8.4126 -8.4125 -7.3277 -7.3272 -5.1286 -5.1280 -4.3685 -4.3667 -0.4564 -0.4553 1.3341 1.3343 2.6420 2.6423 3.2635 3.2662 5.1242 5.1250 5.2428 5.2459 5.9313 5.9325 6.7805 6.7822 7.1982 7.2002 8.4576 8.4605 8.5610 8.5629 9.4732 9.4741 13.8648 13.8655 15.5658 15.5670 16.4833 16.4855 17.1195 17.1229 17.7118 17.7143 k = 0.2564 0.5935 0.3143 ( 3296 PWs) bands (ev): -63.0854 -63.0854 -63.0806 -63.0806 -30.0609 -30.0581 -30.0450 -30.0414 -29.7959 -29.7932 -29.7763 -29.7735 -29.7395 -29.7370 -29.7247 -29.7237 -8.4342 -8.4342 -7.2939 -7.2934 -5.1249 -5.1243 -4.3689 -4.3671 -0.5058 -0.5048 1.3621 1.3622 2.6233 2.6236 3.2540 3.2567 5.1308 5.1314 5.2600 5.2627 5.9382 5.9393 6.7580 6.7598 7.2196 7.2218 8.4622 8.4657 8.5676 8.5702 9.4614 9.4623 13.8943 13.8951 15.5841 15.5853 16.4537 16.4558 17.1472 17.1506 17.6829 17.6858 k = 0.2429 0.5895 0.3193 ( 3300 PWs) bands (ev): -63.0855 -63.0855 -63.0805 -63.0805 -30.0612 -30.0585 -30.0446 -30.0412 -29.7961 -29.7934 -29.7760 -29.7732 -29.7397 -29.7372 -29.7247 -29.7236 -8.4563 -8.4562 -7.2598 -7.2593 -5.1186 -5.1180 -4.3700 -4.3682 -0.5584 -0.5573 1.3926 1.3928 2.6050 2.6053 3.2421 3.2447 5.1360 5.1368 5.2822 5.2846 5.9428 5.9439 6.7328 6.7346 7.2430 7.2454 8.4604 8.4645 8.5824 8.5856 9.4478 9.4488 13.9279 13.9288 15.6022 15.6035 16.4233 16.4252 17.1571 17.1606 17.6678 17.6712 k = 0.2294 0.5855 0.3244 ( 3302 PWs) bands (ev): -63.0856 -63.0856 -63.0804 -63.0804 -30.0614 -30.0590 -30.0442 -30.0409 -29.7963 -29.7937 -29.7756 -29.7729 -29.7399 -29.7374 -29.7246 -29.7236 -8.4784 -8.4784 -7.2261 -7.2256 -5.1097 -5.1091 -4.3721 -4.3703 -0.6132 -0.6122 1.4252 1.4254 2.5873 2.5876 3.2278 3.2304 5.1413 5.1423 5.3075 5.3098 5.9451 5.9462 6.7050 6.7068 7.2686 7.2712 8.4550 8.4595 8.6023 8.6058 9.4327 9.4336 13.9655 13.9665 15.6202 15.6215 16.3930 16.3948 17.1488 17.1521 17.6663 17.6699 k = 0.2159 0.5815 0.3294 ( 3304 PWs) bands (ev): -63.0857 -63.0857 -63.0803 -63.0803 -30.0617 -30.0594 -30.0438 -30.0407 -29.7964 -29.7939 -29.7752 -29.7726 -29.7401 -29.7376 -29.7246 -29.7235 -8.5003 -8.5002 -7.1932 -7.1927 -5.0981 -5.0975 -4.3751 -4.3733 -0.6694 -0.6684 1.4592 1.4595 2.5706 2.5709 3.2113 3.2138 5.1477 5.1488 5.3346 5.3369 5.9455 5.9465 6.6748 6.6767 7.2965 7.2993 8.4478 8.4526 8.6248 8.6283 9.4160 9.4170 14.0067 14.0078 15.6381 15.6395 16.3635 16.3653 17.1250 17.1281 17.6755 17.6792 k = 0.2024 0.5775 0.3345 ( 3300 PWs) bands (ev): -63.0858 -63.0858 -63.0802 -63.0802 -30.0619 -30.0597 -30.0434 -30.0404 -29.7966 -29.7942 -29.7749 -29.7723 -29.7403 -29.7378 -29.7246 -29.7235 -8.5216 -8.5215 -7.1614 -7.1609 -5.0840 -5.0833 -4.3792 -4.3774 -0.7263 -0.7254 1.4941 1.4944 2.5552 2.5556 3.1927 3.1951 5.1555 5.1569 5.3624 5.3648 5.9442 5.9451 6.6426 6.6445 7.3269 7.3299 8.4396 8.4447 8.6484 8.6519 9.3981 9.3990 14.0512 14.0524 15.6559 15.6575 16.3354 16.3371 17.0899 17.0929 17.6912 17.6951 k = 0.1889 0.5735 0.3395 ( 3308 PWs) bands (ev): -63.0859 -63.0859 -63.0801 -63.0801 -30.0622 -30.0601 -30.0430 -30.0402 -29.7967 -29.7944 -29.7745 -29.7721 -29.7404 -29.7380 -29.7246 -29.7234 -8.5421 -8.5420 -7.1310 -7.1306 -5.0673 -5.0666 -4.3844 -4.3826 -0.7832 -0.7823 1.5293 1.5296 2.5416 2.5420 3.1719 3.1742 5.1652 5.1667 5.3902 5.3927 5.9414 5.9422 6.6087 6.6106 7.3597 7.3629 8.4304 8.4357 8.6721 8.6756 9.3791 9.3800 14.0986 14.0998 15.6734 15.6753 16.3090 16.3106 17.0475 17.0503 17.7100 17.7138 k = 0.1754 0.5695 0.3446 ( 3302 PWs) bands (ev): -63.0860 -63.0860 -63.0800 -63.0800 -30.0624 -30.0605 -30.0426 -30.0400 -29.7968 -29.7947 -29.7741 -29.7718 -29.7406 -29.7382 -29.7245 -29.7234 -8.5617 -8.5616 -7.1024 -7.1020 -5.0481 -5.0474 -4.3909 -4.3891 -0.8393 -0.8385 1.5642 1.5645 2.5300 2.5304 3.1491 3.1513 5.1768 5.1784 5.4172 5.4200 5.9375 5.9382 6.5735 6.5753 7.3951 7.3985 8.4202 8.4258 8.6955 8.6989 9.3593 9.3603 14.1485 14.1498 15.6907 15.6927 16.2849 16.2863 17.0006 17.0034 17.7290 17.7328 k = 0.1619 0.5655 0.3496 ( 3298 PWs) bands (ev): -63.0861 -63.0861 -63.0799 -63.0799 -30.0626 -30.0608 -30.0422 -30.0398 -29.7970 -29.7949 -29.7737 -29.7715 -29.7407 -29.7384 -29.7244 -29.7233 -8.5802 -8.5801 -7.0757 -7.0753 -5.0267 -5.0260 -4.3987 -4.3969 -0.8941 -0.8933 1.5984 1.5986 2.5209 2.5214 3.1244 3.1266 5.1903 5.1920 5.4428 5.4458 5.9331 5.9337 6.5371 6.5389 7.4329 7.4365 8.4087 8.4144 8.7182 8.7215 9.3392 9.3401 14.2004 14.2017 15.7072 15.7095 16.2633 16.2646 16.9514 16.9541 17.7461 17.7498 k = 0.1484 0.5614 0.3547 ( 3298 PWs) bands (ev): -63.0862 -63.0862 -63.0799 -63.0799 -30.0628 -30.0612 -30.0418 -30.0396 -29.7971 -29.7952 -29.7734 -29.7713 -29.7409 -29.7386 -29.7243 -29.7233 -8.5975 -8.5975 -7.0511 -7.0507 -5.0032 -5.0024 -4.4079 -4.4061 -0.9470 -0.9462 1.6312 1.6314 2.5146 2.5151 3.0980 3.1000 5.2056 5.2074 5.4664 5.4697 5.9287 5.9291 6.4999 6.5018 7.4730 7.4768 8.3954 8.4013 8.7399 8.7431 9.3189 9.3198 14.2537 14.2551 15.7226 15.7251 16.2447 16.2459 16.9013 16.9040 17.7587 17.7622 k = 0.1349 0.5574 0.3597 ( 3295 PWs) bands (ev): -63.0863 -63.0863 -63.0798 -63.0798 -30.0630 -30.0615 -30.0415 -30.0394 -29.7972 -29.7954 -29.7730 -29.7710 -29.7410 -29.7388 -29.7242 -29.7233 -8.6136 -8.6135 -7.0286 -7.0282 -4.9780 -4.9771 -4.4185 -4.4168 -0.9973 -0.9966 1.6622 1.6625 2.5116 2.5120 3.0700 3.0719 5.2226 5.2245 5.4873 5.4908 5.9250 5.9253 6.4623 6.4641 7.5152 7.5192 8.3801 8.3862 8.7605 8.7636 9.2988 9.2998 14.3078 14.3092 15.7362 15.7389 16.2298 16.2308 16.8511 16.8540 17.7623 17.7654 k = 0.1214 0.5534 0.3648 ( 3296 PWs) bands (ev): -63.0863 -63.0863 -63.0797 -63.0797 -30.0631 -30.0618 -30.0411 -30.0393 -29.7973 -29.7957 -29.7726 -29.7708 -29.7411 -29.7391 -29.7242 -29.7233 -8.6283 -8.6282 -7.0082 -7.0079 -4.9512 -4.9503 -4.4307 -4.4290 -1.0446 -1.0440 1.6910 1.6912 2.5119 2.5124 3.0406 3.0424 5.2412 5.2433 5.5046 5.5083 5.9227 5.9232 6.4246 6.4263 7.5592 7.5635 8.3624 8.3686 8.7797 8.7826 9.2794 9.2802 14.3621 14.3635 15.7473 15.7501 16.2193 16.2200 16.8017 16.8046 17.7494 17.7518 k = 0.1079 0.5494 0.3698 ( 3294 PWs) bands (ev): -63.0864 -63.0864 -63.0797 -63.0797 -30.0632 -30.0621 -30.0408 -30.0392 -29.7973 -29.7959 -29.7723 -29.7707 -29.7411 -29.7393 -29.7241 -29.7233 -8.6416 -8.6416 -6.9901 -6.9898 -4.9232 -4.9223 -4.4442 -4.4426 -1.0884 -1.0878 1.7171 1.7173 2.5159 2.5164 3.0102 3.0118 5.2612 5.2634 5.5176 5.5216 5.9229 5.9235 6.3869 6.3886 7.6047 7.6091 8.3421 8.3484 8.7975 8.8002 9.2609 9.2617 14.4156 14.4170 15.7550 15.7579 16.2139 16.2143 16.7535 16.7565 17.7175 17.7192 k = 0.0945 0.5454 0.3749 ( 3291 PWs) bands (ev): -63.0865 -63.0865 -63.0796 -63.0796 -30.0633 -30.0623 -30.0405 -30.0391 -29.7974 -29.7961 -29.7720 -29.7705 -29.7412 -29.7395 -29.7240 -29.7233 -8.6534 -8.6534 -6.9743 -6.9740 -4.8946 -4.8936 -4.4592 -4.4576 -1.1282 -1.1277 1.7402 1.7404 2.5235 2.5240 2.9789 2.9804 5.2824 5.2847 5.5257 5.5299 5.9262 5.9270 6.3497 6.3514 7.6512 7.6557 8.3192 8.3254 8.8137 8.8162 9.2437 9.2444 14.4674 14.4688 15.7589 15.7617 16.2141 16.2143 16.7069 16.7101 17.6754 17.6767 k = 0.0810 0.5414 0.3799 ( 3288 PWs) bands (ev): -63.0865 -63.0865 -63.0795 -63.0795 -30.0634 -30.0625 -30.0402 -30.0390 -29.7974 -29.7963 -29.7717 -29.7704 -29.7412 -29.7398 -29.7239 -29.7233 -8.6638 -8.6637 -6.9606 -6.9604 -4.8657 -4.8647 -4.4753 -4.4738 -1.1635 -1.1631 1.7602 1.7604 2.5346 2.5351 2.9472 2.9486 5.3046 5.3070 5.5287 5.5329 5.9331 5.9340 6.3134 6.3149 7.6981 7.7027 8.2937 8.2999 8.8281 8.8304 9.2281 9.2287 14.5166 14.5178 15.7587 15.7614 16.2200 16.2202 16.6623 16.6655 17.6320 17.6330 k = 0.0675 0.5374 0.3850 ( 3289 PWs) bands (ev): -63.0865 -63.0865 -63.0795 -63.0795 -30.0635 -30.0627 -30.0400 -30.0390 -29.7974 -29.7965 -29.7714 -29.7703 -29.7412 -29.7400 -29.7238 -29.7233 -8.6726 -8.6725 -6.9491 -6.9489 -4.8372 -4.8362 -4.4924 -4.4910 -1.1941 -1.1938 1.7769 1.7770 2.5488 2.5493 2.9157 2.9170 5.3274 5.3299 5.5264 5.5306 5.9436 5.9446 6.2783 6.2798 7.7447 7.7493 8.2660 8.2720 8.8407 8.8427 9.2144 9.2149 14.5617 14.5629 15.7551 15.7575 16.2313 16.2318 16.6200 16.6232 17.5915 17.5923 k = 0.0540 0.5334 0.3900 ( 3288 PWs) bands (ev): -63.0866 -63.0866 -63.0795 -63.0795 -30.0635 -30.0629 -30.0398 -30.0389 -29.7974 -29.7966 -29.7712 -29.7703 -29.7412 -29.7402 -29.7238 -29.7233 -8.6798 -8.6798 -6.9398 -6.9396 -4.8099 -4.8090 -4.5098 -4.5085 -1.2196 -1.2193 1.7904 1.7905 2.5653 2.5658 2.8852 2.8863 5.3505 5.3532 5.5194 5.5234 5.9573 5.9583 6.2452 6.2465 7.7899 7.7944 8.2368 8.2425 8.8513 8.8529 9.2029 9.2033 14.6016 14.6026 15.7489 15.7510 16.2471 16.2480 16.5805 16.5835 17.5564 17.5570 k = 0.0405 0.5294 0.3951 ( 3288 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0635 -30.0631 -30.0396 -30.0389 -29.7974 -29.7968 -29.7709 -29.7703 -29.7411 -29.7404 -29.7237 -29.7233 -8.6854 -8.6854 -6.9325 -6.9324 -4.7850 -4.7842 -4.5267 -4.5256 -1.2398 -1.2395 1.8006 1.8007 2.5829 2.5833 2.8569 2.8579 5.3734 5.3761 5.5084 5.5123 5.9729 5.9739 6.2149 6.2161 7.8321 7.8362 8.2076 8.2127 8.8598 8.8611 9.1936 9.1939 14.6347 14.6355 15.7417 15.7433 16.2659 16.2670 16.5446 16.5474 17.5279 17.5284 k = 0.0270 0.5254 0.4001 ( 3285 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0635 -30.0632 -30.0394 -30.0390 -29.7973 -29.7969 -29.7707 -29.7703 -29.7411 -29.7405 -29.7236 -29.7234 -8.6895 -8.6894 -6.9274 -6.9273 -4.7642 -4.7635 -4.5416 -4.5407 -1.2543 -1.2541 1.8079 1.8079 2.5995 2.5999 2.8329 2.8336 5.3952 5.3979 5.4950 5.4984 5.9885 5.9893 6.1893 6.1902 7.8686 7.8721 8.1810 8.1851 8.8661 8.8669 9.1869 9.1871 14.6597 14.6602 15.7351 15.7363 16.2851 16.2862 16.5143 16.5165 17.5070 17.5073 k = 0.0135 0.5214 0.4052 ( 3282 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0635 -30.0633 -30.0392 -30.0390 -29.7972 -29.7970 -29.7706 -29.7703 -29.7410 -29.7407 -29.7235 -29.7234 -8.6919 -8.6919 -6.9243 -6.9243 -4.7497 -4.7493 -4.5521 -4.5516 -1.2630 -1.2630 1.8121 1.8122 2.6121 2.6123 2.8160 2.8164 5.4140 5.4160 5.4817 5.4842 6.0010 6.0015 6.1712 6.1717 7.8952 7.8973 8.1615 8.1638 8.8700 8.8704 9.1829 9.1830 14.6753 14.6756 15.7306 15.7312 16.3007 16.3014 16.4928 16.4942 17.4942 17.4944 k = 0.0000 0.5174 0.4102 ( 3280 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0634 -30.0634 -30.0391 -30.0391 -29.7972 -29.7972 -29.7704 -29.7704 -29.7408 -29.7408 -29.7235 -29.7235 -8.6927 -8.6927 -6.9233 -6.9233 -4.7443 -4.7443 -4.5559 -4.5559 -1.2659 -1.2659 1.8136 1.8136 2.6170 2.6170 2.8099 2.8099 5.4235 5.4235 5.4760 5.4760 6.0061 6.0061 6.1646 6.1646 7.9059 7.9059 8.1548 8.1548 8.8714 8.8714 9.1815 9.1815 14.6807 14.6807 15.7292 15.7292 16.3072 16.3072 16.4853 16.4853 17.4900 17.4900 k = 0.0000 0.5174 0.4102 ( 3280 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0634 -30.0634 -30.0391 -30.0391 -29.7972 -29.7972 -29.7704 -29.7704 -29.7408 -29.7408 -29.7235 -29.7235 -8.6927 -8.6927 -6.9233 -6.9233 -4.7443 -4.7443 -4.5559 -4.5559 -1.2659 -1.2659 1.8136 1.8136 2.6170 2.6170 2.8099 2.8099 5.4235 5.4235 5.4760 5.4760 6.0061 6.0061 6.1646 6.1646 7.9059 7.9059 8.1548 8.1548 8.8714 8.8714 9.1815 9.1815 14.6807 14.6807 15.7292 15.7292 16.3072 16.3072 16.4853 16.4853 17.4900 17.4900 k = 0.0064 0.5091 0.4207 ( 3284 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0635 -30.0633 -30.0392 -30.0391 -29.7972 -29.7971 -29.7706 -29.7703 -29.7409 -29.7408 -29.7235 -29.7235 -8.6919 -8.6919 -6.9235 -6.9235 -4.7445 -4.7445 -4.5572 -4.5571 -1.2648 -1.2647 1.8102 1.8102 2.6178 2.6178 2.8103 2.8103 5.4193 5.4194 5.4738 5.4743 6.0105 6.0106 6.1683 6.1685 7.9066 7.9069 8.1551 8.1551 8.8715 8.8717 9.1816 9.1819 14.6814 14.6814 15.7238 15.7239 16.3070 16.3070 16.4910 16.4913 17.4882 17.4886 k = 0.0128 0.5007 0.4313 ( 3284 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0635 -30.0632 -30.0393 -30.0390 -29.7972 -29.7970 -29.7707 -29.7702 -29.7409 -29.7407 -29.7236 -29.7234 -8.6896 -8.6896 -6.9242 -6.9242 -4.7449 -4.7448 -4.5609 -4.5608 -1.2612 -1.2612 1.8001 1.8003 2.6201 2.6202 2.8115 2.8115 5.4073 5.4075 5.4680 5.4690 6.0235 6.0237 6.1795 6.1799 7.9090 7.9096 8.1560 8.1561 8.8720 8.8723 9.1820 9.1827 14.6836 14.6836 15.7081 15.7085 16.3064 16.3065 16.5082 16.5087 17.4832 17.4840 k = 0.0192 0.4924 0.4418 ( 3290 PWs) bands (ev): -63.0866 -63.0866 -63.0794 -63.0794 -30.0636 -30.0631 -30.0395 -30.0390 -29.7973 -29.7970 -29.7709 -29.7701 -29.7410 -29.7407 -29.7236 -29.7234 -8.6858 -8.6858 -6.9254 -6.9253 -4.7455 -4.7455 -4.5670 -4.5669 -1.2554 -1.2553 1.7838 1.7840 2.6237 2.6239 2.8133 2.8134 5.3887 5.3890 5.4591 5.4606 6.0438 6.0441 6.1976 6.1982 7.9130 7.9140 8.1575 8.1577 8.8728 8.8733 9.1827 9.1838 14.6872 14.6872 15.6838 15.6842 16.3055 16.3056 16.5351 16.5358 17.4754 17.4766 k = 0.0256 0.4841 0.4523 ( 3294 PWs) bands (ev): -63.0866 -63.0866 -63.0795 -63.0795 -30.0636 -30.0630 -30.0396 -30.0390 -29.7973 -29.7969 -29.7710 -29.7700 -29.7410 -29.7407 -29.7237 -29.7234 -8.6805 -8.6804 -6.9270 -6.9270 -4.7465 -4.7463 -4.5755 -4.5753 -1.2472 -1.2471 1.7615 1.7618 2.6282 2.6284 2.8157 2.8159 5.3653 5.3657 5.4478 5.4497 6.0697 6.0702 6.2219 6.2226 7.9188 7.9201 8.1597 8.1600 8.8740 8.8747 9.1838 9.1853 14.6923 14.6923 15.6526 15.6532 16.3042 16.3044 16.5700 16.5709 17.4651 17.4666 k = 0.0321 0.4757 0.4628 ( 3292 PWs) bands (ev): -63.0866 -63.0866 -63.0795 -63.0795 -30.0636 -30.0629 -30.0398 -30.0390 -29.7973 -29.7968 -29.7712 -29.7699 -29.7411 -29.7406 -29.7237 -29.7234 -8.6736 -8.6735 -6.9292 -6.9291 -4.7476 -4.7475 -4.5862 -4.5860 -1.2368 -1.2367 1.7340 1.7343 2.6331 2.6334 2.8186 2.8188 5.3388 5.3393 5.4349 5.4372 6.0997 6.1002 6.2514 6.2522 7.9263 7.9279 8.1627 8.1629 8.8756 8.8764 9.1852 9.1870 14.6988 14.6988 15.6165 15.6171 16.3026 16.3029 16.6108 16.6119 17.4527 17.4545 k = 0.0385 0.4674 0.4733 ( 3292 PWs) bands (ev): -63.0865 -63.0865 -63.0795 -63.0795 -30.0636 -30.0627 -30.0400 -30.0391 -29.7972 -29.7967 -29.7714 -29.7698 -29.7411 -29.7406 -29.7237 -29.7234 -8.6652 -8.6651 -6.9320 -6.9319 -4.7491 -4.7489 -4.5990 -4.5987 -1.2242 -1.2240 1.7017 1.7020 2.6379 2.6383 2.8217 2.8219 5.3106 5.3112 5.4213 5.4238 6.1322 6.1329 6.2853 6.2861 7.9356 7.9375 8.1663 8.1666 8.8775 8.8784 9.1867 9.1888 14.7066 14.7067 15.5770 15.5778 16.3007 16.3011 16.6558 16.6570 17.4388 17.4409 k = 0.0449 0.4590 0.4839 ( 3290 PWs) bands (ev): -63.0865 -63.0865 -63.0796 -63.0796 -30.0636 -30.0625 -30.0402 -30.0392 -29.7972 -29.7965 -29.7715 -29.7697 -29.7411 -29.7405 -29.7238 -29.7234 -8.6553 -8.6552 -6.9354 -6.9353 -4.7508 -4.7506 -4.6137 -4.6133 -1.2094 -1.2092 1.6652 1.6656 2.6422 2.6426 2.8248 2.8250 5.2822 5.2828 5.4075 5.4103 6.1661 6.1670 6.3227 6.3235 7.9467 7.9489 8.1708 8.1711 8.8797 8.8808 9.1883 9.1908 14.7158 14.7159 15.5357 15.5365 16.2986 16.2990 16.7034 16.7048 17.4239 17.4262 k = 0.0513 0.4507 0.4944 ( 3294 PWs) bands (ev): -63.0864 -63.0864 -63.0796 -63.0796 -30.0636 -30.0623 -30.0405 -30.0393 -29.7972 -29.7964 -29.7718 -29.7697 -29.7411 -29.7405 -29.7239 -29.7234 -8.6439 -8.6438 -6.9394 -6.9393 -4.7528 -4.7526 -4.6301 -4.6297 -1.1925 -1.1924 1.6252 1.6256 2.6454 2.6459 2.8277 2.8279 5.2545 5.2552 5.3943 5.3974 6.2005 6.2015 6.3626 6.3634 7.9596 7.9621 8.1760 8.1764 8.8822 8.8834 9.1898 9.1927 14.7264 14.7265 15.4934 15.4942 16.2962 16.2967 16.7523 16.7538 17.4087 17.4112 k = 0.0577 0.4424 0.5049 ( 3294 PWs) bands (ev): -63.0864 -63.0864 -63.0796 -63.0796 -30.0635 -30.0621 -30.0408 -30.0394 -29.7971 -29.7963 -29.7720 -29.7697 -29.7412 -29.7404 -29.7239 -29.7235 -8.6310 -8.6309 -6.9442 -6.9441 -4.7552 -4.7549 -4.6481 -4.6477 -1.1737 -1.1735 1.5820 1.5825 2.6474 2.6479 2.8299 2.8302 5.2284 5.2293 5.3821 5.3853 6.2346 6.2357 6.4046 6.4052 7.9743 7.9771 8.1822 8.1826 8.8849 8.8863 9.1913 9.1944 14.7382 14.7383 15.4510 15.4519 16.2937 16.2943 16.8012 16.8028 17.3936 17.3963 k = 0.0641 0.4340 0.5154 ( 3296 PWs) bands (ev): -63.0863 -63.0863 -63.0797 -63.0797 -30.0635 -30.0619 -30.0410 -30.0395 -29.7970 -29.7961 -29.7722 -29.7696 -29.7412 -29.7404 -29.7240 -29.7235 -8.6166 -8.6165 -6.9498 -6.9497 -4.7578 -4.7575 -4.6673 -4.6669 -1.1529 -1.1527 1.5363 1.5368 2.6477 2.6482 2.8314 2.8316 5.2048 5.2057 5.3713 5.3747 6.2678 6.2690 6.4477 6.4483 7.9909 7.9939 8.1894 8.1898 8.8880 8.8894 9.1925 9.1959 14.7512 14.7513 15.4093 15.4102 16.2911 16.2918 16.8488 16.8506 17.3797 17.3825 k = 0.0705 0.4257 0.5259 ( 3292 PWs) bands (ev): -63.0863 -63.0863 -63.0798 -63.0798 -30.0634 -30.0617 -30.0413 -30.0397 -29.7969 -29.7960 -29.7724 -29.7696 -29.7411 -29.7403 -29.7240 -29.7235 -8.6008 -8.6006 -6.9563 -6.9562 -4.7608 -4.7605 -4.6877 -4.6872 -1.1302 -1.1301 1.4884 1.4890 2.6463 2.6468 2.8317 2.8320 5.1842 5.1852 5.3622 5.3658 6.2996 6.3010 6.4916 6.4920 8.0093 8.0126 8.1977 8.1980 8.8912 8.8928 9.1933 9.1971 14.7653 14.7654 15.3687 15.3696 16.2885 16.2893 16.8938 16.8957 17.3680 17.3709 k = 0.0769 0.4173 0.5365 ( 3284 PWs) bands (ev): -63.0862 -63.0862 -63.0798 -63.0798 -30.0632 -30.0614 -30.0416 -30.0399 -29.7968 -29.7958 -29.7726 -29.7696 -29.7411 -29.7403 -29.7241 -29.7235 -8.5835 -8.5833 -6.9638 -6.9637 -4.7640 -4.7637 -4.7088 -4.7083 -1.1058 -1.1056 1.4387 1.4393 2.6430 2.6435 2.8306 2.8309 5.1671 5.1682 5.3549 5.3587 6.3298 6.3313 6.5355 6.5357 8.0295 8.0331 8.2072 8.2075 8.8947 8.8964 9.1936 9.1977 14.7804 14.7806 15.3296 15.3306 16.2860 16.2869 16.9344 16.9364 17.3598 17.3628 k = 0.0833 0.4090 0.5470 ( 3272 PWs) bands (ev): -63.0861 -63.0861 -63.0799 -63.0799 -30.0631 -30.0612 -30.0419 -30.0400 -29.7966 -29.7956 -29.7728 -29.7695 -29.7411 -29.7402 -29.7241 -29.7235 -8.5648 -8.5646 -6.9723 -6.9722 -4.7677 -4.7674 -4.7305 -4.7300 -1.0797 -1.0795 1.3876 1.3881 2.6377 2.6383 2.8279 2.8282 5.1540 5.1552 5.3498 5.3536 6.3580 6.3597 6.5789 6.5790 8.0516 8.0554 8.2180 8.2182 8.8983 8.9000 9.1934 9.1977 14.7964 14.7967 15.2923 15.2933 16.2836 16.2846 16.9687 16.9706 17.3572 17.3601 k = 0.0897 0.4007 0.5575 ( 3280 PWs) bands (ev): -63.0861 -63.0861 -63.0800 -63.0800 -30.0630 -30.0609 -30.0423 -30.0403 -29.7965 -29.7955 -29.7731 -29.7695 -29.7411 -29.7402 -29.7242 -29.7236 -8.5447 -8.5445 -6.9820 -6.9819 -4.7717 -4.7714 -4.7526 -4.7520 -1.0520 -1.0518 1.3351 1.3357 2.6305 2.6311 2.8233 2.8236 5.1450 5.1463 5.3467 5.3506 6.3841 6.3858 6.6212 6.6214 8.0753 8.0793 8.2301 8.2302 8.9020 8.9038 9.1923 9.1970 14.8133 14.8136 15.2571 15.2581 16.2814 16.2825 16.9943 16.9960 17.3618 17.3645 k = 0.0962 0.3923 0.5680 ( 3282 PWs) bands (ev): -63.0860 -63.0860 -63.0800 -63.0800 -30.0629 -30.0606 -30.0427 -30.0406 -29.7964 -29.7953 -29.7733 -29.7695 -29.7410 -29.7401 -29.7242 -29.7237 -8.5232 -8.5230 -6.9929 -6.9928 -4.7761 -4.7761 -4.7743 -4.7741 -1.0228 -1.0226 1.2818 1.2824 2.6215 2.6221 2.8166 2.8169 5.1405 5.1419 5.3457 5.3498 6.4079 6.4097 6.6620 6.6624 8.1006 8.1048 8.2436 8.2437 8.9058 8.9076 9.1905 9.1954 14.8307 14.8311 15.2241 15.2252 16.2795 16.2808 17.0100 17.0113 17.3753 17.3776 k = 0.1026 0.3840 0.5785 ( 3282 PWs) bands (ev): -63.0859 -63.0859 -63.0801 -63.0801 -30.0627 -30.0603 -30.0430 -30.0408 -29.7962 -29.7951 -29.7736 -29.7696 -29.7410 -29.7401 -29.7243 -29.7237 -8.5003 -8.5001 -7.0052 -7.0050 -4.7967 -4.7962 -4.7808 -4.7804 -0.9921 -0.9919 1.2276 1.2282 2.6107 2.6113 2.8079 2.8082 5.1405 5.1419 5.3468 5.3510 6.4294 6.4313 6.7008 6.7015 8.1274 8.1319 8.2587 8.2588 8.9095 8.9114 9.1878 9.1929 14.8487 14.8491 15.1936 15.1947 16.2781 16.2795 17.0154 17.0163 17.3975 17.3994 k = 0.1090 0.3756 0.5890 ( 3286 PWs) bands (ev): -63.0858 -63.0858 -63.0802 -63.0802 -30.0626 -30.0600 -30.0434 -30.0411 -29.7961 -29.7949 -29.7738 -29.7696 -29.7410 -29.7401 -29.7244 -29.7238 -8.4761 -8.4759 -7.0188 -7.0187 -4.8183 -4.8177 -4.7860 -4.7855 -0.9600 -0.9598 1.1729 1.1736 2.5984 2.5990 2.7970 2.7973 5.1450 5.1465 5.3500 5.3542 6.4486 6.4507 6.7373 6.7382 8.1556 8.1603 8.2753 8.2755 8.9133 8.9151 9.1840 9.1894 14.8670 14.8674 15.1656 15.1667 16.2772 16.2788 17.0117 17.0122 17.4270 17.4284 k = 0.1154 0.3673 0.5996 ( 3284 PWs) bands (ev): -63.0857 -63.0857 -63.0803 -63.0803 -30.0624 -30.0597 -30.0438 -30.0414 -29.7959 -29.7947 -29.7741 -29.7696 -29.7409 -29.7400 -29.7244 -29.7239 -8.4506 -8.4504 -7.0340 -7.0338 -4.8393 -4.8387 -4.7915 -4.7910 -0.9266 -0.9264 1.1179 1.1185 2.5848 2.5853 2.7839 2.7842 5.1539 5.1555 5.3551 5.3593 6.4656 6.4677 6.7712 6.7723 8.1851 8.1899 8.2936 8.2940 8.9169 8.9188 9.1793 9.1848 14.8853 14.8858 15.1401 15.1412 16.2771 16.2788 17.0009 17.0010 17.4618 17.4628 k = 0.1218 0.3590 0.6101 ( 3284 PWs) bands (ev): -63.0856 -63.0856 -63.0804 -63.0804 -30.0622 -30.0594 -30.0442 -30.0417 -29.7957 -29.7945 -29.7744 -29.7697 -29.7409 -29.7400 -29.7245 -29.7239 -8.4238 -8.4235 -7.0506 -7.0505 -4.8594 -4.8589 -4.7974 -4.7970 -0.8919 -0.8917 1.0625 1.0632 2.5699 2.5705 2.7688 2.7691 5.1670 5.1687 5.3621 5.3663 6.4804 6.4826 6.8019 6.8033 8.2157 8.2207 8.3136 8.3141 8.9205 8.9223 9.1733 9.1791 14.9037 14.9042 15.1173 15.1184 16.2777 16.2795 16.9847 16.9849 17.5000 17.5006 k = 0.1282 0.3506 0.6206 ( 3282 PWs) bands (ev): -63.0855 -63.0855 -63.0805 -63.0805 -30.0620 -30.0590 -30.0446 -30.0421 -29.7955 -29.7944 -29.7747 -29.7697 -29.7408 -29.7399 -29.7245 -29.7240 -8.3957 -8.3955 -7.0689 -7.0688 -4.8785 -4.8780 -4.8037 -4.8033 -0.8560 -0.8559 1.0070 1.0077 2.5542 2.5548 2.7518 2.7521 5.1841 5.1859 5.3707 5.3750 6.4933 6.4956 6.8292 6.8309 8.2472 8.2523 8.3353 8.3359 8.9238 8.9255 9.1663 9.1722 14.9217 14.9223 15.0970 15.0981 16.2792 16.2812 16.9646 16.9651 17.5400 17.5403 k = 0.1346 0.3423 0.6311 ( 3288 PWs) bands (ev): -63.0854 -63.0854 -63.0806 -63.0806 -30.0618 -30.0587 -30.0451 -30.0425 -29.7953 -29.7942 -29.7750 -29.7698 -29.7407 -29.7399 -29.7246 -29.7241 -8.3665 -8.3662 -7.0889 -7.0887 -4.8965 -4.8960 -4.8104 -4.8100 -0.8189 -0.8189 0.9515 0.9521 2.5379 2.5384 2.7330 2.7333 5.2047 5.2066 5.3809 5.3852 6.5044 6.5067 6.8530 6.8548 8.2794 8.2846 8.3587 8.3594 8.9268 8.9285 9.1580 9.1641 14.9393 14.9399 15.0793 15.0804 16.2817 16.2838 16.9419 16.9426 17.5807 17.5808 k = 0.1410 0.3339 0.6416 ( 3284 PWs) bands (ev): -63.0853 -63.0853 -63.0807 -63.0807 -30.0615 -30.0583 -30.0455 -30.0428 -29.7950 -29.7940 -29.7752 -29.7699 -29.7406 -29.7399 -29.7247 -29.7242 -8.3360 -8.3358 -7.1105 -7.1104 -4.9131 -4.9127 -4.8175 -4.8170 -0.7808 -0.7807 0.8960 0.8966 2.5211 2.5216 2.7127 2.7130 5.2285 5.2305 5.3924 5.3968 6.5139 6.5163 6.8729 6.8750 8.3122 8.3176 8.3836 8.3845 8.9295 8.9311 9.1486 9.1548 14.9562 14.9569 15.0640 15.0652 16.2853 16.2875 16.9174 16.9182 17.6213 17.6214 k = 0.1474 0.3256 0.6522 ( 3282 PWs) bands (ev): -63.0852 -63.0852 -63.0808 -63.0808 -30.0613 -30.0579 -30.0459 -30.0432 -29.7948 -29.7938 -29.7755 -29.7700 -29.7406 -29.7398 -29.7247 -29.7242 -8.3045 -8.3042 -7.1338 -7.1337 -4.9283 -4.9279 -4.8250 -4.8245 -0.7417 -0.7416 0.8405 0.8412 2.5043 2.5047 2.6912 2.6915 5.2550 5.2571 5.4052 5.4096 6.5221 6.5246 6.8890 6.8913 8.3455 8.3509 8.4099 8.4110 8.9318 8.9333 9.1380 9.1443 14.9722 14.9729 15.0512 15.0523 16.2900 16.2924 16.8916 16.8926 17.6614 17.6616 k = 0.1538 0.3173 0.6627 ( 3282 PWs) bands (ev): -63.0851 -63.0851 -63.0810 -63.0810 -30.0610 -30.0575 -30.0464 -30.0436 -29.7945 -29.7936 -29.7758 -29.7700 -29.7405 -29.7398 -29.7248 -29.7243 -8.2718 -8.2715 -7.1588 -7.1587 -4.9420 -4.9416 -4.8328 -4.8323 -0.7015 -0.7015 0.7853 0.7859 2.4875 2.4880 2.6687 2.6689 5.2836 5.2858 5.4191 5.4234 6.5293 6.5318 6.9010 6.9035 8.3790 8.3844 8.4375 8.4387 8.9336 8.9350 9.1263 9.1327 14.9871 14.9878 15.0407 15.0418 16.2960 16.2985 16.8649 16.8661 17.6928 17.6935 k = 0.1603 0.3089 0.6732 ( 3286 PWs) bands (ev): -63.0849 -63.0849 -63.0811 -63.0811 -30.0608 -30.0571 -30.0468 -30.0440 -29.7943 -29.7934 -29.7761 -29.7701 -29.7404 -29.7398 -29.7248 -29.7244 -8.2381 -8.2378 -7.1854 -7.1854 -4.9541 -4.9537 -4.8409 -4.8405 -0.6604 -0.6604 0.7302 0.7309 2.4712 2.4716 2.6455 2.6457 5.3138 5.3162 5.4337 5.4380 6.5357 6.5382 6.9091 6.9118 8.4125 8.4181 8.4661 8.4674 8.9348 8.9361 9.1134 9.1199 15.0008 15.0015 15.0323 15.0334 16.3032 16.3058 16.8378 16.8390 17.6964 17.6971 k = 0.1667 0.3006 0.6837 ( 3282 PWs) bands (ev): -63.0848 -63.0848 -63.0812 -63.0812 -30.0605 -30.0567 -30.0473 -30.0445 -29.7941 -29.7932 -29.7764 -29.7702 -29.7403 -29.7398 -29.7249 -29.7245 -8.2034 -8.2031 -7.2137 -7.2137 -4.9645 -4.9642 -4.8494 -4.8489 -0.6184 -0.6184 0.6754 0.6760 2.4554 2.4558 2.6219 2.6221 5.3451 5.3476 5.4491 5.4533 6.5418 6.5443 6.9132 6.9160 8.4461 8.4517 8.4955 8.4969 8.9353 8.9365 9.0995 9.1060 15.0131 15.0139 15.0260 15.0271 16.3116 16.3144 16.8104 16.8118 17.7027 17.7032 k = 0.1731 0.2922 0.6942 ( 3284 PWs) bands (ev): -63.0847 -63.0847 -63.0813 -63.0813 -30.0602 -30.0563 -30.0477 -30.0449 -29.7938 -29.7931 -29.7767 -29.7703 -29.7402 -29.7397 -29.7249 -29.7246 -8.1677 -8.1675 -7.2436 -7.2436 -4.9733 -4.9730 -4.8581 -4.8577 -0.5756 -0.5756 0.6208 0.6214 2.4405 2.4408 2.5981 2.5983 5.3767 5.3794 5.4648 5.4691 6.5477 6.5502 6.9135 6.9165 8.4794 8.4851 8.5255 8.5270 8.9351 8.9361 9.0844 9.0910 15.0213 15.0218 15.0248 15.0250 16.3213 16.3241 16.7831 16.7846 17.7115 17.7120 k = 0.1795 0.2839 0.7048 ( 3280 PWs) bands (ev): -63.0845 -63.0845 -63.0814 -63.0814 -30.0599 -30.0558 -30.0481 -30.0453 -29.7936 -29.7929 -29.7770 -29.7704 -29.7401 -29.7397 -29.7249 -29.7246 -8.1312 -8.1309 -7.2751 -7.2750 -4.9803 -4.9801 -4.8671 -4.8667 -0.5320 -0.5319 0.5665 0.5671 2.4266 2.4270 2.5745 2.5746 5.4082 5.4110 5.4809 5.4851 6.5540 6.5565 6.9101 6.9132 8.5125 8.5181 8.5557 8.5573 8.9340 8.9349 9.0684 9.0750 15.0186 15.0195 15.0336 15.0342 16.3320 16.3349 16.7560 16.7575 17.7231 17.7235 k = 0.1859 0.2756 0.7153 ( 3284 PWs) bands (ev): -63.0844 -63.0844 -63.0816 -63.0816 -30.0596 -30.0554 -30.0486 -30.0458 -29.7934 -29.7928 -29.7773 -29.7705 -29.7401 -29.7397 -29.7250 -29.7247 -8.0939 -8.0936 -7.3079 -7.3079 -4.9858 -4.9856 -4.8763 -4.8759 -0.4876 -0.4875 0.5125 0.5131 2.4141 2.4144 2.5513 2.5514 5.4388 5.4418 5.4970 5.5011 6.5609 6.5634 6.9033 6.9065 8.5451 8.5508 8.5859 8.5875 8.9319 8.9327 9.0514 9.0581 15.0173 15.0183 15.0414 15.0420 16.3439 16.3468 16.7293 16.7309 17.7374 17.7377 k = 0.1923 0.2672 0.7258 ( 3286 PWs) bands (ev): -63.0843 -63.0843 -63.0817 -63.0817 -30.0594 -30.0550 -30.0490 -30.0463 -29.7931 -29.7927 -29.7775 -29.7706 -29.7400 -29.7397 -29.7250 -29.7248 -8.0557 -8.0555 -7.3422 -7.3421 -4.9896 -4.9895 -4.8856 -4.8852 -0.4425 -0.4423 0.4589 0.4594 2.4029 2.4032 2.5287 2.5289 5.4680 5.4712 5.5129 5.5169 6.5687 6.5713 6.8933 6.8965 8.5772 8.5829 8.6158 8.6175 8.9288 8.9294 9.0335 9.0402 15.0174 15.0183 15.0477 15.0482 16.3566 16.3596 16.7031 16.7048 17.7546 17.7549 k = 0.1987 0.2589 0.7363 ( 3290 PWs) bands (ev): -63.0841 -63.0841 -63.0819 -63.0819 -30.0591 -30.0545 -30.0494 -30.0467 -29.7930 -29.7925 -29.7778 -29.7706 -29.7399 -29.7397 -29.7250 -29.7249 -8.0170 -8.0167 -7.3776 -7.3775 -4.9919 -4.9918 -4.8951 -4.8946 -0.3966 -0.3965 0.4055 0.4060 2.3933 2.3936 2.5070 2.5072 5.4951 5.4987 5.5285 5.5323 6.5779 6.5804 6.8803 6.8836 8.6087 8.6145 8.6451 8.6468 8.9246 8.9249 9.0148 9.0214 15.0186 15.0194 15.0525 15.0530 16.3703 16.3732 16.6776 16.6794 17.7745 17.7748 k = 0.2051 0.2505 0.7468 ( 3294 PWs) bands (ev): -63.0840 -63.0840 -63.0820 -63.0820 -30.0588 -30.0541 -30.0498 -30.0472 -29.7928 -29.7924 -29.7780 -29.7707 -29.7399 -29.7397 -29.7250 -29.7249 -7.9775 -7.9773 -7.4142 -7.4141 -4.9927 -4.9927 -4.9045 -4.9041 -0.3502 -0.3500 0.3524 0.3529 2.3855 2.3858 2.4864 2.4866 5.5197 5.5236 5.5434 5.5469 6.5886 6.5912 6.8647 6.8680 8.6396 8.6454 8.6737 8.6754 8.9190 8.9192 8.9952 9.0018 15.0208 15.0215 15.0558 15.0563 16.3847 16.3876 16.6528 16.6547 17.7972 17.7975 k = 0.2115 0.2422 0.7573 ( 3298 PWs) bands (ev): -63.0839 -63.0839 -63.0821 -63.0821 -30.0586 -30.0537 -30.0501 -30.0477 -29.7926 -29.7923 -29.7782 -29.7708 -29.7398 -29.7397 -29.7251 -29.7250 -7.9376 -7.9373 -7.4518 -7.4517 -4.9921 -4.9921 -4.9139 -4.9136 -0.3031 -0.3029 0.2997 0.3002 2.3796 2.3798 2.4671 2.4673 5.5413 5.5457 5.5576 5.5607 6.6011 6.6037 6.8468 6.8501 8.6698 8.6756 8.7012 8.7029 8.9121 8.9122 8.9748 8.9814 15.0237 15.0244 15.0578 15.0582 16.3998 16.4027 16.6288 16.6308 17.8225 17.8229 k = 0.2179 0.2339 0.7679 ( 3306 PWs) bands (ev): -63.0837 -63.0837 -63.0823 -63.0823 -30.0584 -30.0532 -30.0505 -30.0482 -29.7925 -29.7923 -29.7784 -29.7709 -29.7398 -29.7397 -29.7251 -29.7250 -7.8972 -7.8969 -7.4903 -7.4901 -4.9903 -4.9902 -4.9233 -4.9229 -0.2554 -0.2552 0.2473 0.2478 2.3755 2.3758 2.4493 2.4494 5.5592 5.5646 5.5709 5.5732 6.6156 6.6182 6.8270 6.8302 8.6993 8.7050 8.7275 8.7292 8.9037 8.9037 8.9536 8.9602 15.0273 15.0279 15.0586 15.0589 16.4155 16.4183 16.6057 16.6077 17.8501 17.8506 k = 0.2244 0.2255 0.7784 ( 3304 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0582 -30.0528 -30.0507 -30.0487 -29.7923 -29.7922 -29.7786 -29.7709 -29.7397 -29.7397 -29.7251 -29.7251 -7.8564 -7.8562 -7.5296 -7.5294 -4.9872 -4.9872 -4.9324 -4.9320 -0.2072 -0.2069 0.1952 0.1957 2.3736 2.3738 2.4331 2.4332 5.5735 5.5799 5.5830 5.5842 6.6319 6.6345 6.8057 6.8089 8.7280 8.7337 8.7525 8.7541 8.8936 8.8939 8.9317 8.9383 15.0313 15.0318 15.0582 15.0584 16.4317 16.4345 16.5834 16.5855 17.8798 17.8803 k = 0.2308 0.2172 0.7889 ( 3300 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0580 -30.0523 -30.0510 -30.0491 -29.7922 -29.7921 -29.7787 -29.7709 -29.7397 -29.7396 -29.7251 -29.7251 -7.8154 -7.8151 -7.5694 -7.5693 -4.9831 -4.9830 -4.9412 -4.9409 -0.1584 -0.1581 0.1435 0.1440 2.3737 2.3739 2.4186 2.4187 5.5842 5.5916 5.5932 5.5935 6.6502 6.6528 6.7832 6.7864 8.7559 8.7616 8.7760 8.7776 8.8820 8.8824 8.9090 8.9157 15.0355 15.0360 15.0569 15.0570 16.4485 16.4513 16.5620 16.5642 17.9111 17.9117 k = 0.2372 0.2088 0.7994 ( 3298 PWs) bands (ev): -63.0833 -63.0833 -63.0827 -63.0827 -30.0578 -30.0518 -30.0511 -30.0496 -29.7921 -29.7921 -29.7788 -29.7710 -29.7397 -29.7396 -29.7251 -29.7251 -7.7742 -7.7740 -7.6099 -7.6096 -4.9780 -4.9778 -4.9497 -4.9494 -0.1092 -0.1089 0.0922 0.0926 2.3759 2.3761 2.4060 2.4062 5.5917 5.5995 5.6008 5.6008 6.6701 6.6727 6.7602 6.7633 8.7829 8.7885 8.7978 8.7995 8.8688 8.8692 8.8858 8.8925 15.0398 15.0402 15.0547 15.0547 16.4658 16.4685 16.5413 16.5436 17.9431 17.9439 k = 0.2436 0.2005 0.8099 ( 3292 PWs) bands (ev): -63.0831 -63.0831 -63.0829 -63.0829 -30.0577 -30.0514 -30.0512 -30.0499 -29.7921 -29.7921 -29.7788 -29.7710 -29.7396 -29.7396 -29.7251 -29.7251 -7.7329 -7.7327 -7.6506 -7.6504 -4.9719 -4.9718 -4.9577 -4.9574 -0.0595 -0.0591 0.0412 0.0416 2.3803 2.3805 2.3955 2.3956 5.5963 5.6041 5.6054 5.6054 6.6914 6.6940 6.7369 6.7400 8.8086 8.8137 8.8179 8.8198 8.8541 8.8545 8.8622 8.8691 15.0440 15.0443 15.0517 15.0518 16.4836 16.4863 16.5215 16.5238 17.9748 17.9758 k = 0.2500 0.1922 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0577 -30.0513 -30.0513 -30.0501 -29.7921 -29.7921 -29.7788 -29.7710 -29.7396 -29.7396 -29.7251 -29.7251 -7.6921 -7.6916 -7.6913 -7.6913 -4.9655 -4.9655 -4.9648 -4.9644 -0.0097 -0.0090 -0.0089 -0.0089 2.3862 2.3862 2.3875 2.3878 5.5978 5.6056 5.6069 5.6069 6.7138 6.7138 6.7138 6.7196 8.8267 8.8323 8.8332 8.8332 8.8426 8.8426 8.8427 8.8515 15.0473 15.0473 15.0488 15.0492 16.5001 16.5044 16.5044 16.5052 18.0041 18.0043 k = 0.2500 0.1922 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0577 -30.0513 -30.0513 -30.0501 -29.7921 -29.7921 -29.7788 -29.7710 -29.7396 -29.7396 -29.7251 -29.7251 -7.6921 -7.6916 -7.6913 -7.6913 -4.9655 -4.9655 -4.9648 -4.9644 -0.0097 -0.0090 -0.0089 -0.0089 2.3862 2.3862 2.3875 2.3878 5.5978 5.6056 5.6069 5.6069 6.7138 6.7138 6.7138 6.7196 8.8267 8.8323 8.8332 8.8332 8.8426 8.8426 8.8427 8.8515 15.0473 15.0473 15.0488 15.0492 16.5001 16.5044 16.5044 16.5052 18.0041 18.0043 k = 0.2593 0.1993 0.8115 ( 3292 PWs) bands (ev): -63.0831 -63.0831 -63.0829 -63.0829 -30.0577 -30.0514 -30.0511 -30.0501 -29.7921 -29.7919 -29.7788 -29.7710 -29.7396 -29.7396 -29.7251 -29.7251 -7.7158 -7.7156 -7.6677 -7.6675 -4.9694 -4.9692 -4.9606 -4.9603 -0.0401 -0.0398 0.0204 0.0207 2.3848 2.3850 2.3928 2.3930 5.5942 5.6008 5.6042 5.6052 6.6998 6.7023 6.7308 6.7339 8.8174 8.8191 8.8249 8.8258 8.8507 8.8522 8.8539 8.8608 15.0454 15.0454 15.0502 15.0504 16.4918 16.4944 16.5137 16.5157 17.9847 17.9855 k = 0.2685 0.2064 0.8025 ( 3294 PWs) bands (ev): -63.0832 -63.0832 -63.0828 -63.0828 -30.0577 -30.0517 -30.0510 -30.0499 -29.7922 -29.7918 -29.7789 -29.7711 -29.7396 -29.7395 -29.7252 -29.7251 -7.7384 -7.7382 -7.6454 -7.6452 -4.9734 -4.9732 -4.9556 -4.9553 -0.0715 -0.0712 0.0486 0.0489 2.3879 2.3881 2.4014 2.4016 5.5806 5.5853 5.5993 5.6018 6.6853 6.6879 6.7533 6.7562 8.8024 8.8024 8.8126 8.8141 8.8639 8.8661 8.8685 8.8749 15.0422 15.0422 15.0517 15.0517 16.4836 16.4859 16.5241 16.5260 17.9603 17.9606 k = 0.2778 0.2135 0.7935 ( 3292 PWs) bands (ev): -63.0832 -63.0832 -63.0828 -63.0828 -30.0577 -30.0520 -30.0509 -30.0498 -29.7923 -29.7917 -29.7789 -29.7712 -29.7395 -29.7394 -29.7253 -29.7251 -7.7594 -7.7592 -7.6249 -7.6247 -4.9771 -4.9769 -4.9502 -4.9499 -0.1028 -0.1026 0.0752 0.0755 2.3956 2.3958 2.4129 2.4131 5.5573 5.5612 5.5930 5.5961 6.6709 6.6733 6.7795 6.7823 8.7863 8.7868 8.8002 8.8019 8.8779 8.8803 8.8833 8.8894 15.0386 15.0386 15.0525 15.0528 16.4768 16.4789 16.5339 16.5355 17.9331 17.9332 k = 0.2870 0.2206 0.7846 ( 3295 PWs) bands (ev): -63.0833 -63.0833 -63.0827 -63.0827 -30.0577 -30.0523 -30.0507 -30.0496 -29.7923 -29.7916 -29.7790 -29.7713 -29.7394 -29.7393 -29.7253 -29.7252 -7.7789 -7.7787 -7.6062 -7.6061 -4.9806 -4.9804 -4.9446 -4.9442 -0.1337 -0.1336 0.1000 0.1003 2.4077 2.4079 2.4272 2.4274 5.5264 5.5298 5.5844 5.5876 6.6567 6.6590 6.8077 6.8104 8.7709 8.7716 8.7877 8.7895 8.8921 8.8947 8.8978 8.9038 15.0347 15.0348 15.0530 15.0534 16.4711 16.4729 16.5428 16.5442 17.9050 17.9053 k = 0.2963 0.2277 0.7756 ( 3295 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0578 -30.0525 -30.0505 -30.0495 -29.7923 -29.7914 -29.7791 -29.7715 -29.7393 -29.7391 -29.7254 -29.7252 -7.7968 -7.7966 -7.5895 -7.5894 -4.9838 -4.9836 -4.9388 -4.9385 -0.1635 -0.1635 0.1231 0.1233 2.4236 2.4239 2.4443 2.4445 5.4897 5.4928 5.5730 5.5762 6.6431 6.6452 6.8363 6.8390 8.7564 8.7571 8.7750 8.7768 8.9067 8.9092 8.9122 8.9180 15.0310 15.0311 15.0531 15.0536 16.4660 16.4677 16.5508 16.5520 17.8775 17.8780 k = 0.3056 0.2349 0.7666 ( 3297 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0578 -30.0528 -30.0504 -30.0493 -29.7923 -29.7913 -29.7792 -29.7718 -29.7391 -29.7390 -29.7255 -29.7253 -7.8131 -7.8129 -7.5748 -7.5746 -4.9866 -4.9865 -4.9331 -4.9327 -0.1918 -0.1918 0.1442 0.1444 2.4431 2.4434 2.4640 2.4643 5.4486 5.4514 5.5587 5.5618 6.6303 6.6323 6.8640 6.8665 8.7429 8.7434 8.7623 8.7640 8.9214 8.9238 8.9265 8.9321 15.0277 15.0277 15.0529 15.0536 16.4611 16.4626 16.5578 16.5588 17.8517 17.8524 k = 0.3148 0.2420 0.7576 ( 3291 PWs) bands (ev): -63.0835 -63.0835 -63.0825 -63.0825 -30.0578 -30.0530 -30.0502 -30.0492 -29.7923 -29.7911 -29.7793 -29.7720 -29.7390 -29.7387 -29.7257 -29.7253 -7.8278 -7.8276 -7.5620 -7.5619 -4.9892 -4.9891 -4.9275 -4.9271 -0.2181 -0.2180 0.1633 0.1636 2.4656 2.4659 2.4864 2.4867 5.4043 5.4069 5.5414 5.5443 6.6187 6.6204 6.8894 6.8919 8.7303 8.7307 8.7494 8.7511 8.9363 8.9380 8.9412 8.9460 15.0250 15.0251 15.0526 15.0533 16.4560 16.4573 16.5639 16.5647 17.8282 17.8290 k = 0.3241 0.2491 0.7486 ( 3287 PWs) bands (ev): -63.0835 -63.0835 -63.0825 -63.0825 -30.0577 -30.0532 -30.0501 -30.0491 -29.7922 -29.7909 -29.7795 -29.7723 -29.7388 -29.7385 -29.7258 -29.7254 -7.8408 -7.8406 -7.5513 -7.5513 -4.9913 -4.9912 -4.9223 -4.9218 -0.2417 -0.2416 0.1805 0.1807 2.4907 2.4911 2.5111 2.5114 5.3578 5.3602 5.5210 5.5237 6.6082 6.6097 6.9118 6.9143 8.7185 8.7188 8.7365 8.7381 8.9510 8.9515 8.9566 8.9599 15.0234 15.0234 15.0520 15.0529 16.4502 16.4513 16.5689 16.5696 17.8073 17.8082 k = 0.3333 0.2562 0.7397 ( 3289 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0577 -30.0534 -30.0499 -30.0490 -29.7922 -29.7907 -29.7796 -29.7726 -29.7386 -29.7382 -29.7259 -29.7255 -7.8522 -7.8520 -7.5427 -7.5427 -4.9930 -4.9930 -4.9174 -4.9169 -0.2623 -0.2621 0.1955 0.1958 2.5181 2.5184 2.5381 2.5384 5.3100 5.3122 5.4978 5.5003 6.5989 6.6002 6.9303 6.9328 8.7076 8.7077 8.7236 8.7250 8.9643 8.9653 8.9724 8.9741 15.0229 15.0230 15.0513 15.0523 16.4433 16.4443 16.5728 16.5734 17.7894 17.7905 k = 0.3426 0.2633 0.7307 ( 3289 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0577 -30.0536 -30.0498 -30.0489 -29.7921 -29.7906 -29.7798 -29.7730 -29.7383 -29.7379 -29.7261 -29.7256 -7.8618 -7.8617 -7.5363 -7.5362 -4.9944 -4.9943 -4.9130 -4.9125 -0.2794 -0.2792 0.2085 0.2088 2.5472 2.5475 2.5670 2.5674 5.2616 5.2638 5.4718 5.4741 6.5910 6.5920 6.9446 6.9471 8.6972 8.6975 8.7108 8.7119 8.9766 8.9787 8.9884 8.9889 15.0239 15.0240 15.0507 15.0517 16.4352 16.4359 16.5757 16.5762 17.7747 17.7759 k = 0.3519 0.2704 0.7217 ( 3289 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0576 -30.0538 -30.0497 -30.0489 -29.7920 -29.7904 -29.7799 -29.7733 -29.7381 -29.7376 -29.7262 -29.7257 -7.8698 -7.8696 -7.5319 -7.5319 -4.9953 -4.9953 -4.9093 -4.9088 -0.2927 -0.2924 0.2194 0.2197 2.5776 2.5780 2.5976 2.5979 5.2136 5.2156 5.4433 5.4454 6.5843 6.5851 6.9543 6.9568 8.6872 8.6879 8.6982 8.6989 8.9883 8.9912 9.0041 9.0044 15.0265 15.0266 15.0500 15.0512 16.4255 16.4261 16.5775 16.5779 17.7633 17.7645 k = 0.3611 0.2776 0.7127 ( 3289 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0575 -30.0539 -30.0496 -30.0489 -29.7920 -29.7902 -29.7801 -29.7737 -29.7379 -29.7373 -29.7264 -29.7258 -7.8761 -7.8759 -7.5298 -7.5298 -4.9957 -4.9957 -4.9064 -4.9058 -0.3017 -0.3014 0.2283 0.2285 2.6090 2.6094 2.6295 2.6298 5.1664 5.1683 5.4127 5.4145 6.5788 6.5792 6.9593 6.9617 8.6772 8.6787 8.6861 8.6862 8.9996 9.0028 9.0195 9.0202 15.0308 15.0310 15.0495 15.0508 16.4141 16.4146 16.5781 16.5784 17.7552 17.7565 k = 0.3704 0.2847 0.7038 ( 3291 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0574 -30.0541 -30.0496 -30.0488 -29.7919 -29.7901 -29.7802 -29.7741 -29.7376 -29.7370 -29.7265 -29.7259 -7.8806 -7.8805 -7.5298 -7.5298 -4.9957 -4.9957 -4.9042 -4.9036 -0.3064 -0.3060 0.2351 0.2354 2.6410 2.6413 2.6622 2.6626 5.1207 5.1226 5.3803 5.3818 6.5743 6.5745 6.9594 6.9619 8.6665 8.6691 8.6741 8.6753 9.0103 9.0137 9.0345 9.0356 15.0369 15.0372 15.0492 15.0505 16.4012 16.4014 16.5776 16.5778 17.7506 17.7520 k = 0.3796 0.2918 0.6948 ( 3291 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0573 -30.0542 -30.0495 -30.0488 -29.7917 -29.7899 -29.7803 -29.7745 -29.7374 -29.7367 -29.7267 -29.7260 -7.8834 -7.8833 -7.5320 -7.5320 -4.9952 -4.9952 -4.9029 -4.9023 -0.3063 -0.3059 0.2399 0.2402 2.6731 2.6734 2.6955 2.6959 5.0772 5.0790 5.3465 5.3478 6.5707 6.5707 6.9549 6.9574 8.6549 8.6579 8.6642 8.6657 9.0205 9.0240 9.0490 9.0503 15.0448 15.0448 15.0494 15.0504 16.3867 16.3868 16.5758 16.5759 17.7493 17.7507 k = 0.3889 0.2989 0.6858 ( 3289 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0572 -30.0543 -30.0494 -30.0489 -29.7916 -29.7898 -29.7804 -29.7750 -29.7372 -29.7365 -29.7268 -29.7261 -7.8845 -7.8843 -7.5364 -7.5364 -4.9942 -4.9941 -4.9024 -4.9019 -0.3013 -0.3009 0.2427 0.2430 2.7049 2.7052 2.7287 2.7292 5.0365 5.0382 5.3116 5.3127 6.5677 6.5680 6.9458 6.9483 8.6428 8.6456 8.6555 8.6569 9.0302 9.0338 9.0625 9.0641 15.0488 15.0506 15.0543 15.0551 16.3710 16.3711 16.5726 16.5728 17.7514 17.7529 k = 0.3981 0.3060 0.6768 ( 3291 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0571 -30.0544 -30.0494 -30.0489 -29.7915 -29.7897 -29.7805 -29.7754 -29.7370 -29.7362 -29.7270 -29.7262 -7.8838 -7.8837 -7.5430 -7.5429 -4.9927 -4.9926 -4.9029 -4.9023 -0.2914 -0.2910 0.2435 0.2438 2.7362 2.7364 2.7615 2.7619 4.9991 5.0007 5.2761 5.2770 6.5654 6.5659 6.9323 6.9347 8.6304 8.6330 8.6472 8.6484 9.0393 9.0430 9.0750 9.0767 15.0495 15.0511 15.0650 15.0658 16.3545 16.3547 16.5679 16.5681 17.7567 17.7582 k = 0.4074 0.3131 0.6679 ( 3296 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0569 -30.0544 -30.0494 -30.0490 -29.7914 -29.7896 -29.7805 -29.7758 -29.7368 -29.7360 -29.7271 -29.7264 -7.8814 -7.8812 -7.5518 -7.5518 -4.9907 -4.9905 -4.9041 -4.9036 -0.2765 -0.2760 0.2423 0.2427 2.7665 2.7666 2.7932 2.7937 4.9657 4.9672 5.2404 5.2410 6.5637 6.5644 6.9146 6.9171 8.6179 8.6204 8.6387 8.6399 9.0481 9.0518 9.0861 9.0880 15.0504 15.0520 15.0767 15.0775 16.3378 16.3381 16.5616 16.5618 17.7653 17.7669 k = 0.4167 0.3203 0.6589 ( 3299 PWs) bands (ev): -63.0836 -63.0836 -63.0824 -63.0824 -30.0567 -30.0545 -30.0494 -30.0491 -29.7912 -29.7896 -29.7805 -29.7762 -29.7366 -29.7358 -29.7272 -29.7265 -7.8771 -7.8770 -7.5628 -7.5628 -4.9881 -4.9879 -4.9062 -4.9056 -0.2566 -0.2561 0.2393 0.2396 2.7955 2.7956 2.8234 2.8239 4.9367 4.9383 5.2049 5.2053 6.5624 6.5634 6.8930 6.8954 8.6055 8.6079 8.6299 8.6310 9.0564 9.0601 9.0958 9.0978 15.0516 15.0533 15.0888 15.0897 16.3218 16.3221 16.5535 16.5537 17.7770 17.7786 k = 0.4259 0.3274 0.6499 ( 3299 PWs) bands (ev): -63.0835 -63.0835 -63.0825 -63.0825 -30.0565 -30.0545 -30.0494 -30.0491 -29.7911 -29.7896 -29.7805 -29.7766 -29.7364 -29.7356 -29.7273 -29.7265 -7.8712 -7.8710 -7.5760 -7.5760 -4.9850 -4.9848 -4.9089 -4.9083 -0.2316 -0.2311 0.2344 0.2347 2.8229 2.8229 2.8514 2.8519 4.9128 4.9143 5.1699 5.1701 6.5616 6.5627 6.8678 6.8702 8.5932 8.5954 8.6205 8.6217 9.0644 9.0681 9.1039 9.1060 15.0534 15.0551 15.1007 15.1016 16.3073 16.3077 16.5435 16.5437 17.7917 17.7934 k = 0.4352 0.3345 0.6409 ( 3300 PWs) bands (ev): -63.0835 -63.0835 -63.0825 -63.0825 -30.0563 -30.0546 -30.0494 -30.0492 -29.7910 -29.7896 -29.7804 -29.7769 -29.7363 -29.7355 -29.7273 -29.7266 -7.8634 -7.8633 -7.5915 -7.5914 -4.9813 -4.9811 -4.9122 -4.9117 -0.2018 -0.2013 0.2275 0.2279 2.8484 2.8484 2.8769 2.8774 4.8944 4.8959 5.1357 5.1358 6.5611 6.5624 6.8392 6.8415 8.5809 8.5830 8.6103 8.6115 9.0721 9.0757 9.1105 9.1127 15.0556 15.0573 15.1114 15.1125 16.2953 16.2958 16.5313 16.5316 17.8094 17.8110 k = 0.4444 0.3416 0.6320 ( 3300 PWs) bands (ev): -63.0835 -63.0835 -63.0826 -63.0826 -30.0561 -30.0546 -30.0495 -30.0493 -29.7909 -29.7897 -29.7802 -29.7773 -29.7361 -29.7355 -29.7273 -29.7267 -7.8538 -7.8537 -7.6091 -7.6090 -4.9771 -4.9769 -4.9160 -4.9155 -0.1672 -0.1667 0.2189 0.2192 2.8717 2.8718 2.8994 2.8999 4.8820 4.8835 5.1026 5.1029 6.5608 6.5623 6.8074 6.8097 8.5686 8.5707 8.5991 8.6004 9.0796 9.0832 9.1155 9.1179 15.0583 15.0600 15.1202 15.1213 16.2871 16.2876 16.5167 16.5170 17.8298 17.8315 k = 0.4537 0.3487 0.6230 ( 3299 PWs) bands (ev): -63.0834 -63.0834 -63.0826 -63.0826 -30.0559 -30.0546 -30.0495 -30.0494 -29.7908 -29.7898 -29.7800 -29.7776 -29.7360 -29.7354 -29.7272 -29.7267 -7.8425 -7.8424 -7.6288 -7.6287 -4.9724 -4.9721 -4.9201 -4.9196 -0.1280 -0.1275 0.2083 0.2087 2.8926 2.8928 2.9184 2.9190 4.8758 4.8773 5.0710 5.0715 6.5609 6.5625 6.7728 6.7750 8.5563 8.5583 8.5867 8.5879 9.0870 9.0904 9.1192 9.1217 15.0616 15.0633 15.1260 15.1273 16.2836 16.2842 16.4994 16.4998 17.8528 17.8545 k = 0.4630 0.3558 0.6140 ( 3309 PWs) bands (ev): -63.0833 -63.0833 -63.0827 -63.0827 -30.0557 -30.0547 -30.0496 -30.0495 -29.7907 -29.7899 -29.7798 -29.7779 -29.7360 -29.7355 -29.7272 -29.7267 -7.8293 -7.8292 -7.6507 -7.6506 -4.9671 -4.9668 -4.9244 -4.9240 -0.0845 -0.0840 0.1959 0.1963 2.9110 2.9112 2.9338 2.9343 4.8761 4.8776 5.0410 5.0417 6.5611 6.5629 6.7354 6.7376 8.5440 8.5459 8.5726 8.5740 9.0942 9.0975 9.1217 9.1243 15.0655 15.0672 15.1280 15.1294 16.2861 16.2866 16.4794 16.4798 17.8783 17.8800 k = 0.4722 0.3630 0.6050 ( 3301 PWs) bands (ev): -63.0833 -63.0833 -63.0828 -63.0828 -30.0555 -30.0547 -30.0496 -30.0495 -29.7907 -29.7901 -29.7796 -29.7781 -29.7359 -29.7355 -29.7271 -29.7267 -7.8144 -7.8143 -7.6747 -7.6746 -4.9612 -4.9609 -4.9288 -4.9283 -0.0369 -0.0364 0.1816 0.1820 2.9267 2.9271 2.9454 2.9459 4.8830 4.8844 5.0130 5.0139 6.5617 6.5635 6.6958 6.6979 8.5317 8.5335 8.5569 8.5583 9.1014 9.1046 9.1233 9.1259 15.0699 15.0716 15.1255 15.1269 16.2953 16.2959 16.4563 16.4567 17.9059 17.9076 k = 0.4815 0.3701 0.5960 ( 3302 PWs) bands (ev): -63.0832 -63.0832 -63.0828 -63.0828 -30.0552 -30.0547 -30.0496 -30.0496 -29.7906 -29.7903 -29.7793 -29.7783 -29.7359 -29.7356 -29.7269 -29.7267 -7.7977 -7.7976 -7.7007 -7.7006 -4.9549 -4.9545 -4.9330 -4.9326 0.0145 0.0150 0.1654 0.1659 2.9397 2.9401 2.9531 2.9537 4.8964 4.8978 4.9870 4.9881 6.5624 6.5643 6.6539 6.6560 8.5193 8.5210 8.5392 8.5406 9.1086 9.1116 9.1243 9.1269 15.0750 15.0767 15.1179 15.1194 16.3118 16.3124 16.4300 16.4305 17.9355 17.9372 k = 0.4907 0.3772 0.5871 ( 3306 PWs) bands (ev): -63.0831 -63.0831 -63.0829 -63.0829 -30.0550 -30.0548 -30.0496 -30.0496 -29.7906 -29.7905 -29.7790 -29.7785 -29.7359 -29.7358 -29.7268 -29.7267 -7.7791 -7.7790 -7.7288 -7.7287 -4.9480 -4.9476 -4.9370 -4.9366 0.0693 0.0698 0.1473 0.1478 2.9500 2.9505 2.9572 2.9577 4.9160 4.9173 4.9633 4.9645 6.5634 6.5654 6.6101 6.6122 8.5065 8.5080 8.5196 8.5209 9.1157 9.1181 9.1255 9.1276 15.0807 15.0823 15.1051 15.1066 16.3358 16.3364 16.4004 16.4009 17.9666 17.9683 k = 0.5000 0.3843 0.5781 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0549 -30.0549 -30.0497 -30.0497 -29.7907 -29.7907 -29.7787 -29.7787 -29.7360 -29.7360 -29.7266 -29.7266 -7.7590 -7.7590 -7.7586 -7.7586 -4.9407 -4.9407 -4.9400 -4.9400 0.1271 0.1271 0.1280 0.1280 2.9573 2.9573 2.9585 2.9585 4.9400 4.9400 4.9448 4.9448 6.5642 6.5642 6.5671 6.5671 8.4922 8.4922 8.5002 8.5002 9.1223 9.1223 9.1289 9.1289 15.0866 15.0866 15.0893 15.0893 16.3651 16.3651 16.3699 16.3699 17.9973 17.9973 k = 0.5000 0.3843 0.5781 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0549 -30.0549 -30.0497 -30.0497 -29.7907 -29.7907 -29.7787 -29.7787 -29.7360 -29.7360 -29.7266 -29.7266 -7.7590 -7.7590 -7.7586 -7.7586 -4.9407 -4.9407 -4.9400 -4.9400 0.1271 0.1271 0.1280 0.1280 2.9573 2.9573 2.9585 2.9585 4.9400 4.9400 4.9448 4.9448 6.5642 6.5642 6.5671 6.5671 8.4922 8.4922 8.5002 8.5002 9.1223 9.1223 9.1289 9.1289 15.0866 15.0866 15.0893 15.0893 16.3651 16.3651 16.3699 16.3699 17.9973 17.9973 k = 0.5000 0.3843 0.5633 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0548 -30.0548 -30.0496 -30.0496 -29.7909 -29.7909 -29.7785 -29.7785 -29.7362 -29.7362 -29.7265 -29.7265 -7.7673 -7.7673 -7.7669 -7.7669 -4.9366 -4.9366 -4.9360 -4.9360 0.1591 0.1591 0.1599 0.1599 2.9617 2.9617 2.9630 2.9630 4.9467 4.9467 4.9516 4.9516 6.5273 6.5273 6.5302 6.5302 8.4615 8.4615 8.4695 8.4695 9.1288 9.1288 9.1354 9.1354 15.0727 15.0727 15.0754 15.0754 16.3673 16.3673 16.3719 16.3719 18.0030 18.0030 k = 0.5000 0.3843 0.5485 ( 3324 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0548 -30.0548 -30.0496 -30.0496 -29.7911 -29.7911 -29.7783 -29.7783 -29.7363 -29.7363 -29.7263 -29.7263 -7.7761 -7.7761 -7.7757 -7.7757 -4.9318 -4.9318 -4.9311 -4.9311 0.1912 0.1912 0.1919 0.1919 2.9664 2.9664 2.9677 2.9677 4.9536 4.9536 4.9586 4.9586 6.4913 6.4913 6.4942 6.4942 8.4294 8.4294 8.4374 8.4374 9.1352 9.1352 9.1418 9.1418 15.0537 15.0537 15.0563 15.0563 16.3732 16.3732 16.3777 16.3777 18.0070 18.0070 k = 0.5000 0.3843 0.5336 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0547 -30.0547 -30.0496 -30.0496 -29.7913 -29.7913 -29.7782 -29.7782 -29.7365 -29.7365 -29.7261 -29.7261 -7.7854 -7.7854 -7.7850 -7.7850 -4.9260 -4.9260 -4.9253 -4.9253 0.2232 0.2232 0.2239 0.2239 2.9714 2.9714 2.9728 2.9728 4.9607 4.9607 4.9656 4.9656 6.4563 6.4563 6.4592 6.4592 8.3960 8.3960 8.4039 8.4039 9.1417 9.1417 9.1482 9.1482 15.0296 15.0296 15.0322 15.0322 16.3822 16.3822 16.3866 16.3866 18.0091 18.0091 k = 0.5000 0.3843 0.5188 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0546 -30.0546 -30.0496 -30.0496 -29.7915 -29.7915 -29.7780 -29.7780 -29.7366 -29.7366 -29.7259 -29.7259 -7.7951 -7.7951 -7.7947 -7.7947 -4.9193 -4.9193 -4.9186 -4.9186 0.2549 0.2549 0.2555 0.2555 2.9767 2.9767 2.9782 2.9782 4.9678 4.9678 4.9728 4.9728 6.4227 6.4227 6.4256 6.4256 8.3612 8.3612 8.3691 8.3691 9.1483 9.1483 9.1546 9.1546 15.0011 15.0011 15.0036 15.0036 16.3935 16.3935 16.3978 16.3978 18.0088 18.0088 k = 0.5000 0.3843 0.5040 ( 3308 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0545 -30.0545 -30.0495 -30.0495 -29.7916 -29.7916 -29.7779 -29.7779 -29.7366 -29.7366 -29.7258 -29.7258 -7.8053 -7.8053 -7.8049 -7.8049 -4.9116 -4.9116 -4.9109 -4.9109 0.2859 0.2859 0.2865 0.2865 2.9824 2.9824 2.9840 2.9840 4.9750 4.9750 4.9800 4.9800 6.3907 6.3907 6.3936 6.3936 8.3252 8.3252 8.3330 8.3330 9.1549 9.1549 9.1611 9.1611 14.9686 14.9686 14.9710 14.9710 16.4059 16.4059 16.4101 16.4101 18.0058 18.0058 k = 0.5000 0.3843 0.4892 ( 3312 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0544 -30.0544 -30.0495 -30.0495 -29.7918 -29.7918 -29.7778 -29.7778 -29.7367 -29.7367 -29.7256 -29.7256 -7.8159 -7.8159 -7.8155 -7.8155 -4.9030 -4.9030 -4.9023 -4.9023 0.3161 0.3161 0.3167 0.3167 2.9885 2.9885 2.9902 2.9902 4.9822 4.9822 4.9873 4.9873 6.3606 6.3606 6.3633 6.3633 8.2879 8.2879 8.2957 8.2957 9.1615 9.1615 9.1676 9.1676 14.9327 14.9327 14.9350 14.9350 16.4184 16.4184 16.4226 16.4226 17.9996 17.9996 k = 0.5000 0.3843 0.4743 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0544 -30.0544 -30.0495 -30.0495 -29.7919 -29.7919 -29.7778 -29.7778 -29.7368 -29.7368 -29.7255 -29.7255 -7.8269 -7.8269 -7.8265 -7.8265 -4.8933 -4.8933 -4.8926 -4.8926 0.3452 0.3452 0.3457 0.3457 2.9950 2.9950 2.9969 2.9969 4.9896 4.9896 4.9947 4.9947 6.3325 6.3325 6.3352 6.3352 8.2495 8.2495 8.2571 8.2571 9.1683 9.1683 9.1742 9.1742 14.8942 14.8942 14.8963 14.8963 16.4298 16.4298 16.4339 16.4339 17.9899 17.9899 k = 0.5000 0.3843 0.4595 ( 3318 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0543 -30.0543 -30.0495 -30.0495 -29.7920 -29.7920 -29.7778 -29.7778 -29.7368 -29.7368 -29.7254 -29.7254 -7.8383 -7.8383 -7.8379 -7.8379 -4.8827 -4.8827 -4.8820 -4.8820 0.3730 0.3730 0.3734 0.3734 3.0021 3.0021 3.0040 3.0040 4.9970 4.9970 5.0021 5.0021 6.3066 6.3066 6.3091 6.3091 8.2099 8.2099 8.2174 8.2174 9.1753 9.1753 9.1810 9.1810 14.8535 14.8535 14.8555 14.8555 16.4391 16.4391 16.4431 16.4431 17.9763 17.9763 k = 0.5000 0.3843 0.4447 ( 3326 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0542 -30.0542 -30.0495 -30.0495 -29.7921 -29.7921 -29.7778 -29.7778 -29.7368 -29.7368 -29.7254 -29.7254 -7.8500 -7.8500 -7.8496 -7.8496 -4.8711 -4.8711 -4.8704 -4.8704 0.3991 0.3991 0.3995 0.3995 3.0097 3.0097 3.0117 3.0117 5.0046 5.0046 5.0097 5.0097 6.2830 6.2830 6.2854 6.2854 8.1692 8.1692 8.1766 8.1766 9.1824 9.1824 9.1880 9.1880 14.8114 14.8114 14.8133 14.8133 16.4450 16.4450 16.4489 16.4489 17.9583 17.9583 k = 0.5000 0.3843 0.4299 ( 3328 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0541 -30.0541 -30.0495 -30.0495 -29.7922 -29.7922 -29.7779 -29.7779 -29.7368 -29.7368 -29.7253 -29.7253 -7.8619 -7.8619 -7.8615 -7.8615 -4.8586 -4.8586 -4.8578 -4.8578 0.4236 0.4236 0.4238 0.4238 3.0180 3.0180 3.0200 3.0200 5.0123 5.0123 5.0174 5.0174 6.2620 6.2620 6.2642 6.2642 8.1274 8.1274 8.1347 8.1347 9.1898 9.1898 9.1952 9.1952 14.7684 14.7684 14.7702 14.7702 16.4468 16.4468 16.4506 16.4506 17.9357 17.9357 k = 0.5000 0.3843 0.4150 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0540 -30.0540 -30.0494 -30.0494 -29.7922 -29.7922 -29.7779 -29.7779 -29.7367 -29.7367 -29.7252 -29.7252 -7.8741 -7.8741 -7.8737 -7.8737 -4.8451 -4.8451 -4.8443 -4.8443 0.4460 0.4460 0.4462 0.4462 3.0269 3.0269 3.0291 3.0291 5.0202 5.0202 5.0252 5.0252 6.2435 6.2435 6.2455 6.2455 8.0846 8.0846 8.0918 8.0918 9.1975 9.1975 9.2026 9.2026 14.7251 14.7251 14.7268 14.7268 16.4436 16.4436 16.4474 16.4474 17.9085 17.9085 k = 0.5000 0.3843 0.4002 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0539 -30.0539 -30.0494 -30.0494 -29.7922 -29.7922 -29.7780 -29.7780 -29.7366 -29.7366 -29.7252 -29.7252 -7.8865 -7.8865 -7.8861 -7.8861 -4.8307 -4.8307 -4.8300 -4.8300 0.4663 0.4663 0.4665 0.4665 3.0365 3.0365 3.0387 3.0387 5.0283 5.0283 5.0333 5.0333 6.2275 6.2275 6.2293 6.2293 8.0408 8.0408 8.0480 8.0480 9.2054 9.2054 9.2104 9.2104 14.6819 14.6819 14.6836 14.6836 16.4348 16.4348 16.4386 16.4386 17.8768 17.8768 k = 0.5000 0.3843 0.3854 ( 3318 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0538 -30.0538 -30.0494 -30.0494 -29.7923 -29.7923 -29.7781 -29.7781 -29.7365 -29.7365 -29.7251 -29.7251 -7.8989 -7.8989 -7.8986 -7.8986 -4.8156 -4.8156 -4.8148 -4.8148 0.4843 0.4843 0.4845 0.4845 3.0468 3.0468 3.0492 3.0492 5.0367 5.0367 5.0416 5.0416 6.2142 6.2142 6.2157 6.2157 7.9962 7.9962 8.0032 8.0032 9.2136 9.2136 9.2183 9.2183 14.6393 14.6393 14.6410 14.6410 16.4201 16.4201 16.4238 16.4238 17.8410 17.8410 k = 0.5000 0.3843 0.3706 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0537 -30.0537 -30.0494 -30.0494 -29.7923 -29.7923 -29.7783 -29.7783 -29.7364 -29.7364 -29.7251 -29.7251 -7.9115 -7.9115 -7.9111 -7.9111 -4.7996 -4.7996 -4.7988 -4.7988 0.5000 0.5000 0.5002 0.5002 3.0580 3.0580 3.0603 3.0603 5.0454 5.0454 5.0501 5.0501 6.2034 6.2034 6.2048 6.2048 7.9506 7.9506 7.9575 7.9575 9.2220 9.2220 9.2266 9.2266 14.5978 14.5978 14.5993 14.5993 16.3993 16.3993 16.4030 16.4030 17.8017 17.8017 k = 0.5000 0.3843 0.3558 ( 3324 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0536 -30.0536 -30.0494 -30.0494 -29.7923 -29.7923 -29.7784 -29.7784 -29.7362 -29.7362 -29.7251 -29.7251 -7.9241 -7.9241 -7.9238 -7.9238 -4.7830 -4.7830 -4.7822 -4.7822 0.5132 0.5132 0.5134 0.5134 3.0698 3.0698 3.0723 3.0723 5.0544 5.0544 5.0590 5.0590 6.1953 6.1953 6.1964 6.1964 7.9042 7.9042 7.9110 7.9110 9.2307 9.2307 9.2350 9.2350 14.5576 14.5576 14.5591 14.5591 16.3724 16.3724 16.3760 16.3760 17.7596 17.7596 k = 0.5000 0.3843 0.3409 ( 3318 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0534 -30.0534 -30.0494 -30.0494 -29.7922 -29.7922 -29.7786 -29.7786 -29.7361 -29.7361 -29.7251 -29.7251 -7.9367 -7.9367 -7.9363 -7.9363 -4.7658 -4.7658 -4.7650 -4.7650 0.5239 0.5239 0.5242 0.5242 3.0825 3.0825 3.0850 3.0850 5.0638 5.0638 5.0682 5.0682 6.1898 6.1898 6.1907 6.1907 7.8570 7.8570 7.8637 7.8637 9.2397 9.2397 9.2438 9.2438 14.5191 14.5191 14.5206 14.5206 16.3396 16.3396 16.3432 16.3432 17.7152 17.7152 k = 0.5000 0.3843 0.3261 ( 3310 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0533 -30.0533 -30.0494 -30.0494 -29.7921 -29.7921 -29.7788 -29.7788 -29.7359 -29.7359 -29.7251 -29.7251 -7.9492 -7.9492 -7.9489 -7.9489 -4.7480 -4.7480 -4.7472 -4.7472 0.5323 0.5323 0.5326 0.5326 3.0959 3.0959 3.0984 3.0984 5.0736 5.0736 5.0778 5.0778 6.1869 6.1869 6.1876 6.1876 7.8091 7.8091 7.8157 7.8157 9.2489 9.2489 9.2528 9.2528 14.4827 14.4827 14.4842 14.4842 16.3012 16.3012 16.3047 16.3047 17.6695 17.6695 k = 0.5000 0.3843 0.3113 ( 3312 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0532 -30.0532 -30.0494 -30.0494 -29.7921 -29.7921 -29.7791 -29.7791 -29.7357 -29.7357 -29.7252 -29.7252 -7.9616 -7.9616 -7.9613 -7.9613 -4.7298 -4.7298 -4.7291 -4.7291 0.5382 0.5382 0.5385 0.5385 3.1100 3.1100 3.1124 3.1124 5.0838 5.0838 5.0878 5.0878 6.1863 6.1863 6.1870 6.1870 7.7605 7.7605 7.7670 7.7670 9.2582 9.2582 9.2619 9.2619 14.4485 14.4485 14.4500 14.4500 16.2576 16.2576 16.2611 16.2611 17.6228 17.6228 k = 0.5000 0.3843 0.2965 ( 3302 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0530 -30.0530 -30.0494 -30.0494 -29.7920 -29.7920 -29.7793 -29.7793 -29.7354 -29.7354 -29.7252 -29.7252 -7.9738 -7.9738 -7.9735 -7.9735 -4.7113 -4.7113 -4.7106 -4.7106 0.5417 0.5417 0.5421 0.5421 3.1247 3.1247 3.1271 3.1271 5.0943 5.0943 5.0981 5.0981 6.1882 6.1882 6.1890 6.1890 7.7113 7.7113 7.7177 7.7177 9.2677 9.2677 9.2712 9.2712 14.4168 14.4168 14.4184 14.4184 16.2094 16.2094 16.2128 16.2128 17.5760 17.5760 k = 0.5000 0.3843 0.2816 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0530 -30.0530 -30.0494 -30.0494 -29.7919 -29.7919 -29.7796 -29.7796 -29.7352 -29.7352 -29.7253 -29.7253 -7.9858 -7.9858 -7.9855 -7.9855 -4.6927 -4.6927 -4.6919 -4.6919 0.5431 0.5431 0.5435 0.5435 3.1398 3.1398 3.1423 3.1423 5.1052 5.1052 5.1087 5.1087 6.1924 6.1924 6.1935 6.1935 7.6615 7.6615 7.6678 7.6678 9.2773 9.2773 9.2806 9.2806 14.3878 14.3878 14.3894 14.3894 16.1571 16.1571 16.1604 16.1604 17.5293 17.5293 k = 0.5000 0.3843 0.2668 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0528 -30.0528 -30.0495 -30.0495 -29.7917 -29.7917 -29.7799 -29.7799 -29.7349 -29.7349 -29.7254 -29.7254 -7.9975 -7.9975 -7.9972 -7.9972 -4.6739 -4.6739 -4.6731 -4.6731 0.5424 0.5424 0.5428 0.5428 3.1554 3.1554 3.1579 3.1579 5.1164 5.1164 5.1197 5.1197 6.1990 6.1990 6.2005 6.2005 7.6112 7.6112 7.6174 7.6174 9.2870 9.2870 9.2901 9.2901 14.3617 14.3617 14.3634 14.3634 16.1012 16.1012 16.1045 16.1045 17.4834 17.4834 k = 0.5000 0.3843 0.2520 ( 3314 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0527 -30.0527 -30.0495 -30.0495 -29.7916 -29.7916 -29.7802 -29.7802 -29.7347 -29.7347 -29.7255 -29.7255 -8.0089 -8.0089 -8.0086 -8.0086 -4.6551 -4.6551 -4.6544 -4.6544 0.5398 0.5398 0.5403 0.5403 3.1713 3.1713 3.1737 3.1737 5.1278 5.1278 5.1308 5.1308 6.2080 6.2080 6.2098 6.2098 7.5604 7.5604 7.5665 7.5665 9.2966 9.2966 9.2995 9.2995 14.3387 14.3387 14.3404 14.3404 16.0425 16.0425 16.0457 16.0457 17.4386 17.4386 k = 0.5000 0.3843 0.2372 ( 3320 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0526 -30.0526 -30.0495 -30.0495 -29.7914 -29.7914 -29.7806 -29.7806 -29.7344 -29.7344 -29.7256 -29.7256 -8.0199 -8.0199 -8.0196 -8.0196 -4.6365 -4.6365 -4.6358 -4.6358 0.5356 0.5356 0.5361 0.5361 3.1874 3.1874 3.1897 3.1897 5.1394 5.1394 5.1422 5.1422 6.2193 6.2193 6.2215 6.2215 7.5092 7.5092 7.5152 7.5152 9.3062 9.3062 9.3089 9.3089 14.3188 14.3188 14.3205 14.3205 15.9815 15.9815 15.9846 15.9846 17.3951 17.3951 k = 0.5000 0.3843 0.2223 ( 3324 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0525 -30.0525 -30.0496 -30.0496 -29.7913 -29.7913 -29.7809 -29.7809 -29.7341 -29.7341 -29.7258 -29.7258 -8.0305 -8.0305 -8.0302 -8.0302 -4.6181 -4.6181 -4.6174 -4.6174 0.5299 0.5299 0.5304 0.5304 3.2035 3.2035 3.2057 3.2057 5.1511 5.1511 5.1536 5.1536 6.2330 6.2330 6.2355 6.2355 7.4577 7.4577 7.4636 7.4636 9.3157 9.3157 9.3182 9.3182 14.3021 14.3021 14.3038 14.3038 15.9189 15.9189 15.9219 15.9219 17.3534 17.3534 k = 0.5000 0.3843 0.2075 ( 3324 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0524 -30.0524 -30.0496 -30.0496 -29.7911 -29.7911 -29.7813 -29.7813 -29.7338 -29.7338 -29.7259 -29.7259 -8.0406 -8.0406 -8.0403 -8.0403 -4.6001 -4.6001 -4.5995 -4.5995 0.5231 0.5231 0.5235 0.5235 3.2194 3.2194 3.2216 3.2216 5.1627 5.1627 5.1651 5.1651 6.2489 6.2489 6.2518 6.2518 7.4059 7.4059 7.4118 7.4118 9.3249 9.3249 9.3273 9.3273 14.2886 14.2886 14.2904 14.2904 15.8553 15.8553 15.8582 15.8582 17.3135 17.3135 k = 0.5000 0.3843 0.1927 ( 3328 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0522 -30.0522 -30.0497 -30.0497 -29.7909 -29.7909 -29.7817 -29.7817 -29.7335 -29.7335 -29.7261 -29.7261 -8.0502 -8.0502 -8.0499 -8.0499 -4.5827 -4.5827 -4.5821 -4.5821 0.5152 0.5152 0.5157 0.5157 3.2351 3.2351 3.2371 3.2371 5.1743 5.1743 5.1764 5.1764 6.2672 6.2672 6.2703 6.2703 7.3539 7.3539 7.3598 7.3598 9.3339 9.3339 9.3361 9.3361 14.2784 14.2784 14.2801 14.2801 15.7914 15.7914 15.7942 15.7942 17.2756 17.2756 k = 0.5000 0.3843 0.1779 ( 3332 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0521 -30.0521 -30.0497 -30.0497 -29.7906 -29.7906 -29.7821 -29.7821 -29.7332 -29.7332 -29.7263 -29.7263 -8.0592 -8.0592 -8.0590 -8.0590 -4.5659 -4.5659 -4.5653 -4.5653 0.5067 0.5067 0.5071 0.5071 3.2503 3.2503 3.2522 3.2522 5.1856 5.1856 5.1875 5.1875 6.2876 6.2876 6.2911 6.2911 7.3019 7.3019 7.3077 7.3077 9.3426 9.3426 9.3445 9.3445 14.2713 14.2713 14.2730 14.2730 15.7276 15.7276 15.7303 15.7303 17.2400 17.2400 k = 0.5000 0.3843 0.1631 ( 3324 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0520 -30.0520 -30.0498 -30.0498 -29.7904 -29.7904 -29.7824 -29.7824 -29.7328 -29.7328 -29.7264 -29.7264 -8.0677 -8.0677 -8.0675 -8.0675 -4.5499 -4.5499 -4.5494 -4.5494 0.4977 0.4977 0.4982 0.4982 3.2649 3.2649 3.2667 3.2667 5.1966 5.1966 5.1982 5.1982 6.3104 6.3104 6.3142 6.3142 7.2498 7.2498 7.2556 7.2556 9.3508 9.3508 9.3526 9.3526 14.2672 14.2672 14.2690 14.2690 15.6648 15.6648 15.6674 15.6674 17.2069 17.2069 k = 0.5000 0.3843 0.1482 ( 3324 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0518 -30.0518 -30.0498 -30.0498 -29.7901 -29.7901 -29.7828 -29.7828 -29.7325 -29.7325 -29.7266 -29.7266 -8.0755 -8.0755 -8.0753 -8.0753 -4.5348 -4.5348 -4.5343 -4.5343 0.4886 0.4886 0.4890 0.4890 3.2788 3.2788 3.2805 3.2805 5.2071 5.2071 5.2085 5.2085 6.3354 6.3354 6.3394 6.3394 7.1978 7.1978 7.2036 7.2036 9.3586 9.3586 9.3603 9.3603 14.2660 14.2660 14.2677 14.2677 15.6035 15.6035 15.6059 15.6059 17.1762 17.1762 k = 0.5000 0.3843 0.1334 ( 3316 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0517 -30.0517 -30.0499 -30.0499 -29.7898 -29.7898 -29.7832 -29.7832 -29.7322 -29.7322 -29.7268 -29.7268 -8.0827 -8.0827 -8.0825 -8.0825 -4.5208 -4.5208 -4.5203 -4.5203 0.4794 0.4794 0.4798 0.4798 3.2918 3.2918 3.2934 3.2934 5.2170 5.2170 5.2182 5.2182 6.3625 6.3625 6.3668 6.3668 7.1461 7.1461 7.1518 7.1518 9.3659 9.3659 9.3674 9.3674 14.2674 14.2674 14.2690 14.2690 15.5444 15.5444 15.5467 15.5467 17.1481 17.1481 k = 0.5000 0.3843 0.1186 ( 3312 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0516 -30.0516 -30.0500 -30.0500 -29.7895 -29.7895 -29.7836 -29.7836 -29.7318 -29.7318 -29.7270 -29.7270 -8.0892 -8.0892 -8.0891 -8.0891 -4.5078 -4.5078 -4.5074 -4.5074 0.4706 0.4706 0.4710 0.4710 3.3038 3.3038 3.3052 3.3052 5.2261 5.2261 5.2272 5.2272 6.3917 6.3917 6.3962 6.3962 7.0946 7.0946 7.1003 7.1003 9.3726 9.3726 9.3739 9.3739 14.2710 14.2710 14.2726 14.2726 15.4882 15.4882 15.4903 15.4903 17.1227 17.1227 k = 0.5000 0.3843 0.1038 ( 3316 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0515 -30.0515 -30.0500 -30.0500 -29.7892 -29.7892 -29.7840 -29.7840 -29.7315 -29.7315 -29.7273 -29.7273 -8.0951 -8.0951 -8.0949 -8.0949 -4.4961 -4.4961 -4.4957 -4.4957 0.4622 0.4622 0.4626 0.4626 3.3147 3.3147 3.3159 3.3159 5.2345 5.2345 5.2354 5.2354 6.4230 6.4230 6.4277 6.4277 7.0436 7.0436 7.0492 7.0492 9.3786 9.3786 9.3798 9.3798 14.2764 14.2764 14.2779 14.2779 15.4356 15.4356 15.4376 15.4376 17.1002 17.1002 k = 0.5000 0.3843 0.0889 ( 3316 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0513 -30.0513 -30.0501 -30.0501 -29.7889 -29.7889 -29.7844 -29.7844 -29.7312 -29.7312 -29.7275 -29.7275 -8.1001 -8.1001 -8.1000 -8.1000 -4.4858 -4.4858 -4.4854 -4.4854 0.4546 0.4546 0.4549 0.4549 3.3244 3.3244 3.3254 3.3254 5.2420 5.2420 5.2427 5.2427 6.4562 6.4562 6.4610 6.4610 6.9932 6.9932 6.9988 6.9988 9.3840 9.3840 9.3850 9.3850 14.2832 14.2832 14.2846 14.2846 15.3875 15.3875 15.3892 15.3892 17.0805 17.0805 k = 0.5000 0.3843 0.0741 ( 3320 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0512 -30.0512 -30.0502 -30.0502 -29.7886 -29.7886 -29.7848 -29.7848 -29.7308 -29.7308 -29.7278 -29.7278 -8.1045 -8.1045 -8.1043 -8.1043 -4.4769 -4.4769 -4.4766 -4.4766 0.4478 0.4478 0.4481 0.4481 3.3327 3.3327 3.3336 3.3336 5.2484 5.2484 5.2490 5.2490 6.4911 6.4911 6.4962 6.4962 6.9435 6.9435 6.9491 6.9491 9.3886 9.3886 9.3894 9.3894 14.2907 14.2907 14.2920 14.2920 15.3447 15.3447 15.3462 15.3462 17.0637 17.0637 k = 0.5000 0.3843 0.0593 ( 3326 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0511 -30.0511 -30.0503 -30.0503 -29.7883 -29.7883 -29.7853 -29.7853 -29.7305 -29.7305 -29.7281 -29.7281 -8.1080 -8.1080 -8.1079 -8.1079 -4.4695 -4.4695 -4.4692 -4.4692 0.4420 0.4420 0.4422 0.4422 3.3397 3.3397 3.3404 3.3404 5.2538 5.2538 5.2542 5.2542 6.5277 6.5277 6.5328 6.5328 6.8950 6.8950 6.9005 6.9005 9.3924 9.3924 9.3931 9.3931 14.2983 14.2983 14.2994 14.2994 15.3080 15.3080 15.3093 15.3093 17.0500 17.0500 k = 0.5000 0.3843 0.0445 ( 3334 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0510 -30.0510 -30.0504 -30.0504 -29.7879 -29.7879 -29.7857 -29.7857 -29.7302 -29.7302 -29.7284 -29.7284 -8.1108 -8.1108 -8.1107 -8.1107 -4.4636 -4.4636 -4.4634 -4.4634 0.4374 0.4374 0.4376 0.4376 3.3451 3.3451 3.3457 3.3457 5.2580 5.2580 5.2584 5.2584 6.5654 6.5654 6.5705 6.5705 6.8480 6.8480 6.8533 6.8533 9.3954 9.3954 9.3959 9.3959 14.3052 14.3052 14.3060 14.3060 15.2784 15.2784 15.2793 15.2793 17.0392 17.0392 k = 0.5000 0.3843 0.0296 ( 3338 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0509 -30.0509 -30.0505 -30.0505 -29.7876 -29.7876 -29.7861 -29.7861 -29.7299 -29.7299 -29.7287 -29.7287 -8.1128 -8.1128 -8.1128 -8.1128 -4.4594 -4.4594 -4.4593 -4.4593 0.4341 0.4341 0.4342 0.4342 3.3491 3.3491 3.3495 3.3495 5.2611 5.2611 5.2613 5.2613 6.6034 6.6034 6.6083 6.6083 6.8035 6.8035 6.8086 6.8086 9.3977 9.3977 9.3980 9.3980 14.3108 14.3108 14.3114 14.3114 15.2565 15.2565 15.2572 15.2572 17.0316 17.0316 k = 0.5000 0.3843 0.0148 ( 3338 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0508 -30.0508 -30.0506 -30.0506 -29.7872 -29.7872 -29.7865 -29.7865 -29.7296 -29.7296 -29.7290 -29.7290 -8.1140 -8.1140 -8.1140 -8.1140 -4.4569 -4.4569 -4.4568 -4.4568 0.4320 0.4320 0.4321 0.4321 3.3516 3.3516 3.3518 3.3518 5.2630 5.2630 5.2631 5.2631 6.6388 6.6388 6.6426 6.6426 6.7652 6.7652 6.7692 6.7692 9.3990 9.3990 9.3992 9.3992 14.3145 14.3145 14.3148 14.3148 15.2432 15.2432 15.2436 15.2436 17.0270 17.0270 k = 0.5000 0.3843-0.0000 ( 3326 PWs) bands (ev): -63.0831 -63.0831 -63.0831 -63.0831 -30.0507 -30.0507 -30.0507 -30.0507 -29.7868 -29.7868 -29.7868 -29.7868 -29.7292 -29.7292 -29.7292 -29.7292 -8.1144 -8.1144 -8.1144 -8.1144 -4.4560 -4.4560 -4.4560 -4.4560 0.4314 0.4314 0.4314 0.4314 3.3525 3.3525 3.3525 3.3525 5.2637 5.2637 5.2637 5.2637 6.6587 6.6587 6.6587 6.6587 6.7479 6.7479 6.7479 6.7479 9.3996 9.3996 9.3996 9.3996 14.3159 14.3159 14.3159 14.3159 15.2388 15.2388 15.2388 15.2388 17.0256 17.0256 k = 0.0000 0.0000 0.8205 ( 3274 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0553 -30.0553 -30.0498 -30.0498 -29.7871 -29.7871 -29.7822 -29.7822 -29.7315 -29.7315 -29.7308 -29.7308 -7.6951 -7.6951 -7.6947 -7.6947 -4.9461 -4.9461 -4.9461 -4.9461 -0.1870 -0.1870 -0.1858 -0.1858 2.9208 2.9208 2.9210 2.9210 4.8756 4.8756 4.8795 4.8795 6.9803 6.9803 6.9817 6.9817 8.7623 8.7623 8.7642 8.7642 9.0371 9.0371 9.0383 9.0383 14.9754 14.9754 14.9774 14.9774 16.5799 16.5799 16.5865 16.5865 17.8751 17.8751 k = 0.0119 0.0092 0.8205 ( 3272 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0555 -30.0551 -30.0498 -30.0498 -29.7876 -29.7865 -29.7829 -29.7814 -29.7320 -29.7313 -29.7310 -29.7303 -7.6951 -7.6950 -7.6947 -7.6946 -4.9463 -4.9463 -4.9462 -4.9462 -0.1861 -0.1861 -0.1849 -0.1849 2.9172 2.9173 2.9173 2.9175 4.8796 4.8801 4.8836 4.8838 6.9793 6.9793 6.9806 6.9808 8.7624 8.7624 8.7642 8.7644 9.0363 9.0363 9.0374 9.0377 14.9757 14.9759 14.9778 14.9778 16.5794 16.5795 16.5860 16.5862 17.8754 17.8756 k = 0.0238 0.0183 0.8205 ( 3280 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0557 -30.0549 -30.0499 -30.0499 -29.7881 -29.7860 -29.7836 -29.7807 -29.7326 -29.7318 -29.7305 -29.7298 -7.6951 -7.6950 -7.6946 -7.6946 -4.9466 -4.9466 -4.9465 -4.9465 -0.1835 -0.1834 -0.1823 -0.1822 2.9066 2.9067 2.9069 2.9071 4.8919 4.8929 4.8961 4.8965 6.9762 6.9762 6.9774 6.9778 8.7627 8.7627 8.7644 8.7648 9.0339 9.0340 9.0349 9.0354 14.9767 14.9771 14.9789 14.9789 16.5782 16.5784 16.5847 16.5850 17.8765 17.8769 k = 0.0357 0.0275 0.8205 ( 3280 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0558 -30.0547 -30.0499 -30.0499 -29.7885 -29.7855 -29.7843 -29.7800 -29.7331 -29.7324 -29.7300 -29.7293 -7.6950 -7.6949 -7.6946 -7.6945 -4.9472 -4.9472 -4.9470 -4.9469 -0.1791 -0.1790 -0.1779 -0.1778 2.8895 2.8896 2.8899 2.8902 4.9122 4.9137 4.9166 4.9171 6.9712 6.9712 6.9723 6.9729 8.7631 8.7632 8.7649 8.7653 9.0300 9.0301 9.0309 9.0316 14.9785 14.9791 14.9807 14.9808 16.5762 16.5764 16.5826 16.5830 17.8784 17.8791 k = 0.0476 0.0366 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0560 -30.0545 -30.0499 -30.0499 -29.7890 -29.7850 -29.7850 -29.7793 -29.7336 -29.7329 -29.7296 -29.7288 -7.6949 -7.6947 -7.6945 -7.6943 -4.9480 -4.9479 -4.9477 -4.9476 -0.1730 -0.1729 -0.1719 -0.1717 2.8665 2.8666 2.8671 2.8674 4.9397 4.9417 4.9443 4.9450 6.9641 6.9641 6.9651 6.9660 8.7638 8.7639 8.7655 8.7661 9.0246 9.0248 9.0254 9.0263 14.9810 14.9817 14.9833 14.9833 16.5734 16.5737 16.5798 16.5803 17.8811 17.8820 k = 0.0595 0.0458 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0562 -30.0543 -30.0499 -30.0499 -29.7894 -29.7856 -29.7844 -29.7785 -29.7342 -29.7335 -29.7291 -29.7284 -7.6948 -7.6945 -7.6943 -7.6942 -4.9489 -4.9488 -4.9486 -4.9484 -0.1654 -0.1653 -0.1643 -0.1641 2.8384 2.8386 2.8391 2.8395 4.9738 4.9762 4.9784 4.9793 6.9551 6.9551 6.9560 6.9571 8.7648 8.7649 8.7663 8.7671 9.0179 9.0180 9.0185 9.0197 14.9841 14.9850 14.9864 14.9865 16.5700 16.5704 16.5762 16.5768 17.8847 17.8858 k = 0.0714 0.0549 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0564 -30.0540 -30.0499 -30.0499 -29.7898 -29.7862 -29.7839 -29.7778 -29.7347 -29.7340 -29.7287 -29.7280 -7.6946 -7.6943 -7.6942 -7.6940 -4.9500 -4.9499 -4.9496 -4.9494 -0.1563 -0.1562 -0.1553 -0.1551 2.8061 2.8064 2.8070 2.8073 5.0134 5.0162 5.0182 5.0191 6.9441 6.9441 6.9450 6.9464 8.7660 8.7661 8.7674 8.7683 9.0099 9.0100 9.0104 9.0118 14.9879 14.9889 14.9902 14.9903 16.5659 16.5664 16.5720 16.5727 17.8892 17.8905 k = 0.0833 0.0641 0.8205 ( 3282 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0565 -30.0538 -30.0500 -30.0499 -29.7902 -29.7868 -29.7833 -29.7771 -29.7352 -29.7346 -29.7283 -29.7276 -7.6944 -7.6941 -7.6940 -7.6938 -4.9512 -4.9511 -4.9508 -4.9506 -0.1460 -0.1459 -0.1450 -0.1448 2.7706 2.7709 2.7716 2.7720 5.0575 5.0608 5.0624 5.0635 6.9313 6.9313 6.9322 6.9338 8.7674 8.7675 8.7688 8.7698 9.0008 9.0009 9.0011 9.0027 14.9921 14.9933 14.9944 14.9946 16.5612 16.5619 16.5672 16.5680 17.8946 17.8960 k = 0.0952 0.0732 0.8205 ( 3286 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0567 -30.0536 -30.0500 -30.0500 -29.7906 -29.7874 -29.7828 -29.7764 -29.7357 -29.7352 -29.7279 -29.7273 -7.6942 -7.6938 -7.6938 -7.6935 -4.9525 -4.9524 -4.9520 -4.9518 -0.1346 -0.1345 -0.1336 -0.1334 2.7329 2.7332 2.7340 2.7343 5.1051 5.1088 5.1102 5.1114 6.9167 6.9168 6.9175 6.9194 8.7692 8.7693 8.7705 8.7717 8.9906 8.9907 8.9908 8.9926 14.9968 14.9981 14.9990 14.9993 16.5560 16.5569 16.5620 16.5628 17.9008 17.9024 k = 0.1071 0.0824 0.8205 ( 3280 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0568 -30.0534 -30.0501 -30.0500 -29.7909 -29.7879 -29.7823 -29.7757 -29.7362 -29.7357 -29.7275 -29.7269 -7.6940 -7.6936 -7.6935 -7.6933 -4.9539 -4.9538 -4.9534 -4.9531 -0.1224 -0.1222 -0.1214 -0.1211 2.6938 2.6942 2.6950 2.6953 5.1553 5.1594 5.1606 5.1619 6.9006 6.9006 6.9013 6.9035 8.7713 8.7714 8.7725 8.7738 8.9796 8.9797 8.9798 8.9817 15.0018 15.0033 15.0040 15.0044 16.5505 16.5515 16.5563 16.5572 17.9079 17.9096 k = 0.1190 0.0915 0.8205 ( 3276 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0569 -30.0532 -30.0501 -30.0500 -29.7911 -29.7884 -29.7818 -29.7750 -29.7367 -29.7362 -29.7271 -29.7266 -7.6938 -7.6933 -7.6933 -7.6930 -4.9553 -4.9552 -4.9547 -4.9545 -0.1096 -0.1093 -0.1086 -0.1083 2.6543 2.6547 2.6555 2.6559 5.2070 5.2116 5.2125 5.2139 6.8830 6.8830 6.8837 6.8861 8.7738 8.7738 8.7749 8.7763 8.9679 8.9680 8.9681 8.9701 15.0071 15.0087 15.0092 15.0096 16.5447 16.5459 16.5504 16.5513 17.9158 17.9177 k = 0.1310 0.1007 0.8205 ( 3276 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0570 -30.0530 -30.0502 -30.0500 -29.7914 -29.7889 -29.7813 -29.7744 -29.7371 -29.7367 -29.7268 -29.7263 -7.6936 -7.6931 -7.6930 -7.6928 -4.9567 -4.9566 -4.9561 -4.9558 -0.0964 -0.0961 -0.0955 -0.0951 2.6151 2.6155 2.6165 2.6168 5.2593 5.2644 5.2650 5.2665 6.8641 6.8642 6.8648 6.8675 8.7767 8.7767 8.7778 8.7792 8.9555 8.9559 8.9559 8.9580 15.0124 15.0141 15.0144 15.0150 16.5388 16.5402 16.5444 16.5452 17.9245 17.9264 k = 0.1429 0.1098 0.8205 ( 3276 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0572 -30.0528 -30.0502 -30.0500 -29.7916 -29.7894 -29.7809 -29.7738 -29.7376 -29.7372 -29.7265 -29.7261 -7.6933 -7.6929 -7.6928 -7.6925 -4.9581 -4.9580 -4.9575 -4.9572 -0.0831 -0.0828 -0.0822 -0.0819 2.5771 2.5775 2.5785 2.5788 5.3113 5.3167 5.3172 5.3187 6.8443 6.8444 6.8449 6.8480 8.7801 8.7801 8.7811 8.7825 8.9428 8.9433 8.9434 8.9455 15.0178 15.0195 15.0197 15.0203 16.5328 16.5345 16.5383 16.5391 17.9338 17.9358 k = 0.1548 0.1190 0.8205 ( 3284 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0573 -30.0526 -30.0503 -30.0500 -29.7918 -29.7899 -29.7805 -29.7733 -29.7380 -29.7377 -29.7263 -29.7259 -7.6931 -7.6926 -7.6925 -7.6923 -4.9595 -4.9594 -4.9589 -4.9585 -0.0701 -0.0698 -0.0693 -0.0690 2.5410 2.5414 2.5424 2.5427 5.3618 5.3678 5.3680 5.3696 6.8239 6.8240 6.8246 6.8280 8.7839 8.7839 8.7848 8.7863 8.9300 8.9305 8.9307 8.9328 15.0230 15.0248 15.0248 15.0255 16.5270 16.5289 16.5324 16.5331 17.9436 17.9456 k = 0.1667 0.1281 0.8205 ( 3300 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0574 -30.0525 -30.0505 -30.0501 -29.7920 -29.7903 -29.7802 -29.7728 -29.7384 -29.7381 -29.7260 -29.7257 -7.6929 -7.6924 -7.6923 -7.6921 -4.9608 -4.9607 -4.9601 -4.9598 -0.0577 -0.0573 -0.0569 -0.0566 2.5074 2.5078 2.5089 2.5092 5.4100 5.4164 5.4165 5.4181 6.8035 6.8036 6.8041 6.8078 8.7882 8.7883 8.7890 8.7906 8.9171 8.9178 8.9180 8.9202 15.0279 15.0295 15.0298 15.0304 16.5214 16.5235 16.5267 16.5274 17.9537 17.9557 k = 0.1786 0.1373 0.8205 ( 3292 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0575 -30.0523 -30.0505 -30.0501 -29.7921 -29.7906 -29.7798 -29.7723 -29.7387 -29.7385 -29.7258 -29.7255 -7.6927 -7.6922 -7.6921 -7.6919 -4.9620 -4.9619 -4.9613 -4.9609 -0.0461 -0.0457 -0.0453 -0.0450 2.4770 2.4774 2.4785 2.4788 5.4549 5.4616 5.4618 5.4632 6.7836 6.7837 6.7841 6.7883 8.7931 8.7933 8.7938 8.7955 8.9045 8.9051 8.9055 8.9077 15.0326 15.0340 15.0345 15.0350 16.5162 16.5187 16.5215 16.5220 17.9640 17.9659 k = 0.1905 0.1464 0.8205 ( 3290 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0575 -30.0521 -30.0506 -30.0501 -29.7922 -29.7910 -29.7795 -29.7719 -29.7389 -29.7388 -29.7256 -29.7254 -7.6925 -7.6921 -7.6918 -7.6917 -4.9630 -4.9629 -4.9623 -4.9619 -0.0357 -0.0352 -0.0349 -0.0346 2.4503 2.4506 2.4518 2.4521 5.4954 5.5024 5.5028 5.5040 6.7648 6.7649 6.7653 6.7698 8.7986 8.7989 8.7992 8.8010 8.8920 8.8928 8.8933 8.8956 15.0367 15.0379 15.0386 15.0391 16.5116 16.5143 16.5168 16.5172 17.9740 17.9757 k = 0.2024 0.1556 0.8205 ( 3290 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0576 -30.0519 -30.0507 -30.0501 -29.7922 -29.7912 -29.7793 -29.7716 -29.7392 -29.7391 -29.7255 -29.7252 -7.6924 -7.6919 -7.6917 -7.6916 -4.9639 -4.9638 -4.9632 -4.9628 -0.0267 -0.0262 -0.0259 -0.0257 2.4278 2.4280 2.4292 2.4295 5.5305 5.5377 5.5383 5.5393 6.7479 6.7480 6.7483 6.7532 8.8048 8.8050 8.8051 8.8071 8.8800 8.8808 8.8814 8.8839 15.0403 15.0413 15.0421 15.0426 16.5076 16.5107 16.5128 16.5130 17.9833 17.9848 k = 0.2143 0.1647 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0576 -30.0517 -30.0509 -30.0501 -29.7923 -29.7915 -29.7791 -29.7713 -29.7394 -29.7393 -29.7253 -29.7252 -7.6923 -7.6918 -7.6915 -7.6915 -4.9646 -4.9645 -4.9639 -4.9634 -0.0194 -0.0189 -0.0187 -0.0185 2.4098 2.4100 2.4112 2.4115 5.5591 5.5666 5.5673 5.5681 6.7337 6.7338 6.7340 6.7391 8.8114 8.8116 8.8119 8.8139 8.8685 8.8693 8.8700 8.8729 15.0432 15.0440 15.0450 15.0454 16.5044 16.5078 16.5095 16.5095 17.9914 17.9927 k = 0.2262 0.1739 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0577 -30.0516 -30.0510 -30.0501 -29.7922 -29.7917 -29.7790 -29.7712 -29.7395 -29.7395 -29.7252 -29.7251 -7.6922 -7.6917 -7.6914 -7.6914 -4.9651 -4.9651 -4.9644 -4.9639 -0.0141 -0.0134 -0.0134 -0.0132 2.3967 2.3969 2.3981 2.3984 5.5803 5.5880 5.5889 5.5894 6.7228 6.7229 6.7231 6.7285 8.8179 8.8190 8.8194 8.8212 8.8576 8.8584 8.8593 8.8630 15.0454 15.0459 15.0471 15.0475 16.5020 16.5057 16.5069 16.5071 17.9980 17.9988 k = 0.2381 0.1830 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0577 -30.0514 -30.0511 -30.0501 -29.7922 -29.7919 -29.7789 -29.7710 -29.7396 -29.7396 -29.7252 -29.7251 -7.6921 -7.6917 -7.6914 -7.6913 -4.9654 -4.9654 -4.9647 -4.9642 -0.0108 -0.0101 -0.0101 -0.0100 2.3888 2.3889 2.3902 2.3905 5.5934 5.6012 5.6023 5.6026 6.7161 6.7161 6.7162 6.7218 8.8239 8.8269 8.8271 8.8288 8.8478 8.8487 8.8495 8.8550 15.0468 15.0470 15.0484 15.0488 16.5006 16.5046 16.5052 16.5056 18.0024 18.0027 k = 0.2500 0.1922 0.8205 ( 3296 PWs) bands (ev): -63.0830 -63.0830 -63.0830 -63.0830 -30.0577 -30.0513 -30.0513 -30.0501 -29.7921 -29.7921 -29.7788 -29.7710 -29.7396 -29.7396 -29.7251 -29.7251 -7.6921 -7.6916 -7.6913 -7.6913 -4.9655 -4.9655 -4.9648 -4.9644 -0.0097 -0.0090 -0.0089 -0.0089 2.3862 2.3862 2.3875 2.3878 5.5978 5.6056 5.6069 5.6069 6.7138 6.7138 6.7138 6.7196 8.8267 8.8323 8.8332 8.8332 8.8426 8.8426 8.8427 8.8515 15.0473 15.0473 15.0488 15.0492 16.5001 16.5044 16.5044 16.5052 18.0042 18.0043 Writing output data file MgCN2.save init_run : 1.41s CPU 11.30s WALL ( 1 calls) electrons : 782.60s CPU 790.78s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.08s WALL ( 1 calls) potinit : 0.25s CPU 1.39s WALL ( 1 calls) Called by electrons: c_bands : 782.57s CPU 790.49s WALL ( 1 calls) v_of_rho : 0.08s CPU 0.94s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.07s CPU 0.61s WALL ( 1 calls) newd : 0.09s CPU 0.43s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 378 calls) cegterg : 746.37s CPU 751.29s WALL ( 873 calls) Called by sum_band: Called by *egterg: h_psi : 298.95s CPU 307.97s WALL ( 14592 calls) s_psi : 17.10s CPU 17.50s WALL ( 14592 calls) g_psi : 0.65s CPU 0.68s WALL ( 13341 calls) cdiaghg : 323.69s CPU 320.70s WALL ( 13719 calls) cegterg:over : 64.68s CPU 62.53s WALL ( 13341 calls) cegterg:upda : 11.33s CPU 14.45s WALL ( 13341 calls) cegterg:last : 10.75s CPU 11.54s WALL ( 2275 calls) Called by h_psi: h_psi:vloc : 250.33s CPU 257.55s WALL ( 14592 calls) h_psi:vnl : 48.40s CPU 49.69s WALL ( 14592 calls) add_vuspsi : 11.81s CPU 14.92s WALL ( 14592 calls) General routines calbec : 36.53s CPU 34.64s WALL ( 14592 calls) fft : 0.24s CPU 1.07s WALL ( 19 calls) ffts : 0.02s CPU 0.02s WALL ( 4 calls) fftw : 234.97s CPU 240.70s WALL ( 1508284 calls) interpolate : 0.07s CPU 0.07s WALL ( 4 calls) davcio : 0.03s CPU 0.88s WALL ( 756 calls) Parallel routines fft_scatter : 151.03s CPU 155.03s WALL ( 1508307 calls) PWSCF : 13m59.43s CPU 15m21.78s WALL This run was terminated on: 6:26:29 13Jun2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=