Program PWSCF v.5.1.1 starts on 23Jul2015 at 15:54:38 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: ./YH3.save/ file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 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 11 8 2 315 186 30 Max 12 9 3 324 201 37 Sum 573 419 131 15439 9327 1645 Message from routine sym_rho_init: likely internal error: no G-vectors found bravais-lattice index = 14 lattice parameter (alat) = 6.2085 a.u. unit-cell volume = 220.1440 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 28.00 number of Kohn-Sham states= 36 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 258.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.208477 celldm(2)= 1.000000 celldm(3)= 1.259822 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.683232 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.683232 0.730201 0.000000 ) a(3) = ( 0.000000 0.000000 1.259822 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.935677 -0.000000 ) b(2) = ( 0.000000 1.369486 -0.000000 ) b(3) = ( 0.000000 0.000000 0.793763 ) PseudoPot. # 1 for H read from file: /home/autes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Y read from file: /home/autes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) Y 11.00 88.90590 Y( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.6299110 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.6299110 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 570 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 2) = ( 0.0041257 0.0095103 -0.0000000), wk = 0.0017544 k( 3) = ( 0.0082513 0.0190206 -0.0000000), wk = 0.0017544 k( 4) = ( 0.0123770 0.0285310 -0.0000000), wk = 0.0017544 k( 5) = ( 0.0165026 0.0380413 -0.0000000), wk = 0.0017544 k( 6) = ( 0.0206283 0.0475516 -0.0000000), wk = 0.0017544 k( 7) = ( 0.0247540 0.0570619 -0.0000000), wk = 0.0017544 k( 8) = ( 0.0288796 0.0665722 -0.0000000), wk = 0.0017544 k( 9) = ( 0.0330053 0.0760825 -0.0000000), wk = 0.0017544 k( 10) = ( 0.0371309 0.0855929 -0.0000000), wk = 0.0017544 k( 11) = ( 0.0412566 0.0951032 -0.0000000), wk = 0.0017544 k( 12) = ( 0.0453823 0.1046135 -0.0000000), wk = 0.0017544 k( 13) = ( 0.0495079 0.1141238 -0.0000000), wk = 0.0017544 k( 14) = ( 0.0536336 0.1236341 -0.0000000), wk = 0.0017544 k( 15) = ( 0.0577592 0.1331444 -0.0000000), wk = 0.0017544 k( 16) = ( 0.0618849 0.1426548 -0.0000000), wk = 0.0017544 k( 17) = ( 0.0660106 0.1521651 -0.0000000), wk = 0.0017544 k( 18) = ( 0.0701362 0.1616754 -0.0000000), wk = 0.0017544 k( 19) = ( 0.0742619 0.1711857 -0.0000000), wk = 0.0017544 k( 20) = ( 0.0783875 0.1806960 -0.0000000), wk = 0.0017544 k( 21) = ( 0.0825132 0.1902064 -0.0000000), wk = 0.0017544 k( 22) = ( 0.0866389 0.1997167 -0.0000000), wk = 0.0017544 k( 23) = ( 0.0907645 0.2092270 -0.0000000), wk = 0.0017544 k( 24) = ( 0.0948902 0.2187373 -0.0000000), wk = 0.0017544 k( 25) = ( 0.0990159 0.2282476 -0.0000000), wk = 0.0017544 k( 26) = ( 0.1031415 0.2377579 -0.0000000), wk = 0.0017544 k( 27) = ( 0.1072672 0.2472683 -0.0000000), wk = 0.0017544 k( 28) = ( 0.1113928 0.2567786 -0.0000000), wk = 0.0017544 k( 29) = ( 0.1155185 0.2662889 -0.0000000), wk = 0.0017544 k( 30) = ( 0.1196442 0.2757992 -0.0000000), wk = 0.0017544 k( 31) = ( 0.1237698 0.2853095 -0.0000000), wk = 0.0017544 k( 32) = ( 0.1278955 0.2948198 -0.0000000), wk = 0.0017544 k( 33) = ( 0.1320211 0.3043302 -0.0000000), wk = 0.0017544 k( 34) = ( 0.1361468 0.3138405 -0.0000000), wk = 0.0017544 k( 35) = ( 0.1402724 0.3233508 -0.0000000), wk = 0.0017544 k( 36) = ( 0.1443981 0.3328611 -0.0000000), wk = 0.0017544 k( 37) = ( 0.1485238 0.3423714 -0.0000000), wk = 0.0017544 k( 38) = ( 0.1526494 0.3518817 -0.0000000), wk = 0.0017544 k( 39) = ( 0.1567751 0.3613921 -0.0000000), wk = 0.0017544 k( 40) = ( 0.1609008 0.3709024 -0.0000000), wk = 0.0017544 k( 41) = ( 0.1650264 0.3804127 -0.0000000), wk = 0.0017544 k( 42) = ( 0.1691521 0.3899230 -0.0000000), wk = 0.0017544 k( 43) = ( 0.1732777 0.3994333 -0.0000000), wk = 0.0017544 k( 44) = ( 0.1774034 0.4089436 -0.0000000), wk = 0.0017544 k( 45) = ( 0.1815290 0.4184540 -0.0000000), wk = 0.0017544 k( 46) = ( 0.1856547 0.4279643 -0.0000000), wk = 0.0017544 k( 47) = ( 0.1897804 0.4374746 -0.0000000), wk = 0.0017544 k( 48) = ( 0.1939060 0.4469849 -0.0000000), wk = 0.0017544 k( 49) = ( 0.1980317 0.4564952 -0.0000000), wk = 0.0017544 k( 50) = ( 0.2021574 0.4660055 -0.0000000), wk = 0.0017544 k( 51) = ( 0.2062830 0.4755159 -0.0000000), wk = 0.0017544 k( 52) = ( 0.2104087 0.4850262 -0.0000000), wk = 0.0017544 k( 53) = ( 0.2145343 0.4945365 -0.0000000), wk = 0.0017544 k( 54) = ( 0.2186600 0.5040468 -0.0000000), wk = 0.0017544 k( 55) = ( 0.2227857 0.5135571 -0.0000000), wk = 0.0017544 k( 56) = ( 0.2269113 0.5230674 -0.0000000), wk = 0.0017544 k( 57) = ( 0.2310370 0.5325778 -0.0000000), wk = 0.0017544 k( 58) = ( 0.2351626 0.5420881 -0.0000000), wk = 0.0017544 k( 59) = ( 0.2392883 0.5515984 -0.0000000), wk = 0.0017544 k( 60) = ( 0.2434140 0.5611087 -0.0000000), wk = 0.0017544 k( 61) = ( 0.2475396 0.5706191 -0.0000000), wk = 0.0017544 k( 62) = ( 0.2516653 0.5801294 -0.0000000), wk = 0.0017544 k( 63) = ( 0.2557909 0.5896397 -0.0000000), wk = 0.0017544 k( 64) = ( 0.2599166 0.5991500 -0.0000000), wk = 0.0017544 k( 65) = ( 0.2640423 0.6086603 -0.0000000), wk = 0.0017544 k( 66) = ( 0.2681679 0.6181706 -0.0000000), wk = 0.0017544 k( 67) = ( 0.2722936 0.6276810 -0.0000000), wk = 0.0017544 k( 68) = ( 0.2764192 0.6371913 -0.0000000), wk = 0.0017544 k( 69) = ( 0.2805449 0.6467016 -0.0000000), wk = 0.0017544 k( 70) = ( 0.2846706 0.6562119 -0.0000000), wk = 0.0017544 k( 71) = ( 0.2887962 0.6657222 -0.0000000), wk = 0.0017544 k( 72) = ( 0.2929219 0.6752325 -0.0000000), wk = 0.0017544 k( 73) = ( 0.2970475 0.6847429 -0.0000000), wk = 0.0017544 k( 74) = ( 0.2970475 0.6847429 -0.0000000), wk = 0.0017544 k( 75) = ( 0.2868045 0.6847429 -0.0000000), wk = 0.0017544 k( 76) = ( 0.2765615 0.6847429 -0.0000000), wk = 0.0017544 k( 77) = ( 0.2663185 0.6847428 -0.0000000), wk = 0.0017544 k( 78) = ( 0.2560755 0.6847428 -0.0000000), wk = 0.0017544 k( 79) = ( 0.2458325 0.6847429 -0.0000000), wk = 0.0017544 k( 80) = ( 0.2355894 0.6847429 -0.0000000), wk = 0.0017544 k( 81) = ( 0.2253464 0.6847428 -0.0000000), wk = 0.0017544 k( 82) = ( 0.2151034 0.6847428 -0.0000000), wk = 0.0017544 k( 83) = ( 0.2048604 0.6847429 -0.0000000), wk = 0.0017544 k( 84) = ( 0.1946173 0.6847429 -0.0000000), wk = 0.0017544 k( 85) = ( 0.1843743 0.6847429 -0.0000000), wk = 0.0017544 k( 86) = ( 0.1741313 0.6847429 -0.0000000), wk = 0.0017544 k( 87) = ( 0.1638883 0.6847429 -0.0000000), wk = 0.0017544 k( 88) = ( 0.1536453 0.6847429 -0.0000000), wk = 0.0017544 k( 89) = ( 0.1434023 0.6847429 -0.0000000), wk = 0.0017544 k( 90) = ( 0.1331592 0.6847429 -0.0000000), wk = 0.0017544 k( 91) = ( 0.1229162 0.6847428 -0.0000000), wk = 0.0017544 k( 92) = ( 0.1126732 0.6847428 -0.0000000), wk = 0.0017544 k( 93) = ( 0.1024302 0.6847429 -0.0000000), wk = 0.0017544 k( 94) = ( 0.0921872 0.6847429 -0.0000000), wk = 0.0017544 k( 95) = ( 0.0819441 0.6847428 -0.0000000), wk = 0.0017544 k( 96) = ( 0.0717011 0.6847428 -0.0000000), wk = 0.0017544 k( 97) = ( 0.0614581 0.6847429 -0.0000000), wk = 0.0017544 k( 98) = ( 0.0512151 0.6847429 -0.0000000), wk = 0.0017544 k( 99) = ( 0.0409721 0.6847429 -0.0000000), wk = 0.0017544 k( 100) = ( 0.0307291 0.6847429 -0.0000000), wk = 0.0017544 k( 101) = ( 0.0204860 0.6847429 -0.0000000), wk = 0.0017544 k( 102) = ( 0.0102430 0.6847429 -0.0000000), wk = 0.0017544 k( 103) = ( 0.0000000 0.6847429 -0.0000000), wk = 0.0017544 k( 104) = ( 0.0000000 0.6847429 -0.0000000), wk = 0.0017544 k( 105) = ( 0.0000000 0.6847429 0.0104442), wk = 0.0017544 k( 106) = ( 0.0000000 0.6847429 0.0208885), wk = 0.0017544 k( 107) = ( 0.0000000 0.6847429 0.0313327), wk = 0.0017544 k( 108) = ( 0.0000000 0.6847429 0.0417770), wk = 0.0017544 k( 109) = ( 0.0000000 0.6847429 0.0522212), wk = 0.0017544 k( 110) = ( 0.0000000 0.6847429 0.0626655), wk = 0.0017544 k( 111) = ( 0.0000000 0.6847429 0.0731097), wk = 0.0017544 k( 112) = ( 0.0000000 0.6847429 0.0835540), wk = 0.0017544 k( 113) = ( 0.0000000 0.6847429 0.0939982), wk = 0.0017544 k( 114) = ( 0.0000000 0.6847429 0.1044425), wk = 0.0017544 k( 115) = ( 0.0000000 0.6847429 0.1148867), wk = 0.0017544 k( 116) = ( 0.0000000 0.6847429 0.1253310), wk = 0.0017544 k( 117) = ( 0.0000000 0.6847429 0.1357752), wk = 0.0017544 k( 118) = ( 0.0000000 0.6847429 0.1462195), wk = 0.0017544 k( 119) = ( 0.0000000 0.6847429 0.1566637), wk = 0.0017544 k( 120) = ( 0.0000000 0.6847429 0.1671080), wk = 0.0017544 k( 121) = ( 0.0000000 0.6847429 0.1775522), wk = 0.0017544 k( 122) = ( 0.0000000 0.6847429 0.1879965), wk = 0.0017544 k( 123) = ( 0.0000000 0.6847429 0.1984407), wk = 0.0017544 k( 124) = ( 0.0000000 0.6847429 0.2088850), wk = 0.0017544 k( 125) = ( 0.0000000 0.6847429 0.2193292), wk = 0.0017544 k( 126) = ( 0.0000000 0.6847429 0.2297735), wk = 0.0017544 k( 127) = ( 0.0000000 0.6847429 0.2402177), wk = 0.0017544 k( 128) = ( 0.0000000 0.6847429 0.2506620), wk = 0.0017544 k( 129) = ( 0.0000000 0.6847429 0.2611062), wk = 0.0017544 k( 130) = ( 0.0000000 0.6847429 0.2715505), wk = 0.0017544 k( 131) = ( 0.0000000 0.6847429 0.2819947), wk = 0.0017544 k( 132) = ( 0.0000000 0.6847429 0.2924390), wk = 0.0017544 k( 133) = ( 0.0000000 0.6847429 0.3028832), wk = 0.0017544 k( 134) = ( 0.0000000 0.6847429 0.3133275), wk = 0.0017544 k( 135) = ( 0.0000000 0.6847429 0.3237717), wk = 0.0017544 k( 136) = ( 0.0000000 0.6847429 0.3342160), wk = 0.0017544 k( 137) = ( 0.0000000 0.6847429 0.3446602), wk = 0.0017544 k( 138) = ( 0.0000000 0.6847429 0.3551045), wk = 0.0017544 k( 139) = ( 0.0000000 0.6847429 0.3655487), wk = 0.0017544 k( 140) = ( 0.0000000 0.6847429 0.3759930), wk = 0.0017544 k( 141) = ( 0.0000000 0.6847429 0.3864372), wk = 0.0017544 k( 142) = ( 0.0000000 0.6847429 0.3968814), wk = 0.0017544 k( 143) = ( 0.0000000 0.6847429 0.3968814), wk = 0.0017544 k( 144) = ( 0.0102430 0.6847429 0.3968814), wk = 0.0017544 k( 145) = ( 0.0204860 0.6847429 0.3968814), wk = 0.0017544 k( 146) = ( 0.0307291 0.6847429 0.3968814), wk = 0.0017544 k( 147) = ( 0.0409721 0.6847429 0.3968814), wk = 0.0017544 k( 148) = ( 0.0512151 0.6847429 0.3968814), wk = 0.0017544 k( 149) = ( 0.0614581 0.6847429 0.3968814), wk = 0.0017544 k( 150) = ( 0.0717011 0.6847428 0.3968814), wk = 0.0017544 k( 151) = ( 0.0819441 0.6847428 0.3968814), wk = 0.0017544 k( 152) = ( 0.0921872 0.6847429 0.3968814), wk = 0.0017544 k( 153) = ( 0.1024302 0.6847429 0.3968814), wk = 0.0017544 k( 154) = ( 0.1126732 0.6847428 0.3968814), wk = 0.0017544 k( 155) = ( 0.1229162 0.6847428 0.3968814), wk = 0.0017544 k( 156) = ( 0.1331592 0.6847429 0.3968814), wk = 0.0017544 k( 157) = ( 0.1434023 0.6847429 0.3968814), wk = 0.0017544 k( 158) = ( 0.1536453 0.6847429 0.3968814), wk = 0.0017544 k( 159) = ( 0.1638883 0.6847429 0.3968814), wk = 0.0017544 k( 160) = ( 0.1741313 0.6847429 0.3968814), wk = 0.0017544 k( 161) = ( 0.1843743 0.6847429 0.3968814), wk = 0.0017544 k( 162) = ( 0.1946173 0.6847429 0.3968814), wk = 0.0017544 k( 163) = ( 0.2048604 0.6847429 0.3968814), wk = 0.0017544 k( 164) = ( 0.2151034 0.6847428 0.3968814), wk = 0.0017544 k( 165) = ( 0.2253464 0.6847428 0.3968814), wk = 0.0017544 k( 166) = ( 0.2355894 0.6847429 0.3968814), wk = 0.0017544 k( 167) = ( 0.2458325 0.6847429 0.3968814), wk = 0.0017544 k( 168) = ( 0.2560755 0.6847428 0.3968814), wk = 0.0017544 k( 169) = ( 0.2663185 0.6847428 0.3968814), wk = 0.0017544 k( 170) = ( 0.2765615 0.6847429 0.3968814), wk = 0.0017544 k( 171) = ( 0.2868045 0.6847429 0.3968814), wk = 0.0017544 k( 172) = ( 0.2970475 0.6847429 0.3968814), wk = 0.0017544 k( 173) = ( 0.2970475 0.6847429 0.3968814), wk = 0.0017544 k( 174) = ( 0.2929219 0.6752325 0.3968814), wk = 0.0017544 k( 175) = ( 0.2887962 0.6657222 0.3968814), wk = 0.0017544 k( 176) = ( 0.2846706 0.6562119 0.3968814), wk = 0.0017544 k( 177) = ( 0.2805449 0.6467016 0.3968814), wk = 0.0017544 k( 178) = ( 0.2764192 0.6371913 0.3968814), wk = 0.0017544 k( 179) = ( 0.2722936 0.6276810 0.3968814), wk = 0.0017544 k( 180) = ( 0.2681679 0.6181706 0.3968814), wk = 0.0017544 k( 181) = ( 0.2640423 0.6086603 0.3968814), wk = 0.0017544 k( 182) = ( 0.2599166 0.5991500 0.3968814), wk = 0.0017544 k( 183) = ( 0.2557909 0.5896397 0.3968814), wk = 0.0017544 k( 184) = ( 0.2516653 0.5801294 0.3968814), wk = 0.0017544 k( 185) = ( 0.2475396 0.5706191 0.3968814), wk = 0.0017544 k( 186) = ( 0.2434140 0.5611087 0.3968814), wk = 0.0017544 k( 187) = ( 0.2392883 0.5515984 0.3968814), wk = 0.0017544 k( 188) = ( 0.2351626 0.5420881 0.3968814), wk = 0.0017544 k( 189) = ( 0.2310370 0.5325778 0.3968814), wk = 0.0017544 k( 190) = ( 0.2269113 0.5230674 0.3968814), wk = 0.0017544 k( 191) = ( 0.2227857 0.5135571 0.3968814), wk = 0.0017544 k( 192) = ( 0.2186600 0.5040468 0.3968814), wk = 0.0017544 k( 193) = ( 0.2145343 0.4945365 0.3968814), wk = 0.0017544 k( 194) = ( 0.2104087 0.4850262 0.3968814), wk = 0.0017544 k( 195) = ( 0.2062830 0.4755159 0.3968814), wk = 0.0017544 k( 196) = ( 0.2021574 0.4660055 0.3968814), wk = 0.0017544 k( 197) = ( 0.1980317 0.4564952 0.3968814), wk = 0.0017544 k( 198) = ( 0.1939060 0.4469849 0.3968814), wk = 0.0017544 k( 199) = ( 0.1897804 0.4374746 0.3968814), wk = 0.0017544 k( 200) = ( 0.1856547 0.4279643 0.3968814), wk = 0.0017544 k( 201) = ( 0.1815290 0.4184540 0.3968814), wk = 0.0017544 k( 202) = ( 0.1774034 0.4089436 0.3968814), wk = 0.0017544 k( 203) = ( 0.1732777 0.3994333 0.3968814), wk = 0.0017544 k( 204) = ( 0.1691521 0.3899230 0.3968814), wk = 0.0017544 k( 205) = ( 0.1650264 0.3804127 0.3968814), wk = 0.0017544 k( 206) = ( 0.1609008 0.3709024 0.3968814), wk = 0.0017544 k( 207) = ( 0.1567751 0.3613921 0.3968814), wk = 0.0017544 k( 208) = ( 0.1526494 0.3518817 0.3968814), wk = 0.0017544 k( 209) = ( 0.1485238 0.3423714 0.3968814), wk = 0.0017544 k( 210) = ( 0.1443981 0.3328611 0.3968814), wk = 0.0017544 k( 211) = ( 0.1402724 0.3233508 0.3968814), wk = 0.0017544 k( 212) = ( 0.1361468 0.3138405 0.3968814), wk = 0.0017544 k( 213) = ( 0.1320211 0.3043302 0.3968814), wk = 0.0017544 k( 214) = ( 0.1278955 0.2948198 0.3968814), wk = 0.0017544 k( 215) = ( 0.1237698 0.2853095 0.3968814), wk = 0.0017544 k( 216) = ( 0.1196442 0.2757992 0.3968814), wk = 0.0017544 k( 217) = ( 0.1155185 0.2662889 0.3968814), wk = 0.0017544 k( 218) = ( 0.1113928 0.2567786 0.3968814), wk = 0.0017544 k( 219) = ( 0.1072672 0.2472683 0.3968814), wk = 0.0017544 k( 220) = ( 0.1031415 0.2377579 0.3968814), wk = 0.0017544 k( 221) = ( 0.0990159 0.2282476 0.3968814), wk = 0.0017544 k( 222) = ( 0.0948902 0.2187373 0.3968814), wk = 0.0017544 k( 223) = ( 0.0907645 0.2092270 0.3968814), wk = 0.0017544 k( 224) = ( 0.0866389 0.1997167 0.3968814), wk = 0.0017544 k( 225) = ( 0.0825132 0.1902064 0.3968814), wk = 0.0017544 k( 226) = ( 0.0783875 0.1806960 0.3968814), wk = 0.0017544 k( 227) = ( 0.0742619 0.1711857 0.3968814), wk = 0.0017544 k( 228) = ( 0.0701362 0.1616754 0.3968814), wk = 0.0017544 k( 229) = ( 0.0660106 0.1521651 0.3968814), wk = 0.0017544 k( 230) = ( 0.0618849 0.1426548 0.3968814), wk = 0.0017544 k( 231) = ( 0.0577592 0.1331444 0.3968814), wk = 0.0017544 k( 232) = ( 0.0536336 0.1236341 0.3968814), wk = 0.0017544 k( 233) = ( 0.0495079 0.1141238 0.3968814), wk = 0.0017544 k( 234) = ( 0.0453823 0.1046135 0.3968814), wk = 0.0017544 k( 235) = ( 0.0412566 0.0951032 0.3968814), wk = 0.0017544 k( 236) = ( 0.0371309 0.0855929 0.3968814), wk = 0.0017544 k( 237) = ( 0.0330053 0.0760825 0.3968814), wk = 0.0017544 k( 238) = ( 0.0288796 0.0665722 0.3968814), wk = 0.0017544 k( 239) = ( 0.0247540 0.0570619 0.3968814), wk = 0.0017544 k( 240) = ( 0.0206283 0.0475516 0.3968814), wk = 0.0017544 k( 241) = ( 0.0165026 0.0380413 0.3968814), wk = 0.0017544 k( 242) = ( 0.0123770 0.0285310 0.3968814), wk = 0.0017544 k( 243) = ( 0.0082513 0.0190206 0.3968814), wk = 0.0017544 k( 244) = ( 0.0041257 0.0095103 0.3968814), wk = 0.0017544 k( 245) = ( 0.0000000 0.0000000 0.3968814), wk = 0.0017544 k( 246) = ( 0.0000000 0.0000000 0.3968814), wk = 0.0017544 k( 247) = ( 0.0000000 0.0000000 0.3864372), wk = 0.0017544 k( 248) = ( 0.0000000 0.0000000 0.3759930), wk = 0.0017544 k( 249) = ( 0.0000000 0.0000000 0.3655487), wk = 0.0017544 k( 250) = ( 0.0000000 0.0000000 0.3551045), wk = 0.0017544 k( 251) = ( 0.0000000 0.0000000 0.3446602), wk = 0.0017544 k( 252) = ( 0.0000000 0.0000000 0.3342160), wk = 0.0017544 k( 253) = ( 0.0000000 0.0000000 0.3237717), wk = 0.0017544 k( 254) = ( 0.0000000 0.0000000 0.3133275), wk = 0.0017544 k( 255) = ( 0.0000000 0.0000000 0.3028832), wk = 0.0017544 k( 256) = ( 0.0000000 0.0000000 0.2924390), wk = 0.0017544 k( 257) = ( 0.0000000 0.0000000 0.2819947), wk = 0.0017544 k( 258) = ( 0.0000000 0.0000000 0.2715505), wk = 0.0017544 k( 259) = ( 0.0000000 0.0000000 0.2611062), wk = 0.0017544 k( 260) = ( 0.0000000 0.0000000 0.2506620), wk = 0.0017544 k( 261) = ( 0.0000000 0.0000000 0.2402177), wk = 0.0017544 k( 262) = ( 0.0000000 0.0000000 0.2297735), wk = 0.0017544 k( 263) = ( 0.0000000 0.0000000 0.2193292), wk = 0.0017544 k( 264) = ( 0.0000000 0.0000000 0.2088850), wk = 0.0017544 k( 265) = ( 0.0000000 0.0000000 0.1984407), wk = 0.0017544 k( 266) = ( 0.0000000 0.0000000 0.1879965), wk = 0.0017544 k( 267) = ( 0.0000000 0.0000000 0.1775522), wk = 0.0017544 k( 268) = ( 0.0000000 0.0000000 0.1671080), wk = 0.0017544 k( 269) = ( 0.0000000 0.0000000 0.1566637), wk = 0.0017544 k( 270) = ( 0.0000000 0.0000000 0.1462195), wk = 0.0017544 k( 271) = ( 0.0000000 0.0000000 0.1357752), wk = 0.0017544 k( 272) = ( 0.0000000 0.0000000 0.1253310), wk = 0.0017544 k( 273) = ( 0.0000000 0.0000000 0.1148867), wk = 0.0017544 k( 274) = ( 0.0000000 0.0000000 0.1044425), wk = 0.0017544 k( 275) = ( 0.0000000 0.0000000 0.0939982), wk = 0.0017544 k( 276) = ( 0.0000000 0.0000000 0.0835540), wk = 0.0017544 k( 277) = ( 0.0000000 0.0000000 0.0731097), wk = 0.0017544 k( 278) = ( 0.0000000 0.0000000 0.0626655), wk = 0.0017544 k( 279) = ( 0.0000000 0.0000000 0.0522212), wk = 0.0017544 k( 280) = ( 0.0000000 0.0000000 0.0417770), wk = 0.0017544 k( 281) = ( 0.0000000 0.0000000 0.0313327), wk = 0.0017544 k( 282) = ( 0.0000000 0.0000000 0.0208885), wk = 0.0017544 k( 283) = ( 0.0000000 0.0000000 0.0104442), wk = 0.0017544 k( 284) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 285) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 286) = ( -0.0094340 0.0040925 0.0000000), wk = 0.0017544 k( 287) = ( -0.0188679 0.0081851 0.0000000), wk = 0.0017544 k( 288) = ( -0.0283019 0.0122776 0.0000000), wk = 0.0017544 k( 289) = ( -0.0377359 0.0163701 0.0000000), wk = 0.0017544 k( 290) = ( -0.0471698 0.0204627 0.0000000), wk = 0.0017544 k( 291) = ( -0.0566038 0.0245552 0.0000000), wk = 0.0017544 k( 292) = ( -0.0660377 0.0286478 0.0000000), wk = 0.0017544 k( 293) = ( -0.0754717 0.0327403 0.0000000), wk = 0.0017544 k( 294) = ( -0.0849057 0.0368328 0.0000000), wk = 0.0017544 k( 295) = ( -0.0943396 0.0409254 0.0000000), wk = 0.0017544 k( 296) = ( -0.1037736 0.0450179 0.0000000), wk = 0.0017544 k( 297) = ( -0.1132076 0.0491104 0.0000000), wk = 0.0017544 k( 298) = ( -0.1226415 0.0532030 0.0000000), wk = 0.0017544 k( 299) = ( -0.1320755 0.0572955 0.0000000), wk = 0.0017544 k( 300) = ( -0.1415094 0.0613880 0.0000000), wk = 0.0017544 k( 301) = ( -0.1509434 0.0654806 0.0000000), wk = 0.0017544 k( 302) = ( -0.1603774 0.0695731 0.0000000), wk = 0.0017544 k( 303) = ( -0.1698113 0.0736657 0.0000000), wk = 0.0017544 k( 304) = ( -0.1792453 0.0777582 0.0000000), wk = 0.0017544 k( 305) = ( -0.1886792 0.0818507 0.0000000), wk = 0.0017544 k( 306) = ( -0.1981132 0.0859433 0.0000000), wk = 0.0017544 k( 307) = ( -0.2075472 0.0900358 0.0000000), wk = 0.0017544 k( 308) = ( -0.2169811 0.0941283 0.0000000), wk = 0.0017544 k( 309) = ( -0.2264151 0.0982209 0.0000000), wk = 0.0017544 k( 310) = ( -0.2358491 0.1023134 0.0000000), wk = 0.0017544 k( 311) = ( -0.2452830 0.1064060 0.0000000), wk = 0.0017544 k( 312) = ( -0.2547170 0.1104985 0.0000000), wk = 0.0017544 k( 313) = ( -0.2641509 0.1145910 0.0000000), wk = 0.0017544 k( 314) = ( -0.2735849 0.1186836 0.0000000), wk = 0.0017544 k( 315) = ( -0.2830189 0.1227761 0.0000000), wk = 0.0017544 k( 316) = ( -0.2924528 0.1268686 0.0000000), wk = 0.0017544 k( 317) = ( -0.3018868 0.1309612 0.0000000), wk = 0.0017544 k( 318) = ( -0.3113207 0.1350537 0.0000000), wk = 0.0017544 k( 319) = ( -0.3207547 0.1391462 0.0000000), wk = 0.0017544 k( 320) = ( -0.3301887 0.1432388 0.0000000), wk = 0.0017544 k( 321) = ( -0.3396226 0.1473313 0.0000000), wk = 0.0017544 k( 322) = ( -0.3490566 0.1514239 0.0000000), wk = 0.0017544 k( 323) = ( -0.3584906 0.1555164 0.0000000), wk = 0.0017544 k( 324) = ( -0.3679245 0.1596089 0.0000000), wk = 0.0017544 k( 325) = ( -0.3773585 0.1637015 0.0000000), wk = 0.0017544 k( 326) = ( -0.3867925 0.1677940 0.0000000), wk = 0.0017544 k( 327) = ( -0.3962264 0.1718865 0.0000000), wk = 0.0017544 k( 328) = ( -0.4056604 0.1759791 0.0000000), wk = 0.0017544 k( 329) = ( -0.4150943 0.1800716 0.0000000), wk = 0.0017544 k( 330) = ( -0.4245283 0.1841642 0.0000000), wk = 0.0017544 k( 331) = ( -0.4339623 0.1882567 0.0000000), wk = 0.0017544 k( 332) = ( -0.4433962 0.1923492 0.0000000), wk = 0.0017544 k( 333) = ( -0.4528302 0.1964418 0.0000000), wk = 0.0017544 k( 334) = ( -0.4622641 0.2005343 0.0000000), wk = 0.0017544 k( 335) = ( -0.4716981 0.2046268 0.0000000), wk = 0.0017544 k( 336) = ( -0.4811321 0.2087194 0.0000000), wk = 0.0017544 k( 337) = ( -0.4905660 0.2128119 0.0000000), wk = 0.0017544 k( 338) = ( -0.5000000 0.2169044 0.0000000), wk = 0.0017544 k( 339) = ( -0.5000000 0.2169044 0.0000000), wk = 0.0017544 k( 340) = ( -0.4958581 0.2264522 -0.0000000), wk = 0.0017544 k( 341) = ( -0.4917162 0.2359999 -0.0000000), wk = 0.0017544 k( 342) = ( -0.4875743 0.2455476 -0.0000000), wk = 0.0017544 k( 343) = ( -0.4834325 0.2550953 -0.0000000), wk = 0.0017544 k( 344) = ( -0.4792906 0.2646430 -0.0000000), wk = 0.0017544 k( 345) = ( -0.4751487 0.2741908 -0.0000000), wk = 0.0017544 k( 346) = ( -0.4710068 0.2837385 -0.0000000), wk = 0.0017544 k( 347) = ( -0.4668649 0.2932862 -0.0000000), wk = 0.0017544 k( 348) = ( -0.4627230 0.3028339 -0.0000000), wk = 0.0017544 k( 349) = ( -0.4585811 0.3123817 -0.0000000), wk = 0.0017544 k( 350) = ( -0.4544392 0.3219294 -0.0000000), wk = 0.0017544 k( 351) = ( -0.4502974 0.3314771 -0.0000000), wk = 0.0017544 k( 352) = ( -0.4461555 0.3410248 -0.0000000), wk = 0.0017544 k( 353) = ( -0.4420136 0.3505726 -0.0000000), wk = 0.0017544 k( 354) = ( -0.4378717 0.3601203 -0.0000000), wk = 0.0017544 k( 355) = ( -0.4337298 0.3696680 -0.0000000), wk = 0.0017544 k( 356) = ( -0.4295879 0.3792157 -0.0000000), wk = 0.0017544 k( 357) = ( -0.4254460 0.3887635 -0.0000000), wk = 0.0017544 k( 358) = ( -0.4213041 0.3983112 -0.0000000), wk = 0.0017544 k( 359) = ( -0.4171623 0.4078589 -0.0000000), wk = 0.0017544 k( 360) = ( -0.4130204 0.4174066 -0.0000000), wk = 0.0017544 k( 361) = ( -0.4088785 0.4269543 -0.0000000), wk = 0.0017544 k( 362) = ( -0.4047366 0.4365021 -0.0000000), wk = 0.0017544 k( 363) = ( -0.4005947 0.4460498 -0.0000000), wk = 0.0017544 k( 364) = ( -0.3964528 0.4555975 -0.0000000), wk = 0.0017544 k( 365) = ( -0.3923109 0.4651452 -0.0000000), wk = 0.0017544 k( 366) = ( -0.3881691 0.4746930 -0.0000000), wk = 0.0017544 k( 367) = ( -0.3840272 0.4842407 -0.0000000), wk = 0.0017544 k( 368) = ( -0.3798853 0.4937884 -0.0000000), wk = 0.0017544 k( 369) = ( -0.3757434 0.5033361 -0.0000000), wk = 0.0017544 k( 370) = ( -0.3716015 0.5128839 -0.0000000), wk = 0.0017544 k( 371) = ( -0.3674596 0.5224316 -0.0000000), wk = 0.0017544 k( 372) = ( -0.3633177 0.5319793 -0.0000000), wk = 0.0017544 k( 373) = ( -0.3591758 0.5415270 -0.0000000), wk = 0.0017544 k( 374) = ( -0.3550340 0.5510747 -0.0000000), wk = 0.0017544 k( 375) = ( -0.3508921 0.5606225 -0.0000000), wk = 0.0017544 k( 376) = ( -0.3467502 0.5701702 -0.0000000), wk = 0.0017544 k( 377) = ( -0.3426083 0.5797179 -0.0000000), wk = 0.0017544 k( 378) = ( -0.3384664 0.5892656 -0.0000000), wk = 0.0017544 k( 379) = ( -0.3343245 0.5988134 -0.0000000), wk = 0.0017544 k( 380) = ( -0.3301826 0.6083611 -0.0000000), wk = 0.0017544 k( 381) = ( -0.3260407 0.6179088 -0.0000000), wk = 0.0017544 k( 382) = ( -0.3218989 0.6274565 -0.0000000), wk = 0.0017544 k( 383) = ( -0.3177570 0.6370042 -0.0000000), wk = 0.0017544 k( 384) = ( -0.3136151 0.6465520 -0.0000000), wk = 0.0017544 k( 385) = ( -0.3094732 0.6560997 -0.0000000), wk = 0.0017544 k( 386) = ( -0.3053313 0.6656474 -0.0000000), wk = 0.0017544 k( 387) = ( -0.3011894 0.6751951 -0.0000000), wk = 0.0017544 k( 388) = ( -0.2970475 0.6847429 -0.0000000), wk = 0.0017544 k( 389) = ( -0.2970475 0.6847429 -0.0000000), wk = 0.0017544 k( 390) = ( -0.2970475 0.6847429 0.0104442), wk = 0.0017544 k( 391) = ( -0.2970475 0.6847429 0.0208885), wk = 0.0017544 k( 392) = ( -0.2970475 0.6847429 0.0313327), wk = 0.0017544 k( 393) = ( -0.2970475 0.6847429 0.0417770), wk = 0.0017544 k( 394) = ( -0.2970475 0.6847429 0.0522212), wk = 0.0017544 k( 395) = ( -0.2970475 0.6847429 0.0626655), wk = 0.0017544 k( 396) = ( -0.2970475 0.6847429 0.0731097), wk = 0.0017544 k( 397) = ( -0.2970475 0.6847429 0.0835540), wk = 0.0017544 k( 398) = ( -0.2970475 0.6847429 0.0939982), wk = 0.0017544 k( 399) = ( -0.2970475 0.6847429 0.1044425), wk = 0.0017544 k( 400) = ( -0.2970475 0.6847429 0.1148867), wk = 0.0017544 k( 401) = ( -0.2970475 0.6847429 0.1253310), wk = 0.0017544 k( 402) = ( -0.2970475 0.6847429 0.1357752), wk = 0.0017544 k( 403) = ( -0.2970475 0.6847429 0.1462195), wk = 0.0017544 k( 404) = ( -0.2970475 0.6847429 0.1566637), wk = 0.0017544 k( 405) = ( -0.2970475 0.6847429 0.1671080), wk = 0.0017544 k( 406) = ( -0.2970475 0.6847429 0.1775522), wk = 0.0017544 k( 407) = ( -0.2970475 0.6847429 0.1879965), wk = 0.0017544 k( 408) = ( -0.2970475 0.6847429 0.1984407), wk = 0.0017544 k( 409) = ( -0.2970475 0.6847429 0.2088850), wk = 0.0017544 k( 410) = ( -0.2970475 0.6847429 0.2193292), wk = 0.0017544 k( 411) = ( -0.2970475 0.6847429 0.2297735), wk = 0.0017544 k( 412) = ( -0.2970475 0.6847429 0.2402177), wk = 0.0017544 k( 413) = ( -0.2970475 0.6847429 0.2506620), wk = 0.0017544 k( 414) = ( -0.2970475 0.6847429 0.2611062), wk = 0.0017544 k( 415) = ( -0.2970475 0.6847429 0.2715505), wk = 0.0017544 k( 416) = ( -0.2970475 0.6847429 0.2819947), wk = 0.0017544 k( 417) = ( -0.2970475 0.6847429 0.2924390), wk = 0.0017544 k( 418) = ( -0.2970475 0.6847429 0.3028832), wk = 0.0017544 k( 419) = ( -0.2970475 0.6847429 0.3133275), wk = 0.0017544 k( 420) = ( -0.2970475 0.6847429 0.3237717), wk = 0.0017544 k( 421) = ( -0.2970475 0.6847429 0.3342160), wk = 0.0017544 k( 422) = ( -0.2970475 0.6847429 0.3446602), wk = 0.0017544 k( 423) = ( -0.2970475 0.6847429 0.3551045), wk = 0.0017544 k( 424) = ( -0.2970475 0.6847429 0.3655487), wk = 0.0017544 k( 425) = ( -0.2970475 0.6847429 0.3759930), wk = 0.0017544 k( 426) = ( -0.2970475 0.6847429 0.3864372), wk = 0.0017544 k( 427) = ( -0.2970475 0.6847429 0.3968814), wk = 0.0017544 k( 428) = ( -0.2970475 0.6847429 0.3968814), wk = 0.0017544 k( 429) = ( -0.3011894 0.6751951 0.3968814), wk = 0.0017544 k( 430) = ( -0.3053313 0.6656474 0.3968814), wk = 0.0017544 k( 431) = ( -0.3094732 0.6560997 0.3968814), wk = 0.0017544 k( 432) = ( -0.3136151 0.6465520 0.3968814), wk = 0.0017544 k( 433) = ( -0.3177570 0.6370042 0.3968814), wk = 0.0017544 k( 434) = ( -0.3218989 0.6274565 0.3968814), wk = 0.0017544 k( 435) = ( -0.3260407 0.6179088 0.3968814), wk = 0.0017544 k( 436) = ( -0.3301826 0.6083611 0.3968814), wk = 0.0017544 k( 437) = ( -0.3343245 0.5988134 0.3968814), wk = 0.0017544 k( 438) = ( -0.3384664 0.5892656 0.3968814), wk = 0.0017544 k( 439) = ( -0.3426083 0.5797179 0.3968814), wk = 0.0017544 k( 440) = ( -0.3467502 0.5701702 0.3968814), wk = 0.0017544 k( 441) = ( -0.3508921 0.5606225 0.3968814), wk = 0.0017544 k( 442) = ( -0.3550340 0.5510747 0.3968814), wk = 0.0017544 k( 443) = ( -0.3591758 0.5415270 0.3968814), wk = 0.0017544 k( 444) = ( -0.3633177 0.5319793 0.3968814), wk = 0.0017544 k( 445) = ( -0.3674596 0.5224316 0.3968814), wk = 0.0017544 k( 446) = ( -0.3716015 0.5128839 0.3968814), wk = 0.0017544 k( 447) = ( -0.3757434 0.5033361 0.3968814), wk = 0.0017544 k( 448) = ( -0.3798853 0.4937884 0.3968814), wk = 0.0017544 k( 449) = ( -0.3840272 0.4842407 0.3968814), wk = 0.0017544 k( 450) = ( -0.3881691 0.4746930 0.3968814), wk = 0.0017544 k( 451) = ( -0.3923109 0.4651452 0.3968814), wk = 0.0017544 k( 452) = ( -0.3964528 0.4555975 0.3968814), wk = 0.0017544 k( 453) = ( -0.4005947 0.4460498 0.3968814), wk = 0.0017544 k( 454) = ( -0.4047366 0.4365021 0.3968814), wk = 0.0017544 k( 455) = ( -0.4088785 0.4269543 0.3968814), wk = 0.0017544 k( 456) = ( -0.4130204 0.4174066 0.3968814), wk = 0.0017544 k( 457) = ( -0.4171623 0.4078589 0.3968814), wk = 0.0017544 k( 458) = ( -0.4213041 0.3983112 0.3968814), wk = 0.0017544 k( 459) = ( -0.4254460 0.3887635 0.3968814), wk = 0.0017544 k( 460) = ( -0.4295879 0.3792157 0.3968814), wk = 0.0017544 k( 461) = ( -0.4337298 0.3696680 0.3968814), wk = 0.0017544 k( 462) = ( -0.4378717 0.3601203 0.3968814), wk = 0.0017544 k( 463) = ( -0.4420136 0.3505726 0.3968814), wk = 0.0017544 k( 464) = ( -0.4461555 0.3410248 0.3968814), wk = 0.0017544 k( 465) = ( -0.4502974 0.3314771 0.3968814), wk = 0.0017544 k( 466) = ( -0.4544392 0.3219294 0.3968814), wk = 0.0017544 k( 467) = ( -0.4585811 0.3123817 0.3968814), wk = 0.0017544 k( 468) = ( -0.4627230 0.3028339 0.3968814), wk = 0.0017544 k( 469) = ( -0.4668649 0.2932862 0.3968814), wk = 0.0017544 k( 470) = ( -0.4710068 0.2837385 0.3968814), wk = 0.0017544 k( 471) = ( -0.4751487 0.2741908 0.3968814), wk = 0.0017544 k( 472) = ( -0.4792906 0.2646430 0.3968814), wk = 0.0017544 k( 473) = ( -0.4834325 0.2550953 0.3968814), wk = 0.0017544 k( 474) = ( -0.4875743 0.2455476 0.3968814), wk = 0.0017544 k( 475) = ( -0.4917162 0.2359999 0.3968814), wk = 0.0017544 k( 476) = ( -0.4958581 0.2264522 0.3968814), wk = 0.0017544 k( 477) = ( -0.5000000 0.2169044 0.3968814), wk = 0.0017544 k( 478) = ( -0.5000000 0.2169044 0.3968814), wk = 0.0017544 k( 479) = ( -0.5000000 0.2169044 0.3864372), wk = 0.0017544 k( 480) = ( -0.5000000 0.2169044 0.3759930), wk = 0.0017544 k( 481) = ( -0.5000000 0.2169044 0.3655487), wk = 0.0017544 k( 482) = ( -0.5000000 0.2169044 0.3551045), wk = 0.0017544 k( 483) = ( -0.5000000 0.2169044 0.3446602), wk = 0.0017544 k( 484) = ( -0.5000000 0.2169044 0.3342160), wk = 0.0017544 k( 485) = ( -0.5000000 0.2169044 0.3237717), wk = 0.0017544 k( 486) = ( -0.5000000 0.2169044 0.3133275), wk = 0.0017544 k( 487) = ( -0.5000000 0.2169044 0.3028832), wk = 0.0017544 k( 488) = ( -0.5000000 0.2169044 0.2924390), wk = 0.0017544 k( 489) = ( -0.5000000 0.2169044 0.2819947), wk = 0.0017544 k( 490) = ( -0.5000000 0.2169044 0.2715505), wk = 0.0017544 k( 491) = ( -0.5000000 0.2169044 0.2611062), wk = 0.0017544 k( 492) = ( -0.5000000 0.2169044 0.2506620), wk = 0.0017544 k( 493) = ( -0.5000000 0.2169044 0.2402177), wk = 0.0017544 k( 494) = ( -0.5000000 0.2169044 0.2297735), wk = 0.0017544 k( 495) = ( -0.5000000 0.2169044 0.2193292), wk = 0.0017544 k( 496) = ( -0.5000000 0.2169044 0.2088850), wk = 0.0017544 k( 497) = ( -0.5000000 0.2169044 0.1984407), wk = 0.0017544 k( 498) = ( -0.5000000 0.2169044 0.1879965), wk = 0.0017544 k( 499) = ( -0.5000000 0.2169044 0.1775522), wk = 0.0017544 k( 500) = ( -0.5000000 0.2169044 0.1671080), wk = 0.0017544 k( 501) = ( -0.5000000 0.2169044 0.1566637), wk = 0.0017544 k( 502) = ( -0.5000000 0.2169044 0.1462195), wk = 0.0017544 k( 503) = ( -0.5000000 0.2169044 0.1357752), wk = 0.0017544 k( 504) = ( -0.5000000 0.2169044 0.1253310), wk = 0.0017544 k( 505) = ( -0.5000000 0.2169044 0.1148867), wk = 0.0017544 k( 506) = ( -0.5000000 0.2169044 0.1044425), wk = 0.0017544 k( 507) = ( -0.5000000 0.2169044 0.0939982), wk = 0.0017544 k( 508) = ( -0.5000000 0.2169044 0.0835540), wk = 0.0017544 k( 509) = ( -0.5000000 0.2169044 0.0731097), wk = 0.0017544 k( 510) = ( -0.5000000 0.2169044 0.0626655), wk = 0.0017544 k( 511) = ( -0.5000000 0.2169044 0.0522212), wk = 0.0017544 k( 512) = ( -0.5000000 0.2169044 0.0417770), wk = 0.0017544 k( 513) = ( -0.5000000 0.2169044 0.0313327), wk = 0.0017544 k( 514) = ( -0.5000000 0.2169044 0.0208885), wk = 0.0017544 k( 515) = ( -0.5000000 0.2169044 0.0104442), wk = 0.0017544 k( 516) = ( -0.5000000 0.2169044 0.0000000), wk = 0.0017544 k( 517) = ( 0.0000000 0.0000000 0.3968814), wk = 0.0017544 k( 518) = ( -0.0094340 0.0040925 0.3968814), wk = 0.0017544 k( 519) = ( -0.0188679 0.0081851 0.3968814), wk = 0.0017544 k( 520) = ( -0.0283019 0.0122776 0.3968814), wk = 0.0017544 k( 521) = ( -0.0377359 0.0163701 0.3968814), wk = 0.0017544 k( 522) = ( -0.0471698 0.0204627 0.3968814), wk = 0.0017544 k( 523) = ( -0.0566038 0.0245552 0.3968814), wk = 0.0017544 k( 524) = ( -0.0660377 0.0286478 0.3968814), wk = 0.0017544 k( 525) = ( -0.0754717 0.0327403 0.3968814), wk = 0.0017544 k( 526) = ( -0.0849057 0.0368328 0.3968814), wk = 0.0017544 k( 527) = ( -0.0943396 0.0409254 0.3968814), wk = 0.0017544 k( 528) = ( -0.1037736 0.0450179 0.3968814), wk = 0.0017544 k( 529) = ( -0.1132076 0.0491104 0.3968814), wk = 0.0017544 k( 530) = ( -0.1226415 0.0532030 0.3968814), wk = 0.0017544 k( 531) = ( -0.1320755 0.0572955 0.3968814), wk = 0.0017544 k( 532) = ( -0.1415094 0.0613880 0.3968814), wk = 0.0017544 k( 533) = ( -0.1509434 0.0654806 0.3968814), wk = 0.0017544 k( 534) = ( -0.1603774 0.0695731 0.3968814), wk = 0.0017544 k( 535) = ( -0.1698113 0.0736657 0.3968814), wk = 0.0017544 k( 536) = ( -0.1792453 0.0777582 0.3968814), wk = 0.0017544 k( 537) = ( -0.1886792 0.0818507 0.3968814), wk = 0.0017544 k( 538) = ( -0.1981132 0.0859433 0.3968814), wk = 0.0017544 k( 539) = ( -0.2075472 0.0900358 0.3968814), wk = 0.0017544 k( 540) = ( -0.2169811 0.0941283 0.3968814), wk = 0.0017544 k( 541) = ( -0.2264151 0.0982209 0.3968814), wk = 0.0017544 k( 542) = ( -0.2358491 0.1023134 0.3968814), wk = 0.0017544 k( 543) = ( -0.2452830 0.1064060 0.3968814), wk = 0.0017544 k( 544) = ( -0.2547170 0.1104985 0.3968814), wk = 0.0017544 k( 545) = ( -0.2641509 0.1145910 0.3968814), wk = 0.0017544 k( 546) = ( -0.2735849 0.1186836 0.3968814), wk = 0.0017544 k( 547) = ( -0.2830189 0.1227761 0.3968814), wk = 0.0017544 k( 548) = ( -0.2924528 0.1268686 0.3968814), wk = 0.0017544 k( 549) = ( -0.3018868 0.1309612 0.3968814), wk = 0.0017544 k( 550) = ( -0.3113207 0.1350537 0.3968814), wk = 0.0017544 k( 551) = ( -0.3207547 0.1391462 0.3968814), wk = 0.0017544 k( 552) = ( -0.3301887 0.1432388 0.3968814), wk = 0.0017544 k( 553) = ( -0.3396226 0.1473313 0.3968814), wk = 0.0017544 k( 554) = ( -0.3490566 0.1514239 0.3968814), wk = 0.0017544 k( 555) = ( -0.3584906 0.1555164 0.3968814), wk = 0.0017544 k( 556) = ( -0.3679245 0.1596089 0.3968814), wk = 0.0017544 k( 557) = ( -0.3773585 0.1637015 0.3968814), wk = 0.0017544 k( 558) = ( -0.3867925 0.1677940 0.3968814), wk = 0.0017544 k( 559) = ( -0.3962264 0.1718865 0.3968814), wk = 0.0017544 k( 560) = ( -0.4056604 0.1759791 0.3968814), wk = 0.0017544 k( 561) = ( -0.4150943 0.1800716 0.3968814), wk = 0.0017544 k( 562) = ( -0.4245283 0.1841642 0.3968814), wk = 0.0017544 k( 563) = ( -0.4339623 0.1882567 0.3968814), wk = 0.0017544 k( 564) = ( -0.4433962 0.1923492 0.3968814), wk = 0.0017544 k( 565) = ( -0.4528302 0.1964418 0.3968814), wk = 0.0017544 k( 566) = ( -0.4622641 0.2005343 0.3968814), wk = 0.0017544 k( 567) = ( -0.4716981 0.2046268 0.3968814), wk = 0.0017544 k( 568) = ( -0.4811321 0.2087194 0.3968814), wk = 0.0017544 k( 569) = ( -0.4905660 0.2128119 0.3968814), wk = 0.0017544 k( 570) = ( -0.5000000 0.2169044 0.3968814), wk = 0.0017544 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 2) = ( 0.0041257 0.0041257 0.0000000), wk = 0.0017544 k( 3) = ( 0.0082513 0.0082513 0.0000000), wk = 0.0017544 k( 4) = ( 0.0123770 0.0123770 0.0000000), wk = 0.0017544 k( 5) = ( 0.0165026 0.0165026 0.0000000), wk = 0.0017544 k( 6) = ( 0.0206283 0.0206283 0.0000000), wk = 0.0017544 k( 7) = ( 0.0247540 0.0247540 0.0000000), wk = 0.0017544 k( 8) = ( 0.0288796 0.0288796 0.0000000), wk = 0.0017544 k( 9) = ( 0.0330053 0.0330053 0.0000000), wk = 0.0017544 k( 10) = ( 0.0371309 0.0371309 0.0000000), wk = 0.0017544 k( 11) = ( 0.0412566 0.0412566 0.0000000), wk = 0.0017544 k( 12) = ( 0.0453823 0.0453823 0.0000000), wk = 0.0017544 k( 13) = ( 0.0495079 0.0495079 0.0000000), wk = 0.0017544 k( 14) = ( 0.0536336 0.0536336 -0.0000000), wk = 0.0017544 k( 15) = ( 0.0577592 0.0577592 0.0000000), wk = 0.0017544 k( 16) = ( 0.0618849 0.0618849 0.0000000), wk = 0.0017544 k( 17) = ( 0.0660106 0.0660106 0.0000000), wk = 0.0017544 k( 18) = ( 0.0701362 0.0701362 0.0000000), wk = 0.0017544 k( 19) = ( 0.0742619 0.0742619 0.0000000), wk = 0.0017544 k( 20) = ( 0.0783875 0.0783875 -0.0000000), wk = 0.0017544 k( 21) = ( 0.0825132 0.0825132 0.0000000), wk = 0.0017544 k( 22) = ( 0.0866389 0.0866389 0.0000000), wk = 0.0017544 k( 23) = ( 0.0907645 0.0907645 -0.0000000), wk = 0.0017544 k( 24) = ( 0.0948902 0.0948902 -0.0000000), wk = 0.0017544 k( 25) = ( 0.0990159 0.0990159 -0.0000000), wk = 0.0017544 k( 26) = ( 0.1031415 0.1031415 0.0000000), wk = 0.0017544 k( 27) = ( 0.1072672 0.1072672 0.0000000), wk = 0.0017544 k( 28) = ( 0.1113928 0.1113928 0.0000000), wk = 0.0017544 k( 29) = ( 0.1155185 0.1155185 0.0000000), wk = 0.0017544 k( 30) = ( 0.1196442 0.1196442 -0.0000000), wk = 0.0017544 k( 31) = ( 0.1237698 0.1237698 -0.0000000), wk = 0.0017544 k( 32) = ( 0.1278955 0.1278955 0.0000000), wk = 0.0017544 k( 33) = ( 0.1320211 0.1320211 0.0000000), wk = 0.0017544 k( 34) = ( 0.1361468 0.1361468 0.0000000), wk = 0.0017544 k( 35) = ( 0.1402724 0.1402724 -0.0000000), wk = 0.0017544 k( 36) = ( 0.1443981 0.1443981 0.0000000), wk = 0.0017544 k( 37) = ( 0.1485238 0.1485238 0.0000000), wk = 0.0017544 k( 38) = ( 0.1526494 0.1526494 -0.0000000), wk = 0.0017544 k( 39) = ( 0.1567751 0.1567751 0.0000000), wk = 0.0017544 k( 40) = ( 0.1609008 0.1609008 0.0000000), wk = 0.0017544 k( 41) = ( 0.1650264 0.1650264 -0.0000000), wk = 0.0017544 k( 42) = ( 0.1691521 0.1691521 -0.0000000), wk = 0.0017544 k( 43) = ( 0.1732777 0.1732777 -0.0000000), wk = 0.0017544 k( 44) = ( 0.1774034 0.1774034 0.0000000), wk = 0.0017544 k( 45) = ( 0.1815290 0.1815291 0.0000000), wk = 0.0017544 k( 46) = ( 0.1856547 0.1856547 0.0000000), wk = 0.0017544 k( 47) = ( 0.1897804 0.1897804 0.0000000), wk = 0.0017544 k( 48) = ( 0.1939060 0.1939060 -0.0000000), wk = 0.0017544 k( 49) = ( 0.1980317 0.1980317 0.0000000), wk = 0.0017544 k( 50) = ( 0.2021574 0.2021574 0.0000000), wk = 0.0017544 k( 51) = ( 0.2062830 0.2062830 0.0000000), wk = 0.0017544 k( 52) = ( 0.2104087 0.2104087 -0.0000000), wk = 0.0017544 k( 53) = ( 0.2145343 0.2145343 0.0000000), wk = 0.0017544 k( 54) = ( 0.2186600 0.2186600 0.0000000), wk = 0.0017544 k( 55) = ( 0.2227857 0.2227856 -0.0000000), wk = 0.0017544 k( 56) = ( 0.2269113 0.2269113 0.0000000), wk = 0.0017544 k( 57) = ( 0.2310370 0.2310370 -0.0000000), wk = 0.0017544 k( 58) = ( 0.2351626 0.2351626 0.0000000), wk = 0.0017544 k( 59) = ( 0.2392883 0.2392883 -0.0000000), wk = 0.0017544 k( 60) = ( 0.2434140 0.2434140 0.0000000), wk = 0.0017544 k( 61) = ( 0.2475396 0.2475396 -0.0000000), wk = 0.0017544 k( 62) = ( 0.2516653 0.2516653 -0.0000000), wk = 0.0017544 k( 63) = ( 0.2557909 0.2557909 0.0000000), wk = 0.0017544 k( 64) = ( 0.2599166 0.2599166 0.0000000), wk = 0.0017544 k( 65) = ( 0.2640423 0.2640423 0.0000000), wk = 0.0017544 k( 66) = ( 0.2681679 0.2681679 0.0000000), wk = 0.0017544 k( 67) = ( 0.2722936 0.2722936 0.0000000), wk = 0.0017544 k( 68) = ( 0.2764192 0.2764192 0.0000000), wk = 0.0017544 k( 69) = ( 0.2805449 0.2805449 -0.0000000), wk = 0.0017544 k( 70) = ( 0.2846706 0.2846706 0.0000000), wk = 0.0017544 k( 71) = ( 0.2887962 0.2887962 0.0000000), wk = 0.0017544 k( 72) = ( 0.2929219 0.2929219 0.0000000), wk = 0.0017544 k( 73) = ( 0.2970475 0.2970475 0.0000000), wk = 0.0017544 k( 74) = ( 0.2970475 0.2970475 0.0000000), wk = 0.0017544 k( 75) = ( 0.2868045 0.3040459 0.0000000), wk = 0.0017544 k( 76) = ( 0.2765615 0.3110443 0.0000000), wk = 0.0017544 k( 77) = ( 0.2663185 0.3180426 0.0000000), wk = 0.0017544 k( 78) = ( 0.2560755 0.3250410 -0.0000000), wk = 0.0017544 k( 79) = ( 0.2458325 0.3320393 0.0000000), wk = 0.0017544 k( 80) = ( 0.2355894 0.3390377 0.0000000), wk = 0.0017544 k( 81) = ( 0.2253464 0.3460361 0.0000000), wk = 0.0017544 k( 82) = ( 0.2151034 0.3530344 -0.0000000), wk = 0.0017544 k( 83) = ( 0.2048604 0.3600328 0.0000000), wk = 0.0017544 k( 84) = ( 0.1946173 0.3670312 0.0000000), wk = 0.0017544 k( 85) = ( 0.1843743 0.3740295 0.0000000), wk = 0.0017544 k( 86) = ( 0.1741313 0.3810279 -0.0000000), wk = 0.0017544 k( 87) = ( 0.1638883 0.3880262 -0.0000000), wk = 0.0017544 k( 88) = ( 0.1536453 0.3950246 0.0000000), wk = 0.0017544 k( 89) = ( 0.1434023 0.4020229 -0.0000000), wk = 0.0017544 k( 90) = ( 0.1331592 0.4090213 -0.0000000), wk = 0.0017544 k( 91) = ( 0.1229162 0.4160197 0.0000000), wk = 0.0017544 k( 92) = ( 0.1126732 0.4230180 -0.0000000), wk = 0.0017544 k( 93) = ( 0.1024302 0.4300164 0.0000000), wk = 0.0017544 k( 94) = ( 0.0921872 0.4370148 0.0000000), wk = 0.0017544 k( 95) = ( 0.0819441 0.4440131 0.0000000), wk = 0.0017544 k( 96) = ( 0.0717011 0.4510115 0.0000000), wk = 0.0017544 k( 97) = ( 0.0614581 0.4580098 0.0000000), wk = 0.0017544 k( 98) = ( 0.0512151 0.4650082 0.0000000), wk = 0.0017544 k( 99) = ( 0.0409721 0.4720066 0.0000000), wk = 0.0017544 k( 100) = ( 0.0307291 0.4790049 0.0000000), wk = 0.0017544 k( 101) = ( 0.0204860 0.4860033 0.0000000), wk = 0.0017544 k( 102) = ( 0.0102430 0.4930016 -0.0000000), wk = 0.0017544 k( 103) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0017544 k( 104) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0017544 k( 105) = ( 0.0000000 0.5000000 0.0131579), wk = 0.0017544 k( 106) = ( 0.0000000 0.5000000 0.0263158), wk = 0.0017544 k( 107) = ( 0.0000000 0.5000000 0.0394737), wk = 0.0017544 k( 108) = ( 0.0000000 0.5000000 0.0526316), wk = 0.0017544 k( 109) = ( 0.0000000 0.5000000 0.0657895), wk = 0.0017544 k( 110) = ( 0.0000000 0.5000000 0.0789474), wk = 0.0017544 k( 111) = ( 0.0000000 0.5000000 0.0921053), wk = 0.0017544 k( 112) = ( 0.0000000 0.5000000 0.1052632), wk = 0.0017544 k( 113) = ( 0.0000000 0.5000000 0.1184211), wk = 0.0017544 k( 114) = ( 0.0000000 0.5000000 0.1315790), wk = 0.0017544 k( 115) = ( 0.0000000 0.5000000 0.1447368), wk = 0.0017544 k( 116) = ( 0.0000000 0.5000000 0.1578947), wk = 0.0017544 k( 117) = ( 0.0000000 0.5000000 0.1710526), wk = 0.0017544 k( 118) = ( 0.0000000 0.5000000 0.1842105), wk = 0.0017544 k( 119) = ( 0.0000000 0.5000000 0.1973684), wk = 0.0017544 k( 120) = ( 0.0000000 0.5000000 0.2105263), wk = 0.0017544 k( 121) = ( 0.0000000 0.5000000 0.2236842), wk = 0.0017544 k( 122) = ( 0.0000000 0.5000000 0.2368421), wk = 0.0017544 k( 123) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0017544 k( 124) = ( 0.0000000 0.5000000 0.2631579), wk = 0.0017544 k( 125) = ( 0.0000000 0.5000000 0.2763158), wk = 0.0017544 k( 126) = ( 0.0000000 0.5000000 0.2894737), wk = 0.0017544 k( 127) = ( 0.0000000 0.5000000 0.3026316), wk = 0.0017544 k( 128) = ( 0.0000000 0.5000000 0.3157895), wk = 0.0017544 k( 129) = ( 0.0000000 0.5000000 0.3289474), wk = 0.0017544 k( 130) = ( 0.0000000 0.5000000 0.3421053), wk = 0.0017544 k( 131) = ( 0.0000000 0.5000000 0.3552632), wk = 0.0017544 k( 132) = ( 0.0000000 0.5000000 0.3684211), wk = 0.0017544 k( 133) = ( 0.0000000 0.5000000 0.3815790), wk = 0.0017544 k( 134) = ( 0.0000000 0.5000000 0.3947368), wk = 0.0017544 k( 135) = ( 0.0000000 0.5000000 0.4078947), wk = 0.0017544 k( 136) = ( 0.0000000 0.5000000 0.4210526), wk = 0.0017544 k( 137) = ( 0.0000000 0.5000000 0.4342105), wk = 0.0017544 k( 138) = ( 0.0000000 0.5000000 0.4473684), wk = 0.0017544 k( 139) = ( 0.0000000 0.5000000 0.4605263), wk = 0.0017544 k( 140) = ( 0.0000000 0.5000000 0.4736842), wk = 0.0017544 k( 141) = ( 0.0000000 0.5000000 0.4868421), wk = 0.0017544 k( 142) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0017544 k( 143) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0017544 k( 144) = ( 0.0102430 0.4930016 0.5000000), wk = 0.0017544 k( 145) = ( 0.0204860 0.4860033 0.5000000), wk = 0.0017544 k( 146) = ( 0.0307291 0.4790049 0.5000000), wk = 0.0017544 k( 147) = ( 0.0409721 0.4720066 0.5000000), wk = 0.0017544 k( 148) = ( 0.0512151 0.4650082 0.5000000), wk = 0.0017544 k( 149) = ( 0.0614581 0.4580098 0.5000000), wk = 0.0017544 k( 150) = ( 0.0717011 0.4510115 0.5000000), wk = 0.0017544 k( 151) = ( 0.0819441 0.4440131 0.5000000), wk = 0.0017544 k( 152) = ( 0.0921872 0.4370148 0.5000000), wk = 0.0017544 k( 153) = ( 0.1024302 0.4300164 0.5000000), wk = 0.0017544 k( 154) = ( 0.1126732 0.4230180 0.5000000), wk = 0.0017544 k( 155) = ( 0.1229162 0.4160197 0.5000000), wk = 0.0017544 k( 156) = ( 0.1331592 0.4090213 0.5000000), wk = 0.0017544 k( 157) = ( 0.1434023 0.4020229 0.5000000), wk = 0.0017544 k( 158) = ( 0.1536453 0.3950246 0.5000000), wk = 0.0017544 k( 159) = ( 0.1638883 0.3880262 0.5000000), wk = 0.0017544 k( 160) = ( 0.1741313 0.3810279 0.5000000), wk = 0.0017544 k( 161) = ( 0.1843743 0.3740295 0.5000000), wk = 0.0017544 k( 162) = ( 0.1946173 0.3670312 0.5000000), wk = 0.0017544 k( 163) = ( 0.2048604 0.3600328 0.5000000), wk = 0.0017544 k( 164) = ( 0.2151034 0.3530344 0.5000000), wk = 0.0017544 k( 165) = ( 0.2253464 0.3460361 0.5000000), wk = 0.0017544 k( 166) = ( 0.2355894 0.3390377 0.5000000), wk = 0.0017544 k( 167) = ( 0.2458325 0.3320393 0.5000000), wk = 0.0017544 k( 168) = ( 0.2560755 0.3250410 0.5000000), wk = 0.0017544 k( 169) = ( 0.2663185 0.3180426 0.5000000), wk = 0.0017544 k( 170) = ( 0.2765615 0.3110443 0.5000000), wk = 0.0017544 k( 171) = ( 0.2868045 0.3040459 0.5000000), wk = 0.0017544 k( 172) = ( 0.2970475 0.2970475 0.5000000), wk = 0.0017544 k( 173) = ( 0.2970475 0.2970475 0.5000000), wk = 0.0017544 k( 174) = ( 0.2929219 0.2929219 0.5000000), wk = 0.0017544 k( 175) = ( 0.2887962 0.2887962 0.5000000), wk = 0.0017544 k( 176) = ( 0.2846706 0.2846706 0.5000000), wk = 0.0017544 k( 177) = ( 0.2805449 0.2805449 0.5000000), wk = 0.0017544 k( 178) = ( 0.2764192 0.2764192 0.5000000), wk = 0.0017544 k( 179) = ( 0.2722936 0.2722936 0.5000000), wk = 0.0017544 k( 180) = ( 0.2681679 0.2681679 0.5000000), wk = 0.0017544 k( 181) = ( 0.2640423 0.2640423 0.5000000), wk = 0.0017544 k( 182) = ( 0.2599166 0.2599166 0.5000000), wk = 0.0017544 k( 183) = ( 0.2557909 0.2557909 0.5000000), wk = 0.0017544 k( 184) = ( 0.2516653 0.2516653 0.5000000), wk = 0.0017544 k( 185) = ( 0.2475396 0.2475396 0.5000000), wk = 0.0017544 k( 186) = ( 0.2434140 0.2434140 0.5000000), wk = 0.0017544 k( 187) = ( 0.2392883 0.2392883 0.5000000), wk = 0.0017544 k( 188) = ( 0.2351626 0.2351626 0.5000000), wk = 0.0017544 k( 189) = ( 0.2310370 0.2310370 0.5000000), wk = 0.0017544 k( 190) = ( 0.2269113 0.2269113 0.5000000), wk = 0.0017544 k( 191) = ( 0.2227857 0.2227856 0.5000000), wk = 0.0017544 k( 192) = ( 0.2186600 0.2186600 0.5000000), wk = 0.0017544 k( 193) = ( 0.2145343 0.2145343 0.5000000), wk = 0.0017544 k( 194) = ( 0.2104087 0.2104087 0.5000000), wk = 0.0017544 k( 195) = ( 0.2062830 0.2062830 0.5000000), wk = 0.0017544 k( 196) = ( 0.2021574 0.2021574 0.5000000), wk = 0.0017544 k( 197) = ( 0.1980317 0.1980317 0.5000000), wk = 0.0017544 k( 198) = ( 0.1939060 0.1939060 0.5000000), wk = 0.0017544 k( 199) = ( 0.1897804 0.1897804 0.5000000), wk = 0.0017544 k( 200) = ( 0.1856547 0.1856547 0.5000000), wk = 0.0017544 k( 201) = ( 0.1815290 0.1815291 0.5000000), wk = 0.0017544 k( 202) = ( 0.1774034 0.1774034 0.5000000), wk = 0.0017544 k( 203) = ( 0.1732777 0.1732777 0.5000000), wk = 0.0017544 k( 204) = ( 0.1691521 0.1691521 0.5000000), wk = 0.0017544 k( 205) = ( 0.1650264 0.1650264 0.5000000), wk = 0.0017544 k( 206) = ( 0.1609008 0.1609008 0.5000000), wk = 0.0017544 k( 207) = ( 0.1567751 0.1567751 0.5000000), wk = 0.0017544 k( 208) = ( 0.1526494 0.1526494 0.5000000), wk = 0.0017544 k( 209) = ( 0.1485238 0.1485238 0.5000000), wk = 0.0017544 k( 210) = ( 0.1443981 0.1443981 0.5000000), wk = 0.0017544 k( 211) = ( 0.1402724 0.1402724 0.5000000), wk = 0.0017544 k( 212) = ( 0.1361468 0.1361468 0.5000000), wk = 0.0017544 k( 213) = ( 0.1320211 0.1320211 0.5000000), wk = 0.0017544 k( 214) = ( 0.1278955 0.1278955 0.5000000), wk = 0.0017544 k( 215) = ( 0.1237698 0.1237698 0.5000000), wk = 0.0017544 k( 216) = ( 0.1196442 0.1196442 0.5000000), wk = 0.0017544 k( 217) = ( 0.1155185 0.1155185 0.5000000), wk = 0.0017544 k( 218) = ( 0.1113928 0.1113928 0.5000000), wk = 0.0017544 k( 219) = ( 0.1072672 0.1072672 0.5000000), wk = 0.0017544 k( 220) = ( 0.1031415 0.1031415 0.5000000), wk = 0.0017544 k( 221) = ( 0.0990159 0.0990159 0.5000000), wk = 0.0017544 k( 222) = ( 0.0948902 0.0948902 0.5000000), wk = 0.0017544 k( 223) = ( 0.0907645 0.0907645 0.5000000), wk = 0.0017544 k( 224) = ( 0.0866389 0.0866389 0.5000000), wk = 0.0017544 k( 225) = ( 0.0825132 0.0825132 0.5000000), wk = 0.0017544 k( 226) = ( 0.0783875 0.0783875 0.5000000), wk = 0.0017544 k( 227) = ( 0.0742619 0.0742619 0.5000000), wk = 0.0017544 k( 228) = ( 0.0701362 0.0701362 0.5000000), wk = 0.0017544 k( 229) = ( 0.0660106 0.0660106 0.5000000), wk = 0.0017544 k( 230) = ( 0.0618849 0.0618849 0.5000000), wk = 0.0017544 k( 231) = ( 0.0577592 0.0577592 0.5000000), wk = 0.0017544 k( 232) = ( 0.0536336 0.0536336 0.5000000), wk = 0.0017544 k( 233) = ( 0.0495079 0.0495079 0.5000000), wk = 0.0017544 k( 234) = ( 0.0453823 0.0453823 0.5000000), wk = 0.0017544 k( 235) = ( 0.0412566 0.0412566 0.5000000), wk = 0.0017544 k( 236) = ( 0.0371309 0.0371309 0.5000000), wk = 0.0017544 k( 237) = ( 0.0330053 0.0330053 0.5000000), wk = 0.0017544 k( 238) = ( 0.0288796 0.0288796 0.5000000), wk = 0.0017544 k( 239) = ( 0.0247540 0.0247540 0.5000000), wk = 0.0017544 k( 240) = ( 0.0206283 0.0206283 0.5000000), wk = 0.0017544 k( 241) = ( 0.0165026 0.0165026 0.5000000), wk = 0.0017544 k( 242) = ( 0.0123770 0.0123770 0.5000000), wk = 0.0017544 k( 243) = ( 0.0082513 0.0082513 0.5000000), wk = 0.0017544 k( 244) = ( 0.0041257 0.0041257 0.5000000), wk = 0.0017544 k( 245) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017544 k( 246) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017544 k( 247) = ( 0.0000000 0.0000000 0.4868421), wk = 0.0017544 k( 248) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0017544 k( 249) = ( 0.0000000 0.0000000 0.4605263), wk = 0.0017544 k( 250) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0017544 k( 251) = ( 0.0000000 0.0000000 0.4342105), wk = 0.0017544 k( 252) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0017544 k( 253) = ( 0.0000000 0.0000000 0.4078947), wk = 0.0017544 k( 254) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0017544 k( 255) = ( 0.0000000 0.0000000 0.3815790), wk = 0.0017544 k( 256) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0017544 k( 257) = ( 0.0000000 0.0000000 0.3552632), wk = 0.0017544 k( 258) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0017544 k( 259) = ( 0.0000000 0.0000000 0.3289474), wk = 0.0017544 k( 260) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0017544 k( 261) = ( 0.0000000 0.0000000 0.3026316), wk = 0.0017544 k( 262) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0017544 k( 263) = ( 0.0000000 0.0000000 0.2763158), wk = 0.0017544 k( 264) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0017544 k( 265) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0017544 k( 266) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0017544 k( 267) = ( 0.0000000 0.0000000 0.2236842), wk = 0.0017544 k( 268) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0017544 k( 269) = ( 0.0000000 0.0000000 0.1973684), wk = 0.0017544 k( 270) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0017544 k( 271) = ( 0.0000000 0.0000000 0.1710526), wk = 0.0017544 k( 272) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0017544 k( 273) = ( 0.0000000 0.0000000 0.1447368), wk = 0.0017544 k( 274) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0017544 k( 275) = ( 0.0000000 0.0000000 0.1184211), wk = 0.0017544 k( 276) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0017544 k( 277) = ( 0.0000000 0.0000000 0.0921053), wk = 0.0017544 k( 278) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0017544 k( 279) = ( 0.0000000 0.0000000 0.0657895), wk = 0.0017544 k( 280) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0017544 k( 281) = ( 0.0000000 0.0000000 0.0394737), wk = 0.0017544 k( 282) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0017544 k( 283) = ( 0.0000000 0.0000000 0.0131579), wk = 0.0017544 k( 284) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 285) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0017544 k( 286) = ( -0.0094340 0.0094340 0.0000000), wk = 0.0017544 k( 287) = ( -0.0188679 0.0188679 0.0000000), wk = 0.0017544 k( 288) = ( -0.0283019 0.0283019 0.0000000), wk = 0.0017544 k( 289) = ( -0.0377359 0.0377359 -0.0000000), wk = 0.0017544 k( 290) = ( -0.0471698 0.0471698 0.0000000), wk = 0.0017544 k( 291) = ( -0.0566038 0.0566038 0.0000000), wk = 0.0017544 k( 292) = ( -0.0660377 0.0660377 0.0000000), wk = 0.0017544 k( 293) = ( -0.0754717 0.0754717 -0.0000000), wk = 0.0017544 k( 294) = ( -0.0849057 0.0849057 0.0000000), wk = 0.0017544 k( 295) = ( -0.0943396 0.0943396 0.0000000), wk = 0.0017544 k( 296) = ( -0.1037736 0.1037736 0.0000000), wk = 0.0017544 k( 297) = ( -0.1132076 0.1132076 0.0000000), wk = 0.0017544 k( 298) = ( -0.1226415 0.1226415 0.0000000), wk = 0.0017544 k( 299) = ( -0.1320755 0.1320755 0.0000000), wk = 0.0017544 k( 300) = ( -0.1415094 0.1415094 -0.0000000), wk = 0.0017544 k( 301) = ( -0.1509434 0.1509434 -0.0000000), wk = 0.0017544 k( 302) = ( -0.1603774 0.1603774 -0.0000000), wk = 0.0017544 k( 303) = ( -0.1698113 0.1698113 0.0000000), wk = 0.0017544 k( 304) = ( -0.1792453 0.1792453 0.0000000), wk = 0.0017544 k( 305) = ( -0.1886792 0.1886792 0.0000000), wk = 0.0017544 k( 306) = ( -0.1981132 0.1981132 0.0000000), wk = 0.0017544 k( 307) = ( -0.2075472 0.2075472 0.0000000), wk = 0.0017544 k( 308) = ( -0.2169811 0.2169811 0.0000000), wk = 0.0017544 k( 309) = ( -0.2264151 0.2264151 0.0000000), wk = 0.0017544 k( 310) = ( -0.2358491 0.2358491 0.0000000), wk = 0.0017544 k( 311) = ( -0.2452830 0.2452830 0.0000000), wk = 0.0017544 k( 312) = ( -0.2547170 0.2547170 0.0000000), wk = 0.0017544 k( 313) = ( -0.2641509 0.2641509 0.0000000), wk = 0.0017544 k( 314) = ( -0.2735849 0.2735849 0.0000000), wk = 0.0017544 k( 315) = ( -0.2830189 0.2830189 0.0000000), wk = 0.0017544 k( 316) = ( -0.2924528 0.2924528 0.0000000), wk = 0.0017544 k( 317) = ( -0.3018868 0.3018868 -0.0000000), wk = 0.0017544 k( 318) = ( -0.3113207 0.3113208 0.0000000), wk = 0.0017544 k( 319) = ( -0.3207547 0.3207547 -0.0000000), wk = 0.0017544 k( 320) = ( -0.3301887 0.3301887 -0.0000000), wk = 0.0017544 k( 321) = ( -0.3396226 0.3396226 0.0000000), wk = 0.0017544 k( 322) = ( -0.3490566 0.3490566 0.0000000), wk = 0.0017544 k( 323) = ( -0.3584906 0.3584906 -0.0000000), wk = 0.0017544 k( 324) = ( -0.3679245 0.3679245 0.0000000), wk = 0.0017544 k( 325) = ( -0.3773585 0.3773585 -0.0000000), wk = 0.0017544 k( 326) = ( -0.3867925 0.3867925 0.0000000), wk = 0.0017544 k( 327) = ( -0.3962264 0.3962264 0.0000000), wk = 0.0017544 k( 328) = ( -0.4056604 0.4056604 0.0000000), wk = 0.0017544 k( 329) = ( -0.4150943 0.4150943 0.0000000), wk = 0.0017544 k( 330) = ( -0.4245283 0.4245283 0.0000000), wk = 0.0017544 k( 331) = ( -0.4339623 0.4339623 0.0000000), wk = 0.0017544 k( 332) = ( -0.4433962 0.4433962 0.0000000), wk = 0.0017544 k( 333) = ( -0.4528302 0.4528302 0.0000000), wk = 0.0017544 k( 334) = ( -0.4622641 0.4622642 -0.0000000), wk = 0.0017544 k( 335) = ( -0.4716981 0.4716981 0.0000000), wk = 0.0017544 k( 336) = ( -0.4811321 0.4811321 0.0000000), wk = 0.0017544 k( 337) = ( -0.4905660 0.4905660 0.0000000), wk = 0.0017544 k( 338) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0017544 k( 339) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0017544 k( 340) = ( -0.4958581 0.5041419 -0.0000000), wk = 0.0017544 k( 341) = ( -0.4917162 0.5082838 0.0000000), wk = 0.0017544 k( 342) = ( -0.4875743 0.5124257 0.0000000), wk = 0.0017544 k( 343) = ( -0.4834325 0.5165675 0.0000000), wk = 0.0017544 k( 344) = ( -0.4792906 0.5207094 -0.0000000), wk = 0.0017544 k( 345) = ( -0.4751487 0.5248513 0.0000000), wk = 0.0017544 k( 346) = ( -0.4710068 0.5289932 0.0000000), wk = 0.0017544 k( 347) = ( -0.4668649 0.5331351 -0.0000000), wk = 0.0017544 k( 348) = ( -0.4627230 0.5372770 -0.0000000), wk = 0.0017544 k( 349) = ( -0.4585811 0.5414189 0.0000000), wk = 0.0017544 k( 350) = ( -0.4544392 0.5455608 0.0000000), wk = 0.0017544 k( 351) = ( -0.4502974 0.5497026 -0.0000000), wk = 0.0017544 k( 352) = ( -0.4461555 0.5538445 0.0000000), wk = 0.0017544 k( 353) = ( -0.4420136 0.5579864 0.0000000), wk = 0.0017544 k( 354) = ( -0.4378717 0.5621283 0.0000000), wk = 0.0017544 k( 355) = ( -0.4337298 0.5662702 -0.0000000), wk = 0.0017544 k( 356) = ( -0.4295879 0.5704121 0.0000000), wk = 0.0017544 k( 357) = ( -0.4254460 0.5745540 0.0000000), wk = 0.0017544 k( 358) = ( -0.4213041 0.5786959 0.0000000), wk = 0.0017544 k( 359) = ( -0.4171623 0.5828377 0.0000000), wk = 0.0017544 k( 360) = ( -0.4130204 0.5869796 0.0000000), wk = 0.0017544 k( 361) = ( -0.4088785 0.5911215 -0.0000000), wk = 0.0017544 k( 362) = ( -0.4047366 0.5952634 -0.0000000), wk = 0.0017544 k( 363) = ( -0.4005947 0.5994053 0.0000000), wk = 0.0017544 k( 364) = ( -0.3964528 0.6035472 0.0000000), wk = 0.0017544 k( 365) = ( -0.3923109 0.6076891 0.0000000), wk = 0.0017544 k( 366) = ( -0.3881691 0.6118310 0.0000000), wk = 0.0017544 k( 367) = ( -0.3840272 0.6159728 0.0000000), wk = 0.0017544 k( 368) = ( -0.3798853 0.6201147 0.0000000), wk = 0.0017544 k( 369) = ( -0.3757434 0.6242566 -0.0000000), wk = 0.0017544 k( 370) = ( -0.3716015 0.6283985 0.0000000), wk = 0.0017544 k( 371) = ( -0.3674596 0.6325404 0.0000000), wk = 0.0017544 k( 372) = ( -0.3633177 0.6366823 0.0000000), wk = 0.0017544 k( 373) = ( -0.3591758 0.6408242 -0.0000000), wk = 0.0017544 k( 374) = ( -0.3550340 0.6449660 0.0000000), wk = 0.0017544 k( 375) = ( -0.3508921 0.6491079 0.0000000), wk = 0.0017544 k( 376) = ( -0.3467502 0.6532498 0.0000000), wk = 0.0017544 k( 377) = ( -0.3426083 0.6573917 0.0000000), wk = 0.0017544 k( 378) = ( -0.3384664 0.6615336 0.0000000), wk = 0.0017544 k( 379) = ( -0.3343245 0.6656755 -0.0000000), wk = 0.0017544 k( 380) = ( -0.3301826 0.6698174 0.0000000), wk = 0.0017544 k( 381) = ( -0.3260407 0.6739593 0.0000000), wk = 0.0017544 k( 382) = ( -0.3218989 0.6781011 -0.0000000), wk = 0.0017544 k( 383) = ( -0.3177570 0.6822430 0.0000000), wk = 0.0017544 k( 384) = ( -0.3136151 0.6863849 0.0000000), wk = 0.0017544 k( 385) = ( -0.3094732 0.6905268 0.0000000), wk = 0.0017544 k( 386) = ( -0.3053313 0.6946687 -0.0000000), wk = 0.0017544 k( 387) = ( -0.3011894 0.6988106 0.0000000), wk = 0.0017544 k( 388) = ( -0.2970475 0.7029525 0.0000000), wk = 0.0017544 k( 389) = ( -0.2970475 0.7029525 0.0000000), wk = 0.0017544 k( 390) = ( -0.2970475 0.7029525 0.0131579), wk = 0.0017544 k( 391) = ( -0.2970475 0.7029525 0.0263158), wk = 0.0017544 k( 392) = ( -0.2970475 0.7029525 0.0394737), wk = 0.0017544 k( 393) = ( -0.2970475 0.7029525 0.0526316), wk = 0.0017544 k( 394) = ( -0.2970475 0.7029525 0.0657895), wk = 0.0017544 k( 395) = ( -0.2970475 0.7029525 0.0789474), wk = 0.0017544 k( 396) = ( -0.2970475 0.7029525 0.0921053), wk = 0.0017544 k( 397) = ( -0.2970475 0.7029525 0.1052632), wk = 0.0017544 k( 398) = ( -0.2970475 0.7029525 0.1184211), wk = 0.0017544 k( 399) = ( -0.2970475 0.7029525 0.1315790), wk = 0.0017544 k( 400) = ( -0.2970475 0.7029525 0.1447368), wk = 0.0017544 k( 401) = ( -0.2970475 0.7029525 0.1578947), wk = 0.0017544 k( 402) = ( -0.2970475 0.7029525 0.1710526), wk = 0.0017544 k( 403) = ( -0.2970475 0.7029525 0.1842105), wk = 0.0017544 k( 404) = ( -0.2970475 0.7029525 0.1973684), wk = 0.0017544 k( 405) = ( -0.2970475 0.7029525 0.2105263), wk = 0.0017544 k( 406) = ( -0.2970475 0.7029525 0.2236842), wk = 0.0017544 k( 407) = ( -0.2970475 0.7029525 0.2368421), wk = 0.0017544 k( 408) = ( -0.2970475 0.7029525 0.2500000), wk = 0.0017544 k( 409) = ( -0.2970475 0.7029525 0.2631579), wk = 0.0017544 k( 410) = ( -0.2970475 0.7029525 0.2763158), wk = 0.0017544 k( 411) = ( -0.2970475 0.7029525 0.2894737), wk = 0.0017544 k( 412) = ( -0.2970475 0.7029525 0.3026316), wk = 0.0017544 k( 413) = ( -0.2970475 0.7029525 0.3157895), wk = 0.0017544 k( 414) = ( -0.2970475 0.7029525 0.3289474), wk = 0.0017544 k( 415) = ( -0.2970475 0.7029525 0.3421053), wk = 0.0017544 k( 416) = ( -0.2970475 0.7029525 0.3552632), wk = 0.0017544 k( 417) = ( -0.2970475 0.7029525 0.3684211), wk = 0.0017544 k( 418) = ( -0.2970475 0.7029525 0.3815790), wk = 0.0017544 k( 419) = ( -0.2970475 0.7029525 0.3947368), wk = 0.0017544 k( 420) = ( -0.2970475 0.7029525 0.4078947), wk = 0.0017544 k( 421) = ( -0.2970475 0.7029525 0.4210526), wk = 0.0017544 k( 422) = ( -0.2970475 0.7029525 0.4342105), wk = 0.0017544 k( 423) = ( -0.2970475 0.7029525 0.4473684), wk = 0.0017544 k( 424) = ( -0.2970475 0.7029525 0.4605263), wk = 0.0017544 k( 425) = ( -0.2970475 0.7029525 0.4736842), wk = 0.0017544 k( 426) = ( -0.2970475 0.7029525 0.4868421), wk = 0.0017544 k( 427) = ( -0.2970475 0.7029525 0.5000000), wk = 0.0017544 k( 428) = ( -0.2970475 0.7029525 0.5000000), wk = 0.0017544 k( 429) = ( -0.3011894 0.6988106 0.5000000), wk = 0.0017544 k( 430) = ( -0.3053313 0.6946687 0.5000000), wk = 0.0017544 k( 431) = ( -0.3094732 0.6905268 0.5000000), wk = 0.0017544 k( 432) = ( -0.3136151 0.6863849 0.5000000), wk = 0.0017544 k( 433) = ( -0.3177570 0.6822430 0.5000000), wk = 0.0017544 k( 434) = ( -0.3218989 0.6781011 0.5000000), wk = 0.0017544 k( 435) = ( -0.3260407 0.6739593 0.5000000), wk = 0.0017544 k( 436) = ( -0.3301826 0.6698174 0.5000000), wk = 0.0017544 k( 437) = ( -0.3343245 0.6656755 0.5000000), wk = 0.0017544 k( 438) = ( -0.3384664 0.6615336 0.5000000), wk = 0.0017544 k( 439) = ( -0.3426083 0.6573917 0.5000000), wk = 0.0017544 k( 440) = ( -0.3467502 0.6532498 0.5000000), wk = 0.0017544 k( 441) = ( -0.3508921 0.6491079 0.5000000), wk = 0.0017544 k( 442) = ( -0.3550340 0.6449660 0.5000000), wk = 0.0017544 k( 443) = ( -0.3591758 0.6408242 0.5000000), wk = 0.0017544 k( 444) = ( -0.3633177 0.6366823 0.5000000), wk = 0.0017544 k( 445) = ( -0.3674596 0.6325404 0.5000000), wk = 0.0017544 k( 446) = ( -0.3716015 0.6283985 0.5000000), wk = 0.0017544 k( 447) = ( -0.3757434 0.6242566 0.5000000), wk = 0.0017544 k( 448) = ( -0.3798853 0.6201147 0.5000000), wk = 0.0017544 k( 449) = ( -0.3840272 0.6159728 0.5000000), wk = 0.0017544 k( 450) = ( -0.3881691 0.6118310 0.5000000), wk = 0.0017544 k( 451) = ( -0.3923109 0.6076891 0.5000000), wk = 0.0017544 k( 452) = ( -0.3964528 0.6035472 0.5000000), wk = 0.0017544 k( 453) = ( -0.4005947 0.5994053 0.5000000), wk = 0.0017544 k( 454) = ( -0.4047366 0.5952634 0.5000000), wk = 0.0017544 k( 455) = ( -0.4088785 0.5911215 0.5000000), wk = 0.0017544 k( 456) = ( -0.4130204 0.5869796 0.5000000), wk = 0.0017544 k( 457) = ( -0.4171623 0.5828377 0.5000000), wk = 0.0017544 k( 458) = ( -0.4213041 0.5786959 0.5000000), wk = 0.0017544 k( 459) = ( -0.4254460 0.5745540 0.5000000), wk = 0.0017544 k( 460) = ( -0.4295879 0.5704121 0.5000000), wk = 0.0017544 k( 461) = ( -0.4337298 0.5662702 0.5000000), wk = 0.0017544 k( 462) = ( -0.4378717 0.5621283 0.5000000), wk = 0.0017544 k( 463) = ( -0.4420136 0.5579864 0.5000000), wk = 0.0017544 k( 464) = ( -0.4461555 0.5538445 0.5000000), wk = 0.0017544 k( 465) = ( -0.4502974 0.5497026 0.5000000), wk = 0.0017544 k( 466) = ( -0.4544392 0.5455608 0.5000000), wk = 0.0017544 k( 467) = ( -0.4585811 0.5414189 0.5000000), wk = 0.0017544 k( 468) = ( -0.4627230 0.5372770 0.5000000), wk = 0.0017544 k( 469) = ( -0.4668649 0.5331351 0.5000000), wk = 0.0017544 k( 470) = ( -0.4710068 0.5289932 0.5000000), wk = 0.0017544 k( 471) = ( -0.4751487 0.5248513 0.5000000), wk = 0.0017544 k( 472) = ( -0.4792906 0.5207094 0.5000000), wk = 0.0017544 k( 473) = ( -0.4834325 0.5165675 0.5000000), wk = 0.0017544 k( 474) = ( -0.4875743 0.5124257 0.5000000), wk = 0.0017544 k( 475) = ( -0.4917162 0.5082838 0.5000000), wk = 0.0017544 k( 476) = ( -0.4958581 0.5041419 0.5000000), wk = 0.0017544 k( 477) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0017544 k( 478) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0017544 k( 479) = ( -0.5000000 0.5000000 0.4868421), wk = 0.0017544 k( 480) = ( -0.5000000 0.5000000 0.4736842), wk = 0.0017544 k( 481) = ( -0.5000000 0.5000000 0.4605263), wk = 0.0017544 k( 482) = ( -0.5000000 0.5000000 0.4473684), wk = 0.0017544 k( 483) = ( -0.5000000 0.5000000 0.4342105), wk = 0.0017544 k( 484) = ( -0.5000000 0.5000000 0.4210526), wk = 0.0017544 k( 485) = ( -0.5000000 0.5000000 0.4078947), wk = 0.0017544 k( 486) = ( -0.5000000 0.5000000 0.3947368), wk = 0.0017544 k( 487) = ( -0.5000000 0.5000000 0.3815790), wk = 0.0017544 k( 488) = ( -0.5000000 0.5000000 0.3684211), wk = 0.0017544 k( 489) = ( -0.5000000 0.5000000 0.3552632), wk = 0.0017544 k( 490) = ( -0.5000000 0.5000000 0.3421053), wk = 0.0017544 k( 491) = ( -0.5000000 0.5000000 0.3289474), wk = 0.0017544 k( 492) = ( -0.5000000 0.5000000 0.3157895), wk = 0.0017544 k( 493) = ( -0.5000000 0.5000000 0.3026316), wk = 0.0017544 k( 494) = ( -0.5000000 0.5000000 0.2894737), wk = 0.0017544 k( 495) = ( -0.5000000 0.5000000 0.2763158), wk = 0.0017544 k( 496) = ( -0.5000000 0.5000000 0.2631579), wk = 0.0017544 k( 497) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0017544 k( 498) = ( -0.5000000 0.5000000 0.2368421), wk = 0.0017544 k( 499) = ( -0.5000000 0.5000000 0.2236842), wk = 0.0017544 k( 500) = ( -0.5000000 0.5000000 0.2105263), wk = 0.0017544 k( 501) = ( -0.5000000 0.5000000 0.1973684), wk = 0.0017544 k( 502) = ( -0.5000000 0.5000000 0.1842105), wk = 0.0017544 k( 503) = ( -0.5000000 0.5000000 0.1710526), wk = 0.0017544 k( 504) = ( -0.5000000 0.5000000 0.1578947), wk = 0.0017544 k( 505) = ( -0.5000000 0.5000000 0.1447368), wk = 0.0017544 k( 506) = ( -0.5000000 0.5000000 0.1315790), wk = 0.0017544 k( 507) = ( -0.5000000 0.5000000 0.1184211), wk = 0.0017544 k( 508) = ( -0.5000000 0.5000000 0.1052632), wk = 0.0017544 k( 509) = ( -0.5000000 0.5000000 0.0921053), wk = 0.0017544 k( 510) = ( -0.5000000 0.5000000 0.0789474), wk = 0.0017544 k( 511) = ( -0.5000000 0.5000000 0.0657895), wk = 0.0017544 k( 512) = ( -0.5000000 0.5000000 0.0526316), wk = 0.0017544 k( 513) = ( -0.5000000 0.5000000 0.0394737), wk = 0.0017544 k( 514) = ( -0.5000000 0.5000000 0.0263158), wk = 0.0017544 k( 515) = ( -0.5000000 0.5000000 0.0131579), wk = 0.0017544 k( 516) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0017544 k( 517) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0017544 k( 518) = ( -0.0094340 0.0094340 0.5000000), wk = 0.0017544 k( 519) = ( -0.0188679 0.0188679 0.5000000), wk = 0.0017544 k( 520) = ( -0.0283019 0.0283019 0.5000000), wk = 0.0017544 k( 521) = ( -0.0377359 0.0377359 0.5000000), wk = 0.0017544 k( 522) = ( -0.0471698 0.0471698 0.5000000), wk = 0.0017544 k( 523) = ( -0.0566038 0.0566038 0.5000000), wk = 0.0017544 k( 524) = ( -0.0660377 0.0660377 0.5000000), wk = 0.0017544 k( 525) = ( -0.0754717 0.0754717 0.5000000), wk = 0.0017544 k( 526) = ( -0.0849057 0.0849057 0.5000000), wk = 0.0017544 k( 527) = ( -0.0943396 0.0943396 0.5000000), wk = 0.0017544 k( 528) = ( -0.1037736 0.1037736 0.5000000), wk = 0.0017544 k( 529) = ( -0.1132076 0.1132076 0.5000000), wk = 0.0017544 k( 530) = ( -0.1226415 0.1226415 0.5000000), wk = 0.0017544 k( 531) = ( -0.1320755 0.1320755 0.5000000), wk = 0.0017544 k( 532) = ( -0.1415094 0.1415094 0.5000000), wk = 0.0017544 k( 533) = ( -0.1509434 0.1509434 0.5000000), wk = 0.0017544 k( 534) = ( -0.1603774 0.1603774 0.5000000), wk = 0.0017544 k( 535) = ( -0.1698113 0.1698113 0.5000000), wk = 0.0017544 k( 536) = ( -0.1792453 0.1792453 0.5000000), wk = 0.0017544 k( 537) = ( -0.1886792 0.1886792 0.5000000), wk = 0.0017544 k( 538) = ( -0.1981132 0.1981132 0.5000000), wk = 0.0017544 k( 539) = ( -0.2075472 0.2075472 0.5000000), wk = 0.0017544 k( 540) = ( -0.2169811 0.2169811 0.5000000), wk = 0.0017544 k( 541) = ( -0.2264151 0.2264151 0.5000000), wk = 0.0017544 k( 542) = ( -0.2358491 0.2358491 0.5000000), wk = 0.0017544 k( 543) = ( -0.2452830 0.2452830 0.5000000), wk = 0.0017544 k( 544) = ( -0.2547170 0.2547170 0.5000000), wk = 0.0017544 k( 545) = ( -0.2641509 0.2641509 0.5000000), wk = 0.0017544 k( 546) = ( -0.2735849 0.2735849 0.5000000), wk = 0.0017544 k( 547) = ( -0.2830189 0.2830189 0.5000000), wk = 0.0017544 k( 548) = ( -0.2924528 0.2924528 0.5000000), wk = 0.0017544 k( 549) = ( -0.3018868 0.3018868 0.5000000), wk = 0.0017544 k( 550) = ( -0.3113207 0.3113208 0.5000000), wk = 0.0017544 k( 551) = ( -0.3207547 0.3207547 0.5000000), wk = 0.0017544 k( 552) = ( -0.3301887 0.3301887 0.5000000), wk = 0.0017544 k( 553) = ( -0.3396226 0.3396226 0.5000000), wk = 0.0017544 k( 554) = ( -0.3490566 0.3490566 0.5000000), wk = 0.0017544 k( 555) = ( -0.3584906 0.3584906 0.5000000), wk = 0.0017544 k( 556) = ( -0.3679245 0.3679245 0.5000000), wk = 0.0017544 k( 557) = ( -0.3773585 0.3773585 0.5000000), wk = 0.0017544 k( 558) = ( -0.3867925 0.3867925 0.5000000), wk = 0.0017544 k( 559) = ( -0.3962264 0.3962264 0.5000000), wk = 0.0017544 k( 560) = ( -0.4056604 0.4056604 0.5000000), wk = 0.0017544 k( 561) = ( -0.4150943 0.4150943 0.5000000), wk = 0.0017544 k( 562) = ( -0.4245283 0.4245283 0.5000000), wk = 0.0017544 k( 563) = ( -0.4339623 0.4339623 0.5000000), wk = 0.0017544 k( 564) = ( -0.4433962 0.4433962 0.5000000), wk = 0.0017544 k( 565) = ( -0.4528302 0.4528302 0.5000000), wk = 0.0017544 k( 566) = ( -0.4622641 0.4622642 0.5000000), wk = 0.0017544 k( 567) = ( -0.4716981 0.4716981 0.5000000), wk = 0.0017544 k( 568) = ( -0.4811321 0.4811321 0.5000000), wk = 0.0017544 k( 569) = ( -0.4905660 0.4905660 0.5000000), wk = 0.0017544 k( 570) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0017544 Dense grid: 15439 G-vectors FFT dimensions: ( 32, 32, 40) Smooth grid: 9327 G-vectors FFT dimensions: ( 27, 27, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.03 Mb ( 58, 36) NL pseudopotentials 0.04 Mb ( 29, 80) Each V/rho on FFT grid 0.02 Mb ( 1024) Each G-vector array 0.00 Mb ( 322) G-vector shells 0.00 Mb ( 167) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.13 Mb ( 58, 144) Each subspace H/S matrix 0.32 Mb ( 144, 144) Each matrix 0.09 Mb ( 80, 2, 36) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./YH3.save/charge-density.dat Starting wfc are 64 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 41.0 secs Computing kpt #: 2 total cpu time spent up to now is 41.4 secs Computing kpt #: 3 total cpu time spent up to now is 41.8 secs Computing kpt #: 4 total cpu time spent up to now is 42.2 secs Computing kpt #: 5 total cpu time spent up to now is 42.7 secs Computing kpt #: 6 total cpu time spent up to now is 43.1 secs Computing kpt #: 7 total cpu time spent up to now is 43.4 secs Computing kpt #: 8 total cpu time spent up to now is 43.8 secs Computing kpt #: 9 total cpu time spent up to now is 44.2 secs Computing kpt #: 10 total cpu time spent up to now is 44.6 secs Computing kpt #: 11 total cpu time spent up to now is 45.0 secs Computing kpt #: 12 total cpu time spent up to now is 45.4 secs Computing kpt #: 13 total cpu time spent up to now is 45.8 secs Computing kpt #: 14 total cpu time spent up to now is 46.2 secs Computing kpt #: 15 total cpu time spent up to now is 46.6 secs Computing kpt #: 16 total cpu time spent up to now is 46.9 secs Computing kpt #: 17 total cpu time spent up to now is 47.3 secs Computing kpt #: 18 total cpu time spent up to now is 47.7 secs Computing kpt #: 19 total cpu time spent up to now is 48.1 secs Computing kpt #: 20 total cpu time spent up to now is 48.5 secs Computing kpt #: 21 total cpu time spent up to now is 48.9 secs Computing kpt #: 22 total cpu time spent up to now is 49.3 secs Computing kpt #: 23 total cpu time spent up to now is 49.7 secs Computing kpt #: 24 total cpu time spent up to now is 50.0 secs Computing kpt #: 25 total cpu time spent up to now is 50.4 secs Computing kpt #: 26 total cpu time spent up to now is 50.8 secs Computing kpt #: 27 total cpu time spent up to now is 51.3 secs Computing kpt #: 28 total cpu time spent up to now is 51.7 secs Computing kpt #: 29 total cpu time spent up to now is 52.1 secs Computing kpt #: 30 total cpu time spent up to now is 52.5 secs Computing kpt #: 31 total cpu time spent up to now is 52.9 secs Computing kpt #: 32 total cpu time spent up to now is 53.4 secs Computing kpt #: 33 total cpu time spent up to now is 53.8 secs Computing kpt #: 34 total cpu time spent up to now is 54.3 secs Computing kpt #: 35 total cpu time spent up to now is 54.7 secs Computing kpt #: 36 total cpu time spent up to now is 55.2 secs Computing kpt #: 37 total cpu time spent up to now is 55.5 secs Computing kpt #: 38 total cpu time spent up to now is 55.9 secs Computing kpt #: 39 total cpu time spent up to now is 56.3 secs Computing kpt #: 40 total cpu time spent up to now is 56.7 secs Computing kpt #: 41 total cpu time spent up to now is 57.1 secs Computing kpt #: 42 total cpu time spent up to now is 57.5 secs Computing kpt #: 43 total cpu time spent up to now is 58.0 secs Computing kpt #: 44 total cpu time spent up to now is 58.4 secs Computing kpt #: 45 total cpu time spent up to now is 58.9 secs Computing kpt #: 46 total cpu time spent up to now is 59.3 secs Computing kpt #: 47 total cpu time spent up to now is 59.9 secs Computing kpt #: 48 total cpu time spent up to now is 60.3 secs Computing kpt #: 49 total cpu time spent up to now is 60.8 secs Computing kpt #: 50 total cpu time spent up to now is 61.2 secs Computing kpt #: 51 total cpu time spent up to now is 61.7 secs Computing kpt #: 52 total cpu time spent up to now is 62.3 secs Computing kpt #: 53 total cpu time spent up to now is 62.9 secs Computing kpt #: 54 total cpu time spent up to now is 63.4 secs Computing kpt #: 55 total cpu time spent up to now is 63.9 secs Computing kpt #: 56 total cpu time spent up to now is 64.3 secs Computing kpt #: 57 total cpu time spent up to now is 64.8 secs Computing kpt #: 58 total cpu time spent up to now is 65.3 secs Computing kpt #: 59 total cpu time spent up to now is 65.9 secs Computing kpt #: 60 total cpu time spent up to now is 66.5 secs Computing kpt #: 61 total cpu time spent up to now is 67.1 secs Computing kpt #: 62 total cpu time spent up to now is 67.7 secs Computing kpt #: 63 total cpu time spent up to now is 68.4 secs Computing kpt #: 64 total cpu time spent up to now is 69.0 secs Computing kpt #: 65 total cpu time spent up to now is 69.6 secs Computing kpt #: 66 total cpu time spent up to now is 70.2 secs Computing kpt #: 67 total cpu time spent up to now is 70.8 secs Computing kpt #: 68 total cpu time spent up to now is 71.3 secs Computing kpt #: 69 total cpu time spent up to now is 71.9 secs Computing kpt #: 70 total cpu time spent up to now is 72.4 secs Computing kpt #: 71 total cpu time spent up to now is 72.9 secs Computing kpt #: 72 total cpu time spent up to now is 73.3 secs Computing kpt #: 73 total cpu time spent up to now is 73.8 secs Computing kpt #: 74 total cpu time spent up to now is 74.3 secs Computing kpt #: 75 total cpu time spent up to now is 74.8 secs Computing kpt #: 76 total cpu time spent up to now is 75.3 secs Computing kpt #: 77 total cpu time spent up to now is 75.8 secs Computing kpt #: 78 total cpu time spent up to now is 76.3 secs Computing kpt #: 79 total cpu time spent up to now is 76.7 secs Computing kpt #: 80 total cpu time spent up to now is 77.2 secs Computing kpt #: 81 total cpu time spent up to now is 77.7 secs Computing kpt #: 82 total cpu time spent up to now is 78.1 secs Computing kpt #: 83 total cpu time spent up to now is 78.5 secs Computing kpt #: 84 total cpu time spent up to now is 78.9 secs Computing kpt #: 85 total cpu time spent up to now is 79.3 secs Computing kpt #: 86 total cpu time spent up to now is 79.7 secs Computing kpt #: 87 total cpu time spent up to now is 80.2 secs Computing kpt #: 88 total cpu time spent up to now is 80.6 secs Computing kpt #: 89 total cpu time spent up to now is 81.0 secs Computing kpt #: 90 total cpu time spent up to now is 81.5 secs Computing kpt #: 91 total cpu time spent up to now is 81.9 secs Computing kpt #: 92 total cpu time spent up to now is 82.3 secs Computing kpt #: 93 total cpu time spent up to now is 82.8 secs Computing kpt #: 94 total cpu time spent up to now is 83.3 secs Computing kpt #: 95 total cpu time spent up to now is 83.7 secs Computing kpt #: 96 total cpu time spent up to now is 84.1 secs Computing kpt #: 97 total cpu time spent up to now is 84.6 secs Computing kpt #: 98 total cpu time spent up to now is 85.0 secs Computing kpt #: 99 total cpu time spent up to now is 85.4 secs Computing kpt #: 100 total cpu time spent up to now is 85.8 secs Computing kpt #: 101 total cpu time spent up to now is 86.3 secs Computing kpt #: 102 total cpu time spent up to now is 86.7 secs Computing kpt #: 103 total cpu time spent up to now is 87.1 secs Computing kpt #: 104 total cpu time spent up to now is 87.6 secs Computing kpt #: 105 total cpu time spent up to now is 88.1 secs Computing kpt #: 106 total cpu time spent up to now is 88.6 secs Computing kpt #: 107 total cpu time spent up to now is 89.1 secs Computing kpt #: 108 total cpu time spent up to now is 89.6 secs Computing kpt #: 109 total cpu time spent up to now is 90.1 secs Computing kpt #: 110 total cpu time spent up to now is 90.5 secs Computing kpt #: 111 total cpu time spent up to now is 91.0 secs Computing kpt #: 112 total cpu time spent up to now is 91.4 secs Computing kpt #: 113 total cpu time spent up to now is 91.8 secs Computing kpt #: 114 total cpu time spent up to now is 92.2 secs Computing kpt #: 115 total cpu time spent up to now is 92.6 secs Computing kpt #: 116 total cpu time spent up to now is 93.0 secs Computing kpt #: 117 total cpu time spent up to now is 93.4 secs Computing kpt #: 118 total cpu time spent up to now is 94.0 secs Computing kpt #: 119 total cpu time spent up to now is 94.4 secs Computing kpt #: 120 total cpu time spent up to now is 94.8 secs Computing kpt #: 121 total cpu time spent up to now is 95.2 secs Computing kpt #: 122 total cpu time spent up to now is 95.7 secs Computing kpt #: 123 total cpu time spent up to now is 96.1 secs Computing kpt #: 124 total cpu time spent up to now is 96.5 secs Computing kpt #: 125 total cpu time spent up to now is 96.9 secs Computing kpt #: 126 total cpu time spent up to now is 97.4 secs Computing kpt #: 127 total cpu time spent up to now is 97.8 secs Computing kpt #: 128 total cpu time spent up to now is 98.2 secs Computing kpt #: 129 total cpu time spent up to now is 98.6 secs Computing kpt #: 130 total cpu time spent up to now is 99.0 secs Computing kpt #: 131 total cpu time spent up to now is 99.6 secs Computing kpt #: 132 total cpu time spent up to now is 100.1 secs Computing kpt #: 133 total cpu time spent up to now is 100.5 secs Computing kpt #: 134 total cpu time spent up to now is 100.9 secs Computing kpt #: 135 total cpu time spent up to now is 101.5 secs Computing kpt #: 136 total cpu time spent up to now is 101.9 secs Computing kpt #: 137 total cpu time spent up to now is 102.4 secs Computing kpt #: 138 total cpu time spent up to now is 102.8 secs Computing kpt #: 139 total cpu time spent up to now is 103.2 secs Computing kpt #: 140 total cpu time spent up to now is 103.6 secs Computing kpt #: 141 total cpu time spent up to now is 104.4 secs Computing kpt #: 142 total cpu time spent up to now is 104.8 secs Computing kpt #: 143 total cpu time spent up to now is 105.2 secs Computing kpt #: 144 total cpu time spent up to now is 105.7 secs Computing kpt #: 145 total cpu time spent up to now is 106.1 secs Computing kpt #: 146 total cpu time spent up to now is 106.7 secs Computing kpt #: 147 total cpu time spent up to now is 107.1 secs Computing kpt #: 148 total cpu time spent up to now is 107.5 secs Computing kpt #: 149 total cpu time spent up to now is 107.9 secs Computing kpt #: 150 total cpu time spent up to now is 108.2 secs Computing kpt #: 151 total cpu time spent up to now is 108.6 secs Computing kpt #: 152 total cpu time spent up to now is 109.1 secs Computing kpt #: 153 total cpu time spent up to now is 109.5 secs Computing kpt #: 154 total cpu time spent up to now is 109.9 secs Computing kpt #: 155 total cpu time spent up to now is 110.3 secs Computing kpt #: 156 total cpu time spent up to now is 110.7 secs Computing kpt #: 157 total cpu time spent up to now is 111.1 secs Computing kpt #: 158 total cpu time spent up to now is 111.5 secs Computing kpt #: 159 total cpu time spent up to now is 112.0 secs Computing kpt #: 160 total cpu time spent up to now is 112.4 secs Computing kpt #: 161 total cpu time spent up to now is 112.9 secs Computing kpt #: 162 total cpu time spent up to now is 113.4 secs Computing kpt #: 163 total cpu time spent up to now is 113.8 secs Computing kpt #: 164 total cpu time spent up to now is 114.3 secs Computing kpt #: 165 total cpu time spent up to now is 114.8 secs Computing kpt #: 166 total cpu time spent up to now is 115.3 secs Computing kpt #: 167 total cpu time spent up to now is 115.6 secs Computing kpt #: 168 total cpu time spent up to now is 116.0 secs Computing kpt #: 169 total cpu time spent up to now is 116.4 secs Computing kpt #: 170 total cpu time spent up to now is 116.8 secs Computing kpt #: 171 total cpu time spent up to now is 117.2 secs Computing kpt #: 172 total cpu time spent up to now is 117.6 secs Computing kpt #: 173 total cpu time spent up to now is 118.0 secs Computing kpt #: 174 total cpu time spent up to now is 118.6 secs Computing kpt #: 175 total cpu time spent up to now is 119.0 secs Computing kpt #: 176 total cpu time spent up to now is 119.5 secs Computing kpt #: 177 total cpu time spent up to now is 119.9 secs Computing kpt #: 178 total cpu time spent up to now is 120.3 secs Computing kpt #: 179 total cpu time spent up to now is 120.7 secs Computing kpt #: 180 total cpu time spent up to now is 121.1 secs Computing kpt #: 181 total cpu time spent up to now is 121.5 secs Computing kpt #: 182 total cpu time spent up to now is 121.9 secs Computing kpt #: 183 total cpu time spent up to now is 122.3 secs Computing kpt #: 184 total cpu time spent up to now is 122.7 secs Computing kpt #: 185 total cpu time spent up to now is 123.1 secs Computing kpt #: 186 total cpu time spent up to now is 123.5 secs Computing kpt #: 187 total cpu time spent up to now is 124.0 secs Computing kpt #: 188 total cpu time spent up to now is 124.4 secs Computing kpt #: 189 total cpu time spent up to now is 124.9 secs Computing kpt #: 190 total cpu time spent up to now is 125.3 secs Computing kpt #: 191 total cpu time spent up to now is 125.7 secs Computing kpt #: 192 total cpu time spent up to now is 126.2 secs Computing kpt #: 193 total cpu time spent up to now is 126.5 secs Computing kpt #: 194 total cpu time spent up to now is 126.9 secs Computing kpt #: 195 total cpu time spent up to now is 127.3 secs Computing kpt #: 196 total cpu time spent up to now is 127.7 secs Computing kpt #: 197 total cpu time spent up to now is 128.1 secs Computing kpt #: 198 total cpu time spent up to now is 128.5 secs Computing kpt #: 199 total cpu time spent up to now is 128.9 secs Computing kpt #: 200 total cpu time spent up to now is 129.3 secs Computing kpt #: 201 total cpu time spent up to now is 129.7 secs Computing kpt #: 202 total cpu time spent up to now is 130.2 secs Computing kpt #: 203 total cpu time spent up to now is 130.6 secs Computing kpt #: 204 total cpu time spent up to now is 131.1 secs Computing kpt #: 205 total cpu time spent up to now is 131.5 secs Computing kpt #: 206 total cpu time spent up to now is 131.9 secs Computing kpt #: 207 total cpu time spent up to now is 132.3 secs Computing kpt #: 208 total cpu time spent up to now is 132.8 secs Computing kpt #: 209 total cpu time spent up to now is 133.2 secs Computing kpt #: 210 total cpu time spent up to now is 133.5 secs Computing kpt #: 211 total cpu time spent up to now is 133.9 secs Computing kpt #: 212 total cpu time spent up to now is 134.3 secs Computing kpt #: 213 total cpu time spent up to now is 134.7 secs Computing kpt #: 214 total cpu time spent up to now is 135.1 secs Computing kpt #: 215 total cpu time spent up to now is 135.5 secs Computing kpt #: 216 total cpu time spent up to now is 136.0 secs Computing kpt #: 217 total cpu time spent up to now is 136.5 secs Computing kpt #: 218 total cpu time spent up to now is 136.9 secs Computing kpt #: 219 total cpu time spent up to now is 137.3 secs Computing kpt #: 220 total cpu time spent up to now is 137.7 secs Computing kpt #: 221 total cpu time spent up to now is 138.2 secs Computing kpt #: 222 total cpu time spent up to now is 138.6 secs Computing kpt #: 223 total cpu time spent up to now is 139.0 secs Computing kpt #: 224 total cpu time spent up to now is 139.4 secs Computing kpt #: 225 total cpu time spent up to now is 139.8 secs Computing kpt #: 226 total cpu time spent up to now is 140.2 secs Computing kpt #: 227 total cpu time spent up to now is 140.5 secs Computing kpt #: 228 total cpu time spent up to now is 140.9 secs Computing kpt #: 229 total cpu time spent up to now is 141.4 secs Computing kpt #: 230 total cpu time spent up to now is 141.8 secs Computing kpt #: 231 total cpu time spent up to now is 142.2 secs Computing kpt #: 232 total cpu time spent up to now is 142.7 secs Computing kpt #: 233 total cpu time spent up to now is 143.1 secs Computing kpt #: 234 total cpu time spent up to now is 143.5 secs Computing kpt #: 235 total cpu time spent up to now is 144.0 secs Computing kpt #: 236 total cpu time spent up to now is 144.4 secs Computing kpt #: 237 total cpu time spent up to now is 144.9 secs Computing kpt #: 238 total cpu time spent up to now is 145.3 secs Computing kpt #: 239 total cpu time spent up to now is 145.7 secs Computing kpt #: 240 total cpu time spent up to now is 146.1 secs Computing kpt #: 241 total cpu time spent up to now is 146.4 secs Computing kpt #: 242 total cpu time spent up to now is 146.8 secs Computing kpt #: 243 total cpu time spent up to now is 147.2 secs Computing kpt #: 244 total cpu time spent up to now is 147.6 secs Computing kpt #: 245 total cpu time spent up to now is 148.1 secs Computing kpt #: 246 total cpu time spent up to now is 148.5 secs Computing kpt #: 247 total cpu time spent up to now is 149.0 secs Computing kpt #: 248 total cpu time spent up to now is 149.4 secs Computing kpt #: 249 total cpu time spent up to now is 149.7 secs Computing kpt #: 250 total cpu time spent up to now is 150.1 secs Computing kpt #: 251 total cpu time spent up to now is 150.5 secs Computing kpt #: 252 total cpu time spent up to now is 150.9 secs Computing kpt #: 253 total cpu time spent up to now is 151.2 secs Computing kpt #: 254 total cpu time spent up to now is 151.6 secs Computing kpt #: 255 total cpu time spent up to now is 151.9 secs Computing kpt #: 256 total cpu time spent up to now is 152.3 secs Computing kpt #: 257 total cpu time spent up to now is 152.7 secs Computing kpt #: 258 total cpu time spent up to now is 153.1 secs Computing kpt #: 259 total cpu time spent up to now is 153.4 secs Computing kpt #: 260 total cpu time spent up to now is 153.8 secs Computing kpt #: 261 total cpu time spent up to now is 154.2 secs Computing kpt #: 262 total cpu time spent up to now is 154.7 secs Computing kpt #: 263 total cpu time spent up to now is 155.1 secs Computing kpt #: 264 total cpu time spent up to now is 155.5 secs Computing kpt #: 265 total cpu time spent up to now is 155.8 secs Computing kpt #: 266 total cpu time spent up to now is 156.2 secs Computing kpt #: 267 total cpu time spent up to now is 156.6 secs Computing kpt #: 268 total cpu time spent up to now is 157.0 secs Computing kpt #: 269 total cpu time spent up to now is 157.3 secs Computing kpt #: 270 total cpu time spent up to now is 157.7 secs Computing kpt #: 271 total cpu time spent up to now is 158.1 secs Computing kpt #: 272 total cpu time spent up to now is 158.5 secs Computing kpt #: 273 total cpu time spent up to now is 158.9 secs Computing kpt #: 274 total cpu time spent up to now is 159.2 secs Computing kpt #: 275 total cpu time spent up to now is 159.6 secs Computing kpt #: 276 total cpu time spent up to now is 160.1 secs Computing kpt #: 277 total cpu time spent up to now is 160.5 secs Computing kpt #: 278 total cpu time spent up to now is 160.9 secs Computing kpt #: 279 total cpu time spent up to now is 161.3 secs Computing kpt #: 280 total cpu time spent up to now is 161.7 secs Computing kpt #: 281 total cpu time spent up to now is 162.2 secs Computing kpt #: 282 total cpu time spent up to now is 162.6 secs Computing kpt #: 283 total cpu time spent up to now is 163.0 secs Computing kpt #: 284 total cpu time spent up to now is 163.4 secs Computing kpt #: 285 total cpu time spent up to now is 163.7 secs Computing kpt #: 286 total cpu time spent up to now is 164.1 secs Computing kpt #: 287 total cpu time spent up to now is 164.5 secs Computing kpt #: 288 total cpu time spent up to now is 164.8 secs Computing kpt #: 289 total cpu time spent up to now is 165.2 secs Computing kpt #: 290 total cpu time spent up to now is 165.8 secs Computing kpt #: 291 total cpu time spent up to now is 166.2 secs Computing kpt #: 292 total cpu time spent up to now is 166.6 secs Computing kpt #: 293 total cpu time spent up to now is 167.2 secs Computing kpt #: 294 total cpu time spent up to now is 167.7 secs Computing kpt #: 295 total cpu time spent up to now is 168.3 secs Computing kpt #: 296 total cpu time spent up to now is 168.8 secs Computing kpt #: 297 total cpu time spent up to now is 169.4 secs Computing kpt #: 298 total cpu time spent up to now is 170.2 secs Computing kpt #: 299 total cpu time spent up to now is 170.8 secs Computing kpt #: 300 total cpu time spent up to now is 171.5 secs Computing kpt #: 301 total cpu time spent up to now is 172.1 secs Computing kpt #: 302 total cpu time spent up to now is 172.7 secs Computing kpt #: 303 total cpu time spent up to now is 173.4 secs Computing kpt #: 304 total cpu time spent up to now is 174.0 secs Computing kpt #: 305 total cpu time spent up to now is 174.5 secs Computing kpt #: 306 total cpu time spent up to now is 174.9 secs Computing kpt #: 307 total cpu time spent up to now is 175.4 secs Computing kpt #: 308 total cpu time spent up to now is 175.8 secs Computing kpt #: 309 total cpu time spent up to now is 176.2 secs Computing kpt #: 310 total cpu time spent up to now is 176.6 secs Computing kpt #: 311 total cpu time spent up to now is 177.0 secs Computing kpt #: 312 total cpu time spent up to now is 177.4 secs Computing kpt #: 313 total cpu time spent up to now is 177.8 secs Computing kpt #: 314 total cpu time spent up to now is 178.3 secs Computing kpt #: 315 total cpu time spent up to now is 178.7 secs Computing kpt #: 316 total cpu time spent up to now is 179.2 secs Computing kpt #: 317 total cpu time spent up to now is 179.7 secs Computing kpt #: 318 total cpu time spent up to now is 180.2 secs Computing kpt #: 319 total cpu time spent up to now is 180.6 secs Computing kpt #: 320 total cpu time spent up to now is 181.0 secs Computing kpt #: 321 total cpu time spent up to now is 181.4 secs Computing kpt #: 322 total cpu time spent up to now is 181.8 secs Computing kpt #: 323 total cpu time spent up to now is 182.2 secs Computing kpt #: 324 total cpu time spent up to now is 182.6 secs Computing kpt #: 325 total cpu time spent up to now is 183.0 secs Computing kpt #: 326 total cpu time spent up to now is 183.5 secs Computing kpt #: 327 total cpu time spent up to now is 183.9 secs Computing kpt #: 328 total cpu time spent up to now is 184.4 secs Computing kpt #: 329 total cpu time spent up to now is 184.8 secs Computing kpt #: 330 total cpu time spent up to now is 185.3 secs Computing kpt #: 331 total cpu time spent up to now is 185.8 secs Computing kpt #: 332 total cpu time spent up to now is 186.3 secs Computing kpt #: 333 total cpu time spent up to now is 186.9 secs Computing kpt #: 334 total cpu time spent up to now is 187.4 secs Computing kpt #: 335 total cpu time spent up to now is 188.1 secs Computing kpt #: 336 total cpu time spent up to now is 188.8 secs Computing kpt #: 337 total cpu time spent up to now is 189.6 secs Computing kpt #: 338 total cpu time spent up to now is 190.3 secs Computing kpt #: 339 total cpu time spent up to now is 191.1 secs Computing kpt #: 340 total cpu time spent up to now is 191.9 secs Computing kpt #: 341 total cpu time spent up to now is 192.6 secs Computing kpt #: 342 total cpu time spent up to now is 193.6 secs Computing kpt #: 343 total cpu time spent up to now is 194.3 secs Computing kpt #: 344 total cpu time spent up to now is 194.9 secs Computing kpt #: 345 total cpu time spent up to now is 195.4 secs Computing kpt #: 346 total cpu time spent up to now is 195.9 secs Computing kpt #: 347 total cpu time spent up to now is 196.4 secs Computing kpt #: 348 total cpu time spent up to now is 196.8 secs Computing kpt #: 349 total cpu time spent up to now is 197.3 secs Computing kpt #: 350 total cpu time spent up to now is 197.7 secs Computing kpt #: 351 total cpu time spent up to now is 198.2 secs Computing kpt #: 352 total cpu time spent up to now is 198.6 secs Computing kpt #: 353 total cpu time spent up to now is 199.0 secs Computing kpt #: 354 total cpu time spent up to now is 199.4 secs Computing kpt #: 355 total cpu time spent up to now is 199.8 secs Computing kpt #: 356 total cpu time spent up to now is 200.3 secs Computing kpt #: 357 total cpu time spent up to now is 200.7 secs Computing kpt #: 358 total cpu time spent up to now is 201.1 secs Computing kpt #: 359 total cpu time spent up to now is 201.6 secs Computing kpt #: 360 total cpu time spent up to now is 202.0 secs Computing kpt #: 361 total cpu time spent up to now is 202.4 secs Computing kpt #: 362 total cpu time spent up to now is 202.9 secs Computing kpt #: 363 total cpu time spent up to now is 203.4 secs Computing kpt #: 364 total cpu time spent up to now is 203.9 secs Computing kpt #: 365 total cpu time spent up to now is 204.3 secs Computing kpt #: 366 total cpu time spent up to now is 204.9 secs Computing kpt #: 367 total cpu time spent up to now is 205.3 secs Computing kpt #: 368 total cpu time spent up to now is 205.7 secs Computing kpt #: 369 total cpu time spent up to now is 206.1 secs Computing kpt #: 370 total cpu time spent up to now is 206.6 secs Computing kpt #: 371 total cpu time spent up to now is 207.0 secs Computing kpt #: 372 total cpu time spent up to now is 207.4 secs Computing kpt #: 373 total cpu time spent up to now is 207.9 secs Computing kpt #: 374 total cpu time spent up to now is 208.4 secs Computing kpt #: 375 total cpu time spent up to now is 208.9 secs Computing kpt #: 376 total cpu time spent up to now is 209.4 secs Computing kpt #: 377 total cpu time spent up to now is 209.9 secs Computing kpt #: 378 total cpu time spent up to now is 210.4 secs Computing kpt #: 379 total cpu time spent up to now is 211.0 secs Computing kpt #: 380 total cpu time spent up to now is 211.7 secs Computing kpt #: 381 total cpu time spent up to now is 212.3 secs Computing kpt #: 382 total cpu time spent up to now is 212.7 secs Computing kpt #: 383 total cpu time spent up to now is 213.1 secs Computing kpt #: 384 total cpu time spent up to now is 213.6 secs Computing kpt #: 385 total cpu time spent up to now is 214.1 secs Computing kpt #: 386 total cpu time spent up to now is 214.5 secs Computing kpt #: 387 total cpu time spent up to now is 215.0 secs Computing kpt #: 388 total cpu time spent up to now is 215.5 secs Computing kpt #: 389 total cpu time spent up to now is 216.1 secs Computing kpt #: 390 total cpu time spent up to now is 216.6 secs Computing kpt #: 391 total cpu time spent up to now is 217.1 secs Computing kpt #: 392 total cpu time spent up to now is 217.6 secs Computing kpt #: 393 total cpu time spent up to now is 218.1 secs Computing kpt #: 394 total cpu time spent up to now is 218.6 secs Computing kpt #: 395 total cpu time spent up to now is 219.0 secs Computing kpt #: 396 total cpu time spent up to now is 219.5 secs Computing kpt #: 397 total cpu time spent up to now is 220.0 secs Computing kpt #: 398 total cpu time spent up to now is 220.5 secs Computing kpt #: 399 total cpu time spent up to now is 221.0 secs Computing kpt #: 400 total cpu time spent up to now is 221.4 secs Computing kpt #: 401 total cpu time spent up to now is 221.9 secs Computing kpt #: 402 total cpu time spent up to now is 222.4 secs Computing kpt #: 403 total cpu time spent up to now is 222.8 secs Computing kpt #: 404 total cpu time spent up to now is 223.2 secs Computing kpt #: 405 total cpu time spent up to now is 223.6 secs Computing kpt #: 406 total cpu time spent up to now is 224.1 secs Computing kpt #: 407 total cpu time spent up to now is 224.5 secs Computing kpt #: 408 total cpu time spent up to now is 225.0 secs Computing kpt #: 409 total cpu time spent up to now is 225.5 secs Computing kpt #: 410 total cpu time spent up to now is 225.9 secs Computing kpt #: 411 total cpu time spent up to now is 226.4 secs Computing kpt #: 412 total cpu time spent up to now is 226.8 secs Computing kpt #: 413 total cpu time spent up to now is 227.3 secs Computing kpt #: 414 total cpu time spent up to now is 227.8 secs Computing kpt #: 415 total cpu time spent up to now is 228.3 secs Computing kpt #: 416 total cpu time spent up to now is 228.7 secs Computing kpt #: 417 total cpu time spent up to now is 229.1 secs Computing kpt #: 418 total cpu time spent up to now is 229.5 secs Computing kpt #: 419 total cpu time spent up to now is 229.9 secs Computing kpt #: 420 total cpu time spent up to now is 230.3 secs Computing kpt #: 421 total cpu time spent up to now is 230.9 secs Computing kpt #: 422 total cpu time spent up to now is 231.3 secs Computing kpt #: 423 total cpu time spent up to now is 231.8 secs Computing kpt #: 424 total cpu time spent up to now is 232.2 secs Computing kpt #: 425 total cpu time spent up to now is 232.7 secs Computing kpt #: 426 total cpu time spent up to now is 233.1 secs Computing kpt #: 427 total cpu time spent up to now is 233.6 secs Computing kpt #: 428 total cpu time spent up to now is 234.0 secs Computing kpt #: 429 total cpu time spent up to now is 234.4 secs Computing kpt #: 430 total cpu time spent up to now is 234.8 secs Computing kpt #: 431 total cpu time spent up to now is 235.2 secs Computing kpt #: 432 total cpu time spent up to now is 235.6 secs Computing kpt #: 433 total cpu time spent up to now is 236.0 secs Computing kpt #: 434 total cpu time spent up to now is 236.4 secs Computing kpt #: 435 total cpu time spent up to now is 236.8 secs Computing kpt #: 436 total cpu time spent up to now is 237.2 secs Computing kpt #: 437 total cpu time spent up to now is 237.6 secs Computing kpt #: 438 total cpu time spent up to now is 238.1 secs Computing kpt #: 439 total cpu time spent up to now is 238.6 secs Computing kpt #: 440 total cpu time spent up to now is 239.0 secs Computing kpt #: 441 total cpu time spent up to now is 239.5 secs Computing kpt #: 442 total cpu time spent up to now is 240.0 secs Computing kpt #: 443 total cpu time spent up to now is 240.4 secs Computing kpt #: 444 total cpu time spent up to now is 240.8 secs Computing kpt #: 445 total cpu time spent up to now is 241.2 secs Computing kpt #: 446 total cpu time spent up to now is 241.5 secs Computing kpt #: 447 total cpu time spent up to now is 241.9 secs Computing kpt #: 448 total cpu time spent up to now is 242.3 secs Computing kpt #: 449 total cpu time spent up to now is 242.7 secs Computing kpt #: 450 total cpu time spent up to now is 243.1 secs Computing kpt #: 451 total cpu time spent up to now is 243.5 secs Computing kpt #: 452 total cpu time spent up to now is 243.9 secs Computing kpt #: 453 total cpu time spent up to now is 244.4 secs Computing kpt #: 454 total cpu time spent up to now is 244.8 secs Computing kpt #: 455 total cpu time spent up to now is 245.2 secs Computing kpt #: 456 total cpu time spent up to now is 245.6 secs Computing kpt #: 457 total cpu time spent up to now is 246.0 secs Computing kpt #: 458 total cpu time spent up to now is 246.4 secs Computing kpt #: 459 total cpu time spent up to now is 246.8 secs Computing kpt #: 460 total cpu time spent up to now is 247.2 secs Computing kpt #: 461 total cpu time spent up to now is 247.7 secs Computing kpt #: 462 total cpu time spent up to now is 248.1 secs Computing kpt #: 463 total cpu time spent up to now is 248.5 secs Computing kpt #: 464 total cpu time spent up to now is 248.9 secs Computing kpt #: 465 total cpu time spent up to now is 249.3 secs Computing kpt #: 466 total cpu time spent up to now is 249.8 secs Computing kpt #: 467 total cpu time spent up to now is 250.2 secs Computing kpt #: 468 total cpu time spent up to now is 250.7 secs Computing kpt #: 469 total cpu time spent up to now is 251.2 secs Computing kpt #: 470 total cpu time spent up to now is 251.7 secs Computing kpt #: 471 total cpu time spent up to now is 252.1 secs Computing kpt #: 472 total cpu time spent up to now is 252.6 secs Computing kpt #: 473 total cpu time spent up to now is 253.0 secs Computing kpt #: 474 total cpu time spent up to now is 253.4 secs Computing kpt #: 475 total cpu time spent up to now is 253.8 secs Computing kpt #: 476 total cpu time spent up to now is 254.2 secs Computing kpt #: 477 total cpu time spent up to now is 254.6 secs Computing kpt #: 478 total cpu time spent up to now is 255.0 secs Computing kpt #: 479 total cpu time spent up to now is 255.4 secs Computing kpt #: 480 total cpu time spent up to now is 255.8 secs Computing kpt #: 481 total cpu time spent up to now is 256.3 secs Computing kpt #: 482 total cpu time spent up to now is 256.7 secs Computing kpt #: 483 total cpu time spent up to now is 257.2 secs Computing kpt #: 484 total cpu time spent up to now is 257.7 secs Computing kpt #: 485 total cpu time spent up to now is 258.6 secs Computing kpt #: 486 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 260.1 secs Computing kpt #: 487 total cpu time spent up to now is 260.9 secs Computing kpt #: 488 total cpu time spent up to now is 261.7 secs Computing kpt #: 489 total cpu time spent up to now is 262.5 secs Computing kpt #: 490 total cpu time spent up to now is 263.2 secs Computing kpt #: 491 total cpu time spent up to now is 263.9 secs Computing kpt #: 492 total cpu time spent up to now is 264.7 secs Computing kpt #: 493 total cpu time spent up to now is 265.3 secs Computing kpt #: 494 total cpu time spent up to now is 266.0 secs Computing kpt #: 495 total cpu time spent up to now is 266.6 secs Computing kpt #: 496 total cpu time spent up to now is 267.1 secs Computing kpt #: 497 total cpu time spent up to now is 267.7 secs Computing kpt #: 498 total cpu time spent up to now is 268.2 secs Computing kpt #: 499 total cpu time spent up to now is 268.8 secs Computing kpt #: 500 total cpu time spent up to now is 269.4 secs Computing kpt #: 501 total cpu time spent up to now is 270.0 secs Computing kpt #: 502 total cpu time spent up to now is 270.5 secs Computing kpt #: 503 total cpu time spent up to now is 271.1 secs Computing kpt #: 504 total cpu time spent up to now is 271.6 secs Computing kpt #: 505 total cpu time spent up to now is 272.2 secs Computing kpt #: 506 total cpu time spent up to now is 272.7 secs Computing kpt #: 507 total cpu time spent up to now is 273.4 secs Computing kpt #: 508 total cpu time spent up to now is 274.0 secs Computing kpt #: 509 total cpu time spent up to now is 274.6 secs Computing kpt #: 510 total cpu time spent up to now is 275.3 secs Computing kpt #: 511 total cpu time spent up to now is 276.0 secs Computing kpt #: 512 total cpu time spent up to now is 276.8 secs Computing kpt #: 513 total cpu time spent up to now is 278.3 secs Computing kpt #: 514 total cpu time spent up to now is 279.3 secs Computing kpt #: 515 total cpu time spent up to now is 280.0 secs Computing kpt #: 516 total cpu time spent up to now is 280.7 secs Computing kpt #: 517 total cpu time spent up to now is 281.1 secs Computing kpt #: 518 total cpu time spent up to now is 281.6 secs Computing kpt #: 519 total cpu time spent up to now is 282.0 secs Computing kpt #: 520 total cpu time spent up to now is 282.4 secs Computing kpt #: 521 total cpu time spent up to now is 282.7 secs Computing kpt #: 522 total cpu time spent up to now is 283.1 secs Computing kpt #: 523 total cpu time spent up to now is 283.4 secs Computing kpt #: 524 total cpu time spent up to now is 283.8 secs Computing kpt #: 525 total cpu time spent up to now is 284.2 secs Computing kpt #: 526 total cpu time spent up to now is 284.6 secs Computing kpt #: 527 total cpu time spent up to now is 284.9 secs Computing kpt #: 528 total cpu time spent up to now is 285.3 secs Computing kpt #: 529 total cpu time spent up to now is 285.8 secs Computing kpt #: 530 total cpu time spent up to now is 286.2 secs Computing kpt #: 531 total cpu time spent up to now is 286.6 secs Computing kpt #: 532 total cpu time spent up to now is 287.0 secs Computing kpt #: 533 total cpu time spent up to now is 287.4 secs Computing kpt #: 534 total cpu time spent up to now is 287.7 secs Computing kpt #: 535 total cpu time spent up to now is 288.1 secs Computing kpt #: 536 total cpu time spent up to now is 288.6 secs Computing kpt #: 537 total cpu time spent up to now is 288.9 secs Computing kpt #: 538 total cpu time spent up to now is 289.3 secs Computing kpt #: 539 total cpu time spent up to now is 289.7 secs Computing kpt #: 540 total cpu time spent up to now is 290.0 secs Computing kpt #: 541 total cpu time spent up to now is 290.4 secs Computing kpt #: 542 total cpu time spent up to now is 290.7 secs Computing kpt #: 543 total cpu time spent up to now is 291.1 secs Computing kpt #: 544 total cpu time spent up to now is 291.5 secs Computing kpt #: 545 total cpu time spent up to now is 291.9 secs Computing kpt #: 546 total cpu time spent up to now is 292.3 secs Computing kpt #: 547 total cpu time spent up to now is 292.7 secs Computing kpt #: 548 total cpu time spent up to now is 293.1 secs Computing kpt #: 549 total cpu time spent up to now is 293.6 secs Computing kpt #: 550 total cpu time spent up to now is 294.0 secs Computing kpt #: 551 total cpu time spent up to now is 294.4 secs Computing kpt #: 552 total cpu time spent up to now is 294.8 secs Computing kpt #: 553 total cpu time spent up to now is 295.2 secs Computing kpt #: 554 total cpu time spent up to now is 295.6 secs Computing kpt #: 555 total cpu time spent up to now is 296.0 secs Computing kpt #: 556 total cpu time spent up to now is 296.4 secs Computing kpt #: 557 total cpu time spent up to now is 296.8 secs Computing kpt #: 558 total cpu time spent up to now is 297.3 secs Computing kpt #: 559 total cpu time spent up to now is 297.7 secs Computing kpt #: 560 total cpu time spent up to now is 298.1 secs Computing kpt #: 561 total cpu time spent up to now is 298.7 secs Computing kpt #: 562 total cpu time spent up to now is 299.2 secs Computing kpt #: 563 total cpu time spent up to now is 299.6 secs Computing kpt #: 564 total cpu time spent up to now is 300.0 secs Computing kpt #: 565 total cpu time spent up to now is 300.4 secs Computing kpt #: 566 total cpu time spent up to now is 300.8 secs Computing kpt #: 567 total cpu time spent up to now is 301.2 secs Computing kpt #: 568 total cpu time spent up to now is 301.6 secs Computing kpt #: 569 total cpu time spent up to now is 302.0 secs Computing kpt #: 570 total cpu time spent up to now is 302.4 secs ethr = 3.57E-11, avg # of iterations = 19.4 total cpu time spent up to now is 302.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1165 PWs) bands (ev): -19.6308 -19.6308 -17.9618 -17.9618 -2.2254 -2.2254 0.3238 0.3238 1.7821 1.7821 3.2240 3.2240 3.3217 3.3217 3.6893 3.6893 10.6907 10.6907 11.0967 11.0967 19.6995 19.6995 20.9536 20.9536 21.0215 21.0215 22.0282 22.0282 24.8279 24.8279 24.9651 24.9651 26.8624 26.8624 26.8919 26.8919 k = 0.0041 0.0095-0.0000 ( 1161 PWs) bands (ev): -19.6302 -19.6302 -17.9615 -17.9615 -2.2246 -2.2246 0.3241 0.3241 1.7812 1.7812 3.2217 3.2217 3.3187 3.3187 3.6871 3.6871 10.6949 10.6949 11.0984 11.0984 19.7018 19.7018 20.9500 20.9500 21.0157 21.0157 22.0289 22.0289 24.8091 24.8091 24.9605 24.9605 26.8346 26.8346 26.8807 26.8807 k = 0.0083 0.0190-0.0000 ( 1157 PWs) bands (ev): -19.6284 -19.6284 -17.9603 -17.9603 -2.2223 -2.2223 0.3249 0.3249 1.7784 1.7784 3.2145 3.2145 3.3098 3.3098 3.6810 3.6810 10.7074 10.7074 11.1033 11.1033 19.7087 19.7087 20.9375 20.9375 20.9994 20.9994 22.0310 22.0310 24.7559 24.7559 24.9464 24.9464 26.6953 26.6953 26.9311 26.9311 k = 0.0124 0.0285-0.0000 ( 1157 PWs) bands (ev): -19.6254 -19.6254 -17.9583 -17.9583 -2.2184 -2.2184 0.3262 0.3262 1.7737 1.7737 3.2021 3.2021 3.2952 3.2952 3.6711 3.6711 10.7282 10.7282 11.1116 11.1116 19.7196 19.7196 20.9117 20.9117 20.9768 20.9768 22.0347 22.0347 24.6761 24.6761 24.9228 24.9228 26.5196 26.5196 27.0047 27.0047 k = 0.0165 0.0380-0.0000 ( 1161 PWs) bands (ev): -19.6213 -19.6213 -17.9556 -17.9556 -2.2130 -2.2130 0.3281 0.3281 1.7669 1.7669 3.1838 3.1838 3.2751 3.2751 3.6584 3.6584 10.7568 10.7568 11.1230 11.1230 19.7343 19.7343 20.8680 20.8680 20.9519 20.9519 22.0402 22.0402 24.5797 24.5797 24.8900 24.8900 26.3320 26.3320 27.0902 27.0902 k = 0.0206 0.0476-0.0000 ( 1161 PWs) bands (ev): -19.6159 -19.6159 -17.9521 -17.9521 -2.2061 -2.2061 0.3304 0.3304 1.7580 1.7580 3.1592 3.1592 3.2499 3.2499 3.6436 3.6436 10.7933 10.7933 11.1378 11.1378 19.7520 19.7520 20.8066 20.8066 20.9239 20.9239 22.0477 22.0477 24.4758 24.4758 24.8481 24.8481 26.1436 26.1436 27.1772 27.1772 k = 0.0248 0.0571-0.0000 ( 1161 PWs) bands (ev): -19.6094 -19.6094 -17.9478 -17.9478 -2.1977 -2.1977 0.3331 0.3331 1.7466 1.7466 3.1276 3.1276 3.2201 3.2201 3.6278 3.6278 10.8372 10.8372 11.1557 11.1557 19.7719 19.7719 20.7296 20.7296 20.8897 20.8897 22.0575 22.0575 24.3725 24.3725 24.7974 24.7974 25.9603 25.9603 27.2590 27.2590 k = 0.0289 0.0666-0.0000 ( 1159 PWs) bands (ev): -19.6017 -19.6017 -17.9428 -17.9428 -2.1877 -2.1877 0.3363 0.3363 1.7326 1.7326 3.0888 3.0888 3.1858 3.1858 3.6119 3.6119 10.8880 10.8880 11.1769 11.1769 19.7929 19.7929 20.6392 20.6392 20.8465 20.8465 22.0698 22.0698 24.2764 24.2764 24.7382 24.7382 25.7857 25.7857 27.3322 27.3322 k = 0.0330 0.0761-0.0000 ( 1155 PWs) bands (ev): -19.5929 -19.5929 -17.9370 -17.9370 -2.1762 -2.1762 0.3398 0.3398 1.7157 1.7157 3.0428 3.0428 3.1471 3.1471 3.5968 3.5968 10.9456 10.9456 11.2012 11.2012 19.8136 19.8136 20.5370 20.5370 20.7921 20.7921 22.0846 22.0846 24.1925 24.1925 24.6707 24.6707 25.6221 25.6221 27.3964 27.3964 k = 0.0371 0.0856-0.0000 ( 1159 PWs) bands (ev): -19.5829 -19.5829 -17.9306 -17.9306 -2.1633 -2.1633 0.3435 0.3435 1.6955 1.6955 2.9902 2.9902 3.1043 3.1043 3.5830 3.5830 11.0091 11.0091 11.2286 11.2286 19.8325 19.8325 20.4242 20.4242 20.7248 20.7248 22.1021 22.1021 24.1248 24.1248 24.5954 24.5954 25.4719 25.4719 27.4527 27.4527 k = 0.0413 0.0951-0.0000 ( 1159 PWs) bands (ev): -19.5718 -19.5718 -17.9234 -17.9234 -2.1489 -2.1489 0.3474 0.3474 1.6716 1.6716 2.9314 2.9314 3.0578 3.0578 3.5708 3.5708 11.0782 11.0782 11.2591 11.2591 19.8478 19.8478 20.3025 20.3025 20.6436 20.6436 22.1222 22.1222 24.0764 24.0764 24.5129 24.5129 25.3370 25.3370 27.5030 27.5030 k = 0.0454 0.1046-0.0000 ( 1163 PWs) bands (ev): -19.5596 -19.5596 -17.9155 -17.9155 -2.1331 -2.1331 0.3514 0.3514 1.6435 1.6435 2.8670 2.8670 3.0082 3.0082 3.5604 3.5604 11.1524 11.1524 11.2926 11.2926 19.8568 19.8568 20.1740 20.1740 20.5479 20.5479 22.1450 22.1450 24.0489 24.0489 24.4234 24.4234 25.2192 25.2192 27.5489 27.5489 k = 0.0495 0.1141-0.0000 ( 1163 PWs) bands (ev): -19.5463 -19.5463 -17.9070 -17.9070 -2.1158 -2.1158 0.3554 0.3554 1.6109 1.6109 2.7978 2.7978 2.9565 2.9565 3.5516 3.5516 11.2314 11.2314 11.3292 11.3292 19.8541 19.8541 20.0434 20.0434 20.4380 20.4380 22.1704 22.1704 24.0432 24.0432 24.3277 24.3277 25.1203 25.1203 27.5919 27.5919 k = 0.0536 0.1236-0.0000 ( 1155 PWs) bands (ev): -19.5319 -19.5319 -17.8978 -17.8978 -2.0972 -2.0972 0.3591 0.3591 1.5733 1.5733 2.7241 2.7241 2.9036 2.9036 3.5443 3.5443 11.3146 11.3146 11.3688 11.3688 19.8168 19.8168 19.9333 19.9333 20.3145 20.3145 22.1985 22.1985 24.0592 24.0592 24.2264 24.2264 25.0419 25.0419 27.6332 27.6332 k = 0.0578 0.1331-0.0000 ( 1155 PWs) bands (ev): -19.5165 -19.5165 -17.8879 -17.8879 -2.0772 -2.0772 0.3625 0.3625 1.5304 1.5304 2.6467 2.6467 2.8507 2.8507 3.5382 3.5382 11.4009 11.4009 11.4121 11.4121 19.7043 19.7043 19.8832 19.8832 20.1787 20.1787 22.2291 22.2291 24.0939 24.0939 24.1223 24.1223 24.9854 24.9854 27.6734 27.6734 k = 0.0619 0.1427-0.0000 ( 1155 PWs) bands (ev): -19.5001 -19.5001 -17.8775 -17.8775 -2.0558 -2.0558 0.3651 0.3651 1.4818 1.4818 2.5660 2.5660 2.7987 2.7987 3.5331 3.5331 11.4560 11.4560 11.4928 11.4928 19.5575 19.5575 19.8521 19.8521 20.0321 20.0321 22.2622 22.2622 24.0072 24.0072 24.1549 24.1549 24.9519 24.9519 27.7134 27.7134 k = 0.0660 0.1522-0.0000 ( 1157 PWs) bands (ev): -19.4826 -19.4826 -17.8665 -17.8665 -2.0332 -2.0332 0.3669 0.3669 1.4275 1.4275 2.4824 2.4824 2.7486 2.7486 3.5289 3.5289 11.5043 11.5043 11.5862 11.5862 19.4008 19.4008 19.8144 19.8144 19.8776 19.8776 22.2979 22.2979 23.8919 23.8919 24.2306 24.2306 24.9421 24.9421 27.7535 27.7535 k = 0.0701 0.1617-0.0000 ( 1153 PWs) bands (ev): -19.4642 -19.4642 -17.8550 -17.8550 -2.0093 -2.0093 0.3672 0.3672 1.3677 1.3677 2.3965 2.3965 2.7011 2.7011 3.5254 3.5254 11.5554 11.5554 11.6826 11.6826 19.2390 19.2390 19.7096 19.7096 19.7727 19.7727 22.3361 22.3361 23.7731 23.7731 24.3239 24.3239 24.9562 24.9562 27.7941 27.7941 k = 0.0743 0.1712-0.0000 ( 1153 PWs) bands (ev): -19.4449 -19.4449 -17.8429 -17.8429 -1.9842 -1.9842 0.3657 0.3657 1.3028 1.3028 2.3086 2.3086 2.6566 2.6566 3.5223 3.5223 11.6092 11.6092 11.7814 11.7814 19.0738 19.0738 19.5413 19.5413 19.7142 19.7142 22.3767 22.3767 23.6511 23.6511 24.4329 24.4329 24.9941 24.9941 27.8355 27.8355 k = 0.0784 0.1807-0.0000 ( 1157 PWs) bands (ev): -19.4246 -19.4246 -17.8304 -17.8304 -1.9579 -1.9579 0.3617 0.3617 1.2335 1.2335 2.2193 2.2193 2.6156 2.6156 3.5196 3.5196 11.6658 11.6658 11.8823 11.8823 18.9061 18.9061 19.3673 19.3673 19.6457 19.6457 22.4196 22.4196 23.5266 23.5266 24.5563 24.5563 25.0550 25.0550 27.8777 27.8777 k = 0.0825 0.1902-0.0000 ( 1153 PWs) bands (ev): -19.4035 -19.4035 -17.8174 -17.8174 -1.9305 -1.9305 0.3542 0.3542 1.1611 1.1611 2.1290 2.1290 2.5781 2.5781 3.5171 3.5171 11.7252 11.7252 11.9852 11.9852 18.7366 18.7366 19.1898 19.1898 19.5671 19.5671 22.4650 22.4650 23.4002 23.4002 24.6931 24.6931 25.1382 25.1382 27.9211 27.9211 k = 0.0866 0.1997-0.0000 ( 1155 PWs) bands (ev): -19.3815 -19.3815 -17.8040 -17.8040 -1.9020 -1.9020 0.3422 0.3422 1.0867 1.0867 2.0383 2.0383 2.5440 2.5440 3.5147 3.5147 11.7873 11.7873 12.0898 12.0898 18.5658 18.5658 19.0100 19.0100 19.4789 19.4789 22.5127 22.5127 23.2723 23.2723 24.8417 24.8417 25.2423 25.2423 27.9656 27.9656 k = 0.0908 0.2092-0.0000 ( 1155 PWs) bands (ev): -19.3587 -19.3587 -17.7902 -17.7902 -1.8725 -1.8725 0.3241 0.3241 1.0125 1.0125 1.9477 1.9477 2.5131 2.5131 3.5123 3.5123 11.8521 11.8521 12.1959 12.1959 18.3944 18.3944 18.8288 18.8288 19.3824 19.3824 22.5627 22.5627 23.1435 23.1435 25.0014 25.0014 25.3660 25.3660 28.0114 28.0114 k = 0.0949 0.2187-0.0000 ( 1159 PWs) bands (ev): -19.3352 -19.3352 -17.7761 -17.7761 -1.8421 -1.8421 0.2983 0.2983 0.9403 0.9403 1.8579 1.8579 2.4851 2.4851 3.5097 3.5097 11.9195 11.9195 12.3032 12.3032 18.2226 18.2226 18.6471 18.6471 19.2786 19.2786 22.6149 22.6149 23.0142 23.0142 25.1711 25.1711 25.5078 25.5078 28.0584 28.0584 k = 0.0990 0.2282-0.0000 ( 1163 PWs) bands (ev): -19.3109 -19.3109 -17.7617 -17.7617 -1.8107 -1.8107 0.2627 0.2627 0.8723 0.8723 1.7696 1.7696 2.4597 2.4597 3.5071 3.5071 11.9897 11.9897 12.4118 12.4118 18.0508 18.0508 18.4656 18.4656 19.1689 19.1689 22.6692 22.6692 22.8848 22.8848 25.3500 25.3500 25.6661 25.6661 28.1067 28.1067 k = 0.1031 0.2378-0.0000 ( 1163 PWs) bands (ev): -19.2859 -19.2859 -17.7471 -17.7471 -1.7786 -1.7786 0.2160 0.2160 0.8102 0.8102 1.6835 1.6835 2.4365 2.4365 3.5042 3.5042 12.0626 12.0626 12.5214 12.5214 17.8795 17.8795 18.2851 18.2851 19.0543 19.0543 22.7227 22.7227 22.7588 22.7588 25.5372 25.5372 25.8395 25.8395 28.1563 28.1563 k = 0.1073 0.2473-0.0000 ( 1159 PWs) bands (ev): -19.2603 -19.2603 -17.7322 -17.7322 -1.7458 -1.7458 0.1574 0.1574 0.7549 0.7549 1.6005 1.6005 2.4151 2.4151 3.5009 3.5009 12.1381 12.1381 12.6319 12.6319 17.7089 17.7089 18.1060 18.1060 18.9360 18.9360 22.6255 22.6255 22.7863 22.7863 25.7321 25.7321 26.0267 26.0267 28.2072 28.2072 k = 0.1114 0.2568-0.0000 ( 1159 PWs) bands (ev): -19.2341 -19.2341 -17.7172 -17.7172 -1.7124 -1.7124 0.0874 0.0874 0.7055 0.7055 1.5216 1.5216 2.3953 2.3953 3.4973 3.4973 12.2164 12.2164 12.7432 12.7432 17.5393 17.5393 17.9287 17.9287 18.8150 18.8150 22.4982 22.4982 22.8470 22.8470 25.9338 25.9338 26.2263 26.2263 28.2595 28.2595 k = 0.1155 0.2663-0.0000 ( 1159 PWs) bands (ev): -19.2073 -19.2073 -17.7021 -17.7021 -1.6784 -1.6784 0.0074 0.0074 0.6605 0.6605 1.4479 1.4479 2.3766 2.3766 3.4932 3.4932 12.2972 12.2972 12.8552 12.8552 17.3710 17.3710 17.7538 17.7538 18.6922 18.6922 22.3718 22.3718 22.9101 22.9101 26.1417 26.1417 26.4370 26.4370 28.3131 28.3131 k = 0.1196 0.2758-0.0000 ( 1159 PWs) bands (ev): -19.1800 -19.1800 -17.6869 -17.6869 -1.6441 -1.6441 -0.0804 -0.0804 0.6175 0.6175 1.3804 1.3804 2.3589 2.3589 3.4886 3.4886 12.3808 12.3808 12.9679 12.9679 17.2042 17.2042 17.5816 17.5816 18.5685 18.5685 22.2468 22.2468 22.9754 22.9754 26.3550 26.3550 26.6577 26.6577 28.3679 28.3679 k = 0.1238 0.2853-0.0000 ( 1161 PWs) bands (ev): -19.1523 -19.1523 -17.6716 -17.6716 -1.6095 -1.6095 -0.1741 -0.1741 0.5742 0.5742 1.3200 1.3200 2.3419 2.3419 3.4834 3.4834 12.4670 12.4670 13.0810 13.0810 17.0391 17.0391 17.4126 17.4126 18.4446 18.4446 22.1237 22.1237 23.0427 23.0427 26.5731 26.5731 26.8874 26.8874 28.4241 28.4241 k = 0.1279 0.2948-0.0000 ( 1157 PWs) bands (ev): -19.1242 -19.1242 -17.6564 -17.6564 -1.5749 -1.5749 -0.2718 -0.2718 0.5289 0.5289 1.2674 1.2674 2.3253 2.3253 3.4776 3.4776 12.5559 12.5559 13.1947 13.1947 16.8760 16.8760 17.2469 17.2469 18.3212 18.3212 22.0026 22.0026 23.1121 23.1121 26.7951 26.7951 27.1250 27.1250 28.4817 28.4817 k = 0.1320 0.3043-0.0000 ( 1157 PWs) bands (ev): -19.0957 -19.0957 -17.6413 -17.6413 -1.5404 -1.5404 -0.3720 -0.3720 0.4805 0.4805 1.2230 1.2230 2.3089 2.3089 3.4710 3.4710 12.6473 12.6473 13.3086 13.3086 16.7151 16.7151 17.0849 17.0849 18.1989 18.1989 21.8838 21.8838 23.1834 23.1834 27.0204 27.0204 27.3696 27.3696 28.5407 28.5407 k = 0.1361 0.3138-0.0000 ( 1157 PWs) bands (ev): -19.0670 -19.0670 -17.6263 -17.6263 -1.5063 -1.5063 -0.4735 -0.4735 0.4285 0.4285 1.1864 1.1864 2.2927 2.2927 3.4638 3.4638 12.7414 12.7414 13.4228 13.4228 16.5566 16.5566 16.9271 16.9271 18.0781 18.0781 21.7675 21.7675 23.2566 23.2566 27.2479 27.2479 27.6204 27.6204 28.6013 28.6013 k = 0.1403 0.3234-0.0000 ( 1153 PWs) bands (ev): -19.0380 -19.0380 -17.6115 -17.6115 -1.4728 -1.4728 -0.5752 -0.5752 0.3733 0.3733 1.1572 1.1572 2.2763 2.2763 3.4557 3.4557 12.8381 12.8381 13.5372 13.5372 16.4007 16.4007 16.7736 16.7736 17.9594 17.9594 21.6540 21.6540 23.3317 23.3317 27.4766 27.4766 27.8764 27.8764 28.6638 28.6638 k = 0.1444 0.3329-0.0000 ( 1153 PWs) bands (ev): -19.0088 -19.0088 -17.5970 -17.5970 -1.4404 -1.4404 -0.6763 -0.6763 0.3156 0.3156 1.1343 1.1343 2.2597 2.2597 3.4469 3.4469 12.9374 12.9374 13.6515 13.6515 16.2475 16.2475 16.6247 16.6247 17.8431 17.8431 21.5432 21.5432 23.4086 23.4086 27.7052 27.7052 28.1369 28.1369 28.7288 28.7288 k = 0.1485 0.3424-0.0000 ( 1159 PWs) bands (ev): -18.9796 -18.9796 -17.5827 -17.5827 -1.4098 -1.4098 -0.7757 -0.7757 0.2564 0.2564 1.1168 1.1168 2.2427 2.2427 3.4371 3.4371 13.0392 13.0392 13.7656 13.7656 16.0972 16.0972 16.4807 16.4807 17.7295 17.7295 21.4355 21.4355 23.4872 23.4872 27.9318 27.9318 28.4010 28.4010 28.7973 28.7973 k = 0.1526 0.3519-0.0000 ( 1157 PWs) bands (ev): -18.9502 -18.9502 -17.5687 -17.5687 -1.3819 -1.3819 -0.8722 -0.8722 0.1967 0.1967 1.1036 1.1036 2.2252 2.2252 3.4264 3.4264 13.1438 13.1438 13.8792 13.8792 15.9500 15.9500 16.3423 16.3423 17.6191 17.6191 21.3310 21.3310 23.5676 23.5676 28.1535 28.1535 28.6677 28.6677 28.8714 28.8714 k = 0.1568 0.3614-0.0000 ( 1157 PWs) bands (ev): -18.9209 -18.9209 -17.5552 -17.5552 -1.3584 -1.3584 -0.9639 -0.9639 0.1378 0.1378 1.0938 1.0938 2.2072 2.2072 3.4147 3.4147 13.2508 13.2508 13.9920 13.9920 15.8061 15.8061 16.2099 16.2099 17.5119 17.5119 21.2299 21.2299 23.6495 23.6495 28.3656 28.3656 28.9312 28.9312 28.9603 28.9603 k = 0.1609 0.3709-0.0000 ( 1159 PWs) bands (ev): -18.8917 -18.8917 -17.5421 -17.5421 -1.3434 -1.3434 -1.0469 -1.0469 0.0805 0.0805 1.0865 1.0865 2.1885 2.1885 3.4020 3.4020 13.3605 13.3605 14.1035 14.1035 15.6655 15.6655 16.0840 16.0840 17.4084 17.4084 21.1322 21.1322 23.7331 23.7331 28.5599 28.5599 29.0527 29.0527 29.2087 29.2087 k = 0.1650 0.3804-0.0000 ( 1163 PWs) bands (ev): -18.8625 -18.8625 -17.5294 -17.5294 -1.3451 -1.3451 -1.1129 -1.1129 0.0258 0.0258 1.0812 1.0812 2.1690 2.1690 3.3883 3.3883 13.4726 13.4726 14.2129 14.2129 15.5285 15.5285 15.9654 15.9654 17.3087 17.3087 21.0381 21.0381 23.8181 23.8181 28.7251 28.7251 29.1795 29.1795 29.4788 29.4788 k = 0.1692 0.3899-0.0000 ( 1163 PWs) bands (ev): -18.8336 -18.8336 -17.5174 -17.5174 -1.3751 -1.3751 -1.1505 -1.1505 -0.0253 -0.0253 1.0772 1.0772 2.1487 2.1487 3.3735 3.3735 13.5874 13.5874 14.3192 14.3192 15.3952 15.3952 15.8554 15.8554 17.2130 17.2130 20.9476 20.9476 23.9045 23.9045 28.8548 28.8548 29.3382 29.3382 29.7486 29.7486 k = 0.1733 0.3994-0.0000 ( 1163 PWs) bands (ev): -18.8049 -18.8049 -17.5059 -17.5059 -1.4324 -1.4324 -1.1607 -1.1607 -0.0722 -0.0722 1.0740 1.0740 2.1276 2.1276 3.3576 3.3576 13.7046 13.7046 14.4207 14.4207 15.2658 15.2658 15.7558 15.7558 17.1214 17.1214 20.8610 20.8610 23.9923 23.9923 28.9544 28.9544 29.5223 29.5223 30.0167 30.0167 k = 0.1774 0.4089-0.0000 ( 1167 PWs) bands (ev): -18.7766 -18.7766 -17.4951 -17.4951 -1.5037 -1.5037 -1.1574 -1.1574 -0.1140 -0.1140 1.0713 1.0713 2.1055 2.1055 3.3407 3.3407 13.8242 13.8242 14.5148 14.5148 15.1404 15.1404 15.6690 15.6690 17.0342 17.0342 20.7781 20.7781 24.0814 24.0814 29.0344 29.0344 29.7202 29.7202 30.2819 30.2819 k = 0.1815 0.4185-0.0000 ( 1167 PWs) bands (ev): -18.7486 -18.7486 -17.4849 -17.4849 -1.5793 -1.5793 -1.1501 -1.1501 -0.1501 -0.1501 1.0688 1.0688 2.0824 2.0824 3.3225 3.3225 13.9464 13.9464 14.5976 14.5976 15.0192 15.0192 15.5991 15.5991 16.9514 16.9514 20.6992 20.6992 24.1716 24.1716 29.1025 29.1025 29.9229 29.9229 30.5427 30.5427 k = 0.1857 0.4280-0.0000 ( 1163 PWs) bands (ev): -18.7211 -18.7211 -17.4755 -17.4755 -1.6552 -1.6552 -1.1431 -1.1431 -0.1800 -0.1800 1.0663 1.0663 2.0583 2.0583 3.3033 3.3033 14.0711 14.0711 14.6636 14.6636 14.9025 14.9025 15.5516 15.5516 16.8733 16.8733 20.6243 20.6243 24.2628 24.2628 29.1628 29.1628 30.1251 30.1251 30.7974 30.7974 k = 0.1898 0.4375-0.0000 ( 1163 PWs) bands (ev): -18.6940 -18.6940 -17.4669 -17.4669 -1.7295 -1.7295 -1.1383 -1.1383 -0.2035 -0.2035 1.0634 1.0634 2.0332 2.0332 3.2828 3.2828 14.1980 14.1980 14.7062 14.7062 14.7908 14.7908 15.5327 15.5327 16.7998 16.7998 20.5533 20.5533 24.3550 24.3550 29.2170 29.2170 30.3235 30.3235 31.0437 31.0437 k = 0.1939 0.4470-0.0000 ( 1167 PWs) bands (ev): -18.6676 -18.6676 -17.4591 -17.4591 -1.8013 -1.8013 -1.1365 -1.1365 -0.2204 -0.2204 1.0600 1.0600 2.0070 2.0070 3.2612 3.2612 14.3271 14.3271 14.6794 14.6794 14.7265 14.7265 15.5459 15.5459 16.7312 16.7312 20.4864 20.4864 24.4480 24.4480 29.2662 29.2662 30.5159 30.5159 31.2782 31.2782 k = 0.1980 0.4565-0.0000 ( 1167 PWs) bands (ev): -18.6418 -18.6418 -17.4521 -17.4521 -1.8699 -1.8699 -1.1378 -1.1378 -0.2308 -0.2308 1.0560 1.0560 1.9798 1.9798 3.2384 3.2384 14.4572 14.4572 14.5790 14.5790 14.7166 14.7166 15.5900 15.5900 16.6676 16.6676 20.4236 20.4236 24.5417 24.5417 29.3105 29.3105 30.7006 30.7006 31.4960 31.4960 k = 0.2022 0.4660-0.0000 ( 1167 PWs) bands (ev): -18.6167 -18.6167 -17.4461 -17.4461 -1.9351 -1.9351 -1.1421 -1.1421 -0.2353 -0.2353 1.0512 1.0512 1.9516 1.9516 3.2145 3.2145 14.4760 14.4760 14.5955 14.5955 14.6891 14.6891 15.6585 15.6585 16.6091 16.6091 20.3649 20.3649 24.6360 24.6360 29.3500 29.3500 30.8762 30.8762 31.6894 31.6894 k = 0.2063 0.4755-0.0000 ( 1163 PWs) bands (ev): -18.5923 -18.5923 -17.4410 -17.4410 -1.9965 -1.9965 -1.1489 -1.1489 -0.2342 -0.2342 1.0455 1.0455 1.9223 1.9223 3.1894 3.1894 14.3839 14.3839 14.6501 14.6501 14.7298 14.7298 15.7442 15.7442 16.5561 16.5561 20.3103 20.3103 24.7308 24.7308 29.3845 29.3845 31.0416 31.0416 31.8459 31.8459 k = 0.2104 0.4850-0.0000 ( 1167 PWs) bands (ev): -18.5688 -18.5688 -17.4369 -17.4369 -2.0540 -2.0540 -1.1576 -1.1576 -0.2284 -0.2284 1.0389 1.0389 1.8919 1.8919 3.1631 3.1631 14.2955 14.2955 14.6050 14.6050 14.8670 14.8670 15.8410 15.8410 16.5090 16.5090 20.2597 20.2597 24.8258 24.8258 29.4139 29.4139 31.1960 31.1960 31.9510 31.9510 k = 0.2145 0.4945-0.0000 ( 1163 PWs) bands (ev): -18.5461 -18.5461 -17.4337 -17.4337 -2.1074 -2.1074 -1.1674 -1.1674 -0.2186 -0.2186 1.0313 1.0313 1.8606 1.8606 3.1357 3.1357 14.2120 14.2120 14.5580 14.5580 15.0060 15.0060 15.9445 15.9445 16.4683 16.4683 20.2133 20.2133 24.9209 24.9209 29.4377 29.4377 31.3385 31.3385 31.9943 31.9943 k = 0.2187 0.5040-0.0000 ( 1163 PWs) bands (ev): -18.5243 -18.5243 -17.4316 -17.4316 -2.1565 -2.1565 -1.1778 -1.1778 -0.2056 -0.2056 1.0226 1.0226 1.8283 1.8283 3.1071 3.1071 14.1338 14.1338 14.5112 14.5112 15.1461 15.1461 16.0512 16.0512 16.4358 16.4358 20.1709 20.1709 25.0159 25.0159 29.4558 29.4558 31.4689 31.4689 31.9785 31.9785 k = 0.2228 0.5136-0.0000 ( 1163 PWs) bands (ev): -18.5035 -18.5035 -17.4305 -17.4305 -2.2014 -2.2014 -1.1880 -1.1880 -0.1901 -0.1901 1.0127 1.0127 1.7951 1.7951 3.0775 3.0775 14.0608 14.0608 14.4664 14.4664 15.2866 15.2866 16.1560 16.1560 16.4151 16.4151 20.1326 20.1326 25.1108 25.1108 29.4680 29.4680 31.5870 31.5870 31.9211 31.9211 k = 0.2269 0.5231-0.0000 ( 1159 PWs) bands (ev): -18.4837 -18.4837 -17.4305 -17.4305 -2.2417 -2.2417 -1.1975 -1.1975 -0.1726 -0.1726 1.0018 1.0018 1.7610 1.7610 3.0468 3.0468 13.9933 13.9933 14.4245 14.4245 15.4265 15.4265 16.2467 16.2467 16.4186 16.4186 20.0982 20.0982 25.2051 25.2051 29.4739 29.4739 31.6931 31.6931 31.8390 31.8390 k = 0.2310 0.5326-0.0000 ( 1155 PWs) bands (ev): -18.4649 -18.4649 -17.4316 -17.4316 -2.2776 -2.2776 -1.2059 -1.2059 -0.1539 -0.1539 0.9896 0.9896 1.7262 1.7262 3.0151 3.0151 13.9312 13.9312 14.3862 14.3862 15.5635 15.5635 16.2983 16.2983 16.4727 16.4727 20.0678 20.0678 25.2988 25.2988 29.4738 29.4738 31.7429 31.7429 31.7880 31.7880 k = 0.2352 0.5421-0.0000 ( 1155 PWs) bands (ev): -18.4472 -18.4472 -17.4337 -17.4337 -2.3089 -2.3089 -1.2127 -1.2127 -0.1343 -0.1343 0.9764 0.9764 1.6906 1.6906 2.9823 2.9823 13.8748 13.8748 14.3518 14.3518 15.6941 15.6941 16.3211 16.3211 16.5695 16.5695 20.0413 20.0413 25.3916 25.3916 29.4673 29.4673 31.6399 31.6399 31.8716 31.8716 k = 0.2393 0.5516-0.0000 ( 1155 PWs) bands (ev): -18.4307 -18.4307 -17.4370 -17.4370 -2.3356 -2.3356 -1.2177 -1.2177 -0.1144 -0.1144 0.9620 0.9620 1.6545 1.6545 2.9485 2.9485 13.8241 13.8241 14.3217 14.3217 15.8123 15.8123 16.3485 16.3485 16.6812 16.6812 20.0186 20.0186 25.4833 25.4833 29.4547 29.4547 31.5331 31.5331 31.9455 31.9455 k = 0.2434 0.5611-0.0000 ( 1155 PWs) bands (ev): -18.4153 -18.4153 -17.4413 -17.4413 -2.3576 -2.3576 -1.2205 -1.2205 -0.0944 -0.0944 0.9465 0.9465 1.6178 1.6178 2.9139 2.9139 13.7792 13.7792 14.2960 14.2960 15.9091 15.9091 16.3991 16.3991 16.7978 16.7978 19.9997 19.9997 25.5736 25.5736 29.4362 29.4362 31.4248 31.4248 32.0105 32.0105 k = 0.2475 0.5706-0.0000 ( 1155 PWs) bands (ev): -18.4011 -18.4011 -17.4468 -17.4468 -2.3749 -2.3749 -1.2210 -1.2210 -0.0747 -0.0747 0.9299 0.9299 1.5807 1.5807 2.8783 2.8783 13.7400 13.7400 14.2749 14.2749 15.9780 15.9780 16.4820 16.4820 16.9161 16.9161 19.9844 19.9844 25.6623 25.6623 29.4122 29.4122 31.3165 31.3165 32.0670 32.0670 k = 0.2517 0.5801-0.0000 ( 1155 PWs) bands (ev): -18.3881 -18.3881 -17.4533 -17.4533 -2.3874 -2.3874 -1.2192 -1.2192 -0.0555 -0.0555 0.9123 0.9123 1.5434 1.5434 2.8419 2.8419 13.7068 13.7068 14.2584 14.2584 16.0216 16.0216 16.5954 16.5954 17.0350 17.0350 19.9728 19.9728 25.7491 25.7491 29.3830 29.3830 31.2090 31.2090 32.1133 32.1133 k = 0.2558 0.5896-0.0000 ( 1159 PWs) bands (ev): -18.3763 -18.3763 -17.4610 -17.4610 -2.3953 -2.3953 -1.2149 -1.2149 -0.0372 -0.0372 0.8937 0.8937 1.5059 1.5059 2.8047 2.8047 13.6795 13.6795 14.2464 14.2464 16.0485 16.0485 16.7308 16.7308 17.1536 17.1536 19.9646 19.9646 25.8337 25.8337 29.3491 29.3491 31.1029 31.1029 32.1386 32.1386 k = 0.2599 0.5992-0.0000 ( 1159 PWs) bands (ev): -18.3658 -18.3658 -17.4697 -17.4697 -2.3984 -2.3984 -1.2081 -1.2081 -0.0197 -0.0197 0.8742 0.8742 1.4685 1.4685 2.7667 2.7667 13.6582 13.6582 14.2390 14.2390 16.0671 16.0671 16.8803 16.8803 17.2716 17.2716 19.9599 19.9599 25.9158 25.9158 29.3111 29.3111 30.9987 30.9987 32.1213 32.1213 k = 0.2640 0.6087-0.0000 ( 1155 PWs) bands (ev): -18.3565 -18.3565 -17.4794 -17.4794 -2.3968 -2.3968 -1.1989 -1.1989 -0.0034 -0.0034 0.8538 0.8538 1.4314 1.4314 2.7281 2.7281 13.6428 13.6428 14.2360 14.2360 16.0819 16.0819 17.0390 17.0390 17.3885 17.3885 19.9584 19.9584 25.9951 25.9951 29.2694 29.2694 30.8967 30.8967 32.0780 32.0780 k = 0.2682 0.6182-0.0000 ( 1155 PWs) bands (ev): -18.3485 -18.3485 -17.4902 -17.4902 -2.3906 -2.3906 -1.1873 -1.1873 0.0116 0.0116 0.8327 0.8327 1.3947 1.3947 2.6888 2.6888 13.6336 13.6336 14.2376 14.2376 16.0956 16.0956 17.2039 17.2039 17.5039 17.5039 19.9602 19.9602 26.0714 26.0714 29.2247 29.2247 30.7972 30.7972 32.0279 32.0279 k = 0.2723 0.6277-0.0000 ( 1159 PWs) bands (ev): -18.3418 -18.3418 -17.5020 -17.5020 -2.3797 -2.3797 -1.1734 -1.1734 0.0252 0.0252 0.8109 0.8109 1.3587 1.3587 2.6489 2.6489 13.6302 13.6302 14.2433 14.2433 16.1097 16.1097 17.3736 17.3736 17.6177 17.6177 19.9649 19.9649 26.1443 26.1443 29.1774 29.1774 30.7003 30.7003 31.9761 31.9761 k = 0.2764 0.6372-0.0000 ( 1159 PWs) bands (ev): -18.3363 -18.3363 -17.5148 -17.5148 -2.3642 -2.3642 -1.1575 -1.1575 0.0374 0.0374 0.7885 0.7885 1.3236 1.3236 2.6086 2.6086 13.6330 13.6330 14.2533 14.2533 16.1250 16.1250 17.5469 17.5469 17.7296 17.7296 19.9726 19.9726 26.2137 26.2137 29.1282 29.1282 30.6063 30.6063 31.9247 31.9247 k = 0.2805 0.6467-0.0000 ( 1159 PWs) bands (ev): -18.3320 -18.3320 -17.5285 -17.5285 -2.3443 -2.3443 -1.1396 -1.1396 0.0480 0.0480 0.7656 0.7656 1.2898 1.2898 2.5678 2.5678 13.6417 13.6417 14.2673 14.2673 16.1418 16.1418 17.7227 17.7227 17.8398 17.8398 19.9831 19.9831 26.2791 26.2791 29.0775 29.0775 30.5151 30.5151 31.8744 31.8744 k = 0.2847 0.6562-0.0000 ( 1159 PWs) bands (ev): -18.3290 -18.3290 -17.5432 -17.5432 -2.3199 -2.3199 -1.1200 -1.1200 0.0570 0.0570 0.7423 0.7423 1.2575 1.2575 2.5266 2.5266 13.6565 13.6565 14.2852 14.2852 16.1603 16.1603 17.8968 17.8968 17.9518 17.9518 19.9963 19.9963 26.3404 26.3404 29.0258 29.0258 30.4270 30.4270 31.8259 31.8259 k = 0.2888 0.6657-0.0000 ( 1163 PWs) bands (ev): -18.3272 -18.3272 -17.5588 -17.5588 -2.2912 -2.2912 -1.0990 -1.0990 0.0643 0.0643 0.7187 0.7187 1.2271 1.2271 2.4851 2.4851 13.6771 13.6771 14.3069 14.3069 16.1806 16.1806 18.0356 18.0356 18.0982 18.0982 20.0119 20.0119 26.3972 26.3972 28.9736 28.9736 30.3418 30.3418 31.7796 31.7796 k = 0.2929 0.6752-0.0000 ( 1159 PWs) bands (ev): -18.3265 -18.3265 -17.5752 -17.5752 -2.2584 -2.2584 -1.0768 -1.0768 0.0700 0.0700 0.6949 0.6949 1.1989 1.1989 2.4433 2.4433 13.7038 13.7038 14.3321 14.3321 16.2028 16.2028 18.1395 18.1395 18.2785 18.2785 20.0300 20.0300 26.4495 26.4495 28.9213 28.9213 30.2598 30.2598 31.7360 31.7360 k = 0.2970 0.6847-0.0000 ( 1159 PWs) bands (ev): -18.3271 -18.3271 -17.5924 -17.5924 -2.2215 -2.2215 -1.0538 -1.0538 0.0739 0.0739 0.6709 0.6709 1.1736 1.1736 2.4014 2.4014 13.7363 13.7363 14.3608 14.3608 16.2267 16.2267 18.2355 18.2355 18.4646 18.4646 20.0503 20.0503 26.4971 26.4971 28.8693 28.8693 30.1808 30.1808 31.6953 31.6953 k = 0.2970 0.6847-0.0000 ( 1159 PWs) bands (ev): -18.3271 -18.3271 -17.5924 -17.5924 -2.2215 -2.2215 -1.0538 -1.0538 0.0739 0.0739 0.6709 0.6709 1.1736 1.1736 2.4014 2.4014 13.7363 13.7363 14.3608 14.3608 16.2267 16.2267 18.2355 18.2355 18.4646 18.4646 20.0503 20.0503 26.4971 26.4971 28.8693 28.8693 30.1808 30.1808 31.6953 31.6953 k = 0.2868 0.6847-0.0000 ( 1159 PWs) bands (ev): -18.3270 -18.3270 -17.5854 -17.5854 -2.2367 -2.2367 -1.0625 -1.0625 0.0725 0.0725 0.6799 0.6799 1.1843 1.1843 2.4187 2.4187 13.7238 13.7238 14.3441 14.3441 16.2106 16.2106 18.1974 18.1974 18.4052 18.4052 20.0403 20.0403 26.4822 26.4822 28.8772 28.8772 30.2033 30.2033 31.6937 31.6937 k = 0.2766 0.6847-0.0000 ( 1160 PWs) bands (ev): -18.3275 -18.3275 -17.5782 -17.5782 -2.2517 -2.2517 -1.0704 -1.0704 0.0708 0.0708 0.6879 0.6879 1.1976 1.1976 2.4375 2.4375 13.7142 13.7142 14.3177 14.3177 16.1816 16.1816 18.1556 18.1556 18.3763 18.3763 20.0270 20.0270 26.4730 26.4730 28.8611 28.8611 30.2095 30.2095 31.6600 31.6600 k = 0.2663 0.6847-0.0000 ( 1158 PWs) bands (ev): -18.3286 -18.3286 -17.5710 -17.5710 -2.2666 -2.2666 -1.0774 -1.0774 0.0689 0.0689 0.6949 0.6949 1.2136 1.2136 2.4575 2.4575 13.7074 13.7074 14.2816 14.2816 16.1400 16.1400 18.1144 18.1144 18.3741 18.3741 20.0106 20.0106 26.4697 26.4697 28.8223 28.8223 30.2004 30.2004 31.5990 31.5990 k = 0.2561 0.6847-0.0000 ( 1158 PWs) bands (ev): -18.3301 -18.3301 -17.5637 -17.5637 -2.2814 -2.2814 -1.0834 -1.0834 0.0666 0.0666 0.7010 0.7010 1.2320 1.2320 2.4786 2.4786 13.7033 13.7033 14.2362 14.2362 16.0860 16.0860 18.0802 18.0802 18.3917 18.3917 19.9909 19.9909 26.4722 26.4722 28.7621 28.7621 30.1784 30.1784 31.5172 31.5172 k = 0.2458 0.6847-0.0000 ( 1160 PWs) bands (ev): -18.3321 -18.3321 -17.5564 -17.5564 -2.2961 -2.2961 -1.0886 -1.0886 0.0641 0.0641 0.7061 0.7061 1.2527 1.2527 2.5005 2.5005 13.7017 13.7017 14.1822 14.1822 16.0209 16.0209 18.0573 18.0573 18.4239 18.4239 19.9680 19.9680 26.4806 26.4806 28.6824 28.6824 30.1465 30.1465 31.4204 31.4204 k = 0.2356 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3345 -18.3345 -17.5492 -17.5492 -2.3107 -2.3107 -1.0930 -1.0930 0.0615 0.0615 0.7104 0.7104 1.2756 1.2756 2.5230 2.5230 13.7026 13.7026 14.1204 14.1204 15.9458 15.9458 18.0472 18.0472 18.4673 18.4673 19.9422 19.9422 26.4948 26.4948 28.5852 28.5852 30.1074 30.1074 31.3132 31.3132 k = 0.2253 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3372 -18.3372 -17.5420 -17.5420 -2.3252 -2.3252 -1.0965 -1.0965 0.0587 0.0587 0.7141 0.7141 1.3002 1.3002 2.5461 2.5461 13.7058 13.7058 14.0520 14.0520 15.8625 15.8625 18.0500 18.0500 18.5195 18.5195 19.9135 19.9135 26.5146 26.5146 28.4727 28.4727 30.0634 30.0634 31.1989 31.1989 k = 0.2151 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3402 -18.3402 -17.5349 -17.5349 -2.3395 -2.3395 -1.0993 -1.0993 0.0559 0.0559 0.7174 0.7174 1.3263 1.3263 2.5694 2.5694 13.7112 13.7112 13.9782 13.9782 15.7724 15.7724 18.0650 18.0650 18.5788 18.5788 19.8823 19.8823 26.5400 26.5400 28.3473 28.3473 30.0162 30.0162 31.0798 31.0798 k = 0.2049 0.6847-0.0000 ( 1161 PWs) bands (ev): -18.3433 -18.3433 -17.5280 -17.5280 -2.3536 -2.3536 -1.1014 -1.1014 0.0530 0.0530 0.7203 0.7203 1.3536 1.3536 2.5928 2.5928 13.7184 13.7184 13.9003 13.9003 15.6772 15.6772 18.0909 18.0909 18.6436 18.6436 19.8487 19.8487 26.5708 26.5708 28.2114 28.2114 29.9667 29.9667 30.9577 30.9577 k = 0.1946 0.6847-0.0000 ( 1164 PWs) bands (ev): -18.3466 -18.3466 -17.5213 -17.5213 -2.3674 -2.3674 -1.1029 -1.1029 0.0501 0.0501 0.7231 0.7231 1.3818 1.3818 2.6163 2.6163 13.7270 13.7270 13.8199 13.8199 15.5787 15.5787 18.1264 18.1264 18.7126 18.7126 19.8131 19.8131 26.6068 26.6068 28.0674 28.0674 29.9155 29.9155 30.8338 30.8338 k = 0.1844 0.6847-0.0000 ( 1166 PWs) bands (ev): -18.3501 -18.3501 -17.5148 -17.5148 -2.3810 -2.3810 -1.1039 -1.1039 0.0473 0.0473 0.7258 0.7258 1.4104 1.4104 2.6395 2.6395 13.7262 13.7262 13.7488 13.7488 15.4782 15.4782 18.1699 18.1699 18.7850 18.7850 19.7759 19.7759 26.6475 26.6475 27.9177 27.9177 29.8630 29.8630 30.7091 30.7091 k = 0.1741 0.6847-0.0000 ( 1169 PWs) bands (ev): -18.3535 -18.3535 -17.5085 -17.5085 -2.3942 -2.3942 -1.1045 -1.1045 0.0445 0.0445 0.7286 0.7286 1.4392 1.4392 2.6624 2.6624 13.6508 13.6508 13.7530 13.7530 15.3769 15.3769 18.2200 18.2200 18.8596 18.8596 19.7373 19.7373 26.6929 26.6929 27.7642 27.7642 29.8096 29.8096 30.5844 30.5844 k = 0.1639 0.6847-0.0000 ( 1171 PWs) bands (ev): -18.3570 -18.3570 -17.5025 -17.5025 -2.4071 -2.4071 -1.1047 -1.1047 0.0418 0.0418 0.7315 0.7315 1.4680 1.4680 2.6848 2.6848 13.5682 13.5682 13.7661 13.7661 15.2762 15.2762 18.2751 18.2751 18.9358 18.9358 19.6978 19.6978 26.7425 26.7425 27.6088 27.6088 29.7553 29.7553 30.4604 30.4604 k = 0.1536 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3605 -18.3605 -17.4968 -17.4968 -2.4195 -2.4195 -1.1047 -1.1047 0.0392 0.0392 0.7347 0.7347 1.4963 1.4963 2.7066 2.7066 13.4866 13.4866 13.7805 13.7805 15.1770 15.1770 18.3339 18.3339 19.0127 19.0127 19.6579 19.6579 26.7961 26.7961 27.4533 27.4533 29.7007 29.7007 30.3375 30.3375 k = 0.1434 0.6847-0.0000 ( 1166 PWs) bands (ev): -18.3639 -18.3639 -17.4913 -17.4913 -2.4313 -2.4313 -1.1044 -1.1044 0.0366 0.0366 0.7381 0.7381 1.5240 1.5240 2.7277 2.7277 13.4069 13.4069 13.7958 13.7958 15.0803 15.0803 18.3951 18.3951 19.0895 19.0895 19.6180 19.6180 26.8530 26.8530 27.2993 27.2993 29.6458 29.6458 30.2162 30.2162 k = 0.1332 0.6847-0.0000 ( 1172 PWs) bands (ev): -18.3672 -18.3672 -17.4862 -17.4862 -2.4427 -2.4427 -1.1039 -1.1039 0.0342 0.0342 0.7417 0.7417 1.5507 1.5507 2.7479 2.7479 13.3300 13.3300 13.8117 13.8117 14.9868 14.9868 18.4575 18.4575 19.1655 19.1655 19.5785 19.5785 26.9127 26.9127 27.1484 27.1484 29.5913 29.5913 30.0970 30.0970 k = 0.1229 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3704 -18.3704 -17.4814 -17.4814 -2.4533 -2.4533 -1.1033 -1.1033 0.0320 0.0320 0.7456 0.7456 1.5763 1.5763 2.7672 2.7672 13.2567 13.2567 13.8278 13.8278 14.8974 14.8974 18.5201 18.5201 19.2397 19.2397 19.5404 19.5404 26.9697 26.9697 27.0070 27.0070 29.5375 29.5375 29.9802 29.9802 k = 0.1127 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3734 -18.3734 -17.4770 -17.4770 -2.4634 -2.4634 -1.1027 -1.1027 0.0298 0.0298 0.7496 0.7496 1.6005 1.6005 2.7854 2.7854 13.1875 13.1875 13.8440 13.8440 14.8127 14.8127 18.5816 18.5816 19.3106 19.3106 19.5047 19.5047 26.8579 26.8579 27.0419 27.0419 29.4850 29.4850 29.8665 29.8665 k = 0.1024 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3763 -18.3763 -17.4729 -17.4729 -2.4727 -2.4727 -1.1020 -1.1020 0.0278 0.0278 0.7537 0.7537 1.6233 1.6233 2.8024 2.8024 13.1229 13.1229 13.8599 13.8599 14.7333 14.7333 18.6411 18.6411 19.3734 19.3734 19.4761 19.4761 26.7239 26.7239 27.1073 27.1073 29.4344 29.4344 29.7564 29.7564 k = 0.0922 0.6847-0.0000 ( 1166 PWs) bands (ev): -18.3789 -18.3789 -17.4692 -17.4692 -2.4813 -2.4813 -1.1014 -1.1014 0.0260 0.0260 0.7579 0.7579 1.6443 1.6443 2.8181 2.8181 13.0633 13.0633 13.8752 13.8752 14.6598 14.6598 18.6977 18.6977 19.4017 19.4017 19.4807 19.4807 26.5975 26.5975 27.1737 27.1737 29.3863 29.3863 29.6504 29.6504 k = 0.0819 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3814 -18.3814 -17.4658 -17.4658 -2.4891 -2.4891 -1.1007 -1.1007 0.0243 0.0243 0.7619 0.7619 1.6635 1.6635 2.8325 2.8325 13.0091 13.0091 13.8898 13.8898 14.5926 14.5926 18.7507 18.7507 19.3839 19.3839 19.5296 19.5296 26.4803 26.4803 27.2398 27.2398 29.3412 29.3412 29.5495 29.5495 k = 0.0717 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3836 -18.3836 -17.4629 -17.4629 -2.4960 -2.4960 -1.1002 -1.1002 0.0227 0.0227 0.7658 0.7658 1.6807 1.6807 2.8453 2.8453 12.9606 12.9606 13.9034 13.9034 14.5322 14.5322 18.7993 18.7993 19.3581 19.3581 19.5844 19.5844 26.3734 26.3734 27.3046 27.3046 29.2997 29.2997 29.4545 29.4545 k = 0.0615 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3855 -18.3855 -17.4603 -17.4603 -2.5021 -2.5021 -1.0996 -1.0996 0.0214 0.0214 0.7694 0.7694 1.6958 1.6958 2.8567 2.8567 12.9181 12.9181 13.9157 13.9157 14.4790 14.4790 18.8428 18.8428 19.3331 19.3331 19.6357 19.6357 26.2781 26.2781 27.3668 27.3668 29.2620 29.2620 29.3669 29.3669 k = 0.0512 0.6847-0.0000 ( 1168 PWs) bands (ev): -18.3871 -18.3871 -17.4581 -17.4581 -2.5073 -2.5073 -1.0992 -1.0992 0.0202 0.0202 0.7727 0.7727 1.7088 1.7088 2.8664 2.8664 12.8819 12.8819 13.9265 13.9265 14.4334 14.4334 18.8807 18.8807 19.3107 19.3107 19.6813 19.6813 26.1953 26.1953 27.4248 27.4248 29.2280 29.2280 29.2889 29.2889 k = 0.0410 0.6847-0.0000 ( 1166 PWs) bands (ev): -18.3885 -18.3885 -17.4563 -17.4563 -2.5116 -2.5116 -1.0988 -1.0988 0.0192 0.0192 0.7755 0.7755 1.7195 1.7195 2.8745 2.8745 12.8520 12.8520 13.9357 13.9357 14.3956 14.3956 18.9125 18.9125 19.2918 19.2918 19.7201 19.7201 26.1261 26.1261 27.4767 27.4767 29.1939 29.1939 29.2263 29.2263 k = 0.0307 0.6847-0.0000 ( 1164 PWs) bands (ev): -18.3896 -18.3896 -17.4549 -17.4549 -2.5150 -2.5150 -1.0985 -1.0985 0.0185 0.0185 0.7778 0.7778 1.7279 1.7279 2.8808 2.8808 12.8286 12.8286 13.9430 13.9430 14.3660 14.3660 18.9377 18.9377 19.2765 19.2765 19.7511 19.7511 26.0713 26.0713 27.5205 27.5205 29.1503 29.1503 29.1911 29.1911 k = 0.0205 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3904 -18.3904 -17.4539 -17.4539 -2.5174 -2.5174 -1.0983 -1.0983 0.0179 0.0179 0.7795 0.7795 1.7339 1.7339 2.8853 2.8853 12.8118 12.8118 13.9483 13.9483 14.3446 14.3446 18.9561 18.9561 19.2654 19.2654 19.7737 19.7737 26.0317 26.0317 27.5540 27.5540 29.1101 29.1101 29.1726 29.1726 k = 0.0102 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3908 -18.3908 -17.4533 -17.4533 -2.5188 -2.5188 -1.0982 -1.0982 0.0176 0.0176 0.7805 0.7805 1.7375 1.7375 2.8881 2.8881 12.8017 12.8017 13.9516 13.9516 14.3318 14.3318 18.9672 18.9672 19.2586 19.2586 19.7875 19.7875 26.0077 26.0077 27.5751 27.5751 29.0841 29.0841 29.1623 29.1623 k = 0.0000 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3910 -18.3910 -17.4531 -17.4531 -2.5193 -2.5193 -1.0981 -1.0981 0.0175 0.0175 0.7809 0.7809 1.7387 1.7387 2.8890 2.8890 12.7984 12.7984 13.9527 13.9527 14.3275 14.3275 18.9709 18.9709 19.2563 19.2563 19.7921 19.7921 25.9996 25.9996 27.5823 27.5823 29.0751 29.0751 29.1589 29.1589 k = 0.0000 0.6847-0.0000 ( 1162 PWs) bands (ev): -18.3910 -18.3910 -17.4531 -17.4531 -2.5193 -2.5193 -1.0981 -1.0981 0.0175 0.0175 0.7809 0.7809 1.7387 1.7387 2.8890 2.8890 12.7984 12.7984 13.9527 13.9527 14.3275 14.3275 18.9709 18.9709 19.2563 19.2563 19.7921 19.7921 25.9996 25.9996 27.5823 27.5823 29.0751 29.0751 29.1589 29.1589 k = 0.0000 0.6847 0.0104 ( 1162 PWs) bands (ev): -18.3906 -18.3906 -17.4535 -17.4535 -2.5193 -2.5193 -1.0984 -1.0984 0.0178 0.0178 0.7789 0.7789 1.7399 1.7399 2.8897 2.8897 12.7979 12.7979 13.9193 13.9193 14.3644 14.3644 18.9649 18.9649 19.2654 19.2654 19.7944 19.7944 26.0000 26.0000 27.5820 27.5820 28.9008 28.9008 29.3255 29.3255 k = 0.0000 0.6847 0.0209 ( 1164 PWs) bands (ev): -18.3894 -18.3894 -17.4547 -17.4547 -2.5194 -2.5194 -1.0992 -1.0992 0.0189 0.0189 0.7731 0.7731 1.7434 1.7434 2.8919 2.8919 12.7967 12.7967 13.8427 13.8427 14.4515 14.4515 18.9484 18.9484 19.2907 19.2907 19.8011 19.8011 26.0012 26.0012 27.5810 27.5810 28.6861 28.6861 29.5156 29.5156 k = 0.0000 0.6847 0.0313 ( 1162 PWs) bands (ev): -18.3875 -18.3875 -17.4568 -17.4568 -2.5194 -2.5194 -1.1005 -1.1005 0.0207 0.0207 0.7637 0.7637 1.7491 1.7491 2.8954 2.8954 12.7946 12.7946 13.7508 13.7508 14.5610 14.5610 18.9250 18.9250 19.3287 19.3287 19.8124 19.8124 26.0033 26.0033 27.5791 27.5791 28.4674 28.4674 29.6891 29.6891 k = 0.0000 0.6847 0.0418 ( 1160 PWs) bands (ev): -18.3848 -18.3848 -17.4597 -17.4597 -2.5194 -2.5194 -1.1025 -1.1025 0.0231 0.0231 0.7510 0.7510 1.7568 1.7568 2.9003 2.9003 12.7918 12.7918 13.6548 13.6548 14.6815 14.6815 18.8976 18.8976 19.3766 19.3766 19.8282 19.8282 26.0063 26.0063 27.5759 27.5759 28.2475 28.2475 29.8375 29.8375 k = 0.0000 0.6847 0.0522 ( 1156 PWs) bands (ev): -18.3814 -18.3814 -17.4634 -17.4634 -2.5193 -2.5193 -1.1053 -1.1053 0.0262 0.0262 0.7355 0.7355 1.7664 1.7664 2.9062 2.9062 12.7882 12.7882 13.5593 13.5593 14.8084 14.8084 18.8680 18.8680 19.4325 19.4325 19.8486 19.8486 26.0104 26.0104 27.5707 27.5707 28.0279 28.0279 29.9526 29.9526 k = 0.0000 0.6847 0.0627 ( 1156 PWs) bands (ev): -18.3771 -18.3771 -17.4679 -17.4679 -2.5191 -2.5191 -1.1090 -1.1090 0.0299 0.0299 0.7176 0.7176 1.7775 1.7775 2.9131 2.9131 12.7840 12.7840 13.4661 13.4661 14.9397 14.9397 18.8371 18.8371 19.4954 19.4954 19.8735 19.8735 26.0156 26.0156 27.5626 27.5626 27.8101 27.8101 30.0291 30.0291 k = 0.0000 0.6847 0.0731 ( 1160 PWs) bands (ev): -18.3722 -18.3722 -17.4732 -17.4732 -2.5188 -2.5188 -1.1138 -1.1138 0.0342 0.0342 0.6979 0.6979 1.7900 1.7900 2.9206 2.9206 12.7793 12.7793 13.3761 13.3761 15.0741 15.0741 18.8054 18.8054 19.5646 19.5646 19.9028 19.9028 26.0221 26.0221 27.5437 27.5437 27.6021 27.6021 30.0674 30.0674 k = 0.0000 0.6847 0.0836 ( 1160 PWs) bands (ev): -18.3665 -18.3665 -17.4793 -17.4793 -2.5182 -2.5182 -1.1197 -1.1197 0.0391 0.0391 0.6769 0.6769 1.8037 1.8037 2.9286 2.9286 12.7740 12.7740 13.2901 13.2901 15.2111 15.2111 18.7731 18.7731 19.6400 19.6400 19.9368 19.9368 26.0302 26.0302 27.3747 27.3747 27.5431 27.5431 30.0724 30.0724 k = 0.0000 0.6847 0.0940 ( 1162 PWs) bands (ev): -18.3600 -18.3600 -17.4862 -17.4862 -2.5172 -2.5172 -1.1271 -1.1271 0.0444 0.0444 0.6552 0.6552 1.8183 1.8183 2.9368 2.9368 12.7684 12.7684 13.2082 13.2082 15.3498 15.3498 18.7404 18.7404 19.7213 19.7213 19.9753 19.9753 26.0399 26.0399 27.1662 27.1662 27.5225 27.5225 30.0510 30.0510 k = 0.0000 0.6847 0.1044 ( 1158 PWs) bands (ev): -18.3529 -18.3529 -17.4938 -17.4938 -2.5158 -2.5158 -1.1360 -1.1360 0.0502 0.0502 0.6333 0.6333 1.8338 1.8338 2.9450 2.9450 12.7625 12.7625 13.1309 13.1309 15.4900 15.4900 18.7074 18.7074 19.8084 19.8084 20.0185 20.0185 26.0514 26.0514 26.9609 26.9609 27.4973 27.4973 30.0094 30.0094 k = 0.0000 0.6847 0.1149 ( 1156 PWs) bands (ev): -18.3450 -18.3450 -17.5022 -17.5022 -2.5139 -2.5139 -1.1468 -1.1468 0.0564 0.0564 0.6117 0.6117 1.8500 1.8500 2.9528 2.9528 12.7564 12.7564 13.0582 13.0582 15.6309 15.6309 18.6740 18.6740 19.9009 19.9009 20.0663 20.0663 26.0649 26.0649 26.7601 26.7601 27.4658 27.4658 29.9523 29.9523 k = 0.0000 0.6847 0.1253 ( 1158 PWs) bands (ev): -18.3364 -18.3364 -17.5114 -17.5114 -2.5115 -2.5115 -1.1594 -1.1594 0.0629 0.0629 0.5907 0.5907 1.8669 1.8669 2.9600 2.9600 12.7502 12.7502 12.9902 12.9902 15.7722 15.7722 18.6404 18.6404 19.9984 19.9984 20.1190 20.1190 26.0804 26.0804 26.5647 26.5647 27.4270 27.4270 29.8832 29.8832 k = 0.0000 0.6847 0.1358 ( 1156 PWs) bands (ev): -18.3271 -18.3271 -17.5212 -17.5212 -2.5084 -2.5084 -1.1742 -1.1742 0.0698 0.0698 0.5707 0.5707 1.8845 1.8845 2.9664 2.9664 12.7439 12.7439 12.9271 12.9271 15.9134 15.9134 18.6068 18.6068 20.1002 20.1002 20.1771 20.1771 26.0978 26.0978 26.3757 26.3757 27.3803 27.3803 29.8043 29.8043 k = 0.0000 0.6847 0.1462 ( 1158 PWs) bands (ev): -18.3172 -18.3172 -17.5318 -17.5318 -2.5045 -2.5045 -1.1912 -1.1912 0.0770 0.0770 0.5520 0.5520 1.9026 1.9026 2.9716 2.9716 12.7376 12.7376 12.8689 12.8689 16.0539 16.0539 18.5730 18.5730 20.2026 20.2026 20.2441 20.2441 26.1145 26.1145 26.1963 26.1963 27.3248 27.3248 29.7176 29.7176 k = 0.0000 0.6847 0.1567 ( 1160 PWs) bands (ev): -18.3066 -18.3066 -17.5430 -17.5430 -2.4998 -2.4998 -1.2105 -1.2105 0.0846 0.0846 0.5348 0.5348 1.9213 1.9213 2.9755 2.9755 12.7314 12.7314 12.8156 12.8156 16.1932 16.1932 18.5394 18.5394 20.2897 20.2897 20.3355 20.3355 26.0122 26.0122 26.1455 26.1455 27.2602 27.2602 29.6242 29.6242 k = 0.0000 0.6847 0.1671 ( 1162 PWs) bands (ev): -18.2953 -18.2953 -17.5549 -17.5549 -2.4942 -2.4942 -1.2322 -1.2322 0.0924 0.0924 0.5192 0.5192 1.9407 1.9407 2.9780 2.9780 12.7249 12.7249 12.7675 12.7675 16.3309 16.3309 18.5060 18.5060 20.3643 20.3643 20.4483 20.4483 25.8458 25.8458 26.1692 26.1692 27.1864 27.1864 29.5253 29.5253 k = 0.0000 0.6847 0.1776 ( 1164 PWs) bands (ev): -18.2835 -18.2835 -17.5675 -17.5675 -2.4876 -2.4876 -1.2562 -1.2562 0.1006 0.1006 0.5053 0.5053 1.9607 1.9607 2.9787 2.9787 12.7143 12.7143 12.7284 12.7284 16.4663 16.4663 18.4730 18.4730 20.4400 20.4400 20.5684 20.5684 25.6864 25.6864 26.1969 26.1969 27.1033 27.1033 29.4216 29.4216 k = 0.0000 0.6847 0.1880 ( 1162 PWs) bands (ev): -18.2710 -18.2710 -17.5806 -17.5806 -2.4798 -2.4798 -1.2826 -1.2826 0.1091 0.1091 0.4931 0.4931 1.9814 1.9814 2.9776 2.9776 12.6818 12.6818 12.7162 12.7162 16.5989 16.5989 18.4406 18.4406 20.5192 20.5192 20.6929 20.6929 25.5357 25.5357 26.2275 26.2275 27.0111 27.0111 29.3137 29.3137 k = 0.0000 0.6847 0.1984 ( 1166 PWs) bands (ev): -18.2579 -18.2579 -17.5944 -17.5944 -2.4710 -2.4710 -1.3112 -1.3112 0.1180 0.1180 0.4824 0.4824 2.0029 2.0029 2.9746 2.9746 12.6477 12.6477 12.7101 12.7101 16.7280 16.7280 18.4089 18.4089 20.6023 20.6023 20.8208 20.8208 25.3945 25.3945 26.2610 26.2610 26.9103 26.9103 29.2022 29.2022 k = 0.0000 0.6847 0.2089 ( 1164 PWs) bands (ev): -18.2443 -18.2443 -17.6087 -17.6087 -2.4609 -2.4609 -1.3419 -1.3419 0.1273 0.1273 0.4731 0.4731 2.0252 2.0252 2.9695 2.9695 12.6177 12.6177 12.7046 12.7046 16.8531 16.8531 18.3781 18.3781 20.6896 20.6896 20.9515 20.9515 25.2633 25.2633 26.2973 26.2973 26.8016 26.8016 29.0874 29.0874 k = 0.0000 0.6847 0.2193 ( 1164 PWs) bands (ev): -18.2301 -18.2301 -17.6236 -17.6236 -2.4496 -2.4496 -1.3746 -1.3746 0.1371 0.1371 0.4650 0.4650 2.0483 2.0483 2.9623 2.9623 12.5919 12.5919 12.6994 12.6994 16.9736 16.9736 18.3484 18.3484 20.7808 20.7808 21.0843 21.0843 25.1429 25.1429 26.3364 26.3364 26.6858 26.6858 28.9696 28.9696 k = 0.0000 0.6847 0.2298 ( 1162 PWs) bands (ev): -18.2154 -18.2154 -17.6389 -17.6389 -2.4370 -2.4370 -1.4091 -1.4091 0.1473 0.1473 0.4579 0.4579 2.0723 2.0723 2.9529 2.9529 12.5702 12.5702 12.6944 12.6944 17.0889 17.0889 18.3199 18.3199 20.8758 20.8758 21.2185 21.2185 25.0337 25.0337 26.3781 26.3781 26.5639 26.5639 28.8491 28.8491 k = 0.0000 0.6847 0.2402 ( 1160 PWs) bands (ev): -18.2002 -18.2002 -17.6548 -17.6548 -2.4229 -2.4229 -1.4452 -1.4452 0.1580 0.1580 0.4517 0.4517 2.0971 2.0971 2.9414 2.9414 12.5523 12.5523 12.6893 12.6893 17.1985 17.1985 18.2929 18.2929 20.9745 20.9745 21.3533 21.3533 24.9362 24.9362 26.4219 26.4219 26.4377 26.4377 28.7261 28.7261 k = 0.0000 0.6847 0.2507 ( 1162 PWs) bands (ev): -18.1845 -18.1845 -17.6711 -17.6711 -2.4075 -2.4075 -1.4827 -1.4827 0.1691 0.1691 0.4460 0.4460 2.1229 2.1229 2.9278 2.9278 12.5380 12.5380 12.6843 12.6843 17.3018 17.3018 18.2672 18.2672 21.0765 21.0765 21.4878 21.4878 24.8510 24.8510 26.3063 26.3063 26.4695 26.4695 28.6007 28.6007 k = 0.0000 0.6847 0.2611 ( 1158 PWs) bands (ev): -18.1684 -18.1684 -17.6879 -17.6879 -2.3907 -2.3907 -1.5214 -1.5214 0.1806 0.1806 0.4407 0.4407 2.1496 2.1496 2.9120 2.9120 12.5272 12.5272 12.6791 12.6791 17.3984 17.3984 18.2433 18.2433 21.1816 21.1816 21.6210 21.6210 24.7782 24.7782 26.1732 26.1732 26.5188 26.5188 28.4731 28.4731 k = 0.0000 0.6847 0.2716 ( 1158 PWs) bands (ev): -18.1518 -18.1518 -17.7050 -17.7050 -2.3723 -2.3723 -1.5610 -1.5610 0.1926 0.1926 0.4355 0.4355 2.1772 2.1772 2.8942 2.8942 12.5196 12.5196 12.6738 12.6738 17.4879 17.4879 18.2210 18.2210 21.2893 21.2893 21.7517 21.7517 24.7181 24.7181 26.0390 26.0390 26.5703 26.5703 28.3436 28.3436 k = 0.0000 0.6847 0.2820 ( 1156 PWs) bands (ev): -18.1348 -18.1348 -17.7226 -17.7226 -2.3525 -2.3525 -1.6013 -1.6013 0.2049 0.2049 0.4303 0.4303 2.2058 2.2058 2.8744 2.8744 12.5149 12.5149 12.6683 12.6683 17.5701 17.5701 18.2004 18.2004 21.3993 21.3993 21.8785 21.8785 24.6708 24.6708 25.9052 25.9052 26.6235 26.6235 28.2127 28.2127 k = 0.0000 0.6847 0.2924 ( 1158 PWs) bands (ev): -18.1175 -18.1175 -17.7404 -17.7404 -2.3312 -2.3312 -1.6422 -1.6422 0.2174 0.2174 0.4249 0.4249 2.2351 2.2351 2.8526 2.8526 12.5129 12.5129 12.6623 12.6623 17.6447 17.6447 18.1814 18.1814 21.5108 21.5108 21.9996 21.9996 24.6362 24.6362 25.7731 25.7731 26.6781 26.6781 28.0810 28.0810 k = 0.0000 0.6847 0.3029 ( 1160 PWs) bands (ev): -18.0998 -18.0998 -17.7586 -17.7586 -2.3084 -2.3084 -1.6833 -1.6833 0.2303 0.2303 0.4193 0.4193 2.2653 2.2653 2.8291 2.8291 12.5132 12.5132 12.6561 12.6561 17.7119 17.7119 18.1641 18.1641 21.6231 21.6231 22.1134 22.1134 24.6139 24.6139 25.6445 25.6445 26.7335 26.7335 27.9496 27.9496 k = 0.0000 0.6847 0.3133 ( 1160 PWs) bands (ev): -18.0818 -18.0818 -17.7770 -17.7770 -2.2841 -2.2841 -1.7245 -1.7245 0.2432 0.2432 0.4131 0.4131 2.2963 2.2963 2.8040 2.8040 12.5157 12.5157 12.6493 12.6493 17.7718 17.7718 18.1481 18.1481 21.7355 21.7355 22.2178 22.2178 24.6034 24.6034 25.5209 25.5209 26.7887 26.7887 27.8199 27.8199 k = 0.0000 0.6847 0.3238 ( 1156 PWs) bands (ev): -18.0636 -18.0636 -17.7957 -17.7957 -2.2583 -2.2583 -1.7656 -1.7656 0.2563 0.2563 0.4065 0.4065 2.3280 2.3280 2.7773 2.7773 12.5200 12.5200 12.6421 12.6421 17.8246 17.8246 18.1335 18.1335 21.8467 21.8467 22.3104 22.3104 24.6040 24.6040 25.4036 25.4036 26.8424 26.8424 27.6936 27.6936 k = 0.0000 0.6847 0.3342 ( 1154 PWs) bands (ev): -18.0450 -18.0450 -17.8146 -17.8146 -2.2310 -2.2310 -1.8065 -1.8065 0.2693 0.2693 0.3994 0.3994 2.3602 2.3602 2.7492 2.7492 12.5258 12.5258 12.6344 12.6344 17.8706 17.8706 18.1199 18.1199 21.9558 21.9558 22.3886 22.3886 24.6148 24.6148 25.2943 25.2943 26.8928 26.8928 27.5729 27.5729 k = 0.0000 0.6847 0.3447 ( 1154 PWs) bands (ev): -18.0263 -18.0263 -17.8336 -17.8336 -2.2023 -2.2023 -1.8470 -1.8470 0.2823 0.2823 0.3916 0.3916 2.3930 2.3930 2.7199 2.7199 12.5329 12.5329 12.6263 12.6263 17.9105 17.9105 18.1070 18.1070 22.0610 22.0610 22.4503 22.4503 24.6345 24.6345 25.1939 25.1939 26.9379 26.9379 27.4602 27.4602 k = 0.0000 0.6847 0.3551 ( 1156 PWs) bands (ev): -18.0073 -18.0073 -17.8528 -17.8528 -2.1722 -2.1722 -1.8869 -1.8869 0.2951 0.2951 0.3831 0.3831 2.4262 2.4262 2.6895 2.6895 12.5411 12.5411 12.6176 12.6176 17.9447 17.9447 18.0945 18.0945 22.1607 22.1607 22.4933 22.4933 24.6620 24.6620 25.1031 25.1031 26.9758 26.9758 27.3579 27.3579 k = 0.0000 0.6847 0.3655 ( 1156 PWs) bands (ev): -17.9882 -17.9882 -17.8721 -17.8721 -2.1406 -2.1406 -1.9261 -1.9261 0.3077 0.3077 0.3740 0.3740 2.4596 2.4596 2.6582 2.6582 12.5500 12.5500 12.6084 12.6084 17.9739 17.9739 18.0819 18.0819 22.2531 22.2531 22.5160 22.5160 24.6961 24.6961 25.0223 25.0223 27.0060 27.0060 27.2684 27.2684 k = 0.0000 0.6847 0.3760 ( 1156 PWs) bands (ev): -17.9690 -17.9690 -17.8915 -17.8915 -2.1078 -2.1078 -1.9645 -1.9645 0.3199 0.3199 0.3643 0.3643 2.4932 2.4932 2.6261 2.6261 12.5595 12.5595 12.5989 12.5989 17.9987 17.9987 18.0686 18.0686 22.3356 22.3356 22.5179 22.5179 24.7359 24.7359 24.9507 24.9507 27.0312 27.0312 27.1935 27.1935 k = 0.0000 0.6847 0.3864 ( 1158 PWs) bands (ev): -17.9497 -17.9497 -17.9109 -17.9109 -2.0737 -2.0737 -2.0020 -2.0020 0.3317 0.3317 0.3540 0.3540 2.5268 2.5268 2.5934 2.5934 12.5693 12.5693 12.5892 12.5892 18.0200 18.0200 18.0543 18.0543 22.4057 22.4057 22.4991 22.4991 24.7809 24.7809 24.8874 24.8874 27.0569 27.0569 27.1341 27.1341 k = 0.0000 0.6847 0.3969 ( 1160 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0384 -2.0384 -2.0384 -2.0384 0.3431 0.3431 0.3431 0.3431 2.5602 2.5602 2.5602 2.5602 12.5792 12.5792 12.5792 12.5792 18.0383 18.0383 18.0383 18.0383 22.4611 22.4611 22.4611 22.4611 24.8312 24.8312 24.8312 24.8312 27.0895 27.0895 27.0895 27.0895 k = 0.0000 0.6847 0.3969 ( 1160 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0384 -2.0384 -2.0384 -2.0384 0.3431 0.3431 0.3431 0.3431 2.5602 2.5602 2.5602 2.5602 12.5792 12.5792 12.5792 12.5792 18.0383 18.0383 18.0383 18.0383 22.4611 22.4611 22.4611 22.4611 24.8312 24.8312 24.8312 24.8312 27.0895 27.0895 27.0895 27.0895 k = 0.0102 0.6847 0.3969 ( 1158 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0408 -2.0408 -2.0347 -2.0347 0.3309 0.3309 0.3506 0.3506 2.5529 2.5529 2.5697 2.5697 12.5788 12.5788 12.5857 12.5857 18.0359 18.0359 18.0391 18.0391 22.4499 22.4499 22.4567 22.4567 24.8270 24.8270 24.8352 24.8352 27.0864 27.0864 27.0927 27.0927 k = 0.0205 0.6847 0.3969 ( 1156 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0419 -2.0419 -2.0297 -2.0297 0.3140 0.3140 0.3533 0.3533 2.5479 2.5479 2.5813 2.5813 12.5844 12.5844 12.5981 12.5981 18.0320 18.0320 18.0384 18.0384 22.4236 22.4236 22.4369 22.4369 24.8224 24.8224 24.8383 24.8383 27.0848 27.0848 27.0974 27.0974 k = 0.0307 0.6847 0.3969 ( 1152 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0418 -2.0418 -2.0234 -2.0234 0.2926 0.2926 0.3512 0.3512 2.5452 2.5452 2.5948 2.5948 12.5959 12.5959 12.6166 12.6166 18.0265 18.0265 18.0362 18.0362 22.3834 22.3834 22.4026 22.4026 24.8168 24.8168 24.8393 24.8393 27.0884 27.0884 27.1072 27.1072 k = 0.0410 0.6847 0.3969 ( 1152 PWs) bands (ev): -17.9303 -17.9303 -17.9303 -17.9303 -2.0405 -2.0405 -2.0158 -2.0158 0.2670 0.2670 0.3444 0.3444 2.5448 2.5448 2.6100 2.6100 12.6133 12.6133 12.6408 12.6408 18.0194 18.0194 18.0325 18.0325 22.3306 22.3306 22.3548 22.3548 24.8089 24.8089 24.8367 24.8367 27.1012 27.1012 27.1264 27.1264 k = 0.0512 0.6847 0.3969 ( 1150 PWs) bands (ev): -17.9304 -17.9304 -17.9303 -17.9303 -2.0379 -2.0379 -2.0069 -2.0069 0.2374 0.2374 0.3330 0.3330 2.5465 2.5465 2.6266 2.6266 12.6365 12.6365 12.6708 12.6708 18.0109 18.0109 18.0273 18.0273 22.2670 22.2670 22.2954 22.2954 24.7976 24.7976 24.8292 24.8292 27.1266 27.1266 27.1584 27.1584 k = 0.0615 0.6847 0.3969 ( 1150 PWs) bands (ev): -17.9304 -17.9304 -17.9304 -17.9304 -2.0342 -2.0342 -1.9967 -1.9967 0.2041 0.2041 0.3173 0.3173 2.5504 2.5504 2.6446 2.6446 12.6652 12.6652 12.7063 12.7063 18.0009 18.0009 18.0206 18.0206 22.1943 22.1943 22.2261 22.2261 24.7820 24.7820 24.8159 24.8159 27.1667 27.1667 27.2057 27.2057 k = 0.0717 0.6847 0.3969 ( 1148 PWs) bands (ev): -17.9304 -17.9304 -17.9304 -17.9304 -2.0294 -2.0294 -1.9852 -1.9852 0.1675 0.1675 0.2976 0.2976 2.5562 2.5562 2.6635 2.6635 12.6992 12.6992 12.7471 12.7471 17.9896 17.9896 18.0127 18.0127 22.1145 22.1145 22.1488 22.1488 24.7616 24.7616 24.7966 24.7966 27.2224 27.2224 27.2689 27.2689 k = 0.0819 0.6847 0.3969 ( 1150 PWs) bands (ev): -17.9305 -17.9305 -17.9305 -17.9305 -2.0235 -2.0235 -1.9725 -1.9725 0.1278 0.1278 0.2742 0.2742 2.5637 2.5637 2.6832 2.6832 12.7382 12.7382 12.7929 12.7929 17.9769 17.9769 18.0035 18.0035 22.0291 22.0291 22.0650 22.0650 24.7364 24.7364 24.7713 24.7713 27.2934 27.2934 27.3480 27.3480 k = 0.0922 0.6847 0.3969 ( 1148 PWs) bands (ev): -17.9306 -17.9306 -17.9306 -17.9306 -2.0166 -2.0166 -1.9585 -1.9585 0.0854 0.0854 0.2474 0.2474 2.5727 2.5727 2.7034 2.7034 12.7821 12.7821 12.8435 12.8435 17.9630 17.9630 17.9932 17.9932 21.9395 21.9395 21.9765 21.9765 24.7070 24.7070 24.7411 24.7411 27.3789 27.3789 27.4417 27.4417 k = 0.1024 0.6847 0.3969 ( 1150 PWs) bands (ev): -17.9308 -17.9308 -17.9308 -17.9308 -2.0087 -2.0087 -1.9432 -1.9432 0.0407 0.0407 0.2177 0.2177 2.5830 2.5830 2.7239 2.7239 12.8304 12.8304 12.8986 12.8986 17.9480 17.9480 17.9819 17.9819 21.8472 21.8472 21.8846 21.8846 24.6743 24.6743 24.7070 24.7070 27.4771 27.4771 27.5484 27.5484 k = 0.1127 0.6847 0.3969 ( 1146 PWs) bands (ev): -17.9310 -17.9310 -17.9310 -17.9310 -1.9999 -1.9999 -1.9268 -1.9268 -0.0060 -0.0060 0.1855 0.1855 2.5944 2.5944 2.7445 2.7445 12.8829 12.8829 12.9576 12.9576 17.9322 17.9322 17.9697 17.9697 21.7532 21.7532 21.7906 21.7906 24.6394 24.6394 24.6704 24.6704 27.5863 27.5863 27.6662 27.6662 k = 0.1229 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9313 -17.9313 -17.9312 -17.9312 -1.9902 -1.9902 -1.9091 -1.9091 -0.0543 -0.0543 0.1511 0.1511 2.6066 2.6066 2.7650 2.7650 12.9389 12.9389 13.0203 13.0203 17.9155 17.9155 17.9568 17.9568 21.6585 21.6585 21.6955 21.6955 24.6035 24.6035 24.6326 24.6326 27.7043 27.7043 27.7928 27.7928 k = 0.1332 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9316 -17.9316 -17.9316 -17.9316 -1.9798 -1.9798 -1.8904 -1.8904 -0.1040 -0.1040 0.1150 0.1150 2.6195 2.6195 2.7852 2.7852 12.9982 12.9982 13.0862 13.0862 17.8983 17.8983 17.9435 17.9435 21.5640 21.5640 21.6002 21.6002 24.5677 24.5677 24.5949 24.5949 27.8290 27.8290 27.9262 27.9262 k = 0.1434 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9320 -17.9320 -17.9320 -17.9320 -1.9687 -1.9687 -1.8706 -1.8706 -0.1545 -0.1545 0.0777 0.0777 2.6327 2.6327 2.8049 2.8049 13.0602 13.0602 13.1548 13.1548 17.8808 17.8808 17.9300 17.9300 21.4704 21.4704 21.5055 21.5055 24.5331 24.5331 24.5583 24.5583 27.9582 27.9582 28.0641 28.0641 k = 0.1536 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9325 -17.9325 -17.9325 -17.9325 -1.9570 -1.9570 -1.8498 -1.8498 -0.2057 -0.2057 0.0395 0.0395 2.6462 2.6462 2.8242 2.8242 13.1244 13.1244 13.2254 13.2254 17.8633 17.8633 17.9165 17.9165 21.3782 21.3782 21.4121 21.4121 24.5007 24.5007 24.5239 24.5239 28.0899 28.0899 28.2044 28.2044 k = 0.1639 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9331 -17.9331 -17.9331 -17.9331 -1.9448 -1.9448 -1.8281 -1.8281 -0.2572 -0.2572 0.0009 0.0009 2.6597 2.6597 2.8427 2.8427 13.1902 13.1902 13.2977 13.2977 17.8460 17.8460 17.9034 17.9034 21.2881 21.2881 21.3207 21.3207 24.4713 24.4713 24.4926 24.4926 28.2218 28.2218 28.3449 28.3449 k = 0.1741 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9338 -17.9338 -17.9338 -17.9338 -1.9322 -1.9322 -1.8056 -1.8056 -0.3086 -0.3086 -0.0377 -0.0377 2.6730 2.6730 2.8604 2.8604 13.2570 13.2570 13.3708 13.3708 17.8294 17.8294 17.8909 17.8909 21.2006 21.2006 21.2316 21.2316 24.4457 24.4457 24.4651 24.4651 28.3521 28.3521 28.4835 28.4835 k = 0.1844 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9347 -17.9347 -17.9346 -17.9346 -1.9195 -1.9195 -1.7823 -1.7823 -0.3596 -0.3596 -0.0760 -0.0760 2.6862 2.6862 2.8772 2.8772 13.3243 13.3243 13.4443 13.4443 17.8137 17.8137 17.8794 17.8794 21.1160 21.1160 21.1455 21.1455 24.4243 24.4243 24.4421 24.4421 28.4786 28.4786 28.6182 28.6182 k = 0.1946 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9357 -17.9357 -17.9356 -17.9356 -1.9065 -1.9065 -1.7584 -1.7584 -0.4099 -0.4099 -0.1134 -0.1134 2.6989 2.6989 2.8930 2.8930 13.3913 13.3913 13.5174 13.5174 17.7993 17.7993 17.8693 17.8693 21.0347 21.0347 21.0627 21.0627 24.4078 24.4078 24.4241 24.4241 28.5995 28.5995 28.7467 28.7467 k = 0.2049 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9368 -17.9368 -17.9368 -17.9368 -1.8936 -1.8936 -1.7342 -1.7342 -0.4591 -0.4591 -0.1497 -0.1497 2.7111 2.7111 2.9078 2.9078 13.4575 13.4575 13.5894 13.5894 17.7867 17.7867 17.8609 17.8609 20.9572 20.9572 20.9836 20.9836 24.3966 24.3966 24.4115 24.4115 28.7129 28.7129 28.8672 28.8672 k = 0.2151 0.6847 0.3969 ( 1146 PWs) bands (ev): -17.9382 -17.9382 -17.9381 -17.9381 -1.8809 -1.8809 -1.7096 -1.7096 -0.5068 -0.5068 -0.1845 -0.1845 2.7226 2.7226 2.9215 2.9215 13.5221 13.5221 13.6596 13.6596 17.7760 17.7760 17.8545 17.8545 20.8837 20.8837 20.9086 20.9086 24.3910 24.3910 24.4046 24.4046 28.8170 28.8170 28.9777 28.9777 k = 0.2253 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9397 -17.9397 -17.9396 -17.9396 -1.8685 -1.8685 -1.6851 -1.6851 -0.5526 -0.5526 -0.2173 -0.2173 2.7335 2.7335 2.9341 2.9341 13.5845 13.5845 13.7273 13.7273 17.7679 17.7679 17.8505 17.8505 20.8147 20.8147 20.8382 20.8382 24.3914 24.3914 24.4039 24.4039 28.9104 28.9104 29.0766 29.0766 k = 0.2356 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9414 -17.9414 -17.9413 -17.9413 -1.8565 -1.8565 -1.6608 -1.6608 -0.5961 -0.5961 -0.2479 -0.2479 2.7437 2.7437 2.9455 2.9455 13.6440 13.6440 13.7919 13.7919 17.7625 17.7625 17.8491 17.8491 20.7504 20.7504 20.7726 20.7726 24.3979 24.3979 24.4094 24.4094 28.9918 28.9918 29.1624 29.1624 k = 0.2458 0.6847 0.3969 ( 1144 PWs) bands (ev): -17.9433 -17.9433 -17.9432 -17.9432 -1.8451 -1.8451 -1.6371 -1.6371 -0.6368 -0.6368 -0.2760 -0.2760 2.7530 2.7530 2.9557 2.9557 13.7001 13.7001 13.8525 13.8525 17.7601 17.7601 17.8505 17.8505 20.6911 20.6911 20.7121 20.7121 24.4107 24.4107 24.4214 24.4214 29.0601 29.0601 29.2342 29.2342 k = 0.2561 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9454 -17.9454 -17.9453 -17.9453 -1.8345 -1.8345 -1.6143 -1.6143 -0.6742 -0.6742 -0.3012 -0.3012 2.7614 2.7614 2.9646 2.9646 13.7523 13.7523 13.9087 13.9087 17.7609 17.7609 17.8549 17.8549 20.6372 20.6372 20.6573 20.6573 24.4299 24.4299 24.4400 24.4400 29.1147 29.1147 29.2913 29.2913 k = 0.2663 0.6847 0.3969 ( 1138 PWs) bands (ev): -17.9478 -17.9478 -17.9477 -17.9477 -1.8247 -1.8247 -1.5930 -1.5930 -0.7078 -0.7078 -0.3232 -0.3232 2.7690 2.7690 2.9723 2.9723 13.8000 13.8000 13.9600 13.9600 17.7651 17.7651 17.8623 17.8623 20.5892 20.5892 20.6085 20.6085 24.4558 24.4558 24.4654 24.4654 29.1554 29.1554 29.3335 29.3335 k = 0.2766 0.6847 0.3969 ( 1138 PWs) bands (ev): -17.9504 -17.9504 -17.9503 -17.9503 -1.8159 -1.8159 -1.5736 -1.5736 -0.7368 -0.7368 -0.3419 -0.3419 2.7755 2.7755 2.9788 2.9788 13.8428 13.8428 14.0057 14.0057 17.7725 17.7725 17.8727 17.8727 20.5471 20.5471 20.5659 20.5659 24.4882 24.4882 24.4976 24.4976 29.1820 29.1820 29.3607 29.3607 k = 0.2868 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9533 -17.9533 -17.9532 -17.9532 -1.8082 -1.8082 -1.5566 -1.5566 -0.7608 -0.7608 -0.3570 -0.3570 2.7811 2.7811 2.9839 2.9839 13.8803 13.8803 14.0457 14.0457 17.7830 17.7830 17.8858 17.8858 20.5115 20.5115 20.5299 20.5299 24.5272 24.5272 24.5365 24.5365 29.1948 29.1948 29.3735 29.3735 k = 0.2970 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9565 -17.9565 -17.9564 -17.9564 -1.8015 -1.8015 -1.5425 -1.5425 -0.7790 -0.7790 -0.3683 -0.3683 2.7857 2.7857 2.9878 2.9878 13.9125 13.9125 14.0796 14.0796 17.7963 17.7963 17.9013 17.9013 20.4828 20.4828 20.5011 20.5011 24.5729 24.5729 24.5823 24.5823 29.1944 29.1944 29.3724 29.3724 k = 0.2970 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9565 -17.9565 -17.9564 -17.9564 -1.8015 -1.8015 -1.5425 -1.5425 -0.7790 -0.7790 -0.3683 -0.3683 2.7857 2.7857 2.9878 2.9878 13.9125 13.9125 14.0796 14.0796 17.7963 17.7963 17.9013 17.9013 20.4828 20.4828 20.5011 20.5011 24.5729 24.5729 24.5823 24.5823 29.1944 29.1944 29.3724 29.3724 k = 0.2929 0.6752 0.3969 ( 1138 PWs) bands (ev): -17.9486 -17.9486 -17.9485 -17.9485 -1.8175 -1.8175 -1.5748 -1.5748 -0.7378 -0.7378 -0.3417 -0.3417 2.7749 2.7749 2.9791 2.9791 13.8392 13.8392 14.0027 14.0027 17.7568 17.7568 17.8566 17.8566 20.5496 20.5496 20.5677 20.5677 24.4513 24.4513 24.4602 24.4602 29.2068 29.2068 29.3866 29.3866 k = 0.2888 0.6657 0.3969 ( 1138 PWs) bands (ev): -17.9416 -17.9416 -17.9415 -17.9415 -1.8341 -1.8341 -1.6072 -1.6072 -0.6926 -0.6926 -0.3105 -0.3105 2.7631 2.7631 2.9696 2.9696 13.7690 13.7690 13.9292 13.9292 17.7132 17.7132 17.8076 17.8076 20.6208 20.6208 20.6383 20.6383 24.3361 24.3361 24.3443 24.3443 29.2099 29.2099 29.3905 29.3905 k = 0.2847 0.6562 0.3969 ( 1138 PWs) bands (ev): -17.9357 -17.9357 -17.9356 -17.9356 -1.8505 -1.8505 -1.6384 -1.6384 -0.6447 -0.6447 -0.2754 -0.2754 2.7504 2.7504 2.9592 2.9592 13.7022 13.7022 13.8590 13.8590 17.6661 17.6661 17.7551 17.7551 20.6953 20.6953 20.7120 20.7120 24.2276 24.2276 24.2351 24.2351 29.2044 29.2044 29.3850 29.3850 k = 0.2805 0.6467 0.3969 ( 1138 PWs) bands (ev): -17.9309 -17.9309 -17.9308 -17.9308 -1.8660 -1.8660 -1.6675 -1.6675 -0.5950 -0.5950 -0.2372 -0.2372 2.7367 2.7367 2.9481 2.9481 13.6390 13.6390 13.7923 13.7923 17.6161 17.6161 17.6997 17.6997 20.7719 20.7719 20.7877 20.7877 24.1264 24.1264 24.1332 24.1332 29.1911 29.1911 29.3711 29.3711 k = 0.2764 0.6372 0.3969 ( 1142 PWs) bands (ev): -17.9271 -17.9271 -17.9271 -17.9271 -1.8801 -1.8801 -1.6940 -1.6940 -0.5442 -0.5442 -0.1964 -0.1964 2.7222 2.7222 2.9361 2.9361 13.5794 13.5794 13.7294 13.7294 17.5637 17.5637 17.6421 17.6421 20.8496 20.8496 20.8643 20.8643 24.0332 24.0332 24.0390 24.0390 29.1707 29.1707 29.3496 29.3496 k = 0.2723 0.6277 0.3969 ( 1142 PWs) bands (ev): -17.9245 -17.9245 -17.9245 -17.9245 -1.8922 -1.8922 -1.7172 -1.7172 -0.4928 -0.4928 -0.1537 -0.1537 2.7067 2.7067 2.9233 2.9233 13.5237 13.5237 13.6703 13.6703 17.5094 17.5094 17.5826 17.5826 20.9272 20.9272 20.9408 20.9408 23.9486 23.9486 23.9533 23.9533 29.1442 29.1442 29.3215 29.3215 k = 0.2682 0.6182 0.3969 ( 1146 PWs) bands (ev): -17.9231 -17.9231 -17.9231 -17.9231 -1.9020 -1.9020 -1.7370 -1.7370 -0.4412 -0.4412 -0.1095 -0.1095 2.6903 2.6903 2.9096 2.9096 13.4719 13.4719 13.6151 13.6151 17.4535 17.4535 17.5217 17.5217 21.0035 21.0035 21.0160 21.0160 23.8733 23.8733 23.8768 23.8768 29.1120 29.1120 29.2875 29.2875 k = 0.2640 0.6087 0.3969 ( 1150 PWs) bands (ev): -17.9228 -17.9228 -17.9228 -17.9228 -1.9092 -1.9092 -1.7530 -1.7530 -0.3898 -0.3898 -0.0641 -0.0641 2.6731 2.6731 2.8953 2.8953 13.4241 13.4241 13.5640 13.5640 17.3964 17.3964 17.4597 17.4597 21.0775 21.0775 21.0887 21.0887 23.8082 23.8082 23.8104 23.8104 29.0749 29.0749 29.2485 29.2485 k = 0.2599 0.5992 0.3969 ( 1150 PWs) bands (ev): -17.9237 -17.9237 -17.9237 -17.9237 -1.9134 -1.9134 -1.7651 -1.7651 -0.3388 -0.3388 -0.0180 -0.0180 2.6550 2.6550 2.8802 2.8802 13.3806 13.3806 13.5171 13.5171 17.3384 17.3384 17.3970 17.3970 21.1479 21.1479 21.1579 21.1579 23.7541 23.7541 23.7548 23.7548 29.0336 29.0336 29.2051 29.2051 k = 0.2558 0.5896 0.3969 ( 1152 PWs) bands (ev): -17.9257 -17.9257 -17.9257 -17.9257 -1.9145 -1.9145 -1.7732 -1.7732 -0.2884 -0.2884 0.0286 0.0286 2.6360 2.6360 2.8643 2.8643 13.3413 13.3413 13.4745 13.4745 17.2797 17.2797 17.3339 17.3339 21.2135 21.2135 21.2222 21.2222 23.7109 23.7109 23.7119 23.7119 28.9886 28.9886 29.1579 29.1579 k = 0.2517 0.5801 0.3969 ( 1152 PWs) bands (ev): -17.9290 -17.9290 -17.9289 -17.9289 -1.9123 -1.9123 -1.7771 -1.7771 -0.2388 -0.2388 0.0754 0.0754 2.6163 2.6163 2.8478 2.8478 13.3063 13.3063 13.4362 13.4362 17.2207 17.2207 17.2706 17.2706 21.2731 21.2731 21.2805 21.2805 23.6795 23.6795 23.6823 23.6823 28.9406 28.9406 29.1077 29.1077 k = 0.2475 0.5706 0.3969 ( 1152 PWs) bands (ev): -17.9334 -17.9334 -17.9334 -17.9334 -1.9066 -1.9066 -1.7769 -1.7769 -0.1901 -0.1901 0.1221 0.1221 2.5958 2.5958 2.8306 2.8306 13.2758 13.2758 13.4023 13.4023 17.1614 17.1614 17.2072 17.2072 21.3259 21.3259 21.3320 21.3320 23.6613 23.6613 23.6661 23.6661 28.8901 28.8901 29.0549 29.0549 k = 0.2434 0.5611 0.3969 ( 1152 PWs) bands (ev): -17.9390 -17.9390 -17.9389 -17.9389 -1.8974 -1.8974 -1.7725 -1.7725 -0.1424 -0.1424 0.1686 0.1686 2.5746 2.5746 2.8128 2.8128 13.2496 13.2496 13.3729 13.3729 17.1022 17.1022 17.1440 17.1440 21.3709 21.3709 21.3757 21.3757 23.6568 23.6568 23.6636 23.6636 28.8375 28.8375 29.0002 29.0002 k = 0.2393 0.5516 0.3969 ( 1152 PWs) bands (ev): -17.9457 -17.9457 -17.9457 -17.9457 -1.8845 -1.8845 -1.7638 -1.7638 -0.0960 -0.0960 0.2146 0.2146 2.5527 2.5527 2.7945 2.7945 13.2280 13.2280 13.3480 13.3480 17.0430 17.0430 17.0811 17.0811 21.4076 21.4076 21.4113 21.4113 23.6661 23.6661 23.6750 23.6750 28.7834 28.7834 28.9439 28.9439 k = 0.2352 0.5421 0.3969 ( 1152 PWs) bands (ev): -17.9536 -17.9536 -17.9536 -17.9536 -1.8681 -1.8681 -1.7510 -1.7510 -0.0508 -0.0508 0.2601 0.2601 2.5302 2.5302 2.7756 2.7756 13.2109 13.2109 13.3276 13.3276 16.9843 16.9843 17.0188 17.0188 21.4359 21.4359 21.4386 21.4386 23.6892 23.6892 23.7001 23.7001 28.7281 28.7281 28.8867 28.8867 k = 0.2310 0.5326 0.3969 ( 1152 PWs) bands (ev): -17.9627 -17.9627 -17.9626 -17.9626 -1.8480 -1.8480 -1.7341 -1.7341 -0.0070 -0.0070 0.3049 0.3049 2.5070 2.5070 2.7563 2.7563 13.1982 13.1982 13.3117 13.3117 16.9260 16.9260 16.9572 16.9572 21.4558 21.4558 21.4578 21.4578 23.7253 23.7253 23.7383 23.7383 28.6722 28.6722 28.8288 28.8288 k = 0.2269 0.5231 0.3969 ( 1152 PWs) bands (ev): -17.9728 -17.9728 -17.9727 -17.9727 -1.8242 -1.8242 -1.7130 -1.7130 0.0353 0.0353 0.3489 0.3489 2.4833 2.4833 2.7366 2.7366 13.1899 13.1899 13.3002 13.3002 16.8685 16.8685 16.8964 16.8964 21.4680 21.4680 21.4693 21.4693 23.7737 23.7737 23.7887 23.7887 28.6159 28.6159 28.7707 28.7707 k = 0.2228 0.5136 0.3969 ( 1154 PWs) bands (ev): -17.9840 -17.9840 -17.9839 -17.9839 -1.7969 -1.7969 -1.6879 -1.6879 0.0762 0.0762 0.3921 0.3921 2.4591 2.4591 2.7165 2.7165 13.1861 13.1861 13.2931 13.2931 16.8118 16.8118 16.8368 16.8368 21.4729 21.4729 21.4739 21.4739 23.8332 23.8332 23.8500 23.8500 28.5596 28.5596 28.7127 28.7127 k = 0.2187 0.5040 0.3969 ( 1154 PWs) bands (ev): -17.9963 -17.9963 -17.9962 -17.9962 -1.7661 -1.7661 -1.6589 -1.6589 0.1155 0.1155 0.4343 0.4343 2.4345 2.4345 2.6961 2.6961 13.1865 13.1865 13.2903 13.2903 16.7563 16.7563 16.7784 16.7784 21.4717 21.4717 21.4725 21.4725 23.9025 23.9025 23.9211 23.9211 28.5036 28.5036 28.6552 28.6552 k = 0.2145 0.4945 0.3969 ( 1158 PWs) bands (ev): -18.0096 -18.0096 -18.0095 -18.0095 -1.7318 -1.7318 -1.6261 -1.6261 0.1533 0.1533 0.4755 0.4755 2.4095 2.4095 2.6755 2.6755 13.1911 13.1911 13.2917 13.2917 16.7021 16.7021 16.7215 16.7215 21.4651 21.4651 21.4659 21.4659 23.9800 23.9800 24.0004 24.0004 28.4481 28.4481 28.5982 28.5982 k = 0.2104 0.4850 0.3969 ( 1158 PWs) bands (ev): -18.0238 -18.0238 -18.0237 -18.0237 -1.6941 -1.6941 -1.5895 -1.5895 0.1895 0.1895 0.5158 0.5158 2.3842 2.3842 2.6547 2.6547 13.1997 13.1997 13.2972 13.2972 16.6495 16.6495 16.6664 16.6664 21.4541 21.4541 21.4551 21.4551 24.0645 24.0645 24.0866 24.0866 28.3935 28.3935 28.5423 28.5423 k = 0.2063 0.4755 0.3969 ( 1162 PWs) bands (ev): -18.0390 -18.0390 -18.0389 -18.0389 -1.6532 -1.6532 -1.5493 -1.5493 0.2242 0.2242 0.5551 0.5551 2.3586 2.3586 2.6338 2.6338 13.2121 13.2121 13.3065 13.3065 16.5988 16.5988 16.6133 16.6133 21.4394 21.4394 21.4408 21.4408 24.1544 24.1544 24.1782 24.1782 28.3399 28.3399 28.4875 28.4875 k = 0.2022 0.4660 0.3969 ( 1162 PWs) bands (ev): -18.0551 -18.0551 -18.0550 -18.0550 -1.6093 -1.6093 -1.5057 -1.5057 0.2573 0.2573 0.5934 0.5934 2.3327 2.3327 2.6129 2.6129 13.2281 13.2281 13.3194 13.3194 16.5503 16.5503 16.5626 16.5626 21.4218 21.4218 21.4237 21.4237 24.2485 24.2485 24.2739 24.2739 28.2874 28.2874 28.4341 28.4341 k = 0.1980 0.4565 0.3969 ( 1162 PWs) bands (ev): -18.0720 -18.0720 -18.0719 -18.0719 -1.5624 -1.5624 -1.4588 -1.4588 0.2890 0.2890 0.6308 0.6308 2.3067 2.3067 2.5921 2.5921 13.2474 13.2474 13.3356 13.3356 16.5044 16.5044 16.5146 16.5146 21.4018 21.4018 21.4043 21.4043 24.3454 24.3454 24.3724 24.3724 28.2363 28.2363 28.3820 28.3820 k = 0.1939 0.4470 0.3969 ( 1158 PWs) bands (ev): -18.0898 -18.0898 -18.0896 -18.0896 -1.5128 -1.5128 -1.4089 -1.4089 0.3192 0.3192 0.6675 0.6675 2.2806 2.2806 2.5714 2.5714 13.2696 13.2696 13.3548 13.3548 16.4614 16.4614 16.4697 16.4697 21.3798 21.3798 21.3831 21.3831 24.4439 24.4439 24.4727 24.4727 28.1865 28.1865 28.3314 28.3314 k = 0.1898 0.4375 0.3969 ( 1162 PWs) bands (ev): -18.1082 -18.1082 -18.1081 -18.1081 -1.4607 -1.4607 -1.3561 -1.3561 0.3482 0.3482 0.7034 0.7034 2.2545 2.2545 2.5509 2.5509 13.2944 13.2944 13.3765 13.3765 16.4218 16.4218 16.4282 16.4282 21.3562 21.3562 21.3603 21.3603 24.5429 24.5429 24.5734 24.5734 28.1381 28.1381 28.2823 28.2823 k = 0.1857 0.4280 0.3969 ( 1162 PWs) bands (ev): -18.1274 -18.1274 -18.1273 -18.1273 -1.4063 -1.4063 -1.3008 -1.3008 0.3759 0.3759 0.7387 0.7387 2.2283 2.2283 2.5307 2.5307 13.3213 13.3213 13.4005 13.4005 16.3860 16.3860 16.3907 16.3907 21.3313 21.3313 21.3362 21.3362 24.6413 24.6413 24.6736 24.6736 28.0910 28.0910 28.2347 28.2347 k = 0.1815 0.4185 0.3969 ( 1162 PWs) bands (ev): -18.1472 -18.1472 -18.1471 -18.1471 -1.3499 -1.3499 -1.2430 -1.2430 0.4025 0.4025 0.7736 0.7736 2.2022 2.2022 2.5108 2.5108 13.3498 13.3498 13.4261 13.4261 16.3547 16.3547 16.3577 16.3577 21.3052 21.3052 21.3109 21.3109 24.7379 24.7379 24.7720 24.7720 28.0451 28.0451 28.1882 28.1882 k = 0.1774 0.4089 0.3969 ( 1162 PWs) bands (ev): -18.1676 -18.1676 -18.1675 -18.1675 -1.2918 -1.2918 -1.1833 -1.1833 0.4282 0.4282 0.8083 0.8083 2.1763 2.1763 2.4915 2.4915 13.3794 13.3794 13.4528 13.4528 16.3283 16.3283 16.3297 16.3297 21.2779 21.2779 21.2846 21.2846 24.8318 24.8318 24.8677 24.8677 28.0001 28.0001 28.1429 28.1429 k = 0.1733 0.3994 0.3969 ( 1162 PWs) bands (ev): -18.1886 -18.1886 -18.1884 -18.1884 -1.2322 -1.2322 -1.1218 -1.1218 0.4532 0.4532 0.8429 0.8429 2.1505 2.1505 2.4727 2.4727 13.4095 13.4095 13.4799 13.4799 16.3074 16.3074 16.3074 16.3074 21.2496 21.2496 21.2571 21.2571 24.9218 24.9218 24.9596 24.9596 27.9559 27.9559 28.0982 28.0982 k = 0.1692 0.3899 0.3969 ( 1162 PWs) bands (ev): -18.2100 -18.2100 -18.2098 -18.2098 -1.1716 -1.1716 -1.0590 -1.0590 0.4777 0.4777 0.8777 0.8777 2.1249 2.1249 2.4545 2.4545 13.4393 13.4393 13.5069 13.5069 16.2914 16.2914 16.2928 16.2928 21.2201 21.2201 21.2284 21.2284 25.0069 25.0069 25.0466 25.0466 27.9120 27.9120 28.0539 28.0539 k = 0.1650 0.3804 0.3969 ( 1162 PWs) bands (ev): -18.2318 -18.2318 -18.2316 -18.2316 -1.1103 -1.1103 -0.9952 -0.9952 0.5019 0.5019 0.9130 0.9130 2.0996 2.0996 2.4371 2.4371 13.4683 13.4683 13.5331 13.5331 16.2823 16.2823 16.2850 16.2850 21.1894 21.1894 21.1986 21.1986 25.0861 25.0861 25.1277 25.1277 27.8681 27.8681 28.0094 28.0094 k = 0.1609 0.3709 0.3969 ( 1154 PWs) bands (ev): -18.2539 -18.2539 -18.2538 -18.2538 -1.0486 -1.0486 -0.9309 -0.9309 0.5262 0.5262 0.9491 0.9491 2.0746 2.0746 2.4206 2.4206 13.4958 13.4958 13.5578 13.5578 16.2808 16.2808 16.2847 16.2847 21.1575 21.1575 21.1676 21.1676 25.1584 25.1584 25.2018 25.2018 27.8237 27.8237 27.9643 27.9643 k = 0.1568 0.3614 0.3969 ( 1154 PWs) bands (ev): -18.2764 -18.2764 -18.2762 -18.2762 -0.9870 -0.9870 -0.8666 -0.8666 0.5508 0.5508 0.9862 0.9862 2.0501 2.0501 2.4052 2.4052 13.5209 13.5209 13.5802 13.5802 16.2874 16.2874 16.2926 16.2926 21.1243 21.1243 21.1351 21.1351 25.2228 25.2228 25.2679 25.2679 27.7783 27.7783 27.9178 27.9178 k = 0.1526 0.3519 0.3969 ( 1154 PWs) bands (ev): -18.2991 -18.2991 -18.2989 -18.2989 -0.9259 -0.9259 -0.8028 -0.8028 0.5760 0.5760 1.0247 1.0247 2.0259 2.0259 2.3909 2.3909 13.5431 13.5431 13.5997 13.5997 16.3029 16.3029 16.3091 16.3091 21.0896 21.0896 21.1011 21.1011 25.2783 25.2783 25.3249 25.3249 27.7314 27.7314 27.8696 27.8696 k = 0.1485 0.3424 0.3969 ( 1154 PWs) bands (ev): -18.3220 -18.3220 -18.3218 -18.3218 -0.8658 -0.8658 -0.7400 -0.7400 0.6022 0.6022 1.0648 1.0648 2.0023 2.0023 2.3779 2.3779 13.5617 13.5617 13.6158 13.6158 16.3276 16.3276 16.3348 16.3348 21.0532 21.0532 21.0654 21.0654 25.3241 25.3241 25.3720 25.3720 27.6828 27.6828 27.8190 27.8190 k = 0.1444 0.3329 0.3969 ( 1158 PWs) bands (ev): -18.3450 -18.3450 -18.3448 -18.3448 -0.8072 -0.8072 -0.6789 -0.6789 0.6297 0.6297 1.1070 1.1070 1.9793 1.9793 2.3663 2.3663 13.5764 13.5764 13.6280 13.6280 16.3620 16.3620 16.3701 16.3701 21.0151 21.0151 21.0279 21.0279 25.3594 25.3594 25.4084 25.4084 27.6322 27.6322 27.7659 27.7659 k = 0.1403 0.3234 0.3969 ( 1158 PWs) bands (ev): -18.3681 -18.3681 -18.3679 -18.3679 -0.7503 -0.7503 -0.6200 -0.6200 0.6589 0.6589 1.1514 1.1514 1.9570 1.9570 2.3565 2.3565 13.5867 13.5867 13.6359 13.6359 16.4062 16.4062 16.4151 16.4151 20.9752 20.9752 20.9886 20.9886 25.3837 25.3837 25.4334 25.4334 27.5799 27.5799 27.7103 27.7103 k = 0.1361 0.3138 0.3969 ( 1162 PWs) bands (ev): -18.3911 -18.3911 -18.3909 -18.3909 -0.6956 -0.6956 -0.5638 -0.5638 0.6901 0.6901 1.1983 1.1983 1.9354 1.9354 2.3485 2.3485 13.5925 13.5925 13.6393 13.6393 16.4604 16.4604 16.4700 16.4700 20.9335 20.9335 20.9474 20.9474 25.3965 25.3965 25.4465 25.4465 27.5261 27.5261 27.6527 27.6527 k = 0.1320 0.3043 0.3969 ( 1154 PWs) bands (ev): -18.4141 -18.4141 -18.4140 -18.4140 -0.6436 -0.6436 -0.5109 -0.5109 0.7233 0.7233 1.2478 1.2478 1.9150 1.9150 2.3426 2.3426 13.5936 13.5936 13.6383 13.6383 16.5245 16.5245 16.5346 16.5346 20.8898 20.8898 20.9042 20.9042 25.3976 25.3976 25.4474 25.4474 27.4716 27.4716 27.5937 27.5937 k = 0.1279 0.2948 0.3969 ( 1154 PWs) bands (ev): -18.4370 -18.4370 -18.4369 -18.4369 -0.5945 -0.5945 -0.4618 -0.4618 0.7589 0.7589 1.2998 1.2998 1.8957 1.8957 2.3392 2.3392 13.5900 13.5900 13.6327 13.6327 16.5983 16.5983 16.6087 16.6087 20.8442 20.8442 20.8590 20.8590 25.3871 25.3871 25.4362 25.4362 27.4170 27.4170 27.5340 27.5340 k = 0.1238 0.2853 0.3969 ( 1154 PWs) bands (ev): -18.4598 -18.4598 -18.4596 -18.4596 -0.5486 -0.5486 -0.4168 -0.4168 0.7967 0.7967 1.3542 1.3542 1.8782 1.8782 2.3383 2.3383 13.5819 13.5819 13.6227 13.6227 16.6812 16.6812 16.6920 16.6920 20.7967 20.7967 20.8118 20.8118 25.3652 25.3652 25.4133 25.4133 27.3633 27.3633 27.4747 27.4747 k = 0.1196 0.2758 0.3969 ( 1154 PWs) bands (ev): -18.4823 -18.4823 -18.4822 -18.4822 -0.5061 -0.5061 -0.3761 -0.3761 0.8365 0.8365 1.4101 1.4101 1.8631 1.8631 2.3405 2.3405 13.5696 13.5696 13.6086 13.6086 16.7729 16.7729 16.7838 16.7838 20.7474 20.7474 20.7627 20.7627 25.3326 25.3326 25.3792 25.3792 27.3111 27.3111 27.4167 27.4167 k = 0.1155 0.2663 0.3969 ( 1158 PWs) bands (ev): -18.5046 -18.5046 -18.5044 -18.5044 -0.4671 -0.4671 -0.3400 -0.3400 0.8780 0.8780 1.4665 1.4665 1.8516 1.8516 2.3460 2.3460 13.5533 13.5533 13.5906 13.5906 16.8727 16.8727 16.8835 16.8835 20.6965 20.6965 20.7120 20.7120 25.2903 25.2903 25.3351 25.3351 27.2611 27.2611 27.3606 27.3606 k = 0.1114 0.2568 0.3969 ( 1158 PWs) bands (ev): -18.5266 -18.5266 -18.5264 -18.5264 -0.4317 -0.4317 -0.3083 -0.3083 0.9207 0.9207 1.5210 1.5210 1.8460 1.8460 2.3552 2.3552 13.5334 13.5334 13.5692 13.5692 16.9798 16.9798 16.9905 16.9905 20.6443 20.6443 20.6599 20.6599 25.2394 25.2394 25.2822 25.2822 27.2136 27.2136 27.3070 27.3070 k = 0.1073 0.2473 0.3969 ( 1154 PWs) bands (ev): -18.5481 -18.5481 -18.5480 -18.5480 -0.3998 -0.3998 -0.2809 -0.2809 0.9640 0.9640 1.5695 1.5695 1.8503 1.8503 2.3684 2.3684 13.5103 13.5103 13.5448 13.5448 17.0935 17.0935 17.1039 17.1039 20.5910 20.5910 20.6068 20.6068 25.1814 25.1814 25.2221 25.2221 27.1687 27.1687 27.2561 27.2561 k = 0.1031 0.2378 0.3969 ( 1154 PWs) bands (ev): -18.5693 -18.5693 -18.5692 -18.5692 -0.3714 -0.3714 -0.2576 -0.2576 1.0072 1.0072 1.6061 1.6061 1.8700 1.8700 2.3860 2.3860 13.4845 13.4845 13.5176 13.5176 17.2128 17.2128 17.2228 17.2228 20.5373 20.5373 20.5531 20.5531 25.1177 25.1177 25.1563 25.1563 27.1262 27.1262 27.2080 27.2080 k = 0.0990 0.2282 0.3969 ( 1154 PWs) bands (ev): -18.5900 -18.5900 -18.5899 -18.5899 -0.3463 -0.3463 -0.2381 -0.2381 1.0495 1.0495 1.6270 1.6270 1.9087 1.9087 2.4081 2.4081 13.4562 13.4562 13.4881 13.4881 17.3366 17.3366 17.3461 17.3461 20.4838 20.4838 20.4995 20.4995 25.0500 25.0500 25.0864 25.0864 27.0860 27.0860 27.1623 27.1623 k = 0.0949 0.2187 0.3969 ( 1158 PWs) bands (ev): -18.6102 -18.6102 -18.6101 -18.6101 -0.3242 -0.3242 -0.2220 -0.2220 1.0902 1.0902 1.6340 1.6340 1.9641 1.9641 2.4351 2.4351 13.4260 13.4260 13.4566 13.4566 17.4637 17.4637 17.4726 17.4726 20.4311 20.4311 20.4469 20.4469 24.9796 24.9796 25.0141 25.0141 27.0475 27.0475 27.1189 27.1189 k = 0.0908 0.2092 0.3969 ( 1158 PWs) bands (ev): -18.6299 -18.6299 -18.6298 -18.6298 -0.3051 -0.3051 -0.2090 -0.2090 1.1286 1.1286 1.6318 1.6318 2.0312 2.0312 2.4669 2.4669 13.3941 13.3941 13.4236 13.4236 17.5929 17.5929 17.6011 17.6011 20.3805 20.3805 20.3962 20.3962 24.9081 24.9081 24.9409 24.9409 27.0103 27.0103 27.0772 27.0772 k = 0.0866 0.1997 0.3969 ( 1162 PWs) bands (ev): -18.6490 -18.6490 -18.6489 -18.6489 -0.2887 -0.2887 -0.1988 -0.1988 1.1643 1.1643 1.6245 1.6245 2.1054 2.1054 2.5034 2.5034 13.3608 13.3608 13.3893 13.3893 17.7225 17.7225 17.7300 17.7300 20.3330 20.3330 20.3486 20.3486 24.8369 24.8369 24.8681 24.8681 26.9738 26.9738 27.0366 27.0366 k = 0.0825 0.1902 0.3969 ( 1162 PWs) bands (ev): -18.6675 -18.6675 -18.6673 -18.6673 -0.2747 -0.2747 -0.1910 -0.1910 1.1969 1.1969 1.6144 1.6144 2.1840 2.1840 2.5446 2.5446 13.3267 13.3267 13.3541 13.3541 17.8508 17.8508 17.8574 17.8574 20.2904 20.2904 20.3060 20.3060 24.7671 24.7671 24.7970 24.7970 26.9374 26.9374 26.9967 26.9967 k = 0.0784 0.1807 0.3969 ( 1166 PWs) bands (ev): -18.6852 -18.6852 -18.6851 -18.6851 -0.2628 -0.2628 -0.1852 -0.1852 1.2262 1.2262 1.6028 1.6028 2.2650 2.2650 2.5899 2.5899 13.2919 13.2919 13.3182 13.3182 17.9757 17.9757 17.9815 17.9815 20.2545 20.2545 20.2699 20.2699 24.6998 24.6998 24.7286 24.7286 26.9006 26.9006 26.9568 26.9568 k = 0.0743 0.1712 0.3969 ( 1166 PWs) bands (ev): -18.7023 -18.7023 -18.7022 -18.7022 -0.2529 -0.2529 -0.1811 -0.1811 1.2523 1.2523 1.5905 1.5905 2.3473 2.3473 2.6389 2.6389 13.2568 13.2568 13.2821 13.2821 18.0948 18.0948 18.0997 18.0997 20.2276 20.2276 20.2428 20.2428 24.6359 24.6359 24.6639 24.6639 26.8625 26.8625 26.9160 26.9160 k = 0.0701 0.1617 0.3969 ( 1170 PWs) bands (ev): -18.7187 -18.7187 -18.7186 -18.7186 -0.2447 -0.2447 -0.1786 -0.1786 1.2750 1.2750 1.5779 1.5779 2.4299 2.4299 2.6909 2.6909 13.2216 13.2216 13.2458 13.2458 18.2053 18.2053 18.2093 18.2093 20.2121 20.2121 20.2271 20.2271 24.5765 24.5765 24.6037 24.6037 26.8223 26.8223 26.8736 26.8736 k = 0.0660 0.1522 0.3969 ( 1170 PWs) bands (ev): -18.7343 -18.7343 -18.7342 -18.7342 -0.2379 -0.2379 -0.1773 -0.1773 1.2948 1.2948 1.5654 1.5654 2.5121 2.5121 2.7451 2.7451 13.1867 13.1867 13.2098 13.2098 18.3043 18.3043 18.3074 18.3074 20.2108 20.2108 20.2254 20.2254 24.5221 24.5221 24.5488 24.5488 26.7791 26.7791 26.8286 26.8286 k = 0.0619 0.1427 0.3969 ( 1170 PWs) bands (ev): -18.7491 -18.7491 -18.7490 -18.7490 -0.2325 -0.2325 -0.1770 -0.1770 1.3118 1.3118 1.5529 1.5529 2.5930 2.5930 2.8008 2.8008 13.1523 13.1523 13.1743 13.1743 18.3893 18.3893 18.3917 18.3917 20.2259 20.2259 20.2400 20.2400 24.4735 24.4735 24.4999 24.4999 26.7317 26.7317 26.7797 26.7797 k = 0.0578 0.1331 0.3969 ( 1170 PWs) bands (ev): -18.7631 -18.7631 -18.7630 -18.7630 -0.2281 -0.2281 -0.1776 -0.1776 1.3264 1.3264 1.5408 1.5408 2.6722 2.6722 2.8571 2.8571 13.1186 13.1186 13.1395 13.1395 18.4581 18.4581 18.4599 18.4599 20.2592 20.2592 20.2726 20.2726 24.4314 24.4314 24.4577 24.4577 26.6788 26.6788 26.7257 26.7257 k = 0.0536 0.1236 0.3969 ( 1162 PWs) bands (ev): -18.7762 -18.7762 -18.7761 -18.7761 -0.2246 -0.2246 -0.1788 -0.1788 1.3388 1.3388 1.5291 1.5291 2.7490 2.7490 2.9133 2.9133 13.0859 13.0859 13.1056 13.1056 18.5100 18.5100 18.5114 18.5114 20.3111 20.3111 20.3236 20.3236 24.3965 24.3965 24.4227 24.4227 26.6188 26.6188 26.6649 26.6649 k = 0.0495 0.1141 0.3969 ( 1162 PWs) bands (ev): -18.7885 -18.7885 -18.7884 -18.7884 -0.2219 -0.2219 -0.1806 -0.1806 1.3494 1.3494 1.5177 1.5177 2.8229 2.8229 2.9684 2.9684 13.0545 13.0545 13.0730 13.0730 18.5454 18.5454 18.5464 18.5464 20.3803 20.3803 20.3918 20.3918 24.3694 24.3694 24.3958 24.3958 26.5498 26.5498 26.5952 26.5952 k = 0.0454 0.1046 0.3969 ( 1166 PWs) bands (ev): -18.7998 -18.7998 -18.7997 -18.7997 -0.2198 -0.2198 -0.1827 -0.1827 1.3585 1.3585 1.5068 1.5068 2.8934 2.8934 3.0219 3.0219 13.0245 13.0245 13.0417 13.0417 18.5660 18.5660 18.5669 18.5669 20.4643 20.4643 20.4747 20.4747 24.3510 24.3510 24.3776 24.3776 26.4699 26.4699 26.5146 26.5146 k = 0.0413 0.0951 0.3969 ( 1170 PWs) bands (ev): -18.8103 -18.8103 -18.8102 -18.8102 -0.2181 -0.2181 -0.1851 -0.1851 1.3664 1.3664 1.4964 1.4964 2.9599 2.9599 3.0728 3.0728 12.9963 12.9963 13.0122 13.0122 18.5744 18.5744 18.5752 18.5752 20.5596 20.5596 20.5688 20.5688 24.3419 24.3419 24.3690 24.3690 26.3772 26.3772 26.4213 26.4213 k = 0.0371 0.0856 0.3969 ( 1178 PWs) bands (ev): -18.8198 -18.8198 -18.8197 -18.8197 -0.2169 -0.2169 -0.1877 -0.1877 1.3732 1.3732 1.4865 1.4865 3.0220 3.0220 3.1206 3.1206 12.9700 12.9700 12.9845 12.9845 18.5736 18.5736 18.5744 18.5744 20.6622 20.6622 20.6701 20.6701 24.3432 24.3432 24.3707 24.3707 26.2706 26.2706 26.3139 26.3139 k = 0.0330 0.0761 0.3969 ( 1174 PWs) bands (ev): -18.8283 -18.8283 -18.8283 -18.8283 -0.2159 -0.2159 -0.1903 -0.1903 1.3794 1.3794 1.4772 1.4772 3.0794 3.0794 3.1647 3.1647 12.9460 12.9460 12.9590 12.9590 18.5663 18.5663 18.5670 18.5670 20.7679 20.7679 20.7745 20.7745 24.3558 24.3558 24.3839 24.3839 26.1497 26.1497 26.1920 26.1920 k = 0.0289 0.0666 0.3969 ( 1174 PWs) bands (ev): -18.8359 -18.8359 -18.8358 -18.8358 -0.2150 -0.2150 -0.1930 -0.1930 1.3849 1.3849 1.4683 1.4683 3.1316 3.1316 3.2045 3.2045 12.9243 12.9243 12.9358 12.9358 18.5550 18.5550 18.5556 18.5556 20.8724 20.8724 20.8779 20.8779 24.3807 24.3807 24.4094 24.4094 26.0157 26.0157 26.0568 26.0568 k = 0.0248 0.0571 0.3969 ( 1174 PWs) bands (ev): -18.8425 -18.8425 -18.8424 -18.8424 -0.2142 -0.2142 -0.1956 -0.1956 1.3901 1.3901 1.4600 1.4600 3.1781 3.1781 3.2394 3.2394 12.9052 12.9052 12.9152 12.9152 18.5416 18.5416 18.5422 18.5422 20.9721 20.9721 20.9765 20.9765 24.4188 24.4188 24.4483 24.4483 25.8707 25.8707 25.9104 25.9104 k = 0.0206 0.0476 0.3969 ( 1172 PWs) bands (ev): -18.8481 -18.8481 -18.8481 -18.8481 -0.2134 -0.2134 -0.1981 -0.1981 1.3950 1.3950 1.4522 1.4522 3.2188 3.2188 3.2691 3.2691 12.8888 12.8888 12.8973 12.8973 18.5279 18.5279 18.5284 18.5284 21.0632 21.0632 21.0666 21.0666 24.4711 24.4711 24.5012 24.5012 25.7180 25.7180 25.7564 25.7564 k = 0.0165 0.0380 0.3969 ( 1176 PWs) bands (ev): -18.8527 -18.8527 -18.8527 -18.8527 -0.2126 -0.2126 -0.2005 -0.2005 1.3998 1.3998 1.4448 1.4448 3.2533 3.2533 3.2930 3.2930 12.8754 12.8754 12.8822 12.8822 18.5151 18.5151 18.5155 18.5155 21.1426 21.1426 21.1451 21.1451 24.5382 24.5382 24.5689 24.5689 25.5614 25.5614 25.5985 25.5985 k = 0.0124 0.0285 0.3969 ( 1176 PWs) bands (ev): -18.8563 -18.8563 -18.8562 -18.8562 -0.2117 -0.2117 -0.2027 -0.2027 1.4046 1.4046 1.4380 1.4380 3.2815 3.2815 3.3109 3.3109 12.8650 12.8650 12.8701 12.8701 18.5042 18.5042 18.5045 18.5045 21.2075 21.2075 21.2092 21.2092 24.6203 24.6203 24.6516 24.6516 25.4050 25.4050 25.4408 25.4408 k = 0.0083 0.0190 0.3969 ( 1176 PWs) bands (ev): -18.8588 -18.8588 -18.8588 -18.8588 -0.2107 -0.2107 -0.2047 -0.2047 1.4095 1.4095 1.4315 1.4315 3.3031 3.3031 3.3226 3.3226 12.8577 12.8577 12.8612 12.8612 18.4960 18.4960 18.4962 18.4962 21.2556 21.2556 21.2567 21.2567 24.7168 24.7168 24.7484 24.7484 25.2529 25.2529 25.2874 25.2874 k = 0.0041 0.0095 0.3969 ( 1176 PWs) bands (ev): -18.8604 -18.8604 -18.8604 -18.8604 -0.2095 -0.2095 -0.2065 -0.2065 1.4145 1.4145 1.4255 1.4255 3.3180 3.3180 3.3277 3.3277 12.8537 12.8537 12.8554 12.8554 18.4908 18.4908 18.4910 18.4910 21.2852 21.2852 21.2858 21.2858 24.8253 24.8253 24.8557 24.8557 25.1117 25.1117 25.1435 25.1435 k = 0.0000 0.0000 0.3969 ( 1176 PWs) bands (ev): -18.8609 -18.8609 -18.8609 -18.8609 -0.2081 -0.2081 -0.2081 -0.2081 1.4199 1.4199 1.4199 1.4199 3.3262 3.3262 3.3262 3.3262 12.8529 12.8529 12.8529 12.8529 18.4892 18.4892 18.4892 18.4892 21.2954 21.2954 21.2954 21.2954 24.9209 24.9209 24.9209 24.9209 25.0355 25.0355 25.0355 25.0355 k = 0.0000 0.0000 0.3969 ( 1176 PWs) bands (ev): -18.8609 -18.8609 -18.8609 -18.8609 -0.2081 -0.2081 -0.2081 -0.2081 1.4199 1.4199 1.4199 1.4199 3.3262 3.3262 3.3262 3.3262 12.8529 12.8529 12.8529 12.8529 18.4892 18.4892 18.4892 18.4892 21.2954 21.2954 21.2954 21.2954 24.9209 24.9209 24.9209 24.9209 25.0355 25.0355 25.0355 25.0355 k = 0.0000 0.0000 0.3864 ( 1176 PWs) bands (ev): -18.8949 -18.8949 -18.8266 -18.8266 -0.2920 -0.2920 -0.1248 -0.1248 1.3771 1.3771 1.4646 1.4646 3.3253 3.3253 3.3273 3.3273 12.8355 12.8355 12.8620 12.8620 18.4764 18.4764 18.5127 18.5127 21.2177 21.2177 21.3767 21.3767 24.8154 24.8154 25.0006 25.0006 25.0343 25.0343 25.0578 25.0578 k = 0.0000 0.0000 0.3760 ( 1176 PWs) bands (ev): -18.9287 -18.9287 -18.7922 -18.7922 -0.3761 -0.3761 -0.0425 -0.0425 1.3363 1.3363 1.5110 1.5110 3.3245 3.3245 3.3285 3.3285 12.8100 12.8100 12.8624 12.8624 18.4741 18.4741 18.5474 18.5474 21.1437 21.1437 21.4615 21.4615 24.7024 24.7024 25.0219 25.0219 25.0424 25.0424 25.1260 25.1260 k = 0.0000 0.0000 0.3655 ( 1172 PWs) bands (ev): -18.9621 -18.9621 -18.7577 -18.7577 -0.4602 -0.4602 0.0384 0.0384 1.2977 1.2977 1.5592 1.5592 3.3238 3.3238 3.3299 3.3299 12.7770 12.7770 12.8540 12.8540 18.4816 18.4816 18.5933 18.5933 21.0735 21.0735 21.5496 21.5496 24.5861 24.5861 25.0301 25.0301 25.0555 25.0555 25.1913 25.1913 k = 0.0000 0.0000 0.3551 ( 1168 PWs) bands (ev): -18.9952 -18.9952 -18.7231 -18.7231 -0.5439 -0.5439 0.1174 0.1174 1.2617 1.2617 1.6091 1.6091 3.3232 3.3232 3.3315 3.3315 12.7370 12.7370 12.8369 12.8369 18.4984 18.4984 18.6503 18.6503 21.0074 21.0074 21.6410 21.6410 24.4688 24.4688 25.0397 25.0397 25.0722 25.0722 25.2321 25.2321 k = 0.0000 0.0000 0.3447 ( 1169 PWs) bands (ev): -19.0278 -19.0278 -18.6886 -18.6886 -0.6271 -0.6271 0.1936 0.1936 1.2286 1.2286 1.6606 1.6606 3.3228 3.3228 3.3333 3.3333 12.6909 12.6909 12.8109 12.8109 18.5237 18.5237 18.7181 18.7181 20.9455 20.9455 21.7354 21.7354 24.3519 24.3519 25.0522 25.0522 25.0923 25.0923 25.2394 25.2394 k = 0.0000 0.0000 0.3342 ( 1169 PWs) bands (ev): -19.0600 -19.0600 -18.6541 -18.6541 -0.7096 -0.7096 0.2664 0.2664 1.1990 1.1990 1.7138 1.7138 3.3224 3.3224 3.3353 3.3353 12.6391 12.6391 12.7766 12.7766 18.5565 18.5565 18.7961 18.7961 20.8879 20.8879 21.8328 21.8328 24.2367 24.2367 25.0671 25.0671 25.1152 25.1152 25.2094 25.2094 k = 0.0000 0.0000 0.3238 ( 1173 PWs) bands (ev): -19.0916 -19.0916 -18.6198 -18.6198 -0.7912 -0.7912 0.3347 0.3347 1.1737 1.1737 1.7686 1.7686 3.3221 3.3221 3.3375 3.3375 12.5826 12.5826 12.7343 12.7343 18.5960 18.5960 18.8841 18.8841 20.8348 20.8348 21.9329 21.9329 24.1241 24.1241 25.0772 25.0772 25.1305 25.1305 25.1606 25.1606 k = 0.0000 0.0000 0.3133 ( 1173 PWs) bands (ev): -19.1227 -19.1227 -18.5856 -18.5856 -0.8716 -0.8716 0.3972 0.3972 1.1536 1.1536 1.8252 1.8252 3.3219 3.3219 3.3400 3.3400 12.5220 12.5220 12.6845 12.6845 18.6414 18.6414 18.9812 18.9812 20.7865 20.7865 22.0358 22.0358 24.0151 24.0151 25.0164 25.0164 25.1249 25.1249 25.1788 25.1788 k = 0.0000 0.0000 0.3029 ( 1173 PWs) bands (ev): -19.1532 -19.1532 -18.5518 -18.5518 -0.9508 -0.9508 0.4525 0.4525 1.1400 1.1400 1.8835 1.8835 3.3217 3.3217 3.3428 3.3428 12.4580 12.4580 12.6277 12.6277 18.6915 18.6915 19.0867 19.0867 20.7432 20.7432 22.1413 22.1413 23.9103 23.9103 24.8950 24.8950 25.1484 25.1484 25.2123 25.2123 k = 0.0000 0.0000 0.2924 ( 1175 PWs) bands (ev): -19.1830 -19.1830 -18.5182 -18.5182 -1.0286 -1.0286 0.4991 0.4991 1.1341 1.1341 1.9434 1.9434 3.3216 3.3216 3.3459 3.3459 12.3914 12.3914 12.5645 12.5645 18.7455 18.7455 19.1995 19.1995 20.7051 20.7051 22.2492 22.2492 23.8107 23.8107 24.7538 24.7538 25.1786 25.1786 25.2500 25.2500 k = 0.0000 0.0000 0.2820 ( 1175 PWs) bands (ev): -19.2122 -19.2122 -18.4851 -18.4851 -1.1048 -1.1048 0.5354 0.5354 1.1372 1.1372 2.0051 2.0051 3.3215 3.3215 3.3493 3.3493 12.3229 12.3229 12.4957 12.4957 18.8024 18.8024 19.3187 19.3187 20.6725 20.6725 22.3594 22.3594 23.7168 23.7168 24.6021 24.6021 25.2132 25.2132 25.2912 25.2912 k = 0.0000 0.0000 0.2716 ( 1171 PWs) bands (ev): -19.2406 -19.2406 -18.4524 -18.4524 -1.1793 -1.1793 0.5609 0.5609 1.1496 1.1496 2.0685 2.0685 3.3215 3.3215 3.3530 3.3530 12.2529 12.2529 12.4217 12.4217 18.8611 18.8611 19.4430 19.4430 20.6457 20.6457 22.4717 22.4717 23.6297 23.6297 24.4445 24.4445 25.2517 25.2517 25.3359 25.3359 k = 0.0000 0.0000 0.2611 ( 1173 PWs) bands (ev): -19.2682 -19.2682 -18.4202 -18.4202 -1.2521 -1.2521 0.5758 0.5758 1.1710 1.1710 2.1334 2.1334 3.3215 3.3215 3.3571 3.3571 12.1821 12.1821 12.3433 12.3433 18.9207 18.9207 19.5713 19.5713 20.6248 20.6248 22.5859 22.5859 23.5500 23.5500 24.2843 24.2843 25.2939 25.2939 25.3838 25.3838 k = 0.0000 0.0000 0.2507 ( 1173 PWs) bands (ev): -19.2951 -19.2951 -18.3886 -18.3886 -1.3229 -1.3229 0.5813 0.5813 1.2000 1.2000 2.1997 2.1997 3.3215 3.3215 3.3617 3.3617 12.1111 12.1111 12.2612 12.2612 18.9804 18.9804 19.7020 19.7020 20.6103 20.6103 22.7017 22.7017 23.4788 23.4788 24.1235 24.1235 25.3397 25.3397 25.4349 25.4349 k = 0.0000 0.0000 0.2402 ( 1173 PWs) bands (ev): -19.3211 -19.3211 -18.3577 -18.3577 -1.3917 -1.3917 0.5793 0.5793 1.2344 1.2344 2.2672 2.2672 3.3215 3.3215 3.3667 3.3667 12.0404 12.0404 12.1759 12.1759 19.0393 19.0393 19.8338 19.8338 20.6022 20.6022 22.8190 22.8190 23.4170 23.4170 23.9639 23.9639 25.3890 25.3890 25.4891 25.4891 k = 0.0000 0.0000 0.2298 ( 1169 PWs) bands (ev): -19.3462 -19.3462 -18.3275 -18.3275 -1.4582 -1.4582 0.5718 0.5718 1.2725 1.2725 2.3357 2.3357 3.3216 3.3216 3.3722 3.3722 11.9703 11.9703 12.0882 12.0882 19.0966 19.0966 19.9649 19.9649 20.6008 20.6008 22.9374 22.9374 23.3660 23.3660 23.8065 23.8065 25.4418 25.4418 25.5462 25.5462 k = 0.0000 0.0000 0.2193 ( 1169 PWs) bands (ev): -19.3704 -19.3704 -18.2981 -18.2981 -1.5226 -1.5226 0.5603 0.5603 1.3124 1.3124 2.4049 2.4049 3.3217 3.3217 3.3783 3.3783 11.9012 11.9012 11.9987 11.9987 19.1515 19.1515 20.0936 20.0936 20.6060 20.6060 23.0561 23.0561 23.3271 23.3271 23.6524 23.6524 25.4979 25.4979 25.6061 25.6061 k = 0.0000 0.0000 0.2089 ( 1173 PWs) bands (ev): -19.3937 -19.3937 -18.2695 -18.2695 -1.5847 -1.5847 0.5461 0.5461 1.3530 1.3530 2.4744 2.4744 3.3218 3.3218 3.3851 3.3851 11.8335 11.8335 11.9079 11.9079 19.2035 19.2035 20.2179 20.2179 20.6179 20.6179 23.1731 23.1731 23.3032 23.3032 23.5029 23.5029 25.5574 25.5574 25.6687 25.6687 k = 0.0000 0.0000 0.1984 ( 1173 PWs) bands (ev): -19.4160 -19.4160 -18.2418 -18.2418 -1.6444 -1.6444 0.5302 0.5302 1.3932 1.3932 2.5437 2.5437 3.3219 3.3219 3.3926 3.3926 11.7676 11.7676 11.8165 11.8165 19.2523 19.2523 20.3359 20.3359 20.6360 20.6360 23.2645 23.2645 23.3091 23.3091 23.3685 23.3685 25.6200 25.6200 25.7339 25.7339 k = 0.0000 0.0000 0.1880 ( 1169 PWs) bands (ev): -19.4374 -19.4374 -18.2151 -18.2151 -1.7015 -1.7015 0.5135 0.5135 1.4323 1.4323 2.6124 2.6124 3.3220 3.3220 3.4010 3.4010 11.7037 11.7037 11.7251 11.7251 19.2975 19.2975 20.4457 20.4457 20.6601 20.6601 23.2090 23.2090 23.2855 23.2855 23.4316 23.4316 25.6857 25.6857 25.8013 25.8013 k = 0.0000 0.0000 0.1776 ( 1165 PWs) bands (ev): -19.4577 -19.4577 -18.1895 -18.1895 -1.7560 -1.7560 0.4963 0.4963 1.4699 1.4699 2.6799 2.6799 3.3221 3.3221 3.4104 3.4104 11.6341 11.6341 11.6424 11.6424 19.3394 19.3394 20.5451 20.5451 20.6897 20.6897 23.0754 23.0754 23.3079 23.3079 23.5487 23.5487 25.7544 25.7544 25.8709 25.8709 k = 0.0000 0.0000 0.1671 ( 1165 PWs) bands (ev): -19.4770 -19.4770 -18.1650 -18.1650 -1.8079 -1.8079 0.4791 0.4791 1.5058 1.5058 2.7457 2.7457 3.3222 3.3222 3.4210 3.4210 11.5445 11.5445 11.5832 11.5832 19.3780 19.3780 20.6322 20.6322 20.7244 20.7244 22.9464 22.9464 23.3467 23.3467 23.6677 23.6677 25.8259 25.8259 25.9424 25.9424 k = 0.0000 0.0000 0.1567 ( 1165 PWs) bands (ev): -19.4952 -19.4952 -18.1416 -18.1416 -1.8570 -1.8570 0.4622 0.4622 1.5396 1.5396 2.8089 2.8089 3.3222 3.3222 3.4330 3.4330 11.4565 11.4565 11.5269 11.5269 19.4135 19.4135 20.7049 20.7049 20.7645 20.7645 22.8237 22.8237 23.4029 23.4029 23.7861 23.7861 25.9000 25.9000 26.0155 26.0155 k = 0.0000 0.0000 0.1462 ( 1165 PWs) bands (ev): -19.5124 -19.5124 -18.1194 -18.1194 -1.9033 -1.9033 0.4458 0.4458 1.5713 1.5713 2.8690 2.8690 3.3223 3.3223 3.4466 3.4466 11.3707 11.3707 11.4736 11.4736 19.4462 19.4462 20.7619 20.7619 20.8096 20.8096 22.7082 22.7082 23.4762 23.4762 23.9029 23.9029 25.9764 25.9764 26.0898 26.0898 k = 0.0000 0.0000 0.1358 ( 1163 PWs) bands (ev): -19.5285 -19.5285 -18.0985 -18.0985 -1.9468 -1.9468 0.4300 0.4300 1.6007 1.6007 2.9252 2.9252 3.3224 3.3224 3.4620 3.4620 11.2878 11.2878 11.4233 11.4233 19.4765 19.4765 20.8068 20.8068 20.8553 20.8553 22.6004 22.6004 23.5655 23.5655 24.0175 24.0175 26.0550 26.0550 26.1650 26.1650 k = 0.0000 0.0000 0.1253 ( 1161 PWs) bands (ev): -19.5434 -19.5434 -18.0790 -18.0790 -1.9872 -1.9872 0.4151 0.4151 1.6279 1.6279 2.9768 2.9768 3.3224 3.3224 3.4794 3.4794 11.2083 11.2083 11.3762 11.3762 19.5049 19.5049 20.8445 20.8445 20.8961 20.8961 22.5012 22.5012 23.6688 23.6688 24.1291 24.1291 26.1353 26.1353 26.2405 26.2405 k = 0.0000 0.0000 0.1149 ( 1161 PWs) bands (ev): -19.5572 -19.5572 -18.0608 -18.0608 -2.0247 -2.0247 0.4011 0.4011 1.6529 1.6529 3.0234 3.0234 3.3224 3.3224 3.4988 3.4988 11.1326 11.1326 11.3325 11.3325 19.5314 19.5314 20.8766 20.8766 20.9302 20.9302 22.4110 22.4110 23.7839 23.7839 24.2369 24.2369 26.2170 26.2170 26.3159 26.3159 k = 0.0000 0.0000 0.1044 ( 1153 PWs) bands (ev): -19.5699 -19.5699 -18.0440 -18.0440 -2.0590 -2.0590 0.3881 0.3881 1.6756 1.6756 3.0645 3.0645 3.3224 3.3224 3.5200 3.5200 11.0614 11.0614 11.2923 11.2923 19.5564 19.5564 20.9030 20.9030 20.9584 20.9584 22.3305 22.3305 23.9081 23.9081 24.3402 24.3402 26.2996 26.2996 26.3905 26.3905 k = 0.0000 0.0000 0.0940 ( 1153 PWs) bands (ev): -19.5814 -19.5814 -18.0286 -18.0286 -2.0903 -2.0903 0.3762 0.3762 1.6960 1.6960 3.1000 3.1000 3.3224 3.3224 3.5429 3.5429 10.9951 10.9951 11.2557 11.2557 19.5798 19.5798 20.9231 20.9231 20.9811 20.9811 22.2603 22.2603 24.0381 24.0381 24.4382 24.4382 26.3823 26.3823 26.4635 26.4635 k = 0.0000 0.0000 0.0836 ( 1153 PWs) bands (ev): -19.5917 -19.5917 -18.0148 -18.0148 -2.1184 -2.1184 0.3654 0.3654 1.7143 1.7143 3.1299 3.1299 3.3224 3.3224 3.5666 3.5666 10.9342 10.9342 11.2227 11.2227 19.6018 19.6018 20.9374 20.9374 20.9989 20.9989 22.2007 22.2007 24.1708 24.1708 24.5301 24.5301 26.4643 26.4643 26.5340 26.5340 k = 0.0000 0.0000 0.0731 ( 1157 PWs) bands (ev): -19.6008 -19.6008 -18.0025 -18.0025 -2.1433 -2.1433 0.3558 0.3558 1.7303 1.7303 3.1548 3.1548 3.3223 3.3223 3.5904 3.5904 10.8792 10.8792 11.1934 11.1934 19.6223 19.6223 20.9466 20.9466 21.0118 21.0118 22.1515 22.1515 24.3024 24.3024 24.6151 24.6151 26.5445 26.5445 26.6010 26.6010 k = 0.0000 0.0000 0.0627 ( 1155 PWs) bands (ev): -19.6087 -19.6087 -17.9918 -17.9918 -2.1650 -2.1650 0.3474 0.3474 1.7441 1.7441 3.1750 3.1750 3.3222 3.3222 3.6134 3.6134 10.8306 10.8306 11.1679 11.1679 19.6410 19.6410 20.9521 20.9521 21.0201 21.0201 22.1124 22.1124 24.4288 24.4288 24.6927 24.6927 26.6215 26.6215 26.6633 26.6633 k = 0.0000 0.0000 0.0522 ( 1159 PWs) bands (ev): -19.6155 -19.6155 -17.9827 -17.9827 -2.1834 -2.1834 0.3402 0.3402 1.7558 1.7558 3.1910 3.1910 3.3221 3.3221 3.6347 3.6347 10.7885 10.7885 11.1462 11.1462 19.6577 19.6577 20.9547 20.9547 21.0244 21.0244 22.0824 22.0824 24.5453 24.5453 24.7627 24.7627 26.6936 26.6936 26.7197 26.7197 k = 0.0000 0.0000 0.0418 ( 1159 PWs) bands (ev): -19.6210 -19.6210 -17.9752 -17.9752 -2.1985 -2.1985 0.3343 0.3343 1.7653 1.7653 3.2035 3.2035 3.3220 3.3220 3.6533 3.6533 10.7537 10.7537 11.1285 11.1285 19.6721 19.6721 20.9556 20.9556 21.0256 21.0256 22.0605 22.0605 24.6468 24.6468 24.8249 24.8249 26.7583 26.7583 26.7686 26.7686 k = 0.0000 0.0000 0.0313 ( 1159 PWs) bands (ev): -19.6253 -19.6253 -17.9694 -17.9694 -2.2102 -2.2102 0.3297 0.3297 1.7726 1.7726 3.2127 3.2127 3.3219 3.3219 3.6686 3.6686 10.7263 10.7263 11.1146 11.1146 19.6838 19.6838 20.9553 20.9553 21.0249 21.0249 22.0452 22.0452 24.7276 24.7276 24.8794 24.8794 26.8079 26.8079 26.8141 26.8141 k = 0.0000 0.0000 0.0209 ( 1163 PWs) bands (ev): -19.6284 -19.6284 -17.9652 -17.9652 -2.2186 -2.2186 0.3265 0.3265 1.7779 1.7779 3.2191 3.2191 3.3218 3.3218 3.6799 3.6799 10.7066 10.7066 11.1047 11.1047 19.6924 19.6924 20.9545 20.9545 21.0233 21.0233 22.0354 22.0354 24.7845 24.7845 24.9241 24.9241 26.8379 26.8379 26.8560 26.8560 k = 0.0000 0.0000 0.0104 ( 1161 PWs) bands (ev): -19.6302 -19.6302 -17.9627 -17.9627 -2.2237 -2.2237 0.3245 0.3245 1.7811 1.7811 3.2228 3.2228 3.3218 3.3218 3.6869 3.6869 10.6947 10.6947 11.0987 11.0987 19.6977 19.6977 20.9539 20.9539 21.0220 21.0220 22.0300 22.0300 24.8173 24.8173 24.9544 24.9544 26.8563 26.8563 26.8828 26.8828 k = 0.0000 0.0000 0.0000 ( 1165 PWs) bands (ev): -19.6308 -19.6308 -17.9618 -17.9618 -2.2254 -2.2254 0.3238 0.3238 1.7821 1.7821 3.2240 3.2240 3.3217 3.3217 3.6893 3.6893 10.6907 10.6907 11.0967 11.0967 19.6995 19.6995 20.9536 20.9536 21.0215 21.0215 22.0282 22.0282 24.8279 24.8279 24.9651 24.9651 26.8624 26.8624 26.8919 26.8919 k = 0.0000 0.0000 0.0000 ( 1165 PWs) bands (ev): -19.6308 -19.6308 -17.9618 -17.9618 -2.2254 -2.2254 0.3238 0.3238 1.7821 1.7821 3.2240 3.2240 3.3217 3.3217 3.6893 3.6893 10.6907 10.6907 11.0967 11.0967 19.6995 19.6995 20.9536 20.9536 21.0215 21.0215 22.0282 22.0282 24.8279 24.8279 24.9651 24.9651 26.8624 26.8624 26.8919 26.8919 k =-0.0094 0.0041 0.0000 ( 1161 PWs) bands (ev): -19.6303 -19.6303 -17.9620 -17.9620 -2.2245 -2.2245 0.3216 0.3216 1.7797 1.7797 3.2205 3.2205 3.3226 3.3226 3.6887 3.6887 10.6954 10.6954 11.1024 11.1024 19.6807 19.6807 20.9676 20.9676 21.0284 21.0284 22.0172 22.0172 24.8246 24.8246 24.9800 24.9800 26.8495 26.8495 26.9095 26.9095 k =-0.0189 0.0082 0.0000 ( 1161 PWs) bands (ev): -19.6289 -19.6289 -17.9624 -17.9624 -2.2220 -2.2220 0.3149 0.3149 1.7727 1.7727 3.2106 3.2106 3.3247 3.3247 3.6869 3.6869 10.7095 10.7095 11.1194 11.1194 19.6277 19.6277 20.9883 20.9883 21.0668 21.0668 21.9850 21.9850 24.8148 24.8148 25.0236 25.0236 26.8319 26.8319 26.9405 26.9405 k =-0.0283 0.0123 0.0000 ( 1163 PWs) bands (ev): -19.6264 -19.6264 -17.9631 -17.9631 -2.2179 -2.2179 0.3038 0.3038 1.7609 1.7609 3.1952 3.1952 3.3271 3.3271 3.6840 3.6840 10.7328 10.7328 11.1475 11.1475 19.5485 19.5485 20.9944 20.9944 21.1500 21.1500 21.9333 21.9333 24.7989 24.7989 25.0942 25.0942 26.8177 26.8177 26.9771 26.9771 k =-0.0377 0.0164 0.0000 ( 1165 PWs) bands (ev): -19.6230 -19.6230 -17.9641 -17.9641 -2.2121 -2.2121 0.2883 0.2883 1.7444 1.7444 3.1753 3.1753 3.3288 3.3288 3.6801 3.6801 10.7653 10.7653 11.1867 11.1867 19.4513 19.4513 20.9942 20.9942 21.2608 21.2608 21.8652 21.8652 24.7776 24.7776 25.1888 25.1888 26.8076 26.8076 27.0185 27.0185 k =-0.0472 0.0205 0.0000 ( 1167 PWs) bands (ev): -19.6187 -19.6187 -17.9654 -17.9654 -2.2046 -2.2046 0.2688 0.2688 1.7232 1.7232 3.1517 3.1517 3.3293 3.3293 3.6755 3.6755 10.8067 10.8067 11.2367 11.2367 19.3428 19.3428 20.9914 20.9914 21.3886 21.3886 21.7839 21.7839 24.7515 24.7515 25.3047 25.3047 26.8018 26.8018 27.0645 27.0645 k =-0.0566 0.0246 0.0000 ( 1163 PWs) bands (ev): -19.6133 -19.6133 -17.9669 -17.9669 -2.1955 -2.1955 0.2452 0.2452 1.6974 1.6974 3.1249 3.1249 3.3281 3.3281 3.6703 3.6703 10.8569 10.8569 11.2972 11.2972 19.2275 19.2275 20.9865 20.9865 21.5276 21.5276 21.6928 21.6928 24.7217 24.7217 25.4387 25.4387 26.8005 26.8005 27.1151 27.1151 k =-0.0660 0.0286 0.0000 ( 1163 PWs) bands (ev): -19.6070 -19.6070 -17.9688 -17.9688 -2.1848 -2.1848 0.2178 0.2178 1.6668 1.6668 3.0952 3.0952 3.3250 3.3250 3.6647 3.6647 10.9154 10.9154 11.3678 11.3678 19.1086 19.1086 20.9788 20.9788 21.5954 21.5954 21.6738 21.6738 24.6894 24.6894 25.5880 25.5880 26.8035 26.8035 27.1700 27.1700 k =-0.0755 0.0327 0.0000 ( 1157 PWs) bands (ev): -19.5998 -19.5998 -17.9710 -17.9710 -2.1724 -2.1724 0.1869 0.1869 1.6316 1.6316 3.0631 3.0631 3.3198 3.3198 3.6590 3.6590 10.9820 10.9820 11.4483 11.4483 18.9881 18.9881 20.9674 20.9674 21.4954 21.4954 21.8244 21.8244 24.6560 24.6560 25.7502 25.7502 26.8109 26.8109 27.2295 27.2295 k =-0.0849 0.0368 0.0000 ( 1157 PWs) bands (ev): -19.5917 -19.5917 -17.9735 -17.9735 -2.1585 -2.1585 0.1526 0.1526 1.5917 1.5917 3.0289 3.0289 3.3124 3.3124 3.6535 3.6535 11.0562 11.0562 11.5381 11.5381 18.8673 18.8673 20.9495 20.9495 21.3970 21.3970 21.9771 21.9771 24.6230 24.6230 25.9233 25.9233 26.8227 26.8227 27.2932 27.2932 k =-0.0943 0.0409 0.0000 ( 1149 PWs) bands (ev): -19.5826 -19.5826 -17.9763 -17.9763 -2.1431 -2.1431 0.1153 0.1153 1.5474 1.5474 2.9927 2.9927 3.3028 3.3028 3.6482 3.6482 11.1378 11.1378 11.6369 11.6369 18.7473 18.7473 20.9213 20.9213 21.3060 21.3060 22.1296 22.1296 24.5924 24.5924 26.1056 26.1056 26.8388 26.8388 27.3615 27.3615 k =-0.1038 0.0450 0.0000 ( 1149 PWs) bands (ev): -19.5726 -19.5726 -17.9794 -17.9794 -2.1261 -2.1261 0.0752 0.0752 1.4987 1.4987 2.9549 2.9549 3.2909 3.2909 3.6435 3.6435 11.2264 11.2264 11.7440 11.7440 18.6287 18.6287 20.8767 20.8767 21.2295 21.2295 22.2794 22.2794 24.5665 24.5665 26.2956 26.2956 26.8592 26.8592 27.4339 27.4339 k =-0.1132 0.0491 0.0000 ( 1147 PWs) bands (ev): -19.5617 -19.5617 -17.9829 -17.9829 -2.1076 -2.1076 0.0328 0.0328 1.4457 1.4457 2.9157 2.9157 3.2768 3.2768 3.6393 3.6393 11.3213 11.3213 11.8591 11.8591 18.5122 18.5122 20.8115 20.8115 21.1731 21.1731 22.4240 22.4240 24.5482 24.5482 26.4922 26.4922 26.8838 26.8838 27.5107 27.5107 k =-0.1226 0.0532 0.0000 ( 1147 PWs) bands (ev): -19.5499 -19.5499 -17.9867 -17.9867 -2.0876 -2.0876 -0.0118 -0.0118 1.3886 1.3886 2.8753 2.8753 3.2605 3.2605 3.6358 3.6358 11.4223 11.4223 11.9816 11.9816 18.3981 18.3981 20.7271 20.7271 21.1358 21.1358 22.5602 22.5602 24.5406 24.5406 26.6942 26.6942 26.9128 26.9128 27.5916 27.5916 k =-0.1321 0.0573 0.0000 ( 1143 PWs) bands (ev): -19.5373 -19.5373 -17.9909 -17.9909 -2.0662 -2.0662 -0.0582 -0.0582 1.3277 1.3277 2.8339 2.8339 3.2422 3.2422 3.6330 3.6330 11.5289 11.5289 12.1111 12.1111 18.2868 18.2868 20.6296 20.6296 21.1123 21.1123 22.6845 22.6845 24.5475 24.5475 26.9000 26.9000 26.9466 26.9466 27.6012 27.6012 k =-0.1415 0.0614 0.0000 ( 1143 PWs) bands (ev): -19.5238 -19.5238 -17.9954 -17.9954 -2.0435 -2.0435 -0.1060 -0.1060 1.2631 1.2631 2.7915 2.7915 3.2221 3.2221 3.6310 3.6310 11.6405 11.6405 12.2470 12.2470 18.1786 18.1786 20.5250 20.5250 21.0973 21.0973 22.7929 22.7929 24.5729 24.5729 26.9822 26.9822 27.1117 27.1117 27.5201 27.5201 k =-0.1509 0.0655 0.0000 ( 1142 PWs) bands (ev): -19.5095 -19.5095 -18.0004 -18.0004 -2.0194 -2.0194 -0.1549 -0.1549 1.1952 1.1952 2.7482 2.7482 3.2003 3.2003 3.6296 3.6296 11.7566 11.7566 12.3888 12.3888 18.0737 18.0737 20.4169 20.4169 21.0874 21.0874 22.8821 22.8821 24.6205 24.6205 27.0234 27.0234 27.3241 27.3241 27.4408 27.4408 k =-0.1604 0.0696 0.0000 ( 1142 PWs) bands (ev): -19.4944 -19.4944 -18.0057 -18.0057 -1.9941 -1.9941 -0.2046 -0.2046 1.1242 1.1242 2.7042 2.7042 3.1771 3.1771 3.6288 3.6288 11.8769 11.8769 12.5360 12.5360 17.9723 17.9723 20.3078 20.3078 21.0807 21.0807 22.9498 22.9498 24.6928 24.6928 27.0682 27.0682 27.3613 27.3613 27.5405 27.5405 k =-0.1698 0.0737 0.0000 ( 1146 PWs) bands (ev): -19.4786 -19.4786 -18.0114 -18.0114 -1.9677 -1.9677 -0.2547 -0.2547 1.0504 1.0504 2.6593 2.6593 3.1526 3.1526 3.6286 3.6286 12.0007 12.0007 12.6882 12.6882 17.8747 17.8747 20.1990 20.1990 21.0760 21.0760 22.9955 22.9955 24.7902 24.7902 27.1161 27.1161 27.2858 27.2858 27.7557 27.7557 k =-0.1792 0.0778 0.0000 ( 1146 PWs) bands (ev): -19.4619 -19.4619 -18.0176 -18.0176 -1.9402 -1.9402 -0.3048 -0.3048 0.9743 0.9743 2.6136 2.6136 3.1272 3.1272 3.6288 3.6288 12.1276 12.1276 12.8449 12.8449 17.7810 17.7810 20.0914 20.0914 21.0728 21.0728 23.0208 23.0208 24.9114 24.9114 27.1613 27.1613 27.2183 27.2183 27.8858 27.8858 k =-0.1887 0.0819 0.0000 ( 1150 PWs) bands (ev): -19.4445 -19.4445 -18.0242 -18.0242 -1.9117 -1.9117 -0.3546 -0.3546 0.8960 0.8960 2.5671 2.5671 3.1010 3.1010 3.6295 3.6295 12.2571 12.2571 13.0055 13.0055 17.6915 17.6915 19.9855 19.9855 21.0706 21.0706 23.0285 23.0285 25.0536 25.0536 27.1290 27.1290 27.2338 27.2338 27.9230 27.9230 k =-0.1981 0.0859 0.0000 ( 1150 PWs) bands (ev): -19.4264 -19.4264 -18.0312 -18.0312 -1.8824 -1.8824 -0.4037 -0.4037 0.8159 0.8159 2.5196 2.5196 3.0743 3.0743 3.6305 3.6305 12.3884 12.3884 13.1696 13.1696 17.6064 17.6064 19.8819 19.8819 21.0692 21.0692 23.0220 23.0220 25.2136 25.2136 27.0601 27.0601 27.2913 27.2913 27.9614 27.9614 k =-0.2075 0.0900 0.0000 ( 1154 PWs) bands (ev): -19.4076 -19.4076 -18.0386 -18.0386 -1.8524 -1.8524 -0.4518 -0.4518 0.7344 0.7344 2.4711 2.4711 3.0473 3.0473 3.6318 3.6318 12.5211 12.5211 13.3368 13.3368 17.5259 17.5259 19.7806 19.7806 21.0685 21.0685 23.0045 23.0045 25.3882 25.3882 26.9910 26.9910 27.3542 27.3542 28.0018 28.0018 k =-0.2170 0.0941 0.0000 ( 1158 PWs) bands (ev): -19.3882 -19.3882 -18.0466 -18.0466 -1.8220 -1.8220 -0.4984 -0.4984 0.6518 0.6518 2.4217 2.4217 3.0202 3.0202 3.6334 3.6334 12.6545 12.6545 13.5065 13.5065 17.4502 17.4502 19.6821 19.6821 21.0682 21.0682 22.9788 22.9788 25.5744 25.5744 26.9235 26.9235 27.4210 27.4210 28.0442 28.0442 k =-0.2264 0.0982 0.0000 ( 1158 PWs) bands (ev): -19.3681 -19.3681 -18.0550 -18.0550 -1.7912 -1.7912 -0.5431 -0.5431 0.5684 0.5684 2.3711 2.3711 2.9931 2.9931 3.6351 3.6351 12.7881 12.7881 13.6784 13.6784 17.3797 17.3797 19.5865 19.5865 21.0684 21.0684 22.9474 22.9474 25.7700 25.7700 26.8577 26.8577 27.4912 27.4912 28.0884 28.0884 k =-0.2358 0.1023 0.0000 ( 1158 PWs) bands (ev): -19.3475 -19.3475 -18.0639 -18.0639 -1.7603 -1.7603 -0.5855 -0.5855 0.4844 0.4844 2.3193 2.3193 2.9663 2.9663 3.6370 3.6370 12.9212 12.9212 13.8518 13.8518 17.3145 17.3145 19.4939 19.4939 21.0690 21.0690 22.9119 22.9119 25.9731 25.9731 26.7939 26.7939 27.5646 27.5646 28.1342 28.1342 k =-0.2453 0.1064 0.0000 ( 1158 PWs) bands (ev): -19.3263 -19.3263 -18.0732 -18.0732 -1.7298 -1.7298 -0.6252 -0.6252 0.4002 0.4002 2.2664 2.2664 2.9399 2.9399 3.6390 3.6390 13.0530 13.0530 14.0265 14.0265 17.2550 17.2550 19.4043 19.4043 21.0699 21.0699 22.8738 22.8738 26.1822 26.1822 26.7322 26.7322 27.6409 27.6409 28.1815 28.1815 k =-0.2547 0.1105 0.0000 ( 1160 PWs) bands (ev): -19.3046 -19.3046 -18.0831 -18.0831 -1.6998 -1.6998 -0.6615 -0.6615 0.3160 0.3160 2.2123 2.2123 2.9140 2.9140 3.6410 3.6410 13.1830 13.1830 14.2018 14.2018 17.2014 17.2014 19.3180 19.3180 21.0711 21.0711 22.8341 22.8341 26.3959 26.3959 26.6727 26.6727 27.7200 27.7200 28.2301 28.2301 k =-0.2642 0.1146 0.0000 ( 1164 PWs) bands (ev): -19.2824 -19.2824 -18.0934 -18.0934 -1.6709 -1.6709 -0.6941 -0.6941 0.2321 0.2321 2.1569 2.1569 2.8888 2.8888 3.6431 3.6431 13.3103 13.3103 14.3773 14.3773 17.1541 17.1541 19.2347 19.2347 21.0725 21.0725 22.7937 22.7937 26.6011 26.6011 26.6276 26.6276 27.8017 27.8017 28.2796 28.2796 k =-0.2736 0.1187 0.0000 ( 1160 PWs) bands (ev): -19.2597 -19.2597 -18.1043 -18.1043 -1.6434 -1.6434 -0.7222 -0.7222 0.1488 0.1488 2.1005 2.1005 2.8643 2.8643 3.6452 3.6452 13.4342 13.4342 14.5525 14.5525 17.1134 17.1134 19.1548 19.1548 21.0742 21.0742 22.7532 22.7532 26.5581 26.5581 26.8360 26.8360 27.8856 27.8856 28.3299 28.3299 k =-0.2830 0.1228 0.0000 ( 1160 PWs) bands (ev): -19.2367 -19.2367 -18.1157 -18.1157 -1.6178 -1.6178 -0.7454 -0.7454 0.0662 0.0662 2.0428 2.0428 2.8406 2.8406 3.6473 3.6473 13.5540 13.5540 14.7269 14.7269 17.0797 17.0797 19.0782 19.0782 21.0761 21.0761 22.7132 22.7132 26.5049 26.5049 27.0587 27.0587 27.9717 27.9717 28.3807 28.3807 k =-0.2925 0.1269 0.0000 ( 1160 PWs) bands (ev): -19.2133 -19.2133 -18.1275 -18.1275 -1.5947 -1.5947 -0.7630 -0.7630 -0.0153 -0.0153 1.9841 1.9841 2.8179 2.8179 3.6493 3.6493 13.6689 13.6689 14.8998 14.8998 17.0533 17.0533 19.0050 19.0050 21.0782 21.0782 22.6742 22.6742 26.4536 26.4536 27.2830 27.2830 28.0596 28.0596 28.4316 28.4316 k =-0.3019 0.1310 0.0000 ( 1162 PWs) bands (ev): -19.1895 -19.1895 -18.1399 -18.1399 -1.5744 -1.5744 -0.7746 -0.7746 -0.0957 -0.0957 1.9244 1.9244 2.7960 2.7960 3.6513 3.6513 13.7781 13.7781 15.0709 15.0709 17.0344 17.0344 18.9352 18.9352 21.0805 21.0805 22.6363 22.6363 26.4045 26.4045 27.5081 27.5081 28.1491 28.1491 28.4823 28.4823 k =-0.3113 0.1351 0.0000 ( 1162 PWs) bands (ev): -19.1655 -19.1655 -18.1527 -18.1527 -1.5574 -1.5574 -0.7797 -0.7797 -0.1745 -0.1745 1.8639 1.8639 2.7751 2.7751 3.6533 3.6533 13.8810 13.8810 15.2394 15.2394 17.0234 17.0234 18.8687 18.8687 21.0828 21.0828 22.6000 22.6000 26.3575 26.3575 27.7333 27.7333 28.2399 28.2399 28.5324 28.5324 k =-0.3208 0.1391 0.0000 ( 1158 PWs) bands (ev): -19.1414 -19.1414 -18.1660 -18.1660 -1.5438 -1.5438 -0.7782 -0.7782 -0.2517 -0.2517 1.8025 1.8025 2.7552 2.7552 3.6552 3.6552 13.9771 13.9771 15.4049 15.4049 17.0203 17.0203 18.8056 18.8056 21.0854 21.0854 22.5654 22.5654 26.3127 26.3127 27.9577 27.9577 28.3317 28.3317 28.5816 28.5816 k =-0.3302 0.1432 0.0000 ( 1156 PWs) bands (ev): -19.1170 -19.1170 -18.1797 -18.1797 -1.5335 -1.5335 -0.7703 -0.7703 -0.3269 -0.3269 1.7405 1.7405 2.7363 2.7363 3.6570 3.6570 14.0657 14.0657 15.5666 15.5666 17.0251 17.0251 18.7459 18.7459 21.0879 21.0879 22.5327 22.5327 26.2702 26.2702 28.1804 28.1804 28.4243 28.4243 28.6293 28.6293 k =-0.3396 0.1473 0.0000 ( 1164 PWs) bands (ev): -19.0926 -19.0926 -18.1939 -18.1939 -1.5264 -1.5264 -0.7563 -0.7563 -0.3999 -0.3999 1.6780 1.6780 2.7184 2.7184 3.6587 3.6587 14.1466 14.1466 15.7239 15.7239 17.0377 17.0377 18.6894 18.6894 21.0906 21.0906 22.5019 22.5019 26.2298 26.2298 28.3993 28.3993 28.5186 28.5186 28.6751 28.6751 k =-0.3491 0.1514 0.0000 ( 1172 PWs) bands (ev): -19.0681 -19.0681 -18.2085 -18.2085 -1.5219 -1.5219 -0.7373 -0.7373 -0.4701 -0.4701 1.6151 1.6151 2.7015 2.7015 3.6604 3.6604 14.2195 14.2195 15.8762 15.8762 17.0579 17.0579 18.6365 18.6365 21.0932 21.0932 22.4733 22.4733 26.1917 26.1917 28.5885 28.5885 28.6387 28.6387 28.7186 28.7186 k =-0.3585 0.1555 0.0000 ( 1174 PWs) bands (ev): -19.0437 -19.0437 -18.2234 -18.2234 -1.5194 -1.5194 -0.7152 -0.7152 -0.5358 -0.5358 1.5522 1.5522 2.6857 2.6857 3.6619 3.6619 14.2845 14.2845 16.0229 16.0229 17.0851 17.0851 18.5870 18.5870 21.0959 21.0959 22.4469 22.4469 26.1559 26.1559 28.6903 28.6903 28.7601 28.7601 28.8408 28.8408 k =-0.3679 0.1596 0.0000 ( 1170 PWs) bands (ev): -19.0194 -19.0194 -18.2387 -18.2387 -1.5182 -1.5182 -0.6966 -0.6966 -0.5912 -0.5912 1.4894 1.4894 2.6709 2.6709 3.6634 3.6634 14.3418 14.3418 16.1631 16.1631 17.1187 17.1187 18.5410 18.5410 21.0985 21.0985 22.4227 22.4227 26.1223 26.1223 28.7721 28.7721 28.8055 28.8055 29.0488 29.0488 k =-0.3774 0.1637 0.0000 ( 1166 PWs) bands (ev): -18.9953 -18.9953 -18.2542 -18.2542 -1.5179 -1.5179 -0.7077 -0.7077 -0.6107 -0.6107 1.4270 1.4270 2.6572 2.6572 3.6647 3.6647 14.3916 14.3916 16.2963 16.2963 17.1577 17.1577 18.4983 18.4983 21.1012 21.1012 22.4009 22.4009 26.0910 26.0910 28.8187 28.8187 28.8791 28.8791 29.2521 29.2521 k =-0.3868 0.1678 0.0000 ( 1162 PWs) bands (ev): -18.9715 -18.9715 -18.2699 -18.2699 -1.5177 -1.5177 -0.7548 -0.7548 -0.5887 -0.5887 1.3651 1.3651 2.6445 2.6445 3.6660 3.6660 14.4344 14.4344 16.4217 16.4217 17.2013 17.2013 18.4591 18.4591 21.1037 21.1037 22.3812 22.3812 26.0620 26.0620 28.8481 28.8481 28.9623 28.9623 29.4487 29.4487 k =-0.3962 0.1719 0.0000 ( 1162 PWs) bands (ev): -18.9482 -18.9482 -18.2857 -18.2857 -1.5173 -1.5173 -0.8096 -0.8096 -0.5540 -0.5540 1.3043 1.3043 2.6328 2.6328 3.6672 3.6672 14.4708 14.4708 16.5387 16.5387 17.2481 17.2481 18.4234 18.4234 21.1062 21.1062 22.3637 22.3637 26.0353 26.0353 28.8709 28.8709 29.0438 29.0438 29.6369 29.6369 k =-0.4057 0.1760 0.0000 ( 1162 PWs) bands (ev): -18.9255 -18.9255 -18.3014 -18.3014 -1.5162 -1.5162 -0.8641 -0.8641 -0.5154 -0.5154 1.2448 1.2448 2.6221 2.6221 3.6682 3.6682 14.5013 14.5013 16.6468 16.6468 17.2970 17.2970 18.3910 18.3910 21.1085 21.1085 22.3484 22.3484 26.0108 26.0108 28.8881 28.8881 29.1218 29.1218 29.8157 29.8157 k =-0.4151 0.1801 0.0000 ( 1160 PWs) bands (ev): -18.9035 -18.9035 -18.3171 -18.3171 -1.5141 -1.5141 -0.9164 -0.9164 -0.4752 -0.4752 1.1872 1.1872 2.6125 2.6125 3.6692 3.6692 14.5267 14.5267 16.7455 16.7455 17.3466 17.3466 18.3621 18.3621 21.1107 21.1107 22.3350 22.3350 25.9887 25.9887 28.9000 28.9000 29.1955 29.1955 29.9836 29.9836 k =-0.4245 0.1842 0.0000 ( 1162 PWs) bands (ev): -18.8824 -18.8824 -18.3323 -18.3323 -1.5108 -1.5108 -0.9658 -0.9658 -0.4347 -0.4347 1.1319 1.1319 2.6039 2.6039 3.6700 3.6700 14.5475 14.5475 16.8342 16.8342 17.3955 17.3955 18.3367 18.3367 21.1127 21.1127 22.3236 22.3236 25.9689 25.9689 28.9071 28.9071 29.2640 29.2640 30.1395 30.1395 k =-0.4340 0.1883 0.0000 ( 1158 PWs) bands (ev): -18.8625 -18.8625 -18.3471 -18.3471 -1.5063 -1.5063 -1.0119 -1.0119 -0.3949 -0.3949 1.0797 1.0797 2.5963 2.5963 3.6708 3.6708 14.5645 14.5645 16.9129 16.9129 17.4424 17.4424 18.3146 18.3146 21.1145 21.1145 22.3140 22.3140 25.9514 25.9514 28.9101 28.9101 29.3267 29.3267 30.2822 30.2822 k =-0.4434 0.1923 0.0000 ( 1156 PWs) bands (ev): -18.8441 -18.8441 -18.3610 -18.3610 -1.5006 -1.5006 -1.0542 -1.0542 -0.3570 -0.3570 1.0312 1.0312 2.5898 2.5898 3.6714 3.6714 14.5781 14.5781 16.9812 16.9812 17.4859 17.4859 18.2958 18.2958 21.1161 21.1161 22.3061 22.3061 25.9363 25.9363 28.9097 28.9097 29.3828 29.3828 30.4109 30.4109 k =-0.4528 0.1964 0.0000 ( 1160 PWs) bands (ev): -18.8274 -18.8274 -18.3739 -18.3739 -1.4939 -1.4939 -1.0923 -1.0923 -0.3219 -0.3219 0.9874 0.9874 2.5842 2.5842 3.6720 3.6720 14.5887 14.5887 17.0391 17.0391 17.5247 17.5247 18.2803 18.2803 21.1175 21.1175 22.2996 22.2996 25.9234 25.9234 28.9068 28.9068 29.4315 29.4315 30.5250 30.5250 k =-0.4623 0.2005 0.0000 ( 1162 PWs) bands (ev): -18.8130 -18.8130 -18.3852 -18.3852 -1.4866 -1.4866 -1.1254 -1.1254 -0.2908 -0.2908 0.9493 0.9493 2.5797 2.5797 3.6724 3.6724 14.5968 14.5968 17.0865 17.0865 17.5579 17.5579 18.2680 18.2680 21.1186 21.1186 22.2946 22.2946 25.9129 25.9129 28.9027 28.9027 29.4724 29.4724 30.6244 30.6244 k =-0.4717 0.2046 0.0000 ( 1166 PWs) bands (ev): -18.8010 -18.8010 -18.3946 -18.3946 -1.4794 -1.4794 -1.1530 -1.1530 -0.2649 -0.2649 0.9181 0.9181 2.5761 2.5761 3.6727 3.6727 14.6027 14.6027 17.1233 17.1233 17.5845 17.5845 18.2586 18.2586 21.1195 21.1195 22.2908 22.2908 25.9047 25.9047 28.8983 28.8983 29.5048 29.5048 30.7094 30.7094 k =-0.4811 0.2087 0.0000 ( 1166 PWs) bands (ev): -18.7921 -18.7921 -18.4018 -18.4018 -1.4731 -1.4731 -1.1739 -1.1739 -0.2454 -0.2454 0.8947 0.8947 2.5736 2.5736 3.6730 3.6730 14.6068 14.6068 17.1496 17.1496 17.6040 17.6040 18.2521 18.2521 21.1202 21.1202 22.2881 22.2881 25.8988 25.8988 28.8944 28.8944 29.5283 29.5283 30.7801 30.7801 k =-0.4906 0.2128 0.0000 ( 1174 PWs) bands (ev): -18.7866 -18.7866 -18.4062 -18.4062 -1.4687 -1.4687 -1.1871 -1.1871 -0.2332 -0.2332 0.8803 0.8803 2.5721 2.5721 3.6731 3.6731 14.6092 14.6092 17.1654 17.1654 17.6157 17.6157 18.2482 18.2482 21.1206 21.1206 22.2866 22.2866 25.8953 25.8953 28.8918 28.8918 29.5424 29.5424 30.8341 30.8341 k =-0.5000 0.2169 0.0000 ( 1170 PWs) bands (ev): -18.7847 -18.7847 -18.4078 -18.4078 -1.4671 -1.4671 -1.1916 -1.1916 -0.2290 -0.2290 0.8754 0.8754 2.5716 2.5716 3.6731 3.6731 14.6100 14.6100 17.1706 17.1706 17.6197 17.6197 18.2469 18.2469 21.1207 21.1207 22.2861 22.2861 25.8942 25.8942 28.8909 28.8909 29.5472 29.5472 30.8581 30.8581 k =-0.5000 0.2169 0.0000 ( 1170 PWs) bands (ev): -18.7847 -18.7847 -18.4078 -18.4078 -1.4671 -1.4671 -1.1916 -1.1916 -0.2290 -0.2290 0.8754 0.8754 2.5716 2.5716 3.6731 3.6731 14.6100 14.6100 17.1706 17.1706 17.6197 17.6197 18.2469 18.2469 21.1207 21.1207 22.2861 22.2861 25.8942 25.8942 28.8909 28.8909 29.5472 29.5472 30.8581 30.8581 k =-0.4959 0.2265-0.0000 ( 1166 PWs) bands (ev): -18.7844 -18.7844 -18.4072 -18.4072 -1.4665 -1.4665 -1.1909 -1.1909 -0.2285 -0.2285 0.8759 0.8759 2.5674 2.5674 3.6699 3.6699 14.6141 14.6141 17.1707 17.1707 17.6198 17.6198 18.2419 18.2419 21.1202 21.1202 22.2903 22.2903 25.8953 25.8953 28.8837 28.8837 29.5405 29.5405 30.8619 30.8619 k =-0.4917 0.2360-0.0000 ( 1168 PWs) bands (ev): -18.7832 -18.7832 -18.4057 -18.4057 -1.4648 -1.4648 -1.1889 -1.1889 -0.2271 -0.2271 0.8774 0.8774 2.5550 2.5550 3.6601 3.6601 14.6263 14.6263 17.1707 17.1707 17.6201 17.6201 18.2268 18.2268 21.1188 21.1188 22.3026 22.3026 25.8988 25.8988 28.8621 28.8621 29.5205 29.5205 30.8730 30.8730 k =-0.4876 0.2455-0.0000 ( 1170 PWs) bands (ev): -18.7812 -18.7812 -18.4032 -18.4032 -1.4620 -1.4620 -1.1856 -1.1856 -0.2249 -0.2249 0.8799 0.8799 2.5343 2.5343 3.6438 3.6438 14.6464 14.6464 17.1708 17.1708 17.6207 17.6207 18.2019 18.2019 21.1163 21.1163 22.3229 22.3229 25.9046 25.9046 28.8262 28.8262 29.4884 29.4884 30.8903 30.8903 k =-0.4834 0.2551-0.0000 ( 1170 PWs) bands (ev): -18.7785 -18.7785 -18.3996 -18.3996 -1.4580 -1.4580 -1.1809 -1.1809 -0.2216 -0.2216 0.8833 0.8833 2.5058 2.5058 3.6211 3.6211 14.6740 14.6740 17.1708 17.1708 17.6215 17.6215 18.1674 18.1674 21.1129 21.1129 22.3512 22.3512 25.9126 25.9126 28.7762 28.7762 29.4459 29.4459 30.8661 30.8661 k =-0.4793 0.2646-0.0000 ( 1166 PWs) bands (ev): -18.7750 -18.7750 -18.3950 -18.3950 -1.4529 -1.4529 -1.1750 -1.1750 -0.2175 -0.2175 0.8876 0.8876 2.4696 2.4696 3.5923 3.5923 14.7086 14.7086 17.1705 17.1705 17.6227 17.6227 18.1240 18.1240 21.1085 21.1085 22.3873 22.3873 25.9228 25.9228 28.7125 28.7125 29.3946 29.3946 30.8131 30.8131 k =-0.4751 0.2742-0.0000 ( 1164 PWs) bands (ev): -18.7707 -18.7707 -18.3895 -18.3895 -1.4467 -1.4467 -1.1677 -1.1677 -0.2125 -0.2125 0.8927 0.8927 2.4262 2.4262 3.5573 3.5573 14.7495 14.7495 17.1701 17.1701 17.6242 17.6242 18.0721 18.0721 21.1030 21.1030 22.4306 22.4306 25.9351 25.9351 28.6358 28.6358 29.3364 29.3364 30.7541 30.7541 k =-0.4710 0.2837-0.0000 ( 1164 PWs) bands (ev): -18.7657 -18.7657 -18.3829 -18.3829 -1.4394 -1.4394 -1.1592 -1.1592 -0.2066 -0.2066 0.8986 0.8986 2.3760 2.3760 3.5165 3.5165 14.7961 14.7961 17.1691 17.1691 17.6257 17.6257 18.0128 18.0128 21.0965 21.0965 22.4808 22.4808 25.9494 25.9494 28.5468 28.5468 29.2732 29.2732 30.6911 30.6911 k =-0.4669 0.2933-0.0000 ( 1164 PWs) bands (ev): -18.7599 -18.7599 -18.3754 -18.3754 -1.4311 -1.4311 -1.1496 -1.1496 -0.1999 -0.1999 0.9051 0.9051 2.3196 2.3196 3.4701 3.4701 14.8473 14.8473 17.1676 17.1676 17.6265 17.6265 17.9479 17.9479 21.0890 21.0890 22.5373 22.5373 25.9656 25.9656 28.4468 28.4468 29.2063 29.2063 30.6261 30.6261 k =-0.4627 0.3028-0.0000 ( 1164 PWs) bands (ev): -18.7534 -18.7534 -18.3669 -18.3669 -1.4219 -1.4219 -1.1387 -1.1387 -0.1923 -0.1923 0.9120 0.9120 2.2576 2.2576 3.4183 3.4183 14.9021 14.9021 17.1653 17.1653 17.6242 17.6242 17.8806 17.8806 21.0804 21.0804 22.5992 22.5992 25.9835 25.9835 28.3374 28.3374 29.1371 29.1371 30.5606 30.5606 k =-0.4586 0.3124-0.0000 ( 1164 PWs) bands (ev): -18.7463 -18.7463 -18.3575 -18.3575 -1.4117 -1.4117 -1.1267 -1.1267 -0.1840 -0.1840 0.9192 0.9192 2.1908 2.1908 3.3615 3.3615 14.9595 14.9595 17.1622 17.1622 17.6120 17.6120 17.8188 17.8188 21.0707 21.0707 22.6659 22.6659 26.0031 26.0031 28.2203 28.2203 29.0667 29.0667 30.4956 30.4956 k =-0.4544 0.3219-0.0000 ( 1168 PWs) bands (ev): -18.7384 -18.7384 -18.3471 -18.3471 -1.4007 -1.4007 -1.1136 -1.1136 -0.1749 -0.1749 0.9263 0.9263 2.1198 2.1198 3.2999 3.2999 15.0180 15.0180 17.1580 17.1580 17.5767 17.5767 17.7768 17.7768 21.0599 21.0599 22.7360 22.7360 26.0242 26.0242 28.0977 28.0977 28.9961 28.9961 30.4321 30.4321 k =-0.4503 0.3315-0.0000 ( 1164 PWs) bands (ev): -18.7299 -18.7299 -18.3358 -18.3358 -1.3889 -1.3889 -1.0995 -1.0995 -0.1652 -0.1652 0.9329 0.9329 2.0458 2.0458 3.2339 3.2339 15.0766 15.0766 17.1525 17.1525 17.5106 17.5106 17.7637 17.7637 21.0480 21.0480 22.8083 22.8083 26.0468 26.0468 27.9721 27.9721 28.9261 28.9261 30.3707 30.3707 k =-0.4462 0.3410-0.0000 ( 1162 PWs) bands (ev): -18.7208 -18.7208 -18.3236 -18.3236 -1.3763 -1.3763 -1.0845 -1.0845 -0.1547 -0.1547 0.9386 0.9386 1.9698 1.9698 3.1639 3.1639 15.1339 15.1339 17.1453 17.1453 17.4232 17.4232 17.7715 17.7715 21.0349 21.0349 22.8811 22.8811 26.0706 26.0706 27.8463 27.8463 28.8575 28.8575 30.3115 30.3115 k =-0.4420 0.3506-0.0000 ( 1158 PWs) bands (ev): -18.7110 -18.7110 -18.3106 -18.3106 -1.3631 -1.3631 -1.0686 -1.0686 -0.1437 -0.1437 0.9426 0.9426 1.8932 1.8932 3.0902 3.0902 15.1885 15.1885 17.1354 17.1354 17.3248 17.3248 17.7918 17.7918 21.0207 21.0207 22.9525 22.9525 26.0957 26.0957 27.7232 27.7232 28.7908 28.7908 30.2550 30.2550 k =-0.4379 0.3601-0.0000 ( 1162 PWs) bands (ev): -18.7007 -18.7007 -18.2966 -18.2966 -1.3494 -1.3494 -1.0520 -1.0520 -0.1321 -0.1321 0.9440 0.9440 1.8173 1.8173 3.0132 3.0132 15.2392 15.2392 17.1182 17.1182 17.2247 17.2247 17.8209 17.8209 21.0053 21.0053 23.0201 23.0201 26.1218 26.1218 27.6060 27.6060 28.7265 28.7265 30.2010 30.2010 k =-0.4337 0.3697-0.0000 ( 1162 PWs) bands (ev): -18.6898 -18.6898 -18.2819 -18.2819 -1.3353 -1.3353 -1.0347 -1.0347 -0.1201 -0.1201 0.9415 0.9415 1.7443 1.7443 2.9333 2.9333 15.2848 15.2848 17.0663 17.0663 17.1524 17.1524 17.8574 17.8574 20.9887 20.9887 23.0813 23.0813 26.1488 26.1488 27.4983 27.4983 28.6652 28.6652 30.1501 30.1501 k =-0.4296 0.3792-0.0000 ( 1162 PWs) bands (ev): -18.6785 -18.6785 -18.2664 -18.2664 -1.3210 -1.3210 -1.0170 -1.0170 -0.1077 -0.1077 0.9334 0.9334 1.6764 1.6764 2.8509 2.8509 15.3244 15.3244 16.9633 16.9633 17.1257 17.1257 17.9006 17.9006 20.9710 20.9710 23.1331 23.1331 26.1766 26.1766 27.4037 27.4037 28.6072 28.6072 30.1020 30.1020 k =-0.4254 0.3888-0.0000 ( 1166 PWs) bands (ev): -18.6666 -18.6666 -18.2501 -18.2501 -1.3066 -1.3066 -0.9989 -0.9989 -0.0950 -0.0950 0.9181 0.9181 1.6160 1.6160 2.7663 2.7663 15.3571 15.3571 16.8455 16.8455 17.1092 17.1092 17.9503 17.9503 20.9521 20.9521 23.1724 23.1724 26.2050 26.2050 27.3261 27.3261 28.5529 28.5529 30.0571 30.0571 k =-0.4213 0.3983-0.0000 ( 1166 PWs) bands (ev): -18.6543 -18.6543 -18.2331 -18.2331 -1.2923 -1.2923 -0.9806 -0.9806 -0.0821 -0.0821 0.8937 0.8937 1.5656 1.5656 2.6802 2.6802 15.3825 15.3825 16.7228 16.7228 17.0936 17.0936 18.0059 18.0059 20.9320 20.9320 23.1959 23.1959 26.2340 26.2340 27.2691 27.2691 28.5025 28.5025 30.0154 30.0154 k =-0.4172 0.4079-0.0000 ( 1168 PWs) bands (ev): -18.6416 -18.6416 -18.2153 -18.2153 -1.2784 -1.2784 -0.9623 -0.9623 -0.0693 -0.0693 0.8593 0.8593 1.5270 1.5270 2.5928 2.5928 15.4001 15.4001 16.5974 16.5974 17.0773 17.0773 18.0667 18.0667 20.9107 20.9107 23.2009 23.2009 26.2634 26.2634 27.2358 27.2358 28.4564 28.4564 29.9772 29.9772 k =-0.4130 0.4174-0.0000 ( 1160 PWs) bands (ev): -18.6285 -18.6285 -18.1969 -18.1969 -1.2652 -1.2652 -0.9443 -0.9443 -0.0566 -0.0566 0.8153 0.8153 1.5006 1.5006 2.5046 2.5046 15.4100 15.4100 16.4704 16.4704 17.0598 17.0598 18.1321 18.1321 20.8883 20.8883 23.1851 23.1851 26.2931 26.2931 27.2286 27.2286 28.4147 28.4147 29.9425 29.9425 k =-0.4089 0.4270-0.0000 ( 1160 PWs) bands (ev): -18.6152 -18.6152 -18.1779 -18.1779 -1.2529 -1.2529 -0.9268 -0.9268 -0.0443 -0.0443 0.7632 0.7632 1.4856 1.4856 2.4163 2.4163 15.4122 15.4122 16.3423 16.3423 17.0410 17.0410 18.2009 18.2009 20.8648 20.8648 23.1470 23.1470 26.3231 26.3231 27.2490 27.2490 28.3776 28.3776 29.9115 29.9115 k =-0.4047 0.4365-0.0000 ( 1158 PWs) bands (ev): -18.6015 -18.6015 -18.1583 -18.1583 -1.2421 -1.2421 -0.9100 -0.9100 -0.0328 -0.0328 0.7058 0.7058 1.4803 1.4803 2.3282 2.3282 15.4070 15.4070 16.2139 16.2139 17.0207 17.0207 18.2721 18.2721 20.8401 20.8401 23.0865 23.0865 26.3533 26.3533 27.2970 27.2970 28.3452 28.3452 29.8847 29.8847 k =-0.4006 0.4460-0.0000 ( 1158 PWs) bands (ev): -18.5877 -18.5877 -18.1381 -18.1381 -1.2331 -1.2331 -0.8943 -0.8943 -0.0222 -0.0222 0.6462 0.6462 1.4825 1.4825 2.2410 2.2410 15.3948 15.3948 16.0856 16.0856 16.9989 16.9989 18.3445 18.3445 20.8144 20.8144 23.0042 23.0042 26.3835 26.3835 27.3718 27.3718 28.3177 28.3177 29.8624 29.8624 k =-0.3965 0.4556-0.0000 ( 1154 PWs) bands (ev): -18.5736 -18.5736 -18.1173 -18.1173 -1.2267 -1.2267 -0.8799 -0.8799 -0.0130 -0.0130 0.5874 0.5874 1.4904 1.4904 2.1555 2.1555 15.3760 15.3760 15.9580 15.9580 16.9757 16.9757 18.4168 18.4168 20.7876 20.7876 22.9019 22.9019 26.4137 26.4137 27.4714 27.4714 28.2953 28.2953 29.8449 29.8449 k =-0.3923 0.4651-0.0000 ( 1154 PWs) bands (ev): -18.5594 -18.5594 -18.0962 -18.0962 -1.2235 -1.2235 -0.8671 -0.8671 -0.0057 -0.0057 0.5321 0.5321 1.5019 1.5019 2.0726 2.0726 15.3511 15.3511 15.8316 15.8316 16.9510 16.9510 18.4878 18.4878 20.7597 20.7597 22.7814 22.7814 26.4437 26.4437 27.5933 27.5933 28.2778 28.2778 29.8329 29.8329 k =-0.3882 0.4747-0.0000 ( 1154 PWs) bands (ev): -18.5452 -18.5452 -18.0745 -18.0745 -1.2242 -1.2242 -0.8562 -0.8562 -0.0007 -0.0007 0.4828 0.4828 1.5150 1.5150 1.9937 1.9937 15.3203 15.3203 15.7070 15.7070 16.9249 16.9249 18.5562 18.5562 20.7310 20.7310 22.6451 22.6451 26.4733 26.4733 27.7343 27.7343 28.2655 28.2655 29.8269 29.8269 k =-0.3840 0.4842-0.0000 ( 1150 PWs) bands (ev): -18.5309 -18.5309 -18.0525 -18.0525 -1.2298 -1.2298 -0.8471 -0.8471 0.0018 0.0018 0.4415 0.4415 1.5272 1.5272 1.9210 1.9210 15.2838 15.2838 15.5851 15.5851 16.8975 16.8975 18.6211 18.6211 20.7013 20.7013 22.4954 22.4954 26.5023 26.5023 27.8906 27.8906 28.2589 28.2589 29.8279 29.8279 k =-0.3799 0.4938-0.0000 ( 1150 PWs) bands (ev): -18.5167 -18.5167 -18.0302 -18.0302 -1.2411 -1.2411 -0.8400 -0.8400 0.0018 0.0018 0.4094 0.4094 1.5346 1.5346 1.8583 1.8583 15.2410 15.2410 15.4673 15.4673 16.8688 16.8688 18.6810 18.6810 20.6708 20.6708 22.3345 22.3345 26.5303 26.5303 28.0561 28.0561 28.2607 28.2607 29.8371 29.8371 k =-0.3757 0.5033-0.0000 ( 1150 PWs) bands (ev): -18.5025 -18.5025 -18.0075 -18.0075 -1.2588 -1.2588 -0.8347 -0.8347 -0.0002 -0.0002 0.3869 0.3869 1.5312 1.5312 1.8115 1.8115 15.1900 15.1900 15.3565 15.3565 16.8389 16.8389 18.7351 18.7351 20.6395 20.6395 22.1643 22.1643 26.5572 26.5572 28.2001 28.2001 28.2975 28.2975 29.8563 29.8563 k =-0.3716 0.5129-0.0000 ( 1150 PWs) bands (ev): -18.4885 -18.4885 -17.9847 -17.9847 -1.2835 -1.2835 -0.8311 -0.8311 -0.0030 -0.0030 0.3734 0.3734 1.5110 1.5110 1.7868 1.7868 15.1256 15.1256 15.2585 15.2585 16.8079 16.8079 18.7826 18.7826 20.6076 20.6076 21.9865 21.9865 26.5827 26.5827 28.2414 28.2414 28.4462 28.4462 29.8880 29.8880 k =-0.3675 0.5224-0.0000 ( 1148 PWs) bands (ev): -18.4747 -18.4747 -17.9616 -17.9616 -1.3153 -1.3153 -0.8290 -0.8290 -0.0055 -0.0055 0.3678 0.3678 1.4742 1.4742 1.7842 1.7842 15.0428 15.0428 15.1793 15.1793 16.7760 16.7760 18.8227 18.8227 20.5750 20.5750 21.8028 21.8028 26.6065 26.6065 28.2561 28.2561 28.6253 28.6253 29.9355 29.9355 k =-0.3633 0.5320-0.0000 ( 1152 PWs) bands (ev): -18.4612 -18.4612 -17.9384 -17.9384 -1.3540 -1.3540 -0.8283 -0.8283 -0.0065 -0.0065 0.3685 0.3685 1.4273 1.4273 1.7974 1.7974 14.9462 14.9462 15.1148 15.1148 16.7432 16.7432 18.8548 18.8548 20.5419 20.5419 21.6142 21.6142 26.6284 26.6284 28.2710 28.2710 28.8018 28.8018 30.0036 30.0036 k =-0.3592 0.5415-0.0000 ( 1148 PWs) bands (ev): -18.4479 -18.4479 -17.9151 -17.9151 -1.3990 -1.3990 -0.8290 -0.8290 -0.0055 -0.0055 0.3742 0.3742 1.3769 1.3769 1.8201 1.8201 14.8446 14.8446 15.0573 15.0573 16.7098 16.7098 18.8786 18.8786 20.5084 20.5084 21.4218 21.4218 26.6481 26.6481 28.2886 28.2886 28.9663 28.9663 30.0975 30.0975 k =-0.3550 0.5511-0.0000 ( 1152 PWs) bands (ev): -18.4351 -18.4351 -17.8918 -17.8918 -1.4493 -1.4493 -0.8311 -0.8311 -0.0022 -0.0022 0.3838 0.3838 1.3271 1.3271 1.8485 1.8485 14.7427 14.7427 15.0022 15.0022 16.6758 16.6758 18.8935 18.8935 20.4745 20.4745 21.2265 21.2265 26.6652 26.6652 28.3094 28.3094 29.1123 29.1123 30.2220 30.2220 k =-0.3509 0.5606-0.0000 ( 1154 PWs) bands (ev): -18.4227 -18.4227 -17.8684 -17.8684 -1.5041 -1.5041 -0.8349 -0.8349 0.0032 0.0032 0.3963 0.3963 1.2802 1.2802 1.8806 1.8806 14.6428 14.6428 14.9483 14.9483 16.6414 16.6414 18.8995 18.8995 20.4404 20.4404 21.0291 21.0291 26.6796 26.6796 28.3333 28.3333 29.2365 29.2365 30.3788 30.3788 k =-0.3468 0.5702-0.0000 ( 1152 PWs) bands (ev): -18.4108 -18.4108 -17.8452 -17.8452 -1.5621 -1.5621 -0.8404 -0.8404 0.0104 0.0104 0.4112 0.4112 1.2377 1.2377 1.9152 1.9152 14.5458 14.5458 14.8950 14.8950 16.6067 16.6067 18.8965 18.8965 20.4062 20.4062 20.8304 20.8304 26.6909 26.6909 28.3602 28.3602 29.3403 29.3403 30.5656 30.5656 k =-0.3426 0.5797-0.0000 ( 1152 PWs) bands (ev): -18.3994 -18.3994 -17.8221 -17.8221 -1.6223 -1.6223 -0.8480 -0.8480 0.0188 0.0188 0.4280 0.4280 1.2003 1.2003 1.9516 1.9516 14.4524 14.4524 14.8423 14.8423 16.5719 16.5719 18.8845 18.8845 20.3718 20.3718 20.6310 20.6310 26.6988 26.6988 28.3901 28.3901 29.4277 29.4277 30.7771 30.7771 k =-0.3385 0.5893-0.0000 ( 1152 PWs) bands (ev): -18.3887 -18.3887 -17.7992 -17.7992 -1.6837 -1.6837 -0.8578 -0.8578 0.0278 0.0278 0.4462 0.4462 1.1688 1.1688 1.9895 1.9895 14.3629 14.3629 14.7903 14.7903 16.5372 16.5372 18.8636 18.8636 20.3358 20.3358 20.4328 20.4328 26.7031 26.7031 28.4228 28.4228 29.5036 29.5036 31.0071 31.0071 k =-0.3343 0.5988-0.0000 ( 1152 PWs) bands (ev): -18.3786 -18.3786 -17.7765 -17.7765 -1.7455 -1.7455 -0.8698 -0.8698 0.0371 0.0371 0.4657 0.4657 1.1433 1.1433 2.0284 2.0284 14.2777 14.2777 14.7393 14.7393 16.5026 16.5026 18.8339 18.8339 20.2247 20.2247 20.3099 20.3099 26.7035 26.7035 28.4581 28.4581 29.5723 29.5723 31.2495 31.2495 k =-0.3302 0.6084-0.0000 ( 1151 PWs) bands (ev): -18.3693 -18.3693 -17.7541 -17.7541 -1.8069 -1.8069 -0.8841 -0.8841 0.0461 0.0461 0.4862 0.4862 1.1241 1.1241 2.0681 2.0681 14.1971 14.1971 14.6894 14.6894 16.4684 16.4684 18.7959 18.7959 20.0271 20.0271 20.2744 20.2744 26.6996 26.6996 28.4959 28.4959 29.6371 29.6371 31.4819 31.4819 k =-0.3260 0.6179-0.0000 ( 1149 PWs) bands (ev): -18.3607 -18.3607 -17.7321 -17.7321 -1.8672 -1.8672 -0.9005 -0.9005 0.0544 0.0544 0.5075 0.5075 1.1112 1.1112 2.1086 2.1086 14.1211 14.1211 14.6409 14.6409 16.4347 16.4347 18.7498 18.7498 19.8279 19.8279 20.2418 20.2418 26.6913 26.6913 28.5361 28.5361 29.7002 29.7002 31.5089 31.5089 k =-0.3219 0.6275-0.0000 ( 1153 PWs) bands (ev): -18.3530 -18.3530 -17.7105 -17.7105 -1.9260 -1.9260 -0.9189 -0.9189 0.0617 0.0617 0.5296 0.5296 1.1045 1.1045 2.1496 2.1496 14.0502 14.0502 14.5940 14.5940 16.4017 16.4017 18.6960 18.6960 19.6291 19.6291 20.2103 20.2103 26.6784 26.6784 28.5786 28.5786 29.7632 29.7632 31.5240 31.5240 k =-0.3178 0.6370-0.0000 ( 1153 PWs) bands (ev): -18.3462 -18.3462 -17.6893 -17.6893 -1.9826 -1.9826 -0.9390 -0.9390 0.0677 0.0677 0.5523 0.5523 1.1036 1.1036 2.1911 2.1911 13.9843 13.9843 14.5490 14.5490 16.3695 16.3695 18.6350 18.6350 19.4313 19.4313 20.1799 20.1799 26.6607 26.6607 28.6230 28.6230 29.8273 29.8273 31.5429 31.5429 k =-0.3136 0.6466-0.0000 ( 1155 PWs) bands (ev): -18.3403 -18.3403 -17.6687 -17.6687 -2.0367 -2.0367 -0.9606 -0.9606 0.0722 0.0722 0.5755 0.5755 1.1083 1.1083 2.2329 2.2329 13.9237 13.9237 14.5062 14.5062 16.3384 16.3384 18.5671 18.5671 19.2347 19.2347 20.1508 20.1508 26.6381 26.6381 28.6694 28.6694 29.8929 29.8929 31.5658 31.5658 k =-0.3095 0.6561-0.0000 ( 1155 PWs) bands (ev): -18.3354 -18.3354 -17.6486 -17.6486 -2.0879 -2.0879 -0.9833 -0.9833 0.0752 0.0752 0.5991 0.5991 1.1181 1.1181 2.2749 2.2749 13.8685 13.8685 14.4657 14.4657 16.3084 16.3084 18.4928 18.4928 19.0395 19.0395 20.1231 20.1231 26.6104 26.6104 28.7174 28.7174 29.9609 29.9609 31.5927 31.5927 k =-0.3053 0.6656-0.0000 ( 1159 PWs) bands (ev): -18.3316 -18.3316 -17.6292 -17.6292 -2.1360 -2.1360 -1.0066 -1.0066 0.0765 0.0765 0.6229 0.6229 1.1326 1.1326 2.3170 2.3170 13.8187 13.8187 14.4279 14.4279 16.2796 16.2796 18.4125 18.4125 18.8460 18.8460 20.0970 20.0970 26.5777 26.5777 28.7670 28.7670 30.0313 30.0313 31.6233 31.6233 k =-0.3012 0.6752-0.0000 ( 1159 PWs) bands (ev): -18.3288 -18.3288 -17.6104 -17.6104 -2.1806 -2.1806 -1.0303 -1.0303 0.0761 0.0761 0.6469 0.6469 1.1512 1.1512 2.3592 2.3592 13.7746 13.7746 14.3928 14.3928 16.2524 16.2524 18.3266 18.3266 18.6542 18.6542 20.0727 20.0727 26.5399 26.5399 28.8177 28.8177 30.1046 30.1046 31.6576 31.6576 k =-0.2970 0.6847-0.0000 ( 1159 PWs) bands (ev): -18.3271 -18.3271 -17.5924 -17.5924 -2.2215 -2.2215 -1.0538 -1.0538 0.0739 0.0739 0.6709 0.6709 1.1736 1.1736 2.4014 2.4014 13.7363 13.7363 14.3608 14.3608 16.2267 16.2267 18.2355 18.2355 18.4646 18.4646 20.0503 20.0503 26.4971 26.4971 28.8693 28.8693 30.1808 30.1808 31.6953 31.6953 k =-0.2970 0.6847-0.0000 ( 1159 PWs) bands (ev): -18.3271 -18.3271 -17.5924 -17.5924 -2.2215 -2.2215 -1.0538 -1.0538 0.0739 0.0739 0.6709 0.6709 1.1736 1.1736 2.4014 2.4014 13.7363 13.7363 14.3608 14.3608 16.2267 16.2267 18.2355 18.2355 18.4646 18.4646 20.0503 20.0503 26.4971 26.4971 28.8693 28.8693 30.1808 30.1808 31.6953 31.6953 k =-0.2970 0.6847 0.0104 ( 1157 PWs) bands (ev): -18.3268 -18.3268 -17.5927 -17.5927 -2.2208 -2.2208 -1.0562 -1.0562 0.0740 0.0740 0.6678 0.6678 1.1762 1.1762 2.4038 2.4038 13.7368 13.7368 14.3614 14.3614 16.2273 16.2273 18.2320 18.2320 18.4679 18.4679 20.0540 20.0540 26.4967 26.4967 28.8621 28.8621 30.1711 30.1711 31.6876 31.6876 k =-0.2970 0.6847 0.0209 ( 1155 PWs) bands (ev): -18.3258 -18.3258 -17.5936 -17.5936 -2.2186 -2.2186 -1.0632 -1.0632 0.0741 0.0741 0.6586 0.6586 1.1841 1.1841 2.4108 2.4108 13.7383 13.7383 14.3630 14.3630 16.2290 16.2290 18.2217 18.2217 18.4778 18.4778 20.0652 20.0652 26.4954 26.4954 28.8408 28.8408 30.1423 30.1423 31.6658 31.6658 k =-0.2970 0.6847 0.0313 ( 1151 PWs) bands (ev): -18.3242 -18.3242 -17.5951 -17.5951 -2.2149 -2.2149 -1.0746 -1.0746 0.0739 0.0739 0.6441 0.6441 1.1969 1.1969 2.4223 2.4223 13.7408 13.7408 14.3656 14.3656 16.2319 16.2319 18.2051 18.2051 18.4944 18.4944 20.0830 20.0830 26.4929 26.4929 28.8061 28.8061 30.0956 30.0956 31.6326 31.6326 k =-0.2970 0.6847 0.0418 ( 1151 PWs) bands (ev): -18.3220 -18.3220 -17.5973 -17.5973 -2.2098 -2.2098 -1.0900 -1.0900 0.0725 0.0725 0.6254 0.6254 1.2140 1.2140 2.4380 2.4380 13.7442 13.7442 14.3690 14.3690 16.2360 16.2360 18.1830 18.1830 18.5176 18.5176 20.1067 20.1067 26.4886 26.4886 28.7594 28.7594 30.0330 30.0330 31.5906 31.5906 k =-0.2970 0.6847 0.0522 ( 1149 PWs) bands (ev): -18.3192 -18.3192 -17.6000 -17.6000 -2.2033 -2.2033 -1.1091 -1.1091 0.0692 0.0692 0.6034 0.6034 1.2352 1.2352 2.4576 2.4576 13.7485 13.7485 14.3733 14.3733 16.2414 16.2414 18.1565 18.1565 18.5474 18.5474 20.1352 20.1352 26.4817 26.4817 28.7022 28.7022 29.9570 29.9570 31.5408 31.5408 k =-0.2970 0.6847 0.0627 ( 1153 PWs) bands (ev): -18.3157 -18.3157 -17.6033 -17.6033 -2.1954 -2.1954 -1.1311 -1.1311 0.0629 0.0629 0.5795 0.5795 1.2601 1.2601 2.4807 2.4807 13.7536 13.7536 14.3781 14.3781 16.2482 16.2482 18.1267 18.1267 18.5837 18.5837 20.1671 20.1671 26.4713 26.4713 28.6365 28.6365 29.8708 29.8708 31.4811 31.4811 k =-0.2970 0.6847 0.0731 ( 1155 PWs) bands (ev): -18.3116 -18.3116 -17.6073 -17.6073 -2.1861 -2.1861 -1.1557 -1.1557 0.0529 0.0529 0.5544 0.5544 1.2885 1.2885 2.5068 2.5068 13.7593 13.7593 14.3834 14.3834 16.2567 16.2567 18.0947 18.0947 18.6266 18.6266 20.2012 20.2012 26.4560 26.4560 28.5644 28.5644 29.7778 29.7778 31.4056 31.4056 k =-0.2970 0.6847 0.0836 ( 1155 PWs) bands (ev): -18.3070 -18.3070 -17.6118 -17.6118 -2.1754 -2.1754 -1.1822 -1.1822 0.0385 0.0385 0.5289 0.5289 1.3205 1.3205 2.5356 2.5356 13.7656 13.7656 14.3888 14.3888 16.2669 16.2669 18.0619 18.0619 18.6759 18.6759 20.2362 20.2362 26.4345 26.4345 28.4880 28.4880 29.6817 29.6817 31.3058 31.3058 k =-0.2970 0.6847 0.0940 ( 1159 PWs) bands (ev): -18.3017 -18.3017 -17.6169 -17.6169 -2.1635 -2.1635 -1.2102 -1.2102 0.0192 0.0192 0.5034 0.5034 1.3560 1.3560 2.5664 2.5664 13.7724 13.7724 14.3942 14.3942 16.2789 16.2789 18.0294 18.0294 18.7314 18.7314 20.2708 20.2708 26.4052 26.4052 28.4094 28.4094 29.5862 29.5862 31.1751 31.1751 k =-0.2970 0.6847 0.1044 ( 1157 PWs) bands (ev): -18.2958 -18.2958 -17.6226 -17.6226 -2.1502 -2.1502 -1.2392 -1.2392 -0.0050 -0.0050 0.4781 0.4781 1.3949 1.3949 2.5988 2.5988 13.7795 13.7795 14.3992 14.3992 16.2932 16.2932 17.9983 17.9983 18.7932 18.7932 20.3039 20.3039 26.3664 26.3664 28.3306 28.3306 29.4949 29.4949 31.0141 31.0141 k =-0.2970 0.6847 0.1149 ( 1158 PWs) bands (ev): -18.2893 -18.2893 -17.6288 -17.6288 -2.1358 -2.1358 -1.2686 -1.2686 -0.0339 -0.0339 0.4527 0.4527 1.4372 1.4372 2.6325 2.6325 13.7867 13.7867 14.4036 14.4036 16.3096 16.3096 17.9696 17.9696 18.8608 18.8608 20.3344 20.3344 26.3165 26.3165 28.2535 28.2535 29.4113 29.4113 30.8286 30.8286 k =-0.2970 0.6847 0.1253 ( 1160 PWs) bands (ev): -18.2823 -18.2823 -17.6356 -17.6356 -2.1202 -2.1202 -1.2983 -1.2983 -0.0669 -0.0669 0.4270 0.4270 1.4828 1.4828 2.6668 2.6668 13.7941 13.7941 14.4070 14.4070 16.3286 16.3286 17.9440 17.9440 18.9343 18.9343 20.3614 20.3614 26.2542 26.2542 28.1798 28.1798 29.3382 29.3382 30.6249 30.6249 k =-0.2970 0.6847 0.1358 ( 1156 PWs) bands (ev): -18.2747 -18.2747 -17.6430 -17.6430 -2.1035 -2.1035 -1.3277 -1.3277 -0.1035 -0.1035 0.4007 0.4007 1.5315 1.5315 2.7014 2.7014 13.8015 13.8015 14.4093 14.4093 16.3502 16.3502 17.9224 17.9224 19.0134 19.0134 20.3840 20.3840 26.1786 26.1786 28.1109 28.1109 29.2780 29.2780 30.4082 30.4082 k =-0.2970 0.6847 0.1462 ( 1158 PWs) bands (ev): -18.2666 -18.2666 -17.6509 -17.6509 -2.0858 -2.0858 -1.3566 -1.3566 -0.1428 -0.1428 0.3734 0.3734 1.5830 1.5830 2.7360 2.7360 13.8086 13.8086 14.4101 14.4101 16.3747 16.3747 17.9054 17.9054 19.0978 19.0978 20.4014 20.4014 26.0893 26.0893 28.0480 28.0480 29.2322 29.2322 30.1821 30.1821 k =-0.2970 0.6847 0.1567 ( 1162 PWs) bands (ev): -18.2579 -18.2579 -17.6593 -17.6593 -2.0672 -2.0672 -1.3847 -1.3847 -0.1843 -0.1843 0.3449 0.3449 1.6370 1.6370 2.7700 2.7700 13.8155 13.8155 14.4091 14.4091 16.4022 16.4022 17.8935 17.8935 19.1871 19.1871 20.4133 20.4133 25.9864 25.9864 27.9920 27.9920 29.2017 29.2017 29.9493 29.9493 k =-0.2970 0.6847 0.1671 ( 1156 PWs) bands (ev): -18.2488 -18.2488 -17.6682 -17.6682 -2.0478 -2.0478 -1.4118 -1.4118 -0.2272 -0.2272 0.3149 0.3149 1.6933 1.6933 2.8032 2.8032 13.8222 13.8222 14.4064 14.4064 16.4330 16.4330 17.8871 17.8871 19.2812 19.2812 20.4192 20.4192 25.8710 25.8710 27.9437 27.9437 29.1866 29.1866 29.7122 29.7122 k =-0.2970 0.6847 0.1776 ( 1158 PWs) bands (ev): -18.2391 -18.2391 -17.6776 -17.6776 -2.0278 -2.0278 -1.4376 -1.4376 -0.2709 -0.2709 0.2835 0.2835 1.7514 1.7514 2.8352 2.8352 13.8284 13.8284 14.4015 14.4015 16.4671 16.4671 17.8864 17.8864 19.3795 19.3795 20.4189 20.4189 25.7443 25.7443 27.9031 27.9031 29.1859 29.1859 29.4731 29.4731 k =-0.2970 0.6847 0.1880 ( 1158 PWs) bands (ev): -18.2289 -18.2289 -17.6875 -17.6875 -2.0072 -2.0072 -1.4619 -1.4619 -0.3149 -0.3149 0.2505 0.2505 1.8110 1.8110 2.8659 2.8659 13.8341 13.8341 14.3945 14.3945 16.5047 16.5047 17.8915 17.8915 19.4816 19.4816 20.4124 20.4124 25.6082 25.6082 27.8698 27.8698 29.1917 29.1917 29.2410 29.2410 k =-0.2970 0.6847 0.1984 ( 1154 PWs) bands (ev): -18.2183 -18.2183 -17.6979 -17.6979 -1.9863 -1.9863 -1.4845 -1.4845 -0.3587 -0.3587 0.2161 0.2161 1.8718 1.8718 2.8949 2.8949 13.8395 13.8395 14.3853 14.3853 16.5458 16.5458 17.9022 17.9022 19.5869 19.5869 20.4000 20.4000 25.4649 25.4649 27.8422 27.8422 28.9934 28.9934 29.2281 29.2281 k =-0.2970 0.6847 0.2089 ( 1154 PWs) bands (ev): -18.2072 -18.2072 -17.7087 -17.7087 -1.9654 -1.9654 -1.5053 -1.5053 -0.4019 -0.4019 0.1804 0.1804 1.9334 1.9334 2.9219 2.9219 13.8444 13.8444 14.3740 14.3740 16.5906 16.5906 17.9183 17.9183 19.6947 19.6947 20.3820 20.3820 25.3164 25.3164 27.8167 27.8167 28.7645 28.7645 29.2638 29.2638 k =-0.2970 0.6847 0.2193 ( 1154 PWs) bands (ev): -18.1957 -18.1957 -17.7199 -17.7199 -1.9445 -1.9445 -1.5240 -1.5240 -0.4441 -0.4441 0.1435 0.1435 1.9954 1.9954 2.9468 2.9468 13.8488 13.8488 14.3606 14.3606 16.6389 16.6389 17.9392 17.9392 19.8042 19.8042 20.3591 20.3591 25.1652 25.1652 27.7852 27.7852 28.5511 28.5511 29.3090 29.3090 k =-0.2970 0.6847 0.2298 ( 1154 PWs) bands (ev): -18.1838 -18.1838 -17.7315 -17.7315 -1.9241 -1.9241 -1.5404 -1.5404 -0.4849 -0.4849 0.1056 0.1056 2.0575 2.0575 2.9693 2.9693 13.8530 13.8530 14.3452 14.3452 16.6910 16.6910 17.9643 17.9643 19.9145 19.9145 20.3323 20.3323 25.0136 25.0136 27.7311 27.7311 28.3711 28.3711 29.3613 29.3613 k =-0.2970 0.6847 0.2402 ( 1153 PWs) bands (ev): -18.1715 -18.1715 -17.7436 -17.7436 -1.9045 -1.9045 -1.5545 -1.5545 -0.5239 -0.5239 0.0669 0.0669 2.1195 2.1195 2.9893 2.9893 13.8567 13.8567 14.3282 14.3282 16.7466 16.7466 17.9926 17.9926 20.0243 20.0243 20.3027 20.3027 24.8641 24.8641 27.6292 27.6292 28.2498 28.2498 29.4188 29.4188 k =-0.2970 0.6847 0.2507 ( 1151 PWs) bands (ev): -18.1588 -18.1588 -17.7560 -17.7560 -1.8860 -1.8860 -1.5658 -1.5658 -0.5610 -0.5610 0.0278 0.0278 2.1809 2.1809 3.0067 3.0067 13.8603 13.8603 14.3097 14.3097 16.8058 16.8058 18.0230 18.0230 20.1322 20.1322 20.2718 20.2718 24.7191 24.7191 27.4699 27.4699 28.1971 28.1971 29.4795 29.4795 k =-0.2970 0.6847 0.2611 ( 1151 PWs) bands (ev): -18.1458 -18.1458 -17.7688 -17.7688 -1.8690 -1.8690 -1.5744 -1.5744 -0.5956 -0.5956 -0.0117 -0.0117 2.2415 2.2415 3.0213 3.0213 13.8638 13.8638 14.2899 14.2899 16.8683 16.8683 18.0541 18.0541 20.2295 20.2295 20.2483 20.2483 24.5813 24.5813 27.2710 27.2710 28.1954 28.1954 29.5408 29.5408 k =-0.2970 0.6847 0.2716 ( 1153 PWs) bands (ev): -18.1325 -18.1325 -17.7819 -17.7819 -1.8538 -1.8538 -1.5801 -1.5801 -0.6277 -0.6277 -0.0511 -0.0511 2.3010 2.3010 3.0330 3.0330 13.8672 13.8672 14.2692 14.2692 16.9340 16.9340 18.0842 18.0842 20.2102 20.2102 20.3379 20.3379 24.4535 24.4535 27.0524 27.0524 28.2245 28.2245 29.6003 29.6003 k =-0.2970 0.6847 0.2820 ( 1149 PWs) bands (ev): -18.1189 -18.1189 -17.7953 -17.7953 -1.8408 -1.8408 -1.5829 -1.5829 -0.6568 -0.6568 -0.0902 -0.0902 2.3592 2.3592 3.0417 3.0417 13.8707 13.8707 14.2480 14.2480 17.0027 17.0027 18.1115 18.1115 20.1853 20.1853 20.4297 20.4297 24.3386 24.3386 26.8255 26.8255 28.2730 28.2730 29.6549 29.6549 k =-0.2970 0.6847 0.2924 ( 1149 PWs) bands (ev): -18.1050 -18.1050 -17.8090 -17.8090 -1.8301 -1.8301 -1.5829 -1.5829 -0.6829 -0.6829 -0.1287 -0.1287 2.4156 2.4156 3.0473 3.0473 13.8744 13.8744 14.2264 14.2264 17.0741 17.0741 18.1340 18.1340 20.1661 20.1661 20.5119 20.5119 24.2399 24.2399 26.5959 26.5959 28.3351 28.3351 29.7011 29.7011 k =-0.2970 0.6847 0.3029 ( 1146 PWs) bands (ev): -18.0908 -18.0908 -17.8229 -17.8229 -1.8217 -1.8217 -1.5805 -1.5805 -0.7057 -0.7057 -0.1661 -0.1661 2.4701 2.4701 3.0500 3.0500 13.8782 13.8782 14.2049 14.2049 17.1480 17.1480 18.1498 18.1498 20.1548 20.1548 20.5818 20.5818 24.1605 24.1605 26.3668 26.3668 28.4076 28.4076 29.7352 29.7352 k =-0.2970 0.6847 0.3133 ( 1143 PWs) bands (ev): -18.0765 -18.0765 -17.8371 -17.8371 -1.8153 -1.8153 -1.5763 -1.5763 -0.7251 -0.7251 -0.2020 -0.2020 2.5224 2.5224 3.0496 3.0496 13.8824 13.8824 14.1839 14.1839 17.2240 17.2240 18.1571 18.1571 20.1532 20.1532 20.6369 20.6369 24.1034 24.1034 26.1402 26.1402 28.4882 28.4882 29.7536 29.7536 k =-0.2970 0.6847 0.3238 ( 1143 PWs) bands (ev): -18.0619 -18.0619 -17.8516 -17.8516 -1.8106 -1.8106 -1.5708 -1.5708 -0.7411 -0.7411 -0.2360 -0.2360 2.5720 2.5720 3.0463 3.0463 13.8868 13.8868 14.1635 14.1635 17.3016 17.3016 18.1545 18.1545 20.1625 20.1625 20.6751 20.6751 24.0713 24.0713 25.9175 25.9175 28.5754 28.5754 29.7534 29.7534 k =-0.2970 0.6847 0.3342 ( 1145 PWs) bands (ev): -18.0471 -18.0471 -17.8662 -17.8662 -1.8073 -1.8073 -1.5648 -1.5648 -0.7537 -0.7537 -0.2675 -0.2675 2.6187 2.6187 3.0403 3.0403 13.8915 13.8915 14.1443 14.1443 17.3804 17.3804 18.1412 18.1412 20.1834 20.1834 20.6952 20.6952 24.0661 24.0661 25.7000 25.7000 28.6677 28.6677 29.7333 29.7333 k =-0.2970 0.6847 0.3447 ( 1145 PWs) bands (ev): -18.0322 -18.0322 -17.8810 -17.8810 -1.8051 -1.8051 -1.5588 -1.5588 -0.7633 -0.7633 -0.2959 -0.2959 2.6618 2.6618 3.0318 3.0318 13.8963 13.8963 14.1267 14.1267 17.4597 17.4597 18.1170 18.1170 20.2157 20.2157 20.6969 20.6969 24.0886 24.0886 25.4888 25.4888 28.7640 28.7640 29.6941 29.6941 k =-0.2970 0.6847 0.3551 ( 1145 PWs) bands (ev): -18.0172 -18.0172 -17.8959 -17.8959 -1.8036 -1.8036 -1.5533 -1.5533 -0.7701 -0.7701 -0.3206 -0.3206 2.7007 2.7007 3.0215 3.0215 13.9011 13.9011 14.1111 14.1111 17.5387 17.5387 18.0824 18.0824 20.2584 20.2584 20.6811 20.6811 24.1385 24.1385 25.2853 25.2853 28.8628 28.8628 29.6382 29.6382 k =-0.2970 0.6847 0.3655 ( 1145 PWs) bands (ev): -18.0021 -18.0021 -17.9109 -17.9109 -1.8026 -1.8026 -1.5487 -1.5487 -0.7745 -0.7745 -0.3408 -0.3408 2.7345 2.7345 3.0101 3.0101 13.9055 13.9055 14.0980 14.0980 17.6166 17.6166 18.0384 18.0384 20.3098 20.3098 20.6497 20.6497 24.2146 24.2146 25.0908 25.0908 28.9624 28.9624 29.5691 29.5691 k =-0.2970 0.6847 0.3760 ( 1141 PWs) bands (ev): -17.9869 -17.9869 -17.9260 -17.9260 -1.8020 -1.8020 -1.5453 -1.5453 -0.7772 -0.7772 -0.3559 -0.3559 2.7614 2.7614 2.9992 2.9992 13.9092 13.9092 14.0880 14.0880 17.6915 17.6915 17.9873 17.9873 20.3676 20.3676 20.6058 20.6058 24.3148 24.3148 24.9068 24.9068 29.0601 29.0601 29.4916 29.4916 k =-0.2970 0.6847 0.3864 ( 1141 PWs) bands (ev): -17.9717 -17.9717 -17.9412 -17.9412 -1.8016 -1.8016 -1.5432 -1.5432 -0.7786 -0.7786 -0.3652 -0.3652 2.7793 2.7793 2.9910 2.9910 13.9117 13.9117 14.0817 14.0817 17.7592 17.7592 17.9338 17.9338 20.4289 20.4289 20.5524 20.5524 24.4366 24.4366 24.7351 24.7351 29.1483 29.1483 29.4149 29.4149 k =-0.2970 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9565 -17.9565 -17.9564 -17.9564 -1.8015 -1.8015 -1.5425 -1.5425 -0.7790 -0.7790 -0.3683 -0.3683 2.7857 2.7857 2.9878 2.9878 13.9125 13.9125 14.0796 14.0796 17.7963 17.7963 17.9013 17.9013 20.4828 20.4828 20.5011 20.5011 24.5729 24.5729 24.5823 24.5823 29.1944 29.1944 29.3724 29.3724 k =-0.2970 0.6847 0.3969 ( 1142 PWs) bands (ev): -17.9565 -17.9565 -17.9564 -17.9564 -1.8015 -1.8015 -1.5425 -1.5425 -0.7790 -0.7790 -0.3683 -0.3683 2.7857 2.7857 2.9878 2.9878 13.9125 13.9125 14.0796 14.0796 17.7963 17.7963 17.9013 17.9013 20.4828 20.4828 20.5011 20.5011 24.5729 24.5729 24.5823 24.5823 29.1944 29.1944 29.3724 29.3724 k =-0.3012 0.6752 0.3969 ( 1144 PWs) bands (ev): -17.9655 -17.9655 -17.9654 -17.9654 -1.7868 -1.7868 -1.5120 -1.5120 -0.8144 -0.8144 -0.3896 -0.3896 2.7957 2.7957 2.9958 2.9958 13.9893 13.9893 14.1598 14.1598 17.8311 17.8311 17.9412 17.9412 20.4212 20.4212 20.4395 20.4395 24.7008 24.7008 24.7106 24.7106 29.1718 29.1718 29.3468 29.3468 k =-0.3053 0.6656 0.3969 ( 1148 PWs) bands (ev): -17.9754 -17.9754 -17.9753 -17.9753 -1.7743 -1.7743 -1.4860 -1.4860 -0.8414 -0.8414 -0.4044 -0.4044 2.8047 2.8047 3.0029 3.0029 14.0688 14.0688 14.2429 14.2429 17.8602 17.8602 17.9753 17.9753 20.3662 20.3662 20.3840 20.3840 24.8341 24.8341 24.8444 24.8444 29.1382 29.1382 29.3090 29.3090 k =-0.3095 0.6561 0.3969 ( 1148 PWs) bands (ev): -17.9862 -17.9862 -17.9861 -17.9861 -1.7649 -1.7649 -1.4674 -1.4674 -0.8570 -0.8570 -0.4120 -0.4120 2.8129 2.8129 3.0093 3.0093 14.1511 14.1511 14.3287 14.3287 17.8831 17.8831 18.0026 18.0026 20.3189 20.3189 20.3356 20.3356 24.9726 24.9726 24.9831 24.9831 29.0930 29.0930 29.2582 29.2582 k =-0.3136 0.6466 0.3969 ( 1148 PWs) bands (ev): -17.9979 -17.9979 -17.9978 -17.9978 -1.7593 -1.7593 -1.4590 -1.4590 -0.8582 -0.8582 -0.4115 -0.4115 2.8201 2.8201 3.0149 3.0149 14.2358 14.2358 14.4171 14.4171 17.8989 17.8989 18.0224 18.0224 20.2801 20.2801 20.2951 20.2951 25.1157 25.1157 25.1266 25.1266 29.0356 29.0356 29.1938 29.1938 k =-0.3178 0.6370 0.3969 ( 1148 PWs) bands (ev): -18.0103 -18.0103 -18.0102 -18.0102 -1.7583 -1.7583 -1.4629 -1.4629 -0.8434 -0.8434 -0.4024 -0.4024 2.8265 2.8265 3.0197 3.0197 14.3227 14.3227 14.5077 14.5077 17.9072 17.9072 18.0339 18.0339 20.2506 20.2506 20.2631 20.2631 25.2632 25.2632 25.2743 25.2743 28.9658 28.9658 29.1155 29.1155 k =-0.3219 0.6275 0.3969 ( 1152 PWs) bands (ev): -18.0236 -18.0236 -18.0234 -18.0234 -1.7622 -1.7622 -1.4787 -1.4787 -0.8125 -0.8125 -0.3842 -0.3842 2.8321 2.8321 3.0239 3.0239 14.4116 14.4116 14.6003 14.6003 17.9074 17.9074 18.0369 18.0369 20.2309 20.2309 20.2400 20.2400 25.4147 25.4147 25.4260 25.4260 28.8834 28.8834 29.0235 29.0235 k =-0.3260 0.6179 0.3969 ( 1148 PWs) bands (ev): -18.0375 -18.0375 -18.0373 -18.0373 -1.7713 -1.7713 -1.5049 -1.5049 -0.7675 -0.7675 -0.3569 -0.3569 2.8369 2.8369 3.0274 3.0274 14.5023 14.5023 14.6948 14.6948 17.8994 17.8994 18.0309 18.0309 20.2212 20.2212 20.2262 20.2262 25.5699 25.5699 25.5815 25.5815 28.7889 28.7889 28.9183 28.9183 k =-0.3302 0.6084 0.3969 ( 1152 PWs) bands (ev): -18.0520 -18.0520 -18.0519 -18.0519 -1.7854 -1.7854 -1.5391 -1.5391 -0.7106 -0.7106 -0.3204 -0.3204 2.8409 2.8409 3.0302 3.0302 14.5943 14.5943 14.7908 14.7908 17.8832 17.8832 18.0162 18.0162 20.2214 20.2214 20.2214 20.2214 25.7284 25.7284 25.7401 25.7401 28.6828 28.6828 28.8009 28.8009 k =-0.3343 0.5988 0.3969 ( 1152 PWs) bands (ev): -18.0672 -18.0672 -18.0670 -18.0670 -1.8043 -1.8043 -1.5789 -1.5789 -0.6443 -0.6443 -0.2753 -0.2753 2.8441 2.8441 3.0325 3.0325 14.6876 14.6876 14.8881 14.8881 17.8591 17.8591 17.9931 17.9931 20.2253 20.2253 20.2309 20.2309 25.8897 25.8897 25.9017 25.9017 28.5664 28.5664 28.6729 28.6729 k =-0.3385 0.5893 0.3969 ( 1146 PWs) bands (ev): -18.0829 -18.0829 -18.0827 -18.0827 -1.8275 -1.8275 -1.6227 -1.6227 -0.5703 -0.5703 -0.2219 -0.2219 2.8467 2.8467 3.0342 3.0342 14.7817 14.7817 14.9863 14.9863 17.8277 17.8277 17.9623 17.9623 20.2373 20.2373 20.2490 20.2490 26.0536 26.0536 26.0657 26.0657 28.4411 28.4411 28.5361 28.5361 k =-0.3426 0.5797 0.3969 ( 1150 PWs) bands (ev): -18.0990 -18.0990 -18.0989 -18.0989 -1.8547 -1.8547 -1.6692 -1.6692 -0.4901 -0.4901 -0.1608 -0.1608 2.8486 2.8486 3.0355 3.0355 14.8761 14.8761 15.0851 15.0851 17.7895 17.7895 17.9246 17.9246 20.2564 20.2564 20.2746 20.2746 26.2192 26.2192 26.2316 26.2316 28.3089 28.3089 28.3927 28.3927 k =-0.3468 0.5702 0.3969 ( 1150 PWs) bands (ev): -18.1156 -18.1156 -18.1155 -18.1155 -1.8850 -1.8850 -1.7174 -1.7174 -0.4046 -0.4046 -0.0929 -0.0929 2.8500 2.8500 3.0363 3.0363 14.9707 14.9707 15.1841 15.1841 17.7455 17.7455 17.8810 17.8810 20.2818 20.2818 20.3067 20.3067 26.3860 26.3860 26.3987 26.3987 28.1720 28.1720 28.2453 28.2453 k =-0.3509 0.5606 0.3969 ( 1150 PWs) bands (ev): -18.1326 -18.1326 -18.1324 -18.1324 -1.9181 -1.9181 -1.7666 -1.7666 -0.3147 -0.3147 -0.0186 -0.0186 2.8508 2.8508 3.0367 3.0367 15.0648 15.0648 15.2828 15.2828 17.6965 17.6965 17.8327 17.8327 20.3122 20.3122 20.3438 20.3438 26.5527 26.5527 26.5659 26.5659 28.0333 28.0333 28.0966 28.0966 k =-0.3550 0.5511 0.3969 ( 1154 PWs) bands (ev): -18.1499 -18.1499 -18.1497 -18.1497 -1.9533 -1.9533 -1.8164 -1.8164 -0.2210 -0.2210 0.0612 0.0612 2.8511 2.8511 3.0368 3.0368 15.1579 15.1579 15.3807 15.3807 17.6437 17.6437 17.7808 17.7808 20.3464 20.3464 20.3847 20.3847 26.7173 26.7173 26.7312 26.7312 27.8966 27.8966 27.9504 27.9504 k =-0.3592 0.5415 0.3969 ( 1158 PWs) bands (ev): -18.1674 -18.1674 -18.1672 -18.1672 -1.9902 -1.9902 -1.8663 -1.8663 -0.1241 -0.1241 0.1461 0.1461 2.8510 2.8510 3.0367 3.0367 15.2496 15.2496 15.4773 15.4773 17.5881 17.5881 17.7263 17.7263 20.3833 20.3833 20.4281 20.4281 26.8755 26.8755 26.8909 26.8909 27.7677 27.7677 27.8122 27.8122 k =-0.3633 0.5320 0.3969 ( 1158 PWs) bands (ev): -18.1851 -18.1851 -18.1849 -18.1849 -2.0284 -2.0284 -1.9160 -1.9160 -0.0244 -0.0244 0.2354 0.2354 2.8505 2.8505 3.0364 3.0364 15.3390 15.3390 15.5717 15.5717 17.5310 17.5310 17.6707 17.6707 20.4217 20.4217 20.4726 20.4726 27.0167 27.0167 27.0351 27.0351 27.6590 27.6590 27.6935 27.6935 k =-0.3675 0.5224 0.3969 ( 1158 PWs) bands (ev): -18.2029 -18.2029 -18.2027 -18.2027 -2.0675 -2.0675 -1.9654 -1.9654 0.0777 0.0777 0.3285 0.3285 2.8497 2.8497 3.0361 3.0361 15.4254 15.4254 15.6631 15.6631 17.4734 17.4734 17.6149 17.6149 20.4603 20.4603 20.5170 20.5170 27.1123 27.1123 27.1365 27.1365 27.6005 27.6005 27.6230 27.6230 k =-0.3716 0.5129 0.3969 ( 1162 PWs) bands (ev): -18.2208 -18.2208 -18.2207 -18.2207 -2.1072 -2.1072 -2.0143 -2.0143 0.1818 0.1818 0.4250 0.4250 2.8487 2.8487 3.0357 3.0357 15.5079 15.5079 15.7503 15.7503 17.4170 17.4170 17.5603 17.5603 20.4980 20.4980 20.5601 20.5601 27.1202 27.1202 27.1491 27.1491 27.6357 27.6357 27.6482 27.6482 k =-0.3757 0.5033 0.3969 ( 1168 PWs) bands (ev): -18.2388 -18.2388 -18.2386 -18.2386 -2.1471 -2.1471 -2.0624 -2.0624 0.2876 0.2876 0.5243 0.5243 2.8476 2.8476 3.0354 3.0354 15.5852 15.5852 15.8319 15.8319 17.3633 17.3633 17.5083 17.5083 20.5335 20.5335 20.6006 20.6006 27.0562 27.0562 27.0840 27.0840 27.7500 27.7500 27.7589 27.7589 k =-0.3799 0.4938 0.3969 ( 1172 PWs) bands (ev): -18.2567 -18.2567 -18.2565 -18.2565 -2.1871 -2.1871 -2.1098 -2.1098 0.3946 0.3946 0.6260 0.6260 2.8464 2.8464 3.0352 3.0352 15.6562 15.6562 15.9061 15.9061 17.3142 17.3142 17.4604 17.4604 20.5661 20.5661 20.6377 20.6377 26.9670 26.9670 26.9917 26.9917 27.8979 27.8979 27.9057 27.9057 k =-0.3840 0.4842 0.3969 ( 1172 PWs) bands (ev): -18.2745 -18.2745 -18.2743 -18.2743 -2.2268 -2.2268 -2.1561 -2.1561 0.5026 0.5026 0.7295 0.7295 2.8453 2.8453 3.0354 3.0354 15.7194 15.7194 15.9708 15.9708 17.2722 17.2722 17.4180 17.4180 20.5946 20.5946 20.6701 20.6701 26.8752 26.8752 26.8969 26.8969 28.0575 28.0575 28.0649 28.0649 k =-0.3882 0.4747 0.3969 ( 1168 PWs) bands (ev): -18.2922 -18.2922 -18.2920 -18.2920 -2.2662 -2.2662 -2.2014 -2.2014 0.6110 0.6110 0.8345 0.8345 2.8444 2.8444 3.0359 3.0359 15.7733 15.7733 16.0236 16.0236 17.2396 17.2396 17.3828 17.3828 20.6183 20.6183 20.6971 20.6971 26.7895 26.7895 26.8088 26.8088 28.2207 28.2207 28.2278 28.2278 k =-0.3923 0.4651 0.3969 ( 1168 PWs) bands (ev): -18.3097 -18.3097 -18.3095 -18.3095 -2.3050 -2.3050 -2.2457 -2.2457 0.7197 0.7197 0.9404 0.9404 2.8437 2.8437 3.0369 3.0369 15.8161 15.8161 16.0617 16.0617 17.2192 17.2192 17.3565 17.3565 20.6363 20.6363 20.7179 20.7179 26.7142 26.7142 26.7317 26.7317 28.3838 28.3838 28.3904 28.3904 k =-0.3965 0.4556 0.3969 ( 1156 PWs) bands (ev): -18.3270 -18.3270 -18.3268 -18.3268 -2.3432 -2.3432 -2.2887 -2.2887 0.8281 0.8281 1.0469 1.0469 2.8435 2.8435 3.0386 3.0386 15.8468 15.8468 16.0834 16.0834 17.2129 17.2129 17.3406 17.3406 20.6483 20.6483 20.7319 20.7319 26.6515 26.6515 26.6678 26.6678 28.5446 28.5446 28.5505 28.5505 k =-0.4006 0.4460 0.3969 ( 1156 PWs) bands (ev): -18.3439 -18.3439 -18.3438 -18.3438 -2.3805 -2.3805 -2.3304 -2.3304 0.9357 0.9357 1.1532 1.1532 2.8438 2.8438 3.0410 3.0410 15.8640 15.8640 16.0874 16.0874 17.2216 17.2216 17.3357 17.3357 20.6536 20.6536 20.7386 20.7386 26.6029 26.6029 26.6186 26.6186 28.7013 28.7013 28.7064 28.7064 k =-0.4047 0.4365 0.3969 ( 1156 PWs) bands (ev): -18.3606 -18.3606 -18.3605 -18.3605 -2.4169 -2.4169 -2.3708 -2.3708 1.0423 1.0423 1.2589 1.2589 2.8450 2.8450 3.0444 3.0444 15.8677 15.8677 16.0745 16.0745 17.2448 17.2448 17.3423 17.3423 20.6522 20.6522 20.7380 20.7380 26.5692 26.5692 26.5849 26.5849 28.8525 28.8525 28.8566 28.8566 k =-0.4089 0.4270 0.3969 ( 1160 PWs) bands (ev): -18.3769 -18.3769 -18.3767 -18.3767 -2.4522 -2.4522 -2.4099 -2.4099 1.1472 1.1472 1.3634 1.3634 2.8471 2.8471 3.0488 3.0488 15.8583 15.8583 16.0466 16.0466 17.2806 17.2806 17.3599 17.3599 20.6440 20.6440 20.7300 20.7300 26.5510 26.5510 26.5672 26.5672 28.9968 28.9968 28.9998 28.9998 k =-0.4130 0.4174 0.3969 ( 1164 PWs) bands (ev): -18.3927 -18.3927 -18.3926 -18.3926 -2.4865 -2.4865 -2.4475 -2.4475 1.2501 1.2501 1.4661 1.4661 2.8505 2.8505 3.0544 3.0544 15.8368 15.8368 16.0062 16.0062 17.3263 17.3263 17.3874 17.3874 20.6293 20.6293 20.7149 20.7149 26.5484 26.5484 26.5654 26.5654 29.1331 29.1331 29.1347 29.1347 k =-0.4172 0.4079 0.3969 ( 1160 PWs) bands (ev): -18.4081 -18.4081 -18.4080 -18.4080 -2.5195 -2.5195 -2.4837 -2.4837 1.3504 1.3504 1.5664 1.5664 2.8555 2.8555 3.0614 3.0614 15.8050 15.8050 15.9561 15.9561 17.3792 17.3792 17.4232 17.4232 20.6086 20.6086 20.6932 20.6932 26.5614 26.5614 26.5795 26.5795 29.2600 29.2600 29.2602 29.2602 k =-0.4213 0.3983 0.3969 ( 1160 PWs) bands (ev): -18.4231 -18.4231 -18.4229 -18.4229 -2.5512 -2.5512 -2.5183 -2.5183 1.4476 1.4476 1.6635 1.6635 2.8624 2.8624 3.0700 3.0700 15.7646 15.7646 15.8988 15.8988 17.4370 17.4370 17.4656 17.4656 20.5824 20.5824 20.6655 20.6655 26.5893 26.5893 26.6090 26.6090 29.3753 29.3753 29.3767 29.3767 k =-0.4254 0.3888 0.3969 ( 1160 PWs) bands (ev): -18.4374 -18.4374 -18.4373 -18.4373 -2.5816 -2.5816 -2.5514 -2.5514 1.5411 1.5411 1.7565 1.7565 2.8716 2.8716 3.0802 3.0802 15.7173 15.7173 15.8363 15.8363 17.4974 17.4974 17.5128 17.5128 20.5515 20.5515 20.6327 20.6327 26.6318 26.6318 26.6530 26.6530 29.4791 29.4791 29.4821 29.4821 k =-0.4296 0.3792 0.3969 ( 1158 PWs) bands (ev): -18.4512 -18.4512 -18.4511 -18.4511 -2.6107 -2.6107 -2.5829 -2.5829 1.6306 1.6306 1.8448 1.8448 2.8836 2.8836 3.0924 3.0924 15.6649 15.6649 15.7705 15.7705 17.5591 17.5591 17.5633 17.5633 20.5167 20.5167 20.5956 20.5956 26.6878 26.6878 26.7108 26.7108 29.5714 29.5714 29.5758 29.5758 k =-0.4337 0.3697 0.3969 ( 1158 PWs) bands (ev): -18.4644 -18.4644 -18.4643 -18.4643 -2.6382 -2.6382 -2.6128 -2.6128 1.7153 1.7153 1.9273 1.9273 2.8988 2.8988 3.1065 3.1065 15.6088 15.6088 15.7025 15.7025 17.6155 17.6155 17.6205 17.6205 20.4790 20.4790 20.5551 20.5551 26.7565 26.7565 26.7812 26.7812 29.6519 29.6519 29.6575 29.6575 k =-0.4379 0.3601 0.3969 ( 1158 PWs) bands (ev): -18.4770 -18.4770 -18.4769 -18.4769 -2.6643 -2.6643 -2.6411 -2.6411 1.7950 1.7950 2.0033 2.0033 2.9176 2.9176 3.1227 3.1227 15.5505 15.5505 15.6337 15.6337 17.6684 17.6684 17.6808 17.6808 20.4391 20.4391 20.5123 20.5123 26.8368 26.8368 26.8631 26.8631 29.7210 29.7210 29.7274 29.7274 k =-0.4420 0.3506 0.3969 ( 1162 PWs) bands (ev): -18.4889 -18.4889 -18.4888 -18.4888 -2.6889 -2.6889 -2.6677 -2.6677 1.8692 1.8692 2.0719 2.0719 2.9405 2.9405 3.1409 3.1409 15.4910 15.4910 15.5649 15.5649 17.7210 17.7210 17.7391 17.7391 20.3981 20.3981 20.4680 20.4680 26.9275 26.9275 26.9553 26.9553 29.7792 29.7792 29.7860 29.7860 k =-0.4462 0.3410 0.3969 ( 1158 PWs) bands (ev): -18.5000 -18.5000 -18.4999 -18.4999 -2.7118 -2.7118 -2.6926 -2.6926 1.9376 1.9376 2.1325 2.1325 2.9676 2.9676 3.1609 3.1609 15.4314 15.4314 15.4971 15.4971 17.7725 17.7725 17.7948 17.7948 20.3569 20.3569 20.4231 20.4231 27.0274 27.0274 27.0564 27.0564 29.8274 29.8274 29.8344 29.8344 k =-0.4503 0.3315 0.3969 ( 1158 PWs) bands (ev): -18.5105 -18.5105 -18.5104 -18.5104 -2.7331 -2.7331 -2.7157 -2.7157 2.0001 2.0001 2.1850 2.1850 2.9987 2.9987 3.1826 3.1826 15.3727 15.3727 15.4310 15.4310 17.8221 17.8221 17.8474 17.8474 20.3162 20.3162 20.3786 20.3786 27.1349 27.1349 27.1649 27.1649 29.8667 29.8667 29.8735 29.8735 k =-0.4544 0.3219 0.3969 ( 1168 PWs) bands (ev): -18.5202 -18.5202 -18.5201 -18.5201 -2.7529 -2.7529 -2.7372 -2.7372 2.0564 2.0564 2.2292 2.2292 3.0332 3.0332 3.2056 3.2056 15.3156 15.3156 15.3672 15.3672 17.8693 17.8693 17.8963 17.8963 20.2767 20.2767 20.3350 20.3350 27.2487 27.2487 27.2794 27.2794 29.8982 29.8982 29.9046 29.9046 k =-0.4586 0.3124 0.3969 ( 1172 PWs) bands (ev): -18.5292 -18.5292 -18.5291 -18.5291 -2.7709 -2.7709 -2.7569 -2.7569 2.1068 2.1068 2.2657 2.2657 3.0706 3.0706 3.2294 3.2294 15.2609 15.2609 15.3064 15.3064 17.9137 17.9137 17.9416 17.9416 20.2391 20.2391 20.2932 20.2932 27.3672 27.3672 27.3982 27.3982 29.9231 29.9231 29.9291 29.9291 k =-0.4627 0.3028 0.3969 ( 1176 PWs) bands (ev): -18.5373 -18.5373 -18.5373 -18.5373 -2.7873 -2.7873 -2.7748 -2.7748 2.1515 2.1515 2.2951 2.2951 3.1095 3.1095 3.2534 3.2534 15.2094 15.2094 15.2492 15.2492 17.9549 17.9549 17.9827 17.9827 20.2041 20.2041 20.2536 20.2536 27.4886 27.4886 27.5194 27.5194 29.9424 29.9424 29.9481 29.9481 k =-0.4669 0.2933 0.3969 ( 1172 PWs) bands (ev): -18.5447 -18.5447 -18.5446 -18.5446 -2.8018 -2.8018 -2.7909 -2.7909 2.1906 2.1906 2.3181 2.3181 3.1490 3.1490 3.2768 3.2768 15.1617 15.1617 15.1962 15.1962 17.9928 17.9928 18.0196 18.0196 20.1721 20.1721 20.2168 20.2168 27.6109 27.6109 27.6410 27.6410 29.9572 29.9572 29.9626 29.9626 k =-0.4710 0.2837 0.3969 ( 1172 PWs) bands (ev): -18.5512 -18.5512 -18.5511 -18.5511 -2.8147 -2.8147 -2.8053 -2.8053 2.2247 2.2247 2.3356 2.3356 3.1876 3.1876 3.2990 3.2990 15.1183 15.1183 15.1479 15.1479 18.0269 18.0269 18.0520 18.0520 20.1434 20.1434 20.1831 20.1831 27.7316 27.7316 27.7605 27.7605 29.9684 29.9684 29.9735 29.9735 k =-0.4751 0.2742 0.3969 ( 1172 PWs) bands (ev): -18.5569 -18.5569 -18.5568 -18.5568 -2.8258 -2.8258 -2.8178 -2.8178 2.2540 2.2540 2.3483 2.3483 3.2244 3.2244 3.3192 3.3192 15.0798 15.0798 15.1048 15.1048 18.0570 18.0570 18.0798 18.0798 20.1185 20.1185 20.1530 20.1530 27.8482 27.8482 27.8751 27.8751 29.9765 29.9765 29.9815 29.9815 k =-0.4793 0.2646 0.3969 ( 1160 PWs) bands (ev): -18.5617 -18.5617 -18.5617 -18.5617 -2.8351 -2.8351 -2.8285 -2.8285 2.2792 2.2792 2.3570 2.3570 3.2582 3.2582 3.3366 3.3366 15.0468 15.0468 15.0673 15.0673 18.0832 18.0832 18.1030 18.1030 20.0976 20.0976 20.1267 20.1267 27.9575 27.9575 27.9818 27.9818 29.9825 29.9825 29.9872 29.9872 k =-0.4834 0.2551 0.3969 ( 1164 PWs) bands (ev): -18.5657 -18.5657 -18.5656 -18.5656 -2.8426 -2.8426 -2.8374 -2.8374 2.3004 2.3004 2.3621 2.3621 3.2884 3.2884 3.3506 3.3506 15.0194 15.0194 15.0357 15.0357 18.1051 18.1051 18.1216 18.1216 20.0808 20.0808 20.1043 20.1043 28.0558 28.0558 28.0766 28.0766 29.9866 29.9866 29.9909 29.9909 k =-0.4876 0.2455 0.3969 ( 1164 PWs) bands (ev): -18.5687 -18.5687 -18.5687 -18.5687 -2.8483 -2.8483 -2.8444 -2.8444 2.3182 2.3182 2.3640 2.3640 3.3141 3.3141 3.3604 3.3604 14.9982 14.9982 15.0103 15.0103 18.1228 18.1228 18.1355 18.1355 20.0683 20.0683 20.0861 20.0861 28.1391 28.1391 28.1558 28.1558 29.9894 29.9894 29.9930 29.9930 k =-0.4917 0.2360 0.3969 ( 1172 PWs) bands (ev): -18.5710 -18.5710 -18.5709 -18.5709 -2.8523 -2.8523 -2.8497 -2.8497 2.3327 2.3327 2.3631 2.3631 3.3349 3.3349 3.3656 3.3656 14.9835 14.9835 14.9915 14.9915 18.1360 18.1360 18.1447 18.1447 20.0601 20.0601 20.0720 20.0720 28.2034 28.2034 28.2150 28.2150 29.9913 29.9913 29.9940 29.9940 k =-0.4959 0.2265 0.3969 ( 1172 PWs) bands (ev): -18.5723 -18.5723 -18.5723 -18.5723 -2.8544 -2.8544 -2.8531 -2.8531 2.3443 2.3443 2.3595 2.3595 3.3506 3.3506 3.3659 3.3659 14.9753 14.9753 14.9793 14.9793 18.1450 18.1450 18.1493 18.1493 20.0564 20.0564 20.0624 20.0624 28.2451 28.2451 28.2511 28.2511 29.9927 29.9927 29.9941 29.9941 k =-0.5000 0.2169 0.3969 ( 1172 PWs) bands (ev): -18.5727 -18.5727 -18.5727 -18.5727 -2.8546 -2.8546 -2.8546 -2.8546 2.3532 2.3532 2.3532 2.3532 3.3609 3.3609 3.3609 3.3609 14.9739 14.9739 14.9739 14.9739 18.1494 18.1494 18.1494 18.1494 20.0572 20.0572 20.0572 20.0572 28.2613 28.2613 28.2613 28.2613 29.9936 29.9936 29.9936 29.9936 k =-0.5000 0.2169 0.3969 ( 1172 PWs) bands (ev): -18.5727 -18.5727 -18.5727 -18.5727 -2.8546 -2.8546 -2.8546 -2.8546 2.3532 2.3532 2.3532 2.3532 3.3609 3.3609 3.3609 3.3609 14.9739 14.9739 14.9739 14.9739 18.1494 18.1494 18.1494 18.1494 20.0572 20.0572 20.0572 20.0572 28.2613 28.2613 28.2613 28.2613 29.9936 29.9936 29.9936 29.9936 k =-0.5000 0.2169 0.3864 ( 1172 PWs) bands (ev): -18.5806 -18.5806 -18.5649 -18.5649 -2.8588 -2.8588 -2.8473 -2.8473 2.3390 2.3390 2.3633 2.3633 3.3449 3.3449 3.3752 3.3752 14.9514 14.9514 14.9992 14.9992 18.1310 18.1310 18.1721 18.1721 19.9441 19.9441 20.1718 20.1718 28.1433 28.1433 28.3819 28.3819 29.9409 29.9409 30.0474 30.0474 k =-0.5000 0.2169 0.3760 ( 1172 PWs) bands (ev): -18.5886 -18.5886 -18.5572 -18.5572 -2.8598 -2.8598 -2.8368 -2.8368 2.3206 2.3206 2.3690 2.3690 3.3269 3.3269 3.3877 3.3877 14.9315 14.9315 15.0275 15.0275 18.1166 18.1166 18.1994 18.1994 19.8327 19.8327 20.2874 20.2874 28.0280 28.0280 28.5051 28.5051 29.8892 29.8892 30.1021 30.1021 k =-0.5000 0.2169 0.3655 ( 1172 PWs) bands (ev): -18.5966 -18.5966 -18.5496 -18.5496 -2.8576 -2.8576 -2.8232 -2.8232 2.2981 2.2981 2.3704 2.3704 3.3071 3.3071 3.3987 3.3987 14.9139 14.9139 15.0590 15.0590 18.1059 18.1059 18.2313 18.2313 19.7234 19.7234 20.4036 20.4036 27.9153 27.9153 28.6308 28.6308 29.8388 29.8388 30.1579 30.1579 k =-0.5000 0.2169 0.3551 ( 1164 PWs) bands (ev): -18.6047 -18.6047 -18.5421 -18.5421 -2.8521 -2.8521 -2.8065 -2.8065 2.2715 2.2715 2.3673 2.3673 3.2853 3.2853 3.4085 3.4085 14.8983 14.8983 15.0941 15.0941 18.0988 18.0988 18.2679 18.2679 19.6167 19.6167 20.5202 20.5202 27.8055 27.8055 28.7589 28.7589 29.7896 29.7896 30.2145 30.2145 k =-0.5000 0.2169 0.3447 ( 1164 PWs) bands (ev): -18.6127 -18.6127 -18.5347 -18.5347 -2.8435 -2.8435 -2.7868 -2.7868 2.2407 2.2407 2.3596 2.3596 3.2616 3.2616 3.4173 3.4173 14.8844 14.8844 15.1325 15.1325 18.0949 18.0949 18.3093 18.3093 19.5129 19.5129 20.6366 20.6366 27.6984 27.6984 28.8892 28.8892 29.7414 29.7414 30.2718 30.2718 k =-0.5000 0.2169 0.3342 ( 1164 PWs) bands (ev): -18.6208 -18.6208 -18.5275 -18.5275 -2.8316 -2.8316 -2.7642 -2.7642 2.2057 2.2057 2.3474 2.3474 3.2362 3.2362 3.4253 3.4253 14.8719 14.8719 15.1746 15.1746 18.0938 18.0938 18.3550 18.3550 19.4127 19.4127 20.7525 20.7525 27.5941 27.5941 29.0217 29.0217 29.6945 29.6945 30.3298 30.3298 k =-0.5000 0.2169 0.3238 ( 1170 PWs) bands (ev): -18.6289 -18.6289 -18.5204 -18.5204 -2.8165 -2.8165 -2.7386 -2.7386 2.1663 2.1663 2.3307 2.3307 3.2092 3.2092 3.4330 3.4330 14.8604 14.8604 15.2203 15.2203 18.0952 18.0952 18.4046 18.4046 19.3169 19.3169 20.8673 20.8673 27.4926 27.4926 29.1560 29.1560 29.6487 29.6487 30.3878 30.3878 k =-0.5000 0.2169 0.3133 ( 1170 PWs) bands (ev): -18.6369 -18.6369 -18.5135 -18.5135 -2.7982 -2.7982 -2.7102 -2.7102 2.1225 2.1225 2.3095 2.3095 3.1807 3.1807 3.4404 3.4404 14.8499 14.8499 15.2697 15.2697 18.0989 18.0989 18.4571 18.4571 19.2268 19.2268 20.9807 20.9807 27.3940 27.3940 29.2921 29.2921 29.6042 29.6042 30.4337 30.4337 k =-0.5000 0.2169 0.3029 ( 1170 PWs) bands (ev): -18.6449 -18.6449 -18.5068 -18.5068 -2.7766 -2.7766 -2.6789 -2.6789 2.0740 2.0740 2.2841 2.2841 3.1510 3.1510 3.4478 3.4478 14.8401 14.8401 15.3227 15.3227 18.1046 18.1046 18.5100 18.5100 19.1449 19.1449 21.0922 21.0922 27.2983 27.2983 29.4288 29.4288 29.5609 29.5609 30.3910 30.3910 k =-0.5000 0.2169 0.2924 ( 1170 PWs) bands (ev): -18.6528 -18.6528 -18.5003 -18.5003 -2.7519 -2.7519 -2.6449 -2.6449 2.0209 2.0209 2.2544 2.2544 3.1201 3.1201 3.4556 3.4556 14.8306 14.8306 15.3793 15.3793 18.1119 18.1119 18.5589 18.5589 19.0758 19.0758 21.2012 21.2012 27.2055 27.2055 29.5185 29.5185 29.5656 29.5656 30.3497 30.3497 k =-0.5000 0.2169 0.2820 ( 1166 PWs) bands (ev): -18.6606 -18.6606 -18.4939 -18.4939 -2.7240 -2.7240 -2.6083 -2.6083 1.9631 1.9631 2.2208 2.2208 3.0885 3.0885 3.4636 3.4636 14.8214 14.8214 15.4393 15.4393 18.1206 18.1206 18.5950 18.5950 19.0282 19.0282 21.3073 21.3073 27.1157 27.1157 29.4779 29.4779 29.6992 29.6992 30.3135 30.3135 k =-0.5000 0.2169 0.2716 ( 1162 PWs) bands (ev): -18.6684 -18.6684 -18.4877 -18.4877 -2.6930 -2.6930 -2.5690 -2.5690 1.9005 1.9005 2.1835 2.1835 3.0563 3.0563 3.4721 3.4721 14.8123 14.8123 15.5026 15.5026 18.1304 18.1304 18.6056 18.6056 19.0148 19.0148 21.4098 21.4098 27.0289 27.0289 29.4383 29.4383 29.8244 29.8244 30.2879 30.2879 k =-0.5000 0.2169 0.2611 ( 1162 PWs) bands (ev): -18.6760 -18.6760 -18.4818 -18.4818 -2.6588 -2.6588 -2.5273 -2.5273 1.8334 1.8334 2.1425 2.1425 3.0237 3.0237 3.4811 3.4811 14.8032 14.8032 15.5691 15.5691 18.1408 18.1408 18.5845 18.5845 19.0416 19.0416 21.5083 21.5083 26.9451 26.9451 29.3999 29.3999 29.9272 29.9272 30.2840 30.2840 k =-0.5000 0.2169 0.2507 ( 1162 PWs) bands (ev): -18.6835 -18.6835 -18.4761 -18.4761 -2.6217 -2.6217 -2.4832 -2.4832 1.7617 1.7617 2.0980 2.0980 2.9912 2.9912 3.4906 3.4906 14.7939 14.7939 15.6385 15.6385 18.1517 18.1517 18.5401 18.5401 19.1001 19.1001 21.6023 21.6023 26.8643 26.8643 29.3628 29.3628 29.9853 29.9853 30.3066 30.3066 k =-0.5000 0.2169 0.2402 ( 1166 PWs) bands (ev): -18.6908 -18.6908 -18.4705 -18.4705 -2.5815 -2.5815 -2.4369 -2.4369 1.6858 1.6858 2.0503 2.0503 2.9589 2.9589 3.5005 3.5005 14.7844 14.7844 15.7105 15.7105 18.1625 18.1625 18.4839 18.4839 19.1785 19.1785 21.6913 21.6913 26.7866 26.7866 29.3269 29.3269 29.9954 29.9954 30.3174 30.3174 k =-0.5000 0.2169 0.2298 ( 1168 PWs) bands (ev): -18.6980 -18.6980 -18.4652 -18.4652 -2.5384 -2.5384 -2.3883 -2.3883 1.6059 1.6059 1.9995 1.9995 2.9271 2.9271 3.5107 3.5107 14.7747 14.7747 15.7851 15.7851 18.1728 18.1728 18.4234 18.4234 19.2693 19.2693 21.7748 21.7748 26.7119 26.7119 29.2923 29.2923 29.9792 29.9792 30.3188 30.3188 k =-0.5000 0.2169 0.2193 ( 1166 PWs) bands (ev): -18.7050 -18.7050 -18.4601 -18.4601 -2.4924 -2.4924 -2.3377 -2.3377 1.5223 1.5223 1.9458 1.9458 2.8960 2.8960 3.5213 3.5213 14.7648 14.7648 15.8617 15.8617 18.1814 18.1814 18.3633 18.3633 19.3683 19.3683 21.8524 21.8524 26.6404 26.6404 29.2590 29.2590 29.9523 29.9523 30.3220 30.3220 k =-0.5000 0.2169 0.2089 ( 1166 PWs) bands (ev): -18.7118 -18.7118 -18.4553 -18.4553 -2.4437 -2.4437 -2.2852 -2.2852 1.4353 1.4353 1.8893 1.8893 2.8660 2.8660 3.5321 3.5321 14.7547 14.7547 15.9403 15.9403 18.1856 18.1856 18.3079 18.3079 19.4731 19.4731 21.9239 21.9239 26.5720 26.5720 29.2270 29.2270 29.9214 29.9214 30.3292 30.3292 k =-0.5000 0.2169 0.1984 ( 1170 PWs) bands (ev): -18.7184 -18.7184 -18.4506 -18.4506 -2.3923 -2.3923 -2.2310 -2.2310 1.3452 1.3452 1.8304 1.8304 2.8370 2.8370 3.5429 3.5429 14.7444 14.7444 16.0203 16.0203 18.1769 18.1769 18.2667 18.2667 19.5821 19.5821 21.9887 21.9887 26.5067 26.5067 29.1964 29.1964 29.8892 29.8892 30.3412 30.3412 k =-0.5000 0.2169 0.1880 ( 1168 PWs) bands (ev): -18.7247 -18.7247 -18.4462 -18.4462 -2.3384 -2.3384 -2.1752 -2.1752 1.2526 1.2526 1.7692 1.7692 2.8094 2.8094 3.5539 3.5539 14.7339 14.7339 16.1014 16.1014 18.1442 18.1442 18.2510 18.2510 19.6940 19.6940 22.0470 22.0470 26.4447 26.4447 29.1670 29.1670 29.8571 29.8571 30.3579 30.3579 k =-0.5000 0.2169 0.1776 ( 1166 PWs) bands (ev): -18.7308 -18.7308 -18.4421 -18.4421 -2.2821 -2.2821 -2.1179 -2.1179 1.1576 1.1576 1.7062 1.7062 2.7832 2.7832 3.5647 3.5647 14.7235 14.7235 16.1834 16.1834 18.0975 18.0975 18.2512 18.2512 19.8078 19.8078 22.0985 22.0985 26.3858 26.3858 29.1390 29.1390 29.8257 29.8257 30.3795 30.3795 k =-0.5000 0.2169 0.1671 ( 1170 PWs) bands (ev): -18.7366 -18.7366 -18.4381 -18.4381 -2.2236 -2.2236 -2.0594 -2.0594 1.0607 1.0607 1.6416 1.6416 2.7585 2.7585 3.5754 3.5754 14.7129 14.7129 16.2656 16.2656 18.0479 18.0479 18.2558 18.2558 19.9226 19.9226 22.1432 22.1432 26.3302 26.3302 29.1123 29.1123 29.7954 29.7954 30.4058 30.4058 k =-0.5000 0.2169 0.1567 ( 1170 PWs) bands (ev): -18.7422 -18.7422 -18.4345 -18.4345 -2.1631 -2.1631 -1.9997 -1.9997 0.9624 0.9624 1.5759 1.5759 2.7353 2.7353 3.5858 3.5858 14.7026 14.7026 16.3477 16.3477 17.9993 17.9993 18.2613 18.2613 20.0373 20.0373 22.1813 22.1813 26.2779 26.2779 29.0870 29.0870 29.7665 29.7665 30.4364 30.4364 k =-0.5000 0.2169 0.1462 ( 1172 PWs) bands (ev): -18.7474 -18.7474 -18.4310 -18.4310 -2.1010 -2.1010 -1.9391 -1.9391 0.8629 0.8629 1.5096 1.5096 2.7137 2.7137 3.5960 3.5960 14.6924 14.6924 16.4295 16.4295 17.9529 17.9529 18.2664 18.2664 20.1510 20.1510 22.2130 22.2130 26.2288 26.2288 29.0630 29.0630 29.7391 29.7391 30.4711 30.4711 k =-0.5000 0.2169 0.1358 ( 1176 PWs) bands (ev): -18.7524 -18.7524 -18.4278 -18.4278 -2.0377 -2.0377 -1.8778 -1.8778 0.7627 0.7627 1.4431 1.4431 2.6936 2.6936 3.6057 3.6057 14.6824 14.6824 16.5101 16.5101 17.9091 17.9091 18.2705 18.2705 20.2629 20.2629 22.2386 22.2386 26.1829 26.1829 29.0403 29.0403 29.7132 29.7132 30.5090 30.5090 k =-0.5000 0.2169 0.1253 ( 1176 PWs) bands (ev): -18.7570 -18.7570 -18.4248 -18.4248 -1.9735 -1.9735 -1.8159 -1.8159 0.6623 0.6623 1.3770 1.3770 2.6752 2.6752 3.6150 3.6150 14.6728 14.6728 16.5892 16.5892 17.8682 17.8682 18.2735 18.2735 20.3719 20.3719 22.2587 22.2587 26.1405 26.1405 29.0191 29.0191 29.6891 29.6891 30.5497 30.5497 k =-0.5000 0.2169 0.1149 ( 1168 PWs) bands (ev): -18.7613 -18.7613 -18.4221 -18.4221 -1.9092 -1.9092 -1.7535 -1.7535 0.5622 0.5622 1.3119 1.3119 2.6584 2.6584 3.6237 3.6237 14.6638 14.6638 16.6661 16.6661 17.8302 17.8302 18.2753 18.2753 20.4771 20.4771 22.2738 22.2738 26.1013 26.1013 28.9993 28.9993 29.6669 29.6669 30.5924 30.5924 k =-0.5000 0.2169 0.1044 ( 1168 PWs) bands (ev): -18.7653 -18.7653 -18.4196 -18.4196 -1.8456 -1.8456 -1.6906 -1.6906 0.4628 0.4628 1.2485 1.2485 2.6431 2.6431 3.6319 3.6319 14.6551 14.6551 16.7404 16.7404 17.7953 17.7953 18.2757 18.2757 20.5774 20.5774 22.2844 22.2844 26.0655 26.0655 28.9811 28.9811 29.6464 29.6464 30.6364 30.6364 k =-0.5000 0.2169 0.0940 ( 1168 PWs) bands (ev): -18.7689 -18.7689 -18.4173 -18.4173 -1.7835 -1.7835 -1.6274 -1.6274 0.3648 0.3648 1.1874 1.1874 2.6293 2.6293 3.6395 3.6395 14.6470 14.6470 16.8112 16.8112 17.7634 17.7634 18.2747 18.2747 20.6720 20.6720 22.2912 22.2912 26.0331 26.0331 28.9644 28.9644 29.6277 29.6277 30.6806 30.6806 k =-0.5000 0.2169 0.0836 ( 1168 PWs) bands (ev): -18.7722 -18.7722 -18.4153 -18.4153 -1.7241 -1.7241 -1.5638 -1.5638 0.2689 0.2689 1.1294 1.1294 2.6171 2.6171 3.6463 3.6463 14.6396 14.6396 16.8781 16.8781 17.7346 17.7346 18.2726 18.2726 20.7598 20.7598 22.2949 22.2949 26.0040 26.0040 28.9493 28.9493 29.6110 29.6110 30.7243 30.7243 k =-0.5000 0.2169 0.0731 ( 1168 PWs) bands (ev): -18.7751 -18.7751 -18.4135 -18.4135 -1.6687 -1.6687 -1.5002 -1.5002 0.1761 0.1761 1.0754 1.0754 2.6063 2.6063 3.6525 3.6525 14.6329 14.6329 16.9402 16.9402 17.7088 17.7088 18.2695 18.2695 20.8400 20.8400 22.2962 22.2962 25.9783 25.9783 28.9359 28.9359 29.5961 29.5961 30.7663 30.7663 k =-0.5000 0.2169 0.0627 ( 1168 PWs) bands (ev): -18.7777 -18.7777 -18.4120 -18.4120 -1.6183 -1.6183 -1.4373 -1.4373 0.0874 0.0874 1.0261 1.0261 2.5970 2.5970 3.6579 3.6579 14.6270 14.6270 16.9967 16.9967 17.6861 17.6861 18.2657 18.2657 20.9116 20.9116 22.2957 22.2957 25.9560 25.9560 28.9241 28.9241 29.5832 29.5832 30.8059 30.8059 k =-0.5000 0.2169 0.0522 ( 1168 PWs) bands (ev): -18.7798 -18.7798 -18.4107 -18.4107 -1.5740 -1.5740 -1.3762 -1.3762 0.0045 0.0045 0.9824 0.9824 2.5892 2.5892 3.6625 3.6625 14.6219 14.6219 17.0467 17.0467 17.6665 17.6665 18.2614 18.2614 20.9737 20.9737 22.2940 22.2940 25.9371 25.9371 28.9141 28.9141 29.5723 29.5723 30.8419 30.8419 k =-0.5000 0.2169 0.0418 ( 1168 PWs) bands (ev): -18.7816 -18.7816 -18.4096 -18.4096 -1.5365 -1.5365 -1.3189 -1.3189 -0.0705 -0.0705 0.9452 0.9452 2.5829 2.5829 3.6663 3.6663 14.6177 14.6177 17.0895 17.0895 17.6501 17.6501 18.2569 18.2569 21.0257 21.0257 22.2919 22.2919 25.9217 25.9217 28.9058 28.9058 29.5632 29.5632 30.8726 30.8726 k =-0.5000 0.2169 0.0313 ( 1168 PWs) bands (ev): -18.7830 -18.7830 -18.4088 -18.4088 -1.5066 -1.5066 -1.2681 -1.2681 -0.1350 -0.1350 0.9153 0.9153 2.5779 2.5779 3.6693 3.6693 14.6143 14.6143 17.1241 17.1241 17.6371 17.6371 18.2529 18.2529 21.0669 21.0669 22.2897 22.2897 25.9097 25.9097 28.8994 28.8994 29.5562 29.5562 30.8868 30.8868 k =-0.5000 0.2169 0.0209 ( 1172 PWs) bands (ev): -18.7840 -18.7840 -18.4082 -18.4082 -1.4848 -1.4848 -1.2275 -1.2275 -0.1854 -0.1854 0.8933 0.8933 2.5744 2.5744 3.6714 3.6714 14.6119 14.6119 17.1497 17.1497 17.6275 17.6275 18.2497 18.2497 21.0966 21.0966 22.2878 22.2878 25.9010 25.9010 28.8946 28.8946 29.5512 29.5512 30.8740 30.8740 k =-0.5000 0.2169 0.0104 ( 1170 PWs) bands (ev): -18.7845 -18.7845 -18.4079 -18.4079 -1.4716 -1.4716 -1.2009 -1.2009 -0.2178 -0.2178 0.8799 0.8799 2.5723 2.5723 3.6727 3.6727 14.6105 14.6105 17.1653 17.1653 17.6217 17.6217 18.2476 18.2476 21.1147 21.1147 22.2866 22.2866 25.8959 25.8959 28.8919 28.8919 29.5482 29.5482 30.8622 30.8622 k =-0.5000 0.2169 0.0000 ( 1170 PWs) bands (ev): -18.7847 -18.7847 -18.4078 -18.4078 -1.4671 -1.4671 -1.1916 -1.1916 -0.2290 -0.2290 0.8754 0.8754 2.5716 2.5716 3.6731 3.6731 14.6100 14.6100 17.1706 17.1706 17.6197 17.6197 18.2469 18.2469 21.1207 21.1207 22.2861 22.2861 25.8942 25.8942 28.8909 28.8909 29.5472 29.5472 30.8581 30.8581 k = 0.0000 0.0000 0.3969 ( 1176 PWs) bands (ev): -18.8609 -18.8609 -18.8609 -18.8609 -0.2081 -0.2081 -0.2081 -0.2081 1.4199 1.4199 1.4199 1.4199 3.3262 3.3262 3.3262 3.3262 12.8529 12.8529 12.8529 12.8529 18.4892 18.4892 18.4892 18.4892 21.2954 21.2954 21.2954 21.2954 24.9209 24.9209 24.9209 24.9209 25.0355 25.0355 25.0355 25.0355 k =-0.0094 0.0041 0.3969 ( 1176 PWs) bands (ev): -18.8606 -18.8606 -18.8606 -18.8606 -0.2122 -0.2122 -0.2122 -0.2122 1.4223 1.4223 1.4223 1.4223 3.3262 3.3262 3.3262 3.3262 12.8569 12.8569 12.8569 12.8569 18.4821 18.4821 18.4821 18.4821 21.3024 21.3024 21.3024 21.3024 24.9129 24.9129 24.9129 24.9129 25.0368 25.0368 25.0368 25.0368 k =-0.0189 0.0082 0.3969 ( 1176 PWs) bands (ev): -18.8599 -18.8599 -18.8599 -18.8599 -0.2246 -0.2246 -0.2246 -0.2246 1.4294 1.4294 1.4294 1.4294 3.3260 3.3260 3.3260 3.3260 12.8686 12.8686 12.8686 12.8686 18.4611 18.4611 18.4611 18.4611 21.3232 21.3232 21.3232 21.3232 24.8890 24.8890 24.8890 24.8890 25.0413 25.0413 25.0413 25.0413 k =-0.0283 0.0123 0.3969 ( 1176 PWs) bands (ev): -18.8587 -18.8587 -18.8587 -18.8587 -0.2448 -0.2448 -0.2448 -0.2448 1.4411 1.4411 1.4411 1.4411 3.3258 3.3258 3.3258 3.3258 12.8882 12.8882 12.8882 12.8882 18.4271 18.4271 18.4271 18.4271 21.3566 21.3566 21.3566 21.3566 24.8507 24.8507 24.8507 24.8507 25.0497 25.0497 25.0497 25.0497 k =-0.0377 0.0164 0.3969 ( 1176 PWs) bands (ev): -18.8570 -18.8570 -18.8570 -18.8570 -0.2726 -0.2726 -0.2726 -0.2726 1.4569 1.4569 1.4569 1.4569 3.3255 3.3255 3.3255 3.3255 12.9154 12.9154 12.9154 12.9154 18.3812 18.3812 18.3812 18.3812 21.4010 21.4010 21.4010 21.4010 24.8006 24.8006 24.8006 24.8006 25.0624 25.0624 25.0624 25.0624 k =-0.0472 0.0205 0.3969 ( 1176 PWs) bands (ev): -18.8549 -18.8549 -18.8549 -18.8549 -0.3074 -0.3074 -0.3074 -0.3074 1.4763 1.4763 1.4763 1.4763 3.3252 3.3252 3.3252 3.3252 12.9503 12.9503 12.9503 12.9503 18.3247 18.3247 18.3247 18.3247 21.4542 21.4542 21.4542 21.4542 24.7424 24.7424 24.7424 24.7424 25.0792 25.0792 25.0792 25.0792 k =-0.0566 0.0246 0.3969 ( 1166 PWs) bands (ev): -18.8523 -18.8523 -18.8523 -18.8523 -0.3485 -0.3485 -0.3485 -0.3485 1.4989 1.4989 1.4989 1.4989 3.3247 3.3247 3.3247 3.3247 12.9926 12.9926 12.9926 12.9926 18.2594 18.2594 18.2594 18.2594 21.5139 21.5139 21.5139 21.5139 24.6800 24.6800 24.6800 24.6800 25.1001 25.1001 25.1001 25.1001 k =-0.0660 0.0286 0.3969 ( 1166 PWs) bands (ev): -18.8492 -18.8492 -18.8492 -18.8492 -0.3954 -0.3954 -0.3954 -0.3954 1.5241 1.5241 1.5241 1.5241 3.3242 3.3242 3.3242 3.3242 13.0423 13.0423 13.0423 13.0423 18.1865 18.1865 18.1865 18.1865 21.5770 21.5770 21.5770 21.5770 24.6173 24.6173 24.6173 24.6173 25.1250 25.1250 25.1250 25.1250 k =-0.0755 0.0327 0.3969 ( 1166 PWs) bands (ev): -18.8457 -18.8457 -18.8457 -18.8457 -0.4474 -0.4474 -0.4474 -0.4474 1.5515 1.5515 1.5515 1.5515 3.3237 3.3237 3.3237 3.3237 13.0991 13.0991 13.0991 13.0991 18.1076 18.1076 18.1076 18.1076 21.6407 21.6407 21.6407 21.6407 24.5580 24.5580 24.5580 24.5580 25.1538 25.1538 25.1538 25.1538 k =-0.0849 0.0368 0.3969 ( 1168 PWs) bands (ev): -18.8417 -18.8417 -18.8417 -18.8417 -0.5039 -0.5039 -0.5039 -0.5039 1.5805 1.5805 1.5805 1.5805 3.3231 3.3231 3.3231 3.3231 13.1628 13.1628 13.1628 13.1628 18.0240 18.0240 18.0240 18.0240 21.7019 21.7019 21.7019 21.7019 24.5060 24.5060 24.5060 24.5060 25.1863 25.1863 25.1863 25.1863 k =-0.0943 0.0409 0.3969 ( 1168 PWs) bands (ev): -18.8373 -18.8373 -18.8373 -18.8373 -0.5644 -0.5644 -0.5644 -0.5644 1.6107 1.6107 1.6107 1.6107 3.3224 3.3224 3.3224 3.3224 13.2332 13.2332 13.2332 13.2332 17.9368 17.9368 17.9368 17.9368 21.7574 21.7574 21.7574 21.7574 24.4649 24.4649 24.4649 24.4649 25.2227 25.2227 25.2227 25.2227 k =-0.1038 0.0450 0.3969 ( 1168 PWs) bands (ev): -18.8325 -18.8325 -18.8325 -18.8325 -0.6283 -0.6283 -0.6283 -0.6283 1.6417 1.6417 1.6417 1.6417 3.3217 3.3217 3.3217 3.3217 13.3100 13.3100 13.3100 13.3100 17.8471 17.8471 17.8471 17.8471 21.8039 21.8039 21.8039 21.8039 24.4380 24.4380 24.4380 24.4380 25.2627 25.2627 25.2627 25.2627 k =-0.1132 0.0491 0.3969 ( 1168 PWs) bands (ev): -18.8273 -18.8273 -18.8273 -18.8273 -0.6952 -0.6952 -0.6952 -0.6952 1.6733 1.6733 1.6733 1.6733 3.3211 3.3211 3.3211 3.3211 13.3929 13.3929 13.3929 13.3929 17.7557 17.7557 17.7557 17.7557 21.8389 21.8389 21.8389 21.8389 24.4284 24.4284 24.4284 24.4284 25.3063 25.3063 25.3063 25.3063 k =-0.1226 0.0532 0.3969 ( 1168 PWs) bands (ev): -18.8218 -18.8218 -18.8218 -18.8218 -0.7645 -0.7645 -0.7645 -0.7645 1.7050 1.7050 1.7050 1.7050 3.3204 3.3204 3.3204 3.3204 13.4815 13.4815 13.4815 13.4815 17.6634 17.6634 17.6634 17.6634 21.8599 21.8599 21.8599 21.8599 24.4383 24.4383 24.4383 24.4383 25.3536 25.3536 25.3536 25.3536 k =-0.1321 0.0573 0.3969 ( 1170 PWs) bands (ev): -18.8158 -18.8158 -18.8158 -18.8158 -0.8359 -0.8359 -0.8359 -0.8359 1.7368 1.7368 1.7368 1.7368 3.3197 3.3197 3.3197 3.3197 13.5756 13.5756 13.5756 13.5756 17.5709 17.5709 17.5709 17.5709 21.8657 21.8657 21.8657 21.8657 24.4693 24.4693 24.4693 24.4693 25.4043 25.4043 25.4043 25.4043 k =-0.1415 0.0614 0.3969 ( 1168 PWs) bands (ev): -18.8096 -18.8096 -18.8096 -18.8096 -0.9090 -0.9090 -0.9090 -0.9090 1.7684 1.7684 1.7684 1.7684 3.3191 3.3191 3.3191 3.3191 13.6747 13.6747 13.6747 13.6747 17.4788 17.4788 17.4788 17.4788 21.8559 21.8559 21.8559 21.8559 24.5217 24.5217 24.5217 24.5217 25.4584 25.4584 25.4584 25.4584 k =-0.1509 0.0655 0.3969 ( 1168 PWs) bands (ev): -18.8030 -18.8030 -18.8030 -18.8030 -0.9835 -0.9835 -0.9835 -0.9835 1.7996 1.7996 1.7996 1.7996 3.3184 3.3184 3.3184 3.3184 13.7783 13.7783 13.7783 13.7783 17.3877 17.3877 17.3877 17.3877 21.8311 21.8311 21.8311 21.8311 24.5949 24.5949 24.5949 24.5949 25.5160 25.5160 25.5160 25.5160 k =-0.1604 0.0696 0.3969 ( 1168 PWs) bands (ev): -18.7961 -18.7961 -18.7961 -18.7961 -1.0589 -1.0589 -1.0589 -1.0589 1.8304 1.8304 1.8304 1.8304 3.3179 3.3179 3.3179 3.3179 13.8861 13.8861 13.8861 13.8861 17.2982 17.2982 17.2982 17.2982 21.7927 21.7927 21.7927 21.7927 24.6876 24.6876 24.6876 24.6876 25.5768 25.5768 25.5768 25.5768 k =-0.1698 0.0737 0.3969 ( 1168 PWs) bands (ev): -18.7889 -18.7889 -18.7889 -18.7889 -1.1351 -1.1351 -1.1351 -1.1351 1.8605 1.8605 1.8605 1.8605 3.3174 3.3174 3.3174 3.3174 13.9974 13.9974 13.9974 13.9974 17.2107 17.2107 17.2107 17.2107 21.7425 21.7425 21.7425 21.7425 24.7978 24.7978 24.7978 24.7978 25.6407 25.6407 25.6407 25.6407 k =-0.1792 0.0778 0.3969 ( 1162 PWs) bands (ev): -18.7815 -18.7815 -18.7815 -18.7815 -1.2118 -1.2118 -1.2118 -1.2118 1.8899 1.8899 1.8899 1.8899 3.3170 3.3170 3.3170 3.3170 14.1117 14.1117 14.1117 14.1117 17.1257 17.1257 17.1257 17.1257 21.6827 21.6827 21.6827 21.6827 24.9236 24.9236 24.9236 24.9236 25.7078 25.7078 25.7078 25.7078 k =-0.1887 0.0819 0.3969 ( 1162 PWs) bands (ev): -18.7738 -18.7738 -18.7738 -18.7738 -1.2887 -1.2887 -1.2887 -1.2887 1.9186 1.9186 1.9186 1.9186 3.3167 3.3167 3.3167 3.3167 14.2282 14.2282 14.2282 14.2282 17.0440 17.0440 17.0440 17.0440 21.6151 21.6151 21.6151 21.6151 25.0627 25.0627 25.0627 25.0627 25.7779 25.7779 25.7779 25.7779 k =-0.1981 0.0859 0.3969 ( 1162 PWs) bands (ev): -18.7659 -18.7659 -18.7659 -18.7659 -1.3655 -1.3655 -1.3655 -1.3655 1.9465 1.9465 1.9465 1.9465 3.3166 3.3166 3.3166 3.3166 14.3462 14.3462 14.3462 14.3462 16.9661 16.9661 16.9661 16.9661 21.5415 21.5415 21.5415 21.5415 25.2134 25.2134 25.2134 25.2134 25.8508 25.8508 25.8508 25.8508 k =-0.2075 0.0900 0.3969 ( 1160 PWs) bands (ev): -18.7579 -18.7579 -18.7579 -18.7579 -1.4420 -1.4420 -1.4420 -1.4420 1.9734 1.9734 1.9734 1.9734 3.3165 3.3165 3.3165 3.3165 14.4646 14.4646 14.4646 14.4646 16.8929 16.8929 16.8929 16.8929 21.4637 21.4637 21.4637 21.4637 25.3740 25.3740 25.3740 25.3740 25.9264 25.9264 25.9264 25.9264 k =-0.2170 0.0941 0.3969 ( 1160 PWs) bands (ev): -18.7497 -18.7497 -18.7497 -18.7497 -1.5180 -1.5180 -1.5180 -1.5180 1.9995 1.9995 1.9995 1.9995 3.3166 3.3166 3.3166 3.3166 14.5825 14.5825 14.5825 14.5825 16.8251 16.8251 16.8251 16.8251 21.3829 21.3829 21.3829 21.3829 25.5430 25.5430 25.5430 25.5430 26.0047 26.0047 26.0047 26.0047 k =-0.2264 0.0982 0.3969 ( 1160 PWs) bands (ev): -18.7413 -18.7413 -18.7413 -18.7413 -1.5934 -1.5934 -1.5934 -1.5934 2.0246 2.0246 2.0246 2.0246 3.3169 3.3169 3.3169 3.3169 14.6983 14.6983 14.6983 14.6983 16.7639 16.7639 16.7639 16.7639 21.3003 21.3003 21.3003 21.3003 25.7191 25.7191 25.7191 25.7191 26.0855 26.0855 26.0855 26.0855 k =-0.2358 0.1023 0.3969 ( 1160 PWs) bands (ev): -18.7329 -18.7329 -18.7329 -18.7329 -1.6678 -1.6678 -1.6678 -1.6678 2.0488 2.0488 2.0488 2.0488 3.3173 3.3173 3.3173 3.3173 14.8104 14.8104 14.8104 14.8104 16.7107 16.7107 16.7107 16.7107 21.2170 21.2170 21.2170 21.2170 25.9012 25.9012 25.9012 25.9012 26.1687 26.1687 26.1687 26.1687 k =-0.2453 0.1064 0.3969 ( 1160 PWs) bands (ev): -18.7244 -18.7244 -18.7244 -18.7244 -1.7412 -1.7412 -1.7412 -1.7412 2.0720 2.0720 2.0720 2.0720 3.3178 3.3178 3.3178 3.3178 14.9169 14.9169 14.9169 14.9169 16.6673 16.6673 16.6673 16.6673 21.1337 21.1337 21.1337 21.1337 26.0882 26.0882 26.0882 26.0882 26.2543 26.2543 26.2543 26.2543 k =-0.2547 0.1105 0.3969 ( 1152 PWs) bands (ev): -18.7159 -18.7159 -18.7159 -18.7159 -1.8134 -1.8134 -1.8134 -1.8134 2.0943 2.0943 2.0943 2.0943 3.3186 3.3186 3.3186 3.3186 15.0153 15.0153 15.0153 15.0153 16.6356 16.6356 16.6356 16.6356 21.0512 21.0512 21.0512 21.0512 26.2786 26.2786 26.2786 26.2786 26.3430 26.3430 26.3430 26.3430 k =-0.2642 0.1146 0.3969 ( 1148 PWs) bands (ev): -18.7073 -18.7073 -18.7073 -18.7073 -1.8841 -1.8841 -1.8841 -1.8841 2.1155 2.1155 2.1155 2.1155 3.3195 3.3195 3.3195 3.3195 15.1030 15.1030 15.1030 15.1030 16.6180 16.6180 16.6180 16.6180 20.9699 20.9699 20.9699 20.9699 26.4271 26.4271 26.4271 26.4271 26.4787 26.4787 26.4787 26.4787 k =-0.2736 0.1187 0.3969 ( 1148 PWs) bands (ev): -18.6988 -18.6988 -18.6988 -18.6988 -1.9533 -1.9533 -1.9533 -1.9533 2.1357 2.1357 2.1357 2.1357 3.3206 3.3206 3.3206 3.3206 15.1773 15.1773 15.1773 15.1773 16.6166 16.6166 16.6166 16.6166 20.8905 20.8905 20.8905 20.8905 26.5197 26.5197 26.5197 26.5197 26.6747 26.6747 26.6747 26.6747 k =-0.2830 0.1228 0.3969 ( 1148 PWs) bands (ev): -18.6904 -18.6904 -18.6904 -18.6904 -2.0208 -2.0208 -2.0208 -2.0208 2.1550 2.1550 2.1550 2.1550 3.3219 3.3219 3.3219 3.3219 15.2361 15.2361 15.2361 15.2361 16.6332 16.6332 16.6332 16.6332 20.8133 20.8133 20.8133 20.8133 26.6123 26.6123 26.6123 26.6123 26.8742 26.8742 26.8742 26.8742 k =-0.2925 0.1269 0.3969 ( 1152 PWs) bands (ev): -18.6820 -18.6820 -18.6820 -18.6820 -2.0864 -2.0864 -2.0864 -2.0864 2.1732 2.1732 2.1732 2.1732 3.3234 3.3234 3.3234 3.3234 15.2782 15.2782 15.2782 15.2782 16.6685 16.6685 16.6685 16.6685 20.7388 20.7388 20.7388 20.7388 26.7058 26.7058 26.7058 26.7058 27.0755 27.0755 27.0755 27.0755 k =-0.3019 0.1310 0.3969 ( 1152 PWs) bands (ev): -18.6737 -18.6737 -18.6737 -18.6737 -2.1500 -2.1500 -2.1500 -2.1500 2.1905 2.1905 2.1905 2.1905 3.3250 3.3250 3.3250 3.3250 15.3040 15.3040 15.3040 15.3040 16.7217 16.7217 16.7217 16.7217 20.6672 20.6672 20.6672 20.6672 26.8002 26.8002 26.8002 26.8002 27.2776 27.2776 27.2776 27.2776 k =-0.3113 0.1351 0.3969 ( 1152 PWs) bands (ev): -18.6656 -18.6656 -18.6656 -18.6656 -2.2115 -2.2115 -2.2115 -2.2115 2.2068 2.2068 2.2068 2.2068 3.3268 3.3268 3.3268 3.3268 15.3152 15.3152 15.3152 15.3152 16.7906 16.7906 16.7906 16.7906 20.5990 20.5990 20.5990 20.5990 26.8953 26.8953 26.8953 26.8953 27.4798 27.4798 27.4798 27.4798 k =-0.3208 0.1391 0.3969 ( 1156 PWs) bands (ev): -18.6576 -18.6576 -18.6576 -18.6576 -2.2708 -2.2708 -2.2708 -2.2708 2.2221 2.2221 2.2221 2.2221 3.3287 3.3287 3.3287 3.3287 15.3142 15.3142 15.3142 15.3142 16.8722 16.8722 16.8722 16.8722 20.5342 20.5342 20.5342 20.5342 26.9908 26.9908 26.9908 26.9908 27.6814 27.6814 27.6814 27.6814 k =-0.3302 0.1432 0.3969 ( 1156 PWs) bands (ev): -18.6499 -18.6499 -18.6499 -18.6499 -2.3277 -2.3277 -2.3277 -2.3277 2.2364 2.2364 2.2364 2.2364 3.3308 3.3308 3.3308 3.3308 15.3038 15.3038 15.3038 15.3038 16.9632 16.9632 16.9632 16.9632 20.4732 20.4732 20.4732 20.4732 27.0863 27.0863 27.0863 27.0863 27.8817 27.8817 27.8817 27.8817 k =-0.3396 0.1473 0.3969 ( 1162 PWs) bands (ev): -18.6423 -18.6423 -18.6423 -18.6423 -2.3822 -2.3822 -2.3822 -2.3822 2.2498 2.2498 2.2498 2.2498 3.3329 3.3329 3.3329 3.3329 15.2865 15.2865 15.2865 15.2865 17.0606 17.0606 17.0606 17.0606 20.4162 20.4162 20.4162 20.4162 27.1817 27.1817 27.1817 27.1817 28.0798 28.0798 28.0798 28.0798 k =-0.3491 0.1514 0.3969 ( 1158 PWs) bands (ev): -18.6351 -18.6351 -18.6351 -18.6351 -2.4341 -2.4341 -2.4341 -2.4341 2.2624 2.2624 2.2624 2.2624 3.3352 3.3352 3.3352 3.3352 15.2645 15.2645 15.2645 15.2645 17.1615 17.1615 17.1615 17.1615 20.3634 20.3634 20.3634 20.3634 27.2765 27.2765 27.2765 27.2765 28.2750 28.2750 28.2750 28.2750 k =-0.3585 0.1555 0.3969 ( 1154 PWs) bands (ev): -18.6281 -18.6281 -18.6281 -18.6281 -2.4833 -2.4833 -2.4833 -2.4833 2.2740 2.2740 2.2740 2.2740 3.3375 3.3375 3.3375 3.3375 15.2394 15.2394 15.2394 15.2394 17.2637 17.2637 17.2637 17.2637 20.3150 20.3150 20.3150 20.3150 27.3702 27.3702 27.3702 27.3702 28.4661 28.4661 28.4661 28.4661 k =-0.3679 0.1596 0.3969 ( 1158 PWs) bands (ev): -18.6214 -18.6214 -18.6214 -18.6214 -2.5298 -2.5298 -2.5298 -2.5298 2.2847 2.2847 2.2847 2.2847 3.3398 3.3398 3.3398 3.3398 15.2126 15.2126 15.2126 15.2126 17.3651 17.3651 17.3651 17.3651 20.2710 20.2710 20.2710 20.2710 27.4626 27.4626 27.4626 27.4626 28.6521 28.6521 28.6521 28.6521 k =-0.3774 0.1637 0.3969 ( 1170 PWs) bands (ev): -18.6151 -18.6151 -18.6151 -18.6151 -2.5735 -2.5735 -2.5735 -2.5735 2.2945 2.2945 2.2945 2.2945 3.3421 3.3421 3.3421 3.3421 15.1851 15.1851 15.1851 15.1851 17.4641 17.4641 17.4641 17.4641 20.2315 20.2315 20.2315 20.2315 27.5529 27.5529 27.5529 27.5529 28.8319 28.8319 28.8319 28.8319 k =-0.3868 0.1678 0.3969 ( 1166 PWs) bands (ev): -18.6091 -18.6091 -18.6091 -18.6091 -2.6142 -2.6142 -2.6142 -2.6142 2.3036 2.3036 2.3036 2.3036 3.3444 3.3444 3.3444 3.3444 15.1579 15.1579 15.1579 15.1579 17.5593 17.5593 17.5593 17.5593 20.1966 20.1966 20.1966 20.1966 27.6409 27.6409 27.6409 27.6409 29.0040 29.0040 29.0040 29.0040 k =-0.3962 0.1719 0.3969 ( 1170 PWs) bands (ev): -18.6036 -18.6036 -18.6036 -18.6036 -2.6519 -2.6519 -2.6519 -2.6519 2.3118 2.3118 2.3118 2.3118 3.3467 3.3467 3.3467 3.3467 15.1313 15.1313 15.1313 15.1313 17.6497 17.6497 17.6497 17.6497 20.1664 20.1664 20.1664 20.1664 27.7259 27.7259 27.7259 27.7259 29.1670 29.1670 29.1670 29.1670 k =-0.4057 0.1760 0.3969 ( 1168 PWs) bands (ev): -18.5984 -18.5984 -18.5984 -18.5984 -2.6866 -2.6866 -2.6866 -2.6866 2.3192 2.3192 2.3192 2.3192 3.3489 3.3489 3.3489 3.3489 15.1060 15.1060 15.1060 15.1060 17.7341 17.7341 17.7341 17.7341 20.1406 20.1406 20.1406 20.1406 27.8073 27.8073 27.8073 27.8073 29.3193 29.3193 29.3193 29.3193 k =-0.4151 0.1801 0.3969 ( 1168 PWs) bands (ev): -18.5936 -18.5936 -18.5936 -18.5936 -2.7181 -2.7181 -2.7181 -2.7181 2.3258 2.3258 2.3258 2.3258 3.3509 3.3509 3.3509 3.3509 15.0823 15.0823 15.0823 15.0823 17.8119 17.8119 17.8119 17.8119 20.1191 20.1191 20.1191 20.1191 27.8845 27.8845 27.8845 27.8845 29.4590 29.4590 29.4590 29.4590 k =-0.4245 0.1842 0.3969 ( 1168 PWs) bands (ev): -18.5893 -18.5893 -18.5893 -18.5893 -2.7465 -2.7465 -2.7465 -2.7465 2.3317 2.3317 2.3317 2.3317 3.3529 3.3529 3.3529 3.3529 15.0605 15.0605 15.0605 15.0605 17.8823 17.8823 17.8823 17.8823 20.1017 20.1017 20.1017 20.1017 27.9566 27.9566 27.9566 27.9566 29.5842 29.5842 29.5842 29.5842 k =-0.4340 0.1883 0.3969 ( 1176 PWs) bands (ev): -18.5855 -18.5855 -18.5855 -18.5855 -2.7717 -2.7717 -2.7717 -2.7717 2.3368 2.3368 2.3368 2.3368 3.3547 3.3547 3.3547 3.3547 15.0407 15.0407 15.0407 15.0407 17.9448 17.9448 17.9448 17.9448 20.0879 20.0879 20.0879 20.0879 28.0230 28.0230 28.0230 28.0230 29.6931 29.6931 29.6931 29.6931 k =-0.4434 0.1923 0.3969 ( 1172 PWs) bands (ev): -18.5822 -18.5822 -18.5822 -18.5822 -2.7936 -2.7936 -2.7936 -2.7936 2.3412 2.3412 2.3412 2.3412 3.3563 3.3563 3.3563 3.3563 15.0234 15.0234 15.0234 15.0234 17.9992 17.9992 17.9992 17.9992 20.0774 20.0774 20.0774 20.0774 28.0828 28.0828 28.0828 28.0828 29.7843 29.7843 29.7843 29.7843 k =-0.4528 0.1964 0.3969 ( 1172 PWs) bands (ev): -18.5793 -18.5793 -18.5793 -18.5793 -2.8122 -2.8122 -2.8122 -2.8122 2.3449 2.3449 2.3449 2.3449 3.3576 3.3576 3.3576 3.3576 15.0085 15.0085 15.0085 15.0085 18.0453 18.0453 18.0453 18.0453 20.0698 20.0698 20.0698 20.0698 28.1352 28.1352 28.1352 28.1352 29.8571 29.8571 29.8571 29.8571 k =-0.4623 0.2005 0.3969 ( 1172 PWs) bands (ev): -18.5770 -18.5770 -18.5770 -18.5770 -2.8274 -2.8274 -2.8274 -2.8274 2.3479 2.3479 2.3479 2.3479 3.3588 3.3588 3.3588 3.3588 14.9961 14.9961 14.9961 14.9961 18.0829 18.0829 18.0829 18.0829 20.0644 20.0644 20.0644 20.0644 28.1794 28.1794 28.1794 28.1794 29.9120 29.9120 29.9120 29.9120 k =-0.4717 0.2046 0.3969 ( 1168 PWs) bands (ev): -18.5751 -18.5751 -18.5751 -18.5751 -2.8393 -2.8393 -2.8393 -2.8393 2.3503 2.3503 2.3503 2.3503 3.3597 3.3597 3.3597 3.3597 14.9865 14.9865 14.9865 14.9865 18.1121 18.1121 18.1121 18.1121 20.0609 20.0609 20.0609 20.0609 28.2147 28.2147 28.2147 28.2147 29.9507 29.9507 29.9507 29.9507 k =-0.4811 0.2087 0.3969 ( 1172 PWs) bands (ev): -18.5738 -18.5738 -18.5738 -18.5738 -2.8478 -2.8478 -2.8478 -2.8478 2.3519 2.3519 2.3519 2.3519 3.3604 3.3604 3.3604 3.3604 14.9795 14.9795 14.9795 14.9795 18.1328 18.1328 18.1328 18.1328 20.0587 20.0587 20.0587 20.0587 28.2404 28.2404 28.2404 28.2404 29.9755 29.9755 29.9755 29.9755 k =-0.4906 0.2128 0.3969 ( 1172 PWs) bands (ev): -18.5730 -18.5730 -18.5730 -18.5730 -2.8529 -2.8529 -2.8529 -2.8529 2.3529 2.3529 2.3529 2.3529 3.3608 3.3608 3.3608 3.3608 14.9753 14.9753 14.9753 14.9753 18.1453 18.1453 18.1453 18.1453 20.0576 20.0576 20.0576 20.0576 28.2561 28.2561 28.2561 28.2561 29.9892 29.9892 29.9892 29.9892 k =-0.5000 0.2169 0.3969 ( 1172 PWs) bands (ev): -18.5727 -18.5727 -18.5727 -18.5727 -2.8546 -2.8546 -2.8546 -2.8546 2.3532 2.3532 2.3532 2.3532 3.3609 3.3609 3.3609 3.3609 14.9739 14.9739 14.9739 14.9739 18.1494 18.1494 18.1494 18.1494 20.0572 20.0572 20.0572 20.0572 28.2613 28.2613 28.2613 28.2613 29.9936 29.9936 29.9936 29.9936 Writing output data file YH3.save init_run : 1.96s CPU 12.58s WALL ( 1 calls) electrons : 259.91s CPU 264.72s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.30s CPU 1.48s WALL ( 1 calls) Called by electrons: c_bands : 259.87s CPU 264.39s WALL ( 1 calls) v_of_rho : 0.09s CPU 0.83s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.08s CPU 0.40s WALL ( 1 calls) newd : 0.22s CPU 0.42s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.00s CPU 0.04s WALL ( 570 calls) cegterg : 224.51s CPU 226.23s WALL ( 721 calls) Called by sum_band: Called by *egterg: h_psi : 92.89s CPU 98.76s WALL ( 12368 calls) s_psi : 10.16s CPU 11.01s WALL ( 12368 calls) g_psi : 0.10s CPU 0.24s WALL ( 11077 calls) cdiaghg : 99.88s CPU 98.03s WALL ( 11647 calls) cegterg:over : 20.84s CPU 17.68s WALL ( 11077 calls) cegterg:upda : 0.85s CPU 2.47s WALL ( 11077 calls) cegterg:last : 1.41s CPU 2.10s WALL ( 2255 calls) Called by h_psi: h_psi:vloc : 72.83s CPU 78.24s WALL ( 12368 calls) h_psi:vnl : 20.01s CPU 20.36s WALL ( 12368 calls) add_vuspsi : 4.19s CPU 7.61s WALL ( 12368 calls) General routines calbec : 15.80s CPU 12.66s WALL ( 12368 calls) fft : 0.12s CPU 1.18s WALL ( 19 calls) ffts : 0.02s CPU 0.09s WALL ( 4 calls) fftw : 71.43s CPU 75.07s WALL ( 1033988 calls) interpolate : 0.06s CPU 0.13s WALL ( 4 calls) davcio : 0.02s CPU 0.65s WALL ( 1140 calls) Parallel routines fft_scatter : 51.30s CPU 52.03s WALL ( 1034011 calls) PWSCF : 5m 4.62s CPU 6m43.56s WALL This run was terminated on: 16: 1:21 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=