Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19: 4:21 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./Ge2Mo.save/ file Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 46 30 9 765 395 67 Max 47 31 10 766 408 68 Sum 1667 1085 329 27555 14467 2419 bravais-lattice index = 14 lattice parameter (alat) = 8.9193 a.u. unit-cell volume = 303.4998 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 2 number of electrons = 22.00 number of Kohn-Sham states= 30 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 307.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.919325 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.753653 celldm(5)= -0.753653 celldm(6)= 0.507307 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.507307 0.861766 0.000000 ) a(3) = ( -0.753653 -0.430883 0.496333 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.588683 1.007388 ) b(2) = ( 0.000000 1.160408 1.007388 ) b(3) = ( 0.000000 0.000000 2.014776 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Mo read from file: /users/gautes/Pseudo/Mo.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 20113fa3d0a6ce27e798500ceb8a7ae4 Pseudo is Ultrasoft + core correction, Zval = 14.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1229 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 Ge 4.00 72.64000 Ge( 1.00) Mo 14.00 95.94000 Mo( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 1 1 1 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 0 1 0 ) ( -1 -1 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 434 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 2) = ( 0.0000000 0.0000000 0.0148145), wk = 0.0023041 k( 3) = ( 0.0000000 0.0000000 0.0296290), wk = 0.0023041 k( 4) = ( 0.0000000 0.0000000 0.0444436), wk = 0.0023041 k( 5) = ( 0.0000000 0.0000000 0.0592581), wk = 0.0023041 k( 6) = ( 0.0000000 0.0000000 0.0740726), wk = 0.0023041 k( 7) = ( 0.0000000 0.0000000 0.0888872), wk = 0.0023041 k( 8) = ( 0.0000000 0.0000000 0.1037017), wk = 0.0023041 k( 9) = ( 0.0000000 0.0000000 0.1185162), wk = 0.0023041 k( 10) = ( 0.0000000 0.0000000 0.1333307), wk = 0.0023041 k( 11) = ( 0.0000000 0.0000000 0.1481453), wk = 0.0023041 k( 12) = ( 0.0000000 0.0000000 0.1629598), wk = 0.0023041 k( 13) = ( 0.0000000 0.0000000 0.1777743), wk = 0.0023041 k( 14) = ( 0.0000000 0.0000000 0.1925889), wk = 0.0023041 k( 15) = ( 0.0000000 0.0000000 0.2074034), wk = 0.0023041 k( 16) = ( 0.0000000 0.0000000 0.2222179), wk = 0.0023041 k( 17) = ( 0.0000000 0.0000000 0.2370324), wk = 0.0023041 k( 18) = ( 0.0000000 0.0000000 0.2518470), wk = 0.0023041 k( 19) = ( 0.0000000 0.0000000 0.2666615), wk = 0.0023041 k( 20) = ( 0.0000000 0.0000000 0.2814760), wk = 0.0023041 k( 21) = ( 0.0000000 0.0000000 0.2962905), wk = 0.0023041 k( 22) = ( 0.0000000 0.0000000 0.3111051), wk = 0.0023041 k( 23) = ( 0.0000000 0.0000000 0.3259196), wk = 0.0023041 k( 24) = ( 0.0000000 0.0000000 0.3407341), wk = 0.0023041 k( 25) = ( 0.0000000 0.0000000 0.3555487), wk = 0.0023041 k( 26) = ( 0.0000000 0.0000000 0.3703632), wk = 0.0023041 k( 27) = ( 0.0000000 0.0000000 0.3851777), wk = 0.0023041 k( 28) = ( 0.0000000 0.0000000 0.3999922), wk = 0.0023041 k( 29) = ( 0.0000000 0.0000000 0.4148067), wk = 0.0023041 k( 30) = ( 0.0000000 0.0000000 0.4296213), wk = 0.0023041 k( 31) = ( 0.0000000 0.0000000 0.4444358), wk = 0.0023041 k( 32) = ( 0.0000000 0.0000000 0.4592503), wk = 0.0023041 k( 33) = ( 0.0000000 0.0000000 0.4740649), wk = 0.0023041 k( 34) = ( 0.0000000 0.0000000 0.4888794), wk = 0.0023041 k( 35) = ( 0.0000000 0.0000000 0.5036939), wk = 0.0023041 k( 36) = ( 0.0000000 0.0000000 0.5185084), wk = 0.0023041 k( 37) = ( 0.0000000 0.0000000 0.5333230), wk = 0.0023041 k( 38) = ( 0.0000000 0.0000000 0.5481375), wk = 0.0023041 k( 39) = ( 0.0000000 0.0000000 0.5629520), wk = 0.0023041 k( 40) = ( 0.0000000 0.0000000 0.5777666), wk = 0.0023041 k( 41) = ( 0.0000000 0.0000000 0.5925811), wk = 0.0023041 k( 42) = ( 0.0000000 0.0000000 0.6073956), wk = 0.0023041 k( 43) = ( 0.0000000 0.0000000 0.6222101), wk = 0.0023041 k( 44) = ( 0.0000000 0.0000000 0.6370247), wk = 0.0023041 k( 45) = ( 0.0000000 0.0000000 0.6518392), wk = 0.0023041 k( 46) = ( 0.0000000 0.0000000 0.6666537), wk = 0.0023041 k( 47) = ( 0.0000000 0.0000000 0.6814682), wk = 0.0023041 k( 48) = ( 0.0000000 0.0000000 0.6962828), wk = 0.0023041 k( 49) = ( 0.0000000 0.0000000 0.7110973), wk = 0.0023041 k( 50) = ( 0.0000000 0.0000000 0.7259118), wk = 0.0023041 k( 51) = ( 0.0000000 0.0000000 0.7407264), wk = 0.0023041 k( 52) = ( 0.0000000 0.0000000 0.7555409), wk = 0.0023041 k( 53) = ( 0.0000000 0.0000000 0.7703554), wk = 0.0023041 k( 54) = ( 0.0000000 0.0000000 0.7851699), wk = 0.0023041 k( 55) = ( 0.0000000 0.0000000 0.7999845), wk = 0.0023041 k( 56) = ( 0.0000000 0.0000000 0.8147990), wk = 0.0023041 k( 57) = ( 0.0000000 0.0000000 0.8296135), wk = 0.0023041 k( 58) = ( 0.0000000 0.0000000 0.8444280), wk = 0.0023041 k( 59) = ( 0.0000000 0.0000000 0.8592426), wk = 0.0023041 k( 60) = ( 0.0000000 0.0000000 0.8740571), wk = 0.0023041 k( 61) = ( 0.0000000 0.0000000 0.8888716), wk = 0.0023041 k( 62) = ( 0.0000000 0.0000000 0.9036861), wk = 0.0023041 k( 63) = ( 0.0000000 0.0000000 0.9185007), wk = 0.0023041 k( 64) = ( 0.0000000 0.0000000 0.9333152), wk = 0.0023041 k( 65) = ( 0.0000000 0.0000000 0.9481297), wk = 0.0023041 k( 66) = ( 0.0000000 0.0000000 0.9629443), wk = 0.0023041 k( 67) = ( 0.0000000 0.0000000 0.9777588), wk = 0.0023041 k( 68) = ( 0.0000000 0.0000000 0.9925733), wk = 0.0023041 k( 69) = ( 0.0000000 0.0000000 1.0073878), wk = 0.0023041 k( 70) = ( 0.0000000 0.0000000 1.0073878), wk = 0.0023041 k( 71) = ( -0.0074289 0.0129938 1.0073878), wk = 0.0023041 k( 72) = ( -0.0148577 0.0259875 1.0073878), wk = 0.0023041 k( 73) = ( -0.0222866 0.0389813 1.0073878), wk = 0.0023041 k( 74) = ( -0.0297155 0.0519750 1.0073878), wk = 0.0023041 k( 75) = ( -0.0371443 0.0649688 1.0073878), wk = 0.0023041 k( 76) = ( -0.0445732 0.0779626 1.0073878), wk = 0.0023041 k( 77) = ( -0.0520020 0.0909563 1.0073878), wk = 0.0023041 k( 78) = ( -0.0594309 0.1039501 1.0073878), wk = 0.0023041 k( 79) = ( -0.0668598 0.1169438 1.0073878), wk = 0.0023041 k( 80) = ( -0.0742886 0.1299376 1.0073878), wk = 0.0023041 k( 81) = ( -0.0817175 0.1429313 1.0073878), wk = 0.0023041 k( 82) = ( -0.0817175 0.1429313 1.0073878), wk = 0.0023041 k( 83) = ( -0.0869460 0.1520765 0.9968535), wk = 0.0023041 k( 84) = ( -0.0921745 0.1612217 0.9863192), wk = 0.0023041 k( 85) = ( -0.0974031 0.1703669 0.9757849), wk = 0.0023041 k( 86) = ( -0.1026316 0.1795121 0.9652506), wk = 0.0023041 k( 87) = ( -0.1078601 0.1886573 0.9547162), wk = 0.0023041 k( 88) = ( -0.1130887 0.1978024 0.9441819), wk = 0.0023041 k( 89) = ( -0.1183172 0.2069476 0.9336476), wk = 0.0023041 k( 90) = ( -0.1235457 0.2160928 0.9231133), wk = 0.0023041 k( 91) = ( -0.1287743 0.2252380 0.9125790), wk = 0.0023041 k( 92) = ( -0.1340028 0.2343831 0.9020446), wk = 0.0023041 k( 93) = ( -0.1392313 0.2435283 0.8915103), wk = 0.0023041 k( 94) = ( -0.1444599 0.2526735 0.8809760), wk = 0.0023041 k( 95) = ( -0.1496884 0.2618187 0.8704417), wk = 0.0023041 k( 96) = ( -0.1549169 0.2709639 0.8599074), wk = 0.0023041 k( 97) = ( -0.1601454 0.2801090 0.8493731), wk = 0.0023041 k( 98) = ( -0.1653740 0.2892542 0.8388388), wk = 0.0023041 k( 99) = ( -0.1706025 0.2983994 0.8283044), wk = 0.0023041 k( 100) = ( -0.1758310 0.3075446 0.8177701), wk = 0.0023041 k( 101) = ( -0.1810596 0.3166898 0.8072358), wk = 0.0023041 k( 102) = ( -0.1862881 0.3258349 0.7967015), wk = 0.0023041 k( 103) = ( -0.1915166 0.3349801 0.7861672), wk = 0.0023041 k( 104) = ( -0.1967452 0.3441253 0.7756328), wk = 0.0023041 k( 105) = ( -0.2019737 0.3532705 0.7650985), wk = 0.0023041 k( 106) = ( -0.2072022 0.3624157 0.7545642), wk = 0.0023041 k( 107) = ( -0.2124308 0.3715608 0.7440299), wk = 0.0023041 k( 108) = ( -0.2176593 0.3807060 0.7334956), wk = 0.0023041 k( 109) = ( -0.2228878 0.3898512 0.7229612), wk = 0.0023041 k( 110) = ( -0.2281164 0.3989964 0.7124269), wk = 0.0023041 k( 111) = ( -0.2333449 0.4081416 0.7018926), wk = 0.0023041 k( 112) = ( -0.2385734 0.4172867 0.6913583), wk = 0.0023041 k( 113) = ( -0.2438020 0.4264319 0.6808240), wk = 0.0023041 k( 114) = ( -0.2490305 0.4355771 0.6702897), wk = 0.0023041 k( 115) = ( -0.2542590 0.4447223 0.6597553), wk = 0.0023041 k( 116) = ( -0.2594876 0.4538675 0.6492210), wk = 0.0023041 k( 117) = ( -0.2647161 0.4630126 0.6386867), wk = 0.0023041 k( 118) = ( -0.2699446 0.4721578 0.6281524), wk = 0.0023041 k( 119) = ( -0.2751731 0.4813030 0.6176181), wk = 0.0023041 k( 120) = ( -0.2804017 0.4904482 0.6070837), wk = 0.0023041 k( 121) = ( -0.2856302 0.4995934 0.5965494), wk = 0.0023041 k( 122) = ( -0.2908587 0.5087385 0.5860151), wk = 0.0023041 k( 123) = ( -0.2908587 0.5087385 0.5860151), wk = 0.0023041 k( 124) = ( -0.2856648 0.4996539 0.5755505), wk = 0.0023041 k( 125) = ( -0.2804709 0.4905693 0.5650860), wk = 0.0023041 k( 126) = ( -0.2752770 0.4814847 0.5546214), wk = 0.0023041 k( 127) = ( -0.2700831 0.4724001 0.5441569), wk = 0.0023041 k( 128) = ( -0.2648892 0.4633155 0.5336923), wk = 0.0023041 k( 129) = ( -0.2596953 0.4542308 0.5232278), wk = 0.0023041 k( 130) = ( -0.2545014 0.4451462 0.5127632), wk = 0.0023041 k( 131) = ( -0.2493075 0.4360616 0.5022987), wk = 0.0023041 k( 132) = ( -0.2441136 0.4269770 0.4918341), wk = 0.0023041 k( 133) = ( -0.2389197 0.4178924 0.4813696), wk = 0.0023041 k( 134) = ( -0.2337258 0.4088078 0.4709050), wk = 0.0023041 k( 135) = ( -0.2285319 0.3997231 0.4604405), wk = 0.0023041 k( 136) = ( -0.2233380 0.3906385 0.4499759), wk = 0.0023041 k( 137) = ( -0.2181441 0.3815539 0.4395113), wk = 0.0023041 k( 138) = ( -0.2129502 0.3724693 0.4290468), wk = 0.0023041 k( 139) = ( -0.2077562 0.3633847 0.4185822), wk = 0.0023041 k( 140) = ( -0.2025623 0.3543001 0.4081177), wk = 0.0023041 k( 141) = ( -0.1973684 0.3452154 0.3976531), wk = 0.0023041 k( 142) = ( -0.1921745 0.3361308 0.3871885), wk = 0.0023041 k( 143) = ( -0.1869806 0.3270462 0.3767240), wk = 0.0023041 k( 144) = ( -0.1817867 0.3179616 0.3662594), wk = 0.0023041 k( 145) = ( -0.1765928 0.3088770 0.3557949), wk = 0.0023041 k( 146) = ( -0.1713989 0.2997924 0.3453303), wk = 0.0023041 k( 147) = ( -0.1662050 0.2907077 0.3348658), wk = 0.0023041 k( 148) = ( -0.1610111 0.2816231 0.3244012), wk = 0.0023041 k( 149) = ( -0.1558172 0.2725385 0.3139367), wk = 0.0023041 k( 150) = ( -0.1506233 0.2634539 0.3034721), wk = 0.0023041 k( 151) = ( -0.1454294 0.2543693 0.2930076), wk = 0.0023041 k( 152) = ( -0.1402355 0.2452846 0.2825430), wk = 0.0023041 k( 153) = ( -0.1350416 0.2362000 0.2720784), wk = 0.0023041 k( 154) = ( -0.1298477 0.2271154 0.2616139), wk = 0.0023041 k( 155) = ( -0.1246537 0.2180308 0.2511493), wk = 0.0023041 k( 156) = ( -0.1194598 0.2089462 0.2406848), wk = 0.0023041 k( 157) = ( -0.1142659 0.1998616 0.2302202), wk = 0.0023041 k( 158) = ( -0.1090720 0.1907770 0.2197557), wk = 0.0023041 k( 159) = ( -0.1038781 0.1816923 0.2092911), wk = 0.0023041 k( 160) = ( -0.0986842 0.1726077 0.1988266), wk = 0.0023041 k( 161) = ( -0.0934903 0.1635231 0.1883620), wk = 0.0023041 k( 162) = ( -0.0882964 0.1544385 0.1778974), wk = 0.0023041 k( 163) = ( -0.0831025 0.1453539 0.1674329), wk = 0.0023041 k( 164) = ( -0.0779086 0.1362693 0.1569683), wk = 0.0023041 k( 165) = ( -0.0727147 0.1271846 0.1465038), wk = 0.0023041 k( 166) = ( -0.0675208 0.1181000 0.1360392), wk = 0.0023041 k( 167) = ( -0.0623269 0.1090154 0.1255747), wk = 0.0023041 k( 168) = ( -0.0571330 0.0999308 0.1151101), wk = 0.0023041 k( 169) = ( -0.0519391 0.0908462 0.1046456), wk = 0.0023041 k( 170) = ( -0.0467451 0.0817615 0.0941810), wk = 0.0023041 k( 171) = ( -0.0415512 0.0726769 0.0837164), wk = 0.0023041 k( 172) = ( -0.0363573 0.0635923 0.0732519), wk = 0.0023041 k( 173) = ( -0.0311634 0.0545077 0.0627873), wk = 0.0023041 k( 174) = ( -0.0259695 0.0454231 0.0523228), wk = 0.0023041 k( 175) = ( -0.0207756 0.0363385 0.0418582), wk = 0.0023041 k( 176) = ( -0.0155817 0.0272539 0.0313937), wk = 0.0023041 k( 177) = ( -0.0103878 0.0181692 0.0209291), wk = 0.0023041 k( 178) = ( -0.0051939 0.0090846 0.0104646), wk = 0.0023041 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 180) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 181) = ( 0.0128205 0.0073298 -0.0000000), wk = 0.0023041 k( 182) = ( 0.0256410 0.0146596 -0.0000000), wk = 0.0023041 k( 183) = ( 0.0384615 0.0219894 -0.0000000), wk = 0.0023041 k( 184) = ( 0.0512821 0.0293192 -0.0000000), wk = 0.0023041 k( 185) = ( 0.0641026 0.0366491 -0.0000000), wk = 0.0023041 k( 186) = ( 0.0769231 0.0439789 -0.0000000), wk = 0.0023041 k( 187) = ( 0.0897436 0.0513087 -0.0000000), wk = 0.0023041 k( 188) = ( 0.1025641 0.0586385 -0.0000000), wk = 0.0023041 k( 189) = ( 0.1153846 0.0659683 -0.0000000), wk = 0.0023041 k( 190) = ( 0.1282051 0.0732981 -0.0000000), wk = 0.0023041 k( 191) = ( 0.1410256 0.0806279 -0.0000000), wk = 0.0023041 k( 192) = ( 0.1538461 0.0879577 -0.0000000), wk = 0.0023041 k( 193) = ( 0.1666667 0.0952876 -0.0000000), wk = 0.0023041 k( 194) = ( 0.1794872 0.1026174 -0.0000000), wk = 0.0023041 k( 195) = ( 0.1923077 0.1099472 -0.0000000), wk = 0.0023041 k( 196) = ( 0.2051282 0.1172770 -0.0000000), wk = 0.0023041 k( 197) = ( 0.2179487 0.1246068 -0.0000000), wk = 0.0023041 k( 198) = ( 0.2307692 0.1319366 -0.0000000), wk = 0.0023041 k( 199) = ( 0.2435897 0.1392664 -0.0000000), wk = 0.0023041 k( 200) = ( 0.2564103 0.1465963 -0.0000000), wk = 0.0023041 k( 201) = ( 0.2692308 0.1539261 -0.0000000), wk = 0.0023041 k( 202) = ( 0.2820513 0.1612559 -0.0000000), wk = 0.0023041 k( 203) = ( 0.2948718 0.1685857 -0.0000000), wk = 0.0023041 k( 204) = ( 0.3076923 0.1759155 -0.0000000), wk = 0.0023041 k( 205) = ( 0.3205128 0.1832453 -0.0000000), wk = 0.0023041 k( 206) = ( 0.3333333 0.1905751 -0.0000000), wk = 0.0023041 k( 207) = ( 0.3461538 0.1979049 -0.0000000), wk = 0.0023041 k( 208) = ( 0.3589744 0.2052348 -0.0000000), wk = 0.0023041 k( 209) = ( 0.3717949 0.2125646 -0.0000000), wk = 0.0023041 k( 210) = ( 0.3846154 0.2198944 -0.0000000), wk = 0.0023041 k( 211) = ( 0.3974359 0.2272242 -0.0000000), wk = 0.0023041 k( 212) = ( 0.4102564 0.2345540 -0.0000000), wk = 0.0023041 k( 213) = ( 0.4230769 0.2418838 -0.0000000), wk = 0.0023041 k( 214) = ( 0.4358974 0.2492136 -0.0000000), wk = 0.0023041 k( 215) = ( 0.4487179 0.2565434 -0.0000000), wk = 0.0023041 k( 216) = ( 0.4615385 0.2638733 -0.0000000), wk = 0.0023041 k( 217) = ( 0.4743590 0.2712031 -0.0000000), wk = 0.0023041 k( 218) = ( 0.4871795 0.2785329 -0.0000000), wk = 0.0023041 k( 219) = ( 0.5000000 0.2858627 -0.0000000), wk = 0.0023041 k( 220) = ( 0.5000000 0.2858627 -0.0000000), wk = 0.0023041 k( 221) = ( 0.4947715 0.2950079 0.0105343), wk = 0.0023041 k( 222) = ( 0.4895429 0.3041530 0.0210686), wk = 0.0023041 k( 223) = ( 0.4843144 0.3132982 0.0316029), wk = 0.0023041 k( 224) = ( 0.4790859 0.3224434 0.0421373), wk = 0.0023041 k( 225) = ( 0.4738573 0.3315886 0.0526716), wk = 0.0023041 k( 226) = ( 0.4686288 0.3407338 0.0632059), wk = 0.0023041 k( 227) = ( 0.4634003 0.3498790 0.0737402), wk = 0.0023041 k( 228) = ( 0.4581717 0.3590241 0.0842745), wk = 0.0023041 k( 229) = ( 0.4529432 0.3681693 0.0948089), wk = 0.0023041 k( 230) = ( 0.4477147 0.3773145 0.1053432), wk = 0.0023041 k( 231) = ( 0.4424862 0.3864597 0.1158775), wk = 0.0023041 k( 232) = ( 0.4372576 0.3956049 0.1264118), wk = 0.0023041 k( 233) = ( 0.4320291 0.4047500 0.1369461), wk = 0.0023041 k( 234) = ( 0.4268006 0.4138952 0.1474805), wk = 0.0023041 k( 235) = ( 0.4215720 0.4230404 0.1580148), wk = 0.0023041 k( 236) = ( 0.4163435 0.4321856 0.1685491), wk = 0.0023041 k( 237) = ( 0.4111150 0.4413308 0.1790834), wk = 0.0023041 k( 238) = ( 0.4058864 0.4504759 0.1896177), wk = 0.0023041 k( 239) = ( 0.4006579 0.4596211 0.2001520), wk = 0.0023041 k( 240) = ( 0.3954294 0.4687663 0.2106864), wk = 0.0023041 k( 241) = ( 0.3902008 0.4779115 0.2212207), wk = 0.0023041 k( 242) = ( 0.3849723 0.4870566 0.2317550), wk = 0.0023041 k( 243) = ( 0.3797438 0.4962018 0.2422893), wk = 0.0023041 k( 244) = ( 0.3745152 0.5053470 0.2528236), wk = 0.0023041 k( 245) = ( 0.3692867 0.5144922 0.2633580), wk = 0.0023041 k( 246) = ( 0.3640582 0.5236374 0.2738923), wk = 0.0023041 k( 247) = ( 0.3588296 0.5327825 0.2844266), wk = 0.0023041 k( 248) = ( 0.3536011 0.5419277 0.2949609), wk = 0.0023041 k( 249) = ( 0.3483726 0.5510729 0.3054952), wk = 0.0023041 k( 250) = ( 0.3431440 0.5602181 0.3160296), wk = 0.0023041 k( 251) = ( 0.3379155 0.5693633 0.3265639), wk = 0.0023041 k( 252) = ( 0.3326870 0.5785085 0.3370982), wk = 0.0023041 k( 253) = ( 0.3274585 0.5876536 0.3476325), wk = 0.0023041 k( 254) = ( 0.3222299 0.5967988 0.3581668), wk = 0.0023041 k( 255) = ( 0.3170014 0.6059440 0.3687011), wk = 0.0023041 k( 256) = ( 0.3117729 0.6150892 0.3792354), wk = 0.0023041 k( 257) = ( 0.3065443 0.6242344 0.3897698), wk = 0.0023041 k( 258) = ( 0.3013158 0.6333795 0.4003041), wk = 0.0023041 k( 259) = ( 0.2960873 0.6425247 0.4108384), wk = 0.0023041 k( 260) = ( 0.2908587 0.6516699 0.4213727), wk = 0.0023041 k( 261) = ( 0.2908587 0.6516699 0.4213727), wk = 0.0023041 k( 262) = ( 0.2770083 0.6482668 0.4252928), wk = 0.0023041 k( 263) = ( 0.2631579 0.6448636 0.4292128), wk = 0.0023041 k( 264) = ( 0.2493075 0.6414605 0.4331329), wk = 0.0023041 k( 265) = ( 0.2354571 0.6380574 0.4370530), wk = 0.0023041 k( 266) = ( 0.2216067 0.6346542 0.4409730), wk = 0.0023041 k( 267) = ( 0.2077562 0.6312511 0.4448931), wk = 0.0023041 k( 268) = ( 0.1939058 0.6278480 0.4488131), wk = 0.0023041 k( 269) = ( 0.1800554 0.6244449 0.4527332), wk = 0.0023041 k( 270) = ( 0.1662050 0.6210417 0.4566532), wk = 0.0023041 k( 271) = ( 0.1523546 0.6176386 0.4605733), wk = 0.0023041 k( 272) = ( 0.1385042 0.6142355 0.4644934), wk = 0.0023041 k( 273) = ( 0.1246537 0.6108324 0.4684134), wk = 0.0023041 k( 274) = ( 0.1108033 0.6074292 0.4723335), wk = 0.0023041 k( 275) = ( 0.0969529 0.6040261 0.4762535), wk = 0.0023041 k( 276) = ( 0.0831025 0.6006230 0.4801736), wk = 0.0023041 k( 277) = ( 0.0692521 0.5972199 0.4840936), wk = 0.0023041 k( 278) = ( 0.0554017 0.5938167 0.4880137), wk = 0.0023041 k( 279) = ( 0.0415512 0.5904136 0.4919337), wk = 0.0023041 k( 280) = ( 0.0277008 0.5870105 0.4958538), wk = 0.0023041 k( 281) = ( 0.0138504 0.5836073 0.4997739), wk = 0.0023041 k( 282) = ( 0.0000000 0.5802042 0.5036939), wk = 0.0023041 k( 283) = ( 0.0000000 0.5802042 0.5036939), wk = 0.0023041 k( 284) = ( 0.0052083 0.5710944 0.5141875), wk = 0.0023041 k( 285) = ( 0.0104167 0.5619845 0.5246812), wk = 0.0023041 k( 286) = ( 0.0156250 0.5528747 0.5351748), wk = 0.0023041 k( 287) = ( 0.0208333 0.5437648 0.5456684), wk = 0.0023041 k( 288) = ( 0.0260417 0.5346550 0.5561620), wk = 0.0023041 k( 289) = ( 0.0312500 0.5255451 0.5666557), wk = 0.0023041 k( 290) = ( 0.0364583 0.5164353 0.5771493), wk = 0.0023041 k( 291) = ( 0.0416667 0.5073254 0.5876429), wk = 0.0023041 k( 292) = ( 0.0468750 0.4982156 0.5981365), wk = 0.0023041 k( 293) = ( 0.0520833 0.4891057 0.6086301), wk = 0.0023041 k( 294) = ( 0.0572917 0.4799958 0.6191238), wk = 0.0023041 k( 295) = ( 0.0625000 0.4708860 0.6296174), wk = 0.0023041 k( 296) = ( 0.0677083 0.4617762 0.6401110), wk = 0.0023041 k( 297) = ( 0.0729167 0.4526663 0.6506047), wk = 0.0023041 k( 298) = ( 0.0781250 0.4435564 0.6610983), wk = 0.0023041 k( 299) = ( 0.0833333 0.4344466 0.6715919), wk = 0.0023041 k( 300) = ( 0.0885417 0.4253367 0.6820855), wk = 0.0023041 k( 301) = ( 0.0937500 0.4162269 0.6925791), wk = 0.0023041 k( 302) = ( 0.0989583 0.4071170 0.7030728), wk = 0.0023041 k( 303) = ( 0.1041667 0.3980072 0.7135664), wk = 0.0023041 k( 304) = ( 0.1093750 0.3888973 0.7240600), wk = 0.0023041 k( 305) = ( 0.1145833 0.3797875 0.7345536), wk = 0.0023041 k( 306) = ( 0.1197917 0.3706776 0.7450473), wk = 0.0023041 k( 307) = ( 0.1250000 0.3615678 0.7555409), wk = 0.0023041 k( 308) = ( 0.1302083 0.3524579 0.7660345), wk = 0.0023041 k( 309) = ( 0.1354167 0.3433481 0.7765281), wk = 0.0023041 k( 310) = ( 0.1406250 0.3342382 0.7870217), wk = 0.0023041 k( 311) = ( 0.1458333 0.3251284 0.7975154), wk = 0.0023041 k( 312) = ( 0.1510417 0.3160185 0.8080090), wk = 0.0023041 k( 313) = ( 0.1562500 0.3069087 0.8185026), wk = 0.0023041 k( 314) = ( 0.1614583 0.2977988 0.8289962), wk = 0.0023041 k( 315) = ( 0.1666667 0.2886890 0.8394899), wk = 0.0023041 k( 316) = ( 0.1718750 0.2795791 0.8499835), wk = 0.0023041 k( 317) = ( 0.1770833 0.2704693 0.8604771), wk = 0.0023041 k( 318) = ( 0.1822917 0.2613594 0.8709707), wk = 0.0023041 k( 319) = ( 0.1875000 0.2522496 0.8814644), wk = 0.0023041 k( 320) = ( 0.1927083 0.2431397 0.8919580), wk = 0.0023041 k( 321) = ( 0.1979167 0.2340299 0.9024516), wk = 0.0023041 k( 322) = ( 0.2031250 0.2249200 0.9129452), wk = 0.0023041 k( 323) = ( 0.2083333 0.2158102 0.9234388), wk = 0.0023041 k( 324) = ( 0.2135417 0.2067003 0.9339325), wk = 0.0023041 k( 325) = ( 0.2187500 0.1975905 0.9444261), wk = 0.0023041 k( 326) = ( 0.2239583 0.1884806 0.9549197), wk = 0.0023041 k( 327) = ( 0.2291667 0.1793707 0.9654133), wk = 0.0023041 k( 328) = ( 0.2343750 0.1702609 0.9759070), wk = 0.0023041 k( 329) = ( 0.2395833 0.1611511 0.9864006), wk = 0.0023041 k( 330) = ( 0.2447917 0.1520412 0.9968942), wk = 0.0023041 k( 331) = ( 0.2500000 0.1429313 1.0073878), wk = 0.0023041 k( 332) = ( 0.2500000 0.1429313 1.0073878), wk = 0.0023041 k( 333) = ( 0.2608696 0.1491458 1.0002295), wk = 0.0023041 k( 334) = ( 0.2717391 0.1553602 0.9930711), wk = 0.0023041 k( 335) = ( 0.2826087 0.1615746 0.9859127), wk = 0.0023041 k( 336) = ( 0.2934783 0.1677890 0.9787544), wk = 0.0023041 k( 337) = ( 0.3043478 0.1740034 0.9715960), wk = 0.0023041 k( 338) = ( 0.3152174 0.1802178 0.9644377), wk = 0.0023041 k( 339) = ( 0.3260870 0.1864322 0.9572793), wk = 0.0023041 k( 340) = ( 0.3369565 0.1926466 0.9501209), wk = 0.0023041 k( 341) = ( 0.3478261 0.1988610 0.9429626), wk = 0.0023041 k( 342) = ( 0.3586956 0.2050754 0.9358042), wk = 0.0023041 k( 343) = ( 0.3695652 0.2112898 0.9286458), wk = 0.0023041 k( 344) = ( 0.3804348 0.2175042 0.9214875), wk = 0.0023041 k( 345) = ( 0.3913044 0.2237186 0.9143291), wk = 0.0023041 k( 346) = ( 0.4021739 0.2299330 0.9071707), wk = 0.0023041 k( 347) = ( 0.4130435 0.2361474 0.9000124), wk = 0.0023041 k( 348) = ( 0.4239130 0.2423618 0.8928540), wk = 0.0023041 k( 349) = ( 0.4347826 0.2485763 0.8856956), wk = 0.0023041 k( 350) = ( 0.4456522 0.2547907 0.8785373), wk = 0.0023041 k( 351) = ( 0.4565217 0.2610051 0.8713789), wk = 0.0023041 k( 352) = ( 0.4673913 0.2672195 0.8642205), wk = 0.0023041 k( 353) = ( 0.4782609 0.2734339 0.8570622), wk = 0.0023041 k( 354) = ( 0.4891304 0.2796483 0.8499038), wk = 0.0023041 k( 355) = ( 0.5000000 0.2858627 0.8427454), wk = 0.0023041 k( 356) = ( 0.5000000 0.2858627 0.8427454), wk = 0.0023041 k( 357) = ( 0.5000000 0.2858627 0.8279604), wk = 0.0023041 k( 358) = ( 0.5000000 0.2858627 0.8131754), wk = 0.0023041 k( 359) = ( 0.5000000 0.2858627 0.7983904), wk = 0.0023041 k( 360) = ( 0.5000000 0.2858627 0.7836054), wk = 0.0023041 k( 361) = ( 0.5000000 0.2858627 0.7688204), wk = 0.0023041 k( 362) = ( 0.5000000 0.2858627 0.7540354), wk = 0.0023041 k( 363) = ( 0.5000000 0.2858627 0.7392504), wk = 0.0023041 k( 364) = ( 0.5000000 0.2858627 0.7244654), wk = 0.0023041 k( 365) = ( 0.5000000 0.2858627 0.7096804), wk = 0.0023041 k( 366) = ( 0.5000000 0.2858627 0.6948954), wk = 0.0023041 k( 367) = ( 0.5000000 0.2858627 0.6801104), wk = 0.0023041 k( 368) = ( 0.5000000 0.2858627 0.6653253), wk = 0.0023041 k( 369) = ( 0.5000000 0.2858627 0.6505403), wk = 0.0023041 k( 370) = ( 0.5000000 0.2858627 0.6357553), wk = 0.0023041 k( 371) = ( 0.5000000 0.2858627 0.6209703), wk = 0.0023041 k( 372) = ( 0.5000000 0.2858627 0.6061853), wk = 0.0023041 k( 373) = ( 0.5000000 0.2858627 0.5914003), wk = 0.0023041 k( 374) = ( 0.5000000 0.2858627 0.5766153), wk = 0.0023041 k( 375) = ( 0.5000000 0.2858627 0.5618303), wk = 0.0023041 k( 376) = ( 0.5000000 0.2858627 0.5470453), wk = 0.0023041 k( 377) = ( 0.5000000 0.2858627 0.5322603), wk = 0.0023041 k( 378) = ( 0.5000000 0.2858627 0.5174753), wk = 0.0023041 k( 379) = ( 0.5000000 0.2858627 0.5026903), wk = 0.0023041 k( 380) = ( 0.5000000 0.2858627 0.4879052), wk = 0.0023041 k( 381) = ( 0.5000000 0.2858627 0.4731202), wk = 0.0023041 k( 382) = ( 0.5000000 0.2858627 0.4583353), wk = 0.0023041 k( 383) = ( 0.5000000 0.2858627 0.4435502), wk = 0.0023041 k( 384) = ( 0.5000000 0.2858627 0.4287652), wk = 0.0023041 k( 385) = ( 0.5000000 0.2858627 0.4139802), wk = 0.0023041 k( 386) = ( 0.5000000 0.2858627 0.3991952), wk = 0.0023041 k( 387) = ( 0.5000000 0.2858627 0.3844102), wk = 0.0023041 k( 388) = ( 0.5000000 0.2858627 0.3696252), wk = 0.0023041 k( 389) = ( 0.5000000 0.2858627 0.3548402), wk = 0.0023041 k( 390) = ( 0.5000000 0.2858627 0.3400552), wk = 0.0023041 k( 391) = ( 0.5000000 0.2858627 0.3252702), wk = 0.0023041 k( 392) = ( 0.5000000 0.2858627 0.3104852), wk = 0.0023041 k( 393) = ( 0.5000000 0.2858627 0.2957002), wk = 0.0023041 k( 394) = ( 0.5000000 0.2858627 0.2809152), wk = 0.0023041 k( 395) = ( 0.5000000 0.2858627 0.2661301), wk = 0.0023041 k( 396) = ( 0.5000000 0.2858627 0.2513451), wk = 0.0023041 k( 397) = ( 0.5000000 0.2858627 0.2365601), wk = 0.0023041 k( 398) = ( 0.5000000 0.2858627 0.2217751), wk = 0.0023041 k( 399) = ( 0.5000000 0.2858627 0.2069901), wk = 0.0023041 k( 400) = ( 0.5000000 0.2858627 0.1922051), wk = 0.0023041 k( 401) = ( 0.5000000 0.2858627 0.1774201), wk = 0.0023041 k( 402) = ( 0.5000000 0.2858627 0.1626351), wk = 0.0023041 k( 403) = ( 0.5000000 0.2858627 0.1478501), wk = 0.0023041 k( 404) = ( 0.5000000 0.2858627 0.1330651), wk = 0.0023041 k( 405) = ( 0.5000000 0.2858627 0.1182801), wk = 0.0023041 k( 406) = ( 0.5000000 0.2858627 0.1034951), wk = 0.0023041 k( 407) = ( 0.5000000 0.2858627 0.0887100), wk = 0.0023041 k( 408) = ( 0.5000000 0.2858627 0.0739250), wk = 0.0023041 k( 409) = ( 0.5000000 0.2858627 0.0591400), wk = 0.0023041 k( 410) = ( 0.5000000 0.2858627 0.0443550), wk = 0.0023041 k( 411) = ( 0.5000000 0.2858627 0.0295700), wk = 0.0023041 k( 412) = ( 0.5000000 0.2858627 0.0147850), wk = 0.0023041 k( 413) = ( 0.5000000 0.2858627 -0.0000000), wk = 0.0023041 k( 414) = ( 0.0000000 0.0000000 1.0073878), wk = 0.0023041 k( 415) = ( 0.0125000 0.0071466 1.0073878), wk = 0.0023041 k( 416) = ( 0.0250000 0.0142931 1.0073878), wk = 0.0023041 k( 417) = ( 0.0375000 0.0214397 1.0073878), wk = 0.0023041 k( 418) = ( 0.0500000 0.0285863 1.0073878), wk = 0.0023041 k( 419) = ( 0.0625000 0.0357328 1.0073878), wk = 0.0023041 k( 420) = ( 0.0750000 0.0428794 1.0073878), wk = 0.0023041 k( 421) = ( 0.0875000 0.0500260 1.0073878), wk = 0.0023041 k( 422) = ( 0.1000000 0.0571725 1.0073878), wk = 0.0023041 k( 423) = ( 0.1125000 0.0643191 1.0073878), wk = 0.0023041 k( 424) = ( 0.1250000 0.0714657 1.0073878), wk = 0.0023041 k( 425) = ( 0.1375000 0.0786122 1.0073878), wk = 0.0023041 k( 426) = ( 0.1500000 0.0857588 1.0073878), wk = 0.0023041 k( 427) = ( 0.1625000 0.0929054 1.0073878), wk = 0.0023041 k( 428) = ( 0.1750000 0.1000519 1.0073878), wk = 0.0023041 k( 429) = ( 0.1875000 0.1071985 1.0073878), wk = 0.0023041 k( 430) = ( 0.2000000 0.1143451 1.0073878), wk = 0.0023041 k( 431) = ( 0.2125000 0.1214916 1.0073878), wk = 0.0023041 k( 432) = ( 0.2250000 0.1286382 1.0073878), wk = 0.0023041 k( 433) = ( 0.2375000 0.1357848 1.0073878), wk = 0.0023041 k( 434) = ( 0.2500000 0.1429313 1.0073878), wk = 0.0023041 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 2) = ( 0.0000000 0.0000000 0.0073529), wk = 0.0023041 k( 3) = ( 0.0000000 0.0000000 0.0147059), wk = 0.0023041 k( 4) = ( 0.0000000 0.0000000 0.0220588), wk = 0.0023041 k( 5) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0023041 k( 6) = ( 0.0000000 0.0000000 0.0367647), wk = 0.0023041 k( 7) = ( 0.0000000 0.0000000 0.0441177), wk = 0.0023041 k( 8) = ( 0.0000000 0.0000000 0.0514706), wk = 0.0023041 k( 9) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0023041 k( 10) = ( 0.0000000 0.0000000 0.0661765), wk = 0.0023041 k( 11) = ( 0.0000000 0.0000000 0.0735294), wk = 0.0023041 k( 12) = ( 0.0000000 0.0000000 0.0808824), wk = 0.0023041 k( 13) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0023041 k( 14) = ( 0.0000000 0.0000000 0.0955882), wk = 0.0023041 k( 15) = ( 0.0000000 0.0000000 0.1029412), wk = 0.0023041 k( 16) = ( 0.0000000 0.0000000 0.1102941), wk = 0.0023041 k( 17) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0023041 k( 18) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0023041 k( 19) = ( 0.0000000 0.0000000 0.1323529), wk = 0.0023041 k( 20) = ( 0.0000000 0.0000000 0.1397059), wk = 0.0023041 k( 21) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0023041 k( 22) = ( 0.0000000 0.0000000 0.1544118), wk = 0.0023041 k( 23) = ( 0.0000000 0.0000000 0.1617647), wk = 0.0023041 k( 24) = ( 0.0000000 0.0000000 0.1691177), wk = 0.0023041 k( 25) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0023041 k( 26) = ( 0.0000000 0.0000000 0.1838235), wk = 0.0023041 k( 27) = ( 0.0000000 0.0000000 0.1911765), wk = 0.0023041 k( 28) = ( 0.0000000 0.0000000 0.1985294), wk = 0.0023041 k( 29) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0023041 k( 30) = ( 0.0000000 0.0000000 0.2132353), wk = 0.0023041 k( 31) = ( 0.0000000 0.0000000 0.2205882), wk = 0.0023041 k( 32) = ( 0.0000000 0.0000000 0.2279412), wk = 0.0023041 k( 33) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0023041 k( 34) = ( 0.0000000 0.0000000 0.2426471), wk = 0.0023041 k( 35) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0023041 k( 36) = ( 0.0000000 0.0000000 0.2573529), wk = 0.0023041 k( 37) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0023041 k( 38) = ( 0.0000000 0.0000000 0.2720588), wk = 0.0023041 k( 39) = ( 0.0000000 0.0000000 0.2794118), wk = 0.0023041 k( 40) = ( 0.0000000 0.0000000 0.2867647), wk = 0.0023041 k( 41) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0023041 k( 42) = ( 0.0000000 0.0000000 0.3014706), wk = 0.0023041 k( 43) = ( 0.0000000 0.0000000 0.3088235), wk = 0.0023041 k( 44) = ( 0.0000000 0.0000000 0.3161765), wk = 0.0023041 k( 45) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0023041 k( 46) = ( 0.0000000 0.0000000 0.3308823), wk = 0.0023041 k( 47) = ( 0.0000000 0.0000000 0.3382353), wk = 0.0023041 k( 48) = ( 0.0000000 0.0000000 0.3455882), wk = 0.0023041 k( 49) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0023041 k( 50) = ( 0.0000000 0.0000000 0.3602941), wk = 0.0023041 k( 51) = ( 0.0000000 0.0000000 0.3676471), wk = 0.0023041 k( 52) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0023041 k( 53) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0023041 k( 54) = ( 0.0000000 0.0000000 0.3897059), wk = 0.0023041 k( 55) = ( 0.0000000 0.0000000 0.3970588), wk = 0.0023041 k( 56) = ( 0.0000000 0.0000000 0.4044118), wk = 0.0023041 k( 57) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0023041 k( 58) = ( 0.0000000 0.0000000 0.4191177), wk = 0.0023041 k( 59) = ( 0.0000000 0.0000000 0.4264706), wk = 0.0023041 k( 60) = ( 0.0000000 0.0000000 0.4338235), wk = 0.0023041 k( 61) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0023041 k( 62) = ( 0.0000000 0.0000000 0.4485294), wk = 0.0023041 k( 63) = ( 0.0000000 0.0000000 0.4558824), wk = 0.0023041 k( 64) = ( 0.0000000 0.0000000 0.4632353), wk = 0.0023041 k( 65) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0023041 k( 66) = ( 0.0000000 0.0000000 0.4779412), wk = 0.0023041 k( 67) = ( 0.0000000 0.0000000 0.4852941), wk = 0.0023041 k( 68) = ( 0.0000000 0.0000000 0.4926471), wk = 0.0023041 k( 69) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023041 k( 70) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023041 k( 71) = ( -0.0074289 0.0074289 0.5000000), wk = 0.0023041 k( 72) = ( -0.0148577 0.0148577 0.5000000), wk = 0.0023041 k( 73) = ( -0.0222866 0.0222866 0.5000000), wk = 0.0023041 k( 74) = ( -0.0297155 0.0297155 0.5000000), wk = 0.0023041 k( 75) = ( -0.0371443 0.0371443 0.5000000), wk = 0.0023041 k( 76) = ( -0.0445732 0.0445732 0.5000000), wk = 0.0023041 k( 77) = ( -0.0520020 0.0520020 0.5000000), wk = 0.0023041 k( 78) = ( -0.0594309 0.0594309 0.5000000), wk = 0.0023041 k( 79) = ( -0.0668598 0.0668598 0.5000000), wk = 0.0023041 k( 80) = ( -0.0742886 0.0742886 0.5000000), wk = 0.0023041 k( 81) = ( -0.0817175 0.0817175 0.5000000), wk = 0.0023041 k( 82) = ( -0.0817175 0.0817175 0.5000000), wk = 0.0023041 k( 83) = ( -0.0869460 0.0869460 0.4947715), wk = 0.0023041 k( 84) = ( -0.0921745 0.0921745 0.4895429), wk = 0.0023041 k( 85) = ( -0.0974031 0.0974031 0.4843144), wk = 0.0023041 k( 86) = ( -0.1026316 0.1026316 0.4790859), wk = 0.0023041 k( 87) = ( -0.1078601 0.1078601 0.4738573), wk = 0.0023041 k( 88) = ( -0.1130887 0.1130887 0.4686288), wk = 0.0023041 k( 89) = ( -0.1183172 0.1183172 0.4634003), wk = 0.0023041 k( 90) = ( -0.1235457 0.1235457 0.4581717), wk = 0.0023041 k( 91) = ( -0.1287743 0.1287743 0.4529432), wk = 0.0023041 k( 92) = ( -0.1340028 0.1340028 0.4477147), wk = 0.0023041 k( 93) = ( -0.1392313 0.1392313 0.4424862), wk = 0.0023041 k( 94) = ( -0.1444599 0.1444599 0.4372576), wk = 0.0023041 k( 95) = ( -0.1496884 0.1496884 0.4320291), wk = 0.0023041 k( 96) = ( -0.1549169 0.1549169 0.4268006), wk = 0.0023041 k( 97) = ( -0.1601454 0.1601454 0.4215720), wk = 0.0023041 k( 98) = ( -0.1653740 0.1653740 0.4163435), wk = 0.0023041 k( 99) = ( -0.1706025 0.1706025 0.4111150), wk = 0.0023041 k( 100) = ( -0.1758310 0.1758310 0.4058864), wk = 0.0023041 k( 101) = ( -0.1810596 0.1810596 0.4006579), wk = 0.0023041 k( 102) = ( -0.1862881 0.1862881 0.3954294), wk = 0.0023041 k( 103) = ( -0.1915166 0.1915166 0.3902008), wk = 0.0023041 k( 104) = ( -0.1967452 0.1967452 0.3849723), wk = 0.0023041 k( 105) = ( -0.2019737 0.2019737 0.3797438), wk = 0.0023041 k( 106) = ( -0.2072022 0.2072022 0.3745152), wk = 0.0023041 k( 107) = ( -0.2124308 0.2124308 0.3692867), wk = 0.0023041 k( 108) = ( -0.2176593 0.2176593 0.3640582), wk = 0.0023041 k( 109) = ( -0.2228878 0.2228878 0.3588296), wk = 0.0023041 k( 110) = ( -0.2281164 0.2281164 0.3536011), wk = 0.0023041 k( 111) = ( -0.2333449 0.2333449 0.3483726), wk = 0.0023041 k( 112) = ( -0.2385734 0.2385734 0.3431441), wk = 0.0023041 k( 113) = ( -0.2438020 0.2438020 0.3379155), wk = 0.0023041 k( 114) = ( -0.2490305 0.2490305 0.3326870), wk = 0.0023041 k( 115) = ( -0.2542590 0.2542590 0.3274585), wk = 0.0023041 k( 116) = ( -0.2594876 0.2594876 0.3222299), wk = 0.0023041 k( 117) = ( -0.2647161 0.2647161 0.3170014), wk = 0.0023041 k( 118) = ( -0.2699446 0.2699446 0.3117729), wk = 0.0023041 k( 119) = ( -0.2751731 0.2751731 0.3065443), wk = 0.0023041 k( 120) = ( -0.2804017 0.2804017 0.3013158), wk = 0.0023041 k( 121) = ( -0.2856302 0.2856302 0.2960873), wk = 0.0023041 k( 122) = ( -0.2908587 0.2908587 0.2908587), wk = 0.0023041 k( 123) = ( -0.2908587 0.2908587 0.2908587), wk = 0.0023041 k( 124) = ( -0.2856648 0.2856648 0.2856648), wk = 0.0023041 k( 125) = ( -0.2804709 0.2804709 0.2804709), wk = 0.0023041 k( 126) = ( -0.2752770 0.2752770 0.2752770), wk = 0.0023041 k( 127) = ( -0.2700831 0.2700831 0.2700831), wk = 0.0023041 k( 128) = ( -0.2648892 0.2648892 0.2648892), wk = 0.0023041 k( 129) = ( -0.2596953 0.2596953 0.2596953), wk = 0.0023041 k( 130) = ( -0.2545014 0.2545014 0.2545014), wk = 0.0023041 k( 131) = ( -0.2493075 0.2493075 0.2493075), wk = 0.0023041 k( 132) = ( -0.2441136 0.2441136 0.2441136), wk = 0.0023041 k( 133) = ( -0.2389197 0.2389197 0.2389197), wk = 0.0023041 k( 134) = ( -0.2337258 0.2337258 0.2337258), wk = 0.0023041 k( 135) = ( -0.2285319 0.2285319 0.2285319), wk = 0.0023041 k( 136) = ( -0.2233380 0.2233380 0.2233380), wk = 0.0023041 k( 137) = ( -0.2181441 0.2181440 0.2181441), wk = 0.0023041 k( 138) = ( -0.2129502 0.2129501 0.2129502), wk = 0.0023041 k( 139) = ( -0.2077562 0.2077562 0.2077562), wk = 0.0023041 k( 140) = ( -0.2025623 0.2025623 0.2025623), wk = 0.0023041 k( 141) = ( -0.1973684 0.1973684 0.1973684), wk = 0.0023041 k( 142) = ( -0.1921745 0.1921745 0.1921745), wk = 0.0023041 k( 143) = ( -0.1869806 0.1869806 0.1869806), wk = 0.0023041 k( 144) = ( -0.1817867 0.1817867 0.1817867), wk = 0.0023041 k( 145) = ( -0.1765928 0.1765928 0.1765928), wk = 0.0023041 k( 146) = ( -0.1713989 0.1713989 0.1713989), wk = 0.0023041 k( 147) = ( -0.1662050 0.1662050 0.1662050), wk = 0.0023041 k( 148) = ( -0.1610111 0.1610111 0.1610111), wk = 0.0023041 k( 149) = ( -0.1558172 0.1558172 0.1558172), wk = 0.0023041 k( 150) = ( -0.1506233 0.1506233 0.1506233), wk = 0.0023041 k( 151) = ( -0.1454294 0.1454294 0.1454294), wk = 0.0023041 k( 152) = ( -0.1402355 0.1402355 0.1402355), wk = 0.0023041 k( 153) = ( -0.1350416 0.1350416 0.1350416), wk = 0.0023041 k( 154) = ( -0.1298477 0.1298476 0.1298477), wk = 0.0023041 k( 155) = ( -0.1246537 0.1246537 0.1246537), wk = 0.0023041 k( 156) = ( -0.1194598 0.1194598 0.1194598), wk = 0.0023041 k( 157) = ( -0.1142659 0.1142659 0.1142659), wk = 0.0023041 k( 158) = ( -0.1090720 0.1090720 0.1090720), wk = 0.0023041 k( 159) = ( -0.1038781 0.1038781 0.1038781), wk = 0.0023041 k( 160) = ( -0.0986842 0.0986842 0.0986842), wk = 0.0023041 k( 161) = ( -0.0934903 0.0934903 0.0934903), wk = 0.0023041 k( 162) = ( -0.0882964 0.0882964 0.0882964), wk = 0.0023041 k( 163) = ( -0.0831025 0.0831025 0.0831025), wk = 0.0023041 k( 164) = ( -0.0779086 0.0779086 0.0779086), wk = 0.0023041 k( 165) = ( -0.0727147 0.0727147 0.0727147), wk = 0.0023041 k( 166) = ( -0.0675208 0.0675208 0.0675208), wk = 0.0023041 k( 167) = ( -0.0623269 0.0623269 0.0623269), wk = 0.0023041 k( 168) = ( -0.0571330 0.0571330 0.0571330), wk = 0.0023041 k( 169) = ( -0.0519391 0.0519391 0.0519391), wk = 0.0023041 k( 170) = ( -0.0467451 0.0467452 0.0467452), wk = 0.0023041 k( 171) = ( -0.0415512 0.0415512 0.0415512), wk = 0.0023041 k( 172) = ( -0.0363573 0.0363573 0.0363573), wk = 0.0023041 k( 173) = ( -0.0311634 0.0311634 0.0311634), wk = 0.0023041 k( 174) = ( -0.0259695 0.0259695 0.0259695), wk = 0.0023041 k( 175) = ( -0.0207756 0.0207756 0.0207756), wk = 0.0023041 k( 176) = ( -0.0155817 0.0155817 0.0155817), wk = 0.0023041 k( 177) = ( -0.0103878 0.0103878 0.0103878), wk = 0.0023041 k( 178) = ( -0.0051939 0.0051939 0.0051939), wk = 0.0023041 k( 179) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 180) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023041 k( 181) = ( 0.0128205 0.0128205 -0.0128205), wk = 0.0023041 k( 182) = ( 0.0256410 0.0256410 -0.0256410), wk = 0.0023041 k( 183) = ( 0.0384615 0.0384615 -0.0384615), wk = 0.0023041 k( 184) = ( 0.0512821 0.0512821 -0.0512821), wk = 0.0023041 k( 185) = ( 0.0641026 0.0641026 -0.0641026), wk = 0.0023041 k( 186) = ( 0.0769231 0.0769231 -0.0769231), wk = 0.0023041 k( 187) = ( 0.0897436 0.0897436 -0.0897436), wk = 0.0023041 k( 188) = ( 0.1025641 0.1025641 -0.1025641), wk = 0.0023041 k( 189) = ( 0.1153846 0.1153846 -0.1153846), wk = 0.0023041 k( 190) = ( 0.1282051 0.1282051 -0.1282051), wk = 0.0023041 k( 191) = ( 0.1410256 0.1410256 -0.1410256), wk = 0.0023041 k( 192) = ( 0.1538461 0.1538462 -0.1538462), wk = 0.0023041 k( 193) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0023041 k( 194) = ( 0.1794872 0.1794872 -0.1794872), wk = 0.0023041 k( 195) = ( 0.1923077 0.1923077 -0.1923077), wk = 0.0023041 k( 196) = ( 0.2051282 0.2051282 -0.2051282), wk = 0.0023041 k( 197) = ( 0.2179487 0.2179487 -0.2179487), wk = 0.0023041 k( 198) = ( 0.2307692 0.2307692 -0.2307692), wk = 0.0023041 k( 199) = ( 0.2435897 0.2435897 -0.2435897), wk = 0.0023041 k( 200) = ( 0.2564103 0.2564103 -0.2564103), wk = 0.0023041 k( 201) = ( 0.2692308 0.2692308 -0.2692308), wk = 0.0023041 k( 202) = ( 0.2820513 0.2820513 -0.2820513), wk = 0.0023041 k( 203) = ( 0.2948718 0.2948718 -0.2948718), wk = 0.0023041 k( 204) = ( 0.3076923 0.3076923 -0.3076923), wk = 0.0023041 k( 205) = ( 0.3205128 0.3205128 -0.3205128), wk = 0.0023041 k( 206) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0023041 k( 207) = ( 0.3461538 0.3461539 -0.3461539), wk = 0.0023041 k( 208) = ( 0.3589744 0.3589744 -0.3589744), wk = 0.0023041 k( 209) = ( 0.3717949 0.3717949 -0.3717949), wk = 0.0023041 k( 210) = ( 0.3846154 0.3846154 -0.3846154), wk = 0.0023041 k( 211) = ( 0.3974359 0.3974359 -0.3974359), wk = 0.0023041 k( 212) = ( 0.4102564 0.4102564 -0.4102564), wk = 0.0023041 k( 213) = ( 0.4230769 0.4230769 -0.4230769), wk = 0.0023041 k( 214) = ( 0.4358974 0.4358974 -0.4358974), wk = 0.0023041 k( 215) = ( 0.4487179 0.4487180 -0.4487180), wk = 0.0023041 k( 216) = ( 0.4615385 0.4615385 -0.4615385), wk = 0.0023041 k( 217) = ( 0.4743590 0.4743590 -0.4743590), wk = 0.0023041 k( 218) = ( 0.4871795 0.4871795 -0.4871795), wk = 0.0023041 k( 219) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0023041 k( 220) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0023041 k( 221) = ( 0.4947715 0.5052285 -0.4947715), wk = 0.0023041 k( 222) = ( 0.4895429 0.5104571 -0.4895429), wk = 0.0023041 k( 223) = ( 0.4843144 0.5156856 -0.4843144), wk = 0.0023041 k( 224) = ( 0.4790859 0.5209141 -0.4790859), wk = 0.0023041 k( 225) = ( 0.4738573 0.5261427 -0.4738573), wk = 0.0023041 k( 226) = ( 0.4686288 0.5313712 -0.4686288), wk = 0.0023041 k( 227) = ( 0.4634003 0.5365997 -0.4634003), wk = 0.0023041 k( 228) = ( 0.4581717 0.5418283 -0.4581718), wk = 0.0023041 k( 229) = ( 0.4529432 0.5470568 -0.4529432), wk = 0.0023041 k( 230) = ( 0.4477147 0.5522853 -0.4477147), wk = 0.0023041 k( 231) = ( 0.4424862 0.5575138 -0.4424862), wk = 0.0023041 k( 232) = ( 0.4372576 0.5627424 -0.4372576), wk = 0.0023041 k( 233) = ( 0.4320291 0.5679709 -0.4320291), wk = 0.0023041 k( 234) = ( 0.4268006 0.5731994 -0.4268006), wk = 0.0023041 k( 235) = ( 0.4215720 0.5784280 -0.4215720), wk = 0.0023041 k( 236) = ( 0.4163435 0.5836565 -0.4163435), wk = 0.0023041 k( 237) = ( 0.4111150 0.5888850 -0.4111150), wk = 0.0023041 k( 238) = ( 0.4058864 0.5941136 -0.4058864), wk = 0.0023041 k( 239) = ( 0.4006579 0.5993421 -0.4006579), wk = 0.0023041 k( 240) = ( 0.3954294 0.6045706 -0.3954294), wk = 0.0023041 k( 241) = ( 0.3902008 0.6097992 -0.3902008), wk = 0.0023041 k( 242) = ( 0.3849723 0.6150277 -0.3849723), wk = 0.0023041 k( 243) = ( 0.3797438 0.6202562 -0.3797438), wk = 0.0023041 k( 244) = ( 0.3745152 0.6254848 -0.3745152), wk = 0.0023041 k( 245) = ( 0.3692867 0.6307133 -0.3692867), wk = 0.0023041 k( 246) = ( 0.3640582 0.6359418 -0.3640582), wk = 0.0023041 k( 247) = ( 0.3588296 0.6411704 -0.3588297), wk = 0.0023041 k( 248) = ( 0.3536011 0.6463989 -0.3536011), wk = 0.0023041 k( 249) = ( 0.3483726 0.6516274 -0.3483726), wk = 0.0023041 k( 250) = ( 0.3431440 0.6568560 -0.3431441), wk = 0.0023041 k( 251) = ( 0.3379155 0.6620845 -0.3379155), wk = 0.0023041 k( 252) = ( 0.3326870 0.6673130 -0.3326870), wk = 0.0023041 k( 253) = ( 0.3274585 0.6725415 -0.3274585), wk = 0.0023041 k( 254) = ( 0.3222299 0.6777701 -0.3222299), wk = 0.0023041 k( 255) = ( 0.3170014 0.6829986 -0.3170014), wk = 0.0023041 k( 256) = ( 0.3117729 0.6882271 -0.3117729), wk = 0.0023041 k( 257) = ( 0.3065443 0.6934557 -0.3065443), wk = 0.0023041 k( 258) = ( 0.3013158 0.6986842 -0.3013158), wk = 0.0023041 k( 259) = ( 0.2960873 0.7039127 -0.2960873), wk = 0.0023041 k( 260) = ( 0.2908587 0.7091413 -0.2908587), wk = 0.0023041 k( 261) = ( 0.2908587 0.7091413 -0.2908587), wk = 0.0023041 k( 262) = ( 0.2770083 0.6991821 -0.2770083), wk = 0.0023041 k( 263) = ( 0.2631579 0.6892230 -0.2631579), wk = 0.0023041 k( 264) = ( 0.2493075 0.6792639 -0.2493075), wk = 0.0023041 k( 265) = ( 0.2354571 0.6693048 -0.2354571), wk = 0.0023041 k( 266) = ( 0.2216067 0.6593457 -0.2216067), wk = 0.0023041 k( 267) = ( 0.2077562 0.6493866 -0.2077562), wk = 0.0023041 k( 268) = ( 0.1939058 0.6394275 -0.1939058), wk = 0.0023041 k( 269) = ( 0.1800554 0.6294684 -0.1800554), wk = 0.0023041 k( 270) = ( 0.1662050 0.6195093 -0.1662050), wk = 0.0023041 k( 271) = ( 0.1523546 0.6095502 -0.1523546), wk = 0.0023041 k( 272) = ( 0.1385042 0.5995911 -0.1385042), wk = 0.0023041 k( 273) = ( 0.1246537 0.5896320 -0.1246538), wk = 0.0023041 k( 274) = ( 0.1108033 0.5796729 -0.1108033), wk = 0.0023041 k( 275) = ( 0.0969529 0.5697137 -0.0969529), wk = 0.0023041 k( 276) = ( 0.0831025 0.5597547 -0.0831025), wk = 0.0023041 k( 277) = ( 0.0692521 0.5497955 -0.0692521), wk = 0.0023041 k( 278) = ( 0.0554017 0.5398364 -0.0554017), wk = 0.0023041 k( 279) = ( 0.0415512 0.5298773 -0.0415513), wk = 0.0023041 k( 280) = ( 0.0277008 0.5199182 -0.0277008), wk = 0.0023041 k( 281) = ( 0.0138504 0.5099591 -0.0138504), wk = 0.0023041 k( 282) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023041 k( 283) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0023041 k( 284) = ( 0.0052083 0.4947917 0.0052083), wk = 0.0023041 k( 285) = ( 0.0104167 0.4895833 0.0104167), wk = 0.0023041 k( 286) = ( 0.0156250 0.4843750 0.0156250), wk = 0.0023041 k( 287) = ( 0.0208333 0.4791667 0.0208333), wk = 0.0023041 k( 288) = ( 0.0260417 0.4739583 0.0260417), wk = 0.0023041 k( 289) = ( 0.0312500 0.4687500 0.0312500), wk = 0.0023041 k( 290) = ( 0.0364583 0.4635417 0.0364583), wk = 0.0023041 k( 291) = ( 0.0416667 0.4583333 0.0416667), wk = 0.0023041 k( 292) = ( 0.0468750 0.4531250 0.0468750), wk = 0.0023041 k( 293) = ( 0.0520833 0.4479167 0.0520833), wk = 0.0023041 k( 294) = ( 0.0572917 0.4427083 0.0572917), wk = 0.0023041 k( 295) = ( 0.0625000 0.4375000 0.0625000), wk = 0.0023041 k( 296) = ( 0.0677083 0.4322917 0.0677083), wk = 0.0023041 k( 297) = ( 0.0729167 0.4270833 0.0729167), wk = 0.0023041 k( 298) = ( 0.0781250 0.4218750 0.0781250), wk = 0.0023041 k( 299) = ( 0.0833333 0.4166667 0.0833333), wk = 0.0023041 k( 300) = ( 0.0885417 0.4114583 0.0885417), wk = 0.0023041 k( 301) = ( 0.0937500 0.4062500 0.0937500), wk = 0.0023041 k( 302) = ( 0.0989583 0.4010417 0.0989583), wk = 0.0023041 k( 303) = ( 0.1041667 0.3958333 0.1041667), wk = 0.0023041 k( 304) = ( 0.1093750 0.3906250 0.1093750), wk = 0.0023041 k( 305) = ( 0.1145833 0.3854167 0.1145833), wk = 0.0023041 k( 306) = ( 0.1197917 0.3802083 0.1197917), wk = 0.0023041 k( 307) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0023041 k( 308) = ( 0.1302083 0.3697917 0.1302083), wk = 0.0023041 k( 309) = ( 0.1354167 0.3645833 0.1354167), wk = 0.0023041 k( 310) = ( 0.1406250 0.3593750 0.1406250), wk = 0.0023041 k( 311) = ( 0.1458333 0.3541667 0.1458333), wk = 0.0023041 k( 312) = ( 0.1510417 0.3489583 0.1510417), wk = 0.0023041 k( 313) = ( 0.1562500 0.3437500 0.1562500), wk = 0.0023041 k( 314) = ( 0.1614583 0.3385417 0.1614583), wk = 0.0023041 k( 315) = ( 0.1666667 0.3333333 0.1666667), wk = 0.0023041 k( 316) = ( 0.1718750 0.3281250 0.1718750), wk = 0.0023041 k( 317) = ( 0.1770833 0.3229167 0.1770833), wk = 0.0023041 k( 318) = ( 0.1822917 0.3177083 0.1822917), wk = 0.0023041 k( 319) = ( 0.1875000 0.3125000 0.1875000), wk = 0.0023041 k( 320) = ( 0.1927083 0.3072917 0.1927083), wk = 0.0023041 k( 321) = ( 0.1979167 0.3020833 0.1979167), wk = 0.0023041 k( 322) = ( 0.2031250 0.2968750 0.2031250), wk = 0.0023041 k( 323) = ( 0.2083333 0.2916667 0.2083333), wk = 0.0023041 k( 324) = ( 0.2135417 0.2864583 0.2135417), wk = 0.0023041 k( 325) = ( 0.2187500 0.2812500 0.2187500), wk = 0.0023041 k( 326) = ( 0.2239583 0.2760417 0.2239583), wk = 0.0023041 k( 327) = ( 0.2291667 0.2708333 0.2291667), wk = 0.0023041 k( 328) = ( 0.2343750 0.2656250 0.2343750), wk = 0.0023041 k( 329) = ( 0.2395833 0.2604167 0.2395833), wk = 0.0023041 k( 330) = ( 0.2447917 0.2552083 0.2447917), wk = 0.0023041 k( 331) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0023041 k( 332) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0023041 k( 333) = ( 0.2608696 0.2608696 0.2355775), wk = 0.0023041 k( 334) = ( 0.2717391 0.2717391 0.2211550), wk = 0.0023041 k( 335) = ( 0.2826087 0.2826087 0.2067325), wk = 0.0023041 k( 336) = ( 0.2934783 0.2934783 0.1923100), wk = 0.0023041 k( 337) = ( 0.3043478 0.3043478 0.1778875), wk = 0.0023041 k( 338) = ( 0.3152174 0.3152174 0.1634650), wk = 0.0023041 k( 339) = ( 0.3260870 0.3260870 0.1490425), wk = 0.0023041 k( 340) = ( 0.3369565 0.3369565 0.1346200), wk = 0.0023041 k( 341) = ( 0.3478261 0.3478261 0.1201975), wk = 0.0023041 k( 342) = ( 0.3586956 0.3586957 0.1057750), wk = 0.0023041 k( 343) = ( 0.3695652 0.3695652 0.0913525), wk = 0.0023041 k( 344) = ( 0.3804348 0.3804348 0.0769300), wk = 0.0023041 k( 345) = ( 0.3913044 0.3913044 0.0625075), wk = 0.0023041 k( 346) = ( 0.4021739 0.4021739 0.0480850), wk = 0.0023041 k( 347) = ( 0.4130435 0.4130435 0.0336625), wk = 0.0023041 k( 348) = ( 0.4239130 0.4239130 0.0192400), wk = 0.0023041 k( 349) = ( 0.4347826 0.4347826 0.0048175), wk = 0.0023041 k( 350) = ( 0.4456522 0.4456522 -0.0096050), wk = 0.0023041 k( 351) = ( 0.4565217 0.4565217 -0.0240275), wk = 0.0023041 k( 352) = ( 0.4673913 0.4673913 -0.0384500), wk = 0.0023041 k( 353) = ( 0.4782609 0.4782609 -0.0528725), wk = 0.0023041 k( 354) = ( 0.4891304 0.4891304 -0.0672950), wk = 0.0023041 k( 355) = ( 0.5000000 0.5000000 -0.0817175), wk = 0.0023041 k( 356) = ( 0.5000000 0.5000000 -0.0817175), wk = 0.0023041 k( 357) = ( 0.5000000 0.5000000 -0.0890558), wk = 0.0023041 k( 358) = ( 0.5000000 0.5000000 -0.0963941), wk = 0.0023041 k( 359) = ( 0.5000000 0.5000000 -0.1037324), wk = 0.0023041 k( 360) = ( 0.5000000 0.5000000 -0.1110706), wk = 0.0023041 k( 361) = ( 0.5000000 0.5000000 -0.1184089), wk = 0.0023041 k( 362) = ( 0.5000000 0.5000000 -0.1257472), wk = 0.0023041 k( 363) = ( 0.5000000 0.5000000 -0.1330855), wk = 0.0023041 k( 364) = ( 0.5000000 0.5000000 -0.1404238), wk = 0.0023041 k( 365) = ( 0.5000000 0.5000000 -0.1477621), wk = 0.0023041 k( 366) = ( 0.5000000 0.5000000 -0.1551004), wk = 0.0023041 k( 367) = ( 0.5000000 0.5000000 -0.1624387), wk = 0.0023041 k( 368) = ( 0.5000000 0.5000000 -0.1697770), wk = 0.0023041 k( 369) = ( 0.5000000 0.5000000 -0.1771153), wk = 0.0023041 k( 370) = ( 0.5000000 0.5000000 -0.1844535), wk = 0.0023041 k( 371) = ( 0.5000000 0.5000000 -0.1917918), wk = 0.0023041 k( 372) = ( 0.5000000 0.5000000 -0.1991301), wk = 0.0023041 k( 373) = ( 0.5000000 0.5000000 -0.2064684), wk = 0.0023041 k( 374) = ( 0.5000000 0.5000000 -0.2138067), wk = 0.0023041 k( 375) = ( 0.5000000 0.5000000 -0.2211450), wk = 0.0023041 k( 376) = ( 0.5000000 0.5000000 -0.2284833), wk = 0.0023041 k( 377) = ( 0.5000000 0.5000000 -0.2358216), wk = 0.0023041 k( 378) = ( 0.5000000 0.5000000 -0.2431599), wk = 0.0023041 k( 379) = ( 0.5000000 0.5000000 -0.2504982), wk = 0.0023041 k( 380) = ( 0.5000000 0.5000000 -0.2578364), wk = 0.0023041 k( 381) = ( 0.5000000 0.5000000 -0.2651747), wk = 0.0023041 k( 382) = ( 0.5000000 0.5000000 -0.2725130), wk = 0.0023041 k( 383) = ( 0.5000000 0.5000000 -0.2798513), wk = 0.0023041 k( 384) = ( 0.5000000 0.5000000 -0.2871896), wk = 0.0023041 k( 385) = ( 0.5000000 0.5000000 -0.2945279), wk = 0.0023041 k( 386) = ( 0.5000000 0.5000000 -0.3018662), wk = 0.0023041 k( 387) = ( 0.5000000 0.5000000 -0.3092045), wk = 0.0023041 k( 388) = ( 0.5000000 0.5000000 -0.3165428), wk = 0.0023041 k( 389) = ( 0.5000000 0.5000000 -0.3238810), wk = 0.0023041 k( 390) = ( 0.5000000 0.5000000 -0.3312193), wk = 0.0023041 k( 391) = ( 0.5000000 0.5000000 -0.3385576), wk = 0.0023041 k( 392) = ( 0.5000000 0.5000000 -0.3458959), wk = 0.0023041 k( 393) = ( 0.5000000 0.5000000 -0.3532342), wk = 0.0023041 k( 394) = ( 0.5000000 0.5000000 -0.3605725), wk = 0.0023041 k( 395) = ( 0.5000000 0.5000000 -0.3679108), wk = 0.0023041 k( 396) = ( 0.5000000 0.5000000 -0.3752491), wk = 0.0023041 k( 397) = ( 0.5000000 0.5000000 -0.3825874), wk = 0.0023041 k( 398) = ( 0.5000000 0.5000000 -0.3899257), wk = 0.0023041 k( 399) = ( 0.5000000 0.5000000 -0.3972639), wk = 0.0023041 k( 400) = ( 0.5000000 0.5000000 -0.4046022), wk = 0.0023041 k( 401) = ( 0.5000000 0.5000000 -0.4119405), wk = 0.0023041 k( 402) = ( 0.5000000 0.5000000 -0.4192788), wk = 0.0023041 k( 403) = ( 0.5000000 0.5000000 -0.4266171), wk = 0.0023041 k( 404) = ( 0.5000000 0.5000000 -0.4339554), wk = 0.0023041 k( 405) = ( 0.5000000 0.5000000 -0.4412937), wk = 0.0023041 k( 406) = ( 0.5000000 0.5000000 -0.4486320), wk = 0.0023041 k( 407) = ( 0.5000000 0.5000000 -0.4559703), wk = 0.0023041 k( 408) = ( 0.5000000 0.5000000 -0.4633086), wk = 0.0023041 k( 409) = ( 0.5000000 0.5000000 -0.4706468), wk = 0.0023041 k( 410) = ( 0.5000000 0.5000000 -0.4779851), wk = 0.0023041 k( 411) = ( 0.5000000 0.5000000 -0.4853234), wk = 0.0023041 k( 412) = ( 0.5000000 0.5000000 -0.4926617), wk = 0.0023041 k( 413) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0023041 k( 414) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023041 k( 415) = ( 0.0125000 0.0125000 0.4875000), wk = 0.0023041 k( 416) = ( 0.0250000 0.0250000 0.4750000), wk = 0.0023041 k( 417) = ( 0.0375000 0.0375000 0.4625000), wk = 0.0023041 k( 418) = ( 0.0500000 0.0500000 0.4500000), wk = 0.0023041 k( 419) = ( 0.0625000 0.0625000 0.4375000), wk = 0.0023041 k( 420) = ( 0.0750000 0.0750000 0.4250000), wk = 0.0023041 k( 421) = ( 0.0875000 0.0875000 0.4125000), wk = 0.0023041 k( 422) = ( 0.1000000 0.1000000 0.4000000), wk = 0.0023041 k( 423) = ( 0.1125000 0.1125000 0.3875000), wk = 0.0023041 k( 424) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0023041 k( 425) = ( 0.1375000 0.1375000 0.3625000), wk = 0.0023041 k( 426) = ( 0.1500000 0.1500000 0.3500000), wk = 0.0023041 k( 427) = ( 0.1625000 0.1625000 0.3375000), wk = 0.0023041 k( 428) = ( 0.1750000 0.1750000 0.3250000), wk = 0.0023041 k( 429) = ( 0.1875000 0.1875000 0.3125000), wk = 0.0023041 k( 430) = ( 0.2000000 0.2000000 0.3000000), wk = 0.0023041 k( 431) = ( 0.2125000 0.2125000 0.2875000), wk = 0.0023041 k( 432) = ( 0.2250000 0.2250000 0.2750000), wk = 0.0023041 k( 433) = ( 0.2375000 0.2375000 0.2625000), wk = 0.0023041 k( 434) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0023041 Dense grid: 27555 G-vectors FFT dimensions: ( 50, 50, 50) Smooth grid: 14467 G-vectors FFT dimensions: ( 45, 45, 45) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.05 Mb ( 108, 30) NL pseudopotentials 0.05 Mb ( 54, 62) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 766) G-vector shells 0.00 Mb ( 374) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.20 Mb ( 108, 120) Each subspace H/S matrix 0.01 Mb ( 30, 30) Each matrix 0.06 Mb ( 62, 2, 30) The potential is recalculated from file : ./Ge2Mo.save/charge-density.dat Starting wfc are 36 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.5 secs Computing kpt #: 2 total cpu time spent up to now is 2.7 secs Computing kpt #: 3 total cpu time spent up to now is 2.9 secs Computing kpt #: 4 total cpu time spent up to now is 3.1 secs Computing kpt #: 5 total cpu time spent up to now is 3.3 secs Computing kpt #: 6 total cpu time spent up to now is 3.5 secs Computing kpt #: 7 total cpu time spent up to now is 3.7 secs Computing kpt #: 8 total cpu time spent up to now is 3.9 secs Computing kpt #: 9 total cpu time spent up to now is 4.1 secs Computing kpt #: 10 total cpu time spent up to now is 4.3 secs Computing kpt #: 11 total cpu time spent up to now is 4.6 secs Computing kpt #: 12 total cpu time spent up to now is 4.8 secs Computing kpt #: 13 total cpu time spent up to now is 5.0 secs Computing kpt #: 14 total cpu time spent up to now is 5.2 secs Computing kpt #: 15 total cpu time spent up to now is 5.4 secs Computing kpt #: 16 total cpu time spent up to now is 5.6 secs Computing kpt #: 17 total cpu time spent up to now is 5.8 secs Computing kpt #: 18 total cpu time spent up to now is 6.1 secs Computing kpt #: 19 total cpu time spent up to now is 6.3 secs Computing kpt #: 20 total cpu time spent up to now is 6.5 secs Computing kpt #: 21 total cpu time spent up to now is 6.7 secs Computing kpt #: 22 total cpu time spent up to now is 6.9 secs Computing kpt #: 23 total cpu time spent up to now is 7.1 secs Computing kpt #: 24 total cpu time spent up to now is 7.3 secs Computing kpt #: 25 total cpu time spent up to now is 7.5 secs Computing kpt #: 26 total cpu time spent up to now is 7.7 secs Computing kpt #: 27 total cpu time spent up to now is 7.9 secs Computing kpt #: 28 total cpu time spent up to now is 8.1 secs Computing kpt #: 29 total cpu time spent up to now is 8.3 secs Computing kpt #: 30 total cpu time spent up to now is 8.5 secs Computing kpt #: 31 total cpu time spent up to now is 8.7 secs Computing kpt #: 32 total cpu time spent up to now is 8.9 secs Computing kpt #: 33 total cpu time spent up to now is 9.1 secs Computing kpt #: 34 total cpu time spent up to now is 9.3 secs Computing kpt #: 35 total cpu time spent up to now is 9.5 secs Computing kpt #: 36 total cpu time spent up to now is 9.8 secs Computing kpt #: 37 total cpu time spent up to now is 10.0 secs Computing kpt #: 38 total cpu time spent up to now is 10.2 secs Computing kpt #: 39 total cpu time spent up to now is 10.4 secs Computing kpt #: 40 total cpu time spent up to now is 10.6 secs Computing kpt #: 41 total cpu time spent up to now is 10.8 secs Computing kpt #: 42 total cpu time spent up to now is 11.0 secs Computing kpt #: 43 total cpu time spent up to now is 11.2 secs Computing kpt #: 44 total cpu time spent up to now is 11.4 secs Computing kpt #: 45 total cpu time spent up to now is 11.6 secs Computing kpt #: 46 total cpu time spent up to now is 11.8 secs Computing kpt #: 47 total cpu time spent up to now is 12.0 secs Computing kpt #: 48 total cpu time spent up to now is 12.2 secs Computing kpt #: 49 total cpu time spent up to now is 12.4 secs Computing kpt #: 50 total cpu time spent up to now is 12.5 secs Computing kpt #: 51 total cpu time spent up to now is 12.7 secs Computing kpt #: 52 total cpu time spent up to now is 12.9 secs Computing kpt #: 53 total cpu time spent up to now is 13.1 secs Computing kpt #: 54 total cpu time spent up to now is 13.3 secs Computing kpt #: 55 total cpu time spent up to now is 13.5 secs Computing kpt #: 56 total cpu time spent up to now is 13.6 secs Computing kpt #: 57 total cpu time spent up to now is 13.8 secs Computing kpt #: 58 total cpu time spent up to now is 14.0 secs Computing kpt #: 59 total cpu time spent up to now is 14.1 secs Computing kpt #: 60 total cpu time spent up to now is 14.3 secs Computing kpt #: 61 total cpu time spent up to now is 14.5 secs Computing kpt #: 62 total cpu time spent up to now is 14.6 secs Computing kpt #: 63 total cpu time spent up to now is 14.8 secs Computing kpt #: 64 total cpu time spent up to now is 14.9 secs Computing kpt #: 65 total cpu time spent up to now is 15.1 secs Computing kpt #: 66 total cpu time spent up to now is 15.3 secs Computing kpt #: 67 total cpu time spent up to now is 15.4 secs Computing kpt #: 68 total cpu time spent up to now is 15.6 secs Computing kpt #: 69 total cpu time spent up to now is 15.7 secs Computing kpt #: 70 total cpu time spent up to now is 15.9 secs Computing kpt #: 71 total cpu time spent up to now is 16.0 secs Computing kpt #: 72 total cpu time spent up to now is 16.2 secs Computing kpt #: 73 total cpu time spent up to now is 16.4 secs Computing kpt #: 74 total cpu time spent up to now is 16.5 secs Computing kpt #: 75 total cpu time spent up to now is 16.7 secs Computing kpt #: 76 total cpu time spent up to now is 16.8 secs Computing kpt #: 77 total cpu time spent up to now is 17.0 secs Computing kpt #: 78 total cpu time spent up to now is 17.2 secs Computing kpt #: 79 total cpu time spent up to now is 17.3 secs Computing kpt #: 80 total cpu time spent up to now is 17.5 secs Computing kpt #: 81 total cpu time spent up to now is 17.6 secs Computing kpt #: 82 total cpu time spent up to now is 17.8 secs Computing kpt #: 83 total cpu time spent up to now is 18.0 secs Computing kpt #: 84 total cpu time spent up to now is 18.2 secs Computing kpt #: 85 total cpu time spent up to now is 18.3 secs Computing kpt #: 86 total cpu time spent up to now is 18.5 secs Computing kpt #: 87 total cpu time spent up to now is 18.7 secs Computing kpt #: 88 total cpu time spent up to now is 18.9 secs Computing kpt #: 89 total cpu time spent up to now is 19.1 secs Computing kpt #: 90 total cpu time spent up to now is 19.3 secs Computing kpt #: 91 total cpu time spent up to now is 19.5 secs Computing kpt #: 92 total cpu time spent up to now is 19.7 secs Computing kpt #: 93 total cpu time spent up to now is 19.9 secs Computing kpt #: 94 total cpu time spent up to now is 20.2 secs Computing kpt #: 95 total cpu time spent up to now is 20.4 secs Computing kpt #: 96 total cpu time spent up to now is 20.6 secs Computing kpt #: 97 total cpu time spent up to now is 20.8 secs Computing kpt #: 98 total cpu time spent up to now is 21.0 secs Computing kpt #: 99 total cpu time spent up to now is 21.2 secs Computing kpt #: 100 total cpu time spent up to now is 21.4 secs Computing kpt #: 101 total cpu time spent up to now is 21.5 secs Computing kpt #: 102 total cpu time spent up to now is 21.7 secs Computing kpt #: 103 total cpu time spent up to now is 21.9 secs Computing kpt #: 104 total cpu time spent up to now is 22.0 secs Computing kpt #: 105 total cpu time spent up to now is 22.2 secs Computing kpt #: 106 total cpu time spent up to now is 22.4 secs Computing kpt #: 107 total cpu time spent up to now is 22.5 secs Computing kpt #: 108 total cpu time spent up to now is 22.7 secs Computing kpt #: 109 total cpu time spent up to now is 22.9 secs Computing kpt #: 110 total cpu time spent up to now is 23.0 secs Computing kpt #: 111 total cpu time spent up to now is 23.2 secs Computing kpt #: 112 total cpu time spent up to now is 23.4 secs Computing kpt #: 113 total cpu time spent up to now is 23.5 secs Computing kpt #: 114 total cpu time spent up to now is 23.7 secs Computing kpt #: 115 total cpu time spent up to now is 23.9 secs Computing kpt #: 116 total cpu time spent up to now is 24.1 secs Computing kpt #: 117 total cpu time spent up to now is 24.3 secs Computing kpt #: 118 total cpu time spent up to now is 24.5 secs Computing kpt #: 119 total cpu time spent up to now is 24.7 secs Computing kpt #: 120 total cpu time spent up to now is 24.9 secs Computing kpt #: 121 total cpu time spent up to now is 25.1 secs Computing kpt #: 122 total cpu time spent up to now is 25.3 secs Computing kpt #: 123 total cpu time spent up to now is 25.5 secs Computing kpt #: 124 total cpu time spent up to now is 25.6 secs Computing kpt #: 125 total cpu time spent up to now is 25.8 secs Computing kpt #: 126 total cpu time spent up to now is 26.0 secs Computing kpt #: 127 total cpu time spent up to now is 26.2 secs Computing kpt #: 128 total cpu time spent up to now is 26.4 secs Computing kpt #: 129 total cpu time spent up to now is 26.5 secs Computing kpt #: 130 total cpu time spent up to now is 26.7 secs Computing kpt #: 131 total cpu time spent up to now is 26.9 secs Computing kpt #: 132 total cpu time spent up to now is 27.0 secs Computing kpt #: 133 total cpu time spent up to now is 27.2 secs Computing kpt #: 134 total cpu time spent up to now is 27.4 secs Computing kpt #: 135 total cpu time spent up to now is 27.5 secs Computing kpt #: 136 total cpu time spent up to now is 27.7 secs Computing kpt #: 137 total cpu time spent up to now is 27.8 secs Computing kpt #: 138 total cpu time spent up to now is 28.0 secs Computing kpt #: 139 total cpu time spent up to now is 28.2 secs Computing kpt #: 140 total cpu time spent up to now is 28.3 secs Computing kpt #: 141 total cpu time spent up to now is 28.5 secs Computing kpt #: 142 total cpu time spent up to now is 28.6 secs Computing kpt #: 143 total cpu time spent up to now is 28.8 secs Computing kpt #: 144 total cpu time spent up to now is 29.0 secs Computing kpt #: 145 total cpu time spent up to now is 29.1 secs Computing kpt #: 146 total cpu time spent up to now is 29.3 secs Computing kpt #: 147 total cpu time spent up to now is 29.4 secs Computing kpt #: 148 total cpu time spent up to now is 29.6 secs Computing kpt #: 149 total cpu time spent up to now is 29.7 secs Computing kpt #: 150 total cpu time spent up to now is 29.9 secs Computing kpt #: 151 total cpu time spent up to now is 30.0 secs Computing kpt #: 152 total cpu time spent up to now is 30.2 secs Computing kpt #: 153 total cpu time spent up to now is 30.4 secs Computing kpt #: 154 total cpu time spent up to now is 30.5 secs Computing kpt #: 155 total cpu time spent up to now is 30.7 secs Computing kpt #: 156 total cpu time spent up to now is 30.9 secs Computing kpt #: 157 total cpu time spent up to now is 31.0 secs Computing kpt #: 158 total cpu time spent up to now is 31.2 secs Computing kpt #: 159 total cpu time spent up to now is 31.4 secs Computing kpt #: 160 total cpu time spent up to now is 31.6 secs Computing kpt #: 161 total cpu time spent up to now is 31.7 secs Computing kpt #: 162 total cpu time spent up to now is 31.9 secs Computing kpt #: 163 total cpu time spent up to now is 32.1 secs Computing kpt #: 164 total cpu time spent up to now is 32.3 secs Computing kpt #: 165 total cpu time spent up to now is 32.5 secs Computing kpt #: 166 total cpu time spent up to now is 32.8 secs Computing kpt #: 167 total cpu time spent up to now is 33.0 secs Computing kpt #: 168 total cpu time spent up to now is 33.3 secs Computing kpt #: 169 total cpu time spent up to now is 33.6 secs Computing kpt #: 170 total cpu time spent up to now is 33.9 secs Computing kpt #: 171 total cpu time spent up to now is 34.2 secs Computing kpt #: 172 total cpu time spent up to now is 34.4 secs Computing kpt #: 173 total cpu time spent up to now is 34.6 secs Computing kpt #: 174 total cpu time spent up to now is 34.8 secs Computing kpt #: 175 total cpu time spent up to now is 35.0 secs Computing kpt #: 176 total cpu time spent up to now is 35.2 secs Computing kpt #: 177 total cpu time spent up to now is 35.4 secs Computing kpt #: 178 total cpu time spent up to now is 35.6 secs Computing kpt #: 179 total cpu time spent up to now is 35.8 secs Computing kpt #: 180 total cpu time spent up to now is 36.0 secs Computing kpt #: 181 total cpu time spent up to now is 36.2 secs Computing kpt #: 182 total cpu time spent up to now is 36.4 secs Computing kpt #: 183 total cpu time spent up to now is 36.6 secs Computing kpt #: 184 total cpu time spent up to now is 36.7 secs Computing kpt #: 185 total cpu time spent up to now is 36.9 secs Computing kpt #: 186 total cpu time spent up to now is 37.1 secs Computing kpt #: 187 total cpu time spent up to now is 37.3 secs Computing kpt #: 188 total cpu time spent up to now is 37.4 secs Computing kpt #: 189 total cpu time spent up to now is 37.6 secs Computing kpt #: 190 total cpu time spent up to now is 37.8 secs Computing kpt #: 191 total cpu time spent up to now is 37.9 secs Computing kpt #: 192 total cpu time spent up to now is 38.1 secs Computing kpt #: 193 total cpu time spent up to now is 38.3 secs Computing kpt #: 194 total cpu time spent up to now is 38.4 secs Computing kpt #: 195 total cpu time spent up to now is 38.6 secs Computing kpt #: 196 total cpu time spent up to now is 38.8 secs Computing kpt #: 197 total cpu time spent up to now is 39.0 secs Computing kpt #: 198 total cpu time spent up to now is 39.1 secs Computing kpt #: 199 total cpu time spent up to now is 39.3 secs Computing kpt #: 200 total cpu time spent up to now is 39.5 secs Computing kpt #: 201 total cpu time spent up to now is 39.6 secs Computing kpt #: 202 total cpu time spent up to now is 39.8 secs Computing kpt #: 203 total cpu time spent up to now is 39.9 secs Computing kpt #: 204 total cpu time spent up to now is 40.1 secs Computing kpt #: 205 total cpu time spent up to now is 40.3 secs Computing kpt #: 206 total cpu time spent up to now is 40.4 secs Computing kpt #: 207 total cpu time spent up to now is 40.6 secs Computing kpt #: 208 total cpu time spent up to now is 40.8 secs Computing kpt #: 209 total cpu time spent up to now is 40.9 secs Computing kpt #: 210 total cpu time spent up to now is 41.1 secs Computing kpt #: 211 total cpu time spent up to now is 41.2 secs Computing kpt #: 212 total cpu time spent up to now is 41.4 secs Computing kpt #: 213 total cpu time spent up to now is 41.5 secs Computing kpt #: 214 total cpu time spent up to now is 41.7 secs Computing kpt #: 215 total cpu time spent up to now is 41.8 secs Computing kpt #: 216 total cpu time spent up to now is 42.0 secs Computing kpt #: 217 total cpu time spent up to now is 42.1 secs Computing kpt #: 218 total cpu time spent up to now is 42.3 secs Computing kpt #: 219 total cpu time spent up to now is 42.4 secs Computing kpt #: 220 total cpu time spent up to now is 42.6 secs Computing kpt #: 221 total cpu time spent up to now is 42.7 secs Computing kpt #: 222 total cpu time spent up to now is 42.9 secs Computing kpt #: 223 total cpu time spent up to now is 43.0 secs Computing kpt #: 224 total cpu time spent up to now is 43.2 secs Computing kpt #: 225 total cpu time spent up to now is 43.4 secs Computing kpt #: 226 total cpu time spent up to now is 43.6 secs Computing kpt #: 227 total cpu time spent up to now is 43.7 secs Computing kpt #: 228 total cpu time spent up to now is 43.9 secs Computing kpt #: 229 total cpu time spent up to now is 44.0 secs Computing kpt #: 230 total cpu time spent up to now is 44.2 secs Computing kpt #: 231 total cpu time spent up to now is 44.3 secs Computing kpt #: 232 total cpu time spent up to now is 44.5 secs Computing kpt #: 233 total cpu time spent up to now is 44.6 secs Computing kpt #: 234 total cpu time spent up to now is 44.8 secs Computing kpt #: 235 total cpu time spent up to now is 45.0 secs Computing kpt #: 236 total cpu time spent up to now is 45.1 secs Computing kpt #: 237 total cpu time spent up to now is 45.3 secs Computing kpt #: 238 total cpu time spent up to now is 45.5 secs Computing kpt #: 239 total cpu time spent up to now is 45.6 secs Computing kpt #: 240 total cpu time spent up to now is 45.8 secs Computing kpt #: 241 total cpu time spent up to now is 46.0 secs Computing kpt #: 242 total cpu time spent up to now is 46.2 secs Computing kpt #: 243 total cpu time spent up to now is 46.5 secs Computing kpt #: 244 total cpu time spent up to now is 46.7 secs Computing kpt #: 245 total cpu time spent up to now is 46.9 secs Computing kpt #: 246 total cpu time spent up to now is 47.1 secs Computing kpt #: 247 total cpu time spent up to now is 47.3 secs Computing kpt #: 248 total cpu time spent up to now is 47.5 secs Computing kpt #: 249 total cpu time spent up to now is 47.7 secs Computing kpt #: 250 total cpu time spent up to now is 47.9 secs Computing kpt #: 251 total cpu time spent up to now is 48.1 secs Computing kpt #: 252 total cpu time spent up to now is 48.3 secs Computing kpt #: 253 total cpu time spent up to now is 48.4 secs Computing kpt #: 254 total cpu time spent up to now is 48.6 secs Computing kpt #: 255 total cpu time spent up to now is 48.8 secs Computing kpt #: 256 total cpu time spent up to now is 49.0 secs Computing kpt #: 257 total cpu time spent up to now is 49.2 secs Computing kpt #: 258 total cpu time spent up to now is 49.4 secs Computing kpt #: 259 total cpu time spent up to now is 49.6 secs Computing kpt #: 260 total cpu time spent up to now is 49.8 secs Computing kpt #: 261 total cpu time spent up to now is 50.0 secs Computing kpt #: 262 total cpu time spent up to now is 50.2 secs Computing kpt #: 263 total cpu time spent up to now is 50.4 secs Computing kpt #: 264 total cpu time spent up to now is 50.5 secs Computing kpt #: 265 total cpu time spent up to now is 50.7 secs Computing kpt #: 266 total cpu time spent up to now is 50.9 secs Computing kpt #: 267 total cpu time spent up to now is 51.1 secs Computing kpt #: 268 total cpu time spent up to now is 51.3 secs Computing kpt #: 269 total cpu time spent up to now is 51.5 secs Computing kpt #: 270 total cpu time spent up to now is 51.6 secs Computing kpt #: 271 total cpu time spent up to now is 51.8 secs Computing kpt #: 272 total cpu time spent up to now is 52.0 secs Computing kpt #: 273 total cpu time spent up to now is 52.2 secs Computing kpt #: 274 total cpu time spent up to now is 52.4 secs Computing kpt #: 275 total cpu time spent up to now is 52.5 secs Computing kpt #: 276 total cpu time spent up to now is 52.7 secs Computing kpt #: 277 total cpu time spent up to now is 52.9 secs Computing kpt #: 278 total cpu time spent up to now is 53.0 secs Computing kpt #: 279 total cpu time spent up to now is 53.2 secs Computing kpt #: 280 total cpu time spent up to now is 53.3 secs Computing kpt #: 281 total cpu time spent up to now is 53.5 secs Computing kpt #: 282 total cpu time spent up to now is 53.6 secs Computing kpt #: 283 total cpu time spent up to now is 53.8 secs Computing kpt #: 284 total cpu time spent up to now is 54.0 secs Computing kpt #: 285 total cpu time spent up to now is 54.1 secs Computing kpt #: 286 total cpu time spent up to now is 54.3 secs Computing kpt #: 287 total cpu time spent up to now is 54.4 secs Computing kpt #: 288 total cpu time spent up to now is 54.6 secs Computing kpt #: 289 total cpu time spent up to now is 54.8 secs Computing kpt #: 290 total cpu time spent up to now is 54.9 secs Computing kpt #: 291 total cpu time spent up to now is 55.1 secs Computing kpt #: 292 total cpu time spent up to now is 55.2 secs Computing kpt #: 293 total cpu time spent up to now is 55.4 secs Computing kpt #: 294 total cpu time spent up to now is 55.5 secs Computing kpt #: 295 total cpu time spent up to now is 55.7 secs Computing kpt #: 296 total cpu time spent up to now is 55.9 secs Computing kpt #: 297 total cpu time spent up to now is 56.0 secs Computing kpt #: 298 total cpu time spent up to now is 56.2 secs Computing kpt #: 299 total cpu time spent up to now is 56.4 secs Computing kpt #: 300 total cpu time spent up to now is 56.5 secs Computing kpt #: 301 total cpu time spent up to now is 56.7 secs Computing kpt #: 302 total cpu time spent up to now is 56.8 secs Computing kpt #: 303 total cpu time spent up to now is 57.0 secs Computing kpt #: 304 total cpu time spent up to now is 57.2 secs Computing kpt #: 305 total cpu time spent up to now is 57.3 secs Computing kpt #: 306 total cpu time spent up to now is 57.5 secs Computing kpt #: 307 total cpu time spent up to now is 57.7 secs Computing kpt #: 308 total cpu time spent up to now is 57.8 secs Computing kpt #: 309 total cpu time spent up to now is 58.0 secs Computing kpt #: 310 total cpu time spent up to now is 58.1 secs Computing kpt #: 311 total cpu time spent up to now is 58.3 secs Computing kpt #: 312 total cpu time spent up to now is 58.5 secs Computing kpt #: 313 total cpu time spent up to now is 58.6 secs Computing kpt #: 314 total cpu time spent up to now is 58.8 secs Computing kpt #: 315 total cpu time spent up to now is 59.0 secs Computing kpt #: 316 total cpu time spent up to now is 59.1 secs Computing kpt #: 317 total cpu time spent up to now is 59.3 secs Computing kpt #: 318 total cpu time spent up to now is 59.5 secs Computing kpt #: 319 total cpu time spent up to now is 59.7 secs Computing kpt #: 320 total cpu time spent up to now is 59.9 secs Computing kpt #: 321 total cpu time spent up to now is 60.1 secs Computing kpt #: 322 total cpu time spent up to now is 60.3 secs Computing kpt #: 323 total cpu time spent up to now is 60.5 secs Computing kpt #: 324 total cpu time spent up to now is 60.7 secs Computing kpt #: 325 total cpu time spent up to now is 60.9 secs Computing kpt #: 326 total cpu time spent up to now is 61.1 secs Computing kpt #: 327 total cpu time spent up to now is 61.3 secs Computing kpt #: 328 total cpu time spent up to now is 61.5 secs Computing kpt #: 329 total cpu time spent up to now is 61.7 secs Computing kpt #: 330 total cpu time spent up to now is 61.9 secs Computing kpt #: 331 total cpu time spent up to now is 62.1 secs Computing kpt #: 332 total cpu time spent up to now is 62.3 secs Computing kpt #: 333 total cpu time spent up to now is 62.5 secs Computing kpt #: 334 total cpu time spent up to now is 62.8 secs Computing kpt #: 335 total cpu time spent up to now is 63.0 secs Computing kpt #: 336 total cpu time spent up to now is 63.2 secs Computing kpt #: 337 total cpu time spent up to now is 63.4 secs Computing kpt #: 338 total cpu time spent up to now is 63.6 secs Computing kpt #: 339 total cpu time spent up to now is 63.8 secs Computing kpt #: 340 total cpu time spent up to now is 64.0 secs Computing kpt #: 341 total cpu time spent up to now is 64.1 secs Computing kpt #: 342 total cpu time spent up to now is 64.3 secs Computing kpt #: 343 total cpu time spent up to now is 64.5 secs Computing kpt #: 344 total cpu time spent up to now is 64.7 secs Computing kpt #: 345 total cpu time spent up to now is 64.9 secs Computing kpt #: 346 total cpu time spent up to now is 65.1 secs Computing kpt #: 347 total cpu time spent up to now is 65.2 secs Computing kpt #: 348 total cpu time spent up to now is 65.4 secs Computing kpt #: 349 total cpu time spent up to now is 65.6 secs Computing kpt #: 350 total cpu time spent up to now is 65.7 secs Computing kpt #: 351 total cpu time spent up to now is 65.9 secs Computing kpt #: 352 total cpu time spent up to now is 66.1 secs Computing kpt #: 353 total cpu time spent up to now is 66.2 secs Computing kpt #: 354 total cpu time spent up to now is 66.4 secs Computing kpt #: 355 total cpu time spent up to now is 66.5 secs Computing kpt #: 356 total cpu time spent up to now is 66.7 secs Computing kpt #: 357 total cpu time spent up to now is 66.9 secs Computing kpt #: 358 total cpu time spent up to now is 67.0 secs Computing kpt #: 359 total cpu time spent up to now is 67.2 secs Computing kpt #: 360 total cpu time spent up to now is 67.4 secs Computing kpt #: 361 total cpu time spent up to now is 67.5 secs Computing kpt #: 362 total cpu time spent up to now is 67.7 secs Computing kpt #: 363 total cpu time spent up to now is 67.9 secs Computing kpt #: 364 total cpu time spent up to now is 68.1 secs Computing kpt #: 365 total cpu time spent up to now is 68.3 secs Computing kpt #: 366 total cpu time spent up to now is 68.4 secs Computing kpt #: 367 total cpu time spent up to now is 68.6 secs Computing kpt #: 368 total cpu time spent up to now is 68.9 secs Computing kpt #: 369 total cpu time spent up to now is 69.1 secs Computing kpt #: 370 total cpu time spent up to now is 69.3 secs Computing kpt #: 371 total cpu time spent up to now is 69.6 secs Computing kpt #: 372 total cpu time spent up to now is 69.8 secs Computing kpt #: 373 total cpu time spent up to now is 70.0 secs Computing kpt #: 374 total cpu time spent up to now is 70.3 secs Computing kpt #: 375 total cpu time spent up to now is 70.5 secs Computing kpt #: 376 total cpu time spent up to now is 70.7 secs Computing kpt #: 377 total cpu time spent up to now is 70.9 secs Computing kpt #: 378 total cpu time spent up to now is 71.2 secs Computing kpt #: 379 total cpu time spent up to now is 71.4 secs Computing kpt #: 380 total cpu time spent up to now is 71.6 secs Computing kpt #: 381 total cpu time spent up to now is 71.8 secs Computing kpt #: 382 total cpu time spent up to now is 72.0 secs Computing kpt #: 383 total cpu time spent up to now is 72.3 secs Computing kpt #: 384 total cpu time spent up to now is 72.5 secs Computing kpt #: 385 total cpu time spent up to now is 72.7 secs Computing kpt #: 386 total cpu time spent up to now is 72.9 secs Computing kpt #: 387 total cpu time spent up to now is 73.1 secs Computing kpt #: 388 total cpu time spent up to now is 73.4 secs Computing kpt #: 389 total cpu time spent up to now is 73.6 secs Computing kpt #: 390 total cpu time spent up to now is 73.8 secs Computing kpt #: 391 total cpu time spent up to now is 74.0 secs Computing kpt #: 392 total cpu time spent up to now is 74.2 secs Computing kpt #: 393 total cpu time spent up to now is 74.3 secs Computing kpt #: 394 total cpu time spent up to now is 74.5 secs Computing kpt #: 395 total cpu time spent up to now is 74.6 secs Computing kpt #: 396 total cpu time spent up to now is 74.8 secs Computing kpt #: 397 total cpu time spent up to now is 75.0 secs Computing kpt #: 398 total cpu time spent up to now is 75.1 secs Computing kpt #: 399 total cpu time spent up to now is 75.3 secs Computing kpt #: 400 total cpu time spent up to now is 75.4 secs Computing kpt #: 401 total cpu time spent up to now is 75.6 secs Computing kpt #: 402 total cpu time spent up to now is 75.8 secs Computing kpt #: 403 total cpu time spent up to now is 75.9 secs Computing kpt #: 404 total cpu time spent up to now is 76.1 secs Computing kpt #: 405 total cpu time spent up to now is 76.2 secs Computing kpt #: 406 total cpu time spent up to now is 76.4 secs Computing kpt #: 407 total cpu time spent up to now is 76.5 secs Computing kpt #: 408 total cpu time spent up to now is 76.7 secs Computing kpt #: 409 total cpu time spent up to now is 76.8 secs Computing kpt #: 410 total cpu time spent up to now is 77.0 secs Computing kpt #: 411 total cpu time spent up to now is 77.1 secs Computing kpt #: 412 total cpu time spent up to now is 77.3 secs Computing kpt #: 413 total cpu time spent up to now is 77.4 secs Computing kpt #: 414 total cpu time spent up to now is 77.6 secs Computing kpt #: 415 total cpu time spent up to now is 77.8 secs Computing kpt #: 416 total cpu time spent up to now is 77.9 secs Computing kpt #: 417 total cpu time spent up to now is 78.1 secs Computing kpt #: 418 total cpu time spent up to now is 78.3 secs Computing kpt #: 419 total cpu time spent up to now is 78.4 secs Computing kpt #: 420 total cpu time spent up to now is 78.6 secs Computing kpt #: 421 total cpu time spent up to now is 78.8 secs Computing kpt #: 422 total cpu time spent up to now is 78.9 secs Computing kpt #: 423 total cpu time spent up to now is 79.1 secs Computing kpt #: 424 total cpu time spent up to now is 79.3 secs Computing kpt #: 425 total cpu time spent up to now is 79.5 secs Computing kpt #: 426 total cpu time spent up to now is 79.8 secs Computing kpt #: 427 total cpu time spent up to now is 80.0 secs Computing kpt #: 428 total cpu time spent up to now is 80.3 secs Computing kpt #: 429 total cpu time spent up to now is 80.6 secs Computing kpt #: 430 total cpu time spent up to now is 80.9 secs Computing kpt #: 431 total cpu time spent up to now is 81.2 secs Computing kpt #: 432 total cpu time spent up to now is 81.4 secs Computing kpt #: 433 total cpu time spent up to now is 81.6 secs Computing kpt #: 434 total cpu time spent up to now is 81.9 secs ethr = 4.55E-08, avg # of iterations = 14.2 total cpu time spent up to now is 81.9 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7200 -19.7200 -19.6609 -19.6609 0.8080 0.8080 8.6360 8.6360 9.8265 9.8265 11.9239 11.9239 11.9919 11.9919 12.1276 12.1276 14.9624 14.9624 16.9066 16.9066 18.1034 18.1034 18.2962 18.2962 18.5513 18.5513 k = 0.0000 0.0000 0.0148 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7201 -19.7201 -19.6610 -19.6610 0.8095 0.8095 8.6374 8.6374 9.8227 9.8227 11.9243 11.9243 11.9925 11.9925 12.1284 12.1284 14.9571 14.9571 16.8984 16.8984 18.0949 18.0949 18.3006 18.3006 18.5527 18.5527 k = 0.0000 0.0000 0.0296 ( 1769 PWs) bands (ev): -46.3734 -46.3734 -22.1817 -22.1817 -19.7201 -19.7201 -19.6613 -19.6613 0.8142 0.8142 8.6417 8.6417 9.8114 9.8114 11.9252 11.9252 11.9925 11.9925 12.1325 12.1325 14.9413 14.9413 16.8740 16.8740 18.0718 18.0718 18.3119 18.3119 18.5565 18.5565 k = 0.0000 0.0000 0.0444 ( 1770 PWs) bands (ev): -46.3734 -46.3734 -22.1819 -22.1819 -19.7202 -19.7202 -19.6617 -19.6617 0.8221 0.8221 8.6489 8.6489 9.7930 9.7930 11.9264 11.9264 11.9884 11.9884 12.1435 12.1435 14.9152 14.9152 16.8350 16.8350 18.0389 18.0389 18.3261 18.3261 18.5626 18.5626 k = 0.0000 0.0000 0.0593 ( 1774 PWs) bands (ev): -46.3733 -46.3733 -22.1823 -22.1823 -19.7204 -19.7204 -19.6624 -19.6624 0.8330 0.8330 8.6589 8.6589 9.7679 9.7679 11.9271 11.9271 11.9768 11.9768 12.1651 12.1651 14.8787 14.8787 16.7833 16.7833 18.0004 18.0004 18.3405 18.3405 18.5704 18.5704 k = 0.0000 0.0000 0.0741 ( 1766 PWs) bands (ev): -46.3731 -46.3731 -22.1826 -22.1826 -19.7205 -19.7205 -19.6632 -19.6632 0.8471 0.8471 8.6716 8.6716 9.7368 9.7368 11.9239 11.9239 11.9599 11.9599 12.1979 12.1979 14.8321 14.8321 16.7213 16.7213 17.9590 17.9590 18.3539 18.3539 18.5793 18.5793 k = 0.0000 0.0000 0.0889 ( 1774 PWs) bands (ev): -46.3731 -46.3731 -22.1831 -22.1831 -19.7208 -19.7208 -19.6642 -19.6642 0.8643 0.8643 8.6871 8.6871 9.7006 9.7006 11.9052 11.9052 11.9500 11.9500 12.2407 12.2407 14.7757 14.7757 16.6512 16.6512 17.9167 17.9167 18.3658 18.3658 18.5886 18.5886 k = 0.0000 0.0000 0.1037 ( 1780 PWs) bands (ev): -46.3731 -46.3731 -22.1836 -22.1836 -19.7210 -19.7210 -19.6655 -19.6655 0.8847 0.8847 8.7053 8.7053 9.6599 9.6599 11.8691 11.8691 11.9503 11.9503 12.2915 12.2915 14.7099 14.7099 16.5751 16.5751 17.8751 17.8751 18.3762 18.3762 18.5975 18.5975 k = 0.0000 0.0000 0.1185 ( 1780 PWs) bands (ev): -46.3729 -46.3729 -22.1842 -22.1842 -19.7213 -19.7213 -19.6669 -19.6669 0.9081 0.9081 8.7262 8.7262 9.6154 9.6154 11.8232 11.8232 11.9542 11.9542 12.3486 12.3486 14.6352 14.6352 16.4950 16.4950 17.8351 17.8351 18.3850 18.3850 18.6047 18.6047 k = 0.0000 0.0000 0.1333 ( 1788 PWs) bands (ev): -46.3728 -46.3728 -22.1850 -22.1850 -19.7216 -19.7216 -19.6685 -19.6685 0.9345 0.9345 8.7495 8.7495 9.5680 9.5680 11.7703 11.7703 11.9598 11.9598 12.4107 12.4107 14.5520 14.5520 16.4127 16.4127 17.7976 17.7976 18.3925 18.3925 18.5834 18.5834 k = 0.0000 0.0000 0.1481 ( 1792 PWs) bands (ev): -46.3727 -46.3727 -22.1858 -22.1858 -19.7220 -19.7220 -19.6702 -19.6702 0.9641 0.9641 8.7753 8.7753 9.5182 9.5182 11.7117 11.7117 11.9664 11.9664 12.4764 12.4764 14.4612 14.4612 16.3296 16.3296 17.7632 17.7632 18.3984 18.3984 18.5363 18.5363 k = 0.0000 0.0000 0.1630 ( 1790 PWs) bands (ev): -46.3724 -46.3724 -22.1866 -22.1866 -19.7224 -19.7224 -19.6720 -19.6720 0.9967 0.9967 8.8033 8.8033 9.4667 9.4667 11.6481 11.6481 11.9741 11.9741 12.5447 12.5447 14.3633 14.3633 16.2472 16.2472 17.7322 17.7322 18.4021 18.4021 18.4923 18.4923 k = 0.0000 0.0000 0.1778 ( 1794 PWs) bands (ev): -46.3722 -46.3722 -22.1875 -22.1875 -19.7228 -19.7228 -19.6741 -19.6741 1.0323 1.0323 8.8336 8.8336 9.4138 9.4138 11.5801 11.5801 11.9826 11.9826 12.6143 12.6143 14.2593 14.2593 16.1665 16.1665 17.7048 17.7048 18.4010 18.4010 18.4549 18.4549 k = 0.0000 0.0000 0.1926 ( 1790 PWs) bands (ev): -46.3719 -46.3719 -22.1884 -22.1884 -19.7232 -19.7232 -19.6762 -19.6762 1.0709 1.0709 8.8658 8.8658 9.3602 9.3602 11.5081 11.5081 11.9920 11.9920 12.6842 12.6842 14.1499 14.1499 16.0890 16.0890 17.6812 17.6812 18.3862 18.3862 18.4329 18.4329 k = 0.0000 0.0000 0.2074 ( 1790 PWs) bands (ev): -46.3715 -46.3715 -22.1895 -22.1895 -19.7237 -19.7237 -19.6786 -19.6786 1.1124 1.1124 8.8999 8.8999 9.3061 9.3061 11.4328 11.4328 12.0024 12.0024 12.7533 12.7533 14.0360 14.0360 16.0155 16.0155 17.6613 17.6613 18.3565 18.3565 18.4271 18.4271 k = 0.0000 0.0000 0.2222 ( 1794 PWs) bands (ev): -46.3713 -46.3713 -22.1906 -22.1906 -19.7242 -19.7242 -19.6810 -19.6810 1.1569 1.1569 8.9356 8.9356 9.2520 9.2520 11.3544 11.3544 12.0137 12.0137 12.8205 12.8205 13.9186 13.9186 15.9474 15.9474 17.6450 17.6450 18.3236 18.3236 18.4256 18.4256 k = 0.0000 0.0000 0.2370 ( 1794 PWs) bands (ev): -46.3710 -46.3710 -22.1918 -22.1918 -19.7247 -19.7247 -19.6836 -19.6836 1.2044 1.2044 8.9727 8.9727 9.1980 9.1980 11.2734 11.2734 12.0259 12.0259 12.8847 12.8847 13.7985 13.7985 15.8857 15.8857 17.6322 17.6322 18.2912 18.2912 18.4243 18.4243 k = 0.0000 0.0000 0.2518 ( 1796 PWs) bands (ev): -46.3706 -46.3706 -22.1930 -22.1930 -19.7252 -19.7252 -19.6864 -19.6864 1.2547 1.2547 9.0108 9.0108 9.1448 9.1448 11.1903 11.1903 12.0391 12.0391 12.9445 12.9445 13.6766 13.6766 15.8315 15.8315 17.6226 17.6226 18.2603 18.2603 18.4220 18.4220 k = 0.0000 0.0000 0.2667 ( 1796 PWs) bands (ev): -46.3703 -46.3703 -22.1943 -22.1943 -19.7258 -19.7258 -19.6892 -19.6892 1.3078 1.3078 9.0484 9.0484 9.0934 9.0934 11.1053 11.1053 12.0532 12.0532 12.9990 12.9990 13.5539 13.5539 15.7860 15.7860 17.6161 17.6161 18.2308 18.2308 18.4182 18.4182 k = 0.0000 0.0000 0.2815 ( 1792 PWs) bands (ev): -46.3698 -46.3698 -22.1956 -22.1956 -19.7263 -19.7263 -19.6922 -19.6922 1.3638 1.3638 9.0368 9.0368 9.0926 9.0926 11.0188 11.0188 12.0684 12.0684 13.0467 13.0467 13.4312 13.4312 15.7502 15.7502 17.6125 17.6125 18.2027 18.2027 18.4128 18.4128 k = 0.0000 0.0000 0.2963 ( 1792 PWs) bands (ev): -46.3694 -46.3694 -22.1969 -22.1969 -19.7269 -19.7269 -19.6952 -19.6952 1.4225 1.4225 8.9869 8.9869 9.1314 9.1314 10.9312 10.9312 12.0845 12.0845 13.0866 13.0866 13.3096 13.3096 15.7249 15.7249 17.6114 17.6114 18.1760 18.1760 18.4054 18.4054 k = 0.0000 0.0000 0.3111 ( 1798 PWs) bands (ev): -46.3691 -46.3691 -22.1984 -22.1984 -19.7276 -19.7276 -19.6984 -19.6984 1.4840 1.4840 8.9370 8.9370 9.1708 9.1708 10.8427 10.8427 12.1017 12.1017 13.1151 13.1151 13.1926 13.1926 15.7110 15.7110 17.6128 17.6128 18.1506 18.1506 18.3959 18.3959 k = 0.0000 0.0000 0.3259 ( 1798 PWs) bands (ev): -46.3686 -46.3686 -22.1999 -22.1999 -19.7282 -19.7282 -19.7016 -19.7016 1.5481 1.5481 8.8882 8.8882 9.2097 9.2097 10.7536 10.7536 12.1200 12.1200 13.0640 13.0640 13.1486 13.1486 15.7089 15.7089 17.6163 17.6163 18.1263 18.1263 18.3841 18.3841 k = 0.0000 0.0000 0.3407 ( 1798 PWs) bands (ev): -46.3682 -46.3682 -22.2014 -22.2014 -19.7288 -19.7288 -19.7050 -19.7050 1.6149 1.6149 8.8406 8.8406 9.2475 9.2475 10.6642 10.6642 12.1393 12.1393 12.9520 12.9520 13.1594 13.1594 15.7188 15.7188 17.6217 17.6217 18.1031 18.1031 18.3698 18.3698 k = 0.0000 0.0000 0.3555 ( 1794 PWs) bands (ev): -46.3677 -46.3677 -22.2029 -22.2029 -19.7295 -19.7295 -19.7083 -19.7083 1.6843 1.6843 8.7944 8.7944 9.2835 9.2835 10.5746 10.5746 12.1596 12.1596 12.8418 12.8418 13.1632 13.1632 15.7406 15.7406 17.6289 17.6289 18.0809 18.0809 18.3530 18.3530 k = 0.0000 0.0000 0.3704 ( 1794 PWs) bands (ev): -46.3672 -46.3672 -22.2044 -22.2044 -19.7302 -19.7302 -19.7118 -19.7118 1.7562 1.7562 8.7496 8.7496 9.3171 9.3171 10.4853 10.4853 12.1810 12.1810 12.7361 12.7361 13.1584 13.1584 15.7736 15.7736 17.6377 17.6377 18.0596 18.0596 18.3336 18.3336 k = 0.0000 0.0000 0.3852 ( 1802 PWs) bands (ev): -46.3668 -46.3668 -22.2061 -22.2061 -19.7309 -19.7309 -19.7153 -19.7153 1.8306 1.8306 8.7062 8.7062 9.3476 9.3476 10.3962 10.3962 12.2033 12.2033 12.6360 12.6360 13.1453 13.1453 15.8173 15.8173 17.6478 17.6478 18.0391 18.0391 18.3115 18.3115 k = 0.0000 0.0000 0.4000 ( 1802 PWs) bands (ev): -46.3664 -46.3664 -22.2077 -22.2077 -19.7316 -19.7316 -19.7189 -19.7189 1.9074 1.9074 8.6643 8.6643 9.3744 9.3744 10.3077 10.3077 12.2265 12.2265 12.5425 12.5425 13.1247 13.1247 15.8704 15.8704 17.6591 17.6591 18.0195 18.0195 18.2866 18.2866 k = 0.0000 0.0000 0.4148 ( 1806 PWs) bands (ev): -46.3659 -46.3659 -22.2094 -22.2094 -19.7323 -19.7323 -19.7225 -19.7225 1.9865 1.9865 8.6240 8.6240 9.3968 9.3968 10.2198 10.2198 12.2502 12.2502 12.4568 12.4568 13.0974 13.0974 15.9319 15.9319 17.6714 17.6714 18.0006 18.0006 18.2590 18.2590 k = 0.0000 0.0000 0.4296 ( 1810 PWs) bands (ev): -46.3655 -46.3655 -22.2111 -22.2111 -19.7331 -19.7331 -19.7260 -19.7260 2.0679 2.0679 8.5852 8.5852 9.4142 9.4142 10.1329 10.1329 12.2728 12.2728 12.3811 12.3811 13.0644 13.0644 16.0006 16.0006 17.6845 17.6845 17.9826 17.9826 18.2286 18.2286 k = 0.0000 0.0000 0.4444 ( 1814 PWs) bands (ev): -46.3651 -46.3651 -22.2128 -22.2128 -19.7340 -19.7340 -19.7295 -19.7295 2.1514 2.1514 8.5479 8.5479 9.4258 9.4258 10.0469 10.0469 12.2784 12.2784 12.3319 12.3319 13.0267 13.0267 16.0751 16.0751 17.6980 17.6980 17.9654 17.9654 18.1955 18.1955 k = 0.0000 0.0000 0.4593 ( 1814 PWs) bands (ev): -46.3646 -46.3646 -22.2145 -22.2145 -19.7354 -19.7354 -19.7325 -19.7325 2.2371 2.2371 8.5123 8.5123 9.4312 9.4312 9.9621 9.9621 12.2341 12.2341 12.3422 12.3422 12.9852 12.9852 16.1543 16.1543 17.7119 17.7119 17.9490 17.9490 18.1598 18.1598 k = 0.0000 0.0000 0.4741 ( 1814 PWs) bands (ev): -46.3640 -46.3640 -22.2162 -22.2162 -19.7381 -19.7381 -19.7342 -19.7342 2.3248 2.3248 8.4782 8.4782 9.4301 9.4301 9.8787 9.8787 12.1840 12.1840 12.3684 12.3684 12.9408 12.9408 16.2369 16.2369 17.7255 17.7255 17.9338 17.9338 18.1216 18.1216 k = 0.0000 0.0000 0.4889 ( 1810 PWs) bands (ev): -46.3635 -46.3635 -22.2179 -22.2179 -19.7414 -19.7414 -19.7352 -19.7352 2.4144 2.4144 8.4457 8.4457 9.4222 9.4222 9.7966 9.7966 12.1407 12.1407 12.3974 12.3974 12.8943 12.8943 16.3219 16.3219 17.7385 17.7385 17.9198 17.9198 18.0810 18.0810 k = 0.0000 0.0000 0.5037 ( 1806 PWs) bands (ev): -46.3629 -46.3629 -22.2195 -22.2195 -19.7449 -19.7449 -19.7359 -19.7359 2.5059 2.5059 8.4147 8.4147 9.4075 9.4075 9.7161 9.7161 12.1055 12.1055 12.4278 12.4278 12.8464 12.8464 16.4083 16.4083 17.7500 17.7500 17.9074 17.9074 18.0382 18.0382 k = 0.0000 0.0000 0.5185 ( 1806 PWs) bands (ev): -46.3624 -46.3624 -22.2212 -22.2212 -19.7486 -19.7486 -19.7366 -19.7366 2.5990 2.5990 8.3852 8.3852 9.3864 9.3864 9.6373 9.6373 12.0780 12.0780 12.4590 12.4590 12.7980 12.7980 16.4949 16.4949 17.7588 17.7588 17.8972 17.8972 17.9937 17.9937 k = 0.0000 0.0000 0.5333 ( 1814 PWs) bands (ev): -46.3620 -46.3620 -22.2230 -22.2230 -19.7522 -19.7522 -19.7374 -19.7374 2.6937 2.6937 8.3573 8.3573 9.3591 9.3591 9.5603 9.5603 12.0576 12.0576 12.4904 12.4904 12.7502 12.7502 16.5810 16.5810 17.7631 17.7631 17.8895 17.8895 17.9482 17.9482 k = 0.0000 0.0000 0.5481 ( 1814 PWs) bands (ev): -46.3615 -46.3615 -22.2247 -22.2247 -19.7558 -19.7558 -19.7380 -19.7380 2.7899 2.7899 8.3308 8.3308 9.3262 9.3262 9.4853 9.4853 12.0431 12.0431 12.5203 12.5203 12.7047 12.7047 16.6656 16.6656 17.7608 17.7608 17.8823 17.8823 17.9047 17.9047 k = 0.0000 0.0000 0.5630 ( 1818 PWs) bands (ev): -46.3610 -46.3610 -22.2264 -22.2264 -19.7594 -19.7594 -19.7387 -19.7387 2.8874 2.8874 8.3058 8.3058 9.2884 9.2884 9.4124 9.4124 12.0333 12.0333 12.5437 12.5437 12.6669 12.6669 16.7478 16.7478 17.7493 17.7493 17.8544 17.8544 17.8848 17.8848 k = 0.0000 0.0000 0.5778 ( 1818 PWs) bands (ev): -46.3605 -46.3605 -22.2280 -22.2280 -19.7629 -19.7629 -19.7393 -19.7393 2.9860 2.9860 8.2823 8.2823 9.2464 9.2464 9.3419 9.3419 12.0269 12.0269 12.5454 12.5454 12.6524 12.6524 16.8268 16.8268 17.7247 17.7247 17.8187 17.8187 17.8745 17.8745 k = 0.0000 0.0000 0.5926 ( 1818 PWs) bands (ev): -46.3600 -46.3600 -22.2296 -22.2296 -19.7664 -19.7664 -19.7399 -19.7399 3.0856 3.0856 8.2601 8.2601 9.2007 9.2007 9.2742 9.2742 12.0224 12.0224 12.5175 12.5175 12.6692 12.6692 16.9019 16.9019 17.6851 17.6851 17.7908 17.7908 17.8519 17.8519 k = 0.0000 0.0000 0.6074 ( 1822 PWs) bands (ev): -46.3596 -46.3596 -22.2313 -22.2313 -19.7698 -19.7698 -19.7405 -19.7405 3.1860 3.1860 8.2392 8.2392 9.1518 9.1518 9.2098 9.2098 12.0181 12.0181 12.4771 12.4771 12.7005 12.7005 16.9723 16.9723 17.6343 17.6343 17.7634 17.7634 17.8106 17.8106 k = 0.0000 0.0000 0.6222 ( 1822 PWs) bands (ev): -46.3591 -46.3591 -22.2328 -22.2328 -19.7731 -19.7731 -19.7411 -19.7411 3.2869 3.2869 8.2197 8.2197 9.0999 9.0999 9.1493 9.1493 12.0127 12.0127 12.4337 12.4337 12.7368 12.7368 17.0371 17.0371 17.5761 17.5761 17.7074 17.7074 17.7745 17.7745 k = 0.0000 0.0000 0.6370 ( 1818 PWs) bands (ev): -46.3586 -46.3586 -22.2344 -22.2344 -19.7763 -19.7763 -19.7417 -19.7417 3.3883 3.3883 8.2015 8.2015 9.0455 9.0455 9.0932 9.0932 12.0045 12.0045 12.3900 12.3900 12.7754 12.7754 17.0954 17.0954 17.5110 17.5110 17.6203 17.6203 17.7555 17.7555 k = 0.0000 0.0000 0.6518 ( 1820 PWs) bands (ev): -46.3582 -46.3582 -22.2359 -22.2359 -19.7795 -19.7795 -19.7422 -19.7422 3.4897 3.4897 8.1844 8.1844 8.9899 8.9899 9.0412 9.0412 11.9922 11.9922 12.3470 12.3470 12.8156 12.8156 17.1456 17.1456 17.4361 17.4361 17.5304 17.5304 17.7412 17.7412 k = 0.0000 0.0000 0.6667 ( 1820 PWs) bands (ev): -46.3577 -46.3577 -22.2374 -22.2374 -19.7826 -19.7826 -19.7427 -19.7427 3.5910 3.5910 8.1686 8.1686 8.9342 8.9342 8.9927 8.9927 11.9746 11.9746 12.3051 12.3051 12.8567 12.8567 17.1835 17.1835 17.3518 17.3518 17.4526 17.4526 17.7284 17.7284 k = 0.0000 0.0000 0.6815 ( 1816 PWs) bands (ev): -46.3572 -46.3572 -22.2388 -22.2388 -19.7856 -19.7856 -19.7432 -19.7432 3.6919 3.6919 8.1538 8.1538 8.8796 8.8796 8.9475 8.9475 11.9505 11.9505 12.2645 12.2645 12.8987 12.8987 17.1880 17.1880 17.2811 17.2811 17.3905 17.3905 17.7164 17.7164 k = 0.0000 0.0000 0.6963 ( 1816 PWs) bands (ev): -46.3568 -46.3568 -22.2401 -22.2401 -19.7885 -19.7885 -19.7437 -19.7437 3.7921 3.7921 8.1402 8.1402 8.8265 8.8265 8.9057 8.9057 11.9191 11.9191 12.2254 12.2254 12.9412 12.9412 17.1248 17.1248 17.2521 17.2521 17.3535 17.3535 17.7051 17.7051 k = 0.0000 0.0000 0.7111 ( 1816 PWs) bands (ev): -46.3563 -46.3563 -22.2415 -22.2415 -19.7914 -19.7914 -19.7442 -19.7442 3.8913 3.8913 8.1276 8.1276 8.7753 8.7753 8.8676 8.8676 11.8797 11.8797 12.1878 12.1878 12.9841 12.9841 17.0410 17.0410 17.2101 17.2101 17.3518 17.3518 17.6943 17.6943 k = 0.0000 0.0000 0.7259 ( 1816 PWs) bands (ev): -46.3559 -46.3559 -22.2428 -22.2428 -19.7941 -19.7941 -19.7446 -19.7446 3.9890 3.9890 8.1160 8.1160 8.7262 8.7262 8.8336 8.8336 11.8318 11.8318 12.1518 12.1518 13.0272 13.0272 16.9604 16.9604 17.1538 17.1538 17.3640 17.3640 17.6839 17.6839 k = 0.0000 0.0000 0.7407 ( 1816 PWs) bands (ev): -46.3556 -46.3556 -22.2440 -22.2440 -19.7967 -19.7967 -19.7450 -19.7450 4.0849 4.0849 8.1053 8.1053 8.6793 8.6793 8.8041 8.8041 11.7753 11.7753 12.1175 12.1175 13.0705 13.0705 16.8873 16.8873 17.0938 17.0938 17.3766 17.3766 17.6740 17.6740 k = 0.0000 0.0000 0.7555 ( 1816 PWs) bands (ev): -46.3552 -46.3552 -22.2452 -22.2452 -19.7991 -19.7991 -19.7454 -19.7454 4.1787 4.1787 8.0955 8.0955 8.6347 8.6347 8.7795 8.7795 11.7102 11.7102 12.0849 12.0849 13.1136 13.1136 16.8227 16.8227 17.0331 17.0331 17.3861 17.3861 17.6646 17.6646 k = 0.0000 0.0000 0.7704 ( 1816 PWs) bands (ev): -46.3548 -46.3548 -22.2463 -22.2463 -19.8015 -19.8015 -19.7458 -19.7458 4.2699 4.2699 8.0865 8.0865 8.5924 8.5924 8.7602 8.7602 11.6369 11.6369 12.0542 12.0542 13.1565 13.1565 16.7666 16.7666 16.9729 16.9729 17.3918 17.3918 17.6556 17.6556 k = 0.0000 0.0000 0.7852 ( 1818 PWs) bands (ev): -46.3545 -46.3545 -22.2474 -22.2474 -19.8038 -19.8038 -19.7462 -19.7462 4.3581 4.3581 8.0784 8.0784 8.5525 8.5525 8.7466 8.7466 11.5558 11.5558 12.0253 12.0253 13.1989 13.1989 16.7187 16.7187 16.9138 16.9138 17.3937 17.3937 17.6471 17.6471 k = 0.0000 0.0000 0.8000 ( 1818 PWs) bands (ev): -46.3542 -46.3542 -22.2484 -22.2484 -19.8059 -19.8059 -19.7465 -19.7465 4.4428 4.4428 8.0710 8.0710 8.5151 8.5151 8.7390 8.7390 11.4677 11.4677 11.9984 11.9984 13.2406 13.2406 16.6781 16.6781 16.8563 16.8563 17.3922 17.3922 17.6390 17.6390 k = 0.0000 0.0000 0.8148 ( 1818 PWs) bands (ev): -46.3539 -46.3539 -22.2494 -22.2494 -19.8078 -19.8078 -19.7468 -19.7468 4.5237 4.5237 8.0643 8.0643 8.4801 8.4801 8.7375 8.7375 11.3737 11.3737 11.9734 11.9734 13.2813 13.2813 16.6440 16.6440 16.8010 16.8010 17.3878 17.3878 17.6315 17.6315 k = 0.0000 0.0000 0.8296 ( 1822 PWs) bands (ev): -46.3537 -46.3537 -22.2503 -22.2503 -19.8097 -19.8097 -19.7471 -19.7471 4.6002 4.6002 8.0583 8.0583 8.4476 8.4476 8.7422 8.7422 11.2748 11.2748 11.9504 11.9504 13.3209 13.3209 16.6151 16.6151 16.7487 16.7487 17.3811 17.3811 17.6244 17.6244 k = 0.0000 0.0000 0.8444 ( 1818 PWs) bands (ev): -46.3534 -46.3534 -22.2511 -22.2511 -19.8114 -19.8114 -19.7474 -19.7474 4.6721 4.6721 8.0529 8.0529 8.4176 8.4176 8.7533 8.7533 11.1722 11.1722 11.9293 11.9293 13.3589 13.3589 16.5899 16.5899 16.7004 16.7004 17.3726 17.3726 17.6179 17.6179 k = 0.0000 0.0000 0.8592 ( 1812 PWs) bands (ev): -46.3530 -46.3530 -22.2518 -22.2518 -19.8129 -19.8129 -19.7476 -19.7476 4.7388 4.7388 8.0482 8.0482 8.3902 8.3902 8.7704 8.7704 11.0673 11.0673 11.9102 11.9102 13.3952 13.3952 16.5664 16.5664 16.6577 16.6577 17.3628 17.3628 17.6119 17.6119 k = 0.0000 0.0000 0.8741 ( 1812 PWs) bands (ev): -46.3528 -46.3528 -22.2525 -22.2525 -19.8143 -19.8143 -19.7478 -19.7478 4.8001 4.8001 8.0439 8.0439 8.3653 8.3653 8.7934 8.7934 10.9616 10.9616 11.8929 11.8929 13.4294 13.4294 16.5417 16.5417 16.6230 16.6230 17.3522 17.3522 17.6064 17.6064 k = 0.0000 0.0000 0.8889 ( 1818 PWs) bands (ev): -46.3527 -46.3527 -22.2532 -22.2532 -19.8157 -19.8157 -19.7480 -19.7480 4.8556 4.8556 8.0403 8.0403 8.3430 8.3430 8.8215 8.8215 10.8567 10.8567 11.8776 11.8776 13.4612 13.4612 16.5139 16.5139 16.5980 16.5980 17.3414 17.3414 17.6015 17.6015 k = 0.0000 0.0000 0.9037 ( 1818 PWs) bands (ev): -46.3526 -46.3526 -22.2537 -22.2537 -19.8168 -19.8168 -19.7482 -19.7482 4.9051 4.9051 8.0371 8.0371 8.3233 8.3233 8.8541 8.8541 10.7543 10.7543 11.8641 11.8641 13.4903 13.4903 16.4839 16.4839 16.5817 16.5817 17.3308 17.3308 17.5972 17.5972 k = 0.0000 0.0000 0.9185 ( 1818 PWs) bands (ev): -46.3524 -46.3524 -22.2542 -22.2542 -19.8178 -19.8178 -19.7484 -19.7484 4.9483 4.9483 8.0344 8.0344 8.3062 8.3062 8.8899 8.8899 10.6565 10.6565 11.8524 11.8524 13.5163 13.5163 16.4543 16.4543 16.5710 16.5710 17.3208 17.3208 17.5934 17.5934 k = 0.0000 0.0000 0.9333 ( 1810 PWs) bands (ev): -46.3521 -46.3521 -22.2545 -22.2545 -19.8186 -19.8186 -19.7485 -19.7485 4.9851 4.9851 8.0321 8.0321 8.2917 8.2917 8.9272 8.9272 10.5657 10.5657 11.8426 11.8426 13.5390 13.5390 16.4273 16.4273 16.5640 16.5640 17.3117 17.3117 17.5902 17.5902 k = 0.0000 0.0000 0.9481 ( 1810 PWs) bands (ev): -46.3520 -46.3520 -22.2549 -22.2549 -19.8193 -19.8193 -19.7486 -19.7486 5.0154 5.0154 8.0303 8.0303 8.2799 8.2799 8.9639 8.9639 10.4844 10.4844 11.8346 11.8346 13.5580 13.5580 16.4041 16.4041 16.5593 16.5593 17.3039 17.3039 17.5876 17.5876 k = 0.0000 0.0000 0.9629 ( 1806 PWs) bands (ev): -46.3519 -46.3519 -22.2551 -22.2551 -19.8198 -19.8198 -19.7486 -19.7486 5.0390 5.0390 8.0289 8.0289 8.2706 8.2706 8.9974 8.9974 10.4158 10.4158 11.8284 11.8284 13.5730 13.5730 16.3854 16.3854 16.5561 16.5561 17.2976 17.2976 17.5855 17.5855 k = 0.0000 0.0000 0.9778 ( 1806 PWs) bands (ev): -46.3518 -46.3518 -22.2553 -22.2553 -19.8202 -19.8202 -19.7487 -19.7487 5.0559 5.0559 8.0279 8.0279 8.2640 8.2640 9.0245 9.0245 10.3634 10.3634 11.8240 11.8240 13.5840 13.5840 16.3718 16.3718 16.5541 16.5541 17.2929 17.2929 17.5841 17.5841 k = 0.0000 0.0000 0.9926 ( 1806 PWs) bands (ev): -46.3518 -46.3518 -22.2554 -22.2554 -19.8204 -19.8204 -19.7487 -19.7487 5.0661 5.0661 8.0273 8.0273 8.2600 8.2600 9.0424 9.0424 10.3303 10.3303 11.8213 11.8213 13.5906 13.5906 16.3635 16.3635 16.5530 16.5530 17.2901 17.2901 17.5832 17.5832 k = 0.0000 0.0000 1.0074 ( 1802 PWs) bands (ev): -46.3517 -46.3517 -22.2554 -22.2554 -19.8205 -19.8205 -19.7487 -19.7487 5.0695 5.0695 8.0272 8.0272 8.2587 8.2587 9.0486 9.0486 10.3189 10.3189 11.8204 11.8204 13.5928 13.5928 16.3608 16.3608 16.5527 16.5527 17.2891 17.2891 17.5829 17.5829 k = 0.0000 0.0000 1.0074 ( 1802 PWs) bands (ev): -46.3517 -46.3517 -22.2554 -22.2554 -19.8205 -19.8205 -19.7487 -19.7487 5.0695 5.0695 8.0272 8.0272 8.2587 8.2587 9.0486 9.0486 10.3189 10.3189 11.8204 11.8204 13.5928 13.5928 16.3608 16.3608 16.5527 16.5527 17.2891 17.2891 17.5829 17.5829 k =-0.0074 0.0130 1.0074 ( 1802 PWs) bands (ev): -46.3517 -46.3517 -22.2554 -22.2554 -19.8204 -19.8204 -19.7487 -19.7487 5.0706 5.0706 7.9347 7.9347 8.3537 8.3537 9.0496 9.0496 10.3188 10.3188 11.8214 11.8214 13.5866 13.5866 16.3578 16.3578 16.5515 16.5515 17.2420 17.2420 17.6325 17.6325 k =-0.0149 0.0260 1.0074 ( 1802 PWs) bands (ev): -46.3517 -46.3517 -22.2553 -22.2553 -19.8202 -19.8202 -19.7487 -19.7487 5.0738 5.0738 7.7802 7.7802 8.5158 8.5158 9.0527 9.0527 10.3186 10.3186 11.8242 11.8242 13.5683 13.5683 16.3490 16.3490 16.5481 16.5481 17.1448 17.1448 17.7370 17.7370 k =-0.0223 0.0390 1.0074 ( 1810 PWs) bands (ev): -46.3519 -46.3519 -22.2551 -22.2551 -19.8198 -19.8198 -19.7487 -19.7487 5.0792 5.0792 7.6181 7.6181 8.6906 8.6906 9.0578 9.0578 10.3182 10.3182 11.8290 11.8290 13.5383 13.5383 16.3345 16.3345 16.5424 16.5424 17.0347 17.0347 17.8595 17.8595 k =-0.0297 0.0520 1.0074 ( 1810 PWs) bands (ev): -46.3520 -46.3520 -22.2549 -22.2549 -19.8193 -19.8193 -19.7486 -19.7486 5.0867 5.0867 7.4557 7.4557 8.8707 8.8707 9.0649 9.0649 10.3175 10.3175 11.8357 11.8357 13.4977 13.4977 16.3143 16.3143 16.5345 16.5345 16.9220 16.9220 17.9895 17.9895 k =-0.0371 0.0650 1.0074 ( 1808 PWs) bands (ev): -46.3521 -46.3521 -22.2546 -22.2546 -19.8186 -19.8186 -19.7486 -19.7486 5.0962 5.0962 7.2947 7.2947 9.0532 9.0532 9.0752 9.0752 10.3164 10.3164 11.8443 11.8443 13.4476 13.4476 16.2887 16.2887 16.5243 16.5243 16.8103 16.8103 18.1238 18.1238 k =-0.0446 0.0780 1.0074 ( 1810 PWs) bands (ev): -46.3523 -46.3523 -22.2542 -22.2542 -19.8178 -19.8178 -19.7485 -19.7485 5.1078 5.1078 7.1357 7.1357 9.0847 9.0847 9.2414 9.2414 10.3146 10.3146 11.8548 11.8548 13.3895 13.3895 16.2580 16.2580 16.5113 16.5113 16.7013 16.7013 18.2613 18.2613 k =-0.0520 0.0910 1.0074 ( 1818 PWs) bands (ev): -46.3526 -46.3526 -22.2538 -22.2538 -19.8168 -19.8168 -19.7485 -19.7485 5.1213 5.1213 6.9790 6.9790 9.0979 9.0979 9.4306 9.4306 10.3121 10.3121 11.8671 11.8671 13.3250 13.3250 16.2225 16.2225 16.4932 16.4932 16.5980 16.5980 18.4011 18.4011 k =-0.0594 0.1040 1.0074 ( 1814 PWs) bands (ev): -46.3527 -46.3527 -22.2532 -22.2532 -19.8156 -19.8156 -19.7485 -19.7485 5.1366 5.1366 6.8248 6.8248 9.1130 9.1130 9.6221 9.6221 10.3086 10.3086 11.8813 11.8813 13.2557 13.2557 16.1825 16.1825 16.4539 16.4539 16.5173 16.5173 18.5430 18.5430 k =-0.0669 0.1169 1.0074 ( 1812 PWs) bands (ev): -46.3528 -46.3528 -22.2526 -22.2526 -19.8143 -19.8143 -19.7484 -19.7484 5.1536 5.1536 6.6731 6.6731 9.1301 9.1301 9.8157 9.8157 10.3039 10.3039 11.8974 11.8974 13.1832 13.1832 16.1383 16.1383 16.3705 16.3705 16.4825 16.4825 18.6864 18.6864 k =-0.0743 0.1299 1.0074 ( 1812 PWs) bands (ev): -46.3530 -46.3530 -22.2520 -22.2520 -19.8129 -19.8129 -19.7483 -19.7483 5.1723 5.1723 6.5240 6.5240 9.1491 9.1491 10.0108 10.0108 10.2981 10.2981 11.9152 11.9152 13.1091 13.1091 16.0902 16.0902 16.2767 16.2767 16.4606 16.4606 18.8312 18.8312 k =-0.0817 0.1429 1.0074 ( 1820 PWs) bands (ev): -46.3534 -46.3534 -22.2513 -22.2513 -19.8113 -19.8113 -19.7482 -19.7482 5.1924 5.1924 6.3776 6.3776 9.1700 9.1700 10.2030 10.2030 10.2953 10.2953 11.9349 11.9349 13.0350 13.0350 16.0381 16.0381 16.1849 16.1849 16.4397 16.4397 18.9769 18.9769 k =-0.0817 0.1429 1.0074 ( 1820 PWs) bands (ev): -46.3534 -46.3534 -22.2513 -22.2513 -19.8113 -19.8113 -19.7482 -19.7482 5.1924 5.1924 6.3776 6.3776 9.1700 9.1700 10.2030 10.2030 10.2953 10.2953 11.9349 11.9349 13.0350 13.0350 16.0381 16.0381 16.1849 16.1849 16.4397 16.4397 18.9769 18.9769 k =-0.0869 0.1521 0.9969 ( 1824 PWs) bands (ev): -46.3537 -46.3537 -22.2508 -22.2508 -19.8101 -19.8101 -19.7481 -19.7481 5.2058 5.2058 6.2765 6.2765 9.1812 9.1812 10.2774 10.2774 10.3612 10.3612 11.9503 11.9503 12.9827 12.9827 15.9999 15.9999 16.1236 16.1236 16.4252 16.4252 19.0799 19.0799 k =-0.0922 0.1612 0.9863 ( 1822 PWs) bands (ev): -46.3539 -46.3539 -22.2501 -22.2501 -19.8088 -19.8088 -19.7480 -19.7480 5.2168 5.2168 6.1778 6.1778 9.1834 9.1834 10.2964 10.2964 10.4969 10.4969 11.9674 11.9674 12.9297 12.9297 15.9612 15.9612 16.0668 16.0668 16.4117 16.4117 19.1830 19.1830 k =-0.0974 0.1704 0.9758 ( 1822 PWs) bands (ev): -46.3541 -46.3541 -22.2495 -22.2495 -19.8074 -19.8074 -19.7478 -19.7478 5.2255 5.2255 6.0813 6.0813 9.1765 9.1765 10.3244 10.3244 10.6379 10.6379 11.9862 11.9862 12.8764 12.8764 15.9219 15.9219 16.0151 16.0151 16.3991 16.3991 19.2860 19.2860 k =-0.1026 0.1795 0.9653 ( 1823 PWs) bands (ev): -46.3543 -46.3543 -22.2487 -22.2487 -19.8060 -19.8060 -19.7475 -19.7475 5.2320 5.2320 5.9873 5.9873 9.1609 9.1609 10.3643 10.3643 10.7798 10.7798 12.0070 12.0070 12.8235 12.8235 15.8822 15.8822 15.9688 15.9688 16.3875 16.3875 19.3885 19.3885 k =-0.1079 0.1887 0.9547 ( 1821 PWs) bands (ev): -46.3546 -46.3546 -22.2479 -22.2479 -19.8045 -19.8045 -19.7470 -19.7470 5.2363 5.2363 5.8956 5.8956 9.1376 9.1376 10.4152 10.4152 10.9219 10.9219 12.0297 12.0297 12.7711 12.7711 15.8426 15.8426 15.9279 15.9279 16.3769 16.3769 19.4903 19.4903 k =-0.1131 0.1978 0.9442 ( 1821 PWs) bands (ev): -46.3548 -46.3548 -22.2471 -22.2471 -19.8031 -19.8031 -19.7465 -19.7465 5.2387 5.2387 5.8063 5.8063 9.1079 9.1079 10.4758 10.4758 11.0634 11.0634 12.0546 12.0546 12.7198 12.7198 15.8044 15.8044 15.8918 15.8918 16.3675 16.3675 19.5911 19.5911 k =-0.1183 0.2069 0.9336 ( 1821 PWs) bands (ev): -46.3551 -46.3551 -22.2462 -22.2462 -19.8016 -19.8016 -19.7458 -19.7458 5.2391 5.2391 5.7194 5.7194 9.0731 9.0731 10.5444 10.5444 11.2033 11.2033 12.0823 12.0823 12.6698 12.6698 15.7686 15.7686 15.8599 15.8599 16.3594 16.3594 19.6903 19.6903 k =-0.1235 0.2161 0.9231 ( 1819 PWs) bands (ev): -46.3554 -46.3554 -22.2453 -22.2453 -19.8002 -19.8002 -19.7450 -19.7450 5.2378 5.2378 5.6350 5.6350 9.0344 9.0344 10.6195 10.6195 11.3405 11.3405 12.1134 12.1134 12.6215 12.6215 15.7364 15.7364 15.8320 15.8320 16.3526 16.3526 19.7874 19.7874 k =-0.1288 0.2252 0.9126 ( 1817 PWs) bands (ev): -46.3557 -46.3557 -22.2444 -22.2444 -19.7989 -19.7989 -19.7439 -19.7439 5.2349 5.2349 5.5530 5.5530 8.9926 8.9926 10.6997 10.6997 11.4734 11.4734 12.1490 12.1490 12.5751 12.5751 15.7085 15.7085 15.8077 15.8077 16.3473 16.3473 19.8806 19.8806 k =-0.1340 0.2344 0.9020 ( 1817 PWs) bands (ev): -46.3560 -46.3560 -22.2434 -22.2434 -19.7977 -19.7977 -19.7428 -19.7428 5.2304 5.2304 5.4736 5.4736 8.9487 8.9487 10.7838 10.7838 11.5994 11.5994 12.1911 12.1911 12.5311 12.5311 15.6856 15.6856 15.7871 15.7871 16.3438 16.3438 19.9610 19.9610 k =-0.1392 0.2435 0.8915 ( 1817 PWs) bands (ev): -46.3563 -46.3563 -22.2424 -22.2424 -19.7966 -19.7966 -19.7414 -19.7414 5.2245 5.2245 5.3967 5.3967 8.9033 8.9033 10.8707 10.8707 11.7154 11.7154 12.2419 12.2419 12.4900 12.4900 15.6682 15.6682 15.7704 15.7704 16.3421 16.3421 19.9622 19.9622 k =-0.1445 0.2527 0.8810 ( 1819 PWs) bands (ev): -46.3567 -46.3567 -22.2414 -22.2414 -19.7956 -19.7956 -19.7398 -19.7398 5.2173 5.2173 5.3225 5.3225 8.8570 8.8570 10.9594 10.9594 11.8173 11.8173 12.3032 12.3032 12.4536 12.4536 15.6569 15.6569 15.7575 15.7575 16.3426 16.3426 19.8971 19.8971 k =-0.1497 0.2618 0.8704 ( 1819 PWs) bands (ev): -46.3571 -46.3571 -22.2404 -22.2404 -19.7948 -19.7948 -19.7380 -19.7380 5.2081 5.2081 5.2516 5.2516 8.8100 8.8100 11.0491 11.0491 11.9022 11.9022 12.3629 12.3629 12.4364 12.4364 15.6520 15.6520 15.7487 15.7487 16.3457 16.3457 19.8216 19.8216 k =-0.1549 0.2710 0.8599 ( 1819 PWs) bands (ev): -46.3574 -46.3574 -22.2394 -22.2394 -19.7941 -19.7941 -19.7360 -19.7360 5.1771 5.1771 5.2041 5.2041 8.7628 8.7628 11.1389 11.1389 11.9699 11.9699 12.3609 12.3609 12.4983 12.4983 15.6537 15.6537 15.7442 15.7442 16.3517 16.3517 19.7428 19.7428 k =-0.1601 0.2801 0.8494 ( 1823 PWs) bands (ev): -46.3579 -46.3579 -22.2384 -22.2384 -19.7936 -19.7936 -19.7339 -19.7339 5.1125 5.1125 5.1919 5.1919 8.7157 8.7157 11.2282 11.2282 12.0228 12.0228 12.3335 12.3335 12.6000 12.6000 15.6623 15.6623 15.7442 15.7442 16.3613 16.3613 19.6626 19.6626 k =-0.1654 0.2893 0.8388 ( 1823 PWs) bands (ev): -46.3582 -46.3582 -22.2373 -22.2373 -19.7932 -19.7932 -19.7315 -19.7315 5.0485 5.0485 5.1809 5.1809 8.6689 8.6689 11.3163 11.3163 12.0645 12.0645 12.3052 12.3052 12.7128 12.7128 15.6773 15.6773 15.7493 15.7493 16.3749 16.3749 19.5818 19.5818 k =-0.1706 0.2984 0.8283 ( 1825 PWs) bands (ev): -46.3586 -46.3586 -22.2363 -22.2363 -19.7929 -19.7929 -19.7291 -19.7291 4.9869 4.9869 5.1696 5.1696 8.6226 8.6226 11.4026 11.4026 12.0980 12.0980 12.2786 12.2786 12.8301 12.8301 15.6972 15.6972 15.7612 15.7612 16.3934 16.3934 19.5013 19.5013 k =-0.1758 0.3075 0.8178 ( 1827 PWs) bands (ev): -46.3590 -46.3590 -22.2353 -22.2353 -19.7928 -19.7928 -19.7265 -19.7265 4.9278 4.9278 5.1578 5.1578 8.5771 8.5771 11.4865 11.4865 12.1252 12.1252 12.2546 12.2546 12.9487 12.9487 15.7185 15.7185 15.7831 15.7831 16.4177 16.4177 19.4213 19.4213 k =-0.1811 0.3167 0.8072 ( 1827 PWs) bands (ev): -46.3594 -46.3594 -22.2343 -22.2343 -19.7927 -19.7927 -19.7238 -19.7238 4.8712 4.8712 5.1457 5.1457 8.5324 8.5324 11.5675 11.5675 12.1471 12.1471 12.2339 12.2339 13.0662 13.0662 15.7375 15.7375 15.8186 15.8186 16.4486 16.4486 19.3424 19.3424 k =-0.1863 0.3258 0.7967 ( 1831 PWs) bands (ev): -46.3598 -46.3598 -22.2333 -22.2333 -19.7928 -19.7928 -19.7211 -19.7211 4.8172 4.8172 5.1334 5.1334 8.4887 8.4887 11.6452 11.6452 12.1624 12.1624 12.2186 12.2186 13.1811 13.1811 15.7537 15.7537 15.8676 15.8676 16.4871 16.4871 19.2649 19.2649 k =-0.1915 0.3350 0.7862 ( 1825 PWs) bands (ev): -46.3600 -46.3600 -22.2323 -22.2323 -19.7929 -19.7929 -19.7183 -19.7183 4.7658 4.7658 5.1210 5.1210 8.4462 8.4462 11.7191 11.7191 12.1667 12.1667 12.2137 12.2137 13.2924 13.2924 15.7681 15.7681 15.9286 15.9286 16.5341 16.5341 19.1891 19.1891 k =-0.1967 0.3441 0.7756 ( 1825 PWs) bands (ev): -46.3603 -46.3603 -22.2313 -22.2313 -19.7930 -19.7930 -19.7155 -19.7155 4.7170 4.7170 5.1086 5.1086 8.4050 8.4050 11.7890 11.7890 12.1595 12.1595 12.2201 12.2201 13.3991 13.3991 15.7814 15.7814 16.0001 16.0001 16.5903 16.5903 19.1153 19.1153 k =-0.2020 0.3533 0.7651 ( 1821 PWs) bands (ev): -46.3606 -46.3606 -22.2304 -22.2304 -19.7933 -19.7933 -19.7127 -19.7127 4.6708 4.6708 5.0962 5.0962 8.3652 8.3652 11.8544 11.8544 12.1483 12.1483 12.2305 12.2305 13.5006 13.5006 15.7935 15.7935 16.0815 16.0815 16.6564 16.6564 19.0437 19.0437 k =-0.2072 0.3624 0.7546 ( 1819 PWs) bands (ev): -46.3609 -46.3609 -22.2295 -22.2295 -19.7935 -19.7935 -19.7099 -19.7099 4.6272 4.6272 5.0841 5.0841 8.3270 8.3270 11.9152 11.9152 12.1373 12.1373 12.2411 12.2411 13.5965 13.5965 15.8043 15.8043 16.1722 16.1722 16.7326 16.7326 18.9746 18.9746 k =-0.2124 0.3716 0.7440 ( 1818 PWs) bands (ev): -46.3612 -46.3612 -22.2286 -22.2286 -19.7938 -19.7938 -19.7072 -19.7072 4.5863 4.5863 5.0722 5.0722 8.2905 8.2905 11.9707 11.9707 12.1277 12.1277 12.2512 12.2512 13.6867 13.6867 15.8138 15.8138 16.2715 16.2715 16.8190 16.8190 18.9082 18.9082 k =-0.2177 0.3807 0.7335 ( 1818 PWs) bands (ev): -46.3615 -46.3615 -22.2278 -22.2278 -19.7941 -19.7941 -19.7046 -19.7046 4.5479 4.5479 5.0606 5.0606 8.2558 8.2558 12.0199 12.0199 12.1208 12.1208 12.2605 12.2605 13.7708 13.7708 15.8218 15.8218 16.3787 16.3787 16.9154 16.9154 18.8447 18.8447 k =-0.2229 0.3899 0.7230 ( 1816 PWs) bands (ev): -46.3617 -46.3617 -22.2270 -22.2270 -19.7944 -19.7944 -19.7020 -19.7020 4.5122 4.5122 5.0495 5.0495 8.2229 8.2229 12.0587 12.0587 12.1205 12.1205 12.2692 12.2692 13.8490 13.8490 15.8286 15.8286 16.4929 16.4929 17.0214 17.0214 18.7844 18.7844 k =-0.2281 0.3990 0.7124 ( 1819 PWs) bands (ev): -46.3620 -46.3620 -22.2263 -22.2263 -19.7948 -19.7948 -19.6996 -19.6996 4.4791 4.4791 5.0389 5.0389 8.1921 8.1921 12.0772 12.0772 12.1366 12.1366 12.2776 12.2776 13.9211 13.9211 15.8341 15.8341 16.6133 16.6133 17.1364 17.1364 18.7275 18.7275 k =-0.2333 0.4081 0.7019 ( 1821 PWs) bands (ev): -46.3623 -46.3623 -22.2256 -22.2256 -19.7951 -19.7951 -19.6973 -19.6973 4.4486 4.4486 5.0289 5.0289 8.1634 8.1634 12.0789 12.0789 12.1650 12.1650 12.2864 12.2864 13.9873 13.9873 15.8385 15.8385 16.7386 16.7386 17.2596 17.2596 18.6743 18.6743 k =-0.2386 0.4173 0.6914 ( 1823 PWs) bands (ev): -46.3626 -46.3626 -22.2250 -22.2250 -19.7955 -19.7955 -19.6952 -19.6952 4.4208 4.4208 5.0196 5.0196 8.1368 8.1368 12.0761 12.0761 12.1930 12.1930 12.2961 12.2961 14.0477 14.0477 15.8420 15.8420 16.8679 16.8679 17.3901 17.3901 18.6248 18.6248 k =-0.2438 0.4264 0.6808 ( 1825 PWs) bands (ev): -46.3628 -46.3628 -22.2245 -22.2245 -19.7958 -19.7958 -19.6932 -19.6932 4.3957 4.3957 5.0109 5.0109 8.1125 8.1125 12.0724 12.0724 12.2162 12.2162 12.3075 12.3075 14.1023 14.1023 15.8447 15.8447 16.9999 16.9999 17.5265 17.5265 18.5794 18.5794 k =-0.2490 0.4356 0.6703 ( 1830 PWs) bands (ev): -46.3631 -46.3631 -22.2240 -22.2240 -19.7961 -19.7961 -19.6915 -19.6915 4.3731 4.3731 5.0030 5.0030 8.0906 8.0906 12.0688 12.0688 12.2336 12.2336 12.3210 12.3210 14.1512 14.1512 15.8468 15.8468 17.1332 17.1332 17.6676 17.6676 18.5381 18.5381 k =-0.2543 0.4447 0.6598 ( 1826 PWs) bands (ev): -46.3632 -46.3632 -22.2235 -22.2235 -19.7963 -19.7963 -19.6898 -19.6898 4.3532 4.3532 4.9959 4.9959 8.0711 8.0711 12.0656 12.0656 12.2456 12.2456 12.3359 12.3359 14.1944 14.1944 15.8483 15.8483 17.2661 17.2661 17.8114 17.8114 18.5013 18.5013 k =-0.2595 0.4539 0.6492 ( 1826 PWs) bands (ev): -46.3633 -46.3633 -22.2231 -22.2231 -19.7966 -19.7966 -19.6884 -19.6884 4.3360 4.3360 4.9897 4.9897 8.0540 8.0540 12.0628 12.0628 12.2536 12.2536 12.3510 12.3510 14.2319 14.2319 15.8495 15.8495 17.3969 17.3969 17.9554 17.9554 18.4689 18.4689 k =-0.2647 0.4630 0.6387 ( 1824 PWs) bands (ev): -46.3634 -46.3634 -22.2227 -22.2227 -19.7968 -19.7968 -19.6871 -19.6871 4.3214 4.3214 4.9844 4.9844 8.0395 8.0395 12.0605 12.0605 12.2589 12.2589 12.3649 12.3649 14.2637 14.2637 15.8503 15.8503 17.5228 17.5228 18.0964 18.0964 18.4413 18.4413 k =-0.2699 0.4722 0.6282 ( 1820 PWs) bands (ev): -46.3635 -46.3635 -22.2224 -22.2224 -19.7969 -19.7969 -19.6861 -19.6861 4.3095 4.3095 4.9800 4.9800 8.0276 8.0276 12.0586 12.0586 12.2624 12.2624 12.3770 12.3770 14.2898 14.2898 15.8509 15.8509 17.6407 17.6407 18.2297 18.2297 18.4186 18.4186 k =-0.2752 0.4813 0.6176 ( 1821 PWs) bands (ev): -46.3636 -46.3636 -22.2222 -22.2222 -19.7970 -19.7970 -19.6853 -19.6853 4.3002 4.3002 4.9766 4.9766 8.0182 8.0182 12.0572 12.0572 12.2647 12.2647 12.3866 12.3866 14.3102 14.3102 15.8513 15.8513 17.7456 17.7456 18.3485 18.3485 18.4011 18.4011 k =-0.2804 0.4904 0.6071 ( 1819 PWs) bands (ev): -46.3636 -46.3636 -22.2220 -22.2220 -19.7971 -19.7971 -19.6847 -19.6847 4.2936 4.2936 4.9741 4.9741 8.0115 8.0115 12.0562 12.0562 12.2661 12.2661 12.3937 12.3937 14.3248 14.3248 15.8515 15.8515 17.8308 17.8308 18.3868 18.3868 18.4465 18.4465 k =-0.2856 0.4996 0.5965 ( 1817 PWs) bands (ev): -46.3636 -46.3636 -22.2219 -22.2219 -19.7972 -19.7972 -19.6844 -19.6844 4.2896 4.2896 4.9726 4.9726 8.0075 8.0075 12.0556 12.0556 12.2669 12.2669 12.3979 12.3979 14.3336 14.3336 15.8517 15.8517 17.8878 17.8878 18.3793 18.3793 18.5101 18.5101 k =-0.2909 0.5087 0.5860 ( 1819 PWs) bands (ev): -46.3636 -46.3636 -22.2219 -22.2219 -19.7972 -19.7972 -19.6843 -19.6843 4.2883 4.2883 4.9721 4.9721 8.0062 8.0062 12.0555 12.0555 12.2671 12.2671 12.3994 12.3994 14.3366 14.3366 15.8517 15.8517 17.9080 17.9080 18.3767 18.3767 18.5326 18.5326 k =-0.2909 0.5087 0.5860 ( 1819 PWs) bands (ev): -46.3636 -46.3636 -22.2219 -22.2219 -19.7972 -19.7972 -19.6843 -19.6843 4.2883 4.2883 4.9721 4.9721 8.0062 8.0062 12.0555 12.0555 12.2671 12.2671 12.3994 12.3994 14.3366 14.3366 15.8517 15.8517 17.9080 17.9080 18.3767 18.3767 18.5326 18.5326 k =-0.2857 0.4997 0.5756 ( 1819 PWs) bands (ev): -46.3635 -46.3635 -22.2225 -22.2225 -19.7986 -19.7986 -19.6840 -19.6840 4.3829 4.3829 4.8768 4.8768 8.0592 8.0592 12.0076 12.0076 12.2404 12.2404 12.3879 12.3879 14.3192 14.3192 15.9105 15.9105 17.7784 17.7784 18.3375 18.3375 18.6629 18.6629 k =-0.2805 0.4906 0.5651 ( 1823 PWs) bands (ev): -46.3634 -46.3634 -22.2230 -22.2230 -19.7999 -19.7999 -19.6837 -19.6837 4.4794 4.4794 4.7754 4.7754 8.1220 8.1220 11.9567 11.9567 12.2151 12.2151 12.3796 12.3796 14.2984 14.2984 15.9655 15.9655 17.6516 17.6516 18.3021 18.3021 18.7948 18.7948 k =-0.2753 0.4815 0.5546 ( 1821 PWs) bands (ev): -46.3632 -46.3632 -22.2233 -22.2233 -19.8010 -19.8010 -19.6834 -19.6834 4.5766 4.5766 4.6704 4.6704 8.1932 8.1932 11.9030 11.9030 12.1914 12.1914 12.3744 12.3744 14.2739 14.2739 16.0164 16.0164 17.5276 17.5276 18.2700 18.2700 18.8465 18.8465 k =-0.2701 0.4724 0.5442 ( 1815 PWs) bands (ev): -46.3630 -46.3630 -22.2236 -22.2236 -19.8018 -19.8018 -19.6832 -19.6832 4.5561 4.5561 4.6812 4.6812 8.2716 8.2716 11.8468 11.8468 12.1694 12.1694 12.3721 12.3721 14.2459 14.2459 16.0628 16.0628 17.4066 17.4066 18.2406 18.2406 18.7912 18.7912 k =-0.2649 0.4633 0.5337 ( 1819 PWs) bands (ev): -46.3630 -46.3630 -22.2238 -22.2238 -19.8024 -19.8024 -19.6830 -19.6830 4.4439 4.4439 4.7829 4.7829 8.3560 8.3560 11.7885 11.7885 12.1491 12.1491 12.3727 12.3727 14.2144 14.2144 16.1044 16.1044 17.2887 17.2887 18.2135 18.2135 18.7416 18.7416 k =-0.2597 0.4542 0.5232 ( 1819 PWs) bands (ev): -46.3630 -46.3630 -22.2240 -22.2240 -19.8028 -19.8028 -19.6828 -19.6828 4.3288 4.3288 4.8872 4.8872 8.4454 8.4454 11.7283 11.7283 12.1306 12.1306 12.3762 12.3762 14.1794 14.1794 16.1409 16.1409 17.1742 17.1742 18.1883 18.1883 18.6981 18.6981 k =-0.2545 0.4451 0.5128 ( 1819 PWs) bands (ev): -46.3629 -46.3629 -22.2240 -22.2240 -19.8030 -19.8030 -19.6826 -19.6826 4.2122 4.2122 4.9936 4.9936 8.5389 8.5389 11.6667 11.6667 12.1138 12.1138 12.3826 12.3826 14.1410 14.1410 16.1720 16.1720 17.0630 17.0630 18.1648 18.1648 18.6604 18.6604 k =-0.2493 0.4361 0.5023 ( 1819 PWs) bands (ev): -46.3629 -46.3629 -22.2240 -22.2240 -19.8029 -19.8029 -19.6825 -19.6825 4.0948 4.0948 5.1018 5.1018 8.6356 8.6356 11.6042 11.6042 12.0988 12.0988 12.3919 12.3919 14.0995 14.0995 16.1976 16.1976 16.9554 16.9554 18.1426 18.1426 18.6283 18.6283 k =-0.2441 0.4270 0.4918 ( 1827 PWs) bands (ev): -46.3631 -46.3631 -22.2239 -22.2239 -19.8027 -19.8027 -19.6824 -19.6824 3.9770 3.9770 5.2118 5.2118 8.7346 8.7346 11.5411 11.5411 12.0856 12.0856 12.4040 12.4040 14.0548 14.0548 16.2172 16.2172 16.8515 16.8515 18.1219 18.1219 18.6018 18.6018 k =-0.2389 0.4179 0.4814 ( 1823 PWs) bands (ev): -46.3631 -46.3631 -22.2237 -22.2237 -19.8022 -19.8022 -19.6823 -19.6823 3.8594 3.8594 5.3235 5.3235 8.8351 8.8351 11.4782 11.4782 12.0740 12.0740 12.4190 12.4190 14.0073 14.0073 16.2307 16.2307 16.7517 16.7517 18.1025 18.1025 18.5805 18.5805 k =-0.2337 0.4088 0.4709 ( 1823 PWs) bands (ev): -46.3632 -46.3632 -22.2233 -22.2233 -19.8015 -19.8015 -19.6823 -19.6823 3.7422 3.7422 5.4368 5.4368 8.9362 8.9362 11.4160 11.4160 12.0641 12.0641 12.4368 12.4368 13.9572 13.9572 16.2378 16.2378 16.6563 16.6563 18.0848 18.0848 18.5642 18.5642 k =-0.2285 0.3997 0.4604 ( 1821 PWs) bands (ev): -46.3632 -46.3632 -22.2229 -22.2229 -19.8006 -19.8006 -19.6822 -19.6822 3.6258 3.6258 5.5518 5.5518 9.0369 9.0369 11.3552 11.3552 12.0558 12.0558 12.4574 12.4574 13.9048 13.9048 16.2380 16.2380 16.5660 16.5660 18.0688 18.0688 18.5526 18.5526 k =-0.2233 0.3906 0.4500 ( 1821 PWs) bands (ev): -46.3633 -46.3633 -22.2224 -22.2224 -19.7994 -19.7994 -19.6823 -19.6823 3.5105 3.5105 5.6683 5.6683 9.1362 9.1362 11.2968 11.2968 12.0491 12.0491 12.4808 12.4808 13.8502 13.8502 16.2305 16.2305 16.4818 16.4818 18.0548 18.0548 18.5453 18.5453 k =-0.2181 0.3816 0.4395 ( 1825 PWs) bands (ev): -46.3635 -46.3635 -22.2219 -22.2219 -19.7981 -19.7981 -19.6823 -19.6823 3.3963 3.3963 5.7862 5.7862 9.2329 9.2329 11.2417 11.2417 12.0438 12.0438 12.5070 12.5070 13.7937 13.7937 16.2136 16.2136 16.4058 16.4058 18.0431 18.0431 18.5421 18.5421 k =-0.2130 0.3725 0.4290 ( 1821 PWs) bands (ev): -46.3636 -46.3636 -22.2212 -22.2212 -19.7965 -19.7965 -19.6823 -19.6823 3.2837 3.2837 5.9055 5.9055 9.3256 9.3256 11.1912 11.1912 12.0398 12.0398 12.5361 12.5361 13.7356 13.7356 16.1847 16.1847 16.3412 16.3412 18.0338 18.0338 18.5426 18.5426 k =-0.2078 0.3634 0.4186 ( 1821 PWs) bands (ev): -46.3638 -46.3638 -22.2205 -22.2205 -19.7948 -19.7948 -19.6824 -19.6824 3.1726 3.1726 6.0262 6.0262 9.4125 9.4125 11.1466 11.1466 12.0372 12.0372 12.5679 12.5679 13.6763 13.6763 16.1420 16.1420 16.2903 16.2903 18.0272 18.0272 18.5466 18.5466 k =-0.2026 0.3543 0.4081 ( 1821 PWs) bands (ev): -46.3640 -46.3640 -22.2197 -22.2197 -19.7928 -19.7928 -19.6825 -19.6825 3.0632 3.0632 6.1480 6.1480 9.4919 9.4919 11.1097 11.1097 12.0358 12.0358 12.6024 12.6024 13.6158 13.6158 16.0885 16.0885 16.2510 16.2510 18.0232 18.0232 18.5536 18.5536 k =-0.1974 0.3452 0.3977 ( 1817 PWs) bands (ev): -46.3641 -46.3641 -22.2188 -22.2188 -19.7907 -19.7907 -19.6826 -19.6826 2.9557 2.9557 6.2709 6.2709 9.5617 9.5617 11.0823 11.0823 12.0354 12.0354 12.6397 12.6397 13.5545 13.5545 16.0304 16.0304 16.2180 16.2180 18.0218 18.0218 18.5633 18.5633 k =-0.1922 0.3361 0.3872 ( 1809 PWs) bands (ev): -46.3642 -46.3642 -22.2178 -22.2178 -19.7883 -19.7883 -19.6827 -19.6827 2.8502 2.8502 6.3948 6.3948 9.6197 9.6197 11.0663 11.0663 12.0361 12.0361 12.6797 12.6797 13.4927 13.4927 15.9720 15.9720 16.1878 16.1878 18.0231 18.0231 18.5755 18.5755 k =-0.1870 0.3270 0.3767 ( 1813 PWs) bands (ev): -46.3646 -46.3646 -22.2168 -22.2168 -19.7859 -19.7859 -19.6829 -19.6829 2.7468 2.7468 6.5196 6.5196 9.6641 9.6641 11.0631 11.0631 12.0376 12.0376 12.7223 12.7223 13.4306 13.4306 15.9159 15.9159 16.1591 16.1591 18.0267 18.0267 18.5899 18.5899 k =-0.1818 0.3180 0.3663 ( 1809 PWs) bands (ev): -46.3648 -46.3648 -22.2158 -22.2158 -19.7833 -19.7833 -19.6830 -19.6830 2.6455 2.6455 6.6452 6.6452 9.6938 9.6938 11.0737 11.0737 12.0398 12.0398 12.7676 12.7676 13.3683 13.3683 15.8632 15.8632 16.1318 16.1318 18.0326 18.0326 18.6061 18.6061 k =-0.1766 0.3089 0.3558 ( 1809 PWs) bands (ev): -46.3651 -46.3651 -22.2146 -22.2146 -19.7806 -19.7806 -19.6831 -19.6831 2.5465 2.5465 6.7714 6.7714 9.7085 9.7085 11.0979 11.0979 12.0427 12.0427 12.8154 12.8154 13.3063 13.3063 15.8147 15.8147 16.1062 16.1062 18.0405 18.0405 18.6239 18.6239 k =-0.1714 0.2998 0.3453 ( 1809 PWs) bands (ev): -46.3654 -46.3654 -22.2135 -22.2135 -19.7777 -19.7777 -19.6833 -19.6833 2.4498 2.4498 6.8982 6.8982 9.7089 9.7089 11.1347 11.1347 12.0461 12.0461 12.8656 12.8656 13.2447 13.2447 15.7708 15.7708 16.0832 16.0832 18.0502 18.0502 18.6431 18.6431 k =-0.1662 0.2907 0.3349 ( 1809 PWs) bands (ev): -46.3657 -46.3657 -22.2123 -22.2123 -19.7747 -19.7747 -19.6834 -19.6834 2.3555 2.3555 7.0252 7.0252 9.6967 9.6967 11.1819 11.1819 12.0498 12.0498 12.9180 12.9180 13.1839 13.1839 15.7319 15.7319 16.0636 16.0636 18.0613 18.0613 18.6634 18.6634 k =-0.1610 0.2816 0.3244 ( 1809 PWs) bands (ev): -46.3660 -46.3660 -22.2110 -22.2110 -19.7717 -19.7717 -19.6836 -19.6836 2.2636 2.2636 7.1525 7.1525 9.6740 9.6740 11.2371 11.2371 12.0538 12.0538 12.9717 12.9717 13.1250 13.1250 15.6982 15.6982 16.0482 16.0482 18.0738 18.0738 18.6846 18.6846 k =-0.1558 0.2725 0.3139 ( 1809 PWs) bands (ev): -46.3664 -46.3664 -22.2097 -22.2097 -19.7686 -19.7686 -19.6837 -19.6837 2.1741 2.1741 7.2798 7.2798 9.6427 9.6427 11.2978 11.2978 12.0579 12.0579 13.0179 13.0179 13.0767 13.0767 15.6699 15.6699 16.0380 16.0380 18.0873 18.0873 18.7065 18.7065 k =-0.1506 0.2635 0.3035 ( 1801 PWs) bands (ev): -46.3666 -46.3666 -22.2084 -22.2084 -19.7654 -19.7654 -19.6837 -19.6837 2.0872 2.0872 7.4069 7.4069 9.6050 9.6050 11.3616 11.3616 12.0620 12.0620 12.9941 12.9941 13.1020 13.1020 15.6473 15.6473 16.0338 16.0338 18.1016 18.1016 18.7289 18.7289 k =-0.1454 0.2544 0.2930 ( 1801 PWs) bands (ev): -46.3669 -46.3669 -22.2071 -22.2071 -19.7622 -19.7622 -19.6837 -19.6837 2.0029 2.0029 7.5337 7.5337 9.5624 9.5624 11.4264 11.4264 12.0660 12.0660 12.9397 12.9397 13.1611 13.1611 15.6304 15.6304 16.0365 16.0365 18.1165 18.1165 18.7516 18.7516 k =-0.1402 0.2453 0.2825 ( 1797 PWs) bands (ev): -46.3672 -46.3672 -22.2057 -22.2057 -19.7589 -19.7589 -19.6837 -19.6837 1.9212 1.9212 7.6599 7.6599 9.5164 9.5164 11.4904 11.4904 12.0698 12.0698 12.8840 12.8840 13.2251 13.2251 15.6194 15.6194 16.0467 16.0467 18.1318 18.1318 18.7745 18.7745 k =-0.1350 0.2362 0.2721 ( 1797 PWs) bands (ev): -46.3676 -46.3676 -22.2043 -22.2043 -19.7557 -19.7557 -19.6837 -19.6837 1.8422 1.8422 7.7854 7.7854 9.4680 9.4680 11.5523 11.5523 12.0733 12.0733 12.8290 12.8290 13.2918 13.2918 15.6145 15.6145 16.0652 16.0652 18.1474 18.1474 18.7973 18.7973 k =-0.1298 0.2271 0.2616 ( 1797 PWs) bands (ev): -46.3679 -46.3679 -22.2030 -22.2030 -19.7525 -19.7525 -19.6835 -19.6835 1.7659 1.7659 7.9098 7.9098 9.4181 9.4181 11.6108 11.6108 12.0763 12.0763 12.7753 12.7753 13.3608 13.3608 15.6157 15.6157 16.0924 16.0924 18.1630 18.1630 18.8200 18.8200 k =-0.1247 0.2180 0.2511 ( 1793 PWs) bands (ev): -46.3682 -46.3682 -22.2016 -22.2016 -19.7494 -19.7494 -19.6833 -19.6833 1.6923 1.6923 8.0330 8.0330 9.3675 9.3675 11.6652 11.6652 12.0789 12.0789 12.7230 12.7230 13.4319 13.4319 15.6230 15.6230 16.1286 16.1286 18.1787 18.1787 18.8425 18.8425 k =-0.1195 0.2089 0.2407 ( 1793 PWs) bands (ev): -46.3686 -46.3686 -22.2003 -22.2003 -19.7464 -19.7464 -19.6830 -19.6830 1.6214 1.6214 8.1546 8.1546 9.3167 9.3167 11.7148 11.7148 12.0810 12.0810 12.6724 12.6724 13.5049 13.5049 15.6367 15.6367 16.1741 16.1741 18.1941 18.1941 18.8645 18.8645 k =-0.1143 0.1999 0.2302 ( 1791 PWs) bands (ev): -46.3689 -46.3689 -22.1989 -22.1989 -19.7435 -19.7435 -19.6826 -19.6826 1.5534 1.5534 8.2744 8.2744 9.2663 9.2663 11.7591 11.7591 12.0825 12.0825 12.6235 12.6235 13.5796 13.5796 15.6565 15.6565 16.2290 16.2290 18.2094 18.2094 18.8861 18.8861 k =-0.1091 0.1908 0.2198 ( 1791 PWs) bands (ev): -46.3693 -46.3693 -22.1976 -22.1976 -19.7407 -19.7407 -19.6820 -19.6820 1.4882 1.4882 8.3922 8.3922 9.2165 9.2165 11.7981 11.7981 12.0833 12.0833 12.5764 12.5764 13.6559 13.6559 15.6826 15.6826 16.2930 16.2930 18.2242 18.2242 18.9070 18.9070 k =-0.1039 0.1817 0.2093 ( 1783 PWs) bands (ev): -46.3695 -46.3695 -22.1963 -22.1963 -19.7381 -19.7381 -19.6813 -19.6813 1.4258 1.4258 8.5075 8.5075 9.1677 9.1677 11.8317 11.8317 12.0836 12.0836 12.5313 12.5313 13.7336 13.7336 15.7149 15.7149 16.3659 16.3659 18.2387 18.2387 18.9273 18.9273 k =-0.0987 0.1726 0.1988 ( 1783 PWs) bands (ev): -46.3699 -46.3699 -22.1950 -22.1950 -19.7357 -19.7357 -19.6806 -19.6806 1.3663 1.3663 8.6202 8.6202 9.1202 9.1202 11.8601 11.8601 12.0831 12.0831 12.4882 12.4882 13.8125 13.8125 15.7532 15.7532 16.4473 16.4473 18.2526 18.2526 18.9467 18.9467 k =-0.0935 0.1635 0.1884 ( 1785 PWs) bands (ev): -46.3703 -46.3703 -22.1938 -22.1938 -19.7335 -19.7335 -19.6796 -19.6796 1.3097 1.3097 8.7297 8.7297 9.0742 9.0742 11.8835 11.8835 12.0819 12.0819 12.4473 12.4473 13.8924 13.8924 15.7976 15.7976 16.5364 16.5364 18.2660 18.2660 18.9652 18.9652 k =-0.0883 0.1544 0.1779 ( 1785 PWs) bands (ev): -46.3706 -46.3706 -22.1926 -22.1926 -19.7314 -19.7314 -19.6786 -19.6786 1.2561 1.2561 8.8357 8.8357 9.0302 9.0302 11.9023 11.9023 12.0800 12.0800 12.4086 12.4086 13.9729 13.9729 15.8477 15.8477 16.6325 16.6325 18.2787 18.2787 18.9826 18.9826 k =-0.0831 0.1454 0.1674 ( 1785 PWs) bands (ev): -46.3709 -46.3709 -22.1914 -22.1914 -19.7296 -19.7296 -19.6775 -19.6775 1.2054 1.2054 8.9360 8.9360 8.9901 8.9901 11.9170 11.9170 12.0773 12.0773 12.3722 12.3722 14.0539 14.0539 15.9034 15.9034 16.7348 16.7348 18.2909 18.2909 18.9989 18.9989 k =-0.0779 0.1363 0.1570 ( 1789 PWs) bands (ev): -46.3713 -46.3713 -22.1904 -22.1904 -19.7280 -19.7280 -19.6762 -19.6762 1.1576 1.1576 8.9444 8.9444 9.0398 9.0398 11.9279 11.9279 12.0739 12.0739 12.3382 12.3382 14.1350 14.1350 15.9644 15.9644 16.8422 16.8422 18.3023 18.3023 19.0136 19.0136 k =-0.0727 0.1272 0.1465 ( 1789 PWs) bands (ev): -46.3716 -46.3716 -22.1893 -22.1893 -19.7266 -19.7266 -19.6749 -19.6749 1.1128 1.1128 8.9070 8.9070 9.1331 9.1331 11.9357 11.9357 12.0698 12.0698 12.3068 12.3068 14.2158 14.2158 16.0304 16.0304 16.9537 16.9537 18.3130 18.3130 19.0264 19.0264 k =-0.0675 0.1181 0.1360 ( 1789 PWs) bands (ev): -46.3719 -46.3719 -22.1883 -22.1883 -19.7254 -19.7254 -19.6735 -19.6735 1.0711 1.0711 8.8710 8.8710 9.2224 9.2224 11.9407 11.9407 12.0649 12.0649 12.2780 12.2780 14.2959 14.2959 16.1008 16.1008 17.0680 17.0680 18.3229 18.3229 19.0363 19.0363 k =-0.0623 0.1090 0.1256 ( 1789 PWs) bands (ev): -46.3722 -46.3722 -22.1874 -22.1874 -19.7244 -19.7244 -19.6720 -19.6720 1.0324 1.0324 8.8373 8.8373 9.3069 9.3069 11.9435 11.9435 12.0592 12.0592 12.2519 12.2519 14.3748 14.3748 16.1751 16.1751 17.1838 17.1838 18.3319 18.3319 19.0408 19.0408 k =-0.0571 0.0999 0.1151 ( 1785 PWs) bands (ev): -46.3723 -46.3723 -22.1865 -22.1865 -19.7235 -19.7235 -19.6706 -19.6706 0.9967 0.9967 8.8058 8.8058 9.3861 9.3861 11.9444 11.9444 12.0529 12.0529 12.2286 12.2286 14.4520 14.4520 16.2526 16.2526 17.2997 17.2997 18.3400 18.3400 19.0330 19.0330 k =-0.0519 0.0908 0.1046 ( 1785 PWs) bands (ev): -46.3726 -46.3726 -22.1857 -22.1857 -19.7228 -19.7228 -19.6691 -19.6691 0.9640 0.9640 8.7769 8.7769 9.4596 9.4596 11.9439 11.9439 12.0460 12.0460 12.2081 12.2081 14.5268 14.5268 16.3325 16.3325 17.4143 17.4143 18.3471 18.3471 18.9940 18.9940 k =-0.0467 0.0818 0.0942 ( 1781 PWs) bands (ev): -46.3727 -46.3727 -22.1849 -22.1849 -19.7222 -19.7222 -19.6677 -19.6677 0.9345 0.9345 8.7505 8.7505 9.5272 9.5272 11.9424 11.9424 12.0387 12.0387 12.1904 12.1904 14.5985 14.5985 16.4136 16.4136 17.5257 17.5257 18.3530 18.3530 18.9188 18.9188 k =-0.0416 0.0727 0.0837 ( 1789 PWs) bands (ev): -46.3731 -46.3731 -22.1843 -22.1843 -19.7217 -19.7217 -19.6665 -19.6665 0.9080 0.9080 8.7268 8.7268 9.5884 9.5884 11.9401 11.9401 12.0311 12.0311 12.1753 12.1753 14.6663 14.6663 16.4947 16.4947 17.6323 17.6323 18.3572 18.3572 18.8355 18.8355 k =-0.0364 0.0636 0.0733 ( 1793 PWs) bands (ev): -46.3733 -46.3733 -22.1837 -22.1837 -19.7213 -19.7213 -19.6653 -19.6653 0.8846 0.8846 8.7057 8.7057 9.6432 9.6432 11.9374 11.9374 12.0234 12.0234 12.1628 12.1628 14.7295 14.7295 16.5742 16.5742 17.7322 17.7322 18.3593 18.3593 18.7572 18.7572 k =-0.0312 0.0545 0.0628 ( 1781 PWs) bands (ev): -46.3732 -46.3732 -22.1831 -22.1831 -19.7209 -19.7209 -19.6641 -19.6641 0.8643 0.8643 8.6873 8.6873 9.6911 9.6911 11.9345 11.9345 12.0161 12.0161 12.1526 12.1526 14.7870 14.7870 16.6502 16.6502 17.8235 17.8235 18.3584 18.3584 18.6892 18.6892 k =-0.0260 0.0454 0.0523 ( 1783 PWs) bands (ev): -46.3734 -46.3734 -22.1827 -22.1827 -19.7207 -19.7207 -19.6632 -19.6632 0.8471 0.8471 8.6717 8.6717 9.7321 9.7321 11.9317 11.9317 12.0093 12.0093 12.1444 12.1444 14.8378 14.8378 16.7206 16.7206 17.9044 17.9044 18.3531 18.3531 18.6347 18.6347 k =-0.0208 0.0363 0.0419 ( 1779 PWs) bands (ev): -46.3734 -46.3734 -22.1823 -22.1823 -19.7204 -19.7204 -19.6624 -19.6624 0.8330 0.8330 8.6589 8.6589 9.7659 9.7659 11.9291 11.9291 12.0033 12.0033 12.1381 12.1381 14.8812 14.8812 16.7829 16.7829 17.9731 17.9731 18.3428 18.3428 18.5954 18.5954 k =-0.0156 0.0273 0.0314 ( 1775 PWs) bands (ev): -46.3734 -46.3734 -22.1820 -22.1820 -19.7202 -19.7202 -19.6618 -19.6618 0.8220 0.8220 8.6489 8.6489 9.7923 9.7923 11.9270 11.9270 11.9985 11.9985 12.1334 12.1334 14.9160 14.9160 16.8349 16.8349 18.0284 18.0284 18.3283 18.3283 18.5710 18.5710 k =-0.0104 0.0182 0.0209 ( 1769 PWs) bands (ev): -46.3734 -46.3734 -22.1817 -22.1817 -19.7201 -19.7201 -19.6613 -19.6613 0.8142 0.8142 8.6417 8.6417 9.8113 9.8113 11.9253 11.9253 11.9949 11.9949 12.1301 12.1301 14.9415 14.9415 16.8740 16.8740 18.0693 18.0693 18.3128 18.3128 18.5582 18.5582 k =-0.0052 0.0091 0.0105 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7201 -19.7201 -19.6610 -19.6610 0.8095 0.8095 8.6374 8.6374 9.8227 9.8227 11.9243 11.9243 11.9927 11.9927 12.1282 12.1282 14.9571 14.9571 16.8984 16.8984 18.0947 18.0947 18.3007 18.3007 18.5527 18.5527 k = 0.0000 0.0000 0.0000 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7200 -19.7200 -19.6609 -19.6609 0.8080 0.8080 8.6360 8.6360 9.8265 9.8265 11.9239 11.9239 11.9919 11.9919 12.1276 12.1276 14.9624 14.9624 16.9066 16.9066 18.1034 18.1034 18.2962 18.2962 18.5513 18.5513 k = 0.0000 0.0000 0.0000 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7200 -19.7200 -19.6609 -19.6609 0.8080 0.8080 8.6360 8.6360 9.8265 9.8265 11.9239 11.9239 11.9919 11.9919 12.1276 12.1276 14.9624 14.9624 16.9066 16.9066 18.1034 18.1034 18.2962 18.2962 18.5513 18.5513 k = 0.0128 0.0073-0.0000 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1816 -22.1816 -19.7201 -19.7201 -19.6609 -19.6609 0.8095 0.8095 8.6128 8.6128 9.8508 9.8508 11.9235 11.9235 11.9932 11.9932 12.1289 12.1289 14.9625 14.9625 16.8849 16.8849 18.1241 18.1241 18.2747 18.2747 18.5256 18.5256 k = 0.0256 0.0147-0.0000 ( 1777 PWs) bands (ev): -46.3736 -46.3736 -22.1817 -22.1817 -19.7202 -19.7202 -19.6609 -19.6609 0.8142 0.8142 8.5482 8.5482 9.9188 9.9188 11.9222 11.9222 11.9972 11.9972 12.1327 12.1327 14.9627 14.9627 16.8242 16.8242 18.1656 18.1656 18.2330 18.2330 18.4574 18.4574 k = 0.0385 0.0220-0.0000 ( 1777 PWs) bands (ev): -46.3736 -46.3736 -22.1817 -22.1817 -19.7203 -19.7203 -19.6609 -19.6609 0.8219 0.8219 8.4529 8.4529 10.0194 10.0194 11.9200 11.9200 12.0037 12.0037 12.1391 12.1391 14.9631 14.9631 16.7348 16.7348 18.1088 18.1088 18.2936 18.2936 18.3628 18.3628 k = 0.0513 0.0293-0.0000 ( 1781 PWs) bands (ev): -46.3737 -46.3737 -22.1818 -22.1818 -19.7205 -19.7205 -19.6610 -19.6610 0.8328 0.8328 8.3375 8.3375 10.1424 10.1424 11.9169 11.9169 12.0128 12.0128 12.1481 12.1481 14.9637 14.9637 16.6268 16.6268 18.0075 18.0075 18.2533 18.2533 18.4027 18.4027 k = 0.0641 0.0366-0.0000 ( 1781 PWs) bands (ev): -46.3736 -46.3736 -22.1819 -22.1819 -19.7207 -19.7207 -19.6610 -19.6610 0.8467 0.8467 8.2093 8.2093 10.2800 10.2800 11.9129 11.9129 12.0245 12.0245 12.1597 12.1597 14.9645 14.9645 16.5079 16.5079 17.8947 17.8947 18.1356 18.1356 18.5259 18.5259 k = 0.0769 0.0440-0.0000 ( 1781 PWs) bands (ev): -46.3736 -46.3736 -22.1819 -22.1819 -19.7209 -19.7209 -19.6610 -19.6610 0.8637 0.8637 8.0733 8.0733 10.4273 10.4273 11.9081 11.9081 12.0389 12.0389 12.1740 12.1740 14.9654 14.9654 16.3832 16.3832 17.7759 17.7759 18.0128 18.0128 18.6561 18.6561 k = 0.0897 0.0513-0.0000 ( 1781 PWs) bands (ev): -46.3736 -46.3736 -22.1820 -22.1820 -19.7212 -19.7212 -19.6611 -19.6611 0.8837 0.8837 7.9324 7.9324 10.5809 10.5809 11.9024 11.9024 12.0558 12.0558 12.1909 12.1909 14.9664 14.9664 16.2565 16.2565 17.6533 17.6533 17.8871 17.8871 18.7891 18.7891 k = 0.1026 0.0586-0.0000 ( 1789 PWs) bands (ev): -46.3738 -46.3738 -22.1822 -22.1822 -19.7215 -19.7215 -19.6612 -19.6612 0.9067 0.9067 7.7886 7.7886 10.7387 10.7387 11.8959 11.8959 12.0753 12.0753 12.2105 12.2105 14.9676 14.9676 16.1302 16.1302 17.5284 17.5284 17.7595 17.7595 18.9220 18.9220 k = 0.1154 0.0660-0.0000 ( 1797 PWs) bands (ev): -46.3739 -46.3739 -22.1824 -22.1824 -19.7219 -19.7219 -19.6613 -19.6613 0.9327 0.9327 7.6432 7.6432 10.8991 10.8991 11.8886 11.8886 12.0974 12.0974 12.2327 12.2327 14.9690 14.9690 16.0063 16.0063 17.4020 17.4020 17.6306 17.6306 19.0526 19.0526 k = 0.1282 0.0733-0.0000 ( 1785 PWs) bands (ev): -46.3737 -46.3737 -22.1825 -22.1825 -19.7222 -19.7222 -19.6613 -19.6613 0.9616 0.9616 7.4970 7.4970 11.0607 11.0607 11.8806 11.8806 12.1221 12.1221 12.2577 12.2577 14.9704 14.9704 15.8863 15.8863 17.2748 17.2748 17.5011 17.5011 19.1791 19.1791 k = 0.1410 0.0806-0.0000 ( 1777 PWs) bands (ev): -46.3735 -46.3735 -22.1826 -22.1826 -19.7226 -19.7226 -19.6613 -19.6613 0.9934 0.9934 7.3507 7.3507 11.2225 11.2225 11.8719 11.8719 12.1493 12.1493 12.2852 12.2852 14.9720 14.9720 15.7715 15.7715 17.1471 17.1471 17.3712 17.3712 19.3001 19.3001 k = 0.1538 0.0880-0.0000 ( 1777 PWs) bands (ev): -46.3735 -46.3735 -22.1827 -22.1827 -19.7230 -19.7230 -19.6613 -19.6613 1.0281 1.0281 7.2047 7.2047 11.3832 11.3832 11.8627 11.8627 12.1791 12.1791 12.3155 12.3155 14.9737 14.9737 15.6634 15.6634 17.0191 17.0191 17.2412 17.2412 19.4144 19.4144 k = 0.1667 0.0953-0.0000 ( 1777 PWs) bands (ev): -46.3735 -46.3735 -22.1829 -22.1829 -19.7235 -19.7235 -19.6614 -19.6614 1.0656 1.0656 7.0593 7.0593 11.5418 11.5418 11.8529 11.8529 12.2115 12.2115 12.3484 12.3484 14.9755 14.9755 15.5631 15.5631 16.8912 16.8912 17.1112 17.1112 19.5208 19.5208 k = 0.1795 0.1026-0.0000 ( 1773 PWs) bands (ev): -46.3735 -46.3735 -22.1831 -22.1831 -19.7239 -19.7239 -19.6614 -19.6614 1.1058 1.1058 6.9148 6.9148 11.6970 11.6970 11.8427 11.8427 12.2464 12.2464 12.3839 12.3839 14.9774 14.9774 15.4722 15.4722 16.7635 16.7635 16.9815 16.9815 19.6185 19.6185 k = 0.1923 0.1099-0.0000 ( 1773 PWs) bands (ev): -46.3734 -46.3734 -22.1833 -22.1833 -19.7244 -19.7244 -19.6615 -19.6615 1.1486 1.1486 6.7715 6.7715 11.8322 11.8322 11.8475 11.8475 12.2838 12.2838 12.4220 12.4220 14.9793 14.9793 15.3921 15.3921 16.6361 16.6361 16.8522 16.8522 19.7065 19.7065 k = 0.2051 0.1173-0.0000 ( 1769 PWs) bands (ev): -46.3734 -46.3734 -22.1834 -22.1834 -19.7249 -19.7249 -19.6615 -19.6615 1.1941 1.1941 6.6294 6.6294 11.8213 11.8213 11.9917 11.9917 12.3237 12.3237 12.4628 12.4628 14.9813 14.9813 15.3244 15.3244 16.5092 16.5092 16.7234 16.7234 19.7844 19.7844 k = 0.2179 0.1246-0.0000 ( 1777 PWs) bands (ev): -46.3735 -46.3735 -22.1837 -22.1837 -19.7255 -19.7255 -19.6616 -19.6616 1.2420 1.2420 6.4887 6.4887 11.8103 11.8103 12.1278 12.1278 12.3661 12.3661 12.5061 12.5061 14.9834 14.9834 15.2712 15.2712 16.3829 16.3829 16.5952 16.5952 19.8514 19.8514 k = 0.2308 0.1319-0.0000 ( 1777 PWs) bands (ev): -46.3735 -46.3735 -22.1839 -22.1839 -19.7260 -19.7260 -19.6617 -19.6617 1.2924 1.2924 6.3497 6.3497 11.7992 11.7992 12.2539 12.2539 12.4110 12.4110 12.5520 12.5520 14.9854 14.9854 15.2341 15.2341 16.2573 16.2573 16.4677 16.4677 19.9072 19.9072 k = 0.2436 0.1393-0.0000 ( 1785 PWs) bands (ev): -46.3736 -46.3736 -22.1841 -22.1841 -19.7267 -19.7267 -19.6618 -19.6618 1.3450 1.3450 6.2124 6.2124 11.7880 11.7880 12.3682 12.3682 12.4584 12.4584 12.6005 12.6005 14.9875 14.9875 15.2153 15.2153 16.1325 16.1325 16.3410 16.3410 19.9515 19.9515 k = 0.2564 0.1466-0.0000 ( 1785 PWs) bands (ev): -46.3736 -46.3736 -22.1843 -22.1843 -19.7272 -19.7272 -19.6619 -19.6619 1.3997 1.3997 6.0771 6.0771 11.7768 11.7768 12.4686 12.4686 12.5083 12.5083 12.6515 12.6515 14.9895 14.9895 15.2165 15.2165 16.0086 16.0086 16.2152 16.2152 19.9838 19.9838 k = 0.2692 0.1539-0.0000 ( 1793 PWs) bands (ev): -46.3737 -46.3737 -22.1846 -22.1846 -19.7278 -19.7278 -19.6620 -19.6620 1.4565 1.4565 5.9439 5.9439 11.7657 11.7657 12.5512 12.5512 12.5635 12.5635 12.7051 12.7051 14.9916 14.9916 15.2391 15.2391 15.8857 15.8857 16.0904 16.0904 20.0040 20.0040 k = 0.2821 0.1613-0.0000 ( 1793 PWs) bands (ev): -46.3737 -46.3737 -22.1848 -22.1848 -19.7284 -19.7284 -19.6620 -19.6620 1.5151 1.5151 5.8130 5.8130 11.7548 11.7548 12.6096 12.6096 12.6295 12.6295 12.7611 12.7611 14.9935 14.9935 15.2836 15.2836 15.7639 15.7639 15.9667 15.9667 20.0119 20.0119 k = 0.2949 0.1686-0.0000 ( 1794 PWs) bands (ev): -46.3737 -46.3737 -22.1850 -22.1850 -19.7289 -19.7289 -19.6621 -19.6621 1.5753 1.5753 5.6845 5.6845 11.7442 11.7442 12.6617 12.6617 12.6884 12.6884 12.8196 12.8196 14.9954 14.9954 15.3498 15.3498 15.6434 15.6434 15.8442 15.8442 20.0072 20.0072 k = 0.3077 0.1759-0.0000 ( 1794 PWs) bands (ev): -46.3737 -46.3737 -22.1852 -22.1852 -19.7294 -19.7294 -19.6622 -19.6622 1.6369 1.6369 5.5588 5.5588 11.7338 11.7338 12.7052 12.7052 12.7435 12.7435 12.8806 12.8806 14.9971 14.9971 15.4350 15.4350 15.5261 15.5261 15.7229 15.7229 19.9898 19.9898 k = 0.3205 0.1832-0.0000 ( 1794 PWs) bands (ev): -46.3737 -46.3737 -22.1854 -22.1854 -19.7299 -19.7299 -19.6622 -19.6622 1.6996 1.6996 5.4362 5.4362 11.7239 11.7239 12.7341 12.7341 12.8022 12.8022 12.9440 12.9440 14.9987 14.9987 15.4024 15.4024 15.5470 15.5470 15.6030 15.6030 19.9594 19.9594 k = 0.3333 0.1906-0.0000 ( 1794 PWs) bands (ev): -46.3737 -46.3737 -22.1856 -22.1856 -19.7304 -19.7304 -19.6623 -19.6623 1.7631 1.7631 5.3168 5.3168 11.7143 11.7143 12.7499 12.7499 12.8651 12.8651 13.0099 13.0099 14.9999 14.9999 15.2865 15.2865 15.4847 15.4847 15.6693 15.6693 19.9161 19.9161 k = 0.3462 0.1979-0.0000 ( 1794 PWs) bands (ev): -46.3737 -46.3737 -22.1858 -22.1858 -19.7308 -19.7308 -19.6624 -19.6624 1.8271 1.8271 5.2012 5.2012 11.7053 11.7053 12.7557 12.7557 12.9311 12.9311 13.0781 13.0781 15.0006 15.0006 15.1711 15.1711 15.3683 15.3683 15.8070 15.8070 19.8598 19.8598 k = 0.3590 0.2052-0.0000 ( 1790 PWs) bands (ev): -46.3736 -46.3736 -22.1859 -22.1859 -19.7312 -19.7312 -19.6624 -19.6624 1.8910 1.8910 5.0897 5.0897 11.6968 11.6968 12.7542 12.7542 12.9998 12.9998 13.1487 13.1487 15.0000 15.0000 15.0570 15.0570 15.2544 15.2544 15.9567 15.9567 19.7907 19.7907 k = 0.3718 0.2126-0.0000 ( 1802 PWs) bands (ev): -46.3738 -46.3738 -22.1861 -22.1861 -19.7317 -19.7317 -19.6625 -19.6625 1.9544 1.9544 4.9829 4.9829 11.6888 11.6888 12.7474 12.7474 13.0709 13.0709 13.2217 13.2217 14.9443 14.9443 14.9958 14.9958 15.1455 15.1455 16.1161 16.1161 19.7092 19.7092 k = 0.3846 0.2199-0.0000 ( 1802 PWs) bands (ev): -46.3738 -46.3738 -22.1863 -22.1863 -19.7321 -19.7321 -19.6626 -19.6626 2.0167 2.0167 4.8815 4.8815 11.6815 11.6815 12.7371 12.7371 13.1445 13.1445 13.2969 13.2969 14.8332 14.8332 14.9723 14.9723 15.0575 15.0575 16.2825 16.2825 19.6158 19.6158 k = 0.3974 0.2272-0.0000 ( 1798 PWs) bands (ev): -46.3737 -46.3737 -22.1864 -22.1864 -19.7324 -19.7324 -19.6626 -19.6626 2.0770 2.0770 4.7860 4.7860 11.6748 11.6748 12.7247 12.7247 13.2203 13.2203 13.3745 13.3745 14.7236 14.7236 14.8926 14.8926 15.0270 15.0270 16.4539 16.4539 19.5116 19.5116 k = 0.4103 0.2346-0.0000 ( 1798 PWs) bands (ev): -46.3737 -46.3737 -22.1865 -22.1865 -19.7327 -19.7327 -19.6627 -19.6627 2.1345 2.1345 4.6976 4.6976 11.6689 11.6689 12.7116 12.7116 13.2985 13.2985 13.4543 13.4543 14.6158 14.6158 14.7898 14.7898 15.0213 15.0213 16.6277 16.6277 19.3978 19.3978 k = 0.4231 0.2419-0.0000 ( 1798 PWs) bands (ev): -46.3737 -46.3737 -22.1866 -22.1866 -19.7330 -19.7330 -19.6627 -19.6627 2.1882 2.1882 4.6170 4.6170 11.6637 11.6637 12.6985 12.6985 13.3788 13.3788 13.5362 13.5362 14.5096 14.5096 14.6843 14.6843 15.0199 15.0199 16.8015 16.8015 19.2765 19.2765 k = 0.4359 0.2492-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1868 -22.1868 -19.7333 -19.7333 -19.6628 -19.6628 2.2368 2.2368 4.5456 4.5456 11.6592 11.6592 12.6864 12.6864 13.4612 13.4612 13.6204 13.6204 14.4053 14.4053 14.5793 14.5793 15.0196 15.0196 16.9721 16.9721 19.1503 19.1503 k = 0.4487 0.2565-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1869 -22.1869 -19.7335 -19.7335 -19.6628 -19.6628 2.2793 2.2793 4.4846 4.4846 11.6555 11.6555 12.6757 12.6757 13.5457 13.5457 13.7066 13.7066 14.3029 14.3029 14.4758 14.4758 15.0197 15.0197 17.1352 17.1352 19.0236 19.0236 k = 0.4615 0.2639-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1869 -22.1869 -19.7336 -19.7336 -19.6628 -19.6628 2.3141 2.3141 4.4353 4.4353 11.6526 11.6526 12.6670 12.6670 13.6320 13.6320 13.7947 13.7947 14.2027 14.2027 14.3740 14.3740 15.0199 15.0199 17.2845 17.2845 18.9024 18.9024 k = 0.4744 0.2712-0.0000 ( 1814 PWs) bands (ev): -46.3740 -46.3740 -22.1870 -22.1870 -19.7338 -19.7338 -19.6628 -19.6628 2.3401 2.3401 4.3990 4.3990 11.6506 11.6506 12.6605 12.6605 13.7197 13.7197 13.8843 13.8843 14.1050 14.1050 14.2746 14.2746 15.0201 15.0201 17.4100 17.4100 18.7970 18.7970 k = 0.4872 0.2785-0.0000 ( 1814 PWs) bands (ev): -46.3740 -46.3740 -22.1870 -22.1870 -19.7339 -19.7339 -19.6629 -19.6629 2.3562 2.3562 4.3767 4.3767 11.6493 11.6493 12.6565 12.6565 13.8070 13.8070 13.9738 13.9738 14.0117 14.0117 14.1791 14.1791 15.0202 15.0202 17.4970 17.4970 18.7219 18.7219 k = 0.5000 0.2859-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1870 -22.1870 -19.7339 -19.7339 -19.6628 -19.6628 2.3617 2.3617 4.3692 4.3692 11.6489 11.6489 12.6552 12.6552 13.8683 13.8683 13.9484 13.9484 14.0388 14.0388 14.1122 14.1122 15.0202 15.0202 17.5287 17.5287 18.6942 18.6942 k = 0.5000 0.2859-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1870 -22.1870 -19.7339 -19.7339 -19.6628 -19.6628 2.3617 2.3617 4.3692 4.3692 11.6489 11.6489 12.6552 12.6552 13.8683 13.8683 13.9484 13.9484 14.0388 14.0388 14.1122 14.1122 15.0202 15.0202 17.5287 17.5287 18.6942 18.6942 k = 0.4948 0.2950 0.0105 ( 1812 PWs) bands (ev): -46.3739 -46.3739 -22.1870 -22.1870 -19.7339 -19.7339 -19.6629 -19.6629 2.3629 2.3629 4.3707 4.3707 11.6466 11.6466 12.6478 12.6478 13.8659 13.8659 13.9479 13.9479 14.0381 14.0381 14.1098 14.1098 15.0264 15.0264 17.5370 17.5370 18.6975 18.6975 k = 0.4895 0.3042 0.0211 ( 1812 PWs) bands (ev): -46.3739 -46.3739 -22.1872 -22.1872 -19.7339 -19.7339 -19.6632 -19.6632 2.3666 2.3666 4.3754 4.3754 11.6394 11.6394 12.6260 12.6260 13.8584 13.8584 13.9459 13.9459 14.0361 14.0361 14.1033 14.1033 15.0445 15.0445 17.5616 17.5616 18.7075 18.7075 k = 0.4843 0.3133 0.0316 ( 1812 PWs) bands (ev): -46.3738 -46.3738 -22.1874 -22.1874 -19.7340 -19.7340 -19.6637 -19.6637 2.3727 2.3727 4.3831 4.3831 11.6266 11.6266 12.5916 12.5916 13.8454 13.8454 13.9406 13.9406 14.0334 14.0334 14.0955 14.0955 15.0736 15.0736 17.6016 17.6016 18.7241 18.7241 k = 0.4791 0.3224 0.0421 ( 1814 PWs) bands (ev): -46.3738 -46.3738 -22.1876 -22.1876 -19.7341 -19.7341 -19.6643 -19.6643 2.3812 2.3812 4.3938 4.3938 11.6068 11.6068 12.5472 12.5472 13.8264 13.8264 13.9299 13.9299 14.0309 14.0309 14.0897 14.0897 15.1121 15.1121 17.6556 17.6556 18.7470 18.7470 k = 0.4739 0.3316 0.0527 ( 1813 PWs) bands (ev): -46.3737 -46.3737 -22.1880 -22.1880 -19.7342 -19.7342 -19.6651 -19.6651 2.3922 2.3922 4.4076 4.4076 11.5779 11.5779 12.4962 12.4962 13.8007 13.8007 13.9125 13.9125 14.0295 14.0295 14.0885 14.0885 15.1588 15.1588 17.7219 17.7219 18.7762 18.7762 k = 0.4686 0.3407 0.0632 ( 1817 PWs) bands (ev): -46.3736 -46.3736 -22.1884 -22.1884 -19.7344 -19.7344 -19.6661 -19.6661 2.4057 2.4057 4.4244 4.4244 11.5377 11.5377 12.4430 12.4430 13.7682 13.7682 13.8885 13.8885 14.0300 14.0300 14.0928 14.0928 15.2121 15.2121 17.7987 17.7987 18.8114 18.8114 k = 0.4634 0.3499 0.0737 ( 1817 PWs) bands (ev): -46.3734 -46.3734 -22.1889 -22.1889 -19.7346 -19.7346 -19.6672 -19.6672 2.4216 2.4216 4.4441 4.4441 11.4835 11.4835 12.3917 12.3917 13.7293 13.7293 13.8591 13.8591 14.0326 14.0326 14.1021 14.1021 15.2709 15.2709 17.8838 17.8838 18.8523 18.8523 k = 0.4582 0.3590 0.0843 ( 1813 PWs) bands (ev): -46.3732 -46.3732 -22.1894 -22.1894 -19.7349 -19.7349 -19.6684 -19.6684 2.4399 2.4399 4.4668 4.4668 11.4133 11.4133 12.3463 12.3463 13.6851 13.6851 13.8251 13.8251 14.0373 14.0373 14.1158 14.1158 15.3344 15.3344 17.9754 17.9754 18.8987 18.8987 k = 0.4529 0.3682 0.0948 ( 1813 PWs) bands (ev): -46.3730 -46.3730 -22.1901 -22.1901 -19.7352 -19.7352 -19.6698 -19.6698 2.4607 2.4607 4.4922 4.4922 11.3262 11.3262 12.3091 12.3091 13.6367 13.6367 13.7874 13.7874 14.0440 14.0440 14.1331 14.1331 15.4017 15.4017 18.0715 18.0715 18.9501 18.9501 k = 0.4477 0.3773 0.1053 ( 1817 PWs) bands (ev): -46.3729 -46.3729 -22.1908 -22.1908 -19.7357 -19.7357 -19.6712 -19.6712 2.4839 2.4839 4.5205 4.5205 11.2226 11.2226 12.2813 12.2813 13.5853 13.5853 13.7463 13.7463 14.0525 14.0525 14.1537 14.1537 15.4724 15.4724 18.1704 18.1704 19.0064 19.0064 k = 0.4425 0.3865 0.1159 ( 1815 PWs) bands (ev): -46.3726 -46.3726 -22.1915 -22.1915 -19.7362 -19.7362 -19.6727 -19.6727 2.5096 2.5096 4.5514 4.5514 11.1042 11.1042 12.2625 12.2625 13.5318 13.5318 13.7021 13.7021 14.0626 14.0626 14.1774 14.1774 15.5460 15.5460 18.2708 18.2708 19.0670 19.0670 k = 0.4373 0.3956 0.1264 ( 1815 PWs) bands (ev): -46.3723 -46.3723 -22.1923 -22.1923 -19.7368 -19.7368 -19.6742 -19.6742 2.5377 2.5377 4.5849 4.5849 10.9732 10.9732 12.2517 12.2517 13.4769 13.4769 13.6554 13.6554 14.0740 14.0740 14.2041 14.2041 15.6221 15.6221 18.3714 18.3714 19.1318 19.1318 k = 0.4320 0.4048 0.1369 ( 1815 PWs) bands (ev): -46.3721 -46.3721 -22.1932 -22.1932 -19.7376 -19.7376 -19.6757 -19.6757 2.5682 2.5682 4.6209 4.6209 10.8319 10.8319 12.2473 12.2473 13.4211 13.4211 13.6063 13.6063 14.0866 14.0866 14.2336 14.2336 15.7007 15.7007 18.4711 18.4711 19.2004 19.2004 k = 0.4268 0.4139 0.1475 ( 1813 PWs) bands (ev): -46.3718 -46.3718 -22.1941 -22.1941 -19.7385 -19.7385 -19.6772 -19.6772 2.6011 2.6011 4.6592 4.6592 10.6826 10.6826 12.2481 12.2481 13.3650 13.3650 13.5553 13.5553 14.1002 14.1002 14.2660 14.2660 15.7813 15.7813 18.5691 18.5691 19.2724 19.2724 k = 0.4216 0.4230 0.1580 ( 1813 PWs) bands (ev): -46.3715 -46.3715 -22.1951 -22.1951 -19.7396 -19.7396 -19.6787 -19.6787 2.6365 2.6365 4.6997 4.6997 10.5273 10.5273 12.2528 12.2528 13.3090 13.3090 13.5027 13.5027 14.1146 14.1146 14.3013 14.3013 15.8641 15.8641 18.6650 18.6650 19.3475 19.3475 k = 0.4163 0.4322 0.1685 ( 1809 PWs) bands (ev): -46.3711 -46.3711 -22.1961 -22.1961 -19.7408 -19.7408 -19.6801 -19.6801 2.6743 2.6743 4.7422 4.7422 10.3675 10.3675 12.2605 12.2605 13.2531 13.2531 13.4487 13.4487 14.1298 14.1298 14.3395 14.3395 15.9487 15.9487 18.7581 18.7581 19.4254 19.4254 k = 0.4111 0.4413 0.1791 ( 1809 PWs) bands (ev): -46.3708 -46.3708 -22.1972 -22.1972 -19.7422 -19.7422 -19.6814 -19.6814 2.7145 2.7145 4.7866 4.7866 10.2048 10.2048 12.2701 12.2701 13.1978 13.1978 13.3937 13.3937 14.1456 14.1456 14.3805 14.3805 16.0352 16.0352 18.8482 18.8482 19.5057 19.5057 k = 0.4059 0.4505 0.1896 ( 1805 PWs) bands (ev): -46.3703 -46.3703 -22.1982 -22.1982 -19.7438 -19.7438 -19.6826 -19.6826 2.7571 2.7571 4.8325 4.8325 10.0402 10.0402 12.2811 12.2811 13.1433 13.1433 13.3381 13.3381 14.1619 14.1619 14.4244 14.4244 16.1235 16.1235 18.9350 18.9350 19.5881 19.5881 k = 0.4007 0.4596 0.2002 ( 1805 PWs) bands (ev): -46.3700 -46.3700 -22.1994 -22.1994 -19.7456 -19.7456 -19.6837 -19.6837 2.8021 2.8021 4.8798 4.8798 9.8749 9.8749 12.2928 12.2928 13.0896 13.0896 13.2819 13.2819 14.1785 14.1785 14.4712 14.4712 16.2137 16.2137 19.0183 19.0183 19.6721 19.6721 k = 0.3954 0.4688 0.2107 ( 1807 PWs) bands (ev): -46.3697 -46.3697 -22.2006 -22.2006 -19.7476 -19.7476 -19.6846 -19.6846 2.8496 2.8496 4.9281 4.9281 9.7098 9.7098 12.3046 12.3046 13.0370 13.0370 13.2256 13.2256 14.1954 14.1954 14.5207 14.5207 16.3056 16.3056 19.0977 19.0977 19.7571 19.7571 k = 0.3902 0.4779 0.2212 ( 1815 PWs) bands (ev): -46.3695 -46.3695 -22.2018 -22.2018 -19.7498 -19.7498 -19.6855 -19.6855 2.8994 2.8994 4.9771 4.9771 9.5458 9.5458 12.3161 12.3161 12.9855 12.9855 13.1693 13.1693 14.2124 14.2124 14.5730 14.5730 16.3992 16.3992 19.1728 19.1728 19.8420 19.8420 k = 0.3850 0.4871 0.2318 ( 1815 PWs) bands (ev): -46.3691 -46.3691 -22.2030 -22.2030 -19.7521 -19.7521 -19.6861 -19.6861 2.9516 2.9516 5.0263 5.0263 9.3837 9.3837 12.3268 12.3268 12.9354 12.9354 13.1134 13.1134 14.2294 14.2294 14.6281 14.6281 16.4947 16.4947 19.2424 19.2424 19.9247 19.9247 k = 0.3797 0.4962 0.2423 ( 1815 PWs) bands (ev): -46.3687 -46.3687 -22.2042 -22.2042 -19.7545 -19.7545 -19.6867 -19.6867 3.0062 3.0062 5.0753 5.0753 9.2245 9.2245 12.3362 12.3362 12.8866 12.8866 13.0579 13.0579 14.2462 14.2462 14.6857 14.6857 16.5919 16.5919 19.3042 19.3042 19.9908 19.9908 k = 0.3745 0.5053 0.2528 ( 1813 PWs) bands (ev): -46.3683 -46.3683 -22.2055 -22.2055 -19.7571 -19.7571 -19.6871 -19.6871 3.0631 3.0631 5.1234 5.1234 9.0691 9.0691 12.3440 12.3440 12.8393 12.8393 13.0031 13.0031 14.2627 14.2627 14.7459 14.7459 16.6910 16.6910 19.3530 19.3530 19.8820 19.8820 k = 0.3693 0.5145 0.2634 ( 1813 PWs) bands (ev): -46.3680 -46.3680 -22.2067 -22.2067 -19.7598 -19.7598 -19.6873 -19.6873 3.1225 3.1225 5.1700 5.1700 8.9183 8.9183 12.3499 12.3499 12.7935 12.7935 12.9493 12.9493 14.2788 14.2788 14.8085 14.8085 16.7918 16.7918 19.3779 19.3779 19.7976 19.7976 k = 0.3641 0.5236 0.2739 ( 1805 PWs) bands (ev): -46.3675 -46.3675 -22.2079 -22.2079 -19.7626 -19.7626 -19.6874 -19.6874 3.1842 3.1842 5.2142 5.2142 8.7732 8.7732 12.3535 12.3535 12.7493 12.7493 12.8965 12.8965 14.2943 14.2943 14.8733 14.8733 16.8945 16.8945 19.3625 19.3625 19.7560 19.7560 k = 0.3588 0.5328 0.2844 ( 1809 PWs) bands (ev): -46.3672 -46.3672 -22.2091 -22.2091 -19.7654 -19.7654 -19.6875 -19.6875 3.2482 3.2482 5.2552 5.2552 8.6349 8.6349 12.3546 12.3546 12.7068 12.7068 12.8450 12.8450 14.3090 14.3090 14.9401 14.9401 16.9991 16.9991 19.3046 19.3046 19.7553 19.7553 k = 0.3536 0.5419 0.2950 ( 1813 PWs) bands (ev): -46.3669 -46.3669 -22.2104 -22.2104 -19.7683 -19.7683 -19.6875 -19.6875 3.3146 3.3146 5.2916 5.2916 8.5047 8.5047 12.3527 12.3527 12.6659 12.6659 12.7951 12.7951 14.3228 14.3228 15.0087 15.0087 17.1055 17.1055 19.2219 19.2219 19.6600 19.6600 k = 0.3484 0.5511 0.3055 ( 1817 PWs) bands (ev): -46.3666 -46.3666 -22.2116 -22.2116 -19.7712 -19.7712 -19.6875 -19.6875 3.3833 3.3833 5.3224 5.3224 8.3839 8.3839 12.3478 12.3478 12.6266 12.6266 12.7468 12.7468 14.3353 14.3353 15.0790 15.0790 17.2138 17.2138 19.1303 19.1303 19.5103 19.5103 k = 0.3431 0.5602 0.3160 ( 1825 PWs) bands (ev): -46.3664 -46.3664 -22.2128 -22.2128 -19.7741 -19.7741 -19.6874 -19.6874 3.4543 3.4543 5.3462 5.3462 8.2741 8.2741 12.3396 12.3396 12.5888 12.5888 12.7005 12.7005 14.3465 14.3465 15.1504 15.1504 17.3240 17.3240 19.0373 19.0373 19.3584 19.3584 k = 0.3379 0.5694 0.3266 ( 1821 PWs) bands (ev): -46.3660 -46.3660 -22.2139 -22.2139 -19.7769 -19.7769 -19.6871 -19.6871 3.5276 3.5276 5.3613 5.3613 8.1767 8.1767 12.3279 12.3279 12.5525 12.5525 12.6564 12.6564 14.3561 14.3561 15.2229 15.2229 17.4361 17.4361 18.9464 18.9464 19.2069 19.2069 k = 0.3327 0.5785 0.3371 ( 1829 PWs) bands (ev): -46.3658 -46.3658 -22.2151 -22.2151 -19.7796 -19.7796 -19.6869 -19.6869 3.6033 3.6033 5.3665 5.3665 8.0933 8.0933 12.3126 12.3126 12.5175 12.5175 12.6147 12.6147 14.3639 14.3639 15.2959 15.2959 17.5502 17.5502 18.8588 18.8588 19.0573 19.0573 k = 0.3275 0.5877 0.3476 ( 1829 PWs) bands (ev): -46.3655 -46.3655 -22.2161 -22.2161 -19.7823 -19.7823 -19.6866 -19.6866 3.6811 3.6811 5.3604 5.3604 8.0252 8.0252 12.2936 12.2936 12.4835 12.4835 12.5758 12.5758 14.3698 14.3698 15.3692 15.3692 17.6661 17.6661 18.7742 18.7742 18.9111 18.9111 k = 0.3222 0.5968 0.3582 ( 1829 PWs) bands (ev): -46.3652 -46.3652 -22.2171 -22.2171 -19.7849 -19.7849 -19.6863 -19.6863 3.7613 3.7613 5.3419 5.3419 7.9735 7.9735 12.2708 12.2708 12.4504 12.4504 12.5401 12.5401 14.3733 14.3733 15.4423 15.4423 17.7841 17.7841 18.6881 18.6881 18.7738 18.7738 k = 0.3170 0.6059 0.3687 ( 1829 PWs) bands (ev): -46.3649 -46.3649 -22.2181 -22.2181 -19.7873 -19.7873 -19.6860 -19.6860 3.8436 3.8436 5.3104 5.3104 7.9389 7.9389 12.2442 12.2442 12.4181 12.4181 12.5077 12.5077 14.3745 14.3745 15.5147 15.5147 17.9039 17.9039 18.5819 18.5819 18.6642 18.6642 k = 0.3118 0.6151 0.3792 ( 1819 PWs) bands (ev): -46.3645 -46.3645 -22.2189 -22.2189 -19.7895 -19.7895 -19.6856 -19.6856 3.9282 3.9282 5.2659 5.2659 7.9213 7.9213 12.2138 12.2138 12.3863 12.3863 12.4789 12.4789 14.3730 14.3730 15.5861 15.5861 18.0257 18.0257 18.4509 18.4509 18.5875 18.5875 k = 0.3065 0.6242 0.3898 ( 1817 PWs) bands (ev): -46.3642 -46.3642 -22.2198 -22.2198 -19.7917 -19.7917 -19.6853 -19.6853 4.0150 4.0150 5.2087 5.2087 7.9203 7.9203 12.1797 12.1797 12.3552 12.3552 12.4537 12.4537 14.3686 14.3686 15.6560 15.6560 18.1493 18.1493 18.3138 18.3138 18.5248 18.5248 k = 0.3013 0.6334 0.4003 ( 1817 PWs) bands (ev): -46.3640 -46.3640 -22.2206 -22.2206 -19.7937 -19.7937 -19.6849 -19.6849 4.1040 4.1040 5.1399 5.1399 7.9350 7.9350 12.1418 12.1418 12.3248 12.3248 12.4322 12.4322 14.3612 14.3612 15.7238 15.7238 18.1759 18.1759 18.2758 18.2758 18.4699 18.4699 k = 0.2961 0.6425 0.4108 ( 1817 PWs) bands (ev): -46.3638 -46.3638 -22.2213 -22.2213 -19.7955 -19.7955 -19.6846 -19.6846 4.1951 4.1951 5.0605 5.0605 7.9641 7.9641 12.1004 12.1004 12.2954 12.2954 12.4141 12.4141 14.3506 14.3506 15.7893 15.7893 18.0410 18.0410 18.4023 18.4023 18.4216 18.4216 k = 0.2909 0.6517 0.4214 ( 1819 PWs) bands (ev): -46.3636 -46.3636 -22.2219 -22.2219 -19.7972 -19.7972 -19.6843 -19.6843 4.2883 4.2883 4.9721 4.9721 8.0062 8.0062 12.0555 12.0555 12.2671 12.2671 12.3994 12.3994 14.3366 14.3366 15.8517 15.8517 17.9080 17.9080 18.3767 18.3767 18.5326 18.5326 k = 0.2909 0.6517 0.4214 ( 1819 PWs) bands (ev): -46.3636 -46.3636 -22.2219 -22.2219 -19.7972 -19.7972 -19.6843 -19.6843 4.2883 4.2883 4.9721 4.9721 8.0062 8.0062 12.0555 12.0555 12.2671 12.2671 12.3994 12.3994 14.3366 14.3366 15.8517 15.8517 17.9080 17.9080 18.3767 18.3767 18.5326 18.5326 k = 0.2770 0.6483 0.4253 ( 1817 PWs) bands (ev): -46.3635 -46.3635 -22.2221 -22.2221 -19.7977 -19.7977 -19.6842 -19.6842 4.3207 4.3207 4.9388 4.9388 8.0288 8.0288 12.0337 12.0337 12.2568 12.2568 12.3945 12.3945 14.3306 14.3306 15.8756 15.8756 17.8530 17.8530 18.3700 18.3700 18.5664 18.5664 k = 0.2632 0.6449 0.4292 ( 1817 PWs) bands (ev): -46.3635 -46.3635 -22.2223 -22.2223 -19.7983 -19.7983 -19.6840 -19.6840 4.3480 4.3480 4.9078 4.9078 8.0609 8.0609 12.0022 12.0022 12.2469 12.2469 12.3896 12.3896 14.3244 14.3244 15.9017 15.9017 17.7906 17.7906 18.3763 18.3763 18.5669 18.5669 k = 0.2493 0.6415 0.4331 ( 1817 PWs) bands (ev): -46.3634 -46.3634 -22.2225 -22.2225 -19.7988 -19.7988 -19.6839 -19.6839 4.3703 4.3703 4.8791 4.8791 8.1024 8.1024 11.9602 11.9602 12.2382 12.2382 12.3849 12.3849 14.3183 14.3183 15.9298 15.9298 17.7263 17.7263 18.3887 18.3887 18.5405 18.5405 k = 0.2355 0.6381 0.4371 ( 1817 PWs) bands (ev): -46.3634 -46.3634 -22.2227 -22.2227 -19.7993 -19.7993 -19.6838 -19.6838 4.3879 4.3879 4.8524 4.8524 8.1531 8.1531 11.9074 11.9074 12.2311 12.2311 12.3805 12.3805 14.3125 14.3125 15.9595 15.9595 17.6637 17.6637 18.3982 18.3982 18.5044 18.5044 k = 0.2216 0.6347 0.4410 ( 1818 PWs) bands (ev): -46.3633 -46.3633 -22.2228 -22.2228 -19.7997 -19.7997 -19.6837 -19.6837 4.4010 4.4010 4.8278 4.8278 8.2126 8.2126 11.8441 11.8441 12.2256 12.2256 12.3763 12.3763 14.3071 14.3071 15.9906 15.9906 17.6049 17.6049 18.3856 18.3856 18.4843 18.4843 k = 0.2078 0.6313 0.4449 ( 1820 PWs) bands (ev): -46.3633 -46.3633 -22.2230 -22.2230 -19.8001 -19.8001 -19.6836 -19.6836 4.4103 4.4103 4.8052 4.8052 8.2805 8.2805 11.7709 11.7709 12.2213 12.2213 12.3724 12.3724 14.3021 14.3021 16.0224 16.0224 17.5509 17.5509 18.3431 18.3431 18.4909 18.4909 k = 0.1939 0.6278 0.4488 ( 1822 PWs) bands (ev): -46.3633 -46.3633 -22.2232 -22.2232 -19.8005 -19.8005 -19.6835 -19.6835 4.4161 4.4161 4.7843 4.7843 8.3563 8.3563 11.6886 11.6886 12.2181 12.2181 12.3687 12.3687 14.2977 14.2977 16.0547 16.0547 17.5023 17.5023 18.2891 18.2891 18.5070 18.5070 k = 0.1801 0.6244 0.4527 ( 1822 PWs) bands (ev): -46.3633 -46.3633 -22.2233 -22.2233 -19.8009 -19.8009 -19.6833 -19.6833 4.4191 4.4191 4.7651 4.7651 8.4396 8.4396 11.5979 11.5979 12.2157 12.2157 12.3653 12.3653 14.2940 14.2940 16.0868 16.0868 17.4593 17.4593 18.2328 18.2328 18.5235 18.5235 k = 0.1662 0.6210 0.4567 ( 1818 PWs) bands (ev): -46.3632 -46.3632 -22.2234 -22.2234 -19.8012 -19.8012 -19.6832 -19.6832 4.4198 4.4198 4.7474 4.7474 8.5298 8.5298 11.4999 11.4999 12.2140 12.2140 12.3621 12.3621 14.2908 14.2908 16.1184 16.1184 17.4220 17.4220 18.1774 18.1774 18.5371 18.5371 k = 0.1524 0.6176 0.4606 ( 1818 PWs) bands (ev): -46.3631 -46.3631 -22.2235 -22.2235 -19.8015 -19.8015 -19.6831 -19.6831 4.4187 4.4187 4.7312 4.7312 8.6263 8.6263 11.3951 11.3951 12.2127 12.2127 12.3591 12.3591 14.2882 14.2882 16.1490 16.1490 17.3900 17.3900 18.1242 18.1242 18.5464 18.5464 k = 0.1385 0.6142 0.4645 ( 1816 PWs) bands (ev): -46.3630 -46.3630 -22.2235 -22.2235 -19.8017 -19.8017 -19.6830 -19.6830 4.4163 4.4163 4.7163 4.7163 8.7286 8.7286 11.2845 11.2845 12.2118 12.2118 12.3563 12.3563 14.2862 14.2862 16.1782 16.1782 17.3630 17.3630 18.0741 18.0741 18.5508 18.5508 k = 0.1247 0.6108 0.4684 ( 1820 PWs) bands (ev): -46.3631 -46.3631 -22.2237 -22.2237 -19.8020 -19.8020 -19.6829 -19.6829 4.4130 4.4130 4.7028 4.7028 8.8360 8.8360 11.1689 11.1689 12.2111 12.2111 12.3537 12.3537 14.2847 14.2847 16.2056 16.2056 17.3408 17.3408 18.0274 18.0274 18.5504 18.5504 k = 0.1108 0.6074 0.4723 ( 1818 PWs) bands (ev): -46.3630 -46.3630 -22.2237 -22.2237 -19.8022 -19.8022 -19.6828 -19.6828 4.4093 4.4093 4.6905 4.6905 8.9481 8.9481 11.0490 11.0490 12.2107 12.2107 12.3513 12.3513 14.2837 14.2837 16.2309 16.2309 17.3228 17.3228 17.9848 17.9848 18.5457 18.5457 k = 0.0970 0.6040 0.4763 ( 1822 PWs) bands (ev): -46.3631 -46.3631 -22.2238 -22.2238 -19.8024 -19.8024 -19.6827 -19.6827 4.4053 4.4053 4.6795 4.6795 9.0642 9.0642 10.9256 10.9256 12.2104 12.2104 12.3491 12.3491 14.2831 14.2831 16.2538 16.2538 17.3086 17.3086 17.9464 17.9464 18.5376 18.5376 k = 0.0831 0.6006 0.4802 ( 1818 PWs) bands (ev): -46.3630 -46.3630 -22.2238 -22.2238 -19.8025 -19.8025 -19.6826 -19.6826 4.4015 4.4015 4.6699 4.6699 9.1836 9.1836 10.7995 10.7995 12.2102 12.2102 12.3473 12.3473 14.2827 14.2827 16.2741 16.2741 17.2977 17.2977 17.9125 17.9125 18.5273 18.5273 k = 0.0693 0.5972 0.4841 ( 1816 PWs) bands (ev): -46.3629 -46.3629 -22.2239 -22.2239 -19.8027 -19.8027 -19.6826 -19.6826 4.3979 4.3979 4.6616 4.6616 9.3055 9.3055 10.6717 10.6717 12.2101 12.2101 12.3456 12.3456 14.2826 14.2826 16.2916 16.2916 17.2895 17.2895 17.8834 17.8834 18.5160 18.5160 k = 0.0554 0.5938 0.4880 ( 1815 PWs) bands (ev): -46.3629 -46.3629 -22.2239 -22.2239 -19.8028 -19.8028 -19.6825 -19.6825 4.3948 4.3948 4.6548 4.6548 9.4289 9.4289 10.5433 10.5433 12.2100 12.2100 12.3443 12.3443 14.2826 14.2826 16.3061 16.3061 17.2836 17.2836 17.8594 17.8594 18.5049 18.5049 k = 0.0416 0.5904 0.4919 ( 1817 PWs) bands (ev): -46.3629 -46.3629 -22.2239 -22.2239 -19.8029 -19.8029 -19.6825 -19.6825 4.3923 4.3923 4.6494 4.6494 9.5522 9.5522 10.4161 10.4161 12.2100 12.2100 12.3432 12.3432 14.2826 14.2826 16.3175 16.3175 17.2796 17.2796 17.8405 17.8405 18.4951 18.4951 k = 0.0277 0.5870 0.4959 ( 1814 PWs) bands (ev): -46.3629 -46.3629 -22.2239 -22.2239 -19.8029 -19.8029 -19.6824 -19.6824 4.3904 4.3904 4.6455 4.6455 9.6715 9.6715 10.2938 10.2938 12.2099 12.2099 12.3424 12.3424 14.2827 14.2827 16.3257 16.3257 17.2770 17.2770 17.8268 17.8268 18.4874 18.4874 k = 0.0139 0.5836 0.4998 ( 1816 PWs) bands (ev): -46.3629 -46.3629 -22.2240 -22.2240 -19.8030 -19.8030 -19.6824 -19.6824 4.3892 4.3892 4.6432 4.6432 9.7757 9.7757 10.1879 10.1879 12.2099 12.2099 12.3420 12.3420 14.2828 14.2828 16.3306 16.3306 17.2755 17.2755 17.8186 17.8186 18.4825 18.4825 k = 0.0000 0.5802 0.5037 ( 1820 PWs) bands (ev): -46.3630 -46.3630 -22.2240 -22.2240 -19.8030 -19.8030 -19.6825 -19.6825 4.3889 4.3889 4.6424 4.6424 9.8257 9.8257 10.1373 10.1373 12.2099 12.2099 12.3418 12.3418 14.2828 14.2828 16.3323 16.3323 17.2751 17.2751 17.8159 17.8159 18.4808 18.4808 k = 0.0000 0.5802 0.5037 ( 1820 PWs) bands (ev): -46.3630 -46.3630 -22.2240 -22.2240 -19.8030 -19.8030 -19.6825 -19.6825 4.3889 4.3889 4.6424 4.6424 9.8257 9.8257 10.1373 10.1373 12.2099 12.2099 12.3418 12.3418 14.2828 14.2828 16.3323 16.3323 17.2751 17.2751 17.8159 17.8159 18.4808 18.4808 k = 0.0052 0.5711 0.5142 ( 1814 PWs) bands (ev): -46.3628 -46.3628 -22.2240 -22.2240 -19.8030 -19.8030 -19.6825 -19.6825 4.3895 4.3895 4.6439 4.6439 9.8277 9.8277 10.1346 10.1346 12.2103 12.2103 12.3439 12.3439 14.2788 14.2788 16.3322 16.3322 17.2447 17.2447 17.8367 17.8367 18.4818 18.4818 k = 0.0104 0.5620 0.5247 ( 1812 PWs) bands (ev): -46.3628 -46.3628 -22.2241 -22.2241 -19.8029 -19.8029 -19.6829 -19.6829 4.3916 4.3916 4.6484 4.6484 9.8336 9.8336 10.1265 10.1265 12.2112 12.2112 12.3502 12.3502 14.2667 14.2667 16.3319 16.3319 17.1648 17.1648 17.8882 17.8882 18.4844 18.4844 k = 0.0156 0.5529 0.5352 ( 1810 PWs) bands (ev): -46.3627 -46.3627 -22.2242 -22.2242 -19.8028 -19.8028 -19.6834 -19.6834 4.3950 4.3950 4.6559 4.6559 9.8435 9.8435 10.1132 10.1132 12.2125 12.2125 12.3607 12.3607 14.2467 14.2467 16.3314 16.3314 17.0539 17.0539 17.9525 17.9525 18.4875 18.4875 k = 0.0208 0.5438 0.5457 ( 1808 PWs) bands (ev): -46.3626 -46.3626 -22.2244 -22.2244 -19.8027 -19.8027 -19.6841 -19.6841 4.3997 4.3997 4.6665 4.6665 9.8574 9.8574 10.0948 10.0948 12.2142 12.2142 12.3750 12.3750 14.2191 14.2191 16.3305 16.3305 16.9245 16.9245 18.0185 18.0185 18.4892 18.4892 k = 0.0260 0.5347 0.5562 ( 1812 PWs) bands (ev): -46.3625 -46.3625 -22.2247 -22.2247 -19.8025 -19.8025 -19.6852 -19.6852 4.4058 4.4058 4.6800 4.6800 9.8751 9.8751 10.0718 10.0718 12.2159 12.2159 12.3929 12.3929 14.1844 14.1844 16.3292 16.3292 16.7833 16.7833 18.0808 18.0808 18.4871 18.4871 k = 0.0312 0.5255 0.5667 ( 1812 PWs) bands (ev): -46.3624 -46.3624 -22.2251 -22.2251 -19.8024 -19.8024 -19.6864 -19.6864 4.4132 4.4132 4.6965 4.6965 9.8967 9.8967 10.0445 10.0445 12.2174 12.2174 12.4141 12.4141 14.1431 14.1431 16.3268 16.3268 16.6349 16.6349 18.1373 18.1373 18.4784 18.4784 k = 0.0365 0.5164 0.5771 ( 1812 PWs) bands (ev): -46.3623 -46.3623 -22.2255 -22.2255 -19.8022 -19.8022 -19.6878 -19.6878 4.4220 4.4220 4.7160 4.7160 9.9221 9.9221 10.0132 10.0132 12.2184 12.2184 12.4382 12.4382 14.0955 14.0955 16.3209 16.3209 16.4845 16.4845 18.1866 18.1866 18.4605 18.4605 k = 0.0417 0.5073 0.5876 ( 1810 PWs) bands (ev): -46.3621 -46.3621 -22.2259 -22.2259 -19.8019 -19.8019 -19.6893 -19.6893 4.4320 4.4320 4.7385 4.7385 9.9505 9.9505 9.9792 9.9792 12.2185 12.2185 12.4645 12.4645 14.0425 14.0425 16.2823 16.2823 16.3632 16.3632 18.2279 18.2279 18.4318 18.4318 k = 0.0469 0.4982 0.5981 ( 1808 PWs) bands (ev): -46.3618 -46.3618 -22.2264 -22.2264 -19.8017 -19.8017 -19.6911 -19.6911 4.4433 4.4433 4.7640 4.7640 9.9390 9.9390 9.9856 9.9856 12.2174 12.2174 12.4927 12.4927 13.9844 13.9844 16.1462 16.1462 16.3377 16.3377 18.2585 18.2585 18.3946 18.3946 k = 0.0521 0.4891 0.6086 ( 1808 PWs) bands (ev): -46.3616 -46.3616 -22.2270 -22.2270 -19.8014 -19.8014 -19.6930 -19.6930 4.4558 4.4558 4.7925 4.7925 9.8987 9.8987 10.0218 10.0218 12.2145 12.2145 12.5222 12.5222 13.9219 13.9219 15.9896 15.9896 16.3323 16.3323 18.2666 18.2666 18.3618 18.3618 k = 0.0573 0.4800 0.6191 ( 1806 PWs) bands (ev): -46.3614 -46.3614 -22.2276 -22.2276 -19.8011 -19.8011 -19.6951 -19.6951 4.4695 4.4695 4.8239 4.8239 9.8557 9.8557 10.0620 10.0620 12.2093 12.2093 12.5524 12.5524 13.8556 13.8556 15.8320 15.8320 16.3292 16.3292 18.2306 18.2306 18.3580 18.3580 k = 0.0625 0.4709 0.6296 ( 1814 PWs) bands (ev): -46.3613 -46.3613 -22.2283 -22.2283 -19.8009 -19.8009 -19.6974 -19.6974 4.4844 4.4844 4.8582 4.8582 9.8107 9.8107 10.1058 10.1058 12.2011 12.2011 12.5828 12.5828 13.7860 13.7860 15.6766 15.6766 16.3264 16.3264 18.1663 18.1663 18.3704 18.3704 k = 0.0677 0.4618 0.6401 ( 1812 PWs) bands (ev): -46.3610 -46.3610 -22.2290 -22.2290 -19.8006 -19.8006 -19.6997 -19.6997 4.5004 4.5004 4.8955 4.8955 9.7640 9.7640 10.1530 10.1530 12.1892 12.1892 12.6130 12.6130 13.7137 13.7137 15.5250 15.5250 16.3237 16.3237 18.0924 18.0924 18.3840 18.3840 k = 0.0729 0.4527 0.6506 ( 1814 PWs) bands (ev): -46.3607 -46.3607 -22.2298 -22.2298 -19.8003 -19.8003 -19.7022 -19.7022 4.5175 4.5175 4.9358 4.9358 9.7161 9.7161 10.2036 10.2036 12.1728 12.1728 12.6423 12.6423 13.6392 13.6392 15.3788 15.3788 16.3208 16.3208 18.0152 18.0152 18.3953 18.3953 k = 0.0781 0.4436 0.6611 ( 1816 PWs) bands (ev): -46.3605 -46.3605 -22.2306 -22.2306 -19.8001 -19.8001 -19.7048 -19.7048 4.5356 4.5356 4.9789 4.9789 9.6671 9.6671 10.2573 10.2573 12.1509 12.1509 12.6703 12.6703 13.5631 13.5631 15.2394 15.2394 16.3176 16.3176 17.9381 17.9381 18.4038 18.4038 k = 0.0833 0.4344 0.6716 ( 1818 PWs) bands (ev): -46.3602 -46.3602 -22.2315 -22.2315 -19.7998 -19.7998 -19.7075 -19.7075 4.5548 4.5548 5.0249 5.0249 9.6175 9.6175 10.3140 10.3140 12.1225 12.1225 12.6965 12.6965 13.4857 13.4857 15.1083 15.1083 16.3141 16.3141 17.8632 17.8632 18.4093 18.4093 k = 0.0885 0.4253 0.6821 ( 1816 PWs) bands (ev): -46.3598 -46.3598 -22.2323 -22.2323 -19.7996 -19.7996 -19.7102 -19.7102 4.5748 4.5748 5.0738 5.0738 9.5674 9.5674 10.3736 10.3736 12.0868 12.0868 12.7203 12.7203 13.4078 13.4078 14.9865 14.9865 16.3102 16.3102 17.7922 17.7922 18.4119 18.4119 k = 0.0938 0.4162 0.6926 ( 1812 PWs) bands (ev): -46.3594 -46.3594 -22.2332 -22.2332 -19.7994 -19.7994 -19.7128 -19.7128 4.5958 4.5958 5.1256 5.1256 9.5172 9.5172 10.4359 10.4359 12.0430 12.0430 12.7411 12.7411 13.3300 13.3300 14.8753 14.8753 16.3059 16.3059 17.7262 17.7262 18.4118 18.4118 k = 0.0990 0.4071 0.7031 ( 1808 PWs) bands (ev): -46.3590 -46.3590 -22.2341 -22.2341 -19.7993 -19.7993 -19.7156 -19.7156 4.6176 4.6176 5.1802 5.1802 9.4669 9.4669 10.5005 10.5005 11.9903 11.9903 12.7581 12.7581 13.2531 13.2531 14.7756 14.7756 16.3011 16.3011 17.6661 17.6661 18.4093 18.4093 k = 0.1042 0.3980 0.7136 ( 1808 PWs) bands (ev): -46.3587 -46.3587 -22.2351 -22.2351 -19.7992 -19.7992 -19.7183 -19.7183 4.6401 4.6401 5.2377 5.2377 9.4169 9.4169 10.5671 10.5671 11.9285 11.9285 12.7701 12.7701 13.1783 13.1783 14.6881 14.6881 16.2960 16.2960 17.6128 17.6128 18.4044 18.4044 k = 0.1094 0.3889 0.7241 ( 1810 PWs) bands (ev): -46.3584 -46.3584 -22.2361 -22.2361 -19.7992 -19.7992 -19.7210 -19.7210 4.6632 4.6632 5.2979 5.2979 9.3672 9.3672 10.6351 10.6351 11.8576 11.8576 12.7755 12.7755 13.1075 13.1075 14.6129 14.6129 16.2904 16.2904 17.5667 17.5667 18.3974 18.3974 k = 0.1146 0.3798 0.7346 ( 1808 PWs) bands (ev): -46.3580 -46.3580 -22.2371 -22.2371 -19.7993 -19.7993 -19.7236 -19.7236 4.6870 4.6870 5.3609 5.3609 9.3182 9.3182 10.7039 10.7039 11.7783 11.7783 12.7711 12.7711 13.0438 13.0438 14.5500 14.5500 16.2844 16.2844 17.5283 17.5283 18.3884 18.3884 k = 0.1198 0.3707 0.7450 ( 1806 PWs) bands (ev): -46.3576 -46.3576 -22.2381 -22.2381 -19.7995 -19.7995 -19.7262 -19.7262 4.7113 4.7113 5.4267 5.4267 9.2699 9.2699 10.7720 10.7720 11.6921 11.6921 12.7527 12.7527 12.9917 12.9917 14.4990 14.4990 16.2781 16.2781 17.4978 17.4978 18.3778 18.3778 k = 0.1250 0.3616 0.7555 ( 1812 PWs) bands (ev): -46.3574 -46.3574 -22.2392 -22.2392 -19.7998 -19.7998 -19.7287 -19.7287 4.7360 4.7360 5.4953 5.4953 9.2224 9.2224 10.8372 10.8372 11.6019 11.6019 12.7170 12.7170 12.9549 12.9549 14.4590 14.4590 16.2716 16.2716 17.4754 17.4754 18.3655 18.3655 k = 0.1302 0.3525 0.7660 ( 1816 PWs) bands (ev): -46.3571 -46.3571 -22.2402 -22.2402 -19.8002 -19.8002 -19.7311 -19.7311 4.7610 4.7610 5.5665 5.5665 9.1760 9.1760 10.8945 10.8945 11.5133 11.5133 12.6658 12.6658 12.9316 12.9316 14.4290 14.4290 16.2648 16.2648 17.4612 17.4612 18.3520 18.3520 k = 0.1354 0.3433 0.7765 ( 1816 PWs) bands (ev): -46.3567 -46.3567 -22.2413 -22.2413 -19.8007 -19.8007 -19.7333 -19.7333 4.7863 4.7863 5.6403 5.6403 9.1306 9.1306 10.9336 10.9336 11.4373 11.4373 12.6048 12.6048 12.9167 12.9167 14.4077 14.4077 16.2580 16.2580 17.4553 17.4553 18.3375 18.3375 k = 0.1406 0.3342 0.7870 ( 1816 PWs) bands (ev): -46.3564 -46.3564 -22.2423 -22.2423 -19.8013 -19.8013 -19.7354 -19.7354 4.8117 4.8117 5.7169 5.7169 9.0866 9.0866 10.9362 10.9362 11.3931 11.3931 12.5389 12.5389 12.9054 12.9054 14.3936 14.3936 16.2514 16.2514 17.4575 17.4575 18.3222 18.3222 k = 0.1458 0.3251 0.7975 ( 1818 PWs) bands (ev): -46.3560 -46.3560 -22.2433 -22.2433 -19.8021 -19.8021 -19.7373 -19.7373 4.8371 4.8371 5.7959 5.7959 9.0439 9.0439 10.8882 10.8882 11.3958 11.3958 12.4710 12.4710 12.8953 12.8953 14.3855 14.3855 16.2451 16.2451 17.4677 17.4677 18.3066 18.3066 k = 0.1510 0.3160 0.8080 ( 1820 PWs) bands (ev): -46.3557 -46.3557 -22.2443 -22.2443 -19.8029 -19.8029 -19.7390 -19.7390 4.8624 4.8624 5.8775 5.8775 9.0026 9.0026 10.7982 10.7982 11.4373 11.4373 12.4029 12.4029 12.8851 12.8851 14.3817 14.3817 16.2395 16.2395 17.4857 17.4857 18.2908 18.2908 k = 0.1562 0.3069 0.8185 ( 1824 PWs) bands (ev): -46.3555 -46.3555 -22.2454 -22.2454 -19.8039 -19.8039 -19.7406 -19.7406 4.8875 4.8875 5.9616 5.9616 8.9629 8.9629 10.6840 10.6840 11.5007 11.5007 12.3357 12.3357 12.8742 12.8742 14.3810 14.3810 16.2347 16.2347 17.5112 17.5112 18.2754 18.2754 k = 0.1615 0.2978 0.8290 ( 1822 PWs) bands (ev): -46.3551 -46.3551 -22.2463 -22.2463 -19.8050 -19.8050 -19.7420 -19.7420 4.9122 4.9122 6.0481 6.0481 8.9249 8.9249 10.5568 10.5568 11.5753 11.5753 12.2700 12.2700 12.8625 12.8625 14.3819 14.3819 16.2312 16.2312 17.5440 17.5440 18.2607 18.2607 k = 0.1667 0.2887 0.8395 ( 1824 PWs) bands (ev): -46.3548 -46.3548 -22.2473 -22.2473 -19.8061 -19.8061 -19.7432 -19.7432 4.9365 4.9365 6.1369 6.1369 8.8885 8.8885 10.4224 10.4224 11.6557 11.6557 12.2063 12.2063 12.8500 12.8500 14.3833 14.3833 16.2292 16.2292 17.5838 17.5838 18.2471 18.2471 k = 0.1719 0.2796 0.8500 ( 1822 PWs) bands (ev): -46.3545 -46.3545 -22.2482 -22.2482 -19.8073 -19.8073 -19.7442 -19.7442 4.9603 4.9603 6.2279 6.2279 8.8540 8.8540 10.2838 10.2838 11.7392 11.7392 12.1454 12.1454 12.8368 12.8368 14.3839 14.3839 16.2290 16.2290 17.6302 17.6302 18.2351 18.2351 k = 0.1771 0.2705 0.8605 ( 1822 PWs) bands (ev): -46.3542 -46.3542 -22.2490 -22.2490 -19.8086 -19.8086 -19.7451 -19.7451 4.9833 4.9833 6.3211 6.3211 8.8214 8.8214 10.1429 10.1429 11.8234 11.8234 12.0879 12.0879 12.8232 12.8232 14.3828 14.3828 16.2310 16.2310 17.6829 17.6829 18.2251 18.2251 k = 0.1823 0.2614 0.8710 ( 1820 PWs) bands (ev): -46.3539 -46.3539 -22.2498 -22.2498 -19.8099 -19.8099 -19.7459 -19.7459 5.0054 5.0054 6.4161 6.4161 8.7906 8.7906 10.0009 10.0009 11.9046 11.9046 12.0371 12.0371 12.8092 12.8092 14.3791 14.3791 16.2353 16.2353 17.7415 17.7415 18.2176 18.2176 k = 0.1875 0.2522 0.8815 ( 1818 PWs) bands (ev): -46.3536 -46.3536 -22.2506 -22.2506 -19.8112 -19.8112 -19.7465 -19.7465 5.0266 5.0266 6.5130 6.5130 8.7619 8.7619 9.8589 9.8589 11.9492 11.9492 12.0259 12.0259 12.7952 12.7952 14.3722 14.3722 16.2420 16.2420 17.8057 17.8057 18.2131 18.2131 k = 0.1927 0.2431 0.8920 ( 1820 PWs) bands (ev): -46.3534 -46.3534 -22.2514 -22.2514 -19.8125 -19.8125 -19.7470 -19.7470 5.0466 5.0466 6.6114 6.6114 8.7353 8.7353 9.7176 9.7176 11.9163 11.9163 12.0946 12.0946 12.7815 12.7815 14.3617 14.3617 16.2510 16.2510 17.8751 17.8751 18.2119 18.2119 k = 0.1979 0.2340 0.9025 ( 1820 PWs) bands (ev): -46.3532 -46.3532 -22.2521 -22.2521 -19.8137 -19.8137 -19.7474 -19.7474 5.0655 5.0655 6.7110 6.7110 8.7108 8.7108 9.5778 9.5778 11.8732 11.8732 12.1753 12.1753 12.7681 12.7681 14.3475 14.3475 16.2623 16.2623 17.9493 17.9493 18.2145 18.2145 k = 0.2031 0.2249 0.9129 ( 1818 PWs) bands (ev): -46.3529 -46.3529 -22.2527 -22.2527 -19.8149 -19.8149 -19.7478 -19.7478 5.0830 5.0830 6.8113 6.8113 8.6884 8.6884 9.4403 9.4403 11.8320 11.8320 12.2555 12.2555 12.7554 12.7554 14.3297 14.3297 16.2753 16.2753 18.0277 18.0277 18.2214 18.2214 k = 0.2083 0.2158 0.9234 ( 1820 PWs) bands (ev): -46.3528 -46.3528 -22.2533 -22.2533 -19.8160 -19.8160 -19.7481 -19.7481 5.0990 5.0990 6.9119 6.9119 8.6682 8.6682 9.3059 9.3059 11.7942 11.7942 12.3328 12.3328 12.7435 12.7435 14.3088 14.3088 16.2896 16.2896 18.1097 18.1097 18.2332 18.2332 k = 0.2135 0.2067 0.9339 ( 1816 PWs) bands (ev): -46.3525 -46.3525 -22.2538 -22.2538 -19.8170 -19.8170 -19.7483 -19.7483 5.1134 5.1134 7.0119 7.0119 8.6503 8.6503 9.1757 9.1757 11.7602 11.7602 12.4061 12.4061 12.7326 12.7326 14.2856 14.2856 16.3047 16.3047 18.1927 18.1927 18.2520 18.2520 k = 0.2188 0.1976 0.9444 ( 1814 PWs) bands (ev): -46.3523 -46.3523 -22.2542 -22.2542 -19.8179 -19.8179 -19.7484 -19.7484 5.1261 5.1261 7.1101 7.1101 8.6347 8.6347 9.0510 9.0510 11.7304 11.7304 12.4739 12.4739 12.7229 12.7229 14.2611 14.2611 16.3197 16.3197 18.2551 18.2551 18.2989 18.2989 k = 0.2240 0.1885 0.9549 ( 1814 PWs) bands (ev): -46.3522 -46.3522 -22.2546 -22.2546 -19.8187 -19.8187 -19.7485 -19.7485 5.1370 5.1370 7.2048 7.2048 8.6213 8.6213 8.9337 8.9337 11.7048 11.7048 12.5349 12.5349 12.7145 12.7145 14.2364 14.2364 16.3340 16.3340 18.2852 18.2852 18.3843 18.3843 k = 0.2292 0.1794 0.9654 ( 1814 PWs) bands (ev): -46.3521 -46.3521 -22.2549 -22.2549 -19.8194 -19.8194 -19.7486 -19.7486 5.1461 5.1461 7.2935 7.2935 8.6101 8.6101 8.8266 8.8266 11.6838 11.6838 12.5877 12.5877 12.7077 12.7077 14.2131 14.2131 16.3469 16.3469 18.3136 18.3136 18.4756 18.4756 k = 0.2344 0.1703 0.9759 ( 1816 PWs) bands (ev): -46.3521 -46.3521 -22.2552 -22.2552 -19.8199 -19.8199 -19.7487 -19.7487 5.1532 5.1532 7.3724 7.3724 8.6010 8.6010 8.7337 8.7337 11.6673 11.6673 12.6306 12.6306 12.7025 12.7025 14.1928 14.1928 16.3577 16.3577 18.3429 18.3429 18.5658 18.5658 k = 0.2396 0.1612 0.9864 ( 1820 PWs) bands (ev): -46.3521 -46.3521 -22.2554 -22.2554 -19.8203 -19.8203 -19.7488 -19.7488 5.1583 5.1583 7.4364 7.4364 8.5932 8.5932 8.6610 8.6610 11.6555 11.6555 12.6617 12.6617 12.6996 12.6996 14.1769 14.1769 16.3658 16.3658 18.3707 18.3707 18.6476 18.6476 k = 0.2448 0.1520 0.9969 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2555 -22.2555 -19.8206 -19.8206 -19.7488 -19.7488 5.1614 5.1614 7.4788 7.4788 8.5841 8.5841 8.6177 8.6177 11.6483 11.6483 12.6789 12.6789 12.6999 12.6999 14.1667 14.1667 16.3708 16.3708 18.3919 18.3919 18.7010 18.7010 k = 0.2500 0.1429 1.0074 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7488 -19.7488 5.1624 5.1624 7.4939 7.4939 8.5768 8.5768 8.6065 8.6065 11.6459 11.6459 12.6832 12.6832 12.7015 12.7015 14.1632 14.1632 16.3725 16.3725 18.4001 18.4001 18.7119 18.7119 k = 0.2500 0.1429 1.0074 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7488 -19.7488 5.1624 5.1624 7.4939 7.4939 8.5768 8.5768 8.6065 8.6065 11.6459 11.6459 12.6832 12.6832 12.7015 12.7015 14.1632 14.1632 16.3725 16.3725 18.4001 18.4001 18.7119 18.7119 k = 0.2609 0.1491 1.0002 ( 1825 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7488 -19.7488 5.1618 5.1618 7.4921 7.4921 8.5671 8.5671 8.6214 8.6214 11.6382 11.6382 12.6329 12.6329 12.7504 12.7504 14.1746 14.1746 16.3721 16.3721 18.3951 18.3951 18.6629 18.6629 k = 0.2717 0.1554 0.9931 ( 1823 PWs) bands (ev): -46.3521 -46.3521 -22.2555 -22.2555 -19.8206 -19.8206 -19.7488 -19.7488 5.1599 5.1599 7.4859 7.4859 8.5578 8.5578 8.6467 8.6467 11.6153 11.6153 12.5761 12.5761 12.8030 12.8030 14.2083 14.2083 16.3707 16.3707 18.3790 18.3790 18.5850 18.5850 k = 0.2826 0.1616 0.9859 ( 1817 PWs) bands (ev): -46.3520 -46.3520 -22.2554 -22.2554 -19.8204 -19.8204 -19.7488 -19.7488 5.1572 5.1572 7.4740 7.4740 8.5585 8.5585 8.6742 8.6742 11.5786 11.5786 12.5196 12.5196 12.8524 12.8524 14.2625 14.2625 16.3682 16.3682 18.3486 18.3486 18.5117 18.5117 k = 0.2935 0.1678 0.9788 ( 1817 PWs) bands (ev): -46.3520 -46.3520 -22.2554 -22.2554 -19.8203 -19.8203 -19.7487 -19.7487 5.1538 5.1538 7.4557 7.4557 8.5705 8.5705 8.7028 8.7028 11.5296 11.5296 12.4640 12.4640 12.8986 12.8986 14.3346 14.3346 16.3644 16.3644 18.2991 18.2991 18.4532 18.4532 k = 0.3043 0.1740 0.9716 ( 1820 PWs) bands (ev): -46.3521 -46.3521 -22.2553 -22.2553 -19.8202 -19.8202 -19.7487 -19.7487 5.1500 5.1500 7.4307 7.4307 8.5943 8.5943 8.7321 8.7321 11.4704 11.4704 12.4096 12.4096 12.9418 12.9418 14.4214 14.4214 16.3593 16.3593 18.2318 18.2318 18.4109 18.4109 k = 0.3152 0.1802 0.9644 ( 1818 PWs) bands (ev): -46.3521 -46.3521 -22.2552 -22.2552 -19.8200 -19.8200 -19.7487 -19.7487 5.1461 5.1461 7.3992 7.3992 8.6293 8.6293 8.7620 8.7620 11.4032 11.4032 12.3567 12.3567 12.9820 12.9820 14.5200 14.5200 16.3528 16.3528 18.1544 18.1544 18.3788 18.3788 k = 0.3261 0.1864 0.9573 ( 1820 PWs) bands (ev): -46.3522 -46.3522 -22.2551 -22.2551 -19.8197 -19.8197 -19.7487 -19.7487 5.1422 5.1422 7.3616 7.3616 8.6750 8.6750 8.7922 8.7922 11.3298 11.3298 12.3056 12.3056 13.0194 13.0194 14.6272 14.6272 16.3449 16.3449 18.0727 18.0727 18.3530 18.3530 k = 0.3370 0.1926 0.9501 ( 1821 PWs) bands (ev): -46.3522 -46.3522 -22.2550 -22.2550 -19.8195 -19.8195 -19.7487 -19.7487 5.1386 5.1386 7.3188 7.3188 8.7302 8.7302 8.8228 8.8228 11.2521 11.2521 12.2566 12.2566 13.0538 13.0538 14.7405 14.7405 16.3355 16.3355 17.9888 17.9888 18.3323 18.3323 k = 0.3478 0.1989 0.9430 ( 1823 PWs) bands (ev): -46.3523 -46.3523 -22.2549 -22.2549 -19.8192 -19.8192 -19.7487 -19.7487 5.1354 5.1354 7.2715 7.2715 8.7936 8.7936 8.8538 8.8538 11.1717 11.1717 12.2099 12.2099 13.0849 13.0849 14.8575 14.8575 16.3248 16.3248 17.9030 17.9030 18.3176 18.3176 k = 0.3587 0.2051 0.9358 ( 1823 PWs) bands (ev): -46.3523 -46.3523 -22.2547 -22.2547 -19.8189 -19.8189 -19.7486 -19.7486 5.1329 5.1329 7.2203 7.2203 8.8617 8.8617 8.8875 8.8875 11.0900 11.0900 12.1660 12.1660 13.1124 13.1124 14.9763 14.9763 16.3126 16.3126 17.8150 17.8150 18.3100 18.3100 k = 0.3696 0.2113 0.9286 ( 1823 PWs) bands (ev): -46.3524 -46.3524 -22.2546 -22.2546 -19.8185 -19.8185 -19.7486 -19.7486 5.1312 5.1312 7.1659 7.1659 8.9084 8.9084 8.9491 8.9491 11.0083 11.0083 12.1249 12.1249 13.1360 13.1360 15.0952 15.0952 16.2991 16.2991 17.7239 17.7239 18.3111 18.3111 k = 0.3804 0.2175 0.9215 ( 1821 PWs) bands (ev): -46.3524 -46.3524 -22.2544 -22.2544 -19.8181 -19.8181 -19.7486 -19.7486 5.1303 5.1303 7.1087 7.1087 8.9392 8.9392 9.0321 9.0321 10.9275 10.9275 12.0870 12.0870 13.1552 13.1552 15.2130 15.2130 16.2842 16.2842 17.6293 17.6293 18.3219 18.3219 k = 0.3913 0.2237 0.9143 ( 1823 PWs) bands (ev): -46.3525 -46.3525 -22.2542 -22.2542 -19.8177 -19.8177 -19.7486 -19.7486 5.1305 5.1305 7.0491 7.0491 8.9679 8.9679 9.1217 9.1217 10.8485 10.8485 12.0525 12.0525 13.1698 13.1698 15.3284 15.3284 16.2680 16.2680 17.5305 17.5305 18.3434 18.3434 k = 0.4022 0.2299 0.9072 ( 1823 PWs) bands (ev): -46.3526 -46.3526 -22.2540 -22.2540 -19.8172 -19.8172 -19.7485 -19.7485 5.1318 5.1318 6.9876 6.9876 8.9953 8.9953 9.2166 9.2166 10.7720 10.7720 12.0216 12.0216 13.1793 13.1793 15.4408 15.4408 16.2507 16.2507 17.4272 17.4272 18.3757 18.3757 k = 0.4130 0.2361 0.9000 ( 1820 PWs) bands (ev): -46.3526 -46.3526 -22.2537 -22.2537 -19.8166 -19.8166 -19.7485 -19.7485 5.1342 5.1342 6.9242 6.9242 9.0214 9.0214 9.3158 9.3158 10.6987 10.6987 11.9946 11.9946 13.1836 13.1836 15.5496 15.5496 16.2323 16.2323 17.3192 17.3192 18.4187 18.4187 k = 0.4239 0.2424 0.8929 ( 1816 PWs) bands (ev): -46.3526 -46.3526 -22.2534 -22.2534 -19.8161 -19.8161 -19.7484 -19.7484 5.1379 5.1379 6.8592 6.8592 9.0460 9.0460 9.4191 9.4191 10.6292 10.6292 11.9716 11.9716 13.1826 13.1826 15.6544 15.6544 16.2130 16.2130 17.2067 17.2067 18.4717 18.4717 k = 0.4348 0.2486 0.8857 ( 1816 PWs) bands (ev): -46.3527 -46.3527 -22.2532 -22.2532 -19.8155 -19.8155 -19.7484 -19.7484 5.1427 5.1427 6.7929 6.7929 9.0691 9.0691 9.5258 9.5258 10.5639 10.5639 11.9528 11.9528 13.1763 13.1763 15.7549 15.7549 16.1929 16.1929 17.0900 17.0900 18.5334 18.5334 k = 0.4457 0.2548 0.8785 ( 1820 PWs) bands (ev): -46.3529 -46.3529 -22.2529 -22.2529 -19.8149 -19.8149 -19.7484 -19.7484 5.1487 5.1487 6.7253 6.7253 9.0905 9.0905 9.6358 9.6358 10.5032 10.5032 11.9382 11.9382 13.1647 13.1647 15.8506 15.8506 16.1724 16.1724 16.9695 16.9695 18.6023 18.6023 k = 0.4565 0.2610 0.8714 ( 1818 PWs) bands (ev): -46.3530 -46.3530 -22.2526 -22.2526 -19.8142 -19.8142 -19.7484 -19.7484 5.1559 5.1559 6.6568 6.6568 9.1100 9.1100 9.7484 9.7484 10.4475 10.4475 11.9281 11.9281 13.1481 13.1481 15.9407 15.9407 16.1524 16.1524 16.8463 16.8463 18.6762 18.6762 k = 0.4674 0.2672 0.8642 ( 1818 PWs) bands (ev): -46.3531 -46.3531 -22.2523 -22.2523 -19.8136 -19.8136 -19.7483 -19.7483 5.1641 5.1641 6.5874 6.5874 9.1276 9.1276 9.8634 9.8634 10.3973 10.3973 11.9225 11.9225 13.1267 13.1267 16.0206 16.0206 16.1363 16.1363 16.7218 16.7218 18.7530 18.7530 k = 0.4783 0.2734 0.8571 ( 1818 PWs) bands (ev): -46.3532 -46.3532 -22.2520 -22.2520 -19.8129 -19.8129 -19.7483 -19.7483 5.1732 5.1732 6.5176 6.5176 9.1432 9.1432 9.9800 9.9800 10.3529 10.3529 11.9214 11.9214 13.1008 13.1008 16.0669 16.0669 16.1450 16.1450 16.5999 16.5999 18.8305 18.8305 k = 0.4891 0.2796 0.8499 ( 1820 PWs) bands (ev): -46.3533 -46.3533 -22.2517 -22.2517 -19.8122 -19.8122 -19.7482 -19.7482 5.1828 5.1828 6.4475 6.4475 9.1568 9.1568 10.0967 10.0967 10.3159 10.3159 11.9247 11.9247 13.0708 13.0708 16.0604 16.0604 16.1866 16.1866 16.4923 16.4923 18.9063 18.9063 k = 0.5000 0.2859 0.8427 ( 1820 PWs) bands (ev): -46.3534 -46.3534 -22.2513 -22.2513 -19.8114 -19.8114 -19.7482 -19.7482 5.1928 5.1928 6.3778 6.3778 9.1683 9.1683 10.2037 10.2037 10.2959 10.2959 11.9323 11.9323 13.0373 13.0373 16.0382 16.0382 16.1865 16.1865 16.4377 16.4377 18.9785 18.9785 k = 0.5000 0.2859 0.8427 ( 1820 PWs) bands (ev): -46.3534 -46.3534 -22.2513 -22.2513 -19.8114 -19.8114 -19.7482 -19.7482 5.1928 5.1928 6.3778 6.3778 9.1683 9.1683 10.2037 10.2037 10.2959 10.2959 11.9323 11.9323 13.0373 13.0373 16.0382 16.0382 16.1865 16.1865 16.4377 16.4377 18.9785 18.9785 k = 0.5000 0.2859 0.8280 ( 1824 PWs) bands (ev): -46.3538 -46.3538 -22.2506 -22.2506 -19.8097 -19.8097 -19.7481 -19.7481 5.2139 5.2139 6.2357 6.2357 9.1909 9.1909 10.2717 10.2717 10.4144 10.4144 11.9535 11.9535 12.9655 12.9655 15.9829 15.9829 16.1002 16.1002 16.4164 16.4164 19.1231 19.1231 k = 0.5000 0.2859 0.8132 ( 1828 PWs) bands (ev): -46.3541 -46.3541 -22.2497 -22.2497 -19.8078 -19.8078 -19.7480 -19.7480 5.2361 5.2361 6.0962 6.0962 9.2153 9.2153 10.2614 10.2614 10.6103 10.6103 11.9764 11.9764 12.8965 12.8965 15.9233 15.9233 16.0197 16.0197 16.3942 16.3942 19.2681 19.2681 k = 0.5000 0.2859 0.7984 ( 1820 PWs) bands (ev): -46.3543 -46.3543 -22.2488 -22.2488 -19.8058 -19.8058 -19.7479 -19.7479 5.2593 5.2593 5.9593 5.9593 9.2416 9.2416 10.2461 10.2461 10.8097 10.8097 12.0010 12.0010 12.8315 12.8315 15.8596 15.8596 15.9457 15.9457 16.3708 16.3708 19.4130 19.4130 k = 0.5000 0.2859 0.7836 ( 1820 PWs) bands (ev): -46.3546 -46.3546 -22.2478 -22.2478 -19.8037 -19.8037 -19.7478 -19.7478 5.2831 5.2831 5.8250 5.8250 9.2698 9.2698 10.2274 10.2274 11.0106 11.0106 12.0273 12.0273 12.7714 12.7714 15.7930 15.7930 15.8776 15.8776 16.3464 16.3464 19.5575 19.5575 k = 0.5000 0.2859 0.7688 ( 1820 PWs) bands (ev): -46.3549 -46.3549 -22.2468 -22.2468 -19.8015 -19.8015 -19.7476 -19.7476 5.3073 5.3073 5.6934 5.6934 9.2997 9.2997 10.2057 10.2057 11.2124 11.2124 12.0551 12.0551 12.7172 12.7172 15.7258 15.7258 15.8137 15.8137 16.3210 16.3210 19.7011 19.7011 k = 0.5000 0.2859 0.7540 ( 1820 PWs) bands (ev): -46.3553 -46.3553 -22.2458 -22.2458 -19.7991 -19.7991 -19.7474 -19.7474 5.3318 5.3318 5.5643 5.5643 9.3314 9.3314 10.1809 10.1809 11.4145 11.4145 12.0846 12.0846 12.6696 12.6696 15.6602 15.6602 15.7526 15.7526 16.2947 16.2947 19.8433 19.8433 k = 0.5000 0.2859 0.7393 ( 1820 PWs) bands (ev): -46.3556 -46.3556 -22.2447 -22.2447 -19.7966 -19.7966 -19.7473 -19.7473 5.3560 5.3560 5.4381 5.4381 9.3648 9.3648 10.1534 10.1534 11.6165 11.6165 12.1156 12.1156 12.6293 12.6293 15.5980 15.5980 15.6932 15.6932 16.2675 16.2675 19.9834 19.9834 k = 0.5000 0.2859 0.7245 ( 1818 PWs) bands (ev): -46.3560 -46.3560 -22.2435 -22.2435 -19.7940 -19.7940 -19.7471 -19.7471 5.3136 5.3136 5.3807 5.3807 9.4000 9.4000 10.1234 10.1234 11.8177 11.8177 12.1481 12.1481 12.5965 12.5965 15.5402 15.5402 15.6354 15.6354 16.2396 16.2396 20.1208 20.1208 k = 0.5000 0.2859 0.7097 ( 1818 PWs) bands (ev): -46.3564 -46.3564 -22.2423 -22.2423 -19.7913 -19.7913 -19.7469 -19.7469 5.1927 5.1927 5.4038 5.4038 9.4368 9.4368 10.0914 10.0914 12.0171 12.0171 12.1820 12.1820 12.5716 12.5716 15.4875 15.4875 15.5794 15.5794 16.2110 16.2110 20.2545 20.2545 k = 0.5000 0.2859 0.6949 ( 1810 PWs) bands (ev): -46.3566 -46.3566 -22.2410 -22.2410 -19.7885 -19.7885 -19.7466 -19.7466 5.0742 5.0742 5.4260 5.4260 9.4753 9.4753 10.0581 10.0581 12.2126 12.2126 12.2181 12.2181 12.5551 12.5551 15.4399 15.4399 15.5262 15.5262 16.1818 16.1818 20.3835 20.3835 k = 0.5000 0.2859 0.6801 ( 1810 PWs) bands (ev): -46.3571 -46.3571 -22.2397 -22.2397 -19.7856 -19.7856 -19.7464 -19.7464 4.9582 4.9582 5.4469 5.4469 9.5154 9.5154 10.0242 10.0242 12.2540 12.2540 12.4020 12.4020 12.5502 12.5502 15.3966 15.3966 15.4780 15.4780 16.1521 16.1521 20.5063 20.5063 k = 0.5000 0.2859 0.6653 ( 1810 PWs) bands (ev): -46.3575 -46.3575 -22.2384 -22.2384 -19.7826 -19.7826 -19.7462 -19.7462 4.8449 4.8449 5.4660 5.4660 9.5571 9.5571 9.9905 9.9905 12.2920 12.2920 12.5210 12.5210 12.6170 12.6170 15.3546 15.3546 15.4394 15.4394 16.1221 16.1221 20.6191 20.6191 k = 0.5000 0.2859 0.6505 ( 1814 PWs) bands (ev): -46.3580 -46.3580 -22.2370 -22.2370 -19.7796 -19.7796 -19.7460 -19.7460 4.7342 4.7342 5.4830 5.4830 9.6002 9.6002 9.9579 9.9579 12.3312 12.3312 12.5356 12.5356 12.7882 12.7882 15.3100 15.3100 15.4161 15.4161 16.0918 16.0918 20.7049 20.7049 k = 0.5000 0.2859 0.6358 ( 1816 PWs) bands (ev): -46.3585 -46.3585 -22.2356 -22.2356 -19.7764 -19.7764 -19.7458 -19.7458 4.6261 4.6261 5.4975 5.4975 9.6448 9.6448 9.9274 9.9274 12.3715 12.3715 12.5474 12.5474 12.9594 12.9594 15.2620 15.2620 15.4114 15.4114 16.0613 16.0613 20.7323 20.7323 k = 0.5000 0.2859 0.6210 ( 1816 PWs) bands (ev): -46.3590 -46.3590 -22.2342 -22.2342 -19.7732 -19.7732 -19.7455 -19.7455 4.5206 4.5206 5.5091 5.5091 9.6907 9.6907 9.8999 9.8999 12.4129 12.4129 12.5639 12.5639 13.1203 13.1203 15.2119 15.2119 15.4262 15.4262 16.0308 16.0308 20.7363 20.7363 k = 0.5000 0.2859 0.6062 ( 1824 PWs) bands (ev): -46.3596 -46.3596 -22.2328 -22.2328 -19.7699 -19.7699 -19.7453 -19.7453 4.4177 4.4177 5.5175 5.5175 9.7376 9.7376 9.8766 9.8766 12.4553 12.4553 12.5854 12.5854 13.2673 13.2673 15.1612 15.1612 15.4620 15.4620 16.0003 16.0003 20.7343 20.7343 k = 0.5000 0.2859 0.5914 ( 1828 PWs) bands (ev): -46.3601 -46.3601 -22.2313 -22.2313 -19.7666 -19.7666 -19.7450 -19.7450 4.3174 4.3174 5.5224 5.5224 9.7846 9.7846 9.8591 9.8591 12.4985 12.4985 12.6115 12.6115 13.3979 13.3979 15.1106 15.1106 15.5203 15.5203 15.9700 15.9700 20.7293 20.7293 k = 0.5000 0.2859 0.5766 ( 1824 PWs) bands (ev): -46.3606 -46.3606 -22.2298 -22.2298 -19.7631 -19.7631 -19.7447 -19.7447 4.2196 4.2196 5.5235 5.5235 9.8229 9.8229 9.8570 9.8570 12.5427 12.5427 12.6418 12.6418 13.5101 13.5101 15.0606 15.0606 15.6026 15.6026 15.9399 15.9399 20.7227 20.7227 k = 0.5000 0.2859 0.5618 ( 1824 PWs) bands (ev): -46.3611 -46.3611 -22.2282 -22.2282 -19.7596 -19.7596 -19.7444 -19.7444 4.1245 4.1245 5.5206 5.5206 9.8280 9.8280 9.8952 9.8952 12.5876 12.5876 12.6759 12.6759 13.6031 13.6031 15.0114 15.0114 15.7092 15.7092 15.9103 15.9103 20.7152 20.7152 k = 0.5000 0.2859 0.5470 ( 1820 PWs) bands (ev): -46.3615 -46.3615 -22.2267 -22.2267 -19.7561 -19.7561 -19.7441 -19.7441 4.0319 4.0319 5.5136 5.5136 9.8285 9.8285 9.9458 9.9458 12.6332 12.6332 12.7133 12.7133 13.6776 13.6776 14.9632 14.9632 15.8387 15.8387 15.8818 15.8818 20.7072 20.7072 k = 0.5000 0.2859 0.5323 ( 1818 PWs) bands (ev): -46.3620 -46.3620 -22.2251 -22.2251 -19.7525 -19.7525 -19.7437 -19.7437 3.9419 3.9419 5.5023 5.5023 9.8346 9.8346 9.9989 9.9989 12.6795 12.6795 12.7534 12.7534 13.7351 13.7351 14.9160 14.9160 15.8518 15.8518 15.9920 15.9920 20.6990 20.6990 k = 0.5000 0.2859 0.5175 ( 1818 PWs) bands (ev): -46.3625 -46.3625 -22.2235 -22.2235 -19.7489 -19.7489 -19.7434 -19.7434 3.8544 3.8544 5.4868 5.4868 9.8477 9.8477 10.0534 10.0534 12.7264 12.7264 12.7958 12.7958 13.7783 13.7783 14.8699 14.8699 15.8239 15.8239 16.1628 16.1628 20.6907 20.6907 k = 0.5000 0.2859 0.5027 ( 1820 PWs) bands (ev): -46.3630 -46.3630 -22.2219 -22.2219 -19.7454 -19.7454 -19.7430 -19.7430 3.7695 3.7695 5.4671 5.4671 9.8681 9.8681 10.1091 10.1091 12.7739 12.7739 12.8401 12.8401 13.8098 13.8098 14.8249 14.8249 15.7966 15.7966 16.3499 16.3499 20.6825 20.6825 k = 0.5000 0.2859 0.4879 ( 1820 PWs) bands (ev): -46.3635 -46.3635 -22.2204 -22.2204 -19.7429 -19.7429 -19.7415 -19.7415 3.6872 3.6872 5.4434 5.4434 9.8961 9.8961 10.1657 10.1657 12.8218 12.8218 12.8858 12.8858 13.8321 13.8321 14.7812 14.7812 15.7701 15.7701 16.5504 16.5504 20.6742 20.6742 k = 0.5000 0.2859 0.4731 ( 1820 PWs) bands (ev): -46.3640 -46.3640 -22.2188 -22.2188 -19.7424 -19.7424 -19.7379 -19.7379 3.6073 3.6073 5.4158 5.4158 9.9317 9.9317 10.2231 10.2231 12.8701 12.8701 12.9325 12.9325 13.8475 13.8475 14.7386 14.7386 15.7444 15.7444 16.7617 16.7617 20.6655 20.6655 k = 0.5000 0.2859 0.4583 ( 1812 PWs) bands (ev): -46.3644 -46.3644 -22.2171 -22.2171 -19.7420 -19.7420 -19.7343 -19.7343 3.5301 3.5301 5.3847 5.3847 9.9748 9.9748 10.2814 10.2814 12.9186 12.9186 12.9799 12.9799 13.8578 13.8578 14.6973 14.6973 15.7197 15.7197 16.9818 16.9818 20.6557 20.6557 k = 0.5000 0.2859 0.4436 ( 1806 PWs) bands (ev): -46.3648 -46.3648 -22.2155 -22.2155 -19.7416 -19.7416 -19.7306 -19.7306 3.4553 3.4553 5.3503 5.3503 10.0253 10.0253 10.3402 10.3402 12.9672 12.9672 13.0278 13.0278 13.8645 13.8645 14.6572 14.6572 15.6959 15.6959 17.2088 17.2088 20.6440 20.6440 k = 0.5000 0.2859 0.4288 ( 1802 PWs) bands (ev): -46.3652 -46.3652 -22.2139 -22.2139 -19.7412 -19.7412 -19.7270 -19.7270 3.3831 3.3831 5.3129 5.3129 10.0830 10.0830 10.3996 10.3996 13.0157 13.0157 13.0757 13.0757 13.8687 13.8687 14.6182 14.6182 15.6732 15.6732 17.4412 17.4412 20.6291 20.6291 k = 0.5000 0.2859 0.4140 ( 1806 PWs) bands (ev): -46.3658 -46.3658 -22.2124 -22.2124 -19.7408 -19.7408 -19.7234 -19.7234 3.3134 3.3134 5.2731 5.2731 10.1475 10.1475 10.4595 10.4595 13.0639 13.0639 13.1237 13.1237 13.8714 13.8714 14.5805 14.5805 15.6515 15.6515 17.6774 17.6774 20.6089 20.6089 k = 0.5000 0.2859 0.3992 ( 1806 PWs) bands (ev): -46.3663 -46.3663 -22.2109 -22.2109 -19.7404 -19.7404 -19.7199 -19.7199 3.2462 3.2462 5.2310 5.2310 10.2186 10.2186 10.5197 10.5197 13.1116 13.1116 13.1713 13.1713 13.8733 13.8733 14.5440 14.5440 15.6308 15.6308 17.9160 17.9160 20.5808 20.5808 k = 0.5000 0.2859 0.3844 ( 1806 PWs) bands (ev): -46.3668 -46.3668 -22.2094 -22.2094 -19.7401 -19.7401 -19.7163 -19.7163 3.1815 3.1815 5.1872 5.1872 10.2958 10.2958 10.5802 10.5802 13.1584 13.1584 13.2186 13.2186 13.8749 13.8749 14.5087 14.5087 15.6112 15.6112 18.1553 18.1553 20.5411 20.5411 k = 0.5000 0.2859 0.3696 ( 1804 PWs) bands (ev): -46.3672 -46.3672 -22.2079 -22.2079 -19.7397 -19.7397 -19.7129 -19.7129 3.1193 3.1193 5.1420 5.1420 10.3788 10.3788 10.6408 10.6408 13.2043 13.2043 13.2653 13.2653 13.8765 13.8765 14.4746 14.4746 15.5926 15.5926 18.3935 18.3935 20.4862 20.4862 k = 0.5000 0.2859 0.3548 ( 1804 PWs) bands (ev): -46.3677 -46.3677 -22.2064 -22.2064 -19.7393 -19.7393 -19.7094 -19.7094 3.0596 3.0596 5.0959 5.0959 10.4672 10.4672 10.7014 10.7014 13.2489 13.2489 13.3115 13.3115 13.8785 13.8785 14.4416 14.4416 15.5749 15.5749 18.6275 18.6275 20.4166 20.4166 k = 0.5000 0.2859 0.3401 ( 1804 PWs) bands (ev): -46.3681 -46.3681 -22.2050 -22.2050 -19.7389 -19.7389 -19.7061 -19.7061 3.0024 3.0024 5.0491 5.0491 10.5604 10.5604 10.7620 10.7620 13.2919 13.2919 13.3571 13.3571 13.8810 13.8810 14.4098 14.4098 15.5580 15.5580 18.8527 18.8527 20.3344 20.3344 k = 0.5000 0.2859 0.3253 ( 1808 PWs) bands (ev): -46.3686 -46.3686 -22.2037 -22.2037 -19.7386 -19.7386 -19.7028 -19.7028 2.9476 2.9476 5.0020 5.0020 10.6578 10.6578 10.8227 10.8227 13.3332 13.3332 13.4021 13.4021 13.8843 13.8843 14.3791 14.3791 15.5418 15.5418 19.0612 19.0612 20.2347 20.2347 k = 0.5000 0.2859 0.3105 ( 1804 PWs) bands (ev): -46.3690 -46.3690 -22.2023 -22.2023 -19.7382 -19.7382 -19.6996 -19.6996 2.8953 2.8953 4.9550 4.9550 10.7586 10.7586 10.8836 10.8836 13.3726 13.3726 13.4463 13.4463 13.8884 13.8884 14.3495 14.3495 15.5262 15.5262 19.2390 19.2390 20.1138 20.1138 k = 0.5000 0.2859 0.2957 ( 1816 PWs) bands (ev): -46.3696 -46.3696 -22.2010 -22.2010 -19.7379 -19.7379 -19.6966 -19.6966 2.8455 2.8455 4.9084 4.9084 10.8609 10.8609 10.9462 10.9462 13.4100 13.4100 13.4897 13.4897 13.8934 13.8934 14.3211 14.3211 15.5109 15.5109 19.3659 19.3659 19.9756 19.9756 k = 0.5000 0.2859 0.2809 ( 1812 PWs) bands (ev): -46.3699 -46.3699 -22.1997 -22.1997 -19.7375 -19.7375 -19.6935 -19.6935 2.7982 2.7982 4.8624 4.8624 10.9579 10.9579 11.0164 11.0164 13.4453 13.4453 13.5321 13.5321 13.8993 13.8993 14.2938 14.2938 15.4958 15.4958 19.4258 19.4258 19.8262 19.8262 k = 0.5000 0.2859 0.2661 ( 1810 PWs) bands (ev): -46.3703 -46.3703 -22.1985 -22.1985 -19.7372 -19.7372 -19.6906 -19.6906 2.7533 2.7533 4.8174 4.8174 11.0353 11.0353 11.1080 11.1080 13.4787 13.4787 13.5735 13.5735 13.9060 13.9060 14.2676 14.2676 15.4806 15.4806 19.4208 19.4208 19.6739 19.6739 k = 0.5000 0.2859 0.2513 ( 1806 PWs) bands (ev): -46.3706 -46.3706 -22.1973 -22.1973 -19.7368 -19.7368 -19.6878 -19.6878 2.7109 2.7109 4.7736 4.7736 11.0973 11.0973 11.2161 11.2161 13.5103 13.5103 13.6136 13.6136 13.9135 13.9135 14.2426 14.2426 15.4650 15.4650 19.3586 19.3586 19.5349 19.5349 k = 0.5000 0.2859 0.2366 ( 1806 PWs) bands (ev): -46.3709 -46.3709 -22.1962 -22.1962 -19.7365 -19.7365 -19.6851 -19.6851 2.6709 2.6709 4.7312 4.7312 11.1538 11.1538 11.3298 11.3298 13.5401 13.5401 13.6523 13.6523 13.9217 13.9217 14.2187 14.2187 15.4487 15.4487 19.2397 19.2397 19.4288 19.4288 k = 0.5000 0.2859 0.2218 ( 1806 PWs) bands (ev): -46.3713 -46.3713 -22.1951 -22.1951 -19.7362 -19.7362 -19.6825 -19.6825 2.6334 2.6334 4.6905 4.6905 11.2073 11.2073 11.4460 11.4460 13.5685 13.5685 13.6894 13.6894 13.9305 13.9305 14.1961 14.1961 15.4313 15.4313 19.0865 19.0865 19.3464 19.3464 k = 0.5000 0.2859 0.2070 ( 1810 PWs) bands (ev): -46.3717 -46.3717 -22.1941 -22.1941 -19.7359 -19.7359 -19.6801 -19.6801 2.5983 2.5983 4.6515 4.6515 11.2585 11.2585 11.5630 11.5630 13.5955 13.5955 13.7247 13.7247 13.9399 13.9399 14.1748 14.1748 15.4125 15.4125 18.9231 18.9231 19.2718 19.2718 k = 0.5000 0.2859 0.1922 ( 1816 PWs) bands (ev): -46.3721 -46.3721 -22.1932 -22.1932 -19.7357 -19.7357 -19.6779 -19.6779 2.5657 2.5657 4.6146 4.6146 11.3074 11.3074 11.6799 11.6799 13.6216 13.6216 13.7581 13.7581 13.9497 13.9497 14.1549 14.1549 15.3919 15.3919 18.7591 18.7591 19.2005 19.2005 k = 0.5000 0.2859 0.1774 ( 1814 PWs) bands (ev): -46.3723 -46.3723 -22.1923 -22.1923 -19.7354 -19.7354 -19.6757 -19.6757 2.5354 2.5354 4.5798 4.5798 11.3538 11.3538 11.7958 11.7958 13.6468 13.6468 13.7893 13.7893 13.9599 13.9599 14.1365 14.1365 15.3692 15.3692 18.5985 18.5985 19.1322 19.1322 k = 0.5000 0.2859 0.1626 ( 1814 PWs) bands (ev): -46.3726 -46.3726 -22.1915 -22.1915 -19.7352 -19.7352 -19.6737 -19.6737 2.5076 2.5076 4.5473 4.5473 11.3977 11.3977 11.9095 11.9095 13.6715 13.6715 13.8182 13.8182 13.9702 13.9702 14.1198 14.1198 15.3440 15.3440 18.4440 18.4440 19.0672 19.0672 k = 0.5000 0.2859 0.1479 ( 1818 PWs) bands (ev): -46.3729 -46.3729 -22.1908 -22.1908 -19.7350 -19.7350 -19.6719 -19.6719 2.4823 2.4823 4.5173 4.5173 11.4386 11.4386 12.0200 12.0200 13.6958 13.6958 13.8445 13.8445 13.9805 13.9805 14.1050 14.1050 15.3160 15.3160 18.2973 18.2973 19.0062 19.0062 k = 0.5000 0.2859 0.1331 ( 1814 PWs) bands (ev): -46.3730 -46.3730 -22.1900 -22.1900 -19.7348 -19.7348 -19.6702 -19.6702 2.4594 2.4594 4.4898 4.4898 11.4766 11.4766 12.1260 12.1260 13.7200 13.7200 13.8682 13.8682 13.9907 13.9907 14.0926 14.0926 15.2852 15.2852 18.1601 18.1601 18.9496 18.9496 k = 0.5000 0.2859 0.1183 ( 1818 PWs) bands (ev): -46.3733 -46.3733 -22.1894 -22.1894 -19.7346 -19.7346 -19.6687 -19.6687 2.4388 2.4388 4.4649 4.4649 11.5113 11.5113 12.2262 12.2262 13.7441 13.7441 13.8888 13.8888 14.0005 14.0005 14.0831 14.0831 15.2516 15.2516 18.0336 18.0336 18.8979 18.8979 k = 0.5000 0.2859 0.1035 ( 1818 PWs) bands (ev): -46.3735 -46.3735 -22.1889 -22.1889 -19.7344 -19.7344 -19.6674 -19.6674 2.4207 2.4207 4.4428 4.4428 11.5425 11.5425 12.3192 12.3192 13.7678 13.7678 13.9064 13.9064 14.0096 14.0096 14.0770 14.0770 15.2156 15.2156 17.9193 17.9193 18.8514 18.8514 k = 0.5000 0.2859 0.0887 ( 1820 PWs) bands (ev): -46.3737 -46.3737 -22.1884 -22.1884 -19.7343 -19.7343 -19.6662 -19.6662 2.4051 2.4051 4.4234 4.4234 11.5701 11.5701 12.4034 12.4034 13.7908 13.7908 13.9205 13.9205 14.0174 14.0174 14.0753 14.0753 15.1779 15.1779 17.8181 17.8181 18.8105 18.8105 k = 0.5000 0.2859 0.0739 ( 1816 PWs) bands (ev): -46.3737 -46.3737 -22.1880 -22.1880 -19.7342 -19.7342 -19.6652 -19.6652 2.3918 2.3918 4.4070 4.4070 11.5937 11.5937 12.4775 12.4775 13.8124 13.8124 13.9312 13.9312 14.0238 14.0238 14.0782 14.0782 15.1398 15.1398 17.7310 17.7310 18.7754 18.7754 k = 0.5000 0.2859 0.0591 ( 1816 PWs) bands (ev): -46.3738 -46.3738 -22.1876 -22.1876 -19.7341 -19.7341 -19.6643 -19.6643 2.3809 2.3809 4.3934 4.3934 11.6134 11.6134 12.5400 12.5400 13.8315 13.8315 13.9387 13.9387 14.0288 14.0288 14.0850 14.0850 15.1031 15.1031 17.6588 17.6588 18.7464 18.7464 k = 0.5000 0.2859 0.0444 ( 1814 PWs) bands (ev): -46.3739 -46.3739 -22.1874 -22.1874 -19.7340 -19.7340 -19.6637 -19.6637 2.3725 2.3725 4.3828 4.3828 11.6288 11.6288 12.5897 12.5897 13.8473 13.8473 13.9435 13.9435 14.0329 14.0329 14.0940 14.0940 15.0701 15.0701 17.6022 17.6022 18.7237 18.7237 k = 0.5000 0.2859 0.0296 ( 1814 PWs) bands (ev): -46.3739 -46.3739 -22.1872 -22.1872 -19.7339 -19.7339 -19.6632 -19.6632 2.3665 2.3665 4.3753 4.3753 11.6399 11.6399 12.6259 12.6259 13.8589 13.8589 13.9464 13.9464 14.0360 14.0360 14.1031 14.1031 15.0436 15.0436 17.5615 17.5615 18.7073 18.7073 k = 0.5000 0.2859 0.0148 ( 1814 PWs) bands (ev): -46.3740 -46.3740 -22.1871 -22.1871 -19.7339 -19.7339 -19.6630 -19.6630 2.3629 2.3629 4.3707 4.3707 11.6466 11.6466 12.6478 12.6478 13.8660 13.8660 13.9479 13.9479 14.0381 14.0381 14.1097 14.1097 15.0263 15.0263 17.5369 17.5369 18.6975 18.6975 k = 0.5000 0.2859-0.0000 ( 1810 PWs) bands (ev): -46.3739 -46.3739 -22.1870 -22.1870 -19.7339 -19.7339 -19.6628 -19.6628 2.3617 2.3617 4.3692 4.3692 11.6489 11.6489 12.6552 12.6552 13.8683 13.8683 13.9484 13.9484 14.0388 14.0388 14.1122 14.1122 15.0202 15.0202 17.5287 17.5287 18.6942 18.6942 k = 0.0000 0.0000 1.0074 ( 1802 PWs) bands (ev): -46.3517 -46.3517 -22.2554 -22.2554 -19.8205 -19.8205 -19.7487 -19.7487 5.0695 5.0695 8.0272 8.0272 8.2587 8.2587 9.0486 9.0486 10.3189 10.3189 11.8204 11.8204 13.5928 13.5928 16.3608 16.3608 16.5527 16.5527 17.2891 17.2891 17.5829 17.5829 k = 0.0125 0.0071 1.0074 ( 1806 PWs) bands (ev): -46.3518 -46.3518 -22.2554 -22.2554 -19.8205 -19.8205 -19.7487 -19.7487 5.0700 5.0700 8.0229 8.0229 8.2596 8.2596 9.0469 9.0469 10.3264 10.3264 11.8233 11.8233 13.5897 13.5897 16.3590 16.3590 16.5207 16.5207 17.3166 17.3166 17.5871 17.5871 k = 0.0250 0.0143 1.0074 ( 1810 PWs) bands (ev): -46.3518 -46.3518 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.0716 5.0716 8.0105 8.0105 8.2624 8.2624 9.0416 9.0416 10.3485 10.3485 11.8320 11.8320 13.5805 13.5805 16.3477 16.3477 16.4430 16.4430 17.3866 17.3866 17.6000 17.6000 k = 0.0375 0.0214 1.0074 ( 1810 PWs) bands (ev): -46.3518 -46.3518 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.0741 5.0741 7.9905 7.9905 8.2670 8.2670 9.0330 9.0330 10.3847 10.3847 11.8464 11.8464 13.5651 13.5651 16.2797 16.2797 16.3880 16.3880 17.4763 17.4763 17.6231 17.6231 k = 0.0500 0.0286 1.0074 ( 1804 PWs) bands (ev): -46.3517 -46.3517 -22.2554 -22.2554 -19.8205 -19.8205 -19.7487 -19.7487 5.0777 5.0777 7.9638 7.9638 8.2733 8.2733 9.0212 9.0212 10.4338 10.4338 11.8663 11.8663 13.5439 13.5439 16.1479 16.1479 16.3775 16.3775 17.5654 17.5654 17.6621 17.6621 k = 0.0625 0.0357 1.0074 ( 1812 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.0821 5.0821 7.9317 7.9317 8.2815 8.2815 9.0063 9.0063 10.4946 10.4946 11.8915 11.8915 13.5171 13.5171 15.9974 15.9974 16.3747 16.3747 17.6340 17.6340 17.7286 17.7286 k = 0.0750 0.0429 1.0074 ( 1816 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.0873 5.0873 7.8954 7.8954 8.2914 8.2914 8.9885 8.9885 10.5658 10.5658 11.9218 11.9218 13.4850 13.4850 15.8389 15.8389 16.3736 16.3736 17.6854 17.6854 17.8151 17.8151 k = 0.0875 0.0500 1.0074 ( 1816 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.0932 5.0932 7.8561 7.8561 8.3030 8.3030 8.9682 8.9682 10.6457 10.6457 11.9569 11.9569 13.4478 13.4478 15.6765 15.6765 16.3731 16.3731 17.7347 17.7347 17.9037 17.9037 k = 0.1000 0.0572 1.0074 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7489 -19.7489 5.0997 5.0997 7.8150 7.8150 8.3163 8.3163 8.9456 8.9456 10.7328 10.7328 11.9964 11.9964 13.4061 13.4061 15.5128 15.5128 16.3728 16.3728 17.7871 17.7871 17.9875 17.9875 k = 0.1125 0.0643 1.0074 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7489 -19.7489 5.1066 5.1066 7.7734 7.7734 8.3313 8.3313 8.9209 8.9209 10.8256 10.8256 12.0401 12.0401 13.3602 13.3602 15.3496 15.3496 16.3726 16.3726 17.8438 17.8438 18.0645 18.0645 k = 0.1250 0.0715 1.0074 ( 1812 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.1138 5.1138 7.7321 7.7321 8.3479 8.3479 8.8946 8.8946 10.9226 10.9226 12.0876 12.0876 13.3104 13.3104 15.1886 15.1886 16.3725 16.3725 17.9049 17.9049 18.1339 18.1339 k = 0.1375 0.0786 1.0074 ( 1812 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.1211 5.1211 7.6921 7.6921 8.3661 8.3661 8.8668 8.8668 11.0219 11.0219 12.1385 12.1385 13.2573 13.2573 15.0315 15.0315 16.3725 16.3725 17.9701 17.9701 18.1957 18.1957 k = 0.1500 0.0858 1.0074 ( 1812 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.1283 5.1283 7.6543 7.6543 8.3858 8.3858 8.8379 8.8379 11.1220 11.1220 12.1925 12.1925 13.2011 13.2011 14.8799 14.8799 16.3725 16.3725 18.0390 18.0390 18.2502 18.2502 k = 0.1625 0.0929 1.0074 ( 1812 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.1353 5.1353 7.6192 7.6192 8.4069 8.4069 8.8081 8.8081 11.2207 11.2207 12.2492 12.2492 13.1424 13.1424 14.7359 14.7359 16.3725 16.3725 18.1108 18.1108 18.2982 18.2982 k = 0.1750 0.1001 1.0074 ( 1814 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8205 -19.8205 -19.7488 -19.7488 5.1418 5.1418 7.5876 7.5876 8.4295 8.4295 8.7776 8.7776 11.3158 11.3158 12.3083 12.3083 13.0816 13.0816 14.6016 14.6016 16.3725 16.3725 18.1839 18.1839 18.3413 18.3413 k = 0.1875 0.1072 1.0074 ( 1814 PWs) bands (ev): -46.3519 -46.3519 -22.2555 -22.2555 -19.8206 -19.8206 -19.7488 -19.7488 5.1477 5.1477 7.5599 7.5599 8.4533 8.4533 8.7468 8.7468 11.4046 11.4046 12.3694 12.3694 13.0189 13.0189 14.4797 14.4797 16.3725 16.3725 18.2550 18.2550 18.3829 18.3829 k = 0.2000 0.1143 1.0074 ( 1828 PWs) bands (ev): -46.3522 -46.3522 -22.2556 -22.2556 -19.8207 -19.8207 -19.7488 -19.7488 5.1527 5.1527 7.5367 7.5367 8.4784 8.4784 8.7159 8.7159 11.4843 11.4843 12.4322 12.4322 12.9549 12.9549 14.3729 14.3729 16.3725 16.3725 18.3165 18.3165 18.4307 18.4307 k = 0.2125 0.1215 1.0074 ( 1826 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7488 -19.7488 5.1569 5.1569 7.5182 7.5182 8.5044 8.5044 8.6851 8.6851 11.5515 11.5515 12.4962 12.4962 12.8898 12.8898 14.2848 14.2848 16.3725 16.3725 18.3591 18.3591 18.4940 18.4940 k = 0.2250 0.1286 1.0074 ( 1826 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8207 -19.8207 -19.7488 -19.7488 5.1599 5.1599 7.5048 7.5048 8.5313 8.5313 8.6548 8.6548 11.6027 11.6027 12.5612 12.5612 12.8241 12.8241 14.2185 14.2185 16.3725 16.3725 18.3836 18.3836 18.5711 18.5711 k = 0.2375 0.1358 1.0074 ( 1826 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8207 -19.8207 -19.7488 -19.7488 5.1618 5.1618 7.4966 7.4966 8.5581 8.5581 8.6260 8.6260 11.6349 11.6349 12.6267 12.6267 12.7582 12.7582 14.1773 14.1773 16.3725 16.3725 18.3962 18.3962 18.6537 18.6537 k = 0.2500 0.1429 1.0074 ( 1824 PWs) bands (ev): -46.3521 -46.3521 -22.2556 -22.2556 -19.8206 -19.8206 -19.7488 -19.7488 5.1624 5.1624 7.4939 7.4939 8.5768 8.5768 8.6065 8.6065 11.6459 11.6459 12.6832 12.6832 12.7015 12.7015 14.1632 14.1632 16.3725 16.3725 18.4001 18.4001 18.7119 18.7119 Writing output data file Ge2Mo.save init_run : 0.14s CPU 0.27s WALL ( 1 calls) electrons : 78.20s CPU 79.56s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 78.20s CPU 79.55s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.02s WALL ( 434 calls) cegterg : 69.84s CPU 70.85s WALL ( 475 calls) Called by sum_band: Called by *egterg: h_psi : 52.31s CPU 53.04s WALL ( 7069 calls) s_psi : 0.78s CPU 0.82s WALL ( 7069 calls) g_psi : 0.08s CPU 0.07s WALL ( 6160 calls) cdiaghg : 20.11s CPU 20.63s WALL ( 6594 calls) cegterg:over : 1.51s CPU 1.50s WALL ( 6160 calls) cegterg:upda : 1.08s CPU 1.01s WALL ( 6160 calls) cegterg:last : 0.63s CPU 0.63s WALL ( 1304 calls) cdiaghg:chol : 1.07s CPU 1.06s WALL ( 6594 calls) cdiaghg:inve : 0.40s CPU 0.44s WALL ( 6594 calls) cdiaghg:para : 1.24s CPU 1.28s WALL ( 13188 calls) Called by h_psi: h_psi:vloc : 50.27s CPU 50.92s WALL ( 7069 calls) h_psi:vnl : 2.02s CPU 2.08s WALL ( 7069 calls) add_vuspsi : 1.06s CPU 1.05s WALL ( 7069 calls) General routines calbec : 0.96s CPU 1.01s WALL ( 7069 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 47.60s CPU 48.29s WALL ( 480900 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.10s CPU 0.15s WALL ( 868 calls) Parallel routines fft_scatter : 15.48s CPU 15.65s WALL ( 480923 calls) PWSCF : 1m28.09s CPU 1m47.94s WALL This run was terminated on: 19: 6: 9 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=