Program PWSCF v.5.1.1 starts on 27Jul2015 at 14:48:17 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 32 processors R & G space division: proc/nbgrp/npool/nimage = 32 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: ./NiSe.save/ file Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 64 45 14 1244 729 123 Max 65 46 15 1246 751 124 Sum 2079 1467 449 39863 23757 3959 bravais-lattice index = 14 lattice parameter (alat) = 11.1180 a.u. unit-cell volume = 650.2030 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 42.0000 Ry charge density cutoff = 236.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 11.118005 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.446511 celldm(5)= -0.446511 celldm(6)= -0.446511 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.446511 0.894778 0.000000 ) a(3) = ( -0.446511 -0.721836 0.528753 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.499019 1.525704 ) b(2) = ( 0.000000 1.117596 1.525704 ) b(3) = ( 0.000000 0.000000 1.891241 ) PseudoPot. # 1 for Se read from file: /home/autes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 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 Ni read from file: /home/autes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Se 6.00 78.96000 Se( 1.00) Ni 10.00 58.69340 Ni( 1.00) No symmetry found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 329 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 2) = ( 0.0093421 -0.0151026 0.0049397), wk = 0.0030395 k( 3) = ( 0.0186843 -0.0302053 0.0098794), wk = 0.0030395 k( 4) = ( 0.0280264 -0.0453079 0.0148191), wk = 0.0030395 k( 5) = ( 0.0373686 -0.0604106 0.0197587), wk = 0.0030395 k( 6) = ( 0.0467107 -0.0755132 0.0246984), wk = 0.0030395 k( 7) = ( 0.0560529 -0.0906159 0.0296381), wk = 0.0030395 k( 8) = ( 0.0653950 -0.1057185 0.0345778), wk = 0.0030395 k( 9) = ( 0.0747371 -0.1208211 0.0395175), wk = 0.0030395 k( 10) = ( 0.0840793 -0.1359238 0.0444572), wk = 0.0030395 k( 11) = ( 0.0934214 -0.1510264 0.0493969), wk = 0.0030395 k( 12) = ( 0.1027636 -0.1661291 0.0543366), wk = 0.0030395 k( 13) = ( 0.1121057 -0.1812317 0.0592763), wk = 0.0030395 k( 14) = ( 0.1214479 -0.1963344 0.0642160), wk = 0.0030395 k( 15) = ( 0.1307900 -0.2114370 0.0691557), wk = 0.0030395 k( 16) = ( 0.1401321 -0.2265396 0.0740953), wk = 0.0030395 k( 17) = ( 0.1494743 -0.2416423 0.0790350), wk = 0.0030395 k( 18) = ( 0.1588164 -0.2567449 0.0839747), wk = 0.0030395 k( 19) = ( 0.1681586 -0.2718476 0.0889144), wk = 0.0030395 k( 20) = ( 0.1775007 -0.2869502 0.0938541), wk = 0.0030395 k( 21) = ( 0.1868429 -0.3020529 0.0987938), wk = 0.0030395 k( 22) = ( 0.1961850 -0.3171555 0.1037335), wk = 0.0030395 k( 23) = ( 0.2055271 -0.3322581 0.1086732), wk = 0.0030395 k( 24) = ( 0.2148693 -0.3473608 0.1136128), wk = 0.0030395 k( 25) = ( 0.2242114 -0.3624634 0.1185526), wk = 0.0030395 k( 26) = ( 0.2335536 -0.3775661 0.1234922), wk = 0.0030395 k( 27) = ( 0.2428957 -0.3926687 0.1284319), wk = 0.0030395 k( 28) = ( 0.2522378 -0.4077714 0.1333716), wk = 0.0030395 k( 29) = ( 0.2615800 -0.4228740 0.1383113), wk = 0.0030395 k( 30) = ( 0.2709221 -0.4379766 0.1432510), wk = 0.0030395 k( 31) = ( 0.2802643 -0.4530793 0.1481907), wk = 0.0030395 k( 32) = ( 0.2896064 -0.4681819 0.1531304), wk = 0.0030395 k( 33) = ( 0.2989486 -0.4832846 0.1580701), wk = 0.0030395 k( 34) = ( 0.3082907 -0.4983872 0.1630097), wk = 0.0030395 k( 35) = ( 0.3176329 -0.5134899 0.1679494), wk = 0.0030395 k( 36) = ( 0.3269750 -0.5285925 0.1728891), wk = 0.0030395 k( 37) = ( 0.3363171 -0.5436951 0.1778288), wk = 0.0030395 k( 38) = ( 0.3456593 -0.5587978 0.1827685), wk = 0.0030395 k( 39) = ( 0.3456593 -0.5587978 0.1827685), wk = 0.0030395 k( 40) = ( 0.3491670 -0.5531271 0.2001060), wk = 0.0030395 k( 41) = ( 0.3526748 -0.5474564 0.2174436), wk = 0.0030395 k( 42) = ( 0.3561825 -0.5417858 0.2347811), wk = 0.0030395 k( 43) = ( 0.3596903 -0.5361151 0.2521187), wk = 0.0030395 k( 44) = ( 0.3631980 -0.5304444 0.2694562), wk = 0.0030395 k( 45) = ( 0.3667057 -0.5247738 0.2867938), wk = 0.0030395 k( 46) = ( 0.3702135 -0.5191031 0.3041313), wk = 0.0030395 k( 47) = ( 0.3737212 -0.5134324 0.3214689), wk = 0.0030395 k( 48) = ( 0.3772290 -0.5077618 0.3388064), wk = 0.0030395 k( 49) = ( 0.3807367 -0.5020911 0.3561440), wk = 0.0030395 k( 50) = ( 0.3842445 -0.4964204 0.3734815), wk = 0.0030395 k( 51) = ( 0.3877522 -0.4907498 0.3908190), wk = 0.0030395 k( 52) = ( 0.3912600 -0.4850791 0.4081566), wk = 0.0030395 k( 53) = ( 0.3947677 -0.4794084 0.4254941), wk = 0.0030395 k( 54) = ( 0.3982754 -0.4737377 0.4428317), wk = 0.0030395 k( 55) = ( 0.4017832 -0.4680671 0.4601692), wk = 0.0030395 k( 56) = ( 0.4052909 -0.4623964 0.4775068), wk = 0.0030395 k( 57) = ( 0.4087987 -0.4567257 0.4948443), wk = 0.0030395 k( 58) = ( 0.4123064 -0.4510551 0.5121819), wk = 0.0030395 k( 59) = ( 0.4158141 -0.4453844 0.5295194), wk = 0.0030395 k( 60) = ( 0.4193219 -0.4397137 0.5468570), wk = 0.0030395 k( 61) = ( 0.4228296 -0.4340431 0.5641945), wk = 0.0030395 k( 62) = ( 0.4263374 -0.4283724 0.5815320), wk = 0.0030395 k( 63) = ( 0.4298451 -0.4227017 0.5988696), wk = 0.0030395 k( 64) = ( 0.4333529 -0.4170311 0.6162071), wk = 0.0030395 k( 65) = ( 0.4368606 -0.4113604 0.6335447), wk = 0.0030395 k( 66) = ( 0.4403684 -0.4056897 0.6508822), wk = 0.0030395 k( 67) = ( 0.4438761 -0.4000191 0.6682198), wk = 0.0030395 k( 68) = ( 0.4473839 -0.3943484 0.6855573), wk = 0.0030395 k( 69) = ( 0.4508916 -0.3886777 0.7028949), wk = 0.0030395 k( 70) = ( 0.4543993 -0.3830070 0.7202324), wk = 0.0030395 k( 71) = ( 0.4579071 -0.3773364 0.7375700), wk = 0.0030395 k( 72) = ( 0.4614148 -0.3716657 0.7549075), wk = 0.0030395 k( 73) = ( 0.4649226 -0.3659950 0.7722450), wk = 0.0030395 k( 74) = ( 0.4684303 -0.3603244 0.7895826), wk = 0.0030395 k( 75) = ( 0.4719380 -0.3546537 0.8069201), wk = 0.0030395 k( 76) = ( 0.4754458 -0.3489830 0.8242577), wk = 0.0030395 k( 77) = ( 0.4789535 -0.3433124 0.8415952), wk = 0.0030395 k( 78) = ( 0.4824613 -0.3376417 0.8589328), wk = 0.0030395 k( 79) = ( 0.4859690 -0.3319710 0.8762703), wk = 0.0030395 k( 80) = ( 0.4894768 -0.3263004 0.8936079), wk = 0.0030395 k( 81) = ( 0.4929845 -0.3206297 0.9109454), wk = 0.0030395 k( 82) = ( 0.4964923 -0.3149590 0.9282830), wk = 0.0030395 k( 83) = ( 0.5000000 -0.3092883 0.9456205), wk = 0.0030395 k( 84) = ( 0.5000000 -0.3092883 0.9456205), wk = 0.0030395 k( 85) = ( 0.4916573 -0.2925701 0.9456205), wk = 0.0030395 k( 86) = ( 0.4833145 -0.2758518 0.9456205), wk = 0.0030395 k( 87) = ( 0.4749718 -0.2591335 0.9456205), wk = 0.0030395 k( 88) = ( 0.4666290 -0.2424152 0.9456205), wk = 0.0030395 k( 89) = ( 0.4582863 -0.2256969 0.9456205), wk = 0.0030395 k( 90) = ( 0.4499436 -0.2089786 0.9456205), wk = 0.0030395 k( 91) = ( 0.4416008 -0.1922603 0.9456205), wk = 0.0030395 k( 92) = ( 0.4332581 -0.1755420 0.9456205), wk = 0.0030395 k( 93) = ( 0.4249153 -0.1588237 0.9456205), wk = 0.0030395 k( 94) = ( 0.4165726 -0.1421055 0.9456205), wk = 0.0030395 k( 95) = ( 0.4082298 -0.1253872 0.9456205), wk = 0.0030395 k( 96) = ( 0.3998871 -0.1086689 0.9456205), wk = 0.0030395 k( 97) = ( 0.3915444 -0.0919506 0.9456205), wk = 0.0030395 k( 98) = ( 0.3832016 -0.0752323 0.9456205), wk = 0.0030395 k( 99) = ( 0.3748589 -0.0585140 0.9456205), wk = 0.0030395 k( 100) = ( 0.3665161 -0.0417957 0.9456205), wk = 0.0030395 k( 101) = ( 0.3581734 -0.0250774 0.9456205), wk = 0.0030395 k( 102) = ( 0.3498307 -0.0083591 0.9456205), wk = 0.0030395 k( 103) = ( 0.3414879 0.0083591 0.9456205), wk = 0.0030395 k( 104) = ( 0.3331452 0.0250774 0.9456205), wk = 0.0030395 k( 105) = ( 0.3248024 0.0417957 0.9456205), wk = 0.0030395 k( 106) = ( 0.3164597 0.0585140 0.9456205), wk = 0.0030395 k( 107) = ( 0.3081169 0.0752323 0.9456205), wk = 0.0030395 k( 108) = ( 0.2997742 0.0919506 0.9456205), wk = 0.0030395 k( 109) = ( 0.2914315 0.1086689 0.9456205), wk = 0.0030395 k( 110) = ( 0.2830887 0.1253872 0.9456205), wk = 0.0030395 k( 111) = ( 0.2747460 0.1421055 0.9456205), wk = 0.0030395 k( 112) = ( 0.2664032 0.1588237 0.9456205), wk = 0.0030395 k( 113) = ( 0.2580605 0.1755420 0.9456205), wk = 0.0030395 k( 114) = ( 0.2497177 0.1922603 0.9456205), wk = 0.0030395 k( 115) = ( 0.2413750 0.2089786 0.9456205), wk = 0.0030395 k( 116) = ( 0.2330323 0.2256969 0.9456205), wk = 0.0030395 k( 117) = ( 0.2246895 0.2424152 0.9456205), wk = 0.0030395 k( 118) = ( 0.2163468 0.2591335 0.9456205), wk = 0.0030395 k( 119) = ( 0.2080040 0.2758518 0.9456205), wk = 0.0030395 k( 120) = ( 0.1996613 0.2925701 0.9456205), wk = 0.0030395 k( 121) = ( 0.1913186 0.3092883 0.9456205), wk = 0.0030395 k( 122) = ( 0.1913186 0.3092883 0.9456205), wk = 0.0030395 k( 123) = ( 0.1878400 0.3036649 0.9284274), wk = 0.0030395 k( 124) = ( 0.1843615 0.2980415 0.9112343), wk = 0.0030395 k( 125) = ( 0.1808830 0.2924181 0.8940412), wk = 0.0030395 k( 126) = ( 0.1774045 0.2867946 0.8768481), wk = 0.0030395 k( 127) = ( 0.1739260 0.2811712 0.8596550), wk = 0.0030395 k( 128) = ( 0.1704475 0.2755478 0.8424619), wk = 0.0030395 k( 129) = ( 0.1669689 0.2699244 0.8252688), wk = 0.0030395 k( 130) = ( 0.1634904 0.2643010 0.8080757), wk = 0.0030395 k( 131) = ( 0.1600119 0.2586775 0.7908826), wk = 0.0030395 k( 132) = ( 0.1565334 0.2530541 0.7736895), wk = 0.0030395 k( 133) = ( 0.1530548 0.2474307 0.7564964), wk = 0.0030395 k( 134) = ( 0.1495763 0.2418073 0.7393033), wk = 0.0030395 k( 135) = ( 0.1460978 0.2361838 0.7221102), wk = 0.0030395 k( 136) = ( 0.1426193 0.2305604 0.7049171), wk = 0.0030395 k( 137) = ( 0.1391408 0.2249370 0.6877240), wk = 0.0030395 k( 138) = ( 0.1356623 0.2193135 0.6705309), wk = 0.0030395 k( 139) = ( 0.1321837 0.2136901 0.6533378), wk = 0.0030395 k( 140) = ( 0.1287052 0.2080667 0.6361447), wk = 0.0030395 k( 141) = ( 0.1252267 0.2024433 0.6189516), wk = 0.0030395 k( 142) = ( 0.1217482 0.1968199 0.6017585), wk = 0.0030395 k( 143) = ( 0.1182697 0.1911964 0.5845654), wk = 0.0030395 k( 144) = ( 0.1147911 0.1855730 0.5673723), wk = 0.0030395 k( 145) = ( 0.1113126 0.1799496 0.5501792), wk = 0.0030395 k( 146) = ( 0.1078341 0.1743262 0.5329861), wk = 0.0030395 k( 147) = ( 0.1043556 0.1687027 0.5157930), wk = 0.0030395 k( 148) = ( 0.1008771 0.1630793 0.4985999), wk = 0.0030395 k( 149) = ( 0.0973985 0.1574559 0.4814068), wk = 0.0030395 k( 150) = ( 0.0939200 0.1518325 0.4642137), wk = 0.0030395 k( 151) = ( 0.0904415 0.1462090 0.4470206), wk = 0.0030395 k( 152) = ( 0.0869630 0.1405856 0.4298275), wk = 0.0030395 k( 153) = ( 0.0834845 0.1349622 0.4126344), wk = 0.0030395 k( 154) = ( 0.0800059 0.1293388 0.3954413), wk = 0.0030395 k( 155) = ( 0.0765274 0.1237153 0.3782482), wk = 0.0030395 k( 156) = ( 0.0730489 0.1180919 0.3610551), wk = 0.0030395 k( 157) = ( 0.0695704 0.1124685 0.3438620), wk = 0.0030395 k( 158) = ( 0.0660919 0.1068451 0.3266689), wk = 0.0030395 k( 159) = ( 0.0626133 0.1012216 0.3094758), wk = 0.0030395 k( 160) = ( 0.0591348 0.0955982 0.2922827), wk = 0.0030395 k( 161) = ( 0.0556563 0.0899748 0.2750896), wk = 0.0030395 k( 162) = ( 0.0521778 0.0843514 0.2578965), wk = 0.0030395 k( 163) = ( 0.0486993 0.0787279 0.2407034), wk = 0.0030395 k( 164) = ( 0.0452207 0.0731045 0.2235103), wk = 0.0030395 k( 165) = ( 0.0417422 0.0674811 0.2063172), wk = 0.0030395 k( 166) = ( 0.0382637 0.0618577 0.1891241), wk = 0.0030395 k( 167) = ( 0.0347852 0.0562342 0.1719310), wk = 0.0030395 k( 168) = ( 0.0313067 0.0506108 0.1547379), wk = 0.0030395 k( 169) = ( 0.0278281 0.0449874 0.1375448), wk = 0.0030395 k( 170) = ( 0.0243496 0.0393640 0.1203517), wk = 0.0030395 k( 171) = ( 0.0208711 0.0337406 0.1031586), wk = 0.0030395 k( 172) = ( 0.0173926 0.0281171 0.0859655), wk = 0.0030395 k( 173) = ( 0.0139141 0.0224937 0.0687724), wk = 0.0030395 k( 174) = ( 0.0104356 0.0168703 0.0515793), wk = 0.0030395 k( 175) = ( 0.0069570 0.0112469 0.0343862), wk = 0.0030395 k( 176) = ( 0.0034785 0.0056234 0.0171931), wk = 0.0030395 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 179) = ( 0.0156250 -0.0096653 -0.0000000), wk = 0.0030395 k( 180) = ( 0.0312500 -0.0193305 -0.0000000), wk = 0.0030395 k( 181) = ( 0.0468750 -0.0289958 -0.0000000), wk = 0.0030395 k( 182) = ( 0.0625000 -0.0386610 -0.0000000), wk = 0.0030395 k( 183) = ( 0.0781250 -0.0483263 -0.0000000), wk = 0.0030395 k( 184) = ( 0.0937500 -0.0579916 -0.0000000), wk = 0.0030395 k( 185) = ( 0.1093750 -0.0676568 -0.0000000), wk = 0.0030395 k( 186) = ( 0.1250000 -0.0773221 -0.0000000), wk = 0.0030395 k( 187) = ( 0.1406250 -0.0869873 -0.0000000), wk = 0.0030395 k( 188) = ( 0.1562500 -0.0966526 -0.0000000), wk = 0.0030395 k( 189) = ( 0.1718750 -0.1063179 -0.0000000), wk = 0.0030395 k( 190) = ( 0.1875000 -0.1159831 -0.0000000), wk = 0.0030395 k( 191) = ( 0.2031250 -0.1256484 -0.0000000), wk = 0.0030395 k( 192) = ( 0.2187500 -0.1353137 -0.0000000), wk = 0.0030395 k( 193) = ( 0.2343750 -0.1449789 -0.0000000), wk = 0.0030395 k( 194) = ( 0.2500000 -0.1546442 -0.0000000), wk = 0.0030395 k( 195) = ( 0.2656250 -0.1643094 -0.0000000), wk = 0.0030395 k( 196) = ( 0.2812500 -0.1739747 -0.0000000), wk = 0.0030395 k( 197) = ( 0.2968750 -0.1836400 -0.0000000), wk = 0.0030395 k( 198) = ( 0.3125000 -0.1933052 -0.0000000), wk = 0.0030395 k( 199) = ( 0.3281250 -0.2029705 -0.0000000), wk = 0.0030395 k( 200) = ( 0.3437500 -0.2126357 -0.0000000), wk = 0.0030395 k( 201) = ( 0.3593750 -0.2223010 -0.0000000), wk = 0.0030395 k( 202) = ( 0.3750000 -0.2319663 -0.0000000), wk = 0.0030395 k( 203) = ( 0.3906250 -0.2416315 -0.0000000), wk = 0.0030395 k( 204) = ( 0.4062500 -0.2512968 -0.0000000), wk = 0.0030395 k( 205) = ( 0.4218750 -0.2609620 -0.0000000), wk = 0.0030395 k( 206) = ( 0.4375000 -0.2706273 -0.0000000), wk = 0.0030395 k( 207) = ( 0.4531250 -0.2802926 -0.0000000), wk = 0.0030395 k( 208) = ( 0.4687500 -0.2899578 -0.0000000), wk = 0.0030395 k( 209) = ( 0.4843750 -0.2996231 -0.0000000), wk = 0.0030395 k( 210) = ( 0.5000000 -0.3092883 -0.0000000), wk = 0.0030395 k( 211) = ( 0.5000000 -0.3092883 -0.0000000), wk = 0.0030395 k( 212) = ( 0.5081232 -0.2961563 -0.0096194), wk = 0.0030395 k( 213) = ( 0.5162464 -0.2830242 -0.0192388), wk = 0.0030395 k( 214) = ( 0.5243696 -0.2698921 -0.0288582), wk = 0.0030395 k( 215) = ( 0.5324928 -0.2567600 -0.0384776), wk = 0.0030395 k( 216) = ( 0.5406160 -0.2436280 -0.0480970), wk = 0.0030395 k( 217) = ( 0.5487392 -0.2304959 -0.0577164), wk = 0.0030395 k( 218) = ( 0.5568624 -0.2173638 -0.0673358), wk = 0.0030395 k( 219) = ( 0.5649856 -0.2042317 -0.0769551), wk = 0.0030395 k( 220) = ( 0.5731088 -0.1910997 -0.0865746), wk = 0.0030395 k( 221) = ( 0.5812320 -0.1779676 -0.0961939), wk = 0.0030395 k( 222) = ( 0.5893552 -0.1648355 -0.1058133), wk = 0.0030395 k( 223) = ( 0.5974784 -0.1517034 -0.1154327), wk = 0.0030395 k( 224) = ( 0.6056015 -0.1385714 -0.1250521), wk = 0.0030395 k( 225) = ( 0.6137247 -0.1254393 -0.1346715), wk = 0.0030395 k( 226) = ( 0.6218479 -0.1123072 -0.1442909), wk = 0.0030395 k( 227) = ( 0.6299711 -0.0991751 -0.1539103), wk = 0.0030395 k( 228) = ( 0.6380943 -0.0860431 -0.1635297), wk = 0.0030395 k( 229) = ( 0.6462175 -0.0729110 -0.1731491), wk = 0.0030395 k( 230) = ( 0.6543407 -0.0597789 -0.1827685), wk = 0.0030395 k( 231) = ( 0.6543407 -0.0597789 -0.1827685), wk = 0.0030395 k( 232) = ( 0.6578485 -0.0541082 -0.1654310), wk = 0.0030395 k( 233) = ( 0.6613562 -0.0484376 -0.1480934), wk = 0.0030395 k( 234) = ( 0.6648639 -0.0427669 -0.1307559), wk = 0.0030395 k( 235) = ( 0.6683717 -0.0370962 -0.1134183), wk = 0.0030395 k( 236) = ( 0.6718794 -0.0314256 -0.0960808), wk = 0.0030395 k( 237) = ( 0.6753872 -0.0257549 -0.0787432), wk = 0.0030395 k( 238) = ( 0.6788949 -0.0200842 -0.0614057), wk = 0.0030395 k( 239) = ( 0.6824027 -0.0144136 -0.0440681), wk = 0.0030395 k( 240) = ( 0.6859104 -0.0087429 -0.0267306), wk = 0.0030395 k( 241) = ( 0.6894182 -0.0030722 -0.0093930), wk = 0.0030395 k( 242) = ( 0.6929259 0.0025984 0.0079445), wk = 0.0030395 k( 243) = ( 0.6964336 0.0082691 0.0252820), wk = 0.0030395 k( 244) = ( 0.6999414 0.0139398 0.0426196), wk = 0.0030395 k( 245) = ( 0.7034491 0.0196105 0.0599571), wk = 0.0030395 k( 246) = ( 0.7069569 0.0252811 0.0772947), wk = 0.0030395 k( 247) = ( 0.7104646 0.0309518 0.0946322), wk = 0.0030395 k( 248) = ( 0.7139724 0.0366225 0.1119698), wk = 0.0030395 k( 249) = ( 0.7174801 0.0422931 0.1293073), wk = 0.0030395 k( 250) = ( 0.7209878 0.0479638 0.1466449), wk = 0.0030395 k( 251) = ( 0.7244956 0.0536345 0.1639824), wk = 0.0030395 k( 252) = ( 0.7280033 0.0593051 0.1813199), wk = 0.0030395 k( 253) = ( 0.7315111 0.0649758 0.1986575), wk = 0.0030395 k( 254) = ( 0.7350188 0.0706465 0.2159950), wk = 0.0030395 k( 255) = ( 0.7385266 0.0763171 0.2333326), wk = 0.0030395 k( 256) = ( 0.7420343 0.0819878 0.2506701), wk = 0.0030395 k( 257) = ( 0.7455420 0.0876585 0.2680077), wk = 0.0030395 k( 258) = ( 0.7490498 0.0933292 0.2853452), wk = 0.0030395 k( 259) = ( 0.7525575 0.0989998 0.3026828), wk = 0.0030395 k( 260) = ( 0.7560653 0.1046705 0.3200203), wk = 0.0030395 k( 261) = ( 0.7595730 0.1103412 0.3373579), wk = 0.0030395 k( 262) = ( 0.7630808 0.1160118 0.3546954), wk = 0.0030395 k( 263) = ( 0.7665885 0.1216825 0.3720329), wk = 0.0030395 k( 264) = ( 0.7700963 0.1273532 0.3893705), wk = 0.0030395 k( 265) = ( 0.7736040 0.1330238 0.4067080), wk = 0.0030395 k( 266) = ( 0.7771117 0.1386945 0.4240456), wk = 0.0030395 k( 267) = ( 0.7806195 0.1443652 0.4413831), wk = 0.0030395 k( 268) = ( 0.7841272 0.1500358 0.4587207), wk = 0.0030395 k( 269) = ( 0.7876350 0.1557065 0.4760583), wk = 0.0030395 k( 270) = ( 0.7911427 0.1613772 0.4933958), wk = 0.0030395 k( 271) = ( 0.7946505 0.1670478 0.5107333), wk = 0.0030395 k( 272) = ( 0.7981582 0.1727185 0.5280709), wk = 0.0030395 k( 273) = ( 0.8016659 0.1783892 0.5454084), wk = 0.0030395 k( 274) = ( 0.8051737 0.1840598 0.5627459), wk = 0.0030395 k( 275) = ( 0.8086814 0.1897305 0.5800835), wk = 0.0030395 k( 276) = ( 0.8086814 0.1897305 0.5800835), wk = 0.0030395 k( 277) = ( 0.7932474 0.1927195 0.5892219), wk = 0.0030395 k( 278) = ( 0.7778133 0.1957084 0.5983603), wk = 0.0030395 k( 279) = ( 0.7623792 0.1986974 0.6074988), wk = 0.0030395 k( 280) = ( 0.7469451 0.2016863 0.6166372), wk = 0.0030395 k( 281) = ( 0.7315111 0.2046752 0.6257756), wk = 0.0030395 k( 282) = ( 0.7160770 0.2076642 0.6349141), wk = 0.0030395 k( 283) = ( 0.7006429 0.2106531 0.6440525), wk = 0.0030395 k( 284) = ( 0.6852089 0.2136421 0.6531909), wk = 0.0030395 k( 285) = ( 0.6697748 0.2166310 0.6623293), wk = 0.0030395 k( 286) = ( 0.6543407 0.2196200 0.6714678), wk = 0.0030395 k( 287) = ( 0.6389067 0.2226089 0.6806062), wk = 0.0030395 k( 288) = ( 0.6234726 0.2255979 0.6897446), wk = 0.0030395 k( 289) = ( 0.6080385 0.2285868 0.6988830), wk = 0.0030395 k( 290) = ( 0.5926044 0.2315758 0.7080214), wk = 0.0030395 k( 291) = ( 0.5771704 0.2345647 0.7171599), wk = 0.0030395 k( 292) = ( 0.5617363 0.2375537 0.7262983), wk = 0.0030395 k( 293) = ( 0.5463022 0.2405426 0.7354368), wk = 0.0030395 k( 294) = ( 0.5308681 0.2435315 0.7445751), wk = 0.0030395 k( 295) = ( 0.5154341 0.2465205 0.7537136), wk = 0.0030395 k( 296) = ( 0.5000000 0.2495094 0.7628520), wk = 0.0030395 k( 297) = ( 0.5000000 0.2495094 0.7628520), wk = 0.0030395 k( 298) = ( 0.5000000 0.2320470 0.7685635), wk = 0.0030395 k( 299) = ( 0.5000000 0.2145846 0.7742750), wk = 0.0030395 k( 300) = ( 0.5000000 0.1971221 0.7799866), wk = 0.0030395 k( 301) = ( 0.5000000 0.1796597 0.7856981), wk = 0.0030395 k( 302) = ( 0.5000000 0.1621973 0.7914096), wk = 0.0030395 k( 303) = ( 0.5000000 0.1447348 0.7971211), wk = 0.0030395 k( 304) = ( 0.5000000 0.1272724 0.8028326), wk = 0.0030395 k( 305) = ( 0.5000000 0.1098100 0.8085441), wk = 0.0030395 k( 306) = ( 0.5000000 0.0923476 0.8142556), wk = 0.0030395 k( 307) = ( 0.5000000 0.0748851 0.8199672), wk = 0.0030395 k( 308) = ( 0.5000000 0.0574227 0.8256787), wk = 0.0030395 k( 309) = ( 0.5000000 0.0399603 0.8313902), wk = 0.0030395 k( 310) = ( 0.5000000 0.0224978 0.8371017), wk = 0.0030395 k( 311) = ( 0.5000000 0.0050354 0.8428132), wk = 0.0030395 k( 312) = ( 0.5000000 -0.0124270 0.8485247), wk = 0.0030395 k( 313) = ( 0.5000000 -0.0298895 0.8542363), wk = 0.0030395 k( 314) = ( 0.5000000 -0.0473519 0.8599478), wk = 0.0030395 k( 315) = ( 0.5000000 -0.0648143 0.8656593), wk = 0.0030395 k( 316) = ( 0.5000000 -0.0822767 0.8713708), wk = 0.0030395 k( 317) = ( 0.5000000 -0.0997392 0.8770823), wk = 0.0030395 k( 318) = ( 0.5000000 -0.1172016 0.8827938), wk = 0.0030395 k( 319) = ( 0.5000000 -0.1346640 0.8885053), wk = 0.0030395 k( 320) = ( 0.5000000 -0.1521265 0.8942169), wk = 0.0030395 k( 321) = ( 0.5000000 -0.1695889 0.8999284), wk = 0.0030395 k( 322) = ( 0.5000000 -0.1870513 0.9056399), wk = 0.0030395 k( 323) = ( 0.5000000 -0.2045138 0.9113514), wk = 0.0030395 k( 324) = ( 0.5000000 -0.2219762 0.9170629), wk = 0.0030395 k( 325) = ( 0.5000000 -0.2394386 0.9227744), wk = 0.0030395 k( 326) = ( 0.5000000 -0.2569011 0.9284860), wk = 0.0030395 k( 327) = ( 0.5000000 -0.2743635 0.9341975), wk = 0.0030395 k( 328) = ( 0.5000000 -0.2918259 0.9399090), wk = 0.0030395 k( 329) = ( 0.5000000 -0.3092883 0.9456205), wk = 0.0030395 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 2) = ( 0.0093421 -0.0176849 0.0093421), wk = 0.0030395 k( 3) = ( 0.0186843 -0.0353698 0.0186843), wk = 0.0030395 k( 4) = ( 0.0280264 -0.0530546 0.0280264), wk = 0.0030395 k( 5) = ( 0.0373686 -0.0707395 0.0373686), wk = 0.0030395 k( 6) = ( 0.0467107 -0.0884244 0.0467107), wk = 0.0030395 k( 7) = ( 0.0560529 -0.1061093 0.0560529), wk = 0.0030395 k( 8) = ( 0.0653950 -0.1237942 0.0653950), wk = 0.0030395 k( 9) = ( 0.0747371 -0.1414791 0.0747371), wk = 0.0030395 k( 10) = ( 0.0840793 -0.1591640 0.0840793), wk = 0.0030395 k( 11) = ( 0.0934214 -0.1768488 0.0934214), wk = 0.0030395 k( 12) = ( 0.1027636 -0.1945337 0.1027636), wk = 0.0030395 k( 13) = ( 0.1121057 -0.2122186 0.1121057), wk = 0.0030395 k( 14) = ( 0.1214479 -0.2299035 0.1214479), wk = 0.0030395 k( 15) = ( 0.1307900 -0.2475884 0.1307900), wk = 0.0030395 k( 16) = ( 0.1401321 -0.2652733 0.1401321), wk = 0.0030395 k( 17) = ( 0.1494743 -0.2829582 0.1494743), wk = 0.0030395 k( 18) = ( 0.1588164 -0.3006430 0.1588164), wk = 0.0030395 k( 19) = ( 0.1681586 -0.3183279 0.1681586), wk = 0.0030395 k( 20) = ( 0.1775007 -0.3360128 0.1775007), wk = 0.0030395 k( 21) = ( 0.1868429 -0.3536977 0.1868428), wk = 0.0030395 k( 22) = ( 0.1961850 -0.3713826 0.1961850), wk = 0.0030395 k( 23) = ( 0.2055271 -0.3890674 0.2055271), wk = 0.0030395 k( 24) = ( 0.2148693 -0.4067523 0.2148693), wk = 0.0030395 k( 25) = ( 0.2242114 -0.4244372 0.2242114), wk = 0.0030395 k( 26) = ( 0.2335536 -0.4421221 0.2335536), wk = 0.0030395 k( 27) = ( 0.2428957 -0.4598070 0.2428957), wk = 0.0030395 k( 28) = ( 0.2522378 -0.4774919 0.2522378), wk = 0.0030395 k( 29) = ( 0.2615800 -0.4951768 0.2615800), wk = 0.0030395 k( 30) = ( 0.2709221 -0.5128616 0.2709221), wk = 0.0030395 k( 31) = ( 0.2802643 -0.5305465 0.2802643), wk = 0.0030395 k( 32) = ( 0.2896064 -0.5482314 0.2896064), wk = 0.0030395 k( 33) = ( 0.2989486 -0.5659163 0.2989486), wk = 0.0030395 k( 34) = ( 0.3082907 -0.5836012 0.3082907), wk = 0.0030395 k( 35) = ( 0.3176329 -0.6012861 0.3176329), wk = 0.0030395 k( 36) = ( 0.3269750 -0.6189709 0.3269750), wk = 0.0030395 k( 37) = ( 0.3363171 -0.6366558 0.3363171), wk = 0.0030395 k( 38) = ( 0.3456593 -0.6543407 0.3456593), wk = 0.0030395 k( 39) = ( 0.3456593 -0.6543407 0.3456593), wk = 0.0030395 k( 40) = ( 0.3491670 -0.6508330 0.3491670), wk = 0.0030395 k( 41) = ( 0.3526748 -0.6473252 0.3526748), wk = 0.0030395 k( 42) = ( 0.3561825 -0.6438175 0.3561825), wk = 0.0030395 k( 43) = ( 0.3596903 -0.6403097 0.3596903), wk = 0.0030395 k( 44) = ( 0.3631980 -0.6368020 0.3631980), wk = 0.0030395 k( 45) = ( 0.3667057 -0.6332943 0.3667057), wk = 0.0030395 k( 46) = ( 0.3702135 -0.6297865 0.3702135), wk = 0.0030395 k( 47) = ( 0.3737212 -0.6262788 0.3737212), wk = 0.0030395 k( 48) = ( 0.3772290 -0.6227710 0.3772290), wk = 0.0030395 k( 49) = ( 0.3807367 -0.6192633 0.3807367), wk = 0.0030395 k( 50) = ( 0.3842445 -0.6157555 0.3842445), wk = 0.0030395 k( 51) = ( 0.3877522 -0.6122478 0.3877522), wk = 0.0030395 k( 52) = ( 0.3912600 -0.6087400 0.3912599), wk = 0.0030395 k( 53) = ( 0.3947677 -0.6052323 0.3947677), wk = 0.0030395 k( 54) = ( 0.3982754 -0.6017246 0.3982754), wk = 0.0030395 k( 55) = ( 0.4017832 -0.5982168 0.4017832), wk = 0.0030395 k( 56) = ( 0.4052909 -0.5947091 0.4052909), wk = 0.0030395 k( 57) = ( 0.4087987 -0.5912013 0.4087987), wk = 0.0030395 k( 58) = ( 0.4123064 -0.5876936 0.4123064), wk = 0.0030395 k( 59) = ( 0.4158141 -0.5841859 0.4158141), wk = 0.0030395 k( 60) = ( 0.4193219 -0.5806781 0.4193219), wk = 0.0030395 k( 61) = ( 0.4228296 -0.5771704 0.4228296), wk = 0.0030395 k( 62) = ( 0.4263374 -0.5736626 0.4263374), wk = 0.0030395 k( 63) = ( 0.4298451 -0.5701549 0.4298451), wk = 0.0030395 k( 64) = ( 0.4333529 -0.5666471 0.4333529), wk = 0.0030395 k( 65) = ( 0.4368606 -0.5631394 0.4368606), wk = 0.0030395 k( 66) = ( 0.4403684 -0.5596316 0.4403684), wk = 0.0030395 k( 67) = ( 0.4438761 -0.5561239 0.4438761), wk = 0.0030395 k( 68) = ( 0.4473839 -0.5526161 0.4473839), wk = 0.0030395 k( 69) = ( 0.4508916 -0.5491084 0.4508916), wk = 0.0030395 k( 70) = ( 0.4543993 -0.5456007 0.4543993), wk = 0.0030395 k( 71) = ( 0.4579071 -0.5420929 0.4579071), wk = 0.0030395 k( 72) = ( 0.4614148 -0.5385852 0.4614148), wk = 0.0030395 k( 73) = ( 0.4649226 -0.5350774 0.4649226), wk = 0.0030395 k( 74) = ( 0.4684303 -0.5315697 0.4684303), wk = 0.0030395 k( 75) = ( 0.4719380 -0.5280620 0.4719380), wk = 0.0030395 k( 76) = ( 0.4754458 -0.5245542 0.4754458), wk = 0.0030395 k( 77) = ( 0.4789535 -0.5210465 0.4789535), wk = 0.0030395 k( 78) = ( 0.4824613 -0.5175387 0.4824613), wk = 0.0030395 k( 79) = ( 0.4859690 -0.5140310 0.4859690), wk = 0.0030395 k( 80) = ( 0.4894768 -0.5105232 0.4894768), wk = 0.0030395 k( 81) = ( 0.4929845 -0.5070155 0.4929845), wk = 0.0030395 k( 82) = ( 0.4964923 -0.5035077 0.4964923), wk = 0.0030395 k( 83) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0030395 k( 84) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0030395 k( 85) = ( 0.4916573 -0.4813157 0.4916573), wk = 0.0030395 k( 86) = ( 0.4833145 -0.4626314 0.4833145), wk = 0.0030395 k( 87) = ( 0.4749718 -0.4439471 0.4749718), wk = 0.0030395 k( 88) = ( 0.4666290 -0.4252629 0.4666290), wk = 0.0030395 k( 89) = ( 0.4582863 -0.4065786 0.4582863), wk = 0.0030395 k( 90) = ( 0.4499436 -0.3878943 0.4499435), wk = 0.0030395 k( 91) = ( 0.4416008 -0.3692100 0.4416008), wk = 0.0030395 k( 92) = ( 0.4332581 -0.3505257 0.4332581), wk = 0.0030395 k( 93) = ( 0.4249153 -0.3318414 0.4249153), wk = 0.0030395 k( 94) = ( 0.4165726 -0.3131571 0.4165726), wk = 0.0030395 k( 95) = ( 0.4082298 -0.2944729 0.4082298), wk = 0.0030395 k( 96) = ( 0.3998871 -0.2757886 0.3998871), wk = 0.0030395 k( 97) = ( 0.3915444 -0.2571043 0.3915444), wk = 0.0030395 k( 98) = ( 0.3832016 -0.2384200 0.3832016), wk = 0.0030395 k( 99) = ( 0.3748589 -0.2197357 0.3748589), wk = 0.0030395 k( 100) = ( 0.3665161 -0.2010514 0.3665161), wk = 0.0030395 k( 101) = ( 0.3581734 -0.1823671 0.3581734), wk = 0.0030395 k( 102) = ( 0.3498307 -0.1636829 0.3498307), wk = 0.0030395 k( 103) = ( 0.3414879 -0.1449986 0.3414879), wk = 0.0030395 k( 104) = ( 0.3331452 -0.1263143 0.3331452), wk = 0.0030395 k( 105) = ( 0.3248024 -0.1076300 0.3248024), wk = 0.0030395 k( 106) = ( 0.3164597 -0.0889457 0.3164597), wk = 0.0030395 k( 107) = ( 0.3081169 -0.0702614 0.3081169), wk = 0.0030395 k( 108) = ( 0.2997742 -0.0515771 0.2997742), wk = 0.0030395 k( 109) = ( 0.2914315 -0.0328929 0.2914315), wk = 0.0030395 k( 110) = ( 0.2830887 -0.0142086 0.2830887), wk = 0.0030395 k( 111) = ( 0.2747460 0.0044757 0.2747460), wk = 0.0030395 k( 112) = ( 0.2664032 0.0231600 0.2664032), wk = 0.0030395 k( 113) = ( 0.2580605 0.0418443 0.2580605), wk = 0.0030395 k( 114) = ( 0.2497177 0.0605286 0.2497178), wk = 0.0030395 k( 115) = ( 0.2413750 0.0792128 0.2413750), wk = 0.0030395 k( 116) = ( 0.2330323 0.0978971 0.2330323), wk = 0.0030395 k( 117) = ( 0.2246895 0.1165814 0.2246895), wk = 0.0030395 k( 118) = ( 0.2163468 0.1352657 0.2163468), wk = 0.0030395 k( 119) = ( 0.2080040 0.1539500 0.2080040), wk = 0.0030395 k( 120) = ( 0.1996613 0.1726343 0.1996613), wk = 0.0030395 k( 121) = ( 0.1913186 0.1913186 0.1913186), wk = 0.0030395 k( 122) = ( 0.1913186 0.1913186 0.1913186), wk = 0.0030395 k( 123) = ( 0.1878400 0.1878400 0.1878400), wk = 0.0030395 k( 124) = ( 0.1843615 0.1843615 0.1843615), wk = 0.0030395 k( 125) = ( 0.1808830 0.1808830 0.1808830), wk = 0.0030395 k( 126) = ( 0.1774045 0.1774045 0.1774045), wk = 0.0030395 k( 127) = ( 0.1739260 0.1739260 0.1739260), wk = 0.0030395 k( 128) = ( 0.1704475 0.1704474 0.1704475), wk = 0.0030395 k( 129) = ( 0.1669689 0.1669689 0.1669689), wk = 0.0030395 k( 130) = ( 0.1634904 0.1634904 0.1634904), wk = 0.0030395 k( 131) = ( 0.1600119 0.1600119 0.1600119), wk = 0.0030395 k( 132) = ( 0.1565334 0.1565334 0.1565334), wk = 0.0030395 k( 133) = ( 0.1530548 0.1530548 0.1530548), wk = 0.0030395 k( 134) = ( 0.1495763 0.1495763 0.1495763), wk = 0.0030395 k( 135) = ( 0.1460978 0.1460978 0.1460978), wk = 0.0030395 k( 136) = ( 0.1426193 0.1426193 0.1426193), wk = 0.0030395 k( 137) = ( 0.1391408 0.1391408 0.1391408), wk = 0.0030395 k( 138) = ( 0.1356623 0.1356622 0.1356623), wk = 0.0030395 k( 139) = ( 0.1321837 0.1321837 0.1321837), wk = 0.0030395 k( 140) = ( 0.1287052 0.1287052 0.1287052), wk = 0.0030395 k( 141) = ( 0.1252267 0.1252267 0.1252267), wk = 0.0030395 k( 142) = ( 0.1217482 0.1217482 0.1217482), wk = 0.0030395 k( 143) = ( 0.1182697 0.1182697 0.1182697), wk = 0.0030395 k( 144) = ( 0.1147911 0.1147911 0.1147911), wk = 0.0030395 k( 145) = ( 0.1113126 0.1113126 0.1113126), wk = 0.0030395 k( 146) = ( 0.1078341 0.1078341 0.1078341), wk = 0.0030395 k( 147) = ( 0.1043556 0.1043556 0.1043556), wk = 0.0030395 k( 148) = ( 0.1008771 0.1008771 0.1008771), wk = 0.0030395 k( 149) = ( 0.0973985 0.0973985 0.0973985), wk = 0.0030395 k( 150) = ( 0.0939200 0.0939200 0.0939200), wk = 0.0030395 k( 151) = ( 0.0904415 0.0904415 0.0904415), wk = 0.0030395 k( 152) = ( 0.0869630 0.0869630 0.0869630), wk = 0.0030395 k( 153) = ( 0.0834845 0.0834845 0.0834845), wk = 0.0030395 k( 154) = ( 0.0800059 0.0800059 0.0800059), wk = 0.0030395 k( 155) = ( 0.0765274 0.0765274 0.0765274), wk = 0.0030395 k( 156) = ( 0.0730489 0.0730489 0.0730489), wk = 0.0030395 k( 157) = ( 0.0695704 0.0695704 0.0695704), wk = 0.0030395 k( 158) = ( 0.0660919 0.0660919 0.0660919), wk = 0.0030395 k( 159) = ( 0.0626133 0.0626134 0.0626133), wk = 0.0030395 k( 160) = ( 0.0591348 0.0591348 0.0591348), wk = 0.0030395 k( 161) = ( 0.0556563 0.0556563 0.0556563), wk = 0.0030395 k( 162) = ( 0.0521778 0.0521778 0.0521778), wk = 0.0030395 k( 163) = ( 0.0486993 0.0486993 0.0486993), wk = 0.0030395 k( 164) = ( 0.0452207 0.0452207 0.0452208), wk = 0.0030395 k( 165) = ( 0.0417422 0.0417422 0.0417422), wk = 0.0030395 k( 166) = ( 0.0382637 0.0382637 0.0382637), wk = 0.0030395 k( 167) = ( 0.0347852 0.0347852 0.0347852), wk = 0.0030395 k( 168) = ( 0.0313067 0.0313067 0.0313067), wk = 0.0030395 k( 169) = ( 0.0278281 0.0278281 0.0278281), wk = 0.0030395 k( 170) = ( 0.0243496 0.0243496 0.0243496), wk = 0.0030395 k( 171) = ( 0.0208711 0.0208711 0.0208711), wk = 0.0030395 k( 172) = ( 0.0173926 0.0173926 0.0173926), wk = 0.0030395 k( 173) = ( 0.0139141 0.0139141 0.0139141), wk = 0.0030395 k( 174) = ( 0.0104356 0.0104356 0.0104356), wk = 0.0030395 k( 175) = ( 0.0069570 0.0069570 0.0069570), wk = 0.0030395 k( 176) = ( 0.0034785 0.0034785 0.0034785), wk = 0.0030395 k( 177) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 178) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0030395 k( 179) = ( 0.0156250 -0.0156250 -0.0000000), wk = 0.0030395 k( 180) = ( 0.0312500 -0.0312500 -0.0000000), wk = 0.0030395 k( 181) = ( 0.0468750 -0.0468750 -0.0000000), wk = 0.0030395 k( 182) = ( 0.0625000 -0.0625000 -0.0000000), wk = 0.0030395 k( 183) = ( 0.0781250 -0.0781250 -0.0000000), wk = 0.0030395 k( 184) = ( 0.0937500 -0.0937500 -0.0000000), wk = 0.0030395 k( 185) = ( 0.1093750 -0.1093750 -0.0000000), wk = 0.0030395 k( 186) = ( 0.1250000 -0.1250000 -0.0000000), wk = 0.0030395 k( 187) = ( 0.1406250 -0.1406250 -0.0000000), wk = 0.0030395 k( 188) = ( 0.1562500 -0.1562500 -0.0000000), wk = 0.0030395 k( 189) = ( 0.1718750 -0.1718750 -0.0000000), wk = 0.0030395 k( 190) = ( 0.1875000 -0.1875000 -0.0000000), wk = 0.0030395 k( 191) = ( 0.2031250 -0.2031250 -0.0000000), wk = 0.0030395 k( 192) = ( 0.2187500 -0.2187500 -0.0000000), wk = 0.0030395 k( 193) = ( 0.2343750 -0.2343750 -0.0000000), wk = 0.0030395 k( 194) = ( 0.2500000 -0.2500000 -0.0000000), wk = 0.0030395 k( 195) = ( 0.2656250 -0.2656250 -0.0000000), wk = 0.0030395 k( 196) = ( 0.2812500 -0.2812500 -0.0000000), wk = 0.0030395 k( 197) = ( 0.2968750 -0.2968750 -0.0000000), wk = 0.0030395 k( 198) = ( 0.3125000 -0.3125000 -0.0000000), wk = 0.0030395 k( 199) = ( 0.3281250 -0.3281250 -0.0000000), wk = 0.0030395 k( 200) = ( 0.3437500 -0.3437500 -0.0000000), wk = 0.0030395 k( 201) = ( 0.3593750 -0.3593750 -0.0000000), wk = 0.0030395 k( 202) = ( 0.3750000 -0.3750000 -0.0000000), wk = 0.0030395 k( 203) = ( 0.3906250 -0.3906250 -0.0000000), wk = 0.0030395 k( 204) = ( 0.4062500 -0.4062500 -0.0000000), wk = 0.0030395 k( 205) = ( 0.4218750 -0.4218750 -0.0000000), wk = 0.0030395 k( 206) = ( 0.4375000 -0.4375000 -0.0000000), wk = 0.0030395 k( 207) = ( 0.4531250 -0.4531250 -0.0000000), wk = 0.0030395 k( 208) = ( 0.4687500 -0.4687500 -0.0000000), wk = 0.0030395 k( 209) = ( 0.4843750 -0.4843750 -0.0000000), wk = 0.0030395 k( 210) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0030395 k( 211) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0030395 k( 212) = ( 0.5081232 -0.4918768 -0.0181926), wk = 0.0030395 k( 213) = ( 0.5162464 -0.4837536 -0.0363852), wk = 0.0030395 k( 214) = ( 0.5243696 -0.4756304 -0.0545778), wk = 0.0030395 k( 215) = ( 0.5324928 -0.4675072 -0.0727704), wk = 0.0030395 k( 216) = ( 0.5406160 -0.4593840 -0.0909630), wk = 0.0030395 k( 217) = ( 0.5487392 -0.4512608 -0.1091556), wk = 0.0030395 k( 218) = ( 0.5568624 -0.4431376 -0.1273482), wk = 0.0030395 k( 219) = ( 0.5649856 -0.4350144 -0.1455408), wk = 0.0030395 k( 220) = ( 0.5731088 -0.4268912 -0.1637333), wk = 0.0030395 k( 221) = ( 0.5812320 -0.4187680 -0.1819259), wk = 0.0030395 k( 222) = ( 0.5893552 -0.4106448 -0.2001185), wk = 0.0030395 k( 223) = ( 0.5974784 -0.4025216 -0.2183111), wk = 0.0030395 k( 224) = ( 0.6056015 -0.3943985 -0.2365037), wk = 0.0030395 k( 225) = ( 0.6137247 -0.3862753 -0.2546963), wk = 0.0030395 k( 226) = ( 0.6218479 -0.3781521 -0.2728889), wk = 0.0030395 k( 227) = ( 0.6299711 -0.3700289 -0.2910815), wk = 0.0030395 k( 228) = ( 0.6380943 -0.3619057 -0.3092741), wk = 0.0030395 k( 229) = ( 0.6462175 -0.3537825 -0.3274667), wk = 0.0030395 k( 230) = ( 0.6543407 -0.3456593 -0.3456593), wk = 0.0030395 k( 231) = ( 0.6543407 -0.3456593 -0.3456593), wk = 0.0030395 k( 232) = ( 0.6578485 -0.3421515 -0.3421515), wk = 0.0030395 k( 233) = ( 0.6613562 -0.3386438 -0.3386438), wk = 0.0030395 k( 234) = ( 0.6648639 -0.3351360 -0.3351361), wk = 0.0030395 k( 235) = ( 0.6683717 -0.3316283 -0.3316283), wk = 0.0030395 k( 236) = ( 0.6718794 -0.3281206 -0.3281206), wk = 0.0030395 k( 237) = ( 0.6753872 -0.3246128 -0.3246128), wk = 0.0030395 k( 238) = ( 0.6788949 -0.3211051 -0.3211051), wk = 0.0030395 k( 239) = ( 0.6824027 -0.3175973 -0.3175973), wk = 0.0030395 k( 240) = ( 0.6859104 -0.3140896 -0.3140896), wk = 0.0030395 k( 241) = ( 0.6894182 -0.3105818 -0.3105818), wk = 0.0030395 k( 242) = ( 0.6929259 -0.3070741 -0.3070741), wk = 0.0030395 k( 243) = ( 0.6964336 -0.3035664 -0.3035664), wk = 0.0030395 k( 244) = ( 0.6999414 -0.3000586 -0.3000586), wk = 0.0030395 k( 245) = ( 0.7034491 -0.2965509 -0.2965509), wk = 0.0030395 k( 246) = ( 0.7069569 -0.2930431 -0.2930431), wk = 0.0030395 k( 247) = ( 0.7104646 -0.2895354 -0.2895354), wk = 0.0030395 k( 248) = ( 0.7139724 -0.2860276 -0.2860276), wk = 0.0030395 k( 249) = ( 0.7174801 -0.2825199 -0.2825199), wk = 0.0030395 k( 250) = ( 0.7209878 -0.2790121 -0.2790122), wk = 0.0030395 k( 251) = ( 0.7244956 -0.2755044 -0.2755044), wk = 0.0030395 k( 252) = ( 0.7280033 -0.2719967 -0.2719967), wk = 0.0030395 k( 253) = ( 0.7315111 -0.2684889 -0.2684889), wk = 0.0030395 k( 254) = ( 0.7350188 -0.2649812 -0.2649812), wk = 0.0030395 k( 255) = ( 0.7385266 -0.2614734 -0.2614734), wk = 0.0030395 k( 256) = ( 0.7420343 -0.2579657 -0.2579657), wk = 0.0030395 k( 257) = ( 0.7455420 -0.2544579 -0.2544580), wk = 0.0030395 k( 258) = ( 0.7490498 -0.2509502 -0.2509502), wk = 0.0030395 k( 259) = ( 0.7525575 -0.2474425 -0.2474425), wk = 0.0030395 k( 260) = ( 0.7560653 -0.2439347 -0.2439347), wk = 0.0030395 k( 261) = ( 0.7595730 -0.2404270 -0.2404270), wk = 0.0030395 k( 262) = ( 0.7630808 -0.2369192 -0.2369192), wk = 0.0030395 k( 263) = ( 0.7665885 -0.2334115 -0.2334115), wk = 0.0030395 k( 264) = ( 0.7700963 -0.2299037 -0.2299037), wk = 0.0030395 k( 265) = ( 0.7736040 -0.2263960 -0.2263960), wk = 0.0030395 k( 266) = ( 0.7771117 -0.2228883 -0.2228883), wk = 0.0030395 k( 267) = ( 0.7806195 -0.2193805 -0.2193805), wk = 0.0030395 k( 268) = ( 0.7841272 -0.2158728 -0.2158728), wk = 0.0030395 k( 269) = ( 0.7876350 -0.2123650 -0.2123650), wk = 0.0030395 k( 270) = ( 0.7911427 -0.2088573 -0.2088573), wk = 0.0030395 k( 271) = ( 0.7946505 -0.2053495 -0.2053495), wk = 0.0030395 k( 272) = ( 0.7981582 -0.2018418 -0.2018418), wk = 0.0030395 k( 273) = ( 0.8016659 -0.1983341 -0.1983341), wk = 0.0030395 k( 274) = ( 0.8051737 -0.1948263 -0.1948263), wk = 0.0030395 k( 275) = ( 0.8086814 -0.1913186 -0.1913186), wk = 0.0030395 k( 276) = ( 0.8086814 -0.1913186 -0.1913186), wk = 0.0030395 k( 277) = ( 0.7932474 -0.1817526 -0.1817526), wk = 0.0030395 k( 278) = ( 0.7778133 -0.1721867 -0.1721867), wk = 0.0030395 k( 279) = ( 0.7623792 -0.1626208 -0.1626208), wk = 0.0030395 k( 280) = ( 0.7469451 -0.1530548 -0.1530549), wk = 0.0030395 k( 281) = ( 0.7315111 -0.1434889 -0.1434889), wk = 0.0030395 k( 282) = ( 0.7160770 -0.1339230 -0.1339230), wk = 0.0030395 k( 283) = ( 0.7006429 -0.1243571 -0.1243571), wk = 0.0030395 k( 284) = ( 0.6852089 -0.1147911 -0.1147911), wk = 0.0030395 k( 285) = ( 0.6697748 -0.1052252 -0.1052252), wk = 0.0030395 k( 286) = ( 0.6543407 -0.0956593 -0.0956593), wk = 0.0030395 k( 287) = ( 0.6389067 -0.0860933 -0.0860934), wk = 0.0030395 k( 288) = ( 0.6234726 -0.0765274 -0.0765274), wk = 0.0030395 k( 289) = ( 0.6080385 -0.0669615 -0.0669615), wk = 0.0030395 k( 290) = ( 0.5926044 -0.0573956 -0.0573956), wk = 0.0030395 k( 291) = ( 0.5771704 -0.0478296 -0.0478296), wk = 0.0030395 k( 292) = ( 0.5617363 -0.0382637 -0.0382637), wk = 0.0030395 k( 293) = ( 0.5463022 -0.0286978 -0.0286978), wk = 0.0030395 k( 294) = ( 0.5308681 -0.0191319 -0.0191319), wk = 0.0030395 k( 295) = ( 0.5154341 -0.0095659 -0.0095659), wk = 0.0030395 k( 296) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0030395 k( 297) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0030395 k( 298) = ( 0.5000000 -0.0156250 0.0156250), wk = 0.0030395 k( 299) = ( 0.5000000 -0.0312500 0.0312500), wk = 0.0030395 k( 300) = ( 0.5000000 -0.0468750 0.0468750), wk = 0.0030395 k( 301) = ( 0.5000000 -0.0625000 0.0625000), wk = 0.0030395 k( 302) = ( 0.5000000 -0.0781250 0.0781250), wk = 0.0030395 k( 303) = ( 0.5000000 -0.0937500 0.0937500), wk = 0.0030395 k( 304) = ( 0.5000000 -0.1093750 0.1093750), wk = 0.0030395 k( 305) = ( 0.5000000 -0.1250000 0.1250000), wk = 0.0030395 k( 306) = ( 0.5000000 -0.1406250 0.1406250), wk = 0.0030395 k( 307) = ( 0.5000000 -0.1562500 0.1562500), wk = 0.0030395 k( 308) = ( 0.5000000 -0.1718750 0.1718750), wk = 0.0030395 k( 309) = ( 0.5000000 -0.1875000 0.1875000), wk = 0.0030395 k( 310) = ( 0.5000000 -0.2031250 0.2031250), wk = 0.0030395 k( 311) = ( 0.5000000 -0.2187500 0.2187500), wk = 0.0030395 k( 312) = ( 0.5000000 -0.2343750 0.2343750), wk = 0.0030395 k( 313) = ( 0.5000000 -0.2500000 0.2500000), wk = 0.0030395 k( 314) = ( 0.5000000 -0.2656250 0.2656250), wk = 0.0030395 k( 315) = ( 0.5000000 -0.2812500 0.2812500), wk = 0.0030395 k( 316) = ( 0.5000000 -0.2968750 0.2968750), wk = 0.0030395 k( 317) = ( 0.5000000 -0.3125000 0.3125000), wk = 0.0030395 k( 318) = ( 0.5000000 -0.3281250 0.3281250), wk = 0.0030395 k( 319) = ( 0.5000000 -0.3437500 0.3437500), wk = 0.0030395 k( 320) = ( 0.5000000 -0.3593750 0.3593750), wk = 0.0030395 k( 321) = ( 0.5000000 -0.3750000 0.3750000), wk = 0.0030395 k( 322) = ( 0.5000000 -0.3906250 0.3906250), wk = 0.0030395 k( 323) = ( 0.5000000 -0.4062500 0.4062500), wk = 0.0030395 k( 324) = ( 0.5000000 -0.4218750 0.4218750), wk = 0.0030395 k( 325) = ( 0.5000000 -0.4375000 0.4375000), wk = 0.0030395 k( 326) = ( 0.5000000 -0.4531250 0.4531250), wk = 0.0030395 k( 327) = ( 0.5000000 -0.4687500 0.4687500), wk = 0.0030395 k( 328) = ( 0.5000000 -0.4843750 0.4843750), wk = 0.0030395 k( 329) = ( 0.5000000 -0.5000000 0.5000000), wk = 0.0030395 Dense grid: 39863 G-vectors FFT dimensions: ( 60, 60, 60) Smooth grid: 23757 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.18 Mb ( 200, 58) NL pseudopotentials 0.22 Mb ( 100, 144) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.01 Mb ( 1246) G-vector shells 0.01 Mb ( 928) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.71 Mb ( 200, 232) Each subspace H/S matrix 0.82 Mb ( 232, 232) Each matrix 0.25 Mb ( 144, 2, 58) The potential is recalculated from file : ./NiSe.save/charge-density.dat Starting wfc are 78 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.7 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 7.4 secs Computing kpt #: 3 total cpu time spent up to now is 8.9 secs Computing kpt #: 4 total cpu time spent up to now is 10.9 secs Computing kpt #: 5 total cpu time spent up to now is 12.8 secs Computing kpt #: 6 total cpu time spent up to now is 14.3 secs Computing kpt #: 7 total cpu time spent up to now is 15.8 secs Computing kpt #: 8 total cpu time spent up to now is 17.3 secs Computing kpt #: 9 total cpu time spent up to now is 18.9 secs Computing kpt #: 10 total cpu time spent up to now is 20.4 secs Computing kpt #: 11 total cpu time spent up to now is 21.9 secs Computing kpt #: 12 total cpu time spent up to now is 23.3 secs Computing kpt #: 13 total cpu time spent up to now is 24.8 secs Computing kpt #: 14 total cpu time spent up to now is 26.2 secs Computing kpt #: 15 total cpu time spent up to now is 27.5 secs Computing kpt #: 16 total cpu time spent up to now is 28.8 secs Computing kpt #: 17 total cpu time spent up to now is 30.1 secs Computing kpt #: 18 total cpu time spent up to now is 31.4 secs Computing kpt #: 19 total cpu time spent up to now is 32.6 secs Computing kpt #: 20 total cpu time spent up to now is 33.8 secs Computing kpt #: 21 total cpu time spent up to now is 35.1 secs Computing kpt #: 22 total cpu time spent up to now is 36.3 secs Computing kpt #: 23 total cpu time spent up to now is 37.5 secs Computing kpt #: 24 total cpu time spent up to now is 38.8 secs Computing kpt #: 25 total cpu time spent up to now is 40.0 secs Computing kpt #: 26 total cpu time spent up to now is 41.3 secs Computing kpt #: 27 total cpu time spent up to now is 42.5 secs Computing kpt #: 28 total cpu time spent up to now is 43.8 secs Computing kpt #: 29 total cpu time spent up to now is 45.0 secs Computing kpt #: 30 total cpu time spent up to now is 46.3 secs Computing kpt #: 31 total cpu time spent up to now is 47.6 secs Computing kpt #: 32 total cpu time spent up to now is 48.9 secs Computing kpt #: 33 total cpu time spent up to now is 50.3 secs Computing kpt #: 34 total cpu time spent up to now is 51.6 secs Computing kpt #: 35 total cpu time spent up to now is 53.2 secs Computing kpt #: 36 total cpu time spent up to now is 54.6 secs Computing kpt #: 37 total cpu time spent up to now is 55.9 secs Computing kpt #: 38 total cpu time spent up to now is 57.3 secs Computing kpt #: 39 total cpu time spent up to now is 59.1 secs Computing kpt #: 40 total cpu time spent up to now is 60.5 secs Computing kpt #: 41 total cpu time spent up to now is 62.1 secs Computing kpt #: 42 total cpu time spent up to now is 63.4 secs Computing kpt #: 43 total cpu time spent up to now is 64.7 secs Computing kpt #: 44 total cpu time spent up to now is 66.1 secs Computing kpt #: 45 total cpu time spent up to now is 67.4 secs Computing kpt #: 46 total cpu time spent up to now is 68.7 secs Computing kpt #: 47 total cpu time spent up to now is 70.1 secs Computing kpt #: 48 total cpu time spent up to now is 71.4 secs Computing kpt #: 49 total cpu time spent up to now is 72.8 secs Computing kpt #: 50 total cpu time spent up to now is 74.1 secs Computing kpt #: 51 total cpu time spent up to now is 75.5 secs Computing kpt #: 52 total cpu time spent up to now is 76.8 secs Computing kpt #: 53 total cpu time spent up to now is 78.5 secs Computing kpt #: 54 total cpu time spent up to now is 79.9 secs Computing kpt #: 55 total cpu time spent up to now is 81.2 secs Computing kpt #: 56 total cpu time spent up to now is 82.4 secs Computing kpt #: 57 total cpu time spent up to now is 83.7 secs Computing kpt #: 58 total cpu time spent up to now is 84.8 secs Computing kpt #: 59 total cpu time spent up to now is 86.0 secs Computing kpt #: 60 total cpu time spent up to now is 87.1 secs Computing kpt #: 61 total cpu time spent up to now is 88.4 secs Computing kpt #: 62 total cpu time spent up to now is 89.7 secs Computing kpt #: 63 total cpu time spent up to now is 91.3 secs Computing kpt #: 64 total cpu time spent up to now is 93.0 secs Computing kpt #: 65 total cpu time spent up to now is 95.2 secs Computing kpt #: 66 total cpu time spent up to now is 96.7 secs Computing kpt #: 67 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 99.4 secs Computing kpt #: 68 total cpu time spent up to now is 100.8 secs Computing kpt #: 69 total cpu time spent up to now is 102.6 secs Computing kpt #: 70 total cpu time spent up to now is 104.9 secs Computing kpt #: 71 total cpu time spent up to now is 106.8 secs Computing kpt #: 72 total cpu time spent up to now is 108.7 secs Computing kpt #: 73 total cpu time spent up to now is 110.6 secs Computing kpt #: 74 total cpu time spent up to now is 112.5 secs Computing kpt #: 75 total cpu time spent up to now is 114.2 secs Computing kpt #: 76 total cpu time spent up to now is 115.8 secs Computing kpt #: 77 total cpu time spent up to now is 117.4 secs Computing kpt #: 78 total cpu time spent up to now is 119.0 secs Computing kpt #: 79 total cpu time spent up to now is 120.6 secs Computing kpt #: 80 total cpu time spent up to now is 122.2 secs Computing kpt #: 81 total cpu time spent up to now is 123.8 secs Computing kpt #: 82 total cpu time spent up to now is 125.4 secs Computing kpt #: 83 total cpu time spent up to now is 127.0 secs Computing kpt #: 84 total cpu time spent up to now is 128.5 secs Computing kpt #: 85 total cpu time spent up to now is 130.2 secs Computing kpt #: 86 total cpu time spent up to now is 132.1 secs Computing kpt #: 87 total cpu time spent up to now is 133.7 secs Computing kpt #: 88 total cpu time spent up to now is 135.2 secs Computing kpt #: 89 total cpu time spent up to now is 136.8 secs Computing kpt #: 90 total cpu time spent up to now is 138.4 secs Computing kpt #: 91 total cpu time spent up to now is 140.0 secs Computing kpt #: 92 total cpu time spent up to now is 141.6 secs Computing kpt #: 93 total cpu time spent up to now is 143.2 secs Computing kpt #: 94 total cpu time spent up to now is 144.8 secs Computing kpt #: 95 total cpu time spent up to now is 146.7 secs Computing kpt #: 96 total cpu time spent up to now is 148.4 secs Computing kpt #: 97 total cpu time spent up to now is 150.0 secs Computing kpt #: 98 total cpu time spent up to now is 151.7 secs Computing kpt #: 99 total cpu time spent up to now is 153.3 secs Computing kpt #: 100 total cpu time spent up to now is 154.9 secs Computing kpt #: 101 total cpu time spent up to now is 156.5 secs Computing kpt #: 102 total cpu time spent up to now is 158.0 secs Computing kpt #: 103 total cpu time spent up to now is 159.6 secs Computing kpt #: 104 total cpu time spent up to now is 161.1 secs Computing kpt #: 105 total cpu time spent up to now is 162.7 secs Computing kpt #: 106 total cpu time spent up to now is 164.0 secs Computing kpt #: 107 total cpu time spent up to now is 165.4 secs Computing kpt #: 108 total cpu time spent up to now is 166.7 secs Computing kpt #: 109 total cpu time spent up to now is 168.0 secs Computing kpt #: 110 total cpu time spent up to now is 169.3 secs Computing kpt #: 111 total cpu time spent up to now is 170.7 secs Computing kpt #: 112 total cpu time spent up to now is 172.1 secs Computing kpt #: 113 total cpu time spent up to now is 173.5 secs Computing kpt #: 114 total cpu time spent up to now is 174.8 secs Computing kpt #: 115 total cpu time spent up to now is 176.2 secs Computing kpt #: 116 total cpu time spent up to now is 177.5 secs Computing kpt #: 117 total cpu time spent up to now is 178.9 secs Computing kpt #: 118 total cpu time spent up to now is 180.2 secs Computing kpt #: 119 total cpu time spent up to now is 181.6 secs Computing kpt #: 120 total cpu time spent up to now is 183.2 secs Computing kpt #: 121 total cpu time spent up to now is 184.7 secs Computing kpt #: 122 total cpu time spent up to now is 186.0 secs Computing kpt #: 123 total cpu time spent up to now is 187.5 secs Computing kpt #: 124 total cpu time spent up to now is 189.1 secs Computing kpt #: 125 total cpu time spent up to now is 190.6 secs Computing kpt #: 126 total cpu time spent up to now is 192.2 secs Computing kpt #: 127 total cpu time spent up to now is 193.7 secs Computing kpt #: 128 total cpu time spent up to now is 195.0 secs Computing kpt #: 129 total cpu time spent up to now is 196.2 secs Computing kpt #: 130 total cpu time spent up to now is 197.8 secs Computing kpt #: 131 total cpu time spent up to now is 199.3 secs Computing kpt #: 132 total cpu time spent up to now is 200.9 secs Computing kpt #: 133 total cpu time spent up to now is 202.3 secs Computing kpt #: 134 total cpu time spent up to now is 203.7 secs Computing kpt #: 135 total cpu time spent up to now is 205.2 secs Computing kpt #: 136 total cpu time spent up to now is 206.7 secs Computing kpt #: 137 total cpu time spent up to now is 208.0 secs Computing kpt #: 138 total cpu time spent up to now is 209.5 secs Computing kpt #: 139 total cpu time spent up to now is 211.1 secs Computing kpt #: 140 total cpu time spent up to now is 212.4 secs Computing kpt #: 141 total cpu time spent up to now is 213.9 secs Computing kpt #: 142 total cpu time spent up to now is 215.2 secs Computing kpt #: 143 total cpu time spent up to now is 216.5 secs Computing kpt #: 144 total cpu time spent up to now is 217.8 secs Computing kpt #: 145 total cpu time spent up to now is 219.1 secs Computing kpt #: 146 total cpu time spent up to now is 220.4 secs Computing kpt #: 147 total cpu time spent up to now is 221.7 secs Computing kpt #: 148 total cpu time spent up to now is 223.0 secs Computing kpt #: 149 total cpu time spent up to now is 224.3 secs Computing kpt #: 150 total cpu time spent up to now is 225.7 secs Computing kpt #: 151 total cpu time spent up to now is 227.0 secs Computing kpt #: 152 total cpu time spent up to now is 228.3 secs Computing kpt #: 153 total cpu time spent up to now is 229.6 secs Computing kpt #: 154 total cpu time spent up to now is 230.8 secs Computing kpt #: 155 total cpu time spent up to now is 232.0 secs Computing kpt #: 156 total cpu time spent up to now is 233.2 secs Computing kpt #: 157 total cpu time spent up to now is 234.4 secs Computing kpt #: 158 total cpu time spent up to now is 235.6 secs Computing kpt #: 159 total cpu time spent up to now is 236.7 secs Computing kpt #: 160 total cpu time spent up to now is 237.9 secs Computing kpt #: 161 total cpu time spent up to now is 239.1 secs Computing kpt #: 162 total cpu time spent up to now is 240.3 secs Computing kpt #: 163 total cpu time spent up to now is 241.5 secs Computing kpt #: 164 total cpu time spent up to now is 242.6 secs Computing kpt #: 165 total cpu time spent up to now is 243.8 secs Computing kpt #: 166 total cpu time spent up to now is 245.0 secs Computing kpt #: 167 total cpu time spent up to now is 246.4 secs Computing kpt #: 168 total cpu time spent up to now is 247.9 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 250.6 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 253.3 secs Computing kpt #: 171 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 256.0 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 258.7 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 261.3 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 264.0 secs Computing kpt #: 175 total cpu time spent up to now is 266.0 secs Computing kpt #: 176 total cpu time spent up to now is 267.9 secs Computing kpt #: 177 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 270.4 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 272.8 secs Computing kpt #: 179 total cpu time spent up to now is 275.4 secs Computing kpt #: 180 total cpu time spent up to now is 277.9 secs Computing kpt #: 181 total cpu time spent up to now is 279.8 secs Computing kpt #: 182 total cpu time spent up to now is 281.4 secs Computing kpt #: 183 total cpu time spent up to now is 283.0 secs Computing kpt #: 184 total cpu time spent up to now is 284.5 secs Computing kpt #: 185 total cpu time spent up to now is 286.1 secs Computing kpt #: 186 total cpu time spent up to now is 287.6 secs Computing kpt #: 187 total cpu time spent up to now is 289.1 secs Computing kpt #: 188 total cpu time spent up to now is 290.7 secs Computing kpt #: 189 total cpu time spent up to now is 292.0 secs Computing kpt #: 190 total cpu time spent up to now is 293.3 secs Computing kpt #: 191 total cpu time spent up to now is 294.7 secs Computing kpt #: 192 total cpu time spent up to now is 296.0 secs Computing kpt #: 193 total cpu time spent up to now is 297.2 secs Computing kpt #: 194 total cpu time spent up to now is 298.4 secs Computing kpt #: 195 total cpu time spent up to now is 299.7 secs Computing kpt #: 196 total cpu time spent up to now is 300.9 secs Computing kpt #: 197 total cpu time spent up to now is 302.1 secs Computing kpt #: 198 total cpu time spent up to now is 303.3 secs Computing kpt #: 199 total cpu time spent up to now is 304.5 secs Computing kpt #: 200 total cpu time spent up to now is 305.8 secs Computing kpt #: 201 total cpu time spent up to now is 307.0 secs Computing kpt #: 202 total cpu time spent up to now is 308.2 secs Computing kpt #: 203 total cpu time spent up to now is 309.5 secs Computing kpt #: 204 total cpu time spent up to now is 310.7 secs Computing kpt #: 205 total cpu time spent up to now is 311.9 secs Computing kpt #: 206 total cpu time spent up to now is 313.2 secs Computing kpt #: 207 total cpu time spent up to now is 314.4 secs Computing kpt #: 208 total cpu time spent up to now is 315.7 secs Computing kpt #: 209 total cpu time spent up to now is 316.9 secs Computing kpt #: 210 total cpu time spent up to now is 318.1 secs Computing kpt #: 211 total cpu time spent up to now is 319.3 secs Computing kpt #: 212 total cpu time spent up to now is 320.6 secs Computing kpt #: 213 total cpu time spent up to now is 321.8 secs Computing kpt #: 214 total cpu time spent up to now is 323.0 secs Computing kpt #: 215 total cpu time spent up to now is 324.3 secs Computing kpt #: 216 total cpu time spent up to now is 325.5 secs Computing kpt #: 217 total cpu time spent up to now is 326.8 secs Computing kpt #: 218 total cpu time spent up to now is 328.0 secs Computing kpt #: 219 total cpu time spent up to now is 329.3 secs Computing kpt #: 220 total cpu time spent up to now is 330.5 secs Computing kpt #: 221 total cpu time spent up to now is 331.8 secs Computing kpt #: 222 total cpu time spent up to now is 333.1 secs Computing kpt #: 223 total cpu time spent up to now is 334.4 secs Computing kpt #: 224 total cpu time spent up to now is 335.6 secs Computing kpt #: 225 total cpu time spent up to now is 337.0 secs Computing kpt #: 226 total cpu time spent up to now is 338.3 secs Computing kpt #: 227 total cpu time spent up to now is 339.9 secs Computing kpt #: 228 total cpu time spent up to now is 341.2 secs Computing kpt #: 229 total cpu time spent up to now is 342.6 secs Computing kpt #: 230 total cpu time spent up to now is 343.9 secs Computing kpt #: 231 total cpu time spent up to now is 345.2 secs Computing kpt #: 232 total cpu time spent up to now is 346.5 secs Computing kpt #: 233 total cpu time spent up to now is 347.9 secs Computing kpt #: 234 total cpu time spent up to now is 349.2 secs Computing kpt #: 235 total cpu time spent up to now is 350.5 secs Computing kpt #: 236 total cpu time spent up to now is 351.8 secs Computing kpt #: 237 total cpu time spent up to now is 353.7 secs Computing kpt #: 238 total cpu time spent up to now is 355.0 secs Computing kpt #: 239 total cpu time spent up to now is 357.0 secs Computing kpt #: 240 total cpu time spent up to now is 358.9 secs Computing kpt #: 241 total cpu time spent up to now is 360.5 secs Computing kpt #: 242 total cpu time spent up to now is 361.8 secs Computing kpt #: 243 total cpu time spent up to now is 363.8 secs Computing kpt #: 244 total cpu time spent up to now is 365.1 secs Computing kpt #: 245 total cpu time spent up to now is 366.4 secs Computing kpt #: 246 total cpu time spent up to now is 367.8 secs Computing kpt #: 247 total cpu time spent up to now is 369.4 secs Computing kpt #: 248 total cpu time spent up to now is 371.3 secs Computing kpt #: 249 total cpu time spent up to now is 372.6 secs Computing kpt #: 250 total cpu time spent up to now is 374.0 secs Computing kpt #: 251 total cpu time spent up to now is 375.4 secs Computing kpt #: 252 total cpu time spent up to now is 377.5 secs Computing kpt #: 253 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 380.1 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 382.7 secs Computing kpt #: 255 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 385.3 secs Computing kpt #: 256 total cpu time spent up to now is 387.9 secs Computing kpt #: 257 total cpu time spent up to now is 389.8 secs Computing kpt #: 258 total cpu time spent up to now is 391.2 secs Computing kpt #: 259 total cpu time spent up to now is 392.5 secs Computing kpt #: 260 total cpu time spent up to now is 393.8 secs Computing kpt #: 261 total cpu time spent up to now is 395.1 secs Computing kpt #: 262 total cpu time spent up to now is 396.4 secs Computing kpt #: 263 total cpu time spent up to now is 397.8 secs Computing kpt #: 264 total cpu time spent up to now is 399.0 secs Computing kpt #: 265 total cpu time spent up to now is 400.3 secs Computing kpt #: 266 total cpu time spent up to now is 401.6 secs Computing kpt #: 267 total cpu time spent up to now is 402.9 secs Computing kpt #: 268 total cpu time spent up to now is 404.5 secs Computing kpt #: 269 total cpu time spent up to now is 405.8 secs Computing kpt #: 270 total cpu time spent up to now is 407.1 secs Computing kpt #: 271 total cpu time spent up to now is 408.3 secs Computing kpt #: 272 total cpu time spent up to now is 409.9 secs Computing kpt #: 273 total cpu time spent up to now is 411.1 secs Computing kpt #: 274 total cpu time spent up to now is 412.7 secs Computing kpt #: 275 total cpu time spent up to now is 414.0 secs Computing kpt #: 276 total cpu time spent up to now is 415.3 secs Computing kpt #: 277 total cpu time spent up to now is 416.6 secs Computing kpt #: 278 total cpu time spent up to now is 418.0 secs Computing kpt #: 279 total cpu time spent up to now is 419.4 secs Computing kpt #: 280 total cpu time spent up to now is 420.6 secs Computing kpt #: 281 total cpu time spent up to now is 421.9 secs Computing kpt #: 282 total cpu time spent up to now is 423.2 secs Computing kpt #: 283 total cpu time spent up to now is 424.3 secs Computing kpt #: 284 total cpu time spent up to now is 425.5 secs Computing kpt #: 285 total cpu time spent up to now is 426.6 secs Computing kpt #: 286 total cpu time spent up to now is 427.7 secs Computing kpt #: 287 total cpu time spent up to now is 428.8 secs Computing kpt #: 288 total cpu time spent up to now is 429.9 secs Computing kpt #: 289 total cpu time spent up to now is 431.0 secs Computing kpt #: 290 total cpu time spent up to now is 432.1 secs Computing kpt #: 291 total cpu time spent up to now is 433.2 secs Computing kpt #: 292 total cpu time spent up to now is 434.3 secs Computing kpt #: 293 total cpu time spent up to now is 435.4 secs Computing kpt #: 294 total cpu time spent up to now is 436.5 secs Computing kpt #: 295 total cpu time spent up to now is 437.6 secs Computing kpt #: 296 total cpu time spent up to now is 438.7 secs Computing kpt #: 297 total cpu time spent up to now is 439.8 secs Computing kpt #: 298 total cpu time spent up to now is 440.9 secs Computing kpt #: 299 total cpu time spent up to now is 442.0 secs Computing kpt #: 300 total cpu time spent up to now is 443.1 secs Computing kpt #: 301 total cpu time spent up to now is 444.3 secs Computing kpt #: 302 total cpu time spent up to now is 445.6 secs Computing kpt #: 303 total cpu time spent up to now is 446.8 secs Computing kpt #: 304 total cpu time spent up to now is 448.0 secs Computing kpt #: 305 total cpu time spent up to now is 449.3 secs Computing kpt #: 306 total cpu time spent up to now is 450.6 secs Computing kpt #: 307 total cpu time spent up to now is 451.8 secs Computing kpt #: 308 total cpu time spent up to now is 453.1 secs Computing kpt #: 309 total cpu time spent up to now is 454.3 secs Computing kpt #: 310 total cpu time spent up to now is 455.6 secs Computing kpt #: 311 total cpu time spent up to now is 457.2 secs Computing kpt #: 312 total cpu time spent up to now is 458.5 secs Computing kpt #: 313 total cpu time spent up to now is 460.1 secs Computing kpt #: 314 total cpu time spent up to now is 461.6 secs Computing kpt #: 315 total cpu time spent up to now is 463.2 secs Computing kpt #: 316 total cpu time spent up to now is 464.8 secs Computing kpt #: 317 total cpu time spent up to now is 466.2 secs Computing kpt #: 318 total cpu time spent up to now is 467.8 secs Computing kpt #: 319 total cpu time spent up to now is 469.5 secs Computing kpt #: 320 total cpu time spent up to now is 471.1 secs Computing kpt #: 321 total cpu time spent up to now is 472.7 secs Computing kpt #: 322 total cpu time spent up to now is 474.2 secs Computing kpt #: 323 total cpu time spent up to now is 475.8 secs Computing kpt #: 324 total cpu time spent up to now is 477.4 secs Computing kpt #: 325 total cpu time spent up to now is 479.0 secs Computing kpt #: 326 total cpu time spent up to now is 480.9 secs Computing kpt #: 327 total cpu time spent up to now is 482.5 secs Computing kpt #: 328 total cpu time spent up to now is 484.1 secs Computing kpt #: 329 total cpu time spent up to now is 485.6 secs ethr = 2.08E-11, avg # of iterations = 39.9 total cpu time spent up to now is 485.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3005 PWs) bands (ev): -5.4237 -5.4237 -3.5872 -3.5872 -3.5799 -3.5799 3.8699 3.8699 4.0014 4.0014 4.0143 4.0143 5.0118 5.0118 6.4437 6.4437 6.4530 6.4530 6.6833 6.6833 6.7318 6.7318 6.8327 6.8327 7.1578 7.1578 7.8311 7.8311 8.0008 8.0008 8.1074 8.1074 8.1944 8.1944 8.4110 8.4110 8.4494 8.4494 8.6376 8.6376 8.6783 8.6783 9.2235 9.2235 10.0626 10.0626 10.9884 10.9884 11.0372 11.0372 11.0929 11.0929 11.1992 11.1992 13.1624 13.1624 16.2050 16.2050 k = 0.0093-0.0151 0.0049 ( 3011 PWs) bands (ev): -5.4227 -5.4227 -3.5880 -3.5880 -3.5807 -3.5807 3.8566 3.8568 3.9672 3.9674 4.0599 4.0610 5.0179 5.0195 6.4432 6.4434 6.4520 6.4532 6.6799 6.6841 6.7305 6.7305 6.8324 6.8347 7.1576 7.1620 7.8298 7.8305 7.9971 8.0040 8.1068 8.1077 8.1911 8.1975 8.4100 8.4123 8.4493 8.4495 8.6357 8.6393 8.6784 8.6788 9.2231 9.2231 10.0556 10.0636 10.9794 10.9936 11.0355 11.0389 11.0887 11.0975 11.1945 11.1975 13.1694 13.1712 16.2037 16.2043 k = 0.0187-0.0302 0.0099 ( 3017 PWs) bands (ev): -5.4199 -5.4198 -3.5905 -3.5905 -3.5832 -3.5832 3.8219 3.8226 3.9386 3.9395 4.1196 4.1205 5.0375 5.0406 6.4419 6.4424 6.4506 6.4529 6.6731 6.6820 6.7270 6.7276 6.8340 6.8385 7.1615 7.1700 7.8267 7.8281 7.9929 8.0067 8.1059 8.1077 8.1879 8.2007 8.4093 8.4139 8.4495 8.4499 8.6338 8.6407 8.6793 8.6799 9.2220 9.2221 10.0427 10.0586 10.9666 10.9929 11.0324 11.0416 11.0848 11.1025 11.1846 11.1910 13.1920 13.1955 16.1988 16.2008 k = 0.0280-0.0453 0.0148 ( 3016 PWs) bands (ev): -5.4151 -5.4150 -3.5947 -3.5947 -3.5873 -3.5872 3.7772 3.7783 3.9140 3.9160 4.1840 4.1847 5.0698 5.0743 6.4394 6.4404 6.4490 6.4521 6.6618 6.6755 6.7231 6.7247 6.8375 6.8440 7.1689 7.1813 7.8219 7.8239 7.9884 8.0090 8.1046 8.1074 8.1848 8.2039 8.4090 8.4158 8.4499 8.4505 8.6321 8.6416 8.6815 8.6815 9.2203 9.2204 10.0244 10.0479 10.9488 10.9836 11.0259 11.0437 11.0827 11.1082 11.1736 11.1837 13.2288 13.2339 16.1907 16.1938 k = 0.0374-0.0604 0.0198 ( 3016 PWs) bands (ev): -5.4084 -5.4083 -3.6008 -3.6007 -3.5928 -3.5927 3.7300 3.7314 3.8890 3.8918 4.2517 4.2521 5.1135 5.1192 6.4356 6.4373 6.4474 6.4512 6.6452 6.6629 6.7206 6.7228 6.8430 6.8515 7.1795 7.1954 7.8154 7.8181 7.9836 8.0107 8.1028 8.1068 8.1817 8.2070 8.4089 8.4178 8.4504 8.4514 8.6305 8.6416 8.6836 8.6851 9.2180 9.2181 10.0010 10.0316 10.9238 10.9639 11.0141 11.0374 11.0880 11.1160 11.1665 11.1798 13.2783 13.2848 16.1795 16.1836 k = 0.0467-0.0755 0.0247 ( 3018 PWs) bands (ev): -5.3998 -5.3997 -3.6086 -3.6086 -3.5997 -3.5996 3.6834 3.6850 3.8624 3.8658 4.3217 4.3219 5.1670 5.1738 6.4303 6.4329 6.4459 6.4501 6.6237 6.6443 6.7203 6.7223 6.8505 6.8607 7.1926 7.2117 7.8075 7.8108 7.9784 8.0119 8.1006 8.1059 8.1787 8.2102 8.4089 8.4198 8.4510 8.4526 8.6289 8.6407 8.6863 8.6901 9.2150 9.2151 9.9731 10.0103 10.8895 10.9326 10.9977 11.0222 11.1014 11.1266 11.1660 11.1813 13.3383 13.3461 16.1654 16.1704 k = 0.0561-0.0906 0.0296 ( 3020 PWs) bands (ev): -5.3894 -5.3892 -3.6183 -3.6183 -3.6079 -3.6077 3.6387 3.6405 3.8345 3.8384 4.3934 4.3935 5.2290 5.2368 6.4234 6.4267 6.4444 6.4489 6.5984 6.6210 6.7217 6.7230 6.8598 6.8716 7.2077 7.2296 7.7983 7.8022 7.9729 8.0125 8.0978 8.1046 8.1760 8.2134 8.4090 8.4216 8.4517 8.4539 8.6274 8.6392 8.6898 8.6964 9.2114 9.2115 9.9412 9.9844 10.8455 10.8899 10.9793 11.0044 11.1181 11.1393 11.1718 11.1884 13.4068 13.4157 16.1483 16.1541 k = 0.0654-0.1057 0.0346 ( 3028 PWs) bands (ev): -5.3771 -5.3768 -3.6299 -3.6299 -3.6173 -3.6170 3.5966 3.5985 3.8062 3.8104 4.4663 4.4667 5.2981 5.3068 6.4146 6.4183 6.4428 6.4477 6.5704 6.5945 6.7241 6.7247 6.8706 6.8840 7.2241 7.2487 7.7881 7.7925 7.9672 8.0126 8.0944 8.1028 8.1736 8.2166 8.4092 8.4232 8.4524 8.4555 8.6257 8.6371 8.6942 8.7039 9.2073 9.2073 9.9060 9.9544 10.7938 10.8387 10.9606 10.9864 11.1341 11.1519 11.1840 11.2012 13.4818 13.4914 16.1281 16.1347 k = 0.0747-0.1208 0.0395 ( 3016 PWs) bands (ev): -5.3629 -5.3626 -3.6433 -3.6432 -3.6279 -3.6276 3.5573 3.5593 3.7781 3.7826 4.5401 4.5409 5.3732 5.3827 6.4032 6.4066 6.4412 6.4465 6.5418 6.5665 6.7272 6.7275 6.8829 6.8977 7.2415 7.2687 7.7772 7.7821 7.9613 8.0122 8.0906 8.1006 8.1716 8.2199 8.4093 8.4246 8.4532 8.4574 8.6240 8.6347 8.6997 8.7124 9.2027 9.2027 9.8678 9.9206 10.7371 10.7823 10.9419 10.9685 11.1476 11.1629 11.2023 11.2194 13.5614 13.5716 16.1045 16.1118 k = 0.0841-0.1359 0.0445 ( 3014 PWs) bands (ev): -5.3469 -5.3466 -3.6583 -3.6582 -3.6397 -3.6394 3.5210 3.5231 3.7511 3.7556 4.6145 4.6156 5.4532 5.4635 6.3877 6.3897 6.4394 6.4452 6.5149 6.5389 6.7304 6.7315 6.8962 6.9123 7.2594 7.2890 7.7657 7.7711 7.9552 8.0113 8.0862 8.0977 8.1700 8.2232 8.4095 8.4257 8.4540 8.4594 8.6221 8.6320 8.7061 8.7215 9.1975 9.1976 9.8273 9.8834 10.6782 10.7236 10.9233 10.9505 11.1585 11.1722 11.2250 11.2415 13.6439 13.6544 16.0768 16.0850 k = 0.0934-0.1510 0.0494 ( 3013 PWs) bands (ev): -5.3291 -5.3288 -3.6749 -3.6748 -3.6527 -3.6523 3.4879 3.4901 3.7256 3.7302 4.6890 4.6905 5.5373 5.5483 6.3655 6.3665 6.4374 6.4438 6.4924 6.5141 6.7343 6.7361 6.9105 6.9276 7.2776 7.3093 7.7542 7.7600 7.9490 8.0100 8.0813 8.0942 8.1688 8.2265 8.4095 8.4263 8.4547 8.4614 8.6199 8.6293 8.7134 8.7310 9.1919 9.1921 9.7849 9.8431 10.6194 10.6648 10.9046 10.9321 11.1681 11.1805 11.2502 11.2660 13.7278 13.7384 16.0442 16.0533 k = 0.1028-0.1661 0.0543 ( 3013 PWs) bands (ev): -5.3096 -5.3092 -3.6930 -3.6929 -3.6668 -3.6664 3.4580 3.4602 3.7020 3.7067 4.7631 4.7650 5.6245 5.6363 6.3329 6.3381 6.4351 6.4423 6.4756 6.4939 6.7389 6.7414 6.9254 6.9434 7.2955 7.3292 7.7429 7.7492 7.9426 8.0082 8.0760 8.0901 8.1683 8.2298 8.4095 8.4266 8.4554 8.4635 8.6176 8.6266 8.7213 8.7405 9.1858 9.1862 9.7413 9.8002 10.5625 10.6073 10.8855 10.9132 11.1769 11.1881 11.2763 11.2916 13.8119 13.8221 16.0057 16.0158 k = 0.1121-0.1812 0.0593 ( 3008 PWs) bands (ev): -5.2882 -5.2878 -3.7125 -3.7124 -3.6820 -3.6816 3.4313 3.4336 3.6809 3.6856 4.8365 4.8386 5.7140 5.7265 6.2931 6.3024 6.4326 6.4407 6.4639 6.4791 6.7443 6.7474 6.9407 6.9595 7.3128 7.3481 7.7323 7.7392 7.9360 8.0061 8.0703 8.0853 8.1682 8.2332 8.4095 8.4266 8.4560 8.4657 8.6153 8.6242 8.7297 8.7497 9.1794 9.1800 9.6970 9.7551 10.5090 10.5526 10.8661 10.8938 11.1854 11.1953 11.3025 11.3173 13.8947 13.9044 15.9598 15.9711 k = 0.1214-0.1963 0.0642 ( 3003 PWs) bands (ev): -5.2652 -5.2648 -3.7333 -3.7332 -3.6982 -3.6978 3.4080 3.4103 3.6624 3.6671 4.9083 4.9109 5.8050 5.8182 6.2481 6.2606 6.4300 6.4391 6.4559 6.4688 6.7506 6.7541 6.9563 6.9757 7.3289 7.3655 7.7229 7.7306 7.9293 8.0037 8.0644 8.0798 8.1686 8.2365 8.4094 8.4263 8.4567 8.4679 8.6128 8.6219 8.7383 8.7581 9.1728 9.1735 9.6527 9.7084 10.4599 10.5017 10.8463 10.8739 11.1938 11.2023 11.3280 11.3425 13.9752 13.9839 15.9052 15.9179 k = 0.1308-0.2114 0.0692 ( 2997 PWs) bands (ev): -5.2405 -5.2401 -3.7553 -3.7552 -3.7154 -3.7150 3.3879 3.3903 3.6468 3.6514 4.9780 4.9809 5.8964 5.9105 6.1995 6.2143 6.4274 6.4375 6.4504 6.4620 6.7582 6.7620 6.9719 6.9916 7.3434 7.3807 7.7153 7.7241 7.9225 8.0011 8.0582 8.0738 8.1696 8.2399 8.4093 8.4257 8.4574 8.4702 8.6105 8.6200 8.7466 8.7652 9.1660 9.1670 9.6091 9.6607 10.4162 10.4553 10.8261 10.8535 11.2020 11.2092 11.3524 11.3667 14.0522 14.0596 15.8409 15.8550 k = 0.1401-0.2265 0.0741 ( 3000 PWs) bands (ev): -5.2142 -5.2137 -3.7784 -3.7783 -3.7336 -3.7331 3.3711 3.3735 3.6342 3.6388 5.0447 5.0477 5.9869 6.0020 6.1490 6.1655 6.4249 6.4358 6.4467 6.4576 6.7675 6.7712 6.9874 7.0072 7.3556 7.3929 7.7100 7.7201 7.9156 7.9983 8.0520 8.0673 8.1710 8.2433 8.4092 8.4248 8.4582 8.4725 8.6081 8.6184 8.7538 8.7702 9.1590 9.1604 9.5669 9.6127 10.3783 10.4140 10.8057 10.8327 11.2103 11.2159 11.3752 11.3894 14.1244 14.1303 15.7664 15.7818 k = 0.1495-0.2416 0.0790 ( 2998 PWs) bands (ev): -5.1863 -5.1858 -3.8026 -3.8024 -3.7526 -3.7521 3.3575 3.3599 3.6248 3.6293 5.1071 5.1102 6.0705 6.0839 6.1058 6.1202 6.4229 6.4340 6.4447 6.4550 6.7790 6.7823 7.0025 7.0222 7.3651 7.4016 7.7075 7.7195 7.9087 7.9953 8.0457 8.0604 8.1729 8.2467 8.4092 8.4238 8.4592 8.4750 8.6060 8.6173 8.7597 8.7725 9.1522 9.1539 9.5270 9.5654 10.3468 10.3785 10.7849 10.8116 11.2185 11.2225 11.3962 11.4102 14.1907 14.1948 15.6822 15.6990 k = 0.1588-0.2567 0.0840 ( 2996 PWs) bands (ev): -5.1569 -5.1564 -3.8276 -3.8274 -3.7723 -3.7718 3.3472 3.3496 3.6186 3.6231 5.1637 5.1666 6.0456 6.0592 6.1664 6.1803 6.4219 6.4320 6.4445 6.4541 6.7936 6.7962 7.0171 7.0365 7.3715 7.4063 7.7082 7.7224 7.9018 7.9923 8.0398 8.0534 8.1752 8.2501 8.4093 8.4227 8.4605 8.4776 8.6041 8.6166 8.7635 8.7717 9.1455 9.1476 9.4900 9.5197 10.3218 10.3492 10.7641 10.7901 11.2267 11.2291 11.4149 11.4288 14.2497 14.2519 15.5903 15.6080 k = 0.1682-0.2718 0.0889 ( 3000 PWs) bands (ev): -5.1261 -5.1255 -3.8534 -3.8532 -3.7928 -3.7922 3.3399 3.3423 3.6158 3.6202 5.2122 5.2145 5.9993 6.0131 6.2429 6.2600 6.4229 6.4301 6.4465 6.4551 6.8127 6.8138 7.0311 7.0498 7.3744 7.4068 7.7122 7.7288 7.8950 7.9892 8.0342 8.0463 8.1778 8.2535 8.4094 8.4215 8.4620 8.4803 8.6024 8.6163 8.7647 8.7671 9.1392 9.1416 9.4565 9.4763 10.3036 10.3264 10.7431 10.7685 11.2349 11.2356 11.4312 11.4449 14.2998 14.2999 15.4933 15.5117 k = 0.1775-0.2870 0.0939 ( 3000 PWs) bands (ev): -5.0938 -5.0932 -3.8799 -3.8797 -3.8139 -3.8133 3.3357 3.3381 3.6164 3.6207 5.2498 5.2509 5.9593 5.9715 6.3076 6.3291 6.4277 6.4288 6.4525 6.4599 6.8367 6.8379 7.0443 7.0623 7.3739 7.4034 7.7192 7.7381 7.8884 7.9859 8.0292 8.0397 8.1808 8.2569 8.4097 8.4204 8.4640 8.4832 8.6009 8.6164 8.7585 8.7628 9.1333 9.1362 9.4268 9.4363 10.2923 10.3104 10.7221 10.7468 11.2421 11.2432 11.4448 11.4583 14.3372 14.3391 15.3948 15.4133 k = 0.1868-0.3021 0.0988 ( 2990 PWs) bands (ev): -5.0603 -5.0597 -3.9069 -3.9067 -3.8356 -3.8350 3.3345 3.3369 3.6204 3.6246 5.2719 5.2727 5.9297 5.9390 6.3498 6.3785 6.4291 6.4367 6.4676 6.4751 6.8667 6.8713 7.0568 7.0736 7.3705 7.3969 7.7288 7.7493 7.8822 7.9823 8.0253 8.0339 8.1843 8.2604 8.4100 8.4193 8.4666 8.4863 8.5996 8.6169 8.7461 8.7574 9.1281 9.1314 9.4001 9.4010 10.2878 10.3016 10.7013 10.7251 11.2485 11.2514 11.4557 11.4689 14.3616 14.3652 15.2990 15.3171 k = 0.1962-0.3172 0.1037 ( 2988 PWs) bands (ev): -5.0255 -5.0248 -3.9343 -3.9341 -3.8577 -3.8571 3.3362 3.3385 3.6278 3.6319 5.2743 5.2776 5.9138 5.9194 6.3679 6.3999 6.4322 6.4438 6.4968 6.5059 6.9053 6.9140 7.0683 7.0839 7.3646 7.3876 7.7400 7.7609 7.8766 7.9779 8.0229 8.0297 8.1881 8.2639 8.4103 8.4184 8.4697 8.4893 8.5983 8.6174 8.7299 8.7483 9.1236 9.1274 9.3682 9.3788 10.2902 10.2999 10.6808 10.7036 11.2549 11.2597 11.4636 11.4765 14.3706 14.3753 15.2106 15.2273 k = 0.2055-0.3323 0.1087 ( 2988 PWs) bands (ev): -4.9895 -4.9889 -3.9620 -3.9618 -3.8802 -3.8796 3.3406 3.3430 3.6386 3.6427 5.2564 5.2624 5.9133 5.9147 6.3733 6.4043 6.4368 6.4484 6.5296 6.5404 6.9528 6.9659 7.0790 7.0933 7.3566 7.3765 7.7519 7.7714 7.8719 7.9725 8.0224 8.0277 8.1924 8.2675 8.4106 8.4176 8.4733 8.4922 8.5970 8.6177 8.7110 8.7359 9.1202 9.1243 9.3405 9.3596 10.2993 10.3053 10.6608 10.6825 11.2613 11.2679 11.4687 11.4811 14.3617 14.3666 15.1338 15.1481 k = 0.2149-0.3474 0.1136 ( 2981 PWs) bands (ev): -4.9526 -4.9519 -3.9898 -3.9896 -3.9031 -3.9024 3.3477 3.3500 3.6527 3.6567 5.2197 5.2280 5.9242 5.9267 6.3736 6.4035 6.4413 6.4524 6.5568 6.5694 7.0075 7.0248 7.0898 7.1023 7.3474 7.3641 7.7636 7.7796 7.8684 7.9658 8.0245 8.0287 8.1971 8.2712 8.4107 8.4171 8.4775 8.4948 8.5954 8.6172 8.6905 8.7207 9.1179 9.1224 9.3170 9.3429 10.3147 10.3176 10.6415 10.6619 11.2675 11.2761 11.4708 11.4826 14.3333 14.3374 15.0720 15.0828 k = 0.2242-0.3625 0.1186 ( 2986 PWs) bands (ev): -4.9147 -4.9140 -4.0176 -4.0174 -3.9262 -3.9255 3.3573 3.3596 3.6702 3.6742 5.1677 5.1776 5.9447 5.9507 6.3717 6.4008 6.4458 6.4564 6.5767 6.5912 7.0633 7.0786 7.1094 7.1145 7.3371 7.3510 7.7741 7.7843 7.8660 7.9579 8.0296 8.0328 8.2022 8.2749 8.4105 8.4166 8.4821 8.4969 8.5933 8.6145 8.6707 8.7035 9.1171 9.1219 9.2971 9.3280 10.3359 10.3362 10.6231 10.6420 11.2737 11.2842 11.4700 11.4810 14.2861 14.2886 15.0258 15.0322 k = 0.2336-0.3776 0.1235 ( 2996 PWs) bands (ev): -4.8761 -4.8754 -4.0453 -4.0451 -3.9494 -3.9488 3.3692 3.3715 3.6910 3.6949 5.1042 5.1151 5.9727 5.9817 6.3685 6.3973 6.4506 6.4609 6.5905 6.6065 7.0965 7.0972 7.1499 7.1659 7.3265 7.3378 7.7827 7.7851 7.8643 7.9490 8.0383 8.0402 8.2079 8.2786 8.4097 8.4162 8.4871 8.4980 8.5903 8.6067 8.6551 8.6855 9.1178 9.1229 9.2804 9.3143 10.3604 10.3623 10.6058 10.6232 11.2797 11.2921 11.4666 11.4767 14.2231 14.2237 14.9928 14.9948 k = 0.2429-0.3927 0.1284 ( 2997 PWs) bands (ev): -4.8368 -4.8361 -4.0726 -4.0723 -3.9727 -3.9721 3.3834 3.3855 3.7150 3.7189 5.0325 5.0438 6.0049 6.0165 6.3646 6.3933 6.4557 6.4660 6.5993 6.6168 7.1035 7.1068 7.2088 7.2313 7.3160 7.3257 7.7828 7.7890 7.8626 7.9393 8.0505 8.0506 8.2141 8.2825 8.4083 8.4159 8.4921 8.4979 8.5864 8.5924 8.6463 8.6680 9.1204 9.1255 9.2664 9.3014 10.3892 10.3929 10.5900 10.6056 11.2856 11.2999 11.4608 11.4697 14.1479 14.1491 14.9672 14.9694 k = 0.2522-0.4078 0.1334 ( 3000 PWs) bands (ev): -4.7972 -4.7965 -4.0993 -4.0991 -3.9960 -3.9954 3.3994 3.4015 3.7422 3.7460 4.9551 4.9664 6.0390 6.0530 6.3600 6.3889 6.4614 6.4717 6.6044 6.6231 7.1081 7.1108 7.2689 7.2877 7.3071 7.3222 7.7780 7.7928 7.8601 7.9292 8.0640 8.0658 8.2209 8.2865 8.4060 8.4155 8.4956 8.4963 8.5747 8.5816 8.6424 8.6523 9.1249 9.1297 9.2546 9.2890 10.4213 10.4265 10.5761 10.5898 11.2912 11.3074 11.4529 11.4605 14.0664 14.0689 14.9460 14.9519 k = 0.2616-0.4229 0.1383 ( 3008 PWs) bands (ev): -4.7575 -4.7568 -4.1252 -4.1250 -4.0193 -4.0186 3.4172 3.4192 3.7725 3.7763 4.8738 4.8848 6.0733 6.0893 6.3548 6.3841 6.4675 6.4780 6.6064 6.6263 7.1111 7.1128 7.2913 7.2929 7.3342 7.3679 7.7717 7.7941 7.8564 7.9186 8.0798 8.0836 8.2283 8.2906 8.4022 8.4147 8.4903 8.4979 8.5587 8.5766 8.6389 8.6402 9.1312 9.1355 9.2447 9.2771 10.4549 10.4615 10.5645 10.5760 11.2965 11.3145 11.4435 11.4493 13.9836 13.9869 14.9285 14.9373 k = 0.2709-0.4380 0.1433 ( 3010 PWs) bands (ev): -4.7180 -4.7172 -4.1500 -4.1498 -4.0423 -4.0417 3.4365 3.4384 3.8059 3.8096 4.7900 4.8005 6.1065 6.1245 6.3491 6.3790 6.4741 6.4850 6.6060 6.6270 7.1128 7.1135 7.2829 7.2832 7.3891 7.4254 7.7645 7.7932 7.8517 7.9078 8.0975 8.1033 8.2363 8.2947 8.3967 8.4132 8.4816 8.4944 8.5492 8.5726 8.6280 8.6384 9.1393 9.1424 9.2366 9.2657 10.4882 10.4958 10.5561 10.5649 11.3015 11.3213 11.4329 11.4368 13.9029 13.9067 14.9126 14.9239 k = 0.2803-0.4531 0.1482 ( 3012 PWs) bands (ev): -4.6791 -4.6784 -4.1732 -4.1730 -4.0652 -4.0645 3.4569 3.4587 3.8421 3.8459 4.7050 4.7149 6.1378 6.1577 6.3430 6.3736 6.4814 6.4927 6.6035 6.6257 7.1133 7.1134 7.2733 7.2741 7.4407 7.4793 7.7569 7.7905 7.8461 7.8968 8.1168 8.1242 8.2449 8.2989 8.3891 8.4108 8.4698 8.4850 8.5477 8.5702 8.6189 8.6363 9.1485 9.1499 9.2304 9.2550 10.5177 10.5244 10.5542 10.5584 11.3060 11.3277 11.4219 11.4236 13.8270 13.8308 14.8971 14.9106 k = 0.2896-0.4682 0.1531 ( 3018 PWs) bands (ev): -4.6415 -4.6408 -4.1942 -4.1941 -4.0877 -4.0871 3.4779 3.4796 3.8812 3.8850 4.6198 4.6290 6.1665 6.1881 6.3362 6.3678 6.4893 6.5011 6.5991 6.6226 7.1122 7.1128 7.2643 7.2660 7.4874 7.5278 7.7494 7.7864 7.8398 7.8856 8.1370 8.1458 8.2538 8.3029 8.3792 8.4068 8.4563 8.4731 8.5511 8.5694 8.6110 8.6338 9.1572 9.1583 9.2264 9.2453 10.5347 10.5353 10.5635 10.5697 11.3100 11.3335 11.4103 11.4109 13.7581 13.7617 14.8796 14.8969 k = 0.2989-0.4833 0.1581 ( 3018 PWs) bands (ev): -4.6060 -4.6054 -4.2123 -4.2122 -4.1098 -4.1092 3.4991 3.5007 3.9231 3.9269 4.5355 4.5439 6.1924 6.2154 6.3289 6.3616 6.4979 6.5100 6.5931 6.6181 7.1106 7.1114 7.2567 7.2588 7.5290 7.5701 7.7429 7.7813 7.8332 7.8743 8.1578 8.1676 8.2631 8.3068 8.3674 8.4008 8.4431 8.4616 8.5567 8.5700 8.6041 8.6309 9.1633 9.1674 9.2247 9.2373 10.5373 10.5375 10.5804 10.5917 11.3133 11.3387 11.3976 11.4005 13.6980 13.7012 14.8520 14.8730 k = 0.3083-0.4984 0.1630 ( 3014 PWs) bands (ev): -4.5739 -4.5733 -4.2263 -4.2263 -4.1315 -4.1309 3.5198 3.5211 3.9675 3.9713 4.4532 4.4607 6.2151 6.2391 6.3210 6.3551 6.5070 6.5192 6.5857 6.6124 7.1083 7.1091 7.2506 7.2528 7.5649 7.6047 7.7384 7.7760 7.8266 7.8629 8.1787 8.1889 8.2723 8.3103 8.3545 8.3919 8.4320 8.4511 8.5629 8.5713 8.5979 8.6280 9.1679 9.1748 9.2252 9.2318 10.5390 10.5406 10.5949 10.6087 11.3158 11.3434 11.3860 11.3909 13.6481 13.6507 14.8241 14.8440 k = 0.3176-0.5135 0.1679 ( 3020 PWs) bands (ev): -4.5466 -4.5462 -4.2347 -4.2346 -4.1527 -4.1521 3.5390 3.5401 4.0143 4.0182 4.3742 4.3807 6.2346 6.2588 6.3124 6.3484 6.5165 6.5282 6.5769 6.6059 7.1056 7.1061 7.2461 7.2480 7.5949 7.6298 7.7374 7.7709 7.8205 7.8515 8.1991 8.2088 8.2804 8.3136 8.3420 8.3799 8.4243 8.4418 8.5687 8.5728 8.5924 8.6251 9.1709 9.1790 9.2273 9.2293 10.5430 10.5466 10.6021 10.6180 11.3174 11.3473 11.3758 11.3822 13.6095 13.6115 14.8049 14.8243 k = 0.3270-0.5286 0.1729 ( 3022 PWs) bands (ev): -4.5261 -4.5258 -4.2358 -4.2356 -4.1734 -4.1728 3.5554 3.5562 4.0631 4.0673 4.3004 4.3056 6.2507 6.2741 6.3030 6.3418 6.5262 6.5363 6.5670 6.5994 7.1024 7.1027 7.2433 7.2446 7.6186 7.6438 7.7412 7.7673 7.8160 7.8400 8.2182 8.2259 8.2856 8.3173 8.3328 8.3657 8.4202 8.4336 8.5739 8.5743 8.5877 8.6228 9.1728 9.1798 9.2297 9.2299 10.5500 10.5552 10.6009 10.6189 11.3178 11.3506 11.3671 11.3739 13.5830 13.5842 14.7956 14.8149 k = 0.3363-0.5437 0.1778 ( 3017 PWs) bands (ev): -4.5136 -4.5134 -4.2285 -4.2281 -4.1933 -4.1927 3.5674 3.5679 4.1127 4.1176 4.2347 4.2383 6.2630 6.2841 6.2935 6.3361 6.5357 6.5423 6.5562 6.5937 7.0988 7.0989 7.2422 7.2429 7.6355 7.6478 7.7474 7.7658 7.8147 7.8288 8.2340 8.2378 8.2854 8.3234 8.3308 8.3505 8.4195 8.4267 8.5755 8.5780 8.5838 8.6212 9.1745 9.1784 9.2315 9.2320 10.5601 10.5654 10.5911 10.6122 11.3168 11.3531 11.3598 11.3654 13.5686 13.5691 14.7956 14.8157 k = 0.3457-0.5588 0.1828 ( 3013 PWs) bands (ev): -4.5091 -4.5091 -4.2126 -4.2126 -4.2126 -4.2115 3.5728 3.5728 4.1480 4.1554 4.1946 4.1946 6.2683 6.2872 6.2873 6.3331 6.5443 6.5443 6.5451 6.5907 7.0949 7.0949 7.2427 7.2427 7.6453 7.6453 7.7511 7.7666 7.8185 7.8185 8.2424 8.2424 8.2834 8.3323 8.3359 8.3360 8.4219 8.4219 8.5759 8.5809 8.5809 8.6207 9.1761 9.1761 9.2329 9.2329 10.5711 10.5711 10.5753 10.6039 11.3137 11.3539 11.3539 11.3570 13.5659 13.5659 14.8017 14.8240 k = 0.3457-0.5588 0.1828 ( 3013 PWs) bands (ev): -4.5091 -4.5091 -4.2126 -4.2126 -4.2126 -4.2115 3.5728 3.5728 4.1480 4.1554 4.1946 4.1946 6.2683 6.2872 6.2873 6.3331 6.5443 6.5443 6.5451 6.5907 7.0949 7.0949 7.2427 7.2427 7.6453 7.6453 7.7511 7.7666 7.8185 7.8185 8.2424 8.2424 8.2834 8.3323 8.3359 8.3360 8.4219 8.4219 8.5759 8.5809 8.5809 8.6207 9.1761 9.1761 9.2329 9.2329 10.5711 10.5711 10.5753 10.6039 11.3137 11.3539 11.3539 11.3570 13.5659 13.5659 14.8017 14.8240 k = 0.3492-0.5531 0.2001 ( 3013 PWs) bands (ev): -4.5004 -4.5004 -4.2074 -4.2073 -4.2073 -4.2061 3.5837 3.5837 4.1553 4.1614 4.2008 4.2008 6.2525 6.2724 6.2724 6.3175 6.5304 6.5304 6.5328 6.5778 7.0440 7.0440 7.2577 7.2577 7.6524 7.6524 7.7654 7.7847 7.8012 7.8012 8.2574 8.2574 8.2826 8.3324 8.3572 8.3573 8.4259 8.4260 8.5740 8.5811 8.5811 8.6192 9.1702 9.1702 9.2423 9.2423 10.5329 10.5329 10.5394 10.5650 11.2675 11.3064 11.3064 11.3071 13.5994 13.5994 14.8669 14.8898 k = 0.3527-0.5475 0.2174 ( 3013 PWs) bands (ev): -4.4900 -4.4900 -4.2006 -4.2005 -4.2005 -4.1993 3.5961 3.5961 4.1641 4.1688 4.2083 4.2083 6.2334 6.2543 6.2543 6.2982 6.5161 6.5161 6.5207 6.5651 6.9823 6.9823 7.2762 7.2762 7.6531 7.6531 7.7814 7.7854 7.7854 7.8042 8.2673 8.2673 8.2817 8.3326 8.3766 8.3767 8.4360 8.4361 8.5719 8.5814 8.5814 8.6179 9.1605 9.1605 9.2594 9.2594 10.4857 10.4857 10.4944 10.5164 11.2248 11.2598 11.2616 11.2616 13.6415 13.6415 14.9364 14.9595 k = 0.3562-0.5418 0.2348 ( 3001 PWs) bands (ev): -4.4779 -4.4779 -4.1924 -4.1922 -4.1922 -4.1909 3.6101 3.6101 4.1743 4.1776 4.2171 4.2171 6.2110 6.2331 6.2331 6.2752 6.5015 6.5015 6.5089 6.5527 6.9134 6.9134 7.2951 7.2951 7.6420 7.6421 7.7783 7.7783 7.7990 7.8248 8.2723 8.2723 8.2808 8.3328 8.3880 8.3881 8.4556 8.4557 8.5698 8.5821 8.5821 8.6168 9.1491 9.1491 9.2830 9.2830 10.4297 10.4297 10.4402 10.4584 11.1870 11.2168 11.2211 11.2211 13.6913 13.6913 15.0084 15.0316 k = 0.3597-0.5361 0.2521 ( 3007 PWs) bands (ev): -4.4641 -4.4641 -4.1826 -4.1824 -4.1824 -4.1811 3.6255 3.6255 4.1858 4.1876 4.2272 4.2272 6.1855 6.2087 6.2087 6.2489 6.4862 6.4862 6.4969 6.5402 6.8389 6.8389 7.3130 7.3131 7.6179 7.6179 7.7826 7.7826 7.8178 7.8461 8.2725 8.2726 8.2798 8.3329 8.3921 8.3922 8.4818 8.4819 8.5674 8.5831 8.5831 8.6158 9.1372 9.1372 9.3123 9.3123 10.3654 10.3654 10.3774 10.3918 11.1547 11.1791 11.1858 11.1858 13.7479 13.7479 15.0813 15.1043 k = 0.3632-0.5304 0.2695 ( 3013 PWs) bands (ev): -4.4485 -4.4485 -4.1714 -4.1711 -4.1711 -4.1697 3.6423 3.6423 4.1984 4.1988 4.2383 4.2383 6.1572 6.1813 6.1813 6.2195 6.4699 6.4699 6.4849 6.5277 6.7595 6.7595 7.3298 7.3299 7.5845 7.5845 7.7951 7.7951 7.8376 7.8679 8.2683 8.2683 8.2787 8.3330 8.3927 8.3927 8.5097 8.5097 8.5652 8.5849 8.5849 8.6151 9.1255 9.1255 9.3473 9.3473 10.2944 10.2944 10.3074 10.3183 11.1277 11.1470 11.1556 11.1556 13.8103 13.8103 15.1539 15.1766 k = 0.3667-0.5248 0.2868 ( 3013 PWs) bands (ev): -4.4313 -4.4313 -4.1588 -4.1584 -4.1584 -4.1570 3.6605 3.6605 4.2111 4.2122 4.2504 4.2504 6.1261 6.1509 6.1509 6.1871 6.4518 6.4518 6.4726 6.5152 6.6766 6.6766 7.3458 7.3458 7.5462 7.5462 7.8125 7.8125 7.8583 7.8900 8.2599 8.2599 8.2777 8.3330 8.3914 8.3914 8.5360 8.5360 8.5631 8.5879 8.5880 8.6150 9.1145 9.1145 9.3875 9.3875 10.2182 10.2183 10.2318 10.2400 11.1053 11.1199 11.1303 11.1303 13.8773 13.8773 15.2252 15.2474 k = 0.3702-0.5191 0.3041 ( 3007 PWs) bands (ev): -4.4125 -4.4125 -4.1447 -4.1444 -4.1444 -4.1429 3.6801 3.6801 4.2243 4.2269 4.2634 4.2634 6.0927 6.1178 6.1178 6.1521 6.4294 6.4295 6.4600 6.5025 6.5932 6.5933 7.3606 7.3606 7.5057 7.5057 7.8325 7.8325 7.8795 7.9120 8.2478 8.2478 8.2767 8.3330 8.3890 8.3890 8.5581 8.5582 8.5613 8.5939 8.5939 8.6155 9.1045 9.1045 9.4329 9.4329 10.1388 10.1388 10.1524 10.1588 11.0867 11.0972 11.1091 11.1091 13.9481 13.9481 15.2944 15.3162 k = 0.3737-0.5134 0.3215 ( 3001 PWs) bands (ev): -4.3921 -4.3921 -4.1294 -4.1289 -4.1289 -4.1274 3.7009 3.7009 4.2382 4.2424 4.2770 4.2770 6.0569 6.0820 6.0820 6.1146 6.3949 6.3949 6.4471 6.4895 6.5176 6.5176 7.3735 7.3735 7.4653 7.4653 7.8540 7.8540 7.9008 7.9336 8.2324 8.2324 8.2758 8.3328 8.3859 8.3859 8.5599 8.5728 8.5729 8.6054 8.6054 8.6167 9.0955 9.0955 9.4831 9.4831 10.0579 10.0579 10.0711 10.0765 11.0708 11.0779 11.0911 11.0911 14.0216 14.0216 15.3614 15.3826 k = 0.3772-0.5078 0.3388 ( 3007 PWs) bands (ev): -4.3701 -4.3701 -4.1127 -4.1122 -4.1122 -4.1106 3.7230 3.7230 4.2527 4.2586 4.2912 4.2912 6.0190 6.0435 6.0435 6.0748 6.3332 6.3332 6.4339 6.4651 6.4651 6.4763 7.3797 7.3797 7.4302 7.4302 7.8762 7.8762 7.9220 7.9544 8.2142 8.2142 8.2750 8.3325 8.3822 8.3822 8.5588 8.5807 8.5808 8.6187 8.6216 8.6217 9.0875 9.0875 9.5377 9.5377 9.9770 9.9770 9.9892 9.9946 11.0571 11.0612 11.0756 11.0756 14.0970 14.0970 15.4257 15.4465 k = 0.3807-0.5021 0.3561 ( 3001 PWs) bands (ev): -4.3466 -4.3466 -4.0947 -4.0942 -4.0942 -4.0926 3.7461 3.7461 4.2675 4.2752 4.3057 4.3057 5.9793 6.0024 6.0024 6.0329 6.2458 6.2458 6.4205 6.4352 6.4352 6.4630 7.3609 7.3609 7.4197 7.4197 7.8986 7.8986 7.9428 7.9740 8.1939 8.1939 8.2747 8.3321 8.3781 8.3782 8.5583 8.5860 8.5860 8.6218 8.6387 8.6387 9.0802 9.0802 9.5960 9.5960 9.8980 9.8980 9.9084 9.9145 11.0448 11.0466 11.0619 11.0619 14.1735 14.1735 15.4873 15.5077 k = 0.3842-0.4964 0.3735 ( 3001 PWs) bands (ev): -4.3217 -4.3217 -4.0756 -4.0750 -4.0750 -4.0733 3.7702 3.7702 4.2825 4.2920 4.3202 4.3202 5.9379 5.9586 5.9586 5.9891 6.1466 6.1466 6.4067 6.4147 6.4147 6.4494 7.3231 7.3231 7.4282 7.4282 7.9207 7.9207 7.9628 7.9920 8.1718 8.1718 8.2748 8.3318 8.3740 8.3740 8.5585 8.5905 8.5905 8.6259 8.6547 8.6547 9.0736 9.0736 9.6562 9.6562 9.8230 9.8230 9.8295 9.8372 11.0332 11.0335 11.0495 11.0495 14.2506 14.2506 15.5464 15.5663 k = 0.3878-0.4907 0.3908 ( 3001 PWs) bands (ev): -4.2954 -4.2954 -4.0553 -4.0547 -4.0547 -4.0530 3.7952 3.7952 4.2972 4.3086 4.3344 4.3344 5.8952 5.9114 5.9114 5.9437 6.0430 6.0430 6.3928 6.3978 6.3978 6.4356 7.2820 7.2820 7.4403 7.4403 7.9422 7.9422 7.9817 8.0081 8.1485 8.1485 8.2757 8.3315 8.3699 8.3699 8.5592 8.5950 8.5950 8.6312 8.6691 8.6691 9.0673 9.0673 9.7029 9.7030 9.7536 9.7637 9.7680 9.7681 11.0208 11.0225 11.0378 11.0378 14.3277 14.3277 15.6031 15.6226 k = 0.3913-0.4851 0.4082 ( 2995 PWs) bands (ev): -4.2677 -4.2677 -4.0339 -4.0333 -4.0333 -4.0315 3.8209 3.8209 4.3114 4.3248 4.3480 4.3480 5.8516 5.8573 5.8574 5.8972 5.9414 5.9415 6.3788 6.3829 6.3829 6.4217 7.2405 7.2405 7.4532 7.4533 7.9627 7.9627 7.9992 8.0219 8.1245 8.1245 8.2775 8.3316 8.3660 8.3660 8.5607 8.5996 8.5997 8.6377 8.6819 8.6819 9.0611 9.0611 9.6637 9.6637 9.6813 9.6946 9.8061 9.8061 11.0087 11.0117 11.0265 11.0265 14.4042 14.4042 15.6576 15.6760 k = 0.3948-0.4794 0.4255 ( 2983 PWs) bands (ev): -4.2388 -4.2388 -4.0115 -4.0108 -4.0108 -4.0090 3.8470 3.8470 4.3246 4.3401 4.3607 4.3607 5.7833 5.7833 5.8075 5.8500 5.8569 5.8569 6.3648 6.3691 6.3691 6.4078 7.1995 7.1995 7.4665 7.4666 7.9818 7.9818 8.0151 8.0332 8.1002 8.1002 8.2804 8.3322 8.3627 8.3627 8.5629 8.6045 8.6046 8.6455 8.6933 8.6934 9.0547 9.0548 9.6011 9.6011 9.6131 9.6304 9.8744 9.8744 10.9968 11.0007 11.0152 11.0152 14.4795 14.4795 15.6838 15.6838 k = 0.3983-0.4737 0.4428 ( 2989 PWs) bands (ev): -4.2087 -4.2087 -3.9882 -3.9875 -3.9875 -3.9856 3.8733 3.8733 4.3363 4.3540 4.3718 4.3718 5.6835 5.6835 5.7633 5.7964 5.7964 5.8025 6.3508 6.3562 6.3562 6.3939 7.1592 7.1592 7.4800 7.4800 7.9987 7.9987 8.0289 8.0418 8.0760 8.0761 8.2844 8.3332 8.3600 8.3600 8.5656 8.6097 8.6097 8.6544 8.7033 8.7034 9.0480 9.0480 9.5408 9.5408 9.5495 9.5714 9.9473 9.9473 10.9846 10.9892 11.0036 11.0036 14.5530 14.5530 15.5835 15.5835 k = 0.4018-0.4681 0.4602 ( 2989 PWs) bands (ev): -4.1775 -4.1775 -3.9640 -3.9632 -3.9632 -3.9613 3.8995 3.8995 4.3461 4.3661 4.3811 4.3811 5.5742 5.5743 5.7198 5.7454 5.7454 5.7555 6.3370 6.3442 6.3442 6.3801 7.1197 7.1197 7.4936 7.4936 8.0117 8.0118 8.0406 8.0478 8.0541 8.0541 8.2895 8.3349 8.3582 8.3582 8.5689 8.6150 8.6150 8.6643 8.7122 8.7122 9.0406 9.0407 9.4851 9.4851 9.4908 9.5181 10.0228 10.0228 10.9719 10.9769 10.9914 10.9914 14.6231 14.6231 15.4801 15.4801 k = 0.4053-0.4624 0.4775 ( 2986 PWs) bands (ev): -4.1453 -4.1453 -3.9390 -3.9382 -3.9382 -3.9363 3.9252 3.9252 4.3534 4.3757 4.3877 4.3877 5.4631 5.4631 5.6776 5.6978 5.6978 5.7097 6.3236 6.3331 6.3331 6.3667 7.0812 7.0812 7.5075 7.5075 8.0118 8.0118 8.0434 8.0434 8.0500 8.0513 8.2955 8.3374 8.3573 8.3573 8.5726 8.6204 8.6204 8.6750 8.7201 8.7201 9.0326 9.0326 9.4345 9.4345 9.4372 9.4706 10.1000 10.1000 10.9586 10.9638 10.9784 10.9784 14.6874 14.6874 15.3803 15.3803 k = 0.4088-0.4567 0.4948 ( 2986 PWs) bands (ev): -4.1121 -4.1121 -3.9133 -3.9125 -3.9125 -3.9105 3.9499 3.9499 4.3576 4.3822 4.3913 4.3913 5.3527 5.3527 5.6373 5.6528 5.6529 5.6658 6.3104 6.3229 6.3229 6.3535 7.0438 7.0438 7.5214 7.5214 7.9938 7.9938 8.0490 8.0490 8.0527 8.0573 8.3022 8.3406 8.3576 8.3576 8.5765 8.6258 8.6258 8.6862 8.7270 8.7270 9.0235 9.0236 9.3889 9.3893 9.3893 9.4290 10.1786 10.1786 10.9443 10.9496 10.9644 10.9644 14.7404 14.7404 15.2909 15.2909 k = 0.4123-0.4511 0.5122 ( 2983 PWs) bands (ev): -4.0782 -4.0782 -3.8870 -3.8861 -3.8861 -3.8842 3.9727 3.9727 4.3581 4.3848 4.3911 4.3911 5.2447 5.2447 5.5998 5.6107 5.6108 5.6248 6.2978 6.3137 6.3137 6.3409 7.0075 7.0075 7.5354 7.5354 7.9716 7.9716 8.0524 8.0573 8.0573 8.0625 8.3094 8.3443 8.3589 8.3589 8.5806 8.6310 8.6310 8.6976 8.7331 8.7331 9.0135 9.0135 9.3461 9.3497 9.3497 9.3933 10.2582 10.2582 10.9290 10.9341 10.9492 10.9492 14.7713 14.7713 15.2241 15.2241 k = 0.4158-0.4454 0.5295 ( 2989 PWs) bands (ev): -4.0436 -4.0436 -3.8601 -3.8593 -3.8593 -3.8573 3.9928 3.9928 4.3542 4.3830 4.3865 4.3865 5.1405 5.1405 5.5659 5.5721 5.5721 5.5875 6.2857 6.3055 6.3055 6.3287 6.9724 6.9724 7.5496 7.5496 7.9489 7.9489 8.0508 8.0645 8.0645 8.0658 8.3167 8.3484 8.3613 8.3613 8.5846 8.6358 8.6359 8.7086 8.7384 8.7385 9.0022 9.0022 9.3090 9.3157 9.3157 9.3633 10.3385 10.3385 10.9124 10.9172 10.9325 10.9326 14.7648 14.7648 15.1961 15.1961 k = 0.4193-0.4397 0.5469 ( 2989 PWs) bands (ev): -4.0084 -4.0084 -3.8329 -3.8321 -3.8321 -3.8301 4.0090 4.0090 4.3455 4.3762 4.3771 4.3771 5.0419 5.0419 5.5362 5.5374 5.5374 5.5546 6.2743 6.2984 6.2984 6.3172 6.9385 6.9385 7.5638 7.5638 7.9267 7.9267 8.0482 8.0676 8.0701 8.0701 8.3241 8.3527 8.3645 8.3645 8.5884 8.6402 8.6403 8.7188 8.7431 8.7431 8.9896 8.9897 9.2777 9.2874 9.2874 9.3391 10.4192 10.4192 10.8944 10.8988 10.9145 10.9145 14.7169 14.7169 15.2119 15.2119 k = 0.4228-0.4340 0.5642 ( 2989 PWs) bands (ev): -3.9728 -3.9728 -3.8054 -3.8046 -3.8046 -3.8026 4.0195 4.0195 4.3316 4.3623 4.3623 4.3638 4.9509 4.9509 5.5073 5.5073 5.5113 5.5269 6.2636 6.2926 6.2926 6.3064 6.9059 6.9059 7.5782 7.5782 7.9053 7.9053 8.0450 8.0681 8.0742 8.0742 8.3313 8.3570 8.3685 8.3685 8.5919 8.6440 8.6440 8.7276 8.7472 8.7472 8.9758 8.9758 9.2524 9.2646 9.2646 9.3204 10.5000 10.5000 10.8751 10.8787 10.8949 10.8949 14.6416 14.6416 15.2579 15.2579 k = 0.4263-0.4284 0.5815 ( 2980 PWs) bands (ev): -3.9368 -3.9368 -3.7778 -3.7769 -3.7769 -3.7749 4.0222 4.0222 4.3125 4.3421 4.3421 4.3457 4.8700 4.8700 5.4822 5.4822 5.4915 5.5047 6.2539 6.2882 6.2882 6.2966 6.8746 6.8746 7.5925 7.5925 7.8849 7.8849 8.0415 8.0678 8.0769 8.0769 8.3382 8.3609 8.3728 8.3728 8.5950 8.6470 8.6471 8.7346 8.7506 8.7506 8.9606 8.9607 9.2332 9.2472 9.2472 9.3070 10.5805 10.5805 10.8541 10.8571 10.8737 10.8738 14.5536 14.5536 15.3200 15.3200 k = 0.4298-0.4227 0.5989 ( 2980 PWs) bands (ev): -3.9007 -3.9007 -3.7500 -3.7492 -3.7492 -3.7472 4.0148 4.0148 4.2881 4.3165 4.3165 4.3220 4.8018 4.8018 5.4620 5.4620 5.4769 5.4883 6.2452 6.2850 6.2850 6.2876 6.8446 6.8446 7.6067 7.6067 7.8658 7.8658 8.0378 8.0667 8.0784 8.0784 8.3446 8.3643 8.3773 8.3773 8.5977 8.6492 8.6492 8.7391 8.7535 8.7535 8.9442 8.9442 9.2200 9.2350 9.2350 9.2985 10.6600 10.6600 10.8316 10.8337 10.8514 10.8514 14.4611 14.4611 15.3900 15.3900 k = 0.4334-0.4170 0.6162 ( 2980 PWs) bands (ev): -3.8646 -3.8646 -3.7224 -3.7216 -3.7216 -3.7196 3.9952 3.9952 4.2589 4.2858 4.2858 4.2929 4.7484 4.7485 5.4468 5.4468 5.4674 5.4775 6.2374 6.2796 6.2832 6.2832 6.8159 6.8159 7.6205 7.6205 7.8482 7.8482 8.0341 8.0651 8.0790 8.0790 8.3505 8.3671 8.3818 8.3818 8.5999 8.6504 8.6505 8.7412 8.7557 8.7557 8.9265 8.9265 9.2129 9.2278 9.2278 9.2945 10.7361 10.7361 10.8075 10.8085 10.8300 10.8301 14.3680 14.3680 15.4585 15.4585 k = 0.4369-0.4114 0.6335 ( 2986 PWs) bands (ev): -3.8287 -3.8287 -3.6949 -3.6942 -3.6942 -3.6922 3.9625 3.9625 4.2254 4.2508 4.2508 4.2589 4.7110 4.7110 5.4360 5.4360 5.4626 5.4719 6.2308 6.2726 6.2828 6.2828 6.7886 6.7886 7.6335 7.6335 7.8325 7.8325 8.0306 8.0633 8.0789 8.0789 8.3559 8.3690 8.3859 8.3859 8.6017 8.6507 8.6508 8.7406 8.7572 8.7572 8.9077 8.9077 9.2113 9.2250 9.2250 9.2946 10.7803 10.7803 10.7817 10.7818 10.8378 10.8379 14.2765 14.2765 15.4288 15.4288 k = 0.4404-0.4057 0.6509 ( 2983 PWs) bands (ev): -3.7931 -3.7931 -3.6678 -3.6671 -3.6671 -3.6651 3.9175 3.9175 4.1883 4.2123 4.2123 4.2210 4.6889 4.6889 5.4294 5.4294 5.4620 5.4708 6.2254 6.2668 6.2839 6.2839 6.7627 6.7627 7.6453 7.6453 7.8194 7.8194 8.0275 8.0614 8.0784 8.0784 8.3606 8.3701 8.3897 8.3897 8.6033 8.6503 8.6504 8.7377 8.7579 8.7579 8.8883 8.8883 9.2148 9.2264 9.2264 9.2984 10.7534 10.7546 10.7618 10.7619 10.9054 10.9054 14.1877 14.1877 15.3542 15.3542 k = 0.4439-0.4000 0.6682 ( 2983 PWs) bands (ev): -3.7580 -3.7580 -3.6412 -3.6405 -3.6405 -3.6385 3.8624 3.8624 4.1485 4.1712 4.1712 4.1800 4.6798 4.6798 5.4262 5.4262 5.4650 5.4737 6.2213 6.2621 6.2865 6.2865 6.7381 6.7382 7.6550 7.6550 7.8097 7.8097 8.0246 8.0595 8.0774 8.0774 8.3647 8.3703 8.3929 8.3929 8.6046 8.6493 8.6493 8.7328 8.7572 8.7572 8.8685 8.8685 9.2227 9.2314 9.2315 9.3053 10.7235 10.7260 10.7332 10.7332 10.9800 10.9800 14.1025 14.1025 15.2839 15.2839 k = 0.4474-0.3943 0.6856 ( 2983 PWs) bands (ev): -3.7237 -3.7237 -3.6152 -3.6145 -3.6145 -3.6126 3.8003 3.8003 4.1067 4.1282 4.1282 4.1368 4.6809 4.6809 5.4257 5.4257 5.4708 5.4797 6.2185 6.2586 6.2904 6.2904 6.7151 6.7151 7.6616 7.6616 7.8044 7.8044 8.0222 8.0576 8.0762 8.0762 8.3681 8.3697 8.3955 8.3955 8.6059 8.6477 8.6477 8.7263 8.7546 8.7546 8.8494 8.8494 9.2344 9.2397 9.2397 9.3149 10.6924 10.6962 10.7019 10.7019 11.0540 11.0540 14.0214 14.0214 15.2196 15.2196 k = 0.4509-0.3887 0.7029 ( 2953 PWs) bands (ev): -3.6902 -3.6902 -3.5899 -3.5893 -3.5893 -3.5874 3.7343 3.7343 4.0638 4.0843 4.0843 4.0923 4.6894 4.6894 5.4275 5.4275 5.4789 5.4880 6.2171 6.2564 6.2958 6.2958 6.6934 6.6934 7.6646 7.6646 7.8043 7.8043 8.0205 8.0561 8.0749 8.0750 8.3684 8.3709 8.3977 8.3977 8.6073 8.6458 8.6459 8.7188 8.7490 8.7490 8.8325 8.8325 9.2491 9.2507 9.2508 9.3268 10.6602 10.6653 10.6690 10.6690 11.1262 11.1262 13.9448 13.9448 15.1617 15.1617 k = 0.4544-0.3830 0.7202 ( 2941 PWs) bands (ev): -3.6579 -3.6579 -3.5656 -3.5650 -3.5650 -3.5632 3.6667 3.6667 4.0207 4.0400 4.0400 4.0474 4.7030 4.7030 5.4309 5.4309 5.4885 5.4979 6.2171 6.2552 6.3023 6.3023 6.6734 6.6734 7.6634 7.6634 7.8095 7.8095 8.0190 8.0545 8.0734 8.0735 8.3664 8.3729 8.3991 8.3991 8.6087 8.6436 8.6437 8.7107 8.7387 8.7387 8.8190 8.8190 9.2640 9.2640 9.2661 9.3405 10.6272 10.6336 10.6349 10.6349 11.1961 11.1961 13.8729 13.8729 15.1100 15.1100 k = 0.4579-0.3773 0.7376 ( 2950 PWs) bands (ev): -3.6268 -3.6268 -3.5423 -3.5418 -3.5418 -3.5400 3.5995 3.5995 3.9781 3.9963 3.9963 4.0028 4.7198 4.7198 5.4352 5.4352 5.4991 5.5087 6.2182 6.2550 6.3097 6.3097 6.6545 6.6545 7.6590 7.6590 7.8190 7.8191 8.0179 8.0529 8.0718 8.0718 8.3637 8.3740 8.3997 8.3997 8.6101 8.6411 8.6411 8.7021 8.7233 8.7233 8.8099 8.8099 9.2789 9.2789 9.2847 9.3553 10.5937 10.6000 10.6000 10.6013 11.2632 11.2632 13.8058 13.8058 15.0643 15.0643 k = 0.4614-0.3717 0.7549 ( 2920 PWs) bands (ev): -3.5972 -3.5972 -3.5202 -3.5198 -3.5198 -3.5181 3.5342 3.5342 3.9367 3.9538 3.9538 3.9594 4.7385 4.7385 5.4403 5.4403 5.5102 5.5199 6.2208 6.2559 6.3182 6.3182 6.6373 6.6373 7.6526 7.6526 7.8323 7.8324 8.0174 8.0516 8.0703 8.0703 8.3610 8.3746 8.4000 8.4000 8.6116 8.6381 8.6381 8.6937 8.7042 8.7042 8.8047 8.8047 9.2953 9.2953 9.3047 9.3712 10.5601 10.5649 10.5649 10.5689 11.3271 11.3271 13.7439 13.7439 15.0243 15.0243 k = 0.4649-0.3660 0.7722 ( 2920 PWs) bands (ev): -3.5694 -3.5694 -3.4995 -3.4991 -3.4991 -3.4975 3.4720 3.4720 3.8970 3.9130 3.9130 3.9176 4.7579 4.7579 5.4456 5.4456 5.5214 5.5310 6.2243 6.2575 6.3272 6.3272 6.6215 6.6215 7.6450 7.6450 7.8477 7.8478 8.0172 8.0502 8.0686 8.0686 8.3578 8.3742 8.3996 8.3996 8.6132 8.6339 8.6339 8.6835 8.6835 8.6854 8.8019 8.8019 9.3125 9.3125 9.3253 9.3875 10.5269 10.5298 10.5298 10.5365 11.3873 11.3873 13.6872 13.6872 14.9897 14.9897 k = 0.4684-0.3603 0.7896 ( 2926 PWs) bands (ev): -3.5435 -3.5435 -3.4802 -3.4800 -3.4799 -3.4784 3.4137 3.4137 3.8596 3.8745 3.8745 3.8782 4.7774 4.7774 5.4509 5.4509 5.5322 5.5416 6.2287 6.2597 6.3365 6.3365 6.6071 6.6071 7.6370 7.6370 7.8646 7.8647 8.0174 8.0489 8.0668 8.0668 8.3546 8.3730 8.3986 8.3987 8.6148 8.6265 8.6265 8.6646 8.6646 8.6775 8.8004 8.8004 9.3302 9.3302 9.3462 9.4037 10.4944 10.4952 10.4952 10.5048 11.4435 11.4435 13.6358 13.6358 14.9601 14.9601 k = 0.4719-0.3547 0.8069 ( 2932 PWs) bands (ev): -3.5197 -3.5197 -3.4626 -3.4624 -3.4624 -3.4609 3.3600 3.3600 3.8250 3.8388 3.8388 3.8416 4.7962 4.7962 5.4560 5.4560 5.5424 5.5514 6.2339 6.2623 6.3459 6.3459 6.5943 6.5943 7.6290 7.6290 7.8824 7.8824 8.0179 8.0475 8.0649 8.0650 8.3515 8.3712 8.3973 8.3974 8.6127 8.6127 8.6165 8.6521 8.6521 8.6702 8.7998 8.7998 9.3479 9.3479 9.3670 9.4196 10.4617 10.4617 10.4632 10.4740 11.4952 11.4952 13.5896 13.5896 14.9351 14.9351 k = 0.4754-0.3490 0.8243 ( 2926 PWs) bands (ev): -3.4982 -3.4982 -3.4467 -3.4466 -3.4466 -3.4452 3.3115 3.3115 3.7937 3.8064 3.8064 3.8082 4.8138 4.8138 5.4607 5.4607 5.5518 5.5602 6.2396 6.2652 6.3551 6.3551 6.5829 6.5829 7.6215 7.6215 7.9005 7.9006 8.0189 8.0460 8.0631 8.0631 8.3488 8.3688 8.3958 8.3958 8.5933 8.5933 8.6185 8.6461 8.6461 8.6638 8.7995 8.7995 9.3653 9.3653 9.3873 9.4348 10.4300 10.4300 10.4338 10.4448 11.5421 11.5421 13.5489 13.5489 14.9144 14.9144 k = 0.4790-0.3433 0.8416 ( 2944 PWs) bands (ev): -3.4791 -3.4791 -3.4327 -3.4326 -3.4326 -3.4313 3.2687 3.2687 3.7660 3.7776 3.7776 3.7783 4.8299 4.8299 5.4648 5.4648 5.5602 5.5678 6.2455 6.2680 6.3638 6.3638 6.5730 6.5730 7.6146 7.6147 7.9183 7.9184 8.0201 8.0444 8.0610 8.0610 8.3463 8.3658 8.3938 8.3939 8.5721 8.5721 8.6204 8.6429 8.6429 8.6577 8.7995 8.7995 9.3818 9.3818 9.4066 9.4486 10.4005 10.4005 10.4069 10.4176 11.5836 11.5836 13.5136 13.5136 14.8974 14.8974 k = 0.4825-0.3376 0.8589 ( 2950 PWs) bands (ev): -3.4627 -3.4627 -3.4206 -3.4206 -3.4206 -3.4195 3.2318 3.2318 3.7421 3.7524 3.7527 3.7527 4.8440 4.8440 5.4684 5.4684 5.5677 5.5743 6.2515 6.2706 6.3717 6.3717 6.5646 6.5646 7.6087 7.6087 7.9356 7.9356 8.0216 8.0427 8.0588 8.0588 8.3447 8.3625 8.3919 8.3919 8.5517 8.5517 8.6223 8.6411 8.6411 8.6524 8.7996 8.7996 9.3970 9.3970 9.4247 9.4607 10.3740 10.3740 10.3830 10.3930 11.6195 11.6195 13.4837 13.4837 14.8839 14.8839 k = 0.4860-0.3320 0.8763 ( 2947 PWs) bands (ev): -3.4491 -3.4491 -3.4107 -3.4107 -3.4105 -3.4096 3.2013 3.2013 3.7225 3.7307 3.7320 3.7320 4.8560 4.8560 5.4715 5.4715 5.5739 5.5794 6.2571 6.2727 6.3786 6.3786 6.5578 6.5578 7.6036 7.6037 7.9515 7.9516 8.0235 8.0409 8.0566 8.0566 8.3436 8.3591 8.3899 8.3899 8.5335 8.5335 8.6244 8.6401 8.6401 8.6478 8.7997 8.7997 9.4104 9.4104 9.4411 9.4706 10.3512 10.3512 10.3628 10.3715 11.6494 11.6494 13.4592 13.4592 14.8734 14.8734 k = 0.4895-0.3263 0.8936 ( 2947 PWs) bands (ev): -3.4384 -3.4384 -3.4028 -3.4028 -3.4026 -3.4019 3.1772 3.1772 3.7072 3.7134 3.7156 3.7156 4.8655 4.8655 5.4738 5.4738 5.5790 5.5832 6.2623 6.2741 6.3842 6.3842 6.5525 6.5525 7.5997 7.5997 7.9655 7.9655 8.0255 8.0389 8.0543 8.0543 8.3434 8.3557 8.3879 8.3880 8.5183 8.5184 8.6266 8.6394 8.6394 8.6436 8.7999 8.7999 9.4215 9.4215 9.4554 9.4780 10.3326 10.3326 10.3467 10.3538 11.6730 11.6730 13.4402 13.4402 14.8657 14.8657 k = 0.4930-0.3206 0.9109 ( 2965 PWs) bands (ev): -3.4307 -3.4307 -3.3972 -3.3972 -3.3969 -3.3964 3.1600 3.1600 3.6965 3.7006 3.7038 3.7038 4.8724 4.8724 5.4754 5.4754 5.5828 5.5857 6.2666 6.2746 6.3883 6.3883 6.5485 6.5485 7.5968 7.5968 7.9764 7.9765 8.0277 8.0368 8.0521 8.0521 8.3438 8.3524 8.3863 8.3863 8.5070 8.5070 8.6287 8.6388 8.6389 8.6399 8.8000 8.8000 9.4297 9.4297 9.4670 9.4824 10.3187 10.3187 10.3352 10.3401 11.6900 11.6900 13.4266 13.4266 14.8603 14.8603 k = 0.4965-0.3150 0.9283 ( 2962 PWs) bands (ev): -3.4260 -3.4260 -3.3938 -3.3938 -3.3934 -3.3931 3.1496 3.1496 3.6904 3.6924 3.6967 3.6967 4.8766 4.8766 5.4765 5.4765 5.5854 5.5869 6.2701 6.2741 6.3909 6.3909 6.5462 6.5462 7.5950 7.5950 7.9838 7.9838 8.0300 8.0346 8.0504 8.0504 8.3450 8.3494 8.3851 8.3851 8.5001 8.5001 8.6312 8.6367 8.6387 8.6387 8.8000 8.8000 9.4348 9.4348 9.4758 9.4835 10.3103 10.3103 10.3287 10.3313 11.7003 11.7003 13.4184 13.4184 14.8572 14.8572 k = 0.5000-0.3093 0.9456 ( 2962 PWs) bands (ev): -3.4244 -3.4244 -3.3927 -3.3927 -3.3921 -3.3921 3.1461 3.1461 3.6890 3.6890 3.6943 3.6943 4.8780 4.8780 5.4768 5.4768 5.5868 5.5868 6.2727 6.2727 6.3918 6.3918 6.5455 6.5455 7.5945 7.5945 7.9864 7.9864 8.0323 8.0323 8.0498 8.0498 8.3469 8.3469 8.3847 8.3847 8.4977 8.4977 8.6338 8.6338 8.6386 8.6386 8.8001 8.8001 9.4366 9.4366 9.4813 9.4813 10.3074 10.3074 10.3274 10.3274 11.7037 11.7037 13.4157 13.4157 14.8562 14.8562 k = 0.5000-0.3093 0.9456 ( 2962 PWs) bands (ev): -3.4244 -3.4244 -3.3927 -3.3927 -3.3921 -3.3921 3.1461 3.1461 3.6890 3.6890 3.6943 3.6943 4.8780 4.8780 5.4768 5.4768 5.5868 5.5868 6.2727 6.2727 6.3918 6.3918 6.5455 6.5455 7.5945 7.5945 7.9864 7.9864 8.0323 8.0323 8.0498 8.0498 8.3469 8.3469 8.3847 8.3847 8.4977 8.4977 8.6338 8.6338 8.6386 8.6386 8.8001 8.8001 9.4366 9.4366 9.4813 9.4813 10.3074 10.3074 10.3274 10.3274 11.7037 11.7037 13.4157 13.4157 14.8562 14.8562 k = 0.4917-0.2926 0.9456 ( 2958 PWs) bands (ev): -3.4368 -3.4338 -3.3925 -3.3924 -3.3828 -3.3800 3.1430 3.1441 3.6909 3.6909 3.6961 3.6978 4.8740 4.8769 5.4767 5.4788 5.5874 5.5877 6.2710 6.2718 6.3886 6.3907 6.5474 6.5474 7.5962 7.5971 7.9812 7.9866 8.0312 8.0315 8.0512 8.0527 8.3461 8.3470 8.3846 8.3868 8.4963 8.4994 8.6332 8.6343 8.6380 8.6393 8.7989 8.8009 9.4336 9.4367 9.4797 9.4811 10.3080 10.3105 10.3303 10.3312 11.7002 11.7020 13.4127 13.4148 14.8490 14.8525 k = 0.4833-0.2759 0.9456 ( 2960 PWs) bands (ev): -3.4564 -3.4529 -3.3923 -3.3922 -3.3640 -3.3607 3.1351 3.1374 3.6937 3.6940 3.7051 3.7088 4.8649 4.8706 5.4785 5.4824 5.5894 5.5900 6.2669 6.2684 6.3814 6.3854 6.5530 6.5530 7.6020 7.6040 7.9720 7.9819 8.0284 8.0297 8.0551 8.0592 8.3445 8.3464 8.3864 8.3906 8.4953 8.5014 8.6323 8.6348 8.6376 8.6399 8.7974 8.8013 9.4277 9.4342 9.4764 9.4790 10.3108 10.3174 10.3395 10.3429 11.6916 11.6950 13.4058 13.4100 14.8289 14.8371 k = 0.4750-0.2591 0.9456 ( 2950 PWs) bands (ev): -3.4771 -3.4735 -3.3920 -3.3918 -3.3437 -3.3403 3.1231 3.1263 3.6974 3.6976 3.7215 3.7269 4.8511 4.8594 5.4822 5.4876 5.5928 5.5939 6.2606 6.2625 6.3711 6.3766 6.5614 6.5616 7.6119 7.6148 7.9601 7.9738 8.0244 8.0285 8.0599 8.0675 8.3425 8.3457 8.3896 8.3959 8.4947 8.5036 8.6309 8.6352 8.6376 8.6404 8.7957 8.8015 9.4192 9.4294 9.4718 9.4750 10.3150 10.3263 10.3564 10.3629 11.6779 11.6830 13.3945 13.4007 14.7977 14.8097 k = 0.4666-0.2424 0.9456 ( 2952 PWs) bands (ev): -3.4981 -3.4945 -3.3916 -3.3913 -3.3232 -3.3198 3.1079 3.1120 3.7021 3.7023 3.7437 3.7505 4.8331 4.8438 5.4877 5.4939 5.5976 5.5993 6.2521 6.2545 6.3580 6.3649 6.5719 6.5725 7.6254 7.6294 7.9460 7.9634 8.0196 8.0268 8.0647 8.0764 8.3403 8.3451 8.3939 8.4021 8.4945 8.5059 8.6291 8.6355 8.6380 8.6408 8.7936 8.8013 9.4085 9.4227 9.4659 9.4693 10.3205 10.3362 10.3808 10.3899 11.6595 11.6661 13.3783 13.3862 14.7600 14.7750 k = 0.4583-0.2257 0.9456 ( 2950 PWs) bands (ev): -3.5190 -3.5154 -3.3910 -3.3907 -3.3030 -3.2996 3.0903 3.0951 3.7081 3.7082 3.7703 3.7787 4.8115 4.8242 5.4948 5.5012 5.6037 5.6063 6.2418 6.2444 6.3429 6.3509 6.5839 6.5849 7.6420 7.6471 7.9303 7.9518 8.0144 8.0246 8.0692 8.0856 8.3383 8.3448 8.3990 8.4092 8.4946 8.5082 8.6269 8.6356 8.6388 8.6413 8.7913 8.8010 9.3963 9.4144 9.4587 9.4624 10.3275 10.3471 10.4117 10.4228 11.6366 11.6446 13.3565 13.3658 14.7201 14.7376 k = 0.4499-0.2090 0.9456 ( 2954 PWs) bands (ev): -3.5397 -3.5361 -3.3903 -3.3899 -3.2831 -3.2798 3.0712 3.0766 3.7152 3.7153 3.8001 3.8101 4.7868 4.8014 5.5034 5.5093 5.6113 5.6148 6.2299 6.2325 6.3262 6.3351 6.5970 6.5984 7.6611 7.6674 7.9135 7.9394 8.0090 8.0218 8.0732 8.0947 8.3366 8.3450 8.4047 8.4169 8.4952 8.5105 8.6244 8.6354 8.6399 8.6418 8.7889 8.8004 9.3831 9.4050 9.4503 9.4544 10.3360 10.3590 10.4476 10.4604 11.6096 11.6189 13.3285 13.3388 14.6820 14.7014 k = 0.4416-0.1923 0.9456 ( 2966 PWs) bands (ev): -3.5601 -3.5566 -3.3894 -3.3890 -3.2638 -3.2605 3.0512 3.0572 3.7235 3.7236 3.8321 3.8438 4.7599 4.7762 5.5132 5.5180 5.6203 5.6250 6.2166 6.2191 6.3081 6.3180 6.6107 6.6124 7.6818 7.6896 7.8959 7.9266 8.0034 8.0185 8.0768 8.1039 8.3352 8.3457 8.4107 8.4250 8.4961 8.5125 8.6216 8.6348 8.6412 8.6424 8.7864 8.7997 9.3697 9.3948 9.4409 9.4459 10.3457 10.3717 10.4874 10.5014 11.5791 11.5895 13.2939 13.3047 14.6485 14.6691 k = 0.4333-0.1755 0.9456 ( 2965 PWs) bands (ev): -3.5801 -3.5766 -3.3884 -3.3879 -3.2451 -3.2419 3.0309 3.0374 3.7330 3.7330 3.8652 3.8788 4.7316 4.7494 5.5240 5.5272 5.6307 5.6368 6.2023 6.2046 6.2891 6.2998 6.6249 6.6268 7.7033 7.7130 7.8779 7.9139 7.9979 8.0150 8.0800 8.1131 8.3345 8.3472 8.4170 8.4336 8.4974 8.5145 8.6187 8.6340 8.6428 8.6430 8.7840 8.7991 9.3565 9.3840 9.4304 9.4371 10.3564 10.3851 10.5299 10.5449 11.5455 11.5568 13.2529 13.2635 14.6213 14.6424 k = 0.4249-0.1588 0.9456 ( 2964 PWs) bands (ev): -3.5995 -3.5961 -3.3873 -3.3867 -3.2272 -3.2241 3.0107 3.0175 3.7434 3.7435 3.8985 3.9142 4.7026 4.7221 5.5356 5.5368 5.6425 5.6500 6.1871 6.1892 6.2693 6.2809 6.6394 6.6414 7.7242 7.7364 7.8598 7.9020 7.9927 8.0113 8.0832 8.1225 8.3344 8.3492 8.4235 8.4424 8.4989 8.5162 8.6157 8.6330 8.6435 8.6445 8.7819 8.7986 9.3438 9.3729 9.4191 9.4284 10.3678 10.3989 10.5739 10.5898 11.5093 11.5213 13.2059 13.2158 14.6008 14.6215 k = 0.4166-0.1421 0.9456 ( 2960 PWs) bands (ev): -3.6185 -3.6151 -3.3859 -3.3853 -3.2101 -3.2071 2.9907 2.9980 3.7549 3.7550 3.9310 3.9490 4.6739 4.6952 5.5468 5.5479 5.6558 5.6646 6.1714 6.1732 6.2490 6.2616 6.6540 6.6560 7.7428 7.7582 7.8427 7.8916 7.9880 8.0077 8.0869 8.1321 8.3350 8.3518 8.4303 8.4514 8.5008 8.5177 8.6126 8.6319 8.6440 8.6463 8.7801 8.7984 9.3318 9.3614 9.4070 9.4201 10.3797 10.4128 10.6184 10.6348 11.4711 11.4837 13.1541 13.1627 14.5861 14.6055 k = 0.4082-0.1254 0.9456 ( 2962 PWs) bands (ev): -3.6368 -3.6335 -3.3844 -3.3837 -3.1939 -3.1911 2.9713 2.9789 3.7672 3.7674 3.9616 3.9824 4.6465 4.6697 5.5571 5.5607 5.6702 5.6804 6.1553 6.1568 6.2285 6.2419 6.6685 6.6705 7.7567 7.7747 7.8290 7.8840 7.9839 8.0041 8.0913 8.1423 8.3365 8.3549 8.4371 8.4606 8.5029 8.5188 8.6094 8.6307 8.6441 8.6481 8.7787 8.7985 9.3206 9.3495 9.3946 9.4125 10.3916 10.4263 10.6623 10.6791 11.4316 11.4444 13.0990 13.1057 14.5750 14.5916 k = 0.3999-0.1087 0.9456 ( 2959 PWs) bands (ev): -3.6545 -3.6512 -3.3826 -3.3819 -3.1788 -3.1760 2.9525 2.9603 3.7804 3.7807 3.9895 4.0132 4.6215 4.6469 5.5677 5.5738 5.6857 5.6971 6.1394 6.1405 6.2081 6.2224 6.6830 6.6846 7.7637 7.7779 7.8260 7.8807 7.9809 8.0005 8.0974 8.1534 8.3389 8.3586 8.4441 8.4699 8.5056 8.5196 8.6063 8.6294 8.6441 8.6497 8.7781 8.7990 9.3100 9.3371 9.3820 9.4060 10.4032 10.4393 10.7045 10.7215 11.3912 11.4042 13.0423 13.0467 14.5640 14.5762 k = 0.3915-0.0920 0.9456 ( 2963 PWs) bands (ev): -3.6714 -3.6683 -3.3807 -3.3800 -3.1648 -3.1622 2.9343 2.9424 3.7944 3.7947 4.0135 4.0405 4.6000 4.6277 5.5786 5.5872 5.7018 5.7143 6.1240 6.1246 6.1881 6.2031 6.6972 6.6983 7.7628 7.7663 7.8340 7.8817 7.9789 7.9970 8.1057 8.1658 8.3423 8.3626 8.4514 8.4790 8.5090 8.5202 8.6032 8.6282 8.6436 8.6511 8.7782 8.8000 9.2999 9.3241 9.3697 9.4008 10.4141 10.4512 10.7441 10.7610 11.3505 11.3634 12.9859 12.9877 14.5499 14.5575 k = 0.3832-0.0752 0.9456 ( 2963 PWs) bands (ev): -3.6877 -3.6846 -3.3786 -3.3778 -3.1520 -3.1495 2.9167 2.9251 3.8090 3.8094 4.0330 4.0632 4.5830 4.6132 5.5898 5.6007 5.7180 5.7314 6.1096 6.1098 6.1690 6.1845 6.7110 6.7116 7.7490 7.7550 7.8434 7.8855 7.9781 7.9933 8.1167 8.1798 8.3467 8.3671 8.4590 8.4872 8.5139 8.5206 8.6004 8.6271 8.6428 8.6521 8.7792 8.8016 9.2900 9.3107 9.3582 9.3967 10.4241 10.4619 10.7799 10.7966 11.3100 11.3227 12.9305 12.9316 14.5320 14.5369 k = 0.3749-0.0585 0.9456 ( 2968 PWs) bands (ev): -3.7031 -3.7002 -3.3762 -3.3754 -3.1404 -3.1381 2.8998 2.9084 3.8242 3.8246 4.0474 4.0807 4.5715 4.6039 5.6012 5.6143 5.7336 5.7475 6.0960 6.0975 6.1514 6.1670 6.7243 6.7244 7.7300 7.7424 7.8501 7.8897 7.9780 7.9891 8.1305 8.1956 8.3521 8.3718 8.4671 8.4939 8.5208 8.5212 8.5977 8.6263 8.6417 8.6527 8.7810 8.8035 9.2797 9.2971 9.3480 9.3939 10.4326 10.4708 10.8110 10.8273 11.2704 11.2827 12.8769 12.8812 14.5118 14.5156 k = 0.3665-0.0418 0.9456 ( 2969 PWs) bands (ev): -3.7178 -3.7150 -3.3737 -3.3728 -3.1302 -3.1280 2.8834 2.8922 3.8398 3.8404 4.0565 4.0924 4.5659 4.6001 5.6127 5.6279 5.7474 5.7618 6.0838 6.0875 6.1367 6.1514 6.7363 6.7373 7.7101 7.7266 7.8535 7.8933 7.9780 7.9844 8.1467 8.2133 8.3583 8.3766 8.4757 8.4988 8.5209 8.5310 8.5954 8.6259 8.6403 8.6530 8.7836 8.8060 9.2690 9.2834 9.3397 9.3920 10.4395 10.4778 10.8365 10.8520 11.2319 11.2437 12.8285 12.8361 14.4893 14.4925 k = 0.3582-0.0251 0.9456 ( 2963 PWs) bands (ev): -3.7316 -3.7289 -3.3708 -3.3700 -3.1214 -3.1193 2.8675 2.8765 3.8558 3.8565 4.0608 4.0987 4.5661 4.6016 5.6243 5.6415 5.7585 5.7731 6.0723 6.0796 6.1271 6.1395 6.7475 6.7496 7.6898 7.7087 7.8541 7.8956 7.9775 7.9792 8.1647 8.2324 8.3652 8.3814 8.4849 8.5024 8.5212 8.5429 8.5937 8.6261 8.6390 8.6529 8.7869 8.8087 9.2579 9.2701 9.3333 9.3910 10.4444 10.4824 10.8554 10.8701 11.1950 11.2062 12.7867 12.7977 14.4621 14.4639 k = 0.3498-0.0084 0.9456 ( 2967 PWs) bands (ev): -3.7445 -3.7420 -3.3678 -3.3669 -3.1140 -3.1121 2.8521 2.8611 3.8721 3.8729 4.0611 4.1003 4.5714 4.6075 5.6357 5.6547 5.7656 5.7803 6.0598 6.0718 6.1254 6.1343 6.7579 6.7611 7.6690 7.6892 7.8526 7.8968 7.9733 7.9759 8.1836 8.2525 8.3724 8.3860 8.4943 8.5052 8.5221 8.5557 8.5927 8.6267 8.6384 8.6525 8.7907 8.8114 9.2466 9.2575 9.3287 9.3906 10.4470 10.4846 10.8673 10.8809 11.1601 11.1706 12.7526 12.7669 14.4269 14.4277 k = 0.3415 0.0084 0.9456 ( 2967 PWs) bands (ev): -3.7566 -3.7541 -3.3645 -3.3635 -3.1082 -3.1064 2.8369 2.8459 3.8885 3.8895 4.0586 4.0984 4.5806 4.6168 5.6468 5.6674 5.7685 5.7832 6.0456 6.0616 6.1332 6.1391 6.7674 6.7718 7.6479 7.6684 7.8497 7.8972 7.9669 7.9730 8.2026 8.2728 8.3798 8.3903 8.5026 8.5076 8.5249 8.5680 8.5930 8.6270 8.6409 8.6521 8.7946 8.8140 9.2358 9.2461 9.3256 9.3906 10.4473 10.4840 10.8715 10.8839 11.1272 11.1371 12.7268 12.7443 14.3833 14.3870 k = 0.3331 0.0251 0.9456 ( 2971 PWs) bands (ev): -3.7678 -3.7654 -3.3609 -3.3599 -3.1039 -3.1023 2.8221 2.8310 3.9050 3.9062 4.0545 4.0944 4.5924 4.6283 5.6572 5.6794 5.7674 5.7823 6.0301 6.0487 6.1499 6.1542 6.7758 6.7815 7.6264 7.6466 7.8458 7.8969 7.9602 7.9689 8.2212 8.2926 8.3871 8.3940 8.5075 8.5097 8.5311 8.5782 8.5951 8.6258 8.6491 8.6522 8.7982 8.8160 9.2261 9.2364 9.3238 9.3906 10.4452 10.4807 10.8681 10.8791 11.0967 11.1058 12.7094 12.7300 14.3364 14.3429 k = 0.3248 0.0418 0.9456 ( 2969 PWs) bands (ev): -3.7780 -3.7758 -3.3570 -3.3561 -3.1012 -3.0998 2.8075 2.8162 3.9214 3.9229 4.0498 4.0895 4.6055 4.6408 5.6666 5.6898 5.7637 5.7786 6.0142 6.0341 6.1744 6.1778 6.7832 6.7902 7.6045 7.6240 7.8415 7.8963 7.9533 7.9639 8.2391 8.3115 8.3941 8.3973 8.5092 8.5117 8.5395 8.5852 8.6001 8.6237 8.6535 8.6635 8.8012 8.8174 9.2183 9.2289 9.3229 9.3907 10.4406 10.4747 10.8572 10.8669 11.0684 11.0768 12.7004 12.7237 14.2892 14.2982 k = 0.3165 0.0585 0.9456 ( 2971 PWs) bands (ev): -3.7873 -3.7853 -3.3529 -3.3519 -3.1002 -3.0989 2.7931 2.8017 3.9377 3.9395 4.0456 4.0849 4.6189 4.6535 5.6742 5.6977 5.7594 5.7738 5.9982 6.0188 6.2050 6.2078 6.7894 6.7977 7.5823 7.6007 7.8369 7.8955 7.9464 7.9581 8.2559 8.3289 8.3998 8.4007 8.5093 8.5135 8.5470 8.5892 8.6077 8.6215 8.6576 8.6831 8.8030 8.8177 9.2130 9.2241 9.3226 9.3905 10.4338 10.4661 10.8393 10.8477 11.0424 11.0502 12.6990 12.7246 14.2440 14.2554 k = 0.3081 0.0752 0.9456 ( 2973 PWs) bands (ev): -3.7957 -3.7938 -3.3485 -3.3475 -3.1008 -3.0997 2.7790 2.7873 3.9538 3.9559 4.0425 4.0812 4.6318 4.6656 5.6791 5.7011 5.7572 5.7697 5.9826 6.0034 6.2404 6.2427 6.7944 6.8040 7.5598 7.5769 7.8324 7.8947 7.9397 7.9518 8.2716 8.3444 8.4017 8.4070 8.5087 8.5150 8.5523 8.5910 8.6154 8.6193 8.6676 8.7059 8.8034 8.8171 9.2105 9.2225 9.3229 9.3900 10.4248 10.4552 10.8152 10.8224 11.0185 11.0258 12.7043 12.7318 14.2029 14.2163 k = 0.2998 0.0920 0.9456 ( 2977 PWs) bands (ev): -3.8032 -3.8014 -3.3439 -3.3429 -3.1030 -3.1020 2.7652 2.7731 3.9695 3.9720 4.0411 4.0789 4.6435 4.6765 5.6807 5.6990 5.7590 5.7677 5.9677 5.9882 6.2794 6.2811 6.7980 6.8089 7.5371 7.5528 7.8279 7.8939 7.9332 7.9453 8.2862 8.3575 8.4029 8.4134 8.5079 8.5163 8.5558 8.5914 8.6177 8.6202 8.6852 8.7298 8.8021 8.8165 9.2112 9.2244 9.3236 9.3889 10.4141 10.4424 10.7859 10.7920 10.9966 11.0035 12.7151 12.7438 14.1675 14.1826 k = 0.2914 0.1087 0.9456 ( 2985 PWs) bands (ev): -3.8098 -3.8082 -3.3389 -3.3379 -3.1069 -3.1061 2.7518 2.7593 3.9847 3.9878 4.0416 4.0784 4.6537 4.6857 5.6789 5.6928 5.7638 5.7685 5.9536 5.9735 6.3210 6.3221 6.8004 6.8125 7.5143 7.5285 7.8237 7.8932 7.9270 7.9387 8.2996 8.3678 8.4036 8.4200 8.5071 8.5172 8.5585 8.5909 8.6166 8.6221 8.7091 8.7508 8.7993 8.8189 9.2151 9.2299 9.3247 9.3872 10.4020 10.4280 10.7522 10.7573 10.9765 10.9831 12.7300 12.7592 14.1392 14.1556 k = 0.2831 0.1254 0.9456 ( 2987 PWs) bands (ev): -3.8155 -3.8140 -3.3337 -3.3327 -3.1124 -3.1117 2.7390 2.7460 3.9994 4.0032 4.0442 4.0798 4.6622 4.6931 5.6745 5.6848 5.7697 5.7713 5.9409 5.9595 6.3642 6.3647 6.8015 6.8146 7.4915 7.5042 7.8199 7.8926 7.9214 7.9322 8.3120 8.3752 8.4039 8.4270 8.5066 8.5178 8.5612 8.5898 8.6164 8.6224 8.7358 8.7626 8.7961 8.8300 9.2220 9.2390 9.3266 9.3850 10.3889 10.4125 10.7154 10.7196 10.9582 10.9644 12.7477 12.7768 14.1188 14.1361 k = 0.2747 0.1421 0.9456 ( 2987 PWs) bands (ev): -3.8204 -3.8190 -3.3282 -3.3272 -3.1194 -3.1189 2.7269 2.7333 4.0135 4.0182 4.0488 4.0830 4.6687 4.6983 5.6688 5.6766 5.7750 5.7751 5.9299 5.9468 6.4081 6.4083 6.8012 6.8153 7.4690 7.4803 7.8163 7.8922 7.9163 7.9261 8.3233 8.3798 8.4039 8.4339 8.5064 8.5180 8.5644 8.5884 8.6169 8.6221 8.7590 8.7628 8.7972 8.8520 9.2312 9.2512 9.3293 9.3823 10.3753 10.3965 10.6764 10.6797 10.9414 10.9474 12.7668 12.7951 14.1072 14.1248 k = 0.2664 0.1588 0.9456 ( 2991 PWs) bands (ev): -3.8244 -3.8232 -3.3224 -3.3214 -3.1280 -3.1277 2.7156 2.7214 4.0270 4.0327 4.0553 4.0878 4.6733 4.7015 5.6629 5.6691 5.7786 5.7786 5.9211 5.9357 6.4517 6.4526 6.7997 6.8144 7.4470 7.4569 7.8131 7.8919 7.9117 7.9203 8.3332 8.3822 8.4037 8.4401 8.5067 8.5179 8.5684 8.5869 8.6181 8.6217 8.7562 8.7648 8.8156 8.8795 9.2421 9.2661 9.3334 9.3793 10.3617 10.3804 10.6361 10.6385 10.9262 10.9319 12.7865 12.8132 14.1045 14.1219 k = 0.2581 0.1755 0.9456 ( 2986 PWs) bands (ev): -3.8276 -3.8265 -3.3163 -3.3154 -3.1381 -3.1379 2.7054 2.7106 4.0400 4.0466 4.0632 4.0939 4.6762 4.7026 5.6576 5.6629 5.7797 5.7805 5.9151 5.9267 6.4947 6.4965 6.7969 6.8122 7.4258 7.4343 7.8103 7.8917 7.9079 7.9149 8.3418 8.3828 8.4036 8.4452 8.5074 8.5176 8.5733 8.5858 8.6199 8.6218 8.7464 8.7587 8.8455 8.9087 9.2538 9.2830 9.3395 9.3761 10.3485 10.3648 10.5955 10.5969 10.9124 10.9179 12.8057 12.8303 14.1107 14.1273 k = 0.2497 0.1923 0.9456 ( 2984 PWs) bands (ev): -3.8301 -3.8292 -3.3100 -3.3091 -3.1496 -3.1495 2.6964 2.7010 4.0525 4.0599 4.0721 4.1010 4.6775 4.7019 5.6534 5.6584 5.7778 5.7802 5.9120 5.9204 6.5366 6.5391 6.7930 6.8085 7.4057 7.4130 7.8079 7.8917 7.9046 7.9101 8.3488 8.3819 8.4037 8.4488 8.5083 8.5169 8.5789 8.5850 8.6221 8.6227 8.7353 8.7493 8.8777 8.9374 9.2658 9.3009 9.3477 9.3733 10.3363 10.3503 10.5553 10.5556 10.9002 10.9053 12.8240 12.8459 14.1250 14.1404 k = 0.2414 0.2090 0.9456 ( 2984 PWs) bands (ev): -3.8319 -3.8311 -3.3034 -3.3026 -3.1625 -3.1624 2.6889 2.6928 4.0646 4.0726 4.0815 4.1086 4.6775 4.6995 5.6505 5.6555 5.7731 5.7770 5.9117 5.9170 6.5766 6.5799 6.7880 6.8035 7.3871 7.3931 7.8057 7.8916 7.9019 7.9058 8.3541 8.3800 8.4043 8.4512 8.5091 8.5161 8.5847 8.5849 8.6246 8.6251 8.7235 8.7387 8.9097 8.9641 9.2778 9.3189 9.3581 9.3715 10.3256 10.3374 10.5154 10.5163 10.8896 10.8943 12.8411 12.8600 14.1464 14.1601 k = 0.2330 0.2257 0.9456 ( 2985 PWs) bands (ev): -3.8331 -3.8325 -3.2966 -3.2958 -3.1766 -3.1764 2.6830 2.6862 4.0763 4.0846 4.0908 4.1163 4.6766 4.6957 5.6490 5.6545 5.7659 5.7708 5.9138 5.9165 6.6141 6.6181 6.7820 6.7974 7.3704 7.3753 7.8038 7.8915 7.8999 7.9021 8.3574 8.3772 8.4053 8.4526 8.5097 8.5151 8.5855 8.5897 8.6272 8.6296 8.7118 8.7277 8.9401 8.9877 9.2904 9.3352 9.3700 9.3718 10.3171 10.3267 10.4770 10.4793 10.8807 10.8849 12.8571 12.8726 14.1734 14.1851 k = 0.2247 0.2424 0.9456 ( 2987 PWs) bands (ev): -3.8338 -3.8333 -3.2896 -3.2888 -3.1918 -3.1915 2.6789 2.6814 4.0874 4.0957 4.0998 4.1237 4.6751 4.6910 5.6489 5.6551 5.7570 5.7623 5.9175 5.9184 6.6484 6.6532 6.7752 6.7902 7.3561 7.3599 7.8022 7.8913 7.8984 7.8988 8.3591 8.3737 8.4068 8.4533 8.5099 8.5139 8.5870 8.5933 8.6297 8.6364 8.7006 8.7166 8.9678 9.0071 9.3041 9.3474 9.3764 9.3825 10.3111 10.3187 10.4409 10.4449 10.8736 10.8772 12.8719 12.8840 14.2041 14.2134 k = 0.2163 0.2591 0.9456 ( 2987 PWs) bands (ev): -3.8341 -3.8338 -3.2823 -3.2816 -3.2078 -3.2075 2.6767 2.6786 4.0978 4.1059 4.1080 4.1303 4.6734 4.6857 5.6500 5.6571 5.7473 5.7521 5.9222 5.9223 6.6790 6.6842 6.7676 6.7823 7.3446 7.3474 7.8009 7.8912 7.8962 7.8975 8.3593 8.3695 8.4083 8.4536 8.5099 8.5126 8.5893 8.5956 8.6319 8.6453 8.6905 8.7059 8.9920 9.0216 9.3194 9.3546 9.3860 9.3946 10.3081 10.3136 10.4079 10.4140 10.8685 10.8714 12.8858 12.8945 14.2362 14.2431 k = 0.2080 0.2759 0.9456 ( 2987 PWs) bands (ev): -3.8342 -3.8340 -3.2749 -3.2742 -3.2246 -3.2242 2.6766 2.6779 4.1074 4.1148 4.1151 4.1359 4.6719 4.6803 5.6518 5.6598 5.7376 5.7414 5.9272 5.9277 6.7050 6.7104 6.7594 6.7741 7.3366 7.3384 7.7998 7.8911 7.8940 7.8969 8.3584 8.3649 8.4097 8.4536 8.5095 8.5111 8.5924 8.5970 8.6333 8.6552 8.6822 8.6958 9.0118 9.0312 9.3361 9.3595 9.3972 9.4052 10.3081 10.3115 10.3788 10.3875 10.8655 10.8676 12.8990 12.9045 14.2670 14.2714 k = 0.1997 0.2926 0.9456 ( 2989 PWs) bands (ev): -3.8341 -3.8340 -3.2672 -3.2666 -3.2419 -3.2414 2.6788 2.6794 4.1156 4.1210 4.1220 4.1407 4.6708 4.6751 5.6531 5.6621 5.7294 5.7316 5.9330 5.9335 6.7258 6.7300 6.7509 6.7666 7.3323 7.3331 7.7988 7.8911 7.8924 7.8965 8.3568 8.3599 8.4107 8.4534 8.5088 8.5094 8.5957 8.5978 8.6337 8.6655 8.6764 8.6867 9.0269 9.0361 9.3530 9.3641 9.4077 9.4142 10.3103 10.3113 10.3552 10.3673 10.8648 10.8659 12.9115 12.9141 14.2923 14.2942 k = 0.1913 0.3093 0.9456 ( 2989 PWs) bands (ev): -3.8341 -3.8341 -3.2598 -3.2590 -3.2590 -3.2587 2.6832 2.6832 4.1215 4.1264 4.1265 4.1452 4.6706 4.6706 5.6519 5.6619 5.7249 5.7249 5.9393 5.9393 6.7389 6.7389 6.7445 6.7640 7.3320 7.3321 7.7982 7.8912 7.8912 7.8964 8.3546 8.3547 8.4112 8.4530 8.5077 8.5078 8.5982 8.5982 8.6335 8.6733 8.6733 8.6808 9.0371 9.0371 9.3682 9.3682 9.4167 9.4220 10.3101 10.3101 10.3421 10.3565 10.8665 10.8665 12.9235 12.9235 14.3049 14.3049 k = 0.1913 0.3093 0.9456 ( 2989 PWs) bands (ev): -3.8341 -3.8341 -3.2598 -3.2590 -3.2590 -3.2587 2.6832 2.6832 4.1215 4.1264 4.1265 4.1452 4.6706 4.6706 5.6519 5.6619 5.7249 5.7249 5.9393 5.9393 6.7389 6.7389 6.7445 6.7640 7.3320 7.3321 7.7982 7.8912 7.8912 7.8964 8.3546 8.3547 8.4112 8.4530 8.5077 8.5078 8.5982 8.5982 8.6335 8.6733 8.6733 8.6808 9.0371 9.0371 9.3682 9.3682 9.4167 9.4220 10.3101 10.3101 10.3421 10.3565 10.8665 10.8665 12.9235 12.9235 14.3049 14.3049 k = 0.1878 0.3037 0.9284 ( 2995 PWs) bands (ev): -3.8349 -3.8349 -3.2353 -3.2343 -3.2343 -3.2340 2.6586 2.6586 4.1021 4.1053 4.1053 4.1217 4.6807 4.6807 5.6676 5.6731 5.7402 5.7402 5.9079 5.9079 6.7302 6.7302 6.7334 6.7545 7.3244 7.3244 7.8011 7.8929 7.8929 7.8971 8.3732 8.3733 8.4098 8.4550 8.5156 8.5158 8.5931 8.5931 8.6333 8.6714 8.6714 8.6800 9.0188 9.0189 9.3249 9.3249 9.3731 9.3818 10.3320 10.3320 10.3698 10.3838 10.8512 10.8512 12.8718 12.8718 14.2929 14.2929 k = 0.1844 0.2980 0.9112 ( 3001 PWs) bands (ev): -3.8388 -3.8388 -3.2123 -3.2111 -3.2111 -3.2108 2.6406 2.6406 4.0853 4.0870 4.0870 4.1010 4.6903 4.6903 5.6816 5.6829 5.7540 5.7540 5.8776 5.8776 6.7202 6.7202 6.7218 6.7440 7.3171 7.3171 7.8043 7.8947 7.8947 7.8981 8.3888 8.3889 8.4083 8.4568 8.5237 8.5238 8.5874 8.5874 8.6326 8.6694 8.6694 8.6785 9.0019 9.0019 9.2828 9.2828 9.3307 9.3427 10.3586 10.3586 10.4023 10.4156 10.8303 10.8303 12.8260 12.8260 14.2845 14.2845 k = 0.1809 0.2924 0.8940 ( 2980 PWs) bands (ev): -3.8459 -3.8459 -3.1910 -3.1896 -3.1896 -3.1892 2.6295 2.6295 4.0716 4.0716 4.0717 4.0835 4.6992 4.6992 5.6907 5.6935 5.7658 5.7658 5.8487 5.8488 6.7088 6.7088 6.7097 6.7327 7.3101 7.3101 7.8081 7.8969 7.8969 7.8997 8.4015 8.4016 8.4067 8.4586 8.5311 8.5313 8.5812 8.5812 8.6320 8.6674 8.6675 8.6765 8.9869 8.9870 9.2427 9.2427 9.2903 9.3052 10.3895 10.3895 10.4387 10.4514 10.8044 10.8044 12.7865 12.7865 14.2794 14.2794 k = 0.1774 0.2868 0.8768 ( 2974 PWs) bands (ev): -3.8561 -3.8561 -3.1714 -3.1697 -3.1697 -3.1694 2.6252 2.6252 4.0597 4.0597 4.0612 4.0693 4.7073 4.7073 5.6963 5.7029 5.7737 5.7737 5.8226 5.8227 6.6961 6.6961 6.6973 6.7205 7.3034 7.3034 7.8122 7.8991 7.8991 7.9017 8.4049 8.4113 8.4114 8.4601 8.5366 8.5367 8.5746 8.5746 8.6312 8.6656 8.6656 8.6737 8.9747 8.9748 9.2050 9.2051 9.2523 9.2698 10.4241 10.4241 10.4788 10.4907 10.7738 10.7738 12.7533 12.7533 14.2773 14.2773 k = 0.1739 0.2812 0.8597 ( 2992 PWs) bands (ev): -3.8696 -3.8696 -3.1536 -3.1517 -3.1517 -3.1514 2.6280 2.6280 4.0513 4.0513 4.0544 4.0587 4.7143 4.7143 5.6991 5.7094 5.7708 5.7709 5.8055 5.8056 6.6819 6.6819 6.6845 6.7075 7.2969 7.2969 7.8166 7.9016 7.9016 7.9040 8.4029 8.4184 8.4185 8.4613 8.5388 8.5390 8.5674 8.5674 8.6305 8.6638 8.6639 8.6703 8.9659 8.9659 9.1705 9.1705 9.2171 9.2367 10.4618 10.4618 10.5218 10.5330 10.7391 10.7391 12.7268 12.7268 14.2782 14.2782 k = 0.1704 0.2755 0.8425 ( 2989 PWs) bands (ev): -3.8862 -3.8862 -3.1378 -3.1356 -3.1356 -3.1353 2.6378 2.6378 4.0468 4.0468 4.0515 4.0520 4.7203 4.7203 5.6989 5.7125 5.7517 5.7517 5.8028 5.8029 6.6667 6.6667 6.6717 6.6940 7.2907 7.2907 7.8215 7.9044 7.9044 7.9068 8.4010 8.4234 8.4234 8.4626 8.5375 8.5376 8.5600 8.5601 8.6303 8.6623 8.6624 8.6668 8.9610 8.9611 9.1395 9.1395 9.1851 9.2063 10.5022 10.5022 10.5676 10.5780 10.7008 10.7008 12.7071 12.7071 14.2819 14.2819 k = 0.1670 0.2699 0.8253 ( 2989 PWs) bands (ev): -3.9059 -3.9059 -3.1238 -3.1214 -3.1214 -3.1211 2.6546 2.6546 4.0462 4.0462 4.0494 4.0525 4.7252 4.7252 5.6951 5.7119 5.7268 5.7268 5.8035 5.8035 6.6505 6.6505 6.6592 6.6802 7.2847 7.2847 7.8268 7.9077 7.9077 7.9102 8.3991 8.4260 8.4261 8.4638 8.5324 8.5326 8.5523 8.5524 8.6307 8.6607 8.6608 8.6634 8.9599 8.9600 9.1125 9.1126 9.1561 9.1784 10.5448 10.5448 10.6157 10.6252 10.6596 10.6596 12.6943 12.6943 14.2883 14.2883 k = 0.1635 0.2643 0.8081 ( 2978 PWs) bands (ev): -3.9286 -3.9286 -3.1119 -3.1092 -3.1092 -3.1090 2.6784 2.6784 4.0498 4.0498 4.0508 4.0577 4.7290 4.7290 5.6875 5.7011 5.7011 5.7074 5.8023 5.8023 6.6338 6.6338 6.6472 6.6666 7.2790 7.2790 7.8327 7.9116 7.9116 7.9142 8.3976 8.4262 8.4263 8.4650 8.5244 8.5245 8.5444 8.5444 8.6319 8.6589 8.6590 8.6603 8.9617 8.9617 9.0904 9.0905 9.1304 9.1531 10.5866 10.5867 10.6186 10.6187 10.6658 10.6743 12.6887 12.6887 14.2974 14.2974 k = 0.1600 0.2587 0.7909 ( 2978 PWs) bands (ev): -3.9542 -3.9542 -3.1021 -3.0991 -3.0991 -3.0989 2.7089 2.7089 4.0564 4.0576 4.0576 4.0671 4.7317 4.7317 5.6755 5.6755 5.6759 5.6986 5.7976 5.7976 6.6168 6.6168 6.6359 6.6532 7.2735 7.2735 7.8389 7.9158 7.9158 7.9186 8.3962 8.4234 8.4235 8.4660 8.5146 8.5147 8.5361 8.5362 8.6339 8.6570 8.6571 8.6578 8.9640 8.9641 9.0744 9.0745 9.1076 9.1301 10.5664 10.5664 10.6392 10.6392 10.7176 10.7250 12.6902 12.6902 14.3093 14.3093 k = 0.1565 0.2531 0.7737 ( 2984 PWs) bands (ev): -3.9825 -3.9825 -3.0943 -3.0910 -3.0910 -3.0908 2.7461 2.7461 4.0663 4.0696 4.0696 4.0809 4.7332 4.7332 5.6502 5.6502 5.6599 5.6853 5.7890 5.7890 6.6002 6.6002 6.6255 6.6405 7.2680 7.2681 7.8456 7.9207 7.9207 7.9235 8.3952 8.4168 8.4169 8.4669 8.5043 8.5045 8.5277 8.5277 8.6370 8.6555 8.6556 8.6562 8.9643 8.9644 9.0663 9.0664 9.0875 9.1094 10.5192 10.5192 10.6862 10.6862 10.7706 10.7769 12.6992 12.6992 14.3239 14.3239 k = 0.1531 0.2474 0.7565 ( 2990 PWs) bands (ev): -4.0134 -4.0134 -3.0885 -3.0850 -3.0850 -3.0849 2.7898 2.7898 4.0803 4.0859 4.0859 4.0989 4.7336 4.7336 5.6254 5.6254 5.6395 5.6677 5.7759 5.7759 6.5845 6.5845 6.6164 6.6289 7.2629 7.2629 7.8529 7.9262 7.9262 7.9290 8.3946 8.4056 8.4056 8.4678 8.4951 8.4952 8.5192 8.5192 8.6409 8.6547 8.6548 8.6555 8.9604 8.9604 9.0670 9.0671 9.0700 9.0908 10.4702 10.4702 10.7347 10.7348 10.8246 10.8297 12.7155 12.7155 14.3415 14.3415 k = 0.1496 0.2418 0.7393 ( 3002 PWs) bands (ev): -4.0468 -4.0468 -3.0848 -3.0810 -3.0810 -3.0810 2.8396 2.8396 4.0985 4.1064 4.1064 4.1212 4.7330 4.7330 5.6010 5.6010 5.6148 5.6456 5.7581 5.7581 6.5700 6.5700 6.6087 6.6185 7.2576 7.2577 7.8606 7.9323 7.9323 7.9350 8.3896 8.3896 8.3945 8.4686 8.4874 8.4875 8.5109 8.5109 8.6462 8.6550 8.6551 8.6562 8.9526 8.9526 9.0547 9.0740 9.0750 9.0751 10.4200 10.4200 10.7840 10.7840 10.8792 10.8830 12.7394 12.7394 14.3621 14.3621 k = 0.1461 0.2362 0.7221 ( 3002 PWs) bands (ev): -4.0823 -4.0823 -3.0832 -3.0791 -3.0790 -3.0790 2.8955 2.8955 4.1207 4.1311 4.1311 4.1478 4.7315 4.7315 5.5771 5.5771 5.5857 5.6194 5.7354 5.7355 6.5574 6.5574 6.6026 6.6097 7.2528 7.2528 7.8690 7.9391 7.9391 7.9417 8.3696 8.3696 8.3948 8.4694 8.4806 8.4806 8.5035 8.5035 8.6527 8.6569 8.6569 8.6584 8.9428 8.9428 9.0416 9.0589 9.0876 9.0877 10.3693 10.3693 10.8334 10.8334 10.9341 10.9364 12.7708 12.7708 14.3861 14.3861 k = 0.1426 0.2306 0.7049 ( 3002 PWs) bands (ev): -4.1199 -4.1199 -3.0835 -3.0793 -3.0791 -3.0791 2.9569 2.9569 4.1468 4.1598 4.1598 4.1784 4.7293 4.7293 5.5526 5.5537 5.5537 5.5894 5.7081 5.7081 6.5468 6.5468 6.5981 6.6024 7.2480 7.2480 7.8780 7.9466 7.9466 7.9488 8.3466 8.3466 8.3956 8.4700 8.4731 8.4731 8.4977 8.4978 8.6602 8.6603 8.6604 8.6620 8.9325 8.9325 9.0304 9.0454 9.1025 9.1026 10.3184 10.3184 10.8827 10.8827 10.9888 10.9897 12.8097 12.8097 14.4136 14.4136 k = 0.1391 0.2249 0.6877 ( 2990 PWs) bands (ev): -4.1592 -4.1592 -3.0857 -3.0813 -3.0810 -3.0810 3.0236 3.0236 4.1766 4.1924 4.1924 4.2131 4.7265 4.7265 5.5158 5.5309 5.5309 5.5559 5.6763 5.6763 6.5385 6.5385 6.5953 6.5969 7.2433 7.2433 7.8876 7.9548 7.9548 7.9566 8.3216 8.3217 8.3967 8.4641 8.4641 8.4706 8.4940 8.4941 8.6651 8.6652 8.6670 8.6694 8.9226 8.9226 9.0210 9.0334 9.1184 9.1185 10.2677 10.2677 10.9315 10.9315 11.0425 11.0431 12.8561 12.8561 14.4450 14.4450 k = 0.1357 0.2193 0.6705 ( 2984 PWs) bands (ev): -4.2002 -4.2002 -3.0898 -3.0853 -3.0849 -3.0849 3.0952 3.0952 4.2096 4.2286 4.2286 4.2514 4.7232 4.7232 5.4757 5.5083 5.5083 5.5196 5.6405 5.6405 6.5325 6.5325 6.5931 6.5939 7.2389 7.2389 7.8978 7.9636 7.9636 7.9648 8.2955 8.2955 8.3981 8.4536 8.4537 8.4710 8.4918 8.4919 8.6713 8.6714 8.6733 8.6797 8.9136 8.9136 9.0134 9.0227 9.1343 9.1344 10.2172 10.2172 10.9793 10.9793 11.0943 11.0966 12.9100 12.9100 14.4806 14.4806 k = 0.1322 0.2137 0.6533 ( 2978 PWs) bands (ev): -4.2425 -4.2425 -3.0956 -3.0910 -3.0905 -3.0905 3.1713 3.1713 4.2456 4.2681 4.2681 4.2932 4.7199 4.7199 5.4329 5.4812 5.4861 5.4861 5.6012 5.6012 6.5287 6.5287 6.5908 6.5939 7.2344 7.2344 7.9087 7.9728 7.9729 7.9736 8.2689 8.2689 8.3996 8.4421 8.4421 8.4712 8.4905 8.4906 8.6785 8.6785 8.6807 8.6911 8.9061 8.9061 9.0076 9.0134 9.1497 9.1498 10.1672 10.1672 11.0258 11.0258 11.1447 11.1488 12.9711 12.9711 14.5206 14.5206 k = 0.1287 0.2081 0.6361 ( 2984 PWs) bands (ev): -4.2860 -4.2860 -3.1032 -3.0984 -3.0978 -3.0978 3.2512 3.2512 4.2840 4.3104 4.3104 4.3380 4.7169 4.7169 5.3882 5.4414 5.4641 5.4641 5.5594 5.5594 6.5270 6.5270 6.5900 6.5953 7.2300 7.2300 7.9202 7.9825 7.9825 7.9828 8.2420 8.2420 8.4011 8.4298 8.4298 8.4712 8.4896 8.4897 8.6862 8.6863 8.6887 8.7035 8.9005 8.9005 9.0037 9.0054 9.1642 9.1642 10.1180 10.1180 11.0706 11.0706 11.1935 11.1993 13.0395 13.0395 14.5655 14.5655 k = 0.1252 0.2024 0.6190 ( 2996 PWs) bands (ev): -4.3305 -4.3305 -3.1123 -3.1075 -3.1067 -3.1067 3.3345 3.3345 4.3241 4.3551 4.3551 4.3853 4.7146 4.7146 5.3422 5.4010 5.4418 5.4418 5.5161 5.5161 6.5271 6.5271 6.5905 6.5976 7.2256 7.2256 7.9323 7.9924 7.9925 7.9925 8.2155 8.2155 8.4024 8.4168 8.4169 8.4708 8.4887 8.4888 8.6940 8.6940 8.6973 8.7169 8.8974 8.8974 8.9989 9.0020 9.1777 9.1777 10.0696 10.0696 11.1135 11.1135 11.2401 11.2478 13.1148 13.1148 14.6155 14.6155 k = 0.1217 0.1968 0.6018 ( 2996 PWs) bands (ev): -4.3758 -4.3758 -3.1230 -3.1180 -3.1170 -3.1170 3.4203 3.4203 4.3652 4.4016 4.4016 4.4343 4.7136 4.7136 5.2959 5.3614 5.4186 5.4186 5.4732 5.4732 6.5290 6.5290 6.5922 6.6011 7.2213 7.2213 7.9451 8.0024 8.0026 8.0026 8.1899 8.1899 8.4036 8.4036 8.4037 8.4703 8.4878 8.4878 8.7011 8.7011 8.7058 8.7310 8.8976 8.8976 8.9943 9.0028 9.1901 9.1901 10.0223 10.0223 11.1541 11.1541 11.2844 11.2940 13.1969 13.1969 14.6708 14.6708 k = 0.1183 0.1912 0.5846 ( 3011 PWs) bands (ev): -4.4216 -4.4216 -3.1350 -3.1299 -3.1288 -3.1288 3.5079 3.5079 4.4061 4.4488 4.4488 4.4841 4.7147 4.7148 5.2505 5.3236 5.3917 5.3917 5.4341 5.4341 6.5322 6.5322 6.5950 6.6053 7.2170 7.2170 7.9584 8.0124 8.0124 8.0128 8.1655 8.1655 8.3900 8.3900 8.4046 8.4694 8.4864 8.4865 8.7067 8.7067 8.7139 8.7453 8.9018 8.9018 8.9918 9.0065 9.2014 9.2014 9.9762 9.9762 11.1922 11.1922 11.3260 11.3375 13.2857 13.2857 14.7319 14.7319 k = 0.1148 0.1856 0.5674 ( 3005 PWs) bands (ev): -4.4678 -4.4678 -3.1482 -3.1431 -3.1418 -3.1418 3.5961 3.5961 4.4453 4.4958 4.4958 4.5332 4.7190 4.7190 5.2078 5.2894 5.3583 5.3583 5.4033 5.4033 6.5368 6.5368 6.5987 6.6103 7.2129 7.2129 7.9725 8.0212 8.0213 8.0236 8.1434 8.1434 8.3763 8.3763 8.4052 8.4683 8.4848 8.4848 8.7105 8.7105 8.7212 8.7596 8.9107 8.9107 8.9922 9.0137 9.2117 9.2117 9.9313 9.9313 11.2275 11.2275 11.3647 11.3781 13.3808 13.3808 14.7988 14.7988 k = 0.1113 0.1799 0.5502 ( 3005 PWs) bands (ev): -4.5142 -4.5142 -3.1625 -3.1574 -3.1560 -3.1560 3.6836 3.6836 4.4811 4.5411 4.5411 4.5793 4.7274 4.7274 5.1699 5.2606 5.3206 5.3206 5.3799 5.3799 6.5424 6.5424 6.6031 6.6158 7.2087 7.2087 7.9872 8.0277 8.0278 8.0347 8.1249 8.1249 8.3625 8.3625 8.4055 8.4669 8.4826 8.4826 8.7120 8.7120 8.7272 8.7730 8.9246 8.9247 8.9961 9.0246 9.2210 9.2211 9.8877 9.8877 11.2600 11.2600 11.4001 11.4155 13.4820 13.4820 14.8718 14.8718 k = 0.1078 0.1743 0.5330 ( 2993 PWs) bands (ev): -4.5606 -4.5606 -3.1779 -3.1728 -3.1711 -3.1711 3.7686 3.7686 4.5112 4.5835 4.5835 4.6190 4.7407 4.7407 5.1405 5.2395 5.2845 5.2845 5.3604 5.3604 6.5488 6.5488 6.6083 6.6218 7.2048 7.2048 8.0026 8.0294 8.0295 8.0460 8.1126 8.1126 8.3487 8.3487 8.4054 8.4651 8.4798 8.4798 8.7113 8.7113 8.7316 8.7847 8.9437 8.9437 9.0045 9.0397 9.2296 9.2297 9.8456 9.8456 11.2894 11.2894 11.4323 11.4495 13.5890 13.5890 14.9466 14.9509 k = 0.1044 0.1687 0.5158 ( 2993 PWs) bands (ev): -4.6069 -4.6069 -3.1941 -3.1890 -3.1872 -3.1872 3.8490 3.8490 4.5332 4.6221 4.6221 4.6478 4.7589 4.7589 5.1241 5.2285 5.2541 5.2541 5.3433 5.3433 6.5559 6.5559 6.6138 6.6281 7.2007 7.2007 8.0184 8.0238 8.0239 8.0575 8.1088 8.1089 8.3349 8.3349 8.4049 8.4628 8.4762 8.4762 8.7087 8.7087 8.7342 8.7939 8.9676 8.9676 9.0181 9.0591 9.2375 9.2376 9.8048 9.8048 11.3157 11.3157 11.4610 11.4801 13.7015 13.7015 15.0248 15.0338 k = 0.1009 0.1631 0.4986 ( 2987 PWs) bands (ev): -4.6529 -4.6529 -3.2111 -3.2060 -3.2040 -3.2040 3.9226 3.9226 4.5452 4.6561 4.6561 4.6611 4.7814 4.7814 5.1251 5.2295 5.2328 5.2329 5.3289 5.3289 6.5634 6.5634 6.6198 6.6346 7.1968 7.1968 8.0117 8.0118 8.0347 8.0690 8.1129 8.1129 8.3211 8.3212 8.4040 8.4601 8.4717 8.4717 8.7048 8.7048 8.7351 8.8004 8.9961 8.9961 9.0374 9.0831 9.2450 9.2450 9.7655 9.7655 11.3389 11.3389 11.4863 11.5072 13.8191 13.8191 15.1093 15.1197 k = 0.0974 0.1575 0.4814 ( 2987 PWs) bands (ev): -4.6985 -4.6985 -3.2287 -3.2237 -3.2214 -3.2214 3.9867 3.9867 4.5461 4.6570 4.6824 4.6824 4.8099 4.8099 5.1454 5.2227 5.2227 5.2436 5.3185 5.3186 6.5714 6.5714 6.6260 6.6412 7.1929 7.1929 7.9963 7.9963 8.0514 8.0804 8.1215 8.1216 8.3076 8.3076 8.4027 8.4569 8.4664 8.4664 8.7000 8.7000 8.7343 8.8040 9.0289 9.0289 9.0627 9.1116 9.2523 9.2523 9.7277 9.7277 11.3590 11.3590 11.5082 11.5307 13.9416 13.9416 15.2000 15.2119 k = 0.0939 0.1518 0.4642 ( 2987 PWs) bands (ev): -4.7434 -4.7434 -3.2468 -3.2418 -3.2394 -3.2394 4.0396 4.0396 4.5363 4.6376 4.6945 4.6945 4.8506 4.8506 5.1829 5.2216 5.2216 5.2702 5.3163 5.3163 6.5795 6.5795 6.6324 6.6478 7.1891 7.1891 7.9796 7.9797 8.0684 8.0917 8.1325 8.1325 8.2943 8.2944 8.4012 8.4532 8.4601 8.4601 8.6946 8.6946 8.7321 8.8051 9.0657 9.0658 9.0936 9.1445 9.2596 9.2597 9.6913 9.6913 11.3762 11.3762 11.5266 11.5508 14.0686 14.0686 15.2970 15.3102 k = 0.0904 0.1462 0.4470 ( 2993 PWs) bands (ev): -4.7877 -4.7877 -3.2653 -3.2604 -3.2578 -3.2578 4.0805 4.0805 4.5172 4.6071 4.6889 4.6889 4.9081 4.9081 5.2222 5.2222 5.2330 5.3077 5.3288 5.3288 6.5878 6.5878 6.6389 6.6544 7.1853 7.1853 7.9630 7.9630 8.0856 8.1025 8.1444 8.1445 8.2815 8.2815 8.3995 8.4490 8.4528 8.4528 8.6890 8.6890 8.7288 8.8041 9.1065 9.1065 9.1299 9.1818 9.2673 9.2673 9.6564 9.6564 11.3904 11.3904 11.5417 11.5675 14.1996 14.1996 15.4000 15.4145 k = 0.0870 0.1406 0.4298 ( 2981 PWs) bands (ev): -4.8311 -4.8311 -3.2840 -3.2792 -3.2764 -3.2764 4.1099 4.1099 4.4910 4.5698 4.6688 4.6688 4.9810 4.9810 5.2183 5.2183 5.2916 5.3539 5.3595 5.3595 6.5963 6.5963 6.6455 6.6609 7.1817 7.1817 7.9469 7.9470 8.1029 8.1130 8.1567 8.1567 8.2693 8.2693 8.3978 8.4443 8.4447 8.4447 8.6835 8.6835 8.7247 8.8016 9.1511 9.1511 9.1713 9.2235 9.2758 9.2758 9.6231 9.6231 11.4019 11.4019 11.5538 11.5809 14.3342 14.3342 15.5086 15.5246 k = 0.0835 0.1350 0.4126 ( 2987 PWs) bands (ev): -4.8736 -4.8736 -3.3029 -3.2982 -3.2952 -3.2952 4.1292 4.1293 4.4596 4.5284 4.6391 4.6391 5.0652 5.0652 5.2110 5.2110 5.3556 5.4045 5.4046 5.4066 6.6045 6.6045 6.6519 6.6673 7.1781 7.1781 7.9314 7.9315 8.1200 8.1226 8.1684 8.1684 8.2580 8.2581 8.3960 8.4355 8.4355 8.4391 8.6781 8.6781 8.7200 8.7979 9.1992 9.1992 9.2175 9.2694 9.2854 9.2855 9.5912 9.5912 11.4107 11.4108 11.5628 11.5913 14.4715 14.4715 15.6002 15.6002 k = 0.0800 0.1293 0.3954 ( 2987 PWs) bands (ev): -4.9151 -4.9151 -3.3219 -3.3173 -3.3140 -3.3140 4.1404 4.1404 4.4248 4.4849 4.6037 4.6037 5.1502 5.1502 5.2096 5.2096 5.4228 5.4588 5.4588 5.4640 6.6128 6.6128 6.6583 6.6734 7.1747 7.1747 7.9171 7.9171 8.1314 8.1368 8.1787 8.1787 8.2485 8.2485 8.3946 8.4256 8.4256 8.4334 8.6730 8.6730 8.7148 8.7933 9.2496 9.2496 9.2683 9.2978 9.2978 9.3196 9.5608 9.5608 11.4172 11.4172 11.5691 11.5987 14.6106 14.6106 15.5158 15.5158 k = 0.0765 0.1237 0.3782 ( 2990 PWs) bands (ev): -4.9554 -4.9554 -3.3407 -3.3363 -3.3328 -3.3328 4.1453 4.1453 4.3878 4.4406 4.5649 4.5649 5.1750 5.1750 5.2740 5.2740 5.4917 5.5185 5.5185 5.5245 6.6209 6.6209 6.6645 6.6793 7.1714 7.1714 7.9038 7.9038 8.1391 8.1531 8.1856 8.1857 8.2422 8.2423 8.3935 8.4151 8.4151 8.4274 8.6683 8.6683 8.7094 8.7881 9.2929 9.2929 9.3226 9.3226 9.3236 9.3741 9.5318 9.5319 11.4214 11.4214 11.5728 11.6035 14.7491 14.7491 15.4214 15.4214 k = 0.0730 0.1181 0.3611 ( 2990 PWs) bands (ev): -4.9944 -4.9944 -3.3594 -3.3551 -3.3515 -3.3515 4.1454 4.1454 4.3496 4.3962 4.5245 4.5245 5.1661 5.1661 5.3760 5.3760 5.5614 5.5816 5.5816 5.5869 6.6288 6.6288 6.6705 6.6850 7.1682 7.1682 7.8916 7.8916 8.1454 8.1687 8.1871 8.1871 8.2412 8.2413 8.3929 8.4041 8.4041 8.4211 8.6640 8.6640 8.7040 8.7825 9.3140 9.3140 9.3754 9.3754 9.3832 9.4328 9.5045 9.5045 11.4235 11.4235 11.5740 11.6058 14.8806 14.8806 15.3328 15.3328 k = 0.0696 0.1125 0.3439 ( 2990 PWs) bands (ev): -5.0321 -5.0321 -3.3779 -3.3737 -3.3698 -3.3698 4.1421 4.1421 4.3111 4.3523 4.4836 4.4836 5.1543 5.1543 5.4832 5.4832 5.6311 5.6465 5.6465 5.6502 6.6365 6.6365 6.6763 6.6904 7.1652 7.1652 7.8805 7.8805 8.1503 8.1828 8.1828 8.1831 8.2455 8.2455 8.3929 8.3930 8.3931 8.4148 8.6601 8.6601 8.6987 8.7766 9.3309 9.3309 9.4376 9.4376 9.4471 9.4793 9.4794 9.4957 11.4237 11.4237 11.5731 11.6057 14.9798 14.9798 15.2756 15.2756 k = 0.0661 0.1068 0.3267 ( 2990 PWs) bands (ev): -5.0685 -5.0685 -3.3960 -3.3920 -3.3879 -3.3879 4.1362 4.1362 4.2727 4.3094 4.4428 4.4428 5.1422 5.1422 5.5916 5.5916 5.7001 5.7125 5.7125 5.7136 6.6439 6.6439 6.6819 6.6954 7.1624 7.1624 7.8705 7.8705 8.1537 8.1748 8.1748 8.1961 8.2524 8.2524 8.3822 8.3822 8.3939 8.4088 8.6566 8.6566 8.6936 8.7705 9.3490 9.3491 9.4526 9.4526 9.5078 9.5079 9.5152 9.5627 11.4222 11.4222 11.5700 11.6035 14.9827 14.9827 15.3136 15.3136 k = 0.0626 0.1012 0.3095 ( 2984 PWs) bands (ev): -5.1033 -5.1033 -3.4136 -3.4098 -3.4055 -3.4055 4.1285 4.1285 4.2350 4.2677 4.4027 4.4027 5.1301 5.1301 5.6985 5.6985 5.7678 5.7766 5.7797 5.7797 6.6510 6.6510 6.6872 6.7002 7.1599 7.1599 7.8617 7.8617 8.1554 8.1651 8.1651 8.2072 8.2596 8.2596 8.3722 8.3723 8.3956 8.4033 8.6536 8.6536 8.6888 8.7644 9.3690 9.3691 9.4309 9.4309 9.5793 9.5793 9.5874 9.6339 11.4191 11.4191 11.5651 11.5993 14.9041 14.9041 15.4315 15.4315 k = 0.0591 0.0956 0.2923 ( 2990 PWs) bands (ev): -5.1366 -5.1366 -3.4308 -3.4271 -3.4226 -3.4226 4.1195 4.1195 4.1983 4.2275 4.3637 4.3637 5.1183 5.1183 5.7993 5.7993 5.8339 5.8385 5.8508 5.8508 6.6578 6.6578 6.6922 6.7046 7.1574 7.1574 7.8539 7.8539 8.1545 8.1545 8.1554 8.2160 8.2654 8.2655 8.3640 8.3640 8.3981 8.3988 8.6508 8.6509 8.6844 8.7582 9.3870 9.3870 9.4150 9.4150 9.6550 9.6550 9.6633 9.7089 11.4145 11.4145 11.5585 11.5933 14.7993 14.7993 15.5738 15.5738 k = 0.0557 0.0900 0.2751 ( 2990 PWs) bands (ev): -5.1683 -5.1683 -3.4473 -3.4438 -3.4391 -3.4391 4.1097 4.1097 4.1628 4.1890 4.3262 4.3262 5.1070 5.1070 5.8830 5.8831 5.8979 5.8990 5.9352 5.9352 6.6643 6.6643 6.6969 6.7086 7.1553 7.1553 7.8472 7.8472 8.1435 8.1436 8.1540 8.2220 8.2686 8.2686 8.3584 8.3584 8.3957 8.4013 8.6485 8.6485 8.6804 8.7520 9.3810 9.3810 9.4278 9.4278 9.7342 9.7343 9.7429 9.7877 11.4085 11.4085 11.5501 11.5856 14.6848 14.6848 15.7237 15.7237 k = 0.0522 0.0844 0.2579 ( 2984 PWs) bands (ev): -5.1984 -5.1984 -3.4632 -3.4599 -3.4550 -3.4550 4.0995 4.0995 4.1288 4.1523 4.2902 4.2902 5.0961 5.0961 5.9504 5.9504 5.9576 5.9596 6.0307 6.0307 6.6705 6.6706 6.7013 6.7123 7.1534 7.1534 7.8416 7.8416 8.1323 8.1323 8.1513 8.2249 8.2683 8.2684 8.3562 8.3563 8.3944 8.4052 8.6465 8.6465 8.6769 8.7460 9.3636 9.3636 9.4570 9.4570 9.8167 9.8167 9.8259 9.8698 11.4012 11.4012 11.5402 11.5762 14.5651 14.5651 15.8763 15.8763 k = 0.0487 0.0787 0.2407 ( 2993 PWs) bands (ev): -5.2267 -5.2267 -3.4783 -3.4752 -3.4701 -3.4701 4.0891 4.0891 4.0965 4.1175 4.2560 4.2560 5.0857 5.0857 6.0109 6.0109 6.0138 6.0184 6.1265 6.1265 6.6765 6.6765 6.7054 6.7156 7.1518 7.1518 7.8369 7.8369 8.1208 8.1208 8.1474 8.2246 8.2646 8.2647 8.3573 8.3573 8.3950 8.4095 8.6447 8.6448 8.6739 8.7400 9.3459 9.3460 9.4913 9.4914 9.9019 9.9019 9.9118 9.9550 11.3926 11.3926 11.5287 11.5652 14.4422 14.4422 16.0295 16.0295 k = 0.0452 0.0731 0.2235 ( 2993 PWs) bands (ev): -5.2533 -5.2533 -3.4927 -3.4897 -3.4845 -3.4845 4.0660 4.0787 4.0787 4.0848 4.2238 4.2238 5.0760 5.0760 6.0675 6.0675 6.0677 6.0744 6.2184 6.2184 6.6823 6.6823 6.7091 6.7186 7.1505 7.1505 7.8332 7.8332 8.1092 8.1093 8.1426 8.2213 8.2584 8.2585 8.3609 8.3609 8.3973 8.4141 8.6433 8.6433 8.6714 8.7342 9.3293 9.3293 9.5300 9.5301 9.9895 9.9895 10.0002 10.0429 11.3828 11.3828 11.5156 11.5527 14.3172 14.3172 16.1817 16.1817 k = 0.0417 0.0675 0.2063 ( 3005 PWs) bands (ev): -5.2780 -5.2780 -3.5062 -3.5034 -3.4980 -3.4980 4.0374 4.0541 4.0686 4.0686 4.1936 4.1936 5.0668 5.0668 6.1186 6.1207 6.1207 6.1270 6.3047 6.3047 6.6879 6.6879 6.7125 6.7213 7.1494 7.1494 7.8302 7.8302 8.0974 8.0975 8.1372 8.2154 8.2508 8.2509 8.3660 8.3660 8.4011 8.4188 8.6420 8.6420 8.6693 8.7285 9.3136 9.3136 9.5727 9.5727 10.0789 10.0789 10.0907 10.1329 11.3717 11.3717 11.5009 11.5384 14.1913 14.1913 16.3318 16.3318 k = 0.0383 0.0619 0.1891 ( 2999 PWs) bands (ev): -5.3010 -5.3010 -3.5187 -3.5162 -3.5106 -3.5106 4.0108 4.0257 4.0588 4.0588 4.1656 4.1656 5.0583 5.0583 6.1667 6.1706 6.1707 6.1763 6.3846 6.3846 6.6937 6.6937 6.7157 6.7236 7.1488 7.1488 7.8283 7.8283 8.0858 8.0858 8.1316 8.2075 8.2428 8.2429 8.3718 8.3718 8.4059 8.4235 8.6410 8.6411 8.6678 8.7231 9.2993 9.2993 9.6191 9.6191 10.1695 10.1695 10.1827 10.2245 11.3593 11.3593 11.4845 11.5225 14.0657 14.0657 16.4783 16.4783 k = 0.0348 0.0562 0.1719 ( 3011 PWs) bands (ev): -5.3220 -5.3220 -3.5304 -3.5281 -3.5223 -3.5223 3.9864 3.9995 4.0496 4.0496 4.1398 4.1398 5.0504 5.0504 6.2114 6.2171 6.2171 6.2218 6.4568 6.4568 6.6998 6.6998 6.7184 6.7256 7.1485 7.1485 7.8269 7.8269 8.0741 8.0741 8.1257 8.1980 8.2347 8.2348 8.3777 8.3778 8.4112 8.4281 8.6402 8.6402 8.6667 8.7178 9.2862 9.2862 9.6686 9.6686 10.2607 10.2607 10.2754 10.3169 11.3453 11.3453 11.4663 11.5046 13.9414 13.9414 16.6193 16.6193 k = 0.0313 0.0506 0.1547 ( 3017 PWs) bands (ev): -5.3411 -5.3411 -3.5410 -3.5390 -3.5330 -3.5330 3.9641 3.9757 4.0409 4.0409 4.1163 4.1163 5.0431 5.0432 6.2528 6.2598 6.2599 6.2636 6.5204 6.5204 6.7070 6.7070 6.7208 6.7273 7.1487 7.1487 7.8263 7.8263 8.0626 8.0626 8.1200 8.1876 8.2271 8.2272 8.3835 8.3836 8.4168 8.4324 8.6395 8.6395 8.6661 8.7128 9.2742 9.2742 9.7206 9.7206 10.3516 10.3516 10.3683 10.4095 11.3296 11.3296 11.4461 11.4847 13.8199 13.8199 16.7493 16.7493 k = 0.0278 0.0450 0.1375 ( 3005 PWs) bands (ev): -5.3583 -5.3583 -3.5506 -3.5488 -3.5426 -3.5426 3.9441 3.9542 4.0330 4.0330 4.0951 4.0951 5.0367 5.0367 6.2906 6.2989 6.2989 6.3014 6.5741 6.5741 6.7163 6.7163 6.7231 6.7287 7.1493 7.1493 7.8262 7.8262 8.0516 8.0517 8.1147 8.1768 8.2203 8.2204 8.3891 8.3891 8.4224 8.4364 8.6390 8.6390 8.6661 8.7081 9.2636 9.2636 9.7742 9.7742 10.4415 10.4416 10.4604 10.5014 11.3120 11.3120 11.4236 11.4626 13.7028 13.7028 16.7650 16.7720 k = 0.0243 0.0394 0.1204 ( 3002 PWs) bands (ev): -5.3736 -5.3736 -3.5592 -3.5576 -3.5513 -3.5513 3.9264 3.9350 4.0258 4.0258 4.0763 4.0763 5.0309 5.0309 6.3246 6.3339 6.3339 6.3350 6.6160 6.6160 6.7250 6.7294 6.7294 6.7299 7.1502 7.1502 7.8266 7.8267 8.0411 8.0411 8.1100 8.1658 8.2142 8.2143 8.3941 8.3941 8.4277 8.4400 8.6386 8.6386 8.6664 8.7035 9.2542 9.2542 9.8279 9.8279 10.5296 10.5296 10.5509 10.5918 11.2922 11.2922 11.3986 11.4378 13.5918 13.5918 16.6495 16.6606 k = 0.0209 0.0337 0.1032 ( 3005 PWs) bands (ev): -5.3868 -5.3868 -3.5666 -3.5652 -3.5588 -3.5588 3.9110 3.9183 4.0195 4.0195 4.0599 4.0599 5.0259 5.0259 6.3546 6.3643 6.3648 6.3648 6.6447 6.6447 6.7266 6.7307 6.7474 6.7474 7.1513 7.1513 7.8273 7.8273 8.0314 8.0314 8.1061 8.1550 8.2089 8.2089 8.3986 8.3986 8.4326 8.4432 8.6383 8.6383 8.6670 8.6992 9.2461 9.2461 9.8803 9.8803 10.6150 10.6150 10.6390 10.6797 11.2698 11.2698 11.3708 11.4101 13.4889 13.4889 16.5406 16.5500 k = 0.0174 0.0281 0.0860 ( 3005 PWs) bands (ev): -5.3980 -5.3980 -3.5730 -3.5718 -3.5652 -3.5652 3.8980 3.9040 4.0141 4.0141 4.0460 4.0460 5.0216 5.0216 6.3806 6.3892 6.3912 6.3913 6.6620 6.6620 6.7280 6.7314 6.7690 6.7690 7.1527 7.1527 7.8281 7.8281 8.0226 8.0226 8.1032 8.1446 8.2044 8.2045 8.4023 8.4024 8.4369 8.4457 8.6380 8.6380 8.6681 8.6951 9.2391 9.2391 9.9296 9.9296 10.6967 10.6967 10.7238 10.7641 11.2444 11.2444 11.3399 11.3793 13.3963 13.3963 16.4430 16.4507 k = 0.0139 0.0225 0.0688 ( 3005 PWs) bands (ev): -5.4072 -5.4072 -3.5781 -3.5772 -3.5705 -3.5705 3.8875 3.8922 4.0095 4.0095 4.0346 4.0346 5.0181 5.0181 6.4022 6.4095 6.4132 6.4132 6.6720 6.6720 6.7291 6.7318 6.7903 6.7903 7.1542 7.1542 7.8290 7.8290 8.0151 8.0151 8.1014 8.1350 8.2008 8.2008 8.4055 8.4055 8.4407 8.4477 8.6379 8.6379 8.6696 8.6913 9.2335 9.2335 9.9738 9.9738 10.7739 10.7739 10.8042 10.8439 11.2156 11.2156 11.3061 11.3450 13.3161 13.3161 16.3596 16.3656 k = 0.0104 0.0169 0.0516 ( 3023 PWs) bands (ev): -5.4144 -5.4144 -3.5822 -3.5815 -3.5746 -3.5746 3.8793 3.8829 4.0060 4.0060 4.0257 4.0257 5.0153 5.0153 6.4194 6.4251 6.4304 6.4304 6.6776 6.6776 6.7300 6.7320 6.8084 6.8084 7.1555 7.1555 7.8298 7.8298 8.0089 8.0089 8.1007 8.1263 8.1978 8.1978 8.4078 8.4078 8.4437 8.4489 8.6376 8.6376 8.6712 8.6875 9.2290 9.2290 10.0109 10.0109 10.8454 10.8454 10.8790 10.9174 11.1832 11.1832 11.2696 11.3074 13.2508 13.2508 16.2928 16.2967 k = 0.0070 0.0112 0.0344 ( 3011 PWs) bands (ev): -5.4195 -5.4195 -3.5850 -3.5846 -3.5775 -3.5775 3.8737 3.8760 4.0035 4.0035 4.0194 4.0194 5.0134 5.0134 6.4322 6.4361 6.4429 6.4429 6.6810 6.6810 6.7307 6.7321 6.8218 6.8218 7.1568 7.1568 7.8305 7.8305 8.0045 8.0045 8.1016 8.1188 8.1959 8.1959 8.4096 8.4096 8.4463 8.4497 8.6376 8.6376 8.6733 8.6843 9.2260 9.2260 10.0390 10.0390 10.9098 10.9098 10.9467 10.9816 11.1478 11.1478 11.2326 11.2672 13.2023 13.2023 16.2440 16.2465 k = 0.0035 0.0056 0.0172 ( 3005 PWs) bands (ev): -5.4226 -5.4226 -3.5867 -3.5865 -3.5793 -3.5793 3.8705 3.8717 4.0019 4.0019 4.0155 4.0155 5.0122 5.0122 6.4403 6.4423 6.4505 6.4505 6.6828 6.6828 6.7314 6.7321 6.8300 6.8300 7.1576 7.1576 7.8309 7.8309 8.0017 8.0017 8.1038 8.1124 8.1947 8.1948 8.4107 8.4107 8.4482 8.4499 8.6376 8.6376 8.6757 8.6811 9.2241 9.2241 10.0566 10.0566 10.9629 10.9629 11.0032 11.0282 11.1124 11.1124 11.2027 11.2276 13.1725 13.1725 16.2145 16.2157 k = 0.0000 0.0000 0.0000 ( 3005 PWs) bands (ev): -5.4237 -5.4237 -3.5872 -3.5872 -3.5799 -3.5799 3.8699 3.8699 4.0014 4.0014 4.0143 4.0143 5.0118 5.0118 6.4437 6.4437 6.4530 6.4530 6.6833 6.6833 6.7318 6.7318 6.8327 6.8327 7.1578 7.1578 7.8311 7.8311 8.0008 8.0008 8.1074 8.1074 8.1944 8.1944 8.4110 8.4110 8.4494 8.4494 8.6376 8.6376 8.6783 8.6783 9.2235 9.2235 10.0626 10.0626 10.9884 10.9884 11.0372 11.0372 11.0929 11.0929 11.1992 11.1992 13.1624 13.1624 16.2050 16.2050 k = 0.0000 0.0000 0.0000 ( 3005 PWs) bands (ev): -5.4237 -5.4237 -3.5872 -3.5872 -3.5799 -3.5799 3.8699 3.8699 4.0014 4.0014 4.0143 4.0143 5.0118 5.0118 6.4437 6.4437 6.4530 6.4530 6.6833 6.6833 6.7318 6.7318 6.8327 6.8327 7.1578 7.1578 7.8311 7.8311 8.0008 8.0008 8.1074 8.1074 8.1944 8.1944 8.4110 8.4110 8.4494 8.4494 8.6376 8.6376 8.6783 8.6783 9.2235 9.2235 10.0626 10.0626 10.9884 10.9884 11.0372 11.0372 11.0929 11.0929 11.1992 11.1992 13.1624 13.1624 16.2050 16.2050 k = 0.0156-0.0097-0.0000 ( 3013 PWs) bands (ev): -5.4227 -5.4227 -3.5880 -3.5880 -3.5808 -3.5807 3.8563 3.8570 3.9664 3.9680 4.0598 4.0612 5.0179 5.0195 6.4433 6.4434 6.4520 6.4533 6.6798 6.6841 6.7304 6.7305 6.8325 6.8347 7.1576 7.1620 7.8298 7.8305 7.9971 8.0040 8.1072 8.1072 8.1911 8.1975 8.4100 8.4123 8.4494 8.4494 8.6357 8.6393 8.6786 8.6786 9.2231 9.2231 10.0556 10.0637 10.9796 10.9939 11.0370 11.0377 11.0885 11.0973 11.1957 11.1959 13.1694 13.1711 16.2037 16.2041 k = 0.0312-0.0193-0.0000 ( 3015 PWs) bands (ev): -5.4199 -5.4198 -3.5907 -3.5904 -3.5834 -3.5831 3.8204 3.8238 3.9359 3.9419 4.1188 4.1216 5.0376 5.0407 6.4419 6.4425 6.4507 6.4530 6.6730 6.6820 6.7268 6.7279 6.8341 6.8386 7.1615 7.1700 7.8267 7.8281 7.9929 8.0067 8.1067 8.1068 8.1879 8.2007 8.4094 8.4139 8.4497 8.4497 8.6338 8.6408 8.6793 8.6800 9.2220 9.2221 10.0429 10.0588 10.9673 10.9944 11.0348 11.0404 11.0845 11.1023 11.1862 11.1874 13.1917 13.1952 16.1991 16.2009 k = 0.0469-0.0290-0.0000 ( 3013 PWs) bands (ev): -5.4152 -5.4150 -3.5953 -3.5943 -3.5878 -3.5868 3.7742 3.7809 3.9092 3.9203 4.1823 4.1868 5.0699 5.0744 6.4393 6.4412 6.4489 6.4525 6.6616 6.6754 6.7227 6.7252 6.8378 6.8444 7.1690 7.1814 7.8219 7.8239 7.9883 8.0089 8.1059 8.1060 8.1847 8.2039 8.4090 8.4158 8.4501 8.4503 8.6320 8.6417 8.6803 8.6827 9.2203 9.2204 10.0247 10.0482 10.9497 10.9860 11.0297 11.0451 11.0816 11.1087 11.1734 11.1779 13.2282 13.2333 16.1914 16.1944 k = 0.0625-0.0387-0.0000 ( 3011 PWs) bands (ev): -5.4085 -5.4084 -3.6020 -3.5999 -3.5938 -3.5917 3.7252 3.7352 3.8824 3.8982 4.2491 4.2551 5.1136 5.1194 6.4355 6.4393 6.4465 6.4519 6.6450 6.6627 6.7197 6.7236 6.8437 6.8521 7.1796 7.1955 7.8154 7.8181 7.9834 8.0106 8.1047 8.1048 8.1816 8.2071 8.4089 8.4179 8.4508 8.4512 8.6301 8.6420 8.6817 8.6869 9.2179 9.2180 10.0015 10.0321 10.9241 10.9651 11.0231 11.0485 11.0815 11.1173 11.1614 11.1722 13.2771 13.2837 16.1808 16.1848 k = 0.0781-0.0483-0.0000 ( 3013 PWs) bands (ev): -5.4000 -5.3999 -3.6109 -3.6075 -3.6011 -3.5977 3.6765 3.6896 3.8545 3.8746 4.3181 4.3256 5.1672 5.1741 6.4306 6.4368 6.4434 6.4510 6.6235 6.6442 6.7185 6.7233 6.8517 6.8619 7.1928 7.2119 7.8074 7.8108 7.9782 8.0116 8.1030 8.1033 8.1785 8.2102 8.4090 8.4199 8.4515 8.4522 8.6279 8.6420 8.6836 8.6927 9.2147 9.2150 9.9738 10.0109 10.8884 10.9308 11.0162 11.0461 11.0863 11.1259 11.1556 11.1738 13.3365 13.3445 16.1674 16.1722 k = 0.0938-0.0580-0.0000 ( 3019 PWs) bands (ev): -5.3896 -5.3894 -3.6220 -3.6176 -3.6090 -3.6047 3.6291 3.6450 3.8264 3.8503 4.3888 4.3976 5.2293 5.2372 6.4249 6.4336 6.4391 6.4494 6.5986 6.6211 6.7185 6.7238 6.8617 6.8734 7.2079 7.2299 7.7981 7.8022 7.9726 8.0121 8.1010 8.1013 8.1756 8.2134 8.4090 8.4217 8.4522 8.4535 8.6250 8.6419 8.6862 8.7000 9.2109 9.2114 9.9421 9.9850 10.8431 10.8857 11.0089 11.0393 11.0944 11.1284 11.1626 11.1832 13.4043 13.4134 16.1509 16.1566 k = 0.1094-0.0677-0.0000 ( 3017 PWs) bands (ev): -5.3774 -5.3772 -3.6352 -3.6304 -3.6174 -3.6125 3.5834 3.6019 3.7991 3.8263 4.4608 4.4706 5.2986 5.3073 6.4184 6.4297 6.4330 6.4465 6.5719 6.5954 6.7192 6.7247 6.8736 6.8867 7.2245 7.2492 7.7877 7.7925 7.9669 8.0119 8.0985 8.0988 8.1729 8.2167 8.4090 8.4234 8.4531 8.4551 8.6215 8.6418 8.6897 8.7087 9.2066 9.2073 9.9070 9.9548 10.7902 10.8331 11.0005 11.0304 11.1030 11.1270 11.1798 11.1991 13.4786 13.4886 16.1310 16.1377 k = 0.1250-0.0773-0.0000 ( 3015 PWs) bands (ev): -5.3634 -5.3631 -3.6507 -3.6456 -3.6264 -3.6212 3.5395 3.5601 3.7738 3.8038 4.5336 4.5443 5.3738 5.3833 6.4105 6.4209 6.4273 6.4412 6.5462 6.5694 6.7201 6.7259 6.8871 6.9014 7.2420 7.2693 7.7766 7.7821 7.9609 8.0111 8.0956 8.0960 8.1704 8.2201 8.4089 8.4246 8.4541 8.4569 8.6172 8.6416 8.6945 8.7185 9.2016 9.2027 9.8689 9.9207 10.7324 10.7761 10.9907 11.0202 11.1113 11.1264 11.2017 11.2196 13.5575 13.5682 16.1066 16.1146 k = 0.1406-0.0870-0.0000 ( 3009 PWs) bands (ev): -5.3475 -5.3472 -3.6684 -3.6631 -3.6358 -3.6305 3.4972 3.5196 3.7516 3.7838 4.6069 4.6183 5.4539 5.4640 6.3994 6.4035 6.4234 6.4329 6.5246 6.5459 6.7213 6.7271 6.9019 6.9173 7.2603 7.2900 7.7649 7.7712 7.9548 8.0096 8.0921 8.0928 8.1683 8.2237 8.4085 8.4253 8.4553 8.4589 8.6124 8.6411 8.7009 8.7292 9.1959 9.1976 9.8284 9.8832 10.6722 10.7169 10.9794 11.0089 11.1194 11.1275 11.2262 11.2432 13.6396 13.6509 16.0765 16.0862 k = 0.1562-0.0967-0.0000 ( 3009 PWs) bands (ev): -5.3298 -5.3295 -3.6883 -3.6830 -3.6458 -3.6404 3.4564 3.4799 3.7333 3.7670 4.6802 4.6921 5.5379 5.5486 6.3758 6.3828 6.4194 6.4231 6.5099 6.5278 6.7225 6.7283 6.9178 6.9340 7.2787 7.3108 7.7530 7.7600 7.9485 8.0073 8.0880 8.0894 8.1665 8.2272 8.4078 8.4254 8.4567 8.4610 8.6071 8.6402 8.7088 8.7408 9.1897 9.1919 9.7861 9.8427 10.6116 10.6573 10.9665 10.9962 11.1275 11.1304 11.2524 11.2688 13.7236 13.7352 16.0387 16.0503 k = 0.1719-0.1063-0.0000 ( 3009 PWs) bands (ev): -5.3104 -5.3100 -3.7103 -3.7050 -3.6561 -3.6508 3.4171 3.4412 3.7196 3.7541 4.7532 4.7655 5.6248 5.6359 6.3403 6.3553 6.4132 6.4173 6.5016 6.5162 6.7238 6.7294 6.9344 6.9514 7.2971 7.3314 7.7413 7.7491 7.9420 8.0044 8.0834 8.0858 8.1651 8.2309 8.4067 8.4250 8.4583 8.4633 8.6015 8.6387 8.7183 8.7530 9.1828 9.1858 9.7425 9.7996 10.5520 10.5984 10.9522 10.9823 11.1346 11.1359 11.2795 11.2956 13.8083 13.8200 15.9909 16.0044 k = 0.1875-0.1160-0.0000 ( 3003 PWs) bands (ev): -5.2892 -5.2888 -3.7345 -3.7293 -3.6666 -3.6614 3.3792 3.4033 3.7109 3.7457 4.8256 4.8382 5.7134 5.7248 6.2985 6.3191 6.4069 6.4143 6.4977 6.5099 6.7252 6.7305 6.9516 6.9692 7.3150 7.3514 7.7301 7.7388 7.9353 8.0007 8.0783 8.0820 8.1641 8.2346 8.4051 8.4240 8.4602 8.4658 8.5957 8.6366 8.7293 8.7655 9.1754 9.1794 9.6984 9.7544 10.4946 10.5414 10.9365 10.9671 11.1401 11.1444 11.3072 11.3230 13.8927 13.9045 15.9303 15.9456 k = 0.2031-0.1256-0.0000 ( 2995 PWs) bands (ev): -5.2664 -5.2660 -3.7608 -3.7557 -3.6774 -3.6723 3.3426 3.3662 3.7075 3.7420 4.8971 4.9097 5.8020 5.8136 6.2527 6.2778 6.4018 6.4119 6.4968 6.5071 6.7271 6.7317 6.9691 6.9872 7.3321 7.3704 7.7200 7.7297 7.9286 7.9965 8.0727 8.0780 8.1637 8.2384 8.4031 8.4224 8.4624 8.4686 8.5900 8.6341 8.7416 8.7781 9.1674 9.1724 9.6541 9.7077 10.4402 10.4870 10.9198 10.9509 11.1464 11.1533 11.3350 11.3505 13.9761 13.9876 15.8550 15.8716 k = 0.2188-0.1353-0.0000 ( 2991 PWs) bands (ev): -5.2419 -5.2414 -3.7892 -3.7842 -3.6882 -3.6832 3.3072 3.3301 3.7093 3.7432 4.9672 4.9799 5.8871 5.8998 6.2057 6.2356 6.3977 6.4102 6.4979 6.5068 6.7295 6.7332 6.9866 7.0052 7.3478 7.3877 7.7113 7.7223 7.9218 7.9916 8.0667 8.0739 8.1637 8.2422 8.4005 8.4203 8.4648 8.4716 8.5843 8.6310 8.7547 8.7905 9.1589 9.1651 9.6107 9.6602 10.3893 10.4355 10.9023 10.9339 11.1533 11.1622 11.3625 11.3778 14.0575 14.0688 15.7640 15.7814 k = 0.2344-0.1450-0.0000 ( 2993 PWs) bands (ev): -5.2158 -5.2153 -3.8195 -3.8147 -3.6990 -3.6942 3.2733 3.2951 3.7164 3.7494 5.0358 5.0484 5.9594 5.9775 6.1634 6.2014 6.3945 6.4089 6.5004 6.5086 6.7328 6.7352 7.0041 7.0230 7.3616 7.4027 7.7045 7.7170 7.9149 7.9861 8.0603 8.0696 8.1643 8.2458 8.3976 8.4179 8.4677 8.4749 8.5788 8.6276 8.7683 8.8021 9.1499 9.1575 9.5686 9.6127 10.3421 10.3874 10.8842 10.9164 11.1606 11.1713 11.3896 11.4047 14.1362 14.1472 15.6581 15.6758 k = 0.2500-0.1546-0.0000 ( 2994 PWs) bands (ev): -5.1881 -5.1876 -3.8516 -3.8470 -3.7097 -3.7050 3.2407 3.2613 3.7286 3.7605 5.1024 5.1148 5.9934 6.0227 6.1502 6.1981 6.3918 6.4084 6.5039 6.5129 6.7377 6.7384 7.0212 7.0405 7.3732 7.4150 7.7001 7.7145 7.9080 7.9802 8.0535 8.0653 8.1654 8.2492 8.3944 8.4153 8.4709 8.4785 8.5737 8.6238 8.7817 8.8126 9.1404 9.1494 9.5287 9.5659 10.2986 10.3426 10.8659 10.8986 11.1680 11.1804 11.4160 11.4308 14.2114 14.2221 15.5397 15.5575 k = 0.2656-0.1643-0.0000 ( 2992 PWs) bands (ev): -5.1590 -5.1584 -3.8855 -3.8811 -3.7201 -3.7157 3.2097 3.2290 3.7457 3.7763 5.1668 5.1789 5.9739 6.0027 6.1959 6.2401 6.3900 6.4090 6.5082 6.5209 6.7436 6.7455 7.0380 7.0577 7.3822 7.4240 7.6983 7.7151 7.9011 7.9739 8.0464 8.0609 8.1669 8.2522 8.3913 8.4127 8.4746 8.4824 8.5688 8.6198 8.7946 8.8216 9.1306 9.1411 9.4919 9.5208 10.2590 10.3014 10.8479 10.8810 11.1755 11.1893 11.4415 11.4561 14.2819 14.2926 15.4124 15.4304 k = 0.2812-0.1740-0.0000 ( 2992 PWs) bands (ev): -5.1284 -5.1278 -3.9209 -3.9167 -3.7302 -3.7261 3.1803 3.1982 3.7674 3.7968 5.2283 5.2401 5.9269 5.9536 6.2600 6.2991 6.3891 6.4117 6.5137 6.5335 6.7528 6.7577 7.0542 7.0745 7.3883 7.4296 7.6991 7.7186 7.8945 7.9674 8.0393 8.0565 8.1687 8.2544 8.3886 8.4102 8.4786 8.4866 8.5645 8.6156 8.8058 8.8287 9.1204 9.1324 9.4586 9.4784 10.2230 10.2636 10.8305 10.8639 11.1829 11.1980 11.4660 11.4802 14.3458 14.3569 15.2811 15.2994 k = 0.2969-0.1836-0.0000 ( 2994 PWs) bands (ev): -5.0965 -5.0959 -3.9579 -3.9539 -3.7400 -3.7361 3.1525 3.1690 3.7934 3.8215 5.2865 5.2979 5.8708 5.8966 6.3172 6.3491 6.3899 6.4197 6.5218 6.5511 6.7689 6.7770 7.0698 7.0910 7.3918 7.4320 7.7023 7.7245 7.8880 7.9607 8.0321 8.0521 8.1706 8.2557 8.3864 8.4083 8.4831 8.4911 8.5606 8.6113 8.8142 8.8337 9.1101 9.1234 9.4295 9.4397 10.1904 10.2290 10.8144 10.8478 11.1899 11.2063 11.4894 11.5031 14.4003 14.4124 15.1517 15.1704 k = 0.3125-0.1933-0.0000 ( 2994 PWs) bands (ev): -5.0633 -5.0626 -3.9961 -3.9923 -3.7493 -3.7457 3.1266 3.1416 3.8234 3.8502 5.3405 5.3514 5.8120 5.8372 6.3595 6.3734 6.3946 6.4377 6.5337 6.5718 6.7963 6.8066 7.0846 7.1073 7.3929 7.4318 7.7071 7.7323 7.8821 7.9539 8.0249 8.0478 8.1721 8.2554 8.3850 8.4075 8.4879 8.4956 8.5573 8.6071 8.8185 8.8369 9.0998 9.1142 9.4023 9.4083 10.1611 10.1976 10.8001 10.8332 11.1965 11.2141 11.5115 11.5246 14.4393 14.4531 15.0329 15.0521 k = 0.3281-0.2030-0.0000 ( 2988 PWs) bands (ev): -5.0289 -5.0282 -4.0354 -4.0319 -3.7581 -3.7548 3.1024 3.1161 3.8570 3.8824 5.3887 5.3990 5.7542 5.7785 6.3779 6.3840 6.4051 6.4569 6.5486 6.5903 6.8378 6.8485 7.0989 7.1238 7.3922 7.4296 7.7126 7.7407 7.8768 7.9471 8.0179 8.0438 8.1728 8.2535 8.3847 8.4086 8.4931 8.5002 8.5548 8.6030 8.8178 8.8382 9.0897 9.1047 9.3743 9.3878 10.1348 10.1691 10.7881 10.8205 11.2025 11.2213 11.5322 11.5447 14.4520 14.4674 14.9388 14.9578 k = 0.3438-0.2126-0.0000 ( 2988 PWs) bands (ev): -4.9935 -4.9927 -4.0757 -4.0724 -3.7664 -3.7633 3.0802 3.0926 3.8935 3.9176 5.4275 5.4376 5.7016 5.7244 6.3796 6.3908 6.4197 6.4692 6.5624 6.6027 6.8917 6.9019 7.1124 7.1412 7.3903 7.4261 7.7177 7.7487 7.8724 7.9404 8.0111 8.0400 8.1724 8.2494 8.3855 8.4119 8.4982 8.5048 8.5531 8.5993 8.8123 8.8369 9.0799 9.0952 9.3509 9.3729 10.1114 10.1432 10.7789 10.8102 11.2078 11.2277 11.5515 11.5633 14.4249 14.4403 14.8867 14.9032 k = 0.3594-0.2223-0.0000 ( 2988 PWs) bands (ev): -4.9572 -4.9564 -4.1167 -4.1136 -3.7740 -3.7711 3.0600 3.0710 3.9326 3.9553 5.4492 5.4606 5.6624 5.6826 6.3802 6.3928 6.4318 6.4760 6.5720 6.6088 6.9511 6.9637 7.1256 7.1609 7.3877 7.4222 7.7213 7.7554 7.8693 7.9338 8.0048 8.0366 8.1704 8.2429 8.3879 8.4176 8.5031 8.5091 8.5524 8.5960 8.8032 8.8320 9.0706 9.0857 9.3333 9.3622 10.0906 10.1199 10.7728 10.8027 11.2124 11.2332 11.5693 11.5802 14.3571 14.3709 14.8792 14.8913 k = 0.3750-0.2320-0.0000 ( 2982 PWs) bands (ev): -4.9201 -4.9193 -4.1581 -4.1552 -3.7809 -3.7784 3.0419 3.0515 3.9735 3.9947 5.4428 5.4575 5.6480 5.6645 6.3804 6.3933 6.4410 6.4798 6.5776 6.6103 7.0084 7.0287 7.1395 7.1854 7.3853 7.4187 7.7223 7.7597 7.8676 7.9275 7.9991 8.0335 8.1667 8.2342 8.3924 8.4254 8.5072 8.5134 8.5531 8.5935 8.7913 8.8235 9.0620 9.0763 9.3213 9.3547 10.0724 10.0989 10.7700 10.7980 11.2162 11.2375 11.5855 11.5955 14.2650 14.2773 14.8997 14.9080 k = 0.3906-0.2416-0.0000 ( 2980 PWs) bands (ev): -4.8826 -4.8818 -4.1996 -4.1969 -3.7871 -3.7848 3.0258 3.0342 4.0153 4.0350 5.4101 5.4270 5.6578 5.6712 6.3805 6.3931 6.4482 6.4818 6.5802 6.6087 7.0567 7.0879 7.1586 7.2179 7.3838 7.4165 7.7200 7.7605 7.8673 7.9213 7.9943 8.0308 8.1614 8.2231 8.3990 8.4346 8.5099 8.5174 8.5554 8.5918 8.7776 8.8117 9.0540 9.0674 9.3141 9.3494 10.0566 10.0801 10.7706 10.7963 11.2193 11.2407 11.6001 11.6091 14.1652 14.1765 14.9325 14.9383 k = 0.4062-0.2513-0.0000 ( 2986 PWs) bands (ev): -4.8450 -4.8441 -4.2409 -4.2384 -3.7925 -3.7906 3.0119 3.0190 4.0571 4.0750 5.3649 5.3819 5.6794 5.6906 6.3806 6.3923 6.4540 6.4827 6.5807 6.6053 7.0920 7.1255 7.1949 7.2590 7.3850 7.4170 7.7136 7.7571 7.8683 7.9154 7.9907 8.0283 8.1549 8.2101 8.4078 8.4446 8.5114 8.5207 8.5592 8.5912 8.7630 8.7975 9.0469 9.0590 9.3108 9.3456 10.0430 10.0634 10.7742 10.7972 11.2218 11.2427 11.6130 11.6209 14.0679 14.0783 14.9693 14.9739 k = 0.4219-0.2610-0.0000 ( 2982 PWs) bands (ev): -4.8078 -4.8069 -4.2812 -4.2790 -3.7971 -3.7955 3.0001 3.0060 4.0975 4.1135 5.3173 5.3332 5.7035 5.7128 6.3807 6.3912 6.4590 6.4829 6.5802 6.6009 7.1156 7.1418 7.2441 7.3010 7.3936 7.4231 7.7030 7.7488 7.8703 7.9097 7.9888 8.0259 8.1482 8.1959 8.4182 8.4545 8.5119 8.5228 8.5647 8.5917 8.7486 8.7818 9.0408 9.0513 9.3105 9.3426 10.0318 10.0489 10.7803 10.8001 11.2237 11.2433 11.6242 11.6308 13.9790 13.9882 15.0057 15.0100 k = 0.4375-0.2706-0.0000 ( 2982 PWs) bands (ev): -4.7718 -4.7708 -4.3199 -4.3179 -3.8009 -3.7996 2.9906 2.9953 4.1351 4.1487 5.2725 5.2865 5.7260 5.7336 6.3809 6.3897 6.4633 6.4824 6.5794 6.5962 7.1313 7.1502 7.2876 7.3293 7.4176 7.4400 7.6880 7.7349 7.8728 7.9043 7.9886 8.0231 8.1419 8.1814 8.4296 8.4633 8.5119 8.5236 8.5713 8.5930 8.7353 8.7655 9.0358 9.0446 9.3121 9.3397 10.0229 10.0366 10.7879 10.8043 11.2253 11.2428 11.6336 11.6390 13.9021 13.9099 15.0395 15.0435 k = 0.4531-0.2803-0.0000 ( 2986 PWs) bands (ev): -4.7383 -4.7374 -4.3554 -4.3537 -3.8038 -3.8028 2.9832 2.9867 4.1680 4.1789 5.2342 5.2455 5.7450 5.7509 6.3812 6.3881 6.4671 6.4815 6.5788 6.5914 7.1422 7.1553 7.3166 7.3403 7.4537 7.4746 7.6682 7.7148 7.8757 7.8991 7.9903 8.0197 8.1370 8.1676 8.4412 8.4701 8.5119 8.5231 8.5784 8.5946 8.7244 8.7498 9.0321 9.0389 9.3149 9.3367 10.0162 10.0266 10.7959 10.8087 11.2268 11.2412 11.6411 11.6452 13.8398 13.8461 15.0687 15.0723 k = 0.4688-0.2900-0.0000 ( 2984 PWs) bands (ev): -4.7095 -4.7088 -4.3854 -4.3842 -3.8059 -3.8052 2.9781 2.9805 4.1942 4.2019 5.2051 5.2130 5.7595 5.7635 6.3816 6.3864 6.4705 6.4801 6.5787 6.5872 7.1498 7.1580 7.3318 7.3435 7.4932 7.5203 7.6441 7.6886 7.8788 7.8943 7.9938 8.0153 8.1345 8.1553 8.4523 8.4737 8.5126 8.5216 8.5852 8.5961 8.7169 8.7357 9.0297 9.0343 9.3184 9.3334 10.0120 10.0189 10.8035 10.8122 11.2286 11.2388 11.6468 11.6495 13.7943 13.7986 15.0916 15.0944 k = 0.4844-0.2996-0.0000 ( 2978 PWs) bands (ev): -4.6891 -4.6886 -4.4064 -4.4057 -3.8070 -3.8067 2.9753 2.9765 4.2119 4.2158 5.1874 5.1916 5.7689 5.7709 6.3824 6.3849 6.4735 6.4783 6.5794 6.5837 7.1549 7.1589 7.3390 7.3438 7.5334 7.5633 7.6183 7.6567 7.8822 7.8899 7.9987 8.0101 8.1350 8.1455 8.4619 8.4734 8.5143 8.5194 8.5909 8.5963 8.7142 8.7243 9.0288 9.0311 9.3223 9.3299 10.0101 10.0136 10.8094 10.8139 11.2307 11.2361 11.6504 11.6518 13.7669 13.7691 15.1065 15.1081 k = 0.5000-0.3093-0.0000 ( 2976 PWs) bands (ev): -4.6814 -4.6814 -4.4138 -4.4138 -3.8073 -3.8073 2.9748 2.9748 4.2193 4.2193 5.1828 5.1828 5.7727 5.7727 6.3835 6.3835 6.4761 6.4761 6.5811 6.5811 7.1578 7.1578 7.3424 7.3424 7.5680 7.5680 7.6224 7.6224 7.8859 7.8859 8.0043 8.0043 8.1387 8.1387 8.4692 8.4692 8.5168 8.5168 8.5947 8.5947 8.7168 8.7168 9.0293 9.0293 9.3261 9.3261 10.0106 10.0106 10.8130 10.8130 11.2333 11.2333 11.6521 11.6521 13.7584 13.7584 15.1122 15.1122 k = 0.5000-0.3093-0.0000 ( 2976 PWs) bands (ev): -4.6814 -4.6814 -4.4138 -4.4138 -3.8073 -3.8073 2.9748 2.9748 4.2193 4.2193 5.1828 5.1828 5.7727 5.7727 6.3835 6.3835 6.4761 6.4761 6.5811 6.5811 7.1578 7.1578 7.3424 7.3424 7.5680 7.5680 7.6224 7.6224 7.8859 7.8859 8.0043 8.0043 8.1387 8.1387 8.4692 8.4692 8.5168 8.5168 8.5947 8.5947 8.7168 8.7168 9.0293 9.0293 9.3261 9.3261 10.0106 10.0106 10.8130 10.8130 11.2333 11.2333 11.6521 11.6521 13.7584 13.7584 15.1122 15.1122 k = 0.5081-0.2962-0.0096 ( 2978 PWs) bands (ev): -4.6807 -4.6807 -4.4133 -4.4132 -3.8090 -3.8089 2.9776 2.9778 4.2178 4.2180 5.1733 5.1755 5.7775 5.7818 6.3814 6.3852 6.4754 6.4771 6.5799 6.5832 7.1576 7.1576 7.3419 7.3422 7.5655 7.5697 7.6229 7.6234 7.8814 7.8902 8.0047 8.0066 8.1354 8.1428 8.4685 8.4689 8.5150 8.5188 8.5936 8.5956 8.7121 8.7182 9.0301 9.0305 9.3218 9.3288 10.0129 10.0154 10.8121 10.8132 11.2330 11.2345 11.6506 11.6507 13.7584 13.7586 15.1091 15.1093 k = 0.5162-0.2830-0.0192 ( 2980 PWs) bands (ev): -4.6787 -4.6786 -4.4115 -4.4114 -3.8138 -3.8136 2.9861 2.9865 4.2137 4.2139 5.1484 5.1525 5.7953 5.8035 6.3790 6.3865 6.4749 6.4783 6.5796 6.5862 7.1569 7.1569 7.3407 7.3412 7.5625 7.5705 7.6252 7.6256 7.8769 7.8943 8.0078 8.0115 8.1330 8.1478 8.4666 8.4678 8.5137 8.5210 8.5922 8.5962 8.7045 8.7165 9.0331 9.0338 9.3160 9.3297 10.0223 10.0271 10.8105 10.8127 11.2337 11.2368 11.6461 11.6463 13.7586 13.7589 15.0998 15.1003 k = 0.5244-0.2699-0.0289 ( 2980 PWs) bands (ev): -4.6753 -4.6752 -4.4085 -4.4084 -3.8217 -3.8215 3.0003 3.0009 4.2070 4.2073 5.1112 5.1165 5.8231 5.8346 6.3763 6.3874 6.4749 6.4799 6.5802 6.5899 7.1558 7.1558 7.3386 7.3394 7.5595 7.5705 7.6289 7.6293 7.8723 7.8980 8.0134 8.0188 8.1319 8.1537 8.4633 8.4658 8.5129 8.5232 8.5906 8.5965 8.6940 8.7117 9.0380 9.0391 9.3092 9.3286 10.0386 10.0451 10.8081 10.8115 11.2355 11.2402 11.6387 11.6392 13.7587 13.7592 15.0846 15.0854 k = 0.5325-0.2568-0.0385 ( 2980 PWs) bands (ev): -4.6706 -4.6705 -4.4043 -4.4042 -3.8327 -3.8324 3.0201 3.0208 4.1979 4.1983 5.0648 5.0708 5.8577 5.8721 6.3734 6.3878 6.4751 6.4818 6.5816 6.5943 7.1542 7.1542 7.3357 7.3365 7.5567 7.5699 7.6332 7.6352 7.8677 7.9013 8.0211 8.0282 8.1321 8.1605 8.4588 8.4633 8.5125 8.5254 8.5889 8.5966 8.6812 8.7043 9.0448 9.0463 9.3015 9.3257 10.0614 10.0689 10.8049 10.8096 11.2382 11.2446 11.6284 11.6293 13.7585 13.7592 15.0636 15.0647 k = 0.5406-0.2436-0.0481 ( 2980 PWs) bands (ev): -4.6646 -4.6644 -4.3990 -4.3989 -3.8467 -3.8463 3.0452 3.0461 4.1864 4.1869 5.0120 5.0183 5.8963 5.9130 6.3702 6.3877 6.4757 6.4840 6.5835 6.5990 7.1523 7.1523 7.3317 7.3325 7.5546 7.5693 7.6385 7.6428 7.8631 7.9041 8.0309 8.0396 8.1338 8.1681 8.4531 8.4600 8.5121 8.5274 8.5871 8.5965 8.6663 8.6949 9.0533 9.0552 9.2932 9.3208 10.0900 10.0978 10.8007 10.8066 11.2419 11.2501 11.6155 11.6169 13.7577 13.7585 15.0372 15.0389 k = 0.5487-0.2305-0.0577 ( 2990 PWs) bands (ev): -4.6573 -4.6571 -4.3925 -4.3923 -3.8635 -3.8631 3.0754 3.0765 4.1730 4.1735 4.9548 4.9612 5.9366 5.9554 6.3667 6.3871 6.4766 6.4866 6.5859 6.6039 7.1500 7.1500 7.3265 7.3272 7.5534 7.5692 7.6447 7.6517 7.8586 7.9061 8.0424 8.0524 8.1370 8.1765 8.4463 8.4561 8.5114 8.5291 8.5852 8.5961 8.6501 8.6839 9.0633 9.0656 9.2844 9.3144 10.1235 10.1309 10.7953 10.8026 11.2467 11.2566 11.6001 11.6022 13.7555 13.7564 15.0060 15.0084 k = 0.5569-0.2174-0.0673 ( 2992 PWs) bands (ev): -4.6487 -4.6485 -4.3849 -4.3847 -3.8829 -3.8825 3.1104 3.1118 4.1578 4.1584 4.8946 4.9010 5.9772 5.9979 6.3630 6.3860 6.4780 6.4896 6.5884 6.6087 7.1474 7.1475 7.3202 7.3207 7.5535 7.5703 7.6517 7.6618 7.8540 7.9073 8.0553 8.0665 8.1421 8.1857 8.4386 8.4516 8.5100 8.5304 8.5833 8.5956 8.6330 8.6723 9.0746 9.0771 9.2755 9.3065 10.1612 10.1676 10.7886 10.7973 11.2524 11.2642 11.5825 11.5855 13.7516 13.7526 14.9713 14.9745 k = 0.5650-0.2042-0.0770 ( 2998 PWs) bands (ev): -4.6390 -4.6388 -4.3761 -4.3759 -3.9049 -3.9043 3.1498 3.1514 4.1414 4.1420 4.8326 4.8387 6.0167 6.0392 6.3591 6.3844 6.4800 6.4931 6.5908 6.6131 7.1446 7.1448 7.3127 7.3128 7.5552 7.5726 7.6594 7.6726 7.8495 7.9076 8.0694 8.0814 8.1493 8.1958 8.4302 8.4464 8.5074 8.5307 8.5814 8.5948 8.6161 8.6608 9.0869 9.0896 9.2665 9.2976 10.2020 10.2068 10.7803 10.7906 11.2591 11.2728 11.5630 11.5672 13.7452 13.7462 14.9343 14.9385 k = 0.5731-0.1911-0.0866 ( 3004 PWs) bands (ev): -4.6282 -4.6279 -4.3662 -4.3659 -3.9291 -3.9285 3.1932 3.1949 4.1242 4.1248 4.7696 4.7754 6.0546 6.0787 6.3549 6.3823 6.4825 6.4970 6.5927 6.6169 7.1417 7.1419 7.3040 7.3043 7.5584 7.5765 7.6677 7.6840 7.8450 7.9067 8.0845 8.0969 8.1586 8.2067 8.4213 8.4406 8.5029 8.5292 8.5791 8.5937 8.6009 8.6505 9.0999 9.1026 9.2577 9.2879 10.2450 10.2478 10.7703 10.7822 11.2666 11.2823 11.5420 11.5476 13.7357 13.7367 14.8970 14.9022 k = 0.5812-0.1780-0.0962 ( 3004 PWs) bands (ev): -4.6163 -4.6161 -4.3552 -4.3549 -3.9554 -3.9547 3.2399 3.2418 4.1068 4.1074 4.7061 4.7117 6.0901 6.1157 6.3503 6.3796 6.4857 6.5015 6.5941 6.6199 7.1386 7.1389 7.2944 7.2952 7.5633 7.5820 7.6764 7.6956 7.8404 7.9044 8.1004 8.1129 8.1701 8.2183 8.4119 8.4342 8.4963 8.5243 8.5761 8.5896 8.5922 8.6420 9.1135 9.1158 9.2493 9.2778 10.2891 10.2897 10.7584 10.7719 11.2749 11.2927 11.5199 11.5271 13.7225 13.7236 14.8612 14.8676 k = 0.5894-0.1648-0.1058 ( 3006 PWs) bands (ev): -4.6035 -4.6033 -4.3432 -4.3429 -3.9834 -3.9827 3.2890 3.2911 4.0901 4.0905 4.6427 4.6479 6.1228 6.1497 6.3454 6.3763 6.4896 6.5066 6.5945 6.6216 7.1354 7.1357 7.2845 7.2857 7.5697 7.5890 7.6854 7.7072 7.8358 7.9007 8.1170 8.1292 8.1836 8.2304 8.4020 8.4271 8.4873 8.5147 8.5726 8.5837 8.5906 8.6356 9.1271 9.1288 9.2416 9.2675 10.3316 10.3334 10.7445 10.7595 11.2838 11.3035 11.4972 11.5061 13.7055 13.7065 14.8290 14.8367 k = 0.5975-0.1517-0.1154 ( 3008 PWs) bands (ev): -4.5900 -4.5898 -4.3301 -4.3298 -4.0129 -4.0122 3.3396 3.3417 4.0750 4.0753 4.5797 4.5846 6.1525 6.1804 6.3400 6.3724 6.4943 6.5121 6.5937 6.6220 7.1321 7.1324 7.2746 7.2762 7.5774 7.5972 7.6946 7.7184 7.8312 7.8955 8.1340 8.1456 8.1991 8.2429 8.3919 8.4192 8.4763 8.5010 8.5704 8.5811 8.5889 8.6312 9.1404 9.1410 9.2350 9.2574 10.3727 10.3769 10.7284 10.7448 11.2929 11.3147 11.4744 11.4850 13.6849 13.6859 14.8023 14.8112 k = 0.6056-0.1386-0.1251 ( 3012 PWs) bands (ev): -4.5760 -4.5757 -4.3160 -4.3157 -4.0435 -4.0428 3.3902 3.3924 4.0630 4.0630 4.5175 4.5221 6.1791 6.2077 6.3341 6.3679 6.4998 6.5181 6.5914 6.6207 7.1285 7.1287 7.2653 7.2671 7.5862 7.6064 7.7039 7.7291 7.8265 7.8887 8.1514 8.1621 8.2164 8.2554 8.3815 8.4103 8.4639 8.4852 8.5700 8.5798 8.5873 8.6283 9.1519 9.1529 9.2300 9.2481 10.4121 10.4186 10.7102 10.7278 11.3018 11.3256 11.4519 11.4640 13.6614 13.6624 14.7822 14.7925 k = 0.6137-0.1254-0.1347 ( 3018 PWs) bands (ev): -4.5617 -4.5614 -4.3010 -4.3006 -4.0748 -4.0740 3.4389 3.4410 4.0555 4.0559 4.4563 4.4606 6.2024 6.2313 6.3276 6.3626 6.5061 6.5244 6.5877 6.6179 7.1246 7.1248 7.2569 7.2588 7.5959 7.6160 7.7131 7.7389 7.8219 7.8800 8.1690 8.1784 8.2349 8.2671 8.3711 8.4002 8.4510 8.4693 8.5705 8.5792 8.5860 8.6264 9.1607 9.1639 9.2269 9.2400 10.4490 10.4576 10.6899 10.7085 11.3101 11.3359 11.4302 11.4437 13.6364 13.6375 14.7696 14.7811 k = 0.6218-0.1123-0.1443 ( 3017 PWs) bands (ev): -4.5475 -4.5473 -4.2850 -4.2846 -4.1061 -4.1053 3.4834 3.4853 4.0551 4.0561 4.3965 4.4005 6.2226 6.2512 6.3203 6.3567 6.5131 6.5308 6.5822 6.6134 7.1202 7.1203 7.2501 7.2520 7.6062 7.6258 7.7222 7.7475 7.8179 7.8698 8.1867 8.1944 8.2544 8.2773 8.3609 8.3884 8.4388 8.4549 8.5716 8.5789 8.5851 8.6249 9.1671 9.1725 9.2261 9.2338 10.4827 10.4929 10.6680 10.6873 11.3171 11.3448 11.4100 11.4241 13.6121 13.6131 14.7646 14.7774 k = 0.6300-0.0992-0.1539 ( 3019 PWs) bands (ev): -4.5341 -4.5339 -4.2682 -4.2677 -4.1367 -4.1360 3.5208 3.5224 4.0643 4.0662 4.3384 4.3419 6.2397 6.2672 6.3121 6.3502 6.5206 6.5369 6.5751 6.6076 7.1151 7.1152 7.2451 7.2467 7.6168 7.6348 7.7311 7.7546 7.8148 7.8578 8.2041 8.2097 8.2745 8.2845 8.3516 8.3750 8.4287 8.4427 8.5729 8.5790 8.5843 8.6236 9.1711 9.1777 9.2272 9.2305 10.5126 10.5238 10.6448 10.6644 11.3218 11.3517 11.3916 11.4055 13.5906 13.5915 14.7667 14.7808 k = 0.6381-0.0860-0.1635 ( 3021 PWs) bands (ev): -4.5224 -4.5222 -4.2504 -4.2499 -4.1657 -4.1650 3.5488 3.5498 4.0853 4.0882 4.2823 4.2854 6.2538 6.2793 6.3031 6.3434 6.5286 6.5420 6.5663 6.6010 7.1092 7.1092 7.2421 7.2433 7.6272 7.6420 7.7394 7.7599 7.8135 7.8446 8.2206 8.2236 8.2873 8.2947 8.3440 8.3604 8.4220 8.4332 8.5743 8.5790 8.5836 8.6223 9.1734 9.1794 9.2294 9.2300 10.5379 10.5492 10.6209 10.6409 11.3234 11.3560 11.3758 11.3879 13.5743 13.5750 14.7751 14.7908 k = 0.6462-0.0729-0.1731 ( 3015 PWs) bands (ev): -4.5135 -4.5133 -4.2319 -4.2314 -4.1916 -4.1909 3.5660 3.5665 4.1181 4.1226 4.2296 4.2318 6.2645 6.2864 6.2937 6.3372 6.5367 6.5451 6.5561 6.5948 7.1024 7.1025 7.2414 7.2420 7.6370 7.6461 7.7466 7.7636 7.8147 7.8309 8.2347 8.2352 8.2856 8.3149 8.3388 8.3459 8.4198 8.4263 8.5755 8.5795 8.5826 8.6213 9.1748 9.1784 9.2313 9.2316 10.5582 10.5672 10.5969 10.6184 11.3207 11.3572 11.3633 11.3713 13.5655 13.5659 14.7882 14.8065 k = 0.6543-0.0598-0.1828 ( 3013 PWs) bands (ev): -4.5091 -4.5091 -4.2126 -4.2126 -4.2126 -4.2115 3.5728 3.5728 4.1480 4.1554 4.1946 4.1946 6.2683 6.2872 6.2873 6.3331 6.5443 6.5443 6.5451 6.5907 7.0949 7.0949 7.2427 7.2427 7.6453 7.6453 7.7511 7.7666 7.8185 7.8185 8.2424 8.2424 8.2834 8.3323 8.3359 8.3360 8.4219 8.4219 8.5759 8.5809 8.5809 8.6207 9.1761 9.1761 9.2329 9.2329 10.5711 10.5711 10.5753 10.6039 11.3137 11.3539 11.3539 11.3570 13.5659 13.5659 14.8017 14.8240 k = 0.6543-0.0598-0.1828 ( 3013 PWs) bands (ev): -4.5091 -4.5091 -4.2126 -4.2126 -4.2126 -4.2115 3.5728 3.5728 4.1480 4.1554 4.1946 4.1946 6.2683 6.2872 6.2873 6.3331 6.5443 6.5443 6.5451 6.5907 7.0949 7.0949 7.2427 7.2427 7.6453 7.6453 7.7511 7.7666 7.8185 7.8185 8.2424 8.2424 8.2834 8.3323 8.3359 8.3360 8.4219 8.4219 8.5759 8.5809 8.5809 8.6207 9.1761 9.1761 9.2329 9.2329 10.5711 10.5711 10.5753 10.6039 11.3137 11.3539 11.3539 11.3570 13.5659 13.5659 14.8017 14.8240 k = 0.6578-0.0541-0.1654 ( 3019 PWs) bands (ev): -4.5160 -4.5160 -4.2163 -4.2163 -4.2163 -4.2153 3.5633 3.5633 4.1421 4.1509 4.1898 4.1898 6.2804 6.2988 6.2988 6.3447 6.5577 6.5577 6.5577 6.6039 7.1244 7.1244 7.2413 7.2413 7.6358 7.6358 7.7388 7.7500 7.8309 7.8309 8.2223 8.2223 8.2841 8.3189 8.3190 8.3323 8.4204 8.4204 8.5775 8.5809 8.5809 8.6220 9.1774 9.1774 9.2315 9.2315 10.6007 10.6007 10.6027 10.6335 11.3608 11.4017 11.4017 11.4069 13.5416 13.5417 14.7428 14.7643 k = 0.6614-0.0484-0.1481 ( 3019 PWs) bands (ev): -4.5211 -4.5211 -4.2185 -4.2185 -4.2184 -4.2175 3.5554 3.5554 4.1377 4.1479 4.1865 4.1865 6.2890 6.3070 6.3070 6.3522 6.5707 6.5707 6.5708 6.6174 7.1216 7.1216 7.2641 7.2641 7.6262 7.6262 7.7286 7.7351 7.8342 7.8342 8.1974 8.1975 8.2849 8.3105 8.3106 8.3324 8.4200 8.4200 8.5788 8.5809 8.5809 8.6234 9.1761 9.1761 9.2358 9.2358 10.6224 10.6226 10.6227 10.6548 11.4062 11.4470 11.4470 11.4540 13.5270 13.5270 14.6924 14.7126 k = 0.6649-0.0428-0.1308 ( 3001 PWs) bands (ev): -4.5244 -4.5244 -4.2191 -4.2191 -4.2189 -4.2181 3.5490 3.5490 4.1349 4.1465 4.1847 4.1847 6.2939 6.3120 6.3120 6.3559 6.5833 6.5833 6.5842 6.6312 7.0968 7.0968 7.3005 7.3005 7.6173 7.6174 7.7207 7.7222 7.8263 7.8263 8.1688 8.1688 8.2856 8.3123 8.3124 8.3327 8.4203 8.4203 8.5799 8.5810 8.5810 8.6247 9.1752 9.1752 9.2423 9.2423 10.6355 10.6378 10.6378 10.6689 11.4467 11.4871 11.4871 11.4956 13.5220 13.5220 14.6525 14.6712 k = 0.6684-0.0371-0.1134 ( 3001 PWs) bands (ev): -4.5260 -4.5260 -4.2181 -4.2181 -4.2179 -4.2172 3.5441 3.5441 4.1336 4.1466 4.1843 4.1843 6.2952 6.3136 6.3136 6.3555 6.5951 6.5951 6.5977 6.6451 7.0608 7.0608 7.3389 7.3390 7.6095 7.6096 7.7113 7.7151 7.8073 7.8073 8.1372 8.1372 8.2863 8.3235 8.3236 8.3332 8.4211 8.4211 8.5805 8.5809 8.5810 8.6258 9.1764 9.1764 9.2492 9.2492 10.6427 10.6470 10.6470 10.6767 11.4797 11.5194 11.5194 11.5288 13.5266 13.5266 14.6249 14.6416 k = 0.6719-0.0314-0.0961 ( 3007 PWs) bands (ev): -4.5259 -4.5259 -4.2156 -4.2156 -4.2153 -4.2147 3.5407 3.5407 4.1339 4.1483 4.1855 4.1855 6.2928 6.3118 6.3118 6.3513 6.6060 6.6060 6.6113 6.6589 7.0171 7.0171 7.3758 7.3758 7.6027 7.6027 7.7025 7.7119 7.7794 7.7794 8.1036 8.1036 8.2869 8.3339 8.3419 8.3420 8.4226 8.4227 8.5806 8.5808 8.5809 8.6267 9.1804 9.1804 9.2559 9.2559 10.6448 10.6510 10.6510 10.6791 11.5029 11.5417 11.5417 11.5519 13.5404 13.5404 14.6111 14.6243 k = 0.6754-0.0258-0.0787 ( 3007 PWs) bands (ev): -4.5240 -4.5240 -4.2114 -4.2114 -4.2111 -4.2106 3.5386 3.5386 4.1357 4.1516 4.1881 4.1881 6.2869 6.3068 6.3068 6.3435 6.6159 6.6159 6.6249 6.6728 6.9667 6.9667 7.4098 7.4098 7.5960 7.5960 7.6960 7.7110 7.7461 7.7462 8.0689 8.0689 8.2876 8.3349 8.3639 8.3640 8.4260 8.4260 8.5803 8.5807 8.5807 8.6275 9.1873 9.1873 9.2627 9.2627 10.6421 10.6503 10.6503 10.6765 11.5151 11.5529 11.5529 11.5636 13.5627 13.5627 14.6117 14.6206 k = 0.6789-0.0201-0.0614 ( 3025 PWs) bands (ev): -4.5203 -4.5203 -4.2057 -4.2057 -4.2053 -4.2049 3.5379 3.5379 4.1391 4.1564 4.1922 4.1922 6.2776 6.2985 6.2985 6.3323 6.6241 6.6241 6.6382 6.6864 6.9100 6.9100 7.4405 7.4405 7.5872 7.5872 7.6915 7.7119 7.7119 7.7123 8.0338 8.0338 8.2881 8.3361 8.3844 8.3846 8.4338 8.4339 8.5794 8.5803 8.5803 8.6279 9.1966 9.1966 9.2701 9.2701 10.6350 10.6452 10.6452 10.6694 11.5156 11.5523 11.5523 11.5634 13.5926 13.5926 14.6268 14.6312 k = 0.6824-0.0144-0.0441 ( 3019 PWs) bands (ev): -4.5150 -4.5150 -4.1984 -4.1984 -4.1979 -4.1977 3.5386 3.5386 4.1440 4.1628 4.1978 4.1978 6.2651 6.2870 6.2870 6.3180 6.6294 6.6294 6.6512 6.6998 6.8484 6.8485 7.4669 7.4670 7.5727 7.5727 7.6834 7.6834 7.6893 7.7160 7.9994 7.9994 8.2888 8.3377 8.3976 8.3977 8.4503 8.4504 8.5782 8.5801 8.5802 8.6284 9.2076 9.2076 9.2796 9.2796 10.6237 10.6360 10.6360 10.6580 11.5047 11.5402 11.5402 11.5517 13.6293 13.6293 14.6557 14.6558 k = 0.6859-0.0087-0.0267 ( 3019 PWs) bands (ev): -4.5079 -4.5079 -4.1895 -4.1895 -4.1890 -4.1888 3.5405 3.5405 4.1504 4.1708 4.2048 4.2048 6.2494 6.2725 6.2725 6.3005 6.6278 6.6278 6.6639 6.7128 6.7858 6.7858 7.4855 7.4855 7.5509 7.5510 7.6667 7.6668 7.6893 7.7218 7.9663 7.9663 8.2894 8.3396 8.4033 8.4033 8.4738 8.4738 8.5764 8.5799 8.5799 8.6285 9.2186 9.2186 9.2932 9.2932 10.6082 10.6228 10.6228 10.6424 11.4834 11.5177 11.5177 11.5296 13.6716 13.6716 14.6927 14.6972 k = 0.6894-0.0031-0.0094 ( 3013 PWs) bands (ev): -4.4992 -4.4992 -4.1791 -4.1791 -4.1785 -4.1785 3.5435 3.5435 4.1582 4.1802 4.2133 4.2133 6.2308 6.2549 6.2549 6.2803 6.6069 6.6069 6.6762 6.7253 6.7347 6.7347 7.4783 7.4783 7.5406 7.5407 7.6619 7.6619 7.6912 7.7295 7.9353 7.9353 8.2901 8.3419 8.4054 8.4055 8.4992 8.4993 8.5742 8.5799 8.5799 8.6286 9.2278 9.2279 9.3130 9.3130 10.5886 10.6055 10.6055 10.6224 11.4532 11.4862 11.4862 11.4988 13.7185 13.7185 14.7405 14.7490 k = 0.6929 0.0026 0.0079 ( 3004 PWs) bands (ev): -4.4889 -4.4889 -4.1672 -4.1672 -4.1666 -4.1665 3.5477 3.5477 4.1674 4.1911 4.2230 4.2230 6.2093 6.2344 6.2345 6.2574 6.5507 6.5507 6.6881 6.7113 6.7113 6.7374 7.4401 7.4401 7.5518 7.5518 7.6647 7.6647 7.6950 7.7388 7.9069 7.9069 8.2908 8.3446 8.4060 8.4061 8.5237 8.5237 8.5716 8.5804 8.5804 8.6286 9.2346 9.2346 9.3399 9.3399 10.5648 10.5840 10.5840 10.5980 11.4161 11.4476 11.4476 11.4610 13.7690 13.7690 14.7972 14.8067 k = 0.6964 0.0083 0.0253 ( 3013 PWs) bands (ev): -4.4770 -4.4770 -4.1537 -4.1537 -4.1531 -4.1530 3.5527 3.5527 4.1778 4.2034 4.2340 4.2340 6.1851 6.2110 6.2110 6.2320 6.4683 6.4683 6.6995 6.7071 6.7071 6.7488 7.3915 7.3915 7.5668 7.5669 7.6719 7.6719 7.7004 7.7496 7.8815 7.8816 8.2915 8.3476 8.4058 8.4059 8.5448 8.5448 8.5683 8.5822 8.5823 8.6283 9.2392 9.2392 9.3736 9.3736 10.5366 10.5582 10.5582 10.5690 11.3739 11.4039 11.4039 11.4183 13.8221 13.8221 14.8606 14.8710 k = 0.6999 0.0139 0.0426 ( 3007 PWs) bands (ev): -4.4635 -4.4635 -4.1388 -4.1388 -4.1382 -4.1380 3.5586 3.5586 4.1896 4.2169 4.2462 4.2462 6.1584 6.1846 6.1846 6.2043 6.3733 6.3733 6.7098 6.7098 6.7105 6.7597 7.3396 7.3396 7.5808 7.5808 7.6820 7.6820 7.7071 7.7616 7.8598 7.8598 8.2924 8.3512 8.4052 8.4053 8.5596 8.5597 8.5647 8.5883 8.5883 8.6279 9.2426 9.2426 9.4133 9.4133 10.5043 10.5281 10.5281 10.5355 11.3286 11.3571 11.3571 11.3724 13.8767 13.8767 14.9286 14.9398 k = 0.7034 0.0196 0.0600 ( 3019 PWs) bands (ev): -4.4486 -4.4486 -4.1223 -4.1223 -4.1219 -4.1216 3.5652 3.5652 4.2024 4.2317 4.2594 4.2594 6.1292 6.1542 6.1542 6.1744 6.2720 6.2720 6.7147 6.7147 6.7209 6.7699 7.2861 7.2861 7.5922 7.5923 7.6938 7.6938 7.7150 7.7745 7.8421 7.8421 8.2934 8.3552 8.4043 8.4044 8.5606 8.5660 8.5660 8.6001 8.6002 8.6275 9.2450 9.2450 9.4582 9.4582 10.4678 10.4937 10.4937 10.4975 11.2818 11.3086 11.3086 11.3250 13.9322 13.9322 14.9995 15.0112 k = 0.7070 0.0253 0.0773 ( 3025 PWs) bands (ev): -4.4322 -4.4322 -4.1045 -4.1045 -4.1040 -4.1037 3.5722 3.5722 4.2162 4.2476 4.2735 4.2735 6.0978 6.1133 6.1133 6.1426 6.1737 6.1737 6.7205 6.7205 6.7309 6.7795 7.2319 7.2319 7.6007 7.6007 7.7067 7.7067 7.7237 7.7880 7.8291 7.8291 8.2947 8.3597 8.4033 8.4033 8.5561 8.5679 8.5679 8.6139 8.6140 8.6271 9.2470 9.2470 9.5076 9.5076 10.4275 10.4552 10.4552 10.4553 11.2350 11.2600 11.2601 11.2774 13.9877 13.9877 15.0716 15.0837 k = 0.7105 0.0310 0.0946 ( 3025 PWs) bands (ev): -4.4144 -4.4144 -4.0853 -4.0853 -4.0848 -4.0844 3.5795 3.5795 4.2310 4.2645 4.2885 4.2885 6.0309 6.0310 6.0646 6.1093 6.1111 6.1111 6.7266 6.7266 6.7404 6.7885 7.1777 7.1777 7.6058 7.6058 7.7202 7.7202 7.7330 7.8019 7.8210 7.8210 8.2961 8.3647 8.4022 8.4022 8.5514 8.5683 8.5684 8.6267 8.6272 8.6272 9.2487 9.2487 9.5610 9.5610 10.3839 10.4093 10.4129 10.4129 11.1889 11.2123 11.2123 11.2304 14.0424 14.0424 15.1433 15.1558 k = 0.7140 0.0366 0.1120 ( 3019 PWs) bands (ev): -4.3953 -4.3953 -4.0647 -4.0647 -4.0643 -4.0638 3.5868 3.5868 4.2465 4.2823 4.3042 4.3042 5.9206 5.9206 6.0296 6.0721 6.0721 6.0744 6.7326 6.7326 6.7494 6.7969 7.1235 7.1235 7.6072 7.6072 7.7339 7.7340 7.7426 7.8159 7.8181 7.8181 8.2979 8.3702 8.4011 8.4011 8.5464 8.5683 8.5684 8.6263 8.6389 8.6389 9.2503 9.2503 9.6177 9.6178 10.3377 10.3604 10.3675 10.3675 11.1442 11.1661 11.1661 11.1846 14.0957 14.0957 15.2136 15.2263 k = 0.7175 0.0423 0.1293 ( 3010 PWs) bands (ev): -4.3749 -4.3749 -4.0428 -4.0428 -4.0424 -4.0418 3.5938 3.5938 4.2625 4.3007 4.3204 4.3204 5.8048 5.8048 5.9930 6.0358 6.0358 6.0384 6.7385 6.7385 6.7579 6.8045 7.0696 7.0696 7.6050 7.6050 7.7475 7.7476 7.7522 7.8202 7.8202 7.8296 8.3002 8.3763 8.4001 8.4001 8.5414 8.5682 8.5682 8.6261 8.6490 8.6490 9.2517 9.2517 9.6773 9.6773 10.2895 10.3091 10.3197 10.3197 11.1010 11.1215 11.1215 11.1401 14.1466 14.1466 15.2812 15.2941 k = 0.7210 0.0480 0.1466 ( 3016 PWs) bands (ev): -4.3534 -4.3534 -4.0196 -4.0196 -4.0192 -4.0186 3.6000 3.6000 4.2789 4.3196 4.3368 4.3368 5.6876 5.6876 5.9551 5.9992 5.9992 6.0012 6.7441 6.7441 6.7658 6.8115 7.0161 7.0161 7.5996 7.5996 7.7607 7.7608 7.7613 7.8266 7.8266 7.8428 8.3029 8.3828 8.3993 8.3993 8.5363 8.5681 8.5681 8.6259 8.6575 8.6575 9.2528 9.2529 9.7390 9.7390 10.2402 10.2566 10.2703 10.2703 11.0591 11.0786 11.0786 11.0970 14.1944 14.1944 15.3450 15.3578 k = 0.7245 0.0536 0.1640 ( 3010 PWs) bands (ev): -4.3308 -4.3308 -3.9952 -3.9952 -3.9949 -3.9942 3.6051 3.6051 4.2955 4.3388 4.3532 4.3532 5.5707 5.5707 5.9162 5.9623 5.9623 5.9634 6.7493 6.7493 6.7733 6.8178 6.9633 6.9633 7.5919 7.5919 7.7700 7.7737 7.7737 7.8364 7.8365 7.8554 8.3063 8.3897 8.3988 8.3988 8.5314 8.5681 8.5681 8.6259 8.6647 8.6647 9.2538 9.2539 9.8025 9.8025 10.1907 10.2037 10.2203 10.2203 11.0185 11.0371 11.0371 11.0550 14.2378 14.2378 15.4033 15.4158 k = 0.7280 0.0593 0.1813 ( 2998 PWs) bands (ev): -4.3073 -4.3073 -3.9696 -3.9696 -3.9693 -3.9686 3.6086 3.6086 4.3120 4.3580 4.3694 4.3694 5.4556 5.4556 5.8767 5.9251 5.9251 5.9252 6.7541 6.7541 6.7802 6.8233 6.9112 6.9112 7.5825 7.5825 7.7778 7.7862 7.7863 7.8487 7.8488 7.8670 8.3103 8.3969 8.3988 8.3988 8.5269 8.5683 8.5683 8.6262 8.6708 8.6708 9.2546 9.2546 9.8670 9.8670 10.1419 10.1515 10.1708 10.1709 10.9786 10.9968 10.9968 11.0138 14.2755 14.2755 15.4539 15.4654 k = 0.7315 0.0650 0.1987 ( 2998 PWs) bands (ev): -4.2828 -4.2828 -3.9430 -3.9430 -3.9427 -3.9419 3.6097 3.6097 4.3281 4.3769 4.3850 4.3850 5.3434 5.3434 5.8368 5.8868 5.8879 5.8879 6.7583 6.7583 6.7864 6.8281 6.8599 6.8599 7.5718 7.5718 7.7845 7.7984 7.7984 7.8626 7.8627 7.8773 8.3151 8.3993 8.3993 8.4041 8.5229 8.5687 8.5687 8.6266 8.6757 8.6757 9.2549 9.2549 9.9312 9.9312 10.0944 10.1006 10.1236 10.1236 10.9392 10.9571 10.9571 10.9730 14.3057 14.3057 15.4926 15.5020 k = 0.7350 0.0706 0.2160 ( 2998 PWs) bands (ev): -4.2576 -4.2576 -3.9153 -3.9153 -3.9150 -3.9142 3.6078 3.6078 4.3435 4.3952 4.3996 4.3996 5.2354 5.2354 5.7969 5.8487 5.8510 5.8510 6.7614 6.7614 6.7921 6.8100 6.8100 6.8320 7.5603 7.5603 7.7902 7.8100 7.8101 7.8777 7.8778 7.8864 8.3207 8.4005 8.4005 8.4111 8.5200 8.5693 8.5693 8.6272 8.6796 8.6796 9.2548 9.2548 9.9896 9.9896 10.0489 10.0518 10.0842 10.0843 10.8997 10.9176 10.9176 10.9323 14.3262 14.3262 15.5128 15.5177 k = 0.7385 0.0763 0.2333 ( 2995 PWs) bands (ev): -4.2317 -4.2317 -3.8866 -3.8866 -3.8864 -3.8856 3.6021 3.6021 4.3578 4.4124 4.4129 4.4129 5.1329 5.1329 5.7577 5.8114 5.8150 5.8150 6.7520 6.7520 6.7729 6.7729 6.7972 6.8353 7.5483 7.5483 7.7946 7.8211 7.8211 7.8937 7.8938 7.8941 8.3271 8.4024 8.4024 8.4174 8.5186 8.5703 8.5703 8.6282 8.6827 8.6827 9.2541 9.2542 10.0046 10.0046 10.0058 10.0060 10.0908 10.0908 10.8599 10.8779 10.8780 10.8913 14.3345 14.3345 15.5027 15.5030 k = 0.7420 0.0820 0.2507 ( 2995 PWs) bands (ev): -4.2054 -4.2054 -3.8570 -3.8570 -3.8568 -3.8560 3.5915 3.5915 4.3706 4.4243 4.4243 4.4280 5.0374 5.0374 5.7196 5.7752 5.7802 5.7802 6.7072 6.7072 6.7715 6.7715 6.8017 6.8377 7.5360 7.5360 7.7978 7.8313 7.8314 7.9004 7.9104 7.9105 8.3341 8.4050 8.4050 8.4227 8.5187 8.5715 8.5715 8.6293 8.6852 8.6852 9.2529 9.2529 9.9629 9.9661 9.9717 9.9717 10.1476 10.1476 10.8195 10.8379 10.8379 10.8497 14.3282 14.3282 15.4532 15.4532 k = 0.7455 0.0877 0.2680 ( 2995 PWs) bands (ev): -4.1786 -4.1786 -3.8267 -3.8267 -3.8265 -3.8256 3.5753 3.5753 4.3816 4.4335 4.4335 4.4417 4.9502 4.9502 5.6831 5.7407 5.7472 5.7472 6.6594 6.6594 6.7735 6.7735 6.8055 6.8393 7.5236 7.5236 7.7998 7.8406 7.8407 7.9053 7.9279 7.9279 8.3419 8.4085 8.4085 8.4266 8.5212 8.5731 8.5731 8.6308 8.6870 8.6870 9.2509 9.2510 9.9234 9.9294 9.9336 9.9337 10.2119 10.2119 10.7783 10.7971 10.7971 10.8074 14.3057 14.3057 15.3773 15.3773 k = 0.7490 0.0933 0.2853 ( 3001 PWs) bands (ev): -4.1516 -4.1516 -3.7956 -3.7956 -3.7954 -3.7945 3.5524 3.5524 4.3903 4.4398 4.4398 4.4529 4.8725 4.8725 5.6489 5.7083 5.7166 5.7166 6.6120 6.6120 6.7755 6.7755 6.8087 6.8400 7.5110 7.5110 7.8008 7.8487 7.8488 7.9088 7.9461 7.9461 8.3501 8.4127 8.4127 8.4290 8.5259 8.5751 8.5751 8.6326 8.6882 8.6882 9.2481 9.2481 9.8876 9.8960 9.8970 9.8971 10.2768 10.2768 10.7361 10.7554 10.7554 10.7641 14.2666 14.2666 15.2875 15.2875 k = 0.7526 0.0990 0.3027 ( 3007 PWs) bands (ev): -4.1245 -4.1245 -3.7638 -3.7638 -3.7636 -3.7628 3.5224 3.5224 4.3962 4.4429 4.4429 4.4610 4.8052 4.8053 5.6178 5.6786 5.6889 5.6889 6.5653 6.5654 6.7771 6.7771 6.8112 6.8400 7.4986 7.4986 7.8009 7.8557 7.8557 7.9110 7.9651 7.9652 8.3587 8.4175 8.4175 8.4299 8.5325 8.5775 8.5775 8.6348 8.6888 8.6889 9.2444 9.2445 9.8553 9.8629 9.8630 9.8660 10.3409 10.3409 10.6929 10.7128 10.7128 10.7198 14.2120 14.2120 15.1925 15.1925 k = 0.7561 0.1047 0.3200 ( 3007 PWs) bands (ev): -4.0974 -4.0974 -3.7315 -3.7315 -3.7313 -3.7306 3.4849 3.4849 4.3991 4.4423 4.4423 4.4655 4.7491 4.7491 5.5903 5.6521 5.6647 5.6647 6.5196 6.5196 6.7783 6.7783 6.8131 6.8391 7.4862 7.4862 7.8003 7.8615 7.8616 7.9122 7.9851 7.9851 8.3676 8.4228 8.4228 8.4297 8.5407 8.5802 8.5803 8.6374 8.6891 8.6891 9.2398 9.2398 9.8266 9.8316 9.8316 9.8393 10.4033 10.4033 10.6489 10.6696 10.6697 10.6748 14.1443 14.1443 15.0975 15.0975 k = 0.7596 0.1103 0.3374 ( 3004 PWs) bands (ev): -4.0707 -4.0707 -3.6988 -3.6988 -3.6986 -3.6979 3.4401 3.4401 4.3986 4.4378 4.4378 4.4659 4.7039 4.7039 5.5670 5.6293 5.6444 5.6444 6.4747 6.4747 6.7791 6.7791 6.8144 6.8375 7.4740 7.4740 7.7991 7.8663 7.8664 7.9124 8.0060 8.0061 8.3765 8.4284 8.4285 8.4288 8.5500 8.5834 8.5835 8.6402 8.6889 8.6890 9.2341 9.2342 9.8012 9.8028 9.8028 9.8154 10.4630 10.4630 10.6044 10.6266 10.6266 10.6291 14.0665 14.0665 15.0053 15.0053 k = 0.7631 0.1160 0.3547 ( 3010 PWs) bands (ev): -4.0443 -4.0443 -3.6657 -3.6657 -3.6655 -3.6648 3.3888 3.3888 4.3944 4.4295 4.4295 4.4619 4.6690 4.6690 5.5484 5.6103 5.6283 5.6283 6.4307 6.4307 6.7794 6.7794 6.8151 6.8351 7.4620 7.4620 7.7975 7.8701 7.8701 7.9118 8.0279 8.0280 8.3852 8.4274 8.4343 8.4343 8.5597 8.5869 8.5869 8.6434 8.6884 8.6885 9.2274 9.2274 9.7764 9.7764 9.7786 9.7941 10.5158 10.5158 10.5595 10.5832 10.5874 10.5874 13.9815 13.9815 14.9175 14.9175 k = 0.7666 0.1217 0.3720 ( 3010 PWs) bands (ev): -4.0186 -4.0186 -3.6324 -3.6324 -3.6322 -3.6315 3.3320 3.3320 4.3864 4.4175 4.4175 4.4534 4.6434 4.6434 5.5349 5.5957 5.6166 5.6166 6.3875 6.3875 6.7793 6.7793 6.8151 6.8319 7.4502 7.4502 7.7959 7.8731 7.8732 7.9106 8.0508 8.0508 8.3936 8.4259 8.4401 8.4402 8.5696 8.5906 8.5906 8.6468 8.6877 8.6877 9.2195 9.2195 9.7519 9.7519 9.7584 9.7749 10.5151 10.5225 10.5226 10.5377 10.5914 10.5915 13.8918 13.8918 14.8351 14.8351 k = 0.7701 0.1274 0.3894 ( 3010 PWs) bands (ev): -3.9937 -3.9937 -3.5989 -3.5989 -3.5987 -3.5982 3.2711 3.2711 4.3746 4.4022 4.4022 4.4402 4.6255 4.6255 5.5265 5.5853 5.6095 5.6095 6.3453 6.3453 6.7788 6.7788 6.8145 6.8281 7.4386 7.4386 7.7942 7.8755 7.8756 7.9090 8.0745 8.0746 8.4016 8.4243 8.4459 8.4460 8.5793 8.5944 8.5945 8.6505 8.6867 8.6867 9.2103 9.2104 9.7287 9.7288 9.7398 9.7568 10.4717 10.4845 10.4845 10.4932 10.6376 10.6376 13.7995 13.7995 14.7587 14.7587 k = 0.7736 0.1330 0.4067 ( 3007 PWs) bands (ev): -3.9699 -3.9699 -3.5655 -3.5655 -3.5652 -3.5648 3.2076 3.2076 4.3593 4.3838 4.3839 4.4228 4.6141 4.6141 5.5231 5.5791 5.6067 5.6067 6.3040 6.3040 6.7779 6.7779 6.8133 6.8235 7.4273 7.4273 7.7927 7.8775 7.8775 7.9072 8.0993 8.0993 8.4092 8.4227 8.4516 8.4516 8.5885 8.5982 8.5983 8.6543 8.6856 8.6856 9.2000 9.2000 9.7062 9.7062 9.7220 9.7392 10.4304 10.4434 10.4434 10.4508 10.6845 10.6845 13.7064 13.7064 14.6884 14.6884 k = 0.7771 0.1387 0.4240 ( 3007 PWs) bands (ev): -3.9473 -3.9473 -3.5321 -3.5321 -3.5319 -3.5315 3.1429 3.1429 4.3408 4.3628 4.3628 4.4014 4.6082 4.6082 5.5244 5.5770 5.6079 5.6079 6.2635 6.2635 6.7766 6.7766 6.8115 6.8183 7.4163 7.4163 7.7913 7.8791 7.8791 7.9053 8.1246 8.1246 8.4161 8.4213 8.4569 8.4570 8.5971 8.6019 8.6019 8.6583 8.6843 8.6844 9.1883 9.1884 9.6833 9.6834 9.7040 9.7208 10.3923 10.4040 10.4040 10.4117 10.7279 10.7279 13.6137 13.6137 14.6244 14.6244 k = 0.7806 0.1444 0.4414 ( 2995 PWs) bands (ev): -3.9261 -3.9261 -3.4990 -3.4990 -3.4988 -3.4985 3.0784 3.0784 4.3196 4.3393 4.3393 4.3767 4.6066 4.6066 5.5300 5.5786 5.6129 5.6129 6.2240 6.2240 6.7749 6.7749 6.8091 6.8125 7.4057 7.4057 7.7904 7.8805 7.8805 7.9034 8.1508 8.1508 8.4201 8.4225 8.4622 8.4623 8.6050 8.6051 8.6052 8.6623 8.6831 8.6831 9.1755 9.1756 9.6594 9.6594 9.6847 9.7007 10.3586 10.3681 10.3681 10.3771 10.7668 10.7668 13.5224 13.5224 14.5667 14.5667 k = 0.7841 0.1500 0.4587 ( 2995 PWs) bands (ev): -3.9067 -3.9067 -3.4663 -3.4663 -3.4661 -3.4659 3.0152 3.0152 4.2961 4.3137 4.3137 4.3494 4.6087 4.6087 5.5392 5.5833 5.6211 5.6211 6.1853 6.1853 6.7727 6.7727 6.8060 6.8060 7.3952 7.3952 7.7898 7.8818 7.8818 7.9015 8.1774 8.1775 8.4189 8.4282 8.4672 8.4673 8.6077 8.6077 8.6120 8.6661 8.6818 8.6818 9.1614 9.1614 9.6332 9.6333 9.6631 9.6778 10.3306 10.3370 10.3370 10.3483 10.8005 10.8005 13.4335 13.4335 14.5150 14.5150 k = 0.7876 0.1557 0.4761 ( 2989 PWs) bands (ev): -3.8891 -3.8891 -3.4341 -3.4341 -3.4339 -3.4338 2.9545 2.9545 4.2710 4.2867 4.2867 4.3202 4.6136 4.6136 5.5515 5.5908 5.6321 5.6321 6.1476 6.1476 6.7700 6.7700 6.7990 6.8023 7.3852 7.3852 7.7897 7.8830 7.8830 7.8999 8.2044 8.2044 8.4178 8.4333 8.4722 8.4722 8.6095 8.6095 8.6180 8.6698 8.6806 8.6807 9.1461 9.1461 9.6042 9.6043 9.6382 9.6511 10.3095 10.3119 10.3119 10.3266 10.8286 10.8286 13.3477 13.3477 14.4694 14.4694 k = 0.7911 0.1614 0.4934 ( 2989 PWs) bands (ev): -3.8736 -3.8736 -3.4025 -3.4025 -3.4024 -3.4023 2.8971 2.8971 4.2450 4.2588 4.2588 4.2899 4.6207 4.6207 5.5661 5.6005 5.6452 5.6452 6.1107 6.1107 6.7668 6.7668 6.7914 6.7979 7.3755 7.3755 7.7900 7.8842 7.8842 7.8985 8.2313 8.2314 8.4167 8.4377 8.4771 8.4772 8.6102 8.6102 8.6229 8.6730 8.6795 8.6796 9.1297 9.1297 9.5719 9.5719 9.6096 9.6202 10.2936 10.2936 10.2960 10.3125 10.8507 10.8507 13.2654 13.2654 14.4295 14.4295 k = 0.7947 0.1670 0.5107 ( 2983 PWs) bands (ev): -3.8604 -3.8604 -3.3718 -3.3718 -3.3717 -3.3714 2.8438 2.8438 4.2186 4.2306 4.2306 4.2593 4.6293 4.6294 5.5823 5.6117 5.6599 5.6599 6.0747 6.0747 6.7630 6.7630 6.7832 6.7929 7.3662 7.3662 7.7907 7.8854 7.8854 7.8974 8.2581 8.2582 8.4158 8.4417 8.4823 8.4823 8.6099 8.6100 8.6269 8.6759 8.6785 8.6785 9.1123 9.1123 9.5360 9.5360 9.5772 9.5850 10.2827 10.2827 10.2905 10.3066 10.8667 10.8667 13.1872 13.1872 14.3949 14.3949 k = 0.7982 0.1727 0.5281 ( 2983 PWs) bands (ev): -3.8496 -3.8496 -3.3421 -3.3419 -3.3419 -3.3416 2.7952 2.7952 4.1925 4.2027 4.2027 4.2288 4.6391 4.6391 5.5996 5.6240 5.6758 5.6758 6.0396 6.0396 6.7584 6.7584 6.7744 6.7870 7.3572 7.3572 7.7919 7.8867 7.8868 7.8966 8.2844 8.2844 8.4148 8.4451 8.4877 8.4878 8.6085 8.6085 8.6299 8.6775 8.6775 8.6782 9.0940 9.0941 9.4970 9.4970 9.5414 9.5462 10.2792 10.2792 10.2929 10.3086 10.8762 10.8762 13.1136 13.1136 14.3656 14.3656 k = 0.8017 0.1784 0.5454 ( 2995 PWs) bands (ev): -3.8416 -3.8416 -3.3134 -3.3130 -3.3130 -3.3127 2.7520 2.7520 4.1673 4.1756 4.1757 4.1993 4.6494 4.6494 5.6174 5.6369 5.6922 5.6922 6.0053 6.0053 6.7529 6.7529 6.7650 6.7802 7.3484 7.3484 7.7935 7.8881 7.8881 7.8961 8.3095 8.3096 8.4136 8.4480 8.4936 8.4937 8.6060 8.6060 8.6318 8.6763 8.6763 8.6797 9.0751 9.0752 9.4553 9.4553 9.5029 9.5044 10.2830 10.2830 10.3027 10.3181 10.8793 10.8793 13.0449 13.0449 14.3410 14.3410 k = 0.8052 0.1841 0.5627 ( 2995 PWs) bands (ev): -3.8364 -3.8364 -3.2859 -3.2854 -3.2854 -3.2851 2.7145 2.7145 4.1435 4.1501 4.1501 4.1713 4.6600 4.6600 5.6350 5.6496 5.7087 5.7087 5.9718 5.9718 6.7464 6.7464 6.7551 6.7726 7.3401 7.3401 7.7956 7.8896 7.8896 7.8961 8.3331 8.3332 8.4125 8.4507 8.5002 8.5003 8.6025 8.6025 8.6330 8.6749 8.6749 8.6806 9.0560 9.0561 9.4121 9.4121 9.4609 9.4628 10.2935 10.2935 10.3193 10.3343 10.8760 10.8760 12.9814 12.9814 14.3209 14.3209 k = 0.8087 0.1897 0.5801 ( 2989 PWs) bands (ev): -3.8341 -3.8341 -3.2598 -3.2590 -3.2590 -3.2587 2.6832 2.6832 4.1215 4.1264 4.1265 4.1452 4.6706 4.6706 5.6519 5.6619 5.7249 5.7249 5.9393 5.9393 6.7389 6.7389 6.7445 6.7640 7.3320 7.3321 7.7982 7.8912 7.8912 7.8964 8.3546 8.3547 8.4112 8.4530 8.5077 8.5078 8.5982 8.5982 8.6335 8.6733 8.6733 8.6808 9.0371 9.0371 9.3682 9.3682 9.4167 9.4220 10.3101 10.3101 10.3421 10.3565 10.8665 10.8665 12.9235 12.9235 14.3049 14.3049 k = 0.8087 0.1897 0.5801 ( 2989 PWs) bands (ev): -3.8341 -3.8341 -3.2598 -3.2590 -3.2590 -3.2587 2.6832 2.6832 4.1215 4.1264 4.1265 4.1452 4.6706 4.6706 5.6519 5.6619 5.7249 5.7249 5.9393 5.9393 6.7389 6.7389 6.7445 6.7640 7.3320 7.3321 7.7982 7.8912 7.8912 7.8964 8.3546 8.3547 8.4112 8.4530 8.5077 8.5078 8.5982 8.5982 8.6335 8.6733 8.6733 8.6808 9.0371 9.0371 9.3682 9.3682 9.4167 9.4220 10.3101 10.3101 10.3421 10.3565 10.8665 10.8665 12.9235 12.9235 14.3049 14.3049 k = 0.7932 0.1927 0.5892 ( 2989 PWs) bands (ev): -3.8341 -3.8340 -3.2621 -3.2615 -3.2389 -3.2383 2.6744 2.6750 4.1124 4.1155 4.1206 4.1370 4.6727 4.6764 5.6557 5.6642 5.7318 5.7339 5.9278 5.9284 6.7276 6.7310 6.7466 6.7632 7.3308 7.3316 7.7993 7.8914 7.8925 7.8967 8.3601 8.3628 8.4106 8.4537 8.5102 8.5106 8.5956 8.5963 8.6340 8.6694 8.6718 8.6860 9.0251 9.0328 9.3474 9.3553 9.4006 9.4078 10.3146 10.3173 10.3566 10.3696 10.8624 10.8635 12.9033 12.9054 14.2921 14.2925 k = 0.7778 0.1957 0.5984 ( 2989 PWs) bands (ev): -3.8346 -3.8345 -3.2645 -3.2638 -3.2188 -3.2182 2.6682 2.6692 4.1001 4.1013 4.1158 4.1304 4.6756 4.6824 5.6559 5.6635 5.7429 5.7464 5.9163 5.9176 6.7133 6.7178 6.7467 6.7625 7.3330 7.3347 7.8008 7.8920 7.8939 7.8973 8.3651 8.3703 8.4095 8.4543 8.5127 8.5132 8.5930 8.5931 8.6355 8.6641 8.6715 8.6928 9.0109 9.0254 9.3253 9.3390 9.3832 9.3931 10.3222 10.3276 10.3756 10.3872 10.8603 10.8625 12.8845 12.8883 14.2679 14.2681 k = 0.7624 0.1987 0.6075 ( 2993 PWs) bands (ev): -3.8356 -3.8353 -3.2667 -3.2659 -3.1993 -3.1987 2.6644 2.6660 4.0846 4.0855 4.1115 4.1249 4.6788 4.6883 5.6539 5.6613 5.7569 5.7613 5.9048 5.9071 6.6984 6.7029 6.7429 6.7589 7.3386 7.3413 7.8027 7.8929 7.8950 7.8990 8.3696 8.3768 8.4083 8.4547 8.5152 8.5156 8.5894 8.5905 8.6377 8.6596 8.6717 8.6986 8.9947 9.0153 9.3022 9.3202 9.3642 9.3771 10.3358 10.3430 10.3950 10.4060 10.8606 10.8638 12.8679 12.8730 14.2365 14.2375 k = 0.7469 0.2017 0.6166 ( 2989 PWs) bands (ev): -3.8369 -3.8366 -3.2685 -3.2677 -3.1803 -3.1798 2.6630 2.6650 4.0661 4.0689 4.1076 4.1202 4.6823 4.6938 5.6508 5.6583 5.7726 5.7775 5.8933 5.8967 6.6831 6.6872 6.7355 6.7520 7.3472 7.3509 7.8052 7.8943 7.8955 7.9019 8.3734 8.3820 8.4072 8.4550 8.5176 8.5177 8.5861 8.5886 8.6402 8.6560 8.6724 8.7031 8.9772 9.0030 9.2787 9.2997 9.3440 9.3596 10.3546 10.3632 10.4140 10.4249 10.8636 10.8678 12.8541 12.8603 14.2005 14.2023 k = 0.7315 0.2047 0.6258 ( 2989 PWs) bands (ev): -3.8386 -3.8382 -3.2701 -3.2693 -3.1621 -3.1616 2.6638 2.6662 4.0462 4.0509 4.1041 4.1160 4.6856 4.6987 5.6474 5.6553 5.7890 5.7946 5.8818 5.8868 6.6677 6.6712 6.7252 6.7421 7.3584 7.3630 7.8085 7.8958 7.8962 7.9061 8.3765 8.3855 8.4068 8.4550 8.5194 8.5201 8.5833 8.5872 8.6425 8.6532 8.6731 8.7063 8.9586 8.9888 9.2550 9.2782 9.3227 9.3406 10.3770 10.3864 10.4327 10.4437 10.8696 10.8747 12.8437 12.8507 14.1610 14.1635 k = 0.7161 0.2077 0.6349 ( 2986 PWs) bands (ev): -3.8405 -3.8401 -3.2714 -3.2706 -3.1447 -3.1442 2.6667 2.6694 4.0254 4.0316 4.1010 4.1123 4.6887 4.7028 5.6439 5.6523 5.8053 5.8121 5.8704 5.8778 6.6524 6.6552 6.7124 6.7296 7.3716 7.3771 7.8125 7.8960 7.8986 7.9114 8.3790 8.3869 8.4075 8.4548 8.5208 8.5224 8.5813 8.5864 8.6445 8.6511 8.6740 8.7082 8.9393 8.9730 9.2315 9.2560 9.3012 9.3208 10.4003 10.4100 10.4519 10.4632 10.8785 10.8844 12.8372 12.8445 14.1185 14.1216 k = 0.7006 0.2107 0.6441 ( 2988 PWs) bands (ev): -3.8426 -3.8423 -3.2725 -3.2717 -3.1281 -3.1276 2.6714 2.6744 4.0041 4.0115 4.0983 4.1090 4.6914 4.7060 5.6406 5.6495 5.8198 5.8296 5.8593 5.8710 6.6371 6.6393 6.6978 6.7152 7.3862 7.3925 7.8173 7.8960 7.9018 7.9178 8.3808 8.3862 8.4093 8.4542 8.5218 8.5244 8.5801 8.5863 8.6457 8.6496 8.6753 8.7089 8.9195 8.9560 9.2085 9.2336 9.2799 9.3008 10.4215 10.4312 10.4732 10.4849 10.8904 10.8968 12.8346 12.8421 14.0735 14.0771 k = 0.6852 0.2136 0.6532 ( 2987 PWs) bands (ev): -3.8449 -3.8445 -3.2734 -3.2726 -3.1123 -3.1119 2.6777 2.6810 3.9825 3.9908 4.0959 4.1060 4.6935 4.7083 5.6377 5.6471 5.8283 5.8417 5.8539 5.8705 6.6221 6.6237 6.6820 6.6993 7.4016 7.4086 7.8230 7.8960 7.9058 7.9255 8.3820 8.3842 8.4117 8.4532 8.5224 8.5261 8.5797 8.5867 8.6458 8.6485 8.6771 8.7085 8.8997 8.9380 9.1863 9.2111 9.2593 9.2810 10.4383 10.4477 10.4975 10.5095 10.9049 10.9117 12.8359 12.8433 14.0268 14.0308 k = 0.6698 0.2166 0.6623 ( 2983 PWs) bands (ev): -3.8473 -3.8469 -3.2741 -3.2733 -3.0976 -3.0972 2.6854 2.6889 3.9610 3.9698 4.0939 4.1034 4.6951 4.7097 5.6352 5.6451 5.8273 5.8338 5.8686 5.8796 6.6074 6.6085 6.6655 6.6825 7.4174 7.4249 7.8293 7.8959 7.9109 7.9345 8.3814 8.3828 8.4142 8.4517 8.5226 8.5273 8.5800 8.5876 8.6445 8.6475 8.6796 8.7073 8.8802 8.9196 9.1650 9.1889 9.2400 9.2621 10.4506 10.4597 10.5237 10.5358 10.9217 10.9286 12.8411 12.8482 13.9790 13.9833 k = 0.6543 0.2196 0.6715 ( 2987 PWs) bands (ev): -3.8497 -3.8493 -3.2746 -3.2739 -3.0839 -3.0835 2.6941 2.6977 3.9398 3.9488 4.0922 4.1011 4.6962 4.7103 5.6332 5.6434 5.8206 5.8228 5.8866 5.8945 6.5931 6.5939 6.6489 6.6652 7.4329 7.4408 7.8361 7.8956 7.9173 7.9447 8.3782 8.3831 8.4164 8.4497 8.5224 8.5279 8.5806 8.5886 8.6420 8.6466 8.6829 8.7056 8.8617 8.9012 9.1447 9.1672 9.2223 9.2443 10.4597 10.4684 10.5500 10.5620 10.9401 10.9470 12.8495 12.8562 13.9311 13.9354 k = 0.6389 0.2226 0.6806 ( 2991 PWs) bands (ev): -3.8521 -3.8517 -3.2750 -3.2743 -3.0714 -3.0710 2.7037 2.7073 3.9192 3.9283 4.0908 4.0990 4.6968 4.7101 5.6318 5.6422 5.8118 5.8119 5.9045 5.9112 6.5792 6.5798 6.6327 6.6481 7.4480 7.4559 7.8431 7.8952 7.9255 7.9562 8.3749 8.3830 8.4185 8.4470 8.5217 8.5276 8.5816 8.5897 8.6382 8.6452 8.6867 8.7040 8.8444 8.8833 9.1255 9.1463 9.2064 9.2277 10.4664 10.4745 10.5751 10.5867 10.9596 10.9662 12.8606 12.8668 13.8838 13.8882 k = 0.6235 0.2256 0.6897 ( 2990 PWs) bands (ev): -3.8544 -3.8541 -3.2752 -3.2746 -3.0599 -3.0596 2.7137 2.7173 3.8996 3.9084 4.0898 4.0972 4.6970 4.7093 5.6309 5.6413 5.8012 5.8027 5.9221 5.9282 6.5656 6.5663 6.6174 6.6316 7.4621 7.4699 7.8499 7.8947 7.9356 7.9687 8.3717 8.3827 8.4201 8.4436 8.5204 8.5264 8.5828 8.5908 8.6337 8.6430 8.6910 8.7028 8.8290 8.8663 9.1076 9.1264 9.1924 9.2127 10.4714 10.4789 10.5980 10.6090 10.9795 10.9857 12.8737 12.8792 13.8383 13.8425 k = 0.6080 0.2286 0.6989 ( 2992 PWs) bands (ev): -3.8565 -3.8562 -3.2754 -3.2748 -3.0497 -3.0494 2.7238 2.7272 3.8813 3.8896 4.0890 4.0957 4.6969 4.7081 5.6306 5.6407 5.7911 5.7936 5.9389 5.9447 6.5525 6.5535 6.6035 6.6162 7.4750 7.4824 7.8562 7.8939 7.9476 7.9818 8.3686 8.3821 8.4214 8.4396 8.5186 8.5240 8.5840 8.5916 8.6287 8.6399 8.6956 8.7026 8.8158 8.8507 9.0911 9.1078 9.1805 9.1992 10.4752 10.4819 10.6182 10.6284 10.9991 11.0048 12.8878 12.8925 13.7953 13.7993 k = 0.5926 0.2316 0.7080 ( 2984 PWs) bands (ev): -3.8585 -3.8582 -3.2754 -3.2749 -3.0408 -3.0405 2.7337 2.7369 3.8647 3.8722 4.0885 4.0943 4.6966 4.7065 5.6308 5.6405 5.7818 5.7849 5.9548 5.9602 6.5401 6.5414 6.5915 6.6022 7.4865 7.4933 7.8619 7.8931 7.9613 7.9950 8.3658 8.3813 8.4222 8.4350 8.5163 8.5205 8.5852 8.5922 8.6239 8.6359 8.7003 8.7036 8.8050 8.8368 9.0763 9.0908 9.1705 9.1873 10.4781 10.4840 10.6356 10.6448 11.0178 11.0229 12.9020 12.9060 13.7560 13.7596 k = 0.5772 0.2346 0.7172 ( 2976 PWs) bands (ev): -3.8602 -3.8600 -3.2755 -3.2750 -3.0331 -3.0329 2.7429 2.7457 3.8499 3.8566 4.0882 4.0932 4.6963 4.7047 5.6315 5.6403 5.7735 5.7769 5.9694 5.9743 6.5284 6.5302 6.5813 6.5901 7.4965 7.5024 7.8668 7.8921 7.9761 8.0078 8.3634 8.3802 8.4225 8.4300 8.5135 8.5161 8.5863 8.5925 8.6199 8.6313 8.7049 8.7055 8.7967 8.8246 9.0634 9.0755 9.1625 9.1770 10.4804 10.4854 10.6501 10.6582 11.0349 11.0393 12.9155 12.9188 13.7211 13.7243 k = 0.5617 0.2376 0.7263 ( 2976 PWs) bands (ev): -3.8617 -3.8615 -3.2755 -3.2751 -3.0268 -3.0266 2.7511 2.7535 3.8375 3.8430 4.0882 4.0921 4.6961 4.7029 5.6325 5.6403 5.7664 5.7697 5.9822 5.9864 6.5180 6.5200 6.5732 6.5800 7.5048 7.5097 7.8712 7.8909 7.9912 8.0192 8.3618 8.3786 8.4220 8.4250 8.5103 8.5113 8.5872 8.5924 8.6168 8.6268 8.7080 8.7089 8.7907 8.8141 9.0525 9.0623 9.1563 9.1682 10.4821 10.4861 10.6619 10.6686 11.0499 11.0535 12.9276 12.9302 13.6914 13.6940 k = 0.5463 0.2405 0.7354 ( 2977 PWs) bands (ev): -3.8628 -3.8627 -3.2754 -3.2752 -3.0219 -3.0217 2.7580 2.7599 3.8276 3.8319 4.0882 4.0912 4.6960 4.7011 5.6338 5.6401 5.7608 5.7637 5.9929 5.9963 6.5094 6.5113 6.5671 6.5720 7.5115 7.5152 7.8749 7.8894 8.0056 8.0284 8.3610 8.3763 8.4206 8.4209 8.5067 8.5071 8.5879 8.5920 8.6149 8.6227 8.7107 8.7123 8.7870 8.8052 9.0439 9.0514 9.1519 9.1610 10.4834 10.4865 10.6711 10.6762 11.0622 11.0649 12.9376 12.9395 13.6676 13.6697 k = 0.5309 0.2435 0.7446 ( 2965 PWs) bands (ev): -3.8637 -3.8636 -3.2754 -3.2752 -3.0183 -3.0182 2.7633 2.7646 3.8206 3.8236 4.0885 4.0905 4.6961 4.6996 5.6353 5.6397 5.7568 5.7590 6.0012 6.0036 6.5030 6.5045 6.5630 6.5662 7.5164 7.5190 7.8783 7.8878 8.0183 8.0345 8.3615 8.3733 8.4176 8.4193 8.5033 8.5042 8.5886 8.5915 8.6142 8.6194 8.7133 8.7147 8.7856 8.7981 9.0381 9.0431 9.1493 9.1554 10.4845 10.4866 10.6778 10.6812 11.0715 11.0733 12.9452 12.9464 13.6504 13.6517 k = 0.5154 0.2465 0.7537 ( 2960 PWs) bands (ev): -3.8641 -3.8641 -3.2753 -3.2753 -3.0162 -3.0161 2.7667 2.7673 3.8167 3.8182 4.0888 4.0898 4.6965 4.6982 5.6367 5.6390 5.7546 5.7558 6.0066 6.0078 6.4992 6.5000 6.5609 6.5624 7.5197 7.5210 7.8811 7.8859 8.0283 8.0367 8.3632 8.3697 8.4162 8.4176 8.5014 8.5021 8.5893 8.5908 8.6143 8.6170 8.7152 8.7161 8.7861 8.7925 9.0349 9.0375 9.1484 9.1515 10.4853 10.4864 10.6821 10.6838 11.0773 11.0783 12.9499 12.9505 13.6400 13.6406 k = 0.5000 0.2495 0.7629 ( 2954 PWs) bands (ev): -3.8643 -3.8643 -3.2753 -3.2753 -3.0154 -3.0154 2.7680 2.7680 3.8158 3.8158 4.0893 4.0893 4.6972 4.6972 5.6380 5.6380 5.7543 5.7543 6.0088 6.0088 6.4982 6.4982 6.5607 6.5607 7.5212 7.5212 7.8837 7.8837 8.0346 8.0346 8.3661 8.3661 8.4164 8.4164 8.5010 8.5010 8.5901 8.5901 8.6153 8.6153 8.7162 8.7162 8.7885 8.7885 9.0348 9.0348 9.1491 9.1491 10.4859 10.4859 10.6841 10.6841 11.0797 11.0797 12.9517 12.9517 13.6367 13.6367 k = 0.5000 0.2495 0.7629 ( 2954 PWs) bands (ev): -3.8643 -3.8643 -3.2753 -3.2753 -3.0154 -3.0154 2.7680 2.7680 3.8158 3.8158 4.0893 4.0893 4.6972 4.6972 5.6380 5.6380 5.7543 5.7543 6.0088 6.0088 6.4982 6.4982 6.5607 6.5607 7.5212 7.5212 7.8837 7.8837 8.0346 8.0346 8.3661 8.3661 8.4164 8.4164 8.5010 8.5010 8.5901 8.5901 8.6153 8.6153 8.7162 8.7162 8.7885 8.7885 9.0348 9.0348 9.1491 9.1491 10.4859 10.4859 10.6841 10.6841 11.0797 11.0797 12.9517 12.9517 13.6367 13.6367 k = 0.5000 0.2320 0.7686 ( 2960 PWs) bands (ev): -3.8638 -3.8636 -3.2757 -3.2755 -3.0158 -3.0158 2.7681 2.7689 3.8146 3.8158 4.0901 4.0909 4.6947 4.6971 5.6348 5.6402 5.7528 5.7579 6.0076 6.0103 6.4669 6.5238 6.5354 6.5880 7.5208 7.5236 7.8797 7.8884 8.0309 8.0373 8.3597 8.3713 8.4151 8.4165 8.4975 8.5045 8.5835 8.5953 8.6136 8.6166 8.7146 8.7172 8.7855 8.7933 9.0234 9.0420 9.1416 9.1630 10.4864 10.4910 10.6797 10.6883 11.0795 11.0803 12.9482 12.9543 13.6383 13.6408 k = 0.5000 0.2146 0.7743 ( 2970 PWs) bands (ev): -3.8623 -3.8619 -3.2767 -3.2764 -3.0170 -3.0168 2.7691 2.7706 3.8123 3.8147 4.0934 4.0948 4.6896 4.6944 5.6308 5.6412 5.7535 5.7640 6.0066 6.0121 6.4336 6.4993 6.5565 6.6132 7.5226 7.5281 7.8765 7.8938 8.0263 8.0389 8.3522 8.3752 8.4129 8.4151 8.4940 8.5079 8.5763 8.5984 8.6112 8.6178 8.7131 8.7171 8.7846 8.7996 9.0104 9.0435 9.1427 9.1806 10.4923 10.5016 10.6751 10.6923 11.0799 11.0815 12.9437 12.9558 13.6455 13.6505 k = 0.5000 0.1971 0.7800 ( 2972 PWs) bands (ev): -3.8596 -3.8590 -3.2783 -3.2779 -3.0189 -3.0186 2.7709 2.7732 3.8091 3.8126 4.0987 4.1007 4.6823 4.6893 5.6259 5.6408 5.7564 5.7726 6.0060 6.0140 6.3991 6.4676 6.5813 6.6362 7.5266 7.5346 7.8742 7.8997 8.0209 8.0395 8.3435 8.3777 8.4100 8.4123 8.4905 8.5114 8.5689 8.5991 8.6082 8.6194 8.7119 8.7157 8.7855 8.8066 8.9975 9.0405 9.1517 9.2003 10.5031 10.5177 10.6703 10.6963 11.0809 11.0832 12.9383 12.9560 13.6585 13.6658 k = 0.5000 0.1797 0.7857 ( 2974 PWs) bands (ev): -3.8558 -3.8551 -3.2804 -3.2799 -3.0216 -3.0212 2.7737 2.7768 3.8054 3.8099 4.1057 4.1080 4.6731 4.6820 5.6201 5.6387 5.7614 5.7839 6.0054 6.0158 6.3636 6.4352 6.6040 6.6565 7.5326 7.5430 7.8726 7.9061 8.0149 8.0390 8.3336 8.3785 8.4055 8.4092 8.4871 8.5147 8.5618 8.5972 8.6051 8.6211 8.7108 8.7136 8.7874 8.8132 8.9864 9.0364 9.1658 9.2210 10.5181 10.5386 10.6654 10.7005 11.0824 11.0855 12.9318 12.9547 13.6772 13.6869 k = 0.5000 0.1622 0.7914 ( 2974 PWs) bands (ev): -3.8510 -3.8500 -3.2832 -3.2825 -3.0251 -3.0246 2.7774 2.7811 3.8015 3.8068 4.1136 4.1161 4.6624 4.6729 5.6133 5.6350 5.7687 5.7978 6.0048 6.0174 6.3278 6.4028 6.6241 6.6743 7.5407 7.5533 7.8720 7.9129 8.0085 8.0374 8.3225 8.3778 8.3984 8.4070 8.4838 8.5180 8.5550 8.5932 8.6022 8.6223 8.7078 8.7129 8.7897 8.8178 8.9786 9.0340 9.1826 9.2420 10.5360 10.5637 10.6605 10.7053 11.0843 11.0884 12.9243 12.9516 13.7018 13.7136 k = 0.5000 0.1447 0.7971 ( 2972 PWs) bands (ev): -3.8450 -3.8439 -3.2864 -3.2857 -3.0293 -3.0287 2.7820 2.7864 3.7977 3.8037 4.1219 4.1244 4.6507 4.6624 5.6055 5.6298 5.7780 5.8141 6.0036 6.0184 6.2923 6.3711 6.6416 6.6894 7.5506 7.5653 7.8721 7.9198 8.0019 8.0348 8.3101 8.3756 8.3892 8.4052 8.4808 8.5210 8.5487 8.5878 8.5996 8.6229 8.7031 8.7134 8.7918 8.8192 8.9758 9.0349 9.2006 9.2629 10.5554 10.5923 10.6557 10.7113 11.0868 11.0917 12.9157 12.9467 13.7321 13.7460 k = 0.5000 0.1273 0.8028 ( 2970 PWs) bands (ev): -3.8380 -3.8367 -3.2901 -3.2893 -3.0343 -3.0336 2.7874 2.7924 3.7942 3.8008 4.1298 4.1321 4.6384 4.6512 5.5968 5.6233 5.7890 5.8324 6.0015 6.0185 6.2579 6.3410 6.6567 6.7018 7.5622 7.5787 7.8730 7.9266 7.9955 8.0311 8.2963 8.3719 8.3783 8.4036 8.4780 8.5238 8.5429 8.5818 8.5970 8.6230 8.6976 8.7141 8.7932 8.8163 8.9790 9.0395 9.2191 9.2832 10.5739 10.6227 10.6520 10.7198 11.0897 11.0957 12.9063 12.9399 13.7682 13.7839 k = 0.5000 0.1098 0.8085 ( 2972 PWs) bands (ev): -3.8300 -3.8285 -3.2943 -3.2934 -3.0401 -3.0393 2.7938 2.7993 3.7911 3.7981 4.1366 4.1389 4.6262 4.6398 5.5875 5.6159 5.8012 5.8523 5.9978 6.0172 6.2258 6.3134 6.6692 6.7116 7.5754 7.5935 7.8746 7.9328 7.9897 8.0264 8.2812 8.3630 8.3703 8.4017 8.4754 8.5260 8.5374 8.5756 8.5944 8.6226 8.6917 8.7147 8.7939 8.8098 8.9880 9.0478 9.2373 9.3028 10.5888 10.6417 10.6616 10.7318 11.0932 11.1002 12.8965 12.9317 13.8098 13.8273 k = 0.5000 0.0923 0.8143 ( 2970 PWs) bands (ev): -3.8209 -3.8192 -3.2988 -3.2978 -3.0468 -3.0458 2.8010 2.8070 3.7886 3.7959 4.1414 4.1442 4.6146 4.6289 5.5777 5.6079 5.8141 5.8732 5.9919 6.0141 6.1975 6.2891 6.6792 6.7188 7.5899 7.6095 7.8768 7.9377 7.9853 8.0208 8.2647 8.3485 8.3660 8.3994 8.4732 8.5270 8.5327 8.5695 8.5921 8.6220 8.6857 8.7149 8.7939 8.8010 9.0018 9.0596 9.2551 9.3213 10.5978 10.6401 10.6926 10.7482 11.0975 11.1056 12.8871 12.9227 13.8568 13.8757 k = 0.5000 0.0749 0.8200 ( 2966 PWs) bands (ev): -3.8108 -3.8090 -3.3037 -3.3027 -3.0542 -3.0531 2.8090 2.8155 3.7864 3.7939 4.1437 4.1476 4.6041 4.6191 5.5678 5.5996 5.8266 5.8941 5.9835 6.0093 6.1744 6.2689 6.6868 6.7238 7.6056 7.6264 7.8795 7.9403 7.9831 8.0143 8.2469 8.3323 8.3622 8.3964 8.4711 8.5243 8.5311 8.5636 8.5904 8.6215 8.6799 8.7142 8.7906 8.7943 9.0190 9.0743 9.2722 9.3387 10.6003 10.6368 10.7243 10.7682 11.1030 11.1122 12.8791 12.9139 13.9087 13.9288 k = 0.5000 0.0574 0.8257 ( 2974 PWs) bands (ev): -3.7997 -3.7978 -3.3089 -3.3078 -3.0626 -3.0613 2.8180 2.8248 3.7845 3.7922 4.1431 4.1485 4.5951 4.6110 5.5581 5.5912 5.8374 5.9118 5.9745 6.0035 6.1576 6.2535 6.6922 6.7264 7.6222 7.6438 7.8823 7.9399 7.9837 8.0071 8.2280 8.3150 8.3585 8.3929 8.4692 8.5190 8.5310 8.5576 8.5893 8.6209 8.6742 8.7123 8.7819 8.7933 9.0387 9.0912 9.2883 9.3545 10.5975 10.6325 10.7530 10.7893 11.1107 11.1208 12.8736 12.9067 13.9649 13.9860 k = 0.5000 0.0400 0.8314 ( 2972 PWs) bands (ev): -3.7877 -3.7856 -3.3143 -3.3131 -3.0717 -3.0703 2.8280 2.8350 3.7828 3.7904 4.1392 4.1465 4.5882 4.6052 5.5488 5.5830 5.8445 5.9167 5.9746 5.9990 6.1473 6.2429 6.6954 6.7270 7.6397 7.6618 7.8852 7.9370 7.9852 8.0007 8.2081 8.2969 8.3552 8.3888 8.4673 8.5132 8.5306 8.5516 8.5893 8.6206 8.6690 8.7088 8.7744 8.7926 9.0603 9.1102 9.3033 9.3689 10.5911 10.6266 10.7763 10.8080 11.1219 11.1326 12.8720 12.9024 14.0246 14.0465 k = 0.5000 0.0225 0.8371 ( 2968 PWs) bands (ev): -3.7748 -3.7725 -3.3198 -3.3187 -3.0817 -3.0802 2.8388 2.8461 3.7809 3.7885 4.1320 4.1411 4.5839 4.6022 5.5401 5.5753 5.8456 5.9028 5.9902 5.9986 6.1425 6.2368 6.6966 6.7258 7.6578 7.6800 7.8876 7.9327 7.9819 7.9998 8.1876 8.2786 8.3521 8.3843 8.4653 8.5073 8.5295 8.5455 8.5903 8.6206 8.6644 8.7038 8.7691 8.7920 9.0832 9.1306 9.3172 9.3817 10.5824 10.6186 10.7919 10.8208 11.1382 11.1492 12.8754 12.9025 14.0871 14.1093 k = 0.5000 0.0050 0.8428 ( 2966 PWs) bands (ev): -3.7610 -3.7585 -3.3255 -3.3243 -3.0926 -3.0909 2.8507 2.8582 3.7788 3.7862 4.1213 4.1322 4.5825 4.6021 5.5323 5.5681 5.8395 5.8797 6.0033 6.0136 6.1420 6.2347 6.6959 6.7227 7.6765 7.6980 7.8887 7.9278 7.9731 8.0046 8.1668 8.2602 8.3492 8.3794 8.4632 8.5014 8.5277 8.5395 8.5922 8.6208 8.6602 8.6975 8.7659 8.7916 9.1070 9.1521 9.3299 9.3930 10.5719 10.6085 10.7978 10.8249 11.1607 11.1717 12.8848 12.9081 14.1511 14.1732 k = 0.5000-0.0124 0.8485 ( 2968 PWs) bands (ev): -3.7463 -3.7437 -3.3313 -3.3301 -3.1043 -3.1025 2.8636 2.8712 3.7761 3.7832 4.1071 4.1194 4.5846 4.6053 5.5254 5.5615 5.8266 5.8533 6.0143 6.0391 6.1445 6.2358 6.6935 6.7181 7.6957 7.7154 7.8874 7.9228 7.9632 8.0109 8.1461 8.2423 8.3467 8.3744 8.4609 8.4953 8.5248 8.5341 8.5948 8.6213 8.6565 8.6905 8.7644 8.7913 9.1314 9.1744 9.3416 9.4027 10.5597 10.5964 10.7934 10.8192 11.1895 11.2005 12.9010 12.9202 14.2156 14.2369 k = 0.5000-0.0299 0.8542 ( 2966 PWs) bands (ev): -3.7308 -3.7280 -3.3370 -3.3358 -3.1168 -3.1148 2.8775 2.8851 3.7728 3.7795 4.0896 4.1029 4.5902 4.6117 5.5195 5.5556 5.8087 5.8265 6.0296 6.0658 6.1492 6.2396 6.6894 6.7120 7.7150 7.7319 7.8827 7.9166 7.9551 8.0176 8.1262 8.2250 8.3444 8.3693 8.4582 8.4891 8.5204 8.5301 8.5977 8.6220 8.6533 8.6832 8.7642 8.7912 9.1563 9.1973 9.3524 9.4110 10.5461 10.5824 10.7791 10.8038 11.2238 11.2351 12.9242 12.9393 14.2793 14.2989 k = 0.5000-0.0474 0.8599 ( 2966 PWs) bands (ev): -3.7145 -3.7116 -3.3427 -3.3415 -3.1302 -3.1281 2.8926 2.9002 3.7686 3.7750 4.0688 4.0828 4.5994 4.6214 5.5147 5.5504 5.7871 5.8004 6.0477 6.0929 6.1555 6.2455 6.6839 6.7046 7.7345 7.7466 7.8740 7.9079 7.9514 8.0242 8.1078 8.2086 8.3424 8.3644 8.4551 8.4828 8.5152 8.5273 8.6010 8.6230 8.6506 8.6762 8.7650 8.7915 9.1815 9.2204 9.3623 9.4181 10.5310 10.5667 10.7562 10.7801 11.2622 11.2739 12.9540 12.9655 14.3410 14.3576 k = 0.5000-0.0648 0.8657 ( 2968 PWs) bands (ev): -3.6975 -3.6945 -3.3483 -3.3471 -3.1444 -3.1421 2.9087 2.9162 3.7637 3.7696 4.0451 4.0593 4.6121 4.6342 5.5109 5.5456 5.7633 5.7759 6.0676 6.1202 6.1631 6.2531 6.6771 6.6960 7.7534 7.7585 7.8615 7.8976 7.9519 8.0304 8.0915 8.1934 8.3407 8.3597 8.4514 8.4760 8.5100 8.5250 8.6044 8.6241 8.6482 8.6697 8.7665 8.7919 9.2067 9.2435 9.3716 9.4242 10.5147 10.5495 10.7264 10.7496 11.3032 11.3156 12.9898 12.9985 14.3996 14.4111 k = 0.5000-0.0823 0.8714 ( 2972 PWs) bands (ev): -3.6798 -3.6767 -3.3537 -3.3526 -3.1594 -3.1569 2.9258 2.9333 3.7580 3.7635 4.0187 4.0327 4.6282 4.6500 5.5080 5.5413 5.7390 5.7527 6.0885 6.1473 6.1718 6.2620 6.6690 6.6862 7.7646 7.7722 7.8458 7.8891 7.9553 8.0362 8.0777 8.1793 8.3392 8.3555 8.4472 8.4688 8.5054 8.5229 8.6078 8.6253 8.6464 8.6638 8.7684 8.7926 9.2318 9.2663 9.3806 9.4296 10.4972 10.5309 10.6913 10.7139 11.3458 11.3585 13.0302 13.0376 14.4521 14.4590 k = 0.5000-0.0997 0.8771 ( 2968 PWs) bands (ev): -3.6615 -3.6583 -3.3589 -3.3579 -3.1751 -3.1725 2.9441 2.9513 3.7516 3.7567 3.9900 4.0036 4.6472 4.6684 5.5057 5.5372 5.7153 5.7303 6.1098 6.1726 6.1827 6.2721 6.6600 6.6756 7.7648 7.7855 7.8310 7.8852 7.9604 8.0415 8.0668 8.1662 8.3381 8.3517 8.4426 8.4614 8.5016 8.5209 8.6112 8.6266 8.6449 8.6585 8.7708 8.7935 9.2567 9.2887 9.3894 9.4343 10.4788 10.5112 10.6526 10.6747 11.3887 11.4017 13.0739 13.0816 14.4900 14.5066 k = 0.5000-0.1172 0.8828 ( 2964 PWs) bands (ev): -3.6426 -3.6393 -3.3639 -3.3629 -3.1916 -3.1889 2.9632 2.9703 3.7448 3.7494 3.9594 3.9723 4.6687 4.6891 5.5040 5.5330 5.6931 5.7089 6.1310 6.1881 6.2035 6.2830 6.6500 6.6640 7.7569 7.7823 7.8303 7.8873 7.9662 8.0458 8.0587 8.1540 8.3372 8.3485 8.4373 8.4535 8.4985 8.5189 8.6144 8.6279 8.6437 8.6540 8.7736 8.7946 9.2811 9.3102 9.3984 9.4387 10.4595 10.4905 10.6118 10.6332 11.4312 11.4442 13.1197 13.1285 14.5186 14.5473 k = 0.5000-0.1347 0.8885 ( 2962 PWs) bands (ev): -3.6231 -3.6197 -3.3685 -3.3676 -3.2087 -3.2059 2.9833 2.9901 3.7376 3.7418 3.9274 3.9396 4.6920 4.7115 5.5025 5.5286 5.6727 5.6885 6.1518 6.1988 6.2288 6.2945 6.6393 6.6518 7.7424 7.7628 7.8442 7.8943 7.9726 8.0480 8.0545 8.1424 8.3367 8.3460 8.4315 8.4456 8.4963 8.5169 8.6174 8.6291 8.6428 8.6501 8.7765 8.7958 9.3046 9.3305 9.4077 9.4430 10.4397 10.4691 10.5704 10.5909 11.4723 11.4851 13.1661 13.1762 14.5443 14.5769 k = 0.5000-0.1521 0.8942 ( 2960 PWs) bands (ev): -3.6032 -3.5997 -3.3729 -3.3721 -3.2266 -3.2236 3.0040 3.0106 3.7304 3.7341 3.8946 3.9059 4.7167 4.7351 5.5010 5.5237 5.6543 5.6694 6.1720 6.2090 6.2538 6.3066 6.6280 6.6389 7.7237 7.7388 7.8618 7.9044 7.9793 8.0459 8.0555 8.1314 8.3365 8.3441 8.4254 8.4377 8.4945 8.5149 8.6203 8.6302 8.6422 8.6468 8.7795 8.7970 9.3271 9.3495 9.4174 9.4473 10.4197 10.4473 10.5296 10.5490 11.5115 11.5238 13.2115 13.2226 14.5710 14.6023 k = 0.5000-0.1696 0.8999 ( 2962 PWs) bands (ev): -3.5828 -3.5793 -3.3769 -3.3761 -3.2450 -3.2419 3.0252 3.0314 3.7233 3.7265 3.8616 3.8719 4.7420 4.7591 5.4993 5.5181 5.6384 5.6517 6.1910 6.2192 6.2777 6.3189 6.6163 6.6256 7.7028 7.7141 7.8800 7.9161 7.9862 8.0433 8.0576 8.1206 8.3368 8.3428 8.4189 8.4298 8.4934 8.5129 8.6230 8.6311 8.6418 8.6441 8.7825 8.7981 9.3481 9.3667 9.4276 9.4517 10.3998 10.4253 10.4906 10.5084 11.5483 11.5598 13.2544 13.2658 14.6008 14.6293 k = 0.5000-0.1871 0.9056 ( 2960 PWs) bands (ev): -3.5621 -3.5585 -3.3805 -3.3798 -3.2640 -3.2608 3.0465 3.0523 3.7165 3.7193 3.8290 3.8384 4.7671 4.7829 5.4971 5.5120 5.6248 5.6358 6.2088 6.2292 6.3003 6.3313 6.6045 6.6120 7.6814 7.6899 7.8980 7.9285 7.9932 8.0412 8.0592 8.1101 8.3375 8.3422 8.4124 8.4223 8.4927 8.5109 8.6254 8.6319 8.6415 8.6419 8.7855 8.7992 9.3674 9.3824 9.4380 9.4562 10.3805 10.4034 10.4544 10.4702 11.5820 11.5925 13.2931 13.3045 14.6348 14.6602 k = 0.5000-0.2045 0.9114 ( 2956 PWs) bands (ev): -3.5411 -3.5375 -3.3836 -3.3830 -3.2835 -3.2802 3.0674 3.0728 3.7102 3.7127 3.7978 3.8061 4.7915 4.8057 5.4942 5.5054 5.6138 5.6219 6.2250 6.2388 6.3214 6.3437 6.5926 6.5985 7.6607 7.6673 7.9154 7.9410 8.0003 8.0393 8.0599 8.0997 8.3385 8.3421 8.4060 8.4149 8.4925 8.5089 8.6276 8.6325 8.6402 8.6413 8.7883 8.8001 9.3844 9.3964 9.4483 9.4610 10.3624 10.3822 10.4221 10.4352 11.6123 11.6217 13.3268 13.3374 14.6731 14.6952 k = 0.5000-0.2220 0.9171 ( 2956 PWs) bands (ev): -3.5199 -3.5163 -3.3863 -3.3859 -3.3034 -3.3000 3.0875 3.0923 3.7046 3.7067 3.7686 3.7759 4.8142 4.8267 5.4905 5.4988 5.6050 5.6104 6.2392 6.2477 6.3404 6.3557 6.5811 6.5852 7.6417 7.6468 7.9318 7.9531 8.0073 8.0375 8.0598 8.0893 8.3400 8.3424 8.3999 8.4079 8.4926 8.5069 8.6295 8.6330 8.6389 8.6410 8.7910 8.8008 9.3989 9.4090 9.4579 9.4658 10.3460 10.3620 10.3942 10.4041 11.6387 11.6468 13.3548 13.3642 14.7144 14.7333 k = 0.5000-0.2394 0.9228 ( 2958 PWs) bands (ev): -3.4986 -3.4950 -3.3886 -3.3882 -3.3236 -3.3202 3.1060 3.1100 3.6999 3.7016 3.7427 3.7488 4.8346 4.8451 5.4861 5.4926 5.5982 5.6012 6.2512 6.2558 6.3570 6.3671 6.5702 6.5728 7.6252 7.6291 7.9470 7.9644 8.0140 8.0356 8.0587 8.0790 8.3417 8.3432 8.3944 8.4013 8.4931 8.5049 8.6312 8.6333 8.6380 8.6407 8.7934 8.8012 9.4110 9.4197 9.4662 9.4705 10.3318 10.3438 10.3711 10.3776 11.6610 11.6677 13.3769 13.3849 14.7564 14.7720 k = 0.5000-0.2569 0.9285 ( 2948 PWs) bands (ev): -3.4774 -3.4738 -3.3903 -3.3900 -3.3439 -3.3405 3.1220 3.1252 3.6960 3.6974 3.7210 3.7259 4.8518 4.8600 5.4819 5.4871 5.5932 5.5945 6.2607 6.2627 6.3709 6.3774 6.5606 6.5619 7.6118 7.6147 7.9608 7.9744 8.0206 8.0337 8.0568 8.0691 8.3436 8.3444 8.3899 8.3955 8.4939 8.5030 8.6325 8.6336 8.6376 8.6404 8.7956 8.8015 9.4208 9.4282 9.4729 9.4748 10.3206 10.3287 10.3527 10.3562 11.6789 11.6840 13.3937 13.3998 14.7957 14.8079 k = 0.5000-0.2744 0.9342 ( 2962 PWs) bands (ev): -3.4565 -3.4530 -3.3915 -3.3914 -3.3642 -3.3608 3.1346 3.1368 3.6930 3.6940 3.7049 3.7084 4.8651 4.8708 5.4785 5.4823 5.5896 5.5900 6.2674 6.2680 6.3815 6.3856 6.5526 6.5531 7.6020 7.6039 7.9724 7.9822 8.0264 8.0322 8.0540 8.0598 8.3452 8.3455 8.3864 8.3905 8.4949 8.5011 8.6333 8.6337 8.6375 8.6399 8.7974 8.8013 9.4283 9.4339 9.4776 9.4782 10.3126 10.3174 10.3391 10.3403 11.6920 11.6954 13.4054 13.4096 14.8280 14.8364 k = 0.5000-0.2918 0.9399 ( 2960 PWs) bands (ev): -3.4369 -3.4338 -3.3923 -3.3922 -3.3829 -3.3800 3.1428 3.1440 3.6906 3.6910 3.6960 3.6977 4.8740 4.8769 5.4767 5.4788 5.5875 5.5876 6.2714 6.2715 6.3886 6.3907 6.5473 6.5474 7.5961 7.5971 7.9813 7.9867 8.0308 8.0319 8.0511 8.0528 8.3465 8.3465 8.3846 8.3868 8.4962 8.4994 8.6337 8.6338 8.6380 8.6393 8.7989 8.8009 9.4337 9.4367 9.4804 9.4805 10.3082 10.3104 10.3304 10.3306 11.7003 11.7021 13.4126 13.4147 14.8489 14.8524 k = 0.5000-0.3093 0.9456 ( 2962 PWs) bands (ev): -3.4244 -3.4244 -3.3927 -3.3927 -3.3921 -3.3921 3.1461 3.1461 3.6890 3.6890 3.6943 3.6943 4.8780 4.8780 5.4768 5.4768 5.5868 5.5868 6.2727 6.2727 6.3918 6.3918 6.5455 6.5455 7.5945 7.5945 7.9864 7.9864 8.0323 8.0323 8.0498 8.0498 8.3469 8.3469 8.3847 8.3847 8.4977 8.4977 8.6338 8.6338 8.6386 8.6386 8.8001 8.8001 9.4366 9.4366 9.4813 9.4813 10.3074 10.3074 10.3274 10.3274 11.7037 11.7037 13.4157 13.4157 14.8562 14.8562 Writing output data file NiSe.save init_run : 0.32s CPU 0.55s WALL ( 1 calls) electrons : 480.34s CPU 483.11s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.07s WALL ( 1 calls) potinit : 0.03s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 480.33s CPU 483.10s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.10s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.03s WALL ( 329 calls) cegterg : 453.59s CPU 456.09s WALL ( 842 calls) Called by sum_band: Called by *egterg: h_psi : 291.04s CPU 297.03s WALL ( 14294 calls) s_psi : 15.15s CPU 15.76s WALL ( 14294 calls) g_psi : 0.38s CPU 0.45s WALL ( 13123 calls) cdiaghg : 136.03s CPU 133.53s WALL ( 13452 calls) cegterg:over : 12.60s CPU 12.13s WALL ( 13123 calls) cegterg:upda : 2.93s CPU 5.09s WALL ( 13123 calls) cegterg:last : 2.56s CPU 3.17s WALL ( 1985 calls) Called by h_psi: h_psi:vloc : 276.75s CPU 277.95s WALL ( 14294 calls) h_psi:vnl : 14.18s CPU 18.82s WALL ( 14294 calls) add_vuspsi : 7.09s CPU 10.16s WALL ( 14294 calls) General routines calbec : 7.08s CPU 8.62s WALL ( 14294 calls) fft : 0.02s CPU 0.04s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 275.84s CPU 267.79s WALL ( 1371476 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.03s CPU 0.13s WALL ( 658 calls) Parallel routines fft_scatter : 263.66s CPU 169.78s WALL ( 1371499 calls) PWSCF : 8m21.74s CPU 8m39.00s WALL This run was terminated on: 14:56:56 27Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=