Program PWSCF v.5.1.1 starts on 26Aug2015 at 11:52:20 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./RhN.save/ file Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 19 12 3 404 185 29 Max 20 13 4 411 198 33 Sum 955 583 169 19603 9257 1471 bravais-lattice index = 14 lattice parameter (alat) = 6.1868 a.u. unit-cell volume = 167.4478 (a.u.)^3 number of atoms/cell = 2 number of atomic types = 2 number of electrons = 22.00 number of Kohn-Sham states= 30 kinetic-energy cutoff = 55.0000 Ry charge density cutoff = 364.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.186782 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= 0.500000 celldm(5)= 0.500000 celldm(6)= 0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.500000 0.866025 0.000000 ) a(3) = ( 0.500000 0.288675 0.816497 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.577350 -0.408248 ) b(2) = ( 0.000000 1.154701 -0.408248 ) b(3) = ( 0.000000 0.000000 1.224745 ) PseudoPot. # 1 for Rh read from file: /home/autes/Pseudo/Rh.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 05b2c48bcc7a2cf2a48258d60087199c Pseudo is Ultrasoft + core correction, Zval = 17.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1233 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for N read from file: /home/autes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Rh 17.00 102.90550 Rh( 1.00) N 5.00 14.00670 N( 1.00) 6 Sym. Ops. (no 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 = 2 120 deg rotation - cryst. axis [0,0,1] cryst. s( 2) = ( -1 1 0 ) ( -1 0 0 ) ( -1 0 1 ) cart. s( 2) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 3) = ( 0 -1 0 ) ( 1 -1 0 ) ( 0 -1 1 ) cart. s( 3) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( -1 0 0 ) ( -1 1 0 ) ( -1 0 1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 5 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 5) = ( 0.5000000 0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s( 6) = ( 1 -1 0 ) ( 0 -1 0 ) ( 0 -1 1 ) cart. s( 6) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_3v (3m) there are 6 classes and 3 irreducible representations the character table: E -E 2C3 -2C3 3s_v -3s_v G_4 2.00 -2.00 1.00 -1.00 0.00 0.00 G_5 1.00 -1.00 -1.00 1.00 0.00 0.00 G_6 1.00 -1.00 -1.00 1.00 0.00 0.00 imaginary part E -E 2C3 -2C3 3s_v -3s_v G_4 0.00 0.00 0.00 0.00 0.00 0.00 G_5 0.00 0.00 0.00 0.00 1.00 -1.00 G_6 0.00 0.00 0.00 0.00 -1.00 1.00 the symmetry operations in each class: E 1 2C3 2 3 3s_v 4 5 -6 3s_v 6 -4 -5 -E -1 -2C3 -2 -3 Cartesian axes number of k points= 447 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 2) = ( 0.0073529 -0.0042452 0.0060037), wk = 0.0022371 k( 3) = ( 0.0147059 -0.0084904 0.0120073), wk = 0.0022371 k( 4) = ( 0.0220588 -0.0127357 0.0180110), wk = 0.0022371 k( 5) = ( 0.0294118 -0.0169809 0.0240146), wk = 0.0022371 k( 6) = ( 0.0367647 -0.0212261 0.0300183), wk = 0.0022371 k( 7) = ( 0.0441177 -0.0254713 0.0360219), wk = 0.0022371 k( 8) = ( 0.0514706 -0.0297166 0.0420256), wk = 0.0022371 k( 9) = ( 0.0588235 -0.0339618 0.0480292), wk = 0.0022371 k( 10) = ( 0.0661765 -0.0382070 0.0540329), wk = 0.0022371 k( 11) = ( 0.0735294 -0.0424522 0.0600365), wk = 0.0022371 k( 12) = ( 0.0808824 -0.0466974 0.0660402), wk = 0.0022371 k( 13) = ( 0.0882353 -0.0509427 0.0720438), wk = 0.0022371 k( 14) = ( 0.0955882 -0.0551879 0.0780475), wk = 0.0022371 k( 15) = ( 0.1029412 -0.0594331 0.0840511), wk = 0.0022371 k( 16) = ( 0.1102941 -0.0636783 0.0900548), wk = 0.0022371 k( 17) = ( 0.1176471 -0.0679236 0.0960584), wk = 0.0022371 k( 18) = ( 0.1250000 -0.0721688 0.1020621), wk = 0.0022371 k( 19) = ( 0.1323529 -0.0764140 0.1080657), wk = 0.0022371 k( 20) = ( 0.1397059 -0.0806592 0.1140694), wk = 0.0022371 k( 21) = ( 0.1470588 -0.0849044 0.1200730), wk = 0.0022371 k( 22) = ( 0.1544118 -0.0891497 0.1260767), wk = 0.0022371 k( 23) = ( 0.1617647 -0.0933949 0.1320803), wk = 0.0022371 k( 24) = ( 0.1691177 -0.0976401 0.1380840), wk = 0.0022371 k( 25) = ( 0.1764706 -0.1018853 0.1440876), wk = 0.0022371 k( 26) = ( 0.1838235 -0.1061306 0.1500913), wk = 0.0022371 k( 27) = ( 0.1911765 -0.1103758 0.1560949), wk = 0.0022371 k( 28) = ( 0.1985294 -0.1146210 0.1620986), wk = 0.0022371 k( 29) = ( 0.2058823 -0.1188662 0.1681022), wk = 0.0022371 k( 30) = ( 0.2132353 -0.1231115 0.1741059), wk = 0.0022371 k( 31) = ( 0.2205882 -0.1273567 0.1801095), wk = 0.0022371 k( 32) = ( 0.2279412 -0.1316019 0.1861132), wk = 0.0022371 k( 33) = ( 0.2352941 -0.1358471 0.1921168), wk = 0.0022371 k( 34) = ( 0.2426471 -0.1400923 0.1981205), wk = 0.0022371 k( 35) = ( 0.2500000 -0.1443376 0.2041241), wk = 0.0022371 k( 36) = ( 0.2573529 -0.1485828 0.2101278), wk = 0.0022371 k( 37) = ( 0.2647059 -0.1528280 0.2161314), wk = 0.0022371 k( 38) = ( 0.2720588 -0.1570732 0.2221351), wk = 0.0022371 k( 39) = ( 0.2794118 -0.1613185 0.2281387), wk = 0.0022371 k( 40) = ( 0.2867647 -0.1655637 0.2341424), wk = 0.0022371 k( 41) = ( 0.2941177 -0.1698089 0.2401461), wk = 0.0022371 k( 42) = ( 0.3014706 -0.1740541 0.2461497), wk = 0.0022371 k( 43) = ( 0.3088235 -0.1782993 0.2521534), wk = 0.0022371 k( 44) = ( 0.3161765 -0.1825446 0.2581570), wk = 0.0022371 k( 45) = ( 0.3235294 -0.1867898 0.2641607), wk = 0.0022371 k( 46) = ( 0.3308823 -0.1910350 0.2701643), wk = 0.0022371 k( 47) = ( 0.3382353 -0.1952802 0.2761680), wk = 0.0022371 k( 48) = ( 0.3455882 -0.1995255 0.2821716), wk = 0.0022371 k( 49) = ( 0.3529412 -0.2037707 0.2881753), wk = 0.0022371 k( 50) = ( 0.3602941 -0.2080159 0.2941789), wk = 0.0022371 k( 51) = ( 0.3676471 -0.2122611 0.3001826), wk = 0.0022371 k( 52) = ( 0.3750000 -0.2165064 0.3061862), wk = 0.0022371 k( 53) = ( 0.3823529 -0.2207516 0.3121899), wk = 0.0022371 k( 54) = ( 0.3897059 -0.2249968 0.3181935), wk = 0.0022371 k( 55) = ( 0.3970588 -0.2292420 0.3241972), wk = 0.0022371 k( 56) = ( 0.4044118 -0.2334872 0.3302008), wk = 0.0022371 k( 57) = ( 0.4117647 -0.2377325 0.3362045), wk = 0.0022371 k( 58) = ( 0.4191177 -0.2419777 0.3422081), wk = 0.0022371 k( 59) = ( 0.4264706 -0.2462229 0.3482118), wk = 0.0022371 k( 60) = ( 0.4338235 -0.2504681 0.3542154), wk = 0.0022371 k( 61) = ( 0.4411765 -0.2547134 0.3602191), wk = 0.0022371 k( 62) = ( 0.4485294 -0.2589586 0.3662227), wk = 0.0022371 k( 63) = ( 0.4558823 -0.2632038 0.3722264), wk = 0.0022371 k( 64) = ( 0.4632353 -0.2674490 0.3782300), wk = 0.0022371 k( 65) = ( 0.4705882 -0.2716942 0.3842337), wk = 0.0022371 k( 66) = ( 0.4779412 -0.2759395 0.3902373), wk = 0.0022371 k( 67) = ( 0.4852941 -0.2801847 0.3962410), wk = 0.0022371 k( 68) = ( 0.4926471 -0.2844299 0.4022446), wk = 0.0022371 k( 69) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0022371 k( 70) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0022371 k( 71) = ( 0.5000000 -0.2801847 0.4142519), wk = 0.0022371 k( 72) = ( 0.5000000 -0.2716942 0.4202556), wk = 0.0022371 k( 73) = ( 0.5000000 -0.2632038 0.4262592), wk = 0.0022371 k( 74) = ( 0.5000000 -0.2547134 0.4322629), wk = 0.0022371 k( 75) = ( 0.5000000 -0.2462229 0.4382666), wk = 0.0022371 k( 76) = ( 0.5000000 -0.2377325 0.4442702), wk = 0.0022371 k( 77) = ( 0.5000000 -0.2292420 0.4502739), wk = 0.0022371 k( 78) = ( 0.5000000 -0.2207516 0.4562775), wk = 0.0022371 k( 79) = ( 0.5000000 -0.2122611 0.4622812), wk = 0.0022371 k( 80) = ( 0.5000000 -0.2037707 0.4682848), wk = 0.0022371 k( 81) = ( 0.5000000 -0.1952802 0.4742885), wk = 0.0022371 k( 82) = ( 0.5000000 -0.1867898 0.4802921), wk = 0.0022371 k( 83) = ( 0.5000000 -0.1782993 0.4862958), wk = 0.0022371 k( 84) = ( 0.5000000 -0.1698089 0.4922994), wk = 0.0022371 k( 85) = ( 0.5000000 -0.1613185 0.4983031), wk = 0.0022371 k( 86) = ( 0.5000000 -0.1528280 0.5043067), wk = 0.0022371 k( 87) = ( 0.5000000 -0.1443376 0.5103104), wk = 0.0022371 k( 88) = ( 0.5000000 -0.1358471 0.5163140), wk = 0.0022371 k( 89) = ( 0.5000000 -0.1273567 0.5223177), wk = 0.0022371 k( 90) = ( 0.5000000 -0.1188662 0.5283213), wk = 0.0022371 k( 91) = ( 0.5000000 -0.1103758 0.5343250), wk = 0.0022371 k( 92) = ( 0.5000000 -0.1018853 0.5403286), wk = 0.0022371 k( 93) = ( 0.5000000 -0.0933949 0.5463323), wk = 0.0022371 k( 94) = ( 0.5000000 -0.0849044 0.5523359), wk = 0.0022371 k( 95) = ( 0.5000000 -0.0764140 0.5583396), wk = 0.0022371 k( 96) = ( 0.5000000 -0.0679236 0.5643432), wk = 0.0022371 k( 97) = ( 0.5000000 -0.0594331 0.5703469), wk = 0.0022371 k( 98) = ( 0.5000000 -0.0509427 0.5763505), wk = 0.0022371 k( 99) = ( 0.5000000 -0.0424522 0.5823542), wk = 0.0022371 k( 100) = ( 0.5000000 -0.0339618 0.5883578), wk = 0.0022371 k( 101) = ( 0.5000000 -0.0254713 0.5943615), wk = 0.0022371 k( 102) = ( 0.5000000 -0.0169809 0.6003651), wk = 0.0022371 k( 103) = ( 0.5000000 -0.0084904 0.6063688), wk = 0.0022371 k( 104) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0022371 k( 105) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0022371 k( 106) = ( 0.4947917 0.0090211 0.6123724), wk = 0.0022371 k( 107) = ( 0.4895833 0.0180422 0.6123724), wk = 0.0022371 k( 108) = ( 0.4843750 0.0270633 0.6123724), wk = 0.0022371 k( 109) = ( 0.4791667 0.0360844 0.6123724), wk = 0.0022371 k( 110) = ( 0.4739583 0.0451055 0.6123724), wk = 0.0022371 k( 111) = ( 0.4687500 0.0541266 0.6123724), wk = 0.0022371 k( 112) = ( 0.4635417 0.0631477 0.6123724), wk = 0.0022371 k( 113) = ( 0.4583333 0.0721688 0.6123724), wk = 0.0022371 k( 114) = ( 0.4531250 0.0811899 0.6123724), wk = 0.0022371 k( 115) = ( 0.4479167 0.0902110 0.6123724), wk = 0.0022371 k( 116) = ( 0.4427083 0.0992321 0.6123724), wk = 0.0022371 k( 117) = ( 0.4375000 0.1082532 0.6123724), wk = 0.0022371 k( 118) = ( 0.4322917 0.1172743 0.6123724), wk = 0.0022371 k( 119) = ( 0.4270833 0.1262954 0.6123724), wk = 0.0022371 k( 120) = ( 0.4218750 0.1353165 0.6123724), wk = 0.0022371 k( 121) = ( 0.4166667 0.1443376 0.6123724), wk = 0.0022371 k( 122) = ( 0.4114583 0.1533587 0.6123724), wk = 0.0022371 k( 123) = ( 0.4062500 0.1623798 0.6123724), wk = 0.0022371 k( 124) = ( 0.4010417 0.1714009 0.6123724), wk = 0.0022371 k( 125) = ( 0.3958333 0.1804220 0.6123724), wk = 0.0022371 k( 126) = ( 0.3906250 0.1894431 0.6123724), wk = 0.0022371 k( 127) = ( 0.3854167 0.1984641 0.6123724), wk = 0.0022371 k( 128) = ( 0.3802083 0.2074853 0.6123724), wk = 0.0022371 k( 129) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0022371 k( 130) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0022371 k( 131) = ( 0.3697917 0.2134993 0.6038673), wk = 0.0022371 k( 132) = ( 0.3645833 0.2104923 0.5953621), wk = 0.0022371 k( 133) = ( 0.3593750 0.2074853 0.5868569), wk = 0.0022371 k( 134) = ( 0.3541667 0.2044782 0.5783517), wk = 0.0022371 k( 135) = ( 0.3489583 0.2014712 0.5698466), wk = 0.0022371 k( 136) = ( 0.3437500 0.1984642 0.5613414), wk = 0.0022371 k( 137) = ( 0.3385417 0.1954571 0.5528362), wk = 0.0022371 k( 138) = ( 0.3333333 0.1924501 0.5443311), wk = 0.0022371 k( 139) = ( 0.3281250 0.1894431 0.5358259), wk = 0.0022371 k( 140) = ( 0.3229167 0.1864360 0.5273207), wk = 0.0022371 k( 141) = ( 0.3177083 0.1834290 0.5188155), wk = 0.0022371 k( 142) = ( 0.3125000 0.1804220 0.5103104), wk = 0.0022371 k( 143) = ( 0.3072917 0.1774149 0.5018052), wk = 0.0022371 k( 144) = ( 0.3020833 0.1744079 0.4933000), wk = 0.0022371 k( 145) = ( 0.2968750 0.1714009 0.4847948), wk = 0.0022371 k( 146) = ( 0.2916667 0.1683938 0.4762897), wk = 0.0022371 k( 147) = ( 0.2864583 0.1653868 0.4677845), wk = 0.0022371 k( 148) = ( 0.2812500 0.1623798 0.4592793), wk = 0.0022371 k( 149) = ( 0.2760417 0.1593727 0.4507741), wk = 0.0022371 k( 150) = ( 0.2708333 0.1563657 0.4422690), wk = 0.0022371 k( 151) = ( 0.2656250 0.1533587 0.4337638), wk = 0.0022371 k( 152) = ( 0.2604167 0.1503516 0.4252586), wk = 0.0022371 k( 153) = ( 0.2552083 0.1473446 0.4167535), wk = 0.0022371 k( 154) = ( 0.2500000 0.1443376 0.4082483), wk = 0.0022371 k( 155) = ( 0.2447917 0.1413305 0.3997431), wk = 0.0022371 k( 156) = ( 0.2395833 0.1383235 0.3912380), wk = 0.0022371 k( 157) = ( 0.2343750 0.1353165 0.3827328), wk = 0.0022371 k( 158) = ( 0.2291667 0.1323094 0.3742276), wk = 0.0022371 k( 159) = ( 0.2239583 0.1293024 0.3657224), wk = 0.0022371 k( 160) = ( 0.2187500 0.1262954 0.3572173), wk = 0.0022371 k( 161) = ( 0.2135417 0.1232883 0.3487121), wk = 0.0022371 k( 162) = ( 0.2083333 0.1202813 0.3402069), wk = 0.0022371 k( 163) = ( 0.2031250 0.1172743 0.3317017), wk = 0.0022371 k( 164) = ( 0.1979167 0.1142672 0.3231966), wk = 0.0022371 k( 165) = ( 0.1927083 0.1112602 0.3146914), wk = 0.0022371 k( 166) = ( 0.1875000 0.1082532 0.3061862), wk = 0.0022371 k( 167) = ( 0.1822917 0.1052461 0.2976810), wk = 0.0022371 k( 168) = ( 0.1770833 0.1022391 0.2891759), wk = 0.0022371 k( 169) = ( 0.1718750 0.0992321 0.2806707), wk = 0.0022371 k( 170) = ( 0.1666667 0.0962250 0.2721655), wk = 0.0022371 k( 171) = ( 0.1614583 0.0932180 0.2636604), wk = 0.0022371 k( 172) = ( 0.1562500 0.0902110 0.2551552), wk = 0.0022371 k( 173) = ( 0.1510417 0.0872039 0.2466500), wk = 0.0022371 k( 174) = ( 0.1458333 0.0841969 0.2381448), wk = 0.0022371 k( 175) = ( 0.1406250 0.0811899 0.2296397), wk = 0.0022371 k( 176) = ( 0.1354167 0.0781829 0.2211345), wk = 0.0022371 k( 177) = ( 0.1302083 0.0751758 0.2126293), wk = 0.0022371 k( 178) = ( 0.1250000 0.0721688 0.2041241), wk = 0.0022371 k( 179) = ( 0.1197917 0.0691618 0.1956190), wk = 0.0022371 k( 180) = ( 0.1145833 0.0661547 0.1871138), wk = 0.0022371 k( 181) = ( 0.1093750 0.0631477 0.1786086), wk = 0.0022371 k( 182) = ( 0.1041667 0.0601407 0.1701034), wk = 0.0022371 k( 183) = ( 0.0989583 0.0571336 0.1615983), wk = 0.0022371 k( 184) = ( 0.0937500 0.0541266 0.1530931), wk = 0.0022371 k( 185) = ( 0.0885417 0.0511196 0.1445879), wk = 0.0022371 k( 186) = ( 0.0833333 0.0481125 0.1360828), wk = 0.0022371 k( 187) = ( 0.0781250 0.0451055 0.1275776), wk = 0.0022371 k( 188) = ( 0.0729167 0.0420985 0.1190724), wk = 0.0022371 k( 189) = ( 0.0677083 0.0390914 0.1105673), wk = 0.0022371 k( 190) = ( 0.0625000 0.0360844 0.1020621), wk = 0.0022371 k( 191) = ( 0.0572917 0.0330774 0.0935569), wk = 0.0022371 k( 192) = ( 0.0520833 0.0300703 0.0850517), wk = 0.0022371 k( 193) = ( 0.0468750 0.0270633 0.0765466), wk = 0.0022371 k( 194) = ( 0.0416667 0.0240563 0.0680414), wk = 0.0022371 k( 195) = ( 0.0364583 0.0210492 0.0595362), wk = 0.0022371 k( 196) = ( 0.0312500 0.0180422 0.0510310), wk = 0.0022371 k( 197) = ( 0.0260417 0.0150352 0.0425259), wk = 0.0022371 k( 198) = ( 0.0208333 0.0120281 0.0340207), wk = 0.0022371 k( 199) = ( 0.0156250 0.0090211 0.0255155), wk = 0.0022371 k( 200) = ( 0.0104167 0.0060141 0.0170103), wk = 0.0022371 k( 201) = ( 0.0052083 0.0030070 0.0085052), wk = 0.0022371 k( 202) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 203) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 204) = ( 0.0084746 0.0048928 0.0034597), wk = 0.0022371 k( 205) = ( 0.0169491 0.0097856 0.0069195), wk = 0.0022371 k( 206) = ( 0.0254237 0.0146784 0.0103792), wk = 0.0022371 k( 207) = ( 0.0338983 0.0195712 0.0138389), wk = 0.0022371 k( 208) = ( 0.0423729 0.0244640 0.0172987), wk = 0.0022371 k( 209) = ( 0.0508475 0.0293568 0.0207584), wk = 0.0022371 k( 210) = ( 0.0593220 0.0342496 0.0242181), wk = 0.0022371 k( 211) = ( 0.0677966 0.0391424 0.0276779), wk = 0.0022371 k( 212) = ( 0.0762712 0.0440352 0.0311376), wk = 0.0022371 k( 213) = ( 0.0847458 0.0489280 0.0345973), wk = 0.0022371 k( 214) = ( 0.0932203 0.0538208 0.0380570), wk = 0.0022371 k( 215) = ( 0.1016949 0.0587136 0.0415168), wk = 0.0022371 k( 216) = ( 0.1101695 0.0636064 0.0449765), wk = 0.0022371 k( 217) = ( 0.1186441 0.0684992 0.0484362), wk = 0.0022371 k( 218) = ( 0.1271186 0.0733920 0.0518960), wk = 0.0022371 k( 219) = ( 0.1355932 0.0782848 0.0553557), wk = 0.0022371 k( 220) = ( 0.1440678 0.0831776 0.0588154), wk = 0.0022371 k( 221) = ( 0.1525424 0.0880704 0.0622752), wk = 0.0022371 k( 222) = ( 0.1610169 0.0929632 0.0657349), wk = 0.0022371 k( 223) = ( 0.1694915 0.0978560 0.0691946), wk = 0.0022371 k( 224) = ( 0.1779661 0.1027488 0.0726544), wk = 0.0022371 k( 225) = ( 0.1864407 0.1076416 0.0761141), wk = 0.0022371 k( 226) = ( 0.1949153 0.1125344 0.0795738), wk = 0.0022371 k( 227) = ( 0.2033898 0.1174272 0.0830336), wk = 0.0022371 k( 228) = ( 0.2118644 0.1223200 0.0864933), wk = 0.0022371 k( 229) = ( 0.2203390 0.1272128 0.0899530), wk = 0.0022371 k( 230) = ( 0.2288136 0.1321056 0.0934127), wk = 0.0022371 k( 231) = ( 0.2372881 0.1369984 0.0968725), wk = 0.0022371 k( 232) = ( 0.2457627 0.1418912 0.1003322), wk = 0.0022371 k( 233) = ( 0.2542373 0.1467840 0.1037919), wk = 0.0022371 k( 234) = ( 0.2627119 0.1516768 0.1072517), wk = 0.0022371 k( 235) = ( 0.2711864 0.1565696 0.1107114), wk = 0.0022371 k( 236) = ( 0.2796610 0.1614624 0.1141711), wk = 0.0022371 k( 237) = ( 0.2881356 0.1663552 0.1176309), wk = 0.0022371 k( 238) = ( 0.2966102 0.1712480 0.1210906), wk = 0.0022371 k( 239) = ( 0.3050848 0.1761408 0.1245503), wk = 0.0022371 k( 240) = ( 0.3135593 0.1810336 0.1280101), wk = 0.0022371 k( 241) = ( 0.3220339 0.1859264 0.1314698), wk = 0.0022371 k( 242) = ( 0.3305085 0.1908192 0.1349295), wk = 0.0022371 k( 243) = ( 0.3389831 0.1957120 0.1383893), wk = 0.0022371 k( 244) = ( 0.3474576 0.2006048 0.1418490), wk = 0.0022371 k( 245) = ( 0.3559322 0.2054976 0.1453087), wk = 0.0022371 k( 246) = ( 0.3644068 0.2103904 0.1487684), wk = 0.0022371 k( 247) = ( 0.3728814 0.2152832 0.1522282), wk = 0.0022371 k( 248) = ( 0.3813559 0.2201759 0.1556879), wk = 0.0022371 k( 249) = ( 0.3898305 0.2250687 0.1591476), wk = 0.0022371 k( 250) = ( 0.3983051 0.2299615 0.1626074), wk = 0.0022371 k( 251) = ( 0.4067797 0.2348543 0.1660671), wk = 0.0022371 k( 252) = ( 0.4152542 0.2397471 0.1695268), wk = 0.0022371 k( 253) = ( 0.4237288 0.2446399 0.1729866), wk = 0.0022371 k( 254) = ( 0.4322034 0.2495327 0.1764463), wk = 0.0022371 k( 255) = ( 0.4406780 0.2544255 0.1799060), wk = 0.0022371 k( 256) = ( 0.4491525 0.2593183 0.1833658), wk = 0.0022371 k( 257) = ( 0.4576271 0.2642111 0.1868255), wk = 0.0022371 k( 258) = ( 0.4661017 0.2691039 0.1902852), wk = 0.0022371 k( 259) = ( 0.4745763 0.2739967 0.1937450), wk = 0.0022371 k( 260) = ( 0.4830508 0.2788895 0.1972047), wk = 0.0022371 k( 261) = ( 0.4915254 0.2837823 0.2006644), wk = 0.0022371 k( 262) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0022371 k( 263) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0022371 k( 264) = ( 0.5029762 0.2800836 0.2089842), wk = 0.0022371 k( 265) = ( 0.5059524 0.2714921 0.2138443), wk = 0.0022371 k( 266) = ( 0.5089286 0.2629006 0.2187044), wk = 0.0022371 k( 267) = ( 0.5119048 0.2543091 0.2235645), wk = 0.0022371 k( 268) = ( 0.5148810 0.2457175 0.2284246), wk = 0.0022371 k( 269) = ( 0.5178571 0.2371260 0.2332847), wk = 0.0022371 k( 270) = ( 0.5208333 0.2285345 0.2381448), wk = 0.0022371 k( 271) = ( 0.5238095 0.2199430 0.2430049), wk = 0.0022371 k( 272) = ( 0.5267857 0.2113514 0.2478650), wk = 0.0022371 k( 273) = ( 0.5297619 0.2027599 0.2527251), wk = 0.0022371 k( 274) = ( 0.5327381 0.1941684 0.2575852), wk = 0.0022371 k( 275) = ( 0.5357143 0.1855769 0.2624453), wk = 0.0022371 k( 276) = ( 0.5386905 0.1769854 0.2673054), wk = 0.0022371 k( 277) = ( 0.5416667 0.1683938 0.2721655), wk = 0.0022371 k( 278) = ( 0.5446429 0.1598023 0.2770256), wk = 0.0022371 k( 279) = ( 0.5476190 0.1512108 0.2818857), wk = 0.0022371 k( 280) = ( 0.5505952 0.1426193 0.2867458), wk = 0.0022371 k( 281) = ( 0.5535714 0.1340277 0.2916059), wk = 0.0022371 k( 282) = ( 0.5565476 0.1254362 0.2964660), wk = 0.0022371 k( 283) = ( 0.5595238 0.1168447 0.3013261), wk = 0.0022371 k( 284) = ( 0.5625000 0.1082532 0.3061862), wk = 0.0022371 k( 285) = ( 0.5654762 0.0996617 0.3110463), wk = 0.0022371 k( 286) = ( 0.5684524 0.0910701 0.3159064), wk = 0.0022371 k( 287) = ( 0.5714286 0.0824786 0.3207665), wk = 0.0022371 k( 288) = ( 0.5744048 0.0738871 0.3256266), wk = 0.0022371 k( 289) = ( 0.5773810 0.0652956 0.3304867), wk = 0.0022371 k( 290) = ( 0.5803571 0.0567040 0.3353468), wk = 0.0022371 k( 291) = ( 0.5833333 0.0481125 0.3402069), wk = 0.0022371 k( 292) = ( 0.5863095 0.0395210 0.3450670), wk = 0.0022371 k( 293) = ( 0.5892857 0.0309295 0.3499271), wk = 0.0022371 k( 294) = ( 0.5922619 0.0223380 0.3547872), wk = 0.0022371 k( 295) = ( 0.5952381 0.0137464 0.3596473), wk = 0.0022371 k( 296) = ( 0.5982143 0.0051549 0.3645074), wk = 0.0022371 k( 297) = ( 0.6011905 -0.0034366 0.3693675), wk = 0.0022371 k( 298) = ( 0.6041667 -0.0120281 0.3742276), wk = 0.0022371 k( 299) = ( 0.6071429 -0.0206196 0.3790877), wk = 0.0022371 k( 300) = ( 0.6101190 -0.0292112 0.3839478), wk = 0.0022371 k( 301) = ( 0.6130952 -0.0378027 0.3888079), wk = 0.0022371 k( 302) = ( 0.6160714 -0.0463942 0.3936680), wk = 0.0022371 k( 303) = ( 0.6190476 -0.0549857 0.3985281), wk = 0.0022371 k( 304) = ( 0.6220238 -0.0635773 0.4033882), wk = 0.0022371 k( 305) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0022371 k( 306) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0022371 k( 307) = ( 0.6197917 -0.0691618 0.4167535), wk = 0.0022371 k( 308) = ( 0.6145833 -0.0661547 0.4252586), wk = 0.0022371 k( 309) = ( 0.6093750 -0.0631477 0.4337638), wk = 0.0022371 k( 310) = ( 0.6041667 -0.0601407 0.4422690), wk = 0.0022371 k( 311) = ( 0.5989583 -0.0571336 0.4507742), wk = 0.0022371 k( 312) = ( 0.5937500 -0.0541266 0.4592793), wk = 0.0022371 k( 313) = ( 0.5885417 -0.0511196 0.4677845), wk = 0.0022371 k( 314) = ( 0.5833333 -0.0481125 0.4762897), wk = 0.0022371 k( 315) = ( 0.5781250 -0.0451055 0.4847948), wk = 0.0022371 k( 316) = ( 0.5729167 -0.0420985 0.4933000), wk = 0.0022371 k( 317) = ( 0.5677083 -0.0390914 0.5018052), wk = 0.0022371 k( 318) = ( 0.5625000 -0.0360844 0.5103104), wk = 0.0022371 k( 319) = ( 0.5572917 -0.0330774 0.5188155), wk = 0.0022371 k( 320) = ( 0.5520833 -0.0300703 0.5273207), wk = 0.0022371 k( 321) = ( 0.5468750 -0.0270633 0.5358259), wk = 0.0022371 k( 322) = ( 0.5416667 -0.0240563 0.5443310), wk = 0.0022371 k( 323) = ( 0.5364583 -0.0210492 0.5528362), wk = 0.0022371 k( 324) = ( 0.5312500 -0.0180422 0.5613414), wk = 0.0022371 k( 325) = ( 0.5260417 -0.0150352 0.5698466), wk = 0.0022371 k( 326) = ( 0.5208333 -0.0120281 0.5783518), wk = 0.0022371 k( 327) = ( 0.5156250 -0.0090211 0.5868569), wk = 0.0022371 k( 328) = ( 0.5104167 -0.0060141 0.5953621), wk = 0.0022371 k( 329) = ( 0.5052083 -0.0030070 0.6038673), wk = 0.0022371 k( 330) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0022371 k( 331) = ( 0.5000000 -0.0000000 0.6123724), wk = 0.0022371 k( 332) = ( 0.5000000 0.0060141 0.6038673), wk = 0.0022371 k( 333) = ( 0.5000000 0.0120281 0.5953621), wk = 0.0022371 k( 334) = ( 0.5000000 0.0180422 0.5868569), wk = 0.0022371 k( 335) = ( 0.5000000 0.0240563 0.5783518), wk = 0.0022371 k( 336) = ( 0.5000000 0.0300703 0.5698466), wk = 0.0022371 k( 337) = ( 0.5000000 0.0360844 0.5613414), wk = 0.0022371 k( 338) = ( 0.5000000 0.0420985 0.5528362), wk = 0.0022371 k( 339) = ( 0.5000000 0.0481125 0.5443310), wk = 0.0022371 k( 340) = ( 0.5000000 0.0541266 0.5358259), wk = 0.0022371 k( 341) = ( 0.5000000 0.0601406 0.5273207), wk = 0.0022371 k( 342) = ( 0.5000000 0.0661547 0.5188155), wk = 0.0022371 k( 343) = ( 0.5000000 0.0721688 0.5103104), wk = 0.0022371 k( 344) = ( 0.5000000 0.0781828 0.5018052), wk = 0.0022371 k( 345) = ( 0.5000000 0.0841969 0.4933000), wk = 0.0022371 k( 346) = ( 0.5000000 0.0902110 0.4847948), wk = 0.0022371 k( 347) = ( 0.5000000 0.0962250 0.4762897), wk = 0.0022371 k( 348) = ( 0.5000000 0.1022391 0.4677845), wk = 0.0022371 k( 349) = ( 0.5000000 0.1082532 0.4592793), wk = 0.0022371 k( 350) = ( 0.5000000 0.1142672 0.4507742), wk = 0.0022371 k( 351) = ( 0.5000000 0.1202813 0.4422690), wk = 0.0022371 k( 352) = ( 0.5000000 0.1262954 0.4337638), wk = 0.0022371 k( 353) = ( 0.5000000 0.1323094 0.4252586), wk = 0.0022371 k( 354) = ( 0.5000000 0.1383235 0.4167535), wk = 0.0022371 k( 355) = ( 0.5000000 0.1443376 0.4082483), wk = 0.0022371 k( 356) = ( 0.5000000 0.1503516 0.3997431), wk = 0.0022371 k( 357) = ( 0.5000000 0.1563657 0.3912379), wk = 0.0022371 k( 358) = ( 0.5000000 0.1623798 0.3827328), wk = 0.0022371 k( 359) = ( 0.5000000 0.1683938 0.3742276), wk = 0.0022371 k( 360) = ( 0.5000000 0.1744079 0.3657224), wk = 0.0022371 k( 361) = ( 0.5000000 0.1804220 0.3572173), wk = 0.0022371 k( 362) = ( 0.5000000 0.1864360 0.3487121), wk = 0.0022371 k( 363) = ( 0.5000000 0.1924501 0.3402069), wk = 0.0022371 k( 364) = ( 0.5000000 0.1984642 0.3317017), wk = 0.0022371 k( 365) = ( 0.5000000 0.2044782 0.3231966), wk = 0.0022371 k( 366) = ( 0.5000000 0.2104923 0.3146914), wk = 0.0022371 k( 367) = ( 0.5000000 0.2165064 0.3061862), wk = 0.0022371 k( 368) = ( 0.5000000 0.2225204 0.2976811), wk = 0.0022371 k( 369) = ( 0.5000000 0.2285345 0.2891759), wk = 0.0022371 k( 370) = ( 0.5000000 0.2345485 0.2806707), wk = 0.0022371 k( 371) = ( 0.5000000 0.2405626 0.2721655), wk = 0.0022371 k( 372) = ( 0.5000000 0.2465767 0.2636603), wk = 0.0022371 k( 373) = ( 0.5000000 0.2525907 0.2551552), wk = 0.0022371 k( 374) = ( 0.5000000 0.2586048 0.2466500), wk = 0.0022371 k( 375) = ( 0.5000000 0.2646189 0.2381448), wk = 0.0022371 k( 376) = ( 0.5000000 0.2706329 0.2296397), wk = 0.0022371 k( 377) = ( 0.5000000 0.2766470 0.2211345), wk = 0.0022371 k( 378) = ( 0.5000000 0.2826611 0.2126293), wk = 0.0022371 k( 379) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0022371 k( 380) = ( 0.5000000 0.2886751 0.2041241), wk = 0.0022371 k( 381) = ( 0.4970238 0.2869568 0.2138443), wk = 0.0022371 k( 382) = ( 0.4940476 0.2852385 0.2235645), wk = 0.0022371 k( 383) = ( 0.4910714 0.2835202 0.2332847), wk = 0.0022371 k( 384) = ( 0.4880952 0.2818019 0.2430049), wk = 0.0022371 k( 385) = ( 0.4851190 0.2800836 0.2527251), wk = 0.0022371 k( 386) = ( 0.4821429 0.2783653 0.2624453), wk = 0.0022371 k( 387) = ( 0.4791667 0.2766470 0.2721655), wk = 0.0022371 k( 388) = ( 0.4761905 0.2749287 0.2818857), wk = 0.0022371 k( 389) = ( 0.4732143 0.2732104 0.2916059), wk = 0.0022371 k( 390) = ( 0.4702381 0.2714921 0.3013261), wk = 0.0022371 k( 391) = ( 0.4672619 0.2697738 0.3110463), wk = 0.0022371 k( 392) = ( 0.4642857 0.2680555 0.3207665), wk = 0.0022371 k( 393) = ( 0.4613095 0.2663372 0.3304867), wk = 0.0022371 k( 394) = ( 0.4583333 0.2646189 0.3402069), wk = 0.0022371 k( 395) = ( 0.4553571 0.2629006 0.3499271), wk = 0.0022371 k( 396) = ( 0.4523810 0.2611823 0.3596473), wk = 0.0022371 k( 397) = ( 0.4494048 0.2594640 0.3693675), wk = 0.0022371 k( 398) = ( 0.4464286 0.2577457 0.3790877), wk = 0.0022371 k( 399) = ( 0.4434524 0.2560274 0.3888079), wk = 0.0022371 k( 400) = ( 0.4404762 0.2543090 0.3985281), wk = 0.0022371 k( 401) = ( 0.4375000 0.2525907 0.4082483), wk = 0.0022371 k( 402) = ( 0.4345238 0.2508724 0.4179685), wk = 0.0022371 k( 403) = ( 0.4315476 0.2491541 0.4276887), wk = 0.0022371 k( 404) = ( 0.4285714 0.2474358 0.4374089), wk = 0.0022371 k( 405) = ( 0.4255952 0.2457175 0.4471291), wk = 0.0022371 k( 406) = ( 0.4226190 0.2439992 0.4568493), wk = 0.0022371 k( 407) = ( 0.4196429 0.2422809 0.4665695), wk = 0.0022371 k( 408) = ( 0.4166667 0.2405626 0.4762897), wk = 0.0022371 k( 409) = ( 0.4136905 0.2388443 0.4860099), wk = 0.0022371 k( 410) = ( 0.4107143 0.2371260 0.4957301), wk = 0.0022371 k( 411) = ( 0.4077381 0.2354077 0.5054503), wk = 0.0022371 k( 412) = ( 0.4047619 0.2336894 0.5151705), wk = 0.0022371 k( 413) = ( 0.4017857 0.2319711 0.5248907), wk = 0.0022371 k( 414) = ( 0.3988095 0.2302528 0.5346109), wk = 0.0022371 k( 415) = ( 0.3958333 0.2285345 0.5443311), wk = 0.0022371 k( 416) = ( 0.3928571 0.2268162 0.5540512), wk = 0.0022371 k( 417) = ( 0.3898810 0.2250979 0.5637715), wk = 0.0022371 k( 418) = ( 0.3869048 0.2233796 0.5734917), wk = 0.0022371 k( 419) = ( 0.3839286 0.2216613 0.5832118), wk = 0.0022371 k( 420) = ( 0.3809524 0.2199430 0.5929320), wk = 0.0022371 k( 421) = ( 0.3779762 0.2182247 0.6026522), wk = 0.0022371 k( 422) = ( 0.3750000 0.2165064 0.6123724), wk = 0.0022371 k( 423) = ( 0.6250000 -0.0721688 0.4082483), wk = 0.0022371 k( 424) = ( 0.6197917 -0.0811899 0.4082483), wk = 0.0022371 k( 425) = ( 0.6145833 -0.0902110 0.4082483), wk = 0.0022371 k( 426) = ( 0.6093750 -0.0992321 0.4082483), wk = 0.0022371 k( 427) = ( 0.6041667 -0.1082532 0.4082483), wk = 0.0022371 k( 428) = ( 0.5989583 -0.1172743 0.4082483), wk = 0.0022371 k( 429) = ( 0.5937500 -0.1262954 0.4082483), wk = 0.0022371 k( 430) = ( 0.5885417 -0.1353165 0.4082483), wk = 0.0022371 k( 431) = ( 0.5833333 -0.1443376 0.4082483), wk = 0.0022371 k( 432) = ( 0.5781250 -0.1533587 0.4082483), wk = 0.0022371 k( 433) = ( 0.5729167 -0.1623798 0.4082483), wk = 0.0022371 k( 434) = ( 0.5677083 -0.1714009 0.4082483), wk = 0.0022371 k( 435) = ( 0.5625000 -0.1804220 0.4082483), wk = 0.0022371 k( 436) = ( 0.5572917 -0.1894431 0.4082483), wk = 0.0022371 k( 437) = ( 0.5520833 -0.1984641 0.4082483), wk = 0.0022371 k( 438) = ( 0.5468750 -0.2074853 0.4082483), wk = 0.0022371 k( 439) = ( 0.5416667 -0.2165064 0.4082483), wk = 0.0022371 k( 440) = ( 0.5364583 -0.2255274 0.4082483), wk = 0.0022371 k( 441) = ( 0.5312500 -0.2345485 0.4082483), wk = 0.0022371 k( 442) = ( 0.5260417 -0.2435697 0.4082483), wk = 0.0022371 k( 443) = ( 0.5208333 -0.2525907 0.4082483), wk = 0.0022371 k( 444) = ( 0.5156250 -0.2616118 0.4082483), wk = 0.0022371 k( 445) = ( 0.5104167 -0.2706329 0.4082483), wk = 0.0022371 k( 446) = ( 0.5052083 -0.2796540 0.4082483), wk = 0.0022371 k( 447) = ( 0.5000000 -0.2886751 0.4082483), wk = 0.0022371 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 2) = ( 0.0073529 0.0000000 0.0073529), wk = 0.0022371 k( 3) = ( 0.0147059 0.0000000 0.0147059), wk = 0.0022371 k( 4) = ( 0.0220588 0.0000000 0.0220588), wk = 0.0022371 k( 5) = ( 0.0294118 0.0000000 0.0294118), wk = 0.0022371 k( 6) = ( 0.0367647 -0.0000000 0.0367647), wk = 0.0022371 k( 7) = ( 0.0441177 0.0000000 0.0441177), wk = 0.0022371 k( 8) = ( 0.0514706 -0.0000000 0.0514706), wk = 0.0022371 k( 9) = ( 0.0588235 0.0000000 0.0588235), wk = 0.0022371 k( 10) = ( 0.0661765 -0.0000000 0.0661765), wk = 0.0022371 k( 11) = ( 0.0735294 -0.0000000 0.0735294), wk = 0.0022371 k( 12) = ( 0.0808824 0.0000000 0.0808824), wk = 0.0022371 k( 13) = ( 0.0882353 0.0000000 0.0882353), wk = 0.0022371 k( 14) = ( 0.0955882 0.0000000 0.0955882), wk = 0.0022371 k( 15) = ( 0.1029412 -0.0000000 0.1029412), wk = 0.0022371 k( 16) = ( 0.1102941 0.0000000 0.1102941), wk = 0.0022371 k( 17) = ( 0.1176471 0.0000000 0.1176471), wk = 0.0022371 k( 18) = ( 0.1250000 0.0000000 0.1250000), wk = 0.0022371 k( 19) = ( 0.1323529 -0.0000000 0.1323529), wk = 0.0022371 k( 20) = ( 0.1397059 0.0000000 0.1397059), wk = 0.0022371 k( 21) = ( 0.1470588 -0.0000000 0.1470588), wk = 0.0022371 k( 22) = ( 0.1544118 0.0000000 0.1544118), wk = 0.0022371 k( 23) = ( 0.1617647 0.0000000 0.1617647), wk = 0.0022371 k( 24) = ( 0.1691177 0.0000000 0.1691177), wk = 0.0022371 k( 25) = ( 0.1764706 0.0000000 0.1764706), wk = 0.0022371 k( 26) = ( 0.1838235 0.0000000 0.1838235), wk = 0.0022371 k( 27) = ( 0.1911765 0.0000000 0.1911765), wk = 0.0022371 k( 28) = ( 0.1985294 0.0000000 0.1985294), wk = 0.0022371 k( 29) = ( 0.2058823 -0.0000000 0.2058824), wk = 0.0022371 k( 30) = ( 0.2132353 0.0000000 0.2132353), wk = 0.0022371 k( 31) = ( 0.2205882 0.0000000 0.2205882), wk = 0.0022371 k( 32) = ( 0.2279412 0.0000000 0.2279412), wk = 0.0022371 k( 33) = ( 0.2352941 0.0000000 0.2352941), wk = 0.0022371 k( 34) = ( 0.2426471 0.0000000 0.2426471), wk = 0.0022371 k( 35) = ( 0.2500000 0.0000000 0.2500000), wk = 0.0022371 k( 36) = ( 0.2573529 0.0000000 0.2573529), wk = 0.0022371 k( 37) = ( 0.2647059 -0.0000000 0.2647059), wk = 0.0022371 k( 38) = ( 0.2720588 0.0000000 0.2720588), wk = 0.0022371 k( 39) = ( 0.2794118 0.0000000 0.2794118), wk = 0.0022371 k( 40) = ( 0.2867647 -0.0000000 0.2867647), wk = 0.0022371 k( 41) = ( 0.2941177 0.0000000 0.2941177), wk = 0.0022371 k( 42) = ( 0.3014706 0.0000000 0.3014706), wk = 0.0022371 k( 43) = ( 0.3088235 -0.0000000 0.3088235), wk = 0.0022371 k( 44) = ( 0.3161765 0.0000000 0.3161765), wk = 0.0022371 k( 45) = ( 0.3235294 0.0000000 0.3235294), wk = 0.0022371 k( 46) = ( 0.3308823 0.0000000 0.3308823), wk = 0.0022371 k( 47) = ( 0.3382353 0.0000000 0.3382353), wk = 0.0022371 k( 48) = ( 0.3455882 0.0000000 0.3455882), wk = 0.0022371 k( 49) = ( 0.3529412 0.0000000 0.3529412), wk = 0.0022371 k( 50) = ( 0.3602941 0.0000000 0.3602941), wk = 0.0022371 k( 51) = ( 0.3676471 0.0000000 0.3676471), wk = 0.0022371 k( 52) = ( 0.3750000 0.0000000 0.3750000), wk = 0.0022371 k( 53) = ( 0.3823529 0.0000000 0.3823529), wk = 0.0022371 k( 54) = ( 0.3897059 0.0000000 0.3897059), wk = 0.0022371 k( 55) = ( 0.3970588 0.0000000 0.3970588), wk = 0.0022371 k( 56) = ( 0.4044118 -0.0000000 0.4044118), wk = 0.0022371 k( 57) = ( 0.4117647 0.0000000 0.4117647), wk = 0.0022371 k( 58) = ( 0.4191177 -0.0000000 0.4191177), wk = 0.0022371 k( 59) = ( 0.4264706 -0.0000000 0.4264706), wk = 0.0022371 k( 60) = ( 0.4338235 -0.0000000 0.4338235), wk = 0.0022371 k( 61) = ( 0.4411765 0.0000000 0.4411765), wk = 0.0022371 k( 62) = ( 0.4485294 0.0000000 0.4485294), wk = 0.0022371 k( 63) = ( 0.4558823 0.0000000 0.4558824), wk = 0.0022371 k( 64) = ( 0.4632353 0.0000000 0.4632353), wk = 0.0022371 k( 65) = ( 0.4705882 0.0000000 0.4705882), wk = 0.0022371 k( 66) = ( 0.4779412 0.0000000 0.4779412), wk = 0.0022371 k( 67) = ( 0.4852941 0.0000000 0.4852941), wk = 0.0022371 k( 68) = ( 0.4926471 0.0000000 0.4926471), wk = 0.0022371 k( 69) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022371 k( 70) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022371 k( 71) = ( 0.5000000 0.0073529 0.5073529), wk = 0.0022371 k( 72) = ( 0.5000000 0.0147059 0.5147059), wk = 0.0022371 k( 73) = ( 0.5000000 0.0220588 0.5220588), wk = 0.0022371 k( 74) = ( 0.5000000 0.0294118 0.5294118), wk = 0.0022371 k( 75) = ( 0.5000000 0.0367647 0.5367647), wk = 0.0022371 k( 76) = ( 0.5000000 0.0441177 0.5441177), wk = 0.0022371 k( 77) = ( 0.5000000 0.0514706 0.5514706), wk = 0.0022371 k( 78) = ( 0.5000000 0.0588235 0.5588235), wk = 0.0022371 k( 79) = ( 0.5000000 0.0661765 0.5661765), wk = 0.0022371 k( 80) = ( 0.5000000 0.0735294 0.5735294), wk = 0.0022371 k( 81) = ( 0.5000000 0.0808824 0.5808824), wk = 0.0022371 k( 82) = ( 0.5000000 0.0882353 0.5882353), wk = 0.0022371 k( 83) = ( 0.5000000 0.0955882 0.5955882), wk = 0.0022371 k( 84) = ( 0.5000000 0.1029412 0.6029412), wk = 0.0022371 k( 85) = ( 0.5000000 0.1102941 0.6102941), wk = 0.0022371 k( 86) = ( 0.5000000 0.1176471 0.6176471), wk = 0.0022371 k( 87) = ( 0.5000000 0.1250000 0.6250000), wk = 0.0022371 k( 88) = ( 0.5000000 0.1323529 0.6323529), wk = 0.0022371 k( 89) = ( 0.5000000 0.1397059 0.6397059), wk = 0.0022371 k( 90) = ( 0.5000000 0.1470588 0.6470588), wk = 0.0022371 k( 91) = ( 0.5000000 0.1544118 0.6544118), wk = 0.0022371 k( 92) = ( 0.5000000 0.1617647 0.6617647), wk = 0.0022371 k( 93) = ( 0.5000000 0.1691177 0.6691177), wk = 0.0022371 k( 94) = ( 0.5000000 0.1764706 0.6764706), wk = 0.0022371 k( 95) = ( 0.5000000 0.1838235 0.6838235), wk = 0.0022371 k( 96) = ( 0.5000000 0.1911765 0.6911765), wk = 0.0022371 k( 97) = ( 0.5000000 0.1985294 0.6985294), wk = 0.0022371 k( 98) = ( 0.5000000 0.2058823 0.7058823), wk = 0.0022371 k( 99) = ( 0.5000000 0.2132353 0.7132353), wk = 0.0022371 k( 100) = ( 0.5000000 0.2205882 0.7205882), wk = 0.0022371 k( 101) = ( 0.5000000 0.2279412 0.7279412), wk = 0.0022371 k( 102) = ( 0.5000000 0.2352941 0.7352941), wk = 0.0022371 k( 103) = ( 0.5000000 0.2426471 0.7426471), wk = 0.0022371 k( 104) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0022371 k( 105) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0022371 k( 106) = ( 0.4947917 0.2552083 0.7500000), wk = 0.0022371 k( 107) = ( 0.4895833 0.2604167 0.7500000), wk = 0.0022371 k( 108) = ( 0.4843750 0.2656250 0.7500000), wk = 0.0022371 k( 109) = ( 0.4791667 0.2708333 0.7500000), wk = 0.0022371 k( 110) = ( 0.4739583 0.2760417 0.7500000), wk = 0.0022371 k( 111) = ( 0.4687500 0.2812500 0.7500000), wk = 0.0022371 k( 112) = ( 0.4635417 0.2864583 0.7500000), wk = 0.0022371 k( 113) = ( 0.4583333 0.2916667 0.7500000), wk = 0.0022371 k( 114) = ( 0.4531250 0.2968750 0.7500000), wk = 0.0022371 k( 115) = ( 0.4479167 0.3020833 0.7500000), wk = 0.0022371 k( 116) = ( 0.4427083 0.3072917 0.7500000), wk = 0.0022371 k( 117) = ( 0.4375000 0.3125000 0.7500000), wk = 0.0022371 k( 118) = ( 0.4322917 0.3177083 0.7500000), wk = 0.0022371 k( 119) = ( 0.4270833 0.3229167 0.7500000), wk = 0.0022371 k( 120) = ( 0.4218750 0.3281250 0.7500000), wk = 0.0022371 k( 121) = ( 0.4166667 0.3333333 0.7500000), wk = 0.0022371 k( 122) = ( 0.4114583 0.3385417 0.7500000), wk = 0.0022371 k( 123) = ( 0.4062500 0.3437500 0.7500000), wk = 0.0022371 k( 124) = ( 0.4010417 0.3489583 0.7500000), wk = 0.0022371 k( 125) = ( 0.3958333 0.3541667 0.7500000), wk = 0.0022371 k( 126) = ( 0.3906250 0.3593750 0.7500000), wk = 0.0022371 k( 127) = ( 0.3854167 0.3645833 0.7500000), wk = 0.0022371 k( 128) = ( 0.3802083 0.3697917 0.7500000), wk = 0.0022371 k( 129) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0022371 k( 130) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0022371 k( 131) = ( 0.3697917 0.3697917 0.7395833), wk = 0.0022371 k( 132) = ( 0.3645833 0.3645833 0.7291667), wk = 0.0022371 k( 133) = ( 0.3593750 0.3593750 0.7187500), wk = 0.0022371 k( 134) = ( 0.3541667 0.3541667 0.7083333), wk = 0.0022371 k( 135) = ( 0.3489583 0.3489583 0.6979167), wk = 0.0022371 k( 136) = ( 0.3437500 0.3437500 0.6875000), wk = 0.0022371 k( 137) = ( 0.3385417 0.3385417 0.6770833), wk = 0.0022371 k( 138) = ( 0.3333333 0.3333333 0.6666667), wk = 0.0022371 k( 139) = ( 0.3281250 0.3281250 0.6562500), wk = 0.0022371 k( 140) = ( 0.3229167 0.3229167 0.6458333), wk = 0.0022371 k( 141) = ( 0.3177083 0.3177083 0.6354167), wk = 0.0022371 k( 142) = ( 0.3125000 0.3125000 0.6250000), wk = 0.0022371 k( 143) = ( 0.3072917 0.3072917 0.6145833), wk = 0.0022371 k( 144) = ( 0.3020833 0.3020833 0.6041667), wk = 0.0022371 k( 145) = ( 0.2968750 0.2968750 0.5937500), wk = 0.0022371 k( 146) = ( 0.2916667 0.2916667 0.5833333), wk = 0.0022371 k( 147) = ( 0.2864583 0.2864583 0.5729167), wk = 0.0022371 k( 148) = ( 0.2812500 0.2812500 0.5625000), wk = 0.0022371 k( 149) = ( 0.2760417 0.2760417 0.5520833), wk = 0.0022371 k( 150) = ( 0.2708333 0.2708333 0.5416667), wk = 0.0022371 k( 151) = ( 0.2656250 0.2656250 0.5312500), wk = 0.0022371 k( 152) = ( 0.2604167 0.2604167 0.5208333), wk = 0.0022371 k( 153) = ( 0.2552083 0.2552083 0.5104167), wk = 0.0022371 k( 154) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0022371 k( 155) = ( 0.2447917 0.2447917 0.4895833), wk = 0.0022371 k( 156) = ( 0.2395833 0.2395833 0.4791667), wk = 0.0022371 k( 157) = ( 0.2343750 0.2343750 0.4687500), wk = 0.0022371 k( 158) = ( 0.2291667 0.2291667 0.4583333), wk = 0.0022371 k( 159) = ( 0.2239583 0.2239583 0.4479167), wk = 0.0022371 k( 160) = ( 0.2187500 0.2187500 0.4375000), wk = 0.0022371 k( 161) = ( 0.2135417 0.2135417 0.4270833), wk = 0.0022371 k( 162) = ( 0.2083333 0.2083333 0.4166667), wk = 0.0022371 k( 163) = ( 0.2031250 0.2031250 0.4062500), wk = 0.0022371 k( 164) = ( 0.1979167 0.1979167 0.3958333), wk = 0.0022371 k( 165) = ( 0.1927083 0.1927083 0.3854167), wk = 0.0022371 k( 166) = ( 0.1875000 0.1875000 0.3750000), wk = 0.0022371 k( 167) = ( 0.1822917 0.1822917 0.3645833), wk = 0.0022371 k( 168) = ( 0.1770833 0.1770833 0.3541667), wk = 0.0022371 k( 169) = ( 0.1718750 0.1718750 0.3437500), wk = 0.0022371 k( 170) = ( 0.1666667 0.1666667 0.3333333), wk = 0.0022371 k( 171) = ( 0.1614583 0.1614583 0.3229167), wk = 0.0022371 k( 172) = ( 0.1562500 0.1562500 0.3125000), wk = 0.0022371 k( 173) = ( 0.1510417 0.1510417 0.3020833), wk = 0.0022371 k( 174) = ( 0.1458333 0.1458333 0.2916667), wk = 0.0022371 k( 175) = ( 0.1406250 0.1406250 0.2812500), wk = 0.0022371 k( 176) = ( 0.1354167 0.1354167 0.2708333), wk = 0.0022371 k( 177) = ( 0.1302083 0.1302083 0.2604167), wk = 0.0022371 k( 178) = ( 0.1250000 0.1250000 0.2500000), wk = 0.0022371 k( 179) = ( 0.1197917 0.1197917 0.2395833), wk = 0.0022371 k( 180) = ( 0.1145833 0.1145833 0.2291667), wk = 0.0022371 k( 181) = ( 0.1093750 0.1093750 0.2187500), wk = 0.0022371 k( 182) = ( 0.1041667 0.1041667 0.2083333), wk = 0.0022371 k( 183) = ( 0.0989583 0.0989583 0.1979167), wk = 0.0022371 k( 184) = ( 0.0937500 0.0937500 0.1875000), wk = 0.0022371 k( 185) = ( 0.0885417 0.0885417 0.1770833), wk = 0.0022371 k( 186) = ( 0.0833333 0.0833333 0.1666667), wk = 0.0022371 k( 187) = ( 0.0781250 0.0781250 0.1562500), wk = 0.0022371 k( 188) = ( 0.0729167 0.0729167 0.1458333), wk = 0.0022371 k( 189) = ( 0.0677083 0.0677083 0.1354167), wk = 0.0022371 k( 190) = ( 0.0625000 0.0625000 0.1250000), wk = 0.0022371 k( 191) = ( 0.0572917 0.0572917 0.1145833), wk = 0.0022371 k( 192) = ( 0.0520833 0.0520833 0.1041667), wk = 0.0022371 k( 193) = ( 0.0468750 0.0468750 0.0937500), wk = 0.0022371 k( 194) = ( 0.0416667 0.0416667 0.0833333), wk = 0.0022371 k( 195) = ( 0.0364583 0.0364583 0.0729167), wk = 0.0022371 k( 196) = ( 0.0312500 0.0312500 0.0625000), wk = 0.0022371 k( 197) = ( 0.0260417 0.0260417 0.0520833), wk = 0.0022371 k( 198) = ( 0.0208333 0.0208333 0.0416667), wk = 0.0022371 k( 199) = ( 0.0156250 0.0156250 0.0312500), wk = 0.0022371 k( 200) = ( 0.0104167 0.0104167 0.0208333), wk = 0.0022371 k( 201) = ( 0.0052083 0.0052083 0.0104167), wk = 0.0022371 k( 202) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 203) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022371 k( 204) = ( 0.0084746 0.0084746 0.0084746), wk = 0.0022371 k( 205) = ( 0.0169491 0.0169492 0.0169491), wk = 0.0022371 k( 206) = ( 0.0254237 0.0254237 0.0254237), wk = 0.0022371 k( 207) = ( 0.0338983 0.0338983 0.0338983), wk = 0.0022371 k( 208) = ( 0.0423729 0.0423729 0.0423729), wk = 0.0022371 k( 209) = ( 0.0508475 0.0508475 0.0508475), wk = 0.0022371 k( 210) = ( 0.0593220 0.0593220 0.0593220), wk = 0.0022371 k( 211) = ( 0.0677966 0.0677966 0.0677966), wk = 0.0022371 k( 212) = ( 0.0762712 0.0762712 0.0762712), wk = 0.0022371 k( 213) = ( 0.0847458 0.0847458 0.0847458), wk = 0.0022371 k( 214) = ( 0.0932203 0.0932203 0.0932203), wk = 0.0022371 k( 215) = ( 0.1016949 0.1016949 0.1016949), wk = 0.0022371 k( 216) = ( 0.1101695 0.1101695 0.1101695), wk = 0.0022371 k( 217) = ( 0.1186441 0.1186441 0.1186441), wk = 0.0022371 k( 218) = ( 0.1271186 0.1271186 0.1271186), wk = 0.0022371 k( 219) = ( 0.1355932 0.1355932 0.1355932), wk = 0.0022371 k( 220) = ( 0.1440678 0.1440678 0.1440678), wk = 0.0022371 k( 221) = ( 0.1525424 0.1525424 0.1525424), wk = 0.0022371 k( 222) = ( 0.1610169 0.1610169 0.1610170), wk = 0.0022371 k( 223) = ( 0.1694915 0.1694915 0.1694915), wk = 0.0022371 k( 224) = ( 0.1779661 0.1779661 0.1779661), wk = 0.0022371 k( 225) = ( 0.1864407 0.1864407 0.1864407), wk = 0.0022371 k( 226) = ( 0.1949153 0.1949153 0.1949153), wk = 0.0022371 k( 227) = ( 0.2033898 0.2033898 0.2033898), wk = 0.0022371 k( 228) = ( 0.2118644 0.2118644 0.2118644), wk = 0.0022371 k( 229) = ( 0.2203390 0.2203390 0.2203390), wk = 0.0022371 k( 230) = ( 0.2288136 0.2288136 0.2288136), wk = 0.0022371 k( 231) = ( 0.2372881 0.2372881 0.2372881), wk = 0.0022371 k( 232) = ( 0.2457627 0.2457627 0.2457627), wk = 0.0022371 k( 233) = ( 0.2542373 0.2542373 0.2542373), wk = 0.0022371 k( 234) = ( 0.2627119 0.2627119 0.2627119), wk = 0.0022371 k( 235) = ( 0.2711864 0.2711864 0.2711864), wk = 0.0022371 k( 236) = ( 0.2796610 0.2796610 0.2796610), wk = 0.0022371 k( 237) = ( 0.2881356 0.2881356 0.2881356), wk = 0.0022371 k( 238) = ( 0.2966102 0.2966102 0.2966102), wk = 0.0022371 k( 239) = ( 0.3050848 0.3050848 0.3050848), wk = 0.0022371 k( 240) = ( 0.3135593 0.3135593 0.3135593), wk = 0.0022371 k( 241) = ( 0.3220339 0.3220339 0.3220339), wk = 0.0022371 k( 242) = ( 0.3305085 0.3305085 0.3305085), wk = 0.0022371 k( 243) = ( 0.3389831 0.3389831 0.3389831), wk = 0.0022371 k( 244) = ( 0.3474576 0.3474576 0.3474576), wk = 0.0022371 k( 245) = ( 0.3559322 0.3559322 0.3559322), wk = 0.0022371 k( 246) = ( 0.3644068 0.3644068 0.3644068), wk = 0.0022371 k( 247) = ( 0.3728814 0.3728814 0.3728814), wk = 0.0022371 k( 248) = ( 0.3813559 0.3813559 0.3813559), wk = 0.0022371 k( 249) = ( 0.3898305 0.3898305 0.3898305), wk = 0.0022371 k( 250) = ( 0.3983051 0.3983051 0.3983051), wk = 0.0022371 k( 251) = ( 0.4067797 0.4067797 0.4067797), wk = 0.0022371 k( 252) = ( 0.4152542 0.4152542 0.4152542), wk = 0.0022371 k( 253) = ( 0.4237288 0.4237288 0.4237288), wk = 0.0022371 k( 254) = ( 0.4322034 0.4322034 0.4322034), wk = 0.0022371 k( 255) = ( 0.4406780 0.4406780 0.4406780), wk = 0.0022371 k( 256) = ( 0.4491525 0.4491525 0.4491525), wk = 0.0022371 k( 257) = ( 0.4576271 0.4576271 0.4576271), wk = 0.0022371 k( 258) = ( 0.4661017 0.4661017 0.4661017), wk = 0.0022371 k( 259) = ( 0.4745763 0.4745763 0.4745763), wk = 0.0022371 k( 260) = ( 0.4830508 0.4830509 0.4830509), wk = 0.0022371 k( 261) = ( 0.4915254 0.4915254 0.4915254), wk = 0.0022371 k( 262) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022371 k( 263) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022371 k( 264) = ( 0.5029762 0.4940476 0.5029762), wk = 0.0022371 k( 265) = ( 0.5059524 0.4880952 0.5059524), wk = 0.0022371 k( 266) = ( 0.5089286 0.4821429 0.5089286), wk = 0.0022371 k( 267) = ( 0.5119048 0.4761905 0.5119048), wk = 0.0022371 k( 268) = ( 0.5148810 0.4702381 0.5148810), wk = 0.0022371 k( 269) = ( 0.5178571 0.4642857 0.5178571), wk = 0.0022371 k( 270) = ( 0.5208333 0.4583333 0.5208333), wk = 0.0022371 k( 271) = ( 0.5238095 0.4523810 0.5238095), wk = 0.0022371 k( 272) = ( 0.5267857 0.4464286 0.5267857), wk = 0.0022371 k( 273) = ( 0.5297619 0.4404762 0.5297619), wk = 0.0022371 k( 274) = ( 0.5327381 0.4345238 0.5327381), wk = 0.0022371 k( 275) = ( 0.5357143 0.4285714 0.5357143), wk = 0.0022371 k( 276) = ( 0.5386905 0.4226190 0.5386905), wk = 0.0022371 k( 277) = ( 0.5416667 0.4166667 0.5416667), wk = 0.0022371 k( 278) = ( 0.5446429 0.4107143 0.5446429), wk = 0.0022371 k( 279) = ( 0.5476190 0.4047619 0.5476190), wk = 0.0022371 k( 280) = ( 0.5505952 0.3988095 0.5505952), wk = 0.0022371 k( 281) = ( 0.5535714 0.3928571 0.5535714), wk = 0.0022371 k( 282) = ( 0.5565476 0.3869048 0.5565476), wk = 0.0022371 k( 283) = ( 0.5595238 0.3809524 0.5595238), wk = 0.0022371 k( 284) = ( 0.5625000 0.3750000 0.5625000), wk = 0.0022371 k( 285) = ( 0.5654762 0.3690476 0.5654762), wk = 0.0022371 k( 286) = ( 0.5684524 0.3630952 0.5684524), wk = 0.0022371 k( 287) = ( 0.5714286 0.3571429 0.5714286), wk = 0.0022371 k( 288) = ( 0.5744048 0.3511905 0.5744048), wk = 0.0022371 k( 289) = ( 0.5773810 0.3452381 0.5773810), wk = 0.0022371 k( 290) = ( 0.5803571 0.3392857 0.5803571), wk = 0.0022371 k( 291) = ( 0.5833333 0.3333333 0.5833333), wk = 0.0022371 k( 292) = ( 0.5863095 0.3273810 0.5863095), wk = 0.0022371 k( 293) = ( 0.5892857 0.3214286 0.5892857), wk = 0.0022371 k( 294) = ( 0.5922619 0.3154762 0.5922619), wk = 0.0022371 k( 295) = ( 0.5952381 0.3095238 0.5952381), wk = 0.0022371 k( 296) = ( 0.5982143 0.3035714 0.5982143), wk = 0.0022371 k( 297) = ( 0.6011905 0.2976190 0.6011905), wk = 0.0022371 k( 298) = ( 0.6041667 0.2916667 0.6041667), wk = 0.0022371 k( 299) = ( 0.6071429 0.2857143 0.6071429), wk = 0.0022371 k( 300) = ( 0.6101190 0.2797619 0.6101190), wk = 0.0022371 k( 301) = ( 0.6130952 0.2738095 0.6130952), wk = 0.0022371 k( 302) = ( 0.6160714 0.2678571 0.6160714), wk = 0.0022371 k( 303) = ( 0.6190476 0.2619048 0.6190476), wk = 0.0022371 k( 304) = ( 0.6220238 0.2559524 0.6220238), wk = 0.0022371 k( 305) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0022371 k( 306) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0022371 k( 307) = ( 0.6197917 0.2500000 0.6302083), wk = 0.0022371 k( 308) = ( 0.6145833 0.2500000 0.6354167), wk = 0.0022371 k( 309) = ( 0.6093750 0.2500000 0.6406250), wk = 0.0022371 k( 310) = ( 0.6041667 0.2500000 0.6458333), wk = 0.0022371 k( 311) = ( 0.5989583 0.2500000 0.6510417), wk = 0.0022371 k( 312) = ( 0.5937500 0.2500000 0.6562500), wk = 0.0022371 k( 313) = ( 0.5885417 0.2500000 0.6614583), wk = 0.0022371 k( 314) = ( 0.5833333 0.2500000 0.6666667), wk = 0.0022371 k( 315) = ( 0.5781250 0.2500000 0.6718750), wk = 0.0022371 k( 316) = ( 0.5729167 0.2500000 0.6770833), wk = 0.0022371 k( 317) = ( 0.5677083 0.2500000 0.6822917), wk = 0.0022371 k( 318) = ( 0.5625000 0.2500000 0.6875000), wk = 0.0022371 k( 319) = ( 0.5572917 0.2500000 0.6927083), wk = 0.0022371 k( 320) = ( 0.5520833 0.2500000 0.6979167), wk = 0.0022371 k( 321) = ( 0.5468750 0.2500000 0.7031250), wk = 0.0022371 k( 322) = ( 0.5416667 0.2500000 0.7083333), wk = 0.0022371 k( 323) = ( 0.5364583 0.2500000 0.7135417), wk = 0.0022371 k( 324) = ( 0.5312500 0.2500000 0.7187500), wk = 0.0022371 k( 325) = ( 0.5260417 0.2500000 0.7239583), wk = 0.0022371 k( 326) = ( 0.5208333 0.2500000 0.7291667), wk = 0.0022371 k( 327) = ( 0.5156250 0.2500000 0.7343750), wk = 0.0022371 k( 328) = ( 0.5104167 0.2500000 0.7395833), wk = 0.0022371 k( 329) = ( 0.5052083 0.2500000 0.7447917), wk = 0.0022371 k( 330) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0022371 k( 331) = ( 0.5000000 0.2500000 0.7500000), wk = 0.0022371 k( 332) = ( 0.5000000 0.2552083 0.7447917), wk = 0.0022371 k( 333) = ( 0.5000000 0.2604167 0.7395833), wk = 0.0022371 k( 334) = ( 0.5000000 0.2656250 0.7343750), wk = 0.0022371 k( 335) = ( 0.5000000 0.2708333 0.7291667), wk = 0.0022371 k( 336) = ( 0.5000000 0.2760417 0.7239583), wk = 0.0022371 k( 337) = ( 0.5000000 0.2812500 0.7187500), wk = 0.0022371 k( 338) = ( 0.5000000 0.2864583 0.7135417), wk = 0.0022371 k( 339) = ( 0.5000000 0.2916667 0.7083333), wk = 0.0022371 k( 340) = ( 0.5000000 0.2968750 0.7031250), wk = 0.0022371 k( 341) = ( 0.5000000 0.3020833 0.6979167), wk = 0.0022371 k( 342) = ( 0.5000000 0.3072917 0.6927083), wk = 0.0022371 k( 343) = ( 0.5000000 0.3125000 0.6875000), wk = 0.0022371 k( 344) = ( 0.5000000 0.3177083 0.6822917), wk = 0.0022371 k( 345) = ( 0.5000000 0.3229167 0.6770833), wk = 0.0022371 k( 346) = ( 0.5000000 0.3281250 0.6718750), wk = 0.0022371 k( 347) = ( 0.5000000 0.3333333 0.6666667), wk = 0.0022371 k( 348) = ( 0.5000000 0.3385417 0.6614583), wk = 0.0022371 k( 349) = ( 0.5000000 0.3437500 0.6562500), wk = 0.0022371 k( 350) = ( 0.5000000 0.3489583 0.6510417), wk = 0.0022371 k( 351) = ( 0.5000000 0.3541667 0.6458333), wk = 0.0022371 k( 352) = ( 0.5000000 0.3593750 0.6406250), wk = 0.0022371 k( 353) = ( 0.5000000 0.3645833 0.6354167), wk = 0.0022371 k( 354) = ( 0.5000000 0.3697917 0.6302083), wk = 0.0022371 k( 355) = ( 0.5000000 0.3750000 0.6250000), wk = 0.0022371 k( 356) = ( 0.5000000 0.3802083 0.6197917), wk = 0.0022371 k( 357) = ( 0.5000000 0.3854167 0.6145833), wk = 0.0022371 k( 358) = ( 0.5000000 0.3906250 0.6093750), wk = 0.0022371 k( 359) = ( 0.5000000 0.3958333 0.6041667), wk = 0.0022371 k( 360) = ( 0.5000000 0.4010417 0.5989583), wk = 0.0022371 k( 361) = ( 0.5000000 0.4062500 0.5937500), wk = 0.0022371 k( 362) = ( 0.5000000 0.4114583 0.5885417), wk = 0.0022371 k( 363) = ( 0.5000000 0.4166667 0.5833333), wk = 0.0022371 k( 364) = ( 0.5000000 0.4218750 0.5781250), wk = 0.0022371 k( 365) = ( 0.5000000 0.4270833 0.5729167), wk = 0.0022371 k( 366) = ( 0.5000000 0.4322917 0.5677083), wk = 0.0022371 k( 367) = ( 0.5000000 0.4375000 0.5625000), wk = 0.0022371 k( 368) = ( 0.5000000 0.4427083 0.5572917), wk = 0.0022371 k( 369) = ( 0.5000000 0.4479167 0.5520833), wk = 0.0022371 k( 370) = ( 0.5000000 0.4531250 0.5468750), wk = 0.0022371 k( 371) = ( 0.5000000 0.4583333 0.5416667), wk = 0.0022371 k( 372) = ( 0.5000000 0.4635417 0.5364583), wk = 0.0022371 k( 373) = ( 0.5000000 0.4687500 0.5312500), wk = 0.0022371 k( 374) = ( 0.5000000 0.4739583 0.5260417), wk = 0.0022371 k( 375) = ( 0.5000000 0.4791667 0.5208333), wk = 0.0022371 k( 376) = ( 0.5000000 0.4843750 0.5156250), wk = 0.0022371 k( 377) = ( 0.5000000 0.4895833 0.5104167), wk = 0.0022371 k( 378) = ( 0.5000000 0.4947917 0.5052083), wk = 0.0022371 k( 379) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022371 k( 380) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022371 k( 381) = ( 0.4970238 0.4970238 0.5059524), wk = 0.0022371 k( 382) = ( 0.4940476 0.4940476 0.5119048), wk = 0.0022371 k( 383) = ( 0.4910714 0.4910714 0.5178571), wk = 0.0022371 k( 384) = ( 0.4880952 0.4880952 0.5238095), wk = 0.0022371 k( 385) = ( 0.4851190 0.4851190 0.5297619), wk = 0.0022371 k( 386) = ( 0.4821429 0.4821429 0.5357143), wk = 0.0022371 k( 387) = ( 0.4791667 0.4791667 0.5416667), wk = 0.0022371 k( 388) = ( 0.4761905 0.4761905 0.5476191), wk = 0.0022371 k( 389) = ( 0.4732143 0.4732143 0.5535714), wk = 0.0022371 k( 390) = ( 0.4702381 0.4702381 0.5595238), wk = 0.0022371 k( 391) = ( 0.4672619 0.4672619 0.5654762), wk = 0.0022371 k( 392) = ( 0.4642857 0.4642857 0.5714286), wk = 0.0022371 k( 393) = ( 0.4613095 0.4613095 0.5773810), wk = 0.0022371 k( 394) = ( 0.4583333 0.4583333 0.5833333), wk = 0.0022371 k( 395) = ( 0.4553571 0.4553571 0.5892857), wk = 0.0022371 k( 396) = ( 0.4523810 0.4523810 0.5952381), wk = 0.0022371 k( 397) = ( 0.4494048 0.4494048 0.6011905), wk = 0.0022371 k( 398) = ( 0.4464286 0.4464286 0.6071429), wk = 0.0022371 k( 399) = ( 0.4434524 0.4434524 0.6130952), wk = 0.0022371 k( 400) = ( 0.4404762 0.4404762 0.6190476), wk = 0.0022371 k( 401) = ( 0.4375000 0.4375000 0.6250000), wk = 0.0022371 k( 402) = ( 0.4345238 0.4345238 0.6309524), wk = 0.0022371 k( 403) = ( 0.4315476 0.4315476 0.6369048), wk = 0.0022371 k( 404) = ( 0.4285714 0.4285714 0.6428571), wk = 0.0022371 k( 405) = ( 0.4255952 0.4255952 0.6488095), wk = 0.0022371 k( 406) = ( 0.4226190 0.4226190 0.6547619), wk = 0.0022371 k( 407) = ( 0.4196429 0.4196429 0.6607143), wk = 0.0022371 k( 408) = ( 0.4166667 0.4166667 0.6666667), wk = 0.0022371 k( 409) = ( 0.4136905 0.4136905 0.6726190), wk = 0.0022371 k( 410) = ( 0.4107143 0.4107143 0.6785714), wk = 0.0022371 k( 411) = ( 0.4077381 0.4077381 0.6845238), wk = 0.0022371 k( 412) = ( 0.4047619 0.4047619 0.6904762), wk = 0.0022371 k( 413) = ( 0.4017857 0.4017857 0.6964286), wk = 0.0022371 k( 414) = ( 0.3988095 0.3988095 0.7023810), wk = 0.0022371 k( 415) = ( 0.3958333 0.3958333 0.7083333), wk = 0.0022371 k( 416) = ( 0.3928571 0.3928571 0.7142857), wk = 0.0022371 k( 417) = ( 0.3898810 0.3898810 0.7202381), wk = 0.0022371 k( 418) = ( 0.3869048 0.3869048 0.7261905), wk = 0.0022371 k( 419) = ( 0.3839286 0.3839286 0.7321429), wk = 0.0022371 k( 420) = ( 0.3809524 0.3809524 0.7380952), wk = 0.0022371 k( 421) = ( 0.3779762 0.3779762 0.7440476), wk = 0.0022371 k( 422) = ( 0.3750000 0.3750000 0.7500000), wk = 0.0022371 k( 423) = ( 0.6250000 0.2500000 0.6250000), wk = 0.0022371 k( 424) = ( 0.6197917 0.2395833 0.6197917), wk = 0.0022371 k( 425) = ( 0.6145833 0.2291667 0.6145833), wk = 0.0022371 k( 426) = ( 0.6093750 0.2187500 0.6093750), wk = 0.0022371 k( 427) = ( 0.6041667 0.2083333 0.6041667), wk = 0.0022371 k( 428) = ( 0.5989583 0.1979167 0.5989583), wk = 0.0022371 k( 429) = ( 0.5937500 0.1875000 0.5937500), wk = 0.0022371 k( 430) = ( 0.5885417 0.1770833 0.5885417), wk = 0.0022371 k( 431) = ( 0.5833333 0.1666667 0.5833333), wk = 0.0022371 k( 432) = ( 0.5781250 0.1562500 0.5781250), wk = 0.0022371 k( 433) = ( 0.5729167 0.1458333 0.5729167), wk = 0.0022371 k( 434) = ( 0.5677083 0.1354167 0.5677083), wk = 0.0022371 k( 435) = ( 0.5625000 0.1250000 0.5625000), wk = 0.0022371 k( 436) = ( 0.5572917 0.1145833 0.5572917), wk = 0.0022371 k( 437) = ( 0.5520833 0.1041667 0.5520833), wk = 0.0022371 k( 438) = ( 0.5468750 0.0937500 0.5468750), wk = 0.0022371 k( 439) = ( 0.5416667 0.0833333 0.5416667), wk = 0.0022371 k( 440) = ( 0.5364583 0.0729167 0.5364583), wk = 0.0022371 k( 441) = ( 0.5312500 0.0625000 0.5312500), wk = 0.0022371 k( 442) = ( 0.5260417 0.0520833 0.5260417), wk = 0.0022371 k( 443) = ( 0.5208333 0.0416667 0.5208333), wk = 0.0022371 k( 444) = ( 0.5156250 0.0312500 0.5156250), wk = 0.0022371 k( 445) = ( 0.5104167 0.0208333 0.5104167), wk = 0.0022371 k( 446) = ( 0.5052083 0.0104167 0.5052083), wk = 0.0022371 k( 447) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022371 Dense grid: 19603 G-vectors FFT dimensions: ( 40, 40, 40) Smooth grid: 9257 G-vectors FFT dimensions: ( 30, 30, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.03 Mb ( 56, 30) NL pseudopotentials 0.02 Mb ( 28, 48) Each V/rho on FFT grid 0.02 Mb ( 1600) Each G-vector array 0.00 Mb ( 410) G-vector shells 0.00 Mb ( 170) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.10 Mb ( 56, 120) Each subspace H/S matrix 0.22 Mb ( 120, 120) Each matrix 0.04 Mb ( 48, 2, 30) Check: negative/imaginary core charge= -0.000008 0.000000 The potential is recalculated from file : ./RhN.save/charge-density.dat Starting wfc are 28 randomized atomic wfcs + 2 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 40.5 secs Computing kpt #: 2 total cpu time spent up to now is 40.9 secs Computing kpt #: 3 total cpu time spent up to now is 41.2 secs Computing kpt #: 4 total cpu time spent up to now is 41.6 secs Computing kpt #: 5 total cpu time spent up to now is 41.9 secs Computing kpt #: 6 total cpu time spent up to now is 42.3 secs Computing kpt #: 7 total cpu time spent up to now is 42.7 secs Computing kpt #: 8 total cpu time spent up to now is 43.1 secs Computing kpt #: 9 total cpu time spent up to now is 43.4 secs Computing kpt #: 10 total cpu time spent up to now is 43.7 secs Computing kpt #: 11 total cpu time spent up to now is 44.1 secs Computing kpt #: 12 total cpu time spent up to now is 44.5 secs Computing kpt #: 13 total cpu time spent up to now is 44.8 secs Computing kpt #: 14 total cpu time spent up to now is 45.2 secs Computing kpt #: 15 total cpu time spent up to now is 45.5 secs Computing kpt #: 16 total cpu time spent up to now is 45.8 secs Computing kpt #: 17 total cpu time spent up to now is 46.2 secs Computing kpt #: 18 total cpu time spent up to now is 46.5 secs Computing kpt #: 19 total cpu time spent up to now is 46.8 secs Computing kpt #: 20 total cpu time spent up to now is 47.4 secs Computing kpt #: 21 total cpu time spent up to now is 48.1 secs Computing kpt #: 22 total cpu time spent up to now is 48.4 secs Computing kpt #: 23 total cpu time spent up to now is 48.7 secs Computing kpt #: 24 total cpu time spent up to now is 49.2 secs Computing kpt #: 25 total cpu time spent up to now is 49.7 secs Computing kpt #: 26 total cpu time spent up to now is 50.1 secs Computing kpt #: 27 total cpu time spent up to now is 50.4 secs Computing kpt #: 28 total cpu time spent up to now is 50.7 secs Computing kpt #: 29 total cpu time spent up to now is 51.2 secs Computing kpt #: 30 total cpu time spent up to now is 51.5 secs Computing kpt #: 31 total cpu time spent up to now is 51.9 secs Computing kpt #: 32 total cpu time spent up to now is 52.2 secs Computing kpt #: 33 total cpu time spent up to now is 52.6 secs Computing kpt #: 34 total cpu time spent up to now is 52.9 secs Computing kpt #: 35 total cpu time spent up to now is 53.2 secs Computing kpt #: 36 total cpu time spent up to now is 53.6 secs Computing kpt #: 37 total cpu time spent up to now is 54.0 secs Computing kpt #: 38 total cpu time spent up to now is 54.3 secs Computing kpt #: 39 total cpu time spent up to now is 54.7 secs Computing kpt #: 40 total cpu time spent up to now is 55.0 secs Computing kpt #: 41 total cpu time spent up to now is 55.3 secs Computing kpt #: 42 total cpu time spent up to now is 55.9 secs Computing kpt #: 43 total cpu time spent up to now is 56.3 secs Computing kpt #: 44 total cpu time spent up to now is 56.6 secs Computing kpt #: 45 total cpu time spent up to now is 57.0 secs Computing kpt #: 46 total cpu time spent up to now is 57.4 secs Computing kpt #: 47 total cpu time spent up to now is 57.8 secs Computing kpt #: 48 total cpu time spent up to now is 58.2 secs Computing kpt #: 49 total cpu time spent up to now is 58.6 secs Computing kpt #: 50 total cpu time spent up to now is 59.1 secs Computing kpt #: 51 total cpu time spent up to now is 59.5 secs Computing kpt #: 52 total cpu time spent up to now is 59.9 secs Computing kpt #: 53 total cpu time spent up to now is 60.3 secs Computing kpt #: 54 total cpu time spent up to now is 60.7 secs Computing kpt #: 55 total cpu time spent up to now is 61.1 secs Computing kpt #: 56 total cpu time spent up to now is 61.4 secs Computing kpt #: 57 total cpu time spent up to now is 61.8 secs Computing kpt #: 58 total cpu time spent up to now is 62.1 secs Computing kpt #: 59 total cpu time spent up to now is 62.4 secs Computing kpt #: 60 total cpu time spent up to now is 62.6 secs Computing kpt #: 61 total cpu time spent up to now is 62.9 secs Computing kpt #: 62 total cpu time spent up to now is 63.2 secs Computing kpt #: 63 total cpu time spent up to now is 63.5 secs Computing kpt #: 64 total cpu time spent up to now is 63.8 secs Computing kpt #: 65 total cpu time spent up to now is 64.1 secs Computing kpt #: 66 total cpu time spent up to now is 64.4 secs Computing kpt #: 67 total cpu time spent up to now is 64.7 secs Computing kpt #: 68 total cpu time spent up to now is 64.9 secs Computing kpt #: 69 total cpu time spent up to now is 65.3 secs Computing kpt #: 70 total cpu time spent up to now is 65.6 secs Computing kpt #: 71 total cpu time spent up to now is 65.8 secs Computing kpt #: 72 total cpu time spent up to now is 66.2 secs Computing kpt #: 73 total cpu time spent up to now is 66.5 secs Computing kpt #: 74 total cpu time spent up to now is 66.9 secs Computing kpt #: 75 total cpu time spent up to now is 67.2 secs Computing kpt #: 76 total cpu time spent up to now is 67.5 secs Computing kpt #: 77 total cpu time spent up to now is 67.9 secs Computing kpt #: 78 total cpu time spent up to now is 68.2 secs Computing kpt #: 79 total cpu time spent up to now is 68.4 secs Computing kpt #: 80 total cpu time spent up to now is 68.7 secs Computing kpt #: 81 total cpu time spent up to now is 69.0 secs Computing kpt #: 82 total cpu time spent up to now is 69.2 secs Computing kpt #: 83 total cpu time spent up to now is 69.5 secs Computing kpt #: 84 total cpu time spent up to now is 69.8 secs Computing kpt #: 85 total cpu time spent up to now is 70.1 secs Computing kpt #: 86 total cpu time spent up to now is 70.4 secs Computing kpt #: 87 total cpu time spent up to now is 70.6 secs Computing kpt #: 88 total cpu time spent up to now is 70.9 secs Computing kpt #: 89 total cpu time spent up to now is 71.3 secs Computing kpt #: 90 total cpu time spent up to now is 71.6 secs Computing kpt #: 91 total cpu time spent up to now is 72.0 secs Computing kpt #: 92 total cpu time spent up to now is 72.3 secs Computing kpt #: 93 total cpu time spent up to now is 72.5 secs Computing kpt #: 94 total cpu time spent up to now is 72.8 secs Computing kpt #: 95 total cpu time spent up to now is 73.2 secs Computing kpt #: 96 total cpu time spent up to now is 73.5 secs Computing kpt #: 97 total cpu time spent up to now is 73.7 secs Computing kpt #: 98 total cpu time spent up to now is 74.0 secs Computing kpt #: 99 total cpu time spent up to now is 74.3 secs Computing kpt #: 100 total cpu time spent up to now is 74.6 secs Computing kpt #: 101 total cpu time spent up to now is 74.9 secs Computing kpt #: 102 total cpu time spent up to now is 75.1 secs Computing kpt #: 103 total cpu time spent up to now is 75.4 secs Computing kpt #: 104 total cpu time spent up to now is 75.7 secs Computing kpt #: 105 total cpu time spent up to now is 76.0 secs Computing kpt #: 106 total cpu time spent up to now is 76.3 secs Computing kpt #: 107 total cpu time spent up to now is 76.6 secs Computing kpt #: 108 total cpu time spent up to now is 77.0 secs Computing kpt #: 109 total cpu time spent up to now is 77.3 secs Computing kpt #: 110 total cpu time spent up to now is 77.6 secs Computing kpt #: 111 total cpu time spent up to now is 78.0 secs Computing kpt #: 112 total cpu time spent up to now is 78.5 secs Computing kpt #: 113 total cpu time spent up to now is 78.7 secs Computing kpt #: 114 total cpu time spent up to now is 79.1 secs Computing kpt #: 115 total cpu time spent up to now is 79.4 secs Computing kpt #: 116 total cpu time spent up to now is 79.7 secs Computing kpt #: 117 total cpu time spent up to now is 80.1 secs Computing kpt #: 118 total cpu time spent up to now is 80.4 secs Computing kpt #: 119 total cpu time spent up to now is 80.7 secs Computing kpt #: 120 total cpu time spent up to now is 81.1 secs Computing kpt #: 121 total cpu time spent up to now is 81.7 secs Computing kpt #: 122 total cpu time spent up to now is 82.0 secs Computing kpt #: 123 total cpu time spent up to now is 82.4 secs Computing kpt #: 124 total cpu time spent up to now is 82.7 secs Computing kpt #: 125 total cpu time spent up to now is 83.0 secs Computing kpt #: 126 total cpu time spent up to now is 83.3 secs Computing kpt #: 127 total cpu time spent up to now is 83.5 secs Computing kpt #: 128 total cpu time spent up to now is 83.8 secs Computing kpt #: 129 total cpu time spent up to now is 84.1 secs Computing kpt #: 130 total cpu time spent up to now is 84.4 secs Computing kpt #: 131 total cpu time spent up to now is 84.7 secs Computing kpt #: 132 total cpu time spent up to now is 85.0 secs Computing kpt #: 133 total cpu time spent up to now is 85.3 secs Computing kpt #: 134 total cpu time spent up to now is 85.6 secs Computing kpt #: 135 total cpu time spent up to now is 86.0 secs Computing kpt #: 136 total cpu time spent up to now is 86.3 secs Computing kpt #: 137 total cpu time spent up to now is 86.6 secs Computing kpt #: 138 total cpu time spent up to now is 86.9 secs Computing kpt #: 139 total cpu time spent up to now is 87.2 secs Computing kpt #: 140 total cpu time spent up to now is 87.4 secs Computing kpt #: 141 total cpu time spent up to now is 87.7 secs Computing kpt #: 142 total cpu time spent up to now is 88.0 secs Computing kpt #: 143 total cpu time spent up to now is 88.2 secs Computing kpt #: 144 total cpu time spent up to now is 88.5 secs Computing kpt #: 145 total cpu time spent up to now is 88.8 secs Computing kpt #: 146 total cpu time spent up to now is 89.1 secs Computing kpt #: 147 total cpu time spent up to now is 89.5 secs Computing kpt #: 148 total cpu time spent up to now is 89.8 secs Computing kpt #: 149 total cpu time spent up to now is 90.1 secs Computing kpt #: 150 total cpu time spent up to now is 90.5 secs Computing kpt #: 151 total cpu time spent up to now is 90.8 secs Computing kpt #: 152 total cpu time spent up to now is 91.1 secs Computing kpt #: 153 total cpu time spent up to now is 91.4 secs Computing kpt #: 154 total cpu time spent up to now is 91.6 secs Computing kpt #: 155 total cpu time spent up to now is 91.9 secs Computing kpt #: 156 total cpu time spent up to now is 92.2 secs Computing kpt #: 157 total cpu time spent up to now is 92.6 secs Computing kpt #: 158 total cpu time spent up to now is 92.9 secs Computing kpt #: 159 total cpu time spent up to now is 93.2 secs Computing kpt #: 160 total cpu time spent up to now is 93.4 secs Computing kpt #: 161 total cpu time spent up to now is 93.7 secs Computing kpt #: 162 total cpu time spent up to now is 94.2 secs Computing kpt #: 163 total cpu time spent up to now is 94.4 secs Computing kpt #: 164 total cpu time spent up to now is 94.7 secs Computing kpt #: 165 total cpu time spent up to now is 95.0 secs Computing kpt #: 166 total cpu time spent up to now is 95.6 secs Computing kpt #: 167 total cpu time spent up to now is 96.1 secs Computing kpt #: 168 total cpu time spent up to now is 96.4 secs Computing kpt #: 169 total cpu time spent up to now is 97.1 secs Computing kpt #: 170 total cpu time spent up to now is 97.6 secs Computing kpt #: 171 total cpu time spent up to now is 97.9 secs Computing kpt #: 172 total cpu time spent up to now is 98.2 secs Computing kpt #: 173 total cpu time spent up to now is 98.5 secs Computing kpt #: 174 total cpu time spent up to now is 98.9 secs Computing kpt #: 175 total cpu time spent up to now is 99.3 secs Computing kpt #: 176 total cpu time spent up to now is 99.6 secs Computing kpt #: 177 total cpu time spent up to now is 99.9 secs Computing kpt #: 178 total cpu time spent up to now is 100.2 secs Computing kpt #: 179 total cpu time spent up to now is 100.5 secs Computing kpt #: 180 total cpu time spent up to now is 100.8 secs Computing kpt #: 181 total cpu time spent up to now is 101.3 secs Computing kpt #: 182 total cpu time spent up to now is 101.6 secs Computing kpt #: 183 total cpu time spent up to now is 102.1 secs Computing kpt #: 184 total cpu time spent up to now is 102.4 secs Computing kpt #: 185 total cpu time spent up to now is 102.7 secs Computing kpt #: 186 total cpu time spent up to now is 103.1 secs Computing kpt #: 187 total cpu time spent up to now is 103.4 secs Computing kpt #: 188 total cpu time spent up to now is 103.7 secs Computing kpt #: 189 total cpu time spent up to now is 104.0 secs Computing kpt #: 190 total cpu time spent up to now is 104.4 secs Computing kpt #: 191 total cpu time spent up to now is 104.7 secs Computing kpt #: 192 total cpu time spent up to now is 105.1 secs Computing kpt #: 193 total cpu time spent up to now is 105.4 secs Computing kpt #: 194 total cpu time spent up to now is 105.8 secs Computing kpt #: 195 total cpu time spent up to now is 106.1 secs Computing kpt #: 196 total cpu time spent up to now is 106.5 secs Computing kpt #: 197 total cpu time spent up to now is 106.9 secs Computing kpt #: 198 total cpu time spent up to now is 107.2 secs Computing kpt #: 199 total cpu time spent up to now is 107.7 secs Computing kpt #: 200 total cpu time spent up to now is 108.1 secs Computing kpt #: 201 total cpu time spent up to now is 108.4 secs Computing kpt #: 202 total cpu time spent up to now is 108.7 secs Computing kpt #: 203 total cpu time spent up to now is 109.1 secs Computing kpt #: 204 total cpu time spent up to now is 109.4 secs Computing kpt #: 205 total cpu time spent up to now is 109.7 secs Computing kpt #: 206 total cpu time spent up to now is 110.1 secs Computing kpt #: 207 total cpu time spent up to now is 110.4 secs Computing kpt #: 208 total cpu time spent up to now is 110.8 secs Computing kpt #: 209 total cpu time spent up to now is 111.1 secs Computing kpt #: 210 total cpu time spent up to now is 111.5 secs Computing kpt #: 211 total cpu time spent up to now is 111.8 secs Computing kpt #: 212 total cpu time spent up to now is 112.2 secs Computing kpt #: 213 total cpu time spent up to now is 112.5 secs Computing kpt #: 214 total cpu time spent up to now is 112.8 secs Computing kpt #: 215 total cpu time spent up to now is 113.2 secs Computing kpt #: 216 total cpu time spent up to now is 113.5 secs Computing kpt #: 217 total cpu time spent up to now is 113.8 secs Computing kpt #: 218 total cpu time spent up to now is 114.2 secs Computing kpt #: 219 total cpu time spent up to now is 114.5 secs Computing kpt #: 220 total cpu time spent up to now is 114.8 secs Computing kpt #: 221 total cpu time spent up to now is 115.2 secs Computing kpt #: 222 total cpu time spent up to now is 115.5 secs Computing kpt #: 223 total cpu time spent up to now is 115.8 secs Computing kpt #: 224 total cpu time spent up to now is 116.1 secs Computing kpt #: 225 total cpu time spent up to now is 116.4 secs Computing kpt #: 226 total cpu time spent up to now is 116.6 secs Computing kpt #: 227 total cpu time spent up to now is 116.9 secs Computing kpt #: 228 total cpu time spent up to now is 117.2 secs Computing kpt #: 229 total cpu time spent up to now is 117.5 secs Computing kpt #: 230 total cpu time spent up to now is 117.7 secs Computing kpt #: 231 total cpu time spent up to now is 118.0 secs Computing kpt #: 232 total cpu time spent up to now is 118.3 secs Computing kpt #: 233 total cpu time spent up to now is 118.5 secs Computing kpt #: 234 total cpu time spent up to now is 118.8 secs Computing kpt #: 235 total cpu time spent up to now is 119.1 secs Computing kpt #: 236 total cpu time spent up to now is 119.4 secs Computing kpt #: 237 total cpu time spent up to now is 119.7 secs Computing kpt #: 238 total cpu time spent up to now is 120.0 secs Computing kpt #: 239 total cpu time spent up to now is 120.4 secs Computing kpt #: 240 total cpu time spent up to now is 120.7 secs Computing kpt #: 241 total cpu time spent up to now is 121.0 secs Computing kpt #: 242 total cpu time spent up to now is 121.3 secs Computing kpt #: 243 total cpu time spent up to now is 121.6 secs Computing kpt #: 244 total cpu time spent up to now is 121.9 secs Computing kpt #: 245 total cpu time spent up to now is 122.3 secs Computing kpt #: 246 total cpu time spent up to now is 122.6 secs Computing kpt #: 247 total cpu time spent up to now is 123.0 secs Computing kpt #: 248 total cpu time spent up to now is 123.2 secs Computing kpt #: 249 total cpu time spent up to now is 123.5 secs Computing kpt #: 250 total cpu time spent up to now is 123.8 secs Computing kpt #: 251 total cpu time spent up to now is 124.1 secs Computing kpt #: 252 total cpu time spent up to now is 124.3 secs Computing kpt #: 253 total cpu time spent up to now is 124.6 secs Computing kpt #: 254 total cpu time spent up to now is 124.8 secs Computing kpt #: 255 total cpu time spent up to now is 125.1 secs Computing kpt #: 256 total cpu time spent up to now is 125.4 secs Computing kpt #: 257 total cpu time spent up to now is 125.6 secs Computing kpt #: 258 total cpu time spent up to now is 126.3 secs Computing kpt #: 259 total cpu time spent up to now is 126.7 secs Computing kpt #: 260 total cpu time spent up to now is 127.0 secs Computing kpt #: 261 total cpu time spent up to now is 127.6 secs Computing kpt #: 262 total cpu time spent up to now is 128.1 secs Computing kpt #: 263 total cpu time spent up to now is 128.4 secs Computing kpt #: 264 total cpu time spent up to now is 128.8 secs Computing kpt #: 265 total cpu time spent up to now is 129.2 secs Computing kpt #: 266 total cpu time spent up to now is 129.5 secs Computing kpt #: 267 total cpu time spent up to now is 129.8 secs Computing kpt #: 268 total cpu time spent up to now is 130.1 secs Computing kpt #: 269 total cpu time spent up to now is 130.4 secs Computing kpt #: 270 total cpu time spent up to now is 130.7 secs Computing kpt #: 271 total cpu time spent up to now is 131.2 secs Computing kpt #: 272 total cpu time spent up to now is 131.4 secs Computing kpt #: 273 total cpu time spent up to now is 131.8 secs Computing kpt #: 274 total cpu time spent up to now is 132.6 secs Computing kpt #: 275 total cpu time spent up to now is 132.9 secs Computing kpt #: 276 total cpu time spent up to now is 133.2 secs Computing kpt #: 277 total cpu time spent up to now is 133.4 secs Computing kpt #: 278 total cpu time spent up to now is 133.7 secs Computing kpt #: 279 total cpu time spent up to now is 134.0 secs Computing kpt #: 280 total cpu time spent up to now is 134.2 secs Computing kpt #: 281 total cpu time spent up to now is 134.5 secs Computing kpt #: 282 total cpu time spent up to now is 134.7 secs Computing kpt #: 283 total cpu time spent up to now is 135.1 secs Computing kpt #: 284 total cpu time spent up to now is 135.3 secs Computing kpt #: 285 total cpu time spent up to now is 135.7 secs Computing kpt #: 286 total cpu time spent up to now is 136.0 secs Computing kpt #: 287 total cpu time spent up to now is 136.3 secs Computing kpt #: 288 total cpu time spent up to now is 136.6 secs Computing kpt #: 289 total cpu time spent up to now is 137.0 secs Computing kpt #: 290 total cpu time spent up to now is 137.2 secs Computing kpt #: 291 total cpu time spent up to now is 137.6 secs Computing kpt #: 292 total cpu time spent up to now is 137.9 secs Computing kpt #: 293 total cpu time spent up to now is 138.2 secs Computing kpt #: 294 total cpu time spent up to now is 138.6 secs Computing kpt #: 295 total cpu time spent up to now is 138.9 secs Computing kpt #: 296 total cpu time spent up to now is 139.3 secs Computing kpt #: 297 total cpu time spent up to now is 139.6 secs Computing kpt #: 298 total cpu time spent up to now is 139.9 secs Computing kpt #: 299 total cpu time spent up to now is 140.2 secs Computing kpt #: 300 total cpu time spent up to now is 140.4 secs Computing kpt #: 301 total cpu time spent up to now is 140.7 secs Computing kpt #: 302 total cpu time spent up to now is 141.0 secs Computing kpt #: 303 total cpu time spent up to now is 141.3 secs Computing kpt #: 304 total cpu time spent up to now is 141.6 secs Computing kpt #: 305 total cpu time spent up to now is 141.9 secs Computing kpt #: 306 total cpu time spent up to now is 142.3 secs Computing kpt #: 307 total cpu time spent up to now is 143.1 secs Computing kpt #: 308 total cpu time spent up to now is 143.5 secs Computing kpt #: 309 total cpu time spent up to now is 143.8 secs Computing kpt #: 310 total cpu time spent up to now is 144.3 secs Computing kpt #: 311 total cpu time spent up to now is 144.7 secs Computing kpt #: 312 total cpu time spent up to now is 145.1 secs Computing kpt #: 313 total cpu time spent up to now is 145.5 secs Computing kpt #: 314 total cpu time spent up to now is 145.9 secs Computing kpt #: 315 total cpu time spent up to now is 146.4 secs Computing kpt #: 316 total cpu time spent up to now is 146.7 secs Computing kpt #: 317 total cpu time spent up to now is 147.1 secs Computing kpt #: 318 total cpu time spent up to now is 147.4 secs Computing kpt #: 319 total cpu time spent up to now is 147.7 secs Computing kpt #: 320 total cpu time spent up to now is 148.0 secs Computing kpt #: 321 total cpu time spent up to now is 148.3 secs Computing kpt #: 322 total cpu time spent up to now is 148.6 secs Computing kpt #: 323 total cpu time spent up to now is 148.9 secs Computing kpt #: 324 total cpu time spent up to now is 149.6 secs Computing kpt #: 325 total cpu time spent up to now is 149.9 secs Computing kpt #: 326 total cpu time spent up to now is 150.2 secs Computing kpt #: 327 total cpu time spent up to now is 150.5 secs Computing kpt #: 328 total cpu time spent up to now is 150.8 secs Computing kpt #: 329 total cpu time spent up to now is 151.1 secs Computing kpt #: 330 total cpu time spent up to now is 151.4 secs Computing kpt #: 331 total cpu time spent up to now is 151.7 secs Computing kpt #: 332 total cpu time spent up to now is 152.0 secs Computing kpt #: 333 total cpu time spent up to now is 152.5 secs Computing kpt #: 334 total cpu time spent up to now is 152.7 secs Computing kpt #: 335 total cpu time spent up to now is 153.0 secs Computing kpt #: 336 total cpu time spent up to now is 153.5 secs Computing kpt #: 337 total cpu time spent up to now is 154.1 secs Computing kpt #: 338 total cpu time spent up to now is 154.4 secs Computing kpt #: 339 total cpu time spent up to now is 154.7 secs Computing kpt #: 340 total cpu time spent up to now is 155.0 secs Computing kpt #: 341 total cpu time spent up to now is 155.2 secs Computing kpt #: 342 total cpu time spent up to now is 155.5 secs Computing kpt #: 343 total cpu time spent up to now is 155.8 secs Computing kpt #: 344 total cpu time spent up to now is 156.2 secs Computing kpt #: 345 total cpu time spent up to now is 156.5 secs Computing kpt #: 346 total cpu time spent up to now is 156.9 secs Computing kpt #: 347 total cpu time spent up to now is 157.4 secs Computing kpt #: 348 total cpu time spent up to now is 157.8 secs Computing kpt #: 349 total cpu time spent up to now is 158.1 secs Computing kpt #: 350 total cpu time spent up to now is 158.4 secs Computing kpt #: 351 total cpu time spent up to now is 158.9 secs Computing kpt #: 352 total cpu time spent up to now is 159.4 secs Computing kpt #: 353 total cpu time spent up to now is 160.2 secs Computing kpt #: 354 total cpu time spent up to now is 161.0 secs Computing kpt #: 355 total cpu time spent up to now is 161.5 secs Computing kpt #: 356 total cpu time spent up to now is 162.2 secs Computing kpt #: 357 total cpu time spent up to now is 162.6 secs Computing kpt #: 358 total cpu time spent up to now is 163.1 secs Computing kpt #: 359 total cpu time spent up to now is 163.4 secs Computing kpt #: 360 total cpu time spent up to now is 163.6 secs Computing kpt #: 361 total cpu time spent up to now is 163.9 secs Computing kpt #: 362 total cpu time spent up to now is 164.2 secs Computing kpt #: 363 total cpu time spent up to now is 164.4 secs Computing kpt #: 364 total cpu time spent up to now is 164.7 secs Computing kpt #: 365 total cpu time spent up to now is 165.0 secs Computing kpt #: 366 total cpu time spent up to now is 165.2 secs Computing kpt #: 367 total cpu time spent up to now is 165.5 secs Computing kpt #: 368 total cpu time spent up to now is 165.7 secs Computing kpt #: 369 total cpu time spent up to now is 166.0 secs Computing kpt #: 370 total cpu time spent up to now is 166.4 secs Computing kpt #: 371 total cpu time spent up to now is 166.9 secs Computing kpt #: 372 total cpu time spent up to now is 167.3 secs Computing kpt #: 373 total cpu time spent up to now is 167.5 secs Computing kpt #: 374 total cpu time spent up to now is 167.9 secs Computing kpt #: 375 total cpu time spent up to now is 168.1 secs Computing kpt #: 376 total cpu time spent up to now is 168.4 secs Computing kpt #: 377 total cpu time spent up to now is 169.1 secs Computing kpt #: 378 total cpu time spent up to now is 169.4 secs Computing kpt #: 379 total cpu time spent up to now is 169.7 secs Computing kpt #: 380 total cpu time spent up to now is 170.1 secs Computing kpt #: 381 total cpu time spent up to now is 170.5 secs Computing kpt #: 382 total cpu time spent up to now is 171.0 secs Computing kpt #: 383 total cpu time spent up to now is 171.3 secs Computing kpt #: 384 total cpu time spent up to now is 171.6 secs Computing kpt #: 385 total cpu time spent up to now is 171.8 secs Computing kpt #: 386 total cpu time spent up to now is 172.1 secs Computing kpt #: 387 total cpu time spent up to now is 172.4 secs Computing kpt #: 388 total cpu time spent up to now is 172.6 secs Computing kpt #: 389 total cpu time spent up to now is 172.9 secs Computing kpt #: 390 total cpu time spent up to now is 173.1 secs Computing kpt #: 391 total cpu time spent up to now is 173.6 secs Computing kpt #: 392 total cpu time spent up to now is 173.9 secs Computing kpt #: 393 total cpu time spent up to now is 174.2 secs Computing kpt #: 394 total cpu time spent up to now is 174.5 secs Computing kpt #: 395 total cpu time spent up to now is 174.8 secs Computing kpt #: 396 total cpu time spent up to now is 175.2 secs Computing kpt #: 397 total cpu time spent up to now is 175.5 secs Computing kpt #: 398 total cpu time spent up to now is 175.8 secs Computing kpt #: 399 total cpu time spent up to now is 176.2 secs Computing kpt #: 400 total cpu time spent up to now is 176.5 secs Computing kpt #: 401 total cpu time spent up to now is 176.9 secs Computing kpt #: 402 total cpu time spent up to now is 177.3 secs Computing kpt #: 403 total cpu time spent up to now is 177.6 secs Computing kpt #: 404 total cpu time spent up to now is 177.8 secs Computing kpt #: 405 total cpu time spent up to now is 178.1 secs Computing kpt #: 406 total cpu time spent up to now is 178.4 secs Computing kpt #: 407 total cpu time spent up to now is 178.6 secs Computing kpt #: 408 total cpu time spent up to now is 178.9 secs Computing kpt #: 409 total cpu time spent up to now is 179.1 secs Computing kpt #: 410 total cpu time spent up to now is 179.4 secs Computing kpt #: 411 total cpu time spent up to now is 179.7 secs Computing kpt #: 412 total cpu time spent up to now is 180.1 secs Computing kpt #: 413 total cpu time spent up to now is 180.5 secs Computing kpt #: 414 total cpu time spent up to now is 180.9 secs Computing kpt #: 415 total cpu time spent up to now is 181.2 secs Computing kpt #: 416 total cpu time spent up to now is 181.5 secs Computing kpt #: 417 total cpu time spent up to now is 181.8 secs Computing kpt #: 418 total cpu time spent up to now is 182.2 secs Computing kpt #: 419 total cpu time spent up to now is 182.6 secs Computing kpt #: 420 total cpu time spent up to now is 182.9 secs Computing kpt #: 421 total cpu time spent up to now is 183.3 secs Computing kpt #: 422 total cpu time spent up to now is 183.6 secs Computing kpt #: 423 total cpu time spent up to now is 184.1 secs Computing kpt #: 424 total cpu time spent up to now is 184.5 secs Computing kpt #: 425 total cpu time spent up to now is 184.9 secs Computing kpt #: 426 total cpu time spent up to now is 185.2 secs Computing kpt #: 427 total cpu time spent up to now is 185.5 secs Computing kpt #: 428 total cpu time spent up to now is 185.8 secs Computing kpt #: 429 total cpu time spent up to now is 186.1 secs Computing kpt #: 430 total cpu time spent up to now is 186.4 secs Computing kpt #: 431 total cpu time spent up to now is 186.6 secs Computing kpt #: 432 total cpu time spent up to now is 186.9 secs Computing kpt #: 433 total cpu time spent up to now is 187.2 secs Computing kpt #: 434 total cpu time spent up to now is 187.5 secs Computing kpt #: 435 total cpu time spent up to now is 187.8 secs Computing kpt #: 436 total cpu time spent up to now is 188.1 secs Computing kpt #: 437 total cpu time spent up to now is 188.5 secs Computing kpt #: 438 total cpu time spent up to now is 188.8 secs Computing kpt #: 439 total cpu time spent up to now is 189.1 secs Computing kpt #: 440 total cpu time spent up to now is 189.5 secs Computing kpt #: 441 total cpu time spent up to now is 189.9 secs Computing kpt #: 442 total cpu time spent up to now is 190.2 secs Computing kpt #: 443 total cpu time spent up to now is 190.6 secs Computing kpt #: 444 total cpu time spent up to now is 191.0 secs Computing kpt #: 445 total cpu time spent up to now is 191.4 secs Computing kpt #: 446 total cpu time spent up to now is 191.7 secs Computing kpt #: 447 total cpu time spent up to now is 192.0 secs ethr = 4.55E-11, avg # of iterations = 15.3 total cpu time spent up to now is 192.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7944 -34.7944 -30.8811 -30.8811 -30.8811 -30.8811 -1.2879 -1.2879 8.2943 8.2943 8.2943 8.2943 8.3852 8.3852 12.6440 12.6440 12.6440 12.6440 16.5071 16.5071 18.3904 18.3904 18.3904 18.3904 18.5214 18.5214 29.0313 29.0313 k = 0.0074-0.0042 0.0060 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7945 -34.7945 -30.8812 -30.8812 -30.8812 -30.8812 -1.2873 -1.2873 8.2936 8.2936 8.2954 8.2954 8.3854 8.3854 12.6414 12.6414 12.6460 12.6460 16.5098 16.5098 18.3870 18.3870 18.3917 18.3917 18.5203 18.5203 29.0287 29.0287 k = 0.0147-0.0085 0.0120 ( 1155 PWs) bands (ev): -64.2342 -64.2342 -34.7946 -34.7946 -30.8814 -30.8814 -30.8813 -30.8813 -1.2853 -1.2853 8.2923 8.2923 8.2973 8.2973 8.3858 8.3858 12.6374 12.6374 12.6478 12.6478 16.5179 16.5179 18.3812 18.3812 18.3907 18.3907 18.5171 18.5171 29.0210 29.0210 k = 0.0221-0.0127 0.0180 ( 1163 PWs) bands (ev): -64.2343 -64.2343 -34.7947 -34.7947 -30.8817 -30.8817 -30.8814 -30.8814 -1.2821 -1.2821 8.2900 8.2900 8.3007 8.3007 8.3870 8.3870 12.6320 12.6320 12.6498 12.6498 16.5315 16.5315 18.3734 18.3734 18.3879 18.3879 18.5119 18.5119 29.0082 29.0082 k = 0.0294-0.0170 0.0240 ( 1163 PWs) bands (ev): -64.2342 -64.2342 -34.7949 -34.7949 -30.8820 -30.8820 -30.8816 -30.8816 -1.2775 -1.2775 8.2865 8.2865 8.3055 8.3055 8.3891 8.3891 12.6250 12.6250 12.6526 12.6526 16.5504 16.5504 18.3633 18.3633 18.3831 18.3831 18.5049 18.5049 28.9904 28.9904 k = 0.0368-0.0212 0.0300 ( 1171 PWs) bands (ev): -64.2342 -64.2342 -34.7952 -34.7952 -30.8825 -30.8825 -30.8818 -30.8818 -1.2717 -1.2717 8.2815 8.2815 8.3117 8.3117 8.3924 8.3924 12.6160 12.6160 12.6559 12.6559 16.5745 16.5745 18.3508 18.3508 18.3762 18.3762 18.4958 18.4958 28.9673 28.9673 k = 0.0441-0.0255 0.0360 ( 1171 PWs) bands (ev): -64.2341 -64.2341 -34.7955 -34.7955 -30.8831 -30.8831 -30.8821 -30.8821 -1.2646 -1.2646 8.2747 8.2747 8.3193 8.3193 8.3973 8.3973 12.6053 12.6053 12.6599 12.6599 16.6039 16.6039 18.3360 18.3360 18.3673 18.3673 18.4850 18.4850 28.9391 28.9391 k = 0.0515-0.0297 0.0420 ( 1171 PWs) bands (ev): -64.2341 -64.2341 -34.7958 -34.7958 -30.8838 -30.8838 -30.8824 -30.8824 -1.2563 -1.2563 8.2661 8.2661 8.3282 8.3282 8.4039 8.4039 12.5930 12.5930 12.6647 12.6647 16.6383 16.6383 18.3187 18.3187 18.3563 18.3563 18.4723 18.4723 28.9056 28.9056 k = 0.0588-0.0340 0.0480 ( 1175 PWs) bands (ev): -64.2340 -64.2340 -34.7962 -34.7962 -30.8845 -30.8845 -30.8828 -30.8828 -1.2467 -1.2467 8.2556 8.2556 8.3385 8.3385 8.4122 8.4122 12.5788 12.5788 12.6700 12.6700 16.6777 16.6777 18.2989 18.2989 18.3429 18.3429 18.4578 18.4578 28.8667 28.8667 k = 0.0662-0.0382 0.0540 ( 1171 PWs) bands (ev): -64.2339 -64.2339 -34.7966 -34.7966 -30.8854 -30.8854 -30.8832 -30.8832 -1.2359 -1.2359 8.2435 8.2435 8.3501 8.3501 8.4223 8.4223 12.5633 12.5633 12.6761 12.6761 16.7219 16.7219 18.2766 18.2766 18.3273 18.3273 18.4419 18.4419 28.8227 28.8227 k = 0.0735-0.0425 0.0600 ( 1171 PWs) bands (ev): -64.2338 -64.2338 -34.7971 -34.7971 -30.8863 -30.8863 -30.8836 -30.8836 -1.2239 -1.2239 8.2297 8.2297 8.3632 8.3632 8.4341 8.4341 12.5458 12.5458 12.6828 12.6828 16.7707 16.7707 18.2517 18.2517 18.3092 18.3092 18.4245 18.4245 28.7734 28.7734 k = 0.0809-0.0467 0.0660 ( 1171 PWs) bands (ev): -64.2337 -64.2337 -34.7977 -34.7977 -30.8874 -30.8874 -30.8841 -30.8841 -1.2108 -1.2108 8.2145 8.2145 8.3776 8.3776 8.4475 8.4475 12.5267 12.5267 12.6902 12.6902 16.8239 16.8239 18.2243 18.2243 18.2884 18.2884 18.4058 18.4058 28.7195 28.7195 k = 0.0882-0.0509 0.0720 ( 1163 PWs) bands (ev): -64.2335 -64.2335 -34.7982 -34.7982 -30.8885 -30.8885 -30.8846 -30.8846 -1.1966 -1.1966 8.1980 8.1980 8.3934 8.3934 8.4626 8.4626 12.5063 12.5063 12.6982 12.6982 16.8813 16.8813 18.1943 18.1943 18.2650 18.2650 18.3859 18.3859 28.6613 28.6613 k = 0.0956-0.0552 0.0780 ( 1163 PWs) bands (ev): -64.2333 -64.2333 -34.7989 -34.7989 -30.8897 -30.8897 -30.8852 -30.8852 -1.1813 -1.1813 8.1804 8.1804 8.4105 8.4105 8.4792 8.4792 12.4843 12.4843 12.7069 12.7069 16.9425 16.9425 18.1617 18.1617 18.2387 18.2387 18.3650 18.3650 28.5997 28.5997 k = 0.1029-0.0594 0.0841 ( 1171 PWs) bands (ev): -64.2332 -64.2332 -34.7995 -34.7995 -30.8910 -30.8910 -30.8859 -30.8859 -1.1649 -1.1649 8.1616 8.1616 8.4289 8.4289 8.4973 8.4973 12.4609 12.4609 12.7161 12.7161 17.0072 17.0072 18.1264 18.1264 18.2094 18.2094 18.3432 18.3432 28.5354 28.5354 k = 0.1103-0.0637 0.0901 ( 1163 PWs) bands (ev): -64.2330 -64.2330 -34.8002 -34.8002 -30.8924 -30.8924 -30.8865 -30.8865 -1.1475 -1.1475 8.1421 8.1421 8.4488 8.4488 8.5170 8.5170 12.4363 12.4363 12.7261 12.7261 17.0750 17.0750 18.0886 18.0886 18.1774 18.1774 18.3209 18.3209 28.4694 28.4694 k = 0.1176-0.0679 0.0961 ( 1163 PWs) bands (ev): -64.2329 -64.2329 -34.8010 -34.8010 -30.8939 -30.8939 -30.8872 -30.8872 -1.1291 -1.1291 8.1220 8.1220 8.4699 8.4699 8.5380 8.5380 12.4106 12.4106 12.7366 12.7366 17.1452 17.1452 18.0481 18.0481 18.1424 18.1424 18.2981 18.2981 28.4023 28.4023 k = 0.1250-0.0722 0.1021 ( 1163 PWs) bands (ev): -64.2327 -64.2327 -34.8018 -34.8018 -30.8954 -30.8954 -30.8879 -30.8879 -1.1099 -1.1099 8.1014 8.1014 8.4924 8.4924 8.5605 8.5605 12.3839 12.3839 12.7476 12.7476 17.2171 17.2171 18.0051 18.0051 18.1047 18.1047 18.2755 18.2755 28.3349 28.3349 k = 0.1324-0.0764 0.1081 ( 1163 PWs) bands (ev): -64.2325 -64.2325 -34.8026 -34.8026 -30.8970 -30.8970 -30.8887 -30.8887 -1.0897 -1.0897 8.0803 8.0803 8.5161 8.5161 8.5844 8.5844 12.3563 12.3563 12.7592 12.7592 17.2896 17.2896 17.9596 17.9596 18.0643 18.0643 18.2536 18.2536 28.2679 28.2679 k = 0.1397-0.0807 0.1141 ( 1163 PWs) bands (ev): -64.2323 -64.2323 -34.8035 -34.8035 -30.8987 -30.8987 -30.8895 -30.8895 -1.0688 -1.0688 8.0590 8.0590 8.5412 8.5412 8.6096 8.6096 12.3279 12.3279 12.7713 12.7713 17.3609 17.3609 17.9117 17.9117 18.0214 18.0214 18.2337 18.2337 28.2018 28.2018 k = 0.1471-0.0849 0.1201 ( 1163 PWs) bands (ev): -64.2321 -64.2321 -34.8044 -34.8044 -30.9005 -30.9005 -30.8903 -30.8903 -1.0470 -1.0470 8.0376 8.0376 8.5675 8.5675 8.6362 8.6362 12.2987 12.2987 12.7840 12.7840 17.4287 17.4287 17.8616 17.8616 17.9763 17.9763 18.2175 18.2175 28.1371 28.1371 k = 0.1544-0.0891 0.1261 ( 1163 PWs) bands (ev): -64.2319 -64.2319 -34.8053 -34.8053 -30.9023 -30.9023 -30.8912 -30.8912 -1.0245 -1.0245 8.0162 8.0162 8.5952 8.5952 8.6641 8.6641 12.2691 12.2691 12.7971 12.7971 17.4891 17.4891 17.8097 17.8097 17.9295 17.9295 18.2078 18.2078 28.0742 28.0742 k = 0.1618-0.0934 0.1321 ( 1163 PWs) bands (ev): -64.2317 -64.2317 -34.8063 -34.8063 -30.9041 -30.9041 -30.8921 -30.8921 -1.0014 -1.0014 7.9948 7.9948 8.6241 8.6241 8.6933 8.6933 12.2389 12.2389 12.8107 12.8107 17.5365 17.5365 17.7569 17.7569 17.8816 17.8816 18.2086 18.2086 28.0135 28.0135 k = 0.1691-0.0976 0.1381 ( 1162 PWs) bands (ev): -64.2315 -64.2315 -34.8073 -34.8073 -30.9060 -30.9060 -30.8930 -30.8930 -0.9777 -0.9777 7.9737 7.9737 8.6542 8.6542 8.7238 8.7238 12.2086 12.2086 12.8247 12.8247 17.5632 17.5632 17.7048 17.7048 17.8336 17.8336 18.2248 18.2248 27.9551 27.9551 k = 0.1765-0.1019 0.1441 ( 1162 PWs) bands (ev): -64.2313 -64.2313 -34.8083 -34.8083 -30.9080 -30.9080 -30.8939 -30.8939 -0.9534 -0.9534 7.9529 7.9529 8.6856 8.6856 8.7556 8.7556 12.1780 12.1780 12.8391 12.8391 17.5604 17.5604 17.6572 17.6572 17.7868 17.7868 18.2599 18.2599 27.8994 27.8994 k = 0.1838-0.1061 0.1501 ( 1162 PWs) bands (ev): -64.2310 -64.2310 -34.8093 -34.8093 -30.9100 -30.9100 -30.8949 -30.8949 -0.9286 -0.9286 7.9325 7.9325 8.7183 8.7183 8.7886 8.7886 12.1473 12.1473 12.8539 12.8539 17.5262 17.5262 17.6144 17.6144 17.7421 17.7421 18.3147 18.3147 27.8466 27.8466 k = 0.1912-0.1104 0.1561 ( 1170 PWs) bands (ev): -64.2308 -64.2308 -34.8104 -34.8104 -30.9121 -30.9121 -30.8959 -30.8959 -0.9034 -0.9034 7.9126 7.9126 8.7520 8.7520 8.8228 8.8228 12.1167 12.1167 12.8687 12.8687 17.4723 17.4723 17.5684 17.5684 17.6981 17.6981 18.3866 18.3866 27.7968 27.7968 k = 0.1985-0.1146 0.1621 ( 1170 PWs) bands (ev): -64.2306 -64.2306 -34.8114 -34.8114 -30.9141 -30.9141 -30.8969 -30.8969 -0.8778 -0.8778 7.8933 7.8933 8.7870 8.7870 8.8582 8.8582 12.0864 12.0864 12.8842 12.8842 17.4096 17.4096 17.5148 17.5148 17.6522 17.6522 18.4720 18.4720 27.7501 27.7501 k = 0.2059-0.1189 0.1681 ( 1166 PWs) bands (ev): -64.2303 -64.2303 -34.8125 -34.8125 -30.9162 -30.9162 -30.8979 -30.8979 -0.8519 -0.8519 7.8746 7.8746 8.8232 8.8232 8.8949 8.8949 12.0565 12.0565 12.9000 12.9000 17.3421 17.3421 17.4548 17.4548 17.6026 17.6026 18.5677 18.5677 27.7066 27.7066 k = 0.2132-0.1231 0.1741 ( 1162 PWs) bands (ev): -64.2301 -64.2301 -34.8136 -34.8136 -30.9183 -30.9183 -30.8989 -30.8989 -0.8258 -0.8258 7.8568 7.8568 8.8605 8.8605 8.9326 8.9326 12.0273 12.0273 12.9160 12.9160 17.2714 17.2714 17.3900 17.3900 17.5484 17.5484 18.6708 18.6708 27.6664 27.6664 k = 0.2206-0.1274 0.1801 ( 1162 PWs) bands (ev): -64.2298 -64.2298 -34.8147 -34.8147 -30.9205 -30.9205 -30.9000 -30.9000 -0.7995 -0.7995 7.8396 7.8396 8.8989 8.8989 8.9714 8.9714 11.9986 11.9986 12.9323 12.9323 17.1980 17.1980 17.3215 17.3215 17.4899 17.4899 18.7798 18.7798 27.6295 27.6295 k = 0.2279-0.1316 0.1861 ( 1162 PWs) bands (ev): -64.2296 -64.2296 -34.8159 -34.8159 -30.9227 -30.9227 -30.9010 -30.9010 -0.7730 -0.7730 7.8233 7.8233 8.9383 8.9383 9.0112 9.0112 11.9707 11.9707 12.9488 12.9488 17.1225 17.1225 17.2502 17.2502 17.4271 17.4271 18.8934 18.8934 27.5959 27.5959 k = 0.2353-0.1358 0.1921 ( 1162 PWs) bands (ev): -64.2293 -64.2293 -34.8170 -34.8170 -30.9248 -30.9248 -30.9021 -30.9021 -0.7466 -0.7466 7.8079 7.8079 8.9788 8.9788 9.0521 9.0521 11.9438 11.9438 12.9654 12.9654 17.0450 17.0450 17.1764 17.1764 17.3604 17.3604 19.0106 19.0106 27.5656 27.5656 k = 0.2426-0.1401 0.1981 ( 1174 PWs) bands (ev): -64.2291 -64.2291 -34.8182 -34.8182 -30.9271 -30.9271 -30.9031 -30.9031 -0.7201 -0.7201 7.7933 7.7933 9.0201 9.0201 9.0938 9.0938 11.9177 11.9177 12.9822 12.9822 16.9657 16.9657 17.1004 17.1004 17.2900 17.2900 19.1309 19.1309 27.5383 27.5383 k = 0.2500-0.1443 0.2041 ( 1174 PWs) bands (ev): -64.2289 -64.2289 -34.8193 -34.8193 -30.9293 -30.9293 -30.9042 -30.9042 -0.6937 -0.6937 7.7797 7.7797 9.0626 9.0626 9.1365 9.1365 11.8931 11.8931 12.9990 12.9990 16.8850 16.8850 17.0228 17.0228 17.2163 17.2163 19.2537 19.2537 27.5145 27.5145 k = 0.2574-0.1486 0.2101 ( 1174 PWs) bands (ev): -64.2286 -64.2286 -34.8204 -34.8204 -30.9315 -30.9315 -30.9052 -30.9052 -0.6674 -0.6674 7.7671 7.7671 9.1059 9.1059 9.1802 9.1802 11.8699 11.8699 13.0160 13.0160 16.8029 16.8029 16.9436 16.9436 17.1395 17.1395 19.3787 19.3787 27.4939 27.4939 k = 0.2647-0.1528 0.2161 ( 1162 PWs) bands (ev): -64.2283 -64.2283 -34.8215 -34.8215 -30.9336 -30.9336 -30.9063 -30.9063 -0.6414 -0.6414 7.7554 7.7554 9.1502 9.1502 9.2247 9.2247 11.8483 11.8483 13.0330 13.0330 16.7198 16.7198 16.8633 16.8633 17.0600 17.0600 19.5056 19.5056 27.4762 27.4762 k = 0.2721-0.1571 0.2221 ( 1158 PWs) bands (ev): -64.2280 -64.2280 -34.8227 -34.8227 -30.9358 -30.9358 -30.9073 -30.9073 -0.6156 -0.6156 7.7447 7.7447 9.1952 9.1952 9.2700 9.2700 11.8282 11.8282 13.0500 13.0500 16.6355 16.6355 16.7816 16.7816 16.9777 16.9777 19.6340 19.6340 27.4615 27.4615 k = 0.2794-0.1613 0.2281 ( 1158 PWs) bands (ev): -64.2278 -64.2278 -34.8238 -34.8238 -30.9379 -30.9379 -30.9084 -30.9084 -0.5901 -0.5901 7.7349 7.7349 9.2409 9.2409 9.3159 9.3159 11.8100 11.8100 13.0669 13.0669 16.5502 16.5502 16.6989 16.6989 16.8929 16.8929 19.7636 19.7636 27.4494 27.4494 k = 0.2868-0.1656 0.2341 ( 1158 PWs) bands (ev): -64.2275 -64.2275 -34.8249 -34.8249 -30.9401 -30.9401 -30.9094 -30.9094 -0.5649 -0.5649 7.7261 7.7261 9.2873 9.2873 9.3624 9.3624 11.7936 11.7936 13.0837 13.0837 16.4641 16.4641 16.6154 16.6154 16.8059 16.8059 19.8943 19.8943 27.4399 27.4399 k = 0.2941-0.1698 0.2401 ( 1146 PWs) bands (ev): -64.2272 -64.2272 -34.8260 -34.8260 -30.9422 -30.9422 -30.9104 -30.9104 -0.5402 -0.5402 7.7182 7.7182 9.3344 9.3344 9.4095 9.4095 11.7794 11.7794 13.1007 13.1007 16.3776 16.3776 16.5314 16.5314 16.7172 16.7172 20.0259 20.0259 27.4327 27.4327 k = 0.3015-0.1741 0.2461 ( 1146 PWs) bands (ev): -64.2270 -64.2270 -34.8271 -34.8271 -30.9442 -30.9442 -30.9114 -30.9114 -0.5160 -0.5160 7.7112 7.7112 9.3819 9.3819 9.4570 9.4570 11.7671 11.7671 13.1172 13.1172 16.2905 16.2905 16.4469 16.4469 16.6266 16.6266 20.1580 20.1580 27.4274 27.4274 k = 0.3088-0.1783 0.2522 ( 1154 PWs) bands (ev): -64.2268 -64.2268 -34.8281 -34.8281 -30.9463 -30.9463 -30.9124 -30.9124 -0.4923 -0.4923 7.7049 7.7049 9.4299 9.4299 9.5048 9.5048 11.7569 11.7569 13.1335 13.1335 16.2030 16.2030 16.3619 16.3619 16.5346 16.5346 20.2906 20.2906 27.4237 27.4237 k = 0.3162-0.1825 0.2582 ( 1154 PWs) bands (ev): -64.2265 -64.2265 -34.8292 -34.8292 -30.9483 -30.9483 -30.9134 -30.9134 -0.4692 -0.4692 7.6995 7.6995 9.4783 9.4783 9.5529 9.5529 11.7491 11.7491 13.1497 13.1497 16.1154 16.1154 16.2771 16.2771 16.4416 16.4416 20.4233 20.4233 27.4213 27.4213 k = 0.3235-0.1868 0.2642 ( 1150 PWs) bands (ev): -64.2263 -64.2263 -34.8302 -34.8302 -30.9503 -30.9503 -30.9143 -30.9143 -0.4466 -0.4466 7.6949 7.6949 9.5270 9.5270 9.6013 9.6013 11.7437 11.7437 13.1655 13.1655 16.0279 16.0279 16.1926 16.1926 16.3479 16.3479 20.5561 20.5561 27.4194 27.4194 k = 0.3309-0.1910 0.2702 ( 1150 PWs) bands (ev): -64.2261 -64.2261 -34.8312 -34.8312 -30.9522 -30.9522 -30.9153 -30.9153 -0.4248 -0.4248 7.6911 7.6911 9.5758 9.5758 9.6496 9.6496 11.7406 11.7406 13.1811 13.1811 15.9403 15.9403 16.1083 16.1083 16.2538 16.2538 20.6886 20.6886 27.4172 27.4172 k = 0.3382-0.1953 0.2762 ( 1150 PWs) bands (ev): -64.2259 -64.2259 -34.8322 -34.8322 -30.9541 -30.9541 -30.9162 -30.9162 -0.4036 -0.4036 7.6878 7.6878 9.6247 9.6247 9.6979 9.6979 11.7399 11.7399 13.1963 13.1963 15.8531 15.8531 16.0246 16.0246 16.1598 16.1598 20.8207 20.8207 27.4133 27.4133 k = 0.3456-0.1995 0.2822 ( 1150 PWs) bands (ev): -64.2256 -64.2256 -34.8331 -34.8331 -30.9559 -30.9559 -30.9171 -30.9171 -0.3832 -0.3832 7.6852 7.6852 9.6735 9.6735 9.7460 9.7460 11.7417 11.7417 13.2111 13.2111 15.7661 15.7661 15.9417 15.9417 16.0662 16.0662 20.9521 20.9521 27.4057 27.4057 k = 0.3529-0.2038 0.2882 ( 1158 PWs) bands (ev): -64.2255 -64.2255 -34.8341 -34.8341 -30.9577 -30.9577 -30.9179 -30.9179 -0.3636 -0.3636 7.6832 7.6832 9.7221 9.7221 9.7936 9.7936 11.7458 11.7458 13.2256 13.2256 15.6795 15.6795 15.8597 15.8597 15.9734 15.9734 21.0826 21.0826 27.3911 27.3911 k = 0.3603-0.2080 0.2942 ( 1150 PWs) bands (ev): -64.2252 -64.2252 -34.8350 -34.8350 -30.9593 -30.9593 -30.9187 -30.9187 -0.3447 -0.3447 7.6816 7.6816 9.7704 9.7704 9.8408 9.8408 11.7525 11.7525 13.2396 13.2396 15.5937 15.5937 15.7792 15.7792 15.8822 15.8822 21.2119 21.2119 27.3657 27.3657 k = 0.3676-0.2123 0.3002 ( 1150 PWs) bands (ev): -64.2250 -64.2250 -34.8358 -34.8358 -30.9610 -30.9610 -30.9195 -30.9195 -0.3266 -0.3266 7.6805 7.6805 9.8182 9.8182 9.8873 9.8873 11.7615 11.7615 13.2531 13.2531 15.5083 15.5083 15.6999 15.6999 15.7928 15.7928 21.3396 21.3396 27.3249 27.3249 k = 0.3750-0.2165 0.3062 ( 1150 PWs) bands (ev): -64.2249 -64.2249 -34.8366 -34.8366 -30.9625 -30.9625 -30.9203 -30.9203 -0.3095 -0.3095 7.6798 7.6798 9.8654 9.8654 9.9330 9.9330 11.7728 11.7728 13.2662 13.2662 15.4236 15.4236 15.6223 15.6223 15.7058 15.7058 21.4656 21.4656 27.2679 27.2679 k = 0.3824-0.2208 0.3122 ( 1150 PWs) bands (ev): -64.2247 -64.2247 -34.8374 -34.8374 -30.9640 -30.9640 -30.9210 -30.9210 -0.2932 -0.2932 7.6794 7.6794 9.9118 9.9118 9.9776 9.9776 11.7862 11.7862 13.2787 13.2787 15.3398 15.3398 15.5467 15.5467 15.6216 15.6216 21.5894 21.5894 27.1977 27.1977 k = 0.3897-0.2250 0.3182 ( 1154 PWs) bands (ev): -64.2246 -64.2246 -34.8382 -34.8382 -30.9655 -30.9655 -30.9217 -30.9217 -0.2778 -0.2778 7.6793 7.6793 9.9571 9.9571 10.0209 10.0209 11.8015 11.8015 13.2907 13.2907 15.2570 15.2570 15.4734 15.4734 15.5408 15.5408 21.7106 21.7106 27.1190 27.1190 k = 0.3971-0.2292 0.3242 ( 1154 PWs) bands (ev): -64.2244 -64.2244 -34.8389 -34.8389 -30.9668 -30.9668 -30.9224 -30.9224 -0.2634 -0.2634 7.6794 7.6794 10.0012 10.0012 10.0628 10.0628 11.8188 11.8188 13.3020 13.3020 15.1754 15.1754 15.4027 15.4027 15.4638 15.4638 21.8289 21.8289 27.0361 27.0361 k = 0.4044-0.2335 0.3302 ( 1154 PWs) bands (ev): -64.2242 -64.2242 -34.8395 -34.8395 -30.9681 -30.9681 -30.9230 -30.9230 -0.2498 -0.2498 7.6797 7.6797 10.0439 10.0439 10.1030 10.1030 11.8376 11.8376 13.3128 13.3128 15.0955 15.0955 15.3350 15.3350 15.3908 15.3908 21.9438 21.9438 26.9517 26.9517 k = 0.4118-0.2377 0.3362 ( 1154 PWs) bands (ev): -64.2241 -64.2241 -34.8402 -34.8402 -30.9692 -30.9692 -30.9236 -30.9236 -0.2373 -0.2373 7.6802 7.6802 10.0850 10.0850 10.1413 10.1413 11.8577 11.8577 13.3230 13.3230 15.0176 15.0176 15.2707 15.2707 15.3220 15.3220 22.0547 22.0547 26.8676 26.8676 k = 0.4191-0.2420 0.3422 ( 1154 PWs) bands (ev): -64.2240 -64.2240 -34.8407 -34.8407 -30.9703 -30.9703 -30.9241 -30.9241 -0.2257 -0.2257 7.6809 7.6809 10.1242 10.1242 10.1775 10.1775 11.8788 11.8788 13.3324 13.3324 14.9423 14.9423 15.2101 15.2101 15.2577 15.2577 22.1611 22.1611 26.7853 26.7853 k = 0.4265-0.2462 0.3482 ( 1154 PWs) bands (ev): -64.2239 -64.2239 -34.8413 -34.8413 -30.9713 -30.9713 -30.9246 -30.9246 -0.2150 -0.2150 7.6815 7.6815 10.1613 10.1613 10.2113 10.2113 11.9005 11.9005 13.3412 13.3412 14.8700 14.8700 15.1538 15.1538 15.1980 15.1980 22.2623 22.2623 26.7056 26.7056 k = 0.4338-0.2505 0.3542 ( 1154 PWs) bands (ev): -64.2237 -64.2237 -34.8418 -34.8418 -30.9722 -30.9722 -30.9251 -30.9251 -0.2054 -0.2054 7.6822 7.6822 10.1961 10.1961 10.2426 10.2426 11.9224 11.9224 13.3494 13.3494 14.8015 14.8015 15.1019 15.1019 15.1431 15.1431 22.3577 22.3577 26.6297 26.6297 k = 0.4412-0.2547 0.3602 ( 1154 PWs) bands (ev): -64.2236 -64.2236 -34.8422 -34.8422 -30.9731 -30.9731 -30.9255 -30.9255 -0.1968 -0.1968 7.6829 7.6829 10.2284 10.2284 10.2710 10.2710 11.9440 11.9440 13.3568 13.3568 14.7374 14.7374 15.0550 15.0550 15.0930 15.0930 22.4465 22.4465 26.5584 26.5584 k = 0.4485-0.2590 0.3662 ( 1154 PWs) bands (ev): -64.2236 -64.2236 -34.8426 -34.8426 -30.9738 -30.9738 -30.9258 -30.9258 -0.1891 -0.1891 7.6835 7.6835 10.2578 10.2578 10.2963 10.2963 11.9648 11.9648 13.3634 13.3634 14.6784 14.6784 15.0131 15.0131 15.0480 15.0480 22.5279 22.5279 26.4925 26.4925 k = 0.4559-0.2632 0.3722 ( 1154 PWs) bands (ev): -64.2235 -64.2235 -34.8429 -34.8429 -30.9744 -30.9744 -30.9261 -30.9261 -0.1825 -0.1825 7.6841 7.6841 10.2841 10.2841 10.3185 10.3185 11.9844 11.9844 13.3693 13.3693 14.6253 14.6253 14.9766 14.9766 15.0083 15.0083 22.6009 22.6009 26.4329 26.4329 k = 0.4632-0.2674 0.3782 ( 1162 PWs) bands (ev): -64.2235 -64.2235 -34.8432 -34.8432 -30.9750 -30.9750 -30.9264 -30.9264 -0.1769 -0.1769 7.6847 7.6847 10.3072 10.3072 10.3371 10.3371 12.0020 12.0020 13.3742 13.3742 14.5788 14.5788 14.9455 14.9455 14.9740 14.9740 22.6646 22.6646 26.3805 26.3805 k = 0.4706-0.2717 0.3842 ( 1162 PWs) bands (ev): -64.2234 -64.2234 -34.8435 -34.8435 -30.9754 -30.9754 -30.9266 -30.9266 -0.1723 -0.1723 7.6851 7.6851 10.3267 10.3267 10.3523 10.3523 12.0174 12.0174 13.3784 13.3784 14.5397 14.5397 14.9202 14.9202 14.9454 14.9454 22.7184 22.7184 26.3361 26.3361 k = 0.4779-0.2759 0.3902 ( 1162 PWs) bands (ev): -64.2234 -64.2234 -34.8436 -34.8436 -30.9758 -30.9758 -30.9268 -30.9268 -0.1687 -0.1687 7.6855 7.6855 10.3425 10.3425 10.3639 10.3639 12.0299 12.0299 13.3817 13.3817 14.5085 14.5085 14.9006 14.9006 14.9228 14.9228 22.7612 22.7612 26.3007 26.3007 k = 0.4853-0.2802 0.3962 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8438 -34.8438 -30.9760 -30.9760 -30.9269 -30.9269 -0.1661 -0.1661 7.6858 7.6858 10.3543 10.3543 10.3719 10.3719 12.0392 12.0392 13.3842 13.3842 14.4858 14.4858 14.8867 14.8867 14.9063 14.9063 22.7923 22.7923 26.2748 26.2748 k = 0.4926-0.2844 0.4022 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8438 -34.8438 -30.9762 -30.9762 -30.9270 -30.9270 -0.1646 -0.1646 7.6859 7.6859 10.3617 10.3617 10.3764 10.3764 12.0449 12.0449 13.3856 13.3856 14.4720 14.4720 14.8785 14.8785 14.8962 14.8962 22.8113 22.8113 26.2590 26.2590 k = 0.5000-0.2887 0.4082 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8439 -34.8439 -30.9762 -30.9762 -30.9270 -30.9270 -0.1641 -0.1641 7.6860 7.6860 10.3642 10.3642 10.3779 10.3779 12.0469 12.0469 13.3861 13.3861 14.4673 14.4673 14.8757 14.8757 14.8929 14.8929 22.8176 22.8176 26.2537 26.2537 k = 0.5000-0.2887 0.4082 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8439 -34.8439 -30.9762 -30.9762 -30.9270 -30.9270 -0.1641 -0.1641 7.6860 7.6860 10.3642 10.3642 10.3779 10.3779 12.0469 12.0469 13.3861 13.3861 14.4673 14.4673 14.8757 14.8757 14.8929 14.8929 22.8176 22.8176 26.2537 26.2537 k = 0.5000-0.2802 0.4143 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8441 -34.8437 -30.9765 -30.9759 -30.9271 -30.9271 -0.1656 -0.1626 7.6862 7.6880 10.3608 10.3665 10.3773 10.3775 12.0446 12.0499 13.3782 13.3915 14.4238 14.4950 14.8368 14.8791 14.9023 14.9363 22.8183 22.8209 26.2522 26.2548 k = 0.5000-0.2717 0.4203 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8443 -34.8435 -30.9768 -30.9755 -30.9271 -30.9271 -0.1671 -0.1611 7.6887 7.6921 10.3563 10.3675 10.3760 10.3763 12.0433 12.0538 13.3676 13.3944 14.3723 14.4975 14.8164 14.8716 14.9195 14.9999 22.8230 22.8280 26.2502 26.2555 k = 0.5000-0.2632 0.4263 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8445 -34.8432 -30.9771 -30.9751 -30.9272 -30.9272 -0.1687 -0.1596 7.6934 7.6985 10.3507 10.3669 10.3742 10.3743 12.0428 12.0586 13.3542 13.3949 14.3175 14.4730 14.8155 14.8646 14.9457 15.0683 22.8317 22.8392 26.2478 26.2559 k = 0.5000-0.2547 0.4323 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8447 -34.8430 -30.9773 -30.9746 -30.9273 -30.9273 -0.1702 -0.1581 7.7002 7.7070 10.3437 10.3637 10.3715 10.3729 12.0431 12.0641 13.3376 13.3928 14.2620 14.4296 14.8235 14.8578 14.9831 15.1391 22.8443 22.8542 26.2450 26.2557 k = 0.5000-0.2462 0.4383 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8449 -34.8428 -30.9774 -30.9741 -30.9275 -30.9275 -0.1718 -0.1567 7.7091 7.7178 10.3354 10.3583 10.3681 10.3719 12.0443 12.0703 13.3178 13.3881 14.2077 14.3768 14.8319 14.8509 15.0310 15.2109 22.8608 22.8730 26.2418 26.2552 k = 0.5000-0.2377 0.4443 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8451 -34.8426 -30.9776 -30.9736 -30.9277 -30.9276 -0.1733 -0.1553 7.7202 7.7306 10.3256 10.3509 10.3643 10.3706 12.0462 12.0773 13.2947 13.3808 14.1557 14.3203 14.8380 14.8440 15.0865 15.2830 22.8812 22.8956 26.2382 26.2544 k = 0.5000-0.2292 0.4503 ( 1146 PWs) bands (ev): -64.2232 -64.2232 -34.8453 -34.8424 -30.9777 -30.9730 -30.9279 -30.9278 -0.1749 -0.1539 7.7334 7.7456 10.3143 10.3418 10.3600 10.3690 12.0489 12.0849 13.2679 13.3705 14.1069 14.2635 14.8369 14.8419 15.1465 15.3548 22.9054 22.9219 26.2342 26.2531 k = 0.5000-0.2208 0.4563 ( 1142 PWs) bands (ev): -64.2232 -64.2232 -34.8454 -34.8422 -30.9778 -30.9724 -30.9282 -30.9281 -0.1764 -0.1526 7.7486 7.7627 10.3016 10.3311 10.3554 10.3669 12.0523 12.0932 13.2375 13.3570 14.0617 14.2083 14.8296 14.8439 15.2089 15.4259 22.9334 22.9519 26.2299 26.2515 k = 0.5000-0.2123 0.4623 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8456 -34.8420 -30.9778 -30.9718 -30.9285 -30.9284 -0.1779 -0.1513 7.7658 7.7818 10.2872 10.3186 10.3505 10.3645 12.0564 12.1019 13.2034 13.3400 14.0205 14.1557 14.8219 14.8444 15.2724 15.4960 22.9651 22.9854 26.2252 26.2496 k = 0.5000-0.2038 0.4683 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8458 -34.8418 -30.9778 -30.9712 -30.9289 -30.9287 -0.1794 -0.1501 7.7849 7.8028 10.2713 10.3044 10.3453 10.3617 12.0610 12.1111 13.1660 13.3197 13.9835 14.1068 14.8141 14.8439 15.3359 15.5648 23.0005 23.0223 26.2202 26.2474 k = 0.5000-0.1953 0.4743 ( 1148 PWs) bands (ev): -64.2232 -64.2232 -34.8460 -34.8416 -30.9778 -30.9705 -30.9293 -30.9290 -0.1809 -0.1489 7.8059 7.8258 10.2538 10.2884 10.3399 10.3586 12.0662 12.1207 13.1258 13.2958 13.9507 14.0621 14.8061 14.8425 15.3988 15.6320 23.0393 23.0625 26.2149 26.2449 k = 0.5000-0.1868 0.4803 ( 1148 PWs) bands (ev): -64.2232 -64.2232 -34.8462 -34.8415 -30.9778 -30.9698 -30.9298 -30.9294 -0.1824 -0.1477 7.8286 7.8505 10.2347 10.2707 10.3343 10.3551 12.0719 12.1308 13.0831 13.2685 13.9219 14.0219 14.7979 14.8404 15.4608 15.6975 23.0816 23.1059 26.2094 26.2422 k = 0.5000-0.1783 0.4863 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8464 -34.8413 -30.9777 -30.9691 -30.9303 -30.9297 -0.1838 -0.1466 7.8531 7.8771 10.2141 10.2512 10.3286 10.3514 12.0780 12.1411 13.0386 13.2380 13.8966 13.9864 14.7896 14.8376 15.5214 15.7611 23.1271 23.1523 26.2036 26.2392 k = 0.5000-0.1698 0.4923 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8465 -34.8411 -30.9776 -30.9683 -30.9308 -30.9301 -0.1852 -0.1456 7.8791 7.9053 10.1920 10.2300 10.3229 10.3476 12.0845 12.1516 12.9930 13.2048 13.8748 13.9555 14.7812 14.8343 15.5803 15.8227 23.1757 23.2016 26.1977 26.2361 k = 0.5000-0.1613 0.4983 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8467 -34.8410 -30.9775 -30.9675 -30.9313 -30.9305 -0.1866 -0.1445 7.9066 7.9350 10.1684 10.2071 10.3171 10.3435 12.0914 12.1623 12.9468 13.1691 13.8558 13.9289 14.7727 14.8307 15.6374 15.8819 23.2273 23.2536 26.1916 26.2328 k = 0.5000-0.1528 0.5043 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8469 -34.8408 -30.9774 -30.9667 -30.9319 -30.9309 -0.1879 -0.1435 7.9354 7.9661 10.1434 10.1824 10.3114 10.3394 12.0984 12.1731 12.9006 13.1318 13.8394 13.9063 14.7643 14.8266 15.6924 15.9389 23.2816 23.3080 26.1854 26.2294 k = 0.5000-0.1443 0.5103 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8470 -34.8407 -30.9773 -30.9659 -30.9325 -30.9313 -0.1891 -0.1426 7.9654 7.9986 10.1171 10.1562 10.3056 10.3352 12.1055 12.1839 12.8549 13.0935 13.8252 13.8871 14.7558 14.8222 15.7450 15.9933 23.3383 23.3645 26.1791 26.2259 k = 0.5000-0.1358 0.5163 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8472 -34.8405 -30.9771 -30.9651 -30.9332 -30.9317 -0.1904 -0.1417 7.9965 8.0321 10.0896 10.1284 10.3000 10.3309 12.1126 12.1946 12.8104 13.0547 13.8129 13.8710 14.7475 14.8176 15.7954 16.0451 23.3972 23.4229 26.1729 26.2224 k = 0.5000-0.1274 0.5223 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8473 -34.8404 -30.9769 -30.9642 -30.9338 -30.9322 -0.1915 -0.1409 8.0284 8.0666 10.0611 10.0993 10.2945 10.3267 12.1197 12.2052 12.7674 13.0161 13.8023 13.8577 14.7393 14.8129 15.8432 16.0943 23.4581 23.4828 26.1667 26.2190 k = 0.5000-0.1189 0.5283 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8474 -34.8402 -30.9767 -30.9633 -30.9345 -30.9326 -0.1926 -0.1401 8.0609 8.1018 10.0317 10.0690 10.2892 10.3226 12.1266 12.2156 12.7262 12.9782 13.7930 13.8464 14.7314 14.8081 15.8883 16.1406 23.5203 23.5439 26.1605 26.2155 k = 0.5000-0.1104 0.5343 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8475 -34.8401 -30.9766 -30.9624 -30.9352 -30.9330 -0.1937 -0.1394 8.0938 8.1376 10.0016 10.0377 10.2841 10.3185 12.1333 12.2256 12.6873 12.9415 13.7850 13.8371 14.7237 14.8033 15.9307 16.1841 23.5837 23.6056 26.1545 26.2121 k = 0.5000-0.1019 0.5403 ( 1158 PWs) bands (ev): -64.2233 -64.2233 -34.8476 -34.8400 -30.9764 -30.9615 -30.9360 -30.9334 -0.1947 -0.1387 8.1268 8.1735 9.9711 10.0057 10.2791 10.3145 12.1396 12.2353 12.6509 12.9064 13.7777 13.8291 14.7162 14.7984 15.9703 16.2246 23.6475 23.6676 26.1486 26.2087 k = 0.5000-0.0934 0.5463 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8477 -34.8399 -30.9762 -30.9606 -30.9367 -30.9337 -0.1956 -0.1381 8.1597 8.2093 9.9405 9.9734 10.2746 10.3108 12.1455 12.2446 12.6172 12.8732 13.7716 13.8227 14.7093 14.7938 16.0070 16.2622 23.7115 23.7293 26.1431 26.2055 k = 0.5000-0.0849 0.5523 ( 1158 PWs) bands (ev): -64.2233 -64.2233 -34.8478 -34.8398 -30.9760 -30.9598 -30.9375 -30.9341 -0.1964 -0.1376 8.1920 8.2446 9.9101 9.9409 10.2702 10.3073 12.1508 12.2532 12.5863 12.8421 13.7664 13.8174 14.7026 14.7893 16.0406 16.2965 23.7747 23.7900 26.1377 26.2024 k = 0.5000-0.0764 0.5583 ( 1158 PWs) bands (ev): -64.2233 -64.2233 -34.8479 -34.8397 -30.9758 -30.9589 -30.9382 -30.9345 -0.1972 -0.1370 8.2234 8.2791 9.8804 9.9088 10.2662 10.3040 12.1556 12.2613 12.5585 12.8136 13.7617 13.8130 14.6965 14.7850 16.0712 16.3278 23.8364 23.8489 26.1327 26.1996 k = 0.5000-0.0679 0.5643 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8480 -34.8396 -30.9756 -30.9580 -30.9390 -30.9348 -0.1979 -0.1366 8.2536 8.3124 9.8517 9.8778 10.2626 10.3010 12.1598 12.2687 12.5339 12.7878 13.7578 13.8094 14.6909 14.7810 16.0989 16.3560 23.8958 23.9052 26.1281 26.1969 k = 0.5000-0.0594 0.5703 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8481 -34.8395 -30.9755 -30.9571 -30.9397 -30.9351 -0.1985 -0.1362 8.2819 8.3437 9.8246 9.8481 10.2594 10.2982 12.1633 12.2754 12.5123 12.7646 13.7543 13.8064 14.6858 14.7774 16.1233 16.3809 23.9520 23.9582 26.1240 26.1945 k = 0.5000-0.0509 0.5764 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8481 -34.8395 -30.9753 -30.9563 -30.9405 -30.9353 -0.1991 -0.1358 8.3079 8.3727 9.7995 9.8204 10.2565 10.2958 12.1662 12.2813 12.4938 12.7444 13.7514 13.8040 14.6812 14.7740 16.1445 16.4026 24.0039 24.0069 26.1202 26.1923 k = 0.5000-0.0425 0.5824 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8394 -30.9752 -30.9555 -30.9412 -30.9356 -0.1995 -0.1355 8.3312 8.3988 9.7770 9.7954 10.2540 10.2937 12.1684 12.2864 12.4784 12.7271 13.7491 13.8021 14.6774 14.7712 16.1625 16.4209 24.0503 24.0505 26.1170 26.1904 k = 0.5000-0.0340 0.5884 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8394 -30.9751 -30.9548 -30.9418 -30.9357 -0.1999 -0.1353 8.3512 8.4212 9.7576 9.7738 10.2520 10.2920 12.1701 12.2906 12.4659 12.7129 13.7471 13.8006 14.6742 14.7688 16.1773 16.4360 24.0875 24.0906 26.1144 26.1889 k = 0.5000-0.0255 0.5944 ( 1148 PWs) bands (ev): -64.2232 -64.2232 -34.8482 -34.8393 -30.9750 -30.9542 -30.9424 -30.9359 -0.2002 -0.1351 8.3673 8.4394 9.7419 9.7562 10.2505 10.2907 12.1714 12.2940 12.4565 12.7019 13.7457 13.7996 14.6719 14.7671 16.1889 16.4478 24.1177 24.1232 26.1123 26.1876 k = 0.5000-0.0170 0.6004 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9538 -30.9428 -30.9360 -0.2004 -0.1349 8.3792 8.4529 9.7304 9.7431 10.2494 10.2898 12.1722 12.2965 12.4498 12.6940 13.7448 13.7989 14.6701 14.7658 16.1972 16.4562 24.1399 24.1473 26.1108 26.1867 k = 0.5000-0.0085 0.6064 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9535 -30.9431 -30.9360 -0.2005 -0.1348 8.3865 8.4612 9.7232 9.7350 10.2487 10.2892 12.1726 12.2979 12.4459 12.6892 13.7442 13.7985 14.6690 14.7650 16.2021 16.4613 24.1534 24.1621 26.1099 26.1862 k = 0.5000-0.0000 0.6124 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9533 -30.9432 -30.9361 -0.2006 -0.1348 8.3890 8.4640 9.7208 9.7323 10.2485 10.2890 12.1727 12.2984 12.4445 12.6876 13.7440 13.7984 14.6687 14.7647 16.2038 16.4629 24.1580 24.1670 26.1096 26.1860 k = 0.5000-0.0000 0.6124 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9533 -30.9432 -30.9361 -0.2006 -0.1348 8.3890 8.4640 9.7208 9.7323 10.2485 10.2890 12.1727 12.2984 12.4445 12.6876 13.7440 13.7984 14.6687 14.7647 16.2038 16.4629 24.1580 24.1670 26.1096 26.1860 k = 0.4948 0.0090 0.6124 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9534 -30.9431 -30.9360 -0.2007 -0.1349 8.3880 8.4628 9.7192 9.7329 10.2501 10.2903 12.1667 12.2912 12.4528 12.6920 13.7451 13.7994 14.6689 14.7664 16.2033 16.4624 24.1553 24.1642 26.1042 26.1814 k = 0.4896 0.0180 0.6124 ( 1146 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9536 -30.9429 -30.9359 -0.2009 -0.1354 8.3850 8.4593 9.7155 9.7340 10.2550 10.2939 12.1490 12.2715 12.4749 12.7050 13.7484 13.8024 14.6695 14.7716 16.2015 16.4604 24.1475 24.1562 26.0890 26.1683 k = 0.4844 0.0271 0.6124 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8393 -30.9749 -30.9538 -30.9426 -30.9358 -0.2014 -0.1360 8.3800 8.4534 9.7111 9.7353 10.2627 10.2998 12.1218 12.2436 12.5049 12.7252 13.7533 13.8076 14.6707 14.7804 16.1983 16.4568 24.1350 24.1436 26.0656 26.1480 k = 0.4792 0.0361 0.6124 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8393 -30.9750 -30.9542 -30.9422 -30.9356 -0.2020 -0.1369 8.3732 8.4454 9.7071 9.7369 10.2730 10.3076 12.0879 12.2105 12.5386 12.7508 13.7596 13.8151 14.6732 14.7930 16.1934 16.4513 24.1182 24.1269 26.0359 26.1220 k = 0.4740 0.0451 0.6124 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8481 -34.8392 -30.9751 -30.9545 -30.9418 -30.9353 -0.2027 -0.1380 8.3647 8.4354 9.7042 9.7392 10.2853 10.3169 12.0496 12.1739 12.5735 12.7794 13.7673 13.8251 14.6774 14.8094 16.1867 16.4439 24.0975 24.1068 26.0019 26.0917 k = 0.4688 0.0541 0.6124 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8480 -34.8392 -30.9751 -30.9549 -30.9413 -30.9350 -0.2036 -0.1392 8.3546 8.4235 9.7029 9.7424 10.2991 10.3272 12.0086 12.1350 12.6079 12.8094 13.7759 13.8373 14.6838 14.8294 16.1780 16.4342 24.0732 24.0835 25.9652 26.0584 k = 0.4635 0.0631 0.6124 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8479 -34.8392 -30.9752 -30.9554 -30.9407 -30.9347 -0.2045 -0.1406 8.3431 8.4100 9.7034 9.7468 10.3140 10.3381 11.9660 12.0949 12.6408 12.8391 13.7855 13.8514 14.6929 14.8530 16.1671 16.4221 24.0460 24.0576 25.9272 26.0232 k = 0.4583 0.0722 0.6124 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8478 -34.8392 -30.9753 -30.9558 -30.9402 -30.9343 -0.2054 -0.1420 8.3304 8.3951 9.7059 9.7525 10.3294 10.3491 11.9228 12.0543 12.6714 12.8675 13.7962 13.8670 14.7052 14.8802 16.1539 16.4074 24.0162 24.0293 25.8892 25.9874 k = 0.4531 0.0812 0.6124 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8477 -34.8391 -30.9755 -30.9562 -30.9397 -30.9339 -0.2064 -0.1436 8.3169 8.3792 9.7105 9.7598 10.3451 10.3600 11.8797 12.0138 12.6993 12.8937 13.8077 13.8836 14.7210 14.9109 16.1383 16.3900 23.9845 23.9990 25.8521 25.9519 k = 0.4479 0.0902 0.6124 ( 1152 PWs) bands (ev): -64.2234 -64.2234 -34.8476 -34.8391 -30.9756 -30.9567 -30.9391 -30.9335 -0.2075 -0.1452 8.3027 8.3627 9.7172 9.7685 10.3606 10.3702 11.8372 11.9742 12.7242 12.9173 13.8203 13.9006 14.7407 14.9449 16.1202 16.3698 23.9515 23.9673 25.8166 25.9175 k = 0.4427 0.0992 0.6124 ( 1156 PWs) bands (ev): -64.2234 -64.2234 -34.8475 -34.8391 -30.9757 -30.9571 -30.9386 -30.9331 -0.2085 -0.1468 8.2881 8.3457 9.7258 9.7787 10.3754 10.3796 11.7958 11.9358 12.7460 12.9378 13.8337 13.9176 14.7645 14.9822 16.0996 16.3468 23.9177 23.9346 25.7832 25.8847 k = 0.4375 0.1083 0.6124 ( 1154 PWs) bands (ev): -64.2234 -64.2234 -34.8474 -34.8391 -30.9759 -30.9575 -30.9381 -30.9327 -0.2095 -0.1484 8.2735 8.3286 9.7361 9.7901 10.3877 10.3898 11.7560 11.8991 12.7650 12.9554 13.8478 13.9340 14.7923 15.0226 16.0767 16.3210 23.8838 23.9016 25.7523 25.8540 k = 0.4323 0.1173 0.6124 ( 1158 PWs) bands (ev): -64.2234 -64.2234 -34.8473 -34.8391 -30.9760 -30.9579 -30.9376 -30.9323 -0.2105 -0.1500 8.2590 8.3117 9.7479 9.8025 10.3949 10.4027 11.7180 11.8645 12.7808 12.9698 13.8622 13.9493 14.8241 15.0658 16.0515 16.2923 23.8502 23.8685 25.7241 25.8256 k = 0.4271 0.1263 0.6124 ( 1158 PWs) bands (ev): -64.2235 -64.2235 -34.8472 -34.8391 -30.9762 -30.9582 -30.9371 -30.9319 -0.2115 -0.1516 8.2449 8.2954 9.7608 9.8158 10.4006 10.4145 11.6822 11.8322 12.7941 12.9815 13.8767 13.9633 14.8595 15.1115 16.0242 16.2609 23.8177 23.8360 25.6985 25.7997 k = 0.4219 0.1353 0.6124 ( 1150 PWs) bands (ev): -64.2234 -64.2234 -34.8471 -34.8390 -30.9763 -30.9585 -30.9366 -30.9315 -0.2124 -0.1531 8.2316 8.2799 9.7747 9.8295 10.4048 10.4249 11.6491 11.8025 12.8051 12.9909 13.8912 13.9758 14.8982 15.1591 15.9953 16.2272 23.7867 23.8047 25.6758 25.7765 k = 0.4167 0.1443 0.6124 ( 1151 PWs) bands (ev): -64.2234 -64.2234 -34.8470 -34.8390 -30.9764 -30.9588 -30.9362 -30.9312 -0.2132 -0.1545 8.2190 8.2654 9.7889 9.8433 10.4076 10.4337 11.6188 11.7757 12.8137 12.9978 13.9051 13.9864 14.9392 15.2082 15.9648 16.1909 23.7576 23.7749 25.6558 25.7560 k = 0.4115 0.1534 0.6124 ( 1151 PWs) bands (ev): -64.2235 -64.2235 -34.8469 -34.8390 -30.9765 -30.9591 -30.9358 -30.9309 -0.2140 -0.1557 8.2075 8.2521 9.8032 9.8568 10.4091 10.4410 11.5915 11.7518 12.8205 13.0029 13.9182 13.9953 14.9818 15.2579 15.9335 16.1527 23.7310 23.7472 25.6385 25.7380 k = 0.4062 0.1624 0.6124 ( 1151 PWs) bands (ev): -64.2235 -64.2235 -34.8469 -34.8390 -30.9766 -30.9593 -30.9355 -30.9306 -0.2146 -0.1569 8.1972 8.2402 9.8170 9.8696 10.4096 10.4468 11.5675 11.7311 12.8257 13.0066 13.9303 14.0024 15.0249 15.3073 15.9024 16.1129 23.7073 23.7220 25.6237 25.7226 k = 0.4010 0.1714 0.6124 ( 1146 PWs) bands (ev): -64.2234 -64.2234 -34.8468 -34.8390 -30.9767 -30.9595 -30.9352 -30.9304 -0.2152 -0.1579 8.1883 8.2299 9.8300 9.8813 10.4092 10.4512 11.5470 11.7135 12.8296 13.0091 13.9414 14.0081 15.0672 15.3551 15.8726 16.0723 23.6869 23.6999 25.6113 25.7098 k = 0.3958 0.1804 0.6124 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9768 -30.9597 -30.9350 -30.9302 -0.2157 -0.1587 8.1808 8.2212 9.8415 9.8915 10.4082 10.4544 11.5301 11.6992 12.8324 13.0107 13.9508 14.0122 15.1069 15.3995 15.8459 16.0319 23.6700 23.6809 25.6014 25.6994 k = 0.3906 0.1894 0.6124 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9769 -30.9598 -30.9348 -30.9300 -0.2161 -0.1593 8.1749 8.2144 9.8511 9.8998 10.4070 10.4565 11.5168 11.6880 12.8343 13.0117 13.9585 14.0150 15.1420 15.4383 15.8243 15.9934 23.6568 23.6656 25.5938 25.6913 k = 0.3854 0.1985 0.6124 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9769 -30.9599 -30.9347 -30.9299 -0.2163 -0.1598 8.1706 8.2095 9.8583 9.9060 10.4059 10.4579 11.5073 11.6801 12.8356 13.0122 13.9642 14.0167 15.1700 15.4686 15.8100 15.9595 23.6476 23.6542 25.5883 25.6856 k = 0.3802 0.2075 0.6124 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9346 -30.9298 -0.2165 -0.1601 8.1680 8.2065 9.8629 9.9098 10.4051 10.4586 11.5016 11.6753 12.8363 13.0125 13.9679 14.0176 15.1883 15.4878 15.8034 15.9350 23.6424 23.6470 25.5851 25.6822 k = 0.3750 0.2165 0.6124 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.3750 0.2165 0.6124 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.3698 0.2135 0.6039 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8465 -34.8387 -30.9768 -30.9592 -30.9347 -30.9296 -0.2208 -0.1634 8.1980 8.2373 9.8320 9.8791 10.3789 10.4414 11.4742 11.6643 12.8103 12.9863 14.0217 14.0634 15.1727 15.4734 15.8653 15.9889 23.6861 23.6930 25.4642 25.5613 k = 0.3646 0.2105 0.5954 ( 1150 PWs) bands (ev): -64.2236 -64.2236 -34.8464 -34.8385 -30.9766 -30.9585 -30.9348 -30.9294 -0.2253 -0.1670 8.2286 8.2687 9.7994 9.8468 10.3451 10.4139 11.4611 11.6647 12.7839 12.9597 14.0775 14.1128 15.1473 15.4492 15.9296 16.0528 23.7303 23.7405 25.3389 25.4359 k = 0.3594 0.2075 0.5869 ( 1142 PWs) bands (ev): -64.2236 -64.2236 -34.8462 -34.8382 -30.9764 -30.9578 -30.9348 -30.9290 -0.2302 -0.1711 8.2591 8.2998 9.7668 9.8144 10.3034 10.3759 11.4616 11.6759 12.7581 12.9335 14.1361 14.1659 15.1192 15.4223 15.9946 16.1174 23.7731 23.7866 25.2097 25.3067 k = 0.3542 0.2045 0.5784 ( 1142 PWs) bands (ev): -64.2236 -64.2236 -34.8460 -34.8379 -30.9762 -30.9572 -30.9346 -30.9287 -0.2354 -0.1758 8.2891 8.3304 9.7341 9.7817 10.2541 10.3278 11.4755 11.6975 12.7321 12.9071 14.1968 14.2220 15.0885 15.3928 16.0601 16.1824 23.8138 23.8307 25.0777 25.1750 k = 0.3490 0.2015 0.5698 ( 1142 PWs) bands (ev): -64.2237 -64.2237 -34.8458 -34.8376 -30.9759 -30.9566 -30.9344 -30.9282 -0.2410 -0.1809 8.3186 8.3603 9.7014 9.7490 10.1981 10.2707 11.5019 11.7291 12.7064 12.8809 14.2593 14.2806 15.0555 15.3614 16.1260 16.2477 23.8519 23.8722 24.9444 25.0423 k = 0.3438 0.1985 0.5613 ( 1141 PWs) bands (ev): -64.2237 -64.2237 -34.8456 -34.8373 -30.9757 -30.9561 -30.9341 -30.9277 -0.2470 -0.1866 8.3476 8.3896 9.6688 9.7162 10.1363 10.2061 11.5395 11.7701 12.6809 12.8550 14.3230 14.3414 15.0209 15.3285 16.1920 16.3132 23.8861 23.9098 24.8116 24.9102 k = 0.3385 0.1955 0.5528 ( 1141 PWs) bands (ev): -64.2238 -64.2238 -34.8453 -34.8370 -30.9753 -30.9557 -30.9337 -30.9272 -0.2534 -0.1928 8.3760 8.4182 9.6362 9.6833 10.0698 10.1356 11.5870 11.8196 12.6557 12.8293 14.3875 14.4037 14.9850 15.2946 16.2582 16.3787 23.9146 23.9414 24.6820 24.7811 k = 0.3333 0.1925 0.5443 ( 1141 PWs) bands (ev): -64.2239 -64.2239 -34.8450 -34.8367 -30.9750 -30.9553 -30.9331 -30.9266 -0.2603 -0.1997 8.4038 8.4460 9.6038 9.6504 9.9996 10.0606 11.6428 11.8766 12.6310 12.8042 14.4520 14.4669 14.9487 15.2606 16.3243 16.4443 23.9338 23.9623 24.5604 24.6590 k = 0.3281 0.1894 0.5358 ( 1141 PWs) bands (ev): -64.2240 -64.2240 -34.8446 -34.8363 -30.9746 -30.9549 -30.9325 -30.9260 -0.2677 -0.2071 8.4309 8.4729 9.5716 9.6174 9.9266 9.9824 11.7056 11.9401 12.6067 12.7796 14.5158 14.5297 14.9133 15.2273 16.3904 16.5098 23.9374 23.9636 24.4562 24.5505 k = 0.3229 0.1864 0.5273 ( 1141 PWs) bands (ev): -64.2241 -64.2241 -34.8442 -34.8360 -30.9742 -30.9545 -30.9317 -30.9253 -0.2755 -0.2151 8.4572 8.4990 9.5396 9.5844 9.8519 9.9020 11.7743 12.0093 12.5831 12.7557 14.5777 14.5899 14.8814 15.1962 16.4563 16.5751 23.9156 23.9313 24.3836 24.4658 k = 0.3177 0.1834 0.5188 ( 1141 PWs) bands (ev): -64.2242 -64.2242 -34.8438 -34.8356 -30.9737 -30.9542 -30.9309 -30.9246 -0.2839 -0.2238 8.4828 8.5242 9.5078 9.5511 9.7762 9.8203 11.8478 12.0829 12.5604 12.7327 14.6359 14.6418 14.8588 15.1692 16.5220 16.6401 23.8569 23.8595 24.3516 24.4140 k = 0.3125 0.1804 0.5103 ( 1141 PWs) bands (ev): -64.2243 -64.2243 -34.8433 -34.8352 -30.9731 -30.9539 -30.9300 -30.9238 -0.2927 -0.2331 8.5075 8.5484 9.4763 9.5174 9.7004 9.7380 11.9248 12.1598 12.5391 12.7110 14.6727 14.6877 14.8585 15.1494 16.5873 16.7048 23.7486 23.7692 24.3521 24.3953 k = 0.3073 0.1774 0.5018 ( 1147 PWs) bands (ev): -64.2244 -64.2244 -34.8428 -34.8347 -30.9726 -30.9536 -30.9290 -30.9230 -0.3022 -0.2431 8.5313 8.5717 9.4451 9.4826 9.6258 9.6557 12.0041 12.2378 12.5202 12.6907 14.6727 14.7293 14.8908 15.1408 16.6521 16.7690 23.6205 23.6541 24.3713 24.4006 k = 0.3021 0.1744 0.4933 ( 1145 PWs) bands (ev): -64.2245 -64.2245 -34.8423 -34.8343 -30.9719 -30.9533 -30.9280 -30.9221 -0.3121 -0.2538 8.5543 8.5940 9.4142 9.4455 9.5541 9.5739 12.0846 12.3136 12.5067 12.6727 14.6528 14.7569 14.9457 15.1481 16.7165 16.8327 23.4817 23.5238 24.4005 24.4208 k = 0.2969 0.1714 0.4848 ( 1145 PWs) bands (ev): -64.2246 -64.2246 -34.8417 -34.8338 -30.9712 -30.9529 -30.9269 -30.9213 -0.3226 -0.2651 8.5761 8.6151 9.3835 9.4029 9.4889 9.4929 12.1644 12.3754 12.5091 12.6579 14.6260 14.7688 15.0105 15.1732 16.7803 16.8958 23.3367 23.3842 24.4352 24.4498 k = 0.2917 0.1684 0.4763 ( 1141 PWs) bands (ev): -64.2247 -64.2247 -34.8411 -34.8333 -30.9704 -30.9525 -30.9258 -30.9203 -0.3338 -0.2771 8.5970 8.6352 9.3505 9.3532 9.4134 9.4350 12.2407 12.4013 12.5485 12.6483 14.5987 14.7678 15.0797 15.2141 16.8436 16.9584 23.1880 23.2389 24.4733 24.4845 k = 0.2865 0.1654 0.4678 ( 1151 PWs) bands (ev): -64.2249 -64.2249 -34.8404 -34.8328 -30.9695 -30.9521 -30.9246 -30.9194 -0.3455 -0.2899 8.6165 8.6540 9.2885 9.3212 9.3372 9.3921 12.3094 12.3977 12.6167 12.6465 14.5739 14.7585 15.1509 15.2663 16.9060 17.0200 23.0369 23.0900 24.5137 24.5230 k = 0.2812 0.1624 0.4593 ( 1151 PWs) bands (ev): -64.2250 -64.2250 -34.8397 -34.8323 -30.9686 -30.9517 -30.9235 -30.9185 -0.3578 -0.3033 8.6348 8.6716 9.2223 9.2571 9.2954 9.3558 12.3648 12.3849 12.6580 12.6925 14.5540 14.7462 15.2236 15.3263 16.9678 17.0810 22.8841 22.9387 24.5559 24.5645 k = 0.2760 0.1594 0.4508 ( 1147 PWs) bands (ev): -64.2252 -64.2252 -34.8390 -34.8317 -30.9676 -30.9511 -30.9222 -30.9175 -0.3707 -0.3175 8.6515 8.6878 9.1555 9.1832 9.2660 9.3226 12.3697 12.4013 12.6869 12.7677 14.5410 14.7347 15.2971 15.3910 17.0287 17.1412 22.7302 22.7856 24.5997 24.6084 k = 0.2708 0.1564 0.4423 ( 1147 PWs) bands (ev): -64.2253 -64.2253 -34.8382 -34.8311 -30.9665 -30.9506 -30.9210 -30.9165 -0.3843 -0.3323 8.6665 8.7024 9.0901 9.1114 9.2373 9.2910 12.3540 12.4188 12.7321 12.8383 14.5366 14.7266 15.3708 15.4587 17.0888 17.2005 22.5755 22.6314 24.6448 24.6543 k = 0.2656 0.1534 0.4338 ( 1147 PWs) bands (ev): -64.2255 -64.2255 -34.8374 -34.8305 -30.9654 -30.9499 -30.9197 -30.9155 -0.3985 -0.3479 8.6791 8.7152 9.0272 9.0422 9.2091 9.2604 12.3386 12.4231 12.7865 12.9021 14.5426 14.7243 15.4447 15.5281 17.1479 17.2588 22.4203 22.4763 24.6913 24.7022 k = 0.2604 0.1504 0.4253 ( 1155 PWs) bands (ev): -64.2257 -64.2257 -34.8366 -34.8299 -30.9641 -30.9492 -30.9185 -30.9145 -0.4134 -0.3642 8.6884 8.7255 8.9681 8.9764 9.1814 9.2304 12.3238 12.4198 12.8430 12.9570 14.5604 14.7297 15.5184 15.5986 17.2061 17.3160 22.2648 22.3206 24.7390 24.7519 k = 0.2552 0.1473 0.4168 ( 1159 PWs) bands (ev): -64.2259 -64.2259 -34.8358 -34.8292 -30.9628 -30.9485 -30.9173 -30.9135 -0.4288 -0.3812 8.6930 8.7322 8.9146 8.9152 9.1543 9.2011 12.3098 12.4127 12.8969 13.0018 14.5917 14.7446 15.5920 15.6696 17.2631 17.3722 22.1091 22.1647 24.7881 24.8035 k = 0.2500 0.1443 0.4082 ( 1159 PWs) bands (ev): -64.2261 -64.2261 -34.8349 -34.8285 -30.9614 -30.9476 -30.9160 -30.9124 -0.4449 -0.3988 8.6899 8.7322 8.8619 8.8700 9.1276 9.1722 12.2968 12.4039 12.9449 13.0357 14.6369 14.7703 15.6653 15.7410 17.3191 17.4272 21.9535 22.0087 24.8386 24.8569 k = 0.2448 0.1413 0.3997 ( 1147 PWs) bands (ev): -64.2262 -64.2262 -34.8339 -34.8278 -30.9599 -30.9467 -30.9147 -30.9114 -0.4617 -0.4172 8.6750 8.7182 8.8239 8.8384 9.1017 9.1439 12.2852 12.3947 12.9853 13.0588 14.6961 14.8077 15.7385 15.8126 17.3741 17.4812 21.7981 21.8527 24.8907 24.9123 k = 0.2396 0.1383 0.3912 ( 1147 PWs) bands (ev): -64.2264 -64.2264 -34.8330 -34.8270 -30.9584 -30.9457 -30.9135 -30.9103 -0.4790 -0.4362 8.6471 8.6847 8.8062 8.8208 9.0762 9.1159 12.2744 12.3853 13.0169 13.0713 14.7682 14.8570 15.8110 15.8839 17.4278 17.5339 21.6429 21.6969 24.9442 24.9694 k = 0.2344 0.1353 0.3827 ( 1147 PWs) bands (ev): -64.2265 -64.2265 -34.8320 -34.8263 -30.9568 -30.9447 -30.9122 -30.9093 -0.4970 -0.4558 8.6101 8.6401 8.8007 8.8134 9.0514 9.0883 12.2648 12.3763 13.0397 13.0745 14.8521 14.9180 15.8829 15.9548 17.4802 17.5854 21.4882 21.5415 24.9992 25.0285 k = 0.2292 0.1323 0.3742 ( 1147 PWs) bands (ev): -64.2267 -64.2267 -34.8310 -34.8255 -30.9551 -30.9435 -30.9110 -30.9082 -0.5156 -0.4761 8.5691 8.5926 8.7991 8.8112 9.0274 9.0611 12.2565 12.3680 13.0539 13.0699 14.9463 14.9902 15.9543 16.0253 17.5314 17.6355 21.3340 21.3865 25.0559 25.0895 k = 0.2240 0.1293 0.3657 ( 1151 PWs) bands (ev): -64.2270 -64.2270 -34.8300 -34.8247 -30.9534 -30.9423 -30.9098 -30.9072 -0.5347 -0.4970 8.5273 8.5457 8.7978 8.8110 9.0041 9.0343 12.2493 12.3605 13.0590 13.0604 15.0492 15.0725 16.0248 16.0951 17.5812 17.6842 21.1805 21.2321 25.1143 25.1525 k = 0.2188 0.1263 0.3572 ( 1151 PWs) bands (ev): -64.2272 -64.2272 -34.8289 -34.8239 -30.9515 -30.9411 -30.9085 -30.9061 -0.5545 -0.5185 8.4863 8.5005 8.7955 8.8112 8.9818 9.0079 12.2435 12.3540 13.0430 13.0602 15.1593 15.1639 16.0947 16.1643 17.6297 17.7315 21.0278 21.0785 25.1745 25.2175 k = 0.2135 0.1233 0.3487 ( 1155 PWs) bands (ev): -64.2274 -64.2274 -34.8279 -34.8231 -30.9497 -30.9397 -30.9073 -30.9051 -0.5747 -0.5406 8.4470 8.4577 8.7917 8.8108 8.9605 8.9819 12.2390 12.3485 13.0234 13.0543 15.2628 15.2750 16.1636 16.2327 17.6768 17.7774 20.8760 20.9258 25.2365 25.2847 k = 0.2083 0.1203 0.3402 ( 1155 PWs) bands (ev): -64.2276 -64.2276 -34.8268 -34.8222 -30.9477 -30.9383 -30.9062 -30.9041 -0.5955 -0.5631 8.4098 8.4175 8.7859 8.8095 8.9402 8.9564 12.2358 12.3442 13.0011 13.0439 15.3681 15.3952 16.2317 16.3003 17.7225 17.8219 20.7254 20.7742 25.3005 25.3539 k = 0.2031 0.1173 0.3317 ( 1155 PWs) bands (ev): -64.2279 -64.2279 -34.8257 -34.8213 -30.9457 -30.9369 -30.9050 -30.9031 -0.6168 -0.5861 8.3749 8.3800 8.7780 8.8068 8.9212 8.9315 12.2340 12.3410 12.9771 13.0299 15.4786 15.5188 16.2988 16.3669 17.7667 17.8648 20.5761 20.6238 25.3666 25.4254 k = 0.1979 0.1143 0.3232 ( 1155 PWs) bands (ev): -64.2281 -64.2281 -34.8245 -34.8204 -30.9437 -30.9353 -30.9038 -30.9021 -0.6385 -0.6096 8.3426 8.3454 8.7679 8.8025 8.9032 8.9073 12.2334 12.3389 12.9521 13.0133 15.5932 15.6449 16.3648 16.4326 17.8093 17.9062 20.4282 20.4748 25.4348 25.4992 k = 0.1927 0.1113 0.3147 ( 1155 PWs) bands (ev): -64.2283 -64.2283 -34.8234 -34.8195 -30.9416 -30.9337 -30.9027 -30.9011 -0.6606 -0.6334 8.3129 8.3135 8.7558 8.7965 8.8838 8.8862 12.2341 12.3381 12.9266 12.9948 15.7107 15.7724 16.4297 16.4971 17.8505 17.9460 20.2819 20.3273 25.5053 25.5752 k = 0.1875 0.1083 0.3062 ( 1155 PWs) bands (ev): -64.2285 -64.2285 -34.8223 -34.8186 -30.9394 -30.9321 -30.9016 -30.9001 -0.6831 -0.6577 8.2844 8.2857 8.7418 8.7884 8.8614 8.8700 12.2362 12.3385 12.9013 12.9752 15.8303 15.9008 16.4934 16.5603 17.8902 17.9843 20.1374 20.1816 25.5781 25.6537 k = 0.1823 0.1052 0.2977 ( 1157 PWs) bands (ev): -64.2288 -64.2288 -34.8211 -34.8177 -30.9372 -30.9304 -30.9005 -30.8991 -0.7060 -0.6822 8.2581 8.2612 8.7264 8.7779 8.8402 8.8543 12.2396 12.3401 12.8764 12.9548 15.9512 16.0292 16.5557 16.6222 17.9283 18.0210 19.9950 20.0379 25.6535 25.7347 k = 0.1771 0.1022 0.2892 ( 1153 PWs) bands (ev): -64.2290 -64.2290 -34.8199 -34.8168 -30.9350 -30.9286 -30.8995 -30.8982 -0.7291 -0.7069 8.2346 8.2394 8.7097 8.7649 8.8206 8.8388 12.2442 12.3429 12.8522 12.9342 16.0729 16.1574 16.6167 16.6826 17.9648 18.0560 19.8548 19.8963 25.7315 25.8182 k = 0.1719 0.0992 0.2807 ( 1153 PWs) bands (ev): -64.2292 -64.2292 -34.8188 -34.8158 -30.9328 -30.9268 -30.8984 -30.8973 -0.7525 -0.7319 8.2138 8.2200 8.6922 8.7495 8.8025 8.8232 12.2501 12.3467 12.8291 12.9138 16.1944 16.2844 16.6762 16.7414 17.9997 18.0894 19.7172 19.7572 25.8122 25.9045 k = 0.1667 0.0962 0.2722 ( 1147 PWs) bands (ev): -64.2294 -64.2294 -34.8176 -34.8149 -30.9305 -30.9250 -30.8974 -30.8964 -0.7761 -0.7570 8.1958 8.2033 8.6741 8.7319 8.7856 8.8074 12.2571 12.3517 12.8072 12.8938 16.3155 16.4099 16.7342 16.7984 18.0329 18.1212 19.5826 19.6209 25.8959 25.9935 k = 0.1615 0.0932 0.2637 ( 1147 PWs) bands (ev): -64.2297 -64.2297 -34.8165 -34.8139 -30.9282 -30.9231 -30.8964 -30.8955 -0.7998 -0.7822 8.1803 8.1890 8.6556 8.7129 8.7693 8.7911 12.2652 12.3578 12.7865 12.8743 16.4353 16.5331 16.7905 16.8532 18.0645 18.1513 19.4510 19.4876 25.9825 26.0853 k = 0.1562 0.0902 0.2552 ( 1149 PWs) bands (ev): -64.2299 -64.2299 -34.8153 -34.8130 -30.9259 -30.9212 -30.8955 -30.8946 -0.8236 -0.8075 8.1673 8.1772 8.6369 8.6930 8.7532 8.7744 12.2743 12.3647 12.7671 12.8556 16.5536 16.6531 16.8455 16.9057 18.0945 18.1797 19.3232 19.3577 26.0723 26.1802 k = 0.1510 0.0872 0.2467 ( 1157 PWs) bands (ev): -64.2302 -64.2302 -34.8142 -34.8120 -30.9236 -30.9193 -30.8946 -30.8938 -0.8475 -0.8327 8.1567 8.1675 8.6182 8.6726 8.7367 8.7571 12.2845 12.3726 12.7491 12.8377 16.6696 16.7680 16.9002 16.9553 18.1226 18.2064 19.1994 19.2316 26.1653 26.2781 k = 0.1458 0.0842 0.2381 ( 1157 PWs) bands (ev): -64.2304 -64.2304 -34.8131 -34.8111 -30.9213 -30.9174 -30.8937 -30.8930 -0.8713 -0.8578 8.1485 8.1602 8.5995 8.6522 8.7199 8.7393 12.2956 12.3815 12.7327 12.8209 16.7834 16.8724 16.9597 17.0020 18.1491 18.2316 19.0804 19.1099 26.2617 26.3792 k = 0.1406 0.0812 0.2296 ( 1157 PWs) bands (ev): -64.2306 -64.2306 -34.8119 -34.8101 -30.9190 -30.9155 -30.8928 -30.8922 -0.8950 -0.8827 8.1426 8.1550 8.5810 8.6319 8.7027 8.7210 12.3077 12.3912 12.7176 12.8052 16.8942 16.9512 17.0384 17.0451 18.1739 18.2551 18.9668 18.9932 26.3615 26.4835 k = 0.1354 0.0782 0.2211 ( 1157 PWs) bands (ev): -64.2309 -64.2309 -34.8108 -34.8092 -30.9167 -30.9136 -30.8920 -30.8914 -0.9185 -0.9075 8.1388 8.1519 8.5628 8.6118 8.6849 8.7023 12.3206 12.4017 12.7040 12.7904 17.0013 17.0035 17.0847 17.1360 18.1968 18.2770 18.8595 18.8821 26.4648 26.5910 k = 0.1302 0.0752 0.2126 ( 1159 PWs) bands (ev): -64.2311 -64.2311 -34.8097 -34.8083 -30.9145 -30.9116 -30.8912 -30.8907 -0.9418 -0.9319 8.1370 8.1506 8.5448 8.5921 8.6667 8.6832 12.3342 12.4128 12.6918 12.7767 17.0431 17.0968 17.1274 17.2378 18.2178 18.2974 18.7596 18.7774 26.5717 26.7019 k = 0.1250 0.0722 0.2041 ( 1159 PWs) bands (ev): -64.2313 -64.2313 -34.8087 -34.8074 -30.9123 -30.9097 -30.8904 -30.8899 -0.9649 -0.9561 8.1371 8.1511 8.5273 8.5727 8.6482 8.6639 12.3485 12.4246 12.6809 12.7641 17.0748 17.1391 17.2137 17.3382 18.2364 18.3162 18.6683 18.6800 26.6821 26.8160 k = 0.1198 0.0692 0.1956 ( 1159 PWs) bands (ev): -64.2315 -64.2315 -34.8076 -34.8065 -30.9101 -30.9078 -30.8896 -30.8893 -0.9876 -0.9798 8.1390 8.1533 8.5101 8.5537 8.6295 8.6443 12.3633 12.4369 12.6714 12.7525 17.0991 17.1608 17.3099 17.4355 18.2525 18.3334 18.5871 18.5908 26.7960 26.9334 k = 0.1146 0.0662 0.1871 ( 1161 PWs) bands (ev): -64.2317 -64.2317 -34.8066 -34.8056 -30.9079 -30.9059 -30.8889 -30.8886 -1.0099 -1.0030 8.1424 8.1570 8.4933 8.5352 8.6106 8.6248 12.3787 12.4496 12.6630 12.7418 17.1156 17.1732 17.4032 17.5288 18.2650 18.3492 18.5111 18.5183 26.9133 27.0538 k = 0.1094 0.0631 0.1786 ( 1161 PWs) bands (ev): -64.2320 -64.2320 -34.8056 -34.8047 -30.9058 -30.9040 -30.8882 -30.8879 -1.0318 -1.0257 8.1474 8.1620 8.4771 8.5172 8.5918 8.6052 12.3944 12.4626 12.6558 12.7321 17.1237 17.1764 17.4928 17.6181 18.2726 18.3636 18.4417 18.4641 27.0339 27.1773 k = 0.1042 0.0601 0.1701 ( 1165 PWs) bands (ev): -64.2322 -64.2322 -34.8047 -34.8039 -30.9038 -30.9022 -30.8876 -30.8873 -1.0531 -1.0478 8.1536 8.1682 8.4613 8.4996 8.5731 8.5859 12.4103 12.4758 12.6496 12.7233 17.1227 17.1698 17.5783 17.7029 18.2734 18.3764 18.3837 18.4272 27.1576 27.3035 k = 0.0990 0.0571 0.1616 ( 1165 PWs) bands (ev): -64.2324 -64.2324 -34.8037 -34.8031 -30.9017 -30.9004 -30.8870 -30.8868 -1.0738 -1.0692 8.1610 8.1755 8.4461 8.4826 8.5546 8.5668 12.4265 12.4892 12.6445 12.7153 17.1123 17.1534 17.6596 17.7832 18.2675 18.3369 18.3884 18.4078 27.2842 27.4321 k = 0.0938 0.0541 0.1531 ( 1165 PWs) bands (ev): -64.2326 -64.2326 -34.8029 -34.8023 -30.8998 -30.8987 -30.8864 -30.8862 -1.0939 -1.0900 8.1694 8.1837 8.4314 8.4662 8.5366 8.5482 12.4428 12.5026 12.6402 12.7081 17.0928 17.1277 17.7367 17.8588 18.2587 18.3020 18.3989 18.4020 27.4132 27.5628 k = 0.0885 0.0511 0.1446 ( 1165 PWs) bands (ev): -64.2327 -64.2327 -34.8020 -34.8015 -30.8979 -30.8970 -30.8858 -30.8857 -1.1132 -1.1099 8.1785 8.1926 8.4174 8.4504 8.5191 8.5301 12.4591 12.5160 12.6368 12.7015 17.0649 17.0937 17.8093 17.9296 18.2516 18.2780 18.4039 18.4084 27.5444 27.6952 k = 0.0833 0.0481 0.1361 ( 1163 PWs) bands (ev): -64.2329 -64.2329 -34.8012 -34.8007 -30.8961 -30.8953 -30.8853 -30.8852 -1.1318 -1.1290 8.1883 8.2020 8.4039 8.4351 8.5022 8.5126 12.4753 12.5292 12.6343 12.6957 17.0298 17.0531 17.8776 17.9955 18.2488 18.2637 18.4096 18.4167 27.6771 27.8285 k = 0.0781 0.0451 0.1276 ( 1169 PWs) bands (ev): -64.2331 -64.2331 -34.8004 -34.8001 -30.8944 -30.8938 -30.8848 -30.8847 -1.1496 -1.1473 8.1985 8.2117 8.3911 8.4204 8.4861 8.4958 12.4911 12.5420 12.6322 12.6903 16.9892 17.0076 17.9413 18.0563 18.2509 18.2579 18.4169 18.4242 27.8108 27.9620 k = 0.0729 0.0421 0.1191 ( 1169 PWs) bands (ev): -64.2332 -64.2332 -34.7997 -34.7994 -30.8928 -30.8923 -30.8843 -30.8843 -1.1665 -1.1646 8.2090 8.2216 8.3790 8.4064 8.4710 8.4800 12.5067 12.5545 12.6308 12.6854 16.9446 16.9589 18.0008 18.1120 18.2571 18.2590 18.4251 18.4309 27.9448 28.0950 k = 0.0677 0.0391 0.1106 ( 1169 PWs) bands (ev): -64.2334 -64.2334 -34.7990 -34.7987 -30.8913 -30.8908 -30.8839 -30.8838 -1.1825 -1.1810 8.2195 8.2315 8.3675 8.3929 8.4569 8.4651 12.5219 12.5666 12.6300 12.6810 16.8977 16.9086 18.0559 18.1625 18.2657 18.2665 18.4336 18.4370 28.0781 28.2260 k = 0.0625 0.0361 0.1021 ( 1177 PWs) bands (ev): -64.2336 -64.2336 -34.7983 -34.7982 -30.8899 -30.8895 -30.8835 -30.8835 -1.1975 -1.1963 8.2299 8.2411 8.3567 8.3801 8.4439 8.4513 12.5362 12.5778 12.6296 12.6770 16.8500 16.8581 18.1066 18.2070 18.2768 18.2779 18.4422 18.4427 28.2096 28.3537 k = 0.0573 0.0331 0.0936 ( 1177 PWs) bands (ev): -64.2337 -64.2337 -34.7977 -34.7976 -30.8885 -30.8882 -30.8832 -30.8831 -1.2114 -1.2105 8.2400 8.2504 8.3466 8.3680 8.4322 8.4387 12.5503 12.5886 12.6297 12.6733 16.8026 16.8086 18.1530 18.2451 18.2907 18.2919 18.4483 18.4508 28.3380 28.4762 k = 0.0521 0.0301 0.0851 ( 1179 PWs) bands (ev): -64.2338 -64.2338 -34.7972 -34.7971 -30.8873 -30.8871 -30.8828 -30.8828 -1.2244 -1.2237 8.2496 8.2590 8.3373 8.3566 8.4218 8.4273 12.5635 12.5985 12.6300 12.6699 16.7566 16.7609 18.1951 18.2755 18.3039 18.3108 18.4541 18.4595 28.4616 28.5911 k = 0.0469 0.0271 0.0765 ( 1183 PWs) bands (ev): -64.2340 -64.2340 -34.7967 -34.7966 -30.8862 -30.8860 -30.8825 -30.8825 -1.2362 -1.2357 8.2584 8.2669 8.3288 8.3460 8.4127 8.4173 12.5761 12.6077 12.6307 12.6667 16.7129 16.7160 18.2329 18.2986 18.3168 18.3320 18.4606 18.4680 28.5784 28.6953 k = 0.0417 0.0241 0.0680 ( 1179 PWs) bands (ev): -64.2340 -64.2340 -34.7962 -34.7962 -30.8851 -30.8850 -30.8822 -30.8822 -1.2468 -1.2465 8.2664 8.2739 8.3211 8.3362 8.4051 8.4088 12.5879 12.6162 12.6317 12.6638 16.6723 16.6743 18.2665 18.3173 18.3293 18.3520 18.4681 18.4765 28.6860 28.7859 k = 0.0365 0.0210 0.0595 ( 1179 PWs) bands (ev): -64.2341 -64.2341 -34.7958 -34.7958 -30.8842 -30.8842 -30.8820 -30.8820 -1.2563 -1.2561 8.2734 8.2798 8.3143 8.3274 8.3990 8.4017 12.5986 12.6235 12.6330 12.6611 16.6353 16.6366 18.2958 18.3335 18.3409 18.3681 18.4767 18.4848 28.7814 28.8600 k = 0.0312 0.0180 0.0510 ( 1179 PWs) bands (ev): -64.2342 -64.2342 -34.7955 -34.7955 -30.8834 -30.8834 -30.8818 -30.8818 -1.2646 -1.2645 8.2793 8.2846 8.3084 8.3194 8.3942 8.3961 12.6083 12.6297 12.6343 12.6585 16.6023 16.6031 18.3210 18.3479 18.3513 18.3798 18.4860 18.4928 28.8617 28.9171 k = 0.0260 0.0150 0.0425 ( 1173 PWs) bands (ev): -64.2342 -64.2342 -34.7952 -34.7952 -30.8828 -30.8827 -30.8816 -30.8816 -1.2717 -1.2716 8.2841 8.2883 8.3034 8.3125 8.3906 8.3918 12.6170 12.6350 12.6359 12.6561 16.5738 16.5743 18.3421 18.3606 18.3607 18.3874 18.4955 18.5003 28.9249 28.9590 k = 0.0208 0.0120 0.0340 ( 1161 PWs) bands (ev): -64.2342 -64.2342 -34.7949 -34.7949 -30.8822 -30.8822 -30.8814 -30.8814 -1.2775 -1.2775 8.2878 8.2910 8.2996 8.3068 8.3883 8.3890 12.6246 12.6378 12.6391 12.6538 16.5501 16.5503 18.3592 18.3690 18.3713 18.3920 18.5044 18.5072 28.9708 28.9885 k = 0.0156 0.0090 0.0255 ( 1161 PWs) bands (ev): -64.2342 -64.2342 -34.7947 -34.7947 -30.8818 -30.8818 -30.8813 -30.8813 -1.2821 -1.2820 8.2905 8.2927 8.2966 8.3019 8.3867 8.3870 12.6309 12.6395 12.6419 12.6514 16.5314 16.5315 18.3723 18.3760 18.3798 18.3940 18.5116 18.5129 29.0011 29.0084 k = 0.0104 0.0060 0.0170 ( 1153 PWs) bands (ev): -64.2342 -64.2342 -34.7946 -34.7946 -30.8814 -30.8814 -30.8812 -30.8812 -1.2853 -1.2853 8.2924 8.2938 8.2948 8.2983 8.3858 8.3859 12.6363 12.6412 12.6437 12.6492 16.5179 16.5179 18.3813 18.3824 18.3860 18.3942 18.5170 18.5174 29.0192 29.0214 k = 0.0052 0.0030 0.0085 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7945 -34.7945 -30.8812 -30.8812 -30.8811 -30.8811 -1.2873 -1.2873 8.2936 8.2942 8.2944 8.2958 8.3854 8.3854 12.6406 12.6429 12.6444 12.6468 16.5098 16.5098 18.3866 18.3880 18.3897 18.3930 18.5203 18.5204 29.0286 29.0288 k = 0.0000 0.0000 0.0000 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7944 -34.7944 -30.8811 -30.8811 -30.8811 -30.8811 -1.2879 -1.2879 8.2943 8.2943 8.2943 8.2943 8.3852 8.3852 12.6440 12.6440 12.6440 12.6440 16.5071 16.5071 18.3904 18.3904 18.3904 18.3904 18.5214 18.5214 29.0313 29.0313 k = 0.0000 0.0000 0.0000 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7944 -34.7944 -30.8811 -30.8811 -30.8811 -30.8811 -1.2879 -1.2879 8.2943 8.2943 8.2943 8.2943 8.3852 8.3852 12.6440 12.6440 12.6440 12.6440 16.5071 16.5071 18.3904 18.3904 18.3904 18.3904 18.5214 18.5214 29.0313 29.0313 k = 0.0085 0.0049 0.0035 ( 1139 PWs) bands (ev): -64.2342 -64.2342 -34.7945 -34.7945 -30.8812 -30.8812 -30.8811 -30.8811 -1.2873 -1.2873 8.2939 8.2941 8.2941 8.2958 8.3854 8.3854 12.6406 12.6436 12.6436 12.6468 16.5098 16.5098 18.3866 18.3888 18.3888 18.3932 18.5204 18.5204 29.0287 29.0287 k = 0.0169 0.0098 0.0069 ( 1157 PWs) bands (ev): -64.2342 -64.2342 -34.7946 -34.7946 -30.8814 -30.8814 -30.8812 -30.8812 -1.2853 -1.2853 8.2933 8.2933 8.2943 8.2982 8.3858 8.3858 12.6365 12.6423 12.6423 12.6489 16.5178 16.5178 18.3816 18.3837 18.3837 18.3948 18.5172 18.5172 29.0201 29.0201 k = 0.0254 0.0147 0.0104 ( 1157 PWs) bands (ev): -64.2342 -64.2342 -34.7947 -34.7947 -30.8818 -30.8818 -30.8813 -30.8813 -1.2821 -1.2821 8.2922 8.2922 8.2958 8.3018 8.3868 8.3868 12.6321 12.6406 12.6406 12.6508 16.5313 16.5313 18.3755 18.3755 18.3759 18.3955 18.5124 18.5124 29.0036 29.0036 k = 0.0339 0.0196 0.0138 ( 1157 PWs) bands (ev): -64.2342 -64.2342 -34.7949 -34.7949 -30.8822 -30.8822 -30.8814 -30.8814 -1.2776 -1.2776 8.2905 8.2905 8.2984 8.3063 8.3884 8.3884 12.6272 12.6382 12.6382 12.6521 16.5498 16.5498 18.3639 18.3639 18.3691 18.3953 18.5060 18.5060 28.9752 28.9752 k = 0.0424 0.0245 0.0173 ( 1164 PWs) bands (ev): -64.2342 -64.2342 -34.7951 -34.7951 -30.8828 -30.8828 -30.8815 -30.8815 -1.2718 -1.2718 8.2878 8.2878 8.3019 8.3118 8.3908 8.3908 12.6219 12.6351 12.6351 12.6528 16.5733 16.5733 18.3486 18.3486 18.3613 18.3939 18.4983 18.4983 28.9298 28.9298 k = 0.0508 0.0294 0.0208 ( 1167 PWs) bands (ev): -64.2341 -64.2341 -34.7954 -34.7954 -30.8835 -30.8835 -30.8817 -30.8817 -1.2647 -1.2647 8.2844 8.2844 8.3065 8.3183 8.3943 8.3943 12.6161 12.6314 12.6314 12.6531 16.6015 16.6015 18.3298 18.3298 18.3526 18.3914 18.4895 18.4895 28.8633 28.8633 k = 0.0593 0.0342 0.0242 ( 1167 PWs) bands (ev): -64.2340 -64.2340 -34.7958 -34.7958 -30.8843 -30.8843 -30.8818 -30.8818 -1.2565 -1.2565 8.2801 8.2801 8.3120 8.3258 8.3988 8.3988 12.6101 12.6272 12.6272 12.6531 16.6340 16.6340 18.3076 18.3076 18.3427 18.3878 18.4797 18.4797 28.7744 28.7744 k = 0.0678 0.0391 0.0277 ( 1179 PWs) bands (ev): -64.2340 -64.2340 -34.7962 -34.7962 -30.8852 -30.8852 -30.8821 -30.8821 -1.2470 -1.2470 8.2748 8.2748 8.3183 8.3340 8.4045 8.4045 12.6037 12.6224 12.6224 12.6526 16.6703 16.6703 18.2821 18.2821 18.3317 18.3829 18.4690 18.4690 28.6651 28.6651 k = 0.0763 0.0440 0.0311 ( 1185 PWs) bands (ev): -64.2340 -64.2340 -34.7966 -34.7966 -30.8863 -30.8863 -30.8823 -30.8823 -1.2364 -1.2364 8.2687 8.2687 8.3257 8.3433 8.4114 8.4114 12.5970 12.6172 12.6172 12.6517 16.7097 16.7097 18.2541 18.2541 18.3196 18.3768 18.4575 18.4575 28.5389 28.5389 k = 0.0847 0.0489 0.0346 ( 1179 PWs) bands (ev): -64.2338 -64.2338 -34.7971 -34.7971 -30.8874 -30.8874 -30.8825 -30.8825 -1.2246 -1.2246 8.2619 8.2619 8.3339 8.3534 8.4195 8.4195 12.5904 12.6118 12.6118 12.6509 16.7516 16.7516 18.2242 18.2242 18.3065 18.3696 18.4453 18.4453 28.3998 28.3998 k = 0.0932 0.0538 0.0381 ( 1179 PWs) bands (ev): -64.2337 -64.2337 -34.7976 -34.7976 -30.8886 -30.8886 -30.8828 -30.8828 -1.2117 -1.2117 8.2545 8.2545 8.3430 8.3644 8.4288 8.4288 12.5836 12.6060 12.6060 12.6497 16.7949 16.7949 18.1933 18.1933 18.2922 18.3610 18.4321 18.4321 28.2507 28.2507 k = 0.1017 0.0587 0.0415 ( 1179 PWs) bands (ev): -64.2336 -64.2336 -34.7982 -34.7982 -30.8900 -30.8900 -30.8831 -30.8831 -1.1977 -1.1977 8.2466 8.2466 8.3529 8.3761 8.4391 8.4391 12.5769 12.6000 12.6000 12.6485 16.8382 16.8382 18.1627 18.1627 18.2767 18.3510 18.4179 18.4179 28.0938 28.0938 k = 0.1102 0.0636 0.0450 ( 1167 PWs) bands (ev): -64.2334 -64.2334 -34.7988 -34.7988 -30.8914 -30.8914 -30.8834 -30.8834 -1.1827 -1.1827 8.2385 8.2385 8.3636 8.3886 8.4505 8.4505 12.5705 12.5942 12.5942 12.6475 16.8798 16.8798 18.1342 18.1342 18.2601 18.3396 18.4027 18.4027 27.9314 27.9314 k = 0.1186 0.0685 0.0484 ( 1173 PWs) bands (ev): -64.2333 -64.2333 -34.7995 -34.7995 -30.8930 -30.8930 -30.8837 -30.8837 -1.1668 -1.1668 8.2303 8.2303 8.3749 8.4017 8.4627 8.4627 12.5639 12.5879 12.5879 12.6462 16.9175 16.9175 18.1096 18.1096 18.2419 18.3266 18.3861 18.3861 27.7647 27.7647 k = 0.1271 0.0734 0.0519 ( 1173 PWs) bands (ev): -64.2331 -64.2331 -34.8002 -34.8002 -30.8946 -30.8946 -30.8841 -30.8841 -1.1499 -1.1499 8.2222 8.2222 8.3869 8.4155 8.4757 8.4757 12.5577 12.5818 12.5818 12.6451 16.9488 16.9488 18.0916 18.0916 18.2225 18.3122 18.3684 18.3684 27.5953 27.5953 k = 0.1356 0.0783 0.0554 ( 1173 PWs) bands (ev): -64.2330 -64.2330 -34.8009 -34.8009 -30.8963 -30.8963 -30.8845 -30.8845 -1.1322 -1.1322 8.2144 8.2144 8.3996 8.4298 8.4896 8.4896 12.5519 12.5758 12.5758 12.6442 16.9708 16.9708 18.0831 18.0831 18.2017 18.2962 18.3495 18.3495 27.4242 27.4242 k = 0.1441 0.0832 0.0588 ( 1173 PWs) bands (ev): -64.2328 -64.2328 -34.8017 -34.8017 -30.8981 -30.8981 -30.8848 -30.8848 -1.1137 -1.1137 8.2070 8.2070 8.4128 8.4446 8.5041 8.5041 12.5465 12.5701 12.5701 12.6436 16.9807 16.9807 18.0866 18.0866 18.1795 18.2785 18.3293 18.3293 27.2523 27.2523 k = 0.1525 0.0881 0.0623 ( 1173 PWs) bands (ev): -64.2326 -64.2326 -34.8025 -34.8025 -30.9000 -30.9000 -30.8852 -30.8852 -1.0944 -1.0944 8.2003 8.2003 8.4265 8.4599 8.5192 8.5192 12.5417 12.5646 12.5646 12.6434 16.9763 16.9763 18.1041 18.1041 18.1559 18.2592 18.3080 18.3080 27.0804 27.0804 k = 0.1610 0.0930 0.0657 ( 1167 PWs) bands (ev): -64.2324 -64.2324 -34.8033 -34.8033 -30.9020 -30.9020 -30.8856 -30.8856 -1.0744 -1.0744 8.1944 8.1944 8.4406 8.4756 8.5350 8.5350 12.5377 12.5598 12.5598 12.6438 16.9566 16.9566 18.1309 18.1360 18.1360 18.2382 18.2861 18.2861 26.9093 26.9093 k = 0.1695 0.0979 0.0692 ( 1167 PWs) bands (ev): -64.2322 -64.2322 -34.8042 -34.8042 -30.9040 -30.9040 -30.8861 -30.8861 -1.0537 -1.0537 8.1894 8.1894 8.4552 8.4916 8.5511 8.5511 12.5343 12.5553 12.5553 12.6446 16.9218 16.9218 18.1043 18.1793 18.1793 18.2154 18.2661 18.2661 26.7394 26.7394 k = 0.1780 0.1027 0.0727 ( 1167 PWs) bands (ev): -64.2320 -64.2320 -34.8050 -34.8050 -30.9061 -30.9061 -30.8865 -30.8865 -1.0326 -1.0326 8.1854 8.1854 8.4700 8.5079 8.5677 8.5677 12.5317 12.5513 12.5513 12.6460 16.8733 16.8733 18.0763 18.1910 18.2095 18.2095 18.2714 18.2714 26.5714 26.5714 k = 0.1864 0.1076 0.0761 ( 1167 PWs) bands (ev): -64.2318 -64.2318 -34.8059 -34.8059 -30.9082 -30.9082 -30.8870 -30.8870 -1.0109 -1.0109 8.1828 8.1828 8.4852 8.5243 8.5846 8.5846 12.5300 12.5481 12.5481 12.6481 16.8126 16.8126 18.0467 18.1647 18.1942 18.1942 18.3324 18.3324 26.4056 26.4056 k = 0.1949 0.1125 0.0796 ( 1167 PWs) bands (ev): -64.2316 -64.2316 -34.8069 -34.8069 -30.9104 -30.9104 -30.8874 -30.8874 -0.9888 -0.9888 8.1814 8.1814 8.5005 8.5409 8.6017 8.6017 12.5294 12.5457 12.5457 12.6510 16.7417 16.7417 18.0157 18.1367 18.1671 18.1671 18.4135 18.4135 26.2425 26.2425 k = 0.2034 0.1174 0.0830 ( 1167 PWs) bands (ev): -64.2314 -64.2314 -34.8078 -34.8078 -30.9126 -30.9126 -30.8879 -30.8879 -0.9663 -0.9663 8.1816 8.1816 8.5160 8.5575 8.6190 8.6190 12.5299 12.5441 12.5441 12.6548 16.6621 16.6621 17.9832 18.1070 18.1368 18.1368 18.5045 18.5045 26.0825 26.0825 k = 0.2119 0.1223 0.0865 ( 1167 PWs) bands (ev): -64.2312 -64.2312 -34.8088 -34.8088 -30.9148 -30.9148 -30.8884 -30.8884 -0.9436 -0.9436 8.1834 8.1834 8.5316 8.5741 8.6364 8.6364 12.5315 12.5434 12.5434 12.6595 16.5753 16.5753 17.9492 18.0755 18.1043 18.1043 18.6028 18.6028 25.9260 25.9260 k = 0.2203 0.1272 0.0900 ( 1167 PWs) bands (ev): -64.2310 -64.2310 -34.8098 -34.8098 -30.9171 -30.9171 -30.8889 -30.8889 -0.9206 -0.9206 8.1869 8.1869 8.5472 8.5906 8.6538 8.6538 12.5345 12.5438 12.5438 12.6652 16.4825 16.4825 17.9137 18.0423 18.0700 18.0700 18.7069 18.7069 25.7731 25.7731 k = 0.2288 0.1321 0.0934 ( 1164 PWs) bands (ev): -64.2307 -64.2307 -34.8107 -34.8107 -30.9194 -30.9194 -30.8894 -30.8894 -0.8975 -0.8975 8.1922 8.1922 8.5627 8.6070 8.6712 8.6712 12.5387 12.5452 12.5452 12.6720 16.3847 16.3847 17.8769 18.0074 18.0341 18.0341 18.8158 18.8158 25.6241 25.6241 k = 0.2373 0.1370 0.0969 ( 1158 PWs) bands (ev): -64.2305 -64.2305 -34.8117 -34.8117 -30.9217 -30.9217 -30.8899 -30.8899 -0.8743 -0.8743 8.1994 8.1994 8.5782 8.6231 8.6885 8.6885 12.5444 12.5479 12.5479 12.6799 16.2825 16.2825 17.8387 17.9709 17.9967 17.9967 18.9283 18.9283 25.4794 25.4794 k = 0.2458 0.1419 0.1003 ( 1158 PWs) bands (ev): -64.2303 -64.2303 -34.8127 -34.8127 -30.9240 -30.9240 -30.8904 -30.8904 -0.8511 -0.8511 8.2085 8.2085 8.5935 8.6390 8.7056 8.7056 12.5515 12.5516 12.5516 12.6889 16.1766 16.1766 17.7992 17.9327 17.9578 17.9578 19.0437 19.0437 25.3391 25.3391 k = 0.2542 0.1468 0.1038 ( 1158 PWs) bands (ev): -64.2300 -64.2300 -34.8137 -34.8137 -30.9264 -30.9264 -30.8909 -30.8909 -0.8280 -0.8280 8.2196 8.2196 8.6086 8.6544 8.7224 8.7224 12.5565 12.5565 12.5600 12.6990 16.0675 16.0675 17.7586 17.8931 17.9175 17.9175 19.1614 19.1614 25.2034 25.2034 k = 0.2627 0.1517 0.1073 ( 1158 PWs) bands (ev): -64.2298 -64.2298 -34.8147 -34.8147 -30.9287 -30.9287 -30.8914 -30.8914 -0.8050 -0.8050 8.2327 8.2327 8.6234 8.6696 8.7390 8.7390 12.5627 12.5627 12.5699 12.7102 15.9559 15.9559 17.7167 17.8520 17.8759 17.8759 19.2809 19.2809 25.0724 25.0724 k = 0.2712 0.1566 0.1107 ( 1164 PWs) bands (ev): -64.2296 -64.2296 -34.8157 -34.8157 -30.9310 -30.9310 -30.8918 -30.8918 -0.7822 -0.7822 8.2478 8.2478 8.6380 8.6842 8.7552 8.7552 12.5701 12.5701 12.5814 12.7226 15.8421 15.8421 17.6738 17.8095 17.8332 17.8332 19.4014 19.4014 24.9464 24.9464 k = 0.2797 0.1615 0.1142 ( 1164 PWs) bands (ev): -64.2294 -64.2294 -34.8167 -34.8167 -30.9333 -30.9333 -30.8923 -30.8923 -0.7597 -0.7597 8.2650 8.2650 8.6522 8.6984 8.7709 8.7709 12.5787 12.5787 12.5944 12.7362 15.7269 15.7269 17.6299 17.7658 17.7894 17.7894 19.5226 19.5226 24.8254 24.8254 k = 0.2881 0.1664 0.1176 ( 1161 PWs) bands (ev): -64.2292 -64.2292 -34.8177 -34.8177 -30.9356 -30.9356 -30.8928 -30.8928 -0.7375 -0.7375 8.2843 8.2843 8.6660 8.7120 8.7863 8.7863 12.5886 12.5886 12.6089 12.7509 15.6105 15.6105 17.5853 17.7210 17.7447 17.7447 19.6439 19.6439 24.7097 24.7097 k = 0.2966 0.1712 0.1211 ( 1161 PWs) bands (ev): -64.2290 -64.2290 -34.8186 -34.8186 -30.9378 -30.9378 -30.8933 -30.8933 -0.7158 -0.7158 8.3055 8.3055 8.6794 8.7251 8.8011 8.8011 12.5996 12.5996 12.6249 12.7666 15.4932 15.4932 17.5400 17.6751 17.6992 17.6992 19.7649 19.7649 24.5993 24.5993 k = 0.3051 0.1761 0.1246 ( 1155 PWs) bands (ev): -64.2287 -64.2287 -34.8196 -34.8196 -30.9400 -30.9400 -30.8937 -30.8937 -0.6944 -0.6944 8.3288 8.3288 8.6925 8.7376 8.8155 8.8155 12.6119 12.6119 12.6423 12.7835 15.3757 15.3757 17.4942 17.6285 17.6531 17.6531 19.8850 19.8850 24.4943 24.4943 k = 0.3136 0.1810 0.1280 ( 1155 PWs) bands (ev): -64.2285 -64.2285 -34.8205 -34.8205 -30.9422 -30.9422 -30.8942 -30.8942 -0.6737 -0.6737 8.3540 8.3540 8.7049 8.7494 8.8292 8.8292 12.6251 12.6251 12.6610 12.8012 15.2581 15.2581 17.4480 17.5810 17.6065 17.6065 20.0039 20.0039 24.3949 24.3949 k = 0.3220 0.1859 0.1315 ( 1152 PWs) bands (ev): -64.2283 -64.2283 -34.8214 -34.8214 -30.9443 -30.9443 -30.8947 -30.8947 -0.6534 -0.6534 8.3809 8.3809 8.7169 8.7606 8.8424 8.8424 12.6395 12.6395 12.6810 12.8198 15.1409 15.1409 17.4016 17.5330 17.5596 17.5596 20.1209 20.1209 24.3011 24.3011 k = 0.3305 0.1908 0.1349 ( 1149 PWs) bands (ev): -64.2281 -64.2281 -34.8223 -34.8223 -30.9463 -30.9463 -30.8951 -30.8951 -0.6338 -0.6338 8.4095 8.4095 8.7284 8.7711 8.8549 8.8549 12.6546 12.6546 12.7022 12.8392 15.0247 15.0247 17.3552 17.4846 17.5125 17.5125 20.2356 20.2356 24.2130 24.2130 k = 0.3390 0.1957 0.1384 ( 1149 PWs) bands (ev): -64.2279 -64.2279 -34.8231 -34.8231 -30.9483 -30.9483 -30.8955 -30.8955 -0.6149 -0.6149 8.4397 8.4397 8.7394 8.7809 8.8667 8.8667 12.6705 12.6705 12.7245 12.8591 14.9096 14.9096 17.3090 17.4360 17.4656 17.4656 20.3475 20.3475 24.1306 24.1306 k = 0.3475 0.2006 0.1418 ( 1155 PWs) bands (ev): -64.2278 -64.2278 -34.8240 -34.8240 -30.9502 -30.9502 -30.8959 -30.8959 -0.5967 -0.5967 8.4711 8.4711 8.7497 8.7900 8.8779 8.8779 12.6869 12.6869 12.7475 12.8793 14.7963 14.7963 17.2631 17.3874 17.4188 17.4188 20.4562 20.4562 24.0541 24.0541 k = 0.3559 0.2055 0.1453 ( 1155 PWs) bands (ev): -64.2276 -64.2276 -34.8248 -34.8248 -30.9521 -30.9521 -30.8963 -30.8963 -0.5793 -0.5793 8.5038 8.5038 8.7596 8.7985 8.8885 8.8885 12.7039 12.7039 12.7715 12.9001 14.6851 14.6851 17.2180 17.3390 17.3727 17.3727 20.5611 20.5611 23.9835 23.9835 k = 0.3644 0.2104 0.1488 ( 1155 PWs) bands (ev): -64.2274 -64.2274 -34.8256 -34.8256 -30.9539 -30.9539 -30.8967 -30.8967 -0.5627 -0.5627 8.5374 8.5374 8.7689 8.8063 8.8985 8.8985 12.7212 12.7212 12.7961 12.9210 14.5765 14.5765 17.1737 17.2911 17.3272 17.3272 20.6618 20.6618 23.9187 23.9187 k = 0.3729 0.2153 0.1522 ( 1155 PWs) bands (ev): -64.2273 -64.2273 -34.8263 -34.8263 -30.9555 -30.9555 -30.8971 -30.8971 -0.5469 -0.5469 8.5717 8.5717 8.7777 8.8134 8.9078 8.9078 12.7387 12.7387 12.8212 12.9419 14.4710 14.4710 17.1306 17.2439 17.2827 17.2827 20.7578 20.7578 23.8599 23.8599 k = 0.3814 0.2202 0.1557 ( 1155 PWs) bands (ev): -64.2271 -64.2271 -34.8270 -34.8270 -30.9572 -30.9572 -30.8974 -30.8974 -0.5320 -0.5320 8.6063 8.6063 8.7860 8.8198 8.9164 8.9164 12.7560 12.7560 12.8466 12.9625 14.3692 14.3692 17.0888 17.1976 17.2394 17.2394 20.8486 20.8486 23.8068 23.8068 k = 0.3898 0.2251 0.1591 ( 1155 PWs) bands (ev): -64.2270 -64.2270 -34.8277 -34.8277 -30.9587 -30.9587 -30.8978 -30.8978 -0.5180 -0.5180 8.6410 8.6410 8.7937 8.8256 8.9245 8.9245 12.7730 12.7730 12.8721 12.9827 14.2714 14.2714 17.0487 17.1525 17.1976 17.1976 20.9340 20.9340 23.7596 23.7596 k = 0.3983 0.2300 0.1626 ( 1155 PWs) bands (ev): -64.2268 -64.2268 -34.8283 -34.8283 -30.9601 -30.9601 -30.8981 -30.8981 -0.5049 -0.5049 8.6755 8.6755 8.8009 8.8307 8.9319 8.9319 12.7896 12.7896 12.8974 13.0022 14.1784 14.1784 17.0105 17.1088 17.1576 17.1576 21.0134 21.0134 23.7179 23.7179 k = 0.4068 0.2349 0.1661 ( 1155 PWs) bands (ev): -64.2267 -64.2267 -34.8288 -34.8288 -30.9614 -30.9614 -30.8984 -30.8984 -0.4928 -0.4928 8.7092 8.7092 8.8075 8.8353 8.9388 8.9388 12.8054 12.8054 12.9224 13.0209 14.0905 14.0905 16.9745 17.0668 17.1194 17.1194 21.0867 21.0867 23.6817 23.6817 k = 0.4153 0.2397 0.1695 ( 1155 PWs) bands (ev): -64.2266 -64.2266 -34.8294 -34.8294 -30.9626 -30.9626 -30.8986 -30.8986 -0.4817 -0.4817 8.7419 8.7419 8.8137 8.8392 8.9452 8.9452 12.8201 12.8201 12.9468 13.0384 14.0083 14.0083 16.9409 17.0268 17.0836 17.0836 21.1535 21.1535 23.6508 23.6508 k = 0.4237 0.2446 0.1730 ( 1155 PWs) bands (ev): -64.2265 -64.2265 -34.8299 -34.8299 -30.9637 -30.9637 -30.8989 -30.8989 -0.4716 -0.4716 8.7731 8.7731 8.8194 8.8426 8.9510 8.9510 12.8337 12.8337 12.9704 13.0546 13.9324 13.9324 16.9101 16.9891 17.0502 17.0502 21.2138 21.2138 23.6247 23.6247 k = 0.4322 0.2495 0.1764 ( 1155 PWs) bands (ev): -64.2264 -64.2264 -34.8303 -34.8303 -30.9647 -30.9647 -30.8991 -30.8991 -0.4625 -0.4625 8.8023 8.8023 8.8246 8.8454 8.9565 8.9565 12.8459 12.8459 12.9929 13.0692 13.8634 13.8634 16.8823 16.9539 17.0195 17.0195 21.2673 21.2673 23.6031 23.6031 k = 0.4407 0.2544 0.1799 ( 1161 PWs) bands (ev): -64.2263 -64.2263 -34.8307 -34.8307 -30.9657 -30.9657 -30.8993 -30.8993 -0.4545 -0.4545 8.8290 8.8290 8.8293 8.8476 8.9615 8.9615 12.8564 12.8564 13.0139 13.0819 13.8014 13.8014 16.8577 16.9215 16.9919 16.9919 21.3141 21.3141 23.5856 23.5856 k = 0.4492 0.2593 0.1834 ( 1164 PWs) bands (ev): -64.2263 -64.2263 -34.8310 -34.8310 -30.9664 -30.9664 -30.8994 -30.8994 -0.4475 -0.4475 8.8335 8.8493 8.8527 8.8527 8.9662 8.9662 12.8655 12.8655 13.0335 13.0927 13.7472 13.7472 16.8366 16.8921 16.9674 16.9674 21.3543 21.3543 23.5718 23.5718 k = 0.4576 0.2642 0.1868 ( 1164 PWs) bands (ev): -64.2262 -64.2262 -34.8313 -34.8313 -30.9671 -30.9671 -30.8996 -30.8996 -0.4416 -0.4416 8.8373 8.8506 8.8733 8.8733 8.9707 8.9707 12.8729 12.8729 13.0514 13.1014 13.7010 13.7010 16.8191 16.8660 16.9463 16.9463 21.3879 21.3879 23.5611 23.5611 k = 0.4661 0.2691 0.1903 ( 1164 PWs) bands (ev): -64.2262 -64.2262 -34.8316 -34.8316 -30.9677 -30.9677 -30.8997 -30.8997 -0.4367 -0.4367 8.8406 8.8513 8.8901 8.8901 8.9748 8.9748 12.8786 12.8786 13.0672 13.1077 13.6631 13.6631 16.8055 16.8435 16.9288 16.9288 21.4152 21.4152 23.5531 23.5531 k = 0.4746 0.2740 0.1937 ( 1164 PWs) bands (ev): -64.2261 -64.2261 -34.8318 -34.8318 -30.9681 -30.9681 -30.8998 -30.8998 -0.4329 -0.4329 8.8435 8.8515 8.9030 8.9030 8.9786 8.9786 12.8829 12.8829 13.0810 13.1116 13.6335 13.6335 16.7958 16.8246 16.9150 16.9150 21.4361 21.4361 23.5475 23.5475 k = 0.4831 0.2789 0.1972 ( 1164 PWs) bands (ev): -64.2261 -64.2261 -34.8319 -34.8319 -30.9684 -30.9684 -30.8999 -30.8999 -0.4302 -0.4302 8.8459 8.8513 8.9120 8.9120 8.9817 8.9817 12.8858 12.8858 13.0924 13.1130 13.6124 13.6124 16.7903 16.8095 16.9050 16.9050 21.4510 21.4510 23.5437 23.5437 k = 0.4915 0.2838 0.2007 ( 1164 PWs) bands (ev): -64.2261 -64.2261 -34.8320 -34.8320 -30.9686 -30.9686 -30.8999 -30.8999 -0.4285 -0.4285 8.8479 8.8506 8.9173 8.9173 8.9838 8.9838 12.8875 12.8875 13.1014 13.1117 13.5998 13.5998 16.7889 16.7985 16.8990 16.8990 21.4599 21.4599 23.5416 23.5416 k = 0.5000 0.2887 0.2041 ( 1158 PWs) bands (ev): -64.2260 -64.2260 -34.8320 -34.8320 -30.9686 -30.9686 -30.8999 -30.8999 -0.4280 -0.4280 8.8496 8.8496 8.9190 8.9190 8.9846 8.9846 12.8881 12.8881 13.1079 13.1079 13.5956 13.5956 16.7918 16.7918 16.8972 16.8972 21.4628 21.4628 23.5409 23.5409 k = 0.5000 0.2887 0.2041 ( 1158 PWs) bands (ev): -64.2260 -64.2260 -34.8320 -34.8320 -30.9686 -30.9686 -30.8999 -30.8999 -0.4280 -0.4280 8.8496 8.8496 8.9190 8.9190 8.9846 8.9846 12.8881 12.8881 13.1079 13.1079 13.5956 13.5956 16.7918 16.7918 16.8972 16.8972 21.4628 21.4628 23.5409 23.5409 k = 0.5030 0.2801 0.2090 ( 1162 PWs) bands (ev): -64.2261 -64.2261 -34.8322 -34.8318 -30.9689 -30.9683 -30.9000 -30.9000 -0.4290 -0.4264 8.8496 8.8496 8.9161 8.9232 8.9823 8.9875 12.8819 12.8932 13.1076 13.1077 13.5887 13.6017 16.7902 16.7903 16.8939 16.8982 21.4649 21.4678 23.5414 23.5426 k = 0.5060 0.2715 0.2138 ( 1164 PWs) bands (ev): -64.2261 -64.2261 -34.8324 -34.8317 -30.9692 -30.9680 -30.9001 -30.9001 -0.4294 -0.4243 8.8495 8.8499 8.9146 8.9286 8.9809 8.9914 12.8749 12.8974 13.1069 13.1069 13.5810 13.6072 16.7853 16.7861 16.8889 16.8969 21.4739 21.4797 23.5442 23.5466 k = 0.5089 0.2629 0.2187 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8326 -34.8316 -30.9695 -30.9677 -30.9003 -30.9003 -0.4293 -0.4216 8.8489 8.8502 8.9149 8.9351 8.9806 8.9963 12.8669 12.9007 13.1056 13.1057 13.5727 13.6120 16.7768 16.7796 16.8827 16.8931 21.4900 21.4986 23.5492 23.5528 k = 0.5119 0.2543 0.2236 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8329 -34.8315 -30.9697 -30.9674 -30.9006 -30.9006 -0.4285 -0.4183 8.8473 8.8504 8.9173 8.9423 8.9820 9.0025 12.8578 12.9031 13.1037 13.1038 13.5638 13.6164 16.7641 16.7705 16.8759 16.8870 21.5129 21.5242 23.5564 23.5612 k = 0.5149 0.2457 0.2284 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8332 -34.8314 -30.9700 -30.9671 -30.9010 -30.9009 -0.4273 -0.4145 8.8441 8.8498 8.9221 8.9502 8.9858 9.0101 12.8475 12.9043 13.1012 13.1012 13.5547 13.6206 16.7471 16.7588 16.8686 16.8785 21.5425 21.5565 23.5657 23.5718 k = 0.5179 0.2371 0.2333 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8335 -34.8314 -30.9702 -30.9668 -30.9014 -30.9014 -0.4254 -0.4101 8.8390 8.8481 8.9293 8.9583 8.9927 9.0194 12.8359 12.9044 13.0976 13.0979 13.5457 13.6247 16.7257 16.7445 16.8611 16.8680 21.5787 21.5953 23.5772 23.5844 k = 0.5208 0.2285 0.2381 ( 1160 PWs) bands (ev): -64.2259 -64.2259 -34.8338 -34.8313 -30.9704 -30.9664 -30.9019 -30.9019 -0.4230 -0.4053 8.8322 8.8448 8.9390 8.9669 9.0031 9.0305 12.8228 12.9034 13.0926 13.0940 13.5372 13.6291 16.7003 16.7274 16.8533 16.8557 21.6214 21.6403 23.5907 23.5991 k = 0.5238 0.2199 0.2430 ( 1158 PWs) bands (ev): -64.2259 -64.2259 -34.8341 -34.8314 -30.9706 -30.9661 -30.9026 -30.9025 -0.4201 -0.3999 8.8234 8.8396 8.9511 8.9765 9.0168 9.0435 12.8081 12.9011 13.0858 13.0892 13.5298 13.6340 16.6709 16.7074 16.8419 16.8450 21.6702 21.6914 23.6062 23.6158 k = 0.5268 0.2114 0.2479 ( 1158 PWs) bands (ev): -64.2258 -64.2258 -34.8345 -34.8314 -30.9709 -30.9657 -30.9032 -30.9031 -0.4167 -0.3941 8.8129 8.8323 8.9653 8.9877 9.0333 9.0586 12.7914 12.8974 13.0768 13.0836 13.5239 13.6395 16.6378 16.6843 16.8267 16.8362 21.7249 21.7482 23.6235 23.6344 k = 0.5298 0.2028 0.2527 ( 1160 PWs) bands (ev): -64.2258 -64.2258 -34.8349 -34.8314 -30.9711 -30.9653 -30.9040 -30.9038 -0.4128 -0.3879 8.8008 8.8230 8.9815 9.0008 9.0524 9.0756 12.7726 12.8923 13.0649 13.0771 13.5202 13.6460 16.6015 16.6580 16.8105 16.8265 21.7853 21.8105 23.6426 23.6547 k = 0.5327 0.1942 0.2576 ( 1160 PWs) bands (ev): -64.2257 -64.2257 -34.8353 -34.8315 -30.9713 -30.9650 -30.9049 -30.9046 -0.4084 -0.3812 8.7873 8.8119 8.9997 9.0158 9.0738 9.0948 12.7516 12.8859 13.0500 13.0700 13.5192 13.6537 16.5623 16.6288 16.7934 16.8160 21.8511 21.8781 23.6635 23.6768 k = 0.5357 0.1856 0.2624 ( 1158 PWs) bands (ev): -64.2256 -64.2256 -34.8357 -34.8316 -30.9715 -30.9646 -30.9058 -30.9054 -0.4036 -0.3741 8.7725 8.7992 9.0197 9.0327 9.0976 9.1160 12.7282 12.8779 13.0319 13.0621 13.5214 13.6628 16.5203 16.5966 16.7753 16.8044 21.9220 21.9504 23.6859 23.7005 k = 0.5387 0.1770 0.2673 ( 1158 PWs) bands (ev): -64.2256 -64.2256 -34.8361 -34.8318 -30.9717 -30.9642 -30.9067 -30.9063 -0.3984 -0.3667 8.7565 8.7850 9.0414 9.0514 9.1235 9.1393 12.7021 12.8682 13.0105 13.0537 13.5269 13.6733 16.4760 16.5616 16.7564 16.7918 21.9976 22.0274 23.7099 23.7259 k = 0.5417 0.1684 0.2722 ( 1156 PWs) bands (ev): -64.2255 -64.2255 -34.8366 -34.8319 -30.9718 -30.9638 -30.9078 -30.9072 -0.3928 -0.3589 8.7394 8.7695 9.0648 9.0719 9.1517 9.1646 12.6734 12.8562 12.9864 13.0447 13.5358 13.6855 16.4294 16.5240 16.7366 16.7779 22.0777 22.1085 23.7354 23.7528 k = 0.5446 0.1598 0.2770 ( 1158 PWs) bands (ev): -64.2254 -64.2254 -34.8370 -34.8321 -30.9720 -30.9634 -30.9089 -30.9082 -0.3868 -0.3509 8.7214 8.7528 9.0897 9.0939 9.1821 9.1921 12.6419 12.8412 12.9604 13.0353 13.5479 13.6992 16.3808 16.4840 16.7158 16.7629 22.1618 22.1934 23.7623 23.7812 k = 0.5476 0.1512 0.2819 ( 1156 PWs) bands (ev): -64.2254 -64.2254 -34.8375 -34.8322 -30.9722 -30.9630 -30.9100 -30.9092 -0.3805 -0.3426 8.7025 8.7352 9.1162 9.1173 9.2146 9.2217 12.6076 12.8221 12.9342 13.0258 13.5632 13.7145 16.3303 16.4419 16.6940 16.7465 22.2495 22.2817 23.7907 23.8112 k = 0.5506 0.1426 0.2867 ( 1154 PWs) bands (ev): -64.2253 -64.2253 -34.8379 -34.8324 -30.9724 -30.9626 -30.9112 -30.9102 -0.3738 -0.3340 8.6830 8.7167 9.1422 9.1440 9.2494 9.2534 12.5704 12.7972 12.9097 13.0161 13.5813 13.7315 16.2782 16.3978 16.6711 16.7289 22.3405 22.3730 23.8205 23.8427 k = 0.5536 0.1340 0.2916 ( 1155 PWs) bands (ev): -64.2252 -64.2252 -34.8384 -34.8327 -30.9725 -30.9622 -30.9124 -30.9113 -0.3670 -0.3253 8.6628 8.6975 9.1683 9.1730 9.2863 9.2872 12.5304 12.7655 12.8882 13.0065 13.6020 13.7499 16.2246 16.3519 16.6472 16.7099 22.4341 22.4667 23.8517 23.8759 k = 0.5565 0.1254 0.2965 ( 1155 PWs) bands (ev): -64.2251 -64.2251 -34.8389 -34.8329 -30.9727 -30.9619 -30.9137 -30.9124 -0.3599 -0.3164 8.6420 8.6777 9.1955 9.2032 9.3232 9.3254 12.4878 12.7271 12.8702 12.9969 13.6250 13.7696 16.1697 16.3045 16.6221 16.6895 22.5301 22.5622 23.8846 23.9109 k = 0.5595 0.1168 0.3013 ( 1159 PWs) bands (ev): -64.2250 -64.2250 -34.8394 -34.8332 -30.9729 -30.9615 -30.9150 -30.9135 -0.3526 -0.3075 8.6209 8.6573 9.2237 9.2343 9.3613 9.3667 12.4426 12.6832 12.8548 12.9876 13.6500 13.7906 16.1136 16.2558 16.5957 16.6676 22.6276 22.6590 23.9191 23.9478 k = 0.5625 0.1083 0.3062 ( 1157 PWs) bands (ev): -64.2249 -64.2249 -34.8398 -34.8334 -30.9731 -30.9611 -30.9163 -30.9146 -0.3451 -0.2984 8.5993 8.6366 9.2529 9.2665 9.4017 9.4102 12.3951 12.6351 12.8415 12.9787 13.6768 13.8127 16.0565 16.2059 16.5683 16.6445 22.7262 22.7564 23.9556 23.9871 k = 0.5655 0.0997 0.3110 ( 1157 PWs) bands (ev): -64.2249 -64.2249 -34.8403 -34.8337 -30.9732 -30.9607 -30.9177 -30.9157 -0.3376 -0.2894 8.5776 8.6154 9.2830 9.2994 9.4441 9.4558 12.3453 12.5835 12.8295 12.9702 13.7049 13.8356 15.9985 16.1551 16.5396 16.6199 22.8249 22.8534 23.9945 24.0291 k = 0.5685 0.0911 0.3159 ( 1153 PWs) bands (ev): -64.2247 -64.2247 -34.8408 -34.8340 -30.9734 -30.9603 -30.9190 -30.9168 -0.3299 -0.2803 8.5556 8.5941 9.3138 9.3329 9.4887 9.5035 12.2938 12.5293 12.8187 12.9623 13.7344 13.8593 15.9398 16.1036 16.5098 16.5940 22.9229 22.9493 24.0361 24.0742 k = 0.5714 0.0825 0.3208 ( 1157 PWs) bands (ev): -64.2247 -64.2247 -34.8412 -34.8343 -30.9736 -30.9599 -30.9204 -30.9179 -0.3222 -0.2713 8.5334 8.5725 9.3452 9.3670 9.5353 9.5532 12.2403 12.4728 12.8088 12.9550 13.7647 13.8832 15.8806 16.0516 16.4788 16.5666 23.0192 23.0429 24.0811 24.1232 k = 0.5744 0.0739 0.3256 ( 1151 PWs) bands (ev): -64.2246 -64.2246 -34.8417 -34.8345 -30.9738 -30.9596 -30.9217 -30.9189 -0.3145 -0.2624 8.5113 8.5508 9.3772 9.4015 9.5839 9.6049 12.1855 12.4149 12.7998 12.9484 13.7958 13.9074 15.8212 15.9996 16.4467 16.5381 23.1127 23.1331 24.1302 24.1766 k = 0.5774 0.0653 0.3305 ( 1151 PWs) bands (ev): -64.2245 -64.2245 -34.8421 -34.8349 -30.9739 -30.9592 -30.9230 -30.9200 -0.3068 -0.2536 8.4892 8.5291 9.4095 9.4363 9.6345 9.6585 12.1295 12.3557 12.7918 12.9427 13.8272 13.9314 15.7617 15.9476 16.4134 16.5081 23.2021 23.2188 24.1841 24.2353 k = 0.5804 0.0567 0.3353 ( 1151 PWs) bands (ev): -64.2244 -64.2244 -34.8426 -34.8352 -30.9741 -30.9589 -30.9243 -30.9210 -0.2992 -0.2450 8.4671 8.5074 9.4420 9.4712 9.6867 9.7138 12.0725 12.2957 12.7846 12.9378 13.8586 13.9549 15.7023 15.8960 16.3792 16.4770 23.2861 23.2988 24.2436 24.2998 k = 0.5833 0.0481 0.3402 ( 1151 PWs) bands (ev): -64.2243 -64.2243 -34.8430 -34.8355 -30.9743 -30.9586 -30.9256 -30.9220 -0.2917 -0.2366 8.4452 8.4857 9.4747 9.5061 9.7406 9.7708 12.0151 12.2353 12.7785 12.9339 13.8899 13.9775 15.6436 15.8452 16.3438 16.4446 23.3635 23.3722 24.3095 24.3707 k = 0.5863 0.0395 0.3451 ( 1153 PWs) bands (ev): -64.2242 -64.2242 -34.8434 -34.8358 -30.9745 -30.9584 -30.9268 -30.9229 -0.2843 -0.2285 8.4234 8.4641 9.5073 9.5408 9.7958 9.8292 11.9574 12.1748 12.7734 12.9310 13.9204 13.9989 15.5857 15.7957 16.3074 16.4111 23.4334 23.4380 24.3821 24.4483 k = 0.5893 0.0309 0.3499 ( 1151 PWs) bands (ev): -64.2241 -64.2241 -34.8438 -34.8361 -30.9747 -30.9582 -30.9280 -30.9238 -0.2772 -0.2206 8.4018 8.4428 9.5398 9.5753 9.8522 9.8888 11.9000 12.1148 12.7696 12.9292 13.9500 14.0185 15.5292 15.7479 16.2703 16.3766 23.4950 23.4961 24.4616 24.5323 k = 0.5923 0.0223 0.3548 ( 1151 PWs) bands (ev): -64.2241 -64.2241 -34.8442 -34.8364 -30.9749 -30.9580 -30.9291 -30.9247 -0.2702 -0.2131 8.3805 8.4215 9.5720 9.6093 9.9095 9.9493 11.8432 12.0557 12.7669 12.9287 13.9780 14.0361 15.4746 15.7024 16.2323 16.3410 23.5461 23.5481 24.5477 24.6225 k = 0.5952 0.0137 0.3596 ( 1151 PWs) bands (ev): -64.2240 -64.2240 -34.8445 -34.8367 -30.9752 -30.9579 -30.9302 -30.9255 -0.2635 -0.2059 8.3595 8.4006 9.6037 9.6428 9.9672 10.0103 11.7876 11.9980 12.7655 12.9294 14.0039 14.0509 15.4225 15.6596 16.1936 16.3047 23.5883 23.5928 24.6397 24.7179 k = 0.5982 0.0052 0.3645 ( 1147 PWs) bands (ev): -64.2239 -64.2239 -34.8449 -34.8370 -30.9754 -30.9578 -30.9311 -30.9262 -0.2570 -0.1991 8.3388 8.3799 9.6349 9.6755 10.0248 10.0714 11.7338 11.9424 12.7656 12.9314 14.0272 14.0626 15.3736 15.6203 16.1544 16.2676 23.6229 23.6294 24.7364 24.8176 k = 0.6012-0.0034 0.3694 ( 1148 PWs) bands (ev): -64.2238 -64.2238 -34.8452 -34.8372 -30.9756 -30.9578 -30.9319 -30.9269 -0.2509 -0.1927 8.3184 8.3594 9.6653 9.7073 10.0819 10.1318 11.6824 11.8893 12.7671 12.9347 14.0470 14.0705 15.3285 15.5848 16.1147 16.2299 23.6504 23.6582 24.8366 24.9204 k = 0.6042-0.0120 0.3742 ( 1143 PWs) bands (ev): -64.2237 -64.2237 -34.8455 -34.8375 -30.9758 -30.9579 -30.9327 -30.9275 -0.2451 -0.1867 8.2983 8.3392 9.6948 9.7381 10.1377 10.1909 11.6344 11.8397 12.7702 12.9396 14.0627 14.0743 15.2883 15.5540 16.0748 16.1918 23.6712 23.6798 24.9390 25.0250 k = 0.6071-0.0206 0.3791 ( 1143 PWs) bands (ev): -64.2237 -64.2237 -34.8457 -34.8378 -30.9760 -30.9580 -30.9333 -30.9280 -0.2396 -0.1813 8.2786 8.3193 9.7232 9.7676 10.1912 10.2476 11.5908 11.7945 12.7749 12.9458 14.0734 14.0736 15.2537 15.5282 16.0347 16.1533 23.6854 23.6943 25.0422 25.1302 k = 0.6101-0.0292 0.3839 ( 1143 PWs) bands (ev): -64.2236 -64.2236 -34.8460 -34.8380 -30.9762 -30.9582 -30.9338 -30.9285 -0.2346 -0.1764 8.2592 8.2997 9.7505 9.7958 10.2416 10.3007 11.5529 11.7545 12.7810 12.9534 14.0677 14.0789 15.2256 15.5081 15.9946 16.1146 23.6934 23.7023 25.1446 25.2344 k = 0.6131-0.0378 0.3888 ( 1143 PWs) bands (ev): -64.2236 -64.2236 -34.8462 -34.8382 -30.9764 -30.9584 -30.9342 -30.9289 -0.2300 -0.1720 8.2402 8.2803 9.7764 9.8224 10.2877 10.3487 11.5221 11.7211 12.7889 12.9625 14.0569 14.0783 15.2045 15.4937 15.9547 16.0759 23.6952 23.7037 25.2446 25.3363 k = 0.6161-0.0464 0.3937 ( 1145 PWs) bands (ev): -64.2236 -64.2236 -34.8463 -34.8384 -30.9766 -30.9587 -30.9344 -30.9292 -0.2259 -0.1681 8.2215 8.2612 9.8009 9.8474 10.3282 10.3900 11.5000 11.6952 12.7983 12.9730 14.0413 14.0716 15.1909 15.4852 15.9152 16.0374 23.6909 23.6987 25.3404 25.4340 k = 0.6190-0.0550 0.3985 ( 1143 PWs) bands (ev): -64.2235 -64.2235 -34.8465 -34.8386 -30.9767 -30.9591 -30.9346 -30.9295 -0.2223 -0.1649 8.2031 8.2424 9.8238 9.8706 10.3619 10.4230 11.4882 11.6782 12.8095 12.9849 14.0211 14.0589 15.1849 15.4827 15.8764 15.9995 23.6804 23.6872 25.4303 25.5255 k = 0.6220-0.0636 0.4034 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8388 -30.9768 -30.9595 -30.9346 -30.9297 -0.2192 -0.1622 8.1850 8.2238 9.8450 9.8918 10.3877 10.4462 11.4879 11.6708 12.8222 12.9982 13.9968 14.0407 15.1864 15.4859 15.8385 15.9621 23.6637 23.6691 25.5121 25.6086 k = 0.6250-0.0722 0.4082 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.6250-0.0722 0.4082 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.6198-0.0692 0.4168 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9346 -30.9298 -0.2165 -0.1601 8.1680 8.2065 9.8629 9.9098 10.4051 10.4586 11.5016 11.6753 12.8363 13.0125 13.9679 14.0176 15.1883 15.4878 15.8034 15.9350 23.6424 23.6470 25.5851 25.6822 k = 0.6146-0.0662 0.4253 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9769 -30.9599 -30.9347 -30.9299 -0.2163 -0.1598 8.1706 8.2095 9.8583 9.9060 10.4059 10.4579 11.5073 11.6801 12.8356 13.0122 13.9642 14.0167 15.1700 15.4686 15.8100 15.9595 23.6476 23.6542 25.5883 25.6856 k = 0.6094-0.0631 0.4338 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9769 -30.9598 -30.9348 -30.9300 -0.2161 -0.1593 8.1749 8.2144 9.8511 9.8998 10.4070 10.4565 11.5168 11.6880 12.8343 13.0117 13.9585 14.0150 15.1420 15.4383 15.8243 15.9934 23.6568 23.6656 25.5938 25.6913 k = 0.6042-0.0601 0.4423 ( 1146 PWs) bands (ev): -64.2235 -64.2235 -34.8467 -34.8390 -30.9768 -30.9597 -30.9350 -30.9302 -0.2157 -0.1587 8.1808 8.2212 9.8415 9.8915 10.4082 10.4544 11.5301 11.6992 12.8324 13.0107 13.9508 14.0122 15.1069 15.3995 15.8459 16.0319 23.6700 23.6809 25.6014 25.6994 k = 0.5990-0.0571 0.4508 ( 1146 PWs) bands (ev): -64.2234 -64.2234 -34.8468 -34.8390 -30.9767 -30.9595 -30.9352 -30.9304 -0.2152 -0.1579 8.1883 8.2299 9.8300 9.8813 10.4092 10.4512 11.5470 11.7135 12.8296 13.0091 13.9414 14.0081 15.0672 15.3551 15.8726 16.0723 23.6869 23.6999 25.6113 25.7098 k = 0.5938-0.0541 0.4593 ( 1151 PWs) bands (ev): -64.2235 -64.2235 -34.8469 -34.8390 -30.9766 -30.9593 -30.9355 -30.9306 -0.2146 -0.1569 8.1972 8.2402 9.8170 9.8696 10.4096 10.4468 11.5675 11.7311 12.8257 13.0066 13.9303 14.0024 15.0249 15.3073 15.9024 16.1129 23.7073 23.7220 25.6237 25.7226 k = 0.5885-0.0511 0.4678 ( 1151 PWs) bands (ev): -64.2235 -64.2235 -34.8469 -34.8390 -30.9765 -30.9591 -30.9358 -30.9309 -0.2140 -0.1557 8.2075 8.2521 9.8032 9.8568 10.4091 10.4410 11.5915 11.7518 12.8205 13.0029 13.9182 13.9953 14.9818 15.2579 15.9335 16.1527 23.7310 23.7472 25.6385 25.7380 k = 0.5833-0.0481 0.4763 ( 1151 PWs) bands (ev): -64.2234 -64.2234 -34.8470 -34.8390 -30.9764 -30.9588 -30.9362 -30.9312 -0.2132 -0.1545 8.2190 8.2654 9.7889 9.8433 10.4076 10.4337 11.6188 11.7757 12.8137 12.9978 13.9051 13.9864 14.9392 15.2082 15.9648 16.1909 23.7576 23.7749 25.6558 25.7560 k = 0.5781-0.0451 0.4848 ( 1150 PWs) bands (ev): -64.2234 -64.2234 -34.8471 -34.8390 -30.9763 -30.9585 -30.9366 -30.9315 -0.2124 -0.1531 8.2316 8.2799 9.7747 9.8295 10.4048 10.4249 11.6491 11.8025 12.8051 12.9909 13.8912 13.9758 14.8982 15.1591 15.9953 16.2272 23.7867 23.8047 25.6758 25.7765 k = 0.5729-0.0421 0.4933 ( 1158 PWs) bands (ev): -64.2235 -64.2235 -34.8472 -34.8391 -30.9762 -30.9582 -30.9371 -30.9319 -0.2115 -0.1516 8.2449 8.2954 9.7608 9.8158 10.4006 10.4145 11.6822 11.8322 12.7941 12.9815 13.8767 13.9633 14.8595 15.1115 16.0242 16.2609 23.8177 23.8360 25.6985 25.7997 k = 0.5677-0.0391 0.5018 ( 1158 PWs) bands (ev): -64.2234 -64.2234 -34.8473 -34.8391 -30.9760 -30.9579 -30.9376 -30.9323 -0.2105 -0.1500 8.2590 8.3117 9.7479 9.8025 10.3949 10.4027 11.7180 11.8645 12.7808 12.9698 13.8622 13.9493 14.8241 15.0658 16.0515 16.2923 23.8502 23.8685 25.7241 25.8256 k = 0.5625-0.0361 0.5103 ( 1154 PWs) bands (ev): -64.2234 -64.2234 -34.8474 -34.8391 -30.9759 -30.9575 -30.9381 -30.9327 -0.2095 -0.1484 8.2735 8.3286 9.7361 9.7901 10.3877 10.3898 11.7560 11.8991 12.7650 12.9554 13.8478 13.9340 14.7923 15.0226 16.0767 16.3210 23.8838 23.9016 25.7523 25.8540 k = 0.5573-0.0331 0.5188 ( 1156 PWs) bands (ev): -64.2234 -64.2234 -34.8475 -34.8391 -30.9757 -30.9571 -30.9386 -30.9331 -0.2085 -0.1468 8.2881 8.3457 9.7258 9.7787 10.3754 10.3796 11.7958 11.9358 12.7460 12.9378 13.8337 13.9176 14.7645 14.9822 16.0996 16.3468 23.9177 23.9346 25.7832 25.8847 k = 0.5521-0.0301 0.5273 ( 1152 PWs) bands (ev): -64.2234 -64.2234 -34.8476 -34.8391 -30.9756 -30.9567 -30.9391 -30.9335 -0.2075 -0.1452 8.3027 8.3627 9.7172 9.7685 10.3606 10.3702 11.8372 11.9742 12.7242 12.9173 13.8203 13.9006 14.7407 14.9449 16.1202 16.3698 23.9515 23.9673 25.8166 25.9175 k = 0.5469-0.0271 0.5358 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8477 -34.8391 -30.9755 -30.9562 -30.9397 -30.9339 -0.2064 -0.1436 8.3169 8.3792 9.7105 9.7598 10.3451 10.3600 11.8797 12.0138 12.6993 12.8937 13.8077 13.8836 14.7210 14.9109 16.1383 16.3900 23.9845 23.9990 25.8521 25.9519 k = 0.5417-0.0241 0.5443 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8478 -34.8392 -30.9753 -30.9558 -30.9402 -30.9343 -0.2054 -0.1420 8.3304 8.3951 9.7059 9.7525 10.3294 10.3491 11.9228 12.0543 12.6714 12.8675 13.7962 13.8670 14.7052 14.8802 16.1539 16.4074 24.0162 24.0293 25.8892 25.9874 k = 0.5365-0.0210 0.5528 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8479 -34.8392 -30.9752 -30.9554 -30.9407 -30.9347 -0.2045 -0.1406 8.3431 8.4100 9.7034 9.7468 10.3140 10.3381 11.9660 12.0949 12.6408 12.8391 13.7855 13.8514 14.6929 14.8530 16.1671 16.4221 24.0460 24.0576 25.9272 26.0232 k = 0.5312-0.0180 0.5613 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8480 -34.8392 -30.9751 -30.9549 -30.9413 -30.9350 -0.2036 -0.1392 8.3546 8.4235 9.7029 9.7424 10.2991 10.3272 12.0086 12.1350 12.6079 12.8094 13.7759 13.8373 14.6838 14.8294 16.1780 16.4342 24.0732 24.0835 25.9652 26.0584 k = 0.5260-0.0150 0.5698 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8481 -34.8392 -30.9751 -30.9545 -30.9418 -30.9353 -0.2027 -0.1380 8.3647 8.4354 9.7042 9.7392 10.2853 10.3169 12.0496 12.1739 12.5735 12.7794 13.7673 13.8251 14.6774 14.8094 16.1867 16.4439 24.0975 24.1068 26.0019 26.0917 k = 0.5208-0.0120 0.5784 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8393 -30.9750 -30.9542 -30.9422 -30.9356 -0.2020 -0.1369 8.3732 8.4454 9.7071 9.7369 10.2730 10.3076 12.0879 12.2105 12.5386 12.7508 13.7596 13.8151 14.6732 14.7930 16.1934 16.4513 24.1182 24.1269 26.0359 26.1220 k = 0.5156-0.0090 0.5869 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8393 -30.9749 -30.9538 -30.9426 -30.9358 -0.2014 -0.1360 8.3800 8.4534 9.7111 9.7353 10.2627 10.2998 12.1218 12.2436 12.5049 12.7252 13.7533 13.8076 14.6707 14.7804 16.1983 16.4568 24.1350 24.1436 26.0656 26.1480 k = 0.5104-0.0060 0.5954 ( 1146 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9536 -30.9429 -30.9359 -0.2009 -0.1354 8.3850 8.4593 9.7155 9.7340 10.2550 10.2939 12.1490 12.2715 12.4749 12.7050 13.7484 13.8024 14.6695 14.7716 16.2015 16.4604 24.1475 24.1562 26.0890 26.1683 k = 0.5052-0.0030 0.6039 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9534 -30.9431 -30.9360 -0.2007 -0.1349 8.3880 8.4628 9.7192 9.7329 10.2501 10.2903 12.1667 12.2912 12.4528 12.6920 13.7451 13.7994 14.6689 14.7664 16.2033 16.4624 24.1553 24.1642 26.1042 26.1814 k = 0.5000-0.0000 0.6124 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9533 -30.9432 -30.9361 -0.2006 -0.1348 8.3890 8.4640 9.7208 9.7323 10.2485 10.2890 12.1727 12.2984 12.4445 12.6876 13.7440 13.7984 14.6687 14.7647 16.2038 16.4629 24.1580 24.1670 26.1096 26.1860 k = 0.5000-0.0000 0.6124 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9533 -30.9432 -30.9361 -0.2006 -0.1348 8.3890 8.4640 9.7208 9.7323 10.2485 10.2890 12.1727 12.2984 12.4445 12.6876 13.7440 13.7984 14.6687 14.7647 16.2038 16.4629 24.1580 24.1670 26.1096 26.1860 k = 0.5000 0.0060 0.6039 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8483 -34.8393 -30.9749 -30.9534 -30.9431 -30.9360 -0.2008 -0.1351 8.3895 8.4645 9.7152 9.7304 10.2516 10.2913 12.1613 12.2857 12.4586 12.6945 13.7462 13.8002 14.6687 14.7676 16.2045 16.4635 24.1570 24.1662 26.0982 26.1762 k = 0.5000 0.0120 0.5954 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8482 -34.8392 -30.9749 -30.9534 -30.9430 -30.9359 -0.2016 -0.1359 8.3909 8.4659 9.7005 9.7230 10.2605 10.2977 12.1304 12.2558 12.4913 12.7136 13.7526 13.8056 14.6692 14.7763 16.2066 16.4653 24.1543 24.1638 26.0641 26.1462 k = 0.5000 0.0180 0.5869 ( 1148 PWs) bands (ev): -64.2233 -64.2233 -34.8482 -34.8392 -30.9749 -30.9534 -30.9428 -30.9357 -0.2028 -0.1372 8.3932 8.4681 9.6794 9.7093 10.2740 10.3071 12.0872 12.2182 12.5303 12.7408 13.7628 13.8143 14.6708 14.7900 16.2100 16.4682 24.1496 24.1597 26.0077 26.0951 k = 0.5000 0.0241 0.5784 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8481 -34.8391 -30.9749 -30.9535 -30.9425 -30.9354 -0.2046 -0.1391 8.3964 8.4714 9.6533 9.6901 10.2905 10.3182 12.0380 12.1775 12.5701 12.7723 13.7759 13.8261 14.6747 14.8087 16.2148 16.4722 24.1431 24.1539 25.9310 26.0237 k = 0.5000 0.0301 0.5698 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8480 -34.8390 -30.9748 -30.9536 -30.9422 -30.9350 -0.2069 -0.1415 8.4006 8.4755 9.6238 9.6664 10.3082 10.3293 11.9872 12.1366 12.6082 12.8051 13.7910 13.8404 14.6820 14.8322 16.2209 16.4774 24.1346 24.1462 25.8377 25.9346 k = 0.5000 0.0361 0.5613 ( 1154 PWs) bands (ev): -64.2234 -64.2234 -34.8478 -34.8389 -30.9748 -30.9538 -30.9417 -30.9346 -0.2096 -0.1445 8.4056 8.4806 9.5919 9.6393 10.3253 10.3388 11.9377 12.0977 12.6433 12.8373 13.8069 13.8563 14.6937 14.8605 16.2283 16.4836 24.1240 24.1366 25.7318 25.8317 k = 0.5000 0.0421 0.5528 ( 1152 PWs) bands (ev): -64.2234 -64.2234 -34.8476 -34.8387 -30.9748 -30.9539 -30.9411 -30.9341 -0.2128 -0.1479 8.4116 8.4865 9.5584 9.6099 10.3398 10.3454 11.8917 12.0627 12.6751 12.8676 13.8224 13.8732 14.7108 14.8937 16.2370 16.4909 24.1113 24.1250 25.6171 25.7188 k = 0.5000 0.0481 0.5443 ( 1152 PWs) bands (ev): -64.2234 -64.2234 -34.8474 -34.8386 -30.9748 -30.9541 -30.9404 -30.9335 -0.2165 -0.1519 8.4184 8.4933 9.5241 9.5789 10.3462 10.3515 11.8510 12.0331 12.7034 12.8955 13.8364 13.8898 14.7341 14.9317 16.2468 16.4991 24.0962 24.1110 25.4966 25.5994 k = 0.5000 0.0541 0.5358 ( 1152 PWs) bands (ev): -64.2235 -64.2235 -34.8472 -34.8384 -30.9747 -30.9543 -30.9397 -30.9329 -0.2206 -0.1563 8.4261 8.5009 9.4893 9.5469 10.3429 10.3564 11.8173 12.0103 12.7282 12.9206 13.8481 13.9049 14.7642 14.9748 16.2576 16.5081 24.0784 24.0944 25.3725 25.4758 k = 0.5000 0.0601 0.5273 ( 1158 PWs) bands (ev): -64.2236 -64.2236 -34.8469 -34.8382 -30.9747 -30.9546 -30.9389 -30.9322 -0.2252 -0.1613 8.4345 8.5092 9.4546 9.5145 10.3330 10.3549 11.7917 11.9949 12.7499 12.9429 13.8570 13.9174 14.8013 15.0226 16.2694 16.5179 24.0577 24.0749 25.2469 25.3501 k = 0.5000 0.0662 0.5188 ( 1158 PWs) bands (ev): -64.2236 -64.2236 -34.8467 -34.8380 -30.9746 -30.9549 -30.9379 -30.9315 -0.2301 -0.1666 8.4437 8.5183 9.4203 9.4821 10.3163 10.3459 11.7753 11.9879 12.7687 12.9625 13.8626 13.9269 14.8456 15.0753 16.2822 16.5285 24.0336 24.0520 25.1211 25.2239 k = 0.5000 0.0722 0.5103 ( 1158 PWs) bands (ev): -64.2237 -64.2237 -34.8464 -34.8378 -30.9746 -30.9551 -30.9369 -30.9307 -0.2354 -0.1725 8.4537 8.5282 9.3866 9.4500 10.2927 10.3290 11.7685 11.9893 12.7849 12.9797 13.8646 13.9330 14.8967 15.1324 16.2958 16.5397 24.0055 24.0250 24.9968 25.0987 k = 0.5000 0.0782 0.5018 ( 1156 PWs) bands (ev): -64.2238 -64.2238 -34.8460 -34.8375 -30.9745 -30.9555 -30.9358 -30.9298 -0.2412 -0.1787 8.4644 8.5388 9.3538 9.4184 10.2625 10.3041 11.7712 11.9988 12.7989 12.9947 13.8631 13.9357 14.9539 15.1934 16.3103 16.5515 23.9727 23.9931 24.8756 24.9761 k = 0.5000 0.0842 0.4933 ( 1156 PWs) bands (ev): -64.2238 -64.2238 -34.8457 -34.8372 -30.9744 -30.9558 -30.9347 -30.9289 -0.2472 -0.1854 8.4757 8.5499 9.3219 9.3875 10.2261 10.2718 11.7830 12.0161 12.8110 13.0077 13.8580 13.9352 15.0163 15.2578 16.3254 16.5638 23.9343 23.9553 24.7589 24.8573 k = 0.5000 0.0902 0.4848 ( 1152 PWs) bands (ev): -64.2239 -64.2239 -34.8453 -34.8370 -30.9744 -30.9561 -30.9335 -30.9280 -0.2536 -0.1924 8.4878 8.5618 9.2911 9.3576 10.1844 10.2328 11.8031 12.0406 12.8215 13.0190 13.8497 13.9318 15.0831 15.3251 16.3413 16.5766 23.8891 23.9103 24.6487 24.7441 k = 0.5000 0.0962 0.4763 ( 1152 PWs) bands (ev): -64.2239 -64.2239 -34.8450 -34.8367 -30.9743 -30.9565 -30.9322 -30.9270 -0.2602 -0.1998 8.5003 8.5741 9.2615 9.3286 10.1380 10.1881 11.8305 12.0712 12.8305 13.0287 13.8385 13.9258 15.1533 15.3946 16.3576 16.5896 23.8358 23.8568 24.5467 24.6379 k = 0.5000 0.1022 0.4678 ( 1152 PWs) bands (ev): -64.2240 -64.2240 -34.8446 -34.8364 -30.9742 -30.9569 -30.9309 -30.9260 -0.2671 -0.2075 8.5134 8.5869 9.2331 9.3008 10.0878 10.1388 11.8640 12.1073 12.8383 13.0371 13.8248 13.9176 15.2260 15.4658 16.3745 16.6030 23.7731 23.7937 24.4544 24.5401 k = 0.5000 0.1083 0.4593 ( 1152 PWs) bands (ev): -64.2241 -64.2241 -34.8441 -34.8361 -30.9741 -30.9572 -30.9296 -30.9250 -0.2743 -0.2155 8.5270 8.6001 9.2061 9.2741 10.0346 10.0858 11.9027 12.1480 12.8451 13.0445 13.8088 13.9075 15.3006 15.5380 16.3918 16.6166 23.7002 23.7210 24.3729 24.4519 k = 0.5000 0.1143 0.4508 ( 1156 PWs) bands (ev): -64.2242 -64.2242 -34.8437 -34.8358 -30.9740 -30.9576 -30.9282 -30.9239 -0.2816 -0.2238 8.5409 8.6137 9.1803 9.2486 9.9792 10.0300 11.9456 12.1925 12.8510 13.0507 13.7911 13.8958 15.3763 15.6109 16.4094 16.6302 23.6170 23.6389 24.3017 24.3733 k = 0.5000 0.1203 0.4423 ( 1154 PWs) bands (ev): -64.2243 -64.2243 -34.8433 -34.8355 -30.9739 -30.9580 -30.9268 -30.9229 -0.2891 -0.2323 8.5553 8.6277 9.1559 9.2244 9.9223 9.9724 11.9918 12.2400 12.8563 13.0563 13.7720 13.8828 15.4526 15.6839 16.4274 16.6440 23.5247 23.5487 24.2400 24.3041 k = 0.5000 0.1263 0.4338 ( 1154 PWs) bands (ev): -64.2244 -64.2244 -34.8428 -34.8352 -30.9738 -30.9584 -30.9254 -30.9217 -0.2968 -0.2411 8.5700 8.6419 9.1329 9.2015 9.8645 9.9136 12.0404 12.2898 12.8611 13.0611 13.7520 13.8687 15.5290 15.7566 16.4458 16.6579 23.4251 23.4519 24.1860 24.2430 k = 0.5000 0.1323 0.4253 ( 1156 PWs) bands (ev): -64.2245 -64.2245 -34.8424 -34.8349 -30.9736 -30.9588 -30.9240 -30.9206 -0.3045 -0.2500 8.5849 8.6562 9.1113 9.1798 9.8063 9.8543 12.0908 12.3413 12.8654 13.0654 13.7312 13.8538 15.6050 15.8285 16.4643 16.6717 23.3203 23.3498 24.1380 24.1887 k = 0.5000 0.1383 0.4168 ( 1156 PWs) bands (ev): -64.2246 -64.2246 -34.8419 -34.8346 -30.9735 -30.9592 -30.9225 -30.9195 -0.3123 -0.2591 8.6000 8.6707 9.0910 9.1595 9.7483 9.7949 12.1423 12.3939 12.8695 13.0691 13.7101 13.8383 15.6803 15.8994 16.4831 16.6854 23.2124 23.2442 24.0945 24.1398 k = 0.5000 0.1443 0.4082 ( 1154 PWs) bands (ev): -64.2246 -64.2246 -34.8414 -34.8343 -30.9734 -30.9597 -30.9211 -30.9183 -0.3201 -0.2682 8.6153 8.6853 9.0720 9.1405 9.6907 9.7360 12.1944 12.4470 12.8734 13.0725 13.6888 13.8224 15.7546 15.9690 16.5021 16.6990 23.1027 23.1364 24.0544 24.0951 k = 0.5000 0.1504 0.3997 ( 1154 PWs) bands (ev): -64.2247 -64.2247 -34.8409 -34.8340 -30.9733 -30.9601 -30.9196 -30.9172 -0.3280 -0.2775 8.6306 8.6998 9.0544 9.1227 9.6339 9.6779 12.2465 12.5001 12.8772 13.0755 13.6677 13.8062 15.8276 16.0369 16.5212 16.7124 22.9926 23.0277 24.0168 24.0535 k = 0.5000 0.1564 0.3912 ( 1156 PWs) bands (ev): -64.2248 -64.2248 -34.8405 -34.8337 -30.9731 -30.9605 -30.9182 -30.9160 -0.3357 -0.2868 8.6459 8.7142 9.0380 9.1062 9.5783 9.6209 12.2981 12.5527 12.8810 13.0781 13.6469 13.7901 15.8991 16.1029 16.5404 16.7255 22.8830 22.9189 23.9811 24.0145 k = 0.5000 0.1624 0.3827 ( 1160 PWs) bands (ev): -64.2249 -64.2249 -34.8400 -34.8335 -30.9730 -30.9609 -30.9168 -30.9149 -0.3434 -0.2960 8.6611 8.7285 9.0229 9.0909 9.5241 9.5653 12.3490 12.6043 12.8850 13.0805 13.6267 13.7740 15.9688 16.1668 16.5597 16.7383 22.7746 22.8110 23.9468 23.9774 k = 0.5000 0.1684 0.3742 ( 1154 PWs) bands (ev): -64.2250 -64.2250 -34.8395 -34.8332 -30.9728 -30.9613 -30.9154 -30.9137 -0.3510 -0.3053 8.6764 8.7426 9.0091 9.0768 9.4715 9.5114 12.3987 12.6543 12.8894 13.0828 13.6076 13.7584 16.0368 16.2285 16.5791 16.7508 22.6681 22.7046 23.9138 23.9419 k = 0.5000 0.1744 0.3657 ( 1156 PWs) bands (ev): -64.2251 -64.2251 -34.8390 -34.8329 -30.9727 -30.9617 -30.9141 -30.9126 -0.3584 -0.3144 8.6913 8.7562 8.9963 9.0638 9.4207 9.4593 12.4467 12.7020 12.8944 13.0848 13.5896 13.7431 16.1027 16.2875 16.5985 16.7629 22.5639 22.6003 23.8819 23.9078 k = 0.5000 0.1804 0.3572 ( 1158 PWs) bands (ev): -64.2252 -64.2252 -34.8385 -34.8327 -30.9725 -30.9621 -30.9128 -30.9115 -0.3657 -0.3235 8.7059 8.7695 8.9847 9.0519 9.3719 9.4093 12.4928 12.7466 12.9005 13.0867 13.5729 13.7285 16.1665 16.3439 16.6179 16.7745 22.4625 22.4984 23.8510 23.8749 k = 0.5000 0.1864 0.3487 ( 1152 PWs) bands (ev): -64.2252 -64.2252 -34.8380 -34.8325 -30.9723 -30.9625 -30.9115 -30.9104 -0.3726 -0.3324 8.7203 8.7822 8.9743 9.0410 9.3253 9.3616 12.5368 12.7871 12.9087 13.0885 13.5580 13.7147 16.2281 16.3974 16.6375 16.7858 22.3643 22.3996 23.8211 23.8433 k = 0.5000 0.1925 0.3402 ( 1152 PWs) bands (ev): -64.2253 -64.2253 -34.8375 -34.8323 -30.9722 -30.9630 -30.9103 -30.9093 -0.3794 -0.3411 8.7342 8.7944 8.9649 9.0311 9.2809 9.3162 12.5783 12.8214 12.9201 13.0902 13.5450 13.7017 16.2872 16.4477 16.6572 16.7965 22.2696 22.3040 23.7922 23.8127 k = 0.5000 0.1985 0.3317 ( 1156 PWs) bands (ev): -64.2254 -64.2254 -34.8371 -34.8321 -30.9720 -30.9634 -30.9091 -30.9083 -0.3858 -0.3495 8.7476 8.8057 8.9564 9.0221 9.2389 9.2733 12.6170 12.8477 12.9365 13.0917 13.5341 13.6896 16.3438 16.4946 16.6769 16.8066 22.1787 22.2120 23.7644 23.7833 k = 0.5000 0.2045 0.3232 ( 1154 PWs) bands (ev): -64.2255 -64.2255 -34.8366 -34.8319 -30.9718 -30.9638 -30.9080 -30.9073 -0.3919 -0.3577 8.7605 8.8162 8.9491 9.0140 9.1994 9.2331 12.6529 12.8656 12.9579 13.0931 13.5256 13.6786 16.3980 16.5381 16.6969 16.8162 22.0920 22.1241 23.7378 23.7552 k = 0.5000 0.2105 0.3147 ( 1156 PWs) bands (ev): -64.2256 -64.2256 -34.8362 -34.8318 -30.9717 -30.9642 -30.9069 -30.9064 -0.3976 -0.3656 8.7728 8.8257 8.9426 9.0065 9.1624 9.1957 12.6857 12.8774 12.9817 13.0945 13.5197 13.6686 16.4494 16.5778 16.7171 16.8252 22.0096 22.0404 23.7123 23.7284 k = 0.5000 0.2165 0.3062 ( 1154 PWs) bands (ev): -64.2256 -64.2256 -34.8357 -34.8316 -30.9715 -30.9645 -30.9059 -30.9055 -0.4030 -0.3732 8.7846 8.8341 8.9372 8.9998 9.1281 9.1612 12.7155 12.8855 13.0054 13.0958 13.5166 13.6597 16.4981 16.6135 16.7377 16.8336 21.9321 21.9612 23.6882 23.7030 k = 0.5000 0.2225 0.2977 ( 1158 PWs) bands (ev): -64.2257 -64.2257 -34.8353 -34.8315 -30.9713 -30.9649 -30.9050 -30.9047 -0.4079 -0.3804 8.7955 8.8412 8.9326 8.9935 9.0967 9.1299 12.7421 12.8915 13.0269 13.0970 13.5161 13.6518 16.5438 16.6451 16.7585 16.8413 21.8595 21.8870 23.6656 23.6790 k = 0.5000 0.2285 0.2892 ( 1158 PWs) bands (ev): -64.2258 -64.2258 -34.8349 -34.8314 -30.9711 -30.9653 -30.9041 -30.9039 -0.4124 -0.3872 8.8058 8.8467 8.9290 8.9877 9.0683 9.1017 12.7658 12.8961 13.0457 13.0982 13.5181 13.6450 16.5863 16.6726 16.7794 16.8486 21.7922 21.8178 23.6445 23.6567 k = 0.5000 0.2345 0.2807 ( 1162 PWs) bands (ev): -64.2258 -64.2258 -34.8346 -34.8314 -30.9709 -30.9657 -30.9033 -30.9032 -0.4164 -0.3935 8.8151 8.8507 8.9262 8.9819 9.0431 9.0769 12.7867 12.8997 13.0615 13.0994 13.5224 13.6390 16.6254 16.6962 16.7998 16.8554 21.7304 21.7541 23.6251 23.6360 k = 0.5000 0.2406 0.2722 ( 1160 PWs) bands (ev): -64.2259 -64.2259 -34.8342 -34.8314 -30.9707 -30.9660 -30.9026 -30.9025 -0.4199 -0.3995 8.8235 8.8532 8.9240 8.9761 9.0216 9.0555 12.8050 12.9024 13.0744 13.1007 13.5287 13.6338 16.6611 16.7165 16.8192 16.8619 21.6745 21.6960 23.6075 23.6172 k = 0.5000 0.2466 0.2637 ( 1160 PWs) bands (ev): -64.2259 -64.2259 -34.8338 -34.8313 -30.9704 -30.9664 -30.9020 -30.9019 -0.4228 -0.4049 8.8310 8.8542 8.9221 8.9694 9.0044 9.0377 12.8209 12.9041 13.0845 13.1018 13.5365 13.6292 16.6929 16.7339 16.8368 16.8682 21.6247 21.6439 23.5918 23.6003 k = 0.5000 0.2526 0.2552 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8335 -34.8314 -30.9702 -30.9667 -30.9015 -30.9014 -0.4253 -0.4098 8.8373 8.8541 8.9201 8.9614 8.9924 9.0232 12.8347 12.9048 13.0922 13.1030 13.5451 13.6249 16.7205 16.7486 16.8520 16.8745 21.5812 21.5979 23.5780 23.5853 k = 0.5000 0.2586 0.2467 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8332 -34.8314 -30.9700 -30.9671 -30.9010 -30.9010 -0.4272 -0.4143 8.8423 8.8534 8.9179 8.9523 8.9853 9.0119 12.8468 12.9045 13.0980 13.1041 13.5542 13.6208 16.7436 16.7612 16.8645 16.8811 21.5442 21.5584 23.5663 23.5724 k = 0.5000 0.2646 0.2381 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8329 -34.8315 -30.9697 -30.9674 -30.9006 -30.9006 -0.4285 -0.4181 8.8460 8.8522 8.9159 8.9434 8.9818 9.0032 12.8573 12.9032 13.1021 13.1052 13.5634 13.6166 16.7621 16.7716 16.8744 16.8877 21.5139 21.5254 23.5567 23.5616 k = 0.5000 0.2706 0.2296 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8327 -34.8316 -30.9695 -30.9677 -30.9003 -30.9003 -0.4292 -0.4215 8.8482 8.8510 8.9146 8.9355 8.9806 8.9966 12.8666 12.9008 13.1049 13.1062 13.5724 13.6122 16.7758 16.7800 16.8823 16.8932 21.4906 21.4993 23.5494 23.5530 k = 0.5000 0.2766 0.2211 ( 1162 PWs) bands (ev): -64.2261 -64.2261 -34.8324 -34.8317 -30.9692 -30.9680 -30.9001 -30.9001 -0.4294 -0.4242 8.8493 8.8502 8.9146 8.9288 8.9809 8.9915 12.8748 12.8975 13.1067 13.1071 13.5809 13.6073 16.7850 16.7863 16.8888 16.8969 21.4742 21.4801 23.5443 23.5467 k = 0.5000 0.2827 0.2126 ( 1162 PWs) bands (ev): -64.2261 -64.2261 -34.8322 -34.8318 -30.9689 -30.9683 -30.9000 -30.9000 -0.4290 -0.4264 8.8495 8.8497 8.9160 8.9233 8.9823 8.9876 12.8819 12.8932 13.1076 13.1077 13.5886 13.6018 16.7901 16.7903 16.8938 16.8982 21.4649 21.4679 23.5414 23.5426 k = 0.5000 0.2887 0.2041 ( 1158 PWs) bands (ev): -64.2260 -64.2260 -34.8320 -34.8320 -30.9686 -30.9686 -30.8999 -30.8999 -0.4280 -0.4280 8.8496 8.8496 8.9190 8.9190 8.9846 8.9846 12.8881 12.8881 13.1079 13.1079 13.5956 13.5956 16.7918 16.7918 16.8972 16.8972 21.4628 21.4628 23.5409 23.5409 k = 0.5000 0.2887 0.2041 ( 1158 PWs) bands (ev): -64.2260 -64.2260 -34.8320 -34.8320 -30.9686 -30.9686 -30.8999 -30.8999 -0.4280 -0.4280 8.8496 8.8496 8.9190 8.9190 8.9846 8.9846 12.8881 12.8881 13.1079 13.1079 13.5956 13.5956 16.7918 16.7918 16.8972 16.8972 21.4628 21.4628 23.5409 23.5409 k = 0.4970 0.2870 0.2138 ( 1162 PWs) bands (ev): -64.2261 -64.2261 -34.8322 -34.8318 -30.9689 -30.9683 -30.9000 -30.9000 -0.4290 -0.4264 8.8496 8.8496 8.9161 8.9232 8.9823 8.9875 12.8819 12.8932 13.1076 13.1077 13.5887 13.6017 16.7902 16.7903 16.8939 16.8982 21.4649 21.4678 23.5414 23.5426 k = 0.4940 0.2852 0.2236 ( 1164 PWs) bands (ev): -64.2261 -64.2261 -34.8324 -34.8317 -30.9692 -30.9680 -30.9001 -30.9001 -0.4294 -0.4243 8.8495 8.8499 8.9146 8.9286 8.9809 8.9914 12.8749 12.8974 13.1069 13.1069 13.5810 13.6072 16.7853 16.7861 16.8889 16.8969 21.4739 21.4797 23.5442 23.5466 k = 0.4911 0.2835 0.2333 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8326 -34.8316 -30.9695 -30.9677 -30.9003 -30.9003 -0.4293 -0.4216 8.8489 8.8502 8.9149 8.9351 8.9806 8.9963 12.8669 12.9007 13.1056 13.1057 13.5727 13.6120 16.7768 16.7796 16.8827 16.8931 21.4900 21.4986 23.5492 23.5528 k = 0.4881 0.2818 0.2430 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8329 -34.8315 -30.9697 -30.9674 -30.9006 -30.9006 -0.4285 -0.4183 8.8473 8.8504 8.9173 8.9423 8.9820 9.0025 12.8578 12.9031 13.1037 13.1038 13.5638 13.6164 16.7641 16.7705 16.8759 16.8870 21.5129 21.5242 23.5564 23.5612 k = 0.4851 0.2801 0.2527 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8332 -34.8314 -30.9700 -30.9671 -30.9010 -30.9009 -0.4273 -0.4145 8.8441 8.8498 8.9221 8.9502 8.9858 9.0101 12.8475 12.9043 13.1012 13.1012 13.5547 13.6206 16.7471 16.7588 16.8686 16.8785 21.5425 21.5565 23.5657 23.5718 k = 0.4821 0.2784 0.2624 ( 1164 PWs) bands (ev): -64.2260 -64.2260 -34.8335 -34.8314 -30.9702 -30.9668 -30.9014 -30.9014 -0.4254 -0.4101 8.8390 8.8481 8.9293 8.9583 8.9927 9.0194 12.8359 12.9044 13.0976 13.0979 13.5457 13.6247 16.7257 16.7445 16.8611 16.8680 21.5787 21.5953 23.5772 23.5844 k = 0.4792 0.2766 0.2722 ( 1160 PWs) bands (ev): -64.2259 -64.2259 -34.8338 -34.8313 -30.9704 -30.9664 -30.9019 -30.9019 -0.4230 -0.4053 8.8322 8.8448 8.9390 8.9669 9.0031 9.0305 12.8228 12.9034 13.0926 13.0940 13.5372 13.6291 16.7003 16.7274 16.8533 16.8557 21.6214 21.6403 23.5907 23.5991 k = 0.4762 0.2749 0.2819 ( 1158 PWs) bands (ev): -64.2259 -64.2259 -34.8341 -34.8314 -30.9706 -30.9661 -30.9026 -30.9025 -0.4201 -0.3999 8.8234 8.8396 8.9511 8.9765 9.0168 9.0435 12.8081 12.9011 13.0858 13.0892 13.5298 13.6340 16.6709 16.7074 16.8418 16.8450 21.6702 21.6914 23.6062 23.6158 k = 0.4732 0.2732 0.2916 ( 1158 PWs) bands (ev): -64.2258 -64.2258 -34.8345 -34.8314 -30.9709 -30.9657 -30.9032 -30.9031 -0.4167 -0.3941 8.8129 8.8323 8.9653 8.9877 9.0333 9.0586 12.7914 12.8974 13.0768 13.0836 13.5239 13.6395 16.6378 16.6843 16.8267 16.8362 21.7249 21.7482 23.6235 23.6344 k = 0.4702 0.2715 0.3013 ( 1160 PWs) bands (ev): -64.2258 -64.2258 -34.8349 -34.8314 -30.9711 -30.9653 -30.9040 -30.9038 -0.4128 -0.3879 8.8008 8.8230 8.9815 9.0008 9.0524 9.0756 12.7726 12.8923 13.0649 13.0771 13.5202 13.6460 16.6015 16.6580 16.8105 16.8265 21.7853 21.8105 23.6426 23.6547 k = 0.4673 0.2698 0.3110 ( 1160 PWs) bands (ev): -64.2257 -64.2257 -34.8353 -34.8315 -30.9713 -30.9650 -30.9049 -30.9046 -0.4084 -0.3812 8.7873 8.8119 8.9997 9.0158 9.0738 9.0948 12.7516 12.8859 13.0500 13.0700 13.5192 13.6537 16.5623 16.6288 16.7934 16.8160 21.8511 21.8781 23.6635 23.6768 k = 0.4643 0.2681 0.3208 ( 1158 PWs) bands (ev): -64.2256 -64.2256 -34.8357 -34.8316 -30.9715 -30.9646 -30.9058 -30.9054 -0.4036 -0.3741 8.7725 8.7992 9.0197 9.0327 9.0976 9.1160 12.7282 12.8779 13.0319 13.0621 13.5214 13.6628 16.5203 16.5966 16.7753 16.8044 21.9220 21.9504 23.6859 23.7005 k = 0.4613 0.2663 0.3305 ( 1158 PWs) bands (ev): -64.2256 -64.2256 -34.8361 -34.8318 -30.9717 -30.9642 -30.9067 -30.9063 -0.3984 -0.3667 8.7565 8.7850 9.0414 9.0514 9.1235 9.1393 12.7021 12.8682 13.0105 13.0537 13.5269 13.6733 16.4760 16.5616 16.7564 16.7918 21.9976 22.0274 23.7099 23.7259 k = 0.4583 0.2646 0.3402 ( 1156 PWs) bands (ev): -64.2255 -64.2255 -34.8366 -34.8319 -30.9718 -30.9638 -30.9078 -30.9072 -0.3928 -0.3589 8.7394 8.7695 9.0648 9.0719 9.1517 9.1646 12.6734 12.8562 12.9864 13.0447 13.5358 13.6855 16.4294 16.5240 16.7366 16.7779 22.0777 22.1085 23.7354 23.7528 k = 0.4554 0.2629 0.3499 ( 1158 PWs) bands (ev): -64.2254 -64.2254 -34.8370 -34.8321 -30.9720 -30.9634 -30.9089 -30.9082 -0.3868 -0.3509 8.7214 8.7528 9.0897 9.0939 9.1821 9.1921 12.6419 12.8412 12.9604 13.0353 13.5479 13.6992 16.3808 16.4840 16.7158 16.7629 22.1618 22.1934 23.7623 23.7812 k = 0.4524 0.2612 0.3596 ( 1156 PWs) bands (ev): -64.2254 -64.2254 -34.8375 -34.8322 -30.9722 -30.9630 -30.9100 -30.9092 -0.3805 -0.3426 8.7025 8.7352 9.1162 9.1173 9.2146 9.2217 12.6076 12.8221 12.9342 13.0258 13.5632 13.7145 16.3303 16.4419 16.6940 16.7465 22.2495 22.2817 23.7907 23.8112 k = 0.4494 0.2595 0.3694 ( 1154 PWs) bands (ev): -64.2253 -64.2253 -34.8379 -34.8324 -30.9724 -30.9626 -30.9112 -30.9102 -0.3738 -0.3340 8.6830 8.7167 9.1422 9.1440 9.2494 9.2534 12.5704 12.7972 12.9097 13.0161 13.5813 13.7315 16.2783 16.3978 16.6711 16.7289 22.3405 22.3730 23.8205 23.8427 k = 0.4464 0.2577 0.3791 ( 1155 PWs) bands (ev): -64.2252 -64.2252 -34.8384 -34.8327 -30.9725 -30.9622 -30.9124 -30.9113 -0.3670 -0.3253 8.6628 8.6975 9.1683 9.1730 9.2863 9.2872 12.5304 12.7655 12.8882 13.0065 13.6020 13.7499 16.2246 16.3519 16.6472 16.7099 22.4341 22.4667 23.8517 23.8759 k = 0.4435 0.2560 0.3888 ( 1155 PWs) bands (ev): -64.2251 -64.2251 -34.8389 -34.8329 -30.9727 -30.9619 -30.9137 -30.9124 -0.3599 -0.3164 8.6420 8.6777 9.1955 9.2032 9.3232 9.3254 12.4878 12.7271 12.8702 12.9969 13.6250 13.7696 16.1697 16.3045 16.6221 16.6895 22.5301 22.5622 23.8846 23.9109 k = 0.4405 0.2543 0.3985 ( 1159 PWs) bands (ev): -64.2250 -64.2250 -34.8394 -34.8332 -30.9729 -30.9615 -30.9150 -30.9135 -0.3526 -0.3075 8.6209 8.6573 9.2237 9.2343 9.3613 9.3667 12.4426 12.6832 12.8548 12.9876 13.6500 13.7906 16.1136 16.2558 16.5957 16.6676 22.6276 22.6590 23.9191 23.9478 k = 0.4375 0.2526 0.4082 ( 1157 PWs) bands (ev): -64.2249 -64.2249 -34.8398 -34.8334 -30.9731 -30.9611 -30.9163 -30.9146 -0.3451 -0.2984 8.5993 8.6366 9.2529 9.2665 9.4017 9.4102 12.3951 12.6351 12.8415 12.9787 13.6768 13.8127 16.0565 16.2059 16.5683 16.6445 22.7262 22.7564 23.9556 23.9871 k = 0.4345 0.2509 0.4180 ( 1157 PWs) bands (ev): -64.2249 -64.2249 -34.8403 -34.8337 -30.9732 -30.9607 -30.9177 -30.9157 -0.3376 -0.2894 8.5776 8.6154 9.2830 9.2994 9.4441 9.4558 12.3453 12.5835 12.8295 12.9702 13.7049 13.8356 15.9985 16.1551 16.5396 16.6199 22.8249 22.8534 23.9945 24.0291 k = 0.4315 0.2492 0.4277 ( 1153 PWs) bands (ev): -64.2247 -64.2247 -34.8408 -34.8340 -30.9734 -30.9603 -30.9190 -30.9168 -0.3299 -0.2803 8.5556 8.5941 9.3138 9.3329 9.4887 9.5035 12.2938 12.5293 12.8187 12.9623 13.7344 13.8593 15.9398 16.1036 16.5098 16.5940 22.9229 22.9493 24.0361 24.0742 k = 0.4286 0.2474 0.4374 ( 1157 PWs) bands (ev): -64.2247 -64.2247 -34.8412 -34.8343 -30.9736 -30.9599 -30.9204 -30.9179 -0.3222 -0.2713 8.5334 8.5725 9.3452 9.3670 9.5353 9.5532 12.2403 12.4728 12.8088 12.9550 13.7647 13.8832 15.8806 16.0516 16.4788 16.5666 23.0192 23.0429 24.0811 24.1232 k = 0.4256 0.2457 0.4471 ( 1151 PWs) bands (ev): -64.2246 -64.2246 -34.8417 -34.8345 -30.9738 -30.9596 -30.9217 -30.9189 -0.3145 -0.2624 8.5113 8.5508 9.3772 9.4015 9.5839 9.6049 12.1855 12.4149 12.7998 12.9484 13.7958 13.9074 15.8212 15.9996 16.4467 16.5381 23.1127 23.1331 24.1302 24.1766 k = 0.4226 0.2440 0.4568 ( 1151 PWs) bands (ev): -64.2245 -64.2245 -34.8421 -34.8349 -30.9739 -30.9592 -30.9230 -30.9200 -0.3068 -0.2536 8.4892 8.5291 9.4095 9.4363 9.6345 9.6585 12.1295 12.3557 12.7918 12.9427 13.8272 13.9314 15.7617 15.9476 16.4134 16.5081 23.2021 23.2188 24.1841 24.2353 k = 0.4196 0.2423 0.4666 ( 1151 PWs) bands (ev): -64.2244 -64.2244 -34.8426 -34.8352 -30.9741 -30.9589 -30.9243 -30.9210 -0.2992 -0.2450 8.4671 8.5074 9.4420 9.4712 9.6867 9.7138 12.0725 12.2957 12.7846 12.9378 13.8586 13.9549 15.7023 15.8960 16.3792 16.4770 23.2861 23.2988 24.2436 24.2998 k = 0.4167 0.2406 0.4763 ( 1151 PWs) bands (ev): -64.2243 -64.2243 -34.8430 -34.8355 -30.9743 -30.9586 -30.9256 -30.9220 -0.2917 -0.2366 8.4452 8.4857 9.4747 9.5061 9.7406 9.7708 12.0151 12.2353 12.7785 12.9339 13.8899 13.9775 15.6436 15.8452 16.3438 16.4446 23.3635 23.3722 24.3095 24.3707 k = 0.4137 0.2388 0.4860 ( 1153 PWs) bands (ev): -64.2242 -64.2242 -34.8434 -34.8358 -30.9745 -30.9584 -30.9268 -30.9229 -0.2843 -0.2285 8.4234 8.4641 9.5073 9.5408 9.7958 9.8292 11.9574 12.1748 12.7734 12.9310 13.9204 13.9989 15.5857 15.7957 16.3074 16.4111 23.4334 23.4380 24.3821 24.4483 k = 0.4107 0.2371 0.4957 ( 1151 PWs) bands (ev): -64.2241 -64.2241 -34.8438 -34.8361 -30.9747 -30.9582 -30.9280 -30.9238 -0.2772 -0.2206 8.4018 8.4428 9.5398 9.5753 9.8522 9.8888 11.9000 12.1148 12.7696 12.9292 13.9500 14.0185 15.5293 15.7479 16.2703 16.3766 23.4950 23.4961 24.4616 24.5323 k = 0.4077 0.2354 0.5055 ( 1151 PWs) bands (ev): -64.2241 -64.2241 -34.8442 -34.8364 -30.9749 -30.9580 -30.9291 -30.9247 -0.2702 -0.2131 8.3805 8.4215 9.5720 9.6093 9.9095 9.9493 11.8432 12.0557 12.7669 12.9287 13.9780 14.0361 15.4746 15.7024 16.2323 16.3410 23.5461 23.5481 24.5477 24.6225 k = 0.4048 0.2337 0.5152 ( 1151 PWs) bands (ev): -64.2240 -64.2240 -34.8445 -34.8367 -30.9752 -30.9579 -30.9302 -30.9255 -0.2635 -0.2059 8.3595 8.4006 9.6037 9.6428 9.9672 10.0103 11.7876 11.9980 12.7655 12.9294 14.0039 14.0509 15.4225 15.6596 16.1936 16.3047 23.5883 23.5928 24.6397 24.7179 k = 0.4018 0.2320 0.5249 ( 1147 PWs) bands (ev): -64.2239 -64.2239 -34.8449 -34.8370 -30.9754 -30.9578 -30.9311 -30.9262 -0.2570 -0.1991 8.3388 8.3799 9.6349 9.6755 10.0248 10.0714 11.7338 11.9424 12.7656 12.9314 14.0272 14.0626 15.3736 15.6203 16.1544 16.2676 23.6229 23.6294 24.7364 24.8176 k = 0.3988 0.2303 0.5346 ( 1148 PWs) bands (ev): -64.2238 -64.2238 -34.8452 -34.8372 -30.9756 -30.9578 -30.9319 -30.9269 -0.2509 -0.1927 8.3184 8.3594 9.6653 9.7073 10.0819 10.1318 11.6824 11.8893 12.7671 12.9347 14.0470 14.0705 15.3285 15.5848 16.1147 16.2299 23.6504 23.6582 24.8366 24.9204 k = 0.3958 0.2285 0.5443 ( 1143 PWs) bands (ev): -64.2237 -64.2237 -34.8455 -34.8375 -30.9758 -30.9579 -30.9327 -30.9275 -0.2451 -0.1867 8.2983 8.3392 9.6948 9.7381 10.1377 10.1909 11.6344 11.8397 12.7702 12.9396 14.0627 14.0743 15.2883 15.5540 16.0748 16.1918 23.6712 23.6798 24.9390 25.0250 k = 0.3929 0.2268 0.5541 ( 1143 PWs) bands (ev): -64.2237 -64.2237 -34.8457 -34.8378 -30.9760 -30.9580 -30.9333 -30.9280 -0.2396 -0.1813 8.2786 8.3193 9.7232 9.7676 10.1912 10.2476 11.5908 11.7945 12.7749 12.9458 14.0734 14.0736 15.2537 15.5282 16.0347 16.1533 23.6854 23.6943 25.0422 25.1302 k = 0.3899 0.2251 0.5638 ( 1143 PWs) bands (ev): -64.2236 -64.2236 -34.8460 -34.8380 -30.9762 -30.9582 -30.9338 -30.9285 -0.2346 -0.1764 8.2592 8.2997 9.7505 9.7958 10.2416 10.3007 11.5529 11.7545 12.7810 12.9534 14.0677 14.0789 15.2256 15.5081 15.9946 16.1146 23.6934 23.7023 25.1446 25.2344 k = 0.3869 0.2234 0.5735 ( 1143 PWs) bands (ev): -64.2236 -64.2236 -34.8462 -34.8382 -30.9764 -30.9584 -30.9342 -30.9289 -0.2300 -0.1720 8.2402 8.2803 9.7764 9.8224 10.2877 10.3487 11.5221 11.7211 12.7889 12.9625 14.0569 14.0783 15.2045 15.4937 15.9547 16.0759 23.6952 23.7037 25.2446 25.3363 k = 0.3839 0.2217 0.5832 ( 1145 PWs) bands (ev): -64.2236 -64.2236 -34.8463 -34.8384 -30.9766 -30.9587 -30.9344 -30.9292 -0.2259 -0.1681 8.2215 8.2612 9.8009 9.8474 10.3282 10.3900 11.5000 11.6952 12.7983 12.9730 14.0413 14.0716 15.1909 15.4852 15.9152 16.0374 23.6909 23.6987 25.3404 25.4340 k = 0.3810 0.2199 0.5929 ( 1143 PWs) bands (ev): -64.2235 -64.2235 -34.8465 -34.8386 -30.9767 -30.9591 -30.9346 -30.9295 -0.2223 -0.1649 8.2031 8.2424 9.8238 9.8706 10.3619 10.4230 11.4882 11.6782 12.8095 12.9849 14.0211 14.0589 15.1849 15.4827 15.8764 15.9995 23.6804 23.6872 25.4303 25.5255 k = 0.3780 0.2182 0.6027 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8388 -30.9768 -30.9595 -30.9346 -30.9297 -0.2192 -0.1622 8.1850 8.2238 9.8450 9.8918 10.3877 10.4462 11.4879 11.6708 12.8222 12.9982 13.9968 14.0407 15.1864 15.4859 15.8385 15.9621 23.6637 23.6691 25.5121 25.6086 k = 0.3750 0.2165 0.6124 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.6250-0.0722 0.4082 ( 1144 PWs) bands (ev): -64.2235 -64.2235 -34.8466 -34.8390 -30.9769 -30.9599 -30.9345 -30.9298 -0.2166 -0.1602 8.1672 8.2055 9.8644 9.9111 10.4048 10.4588 11.4997 11.6737 12.8365 13.0126 13.9691 14.0179 15.1948 15.4944 15.8019 15.9256 23.6407 23.6444 25.5840 25.6811 k = 0.6198-0.0812 0.4082 ( 1144 PWs) bands (ev): -64.2234 -64.2234 -34.8467 -34.8392 -30.9771 -30.9607 -30.9343 -30.9300 -0.2127 -0.1575 8.1362 8.1735 9.8965 9.9427 10.4232 10.4675 11.5361 11.6921 12.8629 13.0388 13.9201 13.9770 15.2133 15.5114 15.7398 15.8633 23.5944 23.5950 25.6965 25.7933 k = 0.6146-0.0902 0.4082 ( 1144 PWs) bands (ev): -64.2234 -64.2234 -34.8468 -34.8394 -30.9772 -30.9615 -30.9340 -30.9301 -0.2090 -0.1551 8.1053 8.1414 9.9283 9.9739 10.4349 10.4690 11.5808 11.7180 12.8894 13.0648 13.8755 13.9412 15.2281 15.5235 15.6801 15.8021 23.5451 23.5473 25.7993 25.8950 k = 0.6094-0.0992 0.4082 ( 1144 PWs) bands (ev): -64.2234 -64.2234 -34.8468 -34.8396 -30.9774 -30.9624 -30.9337 -30.9301 -0.2057 -0.1532 8.0745 8.1094 9.9597 10.0046 10.4410 10.4653 11.6315 11.7494 12.9160 13.0904 13.8357 13.9111 15.2388 15.5275 15.6260 15.7422 23.4948 23.4998 25.8901 25.9829 k = 0.6042-0.1083 0.4082 ( 1144 PWs) bands (ev): -64.2233 -64.2233 -34.8468 -34.8398 -30.9775 -30.9632 -30.9333 -30.9301 -0.2025 -0.1516 8.0440 8.0775 9.9907 10.0348 10.4428 10.4581 11.6855 11.7846 12.9428 13.1157 13.8016 13.8872 15.2450 15.5126 15.5879 15.6839 23.4445 23.4521 25.9666 26.0545 k = 0.5990-0.1173 0.4082 ( 1148 PWs) bands (ev): -64.2233 -64.2233 -34.8468 -34.8401 -30.9776 -30.9641 -30.9329 -30.9301 -0.1996 -0.1504 8.0139 8.0460 10.0210 10.0643 10.4413 10.4487 11.7406 11.8214 12.9698 13.1404 13.7739 13.8702 15.2464 15.4716 15.5731 15.6275 23.3943 23.4042 26.0280 26.1089 k = 0.5938-0.1263 0.4082 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8467 -34.8403 -30.9777 -30.9649 -30.9324 -30.9300 -0.1969 -0.1494 7.9844 8.0149 10.0507 10.0929 10.4375 10.4383 11.7949 11.8582 12.9969 13.1646 13.7531 13.8605 15.2427 15.4196 15.5666 15.5734 23.3445 23.3566 26.0754 26.1482 k = 0.5885-0.1353 0.4082 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8467 -34.8405 -30.9778 -30.9657 -30.9320 -30.9299 -0.1944 -0.1488 7.9555 7.9845 10.0796 10.1208 10.4276 10.4323 11.8466 11.8934 13.0243 13.1881 13.7402 13.8587 15.2334 15.3658 15.5221 15.5594 23.2955 23.3095 26.1113 26.1761 k = 0.5833-0.1443 0.4082 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8466 -34.8407 -30.9778 -30.9666 -30.9315 -30.9298 -0.1920 -0.1485 7.9274 7.9548 10.1077 10.1477 10.4173 10.4264 11.8943 11.9259 13.0519 13.2110 13.7356 13.8650 15.2184 15.3125 15.4739 15.5491 23.2475 23.2631 26.1383 26.1960 k = 0.5781-0.1534 0.4082 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8465 -34.8409 -30.9779 -30.9674 -30.9311 -30.9296 -0.1897 -0.1484 7.9003 7.9261 10.1349 10.1735 10.4077 10.4201 11.9368 11.9546 13.0797 13.2330 13.7398 13.8796 15.1975 15.2606 15.4288 15.5350 23.2007 23.2176 26.1590 26.2104 k = 0.5729-0.1624 0.4082 ( 1154 PWs) bands (ev): -64.2233 -64.2233 -34.8464 -34.8411 -30.9779 -30.9682 -30.9306 -30.9294 -0.1876 -0.1485 7.8743 7.8984 10.1610 10.1982 10.3992 10.4139 11.9736 11.9790 13.1074 13.2543 13.7530 13.9025 15.1712 15.2106 15.3868 15.5167 23.1555 23.1734 26.1752 26.2211 k = 0.5677-0.1714 0.4082 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8462 -34.8412 -30.9780 -30.9689 -30.9302 -30.9292 -0.1856 -0.1488 7.8496 7.8719 10.1860 10.2217 10.3918 10.4081 11.9991 12.0041 13.1350 13.2746 13.7750 13.9335 15.1402 15.1628 15.3473 15.4943 23.1122 23.1307 26.1883 26.2293 k = 0.5625-0.1804 0.4082 ( 1150 PWs) bands (ev): -64.2233 -64.2233 -34.8461 -34.8414 -30.9780 -30.9697 -30.9297 -30.9289 -0.1837 -0.1494 7.8261 7.8468 10.2097 10.2437 10.3856 10.4027 12.0147 12.0282 13.1621 13.2939 13.8056 13.9721 15.1056 15.1176 15.3091 15.4674 23.0709 23.0897 26.1990 26.2357 k = 0.5573-0.1894 0.4082 ( 1142 PWs) bands (ev): -64.2232 -64.2232 -34.8459 -34.8416 -30.9780 -30.9704 -30.9293 -30.9287 -0.1818 -0.1501 7.8042 7.8231 10.2321 10.2643 10.3806 10.3979 12.0264 12.0464 13.1888 13.3123 13.8442 14.0177 15.0689 15.0754 15.2714 15.4363 23.0320 23.0508 26.2080 26.2408 k = 0.5521-0.1985 0.4082 ( 1142 PWs) bands (ev): -64.2232 -64.2232 -34.8458 -34.8418 -30.9779 -30.9711 -30.9289 -30.9284 -0.1801 -0.1509 7.7838 7.8010 10.2529 10.2834 10.3768 10.3936 12.0344 12.0590 13.2145 13.3292 13.8897 14.0692 15.0310 15.0363 15.2333 15.4008 22.9956 23.0140 26.2157 26.2448 k = 0.5469-0.2075 0.4082 ( 1146 PWs) bands (ev): -64.2232 -64.2232 -34.8456 -34.8420 -30.9779 -30.9718 -30.9286 -30.9282 -0.1783 -0.1519 7.7651 7.7806 10.2723 10.3007 10.3740 10.3899 12.0395 12.0667 13.2390 13.3444 13.9411 14.1258 14.9930 15.0006 15.1943 15.3611 22.9621 22.9798 26.2223 26.2481 k = 0.5417-0.2165 0.4082 ( 1142 PWs) bands (ev): -64.2232 -64.2232 -34.8454 -34.8422 -30.9778 -30.9724 -30.9282 -30.9280 -0.1767 -0.1530 7.7483 7.7620 10.2899 10.3164 10.3722 10.3867 12.0424 12.0706 13.2624 13.3581 13.9976 14.1863 14.9556 14.9687 15.1544 15.3175 22.9318 22.9484 26.2281 26.2507 k = 0.5365-0.2255 0.4082 ( 1144 PWs) bands (ev): -64.2232 -64.2232 -34.8452 -34.8424 -30.9777 -30.9730 -30.9279 -30.9278 -0.1750 -0.1542 7.7332 7.7453 10.3058 10.3302 10.3714 10.3839 12.0435 12.0713 13.2844 13.3699 14.0577 14.2492 14.9195 14.9409 15.1137 15.2700 22.9046 22.9198 26.2332 26.2527 k = 0.5312-0.2345 0.4082 ( 1152 PWs) bands (ev): -64.2233 -64.2233 -34.8451 -34.8426 -30.9776 -30.9736 -30.9277 -30.9276 -0.1734 -0.1554 7.7202 7.7305 10.3198 10.3421 10.3713 10.3815 12.0436 12.0696 13.3047 13.3794 14.1203 14.3127 14.8852 14.9175 15.0727 15.2188 22.8808 22.8944 26.2376 26.2541 k = 0.5260-0.2436 0.4082 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8449 -34.8428 -30.9775 -30.9741 -30.9275 -30.9274 -0.1718 -0.1568 7.7091 7.7177 10.3318 10.3520 10.3719 10.3794 12.0432 12.0664 13.3234 13.3868 14.1842 14.3747 14.8538 14.8989 15.0325 15.1647 22.8607 22.8724 26.2415 26.2551 k = 0.5208-0.2526 0.4082 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8447 -34.8430 -30.9773 -30.9746 -30.9273 -30.9273 -0.1703 -0.1582 7.7002 7.7070 10.3419 10.3598 10.3730 10.3777 12.0428 12.0624 13.3403 13.3919 14.2482 14.4312 14.8276 14.8855 14.9945 15.1080 22.8443 22.8540 26.2449 26.2557 k = 0.5156-0.2616 0.4082 ( 1156 PWs) bands (ev): -64.2233 -64.2233 -34.8445 -34.8432 -30.9771 -30.9751 -30.9272 -30.9272 -0.1687 -0.1596 7.6934 7.6985 10.3500 10.3650 10.3745 10.3767 12.0428 12.0580 13.3552 13.3944 14.3107 14.4758 14.8111 14.8774 14.9600 15.0495 22.8317 22.8392 26.2478 26.2558 k = 0.5104-0.2706 0.4082 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8443 -34.8435 -30.9768 -30.9755 -30.9271 -30.9271 -0.1672 -0.1611 7.6887 7.6921 10.3562 10.3671 10.3761 10.3767 12.0433 12.0537 13.3678 13.3942 14.3699 14.4993 14.8121 14.8751 14.9305 14.9904 22.8230 22.8280 26.2502 26.2555 k = 0.5052-0.2797 0.4082 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8441 -34.8437 -30.9765 -30.9759 -30.9271 -30.9271 -0.1656 -0.1626 7.6863 7.6880 10.3608 10.3664 10.3774 10.3776 12.0447 12.0499 13.3782 13.3915 14.4234 14.4953 14.8357 14.8786 14.9073 14.9329 22.8183 22.8209 26.2522 26.2548 k = 0.5000-0.2887 0.4082 ( 1162 PWs) bands (ev): -64.2233 -64.2233 -34.8439 -34.8439 -30.9762 -30.9762 -30.9270 -30.9270 -0.1641 -0.1641 7.6860 7.6860 10.3642 10.3642 10.3779 10.3779 12.0469 12.0469 13.3861 13.3861 14.4673 14.4673 14.8757 14.8757 14.8929 14.8929 22.8176 22.8176 26.2537 26.2537 Writing output data file RhN.save init_run : 3.04s CPU 13.22s WALL ( 1 calls) electrons : 150.74s CPU 154.79s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.23s CPU 1.39s WALL ( 1 calls) Called by electrons: c_bands : 150.69s CPU 154.39s WALL ( 1 calls) v_of_rho : 0.05s CPU 0.82s WALL ( 1 calls) v_h : 0.01s CPU 0.01s WALL ( 1 calls) v_xc : 0.04s CPU 0.42s WALL ( 1 calls) newd : 0.12s CPU 0.39s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.06s WALL ( 447 calls) cegterg : 120.65s CPU 121.60s WALL ( 494 calls) Called by sum_band: Called by *egterg: h_psi : 54.69s CPU 58.50s WALL ( 7786 calls) s_psi : 3.16s CPU 3.74s WALL ( 7786 calls) g_psi : 0.07s CPU 0.11s WALL ( 6845 calls) cdiaghg : 48.46s CPU 47.02s WALL ( 7292 calls) cegterg:over : 10.58s CPU 9.19s WALL ( 6845 calls) cegterg:upda : 0.31s CPU 1.23s WALL ( 6845 calls) cegterg:last : 0.43s CPU 0.87s WALL ( 1434 calls) Called by h_psi: h_psi:vloc : 47.58s CPU 50.86s WALL ( 7786 calls) h_psi:vnl : 7.08s CPU 7.41s WALL ( 7786 calls) add_vuspsi : 1.14s CPU 2.54s WALL ( 7786 calls) General routines calbec : 5.93s CPU 4.75s WALL ( 7786 calls) fft : 0.18s CPU 0.99s WALL ( 19 calls) ffts : 0.04s CPU 0.08s WALL ( 4 calls) fftw : 46.06s CPU 48.58s WALL ( 583420 calls) interpolate : 0.04s CPU 0.10s WALL ( 4 calls) davcio : 0.02s CPU 0.34s WALL ( 894 calls) Parallel routines fft_scatter : 33.79s CPU 33.25s WALL ( 583443 calls) PWSCF : 3m 3.07s CPU 4m13.39s WALL This run was terminated on: 11:56:33 26Aug2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=