Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:30:21 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Zr3Te.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 67 67 18 1730 1730 255 Max 68 68 19 1733 1733 259 Sum 2413 2413 679 62341 62341 9263 bravais-lattice index = 14 lattice parameter (alat) = 15.8259 a.u. unit-cell volume = 1303.9157 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 2 number of electrons = 54.00 number of Kohn-Sham states= 64 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 200.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.825864 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.795643 celldm(5)= 0.795643 celldm(6)= 0.795643 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.795643 0.605766 0.000000 ) a(3) = ( 0.795643 0.268413 0.543053 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -1.313450 -0.815935 ) b(2) = ( 0.000000 1.650803 -0.815935 ) b(3) = ( 0.000000 0.000000 1.841440 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c 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 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 4.00 91.22400 Zr( 1.00) Te 6.00 127.60000 Te( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 239 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 2) = ( 0.0142857 -0.0187636 -0.0116562), wk = 0.0041841 k( 3) = ( 0.0285714 -0.0375271 -0.0233124), wk = 0.0041841 k( 4) = ( 0.0428571 -0.0562907 -0.0349687), wk = 0.0041841 k( 5) = ( 0.0571429 -0.0750543 -0.0466249), wk = 0.0041841 k( 6) = ( 0.0714286 -0.0938178 -0.0582811), wk = 0.0041841 k( 7) = ( 0.0857143 -0.1125814 -0.0699373), wk = 0.0041841 k( 8) = ( 0.1000000 -0.1313450 -0.0815935), wk = 0.0041841 k( 9) = ( 0.1142857 -0.1501085 -0.0932498), wk = 0.0041841 k( 10) = ( 0.1285714 -0.1688721 -0.1049060), wk = 0.0041841 k( 11) = ( 0.1428571 -0.1876357 -0.1165622), wk = 0.0041841 k( 12) = ( 0.1571429 -0.2063992 -0.1282184), wk = 0.0041841 k( 13) = ( 0.1714286 -0.2251628 -0.1398746), wk = 0.0041841 k( 14) = ( 0.1857143 -0.2439264 -0.1515309), wk = 0.0041841 k( 15) = ( 0.2000000 -0.2626899 -0.1631871), wk = 0.0041841 k( 16) = ( 0.2142857 -0.2814535 -0.1748433), wk = 0.0041841 k( 17) = ( 0.2285714 -0.3002171 -0.1864995), wk = 0.0041841 k( 18) = ( 0.2428571 -0.3189806 -0.1981557), wk = 0.0041841 k( 19) = ( 0.2571429 -0.3377442 -0.2098120), wk = 0.0041841 k( 20) = ( 0.2714286 -0.3565078 -0.2214682), wk = 0.0041841 k( 21) = ( 0.2857143 -0.3752714 -0.2331244), wk = 0.0041841 k( 22) = ( 0.3000000 -0.3940349 -0.2447806), wk = 0.0041841 k( 23) = ( 0.3142857 -0.4127985 -0.2564368), wk = 0.0041841 k( 24) = ( 0.3285714 -0.4315621 -0.2680931), wk = 0.0041841 k( 25) = ( 0.3428571 -0.4503256 -0.2797493), wk = 0.0041841 k( 26) = ( 0.3571429 -0.4690892 -0.2914055), wk = 0.0041841 k( 27) = ( 0.3714286 -0.4878528 -0.3030617), wk = 0.0041841 k( 28) = ( 0.3857143 -0.5066163 -0.3147180), wk = 0.0041841 k( 29) = ( 0.4000000 -0.5253799 -0.3263742), wk = 0.0041841 k( 30) = ( 0.4142857 -0.5441435 -0.3380304), wk = 0.0041841 k( 31) = ( 0.4285714 -0.5629070 -0.3496866), wk = 0.0041841 k( 32) = ( 0.4428571 -0.5816706 -0.3613428), wk = 0.0041841 k( 33) = ( 0.4571429 -0.6004342 -0.3729991), wk = 0.0041841 k( 34) = ( 0.4714286 -0.6191977 -0.3846553), wk = 0.0041841 k( 35) = ( 0.4857143 -0.6379613 -0.3963115), wk = 0.0041841 k( 36) = ( 0.5000000 -0.6567249 -0.4079677), wk = 0.0041841 k( 37) = ( 0.5000000 -0.6567249 -0.4079677), wk = 0.0041841 k( 38) = ( 0.5000000 -0.6428758 -0.4302613), wk = 0.0041841 k( 39) = ( 0.5000000 -0.6290266 -0.4525549), wk = 0.0041841 k( 40) = ( 0.5000000 -0.6151775 -0.4748484), wk = 0.0041841 k( 41) = ( 0.5000000 -0.6013284 -0.4971420), wk = 0.0041841 k( 42) = ( 0.5000000 -0.5874793 -0.5194356), wk = 0.0041841 k( 43) = ( 0.5000000 -0.5736302 -0.5417292), wk = 0.0041841 k( 44) = ( 0.5000000 -0.5597811 -0.5640227), wk = 0.0041841 k( 45) = ( 0.5000000 -0.5459319 -0.5863163), wk = 0.0041841 k( 46) = ( 0.5000000 -0.5320828 -0.6086099), wk = 0.0041841 k( 47) = ( 0.5000000 -0.5182337 -0.6309035), wk = 0.0041841 k( 48) = ( 0.5000000 -0.5043846 -0.6531970), wk = 0.0041841 k( 49) = ( 0.5000000 -0.4905355 -0.6754906), wk = 0.0041841 k( 50) = ( 0.5000000 -0.4766864 -0.6977842), wk = 0.0041841 k( 51) = ( 0.5000000 -0.4628372 -0.7200778), wk = 0.0041841 k( 52) = ( 0.5000000 -0.4489881 -0.7423713), wk = 0.0041841 k( 53) = ( 0.5000000 -0.4351390 -0.7646649), wk = 0.0041841 k( 54) = ( 0.5000000 -0.4212899 -0.7869585), wk = 0.0041841 k( 55) = ( 0.5000000 -0.4074408 -0.8092521), wk = 0.0041841 k( 56) = ( 0.5000000 -0.3935917 -0.8315456), wk = 0.0041841 k( 57) = ( 0.5000000 -0.3797425 -0.8538392), wk = 0.0041841 k( 58) = ( 0.5000000 -0.3658934 -0.8761328), wk = 0.0041841 k( 59) = ( 0.5000000 -0.3520443 -0.8984264), wk = 0.0041841 k( 60) = ( 0.5000000 -0.3381952 -0.9207199), wk = 0.0041841 k( 61) = ( 0.8070456 -0.2346124 -0.7111509), wk = 0.0041841 k( 62) = ( 0.7987471 -0.2237127 -0.6890986), wk = 0.0041841 k( 63) = ( 0.7904486 -0.2128130 -0.6670463), wk = 0.0041841 k( 64) = ( 0.7821500 -0.2019133 -0.6449940), wk = 0.0041841 k( 65) = ( 0.7738515 -0.1910136 -0.6229417), wk = 0.0041841 k( 66) = ( 0.7655530 -0.1801139 -0.6008894), wk = 0.0041841 k( 67) = ( 0.7572544 -0.1692142 -0.5788370), wk = 0.0041841 k( 68) = ( 0.7489559 -0.1583145 -0.5567847), wk = 0.0041841 k( 69) = ( 0.7406574 -0.1474148 -0.5347324), wk = 0.0041841 k( 70) = ( 0.7323588 -0.1365151 -0.5126801), wk = 0.0041841 k( 71) = ( 0.7240603 -0.1256154 -0.4906278), wk = 0.0041841 k( 72) = ( 0.7157618 -0.1147157 -0.4685755), wk = 0.0041841 k( 73) = ( 0.7074632 -0.1038160 -0.4465232), wk = 0.0041841 k( 74) = ( 0.6991647 -0.0929163 -0.4244709), wk = 0.0041841 k( 75) = ( 0.6908662 -0.0820166 -0.4024186), wk = 0.0041841 k( 76) = ( 0.6825677 -0.0711169 -0.3803663), wk = 0.0041841 k( 77) = ( 0.6742691 -0.0602172 -0.3583140), wk = 0.0041841 k( 78) = ( 0.6659706 -0.0493175 -0.3362617), wk = 0.0041841 k( 79) = ( 0.6576721 -0.0384178 -0.3142093), wk = 0.0041841 k( 80) = ( 0.6493735 -0.0275181 -0.2921570), wk = 0.0041841 k( 81) = ( 0.6410750 -0.0166184 -0.2701047), wk = 0.0041841 k( 82) = ( 0.6327765 -0.0057187 -0.2480524), wk = 0.0041841 k( 83) = ( 0.6244779 0.0051811 -0.2260001), wk = 0.0041841 k( 84) = ( 0.6161794 0.0160808 -0.2039478), wk = 0.0041841 k( 85) = ( 0.6078809 0.0269805 -0.1818955), wk = 0.0041841 k( 86) = ( 0.5995824 0.0378802 -0.1598432), wk = 0.0041841 k( 87) = ( 0.5912838 0.0487799 -0.1377909), wk = 0.0041841 k( 88) = ( 0.5829853 0.0596796 -0.1157386), wk = 0.0041841 k( 89) = ( 0.5746868 0.0705793 -0.0936863), wk = 0.0041841 k( 90) = ( 0.5663882 0.0814790 -0.0716340), wk = 0.0041841 k( 91) = ( 0.5580897 0.0923787 -0.0495816), wk = 0.0041841 k( 92) = ( 0.5497912 0.1032784 -0.0275293), wk = 0.0041841 k( 93) = ( 0.5414927 0.1141781 -0.0054770), wk = 0.0041841 k( 94) = ( 0.5331941 0.1250778 0.0165753), wk = 0.0041841 k( 95) = ( 0.5248956 0.1359775 0.0386276), wk = 0.0041841 k( 96) = ( 0.5165971 0.1468772 0.0606799), wk = 0.0041841 k( 97) = ( 0.5082985 0.1577769 0.0827322), wk = 0.0041841 k( 98) = ( 0.5000000 0.1686766 0.1047845), wk = 0.0041841 k( 99) = ( 0.5000000 0.1686766 0.1047845), wk = 0.0041841 k( 100) = ( 0.4761905 0.1606444 0.0997948), wk = 0.0041841 k( 101) = ( 0.4523810 0.1526121 0.0948050), wk = 0.0041841 k( 102) = ( 0.4285714 0.1445799 0.0898153), wk = 0.0041841 k( 103) = ( 0.4047619 0.1365477 0.0848256), wk = 0.0041841 k( 104) = ( 0.3809524 0.1285155 0.0798358), wk = 0.0041841 k( 105) = ( 0.3571429 0.1204833 0.0748461), wk = 0.0041841 k( 106) = ( 0.3333333 0.1124511 0.0698563), wk = 0.0041841 k( 107) = ( 0.3095238 0.1044188 0.0648666), wk = 0.0041841 k( 108) = ( 0.2857143 0.0963866 0.0598769), wk = 0.0041841 k( 109) = ( 0.2619048 0.0883544 0.0548871), wk = 0.0041841 k( 110) = ( 0.2380952 0.0803222 0.0498974), wk = 0.0041841 k( 111) = ( 0.2142857 0.0722900 0.0449076), wk = 0.0041841 k( 112) = ( 0.1904762 0.0642577 0.0399179), wk = 0.0041841 k( 113) = ( 0.1666667 0.0562255 0.0349282), wk = 0.0041841 k( 114) = ( 0.1428571 0.0481933 0.0299384), wk = 0.0041841 k( 115) = ( 0.1190476 0.0401611 0.0249487), wk = 0.0041841 k( 116) = ( 0.0952381 0.0321289 0.0199590), wk = 0.0041841 k( 117) = ( 0.0714286 0.0240967 0.0149692), wk = 0.0041841 k( 118) = ( 0.0476191 0.0160644 0.0099795), wk = 0.0041841 k( 119) = ( 0.0238095 0.0080322 0.0049897), wk = 0.0041841 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 121) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 122) = ( 0.0084507 -0.0110995 -0.0224566), wk = 0.0041841 k( 123) = ( 0.0169013 -0.0221990 -0.0449132), wk = 0.0041841 k( 124) = ( 0.0253520 -0.0332986 -0.0673698), wk = 0.0041841 k( 125) = ( 0.0338026 -0.0443981 -0.0898263), wk = 0.0041841 k( 126) = ( 0.0422533 -0.0554976 -0.1122829), wk = 0.0041841 k( 127) = ( 0.0507040 -0.0665971 -0.1347395), wk = 0.0041841 k( 128) = ( 0.0591546 -0.0776966 -0.1571961), wk = 0.0041841 k( 129) = ( 0.0676053 -0.0887962 -0.1796527), wk = 0.0041841 k( 130) = ( 0.0760560 -0.0998957 -0.2021093), wk = 0.0041841 k( 131) = ( 0.0845066 -0.1109952 -0.2245658), wk = 0.0041841 k( 132) = ( 0.0929573 -0.1220947 -0.2470224), wk = 0.0041841 k( 133) = ( 0.1014080 -0.1331943 -0.2694790), wk = 0.0041841 k( 134) = ( 0.1098586 -0.1442938 -0.2919356), wk = 0.0041841 k( 135) = ( 0.1183093 -0.1553933 -0.3143922), wk = 0.0041841 k( 136) = ( 0.1267600 -0.1664928 -0.3368488), wk = 0.0041841 k( 137) = ( 0.1352106 -0.1775923 -0.3593053), wk = 0.0041841 k( 138) = ( 0.1436613 -0.1886919 -0.3817619), wk = 0.0041841 k( 139) = ( 0.1521119 -0.1997914 -0.4042185), wk = 0.0041841 k( 140) = ( 0.1605626 -0.2108909 -0.4266751), wk = 0.0041841 k( 141) = ( 0.1690133 -0.2219904 -0.4491317), wk = 0.0041841 k( 142) = ( 0.1774639 -0.2330900 -0.4715883), wk = 0.0041841 k( 143) = ( 0.1859146 -0.2441895 -0.4940448), wk = 0.0041841 k( 144) = ( 0.1943653 -0.2552890 -0.5165014), wk = 0.0041841 k( 145) = ( 0.2028159 -0.2663885 -0.5389580), wk = 0.0041841 k( 146) = ( 0.2112666 -0.2774880 -0.5614146), wk = 0.0041841 k( 147) = ( 0.2197173 -0.2885876 -0.5838712), wk = 0.0041841 k( 148) = ( 0.2281679 -0.2996871 -0.6063278), wk = 0.0041841 k( 149) = ( 0.2366186 -0.3107866 -0.6287843), wk = 0.0041841 k( 150) = ( 0.2450692 -0.3218861 -0.6512409), wk = 0.0041841 k( 151) = ( 0.2535199 -0.3329856 -0.6736975), wk = 0.0041841 k( 152) = ( 0.2619706 -0.3440852 -0.6961541), wk = 0.0041841 k( 153) = ( 0.2704212 -0.3551847 -0.7186107), wk = 0.0041841 k( 154) = ( 0.2788719 -0.3662842 -0.7410673), wk = 0.0041841 k( 155) = ( 0.2873226 -0.3773837 -0.7635238), wk = 0.0041841 k( 156) = ( 0.2957732 -0.3884833 -0.7859804), wk = 0.0041841 k( 157) = ( 0.3042239 -0.3995828 -0.8084370), wk = 0.0041841 k( 158) = ( 0.3126745 -0.4106823 -0.8308936), wk = 0.0041841 k( 159) = ( 0.3211252 -0.4217818 -0.8533502), wk = 0.0041841 k( 160) = ( 0.3295759 -0.4328813 -0.8758068), wk = 0.0041841 k( 161) = ( 0.3380265 -0.4439809 -0.8982633), wk = 0.0041841 k( 162) = ( 0.3464772 -0.4550804 -0.9207199), wk = 0.0041841 k( 163) = ( 0.6535228 -0.2864038 -0.8159354), wk = 0.0041841 k( 164) = ( 0.6454427 -0.2624522 -0.8159354), wk = 0.0041841 k( 165) = ( 0.6373625 -0.2385006 -0.8159354), wk = 0.0041841 k( 166) = ( 0.6292824 -0.2145490 -0.8159354), wk = 0.0041841 k( 167) = ( 0.6212022 -0.1905974 -0.8159354), wk = 0.0041841 k( 168) = ( 0.6131221 -0.1666458 -0.8159354), wk = 0.0041841 k( 169) = ( 0.6050419 -0.1426942 -0.8159354), wk = 0.0041841 k( 170) = ( 0.5969618 -0.1187426 -0.8159354), wk = 0.0041841 k( 171) = ( 0.5888816 -0.0947910 -0.8159354), wk = 0.0041841 k( 172) = ( 0.5808015 -0.0708394 -0.8159354), wk = 0.0041841 k( 173) = ( 0.5727213 -0.0468878 -0.8159354), wk = 0.0041841 k( 174) = ( 0.5646412 -0.0229362 -0.8159354), wk = 0.0041841 k( 175) = ( 0.5565610 0.0010154 -0.8159354), wk = 0.0041841 k( 176) = ( 0.5484809 0.0249670 -0.8159354), wk = 0.0041841 k( 177) = ( 0.5404007 0.0489186 -0.8159354), wk = 0.0041841 k( 178) = ( 0.5323206 0.0728702 -0.8159354), wk = 0.0041841 k( 179) = ( 0.5242404 0.0968218 -0.8159354), wk = 0.0041841 k( 180) = ( 0.5161603 0.1207734 -0.8159354), wk = 0.0041841 k( 181) = ( 0.5080801 0.1447250 -0.8159354), wk = 0.0041841 k( 182) = ( 0.5000000 0.1686766 -0.8159354), wk = 0.0041841 k( 183) = ( 0.5000000 0.1686766 -0.8159354), wk = 0.0041841 k( 184) = ( 0.5191904 0.1751505 -0.8028374), wk = 0.0041841 k( 185) = ( 0.5383807 0.1816244 -0.7897393), wk = 0.0041841 k( 186) = ( 0.5575710 0.1880984 -0.7766412), wk = 0.0041841 k( 187) = ( 0.5767614 0.1945723 -0.7635432), wk = 0.0041841 k( 188) = ( 0.5959518 0.2010462 -0.7504451), wk = 0.0041841 k( 189) = ( 0.6151421 0.2075201 -0.7373470), wk = 0.0041841 k( 190) = ( 0.6343325 0.2139941 -0.7242490), wk = 0.0041841 k( 191) = ( 0.6535228 0.2204680 -0.7111509), wk = 0.0041841 k( 192) = ( 0.6535228 0.2204680 -0.7111509), wk = 0.0041841 k( 193) = ( 0.6487252 0.2188495 -0.6856529), wk = 0.0041841 k( 194) = ( 0.6439276 0.2172310 -0.6601549), wk = 0.0041841 k( 195) = ( 0.6391300 0.2156125 -0.6346569), wk = 0.0041841 k( 196) = ( 0.6343325 0.2139941 -0.6091590), wk = 0.0041841 k( 197) = ( 0.6295349 0.2123756 -0.5836610), wk = 0.0041841 k( 198) = ( 0.6247373 0.2107571 -0.5581630), wk = 0.0041841 k( 199) = ( 0.6199397 0.2091386 -0.5326650), wk = 0.0041841 k( 200) = ( 0.6151421 0.2075201 -0.5071670), wk = 0.0041841 k( 201) = ( 0.6103445 0.2059017 -0.4816691), wk = 0.0041841 k( 202) = ( 0.6055469 0.2042832 -0.4561711), wk = 0.0041841 k( 203) = ( 0.6007493 0.2026647 -0.4306731), wk = 0.0041841 k( 204) = ( 0.5959518 0.2010462 -0.4051751), wk = 0.0041841 k( 205) = ( 0.5911542 0.1994277 -0.3796771), wk = 0.0041841 k( 206) = ( 0.5863566 0.1978092 -0.3541792), wk = 0.0041841 k( 207) = ( 0.5815590 0.1961908 -0.3286812), wk = 0.0041841 k( 208) = ( 0.5767614 0.1945723 -0.3031832), wk = 0.0041841 k( 209) = ( 0.5719638 0.1929538 -0.2776852), wk = 0.0041841 k( 210) = ( 0.5671662 0.1913353 -0.2521872), wk = 0.0041841 k( 211) = ( 0.5623686 0.1897168 -0.2266892), wk = 0.0041841 k( 212) = ( 0.5575710 0.1880984 -0.2011913), wk = 0.0041841 k( 213) = ( 0.5527735 0.1864799 -0.1756933), wk = 0.0041841 k( 214) = ( 0.5479759 0.1848614 -0.1501953), wk = 0.0041841 k( 215) = ( 0.5431783 0.1832429 -0.1246973), wk = 0.0041841 k( 216) = ( 0.5383807 0.1816244 -0.0991993), wk = 0.0041841 k( 217) = ( 0.5335831 0.1800059 -0.0737014), wk = 0.0041841 k( 218) = ( 0.5287855 0.1783875 -0.0482034), wk = 0.0041841 k( 219) = ( 0.5239879 0.1767690 -0.0227054), wk = 0.0041841 k( 220) = ( 0.5191904 0.1751505 0.0027926), wk = 0.0041841 k( 221) = ( 0.5143928 0.1735320 0.0282906), wk = 0.0041841 k( 222) = ( 0.5095952 0.1719135 0.0537885), wk = 0.0041841 k( 223) = ( 0.5047976 0.1702951 0.0792865), wk = 0.0041841 k( 224) = ( 0.5000000 0.1686766 0.1047845), wk = 0.0041841 k( 225) = ( 0.5000000 -0.6567249 -0.4079677), wk = 0.0041841 k( 226) = ( 0.5219318 -0.6446765 -0.4004831), wk = 0.0041841 k( 227) = ( 0.5438637 -0.6326282 -0.3929985), wk = 0.0041841 k( 228) = ( 0.5657955 -0.6205799 -0.3855139), wk = 0.0041841 k( 229) = ( 0.5877273 -0.6085316 -0.3780293), wk = 0.0041841 k( 230) = ( 0.6096592 -0.5964832 -0.3705447), wk = 0.0041841 k( 231) = ( 0.6315910 -0.5844349 -0.3630601), wk = 0.0041841 k( 232) = ( 0.6535228 -0.5723866 -0.3555755), wk = 0.0041841 k( 233) = ( 0.6754546 -0.5603382 -0.3480908), wk = 0.0041841 k( 234) = ( 0.6973865 -0.5482899 -0.3406062), wk = 0.0041841 k( 235) = ( 0.7193183 -0.5362416 -0.3331216), wk = 0.0041841 k( 236) = ( 0.7412501 -0.5241933 -0.3256370), wk = 0.0041841 k( 237) = ( 0.7631819 -0.5121449 -0.3181524), wk = 0.0041841 k( 238) = ( 0.7851138 -0.5000966 -0.3106678), wk = 0.0041841 k( 239) = ( 0.8070456 -0.4880483 -0.3031832), wk = 0.0041841 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 2) = ( 0.0142857 0.0000000 0.0000000), wk = 0.0041841 k( 3) = ( 0.0285714 0.0000000 0.0000000), wk = 0.0041841 k( 4) = ( 0.0428571 -0.0000000 -0.0000000), wk = 0.0041841 k( 5) = ( 0.0571429 0.0000000 0.0000000), wk = 0.0041841 k( 6) = ( 0.0714286 -0.0000000 0.0000000), wk = 0.0041841 k( 7) = ( 0.0857143 -0.0000000 -0.0000000), wk = 0.0041841 k( 8) = ( 0.1000000 -0.0000000 0.0000000), wk = 0.0041841 k( 9) = ( 0.1142857 0.0000000 0.0000000), wk = 0.0041841 k( 10) = ( 0.1285714 -0.0000000 -0.0000000), wk = 0.0041841 k( 11) = ( 0.1428571 -0.0000000 0.0000000), wk = 0.0041841 k( 12) = ( 0.1571429 0.0000000 0.0000000), wk = 0.0041841 k( 13) = ( 0.1714286 0.0000000 -0.0000000), wk = 0.0041841 k( 14) = ( 0.1857143 -0.0000000 -0.0000000), wk = 0.0041841 k( 15) = ( 0.2000000 -0.0000000 0.0000000), wk = 0.0041841 k( 16) = ( 0.2142857 0.0000000 -0.0000000), wk = 0.0041841 k( 17) = ( 0.2285714 0.0000000 0.0000000), wk = 0.0041841 k( 18) = ( 0.2428571 0.0000000 0.0000000), wk = 0.0041841 k( 19) = ( 0.2571429 -0.0000000 -0.0000000), wk = 0.0041841 k( 20) = ( 0.2714286 0.0000000 0.0000000), wk = 0.0041841 k( 21) = ( 0.2857143 0.0000000 -0.0000000), wk = 0.0041841 k( 22) = ( 0.3000000 0.0000000 -0.0000000), wk = 0.0041841 k( 23) = ( 0.3142857 -0.0000000 -0.0000000), wk = 0.0041841 k( 24) = ( 0.3285714 0.0000000 0.0000000), wk = 0.0041841 k( 25) = ( 0.3428571 0.0000000 -0.0000000), wk = 0.0041841 k( 26) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0041841 k( 27) = ( 0.3714286 -0.0000000 0.0000000), wk = 0.0041841 k( 28) = ( 0.3857143 0.0000000 0.0000000), wk = 0.0041841 k( 29) = ( 0.4000000 -0.0000000 0.0000000), wk = 0.0041841 k( 30) = ( 0.4142857 -0.0000000 0.0000000), wk = 0.0041841 k( 31) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0041841 k( 32) = ( 0.4428571 0.0000000 0.0000000), wk = 0.0041841 k( 33) = ( 0.4571429 0.0000000 0.0000000), wk = 0.0041841 k( 34) = ( 0.4714286 0.0000000 0.0000000), wk = 0.0041841 k( 35) = ( 0.4857143 0.0000000 -0.0000000), wk = 0.0041841 k( 36) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0041841 k( 37) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0041841 k( 38) = ( 0.5000000 0.0083893 -0.0083893), wk = 0.0041841 k( 39) = ( 0.5000000 0.0167786 -0.0167786), wk = 0.0041841 k( 40) = ( 0.5000000 0.0251680 -0.0251680), wk = 0.0041841 k( 41) = ( 0.5000000 0.0335573 -0.0335573), wk = 0.0041841 k( 42) = ( 0.5000000 0.0419466 -0.0419466), wk = 0.0041841 k( 43) = ( 0.5000000 0.0503359 -0.0503359), wk = 0.0041841 k( 44) = ( 0.5000000 0.0587253 -0.0587252), wk = 0.0041841 k( 45) = ( 0.5000000 0.0671146 -0.0671146), wk = 0.0041841 k( 46) = ( 0.5000000 0.0755039 -0.0755039), wk = 0.0041841 k( 47) = ( 0.5000000 0.0838932 -0.0838932), wk = 0.0041841 k( 48) = ( 0.5000000 0.0922825 -0.0922825), wk = 0.0041841 k( 49) = ( 0.5000000 0.1006719 -0.1006719), wk = 0.0041841 k( 50) = ( 0.5000000 0.1090612 -0.1090612), wk = 0.0041841 k( 51) = ( 0.5000000 0.1174505 -0.1174505), wk = 0.0041841 k( 52) = ( 0.5000000 0.1258398 -0.1258398), wk = 0.0041841 k( 53) = ( 0.5000000 0.1342291 -0.1342291), wk = 0.0041841 k( 54) = ( 0.5000000 0.1426185 -0.1426185), wk = 0.0041841 k( 55) = ( 0.5000000 0.1510078 -0.1510078), wk = 0.0041841 k( 56) = ( 0.5000000 0.1593971 -0.1593971), wk = 0.0041841 k( 57) = ( 0.5000000 0.1677864 -0.1677864), wk = 0.0041841 k( 58) = ( 0.5000000 0.1761757 -0.1761757), wk = 0.0041841 k( 59) = ( 0.5000000 0.1845651 -0.1845651), wk = 0.0041841 k( 60) = ( 0.5000000 0.1929544 -0.1929544), wk = 0.0041841 k( 61) = ( 0.8070456 0.5000000 0.1929544), wk = 0.0041841 k( 62) = ( 0.7987471 0.5000000 0.2012529), wk = 0.0041841 k( 63) = ( 0.7904486 0.5000000 0.2095515), wk = 0.0041841 k( 64) = ( 0.7821500 0.5000000 0.2178500), wk = 0.0041841 k( 65) = ( 0.7738515 0.5000000 0.2261485), wk = 0.0041841 k( 66) = ( 0.7655530 0.5000000 0.2344470), wk = 0.0041841 k( 67) = ( 0.7572544 0.5000000 0.2427456), wk = 0.0041841 k( 68) = ( 0.7489559 0.5000000 0.2510441), wk = 0.0041841 k( 69) = ( 0.7406574 0.5000000 0.2593426), wk = 0.0041841 k( 70) = ( 0.7323588 0.5000000 0.2676412), wk = 0.0041841 k( 71) = ( 0.7240603 0.5000000 0.2759397), wk = 0.0041841 k( 72) = ( 0.7157618 0.5000000 0.2842382), wk = 0.0041841 k( 73) = ( 0.7074632 0.5000000 0.2925368), wk = 0.0041841 k( 74) = ( 0.6991647 0.5000000 0.3008353), wk = 0.0041841 k( 75) = ( 0.6908662 0.5000000 0.3091338), wk = 0.0041841 k( 76) = ( 0.6825677 0.5000000 0.3174323), wk = 0.0041841 k( 77) = ( 0.6742691 0.5000000 0.3257309), wk = 0.0041841 k( 78) = ( 0.6659706 0.5000000 0.3340294), wk = 0.0041841 k( 79) = ( 0.6576721 0.5000000 0.3423279), wk = 0.0041841 k( 80) = ( 0.6493735 0.5000000 0.3506265), wk = 0.0041841 k( 81) = ( 0.6410750 0.5000000 0.3589250), wk = 0.0041841 k( 82) = ( 0.6327765 0.5000000 0.3672235), wk = 0.0041841 k( 83) = ( 0.6244779 0.5000000 0.3755220), wk = 0.0041841 k( 84) = ( 0.6161794 0.5000000 0.3838206), wk = 0.0041841 k( 85) = ( 0.6078809 0.5000000 0.3921191), wk = 0.0041841 k( 86) = ( 0.5995824 0.5000000 0.4004176), wk = 0.0041841 k( 87) = ( 0.5912838 0.5000000 0.4087162), wk = 0.0041841 k( 88) = ( 0.5829853 0.5000000 0.4170147), wk = 0.0041841 k( 89) = ( 0.5746868 0.5000000 0.4253132), wk = 0.0041841 k( 90) = ( 0.5663882 0.5000000 0.4336118), wk = 0.0041841 k( 91) = ( 0.5580897 0.5000000 0.4419103), wk = 0.0041841 k( 92) = ( 0.5497912 0.5000000 0.4502088), wk = 0.0041841 k( 93) = ( 0.5414927 0.5000000 0.4585073), wk = 0.0041841 k( 94) = ( 0.5331941 0.5000000 0.4668059), wk = 0.0041841 k( 95) = ( 0.5248956 0.5000000 0.4751044), wk = 0.0041841 k( 96) = ( 0.5165971 0.5000000 0.4834029), wk = 0.0041841 k( 97) = ( 0.5082985 0.5000000 0.4917015), wk = 0.0041841 k( 98) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041841 k( 99) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041841 k( 100) = ( 0.4761905 0.4761905 0.4761905), wk = 0.0041841 k( 101) = ( 0.4523810 0.4523810 0.4523810), wk = 0.0041841 k( 102) = ( 0.4285714 0.4285714 0.4285714), wk = 0.0041841 k( 103) = ( 0.4047619 0.4047619 0.4047619), wk = 0.0041841 k( 104) = ( 0.3809524 0.3809524 0.3809524), wk = 0.0041841 k( 105) = ( 0.3571429 0.3571429 0.3571429), wk = 0.0041841 k( 106) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0041841 k( 107) = ( 0.3095238 0.3095238 0.3095238), wk = 0.0041841 k( 108) = ( 0.2857143 0.2857143 0.2857143), wk = 0.0041841 k( 109) = ( 0.2619048 0.2619048 0.2619048), wk = 0.0041841 k( 110) = ( 0.2380952 0.2380952 0.2380952), wk = 0.0041841 k( 111) = ( 0.2142857 0.2142857 0.2142857), wk = 0.0041841 k( 112) = ( 0.1904762 0.1904762 0.1904762), wk = 0.0041841 k( 113) = ( 0.1666667 0.1666667 0.1666667), wk = 0.0041841 k( 114) = ( 0.1428571 0.1428571 0.1428571), wk = 0.0041841 k( 115) = ( 0.1190476 0.1190476 0.1190476), wk = 0.0041841 k( 116) = ( 0.0952381 0.0952381 0.0952381), wk = 0.0041841 k( 117) = ( 0.0714286 0.0714286 0.0714286), wk = 0.0041841 k( 118) = ( 0.0476191 0.0476191 0.0476191), wk = 0.0041841 k( 119) = ( 0.0238095 0.0238095 0.0238095), wk = 0.0041841 k( 120) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 121) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0041841 k( 122) = ( 0.0084507 -0.0000000 -0.0084507), wk = 0.0041841 k( 123) = ( 0.0169013 0.0000000 -0.0169013), wk = 0.0041841 k( 124) = ( 0.0253520 -0.0000000 -0.0253520), wk = 0.0041841 k( 125) = ( 0.0338026 0.0000000 -0.0338026), wk = 0.0041841 k( 126) = ( 0.0422533 -0.0000000 -0.0422533), wk = 0.0041841 k( 127) = ( 0.0507040 -0.0000000 -0.0507040), wk = 0.0041841 k( 128) = ( 0.0591546 -0.0000000 -0.0591546), wk = 0.0041841 k( 129) = ( 0.0676053 0.0000000 -0.0676053), wk = 0.0041841 k( 130) = ( 0.0760560 0.0000000 -0.0760560), wk = 0.0041841 k( 131) = ( 0.0845066 0.0000000 -0.0845066), wk = 0.0041841 k( 132) = ( 0.0929573 0.0000000 -0.0929573), wk = 0.0041841 k( 133) = ( 0.1014080 -0.0000000 -0.1014080), wk = 0.0041841 k( 134) = ( 0.1098586 -0.0000000 -0.1098586), wk = 0.0041841 k( 135) = ( 0.1183093 -0.0000000 -0.1183093), wk = 0.0041841 k( 136) = ( 0.1267600 0.0000000 -0.1267600), wk = 0.0041841 k( 137) = ( 0.1352106 0.0000000 -0.1352106), wk = 0.0041841 k( 138) = ( 0.1436613 0.0000000 -0.1436613), wk = 0.0041841 k( 139) = ( 0.1521119 0.0000000 -0.1521119), wk = 0.0041841 k( 140) = ( 0.1605626 0.0000000 -0.1605626), wk = 0.0041841 k( 141) = ( 0.1690133 -0.0000000 -0.1690133), wk = 0.0041841 k( 142) = ( 0.1774639 -0.0000000 -0.1774639), wk = 0.0041841 k( 143) = ( 0.1859146 0.0000000 -0.1859146), wk = 0.0041841 k( 144) = ( 0.1943653 0.0000000 -0.1943653), wk = 0.0041841 k( 145) = ( 0.2028159 -0.0000000 -0.2028159), wk = 0.0041841 k( 146) = ( 0.2112666 -0.0000000 -0.2112666), wk = 0.0041841 k( 147) = ( 0.2197173 0.0000000 -0.2197173), wk = 0.0041841 k( 148) = ( 0.2281679 -0.0000000 -0.2281679), wk = 0.0041841 k( 149) = ( 0.2366186 -0.0000000 -0.2366186), wk = 0.0041841 k( 150) = ( 0.2450692 0.0000000 -0.2450692), wk = 0.0041841 k( 151) = ( 0.2535199 0.0000000 -0.2535199), wk = 0.0041841 k( 152) = ( 0.2619706 -0.0000000 -0.2619706), wk = 0.0041841 k( 153) = ( 0.2704212 0.0000000 -0.2704212), wk = 0.0041841 k( 154) = ( 0.2788719 0.0000000 -0.2788719), wk = 0.0041841 k( 155) = ( 0.2873226 0.0000000 -0.2873226), wk = 0.0041841 k( 156) = ( 0.2957732 0.0000000 -0.2957732), wk = 0.0041841 k( 157) = ( 0.3042239 0.0000000 -0.3042239), wk = 0.0041841 k( 158) = ( 0.3126745 0.0000000 -0.3126745), wk = 0.0041841 k( 159) = ( 0.3211252 0.0000000 -0.3211252), wk = 0.0041841 k( 160) = ( 0.3295759 0.0000000 -0.3295759), wk = 0.0041841 k( 161) = ( 0.3380265 0.0000000 -0.3380265), wk = 0.0041841 k( 162) = ( 0.3464772 0.0000000 -0.3464772), wk = 0.0041841 k( 163) = ( 0.6535228 0.3464772 -0.0000000), wk = 0.0041841 k( 164) = ( 0.6454427 0.3545573 0.0000000), wk = 0.0041841 k( 165) = ( 0.6373625 0.3626375 -0.0000000), wk = 0.0041841 k( 166) = ( 0.6292824 0.3707176 -0.0000000), wk = 0.0041841 k( 167) = ( 0.6212022 0.3787978 0.0000000), wk = 0.0041841 k( 168) = ( 0.6131221 0.3868779 0.0000000), wk = 0.0041841 k( 169) = ( 0.6050419 0.3949581 -0.0000000), wk = 0.0041841 k( 170) = ( 0.5969618 0.4030382 0.0000000), wk = 0.0041841 k( 171) = ( 0.5888816 0.4111184 -0.0000000), wk = 0.0041841 k( 172) = ( 0.5808015 0.4191985 0.0000000), wk = 0.0041841 k( 173) = ( 0.5727213 0.4272787 0.0000000), wk = 0.0041841 k( 174) = ( 0.5646412 0.4353588 0.0000000), wk = 0.0041841 k( 175) = ( 0.5565610 0.4434390 -0.0000000), wk = 0.0041841 k( 176) = ( 0.5484809 0.4515191 -0.0000000), wk = 0.0041841 k( 177) = ( 0.5404007 0.4595993 -0.0000000), wk = 0.0041841 k( 178) = ( 0.5323206 0.4676794 0.0000000), wk = 0.0041841 k( 179) = ( 0.5242404 0.4757596 0.0000000), wk = 0.0041841 k( 180) = ( 0.5161603 0.4838397 -0.0000000), wk = 0.0041841 k( 181) = ( 0.5080801 0.4919198 0.0000000), wk = 0.0041841 k( 182) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0041841 k( 183) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0041841 k( 184) = ( 0.5191904 0.5191904 0.0241193), wk = 0.0041841 k( 185) = ( 0.5383807 0.5383807 0.0482386), wk = 0.0041841 k( 186) = ( 0.5575710 0.5575711 0.0723579), wk = 0.0041841 k( 187) = ( 0.5767614 0.5767614 0.0964772), wk = 0.0041841 k( 188) = ( 0.5959518 0.5959518 0.1205965), wk = 0.0041841 k( 189) = ( 0.6151421 0.6151421 0.1447158), wk = 0.0041841 k( 190) = ( 0.6343325 0.6343325 0.1688351), wk = 0.0041841 k( 191) = ( 0.6535228 0.6535228 0.1929544), wk = 0.0041841 k( 192) = ( 0.6535228 0.6535228 0.1929544), wk = 0.0041841 k( 193) = ( 0.6487252 0.6487252 0.2025496), wk = 0.0041841 k( 194) = ( 0.6439276 0.6439276 0.2121447), wk = 0.0041841 k( 195) = ( 0.6391300 0.6391300 0.2217399), wk = 0.0041841 k( 196) = ( 0.6343325 0.6343325 0.2313351), wk = 0.0041841 k( 197) = ( 0.6295349 0.6295349 0.2409303), wk = 0.0041841 k( 198) = ( 0.6247373 0.6247373 0.2505254), wk = 0.0041841 k( 199) = ( 0.6199397 0.6199397 0.2601206), wk = 0.0041841 k( 200) = ( 0.6151421 0.6151421 0.2697158), wk = 0.0041841 k( 201) = ( 0.6103445 0.6103445 0.2793110), wk = 0.0041841 k( 202) = ( 0.6055469 0.6055469 0.2889061), wk = 0.0041841 k( 203) = ( 0.6007493 0.6007493 0.2985013), wk = 0.0041841 k( 204) = ( 0.5959518 0.5959518 0.3080965), wk = 0.0041841 k( 205) = ( 0.5911542 0.5911542 0.3176917), wk = 0.0041841 k( 206) = ( 0.5863566 0.5863566 0.3272868), wk = 0.0041841 k( 207) = ( 0.5815590 0.5815590 0.3368820), wk = 0.0041841 k( 208) = ( 0.5767614 0.5767614 0.3464772), wk = 0.0041841 k( 209) = ( 0.5719638 0.5719638 0.3560724), wk = 0.0041841 k( 210) = ( 0.5671662 0.5671662 0.3656676), wk = 0.0041841 k( 211) = ( 0.5623686 0.5623686 0.3752627), wk = 0.0041841 k( 212) = ( 0.5575710 0.5575711 0.3848579), wk = 0.0041841 k( 213) = ( 0.5527735 0.5527735 0.3944531), wk = 0.0041841 k( 214) = ( 0.5479759 0.5479759 0.4040483), wk = 0.0041841 k( 215) = ( 0.5431783 0.5431783 0.4136434), wk = 0.0041841 k( 216) = ( 0.5383807 0.5383807 0.4232386), wk = 0.0041841 k( 217) = ( 0.5335831 0.5335831 0.4328338), wk = 0.0041841 k( 218) = ( 0.5287855 0.5287855 0.4424289), wk = 0.0041841 k( 219) = ( 0.5239879 0.5239879 0.4520241), wk = 0.0041841 k( 220) = ( 0.5191904 0.5191904 0.4616193), wk = 0.0041841 k( 221) = ( 0.5143928 0.5143928 0.4712145), wk = 0.0041841 k( 222) = ( 0.5095952 0.5095952 0.4808097), wk = 0.0041841 k( 223) = ( 0.5047976 0.5047976 0.4904048), wk = 0.0041841 k( 224) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0041841 k( 225) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0041841 k( 226) = ( 0.5219318 0.0247484 0.0247484), wk = 0.0041841 k( 227) = ( 0.5438637 0.0494967 0.0494967), wk = 0.0041841 k( 228) = ( 0.5657955 0.0742451 0.0742451), wk = 0.0041841 k( 229) = ( 0.5877273 0.0989935 0.0989935), wk = 0.0041841 k( 230) = ( 0.6096592 0.1237419 0.1237419), wk = 0.0041841 k( 231) = ( 0.6315910 0.1484902 0.1484902), wk = 0.0041841 k( 232) = ( 0.6535228 0.1732386 0.1732386), wk = 0.0041841 k( 233) = ( 0.6754546 0.1979870 0.1979870), wk = 0.0041841 k( 234) = ( 0.6973865 0.2227353 0.2227353), wk = 0.0041841 k( 235) = ( 0.7193183 0.2474837 0.2474837), wk = 0.0041841 k( 236) = ( 0.7412501 0.2722321 0.2722321), wk = 0.0041841 k( 237) = ( 0.7631819 0.2969805 0.2969805), wk = 0.0041841 k( 238) = ( 0.7851138 0.3217288 0.3217288), wk = 0.0041841 k( 239) = ( 0.8070456 0.3464772 0.3464772), wk = 0.0041841 Dense grid: 62341 G-vectors FFT dimensions: ( 72, 72, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.44 Mb ( 454, 64) NL pseudopotentials 0.85 Mb ( 227, 246) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1732) G-vector shells 0.01 Mb ( 1458) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.77 Mb ( 454, 256) Each subspace H/S matrix 0.06 Mb ( 64, 64) Each <psi_i|beta_j> matrix 0.48 Mb ( 246, 2, 64) The potential is recalculated from file : ./Zr3Te.save/charge-density.dat Starting wfc are 186 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 7.6 secs Computing kpt #: 3 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 11.5 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 15.4 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 19.3 secs Computing kpt #: 6 total cpu time spent up to now is 22.8 secs Computing kpt #: 7 total cpu time spent up to now is 26.2 secs Computing kpt #: 8 total cpu time spent up to now is 29.6 secs Computing kpt #: 9 total cpu time spent up to now is 32.6 secs Computing kpt #: 10 total cpu time spent up to now is 35.2 secs Computing kpt #: 11 total cpu time spent up to now is 37.8 secs Computing kpt #: 12 total cpu time spent up to now is 40.4 secs Computing kpt #: 13 total cpu time spent up to now is 42.9 secs Computing kpt #: 14 total cpu time spent up to now is 45.5 secs Computing kpt #: 15 total cpu time spent up to now is 48.0 secs Computing kpt #: 16 total cpu time spent up to now is 50.5 secs Computing kpt #: 17 total cpu time spent up to now is 53.0 secs Computing kpt #: 18 total cpu time spent up to now is 55.5 secs Computing kpt #: 19 total cpu time spent up to now is 57.9 secs Computing kpt #: 20 total cpu time spent up to now is 60.2 secs Computing kpt #: 21 total cpu time spent up to now is 62.4 secs Computing kpt #: 22 total cpu time spent up to now is 64.7 secs Computing kpt #: 23 total cpu time spent up to now is 67.0 secs Computing kpt #: 24 total cpu time spent up to now is 69.3 secs Computing kpt #: 25 total cpu time spent up to now is 71.8 secs Computing kpt #: 26 total cpu time spent up to now is 74.4 secs Computing kpt #: 27 total cpu time spent up to now is 77.0 secs Computing kpt #: 28 total cpu time spent up to now is 79.6 secs Computing kpt #: 29 total cpu time spent up to now is 82.7 secs Computing kpt #: 30 total cpu time spent up to now is 85.3 secs Computing kpt #: 31 total cpu time spent up to now is 87.9 secs Computing kpt #: 32 total cpu time spent up to now is 90.9 secs Computing kpt #: 33 total cpu time spent up to now is 94.1 secs Computing kpt #: 34 total cpu time spent up to now is 97.4 secs Computing kpt #: 35 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 101.4 secs Computing kpt #: 36 total cpu time spent up to now is 104.7 secs Computing kpt #: 37 total cpu time spent up to now is 108.5 secs Computing kpt #: 38 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 112.3 secs Computing kpt #: 39 total cpu time spent up to now is 116.2 secs Computing kpt #: 40 total cpu time spent up to now is 120.0 secs Computing kpt #: 41 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 123.9 secs Computing kpt #: 42 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 127.8 secs Computing kpt #: 43 total cpu time spent up to now is 130.5 secs Computing kpt #: 44 total cpu time spent up to now is 133.1 secs Computing kpt #: 45 total cpu time spent up to now is 135.7 secs Computing kpt #: 46 total cpu time spent up to now is 138.1 secs Computing kpt #: 47 total cpu time spent up to now is 140.5 secs Computing kpt #: 48 total cpu time spent up to now is 142.8 secs Computing kpt #: 49 total cpu time spent up to now is 145.1 secs Computing kpt #: 50 total cpu time spent up to now is 147.4 secs Computing kpt #: 51 total cpu time spent up to now is 149.7 secs Computing kpt #: 52 total cpu time spent up to now is 152.0 secs Computing kpt #: 53 total cpu time spent up to now is 154.4 secs Computing kpt #: 54 total cpu time spent up to now is 156.8 secs Computing kpt #: 55 total cpu time spent up to now is 159.3 secs Computing kpt #: 56 total cpu time spent up to now is 161.9 secs Computing kpt #: 57 total cpu time spent up to now is 164.5 secs Computing kpt #: 58 total cpu time spent up to now is 167.1 secs Computing kpt #: 59 total cpu time spent up to now is 169.9 secs Computing kpt #: 60 total cpu time spent up to now is 172.9 secs Computing kpt #: 61 total cpu time spent up to now is 176.3 secs Computing kpt #: 62 total cpu time spent up to now is 180.0 secs Computing kpt #: 63 total cpu time spent up to now is 182.6 secs Computing kpt #: 64 total cpu time spent up to now is 185.4 secs Computing kpt #: 65 total cpu time spent up to now is 188.7 secs Computing kpt #: 66 total cpu time spent up to now is 192.2 secs Computing kpt #: 67 total cpu time spent up to now is 196.1 secs Computing kpt #: 68 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 200.0 secs Computing kpt #: 69 total cpu time spent up to now is 203.4 secs Computing kpt #: 70 total cpu time spent up to now is 206.0 secs Computing kpt #: 71 total cpu time spent up to now is 208.3 secs Computing kpt #: 72 total cpu time spent up to now is 210.7 secs Computing kpt #: 73 total cpu time spent up to now is 213.0 secs Computing kpt #: 74 total cpu time spent up to now is 215.4 secs Computing kpt #: 75 total cpu time spent up to now is 217.8 secs Computing kpt #: 76 total cpu time spent up to now is 220.3 secs Computing kpt #: 77 total cpu time spent up to now is 223.0 secs Computing kpt #: 78 total cpu time spent up to now is 225.6 secs Computing kpt #: 79 total cpu time spent up to now is 228.6 secs Computing kpt #: 80 total cpu time spent up to now is 231.3 secs Computing kpt #: 81 total cpu time spent up to now is 234.0 secs Computing kpt #: 82 total cpu time spent up to now is 236.7 secs Computing kpt #: 83 total cpu time spent up to now is 239.4 secs Computing kpt #: 84 total cpu time spent up to now is 241.9 secs Computing kpt #: 85 total cpu time spent up to now is 244.3 secs Computing kpt #: 86 total cpu time spent up to now is 246.7 secs Computing kpt #: 87 total cpu time spent up to now is 249.2 secs Computing kpt #: 88 total cpu time spent up to now is 251.6 secs Computing kpt #: 89 total cpu time spent up to now is 254.1 secs Computing kpt #: 90 total cpu time spent up to now is 256.7 secs Computing kpt #: 91 total cpu time spent up to now is 259.3 secs Computing kpt #: 92 total cpu time spent up to now is 262.0 secs Computing kpt #: 93 total cpu time spent up to now is 264.9 secs Computing kpt #: 94 total cpu time spent up to now is 268.6 secs Computing kpt #: 95 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 272.5 secs Computing kpt #: 96 total cpu time spent up to now is 275.7 secs Computing kpt #: 97 total cpu time spent up to now is 278.6 secs Computing kpt #: 98 total cpu time spent up to now is 281.4 secs Computing kpt #: 99 total cpu time spent up to now is 284.2 secs Computing kpt #: 100 total cpu time spent up to now is 287.1 secs Computing kpt #: 101 total cpu time spent up to now is 290.0 secs Computing kpt #: 102 total cpu time spent up to now is 292.9 secs Computing kpt #: 103 total cpu time spent up to now is 296.2 secs Computing kpt #: 104 total cpu time spent up to now is 299.9 secs Computing kpt #: 105 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 303.8 secs Computing kpt #: 106 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 307.9 secs Computing kpt #: 107 total cpu time spent up to now is 311.5 secs Computing kpt #: 108 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 315.6 secs Computing kpt #: 109 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 319.8 secs Computing kpt #: 110 total cpu time spent up to now is 323.6 secs Computing kpt #: 111 total cpu time spent up to now is 327.0 secs Computing kpt #: 112 total cpu time spent up to now is 330.5 secs Computing kpt #: 113 total cpu time spent up to now is 333.4 secs Computing kpt #: 114 total cpu time spent up to now is 336.4 secs Computing kpt #: 115 total cpu time spent up to now is 339.4 secs Computing kpt #: 116 total cpu time spent up to now is 342.2 secs Computing kpt #: 117 total cpu time spent up to now is 345.2 secs Computing kpt #: 118 total cpu time spent up to now is 348.3 secs Computing kpt #: 119 total cpu time spent up to now is 351.3 secs Computing kpt #: 120 total cpu time spent up to now is 353.9 secs Computing kpt #: 121 total cpu time spent up to now is 356.7 secs Computing kpt #: 122 total cpu time spent up to now is 359.7 secs Computing kpt #: 123 total cpu time spent up to now is 363.0 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 367.0 secs Computing kpt #: 125 total cpu time spent up to now is 370.8 secs Computing kpt #: 126 total cpu time spent up to now is 374.1 secs Computing kpt #: 127 total cpu time spent up to now is 377.7 secs Computing kpt #: 128 total cpu time spent up to now is 380.7 secs Computing kpt #: 129 total cpu time spent up to now is 383.8 secs Computing kpt #: 130 total cpu time spent up to now is 386.0 secs Computing kpt #: 131 total cpu time spent up to now is 388.2 secs Computing kpt #: 132 total cpu time spent up to now is 390.5 secs Computing kpt #: 133 total cpu time spent up to now is 392.7 secs Computing kpt #: 134 total cpu time spent up to now is 395.0 secs Computing kpt #: 135 total cpu time spent up to now is 397.3 secs Computing kpt #: 136 total cpu time spent up to now is 399.5 secs Computing kpt #: 137 total cpu time spent up to now is 401.9 secs Computing kpt #: 138 total cpu time spent up to now is 404.2 secs Computing kpt #: 139 total cpu time spent up to now is 406.6 secs Computing kpt #: 140 total cpu time spent up to now is 409.0 secs Computing kpt #: 141 total cpu time spent up to now is 411.5 secs Computing kpt #: 142 total cpu time spent up to now is 414.1 secs Computing kpt #: 143 total cpu time spent up to now is 416.6 secs Computing kpt #: 144 total cpu time spent up to now is 418.9 secs Computing kpt #: 145 total cpu time spent up to now is 421.3 secs Computing kpt #: 146 total cpu time spent up to now is 423.6 secs Computing kpt #: 147 total cpu time spent up to now is 425.9 secs Computing kpt #: 148 total cpu time spent up to now is 428.2 secs Computing kpt #: 149 total cpu time spent up to now is 430.5 secs Computing kpt #: 150 total cpu time spent up to now is 432.9 secs Computing kpt #: 151 total cpu time spent up to now is 435.3 secs Computing kpt #: 152 total cpu time spent up to now is 437.6 secs Computing kpt #: 153 total cpu time spent up to now is 440.1 secs Computing kpt #: 154 total cpu time spent up to now is 442.7 secs Computing kpt #: 155 total cpu time spent up to now is 445.3 secs Computing kpt #: 156 total cpu time spent up to now is 448.0 secs Computing kpt #: 157 total cpu time spent up to now is 450.6 secs Computing kpt #: 158 total cpu time spent up to now is 453.3 secs Computing kpt #: 159 total cpu time spent up to now is 456.0 secs Computing kpt #: 160 total cpu time spent up to now is 458.7 secs Computing kpt #: 161 total cpu time spent up to now is 461.7 secs Computing kpt #: 162 total cpu time spent up to now is 464.7 secs Computing kpt #: 163 total cpu time spent up to now is 467.7 secs Computing kpt #: 164 total cpu time spent up to now is 470.7 secs Computing kpt #: 165 total cpu time spent up to now is 473.8 secs Computing kpt #: 166 total cpu time spent up to now is 476.8 secs Computing kpt #: 167 total cpu time spent up to now is 479.8 secs Computing kpt #: 168 total cpu time spent up to now is 482.9 secs Computing kpt #: 169 total cpu time spent up to now is 485.9 secs Computing kpt #: 170 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 489.8 secs Computing kpt #: 171 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 493.8 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 497.8 secs Computing kpt #: 173 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 501.7 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 505.6 secs Computing kpt #: 175 total cpu time spent up to now is 508.8 secs Computing kpt #: 176 total cpu time spent up to now is 511.8 secs Computing kpt #: 177 total cpu time spent up to now is 514.8 secs Computing kpt #: 178 total cpu time spent up to now is 517.7 secs Computing kpt #: 179 total cpu time spent up to now is 520.8 secs Computing kpt #: 180 total cpu time spent up to now is 523.7 secs Computing kpt #: 181 total cpu time spent up to now is 526.6 secs Computing kpt #: 182 total cpu time spent up to now is 529.6 secs Computing kpt #: 183 total cpu time spent up to now is 532.5 secs Computing kpt #: 184 total cpu time spent up to now is 535.4 secs Computing kpt #: 185 total cpu time spent up to now is 538.1 secs Computing kpt #: 186 total cpu time spent up to now is 540.7 secs Computing kpt #: 187 total cpu time spent up to now is 543.3 secs Computing kpt #: 188 total cpu time spent up to now is 545.9 secs Computing kpt #: 189 total cpu time spent up to now is 548.4 secs Computing kpt #: 190 total cpu time spent up to now is 550.9 secs Computing kpt #: 191 total cpu time spent up to now is 553.2 secs Computing kpt #: 192 total cpu time spent up to now is 555.5 secs Computing kpt #: 193 total cpu time spent up to now is 558.1 secs Computing kpt #: 194 total cpu time spent up to now is 560.6 secs Computing kpt #: 195 total cpu time spent up to now is 563.3 secs Computing kpt #: 196 total cpu time spent up to now is 566.0 secs Computing kpt #: 197 total cpu time spent up to now is 568.7 secs Computing kpt #: 198 total cpu time spent up to now is 571.5 secs Computing kpt #: 199 total cpu time spent up to now is 574.2 secs Computing kpt #: 200 total cpu time spent up to now is 576.9 secs Computing kpt #: 201 total cpu time spent up to now is 579.4 secs Computing kpt #: 202 total cpu time spent up to now is 582.0 secs Computing kpt #: 203 total cpu time spent up to now is 584.5 secs Computing kpt #: 204 total cpu time spent up to now is 587.0 secs Computing kpt #: 205 total cpu time spent up to now is 589.5 secs Computing kpt #: 206 total cpu time spent up to now is 592.0 secs Computing kpt #: 207 total cpu time spent up to now is 594.6 secs Computing kpt #: 208 total cpu time spent up to now is 597.3 secs Computing kpt #: 209 total cpu time spent up to now is 600.1 secs Computing kpt #: 210 total cpu time spent up to now is 603.1 secs Computing kpt #: 211 total cpu time spent up to now is 606.5 secs Computing kpt #: 212 total cpu time spent up to now is 609.1 secs Computing kpt #: 213 total cpu time spent up to now is 611.6 secs Computing kpt #: 214 total cpu time spent up to now is 614.0 secs Computing kpt #: 215 total cpu time spent up to now is 616.6 secs Computing kpt #: 216 total cpu time spent up to now is 619.1 secs Computing kpt #: 217 total cpu time spent up to now is 621.7 secs Computing kpt #: 218 total cpu time spent up to now is 624.3 secs Computing kpt #: 219 total cpu time spent up to now is 627.2 secs Computing kpt #: 220 total cpu time spent up to now is 630.9 secs Computing kpt #: 221 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 634.8 secs Computing kpt #: 222 total cpu time spent up to now is 638.0 secs Computing kpt #: 223 total cpu time spent up to now is 640.9 secs Computing kpt #: 224 total cpu time spent up to now is 643.8 secs Computing kpt #: 225 total cpu time spent up to now is 647.6 secs Computing kpt #: 226 total cpu time spent up to now is 651.4 secs Computing kpt #: 227 total cpu time spent up to now is 655.3 secs Computing kpt #: 228 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 659.2 secs Computing kpt #: 229 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 663.2 secs Computing kpt #: 230 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 667.1 secs Computing kpt #: 231 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 671.0 secs Computing kpt #: 232 total cpu time spent up to now is 674.1 secs Computing kpt #: 233 total cpu time spent up to now is 676.7 secs Computing kpt #: 234 total cpu time spent up to now is 679.3 secs Computing kpt #: 235 total cpu time spent up to now is 681.9 secs Computing kpt #: 236 total cpu time spent up to now is 684.6 secs Computing kpt #: 237 total cpu time spent up to now is 686.9 secs Computing kpt #: 238 total cpu time spent up to now is 689.2 secs Computing kpt #: 239 total cpu time spent up to now is 691.6 secs ethr = 1.85E-08, avg # of iterations = 62.0 total cpu time spent up to now is 691.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 7761 PWs) bands (ev): -0.4091 -0.4091 1.3106 1.3106 1.9712 1.9712 7.1647 7.1647 7.4313 7.4313 7.5161 7.5161 8.1546 8.1546 8.4752 8.4752 8.6017 8.6017 8.6730 8.6730 10.0196 10.0196 10.4265 10.4265 10.5939 10.5939 11.2636 11.2636 11.3178 11.3178 11.3375 11.3375 11.5989 11.5989 11.6751 11.6751 11.7789 11.7789 11.7839 11.7839 11.9792 11.9792 12.8985 12.8985 13.0659 13.0659 13.0958 13.0958 13.7243 13.7243 14.3216 14.3216 14.3532 14.3532 15.6573 15.6573 15.6632 15.6632 15.8973 15.8973 15.9688 15.9688 16.0219 16.0219 k = 0.0143-0.0188-0.0117 ( 7763 PWs) bands (ev): -0.4079 -0.4079 1.3106 1.3106 1.9704 1.9704 7.1574 7.1574 7.4160 7.4160 7.5425 7.5425 8.1542 8.1542 8.4736 8.4736 8.6028 8.6028 8.6773 8.6773 10.0161 10.0161 10.4217 10.4217 10.5958 10.5958 11.2640 11.2640 11.3200 11.3200 11.3400 11.3400 11.6006 11.6006 11.6761 11.6761 11.7803 11.7803 11.7856 11.7856 11.9829 11.9829 12.8996 12.8996 13.0640 13.0640 13.0937 13.0937 13.7272 13.7272 14.3227 14.3227 14.3541 14.3541 15.6484 15.6484 15.6595 15.6595 15.8675 15.8675 15.9427 15.9427 16.0726 16.0726 k = 0.0286-0.0375-0.0233 ( 7765 PWs) bands (ev): -0.4045 -0.4045 1.3108 1.3108 1.9682 1.9682 7.1367 7.1367 7.3938 7.3938 7.5965 7.5965 8.1530 8.1530 8.4694 8.4694 8.6057 8.6057 8.6901 8.6901 10.0056 10.0056 10.4076 10.4076 10.6015 10.6015 11.2650 11.2650 11.3233 11.3233 11.3500 11.3500 11.6056 11.6056 11.6792 11.6792 11.7835 11.7835 11.7920 11.7920 11.9939 11.9939 12.9030 12.9030 13.0582 13.0582 13.0874 13.0874 13.7360 13.7360 14.3257 14.3257 14.3568 14.3568 15.6167 15.6167 15.6540 15.6540 15.7982 15.7982 15.9270 15.9270 16.1422 16.1422 k = 0.0429-0.0563-0.0350 ( 7765 PWs) bands (ev): -0.3987 -0.3987 1.3109 1.3109 1.9646 1.9646 7.1058 7.1058 7.3785 7.3785 7.6611 7.6611 8.1511 8.1511 8.4638 8.4638 8.6100 8.6100 8.7106 8.7106 9.9884 9.9884 10.3855 10.3855 10.6113 10.6113 11.2671 11.2671 11.3238 11.3238 11.3705 11.3705 11.6136 11.6136 11.6846 11.6846 11.7878 11.7878 11.8036 11.8036 12.0118 12.0118 12.9088 12.9088 13.0486 13.0486 13.0772 13.0772 13.7503 13.7503 14.3305 14.3305 14.3611 14.3611 15.5629 15.5629 15.6456 15.6456 15.7256 15.7256 15.9122 15.9122 16.2053 16.2053 k = 0.0571-0.0751-0.0466 ( 7773 PWs) bands (ev): -0.3907 -0.3907 1.3112 1.3112 1.9595 1.9595 7.0692 7.0692 7.3702 7.3702 7.7311 7.7311 8.1486 8.1486 8.4582 8.4582 8.6153 8.6153 8.7378 8.7378 9.9647 9.9647 10.3572 10.3572 10.6252 10.6252 11.2705 11.2705 11.3216 11.3216 11.3999 11.3999 11.6238 11.6238 11.6922 11.6922 11.7938 11.7938 11.8201 11.8201 12.0362 12.0362 12.9169 12.9169 13.0356 13.0356 13.0634 13.0634 13.7692 13.7692 14.3372 14.3372 14.3671 14.3671 15.4881 15.4881 15.6322 15.6322 15.6629 15.6629 15.8918 15.8918 16.2560 16.2560 k = 0.0714-0.0938-0.0583 ( 7769 PWs) bands (ev): -0.3804 -0.3804 1.3115 1.3115 1.9528 1.9528 7.0305 7.0305 7.3671 7.3671 7.8039 7.8039 8.1458 8.1458 8.4535 8.4535 8.6217 8.6217 8.7709 8.7709 9.9349 9.9349 10.3247 10.3247 10.6432 10.6432 11.2751 11.2751 11.3172 11.3172 11.4367 11.4367 11.6355 11.6355 11.7019 11.7019 11.8019 11.8019 11.8414 11.8414 12.0666 12.0666 12.9274 12.9274 13.0193 13.0193 13.0462 13.0462 13.7919 13.7919 14.3454 14.3454 14.3744 14.3744 15.3973 15.3973 15.5972 15.5972 15.6272 15.6272 15.8635 15.8635 16.2921 16.2921 k = 0.0857-0.1126-0.0699 ( 7780 PWs) bands (ev): -0.3680 -0.3680 1.3119 1.3119 1.9447 1.9447 6.9921 6.9921 7.3674 7.3674 7.8771 7.8771 8.1437 8.1437 8.4504 8.4504 8.6292 8.6292 8.8092 8.8092 9.8997 9.8997 10.2902 10.2902 10.6651 10.6651 11.2812 11.2812 11.3111 11.3111 11.4797 11.4797 11.6479 11.6479 11.7129 11.7129 11.8132 11.8132 11.8675 11.8675 12.1022 12.1022 12.9401 12.9401 13.0004 13.0004 13.0263 13.0263 13.8170 13.8170 14.3551 14.3551 14.3828 14.3828 15.2964 15.2964 15.5476 15.5476 15.6086 15.6086 15.8256 15.8256 16.3130 16.3130 k = 0.1000-0.1313-0.0816 ( 7786 PWs) bands (ev): -0.3533 -0.3533 1.3123 1.3123 1.9351 1.9351 6.9558 6.9558 7.3702 7.3702 7.9467 7.9467 8.1448 8.1448 8.4494 8.4494 8.6377 8.6377 8.8521 8.8521 9.8602 9.8602 10.2554 10.2554 10.6904 10.6904 11.2883 11.2883 11.3041 11.3041 11.5277 11.5277 11.6607 11.6607 11.7240 11.7240 11.8284 11.8284 11.8983 11.8983 12.1421 12.1421 12.9537 12.9537 12.9797 12.9797 13.0047 13.0047 13.8430 13.8430 14.3662 14.3662 14.3921 14.3921 15.1898 15.1898 15.4994 15.4994 15.5889 15.5889 15.7770 15.7770 16.3175 16.3175 k = 0.1143-0.1501-0.0932 ( 7795 PWs) bands (ev): -0.3366 -0.3366 1.3128 1.3128 1.9239 1.9239 6.9224 6.9224 7.3748 7.3748 8.0044 8.0044 8.1562 8.1562 8.4506 8.4506 8.6473 8.6473 8.8993 8.8993 9.8178 9.8178 10.2215 10.2215 10.7188 10.7188 11.2909 11.2909 11.3023 11.3023 11.5795 11.5795 11.6738 11.6738 11.7342 11.7342 11.8481 11.8481 11.9343 11.9343 12.1857 12.1857 12.9533 12.9533 12.9664 12.9664 12.9882 12.9882 13.8682 13.8682 14.3778 14.3778 14.4024 14.4024 15.0802 15.0802 15.4532 15.4532 15.5663 15.5663 15.7179 15.7179 16.3054 16.3054 k = 0.1286-0.1689-0.1049 ( 7797 PWs) bands (ev): -0.3177 -0.3177 1.3133 1.3133 1.9113 1.9113 6.8926 6.8926 7.3809 7.3809 8.0371 8.0371 8.1897 8.1897 8.4543 8.4543 8.6580 8.6580 8.9504 8.9504 9.7746 9.7746 10.1895 10.1895 10.7493 10.7493 11.2835 11.2835 11.3122 11.3122 11.6340 11.6340 11.6876 11.6876 11.7429 11.7429 11.8722 11.8722 11.9757 11.9757 12.2321 12.2321 12.9300 12.9300 12.9494 12.9494 12.9976 12.9976 13.8908 13.8908 14.3886 14.3886 14.4144 14.4144 14.9694 14.9694 15.4093 15.4093 15.5384 15.5384 15.6512 15.6512 16.2782 16.2782 k = 0.1429-0.1876-0.1166 ( 7791 PWs) bands (ev): -0.2968 -0.2968 1.3138 1.3138 1.8971 1.8971 6.8666 6.8666 7.3881 7.3881 8.0446 8.0446 8.2440 8.2440 8.4606 8.4606 8.6700 8.6700 9.0050 9.0050 9.7327 9.7327 10.1598 10.1598 10.7814 10.7814 11.2746 11.2746 11.3257 11.3257 11.6886 11.6886 11.7033 11.7033 11.7505 11.7505 11.8998 11.8998 12.0227 12.0227 12.2807 12.2807 12.9045 12.9045 12.9257 12.9257 13.0159 13.0159 13.9093 13.9093 14.3965 14.3965 14.4290 14.4290 14.8590 14.8590 15.3681 15.3681 15.4984 15.4984 15.5862 15.5862 16.2384 16.2384 k = 0.1571-0.2064-0.1282 ( 7792 PWs) bands (ev): -0.2740 -0.2740 1.3144 1.3144 1.8814 1.8814 6.8445 6.8445 7.3962 7.3962 8.0388 8.0388 8.3050 8.3050 8.4698 8.4698 8.6835 8.6835 9.0622 9.0622 9.6948 9.6948 10.1326 10.1326 10.8137 10.8137 11.2661 11.2661 11.3419 11.3419 11.7149 11.7149 11.7477 11.7477 11.7586 11.7586 11.9299 11.9299 12.0756 12.0756 12.3308 12.3308 12.8781 12.8781 12.9025 12.9025 13.0352 13.0352 13.9221 13.9221 14.4007 14.4007 14.4453 14.4453 14.7507 14.7507 15.3301 15.3301 15.4345 15.4345 15.5374 15.5374 16.1893 16.1893 k = 0.1714-0.2252-0.1399 ( 7797 PWs) bands (ev): -0.2493 -0.2493 1.3149 1.3149 1.8643 1.8643 6.8265 6.8265 7.4051 7.4051 8.0269 8.0269 8.3632 8.3632 8.4827 8.4827 8.6985 8.6985 9.1213 9.1213 9.6638 9.6638 10.1079 10.1079 10.8452 10.8452 11.2585 11.2585 11.3612 11.3612 11.7304 11.7304 11.7655 11.7655 11.8048 11.8048 11.9615 11.9615 12.1342 12.1342 12.3818 12.3818 12.8519 12.8519 12.8815 12.8815 13.0537 13.0537 13.9279 13.9279 14.4009 14.4009 14.4601 14.4601 14.6478 14.6478 15.2946 15.2946 15.3533 15.3533 15.5031 15.5031 16.1330 16.1330 k = 0.1857-0.2439-0.1515 ( 7798 PWs) bands (ev): -0.2229 -0.2229 1.3153 1.3153 1.8457 1.8457 6.8124 6.8124 7.4146 7.4146 8.0113 8.0113 8.4120 8.4120 8.5010 8.5010 8.7155 8.7155 9.1809 9.1809 9.6432 9.6432 10.0860 10.0860 10.8744 10.8744 11.2523 11.2523 11.3836 11.3836 11.7459 11.7459 11.7759 11.7759 11.8595 11.8595 11.9934 11.9934 12.1980 12.1980 12.4330 12.4330 12.8272 12.8272 12.8641 12.8641 13.0701 13.0701 13.9260 13.9260 14.3969 14.3969 14.4632 14.4632 14.5600 14.5600 15.2446 15.2446 15.2850 15.2850 15.4739 15.4739 16.0708 16.0708 k = 0.2000-0.2627-0.1632 ( 7786 PWs) bands (ev): -0.1947 -0.1947 1.3157 1.3157 1.8258 1.8258 6.8021 6.8021 7.4247 7.4247 7.9934 7.9934 8.4474 8.4474 8.5259 8.5259 8.7345 8.7345 9.2394 9.2394 9.6360 9.6360 10.0667 10.0667 10.9000 10.9000 11.2480 11.2480 11.4094 11.4094 11.7614 11.7614 11.7894 11.7894 11.9121 11.9121 12.0247 12.0247 12.2661 12.2661 12.4827 12.4827 12.8062 12.8062 12.8516 12.8516 13.0833 13.0833 13.9154 13.9154 14.3875 14.3875 14.4185 14.4185 14.5240 14.5240 15.1596 15.1596 15.2573 15.2573 15.4464 15.4464 16.0025 16.0025 k = 0.2143-0.2815-0.1748 ( 7793 PWs) bands (ev): -0.1650 -0.1650 1.3159 1.3159 1.8046 1.8046 6.7953 6.7953 7.4350 7.4350 7.9736 7.9736 8.4712 8.4712 8.5541 8.5541 8.7550 8.7550 9.2954 9.2954 9.6450 9.6450 10.0503 10.0503 10.9207 10.9207 11.2459 11.2459 11.4383 11.4383 11.7782 11.7782 11.8061 11.8061 11.9621 11.9621 12.0540 12.0540 12.3366 12.3366 12.5284 12.5284 12.7921 12.7921 12.8458 12.8458 13.0923 13.0923 13.8957 13.8957 14.3396 14.3396 14.3745 14.3745 14.5246 14.5246 15.0711 15.0711 15.2426 15.2426 15.4195 15.4195 15.9271 15.9271 k = 0.2286-0.3002-0.1865 ( 7783 PWs) bands (ev): -0.1339 -0.1339 1.3160 1.3160 1.7822 1.7822 6.7917 6.7917 7.4457 7.4457 7.9525 7.9525 8.4886 8.4886 8.5800 8.5800 8.7758 8.7758 9.3484 9.3484 9.6709 9.6709 10.0370 10.0370 10.9358 10.9358 11.2463 11.2463 11.4698 11.4698 11.7980 11.7980 11.8257 11.8257 12.0086 12.0086 12.0800 12.0800 12.4071 12.4071 12.5653 12.5653 12.7904 12.7904 12.8497 12.8497 13.0969 13.0969 13.8666 13.8666 14.2646 14.2646 14.3532 14.3532 14.5282 14.5282 14.9870 14.9870 15.2354 15.2354 15.3929 15.3929 15.8442 15.8442 k = 0.2429-0.3190-0.1982 ( 7782 PWs) bands (ev): -0.1014 -0.1014 1.3157 1.3157 1.7588 1.7588 6.7909 6.7909 7.4564 7.4564 7.9306 7.9306 8.5031 8.5031 8.6015 8.6015 8.7953 8.7953 9.3994 9.3994 9.7115 9.7115 10.0274 10.0274 10.9450 10.9450 11.2494 11.2494 11.5025 11.5025 11.8226 11.8226 11.8473 11.8473 12.0510 12.0510 12.1009 12.1009 12.4741 12.4741 12.5889 12.5889 12.8063 12.8063 12.8669 12.8669 13.0973 13.0973 13.8287 13.8287 14.1977 14.1977 14.3251 14.3251 14.5295 14.5295 14.9101 14.9101 15.2337 15.2337 15.3663 15.3663 15.7547 15.7547 k = 0.2571-0.3377-0.2098 ( 7781 PWs) bands (ev): -0.0677 -0.0677 1.3152 1.3152 1.7345 1.7345 6.7923 6.7923 7.4672 7.4672 7.9082 7.9082 8.5159 8.5159 8.6190 8.6190 8.8124 8.8124 9.4506 9.4506 9.7617 9.7617 10.0226 10.0226 10.9487 10.9487 11.2550 11.2550 11.5352 11.5352 11.8528 11.8528 11.8712 11.8712 12.0874 12.0874 12.1160 12.1160 12.5338 12.5338 12.5998 12.5998 12.8396 12.8396 12.9006 12.9006 13.0953 13.0953 13.7836 13.7836 14.1395 14.1395 14.2895 14.2895 14.5282 14.5282 14.8422 14.8422 15.2350 15.2350 15.3397 15.3397 15.6608 15.6608 k = 0.2714-0.3565-0.2215 ( 7777 PWs) bands (ev): -0.0330 -0.0330 1.3142 1.3142 1.7095 1.7095 6.7955 6.7955 7.4778 7.4778 7.8862 7.8862 8.5276 8.5276 8.6335 8.6335 8.8267 8.8267 9.5034 9.5034 9.8147 9.8147 10.0248 10.0248 10.9477 10.9477 11.2631 11.2631 11.5664 11.5664 11.8860 11.8860 11.9001 11.9001 12.1082 12.1082 12.1325 12.1325 12.5835 12.5835 12.6045 12.6045 12.8849 12.8849 12.9512 12.9512 13.0949 13.0949 13.7335 13.7335 14.0889 14.0889 14.2472 14.2472 14.5250 14.5250 14.7842 14.7842 15.2365 15.2365 15.3133 15.3133 15.5658 15.5658 k = 0.2857-0.3753-0.2331 ( 7783 PWs) bands (ev): 0.0026 0.0026 1.3126 1.3126 1.6841 1.6841 6.7998 6.7998 7.4881 7.4881 7.8652 7.8652 8.5386 8.5386 8.6462 8.6462 8.8384 8.8384 9.5585 9.5585 9.8624 9.8624 10.0382 10.0382 10.9429 10.9429 11.2736 11.2736 11.5956 11.5956 11.9140 11.9140 11.9406 11.9406 12.1053 12.1053 12.1578 12.1578 12.6080 12.6080 12.6243 12.6243 12.9334 12.9334 13.0151 13.0151 13.1038 13.1038 13.6806 13.6806 14.0442 14.0442 14.1997 14.1997 14.5206 14.5206 14.7358 14.7358 15.2348 15.2348 15.2873 15.2873 15.4725 15.4725 k = 0.3000-0.3940-0.2448 ( 7789 PWs) bands (ev): 0.0387 0.0387 1.3103 1.3103 1.6586 1.6586 6.8046 6.8046 7.4981 7.4981 7.8459 7.8459 8.5490 8.5490 8.6576 8.6576 8.8480 8.8480 9.6152 9.6152 9.8970 9.8970 10.0673 10.0673 10.9354 10.9354 11.2863 11.2863 11.6226 11.6226 11.9391 11.9391 11.9859 11.9859 12.0921 12.0921 12.1817 12.1817 12.6141 12.6141 12.6579 12.6579 12.9728 12.9728 13.0878 13.0878 13.1339 13.1339 13.6268 13.6268 14.0040 14.0040 14.1498 14.1498 14.5158 14.5158 14.6958 14.6958 15.2251 15.2251 15.2629 15.2629 15.3844 15.3844 k = 0.3143-0.4128-0.2564 ( 7796 PWs) bands (ev): 0.0754 0.0754 1.3072 1.3072 1.6332 1.6332 6.8093 6.8093 7.5076 7.5076 7.8293 7.8293 8.5591 8.5591 8.6681 8.6681 8.8563 8.8563 9.6725 9.6725 9.9180 9.9180 10.1102 10.1102 10.9265 10.9265 11.3011 11.3011 11.6476 11.6476 11.9625 11.9625 12.0141 12.0141 12.0902 12.0902 12.2029 12.2029 12.6221 12.6221 12.6873 12.6873 12.9979 12.9979 13.1642 13.1642 13.1906 13.1906 13.5737 13.5737 13.9672 13.9672 14.1008 14.1008 14.5108 14.5108 14.6630 14.6630 15.2031 15.2031 15.2378 15.2378 15.3078 15.3078 k = 0.3286-0.4316-0.2681 ( 7793 PWs) bands (ev): 0.1122 0.1122 1.3029 1.3029 1.6085 1.6085 6.8133 6.8133 7.5166 7.5166 7.8160 7.8160 8.5691 8.5691 8.6776 8.6776 8.8638 8.8638 9.7288 9.7288 9.9312 9.9312 10.1591 10.1591 10.9172 10.9172 11.3175 11.3175 11.6711 11.6711 11.9804 11.9804 12.0005 12.0005 12.1285 12.1285 12.2224 12.2224 12.6317 12.6317 12.7137 12.7137 13.0168 13.0168 13.2398 13.2398 13.2650 13.2650 13.5233 13.5233 13.9339 13.9339 14.0563 14.0563 14.5059 14.5059 14.6359 14.6359 15.1681 15.1681 15.1968 15.1968 15.2582 15.2582 k = 0.3429-0.4503-0.2797 ( 7796 PWs) bands (ev): 0.1489 0.1489 1.2973 1.2973 1.5848 1.5848 6.8160 6.8160 7.5250 7.5250 7.8065 7.8065 8.5790 8.5790 8.6858 8.6858 8.8712 8.8712 9.7821 9.7821 9.9425 9.9425 10.2068 10.2068 10.9086 10.9086 11.3351 11.3351 11.6927 11.6927 11.9554 11.9554 12.0086 12.0086 12.1808 12.1808 12.2418 12.2418 12.6431 12.6431 12.7369 12.7369 13.0362 13.0362 13.3134 13.3134 13.3431 13.3431 13.4787 13.4787 13.9051 13.9051 14.0202 14.0202 14.5011 14.5011 14.6136 14.6136 15.1161 15.1161 15.1495 15.1495 15.2300 15.2300 k = 0.3571-0.4691-0.2914 ( 7800 PWs) bands (ev): 0.1852 0.1852 1.2902 1.2902 1.5626 1.5626 6.8172 6.8172 7.5330 7.5330 7.8011 7.8011 8.5887 8.5887 8.6924 8.6924 8.8791 8.8791 9.8293 9.8293 9.9566 9.9566 10.2492 10.2492 10.9018 10.9018 11.3528 11.3528 11.7118 11.7118 11.9167 11.9167 12.0251 12.0251 12.2305 12.2305 12.2639 12.2639 12.6578 12.6578 12.7560 12.7560 13.0563 13.0563 13.3750 13.3750 13.4134 13.4134 13.4529 13.4529 13.8836 13.8836 13.9965 13.9965 14.4964 14.4964 14.5955 14.5955 15.0571 15.0571 15.1055 15.1055 15.2040 15.2040 k = 0.3714-0.4879-0.3031 ( 7793 PWs) bands (ev): 0.2206 0.2206 1.2815 1.2815 1.5423 1.5423 6.8167 6.8167 7.5404 7.5404 7.7997 7.7997 8.5981 8.5981 8.6971 8.6971 8.8879 8.8879 9.8664 9.8664 9.9779 9.9779 10.2834 10.2834 10.8977 10.8977 11.3690 11.3690 11.7263 11.7263 11.8834 11.8834 12.0389 12.0389 12.2687 12.2687 12.2930 12.2930 12.6783 12.6783 12.7701 12.7701 13.0731 13.0731 13.3851 13.3851 13.4655 13.4655 13.4886 13.4886 13.8744 13.8744 13.9888 13.9888 14.4917 14.4917 14.5817 14.5817 15.0025 15.0025 15.0592 15.0592 15.1754 15.1754 k = 0.3857-0.5066-0.3147 ( 7790 PWs) bands (ev): 0.2549 0.2549 1.2711 1.2711 1.5244 1.5244 6.8147 6.8147 7.5475 7.5475 7.8020 7.8020 8.6068 8.6068 8.6997 8.6997 8.8979 8.8979 9.8910 9.8910 10.0085 10.0085 10.3084 10.3084 10.8967 10.8967 11.3813 11.3813 11.7329 11.7329 11.8640 11.8640 12.0494 12.0494 12.2968 12.2968 12.3245 12.3245 12.7064 12.7064 12.7783 12.7783 13.0806 13.0806 13.3768 13.3768 13.5098 13.5098 13.5360 13.5360 13.8847 13.8847 13.9991 13.9991 14.4868 14.4868 14.5726 14.5726 14.9550 14.9550 15.0106 15.0106 15.1433 15.1433 k = 0.4000-0.5254-0.3264 ( 7781 PWs) bands (ev): 0.2875 0.2875 1.2592 1.2592 1.5091 1.5091 6.8113 6.8113 7.5540 7.5540 7.8075 7.8075 8.6142 8.6142 8.7007 8.7007 8.9090 8.9090 9.9062 9.9062 10.0450 10.0450 10.3238 10.3238 10.8988 10.8988 11.3872 11.3872 11.7320 11.7320 11.8623 11.8623 12.0568 12.0568 12.3222 12.3222 12.3494 12.3494 12.7411 12.7411 12.7809 12.7809 13.0759 13.0759 13.3812 13.3812 13.5355 13.5355 13.5719 13.5719 13.9180 13.9180 14.0253 14.0253 14.4813 14.4813 14.5693 14.5693 14.9151 14.9151 14.9616 14.9616 15.1082 15.1082 k = 0.4143-0.5441-0.3380 ( 7779 PWs) bands (ev): 0.3178 0.3178 1.2464 1.2464 1.4965 1.4965 6.8069 6.8069 7.5601 7.5601 7.8152 7.8152 8.6201 8.6201 8.7005 8.7005 8.9209 8.9209 9.9161 9.9161 10.0828 10.0828 10.3304 10.3304 10.9035 10.9035 11.3848 11.3848 11.7305 11.7305 11.8737 11.8737 12.0617 12.0617 12.3433 12.3433 12.3694 12.3694 12.7683 12.7683 12.7882 12.7882 13.0626 13.0626 13.3975 13.3975 13.5444 13.5444 13.5983 13.5983 13.9698 13.9698 14.0614 14.0614 14.4747 14.4747 14.5733 14.5733 14.8820 14.8820 14.9154 14.9154 15.0711 15.0711 k = 0.4286-0.5629-0.3497 ( 7774 PWs) bands (ev): 0.3452 0.3452 1.2332 1.2332 1.4863 1.4863 6.8021 6.8021 7.5655 7.5655 7.8243 7.8243 8.6239 8.6239 8.6999 8.6999 8.9329 8.9329 9.9233 9.9233 10.1190 10.1190 10.3295 10.3295 10.9097 10.9097 11.3749 11.3749 11.7341 11.7341 11.8919 11.8919 12.0647 12.0647 12.3530 12.3530 12.3929 12.3929 12.7624 12.7624 12.8195 12.8195 13.0491 13.0491 13.4192 13.4192 13.5456 13.5456 13.6182 13.6182 14.0296 14.0296 14.1003 14.1003 14.4664 14.4664 14.5861 14.5861 14.8521 14.8521 14.8774 14.8774 15.0345 15.0345 k = 0.4429-0.5817-0.3613 ( 7767 PWs) bands (ev): 0.3691 0.3691 1.2206 1.2206 1.4785 1.4785 6.7973 6.7973 7.5701 7.5701 7.8337 7.8337 8.6257 8.6257 8.6995 8.6995 8.9444 8.9444 9.9287 9.9287 10.1522 10.1522 10.3228 10.3228 10.9165 10.9165 11.3602 11.3602 11.7427 11.7427 11.9128 11.9128 12.0665 12.0665 12.3530 12.3530 12.4196 12.4196 12.7487 12.7487 12.8425 12.8425 13.0440 13.0440 13.4408 13.4408 13.5460 13.5460 13.6339 13.6339 14.0863 14.0863 14.1378 14.1378 14.4561 14.4561 14.6079 14.6079 14.8205 14.8205 14.8527 14.8527 15.0030 15.0030 k = 0.4571-0.6004-0.3730 ( 7773 PWs) bands (ev): 0.3887 0.3887 1.2094 1.2094 1.4728 1.4728 6.7930 6.7930 7.5739 7.5739 7.8424 7.8424 8.6258 8.6258 8.6995 8.6995 8.9545 8.9545 9.9329 9.9329 10.1817 10.1817 10.3121 10.3121 10.9229 10.9229 11.3446 11.3446 11.7535 11.7535 11.9338 11.9338 12.0673 12.0673 12.3480 12.3480 12.4458 12.4458 12.7325 12.7325 12.8503 12.8503 13.0503 13.0503 13.4604 13.4604 13.5474 13.5474 13.6466 13.6466 14.1281 14.1281 14.1758 14.1758 14.4441 14.4441 14.6367 14.6367 14.7914 14.7914 14.8352 14.8352 14.9825 14.9825 k = 0.4714-0.6192-0.3847 ( 7774 PWs) bands (ev): 0.4032 0.4032 1.2007 1.2007 1.4689 1.4689 6.7896 6.7896 7.5766 7.5766 7.8494 7.8494 8.6249 8.6249 8.6998 8.6998 8.9623 8.9623 9.9360 9.9360 10.2072 10.2072 10.2990 10.2990 10.9279 10.9279 11.3313 11.3313 11.7633 11.7633 11.9522 11.9522 12.0678 12.0678 12.3412 12.3412 12.4686 12.4686 12.7167 12.7167 12.8479 12.8479 13.0623 13.0623 13.4782 13.4782 13.5480 13.5480 13.6563 13.6563 14.1509 14.1509 14.2128 14.2128 14.4319 14.4319 14.6671 14.6671 14.7695 14.7695 14.8199 14.8199 14.9752 14.9752 k = 0.4857-0.6380-0.3963 ( 7776 PWs) bands (ev): 0.4123 0.4123 1.1951 1.1951 1.4667 1.4667 6.7874 6.7874 7.5783 7.5783 7.8539 7.8539 8.6240 8.6240 8.7001 8.7001 8.9674 8.9674 9.9378 9.9378 10.2274 10.2274 10.2857 10.2857 10.9312 10.9312 11.3225 11.3225 11.7701 11.7701 11.9651 11.9651 12.0679 12.0679 12.3356 12.3356 12.4846 12.4846 12.7047 12.7047 12.8431 12.8431 13.0722 13.0722 13.4931 13.4931 13.5460 13.5460 13.6624 13.6624 14.1616 14.1616 14.2395 14.2395 14.4222 14.4222 14.6908 14.6908 14.7567 14.7567 14.8083 14.8083 14.9745 14.9745 k = 0.5000-0.6567-0.4080 ( 7780 PWs) bands (ev): 0.4153 0.4153 1.1932 1.1932 1.4659 1.4659 6.7867 6.7867 7.5789 7.5789 7.8555 7.8555 8.6236 8.6236 8.7003 8.7003 8.9691 8.9691 9.9384 9.9384 10.2367 10.2367 10.2786 10.2786 10.9323 10.9323 11.3195 11.3195 11.7724 11.7724 11.9698 11.9698 12.0680 12.0680 12.3334 12.3334 12.4904 12.4904 12.7002 12.7002 12.8410 12.8410 13.0759 13.0759 13.4997 13.4997 13.5441 13.5441 13.6646 13.6646 14.1647 14.1647 14.2491 14.2491 14.4184 14.4184 14.6996 14.6996 14.7529 14.7529 14.8040 14.8040 14.9739 14.9739 k = 0.5000-0.6567-0.4080 ( 7780 PWs) bands (ev): 0.4153 0.4153 1.1932 1.1932 1.4659 1.4659 6.7867 6.7867 7.5789 7.5789 7.8555 7.8555 8.6236 8.6236 8.7003 8.7003 8.9691 8.9691 9.9384 9.9384 10.2367 10.2367 10.2786 10.2786 10.9323 10.9323 11.3195 11.3195 11.7724 11.7724 11.9698 11.9698 12.0680 12.0680 12.3334 12.3334 12.4904 12.4904 12.7002 12.7002 12.8410 12.8410 13.0759 13.0759 13.4997 13.4997 13.5441 13.5441 13.6646 13.6646 14.1647 14.1647 14.2491 14.2491 14.4184 14.4184 14.6996 14.6996 14.7529 14.7529 14.8040 14.8040 14.9739 14.9739 k = 0.5000-0.6429-0.4303 ( 7772 PWs) bands (ev): 0.4161 0.4161 1.1926 1.1926 1.4661 1.4661 6.7872 6.7872 7.5706 7.5706 7.8631 7.8631 8.6220 8.6220 8.7008 8.7008 8.9724 8.9724 9.9379 9.9379 10.2387 10.2387 10.2828 10.2828 10.9308 10.9308 11.3207 11.3207 11.7750 11.7750 11.9652 11.9652 12.0656 12.0656 12.3334 12.3334 12.4963 12.4963 12.6987 12.6987 12.8382 12.8382 13.0777 13.0777 13.4985 13.4985 13.5424 13.5424 13.6598 13.6598 14.1612 14.1612 14.2516 14.2516 14.4243 14.4243 14.6898 14.6898 14.7453 14.7453 14.7929 14.7929 14.9863 14.9863 k = 0.5000-0.6290-0.4526 ( 7768 PWs) bands (ev): 0.4183 0.4183 1.1909 1.1909 1.4665 1.4665 6.7885 6.7885 7.5485 7.5485 7.8832 7.8832 8.6174 8.6174 8.7019 8.7019 8.9822 8.9822 9.9364 9.9364 10.2450 10.2450 10.2948 10.2948 10.9263 10.9263 11.3242 11.3242 11.7828 11.7828 11.9523 11.9523 12.0587 12.0587 12.3333 12.3333 12.5128 12.5128 12.6945 12.6945 12.8293 12.8293 13.0838 13.0838 13.4948 13.4948 13.5375 13.5375 13.6467 13.6467 14.1507 14.1507 14.2584 14.2584 14.4405 14.4405 14.6636 14.6636 14.7253 14.7253 14.7662 14.7662 15.0171 15.0171 k = 0.5000-0.6152-0.4748 ( 7776 PWs) bands (ev): 0.4219 0.4219 1.1881 1.1881 1.4672 1.4672 6.7906 6.7906 7.5176 7.5176 7.9112 7.9112 8.6104 8.6104 8.7028 8.7028 8.9983 8.9983 9.9345 9.9345 10.2559 10.2559 10.3137 10.3137 10.9189 10.9189 11.3297 11.3297 11.7959 11.7959 11.9334 11.9334 12.0476 12.0476 12.3327 12.3327 12.5379 12.5379 12.6879 12.6879 12.8130 12.8130 13.0951 13.0951 13.4885 13.4885 13.5294 13.5294 13.6284 13.6284 14.1347 14.1347 14.2661 14.2661 14.4636 14.4636 14.6282 14.6282 14.6972 14.6972 14.7334 14.7334 15.0569 15.0569 k = 0.5000-0.6013-0.4971 ( 7778 PWs) bands (ev): 0.4270 0.4270 1.1840 1.1840 1.4682 1.4682 6.7931 6.7931 7.4824 7.4824 7.9430 7.9430 8.6014 8.6014 8.7026 8.7026 9.0204 9.0204 9.9328 9.9328 10.2715 10.2715 10.3388 10.3388 10.9086 10.9086 11.3369 11.3369 11.8142 11.8142 11.9108 11.9108 12.0328 12.0328 12.3312 12.3312 12.5687 12.5687 12.6797 12.6797 12.7883 12.7883 13.1122 13.1122 13.4794 13.4794 13.5185 13.5185 13.6087 13.6087 14.1157 14.1157 14.2686 14.2686 14.4899 14.4899 14.5885 14.5885 14.6665 14.6665 14.7009 14.7009 15.0996 15.0996 k = 0.5000-0.5875-0.5194 ( 7770 PWs) bands (ev): 0.4335 0.4335 1.1788 1.1788 1.4695 1.4695 6.7959 6.7959 7.4463 7.4463 7.9763 7.9763 8.5906 8.5906 8.7011 8.7011 9.0478 9.0478 9.9321 9.9321 10.2915 10.2915 10.3693 10.3693 10.8957 10.8957 11.3451 11.3451 11.8376 11.8376 11.8869 11.8869 12.0152 12.0152 12.3286 12.3286 12.6024 12.6024 12.6705 12.6705 12.7549 12.7549 13.1348 13.1348 13.4674 13.4674 13.5052 13.5052 13.5912 13.5912 14.0956 14.0956 14.2600 14.2600 14.5145 14.5145 14.5444 14.5444 14.6396 14.6396 14.6750 14.6750 15.1410 15.1410 k = 0.5000-0.5736-0.5417 ( 7774 PWs) bands (ev): 0.4414 0.4414 1.1724 1.1724 1.4712 1.4712 6.7983 6.7983 7.4113 7.4113 8.0098 8.0098 8.5775 8.5775 8.6982 8.6982 9.0797 9.0797 9.9326 9.9326 10.3155 10.3155 10.4051 10.4051 10.8805 10.8805 11.3539 11.3539 11.8589 11.8589 11.8701 11.8701 11.9958 11.9958 12.3248 12.3248 12.6364 12.6364 12.6613 12.6613 12.7134 12.7134 13.1610 13.1610 13.4525 13.4525 13.4898 13.4898 13.5798 13.5798 14.0758 14.0758 14.2376 14.2376 14.4936 14.4936 14.5290 14.5290 14.6242 14.6242 14.6626 14.6626 15.1666 15.1666 k = 0.5000-0.5598-0.5640 ( 7778 PWs) bands (ev): 0.4507 0.4507 1.1646 1.1646 1.4731 1.4731 6.8001 6.8001 7.3793 7.3793 8.0428 8.0428 8.5618 8.5618 8.6947 8.6947 9.1150 9.1150 9.9346 9.9346 10.3430 10.3430 10.4458 10.4458 10.8634 10.8634 11.3626 11.3626 11.8390 11.8390 11.8989 11.8989 11.9767 11.9767 12.3199 12.3199 12.6476 12.6476 12.6600 12.6600 12.6790 12.6790 13.1876 13.1876 13.4352 13.4352 13.4729 13.4729 13.5780 13.5780 14.0571 14.0571 14.2024 14.2024 14.4392 14.4392 14.5203 14.5203 14.6292 14.6292 14.6640 14.6640 15.1628 15.1628 k = 0.5000-0.5459-0.5863 ( 7768 PWs) bands (ev): 0.4612 0.4612 1.1555 1.1555 1.4754 1.4754 6.8006 6.8006 7.3515 7.3515 8.0747 8.0747 8.5427 8.5427 8.6912 8.6912 9.1526 9.1526 9.9379 9.9379 10.3735 10.3735 10.4914 10.4914 10.8448 10.8448 11.3709 11.3709 11.8181 11.8181 11.9235 11.9235 11.9688 11.9688 12.3139 12.3139 12.6066 12.6066 12.6402 12.6402 12.7082 12.7082 13.2101 13.2101 13.4163 13.4163 13.4549 13.4549 13.5888 13.5888 14.0398 14.0398 14.1559 14.1559 14.3858 14.3858 14.4950 14.4950 14.6477 14.6477 14.6739 14.6739 15.1485 15.1485 k = 0.5000-0.5321-0.6086 ( 7760 PWs) bands (ev): 0.4730 0.4730 1.1450 1.1450 1.4781 1.4781 6.7994 6.7994 7.3293 7.3293 8.1053 8.1053 8.5199 8.5199 8.6885 8.6885 9.1912 9.1912 9.9420 9.9420 10.4066 10.4066 10.5413 10.5413 10.8257 10.8257 11.3783 11.3783 11.7990 11.7990 11.9163 11.9163 11.9969 11.9969 12.3073 12.3073 12.5479 12.5479 12.6300 12.6300 12.7392 12.7392 13.2247 13.2247 13.3969 13.3969 13.4369 13.4369 13.6143 13.6143 14.0237 14.0237 14.0995 14.0995 14.3391 14.3391 14.4637 14.4637 14.6676 14.6676 14.6874 14.6874 15.1323 15.1323 k = 0.5000-0.5182-0.6309 ( 7762 PWs) bands (ev): 0.4859 0.4859 1.1330 1.1330 1.4812 1.4812 6.7962 6.7962 7.3132 7.3132 8.1340 8.1340 8.4936 8.4936 8.6872 8.6872 9.2298 9.2298 9.9464 9.9464 10.4421 10.4421 10.5950 10.5950 10.8069 10.8069 11.3845 11.3845 11.7819 11.7819 11.8970 11.8970 12.0412 12.0412 12.3003 12.3003 12.4862 12.4862 12.6196 12.6196 12.7679 12.7679 13.2295 13.2295 13.3781 13.3781 13.4202 13.4202 13.6536 13.6536 14.0055 14.0055 14.0373 14.0373 14.3029 14.3029 14.4306 14.4306 14.6829 14.6829 14.7025 14.7025 15.1190 15.1190 k = 0.5000-0.5044-0.6532 ( 7764 PWs) bands (ev): 0.5000 0.5000 1.1195 1.1195 1.4848 1.4848 6.7911 6.7911 7.3037 7.3037 8.1600 8.1600 8.4646 8.4646 8.6876 8.6876 9.2670 9.2670 9.9502 9.9502 10.4795 10.4795 10.6509 10.6509 10.7906 10.7906 11.3894 11.3894 11.7665 11.7665 11.8764 11.8764 12.0896 12.0896 12.2936 12.2936 12.4237 12.4237 12.6086 12.6086 12.7934 12.7934 13.2250 13.2250 13.3607 13.3607 13.4063 13.4063 13.7021 13.7021 13.9548 13.9548 14.0029 14.0029 14.2788 14.2788 14.3971 14.3971 14.6913 14.6913 14.7183 14.7183 15.1122 15.1122 k = 0.5000-0.4905-0.6755 ( 7772 PWs) bands (ev): 0.5151 0.5151 1.1045 1.1045 1.4888 1.4888 6.7842 6.7842 7.3007 7.3007 8.1816 8.1816 8.4349 8.4349 8.6897 8.6897 9.3018 9.3018 9.9529 9.9529 10.5177 10.5177 10.7039 10.7039 10.7825 10.7825 11.3929 11.3929 11.7526 11.7526 11.8564 11.8564 12.1391 12.1391 12.2877 12.2877 12.3621 12.3621 12.5968 12.5968 12.8152 12.8152 13.2131 13.2131 13.3458 13.3458 13.3967 13.3967 13.7468 13.7468 13.8906 13.8906 13.9874 13.9874 14.2666 14.2666 14.3645 14.3645 14.6937 14.6937 14.7343 14.7343 15.1135 15.1135 k = 0.5000-0.4767-0.6978 ( 7780 PWs) bands (ev): 0.5311 0.5311 1.0878 1.0878 1.4933 1.4933 6.7762 6.7762 7.3039 7.3039 8.1957 8.1957 8.4081 8.4081 8.6934 8.6934 9.3331 9.3331 9.9537 9.9537 10.5546 10.5546 10.7334 10.7334 10.8048 10.8048 11.3951 11.3951 11.7400 11.7400 11.8372 11.8372 12.1860 12.1860 12.2821 12.2821 12.3057 12.3057 12.5841 12.5841 12.8324 12.8324 13.1960 13.1960 13.3337 13.3337 13.3929 13.3929 13.7409 13.7409 13.8749 13.8749 13.9712 13.9712 14.2658 14.2658 14.3356 14.3356 14.6931 14.6931 14.7510 14.7510 15.1223 15.1223 k = 0.5000-0.4628-0.7201 ( 7782 PWs) bands (ev): 0.5479 0.5479 1.0695 1.0695 1.4983 1.4983 6.7680 6.7680 7.3124 7.3124 8.1971 8.1971 8.3900 8.3900 8.6984 8.6984 9.3601 9.3601 9.9525 9.9525 10.5860 10.5860 10.7402 10.7402 10.8597 10.8597 11.3962 11.3962 11.7282 11.7282 11.8190 11.8190 12.2210 12.2210 12.2464 12.2464 12.2943 12.2943 12.5707 12.5707 12.8444 12.8444 13.1760 13.1760 13.3237 13.3237 13.3961 13.3961 13.6768 13.6768 13.9122 13.9122 13.9518 13.9518 14.2735 14.2735 14.3184 14.3184 14.6930 14.6930 14.7695 14.7695 15.1365 15.1365 k = 0.5000-0.4490-0.7424 ( 7788 PWs) bands (ev): 0.5654 0.5654 1.0495 1.0495 1.5040 1.5040 6.7602 6.7602 7.3255 7.3255 8.1817 8.1817 8.3852 8.3852 8.7045 8.7045 9.3819 9.3819 9.9489 9.9489 10.6062 10.6062 10.7524 10.7524 10.9225 10.9225 11.3965 11.3965 11.7171 11.7171 11.8017 11.8017 12.1900 12.1900 12.2465 12.2465 12.3159 12.3159 12.5575 12.5575 12.8504 12.8504 13.1548 13.1548 13.3137 13.3137 13.4070 13.4070 13.6041 13.6041 13.9170 13.9170 13.9599 13.9599 14.2757 14.2757 14.3341 14.3341 14.6964 14.6964 14.7908 14.7908 15.1533 15.1533 k = 0.5000-0.4351-0.7647 ( 7784 PWs) bands (ev): 0.5835 0.5835 1.0278 1.0278 1.5104 1.5104 6.7538 6.7538 7.3422 7.3422 8.1509 8.1509 8.3927 8.3927 8.7114 8.7114 9.3978 9.3978 9.9430 9.9430 10.6131 10.6131 10.7760 10.7760 10.9863 10.9863 11.3964 11.3964 11.7065 11.7065 11.7856 11.7856 12.1460 12.1460 12.2518 12.2518 12.3475 12.3475 12.5460 12.5460 12.8502 12.8502 13.1331 13.1331 13.2989 13.2989 13.4256 13.4256 13.5402 13.5402 13.8816 13.8816 13.9869 13.9869 14.2762 14.2762 14.3840 14.3840 14.7054 14.7054 14.8158 14.8158 15.1704 15.1704 k = 0.5000-0.4213-0.7870 ( 7780 PWs) bands (ev): 0.6020 0.6020 1.0044 1.0044 1.5174 1.5174 6.7495 6.7495 7.3617 7.3617 8.1102 8.1102 8.4077 8.4077 8.7189 8.7189 9.4076 9.4076 9.9351 9.9351 10.6109 10.6109 10.8055 10.8055 11.0487 11.0487 11.3963 11.3963 11.6960 11.6960 11.7714 11.7714 12.1092 12.1092 12.2543 12.2543 12.3762 12.3762 12.5382 12.5382 12.8439 12.8439 13.1102 13.1102 13.2727 13.2727 13.4502 13.4502 13.4961 13.4961 13.8389 13.8389 14.0003 14.0003 14.2867 14.2867 14.4554 14.4554 14.7212 14.7212 14.8446 14.8446 15.1855 15.1855 k = 0.5000-0.4074-0.8093 ( 7786 PWs) bands (ev): 0.6209 0.6209 0.9794 0.9794 1.5253 1.5253 6.7477 6.7477 7.3831 7.3831 8.0640 8.0640 8.4262 8.4262 8.7265 8.7265 9.4111 9.4111 9.9254 9.9254 10.6043 10.6043 10.8333 10.8333 11.1079 11.1079 11.3959 11.3959 11.6855 11.6855 11.7610 11.7610 12.0816 12.0816 12.2572 12.2572 12.3963 12.3963 12.5366 12.5366 12.8324 12.8324 13.0827 13.0827 13.2342 13.2342 13.4741 13.4741 13.4805 13.4805 13.7952 13.7952 14.0019 14.0019 14.3092 14.3092 14.5409 14.5409 14.7443 14.7443 14.8768 14.8768 15.1966 15.1966 k = 0.5000-0.3936-0.8315 ( 7782 PWs) bands (ev): 0.6398 0.6398 0.9526 0.9526 1.5341 1.5341 6.7490 6.7490 7.4057 7.4057 8.0150 8.0150 8.4459 8.4459 8.7340 8.7340 9.4082 9.4082 9.9143 9.9143 10.5960 10.5960 10.8537 10.8537 11.1624 11.1624 11.3937 11.3937 11.6745 11.6745 11.7580 11.7580 12.0645 12.0645 12.2611 12.2611 12.4068 12.4068 12.5416 12.5416 12.8172 12.8172 13.0445 13.0445 13.1944 13.1944 13.4773 13.4773 13.5013 13.5013 13.7592 13.7592 13.9954 13.9954 14.3432 14.3432 14.6341 14.6341 14.7752 14.7752 14.9115 14.9115 15.2024 15.2024 k = 0.5000-0.3797-0.8538 ( 7770 PWs) bands (ev): 0.6587 0.6587 0.9243 0.9243 1.5439 1.5439 6.7537 6.7537 7.4288 7.4288 7.9649 7.9649 8.4655 8.4655 8.7411 8.7411 9.3992 9.3992 9.9021 9.9021 10.5869 10.5869 10.8632 10.8632 11.2108 11.2108 11.3862 11.3862 11.6622 11.6622 11.7673 11.7673 12.0590 12.0590 12.2661 12.2661 12.4110 12.4110 12.5504 12.5504 12.7998 12.7998 12.9919 12.9919 13.1638 13.1638 13.4903 13.4903 13.5100 13.5100 13.7424 13.7424 13.9842 13.9842 14.3876 14.3876 14.7279 14.7279 14.8143 14.8143 14.9487 14.9487 15.2019 15.2019 k = 0.5000-0.3659-0.8761 ( 7764 PWs) bands (ev): 0.6773 0.6773 0.8944 0.8944 1.5548 1.5548 6.7620 6.7620 7.4515 7.4515 7.9149 7.9149 8.4842 8.4842 8.7474 8.7474 9.3846 9.3846 9.8892 9.8892 10.5774 10.5774 10.8606 10.8606 11.2524 11.2524 11.3697 11.3697 11.6478 11.6478 11.7931 11.7931 12.0656 12.0656 12.2717 12.2717 12.4132 12.4132 12.5592 12.5592 12.7821 12.7821 12.9285 12.9285 13.1427 13.1427 13.4923 13.4923 13.5163 13.5163 13.7512 13.7512 13.9711 13.9711 14.4403 14.4403 14.8103 14.8103 14.8633 14.8633 14.9925 14.9925 15.1955 15.1955 k = 0.5000-0.3520-0.8984 ( 7770 PWs) bands (ev): 0.6955 0.6955 0.8629 0.8629 1.5669 1.5669 6.7739 6.7739 7.4733 7.4733 7.8658 7.8658 8.5014 8.5014 8.7528 8.7528 9.3650 9.3650 9.8758 9.8758 10.5676 10.5676 10.8463 10.8463 11.2853 11.2853 11.3438 11.3438 11.6307 11.6307 11.8363 11.8363 12.0837 12.0837 12.2773 12.2773 12.4166 12.4166 12.5651 12.5651 12.7652 12.7652 12.8606 12.8606 13.1269 13.1269 13.4666 13.4666 13.5413 13.5413 13.7784 13.7784 13.9589 13.9589 14.4980 14.4980 14.8697 14.8697 14.9161 14.9161 15.0538 15.0538 15.1862 15.1862 k = 0.5000-0.3382-0.9207 ( 7770 PWs) bands (ev): 0.7131 0.7131 0.8301 0.8301 1.5803 1.5803 6.7895 6.7895 7.4935 7.4935 7.8184 7.8184 8.5168 8.5168 8.7571 8.7571 9.3410 9.3410 9.8621 9.8621 10.5575 10.5575 10.8220 10.8220 11.2890 11.2890 11.3301 11.3301 11.6104 11.6104 11.8944 11.8944 12.1114 12.1114 12.2819 12.2819 12.4233 12.4233 12.5668 12.5668 12.7491 12.7491 12.7938 12.7938 13.1134 13.1134 13.4369 13.4369 13.5698 13.5698 13.8134 13.8134 13.9499 13.9499 14.5548 14.5548 14.9030 14.9030 14.9667 14.9667 15.1251 15.1251 15.1878 15.1878 k = 0.8070-0.2346-0.7112 ( 7770 PWs) bands (ev): 0.7131 0.7131 0.8301 0.8301 1.5803 1.5803 6.7895 6.7895 7.4935 7.4935 7.8184 7.8184 8.5168 8.5168 8.7571 8.7571 9.3410 9.3410 9.8621 9.8621 10.5575 10.5575 10.8220 10.8220 11.2890 11.2890 11.3301 11.3301 11.6104 11.6104 11.8944 11.8944 12.1114 12.1114 12.2819 12.2819 12.4233 12.4233 12.5668 12.5668 12.7491 12.7491 12.7938 12.7938 13.1134 13.1134 13.4369 13.4369 13.5698 13.5698 13.8134 13.8134 13.9499 13.9499 14.5548 14.5548 14.9030 14.9030 14.9667 14.9667 15.1251 15.1251 15.1878 15.1878 k = 0.7987-0.2237-0.6891 ( 7784 PWs) bands (ev): 0.7296 0.7296 0.7963 0.7963 1.5949 1.5949 6.8085 6.8085 7.5112 7.5112 7.7741 7.7741 8.5296 8.5296 8.7600 8.7600 9.3138 9.3138 9.8484 9.8484 10.5472 10.5472 10.7899 10.7899 11.2472 11.2472 11.3482 11.3482 11.5875 11.5875 11.9621 11.9621 12.1455 12.1455 12.2845 12.2845 12.4346 12.4346 12.5638 12.5638 12.7162 12.7162 12.7502 12.7502 13.1008 13.1008 13.4114 13.4114 13.5984 13.5984 13.8491 13.8491 13.9466 13.9466 14.6023 14.6023 14.9084 14.9084 15.0244 15.0244 15.1381 15.1381 15.2404 15.2404 k = 0.7904-0.2128-0.6670 ( 7782 PWs) bands (ev): 0.7452 0.7452 0.7614 0.7614 1.6110 1.6110 6.8308 6.8308 7.5257 7.5257 7.7329 7.7329 8.5397 8.5397 8.7618 8.7618 9.2839 9.2839 9.8345 9.8345 10.5365 10.5365 10.7519 10.7519 11.1941 11.1941 11.3660 11.3660 11.5628 11.5628 12.0353 12.0353 12.1823 12.1823 12.2839 12.2839 12.4512 12.4512 12.5567 12.5567 12.6571 12.6571 12.7415 12.7415 13.0884 13.0884 13.3935 13.3935 13.6256 13.6256 13.8822 13.8822 13.9509 13.9509 14.6327 14.6327 14.8947 14.8947 15.0834 15.0834 15.1149 15.1149 15.2425 15.2425 k = 0.7822-0.2019-0.6450 ( 7780 PWs) bands (ev): 0.7254 0.7254 0.7596 0.7596 1.6286 1.6286 6.8563 6.8563 7.5362 7.5362 7.6961 7.6961 8.5465 8.5465 8.7622 8.7622 9.2523 9.2523 9.8202 9.8202 10.5250 10.5250 10.7101 10.7101 11.1362 11.1362 11.3776 11.3776 11.5391 11.5391 12.1089 12.1089 12.2170 12.2170 12.2789 12.2789 12.4739 12.4739 12.5471 12.5471 12.6000 12.6000 12.7426 12.7426 13.0765 13.0765 13.3855 13.3855 13.6499 13.6499 13.9107 13.9107 13.9632 13.9632 14.6417 14.6417 14.8688 14.8688 15.0634 15.0634 15.1518 15.1518 15.2746 15.2746 k = 0.7739-0.1910-0.6229 ( 7782 PWs) bands (ev): 0.6885 0.6885 0.7726 0.7726 1.6480 1.6480 6.8846 6.8846 7.5412 7.5412 7.6648 7.6648 8.5495 8.5495 8.7617 8.7617 9.2199 9.2199 9.8054 9.8054 10.5118 10.5118 10.6669 10.6669 11.0758 11.0758 11.3777 11.3777 11.5222 11.5222 12.1770 12.1770 12.2439 12.2439 12.2693 12.2693 12.5000 12.5000 12.5361 12.5361 12.5545 12.5545 12.7522 12.7522 13.0659 13.0659 13.3888 13.3888 13.6711 13.6711 13.9331 13.9331 13.9821 13.9821 14.6309 14.6309 14.8358 14.8358 15.0223 15.0223 15.1874 15.1874 15.3312 15.3312 k = 0.7656-0.1801-0.6009 ( 7788 PWs) bands (ev): 0.6508 0.6508 0.7841 0.7841 1.6690 1.6690 6.9153 6.9153 7.5394 7.5394 7.6408 7.6408 8.5480 8.5480 8.7600 8.7600 9.1877 9.1877 9.7898 9.7898 10.4948 10.4948 10.6255 10.6255 11.0147 11.0147 11.3608 11.3608 11.5180 11.5180 12.2277 12.2277 12.2509 12.2509 12.2667 12.2667 12.4961 12.4961 12.5228 12.5228 12.5608 12.5608 12.7705 12.7705 13.0582 13.0582 13.4042 13.4042 13.6905 13.6905 13.9476 13.9476 14.0047 14.0047 14.6052 14.6052 14.8007 14.8007 14.9886 14.9886 15.1782 15.1782 15.3947 15.3947 k = 0.7573-0.1692-0.5788 ( 7780 PWs) bands (ev): 0.6125 0.6125 0.7940 0.7940 1.6918 1.6918 6.9480 6.9480 7.5304 7.5304 7.6244 7.6244 8.5418 8.5418 8.7573 8.7573 9.1570 9.1570 9.7728 9.7728 10.4703 10.4703 10.5910 10.5910 10.9543 10.9543 11.3279 11.3279 11.5259 11.5259 12.2174 12.2174 12.2521 12.2521 12.2929 12.2929 12.4662 12.4662 12.5215 12.5215 12.6036 12.6036 12.7961 12.7961 13.0561 13.0561 13.4329 13.4329 13.7099 13.7099 13.9521 13.9521 14.0272 14.0272 14.5692 14.5692 14.7692 14.7692 14.9648 14.9648 15.1275 15.1275 15.4610 15.4610 k = 0.7490-0.1583-0.5568 ( 7780 PWs) bands (ev): 0.5736 0.5736 0.8022 0.8022 1.7163 1.7163 6.9823 6.9823 7.5165 7.5165 7.6137 7.6137 8.5304 8.5304 8.7531 8.7531 9.1288 9.1288 9.7542 9.7542 10.4353 10.4353 10.5672 10.5672 10.8958 10.8958 11.2845 11.2845 11.5405 11.5405 12.1848 12.1848 12.2351 12.2351 12.3224 12.3224 12.4420 12.4420 12.5260 12.5260 12.6543 12.6543 12.8243 12.8243 13.0637 13.0637 13.4759 13.4759 13.7312 13.7312 13.9460 13.9460 14.0445 14.0445 14.5263 14.5263 14.7470 14.7470 14.9431 14.9431 15.0649 15.0649 15.5264 15.5264 k = 0.7407-0.1474-0.5347 ( 7788 PWs) bands (ev): 0.5344 0.5344 0.8087 0.8087 1.7426 1.7426 7.0173 7.0173 7.5012 7.5012 7.6052 7.6052 8.5139 8.5139 8.7468 8.7468 9.1047 9.1047 9.7333 9.7333 10.3916 10.3916 10.5536 10.5536 10.8400 10.8400 11.2346 11.2346 11.5574 11.5574 12.1445 12.1445 12.2074 12.2074 12.3407 12.3407 12.4210 12.4210 12.5375 12.5375 12.7046 12.7046 12.8484 12.8484 13.0857 13.0857 13.5339 13.5339 13.7560 13.7560 13.9302 13.9302 14.0518 14.0518 14.4786 14.4786 14.7393 14.7393 14.8932 14.8932 15.0344 15.0344 15.5248 15.5248 k = 0.7324-0.1365-0.5127 ( 7784 PWs) bands (ev): 0.4950 0.4950 0.8133 0.8133 1.7705 1.7705 7.0524 7.0524 7.4871 7.4871 7.5969 7.5969 8.4926 8.4926 8.7376 8.7376 9.0857 9.0857 9.7097 9.7097 10.3435 10.3435 10.5468 10.5468 10.7874 10.7874 11.1804 11.1804 11.5739 11.5739 12.0985 12.0985 12.1763 12.1763 12.3492 12.3492 12.3997 12.3997 12.5550 12.5550 12.7494 12.7494 12.8636 12.8636 13.1243 13.1243 13.6070 13.6070 13.7852 13.7852 13.9066 13.9066 14.0472 14.0472 14.4273 14.4273 14.7468 14.7468 14.8105 14.8105 15.0481 15.0481 15.4747 15.4747 k = 0.7241-0.1256-0.4906 ( 7782 PWs) bands (ev): 0.4556 0.4556 0.8163 0.8163 1.8001 1.8001 7.0869 7.0869 7.4756 7.4756 7.5879 7.5879 8.4669 8.4669 8.7248 8.7248 9.0729 9.0729 9.6826 9.6826 10.2946 10.2946 10.5444 10.5444 10.7385 10.7385 11.1233 11.1233 11.5875 11.5875 12.0484 12.0484 12.1463 12.1463 12.3502 12.3502 12.3764 12.3764 12.5759 12.5759 12.7859 12.7859 12.8700 12.8700 13.1762 13.1762 13.6940 13.6940 13.8188 13.8188 13.8784 13.8784 14.0330 14.0330 14.3733 14.3733 14.7053 14.7053 14.7821 14.7821 15.0840 15.0840 15.4081 15.4081 k = 0.7158-0.1147-0.4686 ( 7784 PWs) bands (ev): 0.4162 0.4162 0.8175 0.8175 1.8312 1.8312 7.1197 7.1197 7.4672 7.4672 7.5781 7.5781 8.4374 8.4374 8.7083 8.7083 9.0666 9.0666 9.6517 9.6517 10.2474 10.2474 10.5448 10.5448 10.6933 10.6933 11.0643 11.0643 11.5962 11.5962 11.9951 11.9951 12.1206 12.1206 12.3418 12.3418 12.3548 12.3548 12.5975 12.5975 12.8136 12.8136 12.8707 12.8707 13.2350 13.2350 13.7903 13.7903 13.8393 13.8393 13.8666 13.8666 14.0162 14.0162 14.3168 14.3168 14.6103 14.6103 14.8186 14.8186 15.1306 15.1306 15.3365 15.3365 k = 0.7075-0.1038-0.4465 ( 7776 PWs) bands (ev): 0.3771 0.3771 0.8171 0.8171 1.8637 1.8637 7.1499 7.1499 7.4618 7.4618 7.5681 7.5681 8.4046 8.4046 8.6884 8.6884 9.0667 9.0667 9.6166 9.6166 10.2037 10.2037 10.5471 10.5471 10.6519 10.6519 11.0040 11.0040 11.5981 11.5981 11.9395 11.9395 12.1010 12.1010 12.3156 12.3156 12.3448 12.3448 12.6166 12.6166 12.8335 12.8335 12.8690 12.8690 13.2944 13.2944 13.8050 13.8050 13.8823 13.8823 13.9193 13.9193 14.0093 14.0093 14.2583 14.2583 14.5181 14.5181 14.8601 14.8601 15.1715 15.1715 15.2809 15.2809 k = 0.6992-0.0929-0.4245 ( 7778 PWs) bands (ev): 0.3383 0.3383 0.8151 0.8151 1.8975 1.8975 7.1764 7.1764 7.4592 7.4592 7.5589 7.5589 8.3690 8.3690 8.6662 8.6662 9.0723 9.0723 9.5774 9.5774 10.1649 10.1649 10.5493 10.5493 10.6150 10.6150 10.9433 10.9433 11.5921 11.5921 11.8824 11.8824 12.0883 12.0883 12.2832 12.2832 12.3358 12.3358 12.6298 12.6298 12.8466 12.8466 12.8687 12.8687 13.3482 13.3482 13.7720 13.7720 13.9144 13.9144 14.0110 14.0110 14.0388 14.0388 14.2019 14.2019 14.4344 14.4344 14.8889 14.8889 15.1666 15.1666 15.2950 15.2950 k = 0.6909-0.0820-0.4024 ( 7784 PWs) bands (ev): 0.3001 0.3001 0.8117 0.8117 1.9323 1.9323 7.1981 7.1981 7.4585 7.4585 7.5519 7.5519 8.3312 8.3312 8.6429 8.6429 9.0823 9.0823 9.5347 9.5347 10.1317 10.1317 10.5456 10.5456 10.5875 10.5875 10.8828 10.8828 11.5781 11.5781 11.8243 11.8243 12.0817 12.0817 12.2481 12.2481 12.3255 12.3255 12.6332 12.6332 12.8516 12.8516 12.8769 12.8769 13.3907 13.3907 13.7381 13.7381 13.9326 13.9326 14.0646 14.0646 14.0877 14.0877 14.2004 14.2004 14.3627 14.3627 14.8796 14.8796 15.1630 15.1630 15.3550 15.3550 k = 0.6826-0.0711-0.3804 ( 7782 PWs) bands (ev): 0.2625 0.2625 0.8069 0.8069 1.9681 1.9681 7.2139 7.2139 7.4588 7.4588 7.5487 7.5487 8.2916 8.2916 8.6197 8.6197 9.0950 9.0950 9.4900 9.4900 10.1045 10.1045 10.5248 10.5248 10.5789 10.5789 10.8236 10.8236 11.5568 11.5568 11.7657 11.7657 12.0795 12.0795 12.2112 12.2112 12.3138 12.3138 12.6237 12.6237 12.8526 12.8526 12.8943 12.8943 13.4181 13.4181 13.7033 13.7033 13.9582 13.9582 14.0348 14.0348 14.1269 14.1269 14.2775 14.2775 14.3340 14.3340 14.8299 14.8299 15.1993 15.1993 15.4237 15.4237 k = 0.6743-0.0602-0.3583 ( 7786 PWs) bands (ev): 0.2256 0.2256 0.8010 0.8010 2.0046 2.0046 7.2229 7.2229 7.4596 7.4596 7.5500 7.5500 8.2508 8.2508 8.5976 8.5976 9.1080 9.1080 9.4460 9.4460 10.0831 10.0831 10.4944 10.4944 10.5793 10.5793 10.7676 10.7676 11.5299 11.5299 11.7069 11.7069 12.0789 12.0789 12.1731 12.1731 12.3008 12.3008 12.6008 12.6008 12.8556 12.8556 12.9180 12.9180 13.4305 13.4305 13.6658 13.6658 13.9675 13.9675 14.0000 14.0000 14.1877 14.1877 14.2418 14.2418 14.4493 14.4493 14.7675 14.7675 15.2589 15.2589 15.4929 15.4929 k = 0.6660-0.0493-0.3363 ( 7784 PWs) bands (ev): 0.1897 0.1897 0.7940 0.7940 2.0416 2.0416 7.2247 7.2247 7.4607 7.4607 7.5559 7.5559 8.2094 8.2094 8.5777 8.5777 9.1173 9.1173 9.4071 9.4071 10.0672 10.0672 10.4623 10.4623 10.5761 10.5761 10.7190 10.7190 11.4988 11.4988 11.6482 11.6482 12.0768 12.0768 12.1352 12.1352 12.2867 12.2867 12.5662 12.5662 12.8632 12.8632 12.9461 12.9461 13.4316 13.4316 13.6227 13.6227 13.9086 13.9086 14.0429 14.0429 14.2001 14.2001 14.2466 14.2466 14.5799 14.5799 14.7190 14.7190 15.3279 15.3279 15.5594 15.5594 k = 0.6577-0.0384-0.3142 ( 7800 PWs) bands (ev): 0.1548 0.1548 0.7862 0.7862 2.0790 2.0790 7.2194 7.2194 7.4623 7.4623 7.5655 7.5655 8.1683 8.1683 8.5603 8.5603 9.1168 9.1168 9.3804 9.3804 10.0561 10.0561 10.4298 10.4298 10.5594 10.5594 10.6861 10.6861 11.4649 11.4649 11.5901 11.5901 12.0681 12.0681 12.1014 12.1014 12.2714 12.2714 12.5225 12.5225 12.8768 12.8768 12.9769 12.9769 13.4257 13.4257 13.5720 13.5720 13.8568 13.8568 14.0755 14.0755 14.1707 14.1707 14.2936 14.2936 14.6805 14.6805 14.7349 14.7349 15.4003 15.4003 15.6214 15.6214 k = 0.6494-0.0275-0.2922 ( 7804 PWs) bands (ev): 0.1211 0.1211 0.7776 0.7776 2.1165 2.1165 7.2081 7.2081 7.4638 7.4638 7.5779 7.5779 8.1283 8.1283 8.5458 8.5458 9.1003 9.1003 9.3724 9.3724 10.0492 10.0492 10.3972 10.3972 10.5238 10.5238 10.6734 10.6734 11.4292 11.4292 11.5327 11.5327 12.0428 12.0428 12.0813 12.0813 12.2548 12.2548 12.4726 12.4726 12.8968 12.8968 13.0087 13.0087 13.4162 13.4162 13.5139 13.5139 13.8145 13.8145 14.0722 14.0722 14.1495 14.1495 14.3434 14.3434 14.7202 14.7202 14.8545 14.8545 15.4737 15.4737 15.6791 15.6791 k = 0.6411-0.0166-0.2701 ( 7806 PWs) bands (ev): 0.0885 0.0885 0.7685 0.7685 2.1540 2.1540 7.1919 7.1919 7.4645 7.4645 7.5919 7.5919 8.0908 8.0908 8.5343 8.5343 9.0678 9.0678 9.3840 9.3840 10.0458 10.0458 10.3645 10.3645 10.4766 10.4766 10.6734 10.6734 11.3927 11.3927 11.4765 11.4765 12.0075 12.0075 12.0690 12.0690 12.2367 12.2367 12.4192 12.4192 12.9231 12.9231 13.0394 13.0394 13.4041 13.4041 13.4522 13.4522 13.7801 13.7801 14.0284 14.0284 14.1335 14.1335 14.4090 14.4090 14.7873 14.7873 14.9784 14.9784 15.5468 15.5468 15.7331 15.7331 k = 0.6328-0.0057-0.2481 ( 7800 PWs) bands (ev): 0.0573 0.0573 0.7589 0.7589 2.1911 2.1911 7.1722 7.1722 7.4633 7.4633 7.6059 7.6059 8.0577 8.0577 8.5256 8.5256 9.0243 9.0243 9.4101 9.4101 10.0452 10.0452 10.3319 10.3319 10.4251 10.4251 10.6784 10.6784 11.3557 11.3557 11.4215 11.4215 11.9713 11.9713 12.0565 12.0565 12.2162 12.2162 12.3650 12.3650 12.9549 12.9549 13.0668 13.0668 13.3767 13.3767 13.4050 13.4050 13.7510 13.7510 13.9573 13.9573 14.1250 14.1250 14.4870 14.4870 14.8760 14.8760 15.0941 15.0941 15.6194 15.6194 15.7796 15.7796 k = 0.6245 0.0052-0.2260 ( 7808 PWs) bands (ev): 0.0276 0.0276 0.7491 0.7491 2.2276 2.2276 7.1502 7.1502 7.4598 7.4598 7.6180 7.6180 8.0311 8.0311 8.5194 8.5194 8.9754 8.9754 9.4454 9.4454 10.0465 10.0465 10.3000 10.3000 10.3729 10.3729 10.6846 10.6846 11.3186 11.3186 11.3683 11.3683 11.9367 11.9367 12.0432 12.0432 12.1917 12.1917 12.3135 12.3135 12.9908 12.9908 13.0862 13.0862 13.3227 13.3227 13.3899 13.3899 13.7255 13.7255 13.8728 13.8728 14.1245 14.1245 14.5707 14.5707 14.9770 14.9770 15.1971 15.1971 15.6917 15.6917 15.8072 15.8072 k = 0.6162 0.0161-0.2039 ( 7814 PWs) bands (ev): -0.0007 -0.0007 0.7391 0.7391 2.2634 2.2634 7.1268 7.1268 7.4538 7.4538 7.6258 7.6258 8.0137 8.0137 8.5152 8.5152 8.9248 8.9248 9.4860 9.4860 10.0488 10.0488 10.2697 10.2697 10.3216 10.3216 10.6905 10.6905 11.2814 11.2814 11.3169 11.3169 11.9045 11.9045 12.0300 12.0300 12.1605 12.1605 12.2689 12.2689 13.0288 13.0288 13.0891 13.0891 13.2793 13.2793 13.3791 13.3791 13.7026 13.7026 13.7844 13.7844 14.1307 14.1307 14.6557 14.6557 15.0845 15.0845 15.2832 15.2832 15.7645 15.7645 15.8154 15.8154 k = 0.6079 0.0270-0.1819 ( 7800 PWs) bands (ev): -0.0273 -0.0273 0.7292 0.7292 2.2981 2.2981 7.1028 7.1028 7.4455 7.4455 7.6268 7.6268 8.0076 8.0076 8.5128 8.5128 8.8746 8.8746 9.5291 9.5291 10.0504 10.0504 10.2425 10.2425 10.2720 10.2720 10.6952 10.6952 11.2442 11.2442 11.2680 11.2680 11.8755 11.8755 12.0179 12.0179 12.1209 12.1209 12.2342 12.2342 13.0589 13.0589 13.0738 13.0738 13.2598 13.2598 13.3686 13.3686 13.6794 13.6794 13.7009 13.7009 14.1424 14.1424 14.7390 14.7390 15.1945 15.1945 15.3485 15.3485 15.8171 15.8171 15.8413 15.8413 k = 0.5996 0.0379-0.1598 ( 7814 PWs) bands (ev): -0.0523 -0.0523 0.7194 0.7194 2.3316 2.3316 7.0787 7.0787 7.4352 7.4352 7.6204 7.6204 8.0135 8.0135 8.5116 8.5116 8.8264 8.8264 9.5724 9.5724 10.0496 10.0496 10.2184 10.2184 10.2273 10.2273 10.6983 10.6983 11.2063 11.2063 11.2223 11.2223 11.8496 11.8496 12.0078 12.0078 12.0753 12.0753 12.2082 12.2082 13.0185 13.0185 13.1037 13.1037 13.2595 13.2595 13.3575 13.3575 13.6174 13.6174 13.6673 13.6673 14.1585 14.1585 14.8186 14.8186 15.3030 15.3030 15.3909 15.3909 15.8285 15.8285 15.9196 15.9196 k = 0.5913 0.0488-0.1378 ( 7820 PWs) bands (ev): -0.0755 -0.0755 0.7099 0.7099 2.3636 2.3636 7.0551 7.0551 7.4233 7.4233 7.6072 7.6072 8.0304 8.0304 8.5110 8.5110 8.7813 8.7813 9.6133 9.6133 10.0446 10.0446 10.1776 10.1776 10.2105 10.2105 10.6996 10.6996 11.1672 11.1672 11.1808 11.1808 11.8270 11.8270 11.9995 11.9995 12.0288 12.0288 12.1878 12.1878 12.9641 12.9641 13.1287 13.1287 13.2643 13.2643 13.3469 13.3469 13.5553 13.5553 13.6521 13.6521 14.1778 14.1778 14.8929 14.8929 15.3938 15.3938 15.4246 15.4246 15.8512 15.8512 16.0048 16.0048 k = 0.5830 0.0597-0.1157 ( 7822 PWs) bands (ev): -0.0969 -0.0969 0.7008 0.7008 2.3939 2.3939 7.0322 7.0322 7.4103 7.4103 7.5896 7.5896 8.0556 8.0556 8.5105 8.5105 8.7405 8.7405 9.6488 9.6488 10.0359 10.0359 10.1354 10.1354 10.2082 10.2082 10.6992 10.6992 11.1275 11.1275 11.1431 11.1431 11.8073 11.8073 11.9751 11.9751 12.0029 12.0029 12.1708 12.1708 12.9079 12.9079 13.1318 13.1318 13.2691 13.2691 13.3417 13.3417 13.5140 13.5140 13.6405 13.6405 14.1995 14.1995 14.9604 14.9604 15.4036 15.4036 15.5149 15.5149 15.8850 15.8850 16.0985 16.0985 k = 0.5747 0.0706-0.0937 ( 7834 PWs) bands (ev): -0.1164 -0.1164 0.6923 0.6923 2.4221 2.4221 7.0105 7.0105 7.3965 7.3965 7.5696 7.5696 8.0864 8.0864 8.5092 8.5092 8.7053 8.7053 9.6754 9.6754 10.0268 10.0268 10.0960 10.0960 10.2154 10.2154 10.6973 10.6973 11.0893 11.0893 11.1076 11.1076 11.7902 11.7902 11.9319 11.9319 12.0023 12.0023 12.1562 12.1562 12.8532 12.8532 13.1018 13.1018 13.2798 13.2798 13.3433 13.3433 13.4938 13.4938 13.6326 13.6326 14.2226 14.2226 15.0204 15.0204 15.3918 15.3918 15.6071 15.6071 15.9257 15.9257 16.2017 16.2017 k = 0.5664 0.0815-0.0716 ( 7836 PWs) bands (ev): -0.1341 -0.1341 0.6843 0.6843 2.4481 2.4481 6.9903 6.9903 7.3825 7.3825 7.5493 7.5493 8.1201 8.1201 8.5058 8.5058 8.6772 8.6772 9.6897 9.6897 10.0219 10.0219 10.0600 10.0600 10.2300 10.2300 10.6942 10.6942 11.0538 11.0538 11.0737 11.0737 11.7756 11.7756 11.8906 11.8906 12.0072 12.0072 12.1434 12.1434 12.8020 12.8020 13.0476 13.0476 13.2962 13.2962 13.3475 13.3475 13.4890 13.4890 13.6284 13.6284 14.2463 14.2463 15.0720 15.0720 15.3724 15.3724 15.6915 15.6915 15.9693 15.9693 16.3146 16.3146 k = 0.5581 0.0924-0.0496 ( 7828 PWs) bands (ev): -0.1497 -0.1497 0.6771 0.6771 2.4717 2.4717 6.9717 6.9717 7.3687 7.3687 7.5298 7.5298 8.1546 8.1546 8.4991 8.4991 8.6578 8.6578 9.6904 9.6904 10.0235 10.0235 10.0281 10.0281 10.2500 10.2500 10.6902 10.6902 11.0215 11.0215 11.0414 11.0414 11.7630 11.7630 11.8530 11.8530 12.0159 12.0159 12.1322 12.1322 12.7552 12.7552 12.9834 12.9834 13.3129 13.3129 13.3511 13.3511 13.4933 13.4933 13.6282 13.6282 14.2699 14.2699 15.1153 15.1153 15.3500 15.3500 15.7674 15.7674 16.0126 16.0126 16.4358 16.4358 k = 0.5498 0.1033-0.0275 ( 7838 PWs) bands (ev): -0.1634 -0.1634 0.6706 0.6706 2.4926 2.4926 6.9551 6.9551 7.3556 7.3556 7.5122 7.5122 8.1881 8.1881 8.4885 8.4885 8.6477 8.6477 9.6792 9.6792 9.9988 9.9988 10.0327 10.0327 10.2735 10.2735 10.6858 10.6858 10.9927 10.9927 11.0110 11.0110 11.7524 11.7524 11.8198 11.8198 12.0274 12.0274 12.1228 12.1228 12.7136 12.7136 12.9178 12.9178 13.3269 13.3269 13.3535 13.3535 13.5016 13.5016 13.6316 13.6316 14.2926 14.2926 15.1502 15.1502 15.3273 15.3273 15.8349 15.8349 16.0535 16.0535 16.5629 16.5629 k = 0.5415 0.1142-0.0055 ( 7840 PWs) bands (ev): -0.1750 -0.1750 0.6651 0.6651 2.5107 2.5107 6.9406 6.9406 7.3435 7.3435 7.4970 7.4970 8.2189 8.2189 8.4748 8.4748 8.6457 8.6457 9.6603 9.6603 9.9744 9.9744 10.0448 10.0448 10.2988 10.2988 10.6812 10.6812 10.9677 10.9677 10.9831 10.9831 11.7437 11.7437 11.7914 11.7914 12.0407 12.0407 12.1149 12.1149 12.6776 12.6776 12.8556 12.8556 13.3379 13.3379 13.3548 13.3548 13.5108 13.5108 13.6380 13.6380 14.3136 14.3136 15.1772 15.1772 15.3064 15.3064 15.8937 15.8937 16.0902 16.0902 16.6923 16.6923 k = 0.5332 0.1251 0.0166 ( 7840 PWs) bands (ev): -0.1845 -0.1845 0.6604 0.6604 2.5257 2.5257 6.9285 6.9285 7.3329 7.3329 7.4843 7.4843 8.2461 8.2461 8.4601 8.4601 8.6495 8.6495 9.6380 9.6380 9.9541 9.9541 10.0576 10.0576 10.3242 10.3242 10.6768 10.6768 10.9468 10.9468 10.9581 10.9581 11.7367 11.7367 11.7679 11.7679 12.0542 12.0542 12.1090 12.1090 12.6478 12.6478 12.7999 12.7999 13.3458 13.3458 13.3556 13.3556 13.5190 13.5190 13.6460 13.6460 14.3321 14.3321 15.1965 15.1965 15.2890 15.2890 15.9435 15.9435 16.1215 16.1215 16.8153 16.8153 k = 0.5249 0.1360 0.0386 ( 7836 PWs) bands (ev): -0.1920 -0.1920 0.6568 0.6568 2.5376 2.5376 6.9188 6.9188 7.3243 7.3243 7.4745 7.4745 8.2685 8.2685 8.4461 8.4461 8.6561 8.6561 9.6163 9.6163 9.9382 9.9382 10.0690 10.0690 10.3474 10.3474 10.6728 10.6728 10.9302 10.9302 10.9372 10.9372 11.7312 11.7312 11.7496 11.7496 12.0664 12.0664 12.1053 12.1053 12.6243 12.6243 12.7531 12.7531 13.3514 13.3514 13.3559 13.3559 13.5254 13.5254 13.6543 13.6543 14.3474 14.3474 15.2082 15.2082 15.2768 15.2768 15.9835 15.9835 16.1466 16.1466 16.8636 16.8636 k = 0.5166 0.1469 0.0607 ( 7846 PWs) bands (ev): -0.1973 -0.1973 0.6541 0.6541 2.5462 2.5462 6.9119 6.9119 7.3179 7.3179 7.4674 7.4674 8.2856 8.2856 8.4344 8.4344 8.6632 8.6632 9.5983 9.5983 9.9268 9.9268 10.0777 10.0777 10.3662 10.3662 10.6697 10.6697 10.9180 10.9180 10.9212 10.9212 11.7271 11.7271 11.7368 11.7368 12.0751 12.0751 12.1043 12.1043 12.6074 12.6074 12.7175 12.7175 13.3549 13.3549 13.3561 13.3561 13.5299 13.5299 13.6613 13.6613 14.3588 14.3588 15.2132 15.2132 15.2704 15.2704 16.0129 16.0129 16.1649 16.1649 16.8711 16.8711 k = 0.5083 0.1578 0.0827 ( 7844 PWs) bands (ev): -0.2005 -0.2005 0.6525 0.6525 2.5513 2.5513 6.9076 6.9076 7.3139 7.3139 7.4632 7.4632 8.2965 8.2965 8.4265 8.4265 8.6684 8.6684 9.5866 9.5866 9.9199 9.9199 10.0832 10.0832 10.3785 10.3785 10.6677 10.6677 10.9098 10.9098 10.9119 10.9119 11.7239 11.7239 11.7299 11.7299 12.0795 12.0795 12.1053 12.1053 12.5973 12.5973 12.6951 12.6951 13.3560 13.3560 13.3571 13.3571 13.5326 13.5326 13.6659 13.6659 14.3659 14.3659 15.2140 15.2140 15.2683 15.2683 16.0310 16.0310 16.1760 16.1760 16.8744 16.8744 k = 0.5000 0.1687 0.1048 ( 7840 PWs) bands (ev): -0.2016 -0.2016 0.6520 0.6520 2.5531 2.5531 6.9062 6.9062 7.3126 7.3126 7.4617 7.4617 8.3003 8.3003 8.4237 8.4237 8.6703 8.6703 9.5825 9.5825 9.9177 9.9177 10.0850 10.0850 10.3828 10.3828 10.6670 10.6670 10.9066 10.9066 10.9092 10.9092 11.7224 11.7224 11.7280 11.7280 12.0806 12.0806 12.1061 12.1061 12.5939 12.5939 12.6875 12.6875 13.3560 13.3560 13.3577 13.3577 13.5334 13.5334 13.6675 13.6675 14.3683 14.3683 15.2138 15.2138 15.2679 15.2679 16.0371 16.0371 16.1797 16.1797 16.8754 16.8754 k = 0.5000 0.1687 0.1048 ( 7840 PWs) bands (ev): -0.2016 -0.2016 0.6520 0.6520 2.5531 2.5531 6.9062 6.9062 7.3126 7.3126 7.4617 7.4617 8.3003 8.3003 8.4237 8.4237 8.6703 8.6703 9.5825 9.5825 9.9177 9.9177 10.0850 10.0850 10.3828 10.3828 10.6670 10.6670 10.9066 10.9066 10.9092 10.9092 11.7224 11.7224 11.7280 11.7280 12.0806 12.0806 12.1061 12.1061 12.5939 12.5939 12.6875 12.6875 13.3560 13.3560 13.3577 13.3577 13.5334 13.5334 13.6675 13.6675 14.3683 14.3683 15.2138 15.2138 15.2679 15.2679 16.0371 16.0371 16.1797 16.1797 16.8754 16.8754 k = 0.4762 0.1606 0.0998 ( 7840 PWs) bands (ev): -0.2032 -0.2032 0.6552 0.6552 2.5507 2.5507 6.9078 6.9078 7.3131 7.3131 7.4620 7.4620 8.2993 8.2993 8.4238 8.4238 8.6691 8.6691 9.5706 9.5706 9.9265 9.9265 10.0848 10.0848 10.3834 10.3834 10.6776 10.6776 10.9073 10.9073 10.9099 10.9099 11.7216 11.7216 11.7273 11.7273 12.0832 12.0832 12.1088 12.1088 12.5089 12.5089 12.7694 12.7694 13.3290 13.3290 13.3417 13.3417 13.5598 13.5598 13.6825 13.6825 14.3591 14.3591 15.2168 15.2168 15.2711 15.2711 16.0501 16.0501 16.1755 16.1755 16.8723 16.8723 k = 0.4524 0.1526 0.0948 ( 7840 PWs) bands (ev): -0.2081 -0.2081 0.6649 0.6649 2.5436 2.5436 6.9125 6.9125 7.3146 7.3146 7.4628 7.4628 8.2963 8.2963 8.4241 8.4241 8.6657 8.6657 9.5383 9.5383 9.9495 9.9495 10.0850 10.0850 10.3852 10.3852 10.7085 10.7085 10.9094 10.9094 10.9123 10.9123 11.7193 11.7193 11.7250 11.7250 12.0908 12.0908 12.1167 12.1167 12.3892 12.3892 12.8792 12.8792 13.2718 13.2718 13.3008 13.3008 13.6153 13.6153 13.7204 13.7204 14.3335 14.3335 15.2256 15.2256 15.2803 15.2803 16.0806 16.0806 16.1703 16.1703 16.8629 16.8629 k = 0.4286 0.1446 0.0898 ( 7839 PWs) bands (ev): -0.2159 -0.2159 0.6807 0.6807 2.5318 2.5318 6.9202 6.9202 7.3171 7.3171 7.4642 7.4642 8.2915 8.2915 8.4248 8.4248 8.6601 8.6601 9.4918 9.4918 9.9791 9.9791 10.0891 10.0891 10.3882 10.3882 10.7572 10.7572 10.9130 10.9130 10.9163 10.9163 11.7156 11.7156 11.7213 11.7213 12.1025 12.1025 12.1293 12.1293 12.2678 12.2678 12.9814 12.9814 13.2062 13.2062 13.2464 13.2464 13.6789 13.6789 13.7703 13.7703 14.2977 14.2977 15.2399 15.2399 15.2952 15.2952 16.0870 16.0870 16.2018 16.2018 16.8476 16.8476 k = 0.4048 0.1365 0.0848 ( 7839 PWs) bands (ev): -0.2262 -0.2262 0.7021 0.7021 2.5156 2.5156 6.9307 6.9307 7.3206 7.3206 7.4660 7.4660 8.2851 8.2851 8.4262 8.4262 8.6525 8.6525 9.4362 9.4362 10.0058 10.0058 10.1037 10.1037 10.3919 10.3919 10.8206 10.8206 10.9185 10.9185 10.9224 10.9224 11.7106 11.7106 11.7163 11.7163 12.1101 12.1101 12.1460 12.1460 12.1555 12.1555 13.0651 13.0651 13.1426 13.1426 13.1859 13.1859 13.7442 13.7442 13.8254 13.8254 14.2602 14.2602 15.2588 15.2588 15.3150 15.3150 16.0542 16.0542 16.2809 16.2809 16.8272 16.8272 k = 0.3810 0.1285 0.0798 ( 7830 PWs) bands (ev): -0.2386 -0.2386 0.7287 0.7287 2.4950 2.4950 6.9436 6.9436 7.3250 7.3250 7.4683 7.4683 8.2772 8.2772 8.4286 8.4286 8.6431 8.6431 9.3753 9.3753 10.0217 10.0217 10.1350 10.1350 10.3963 10.3963 10.8957 10.8957 10.9259 10.9259 10.9308 10.9308 11.7044 11.7044 11.7101 11.7101 12.0217 12.0217 12.1445 12.1445 12.1656 12.1656 13.0605 13.0605 13.1234 13.1234 13.1471 13.1471 13.8093 13.8093 13.8824 13.8824 14.2304 14.2304 15.2817 15.2817 15.3388 15.3388 16.0046 16.0046 16.3796 16.3796 16.8036 16.8036 k = 0.3571 0.1205 0.0748 ( 7824 PWs) bands (ev): -0.2525 -0.2525 0.7597 0.7597 2.4703 2.4703 6.9588 6.9588 7.3302 7.3302 7.4711 7.4711 8.2682 8.2682 8.4322 8.4322 8.6321 8.6321 9.3112 9.3112 10.0285 10.0285 10.1803 10.1803 10.4010 10.4010 10.9356 10.9356 10.9418 10.9418 10.9798 10.9798 11.6973 11.6973 11.7029 11.7029 11.9084 11.9084 12.1634 12.1634 12.1865 12.1865 12.9995 12.9995 13.0621 13.0621 13.1831 13.1831 13.8732 13.8732 13.9396 13.9396 14.2169 14.2169 15.3074 15.3074 15.3654 15.3654 15.9463 15.9463 16.4819 16.4819 16.7816 16.7816 k = 0.3333 0.1125 0.0699 ( 7803 PWs) bands (ev): -0.2674 -0.2674 0.7948 0.7948 2.4419 2.4419 6.9757 6.9757 7.3363 7.3363 7.4742 7.4742 8.2582 8.2582 8.4376 8.4376 8.6198 8.6198 9.2457 9.2457 10.0312 10.0312 10.2338 10.2338 10.4058 10.4058 10.9479 10.9479 10.9559 10.9559 11.0701 11.0701 11.6893 11.6893 11.6947 11.6947 11.7991 11.7991 12.1822 12.1822 12.2065 12.2065 12.9413 12.9413 13.0048 13.0048 13.1903 13.1903 13.9354 13.9354 13.9959 13.9959 14.2237 14.2237 15.3350 15.3350 15.3935 15.3935 15.8835 15.8835 16.5624 16.5624 16.7484 16.7487 k = 0.3095 0.1044 0.0649 ( 7818 PWs) bands (ev): -0.2829 -0.2829 0.8331 0.8331 2.4100 2.4100 6.9939 6.9939 7.3431 7.3431 7.4777 7.4777 8.2477 8.2477 8.4450 8.4450 8.6065 8.6065 9.1800 9.1800 10.0325 10.0325 10.2916 10.2916 10.4103 10.4103 10.9630 10.9630 10.9731 10.9731 11.1639 11.1639 11.6809 11.6809 11.6835 11.6835 11.6992 11.6992 12.1970 12.1970 12.2229 12.2229 12.8911 12.8911 12.9543 12.9543 13.1683 13.1683 13.9953 13.9953 14.0505 14.0505 14.2482 14.2482 15.3632 15.3632 15.4218 15.4218 15.8208 15.8208 16.5845 16.5845 16.6689 16.6690 k = 0.2857 0.0964 0.0599 ( 7818 PWs) bands (ev): -0.2985 -0.2985 0.8743 0.8743 2.3750 2.3750 7.0130 7.0130 7.3506 7.3506 7.4814 7.4814 8.2367 8.2367 8.4546 8.4546 8.5924 8.5924 9.1151 9.1151 10.0332 10.0332 10.3515 10.3515 10.4143 10.4143 10.9811 10.9811 10.9939 10.9939 11.2559 11.2559 11.6052 11.6052 11.6722 11.6722 11.6781 11.6781 12.2040 12.2040 12.2322 12.2322 12.8528 12.8528 12.9142 12.9142 13.1234 13.1234 14.0521 14.0521 14.1028 14.1028 14.2816 14.2816 15.3911 15.3911 15.4489 15.4489 15.7636 15.7636 16.5602 16.5602 16.5857 16.5858 k = 0.2619 0.0884 0.0549 ( 7824 PWs) bands (ev): -0.3139 -0.3139 0.9176 0.9176 2.3373 2.3373 7.0325 7.0325 7.3586 7.3586 7.4853 7.4853 8.2257 8.2257 8.4666 8.4666 8.5780 8.5780 9.0518 9.0518 10.0335 10.0335 10.4117 10.4117 10.4178 10.4178 11.0023 11.0023 11.0181 11.0181 11.3294 11.3294 11.5428 11.5428 11.6635 11.6635 11.6691 11.6691 12.1996 12.1996 12.2309 12.2309 12.8294 12.8294 12.8876 12.8876 13.0635 13.0635 14.1048 14.1048 14.1519 14.1519 14.3126 14.3126 15.4178 15.4178 15.4739 15.4739 15.7180 15.7180 16.5011 16.5011 16.5107 16.5184 k = 0.2381 0.0803 0.0499 ( 7818 PWs) bands (ev): -0.3288 -0.3288 0.9626 0.9626 2.2975 2.2975 7.0519 7.0519 7.3670 7.3670 7.4894 7.4894 8.2148 8.2148 8.4810 8.4810 8.5635 8.5635 8.9908 8.9908 10.0335 10.0335 10.4206 10.4206 10.4700 10.4700 11.0265 11.0265 11.0457 11.0457 11.3389 11.3389 11.5529 11.5529 11.6551 11.6551 11.6614 11.6614 12.1818 12.1818 12.2165 12.2165 12.8225 12.8225 12.8767 12.8767 12.9963 12.9963 14.1523 14.1523 14.1972 14.1972 14.3302 14.3302 15.4428 15.4428 15.4959 15.4959 15.6904 15.6904 16.4235 16.4235 16.4375 16.4375 k = 0.2143 0.0723 0.0449 ( 7794 PWs) bands (ev): -0.3429 -0.3429 1.0086 1.0086 2.2560 2.2560 7.0708 7.0708 7.3758 7.3758 7.4934 7.4934 8.2042 8.2042 8.4975 8.4975 8.5492 8.5492 8.9328 8.9328 10.0331 10.0331 10.4228 10.4228 10.5238 10.5238 11.0536 11.0536 11.0764 11.0764 11.2948 11.2948 11.6168 11.6168 11.6474 11.6474 11.6637 11.6637 12.1511 12.1511 12.1888 12.1888 12.8305 12.8305 12.8813 12.8813 12.9289 12.9289 14.1931 14.1931 14.2377 14.2377 14.3268 14.3268 15.4659 15.4659 15.5150 15.5150 15.6852 15.6852 16.3497 16.3497 16.3689 16.3689 k = 0.1905 0.0643 0.0399 ( 7788 PWs) bands (ev): -0.3560 -0.3560 1.0550 1.0550 2.2135 2.2135 7.0888 7.0888 7.3847 7.3847 7.4974 7.4974 8.1942 8.1942 8.5155 8.5155 8.5355 8.5355 8.8785 8.8785 10.0323 10.0323 10.4244 10.4244 10.5698 10.5698 11.0831 11.0831 11.1100 11.1100 11.2468 11.2468 11.6332 11.6332 11.6406 11.6406 11.7278 11.7278 12.1103 12.1103 12.1495 12.1495 12.8418 12.8418 12.8757 12.8757 12.8989 12.8989 14.2225 14.2225 14.2725 14.2725 14.3027 14.3027 15.4876 15.4876 15.5315 15.5315 15.7038 15.7038 16.2803 16.2803 16.3048 16.3048 k = 0.1667 0.0562 0.0349 ( 7770 PWs) bands (ev): -0.3679 -0.3679 1.1011 1.1011 2.1707 2.1707 7.1055 7.1055 7.3935 7.3935 7.5013 7.5013 8.1851 8.1851 8.5226 8.5226 8.5346 8.5346 8.8287 8.8287 10.0311 10.0311 10.4255 10.4255 10.6044 10.6044 11.1140 11.1140 11.1457 11.1457 11.2123 11.2123 11.6276 11.6276 11.6353 11.6353 11.8102 11.8102 12.0631 12.0631 12.1017 12.1017 12.8055 12.8055 12.8892 12.8892 12.9258 12.9258 14.2138 14.2138 14.2852 14.2852 14.3010 14.3010 15.5085 15.5085 15.5466 15.5466 15.7429 15.7429 16.2150 16.2150 16.2448 16.2448 k = 0.1429 0.0482 0.0299 ( 7770 PWs) bands (ev): -0.3785 -0.3785 1.1461 1.1461 2.1286 2.1286 7.1205 7.1205 7.4020 7.4020 7.5049 7.5049 8.1770 8.1770 8.5109 8.5109 8.5536 8.5536 8.7841 8.7841 10.0294 10.0294 10.4261 10.4261 10.6247 10.6247 11.1437 11.1437 11.1827 11.1827 11.1990 11.1990 11.6208 11.6208 11.6318 11.6318 11.8805 11.8805 12.0140 12.0140 12.0485 12.0485 12.7711 12.7711 12.9227 12.9227 12.9582 12.9582 14.1499 14.1499 14.2963 14.2963 14.3227 14.3227 15.5298 15.5298 15.5618 15.5618 15.7961 15.7961 16.1536 16.1536 16.1884 16.1884 k = 0.1190 0.0402 0.0249 ( 7764 PWs) bands (ev): -0.3877 -0.3877 1.1888 1.1888 2.0882 2.0882 7.1336 7.1336 7.4100 7.4100 7.5081 7.5081 8.1701 8.1701 8.5005 8.5005 8.5714 8.5714 8.7457 8.7457 10.0274 10.0274 10.4264 10.4264 10.6306 10.6306 11.1682 11.1682 11.2104 11.2104 11.2200 11.2200 11.6142 11.6142 11.6310 11.6310 11.9202 11.9202 11.9761 11.9761 11.9927 11.9927 12.7587 12.7587 12.9586 12.9586 12.9923 12.9923 14.0647 14.0647 14.3088 14.3088 14.3378 14.3378 15.5527 15.5527 15.5784 15.5784 15.8553 15.8553 16.0956 16.0956 16.1353 16.1353 k = 0.0952 0.0321 0.0200 ( 7770 PWs) bands (ev): -0.3953 -0.3953 1.2278 1.2278 2.0510 2.0510 7.1446 7.1446 7.4171 7.4171 7.5108 7.5108 8.1644 8.1644 8.4916 8.4916 8.5864 8.5864 8.7146 8.7146 10.0252 10.0252 10.4266 10.4266 10.6257 10.6257 11.1909 11.1909 11.2376 11.2376 11.2559 11.2559 11.6085 11.6085 11.6336 11.6336 11.8958 11.8958 11.9366 11.9366 11.9817 11.9817 12.7715 12.7715 12.9929 12.9929 13.0252 13.0252 13.9720 13.9720 14.3169 14.3169 14.3470 14.3470 15.5780 15.5780 15.5969 15.5969 15.9119 15.9119 16.0418 16.0418 16.0858 16.0858 k = 0.0714 0.0241 0.0150 ( 7770 PWs) bands (ev): -0.4013 -0.4013 1.2615 1.2615 2.0186 2.0186 7.1533 7.1533 7.4231 7.4231 7.5131 7.5131 8.1601 8.1601 8.4846 8.4846 8.5969 8.5969 8.6923 8.6923 10.0230 10.0230 10.4266 10.4266 10.6154 10.6154 11.2159 11.2159 11.2677 11.2677 11.2883 11.2883 11.6040 11.6040 11.6406 11.6406 11.8539 11.8539 11.8826 11.8826 11.9894 11.9894 12.8051 12.8051 13.0228 13.0228 13.0541 13.0541 13.8809 13.8809 14.3208 14.3208 14.3516 14.3516 15.6053 15.6053 15.6170 15.6170 15.9531 15.9531 15.9980 15.9980 16.0411 16.0411 k = 0.0476 0.0161 0.0100 ( 7773 PWs) bands (ev): -0.4056 -0.4056 1.2878 1.2878 1.9932 1.9932 7.1596 7.1596 7.4275 7.4275 7.5148 7.5148 8.1570 8.1570 8.4794 8.4794 8.6016 8.6016 8.6794 8.6794 10.0212 10.0212 10.4266 10.4266 10.6045 10.6045 11.2398 11.2398 11.2938 11.2938 11.3144 11.3144 11.6009 11.6009 11.6523 11.6523 11.8176 11.8176 11.8338 11.8338 11.9872 11.9872 12.8480 12.8480 13.0461 13.0461 13.0766 13.0766 13.8012 13.8012 14.3219 14.3219 14.3531 14.3531 15.6323 15.6323 15.6365 15.6365 15.9385 15.9385 16.0019 16.0019 16.0039 16.0039 k = 0.0238 0.0080 0.0050 ( 7773 PWs) bands (ev): -0.4082 -0.4082 1.3047 1.3047 1.9768 1.9768 7.1634 7.1634 7.4303 7.4303 7.5158 7.5158 8.1552 8.1552 8.4763 8.4763 8.6021 8.6021 8.6742 8.6742 10.0200 10.0200 10.4265 10.4265 10.5967 10.5967 11.2572 11.2572 11.3115 11.3115 11.3315 11.3315 11.5993 11.5993 11.6670 11.6670 11.7928 11.7928 11.7953 11.7953 11.9818 11.9818 12.8842 12.8842 13.0609 13.0609 13.0908 13.0908 13.7449 13.7449 14.3218 14.3218 14.3533 14.3533 15.6515 15.6515 15.6543 15.6543 15.9091 15.9091 15.9782 15.9782 16.0170 16.0170 k = 0.0000 0.0000 0.0000 ( 7761 PWs) bands (ev): -0.4091 -0.4091 1.3106 1.3106 1.9712 1.9712 7.1647 7.1647 7.4313 7.4313 7.5161 7.5161 8.1546 8.1546 8.4752 8.4752 8.6017 8.6017 8.6730 8.6730 10.0196 10.0196 10.4265 10.4265 10.5939 10.5939 11.2636 11.2636 11.3178 11.3178 11.3375 11.3375 11.5989 11.5989 11.6751 11.6751 11.7789 11.7789 11.7839 11.7839 11.9792 11.9792 12.8985 12.8985 13.0659 13.0659 13.0958 13.0958 13.7243 13.7243 14.3216 14.3216 14.3532 14.3532 15.6573 15.6573 15.6632 15.6632 15.8973 15.8973 15.9688 15.9688 16.0219 16.0219 k = 0.0000 0.0000 0.0000 ( 7761 PWs) bands (ev): -0.4091 -0.4091 1.3106 1.3106 1.9712 1.9712 7.1647 7.1647 7.4313 7.4313 7.5161 7.5161 8.1546 8.1546 8.4752 8.4752 8.6017 8.6017 8.6730 8.6730 10.0196 10.0196 10.4265 10.4265 10.5939 10.5939 11.2636 11.2636 11.3178 11.3178 11.3375 11.3375 11.5989 11.5989 11.6751 11.6751 11.7789 11.7789 11.7839 11.7839 11.9792 11.9792 12.8985 12.8985 13.0659 13.0659 13.0958 13.0958 13.7243 13.7243 14.3216 14.3216 14.3532 14.3532 15.6573 15.6573 15.6632 15.6632 15.8973 15.8973 15.9688 15.9688 16.0219 16.0219 k = 0.0085-0.0111-0.0225 ( 7763 PWs) bands (ev): -0.4079 -0.4079 1.3109 1.3109 1.9702 1.9702 7.1571 7.1571 7.4154 7.4154 7.5436 7.5436 8.1541 8.1541 8.4735 8.4735 8.6028 8.6028 8.6775 8.6775 10.0159 10.0159 10.4214 10.4214 10.5957 10.5957 11.2642 11.2642 11.3206 11.3206 11.3401 11.3401 11.6006 11.6006 11.6766 11.6766 11.7798 11.7798 11.7852 11.7852 11.9830 11.9830 12.9003 12.9003 13.0641 13.0641 13.0938 13.0938 13.7265 13.7265 14.3227 14.3227 14.3541 14.3541 15.6486 15.6486 15.6594 15.6594 15.8654 15.8654 15.9419 15.9419 16.0744 16.0744 k = 0.0169-0.0222-0.0449 ( 7769 PWs) bands (ev): -0.4044 -0.4044 1.3117 1.3117 1.9671 1.9671 7.1355 7.1355 7.3929 7.3929 7.5998 7.5998 8.1529 8.1529 8.4690 8.4690 8.6058 8.6058 8.6907 8.6907 10.0049 10.0049 10.4068 10.4068 10.6013 10.6013 11.2661 11.2661 11.3280 11.3280 11.3482 11.3482 11.6058 11.6058 11.6811 11.6811 11.7824 11.7824 11.7894 11.7894 11.9942 11.9942 12.9057 12.9057 13.0583 13.0583 13.0881 13.0881 13.7333 13.7333 14.3257 14.3257 14.3570 14.3570 15.6195 15.6195 15.6520 15.6520 15.7915 15.7915 15.9256 15.9256 16.1464 16.1464 k = 0.0254-0.0333-0.0674 ( 7771 PWs) bands (ev): -0.3985 -0.3985 1.3132 1.3132 1.9621 1.9621 7.1036 7.1036 7.3777 7.3777 7.6667 7.6667 8.1508 8.1508 8.4631 8.4631 8.6103 8.6103 8.7117 8.7117 9.9869 9.9869 10.3837 10.3837 10.6105 10.6105 11.2694 11.2694 11.3383 11.3383 11.3618 11.3618 11.6140 11.6140 11.6885 11.6885 11.7870 11.7870 11.7967 11.7967 12.0128 12.0128 12.9144 12.9144 13.0483 13.0483 13.0792 13.0792 13.7446 13.7446 14.3303 14.3303 14.3618 14.3618 15.5750 15.5750 15.6316 15.6316 15.7170 15.7170 15.9102 15.9102 16.2123 16.2123 k = 0.0338-0.0444-0.0898 ( 7777 PWs) bands (ev): -0.3904 -0.3904 1.3151 1.3151 1.9551 1.9551 7.0659 7.0659 7.3695 7.3695 7.7396 7.7396 8.1480 8.1480 8.4572 8.4572 8.6161 8.6161 8.7394 8.7394 9.9623 9.9623 10.3542 10.3542 10.6235 10.6235 11.2742 11.2742 11.3509 11.3509 11.3795 11.3795 11.6249 11.6249 11.6986 11.6986 11.7945 11.7945 11.8073 11.8073 12.0387 12.0387 12.9263 12.9263 13.0336 13.0336 13.0678 13.0678 13.7605 13.7605 14.3359 14.3359 14.3689 14.3689 15.5195 15.5195 15.5729 15.5729 15.6748 15.6748 15.8909 15.8909 16.2645 16.2645 k = 0.0423-0.0555-0.1123 ( 7777 PWs) bands (ev): -0.3799 -0.3799 1.3177 1.3177 1.9461 1.9461 7.0262 7.0262 7.3664 7.3664 7.8157 7.8157 8.1451 8.1451 8.4525 8.4525 8.6230 8.6230 8.7727 8.7727 9.9319 9.9319 10.3201 10.3201 10.6397 10.6397 11.2807 11.2807 11.3660 11.3660 11.3983 11.3983 11.6390 11.6390 11.7103 11.7103 11.8055 11.8055 11.8217 11.8217 12.0714 12.0714 12.9409 12.9409 13.0144 13.0144 13.0542 13.0542 13.7809 13.7809 14.3416 14.3416 14.3783 14.3783 15.4555 15.4555 15.4867 15.4867 15.6570 15.6570 15.8676 15.8676 16.2931 16.2931 k = 0.0507-0.0666-0.1347 ( 7789 PWs) bands (ev): -0.3672 -0.3672 1.3207 1.3207 1.9351 1.9351 6.9872 6.9872 7.3665 7.3665 7.8923 7.8923 8.1433 8.1433 8.4496 8.4496 8.6310 8.6310 8.8111 8.8111 9.8965 9.8965 10.2832 10.2832 10.6589 10.6589 11.2889 11.2889 11.3841 11.3841 11.4159 11.4159 11.6568 11.6568 11.7228 11.7228 11.8202 11.8202 11.8407 11.8407 12.1105 12.1105 12.9576 12.9576 12.9915 12.9915 13.0384 13.0384 13.8055 13.8055 14.3468 14.3468 14.3899 14.3899 15.3802 15.3802 15.3987 15.3987 15.6433 15.6433 15.8406 15.8406 16.2855 16.2855 k = 0.0592-0.0777-0.1572 ( 7791 PWs) bands (ev): -0.3523 -0.3523 1.3242 1.3242 1.9222 1.9222 6.9503 6.9503 7.3686 7.3686 7.9642 7.9642 8.1465 8.1465 8.4491 8.4491 8.6403 8.6403 8.8540 8.8540 9.8574 9.8574 10.2451 10.2451 10.6803 10.6803 11.2992 11.2992 11.4048 11.4048 11.4305 11.4305 11.6786 11.6786 11.7359 11.7359 11.8381 11.8381 11.8650 11.8650 12.1555 12.1555 12.9650 12.9650 12.9764 12.9764 13.0205 13.0205 13.8340 13.8340 14.3510 14.3510 14.4035 14.4035 15.2884 15.2884 15.3212 15.3212 15.6292 15.6292 15.8110 15.8110 16.2359 16.2359 k = 0.0676-0.0888-0.1797 ( 7793 PWs) bands (ev): -0.3353 -0.3353 1.3281 1.3281 1.9073 1.9073 6.9166 6.9166 7.3719 7.3719 8.0195 8.0195 8.1655 8.1655 8.4511 8.4511 8.6510 8.6510 8.9012 8.9012 9.8161 9.8161 10.2069 10.2069 10.7031 10.7031 11.3118 11.3118 11.4269 11.4269 11.4430 11.4430 11.7039 11.7039 11.7501 11.7501 11.8589 11.8589 11.8942 11.8942 12.2056 12.2056 12.9375 12.9375 12.9913 12.9913 13.0047 13.0047 13.8657 13.8657 14.3537 14.3537 14.4185 14.4185 15.1919 15.1919 15.2451 15.2451 15.6135 15.6135 15.7794 15.7794 16.1539 16.1539 k = 0.0761-0.0999-0.2021 ( 7787 PWs) bands (ev): -0.3161 -0.3161 1.3325 1.3325 1.8906 1.8906 6.8867 6.8867 7.3757 7.3757 8.0444 8.0444 8.2129 8.2129 8.4559 8.4559 8.6635 8.6635 8.9524 8.9524 9.7740 9.7740 10.1695 10.1695 10.7263 10.7263 11.3271 11.3271 11.4418 11.4418 11.4618 11.4618 11.7311 11.7311 11.7668 11.7668 11.8833 11.8833 11.9269 11.9269 12.2602 12.2602 12.9090 12.9090 12.9749 12.9749 13.0190 13.0190 13.8994 13.8994 14.3548 14.3548 14.4342 14.4342 15.0955 15.0955 15.1681 15.1681 15.5960 15.5960 15.7466 15.7466 16.0540 16.0540 k = 0.0845-0.1110-0.2246 ( 7787 PWs) bands (ev): -0.2948 -0.2948 1.3372 1.3372 1.8720 1.8720 6.8610 6.8610 7.3796 7.3796 8.0464 8.0464 8.2791 8.2791 8.4638 8.4638 8.6784 8.6784 9.0073 9.0073 9.7328 9.7328 10.1337 10.1337 10.7486 10.7486 11.3454 11.3454 11.4472 11.4472 11.4901 11.4901 11.7584 11.7584 11.7869 11.7869 11.9122 11.9122 11.9614 11.9614 12.3183 12.3183 12.8810 12.8810 12.9512 12.9512 13.0394 13.0394 13.9339 13.9339 14.3536 14.3536 14.4498 14.4498 15.0009 15.0009 15.0907 15.0907 15.5766 15.5766 15.7131 15.7131 15.9456 15.9456 k = 0.0930-0.1221-0.2470 ( 7783 PWs) bands (ev): -0.2716 -0.2716 1.3423 1.3423 1.8516 1.8516 6.8396 6.8396 7.3829 7.3829 8.0385 8.0385 8.3481 8.3481 8.4756 8.4756 8.6971 8.6971 9.0658 9.0658 9.6939 9.6939 10.1001 10.1001 10.7692 10.7692 11.3669 11.3669 11.4493 11.4493 11.5221 11.5221 11.7852 11.7852 11.8102 11.8102 11.9463 11.9463 11.9960 11.9960 12.3787 12.3787 12.8547 12.8547 12.9266 12.9266 13.0597 13.0597 13.9669 13.9669 14.3500 14.3500 14.4645 14.4645 14.9095 14.9095 15.0139 15.0139 15.5554 15.5554 15.6794 15.6794 15.8345 15.8345 k = 0.1014-0.1332-0.2695 ( 7787 PWs) bands (ev): -0.2465 -0.2465 1.3477 1.3477 1.8294 1.8294 6.8228 6.8228 7.3851 7.3851 8.0265 8.0265 8.4088 8.4088 8.4934 8.4934 8.7219 8.7219 9.1278 9.1278 9.6590 9.6590 10.0695 10.0695 10.7868 10.7868 11.3916 11.3916 11.4505 11.4505 11.5563 11.5563 11.8125 11.8125 11.8355 11.8355 11.9855 11.9855 12.0291 12.0291 12.4396 12.4396 12.8317 12.8317 12.9034 12.9034 13.0792 13.0792 13.9960 13.9960 14.3434 14.3434 14.4775 14.4775 14.8234 14.8234 14.9390 14.9390 15.5320 15.5320 15.6447 15.6447 15.7254 15.7254 k = 0.1099-0.1443-0.2919 ( 7791 PWs) bands (ev): -0.2196 -0.2196 1.3533 1.3533 1.8056 1.8056 6.8105 6.8105 7.3856 7.3856 8.0124 8.0124 8.4515 8.4515 8.5206 8.5206 8.7559 8.7559 9.1928 9.1928 9.6293 9.6293 10.0425 10.0425 10.8009 10.8009 11.4178 11.4178 11.4530 11.4530 11.5921 11.5921 11.8397 11.8397 11.8638 11.8638 12.0286 12.0286 12.0598 12.0598 12.4978 12.4978 12.8135 12.8135 12.8849 12.8849 13.0972 13.0972 14.0173 14.0173 14.3336 14.3336 14.4871 14.4871 14.7455 14.7455 14.8674 14.8674 15.5035 15.5035 15.5992 15.5992 15.6341 15.6341 k = 0.1183-0.1554-0.3144 ( 7793 PWs) bands (ev): -0.1909 -0.1909 1.3592 1.3592 1.7802 1.7802 6.8027 6.8027 7.3838 7.3838 7.9977 7.9977 8.4774 8.4774 8.5522 8.5522 8.8009 8.8009 9.2606 9.2606 9.6060 9.6060 10.0198 10.0198 10.8109 10.8109 11.4367 11.4367 11.4657 11.4657 11.6288 11.6288 11.8638 11.8638 11.8990 11.8990 12.0699 12.0699 12.0914 12.0914 12.5477 12.5477 12.8013 12.8013 12.8770 12.8770 13.1134 13.1134 14.0266 14.0266 14.3203 14.3203 14.4915 14.4915 14.6798 14.6798 14.8003 14.8003 15.4526 15.4526 15.5337 15.5337 15.5898 15.5898 k = 0.1268-0.1665-0.3368 ( 7791 PWs) bands (ev): -0.1607 -0.1607 1.3652 1.3652 1.7533 1.7533 6.7994 6.7994 7.3788 7.3788 7.9833 7.9833 8.4956 8.4956 8.5787 8.5787 8.8552 8.8552 9.3304 9.3304 9.5903 9.5903 10.0025 10.0025 10.8169 10.8169 11.4420 11.4420 11.4944 11.4944 11.6661 11.6661 11.8841 11.8841 11.9420 11.9420 12.0956 12.0956 12.1358 12.1358 12.5805 12.5805 12.7965 12.7965 12.8885 12.8885 13.1273 13.1273 14.0192 14.0192 14.3033 14.3033 14.4875 14.4875 14.6314 14.6314 14.7391 14.7391 15.3664 15.3664 15.4999 15.4999 15.5565 15.5565 k = 0.1352-0.1776-0.3593 ( 7791 PWs) bands (ev): -0.1289 -0.1289 1.3714 1.3714 1.7250 1.7250 6.8005 6.8005 7.3702 7.3702 7.9700 7.9700 8.5111 8.5111 8.5984 8.5984 8.9142 8.9142 9.4009 9.4009 9.5838 9.5838 9.9914 9.9914 10.8191 10.8191 11.4441 11.4441 11.5279 11.5279 11.7037 11.7037 11.9017 11.9017 11.9905 11.9905 12.1118 12.1118 12.1873 12.1873 12.5905 12.5905 12.7999 12.7999 12.9250 12.9250 13.1386 13.1386 13.9923 13.9923 14.2827 14.2827 14.4724 14.4724 14.6027 14.6027 14.6850 14.6850 15.2724 15.2724 15.4824 15.4824 15.5242 15.5242 k = 0.1437-0.1887-0.3818 ( 7797 PWs) bands (ev): -0.0958 -0.0958 1.3777 1.3777 1.6953 1.6953 6.8058 6.8058 7.3573 7.3573 7.9586 7.9586 8.5249 8.5249 8.6131 8.6131 8.9730 8.9730 9.4683 9.4683 9.5902 9.5902 9.9876 9.9876 10.8178 10.8178 11.4465 11.4465 11.5615 11.5615 11.7413 11.7413 11.9172 11.9172 12.0371 12.0371 12.1301 12.1301 12.2408 12.2408 12.5810 12.5810 12.8117 12.8117 12.9825 12.9825 13.1476 13.1476 13.9464 13.9464 14.2588 14.2588 14.4476 14.4476 14.5884 14.5884 14.6394 14.6394 15.1832 15.1832 15.4718 15.4718 15.4923 15.4923 k = 0.1521-0.1998-0.4042 ( 7801 PWs) bands (ev): -0.0614 -0.0614 1.3840 1.3840 1.6645 1.6645 6.8151 6.8151 7.3396 7.3396 7.9499 7.9499 8.5373 8.5373 8.6251 8.6251 9.0279 9.0279 9.5218 9.5218 9.6196 9.6196 9.9921 9.9921 10.8137 10.8137 11.4500 11.4500 11.5931 11.5931 11.7785 11.7785 11.9307 11.9307 12.0644 12.0644 12.1695 12.1695 12.2947 12.2947 12.5600 12.5600 12.8309 12.8309 13.0520 13.0520 13.1548 13.1548 13.8858 13.8858 14.2321 14.2321 14.4154 14.4154 14.5767 14.5767 14.6058 14.6058 15.1033 15.1033 15.4511 15.4511 15.4747 15.4747 k = 0.1606-0.2109-0.4267 ( 7799 PWs) bands (ev): -0.0258 -0.0258 1.3904 1.3904 1.6325 1.6325 6.8283 6.8283 7.3172 7.3172 7.9442 7.9442 8.5483 8.5483 8.6357 8.6357 9.0768 9.0768 9.5537 9.5537 9.6787 9.6787 10.0058 10.0058 10.8074 10.8074 11.4550 11.4550 11.6210 11.6210 11.8145 11.8145 11.9423 11.9423 12.0703 12.0703 12.2346 12.2346 12.3478 12.3478 12.5340 12.5340 12.8559 12.8559 13.1203 13.1203 13.1660 13.1660 13.8163 13.8163 14.2032 14.2032 14.3760 14.3760 14.5575 14.5575 14.5879 14.5879 15.0356 15.0356 15.4134 15.4134 15.4764 15.4764 k = 0.1690-0.2220-0.4491 ( 7801 PWs) bands (ev): 0.0106 0.0106 1.3968 1.3968 1.5995 1.5995 6.8449 6.8449 7.2901 7.2901 7.9418 7.9418 8.5576 8.5576 8.6456 8.6456 9.1185 9.1185 9.5765 9.5765 9.7538 9.7538 10.0288 10.0288 10.7994 10.7994 11.4616 11.4616 11.6439 11.6439 11.8469 11.8469 11.9519 11.9519 12.0701 12.0701 12.3136 12.3136 12.3971 12.3971 12.5090 12.5090 12.8853 12.8853 13.1468 13.1468 13.2147 13.2147 13.7451 13.7451 14.1726 14.1726 14.3291 14.3291 14.5377 14.5377 14.5741 14.5741 14.9820 14.9820 15.3699 15.3699 15.4825 15.4825 k = 0.1775-0.2331-0.4716 ( 7803 PWs) bands (ev): 0.0479 0.0479 1.4032 1.4032 1.5657 1.5657 6.8648 6.8648 7.2590 7.2590 7.9428 7.9428 8.5653 8.5653 8.6552 8.6552 9.1531 9.1531 9.5987 9.5987 9.8352 9.8352 10.0607 10.0607 10.7904 10.7904 11.4701 11.4701 11.6605 11.6605 11.8722 11.8722 11.9592 11.9592 12.0746 12.0746 12.4002 12.4002 12.4301 12.4301 12.5000 12.5000 12.9177 12.9177 13.1485 13.1485 13.2739 13.2739 13.6828 13.6828 14.1405 14.1405 14.2759 14.2759 14.5230 14.5230 14.5562 14.5562 14.9429 14.9429 15.3209 15.3209 15.4857 15.4857 k = 0.1859-0.2442-0.4940 ( 7793 PWs) bands (ev): 0.0859 0.0859 1.4095 1.4095 1.5311 1.5311 6.8874 6.8874 7.2246 7.2246 7.9469 7.9469 8.5714 8.5714 8.6644 8.6644 9.1812 9.1812 9.6223 9.6223 9.9193 9.9193 10.1003 10.1003 10.7810 10.7810 11.4804 11.4804 11.6696 11.6696 11.8874 11.8874 11.9640 11.9640 12.0901 12.0901 12.4218 12.4218 12.4944 12.4944 12.5305 12.5305 12.9521 12.9521 13.1459 13.1459 13.3044 13.3044 13.6472 13.6472 14.1072 14.1072 14.2188 14.2188 14.5109 14.5109 14.5367 14.5367 14.9162 14.9162 15.2667 15.2667 15.4670 15.4670 k = 0.1944-0.2553-0.5165 ( 7787 PWs) bands (ev): 0.1243 0.1243 1.4159 1.4159 1.4959 1.4959 6.9122 6.9122 7.1879 7.1879 7.9538 7.9538 8.5760 8.5760 8.6732 8.6732 9.2040 9.2040 9.6475 9.6475 10.0050 10.0050 10.1461 10.1461 10.7718 10.7718 11.4926 11.4926 11.6700 11.6700 11.8941 11.8941 11.9659 11.9659 12.1180 12.1180 12.4006 12.4006 12.5702 12.5702 12.5973 12.5973 12.9880 12.9880 13.1413 13.1413 13.2870 13.2870 13.6528 13.6528 14.0728 14.0728 14.1615 14.1615 14.4916 14.4916 14.5279 14.5279 14.8974 14.8974 15.2079 15.2079 15.4133 15.4133 k = 0.2028-0.2664-0.5390 ( 7777 PWs) bands (ev): 0.1630 0.1630 1.4223 1.4223 1.4602 1.4602 6.9384 6.9384 7.1504 7.1504 7.9629 7.9629 8.5788 8.5788 8.6813 8.6813 9.2227 9.2227 9.6744 9.6744 10.0911 10.0911 10.1962 10.1962 10.7632 10.7632 11.5065 11.5065 11.6613 11.6613 11.8968 11.8968 11.9646 11.9646 12.1549 12.1549 12.3787 12.3787 12.6171 12.6171 12.6972 12.6972 13.0253 13.0253 13.1352 13.1352 13.2320 13.2320 13.6846 13.6846 14.0374 14.0374 14.1087 14.1087 14.4679 14.4679 14.5305 14.5305 14.8812 14.8812 15.1460 15.1460 15.3469 15.3469 k = 0.2113-0.2775-0.5614 ( 7775 PWs) bands (ev): 0.2018 0.2018 1.4240 1.4240 1.4288 1.4288 6.9641 6.9641 7.1145 7.1145 7.9737 7.9737 8.5799 8.5799 8.6890 8.6890 9.2382 9.2382 9.7026 9.7026 10.1767 10.1767 10.2491 10.2491 10.7558 10.7558 11.5219 11.5219 11.6445 11.6445 11.8995 11.8995 11.9599 11.9599 12.1968 12.1968 12.3594 12.3594 12.6593 12.6593 12.8002 12.8002 13.0629 13.0629 13.1281 13.1281 13.1629 13.1629 13.7134 13.7134 14.0012 14.0012 14.0660 14.0660 14.4511 14.4511 14.5384 14.5384 14.8620 14.8620 15.0829 15.0829 15.2834 15.2834 k = 0.2197-0.2886-0.5839 ( 7773 PWs) bands (ev): 0.2405 0.2405 1.3878 1.3878 1.4351 1.4351 6.9836 6.9836 7.0863 7.0863 7.9857 7.9857 8.5788 8.5788 8.6963 8.6963 9.2515 9.2515 9.7318 9.7318 10.2595 10.2595 10.3049 10.3049 10.7500 10.7500 11.5386 11.5386 11.6214 11.6214 11.9035 11.9035 11.9521 11.9521 12.2409 12.2409 12.3438 12.3438 12.6952 12.6952 12.9016 12.9016 13.0667 13.0667 13.1176 13.1176 13.1324 13.1324 13.7201 13.7201 13.9638 13.9638 14.0366 14.0366 14.4496 14.4496 14.5483 14.5483 14.8350 14.8350 15.0205 15.0205 15.2293 15.2293 k = 0.2282-0.2997-0.6063 ( 7769 PWs) bands (ev): 0.2789 0.2789 1.3514 1.3514 1.4415 1.4415 6.9829 6.9829 7.0801 7.0801 7.9982 7.9982 8.5754 8.5754 8.7036 8.7036 9.2630 9.2630 9.7616 9.7616 10.3324 10.3324 10.3687 10.3687 10.7460 10.7460 11.5561 11.5561 11.5946 11.5946 11.9087 11.9087 11.9417 11.9417 12.2850 12.2850 12.3324 12.3324 12.7202 12.7202 12.9932 12.9932 13.0076 13.0076 13.1118 13.1118 13.1788 13.1788 13.7013 13.7013 13.9252 13.9252 14.0149 14.0149 14.4682 14.4682 14.5581 14.5581 14.7974 14.7974 14.9609 14.9609 15.1871 15.1871 k = 0.2366-0.3108-0.6288 ( 7771 PWs) bands (ev): 0.3168 0.3168 1.3149 1.3149 1.4481 1.4481 6.9595 6.9595 7.0988 7.0988 8.0106 8.0106 8.5695 8.5695 8.7113 8.7113 9.2731 9.2731 9.7914 9.7914 10.3897 10.3897 10.4446 10.4446 10.7443 10.7443 11.5637 11.5637 11.5763 11.5763 11.9147 11.9147 11.9296 11.9296 12.3184 12.3184 12.3343 12.3343 12.7250 12.7250 12.9533 12.9533 13.0709 13.0709 13.1094 13.1094 13.2498 13.2498 13.6657 13.6657 13.8866 13.8866 13.9911 13.9911 14.5023 14.5023 14.5663 14.5663 14.7527 14.7527 14.9062 14.9062 15.1558 15.1558 k = 0.2451-0.3219-0.6512 ( 7773 PWs) bands (ev): 0.3539 0.3539 1.2785 1.2785 1.4548 1.4548 6.9281 6.9281 7.1279 7.1279 8.0225 8.0225 8.5607 8.5607 8.7198 8.7198 9.2820 9.2820 9.8207 9.8207 10.4387 10.4387 10.5236 10.5236 10.7451 10.7451 11.5363 11.5363 11.5930 11.5930 11.9163 11.9163 11.9210 11.9210 12.3164 12.3164 12.3727 12.3727 12.7002 12.7002 12.9293 12.9293 13.0857 13.0857 13.1515 13.1515 13.3354 13.3354 13.6230 13.6230 13.8511 13.8511 13.9606 13.9606 14.5288 14.5288 14.5733 14.5733 14.7181 14.7181 14.8581 14.8581 15.1307 15.1307 k = 0.2535-0.3330-0.6737 ( 7775 PWs) bands (ev): 0.3902 0.3902 1.2423 1.2423 1.4617 1.4617 6.8960 6.8960 7.1602 7.1602 8.0332 8.0332 8.5492 8.5492 8.7294 8.7294 9.2900 9.2900 9.8487 9.8487 10.4828 10.4828 10.6007 10.6007 10.7490 10.7490 11.5091 11.5091 11.6101 11.6101 11.9036 11.9036 11.9268 11.9268 12.3135 12.3135 12.4117 12.4117 12.6518 12.6518 12.9281 12.9281 13.0774 13.0774 13.2072 13.2072 13.4207 13.4207 13.5798 13.5798 13.8266 13.8266 13.9243 13.9243 14.5131 14.5131 14.5723 14.5723 14.7293 14.7293 14.8184 14.8184 15.1055 15.1055 k = 0.2620-0.3441-0.6962 ( 7783 PWs) bands (ev): 0.4254 0.4254 1.2064 1.2064 1.4688 1.4688 6.8654 6.8654 7.1934 7.1934 8.0422 8.0422 8.5349 8.5349 8.7403 8.7403 9.2970 9.2970 9.8744 9.8744 10.5222 10.5222 10.6726 10.6726 10.7579 10.7579 11.4843 11.4843 11.6257 11.6257 11.8919 11.8919 11.9323 11.9323 12.3118 12.3118 12.4477 12.4477 12.5948 12.5948 12.9359 12.9359 13.0670 13.0670 13.2610 13.2610 13.4811 13.4811 13.5406 13.5406 13.8304 13.8304 13.8846 13.8846 14.4581 14.4581 14.5607 14.5607 14.7795 14.7795 14.7916 14.7916 15.0751 15.0751 k = 0.2704-0.3552-0.7186 ( 7777 PWs) bands (ev): 0.4593 0.4593 1.1709 1.1709 1.4761 1.4761 6.8375 6.8375 7.2264 7.2264 8.0493 8.0493 8.5181 8.5181 8.7525 8.7525 9.3033 9.3033 9.8972 9.8972 10.5562 10.5562 10.7296 10.7296 10.7810 10.7810 11.4627 11.4627 11.6391 11.6391 11.8819 11.8819 11.9374 11.9374 12.3103 12.3103 12.4801 12.4801 12.5394 12.5394 12.9442 12.9442 13.0554 13.0554 13.3136 13.3136 13.4890 13.4890 13.5139 13.5139 13.8414 13.8414 13.8839 13.8839 14.3869 14.3869 14.5442 14.5442 14.7698 14.7698 14.8471 14.8471 15.0375 15.0375 k = 0.2789-0.3663-0.7411 ( 7777 PWs) bands (ev): 0.4917 0.4917 1.1359 1.1359 1.4838 1.4838 6.8129 6.8129 7.2586 7.2586 8.0541 8.0541 8.4990 8.4990 8.7660 8.7660 9.3090 9.3090 9.9161 9.9161 10.5840 10.5840 10.7579 10.7579 10.8323 10.8323 11.4447 11.4447 11.6498 11.6498 11.8736 11.8736 11.9423 11.9423 12.3079 12.3079 12.4898 12.4898 12.5095 12.5095 12.9496 12.9496 13.0425 13.0425 13.3623 13.3623 13.4640 13.4640 13.4908 13.4908 13.8000 13.8000 13.9752 13.9752 14.3119 14.3119 14.5248 14.5248 14.7623 14.7623 14.9091 14.9091 14.9949 14.9949 k = 0.2873-0.3774-0.7635 ( 7779 PWs) bands (ev): 0.5224 0.5224 1.1015 1.1015 1.4919 1.4919 6.7921 6.7921 7.2893 7.2893 8.0564 8.0564 8.4778 8.4778 8.7804 8.7804 9.3144 9.3144 9.9304 9.9304 10.6044 10.6044 10.7772 10.7772 10.8923 10.8923 11.4305 11.4305 11.6573 11.6573 11.8660 11.8660 11.9473 11.9473 12.3032 12.3032 12.4524 12.4524 12.5330 12.5330 12.9513 12.9513 13.0280 13.0280 13.3876 13.3876 13.4380 13.4380 13.4790 13.4790 13.7586 13.7586 14.0849 14.0849 14.2404 14.2404 14.5061 14.5061 14.7636 14.7636 14.9464 14.9464 14.9681 14.9681 k = 0.2958-0.3885-0.7860 ( 7783 PWs) bands (ev): 0.5514 0.5514 1.0677 1.0677 1.5003 1.5003 6.7752 6.7752 7.3182 7.3182 8.0562 8.0562 8.4549 8.4549 8.7954 8.7954 9.3196 9.3196 9.9395 9.9395 10.6173 10.6173 10.7970 10.7970 10.9508 10.9508 11.4200 11.4200 11.6615 11.6615 11.8576 11.8576 11.9532 11.9532 12.2961 12.2961 12.4271 12.4271 12.5522 12.5522 12.9495 12.9495 13.0114 13.0114 13.3635 13.3635 13.4121 13.4121 13.5150 13.5150 13.7184 13.7184 14.1509 14.1509 14.2242 14.2242 14.4927 14.4927 14.7724 14.7724 14.9064 14.9064 15.0106 15.0106 k = 0.3042-0.3996-0.8084 ( 7779 PWs) bands (ev): 0.5785 0.5785 1.0348 1.0348 1.5091 1.5091 6.7626 6.7626 7.3449 7.3449 8.0536 8.0536 8.4304 8.4304 8.8104 8.8104 9.3250 9.3250 9.9431 9.9431 10.6234 10.6234 10.8177 10.8177 11.0062 11.0062 11.4127 11.4127 11.6624 11.6624 11.8461 11.8461 11.9611 11.9611 12.2889 12.2889 12.4137 12.4137 12.5660 12.5660 12.9455 12.9455 12.9927 12.9927 13.3207 13.3207 13.3889 13.3889 13.5702 13.5702 13.6801 13.6801 14.0981 14.0981 14.3290 14.3290 14.4920 14.4920 14.7879 14.7879 14.8686 14.8686 15.0446 15.0446 k = 0.3127-0.4107-0.8309 ( 7780 PWs) bands (ev): 0.6036 0.6036 1.0027 1.0027 1.5184 1.5184 6.7545 6.7545 7.3692 7.3692 8.0487 8.0487 8.4047 8.4047 8.8249 8.8249 9.3308 9.3308 9.9409 9.9409 10.6237 10.6237 10.8376 10.8376 11.0585 11.0585 11.4078 11.4078 11.6600 11.6600 11.8298 11.8298 11.9721 11.9721 12.2850 12.2850 12.4090 12.4090 12.5735 12.5735 12.9403 12.9403 12.9722 12.9722 13.2786 13.2786 13.3663 13.3663 13.6294 13.6294 13.6451 13.6451 14.0449 14.0449 14.4093 14.4093 14.5295 14.5295 14.8089 14.8089 14.8386 14.8386 15.0688 15.0688 k = 0.3211-0.4218-0.8534 ( 7778 PWs) bands (ev): 0.6266 0.6266 0.9715 0.9715 1.5280 1.5280 6.7508 6.7508 7.3907 7.3907 8.0418 8.0418 8.3780 8.3780 8.8382 8.8382 9.3373 9.3373 9.9333 9.9333 10.6197 10.6197 10.8549 10.8549 11.1078 11.1078 11.4041 11.4041 11.6539 11.6539 11.8087 11.8087 11.9880 11.9880 12.2860 12.2860 12.4105 12.4105 12.5738 12.5738 12.9349 12.9349 12.9511 12.9511 13.2436 13.2436 13.3427 13.3427 13.6114 13.6114 13.6927 13.6927 14.0000 14.0000 14.4362 14.4362 14.6200 14.6200 14.8076 14.8076 14.8483 14.8483 15.0849 15.0849 k = 0.3296-0.4329-0.8758 ( 7784 PWs) bands (ev): 0.6475 0.6475 0.9413 0.9413 1.5380 1.5380 6.7517 6.7517 7.4093 7.4093 8.0330 8.0330 8.3507 8.3507 8.8498 8.8498 9.3446 9.3446 9.9207 9.9207 10.6121 10.6121 10.8677 10.8677 11.1540 11.1540 11.4002 11.4002 11.6437 11.6437 11.7840 11.7840 12.0101 12.0101 12.2906 12.2906 12.4173 12.4173 12.5657 12.5657 12.9244 12.9244 12.9372 12.9372 13.2190 13.2190 13.3174 13.3174 13.5828 13.5828 13.7557 13.7557 13.9641 13.9641 14.4457 14.4457 14.7152 14.7152 14.7922 14.7922 14.8976 14.8976 15.0958 15.0958 k = 0.3380-0.4440-0.8983 ( 7786 PWs) bands (ev): 0.6664 0.6664 0.9121 0.9121 1.5483 1.5483 6.7572 6.7572 7.4250 7.4250 8.0227 8.0227 8.3230 8.3230 8.8589 8.8589 9.3529 9.3529 9.9039 9.9039 10.6019 10.6019 10.8751 10.8751 11.1963 11.1963 11.3946 11.3946 11.6285 11.6285 11.7590 11.7590 12.0401 12.0401 12.2955 12.2955 12.4298 12.4298 12.5487 12.5487 12.9073 12.9073 12.9355 12.9355 13.2064 13.2064 13.2908 13.2908 13.5583 13.5583 13.8189 13.8189 13.9366 13.9366 14.4504 14.4504 14.7722 14.7722 14.8023 14.8023 14.9713 14.9713 15.1050 15.1050 k = 0.3465-0.4551-0.9207 ( 7782 PWs) bands (ev): 0.6833 0.6833 0.8841 0.8841 1.5589 1.5589 6.7672 6.7672 7.4376 7.4376 8.0110 8.0110 8.2951 8.2951 8.8651 8.8651 9.3624 9.3624 9.8838 9.8838 10.5894 10.5894 10.8761 10.8761 11.2333 11.2333 11.3860 11.3860 11.6079 11.6079 11.7374 11.7374 12.0787 12.0787 12.2979 12.2979 12.4479 12.4479 12.5235 12.5235 12.8942 12.8942 12.9385 12.9385 13.2055 13.2055 13.2639 13.2639 13.5377 13.5377 13.8799 13.8799 13.9184 13.9184 14.4504 14.4504 14.7725 14.7725 14.8587 14.8587 15.0544 15.0544 15.1200 15.1200 k = 0.6535-0.2864-0.8159 ( 7782 PWs) bands (ev): 0.6833 0.6833 0.8841 0.8841 1.5589 1.5589 6.7672 6.7672 7.4377 7.4377 8.0110 8.0110 8.2952 8.2952 8.8651 8.8651 9.3624 9.3624 9.8838 9.8838 10.5894 10.5894 10.8761 10.8761 11.2333 11.2333 11.3860 11.3860 11.6079 11.6079 11.7374 11.7374 12.0787 12.0787 12.2979 12.2979 12.4479 12.4479 12.5235 12.5235 12.8942 12.8942 12.9385 12.9385 13.2055 13.2055 13.2639 13.2639 13.5377 13.5377 13.8798 13.8798 13.9184 13.9184 14.4504 14.4504 14.7725 14.7725 14.8587 14.8587 15.0544 15.0544 15.1200 15.1200 k = 0.6454-0.2625-0.8159 ( 7788 PWs) bands (ev): 0.6975 0.6975 0.8584 0.8584 1.5691 1.5691 6.7809 6.7809 7.4470 7.4470 7.9988 7.9988 8.2687 8.2687 8.8679 8.8679 9.3726 9.3726 9.8621 9.8621 10.5758 10.5758 10.8711 10.8711 11.2610 11.2610 11.3743 11.3743 11.5837 11.5837 11.7234 11.7234 12.1240 12.1240 12.2968 12.2968 12.4647 12.4647 12.4980 12.4980 12.8883 12.8883 12.9450 12.9450 13.2135 13.2135 13.2405 13.2405 13.5211 13.5211 13.8974 13.8974 13.9466 13.9466 14.4445 14.4445 14.7732 14.7732 14.9125 14.9125 15.1007 15.1007 15.1625 15.1625 k = 0.6374-0.2385-0.8159 ( 7788 PWs) bands (ev): 0.7101 0.7101 0.8338 0.8338 1.5794 1.5794 6.7985 6.7985 7.4539 7.4539 7.9856 7.9856 8.2425 8.2425 8.8674 8.8674 9.3839 9.3839 9.8389 9.8389 10.5607 10.5607 10.8601 10.8601 11.2776 11.2776 11.3590 11.3590 11.5576 11.5576 11.7179 11.7179 12.1768 12.1768 12.2931 12.2931 12.4467 12.4467 12.5066 12.5066 12.8898 12.8898 12.9545 12.9545 13.2093 13.2093 13.2398 13.2398 13.5067 13.5067 13.8893 13.8893 14.0031 14.0031 14.4328 14.4328 14.7764 14.7764 14.9689 14.9689 15.1195 15.1195 15.2062 15.2062 k = 0.6293-0.2145-0.8159 ( 7788 PWs) bands (ev): 0.7211 0.7211 0.8104 0.8104 1.5896 1.5896 6.8199 6.8199 7.4583 7.4583 7.9715 7.9715 8.2170 8.2170 8.8637 8.8637 9.3964 9.3964 9.8150 9.8150 10.5443 10.5443 10.8436 10.8436 11.2798 11.2798 11.3402 11.3402 11.5330 11.5330 11.7219 11.7219 12.2344 12.2344 12.2882 12.2882 12.4115 12.4115 12.5339 12.5339 12.8990 12.8990 12.9662 12.9662 13.1902 13.1902 13.2649 13.2649 13.4938 13.4938 13.8836 13.8836 14.0570 14.0570 14.4170 14.4170 14.7808 14.7808 15.0294 15.0294 15.1341 15.1341 15.1938 15.1938 k = 0.6212-0.1906-0.8159 ( 7782 PWs) bands (ev): 0.7305 0.7305 0.7882 0.7882 1.5997 1.5997 6.8449 6.8449 7.4606 7.4606 7.9566 7.9566 8.1923 8.1923 8.8568 8.8568 9.4096 9.4096 9.7910 9.7910 10.5266 10.5266 10.8221 10.8221 11.2670 11.2670 11.3173 11.3173 11.5116 11.5116 11.7356 11.7356 12.2812 12.2812 12.2884 12.2884 12.3861 12.3861 12.5638 12.5638 12.9159 12.9159 12.9783 12.9783 13.1738 13.1738 13.2982 13.2982 13.4817 13.4817 13.8808 13.8808 14.1038 14.1038 14.4013 14.4013 14.7853 14.7853 15.0928 15.0928 15.1284 15.1284 15.1932 15.1932 k = 0.6131-0.1666-0.8159 ( 7782 PWs) bands (ev): 0.7386 0.7386 0.7672 0.7672 1.6097 1.6097 6.8732 6.8732 7.4608 7.4608 7.9407 7.9407 8.1685 8.1685 8.8473 8.8473 9.4230 9.4230 9.7679 9.7679 10.5077 10.5077 10.7965 10.7965 11.2417 11.2417 11.2904 11.2904 11.4933 11.4933 11.7576 11.7576 12.2793 12.2793 12.2924 12.2924 12.4129 12.4129 12.5945 12.5945 12.9399 12.9399 12.9884 12.9884 13.1633 13.1633 13.3372 13.3372 13.4700 13.4700 13.8801 13.8801 14.1368 14.1368 14.3929 14.3929 14.7892 14.7892 15.0955 15.0955 15.1628 15.1628 15.2243 15.2243 k = 0.6050-0.1427-0.8159 ( 7786 PWs) bands (ev): 0.7454 0.7454 0.7476 0.7476 1.6193 1.6193 6.9046 6.9046 7.4595 7.4595 7.9237 7.9237 8.1460 8.1460 8.8357 8.8357 9.4356 9.4356 9.7469 9.7469 10.4874 10.4874 10.7676 10.7676 11.2074 11.2074 11.2609 11.2609 11.4764 11.4764 11.7850 11.7850 12.2585 12.2585 12.2833 12.2833 12.4810 12.4810 12.6254 12.6254 12.9698 12.9698 12.9947 12.9947 13.1607 13.1607 13.3801 13.3801 13.4592 13.4592 13.8809 13.8809 14.1486 14.1486 14.4002 14.4002 14.7925 14.7925 15.0612 15.0612 15.2298 15.2298 15.2693 15.2693 k = 0.5970-0.1187-0.8159 ( 7780 PWs) bands (ev): 0.7292 0.7292 0.7511 0.7511 1.6285 1.6285 6.9388 6.9388 7.4567 7.4567 7.9054 7.9054 8.1249 8.1249 8.8228 8.8228 9.4458 9.4458 9.7299 9.7299 10.4656 10.4656 10.7367 10.7367 11.1674 11.1674 11.2302 11.2302 11.4598 11.4598 11.8144 11.8144 12.2228 12.2228 12.2894 12.2894 12.5595 12.5595 12.6563 12.6563 12.9868 12.9868 13.0141 13.0141 13.1658 13.1658 13.4211 13.4211 13.4546 13.4546 13.8826 13.8826 14.1385 14.1385 14.4247 14.4247 14.7958 14.7958 15.0265 15.0265 15.2893 15.2893 15.3215 15.3216 k = 0.5889-0.0948-0.8159 ( 7774 PWs) bands (ev): 0.7122 0.7122 0.7558 0.7558 1.6373 1.6373 6.9755 6.9755 7.4528 7.4528 7.8856 7.8856 8.1053 8.1053 8.8093 8.8093 9.4512 9.4512 9.7191 9.7191 10.4421 10.4421 10.7049 10.7049 11.1247 11.1247 11.1990 11.1990 11.4432 11.4432 11.8427 11.8427 12.1875 12.1875 12.3028 12.3028 12.6413 12.6413 12.6870 12.6870 12.9809 12.9809 13.0571 13.0571 13.1758 13.1758 13.4301 13.4301 13.4862 13.4862 13.8845 13.8845 14.1138 14.1138 14.4598 14.4598 14.7995 14.7995 14.9929 14.9929 15.3148 15.3148 15.3719 15.3720 k = 0.5808-0.0708-0.8159 ( 7776 PWs) bands (ev): 0.6966 0.6966 0.7597 0.7597 1.6455 1.6455 7.0143 7.0143 7.4482 7.4482 7.8642 7.8642 8.0875 8.0875 8.7962 8.7962 9.4497 9.4497 9.7169 9.7169 10.4165 10.4165 10.6735 10.6735 11.0814 11.0814 11.1677 11.1677 11.4268 11.4268 11.8674 11.8674 12.1547 12.1547 12.3240 12.3240 12.7174 12.7174 12.7242 12.7242 12.9698 12.9698 13.1074 13.1074 13.1861 13.1861 13.4260 13.4260 13.5353 13.5353 13.8860 13.8860 14.0826 14.0826 14.4979 14.4979 14.8040 14.8040 14.9606 14.9606 15.3055 15.3055 15.4262 15.4263 k = 0.5727-0.0469-0.8159 ( 7778 PWs) bands (ev): 0.6824 0.6824 0.7628 0.7628 1.6531 1.6531 7.0547 7.0547 7.4431 7.4431 7.8409 7.8409 8.0714 8.0714 8.7840 8.7840 9.4404 9.4404 9.7242 9.7242 10.3885 10.3885 10.6436 10.6436 11.0393 11.0393 11.1367 11.1367 11.4109 11.4109 11.8872 11.8872 12.1251 12.1251 12.3531 12.3531 12.7479 12.7479 12.8058 12.8058 12.9567 12.9567 13.1619 13.1619 13.1935 13.1935 13.4256 13.4256 13.5850 13.5850 13.8870 13.8870 14.0509 14.0509 14.5339 14.5339 14.8094 14.8094 14.9302 14.9302 15.2635 15.2635 15.4673 15.4674 k = 0.5646-0.0229-0.8159 ( 7786 PWs) bands (ev): 0.6697 0.6697 0.7652 0.7652 1.6600 1.6600 7.0964 7.0964 7.4379 7.4379 7.8158 7.8158 8.0571 8.0571 8.7735 8.7735 9.4241 9.4241 9.7407 9.7407 10.3579 10.3579 10.6162 10.6162 10.9994 10.9994 11.1067 11.1067 11.3957 11.3957 11.9018 11.9018 12.0987 12.0987 12.3892 12.3892 12.7777 12.7777 12.8852 12.8852 12.9432 12.9432 13.1856 13.1856 13.2284 13.2284 13.4317 13.4317 13.6306 13.6306 13.8872 13.8872 14.0241 14.0241 14.5644 14.5644 14.8152 14.8152 14.9022 14.9022 15.1981 15.1981 15.4927 15.4927 k = 0.5566 0.0010-0.8159 ( 7788 PWs) bands (ev): 0.6583 0.6583 0.7672 0.7672 1.6662 1.6662 7.1387 7.1387 7.4328 7.4328 7.7887 7.7887 8.0446 8.0446 8.7651 8.7651 9.4029 9.4029 9.7644 9.7644 10.3248 10.3248 10.5919 10.5919 10.9627 10.9627 11.0781 11.0781 11.3815 11.3815 11.9118 11.9118 12.0759 12.0759 12.4306 12.4306 12.8066 12.8066 12.9289 12.9289 12.9623 12.9623 13.1760 13.1760 13.2910 13.2910 13.4439 13.4439 13.6671 13.6671 13.8866 13.8866 14.0083 14.0083 14.5862 14.5862 14.8200 14.8200 14.8780 14.8780 15.1238 15.1238 15.4993 15.4993 k = 0.5485 0.0250-0.8159 ( 7798 PWs) bands (ev): 0.6485 0.6485 0.7686 0.7686 1.6717 1.6717 7.1810 7.1810 7.4281 7.4281 7.7600 7.7600 8.0339 8.0339 8.7589 8.7589 9.3792 9.3792 9.7936 9.7936 10.2893 10.2893 10.5711 10.5711 10.9297 10.9297 11.0516 11.0516 11.3688 11.3688 11.9182 11.9182 12.0564 12.0564 12.4752 12.4752 12.8342 12.8342 12.9169 12.9169 13.0341 13.0341 13.1579 13.1579 13.3547 13.3547 13.4605 13.4605 13.6887 13.6887 13.8855 13.8855 14.0099 14.0099 14.5959 14.5959 14.8196 14.8196 14.8616 14.8616 15.0510 15.0510 15.4846 15.4846 k = 0.5404 0.0489-0.8159 ( 7786 PWs) bands (ev): 0.6402 0.6402 0.7698 0.7698 1.6764 1.6764 7.2226 7.2226 7.4242 7.4242 7.7301 7.7301 8.0249 8.0249 8.7548 8.7548 9.3550 9.3550 9.8266 9.8266 10.2519 10.2519 10.5539 10.5539 10.9011 10.9011 11.0279 11.0279 11.3576 11.3576 11.9220 11.9220 12.0402 12.0402 12.5208 12.5208 12.8590 12.8590 12.9069 12.9069 13.1018 13.1018 13.1342 13.1342 13.4136 13.4136 13.4797 13.4797 13.6946 13.6946 13.8843 13.8843 14.0317 14.0317 14.5897 14.5897 14.8092 14.8092 14.8576 14.8576 14.9872 14.9872 15.4649 15.4649 k = 0.5323 0.0729-0.8159 ( 7780 PWs) bands (ev): 0.6333 0.6333 0.7706 0.7706 1.6803 1.6803 7.2620 7.2620 7.4214 7.4214 7.6997 7.6997 8.0177 8.0177 8.7528 8.7528 9.3324 9.3324 9.8621 9.8621 10.2133 10.2133 10.5401 10.5401 10.8773 10.8773 11.0075 11.0075 11.3482 11.3482 11.9241 11.9241 12.0272 12.0272 12.5650 12.5650 12.8753 12.8753 12.9051 12.9051 13.1068 13.1068 13.1648 13.1648 13.4589 13.4589 13.5008 13.5008 13.6922 13.6922 13.8834 13.8834 14.0697 14.0697 14.5646 14.5646 14.7940 14.7940 14.8608 14.8608 14.9381 14.9381 15.4463 15.4463 k = 0.5242 0.0968-0.8159 ( 7776 PWs) bands (ev): 0.6280 0.6280 0.7712 0.7712 1.6833 1.6833 7.2975 7.2975 7.4204 7.4204 7.6701 7.6701 8.0120 8.0120 8.7521 8.7521 9.3128 9.3128 9.8989 9.8989 10.1743 10.1743 10.5295 10.5295 10.8584 10.8584 10.9910 10.9910 11.3407 11.3407 11.9250 11.9250 12.0173 12.0173 12.6052 12.6052 12.8745 12.8745 12.9199 12.9199 13.0778 13.0778 13.2222 13.2222 13.4835 13.4835 13.5188 13.5188 13.6945 13.6945 13.8828 13.8828 14.1178 14.1178 14.5215 14.5215 14.7797 14.7797 14.8655 14.8655 14.9057 14.9057 15.4309 15.4309 k = 0.5162 0.1208-0.8159 ( 7792 PWs) bands (ev): 0.6241 0.6241 0.7715 0.7715 1.6855 1.6855 7.3262 7.3262 7.4218 7.4218 7.6437 7.6437 8.0080 8.0080 8.7522 8.7522 9.2976 9.2976 9.9351 9.9351 10.1366 10.1366 10.5222 10.5222 10.8448 10.8448 10.9789 10.9789 11.3353 11.3353 11.9254 11.9254 12.0102 12.0102 12.6385 12.6385 12.8682 12.8682 12.9408 12.9408 13.0489 13.0489 13.2723 13.2723 13.4902 13.4902 13.5256 13.5256 13.7075 13.7075 13.8825 13.8825 14.1706 14.1706 14.4670 14.4670 14.7685 14.7685 14.8693 14.8693 14.8871 14.8871 15.4195 15.4195 k = 0.5081 0.1447-0.8159 ( 7796 PWs) bands (ev): 0.6218 0.6218 0.7717 0.7717 1.6868 1.6868 7.3445 7.3445 7.4250 7.4250 7.6242 7.6242 8.0056 8.0056 8.7526 8.7526 9.2880 9.2880 9.9667 9.9667 10.1042 10.1042 10.5178 10.5178 10.8366 10.8366 10.9714 10.9714 11.3321 11.3321 11.9255 11.9255 12.0061 12.0061 12.6610 12.6610 12.8628 12.8628 12.9618 12.9618 13.0222 13.0222 13.3102 13.3102 13.4829 13.4829 13.5275 13.5275 13.7228 13.7228 13.8824 13.8824 14.2211 14.2211 14.4126 14.4126 14.7615 14.7615 14.8709 14.8709 14.8787 14.8787 15.4125 15.4125 k = 0.5000 0.1687-0.8159 ( 7800 PWs) bands (ev): 0.6211 0.6211 0.7718 0.7718 1.6872 1.6872 7.3507 7.3507 7.4269 7.4269 7.6168 7.6168 8.0048 8.0048 8.7528 8.7528 9.2847 9.2847 9.9815 9.9815 10.0891 10.0891 10.5163 10.5163 10.8338 10.8338 10.9689 10.9689 11.3310 11.3310 11.9255 11.9255 12.0047 12.0047 12.6691 12.6691 12.8606 12.8606 12.9753 12.9753 13.0067 13.0067 13.3257 13.3257 13.4764 13.4764 13.5284 13.5284 13.7292 13.7292 13.8824 13.8824 14.2476 14.2476 14.3843 14.3843 14.7591 14.7591 14.8705 14.8705 14.8771 14.8771 15.4101 15.4101 k = 0.5000 0.1687-0.8159 ( 7800 PWs) bands (ev): 0.6211 0.6211 0.7718 0.7718 1.6872 1.6872 7.3507 7.3507 7.4269 7.4269 7.6168 7.6168 8.0048 8.0048 8.7528 8.7528 9.2847 9.2847 9.9815 9.9815 10.0891 10.0891 10.5163 10.5163 10.8338 10.8338 10.9689 10.9689 11.3310 11.3310 11.9255 11.9255 12.0047 12.0047 12.6691 12.6691 12.8606 12.8606 12.9753 12.9753 13.0067 13.0067 13.3257 13.3257 13.4764 13.4764 13.5284 13.5284 13.7292 13.7292 13.8824 13.8824 14.2476 14.2476 14.3843 14.3843 14.7591 14.7591 14.8705 14.8705 14.8771 14.8771 15.4101 15.4101 k = 0.5192 0.1752-0.8028 ( 7804 PWs) bands (ev): 0.6197 0.6197 0.7731 0.7731 1.6872 1.6872 7.3518 7.3518 7.4205 7.4205 7.6183 7.6183 8.0112 8.0112 8.7527 8.7527 9.2821 9.2821 9.9800 9.9800 10.0908 10.0908 10.5152 10.5152 10.8206 10.8206 10.9829 10.9829 11.3341 11.3341 11.9252 11.9252 12.0045 12.0045 12.6681 12.6681 12.8592 12.8592 12.9756 12.9756 13.0028 13.0028 13.3253 13.3253 13.4812 13.4812 13.5283 13.5283 13.7303 13.7303 13.8788 13.8788 14.2440 14.2440 14.3825 14.3825 14.7581 14.7581 14.8469 14.8469 14.8995 14.8995 15.4063 15.4063 k = 0.5384 0.1816-0.7897 ( 7797 PWs) bands (ev): 0.6157 0.6157 0.7769 0.7769 1.6872 1.6872 7.3548 7.3548 7.4031 7.4031 7.6222 7.6222 8.0297 8.0297 8.7523 8.7523 9.2741 9.2741 9.9760 9.9760 10.0953 10.0953 10.5119 10.5119 10.7912 10.7912 11.0144 11.0144 11.3436 11.3436 11.9241 11.9241 12.0040 12.0040 12.6652 12.6652 12.8550 12.8550 12.9762 12.9762 12.9919 12.9919 13.3239 13.3239 13.4936 13.4936 13.5295 13.5295 13.7335 13.7335 13.8686 13.8686 14.2330 14.2330 14.3773 14.3773 14.7552 14.7552 14.8194 14.8194 14.9240 14.9240 15.3929 15.3929 k = 0.5576 0.1881-0.7766 ( 7797 PWs) bands (ev): 0.6093 0.6093 0.7830 0.7830 1.6872 1.6872 7.3559 7.3559 7.3811 7.3811 7.6275 7.6275 8.0584 8.0584 8.7516 8.7516 9.2609 9.2609 9.9703 9.9703 10.1013 10.1013 10.5068 10.5068 10.7577 10.7577 11.0521 11.0521 11.3588 11.3588 11.9222 11.9222 12.0031 12.0031 12.6609 12.6609 12.8481 12.8481 12.9707 12.9707 12.9818 12.9818 13.3202 13.3202 13.5044 13.5044 13.5395 13.5395 13.7388 13.7388 13.8540 13.8540 14.2142 14.2142 14.3693 14.3693 14.7501 14.7501 14.7923 14.7923 14.9491 14.9491 15.3670 15.3670 k = 0.5768 0.1946-0.7635 ( 7795 PWs) bands (ev): 0.6008 0.6008 0.7911 0.7911 1.6871 1.6871 7.3353 7.3353 7.3773 7.3773 7.6333 7.6333 8.0951 8.0951 8.7507 8.7507 9.2427 9.2427 9.9636 9.9636 10.1075 10.1075 10.5003 10.5003 10.7254 10.7254 11.0909 11.0909 11.3792 11.3792 11.9189 11.9189 12.0019 12.0019 12.6558 12.6558 12.8388 12.8388 12.9503 12.9503 12.9834 12.9834 13.3123 13.3123 13.5054 13.5054 13.5648 13.5648 13.7460 13.7460 13.8376 13.8376 14.1869 14.1869 14.3592 14.3592 14.7426 14.7426 14.7674 14.7674 14.9757 14.9757 15.3282 15.3282 k = 0.5960 0.2010-0.7504 ( 7787 PWs) bands (ev): 0.5905 0.5905 0.8009 0.8009 1.6869 1.6869 7.3003 7.3003 7.3865 7.3865 7.6394 7.6394 8.1374 8.1374 8.7497 8.7497 9.2196 9.2196 9.9566 9.9566 10.1124 10.1124 10.4931 10.4931 10.6973 10.6973 11.1291 11.1291 11.4038 11.4038 11.9137 11.9137 12.0005 12.0005 12.6508 12.6508 12.8271 12.8271 12.9260 12.9260 12.9875 12.9875 13.2985 13.2985 13.5018 13.5018 13.5979 13.5979 13.7557 13.7557 13.8224 13.8224 14.1511 14.1511 14.3481 14.3481 14.7317 14.7317 14.7471 14.7471 15.0044 15.0044 15.2797 15.2797 k = 0.6151 0.2075-0.7373 ( 7791 PWs) bands (ev): 0.5788 0.5788 0.8122 0.8122 1.6866 1.6866 7.2619 7.2619 7.3990 7.3990 7.6461 7.6461 8.1835 8.1835 8.7486 8.7486 9.1920 9.1920 9.9495 9.9495 10.1148 10.1148 10.4854 10.4854 10.6754 10.6754 11.1659 11.1659 11.4316 11.4316 11.9061 11.9061 11.9988 11.9988 12.6465 12.6465 12.8130 12.8130 12.9006 12.9006 12.9931 12.9931 13.2774 13.2774 13.4969 13.4969 13.6324 13.6324 13.7690 13.7690 13.8111 13.8111 14.1067 14.1067 14.3371 14.3371 14.7181 14.7181 14.7319 14.7319 15.0329 15.0329 15.2275 15.2275 k = 0.6343 0.2140-0.7242 ( 7786 PWs) bands (ev): 0.5657 0.5657 0.8249 0.8249 1.6860 1.6860 7.2226 7.2226 7.4135 7.4135 7.6534 7.6534 8.2319 8.2319 8.7475 8.7475 9.1602 9.1602 9.9426 9.9426 10.1141 10.1141 10.4769 10.4769 10.6614 10.6614 11.2009 11.2009 11.4615 11.4615 11.8956 11.8956 11.9969 11.9969 12.6438 12.6438 12.7963 12.7963 12.8758 12.8758 13.0001 13.0001 13.2493 13.2493 13.4914 13.4914 13.6624 13.6624 13.7879 13.7879 13.8057 13.8057 14.0549 14.0549 14.3278 14.3278 14.7055 14.7055 14.7187 14.7187 15.0518 15.0518 15.1845 15.1845 k = 0.6535 0.2205-0.7112 ( 7794 PWs) bands (ev): 0.5515 0.5515 0.8388 0.8388 1.6853 1.6853 7.1833 7.1833 7.4293 7.4293 7.6616 7.6616 8.2811 8.2811 8.7465 8.7465 9.1248 9.1248 9.9358 9.9358 10.1103 10.1103 10.4669 10.4669 10.6570 10.6570 11.2339 11.2339 11.4925 11.4925 11.8817 11.8817 11.9950 11.9950 12.6430 12.6430 12.7763 12.7763 12.8533 12.8533 13.0085 13.0085 13.2155 13.2155 13.4853 13.4853 13.6823 13.6823 13.7986 13.7986 13.8228 13.8228 13.9972 13.9972 14.3213 14.3213 14.6948 14.6948 14.7071 14.7071 15.0366 15.0366 15.1772 15.1772 k = 0.6535 0.2205-0.7112 ( 7794 PWs) bands (ev): 0.5515 0.5515 0.8388 0.8388 1.6853 1.6853 7.1833 7.1833 7.4293 7.4293 7.6616 7.6616 8.2811 8.2811 8.7465 8.7465 9.1248 9.1248 9.9358 9.9358 10.1103 10.1103 10.4669 10.4669 10.6570 10.6570 11.2339 11.2339 11.4925 11.4925 11.8817 11.8817 11.9950 11.9950 12.6430 12.6430 12.7763 12.7763 12.8533 12.8533 13.0085 13.0085 13.2155 13.2155 13.4853 13.4853 13.6823 13.6823 13.7986 13.7986 13.8228 13.8228 13.9972 13.9972 14.3213 14.3213 14.6948 14.6948 14.7071 14.7071 15.0366 15.0366 15.1772 15.1772 k = 0.6487 0.2188-0.6857 ( 7788 PWs) bands (ev): 0.5426 0.5426 0.8271 0.8271 1.7035 1.7035 7.1880 7.1880 7.4322 7.4322 7.6660 7.6660 8.2735 8.2735 8.7390 8.7390 9.1171 9.1171 9.9295 9.9295 10.0786 10.0786 10.4756 10.4756 10.6430 10.6430 11.1976 11.1976 11.5313 11.5313 11.8607 11.8607 11.9828 11.9828 12.6730 12.6730 12.7480 12.7480 12.8699 12.8699 13.0058 13.0058 13.2018 13.2018 13.4711 13.4711 13.6887 13.6887 13.7695 13.7695 13.8303 13.8303 14.0079 14.0079 14.2925 14.2925 14.6771 14.6771 14.7168 14.7168 14.9958 14.9958 15.2362 15.2362 k = 0.6439 0.2172-0.6602 ( 7780 PWs) bands (ev): 0.5255 0.5255 0.8203 0.8203 1.7243 1.7243 7.1937 7.1937 7.4337 7.4337 7.6695 7.6695 8.2661 8.2661 8.7298 8.7298 9.1083 9.1083 9.9174 9.9174 10.0505 10.0505 10.4825 10.4825 10.6276 10.6276 11.1564 11.1564 11.5703 11.5703 11.8394 11.8394 11.9682 11.9682 12.6887 12.6887 12.7174 12.7174 12.8849 12.8849 12.9999 12.9999 13.2041 13.2041 13.4569 13.4569 13.6830 13.6830 13.7424 13.7424 13.8368 13.8368 14.0145 14.0145 14.2767 14.2767 14.6581 14.6581 14.7145 14.7145 14.9733 14.9733 15.3047 15.3047 k = 0.6391 0.2156-0.6347 ( 7772 PWs) bands (ev): 0.5017 0.5017 0.8172 0.8172 1.7475 1.7475 7.2009 7.2009 7.4333 7.4333 7.6719 7.6719 8.2592 8.2592 8.7191 8.7191 9.0982 9.0982 9.8964 9.8964 10.0295 10.0295 10.4883 10.4883 10.6107 10.6107 11.1116 11.1116 11.6069 11.6069 11.8199 11.8199 11.9512 11.9512 12.6764 12.6764 12.6962 12.6962 12.8957 12.8957 12.9871 12.9871 13.2235 13.2235 13.4458 13.4458 13.6664 13.6664 13.7213 13.7213 13.8418 13.8418 14.0168 14.0168 14.2738 14.2738 14.6454 14.6454 14.6917 14.6917 14.9734 14.9734 15.3810 15.3810 k = 0.6343 0.2140-0.6092 ( 7770 PWs) bands (ev): 0.4729 0.4729 0.8163 0.8163 1.7731 1.7731 7.2099 7.2099 7.4304 7.4304 7.6727 7.6727 8.2530 8.2530 8.7073 8.7073 9.0867 9.0867 9.8653 9.8653 10.0172 10.0172 10.4938 10.4938 10.5925 10.5925 11.0644 11.0644 11.6352 11.6352 11.8079 11.8079 11.9315 11.9315 12.6439 12.6439 12.6766 12.6766 12.9007 12.9007 12.9661 12.9661 13.2547 13.2547 13.4415 13.4415 13.6417 13.6417 13.7092 13.7092 13.8453 13.8453 14.0160 14.0160 14.2805 14.2805 14.6365 14.6365 14.6605 14.6605 14.9895 14.9895 15.4636 15.4636 k = 0.6295 0.2124-0.5837 ( 7774 PWs) bands (ev): 0.4407 0.4407 0.8162 0.8162 1.8009 1.8009 7.2210 7.2210 7.4251 7.4251 7.6717 7.6717 8.2472 8.2472 8.6945 8.6945 9.0742 9.0742 9.8262 9.8262 10.0116 10.0116 10.4987 10.4987 10.5740 10.5740 11.0159 11.0159 11.6458 11.6458 11.8125 11.8125 11.9092 11.9092 12.6090 12.6090 12.6436 12.6436 12.8982 12.8982 12.9375 12.9375 13.2871 13.2871 13.4500 13.4500 13.6087 13.6087 13.7120 13.7120 13.8465 13.8465 14.0134 14.0134 14.2921 14.2921 14.5957 14.5957 14.6698 14.6698 15.0115 15.0115 15.5505 15.5505 k = 0.6247 0.2108-0.5582 ( 7771 PWs) bands (ev): 0.4063 0.4063 0.8159 0.8159 1.8307 1.8307 7.2340 7.2340 7.4173 7.4173 7.6687 7.6687 8.2414 8.2414 8.6812 8.6812 9.0613 9.0613 9.7818 9.7818 10.0102 10.0102 10.5014 10.5014 10.5574 10.5574 10.9668 10.9668 11.6350 11.6350 11.8361 11.8361 11.8851 11.8851 12.5727 12.5727 12.6001 12.6001 12.8846 12.8846 12.9050 12.9050 13.3078 13.3078 13.4800 13.4800 13.5709 13.5709 13.7293 13.7293 13.8439 13.8439 14.0103 14.0103 14.3063 14.3063 14.5444 14.5444 14.7064 14.7064 15.0319 15.0319 15.5955 15.5955 k = 0.6199 0.2091-0.5327 ( 7765 PWs) bands (ev): 0.3706 0.3706 0.8149 0.8149 1.8623 1.8623 7.2486 7.2486 7.4076 7.4076 7.6636 7.6636 8.2349 8.2349 8.6673 8.6673 9.0491 9.0491 9.7339 9.7339 10.0112 10.0112 10.4976 10.4976 10.5477 10.5477 10.9174 10.9174 11.6098 11.6098 11.8497 11.8497 11.8804 11.8804 12.5317 12.5317 12.5532 12.5532 12.8527 12.8527 12.8773 12.8773 13.3135 13.3135 13.5143 13.5143 13.5511 13.5511 13.7546 13.7546 13.8364 13.8364 14.0076 14.0076 14.3235 14.3235 14.4943 14.4943 14.7616 14.7616 15.0463 15.0463 15.5786 15.5786 k = 0.6151 0.2075-0.5072 ( 7775 PWs) bands (ev): 0.3342 0.3342 0.8129 0.8129 1.8954 1.8954 7.2641 7.2641 7.3968 7.3968 7.6566 7.6566 8.2268 8.2268 8.6531 8.6531 9.0388 9.0388 9.6837 9.6837 10.0138 10.0138 10.4844 10.4844 10.5481 10.5481 10.8680 10.8680 11.5774 11.5774 11.8218 11.8218 11.9187 11.9187 12.4784 12.4784 12.5135 12.5135 12.8128 12.8128 12.8471 12.8471 13.3109 13.3109 13.4869 13.4869 13.6091 13.6091 13.7814 13.7814 13.8239 13.8239 14.0056 14.0056 14.3456 14.3456 14.4508 14.4508 14.8314 14.8314 15.0523 15.0523 15.5652 15.5652 k = 0.6103 0.2059-0.4817 ( 7772 PWs) bands (ev): 0.2975 0.2975 0.8097 0.8097 1.9300 1.9300 7.2786 7.2786 7.3867 7.3867 7.6479 7.6479 8.2160 8.2160 8.6386 8.6386 9.0315 9.0315 9.6322 9.6322 10.0175 10.0175 10.4657 10.4657 10.5544 10.5544 10.8189 10.8189 11.5412 11.5412 11.7882 11.7882 11.9595 11.9595 12.4175 12.4175 12.4788 12.4788 12.7747 12.7747 12.8082 12.8082 13.3052 13.3052 13.4553 13.4553 13.6760 13.6760 13.8005 13.8005 13.8148 13.8148 14.0042 14.0042 14.3721 14.3721 14.4195 14.4195 14.9102 14.9102 15.0521 15.0521 15.5591 15.5591 k = 0.6055 0.2043-0.4562 ( 7773 PWs) bands (ev): 0.2610 0.2610 0.8053 0.8053 1.9656 1.9656 7.2881 7.2881 7.3814 7.3814 7.6379 7.6379 8.2019 8.2019 8.6239 8.6239 9.0278 9.0278 9.5807 9.5807 10.0219 10.0219 10.4451 10.4451 10.5624 10.5624 10.7707 10.7707 11.5032 11.5032 11.7515 11.7515 11.9968 11.9968 12.3539 12.3539 12.4460 12.4460 12.7431 12.7431 12.7607 12.7607 13.2987 13.2987 13.4288 13.4288 13.7221 13.7221 13.7837 13.7837 13.8478 13.8478 14.0047 14.0047 14.3857 14.3857 14.4210 14.4210 14.9819 14.9819 15.0628 15.0628 15.5612 15.5612 k = 0.6007 0.2027-0.4307 ( 7762 PWs) bands (ev): 0.2249 0.2249 0.7997 0.7997 2.0022 2.0022 7.2874 7.2874 7.3859 7.3859 7.6270 7.6270 8.1840 8.1840 8.6092 8.6092 9.0276 9.0276 9.5308 9.5308 10.0270 10.0270 10.4236 10.4236 10.5689 10.5689 10.7250 10.7250 11.4642 11.4642 11.7120 11.7120 12.0275 12.0275 12.2900 12.2900 12.4142 12.4142 12.7052 12.7052 12.7223 12.7223 13.2918 13.2918 13.4076 13.4076 13.7304 13.7304 13.7621 13.7621 13.8921 13.8921 14.0172 14.0172 14.3830 14.3830 14.4586 14.4586 15.0048 15.0048 15.1305 15.1305 15.5713 15.5713 k = 0.5960 0.2010-0.4052 ( 7774 PWs) bands (ev): 0.1895 0.1895 0.7931 0.7931 2.0394 2.0394 7.2757 7.2757 7.4005 7.4005 7.6157 7.6157 8.1622 8.1622 8.5948 8.5948 9.0293 9.0293 9.4852 9.4852 10.0327 10.0327 10.4014 10.4014 10.5687 10.5687 10.6862 10.6862 11.4250 11.4250 11.6700 11.6700 12.0491 12.0491 12.2273 12.2273 12.3833 12.3833 12.6446 12.6446 12.7144 12.7144 13.2841 13.2841 13.3911 13.3911 13.7112 13.7112 13.7395 13.7395 13.9135 13.9135 14.0566 14.0566 14.3912 14.3912 14.5050 14.5050 15.0098 15.0098 15.2303 15.2303 15.5878 15.5878 k = 0.5912 0.1994-0.3797 ( 7776 PWs) bands (ev): 0.1549 0.1549 0.7855 0.7855 2.0770 2.0770 7.2572 7.2572 7.4207 7.4207 7.6048 7.6048 8.1372 8.1372 8.5811 8.5811 9.0298 9.0298 9.4475 9.4475 10.0387 10.0387 10.3784 10.3784 10.5525 10.5525 10.6633 10.6633 11.3859 11.3859 11.6258 11.6258 12.0603 12.0603 12.1671 12.1671 12.3529 12.3529 12.5802 12.5802 12.7216 12.7216 13.2746 13.2746 13.3782 13.3782 13.6760 13.6760 13.7170 13.7170 13.9118 13.9118 14.1010 14.1010 14.4217 14.4217 14.5561 14.5561 15.0239 15.0239 15.3396 15.3396 15.6093 15.6093 k = 0.5864 0.1978-0.3542 ( 7778 PWs) bands (ev): 0.1213 0.1213 0.7772 0.7772 2.1147 2.1147 7.2348 7.2348 7.4418 7.4418 7.5956 7.5956 8.1100 8.1100 8.5683 8.5683 9.0247 9.0247 9.4222 9.4222 10.0451 10.0451 10.3544 10.3544 10.5175 10.5175 10.6586 10.6586 11.3474 11.3474 11.5796 11.5796 12.0608 12.0608 12.1109 12.1109 12.3229 12.3229 12.5141 12.5141 12.7434 12.7434 13.2621 13.2621 13.3679 13.3679 13.6316 13.6316 13.6960 13.6960 13.8986 13.8986 14.1217 14.1217 14.4853 14.4853 14.6105 14.6105 15.0520 15.0520 15.4538 15.4538 15.6348 15.6348 k = 0.5816 0.1962-0.3287 ( 7780 PWs) bands (ev): 0.0889 0.0889 0.7682 0.7682 2.1523 2.1523 7.2104 7.2104 7.4598 7.4598 7.5899 7.5899 8.0821 8.0821 8.5568 8.5568 9.0099 9.0099 9.4131 9.4131 10.0516 10.0516 10.3293 10.3293 10.4723 10.4723 10.6634 10.6634 11.3097 11.3097 11.5318 11.5318 12.0451 12.0451 12.0673 12.0673 12.2927 12.2927 12.4484 12.4484 12.7774 12.7774 13.2444 13.2444 13.3595 13.3595 13.5841 13.5841 13.6773 13.6773 13.8745 13.8745 14.1203 14.1203 14.5783 14.5783 14.6676 14.6676 15.0926 15.0926 15.5711 15.5711 15.6642 15.6642 k = 0.5768 0.1946-0.3032 ( 7784 PWs) bands (ev): 0.0578 0.0578 0.7588 0.7588 2.1897 2.1897 7.1848 7.1848 7.4708 7.4708 7.5899 7.5899 8.0555 8.0555 8.5468 8.5468 8.9840 8.9840 9.4213 9.4213 10.0580 10.0580 10.3033 10.3033 10.4234 10.4234 10.6712 10.6712 11.2729 11.2729 11.4828 11.4828 12.0029 12.0029 12.0497 12.0497 12.2612 12.2612 12.3855 12.3855 12.8205 12.8205 13.2197 13.2197 13.3526 13.3526 13.5384 13.5384 13.6608 13.6608 13.8361 13.8361 14.1132 14.1132 14.6850 14.6850 14.7300 14.7300 15.1419 15.1419 15.6792 15.6792 15.7083 15.7083 k = 0.5720 0.1930-0.2777 ( 7798 PWs) bands (ev): 0.0280 0.0280 0.7491 0.7491 2.2264 2.2264 7.1587 7.1587 7.4727 7.4727 7.5958 7.5958 8.0328 8.0328 8.5384 8.5384 8.9488 8.9488 9.4442 9.4442 10.0639 10.0639 10.2770 10.2770 10.3734 10.3734 10.6794 10.6794 11.2373 11.2373 11.4330 11.4330 11.9598 11.9598 12.0357 12.0357 12.2261 12.2261 12.3287 12.3287 12.8691 12.8691 13.1867 13.1867 13.3469 13.3469 13.4978 13.4978 13.6465 13.6465 13.7835 13.7835 14.1115 14.1115 14.7688 14.7688 14.8248 14.8248 15.1952 15.1952 15.7254 15.7254 15.8197 15.8197 k = 0.5672 0.1913-0.2522 ( 7797 PWs) bands (ev): -0.0002 -0.0002 0.7392 0.7392 2.2624 2.2624 7.1325 7.1325 7.4669 7.4669 7.6037 7.6037 8.0170 8.0170 8.5315 8.5315 8.9076 8.9076 9.4776 9.4776 10.0684 10.0684 10.2512 10.2512 10.3238 10.3238 10.6866 10.6866 11.2031 11.2031 11.3827 11.3827 11.9209 11.9209 12.0222 12.0222 12.1843 12.1843 12.2819 12.2819 12.9190 12.9190 13.1463 13.1463 13.3420 13.3420 13.4630 13.4630 13.6338 13.6338 13.7217 13.7217 14.1179 14.1179 14.8280 14.8280 14.9472 14.9472 15.2479 15.2479 15.7655 15.7655 15.9422 15.9422 k = 0.5624 0.1897-0.2267 ( 7796 PWs) bands (ev): -0.0269 -0.0269 0.7293 0.7293 2.2973 2.2973 7.1065 7.1065 7.4564 7.4564 7.6086 7.6086 8.0106 8.0106 8.5261 8.5261 8.8638 8.8638 9.5175 9.5175 10.0702 10.0702 10.2278 10.2278 10.2756 10.2756 10.6923 10.6923 11.1702 11.1702 11.3324 11.3324 11.8868 11.8868 12.0105 12.0105 12.1357 12.1357 12.2461 12.2461 12.9635 12.9635 13.1045 13.1045 13.3367 13.3367 13.4320 13.4320 13.6192 13.6192 13.6619 13.6619 14.1311 14.1311 14.8824 14.8824 15.0728 15.0728 15.2960 15.2960 15.8101 15.8101 15.9898 15.9898 k = 0.5576 0.1881-0.2012 ( 7810 PWs) bands (ev): -0.0519 -0.0519 0.7195 0.7195 2.3310 2.3310 7.0812 7.0812 7.4433 7.4433 7.6071 7.6071 8.0154 8.0154 8.5219 8.5219 8.8197 8.8197 9.5601 9.5601 10.0673 10.0673 10.2074 10.2074 10.2317 10.2317 10.6962 10.6962 11.1388 11.1388 11.2827 11.2827 11.8573 11.8573 12.0015 12.0015 12.0837 12.0837 12.2185 12.2185 12.9816 12.9816 13.0819 13.0819 13.3285 13.3285 13.4024 13.4024 13.5849 13.5849 13.6304 13.6304 14.1493 14.1493 14.9336 14.9336 15.1942 15.1942 15.3377 15.3377 15.8589 15.8589 16.0019 16.0019 k = 0.5528 0.1865-0.1757 ( 7809 PWs) bands (ev): -0.0752 -0.0752 0.7100 0.7100 2.3631 2.3631 7.0566 7.0566 7.4288 7.4288 7.5986 7.5986 8.0309 8.0309 8.5186 8.5186 8.7774 8.7774 9.6019 9.6019 10.0586 10.0586 10.1763 10.1763 10.2093 10.2093 10.6981 10.6981 11.1090 11.1090 11.2338 11.2338 11.8319 11.8319 11.9956 11.9956 12.0322 12.0322 12.1960 12.1960 12.9514 12.9514 13.0979 13.0979 13.3109 13.3109 13.3773 13.3773 13.5442 13.5442 13.6217 13.6217 14.1709 14.1709 14.9814 14.9814 15.2958 15.2958 15.3831 15.3831 15.9059 15.9059 16.0365 16.0365 k = 0.5480 0.1849-0.1502 ( 7814 PWs) bands (ev): -0.0966 -0.0966 0.7009 0.7009 2.3934 2.3934 7.0332 7.0332 7.4138 7.4138 7.5845 7.5845 8.0553 8.0553 8.5158 8.5158 8.7383 8.7383 9.6395 9.6395 10.0455 10.0455 10.1358 10.1358 10.2083 10.2083 10.6982 10.6982 11.0806 11.0806 11.1864 11.1864 11.8103 11.8103 11.9793 11.9793 11.9974 11.9974 12.1768 12.1768 12.9023 12.9023 13.1145 13.1145 13.2847 13.2847 13.3639 13.3639 13.5171 13.5171 13.6183 13.6183 14.1945 14.1945 15.0256 15.0256 15.3412 15.3412 15.4660 15.4660 15.9438 15.9438 16.1020 16.1020 k = 0.5432 0.1832-0.1247 ( 7829 PWs) bands (ev): -0.1162 -0.1162 0.6924 0.6924 2.4217 2.4217 7.0111 7.0111 7.3986 7.3986 7.5669 7.5669 8.0857 8.0857 8.5126 8.5126 8.7042 8.7042 9.6686 9.6686 10.0327 10.0327 10.0967 10.0967 10.2167 10.2167 10.6966 10.6966 11.0537 11.0537 11.1410 11.1410 11.7920 11.7920 11.9344 11.9344 11.9984 11.9984 12.1603 12.1603 12.8507 12.8507 13.0981 13.0981 13.2746 13.2746 13.3587 13.3587 13.5029 13.5029 13.6176 13.6176 14.2193 14.2193 15.0659 15.0659 15.3499 15.3499 15.5665 15.5665 15.9748 15.9748 16.1941 16.1941 k = 0.5384 0.1816-0.0992 ( 7832 PWs) bands (ev): -0.1339 -0.1339 0.6844 0.6844 2.4479 2.4479 6.9906 6.9906 7.3837 7.3837 7.5480 7.5480 8.1194 8.1194 8.5078 8.5078 8.6768 8.6768 9.6856 9.6856 10.0249 10.0249 10.0606 10.0606 10.2316 10.2316 10.6938 10.6938 11.0282 11.0282 11.0980 11.0980 11.7765 11.7765 11.8920 11.8920 12.0047 12.0047 12.1461 12.1461 12.8009 12.8009 13.0480 13.0480 13.2872 13.2872 13.3567 13.3567 13.4979 13.4979 13.6194 13.6194 14.2443 14.2443 15.1018 15.1018 15.3451 15.3451 15.6624 15.6624 16.0044 16.0044 16.3044 16.3044 k = 0.5336 0.1800-0.0737 ( 7827 PWs) bands (ev): -0.1496 -0.1496 0.6771 0.6771 2.4715 2.4715 6.9719 6.9719 7.3693 7.3693 7.5293 7.5293 8.1541 8.1541 8.5001 8.5001 8.6577 8.6577 9.6884 9.6884 10.0237 10.0237 10.0295 10.0295 10.2511 10.2511 10.6900 10.6900 11.0044 11.0044 11.0579 11.0579 11.7635 11.7635 11.8538 11.8538 12.0143 12.0143 12.1339 12.1339 12.7549 12.7549 12.9842 12.9842 13.3064 13.3064 13.3560 13.3560 13.4992 13.4992 13.6233 13.6233 14.2688 14.2688 15.1333 15.1333 15.3334 15.3334 15.7490 15.7490 16.0344 16.0344 16.4266 16.4266 k = 0.5288 0.1784-0.0482 ( 7830 PWs) bands (ev): -0.1633 -0.1633 0.6707 0.6707 2.4925 2.4925 6.9552 6.9552 7.3559 7.3559 7.5121 7.5121 8.1877 8.1877 8.4890 8.4890 8.6477 8.6477 9.6785 9.6785 9.9990 9.9990 10.0332 10.0332 10.2741 10.2741 10.6857 10.6857 10.9822 10.9822 11.0213 11.0213 11.7526 11.7526 11.8203 11.8203 12.0265 12.0265 12.1237 12.1237 12.7136 12.7136 12.9184 12.9184 13.3234 13.3234 13.3558 13.3558 13.5046 13.5046 13.6294 13.6294 14.2920 14.2920 15.1600 15.1600 15.3181 15.3181 15.8248 15.8248 16.0650 16.0650 16.5561 16.5561 k = 0.5240 0.1768-0.0227 ( 7836 PWs) bands (ev): -0.1749 -0.1749 0.6651 0.6651 2.5106 2.5106 6.9407 6.9407 7.3436 7.3436 7.4970 7.4970 8.2187 8.2187 8.4751 8.4751 8.6457 8.6457 9.6601 9.6601 9.9745 9.9745 10.0449 10.0449 10.2990 10.2990 10.6811 10.6811 10.9620 10.9620 10.9888 10.9888 11.7438 11.7438 11.7916 11.7916 12.0402 12.0402 12.1154 12.1154 12.6777 12.6777 12.8560 12.8560 13.3363 13.3363 13.3559 13.3559 13.5119 13.5119 13.6371 13.6371 14.3133 14.3133 15.1818 15.1818 15.3020 15.3020 15.8891 15.8891 16.0951 16.0951 16.6880 16.6880 k = 0.5192 0.1752 0.0028 ( 7843 PWs) bands (ev): -0.1845 -0.1845 0.6604 0.6604 2.5257 2.5257 6.9285 6.9285 7.3330 7.3330 7.4844 7.4844 8.2459 8.2459 8.4602 8.4602 8.6495 8.6495 9.6380 9.6380 9.9542 9.9542 10.0576 10.0576 10.3242 10.3242 10.6768 10.6768 10.9442 10.9442 10.9609 10.9609 11.7367 11.7367 11.7680 11.7680 12.0540 12.0540 12.1092 12.1092 12.6479 12.6479 12.8002 12.8002 13.3453 13.3453 13.3560 13.3560 13.5192 13.5192 13.6458 13.6458 14.3319 14.3319 15.1982 15.1982 15.2874 15.2874 15.9418 15.9418 16.1231 16.1231 16.8134 16.8134 k = 0.5144 0.1735 0.0283 ( 7844 PWs) bands (ev): -0.1920 -0.1920 0.6568 0.6568 2.5376 2.5376 6.9189 6.9189 7.3243 7.3243 7.4745 7.4745 8.2684 8.2684 8.4461 8.4461 8.6561 8.6561 9.6163 9.6163 9.9383 9.9383 10.0690 10.0690 10.3473 10.3473 10.6728 10.6728 10.9293 10.9293 10.9382 10.9382 11.7312 11.7312 11.7497 11.7497 12.0663 12.0663 12.1054 12.1054 12.6244 12.6244 12.7533 12.7533 13.3512 13.3512 13.3560 13.3560 13.5254 13.5254 13.6542 13.6542 14.3473 14.3473 15.2086 15.2086 15.2764 15.2764 15.9831 15.9831 16.1469 16.1469 16.8635 16.8635 k = 0.5096 0.1719 0.0538 ( 7836 PWs) bands (ev): -0.1973 -0.1973 0.6541 0.6541 2.5461 2.5461 6.9119 6.9119 7.3179 7.3179 7.4674 7.4674 8.2856 8.2856 8.4344 8.4344 8.6631 8.6631 9.5984 9.5984 9.9268 9.9268 10.0777 10.0777 10.3661 10.3661 10.6697 10.6697 10.9178 10.9178 10.9215 10.9215 11.7271 11.7271 11.7368 11.7368 12.0751 12.0751 12.1043 12.1043 12.6075 12.6075 12.7176 12.7176 13.3549 13.3549 13.3561 13.3561 13.5299 13.5299 13.6612 13.6612 14.3588 14.3588 15.2132 15.2132 15.2704 15.2704 16.0129 16.0129 16.1649 16.1649 16.8711 16.8711 k = 0.5048 0.1703 0.0793 ( 7842 PWs) bands (ev): -0.2005 -0.2005 0.6525 0.6525 2.5513 2.5513 6.9076 6.9076 7.3139 7.3139 7.4632 7.4632 8.2965 8.2965 8.4265 8.4265 8.6684 8.6684 9.5866 9.5866 9.9200 9.9200 10.0832 10.0832 10.3785 10.3785 10.6677 10.6677 10.9098 10.9098 10.9120 10.9120 11.7239 11.7239 11.7299 11.7299 12.0795 12.0795 12.1053 12.1053 12.5973 12.5973 12.6952 12.6952 13.3560 13.3560 13.3571 13.3571 13.5326 13.5326 13.6659 13.6659 14.3659 14.3659 15.2140 15.2140 15.2683 15.2683 16.0310 16.0310 16.1760 16.1760 16.8744 16.8744 k = 0.5000 0.1687 0.1048 ( 7840 PWs) bands (ev): -0.2016 -0.2016 0.6520 0.6520 2.5531 2.5531 6.9062 6.9062 7.3126 7.3126 7.4617 7.4617 8.3003 8.3003 8.4237 8.4237 8.6703 8.6703 9.5825 9.5825 9.9177 9.9177 10.0850 10.0850 10.3828 10.3828 10.6670 10.6670 10.9066 10.9066 10.9092 10.9092 11.7224 11.7224 11.7280 11.7280 12.0806 12.0806 12.1061 12.1061 12.5939 12.5939 12.6875 12.6875 13.3560 13.3560 13.3577 13.3577 13.5334 13.5334 13.6675 13.6675 14.3683 14.3683 15.2138 15.2138 15.2679 15.2679 16.0371 16.0371 16.1797 16.1797 16.8754 16.8754 k = 0.5000-0.6567-0.4080 ( 7780 PWs) bands (ev): 0.4153 0.4153 1.1932 1.1932 1.4659 1.4659 6.7867 6.7867 7.5789 7.5789 7.8555 7.8555 8.6236 8.6236 8.7003 8.7003 8.9691 8.9691 9.9384 9.9384 10.2367 10.2367 10.2786 10.2786 10.9323 10.9323 11.3195 11.3195 11.7724 11.7724 11.9698 11.9698 12.0680 12.0680 12.3334 12.3334 12.4904 12.4904 12.7002 12.7002 12.8410 12.8410 13.0759 13.0759 13.4997 13.4997 13.5441 13.5441 13.6646 13.6646 14.1647 14.1647 14.2491 14.2491 14.4184 14.4184 14.6996 14.6996 14.7529 14.7529 14.8040 14.8040 14.9739 14.9739 k = 0.5219-0.6447-0.4005 ( 7774 PWs) bands (ev): 0.4161 0.4161 1.1889 1.1889 1.4694 1.4694 6.7890 6.7890 7.5782 7.5782 7.8529 7.8529 8.6256 8.6256 8.7013 8.7013 8.9662 8.9662 9.9382 9.9382 10.2361 10.2361 10.2793 10.2793 10.9290 10.9290 11.3214 11.3214 11.7718 11.7718 11.9660 11.9660 12.0671 12.0671 12.3376 12.3376 12.4930 12.4930 12.7006 12.7006 12.8442 12.8442 13.0792 13.0792 13.4935 13.4935 13.5464 13.5464 13.6648 13.6648 14.1627 14.1627 14.2385 14.2385 14.4274 14.4274 14.6985 14.6985 14.7457 14.7457 14.7977 14.7977 14.9840 14.9840 k = 0.5439-0.6326-0.3930 ( 7764 PWs) bands (ev): 0.4185 0.4185 1.1769 1.1769 1.4791 1.4791 6.7957 6.7957 7.5763 7.5763 7.8451 7.8451 8.6305 8.6305 8.7048 8.7048 8.9578 8.9578 9.9374 9.9374 10.2341 10.2341 10.2814 10.2814 10.9195 10.9195 11.3268 11.3268 11.7694 11.7694 11.9556 11.9556 12.0646 12.0646 12.3496 12.3496 12.5005 12.5005 12.7021 12.7021 12.8536 12.8536 13.0891 13.0891 13.4787 13.4787 13.5500 13.5500 13.6657 13.6657 14.1560 14.1560 14.2131 14.2131 14.4482 14.4482 14.6936 14.6936 14.7280 14.7280 14.7835 14.7835 15.0102 15.0102 k = 0.5658-0.6206-0.3855 ( 7768 PWs) bands (ev): 0.4225 0.4225 1.1585 1.1585 1.4935 1.4935 6.8070 6.8070 7.5729 7.5729 7.8328 7.8328 8.6360 8.6360 8.7122 8.7122 8.9445 8.9445 9.9363 9.9363 10.2307 10.2307 10.2852 10.2852 10.9044 10.9044 11.3353 11.3353 11.7646 11.7646 11.9402 11.9402 12.0607 12.0607 12.3679 12.3679 12.5128 12.5128 12.7045 12.7045 12.8687 12.8687 13.1047 13.1047 13.4604 13.4604 13.5516 13.5516 13.6671 13.6671 14.1424 14.1424 14.1839 14.1839 14.4720 14.4720 14.6775 14.6775 14.7118 14.7118 14.7692 14.7692 15.0457 15.0457 k = 0.5877-0.6085-0.3780 ( 7774 PWs) bands (ev): 0.4280 0.4280 1.1354 1.1354 1.5111 1.5111 6.8226 6.8226 7.5681 7.5681 7.8170 7.8170 8.6387 8.6387 8.7250 8.7250 8.9276 8.9276 9.9348 9.9348 10.2257 10.2257 10.2910 10.2910 10.8850 10.8850 11.3462 11.3462 11.7557 11.7557 11.9223 11.9223 12.0556 12.0556 12.3904 12.3904 12.5297 12.5297 12.7078 12.7078 12.8888 12.8888 13.1240 13.1240 13.4430 13.4430 13.5504 13.5504 13.6691 13.6691 14.1184 14.1184 14.1593 14.1593 14.4943 14.4943 14.6467 14.6467 14.7044 14.7044 14.7599 14.7599 15.0862 15.0863 k = 0.6097-0.5965-0.3705 ( 7771 PWs) bands (ev): 0.4351 0.4351 1.1090 1.1090 1.5305 1.5305 6.8426 6.8426 7.5617 7.5617 7.7986 7.7986 8.6362 8.6362 8.7429 8.7429 8.9093 8.9093 9.9331 9.9331 10.2188 10.2188 10.2992 10.2992 10.8623 10.8623 11.3584 11.3584 11.7411 11.7411 11.9046 11.9046 12.0496 12.0496 12.4157 12.4157 12.5506 12.5506 12.7121 12.7121 12.9131 12.9131 13.1430 13.1430 13.4315 13.4315 13.5472 13.5472 13.6715 13.6715 14.0860 14.0860 14.1392 14.1392 14.5145 14.5145 14.6096 14.6096 14.7001 14.7001 14.7575 14.7575 15.1290 15.1290 k = 0.6316-0.5844-0.3631 ( 7778 PWs) bands (ev): 0.4437 0.4437 1.0804 1.0804 1.5507 1.5507 6.8668 6.8668 7.5536 7.5536 7.7790 7.7790 8.6271 8.6271 8.7622 8.7622 8.8941 8.8941 9.9313 9.9313 10.2103 10.2103 10.3099 10.3099 10.8375 10.8375 11.3710 11.3710 11.7193 11.7193 11.8893 11.8893 12.0431 12.0431 12.4422 12.4422 12.5753 12.5753 12.7174 12.7174 12.9409 12.9409 13.1553 13.1553 13.4322 13.4322 13.5439 13.5439 13.6743 13.6743 14.0506 14.0506 14.1184 14.1184 14.5331 14.5331 14.5715 14.5715 14.6968 14.6968 14.7615 14.7615 15.1711 15.1711 k = 0.6535-0.5724-0.3556 ( 7790 PWs) bands (ev): 0.4537 0.4537 1.0503 1.0503 1.5710 1.5710 6.8951 6.8951 7.5435 7.5435 7.7590 7.7590 8.6104 8.6104 8.7759 8.7759 8.8897 8.8897 9.9296 9.9296 10.2002 10.2002 10.3231 10.3231 10.8116 10.8116 11.3824 11.3824 11.6901 11.6901 11.8779 11.8779 12.0363 12.0363 12.4692 12.4692 12.6031 12.6031 12.7237 12.7237 12.9715 12.9715 13.1551 13.1551 13.4486 13.4486 13.5443 13.5443 13.6774 13.6774 14.0144 14.0144 14.0945 14.0945 14.5248 14.5248 14.5619 14.5619 14.6941 14.6941 14.7705 14.7705 15.2091 15.2091 k = 0.6755-0.5603-0.3481 ( 7778 PWs) bands (ev): 0.4650 0.4650 1.0192 1.0192 1.5908 1.5908 6.9272 6.9272 7.5313 7.5313 7.7397 7.7397 8.5848 8.5848 8.7781 8.7781 8.9031 8.9031 9.9281 9.9281 10.1888 10.1888 10.3390 10.3390 10.7852 10.7852 11.3909 11.3909 11.6549 11.6549 11.8704 11.8704 12.0294 12.0294 12.4960 12.4960 12.6336 12.6336 12.7309 12.7309 13.0042 13.0042 13.1424 13.1424 13.4718 13.4718 13.5586 13.5586 13.6811 13.6811 13.9782 13.9782 14.0664 14.0664 14.4874 14.4874 14.5855 14.5855 14.6920 14.6920 14.7845 14.7845 15.2394 15.2394 k = 0.6974-0.5483-0.3406 ( 7786 PWs) bands (ev): 0.4776 0.4776 0.9877 0.9877 1.6098 1.6098 6.9630 6.9630 7.5172 7.5172 7.7217 7.7217 8.5499 8.5499 8.7724 8.7724 8.9309 8.9309 9.9271 9.9271 10.1764 10.1764 10.3573 10.3573 10.7591 10.7591 11.3939 11.3939 11.6164 11.6164 11.8665 11.8665 12.0226 12.0226 12.5225 12.5225 12.6660 12.6660 12.7394 12.7394 13.0381 13.0381 13.1217 13.1217 13.4847 13.4847 13.5997 13.5997 13.6856 13.6856 13.9426 13.9426 14.0337 14.0337 14.4505 14.4505 14.6122 14.6122 14.6908 14.6908 14.8051 14.8051 15.2582 15.2582 k = 0.7193-0.5362-0.3331 ( 7793 PWs) bands (ev): 0.4914 0.4914 0.9561 0.9561 1.6278 1.6278 7.0022 7.0022 7.5012 7.5012 7.7057 7.7057 8.5065 8.5065 8.7651 8.7651 8.9664 8.9664 9.9268 9.9268 10.1634 10.1634 10.3777 10.3777 10.7337 10.7337 11.3879 11.3879 11.5788 11.5788 11.8657 11.8657 12.0162 12.0162 12.5484 12.5484 12.6991 12.6991 12.7496 12.7496 13.0684 13.0684 13.1019 13.1019 13.4875 13.4875 13.6574 13.6574 13.6959 13.6959 13.9084 13.9084 13.9964 13.9964 14.4165 14.4165 14.6374 14.6374 14.6905 14.6905 14.8359 14.8359 15.2622 15.2622 k = 0.7413-0.5242-0.3256 ( 7792 PWs) bands (ev): 0.5060 0.5060 0.9249 0.9249 1.6445 1.6445 7.0445 7.0445 7.4837 7.4837 7.6917 7.6917 8.4560 8.4560 8.7587 8.7587 9.0054 9.0054 9.9273 9.9273 10.1500 10.1500 10.3998 10.3998 10.7097 10.7097 11.3687 11.3687 11.5468 11.5468 11.8673 11.8673 12.0101 12.0101 12.5737 12.5737 12.7298 12.7298 12.7638 12.7638 13.0637 13.0637 13.1173 13.1173 13.4871 13.4871 13.6828 13.6828 13.7489 13.7489 13.8767 13.8767 13.9553 13.9553 14.3862 14.3862 14.6576 14.6576 14.6915 14.6915 14.8796 14.8796 15.2498 15.2498 k = 0.7632-0.5121-0.3182 ( 7796 PWs) bands (ev): 0.5213 0.5213 0.8945 0.8945 1.6597 1.6597 7.0892 7.0892 7.4653 7.4653 7.6798 7.6798 8.4004 8.4004 8.7536 8.7536 9.0456 9.0456 9.9288 9.9288 10.1366 10.1366 10.4230 10.4230 10.6879 10.6879 11.3344 11.3344 11.5233 11.5233 11.8710 11.8710 12.0045 12.0045 12.5982 12.5982 12.7517 12.7517 12.7878 12.7878 13.0423 13.0423 13.1510 13.1510 13.4862 13.4862 13.6872 13.6872 13.8190 13.8190 13.8546 13.8546 13.9132 13.9132 14.3602 14.3602 14.6726 14.6726 14.6939 14.6939 14.9353 14.9353 15.2231 15.2231 k = 0.7851-0.5001-0.3107 ( 7799 PWs) bands (ev): 0.5367 0.5367 0.8655 0.8655 1.6733 1.6733 7.1358 7.1358 7.4469 7.4469 7.6699 7.6699 8.3416 8.3416 8.7497 8.7497 9.0858 9.0858 9.9316 9.9316 10.1233 10.1233 10.4461 10.4461 10.6696 10.6696 11.2879 11.2879 11.5063 11.5063 11.8759 11.8759 11.9994 11.9994 12.6216 12.6216 12.7654 12.7654 12.8198 12.8198 13.0231 13.0231 13.1846 13.1846 13.4856 13.4856 13.6875 13.6875 13.8173 13.8173 13.8598 13.8598 13.9223 13.9223 14.3385 14.3385 14.6846 14.6846 14.6983 14.6983 14.9959 14.9959 15.1902 15.1902 k = 0.8070-0.4880-0.3032 ( 7794 PWs) bands (ev): 0.5515 0.5515 0.8388 0.8388 1.6853 1.6853 7.1832 7.1832 7.4293 7.4293 7.6616 7.6616 8.2811 8.2811 8.7465 8.7465 9.1248 9.1248 9.9358 9.9358 10.1103 10.1103 10.4669 10.4669 10.6570 10.6570 11.2339 11.2339 11.4925 11.4925 11.8817 11.8817 11.9949 11.9949 12.6430 12.6430 12.7763 12.7763 12.8533 12.8533 13.0085 13.0085 13.2155 13.2155 13.4853 13.4853 13.6823 13.6823 13.7986 13.7986 13.8228 13.8228 13.9972 13.9972 14.3213 14.3213 14.6949 14.6949 14.7071 14.7071 15.0366 15.0366 15.1772 15.1772 Writing output data file Zr3Te.save init_run : 0.22s CPU 0.37s WALL ( 1 calls) electrons : 682.91s CPU 690.03s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.02s WALL ( 1 calls) potinit : 0.03s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 682.90s CPU 690.02s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.06s CPU 0.07s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.13s WALL ( 239 calls) cegterg : 623.57s CPU 629.19s WALL ( 859 calls) Called by sum_band: Called by *egterg: h_psi : 436.54s CPU 440.72s WALL ( 15916 calls) s_psi : 19.24s CPU 19.11s WALL ( 15916 calls) g_psi : 0.81s CPU 0.89s WALL ( 14818 calls) cdiaghg : 151.68s CPU 153.56s WALL ( 15057 calls) cegterg:over : 24.01s CPU 24.05s WALL ( 14818 calls) cegterg:upda : 24.44s CPU 24.43s WALL ( 14818 calls) cegterg:last : 11.06s CPU 11.14s WALL ( 2136 calls) cdiaghg:chol : 8.76s CPU 8.93s WALL ( 15057 calls) cdiaghg:inve : 6.03s CPU 6.27s WALL ( 15057 calls) cdiaghg:para : 10.49s CPU 10.30s WALL ( 30114 calls) Called by h_psi: h_psi:vloc : 384.99s CPU 388.75s WALL ( 15916 calls) h_psi:vnl : 50.58s CPU 50.91s WALL ( 15916 calls) add_vuspsi : 25.81s CPU 26.12s WALL ( 15916 calls) General routines calbec : 24.73s CPU 24.74s WALL ( 15916 calls) fft : 0.01s CPU 0.01s WALL ( 15 calls) fftw : 363.52s CPU 367.03s WALL ( 1636008 calls) davcio : 0.20s CPU 0.37s WALL ( 478 calls) Parallel routines fft_scatter : 99.12s CPU 100.84s WALL ( 1636023 calls) PWSCF : 11m43.14s CPU 12m 9.30s WALL This run was terminated on: 21:42:30 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=