Program PWSCF v.5.4.0 starts on 28Mar2017 at 18:52:10 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 & OpenMP), running on 144 processor cores Number of MPI processes: 72 Threads/MPI process: 2 R & G space division: proc/nbgrp/npool/nimage = 72 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: ./Tl4SiS4.save/ file Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 6S 5D 5D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 58 49 13 2378 1862 266 Max 59 50 14 2383 1893 272 Sum 4215 3591 981 171379 135069 19381 bravais-lattice index = 14 lattice parameter (alat) = 15.8968 a.u. unit-cell volume = 3312.0478 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 3 number of electrons = 160.00 number of Kohn-Sham states= 192 kinetic-energy cutoff = 45.0000 Ry charge density cutoff = 211.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 15.896752 celldm(2)= 1.000000 celldm(3)= 0.899527 celldm(4)= 0.288327 celldm(5)= 0.288327 celldm(6)= 0.107186 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.107186 0.994239 0.000000 ) a(3) = ( 0.259357 0.232900 0.829241 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.107808 -0.282486 ) b(2) = ( 0.000000 1.005794 -0.282486 ) b(3) = ( 0.000000 0.000000 1.205922 ) PseudoPot. # 1 for S read from file: /users/gautes/Pseudo/S.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 95f1324244b600346090892298cb4451 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1151 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Tl read from file: /users/gautes/Pseudo/Tl.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: cd969aa200d2b9b89aab382fbbb9d684 Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1281 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 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 1141 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 S 6.00 32.06500 S( 1.00) Tl 13.00 204.38330 Tl( 1.00) Si 4.00 28.08550 Si( 1.00) No symmetry found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E Cartesian axes number of k points= 188 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 2) = ( 0.0178571 0.0160355 -0.0100888), wk = 0.0053191 k( 3) = ( 0.0357143 0.0320710 -0.0201776), wk = 0.0053191 k( 4) = ( 0.0535714 0.0481064 -0.0302664), wk = 0.0053191 k( 5) = ( 0.0714286 0.0641419 -0.0403552), wk = 0.0053191 k( 6) = ( 0.0892857 0.0801774 -0.0504440), wk = 0.0053191 k( 7) = ( 0.1071429 0.0962129 -0.0605328), wk = 0.0053191 k( 8) = ( 0.1250000 0.1122484 -0.0706216), wk = 0.0053191 k( 9) = ( 0.1428571 0.1282838 -0.0807104), wk = 0.0053191 k( 10) = ( 0.1607143 0.1443193 -0.0907992), wk = 0.0053191 k( 11) = ( 0.1785714 0.1603548 -0.1008880), wk = 0.0053191 k( 12) = ( 0.1964286 0.1763903 -0.1109767), wk = 0.0053191 k( 13) = ( 0.2142857 0.1924258 -0.1210655), wk = 0.0053191 k( 14) = ( 0.2321429 0.2084612 -0.1311543), wk = 0.0053191 k( 15) = ( 0.2500000 0.2244967 -0.1412431), wk = 0.0053191 k( 16) = ( 0.2678571 0.2405322 -0.1513319), wk = 0.0053191 k( 17) = ( 0.2857143 0.2565677 -0.1614207), wk = 0.0053191 k( 18) = ( 0.3035714 0.2726032 -0.1715095), wk = 0.0053191 k( 19) = ( 0.3214286 0.2886386 -0.1815983), wk = 0.0053191 k( 20) = ( 0.3392857 0.3046741 -0.1916871), wk = 0.0053191 k( 21) = ( 0.3571429 0.3207096 -0.2017759), wk = 0.0053191 k( 22) = ( 0.3750000 0.3367451 -0.2118647), wk = 0.0053191 k( 23) = ( 0.3928571 0.3527806 -0.2219535), wk = 0.0053191 k( 24) = ( 0.4107143 0.3688161 -0.2320423), wk = 0.0053191 k( 25) = ( 0.4285714 0.3848515 -0.2421311), wk = 0.0053191 k( 26) = ( 0.4464286 0.4008870 -0.2522199), wk = 0.0053191 k( 27) = ( 0.4642857 0.4169225 -0.2623087), wk = 0.0053191 k( 28) = ( 0.4821429 0.4329580 -0.2723975), wk = 0.0053191 k( 29) = ( 0.5000000 0.4489934 -0.2824863), wk = 0.0053191 k( 30) = ( 0.5000000 0.4489934 -0.2824863), wk = 0.0053191 k( 31) = ( 0.5077103 0.4559172 -0.2578343), wk = 0.0053191 k( 32) = ( 0.5154205 0.4628409 -0.2331824), wk = 0.0053191 k( 33) = ( 0.5231308 0.4697646 -0.2085305), wk = 0.0053191 k( 34) = ( 0.5308410 0.4766883 -0.1838786), wk = 0.0053191 k( 35) = ( 0.5385513 0.4836120 -0.1592267), wk = 0.0053191 k( 36) = ( 0.5462615 0.4905357 -0.1345748), wk = 0.0053191 k( 37) = ( 0.5539718 0.4974594 -0.1099228), wk = 0.0053191 k( 38) = ( 0.5616821 0.5043831 -0.0852709), wk = 0.0053191 k( 39) = ( 0.5693923 0.5113068 -0.0606190), wk = 0.0053191 k( 40) = ( 0.5771026 0.5182305 -0.0359671), wk = 0.0053191 k( 41) = ( 0.5848128 0.5251543 -0.0113152), wk = 0.0053191 k( 42) = ( 0.5925231 0.5320780 0.0133368), wk = 0.0053191 k( 43) = ( 0.6002333 0.5390017 0.0379887), wk = 0.0053191 k( 44) = ( 0.6002333 0.5390017 0.0379887), wk = 0.0053191 k( 45) = ( 0.5918806 0.5315010 0.0615292), wk = 0.0053191 k( 46) = ( 0.5835278 0.5240003 0.0850697), wk = 0.0053191 k( 47) = ( 0.5751750 0.5164996 0.1086103), wk = 0.0053191 k( 48) = ( 0.5668222 0.5089989 0.1321508), wk = 0.0053191 k( 49) = ( 0.5584695 0.5014982 0.1556913), wk = 0.0053191 k( 50) = ( 0.5501167 0.4939976 0.1792318), wk = 0.0053191 k( 51) = ( 0.5417639 0.4864969 0.2027723), wk = 0.0053191 k( 52) = ( 0.5334111 0.4789962 0.2263129), wk = 0.0053191 k( 53) = ( 0.5250583 0.4714955 0.2498534), wk = 0.0053191 k( 54) = ( 0.5167056 0.4639948 0.2733939), wk = 0.0053191 k( 55) = ( 0.5083528 0.4564941 0.2969344), wk = 0.0053191 k( 56) = ( 0.5000000 0.4489934 0.3204750), wk = 0.0053191 k( 57) = ( 0.5000000 0.4489934 0.3204750), wk = 0.0053191 k( 58) = ( 0.5164854 0.4306353 0.3204750), wk = 0.0053191 k( 59) = ( 0.5329707 0.4122772 0.3204750), wk = 0.0053191 k( 60) = ( 0.5494561 0.3939190 0.3204750), wk = 0.0053191 k( 61) = ( 0.5659415 0.3755609 0.3204750), wk = 0.0053191 k( 62) = ( 0.5824268 0.3572028 0.3204750), wk = 0.0053191 k( 63) = ( 0.5989122 0.3388446 0.3204750), wk = 0.0053191 k( 64) = ( 0.6153976 0.3204865 0.3204750), wk = 0.0053191 k( 65) = ( 0.6318829 0.3021283 0.3204750), wk = 0.0053191 k( 66) = ( 0.6483683 0.2837702 0.3204750), wk = 0.0053191 k( 67) = ( 0.6648537 0.2654121 0.3204750), wk = 0.0053191 k( 68) = ( 0.3351463 -0.3732196 0.6029612), wk = 0.0053191 k( 69) = ( 0.3175070 -0.3535765 0.6029612), wk = 0.0053191 k( 70) = ( 0.2998678 -0.3339333 0.6029612), wk = 0.0053191 k( 71) = ( 0.2822285 -0.3142902 0.6029612), wk = 0.0053191 k( 72) = ( 0.2645892 -0.2946471 0.6029612), wk = 0.0053191 k( 73) = ( 0.2469499 -0.2750039 0.6029612), wk = 0.0053191 k( 74) = ( 0.2293106 -0.2553608 0.6029612), wk = 0.0053191 k( 75) = ( 0.2116714 -0.2357176 0.6029612), wk = 0.0053191 k( 76) = ( 0.1940321 -0.2160745 0.6029612), wk = 0.0053191 k( 77) = ( 0.1763928 -0.1964314 0.6029612), wk = 0.0053191 k( 78) = ( 0.1587535 -0.1767882 0.6029612), wk = 0.0053191 k( 79) = ( 0.1411142 -0.1571451 0.6029612), wk = 0.0053191 k( 80) = ( 0.1234750 -0.1375020 0.6029612), wk = 0.0053191 k( 81) = ( 0.1058357 -0.1178588 0.6029612), wk = 0.0053191 k( 82) = ( 0.0881964 -0.0982157 0.6029612), wk = 0.0053191 k( 83) = ( 0.0705571 -0.0785725 0.6029612), wk = 0.0053191 k( 84) = ( 0.0529178 -0.0589294 0.6029612), wk = 0.0053191 k( 85) = ( 0.0352786 -0.0392863 0.6029612), wk = 0.0053191 k( 86) = ( 0.0176393 -0.0196431 0.6029612), wk = 0.0053191 k( 87) = ( 0.0000000 0.0000000 0.6029612), wk = 0.0053191 k( 88) = ( 0.0000000 0.0000000 0.6029612), wk = 0.0053191 k( 89) = ( 0.0190365 0.0170945 0.6029612), wk = 0.0053191 k( 90) = ( 0.0380730 0.0341891 0.6029612), wk = 0.0053191 k( 91) = ( 0.0571095 0.0512836 0.6029612), wk = 0.0053191 k( 92) = ( 0.0761460 0.0683781 0.6029612), wk = 0.0053191 k( 93) = ( 0.0951825 0.0854727 0.6029612), wk = 0.0053191 k( 94) = ( 0.1142191 0.1025672 0.6029612), wk = 0.0053191 k( 95) = ( 0.1332556 0.1196617 0.6029612), wk = 0.0053191 k( 96) = ( 0.1522921 0.1367563 0.6029612), wk = 0.0053191 k( 97) = ( 0.1713286 0.1538508 0.6029612), wk = 0.0053191 k( 98) = ( 0.1903651 0.1709453 0.6029612), wk = 0.0053191 k( 99) = ( 0.2094016 0.1880399 0.6029612), wk = 0.0053191 k( 100) = ( 0.2284381 0.2051344 0.6029612), wk = 0.0053191 k( 101) = ( 0.2474746 0.2222289 0.6029612), wk = 0.0053191 k( 102) = ( 0.2665111 0.2393235 0.6029612), wk = 0.0053191 k( 103) = ( 0.2855476 0.2564180 0.6029612), wk = 0.0053191 k( 104) = ( 0.3045841 0.2735125 0.6029612), wk = 0.0053191 k( 105) = ( 0.3236206 0.2906071 0.6029612), wk = 0.0053191 k( 106) = ( 0.3426571 0.3077016 0.6029612), wk = 0.0053191 k( 107) = ( 0.3616936 0.3247962 0.6029612), wk = 0.0053191 k( 108) = ( 0.3807301 0.3418907 0.6029612), wk = 0.0053191 k( 109) = ( 0.3997667 0.3589852 0.6029612), wk = 0.0053191 k( 110) = ( 0.5000000 0.4489934 -0.2824863), wk = 0.0053191 k( 111) = ( 0.5127823 0.4347591 -0.2824863), wk = 0.0053191 k( 112) = ( 0.4872177 -0.5425666 0.0000000), wk = 0.0053191 k( 113) = ( 0.4698171 -0.5231892 0.0000000), wk = 0.0053191 k( 114) = ( 0.4524164 -0.5038118 0.0000000), wk = 0.0053191 k( 115) = ( 0.4350158 -0.4844345 0.0000000), wk = 0.0053191 k( 116) = ( 0.4176152 -0.4650571 0.0000000), wk = 0.0053191 k( 117) = ( 0.4002145 -0.4456797 0.0000000), wk = 0.0053191 k( 118) = ( 0.3828139 -0.4263023 0.0000000), wk = 0.0053191 k( 119) = ( 0.3654133 -0.4069250 0.0000000), wk = 0.0053191 k( 120) = ( 0.3480126 -0.3875476 0.0000000), wk = 0.0053191 k( 121) = ( 0.3306120 -0.3681702 0.0000000), wk = 0.0053191 k( 122) = ( 0.3132114 -0.3487928 0.0000000), wk = 0.0053191 k( 123) = ( 0.2958108 -0.3294154 0.0000000), wk = 0.0053191 k( 124) = ( 0.2784101 -0.3100381 0.0000000), wk = 0.0053191 k( 125) = ( 0.2610095 -0.2906607 0.0000000), wk = 0.0053191 k( 126) = ( 0.2436088 -0.2712833 0.0000000), wk = 0.0053191 k( 127) = ( 0.2262082 -0.2519059 0.0000000), wk = 0.0053191 k( 128) = ( 0.2088076 -0.2325285 0.0000000), wk = 0.0053191 k( 129) = ( 0.1914070 -0.2131512 0.0000000), wk = 0.0053191 k( 130) = ( 0.1740063 -0.1937738 0.0000000), wk = 0.0053191 k( 131) = ( 0.1566057 -0.1743964 0.0000000), wk = 0.0053191 k( 132) = ( 0.1392051 -0.1550190 0.0000000), wk = 0.0053191 k( 133) = ( 0.1218044 -0.1356417 0.0000000), wk = 0.0053191 k( 134) = ( 0.1044038 -0.1162643 0.0000000), wk = 0.0053191 k( 135) = ( 0.0870032 -0.0968869 0.0000000), wk = 0.0053191 k( 136) = ( 0.0696025 -0.0775095 0.0000000), wk = 0.0053191 k( 137) = ( 0.0522019 -0.0581321 0.0000000), wk = 0.0053191 k( 138) = ( 0.0348013 -0.0387548 0.0000000), wk = 0.0053191 k( 139) = ( 0.0174006 -0.0193774 0.0000000), wk = 0.0053191 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 142) = ( 0.0250000 -0.0026952 -0.0070622), wk = 0.0053191 k( 143) = ( 0.0500000 -0.0053904 -0.0141243), wk = 0.0053191 k( 144) = ( 0.0750000 -0.0080856 -0.0211865), wk = 0.0053191 k( 145) = ( 0.1000000 -0.0107808 -0.0282486), wk = 0.0053191 k( 146) = ( 0.1250000 -0.0134759 -0.0353108), wk = 0.0053191 k( 147) = ( 0.1500000 -0.0161711 -0.0423729), wk = 0.0053191 k( 148) = ( 0.1750000 -0.0188663 -0.0494351), wk = 0.0053191 k( 149) = ( 0.2000000 -0.0215615 -0.0564973), wk = 0.0053191 k( 150) = ( 0.2250000 -0.0242567 -0.0635594), wk = 0.0053191 k( 151) = ( 0.2500000 -0.0269519 -0.0706216), wk = 0.0053191 k( 152) = ( 0.2750000 -0.0296471 -0.0776837), wk = 0.0053191 k( 153) = ( 0.3000000 -0.0323423 -0.0847459), wk = 0.0053191 k( 154) = ( 0.3250000 -0.0350375 -0.0918080), wk = 0.0053191 k( 155) = ( 0.3500000 -0.0377326 -0.0988702), wk = 0.0053191 k( 156) = ( 0.3750000 -0.0404278 -0.1059323), wk = 0.0053191 k( 157) = ( 0.4000000 -0.0431230 -0.1129945), wk = 0.0053191 k( 158) = ( 0.4250000 -0.0458182 -0.1200567), wk = 0.0053191 k( 159) = ( 0.4500000 -0.0485134 -0.1271188), wk = 0.0053191 k( 160) = ( 0.4750000 -0.0512086 -0.1341810), wk = 0.0053191 k( 161) = ( 0.5000000 -0.0539038 -0.1412431), wk = 0.0053191 k( 162) = ( 0.5000000 -0.0539038 0.4617181), wk = 0.0053191 k( 163) = ( 0.4807692 -0.0518306 0.4439597), wk = 0.0053191 k( 164) = ( 0.4615385 -0.0497573 0.4262013), wk = 0.0053191 k( 165) = ( 0.4423077 -0.0476841 0.4084429), wk = 0.0053191 k( 166) = ( 0.4230769 -0.0456109 0.3906845), wk = 0.0053191 k( 167) = ( 0.4038462 -0.0435377 0.3729261), wk = 0.0053191 k( 168) = ( 0.3846154 -0.0414644 0.3551678), wk = 0.0053191 k( 169) = ( 0.3653846 -0.0393912 0.3374094), wk = 0.0053191 k( 170) = ( 0.3461538 -0.0373180 0.3196510), wk = 0.0053191 k( 171) = ( 0.3269231 -0.0352448 0.3018926), wk = 0.0053191 k( 172) = ( 0.3076923 -0.0331716 0.2841342), wk = 0.0053191 k( 173) = ( 0.2884615 -0.0310983 0.2663758), wk = 0.0053191 k( 174) = ( 0.2692308 -0.0290251 0.2486174), wk = 0.0053191 k( 175) = ( 0.2500000 -0.0269519 0.2308590), wk = 0.0053191 k( 176) = ( 0.2307692 -0.0248787 0.2131007), wk = 0.0053191 k( 177) = ( 0.2115385 -0.0228054 0.1953423), wk = 0.0053191 k( 178) = ( 0.1923077 -0.0207322 0.1775839), wk = 0.0053191 k( 179) = ( 0.1730769 -0.0186590 0.1598255), wk = 0.0053191 k( 180) = ( 0.1538461 -0.0165858 0.1420671), wk = 0.0053191 k( 181) = ( 0.1346154 -0.0145126 0.1243087), wk = 0.0053191 k( 182) = ( 0.1153846 -0.0124393 0.1065503), wk = 0.0053191 k( 183) = ( 0.0961538 -0.0103661 0.0887919), wk = 0.0053191 k( 184) = ( 0.0769231 -0.0082929 0.0710336), wk = 0.0053191 k( 185) = ( 0.0576923 -0.0062197 0.0532752), wk = 0.0053191 k( 186) = ( 0.0384615 -0.0041464 0.0355168), wk = 0.0053191 k( 187) = ( 0.0192308 -0.0020732 0.0177584), wk = 0.0053191 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 2) = ( 0.0178571 0.0178571 0.0000000), wk = 0.0053191 k( 3) = ( 0.0357143 0.0357143 0.0000000), wk = 0.0053191 k( 4) = ( 0.0535714 0.0535714 -0.0000000), wk = 0.0053191 k( 5) = ( 0.0714286 0.0714286 -0.0000000), wk = 0.0053191 k( 6) = ( 0.0892857 0.0892857 -0.0000000), wk = 0.0053191 k( 7) = ( 0.1071429 0.1071429 -0.0000000), wk = 0.0053191 k( 8) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0053191 k( 9) = ( 0.1428571 0.1428571 -0.0000000), wk = 0.0053191 k( 10) = ( 0.1607143 0.1607143 -0.0000000), wk = 0.0053191 k( 11) = ( 0.1785714 0.1785714 -0.0000000), wk = 0.0053191 k( 12) = ( 0.1964286 0.1964286 0.0000000), wk = 0.0053191 k( 13) = ( 0.2142857 0.2142857 -0.0000000), wk = 0.0053191 k( 14) = ( 0.2321429 0.2321429 -0.0000000), wk = 0.0053191 k( 15) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0053191 k( 16) = ( 0.2678571 0.2678571 -0.0000000), wk = 0.0053191 k( 17) = ( 0.2857143 0.2857143 -0.0000000), wk = 0.0053191 k( 18) = ( 0.3035714 0.3035714 0.0000000), wk = 0.0053191 k( 19) = ( 0.3214286 0.3214286 -0.0000000), wk = 0.0053191 k( 20) = ( 0.3392857 0.3392857 0.0000000), wk = 0.0053191 k( 21) = ( 0.3571429 0.3571429 -0.0000000), wk = 0.0053191 k( 22) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0053191 k( 23) = ( 0.3928571 0.3928571 0.0000000), wk = 0.0053191 k( 24) = ( 0.4107143 0.4107143 -0.0000000), wk = 0.0053191 k( 25) = ( 0.4285714 0.4285714 -0.0000000), wk = 0.0053191 k( 26) = ( 0.4464286 0.4464286 -0.0000000), wk = 0.0053191 k( 27) = ( 0.4642857 0.4642857 -0.0000000), wk = 0.0053191 k( 28) = ( 0.4821429 0.4821429 0.0000000), wk = 0.0053191 k( 29) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 30) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 31) = ( 0.5077103 0.5077103 0.0240546), wk = 0.0053191 k( 32) = ( 0.5154205 0.5154205 0.0481092), wk = 0.0053191 k( 33) = ( 0.5231308 0.5231308 0.0721639), wk = 0.0053191 k( 34) = ( 0.5308410 0.5308410 0.0962185), wk = 0.0053191 k( 35) = ( 0.5385513 0.5385513 0.1202731), wk = 0.0053191 k( 36) = ( 0.5462615 0.5462615 0.1443277), wk = 0.0053191 k( 37) = ( 0.5539718 0.5539718 0.1683823), wk = 0.0053191 k( 38) = ( 0.5616821 0.5616821 0.1924369), wk = 0.0053191 k( 39) = ( 0.5693923 0.5693923 0.2164916), wk = 0.0053191 k( 40) = ( 0.5771026 0.5771026 0.2405462), wk = 0.0053191 k( 41) = ( 0.5848128 0.5848128 0.2646008), wk = 0.0053191 k( 42) = ( 0.5925231 0.5925231 0.2886554), wk = 0.0053191 k( 43) = ( 0.6002333 0.6002333 0.3127100), wk = 0.0053191 k( 44) = ( 0.6002333 0.6002333 0.3127100), wk = 0.0053191 k( 45) = ( 0.5918806 0.5918806 0.3283175), wk = 0.0053191 k( 46) = ( 0.5835278 0.5835278 0.3439250), wk = 0.0053191 k( 47) = ( 0.5751750 0.5751750 0.3595325), wk = 0.0053191 k( 48) = ( 0.5668222 0.5668222 0.3751400), wk = 0.0053191 k( 49) = ( 0.5584695 0.5584695 0.3907475), wk = 0.0053191 k( 50) = ( 0.5501167 0.5501167 0.4063550), wk = 0.0053191 k( 51) = ( 0.5417639 0.5417639 0.4219625), wk = 0.0053191 k( 52) = ( 0.5334111 0.5334111 0.4375700), wk = 0.0053191 k( 53) = ( 0.5250583 0.5250583 0.4531775), wk = 0.0053191 k( 54) = ( 0.5167056 0.5167056 0.4687850), wk = 0.0053191 k( 55) = ( 0.5083528 0.5083528 0.4843925), wk = 0.0053191 k( 56) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 57) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0053191 k( 58) = ( 0.5164854 0.4835146 0.5000000), wk = 0.0053191 k( 59) = ( 0.5329707 0.4670293 0.5000000), wk = 0.0053191 k( 60) = ( 0.5494561 0.4505439 0.5000000), wk = 0.0053191 k( 61) = ( 0.5659415 0.4340585 0.5000000), wk = 0.0053191 k( 62) = ( 0.5824268 0.4175732 0.5000000), wk = 0.0053191 k( 63) = ( 0.5989122 0.4010878 0.5000000), wk = 0.0053191 k( 64) = ( 0.6153976 0.3846024 0.5000000), wk = 0.0053191 k( 65) = ( 0.6318829 0.3681171 0.5000000), wk = 0.0053191 k( 66) = ( 0.6483683 0.3516317 0.5000000), wk = 0.0053191 k( 67) = ( 0.6648537 0.3351463 0.5000000), wk = 0.0053191 k( 68) = ( 0.3351463 -0.3351463 0.5000000), wk = 0.0053191 k( 69) = ( 0.3175070 -0.3175070 0.5000000), wk = 0.0053191 k( 70) = ( 0.2998678 -0.2998678 0.5000000), wk = 0.0053191 k( 71) = ( 0.2822285 -0.2822285 0.5000000), wk = 0.0053191 k( 72) = ( 0.2645892 -0.2645892 0.5000000), wk = 0.0053191 k( 73) = ( 0.2469499 -0.2469499 0.5000000), wk = 0.0053191 k( 74) = ( 0.2293106 -0.2293106 0.5000000), wk = 0.0053191 k( 75) = ( 0.2116714 -0.2116714 0.5000000), wk = 0.0053191 k( 76) = ( 0.1940321 -0.1940321 0.5000000), wk = 0.0053191 k( 77) = ( 0.1763928 -0.1763928 0.5000000), wk = 0.0053191 k( 78) = ( 0.1587535 -0.1587535 0.5000000), wk = 0.0053191 k( 79) = ( 0.1411142 -0.1411142 0.5000000), wk = 0.0053191 k( 80) = ( 0.1234750 -0.1234750 0.5000000), wk = 0.0053191 k( 81) = ( 0.1058357 -0.1058357 0.5000000), wk = 0.0053191 k( 82) = ( 0.0881964 -0.0881964 0.5000000), wk = 0.0053191 k( 83) = ( 0.0705571 -0.0705571 0.5000000), wk = 0.0053191 k( 84) = ( 0.0529178 -0.0529178 0.5000000), wk = 0.0053191 k( 85) = ( 0.0352786 -0.0352786 0.5000000), wk = 0.0053191 k( 86) = ( 0.0176393 -0.0176393 0.5000000), wk = 0.0053191 k( 87) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0053191 k( 88) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0053191 k( 89) = ( 0.0190365 0.0190365 0.5089186), wk = 0.0053191 k( 90) = ( 0.0380730 0.0380730 0.5178371), wk = 0.0053191 k( 91) = ( 0.0571095 0.0571095 0.5267557), wk = 0.0053191 k( 92) = ( 0.0761460 0.0761460 0.5356743), wk = 0.0053191 k( 93) = ( 0.0951825 0.0951825 0.5445929), wk = 0.0053191 k( 94) = ( 0.1142191 0.1142191 0.5535114), wk = 0.0053191 k( 95) = ( 0.1332556 0.1332556 0.5624300), wk = 0.0053191 k( 96) = ( 0.1522921 0.1522921 0.5713486), wk = 0.0053191 k( 97) = ( 0.1713286 0.1713286 0.5802671), wk = 0.0053191 k( 98) = ( 0.1903651 0.1903651 0.5891857), wk = 0.0053191 k( 99) = ( 0.2094016 0.2094016 0.5981043), wk = 0.0053191 k( 100) = ( 0.2284381 0.2284381 0.6070228), wk = 0.0053191 k( 101) = ( 0.2474746 0.2474746 0.6159414), wk = 0.0053191 k( 102) = ( 0.2665111 0.2665111 0.6248600), wk = 0.0053191 k( 103) = ( 0.2855476 0.2855476 0.6337786), wk = 0.0053191 k( 104) = ( 0.3045841 0.3045841 0.6426971), wk = 0.0053191 k( 105) = ( 0.3236206 0.3236206 0.6516157), wk = 0.0053191 k( 106) = ( 0.3426571 0.3426571 0.6605343), wk = 0.0053191 k( 107) = ( 0.3616936 0.3616936 0.6694528), wk = 0.0053191 k( 108) = ( 0.3807301 0.3807301 0.6783714), wk = 0.0053191 k( 109) = ( 0.3997667 0.3997667 0.6872900), wk = 0.0053191 k( 110) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0053191 k( 111) = ( 0.5127823 0.4872177 0.0000000), wk = 0.0053191 k( 112) = ( 0.4872177 -0.4872177 0.0000000), wk = 0.0053191 k( 113) = ( 0.4698171 -0.4698171 0.0000000), wk = 0.0053191 k( 114) = ( 0.4524164 -0.4524164 0.0000000), wk = 0.0053191 k( 115) = ( 0.4350158 -0.4350158 0.0000000), wk = 0.0053191 k( 116) = ( 0.4176152 -0.4176152 0.0000000), wk = 0.0053191 k( 117) = ( 0.4002145 -0.4002145 0.0000000), wk = 0.0053191 k( 118) = ( 0.3828139 -0.3828139 0.0000000), wk = 0.0053191 k( 119) = ( 0.3654133 -0.3654133 0.0000000), wk = 0.0053191 k( 120) = ( 0.3480126 -0.3480126 0.0000000), wk = 0.0053191 k( 121) = ( 0.3306120 -0.3306120 0.0000000), wk = 0.0053191 k( 122) = ( 0.3132114 -0.3132114 0.0000000), wk = 0.0053191 k( 123) = ( 0.2958108 -0.2958107 0.0000000), wk = 0.0053191 k( 124) = ( 0.2784101 -0.2784101 0.0000000), wk = 0.0053191 k( 125) = ( 0.2610095 -0.2610095 0.0000000), wk = 0.0053191 k( 126) = ( 0.2436088 -0.2436088 0.0000000), wk = 0.0053191 k( 127) = ( 0.2262082 -0.2262082 0.0000000), wk = 0.0053191 k( 128) = ( 0.2088076 -0.2088076 0.0000000), wk = 0.0053191 k( 129) = ( 0.1914070 -0.1914070 0.0000000), wk = 0.0053191 k( 130) = ( 0.1740063 -0.1740063 0.0000000), wk = 0.0053191 k( 131) = ( 0.1566057 -0.1566057 0.0000000), wk = 0.0053191 k( 132) = ( 0.1392051 -0.1392051 0.0000000), wk = 0.0053191 k( 133) = ( 0.1218044 -0.1218044 0.0000000), wk = 0.0053191 k( 134) = ( 0.1044038 -0.1044038 0.0000000), wk = 0.0053191 k( 135) = ( 0.0870032 -0.0870032 0.0000000), wk = 0.0053191 k( 136) = ( 0.0696025 -0.0696025 0.0000000), wk = 0.0053191 k( 137) = ( 0.0522019 -0.0522019 0.0000000), wk = 0.0053191 k( 138) = ( 0.0348013 -0.0348013 0.0000000), wk = 0.0053191 k( 139) = ( 0.0174006 -0.0174006 0.0000000), wk = 0.0053191 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 k( 142) = ( 0.0250000 -0.0000000 0.0000000), wk = 0.0053191 k( 143) = ( 0.0500000 -0.0000000 0.0000000), wk = 0.0053191 k( 144) = ( 0.0750000 -0.0000000 0.0000000), wk = 0.0053191 k( 145) = ( 0.1000000 -0.0000000 0.0000000), wk = 0.0053191 k( 146) = ( 0.1250000 -0.0000000 0.0000000), wk = 0.0053191 k( 147) = ( 0.1500000 -0.0000000 0.0000000), wk = 0.0053191 k( 148) = ( 0.1750000 -0.0000000 -0.0000000), wk = 0.0053191 k( 149) = ( 0.2000000 -0.0000000 0.0000000), wk = 0.0053191 k( 150) = ( 0.2250000 -0.0000000 0.0000000), wk = 0.0053191 k( 151) = ( 0.2500000 -0.0000000 0.0000000), wk = 0.0053191 k( 152) = ( 0.2750000 -0.0000000 0.0000000), wk = 0.0053191 k( 153) = ( 0.3000000 -0.0000000 0.0000000), wk = 0.0053191 k( 154) = ( 0.3250000 0.0000000 0.0000000), wk = 0.0053191 k( 155) = ( 0.3500000 -0.0000000 -0.0000000), wk = 0.0053191 k( 156) = ( 0.3750000 -0.0000000 0.0000000), wk = 0.0053191 k( 157) = ( 0.4000000 -0.0000000 0.0000000), wk = 0.0053191 k( 158) = ( 0.4250000 -0.0000000 0.0000000), wk = 0.0053191 k( 159) = ( 0.4500000 -0.0000000 0.0000000), wk = 0.0053191 k( 160) = ( 0.4750000 -0.0000000 -0.0000000), wk = 0.0053191 k( 161) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0053191 k( 162) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0053191 k( 163) = ( 0.4807692 -0.0000000 0.4807692), wk = 0.0053191 k( 164) = ( 0.4615385 -0.0000000 0.4615385), wk = 0.0053191 k( 165) = ( 0.4423077 -0.0000000 0.4423077), wk = 0.0053191 k( 166) = ( 0.4230769 -0.0000000 0.4230769), wk = 0.0053191 k( 167) = ( 0.4038462 -0.0000000 0.4038462), wk = 0.0053191 k( 168) = ( 0.3846154 -0.0000000 0.3846154), wk = 0.0053191 k( 169) = ( 0.3653846 -0.0000000 0.3653846), wk = 0.0053191 k( 170) = ( 0.3461538 -0.0000000 0.3461538), wk = 0.0053191 k( 171) = ( 0.3269231 -0.0000000 0.3269231), wk = 0.0053191 k( 172) = ( 0.3076923 -0.0000000 0.3076923), wk = 0.0053191 k( 173) = ( 0.2884615 -0.0000000 0.2884615), wk = 0.0053191 k( 174) = ( 0.2692308 -0.0000000 0.2692308), wk = 0.0053191 k( 175) = ( 0.2500000 -0.0000000 0.2500000), wk = 0.0053191 k( 176) = ( 0.2307692 -0.0000000 0.2307692), wk = 0.0053191 k( 177) = ( 0.2115385 -0.0000000 0.2115385), wk = 0.0053191 k( 178) = ( 0.1923077 -0.0000000 0.1923077), wk = 0.0053191 k( 179) = ( 0.1730769 0.0000000 0.1730769), wk = 0.0053191 k( 180) = ( 0.1538461 0.0000000 0.1538461), wk = 0.0053191 k( 181) = ( 0.1346154 -0.0000000 0.1346154), wk = 0.0053191 k( 182) = ( 0.1153846 -0.0000000 0.1153846), wk = 0.0053191 k( 183) = ( 0.0961538 -0.0000000 0.0961538), wk = 0.0053191 k( 184) = ( 0.0769231 -0.0000000 0.0769231), wk = 0.0053191 k( 185) = ( 0.0576923 -0.0000000 0.0576923), wk = 0.0053191 k( 186) = ( 0.0384615 -0.0000000 0.0384615), wk = 0.0053191 k( 187) = ( 0.0192308 -0.0000000 0.0192308), wk = 0.0053191 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0053191 Dense grid: 171379 G-vectors FFT dimensions: ( 75, 75, 72) Smooth grid: 135069 G-vectors FFT dimensions: ( 72, 72, 64) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.42 Mb ( 484, 192) NL pseudopotentials 2.26 Mb ( 242, 612) Each V/rho on FFT grid 0.09 Mb ( 5625) Each G-vector array 0.02 Mb ( 2381) G-vector shells 0.02 Mb ( 2353) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 5.67 Mb ( 484, 768) Each subspace H/S matrix 0.25 Mb ( 128, 128) Each matrix 3.59 Mb ( 612, 2, 192) The potential is recalculated from file : ./Tl4SiS4.save/charge-density.dat negative rho (up, down): 9.216E+01 0.000E+00 Starting wfc are 224 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 36.1 secs Computing kpt #: 2 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 68.0 secs Computing kpt #: 3 total cpu time spent up to now is 96.3 secs Computing kpt #: 4 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 130.0 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 162.9 secs Computing kpt #: 6 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 195.4 secs Computing kpt #: 7 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 226.9 secs Computing kpt #: 8 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 258.8 secs Computing kpt #: 9 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 290.9 secs Computing kpt #: 10 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 322.0 secs Computing kpt #: 11 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 354.4 secs Computing kpt #: 12 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 388.4 secs Computing kpt #: 13 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 419.5 secs Computing kpt #: 14 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 451.7 secs Computing kpt #: 15 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 484.4 secs Computing kpt #: 16 total cpu time spent up to now is 511.1 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 541.8 secs Computing kpt #: 18 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 571.5 secs Computing kpt #: 19 total cpu time spent up to now is 598.3 secs Computing kpt #: 20 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 632.9 secs Computing kpt #: 21 total cpu time spent up to now is 663.8 secs Computing kpt #: 22 total cpu time spent up to now is 695.1 secs Computing kpt #: 23 total cpu time spent up to now is 726.9 secs Computing kpt #: 24 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 759.0 secs Computing kpt #: 25 total cpu time spent up to now is 786.5 secs Computing kpt #: 26 total cpu time spent up to now is 815.2 secs Computing kpt #: 27 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 847.0 secs Computing kpt #: 28 total cpu time spent up to now is 874.8 secs Computing kpt #: 29 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 909.9 secs Computing kpt #: 30 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 944.6 secs Computing kpt #: 31 total cpu time spent up to now is 976.8 secs Computing kpt #: 32 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1008.8 secs Computing kpt #: 33 total cpu time spent up to now is 1036.1 secs Computing kpt #: 34 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1066.2 secs Computing kpt #: 35 total cpu time spent up to now is 1092.0 secs Computing kpt #: 36 total cpu time spent up to now is 1120.8 secs Computing kpt #: 37 total cpu time spent up to now is 1150.2 secs Computing kpt #: 38 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1182.2 secs Computing kpt #: 39 total cpu time spent up to now is 1213.3 secs Computing kpt #: 40 total cpu time spent up to now is 1244.0 secs Computing kpt #: 41 total cpu time spent up to now is 1271.1 secs Computing kpt #: 42 total cpu time spent up to now is 1301.9 secs Computing kpt #: 43 total cpu time spent up to now is 1328.5 secs Computing kpt #: 44 total cpu time spent up to now is 1355.1 secs Computing kpt #: 45 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1384.7 secs Computing kpt #: 46 total cpu time spent up to now is 1411.9 secs Computing kpt #: 47 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1444.8 secs Computing kpt #: 48 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1478.6 secs Computing kpt #: 49 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1511.4 secs Computing kpt #: 50 total cpu time spent up to now is 1539.3 secs Computing kpt #: 51 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1571.2 secs Computing kpt #: 52 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1602.9 secs Computing kpt #: 53 total cpu time spent up to now is 1635.0 secs Computing kpt #: 54 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1668.2 secs Computing kpt #: 55 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1707.0 secs Computing kpt #: 56 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1745.5 secs Computing kpt #: 57 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1783.4 secs Computing kpt #: 58 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1817.9 secs Computing kpt #: 59 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1853.9 secs Computing kpt #: 60 total cpu time spent up to now is 1884.2 secs Computing kpt #: 61 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1920.3 secs Computing kpt #: 62 total cpu time spent up to now is 1950.0 secs Computing kpt #: 63 total cpu time spent up to now is 1979.9 secs Computing kpt #: 64 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2018.6 secs Computing kpt #: 65 total cpu time spent up to now is 2048.1 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2082.4 secs Computing kpt #: 67 total cpu time spent up to now is 2113.2 secs Computing kpt #: 68 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2147.8 secs Computing kpt #: 69 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2182.1 secs Computing kpt #: 70 total cpu time spent up to now is 2211.2 secs Computing kpt #: 71 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2244.9 secs Computing kpt #: 72 total cpu time spent up to now is 2274.0 secs Computing kpt #: 73 total cpu time spent up to now is 2301.8 secs Computing kpt #: 74 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2337.0 secs Computing kpt #: 75 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2373.0 secs Computing kpt #: 76 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2415.1 secs Computing kpt #: 77 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2448.8 secs Computing kpt #: 78 total cpu time spent up to now is 2479.0 secs Computing kpt #: 79 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2517.1 secs Computing kpt #: 80 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2551.3 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2584.7 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2619.4 secs Computing kpt #: 83 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2651.9 secs Computing kpt #: 84 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2684.1 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2719.4 secs Computing kpt #: 86 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2756.1 secs Computing kpt #: 87 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 2793.0 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2827.7 secs Computing kpt #: 89 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 2863.8 secs Computing kpt #: 90 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2898.5 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2932.1 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2964.8 secs Computing kpt #: 93 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2998.5 secs Computing kpt #: 94 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3034.8 secs Computing kpt #: 95 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3073.3 secs Computing kpt #: 96 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3108.9 secs Computing kpt #: 97 total cpu time spent up to now is 3138.7 secs Computing kpt #: 98 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3172.5 secs Computing kpt #: 99 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3208.0 secs Computing kpt #: 100 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3242.2 secs Computing kpt #: 101 total cpu time spent up to now is 3273.6 secs Computing kpt #: 102 total cpu time spent up to now is 3305.7 secs Computing kpt #: 103 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3343.9 secs Computing kpt #: 104 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3380.9 secs Computing kpt #: 105 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3415.6 secs Computing kpt #: 106 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3450.6 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3486.0 secs Computing kpt #: 108 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 3520.2 secs Computing kpt #: 109 total cpu time spent up to now is 3549.7 secs Computing kpt #: 110 total cpu time spent up to now is 3581.7 secs Computing kpt #: 111 total cpu time spent up to now is 3617.4 secs Computing kpt #: 112 total cpu time spent up to now is 3650.9 secs Computing kpt #: 113 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3687.4 secs Computing kpt #: 114 total cpu time spent up to now is 3719.8 secs Computing kpt #: 115 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 3754.5 secs Computing kpt #: 116 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3789.6 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3823.6 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3859.1 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3895.5 secs Computing kpt #: 120 total cpu time spent up to now is 3931.9 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 3967.3 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4002.8 secs Computing kpt #: 123 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4036.7 secs Computing kpt #: 124 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4069.7 secs Computing kpt #: 125 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4102.9 secs Computing kpt #: 126 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4136.9 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4171.9 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4210.2 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4246.6 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4280.7 secs Computing kpt #: 131 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4316.2 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 4350.0 secs Computing kpt #: 133 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4383.9 secs Computing kpt #: 134 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4421.7 secs Computing kpt #: 135 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4458.9 secs Computing kpt #: 136 total cpu time spent up to now is 4492.0 secs Computing kpt #: 137 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4526.0 secs Computing kpt #: 138 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4559.3 secs Computing kpt #: 139 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4592.3 secs Computing kpt #: 140 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4626.3 secs Computing kpt #: 141 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 4660.3 secs Computing kpt #: 142 total cpu time spent up to now is 4689.4 secs Computing kpt #: 143 total cpu time spent up to now is 4718.9 secs Computing kpt #: 144 total cpu time spent up to now is 4750.4 secs Computing kpt #: 145 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4784.9 secs Computing kpt #: 146 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4820.1 secs Computing kpt #: 147 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4855.2 secs Computing kpt #: 148 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4888.1 secs Computing kpt #: 149 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4921.0 secs Computing kpt #: 150 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 4954.6 secs Computing kpt #: 151 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 4989.1 secs Computing kpt #: 152 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 5026.6 secs Computing kpt #: 153 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 5062.3 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5095.1 secs Computing kpt #: 155 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 5128.0 secs Computing kpt #: 156 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5163.0 secs Computing kpt #: 157 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5197.7 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5230.9 secs Computing kpt #: 159 total cpu time spent up to now is 5260.1 secs Computing kpt #: 160 total cpu time spent up to now is 5291.5 secs Computing kpt #: 161 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5323.0 secs Computing kpt #: 162 total cpu time spent up to now is 5351.8 secs Computing kpt #: 163 total cpu time spent up to now is 5379.9 secs Computing kpt #: 164 total cpu time spent up to now is 5409.7 secs Computing kpt #: 165 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5444.8 secs Computing kpt #: 166 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 5479.6 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5515.8 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5552.4 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5587.7 secs Computing kpt #: 170 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5622.5 secs Computing kpt #: 171 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5654.7 secs Computing kpt #: 172 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5685.3 secs Computing kpt #: 173 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5715.7 secs Computing kpt #: 174 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5745.9 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5778.9 secs Computing kpt #: 176 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5814.2 secs Computing kpt #: 177 total cpu time spent up to now is 5842.1 secs Computing kpt #: 178 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5873.6 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 5904.9 secs Computing kpt #: 180 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5936.3 secs Computing kpt #: 181 total cpu time spent up to now is 5962.2 secs Computing kpt #: 182 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 5990.9 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 6021.3 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 6052.2 secs Computing kpt #: 185 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 6084.4 secs Computing kpt #: 186 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 6115.5 secs Computing kpt #: 187 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 6146.2 secs Computing kpt #: 188 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 6176.1 secs ethr = 6.25E-09, avg # of iterations =111.1 total cpu time spent up to now is 6176.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 16835 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2960-150.2960-146.8960-146.8960-145.5402-145.5402-141.2394-141.2394 -137.5438-137.5438-134.2674-134.2674-134.2029-134.2029-128.2342-128.2342 -32.9916 -32.9916 -32.9291 -32.9291 -31.1786 -31.1786 -30.9919 -30.9919 -26.9142 -26.9142 -25.3519 -25.3519 -24.9006 -24.9006 -23.0059 -23.0059 -19.4829 -19.4829 -19.4375 -19.4375 -18.7732 -18.7732 -17.1566 -17.1566 -16.3722 -16.3722 -16.2548 -16.2548 -16.0475 -16.0475 -15.0198 -15.0198 -14.2554 -14.2554 -13.6330 -13.6330 -13.4262 -13.4262 -12.3692 -12.3692 -11.7407 -11.7407 -11.0495 -11.0495 -10.7258 -10.7258 -9.4189 -9.4189 -9.2609 -9.2609 -8.8458 -8.8458 -7.9898 -7.9898 -7.6494 -7.6494 -7.5187 -7.5187 -7.4042 -7.4042 -7.1341 -7.1341 -6.7672 -6.7672 -2.3895 -2.3895 -1.7276 -1.7276 -0.6431 -0.6431 -0.5236 -0.5236 -0.1725 -0.1725 0.2232 0.2232 0.3575 0.3575 0.6699 0.6699 0.7751 0.7751 0.9221 0.9221 1.0444 1.0444 1.4334 1.4334 1.7198 1.7198 1.8332 1.8332 2.0599 2.0599 2.2181 2.2181 2.4651 2.4651 2.6028 2.6028 2.6552 2.6552 2.9190 2.9190 2.9618 2.9618 3.1210 3.1210 3.1677 3.1677 3.3066 3.3066 3.5116 3.5116 3.7047 3.7047 3.9788 3.9788 4.1773 4.1773 4.3554 4.3554 4.5206 4.5206 4.6555 4.6555 4.8743 4.8743 5.1262 5.1262 5.2101 5.2101 5.4272 5.4272 5.6760 5.6760 6.1740 6.1740 6.2265 6.2265 6.4177 6.4177 6.6628 6.6628 6.7890 6.7890 6.9397 6.9397 7.2651 7.2651 7.3161 7.3161 7.3761 7.3761 7.6128 7.6128 7.7949 7.7949 7.9271 7.9271 k = 0.0179 0.0160-0.0101 ( 16842 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2985-150.2975-146.8981-146.8974-145.5423-145.5417-141.2420-141.2411 -137.5456-137.5451-134.2698-134.2690-134.2057-134.2043-128.2371-128.2361 -32.9943 -32.9929 -32.9353 -32.9349 -31.1815 -31.1806 -30.9967 -30.9952 -26.9178 -26.9175 -25.3554 -25.3552 -24.9048 -24.9032 -23.0097 -23.0083 -19.4848 -19.4842 -19.4402 -19.4394 -18.7765 -18.7762 -17.1590 -17.1587 -16.3749 -16.3732 -16.2566 -16.2561 -16.0504 -16.0493 -15.0219 -15.0215 -14.2578 -14.2567 -13.6351 -13.6349 -13.4278 -13.4276 -12.3710 -12.3709 -11.7429 -11.7423 -11.0513 -11.0510 -10.7286 -10.7270 -9.4209 -9.4185 -9.2627 -9.2606 -8.8464 -8.8454 -7.9900 -7.9896 -7.6496 -7.6492 -7.5194 -7.5181 -7.4050 -7.4036 -7.1343 -7.1341 -6.7673 -6.7671 -2.3908 -2.3880 -1.7287 -1.7264 -0.6496 -0.6377 -0.5266 -0.5192 -0.1795 -0.1655 0.2208 0.2247 0.3552 0.3589 0.6602 0.6786 0.7728 0.7781 0.9163 0.9289 1.0400 1.0496 1.4242 1.4397 1.7156 1.7243 1.8330 1.8344 2.0583 2.0607 2.2104 2.2263 2.4635 2.4665 2.6009 2.6042 2.6510 2.6607 2.9099 2.9236 2.9513 2.9706 3.1168 3.1260 3.1625 3.1721 3.3030 3.3092 3.5048 3.5155 3.6951 3.7131 3.9761 3.9840 4.1736 4.1818 4.3516 4.3604 4.5170 4.5239 4.6487 4.6613 4.8695 4.8780 5.1221 5.1302 5.2076 5.2138 5.4211 5.4320 5.6678 5.6832 6.1668 6.1788 6.2236 6.2304 6.4147 6.4210 6.6549 6.6691 6.7879 6.7912 6.9391 6.9412 7.2532 7.2745 7.3128 7.3197 7.3718 7.3808 7.6050 7.6203 7.7855 7.8041 7.9225 7.9327 k = 0.0357 0.0321-0.0202 ( 16845 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2993-150.2991-146.9011-146.9006-145.5456-145.5446-141.2417-141.2402 -137.5452-137.5444-134.2707-134.2704-134.2059-134.2036-128.2373-128.2356 -32.9985 -32.9980 -32.9335 -32.9329 -31.1843 -31.1830 -30.9986 -30.9982 -26.9193 -26.9191 -25.3571 -25.3565 -24.9069 -24.9053 -23.0119 -23.0105 -19.4849 -19.4843 -19.4400 -19.4397 -18.7761 -18.7756 -17.1606 -17.1603 -16.3773 -16.3768 -16.2572 -16.2567 -16.0509 -16.0493 -15.0228 -15.0224 -14.2583 -14.2580 -13.6358 -13.6355 -13.4277 -13.4275 -12.3719 -12.3717 -11.7429 -11.7423 -11.0504 -11.0498 -10.7291 -10.7273 -9.4216 -9.4173 -9.2638 -9.2591 -8.8470 -8.8449 -7.9902 -7.9894 -7.6495 -7.6487 -7.5203 -7.5177 -7.4058 -7.4031 -7.1345 -7.1342 -6.7675 -6.7671 -2.3918 -2.3862 -1.7299 -1.7253 -0.6573 -0.6338 -0.5270 -0.5127 -0.1862 -0.1583 0.2180 0.2254 0.3523 0.3598 0.6505 0.6857 0.7718 0.7823 0.9117 0.9366 1.0367 1.0556 1.4129 1.4437 1.7121 1.7289 1.8338 1.8367 2.0559 2.0612 2.2040 2.2346 2.4621 2.4681 2.5991 2.6053 2.6484 2.6672 2.8970 2.9223 2.9424 2.9760 3.1143 3.1313 3.1571 3.1757 3.2989 3.3105 3.4959 3.5160 3.6859 3.7199 3.9763 3.9916 4.1704 4.1866 4.3482 4.3663 4.5143 4.5278 4.6425 4.6670 4.8639 4.8806 5.1193 5.1341 5.2068 5.2190 5.4160 5.4374 5.6607 5.6904 6.1592 6.1817 6.2233 6.2363 6.4134 6.4256 6.6464 6.6747 6.7881 6.7953 6.9394 6.9436 7.2409 7.2818 7.3111 7.3251 7.3700 7.3866 7.5982 7.6287 7.7772 7.8132 7.9190 7.9399 k = 0.0536 0.0481-0.0303 ( 16857 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3031-150.3018-146.9060-146.9051-145.5501-145.5487-141.2465-141.2445 -137.5495-137.5494-134.2740-134.2734-134.2104-134.2069-128.2409-128.2384 -33.0064 -33.0058 -32.9397 -32.9384 -31.1919 -31.1890 -31.0053 -31.0049 -26.9249 -26.9246 -25.3636 -25.3626 -24.9122 -24.9092 -23.0179 -23.0145 -19.4886 -19.4882 -19.4452 -19.4449 -18.7779 -18.7770 -17.1653 -17.1649 -16.3811 -16.3804 -16.2609 -16.2603 -16.0543 -16.0510 -15.0251 -15.0249 -14.2628 -14.2624 -13.6386 -13.6380 -13.4315 -13.4308 -12.3737 -12.3734 -11.7462 -11.7455 -11.0530 -11.0519 -10.7330 -10.7294 -9.4237 -9.4174 -9.2658 -9.2591 -8.8477 -8.8446 -7.9904 -7.9892 -7.6494 -7.6481 -7.5212 -7.5174 -7.4068 -7.4028 -7.1348 -7.1343 -6.7676 -6.7670 -2.3924 -2.3842 -1.7311 -1.7242 -0.6652 -0.6318 -0.5257 -0.5047 -0.1932 -0.1522 0.2146 0.2248 0.3488 0.3600 0.6415 0.6907 0.7722 0.7873 0.9084 0.9447 1.0346 1.0625 1.3994 1.4453 1.7091 1.7328 1.8351 1.8403 2.0523 2.0615 2.1990 2.2419 2.4608 2.4700 2.5976 2.6060 2.6476 2.6739 2.8814 2.9132 2.9372 2.9771 3.1139 3.1357 3.1519 3.1780 3.2945 3.3096 3.4854 3.5124 3.6779 3.7245 3.9787 4.0004 4.1679 4.1914 4.3454 4.3726 4.5122 4.5306 4.6358 4.6719 4.8581 4.8828 5.1169 5.1367 5.2072 5.2253 5.4106 5.4418 5.6536 5.6970 6.1508 6.1822 6.2247 6.2428 6.4135 6.4308 6.6378 6.6794 6.7894 6.8006 6.9404 6.9467 7.2278 7.2861 7.3103 7.3311 7.3702 7.3923 7.5916 7.6367 7.7704 7.8213 7.9174 7.9492 k = 0.0714 0.0641-0.0404 ( 16867 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3068-150.3057-146.9105-146.9088-145.5541-145.5521-141.2488-141.2473 -137.5545-137.5530-134.2784-134.2765-134.2127-134.2095-128.2432-128.2414 -33.0123 -33.0118 -32.9466 -32.9439 -31.1964 -31.1948 -31.0117 -31.0100 -26.9323 -26.9295 -25.3695 -25.3669 -24.9155 -24.9140 -23.0208 -23.0191 -19.4927 -19.4919 -19.4492 -19.4485 -18.7801 -18.7793 -17.1684 -17.1678 -16.3835 -16.3820 -16.2641 -16.2620 -16.0562 -16.0546 -15.0288 -15.0280 -14.2664 -14.2653 -13.6414 -13.6408 -13.4332 -13.4327 -12.3776 -12.3751 -11.7491 -11.7486 -11.0564 -11.0548 -10.7350 -10.7329 -9.4248 -9.4175 -9.2677 -9.2584 -8.8484 -8.8444 -7.9905 -7.9890 -7.6491 -7.6475 -7.5222 -7.5173 -7.4079 -7.4026 -7.1352 -7.1345 -6.7677 -6.7670 -2.3928 -2.3820 -1.7322 -1.7232 -0.6730 -0.6316 -0.5226 -0.4952 -0.1998 -0.1458 0.2111 0.2230 0.3455 0.3601 0.6336 0.6932 0.7742 0.7929 0.9064 0.9530 1.0339 1.0701 1.3842 1.4446 1.7073 1.7366 1.8367 1.8452 2.0477 2.0620 2.1956 2.2478 2.4594 2.4723 2.5964 2.6068 2.6482 2.6796 2.8647 2.8989 2.9335 2.9743 3.1149 3.1382 3.1484 3.1790 3.2900 3.3067 3.4743 3.5048 3.6724 3.7270 3.9838 4.0112 4.1660 4.1964 4.3436 4.3798 4.5104 4.5341 4.6298 4.6762 4.8521 4.8838 5.1152 5.1385 5.2095 5.2327 5.4060 5.4464 5.6475 5.7027 6.1425 6.1809 6.2270 6.2497 6.4149 6.4365 6.6292 6.6831 6.7917 6.8074 6.9426 6.9509 7.2150 7.2879 7.3098 7.3365 7.3735 7.3976 7.5861 7.6444 7.7653 7.8280 7.9175 7.9600 k = 0.0893 0.0802-0.0504 ( 16861 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3061-150.3047-146.9078-146.9068-145.5507-145.5491-141.2478-141.2462 -137.5527-137.5523-134.2775-134.2756-134.2126-134.2086-128.2429-128.2401 -33.0072 -33.0064 -32.9431 -32.9411 -31.1942 -31.1931 -31.0069 -31.0056 -26.9272 -26.9248 -25.3660 -25.3638 -24.9123 -24.9102 -23.0179 -23.0159 -19.4912 -19.4901 -19.4480 -19.4475 -18.7786 -18.7780 -17.1654 -17.1649 -16.3802 -16.3796 -16.2626 -16.2609 -16.0542 -16.0526 -15.0281 -15.0272 -14.2641 -14.2632 -13.6398 -13.6391 -13.4331 -13.4326 -12.3767 -12.3744 -11.7479 -11.7471 -11.0549 -11.0533 -10.7334 -10.7309 -9.4254 -9.4162 -9.2680 -9.2569 -8.8490 -8.8443 -7.9905 -7.9887 -7.6486 -7.6467 -7.5233 -7.5172 -7.4090 -7.4025 -7.1356 -7.1348 -6.7678 -6.7669 -2.3928 -2.3796 -1.7332 -1.7222 -0.6798 -0.6323 -0.5173 -0.4835 -0.2060 -0.1393 0.2077 0.2200 0.3427 0.3603 0.6273 0.6936 0.7782 0.7995 0.9058 0.9614 1.0351 1.0787 1.3684 1.4423 1.7067 1.7406 1.8385 1.8518 2.0426 2.0632 2.1939 2.2517 2.4582 2.4759 2.5953 2.6083 2.6501 2.6836 2.8491 2.8820 2.9291 2.9686 3.1169 3.1369 3.1489 3.1782 3.2851 3.3021 3.4639 3.4952 3.6700 3.7284 3.9912 4.0239 4.1651 4.2015 4.3430 4.3885 4.5110 4.5383 4.6257 4.6805 4.8471 4.8846 5.1151 5.1405 5.2141 5.2424 5.4029 5.4514 5.6437 5.7088 6.1356 6.1800 6.2309 6.2577 6.4183 6.4430 6.6222 6.6867 6.7955 6.8159 6.9461 6.9566 7.2034 7.2894 7.3107 7.3421 7.3811 7.4036 7.5821 7.6521 7.7632 7.8333 7.9201 7.9722 k = 0.1071 0.0962-0.0605 ( 16877 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3126-150.3109-146.9148-146.9132-145.5570-145.5550-141.2524-141.2511 -137.5592-137.5585-134.2834-134.2812-134.2161-134.2129-128.2460-128.2439 -33.0181 -33.0169 -32.9527 -32.9500 -31.2020 -31.2004 -31.0176 -31.0158 -26.9359 -26.9330 -25.3740 -25.3712 -24.9189 -24.9178 -23.0244 -23.0234 -19.4971 -19.4960 -19.4541 -19.4538 -18.7826 -18.7819 -17.1705 -17.1699 -16.3846 -16.3831 -16.2664 -16.2638 -16.0595 -16.0581 -15.0325 -15.0315 -14.2697 -14.2685 -13.6438 -13.6431 -13.4358 -13.4351 -12.3803 -12.3778 -11.7518 -11.7513 -11.0597 -11.0580 -10.7369 -10.7353 -9.4266 -9.4167 -9.2699 -9.2564 -8.8495 -8.8443 -7.9906 -7.9886 -7.6482 -7.6461 -7.5243 -7.5173 -7.4102 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3.7267 4.0065 4.0492 4.1645 4.2093 4.3433 4.4055 4.5124 4.5427 4.6184 4.6848 4.8368 4.8818 5.1144 5.1405 5.2259 5.2626 5.3962 5.4586 5.6383 5.7174 6.1204 6.1740 6.2384 6.2697 6.4261 6.4559 6.6080 6.6898 6.8031 6.8337 6.9574 6.9724 7.1825 7.2893 7.3116 7.3499 7.3985 7.4133 7.5750 7.6625 7.7637 7.8347 7.9332 7.9948 k = 0.1429 0.1283-0.0807 ( 16886 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3142-150.3112-146.9183-146.9151-145.5603-145.5570-141.2568-141.2531 -137.5644-137.5625-134.2862-134.2821-134.2202-134.2152-128.2492-128.2469 -33.0250 -33.0204 -32.9602 -32.9550 -31.2072 -31.2018 -31.0252 -31.0202 -26.9407 -26.9374 -25.3793 -25.3750 -24.9237 -24.9196 -23.0302 -23.0264 -19.5003 -19.4990 -19.4566 -19.4554 -18.7854 -18.7839 -17.1724 -17.1714 -16.3867 -16.3823 -16.2712 -16.2671 -16.0627 -16.0583 -15.0343 -15.0334 -14.2720 -14.2682 -13.6481 -13.6471 -13.4388 -13.4372 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************************************************************************ ************************************************************************ -150.3159-150.3125-146.9204-146.9171-145.5622-145.5591-141.2596-141.2565 -137.5670-137.5650-134.2872-134.2834-134.2225-134.2180-128.2509-128.2492 -33.0280 -33.0230 -32.9658 -32.9610 -31.2107 -31.2053 -31.0290 -31.0238 -26.9433 -26.9404 -25.3824 -25.3786 -24.9271 -24.9231 -23.0333 -23.0298 -19.5016 -19.5005 -19.4601 -19.4587 -18.7871 -18.7857 -17.1750 -17.1740 -16.3890 -16.3839 -16.2726 -16.2691 -16.0644 -16.0601 -15.0353 -15.0347 -14.2749 -14.2709 -13.6500 -13.6490 -13.4411 -13.4394 -12.3838 -12.3814 -11.7565 -11.7558 -11.0645 -11.0615 -10.7418 -10.7381 -9.4291 -9.4164 -9.2724 -9.2544 -8.8506 -8.8446 -7.9906 -7.9881 -7.6468 -7.6443 -7.5270 -7.5181 -7.4139 -7.4038 -7.1373 -7.1359 -6.7685 -6.7669 -2.3901 -2.3696 -1.7360 -1.7193 -0.7012 -0.6439 -0.4923 -0.4317 -0.2273 -0.1217 0.1892 0.1967 0.3368 0.3630 0.6129 0.6788 0.8024 0.8221 0.9113 0.9829 1.0567 1.1123 1.3037 1.4074 1.7099 1.7635 1.8427 1.8873 2.0201 2.0739 2.1934 2.2427 2.4490 2.4965 2.5761 2.6117 2.6519 2.6761 2.8041 2.8300 2.9028 2.9355 3.1122 3.1251 3.1466 3.1557 3.2438 3.2811 3.4249 3.4589 3.6802 3.7237 4.0197 4.0732 4.1640 4.2123 4.3475 4.4220 4.5160 4.5465 4.6144 4.6867 4.8293 4.8774 5.1138 5.1423 5.2406 5.2834 5.3939 5.4664 5.6394 5.7245 6.1061 6.1664 6.2427 6.2768 6.4332 6.4715 6.5981 6.6901 6.8118 6.8510 6.9750 6.9948 7.1679 7.2860 7.3167 7.3573 7.4100 7.4284 7.5712 7.6695 7.7684 7.8284 7.9553 8.0085 k = 0.1786 0.1604-0.1009 ( 16893 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3154-150.3115-146.9209-146.9161-145.5626-145.5582-141.2608-141.2575 -137.5669-137.5652-134.2868-134.2822-134.2225-134.2173-128.2506-128.2487 -33.0292 -33.0231 -32.9666 -32.9603 -31.2102 -31.2044 -31.0303 -31.0232 -26.9430 -26.9400 -25.3822 -25.3776 -24.9279 -24.9236 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6.6900 6.8169 6.8587 6.9858 7.0085 7.1640 7.2839 7.3217 7.3611 7.4142 7.4380 7.5708 7.6724 7.7696 7.8247 7.9659 8.0129 k = 0.1964 0.1764-0.1110 ( 16894 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3153-150.3133-146.9211-146.9175-145.5630-145.5597-141.2612-141.2577 -137.5660-137.5652-134.2864-134.2836-134.2228-134.2181-128.2506-128.2492 -33.0282 -33.0239 -32.9668 -32.9630 -31.2091 -31.2043 -31.0299 -31.0252 -26.9452 -26.9436 -25.3811 -25.3785 -24.9288 -24.9252 -23.0358 -23.0325 -19.5020 -19.5010 -19.4587 -19.4575 -18.7891 -18.7880 -17.1745 -17.1734 -16.3884 -16.3835 -16.2724 -16.2706 -16.0664 -16.0622 -15.0328 -15.0323 -14.2740 -14.2704 -13.6511 -13.6503 -13.4418 -13.4405 -12.3818 -12.3804 -11.7555 -11.7549 -11.0657 -11.0632 -10.7415 -10.7377 -9.4290 -9.4157 -9.2715 -9.2530 -8.8507 -8.8449 -7.9904 -7.9880 -7.6466 -7.6438 -7.5279 -7.5185 -7.4165 -7.4054 -7.1380 -7.1361 -6.7688 -6.7670 -2.3873 -2.3649 -1.7363 -1.7184 -0.7051 -0.6486 -0.4781 -0.4069 -0.2338 -0.1194 0.1723 0.1922 0.3404 0.3666 0.6105 0.6673 0.8157 0.8321 0.9171 0.9873 1.0737 1.1260 1.2816 1.3772 1.7136 1.7796 1.8419 1.9080 2.0120 2.0831 2.1939 2.2282 2.4398 2.4981 2.5467 2.6043 2.6524 2.6748 2.7865 2.8392 2.8887 2.9227 3.0912 3.1109 3.1378 3.1431 3.2174 3.2729 3.4182 3.4508 3.6929 3.7240 4.0295 4.0924 4.1641 4.2094 4.3569 4.4345 4.5206 4.5514 4.6142 4.6867 4.8245 4.8713 5.1129 5.1472 5.2556 5.3017 5.3974 5.4777 5.6455 5.7314 6.0947 6.1584 6.2392 6.2792 6.4371 6.4909 6.5933 6.6897 6.8223 6.8653 6.9985 7.0240 7.1620 7.2813 7.3277 7.3642 7.4184 7.4476 7.5716 7.6757 7.7690 7.8216 7.9717 8.0184 k = 0.2143 0.1924-0.1211 ( 16894 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3140-150.3126-146.9226-146.9188-145.5648-145.5613-141.2623-141.2587 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3.7268 4.0326 4.0986 4.1641 4.2058 4.3635 4.4386 4.5229 4.5551 4.6150 4.6864 4.8231 4.8682 5.1125 5.1511 5.2621 5.3083 5.4012 5.4848 5.6493 5.7340 6.0897 6.1536 6.2330 6.2783 6.4385 6.5009 6.5931 6.6892 6.8277 6.8711 7.0120 7.0405 7.1620 7.2786 7.3343 7.3677 7.4232 7.4567 7.5733 7.6792 7.7670 7.8198 7.9729 8.0277 k = 0.2321 0.2085-0.1312 ( 16893 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3126-150.3121-146.9212-146.9181-145.5638-145.5606-141.2623-141.2589 -137.5659-137.5641-134.2835-134.2821-134.2229-134.2203-128.2510-128.2499 -33.0280 -33.0245 -32.9666 -32.9639 -31.2075 -31.2035 -31.0271 -31.0235 -26.9456 -26.9433 -25.3814 -25.3793 -24.9276 -24.9242 -23.0344 -23.0314 -19.5003 -19.4999 -19.4607 -19.4601 -18.7886 -18.7877 -17.1760 -17.1751 -16.3889 -16.3849 -16.2710 -16.2694 -16.0663 -16.0631 -15.0311 -15.0303 -14.2757 -14.2730 -13.6502 -13.6493 -13.4413 -13.4399 -12.3804 -12.3784 -11.7558 -11.7551 -11.0654 -11.0634 -10.7415 -10.7385 -9.4285 -9.4154 -9.2702 -9.2515 -8.8502 -8.8452 -7.9903 -7.9881 -7.6476 -7.6442 -7.5279 -7.5186 -7.4191 -7.4076 -7.1381 -7.1358 -6.7691 -6.7671 -2.3841 -2.3610 -1.7360 -1.7178 -0.7043 -0.6504 -0.4642 -0.3883 -0.2362 -0.1252 0.1581 0.1920 0.3466 0.3712 0.6097 0.6557 0.8231 0.8447 0.9226 0.9894 1.0859 1.1372 1.2716 1.3431 1.7171 1.7952 1.8396 1.9281 2.0074 2.0932 2.1922 2.2129 2.4215 2.4714 2.5238 2.6029 2.6561 2.6703 2.7921 2.8481 2.8759 2.9183 3.0555 3.0835 3.1262 3.1379 3.1960 3.2668 3.4231 3.4456 3.7046 3.7322 4.0344 4.1019 4.1634 4.2011 4.3704 4.4405 4.5258 4.5586 4.6162 4.6860 4.8221 4.8652 5.1122 5.1554 5.2676 5.3134 5.4076 5.4942 5.6536 5.7365 6.0852 6.1484 6.2238 6.2764 6.4403 6.5097 6.5948 6.6884 6.8328 6.8759 7.0261 7.0575 7.1643 7.2763 7.3411 7.3714 7.4295 7.4654 7.5759 7.6827 7.7637 7.8187 7.9727 8.0335 k = 0.2500 0.2245-0.1412 ( 16903 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3148-150.3144-146.9258-146.9231-145.5687-145.5659-141.2647-141.2619 -137.5678-137.5657-134.2853-134.2837-134.2249-134.2231-128.2528-128.2518 -33.0345 -33.0320 -32.9715 -32.9694 -31.2111 -31.2085 -31.0329 -31.0303 -26.9504 -26.9479 -25.3859 -25.3839 -24.9317 -24.9295 -23.0381 -23.0361 -19.5022 -19.5020 -19.4650 -19.4646 -18.7911 -18.7905 -17.1803 -17.1795 -16.3923 -16.3895 -16.2734 -16.2719 -16.0694 -16.0675 -15.0331 -15.0323 -14.2795 -14.2775 -13.6531 -13.6521 -13.4430 -13.4420 -12.3822 -12.3801 -11.7588 -11.7584 -11.0670 -11.0653 -10.7444 -10.7427 -9.4289 -9.4165 -9.2701 -9.2520 -8.8499 -8.8453 -7.9902 -7.9882 -7.6487 -7.6448 -7.5275 -7.5185 -7.4204 -7.4090 -7.1381 -7.1355 -6.7693 -6.7673 -2.3824 -2.3594 -1.7355 -1.7176 -0.7031 -0.6511 -0.4581 -0.3830 -0.2352 -0.1310 0.1533 0.1933 0.3498 0.3737 0.6089 0.6508 0.8245 0.8518 0.9244 0.9894 1.0883 1.1423 1.2703 1.3269 1.7182 1.8013 1.8384 1.9369 2.0065 2.0977 2.1897 2.2069 2.4059 2.4532 2.5161 2.6051 2.6563 2.6690 2.8000 2.8487 2.8705 2.9199 3.0374 3.0648 3.1198 3.1358 3.1887 3.2637 3.4287 3.4434 3.7093 3.7397 4.0349 4.1015 4.1614 4.1949 4.3772 4.4404 4.5279 4.5619 4.6173 4.6844 4.8203 4.8614 5.1120 5.1596 5.2714 5.3165 5.4147 5.5039 5.6579 5.7388 6.0805 6.1423 6.2113 6.2728 6.4423 6.5166 6.5978 6.6874 6.8374 6.8796 7.0399 7.0742 7.1682 7.2745 7.3471 7.3753 7.4369 7.4736 7.5794 7.6863 7.7595 7.8175 7.9719 8.0406 k = 0.2679 0.2405-0.1513 ( 16909 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3173-150.3165-146.9270-146.9254-145.5705-145.5684-141.2668-141.2633 -137.5668-137.5650-134.2872-134.2852-134.2273-134.2238-128.2539-128.2532 -33.0407 -33.0394 -32.9712 -32.9696 -31.2144 -31.2115 -31.0375 -31.0360 -26.9525 -26.9511 -25.3862 -25.3853 -24.9356 -24.9332 -23.0419 -23.0397 -19.5033 -19.5029 -19.4646 -19.4642 -18.7938 -18.7929 -17.1809 -17.1803 -16.3926 -16.3910 -16.2762 -16.2756 -16.0726 -16.0698 -15.0335 -15.0330 -14.2792 -14.2781 -13.6557 -13.6548 -13.4451 -13.4441 -12.3825 -12.3813 -11.7603 -11.7598 -11.0676 -11.0663 -10.7467 -10.7438 -9.4297 -9.4171 -9.2694 -9.2527 -8.8494 -8.8452 -7.9902 -7.9884 -7.6499 -7.6457 -7.5269 -7.5182 -7.4216 -7.4104 -7.1379 -7.1352 -6.7694 -6.7674 -2.3807 -2.3581 -1.7349 -1.7175 -0.7004 -0.6505 -0.4520 -0.3799 -0.2329 -0.1384 0.1504 0.1957 0.3534 0.3767 0.6072 0.6472 0.8251 0.8590 0.9256 0.9895 1.0880 1.1465 1.2702 1.3141 1.7186 1.8054 1.8379 1.9450 2.0067 2.1016 2.1856 2.2030 2.3867 2.4372 2.5090 2.6086 2.6551 2.6692 2.8093 2.8464 2.8666 2.9237 3.0214 3.0449 3.1134 3.1335 3.1835 3.2600 3.4345 3.4437 3.7141 3.7483 4.0342 4.0982 4.1580 4.1892 4.3839 4.4393 4.5304 4.5654 4.6196 4.6830 4.8184 4.8582 5.1129 5.1646 5.2747 5.3187 5.4232 5.5155 5.6625 5.7407 6.0762 6.1354 6.1961 6.2684 6.4450 6.5220 6.6016 6.6870 6.8418 6.8824 7.0537 7.0907 7.1736 7.2739 7.3531 7.3798 7.4465 7.4827 7.5839 7.6903 7.7554 7.8159 7.9720 8.0437 k = 0.2857 0.2566-0.1614 ( 16910 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3173-150.3166-146.9300-146.9278-145.5732-145.5707-141.2671-141.2633 -137.5651-137.5638-134.2873-134.2847-134.2279-134.2239-128.2549-128.2535 -33.0413 -33.0388 -32.9733 -32.9695 -31.2156 -31.2114 -31.0390 -31.0353 -26.9544 -26.9531 -25.3867 -25.3849 -24.9356 -24.9325 -23.0418 -23.0390 -19.5041 -19.5037 -19.4651 -19.4643 -18.7934 -18.7923 -17.1809 -17.1800 -16.3936 -16.3900 -16.2778 -16.2762 -16.0739 -16.0698 -15.0333 -15.0329 -14.2807 -14.2778 -13.6568 -13.6560 -13.4458 -13.4447 -12.3821 -12.3809 -11.7606 -11.7600 -11.0680 -11.0661 -10.7480 -10.7446 -9.4294 -9.4174 -9.2685 -9.2529 -8.8489 -8.8451 -7.9902 -7.9886 -7.6514 -7.6468 -7.5261 -7.5178 -7.4227 -7.4118 -7.1375 -7.1347 -6.7696 -6.7675 -2.3789 -2.3570 -1.7341 -1.7174 -0.6965 -0.6488 -0.4466 -0.3792 -0.2293 -0.1468 0.1493 0.1991 0.3574 0.3803 0.6039 0.6455 0.8251 0.8660 0.9261 0.9896 1.0856 1.1483 1.2694 1.3075 1.7184 1.8067 1.8386 1.9518 2.0078 2.1045 2.1798 2.2016 2.3665 2.4237 2.5021 2.6123 2.6534 2.6699 2.8187 2.8419 2.8637 2.9284 3.0078 3.0266 3.1068 3.1312 3.1799 3.2555 3.4370 3.4501 3.7195 3.7577 4.0327 4.0923 4.1534 4.1844 4.3911 4.4381 4.5334 4.5684 4.6221 4.6812 4.8166 4.8552 5.1146 5.1701 5.2776 5.3202 5.4335 5.5279 5.6673 5.7422 6.0723 6.1283 6.1800 6.2634 6.4482 6.5256 6.6066 6.6887 6.8465 6.8845 7.0669 7.1060 7.1803 7.2757 7.3589 7.3847 7.4579 7.4926 7.5898 7.6937 7.7512 7.8137 7.9737 8.0459 k = 0.3036 0.2726-0.1715 ( 16904 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3180-150.3161-146.9278-146.9232-145.5711-145.5663-141.2647-141.2607 -137.5625-137.5601-134.2880-134.2844-134.2256-134.2223-128.2533-128.2523 -33.0395 -33.0346 -32.9691 -32.9628 -31.2140 -31.2088 -31.0377 -31.0308 -26.9520 -26.9488 -25.3845 -25.3808 -24.9334 -24.9302 -23.0394 -23.0368 -19.5022 -19.5015 -19.4615 -19.4598 -18.7926 -18.7913 -17.1781 -17.1773 -16.3930 -16.3867 -16.2780 -16.2739 -16.0720 -16.0679 -15.0329 -15.0321 -14.2784 -14.2733 -13.6552 -13.6539 -13.4450 -13.4438 -12.3822 -12.3795 -11.7595 -11.7588 -11.0665 -11.0635 -10.7462 -10.7436 -9.4283 -9.4176 -9.2673 -9.2522 -8.8483 -8.8448 -7.9902 -7.9888 -7.6531 -7.6482 -7.5250 -7.5172 -7.4238 -7.4134 -7.1370 -7.1341 -6.7697 -6.7677 -2.3771 -2.3561 -1.7331 -1.7173 -0.6918 -0.6461 -0.4420 -0.3809 -0.2244 -0.1553 0.1500 0.2034 0.3618 0.3846 0.5992 0.6457 0.8251 0.8726 0.9260 0.9899 1.0821 1.1461 1.2686 1.3082 1.7177 1.8053 1.8406 1.9571 2.0097 2.1065 2.1729 2.2019 2.3478 2.4120 2.4954 2.6157 2.6513 2.6701 2.8264 2.8380 2.8622 2.9323 2.9946 3.0149 3.1002 3.1291 3.1766 3.2502 3.4373 3.4603 3.7261 3.7668 4.0291 4.0840 4.1476 4.1812 4.3978 4.4375 4.5357 4.5718 4.6258 4.6799 4.8153 4.8523 5.1175 5.1758 5.2804 5.3209 5.4453 5.5411 5.6725 5.7440 6.0680 6.1205 6.1635 6.2585 6.4515 6.5274 6.6126 6.6917 6.8513 6.8865 7.0790 7.1198 7.1876 7.2796 7.3662 7.3900 7.4703 7.5038 7.5971 7.6977 7.7478 7.8113 7.9768 8.0460 k = 0.3214 0.2886-0.1816 ( 16920 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3244-150.3225-146.9340-146.9297-145.5765-145.5722-141.2679-141.2638 -137.5681-137.5651-134.2933-134.2901-134.2298-134.2271-128.2577-128.2566 -33.0494 -33.0442 -32.9765 -32.9707 -31.2223 -31.2171 -31.0482 -31.0414 -26.9602 -26.9563 -25.3916 -25.3877 -24.9410 -24.9377 -23.0467 -23.0439 -19.5077 -19.5066 -19.4663 -19.4646 -18.7967 -18.7953 -17.1818 -17.1809 -16.3962 -16.3901 -16.2830 -16.2785 -16.0757 -16.0717 -15.0394 -15.0384 -14.2818 -14.2768 -13.6602 -13.6589 -13.4486 -13.4473 -12.3883 -12.3851 -11.7637 -11.7629 -11.0701 -11.0673 -10.7500 -10.7477 -9.4292 -9.4194 -9.2675 -9.2533 -8.8477 -8.8446 -7.9903 -7.9890 -7.6550 -7.6498 -7.5238 -7.5166 -7.4248 -7.4150 -7.1365 -7.1335 -6.7699 -6.7679 -2.3754 -2.3556 -1.7321 -1.7173 -0.6872 -0.6438 -0.4389 -0.3854 -0.2203 -0.1642 0.1518 0.2076 0.3658 0.3888 0.5930 0.6470 0.8246 0.8783 0.9247 0.9897 1.0769 1.1381 1.2699 1.3130 1.7161 1.8011 1.8431 1.9604 2.0119 2.1070 2.1652 2.2032 2.3321 2.4012 2.4888 2.6178 2.6481 2.6694 2.8255 2.8401 2.8622 2.9321 2.9824 3.0114 3.0933 3.1270 3.1733 3.2437 3.4378 3.4709 3.7330 3.7749 4.0229 4.0738 4.1399 4.1778 4.4022 4.4360 4.5367 4.5724 4.6283 4.6774 4.8127 4.8489 5.1205 5.1803 5.2815 5.3200 5.4568 5.5535 5.6767 5.7442 6.0608 6.1104 6.1479 6.2522 6.4540 6.5266 6.6179 6.6944 6.8548 6.8873 7.0888 7.1306 7.1940 7.2849 7.3741 7.3952 7.4820 7.5153 7.6041 7.6999 7.7444 7.8083 7.9812 8.0435 k = 0.3393 0.3047-0.1917 ( 16914 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3227-150.3214-146.9309-146.9270-145.5737-145.5697-141.2673-141.2627 -137.5646-137.5633-134.2912-134.2888-134.2287-134.2250-128.2564-128.2542 -33.0458 -33.0405 -32.9716 -32.9669 -31.2201 -31.2142 -31.0432 -31.0372 -26.9573 -26.9552 -25.3872 -25.3843 -24.9396 -24.9349 -23.0456 -23.0415 -19.5055 -19.5046 -19.4642 -19.4625 -18.7957 -18.7942 -17.1800 -17.1792 -16.3940 -16.3889 -16.2815 -16.2781 -16.0751 -16.0701 -15.0361 -15.0355 -14.2801 -14.2755 -13.6586 -13.6576 -13.4483 -13.4468 -12.3849 -12.3831 -11.7621 -11.7610 -11.0693 -11.0666 -10.7493 -10.7452 -9.4283 -9.4191 -9.2660 -9.2532 -8.8471 -8.8441 -7.9904 -7.9893 -7.6568 -7.6516 -7.5225 -7.5159 -7.4257 -7.4166 -7.1358 -7.1329 -6.7700 -6.7681 -2.3736 -2.3552 -1.7309 -1.7173 -0.6808 -0.6397 -0.4358 -0.3907 -0.2159 -0.1716 0.1549 0.2121 0.3705 0.3941 0.5864 0.6493 0.8247 0.8825 0.9241 0.9902 1.0709 1.1258 1.2755 1.3206 1.7148 1.7956 1.8462 1.9621 2.0147 2.1066 2.1574 2.2057 2.3206 2.3920 2.4826 2.6188 2.6438 2.6684 2.8201 2.8447 2.8657 2.9260 2.9764 3.0138 3.0872 3.1255 3.1697 3.2365 3.4398 3.4821 3.7409 3.7825 4.0157 4.0635 4.1337 4.1756 4.4071 4.4368 4.5390 4.5738 4.6329 4.6762 4.8108 4.8462 5.1255 5.1856 5.2832 5.3190 5.4697 5.5663 5.6812 5.7452 6.0526 6.0982 6.1382 6.2467 6.4573 6.5256 6.6249 6.6986 6.8590 6.8888 7.0974 7.1392 7.2014 7.2925 7.3840 7.4016 7.4940 7.5282 7.6124 7.7016 7.7433 7.8063 7.9876 8.0401 k = 0.3571 0.3207-0.2018 ( 16914 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3238-150.3218-146.9316-146.9278-145.5740-145.5703-141.2669-141.2625 -137.5635-137.5604-134.2918-134.2890-134.2291-134.2257-128.2569-128.2549 -33.0465 -33.0415 -32.9697 -32.9642 -31.2210 -31.2152 -31.0433 -31.0369 -26.9569 -26.9535 -25.3872 -25.3834 -24.9395 -24.9348 -23.0455 -23.0409 -19.5051 -19.5036 -19.4634 -19.4615 -18.7958 -18.7942 -17.1791 -17.1784 -16.3936 -16.3884 -16.2828 -16.2787 -16.0748 -16.0699 -15.0369 -15.0360 -14.2794 -14.2746 -13.6589 -13.6577 -13.4493 -13.4480 -12.3860 -12.3830 -11.7626 -11.7612 -11.0685 -11.0649 -10.7495 -10.7450 -9.4284 -9.4198 -9.2650 -9.2539 -8.8465 -8.8436 -7.9904 -7.9895 -7.6586 -7.6535 -7.5211 -7.5152 -7.4265 -7.4182 -7.1351 -7.1323 -6.7700 -6.7682 -2.3720 -2.3552 -1.7296 -1.7174 -0.6743 -0.6357 -0.4343 -0.3973 -0.2125 -0.1775 0.1592 0.2161 0.3755 0.4002 0.5798 0.6516 0.8247 0.8842 0.9245 0.9906 1.0640 1.1104 1.2840 1.3289 1.7136 1.7888 1.8493 1.9616 2.0174 2.1052 2.1505 2.2089 2.3130 2.3835 2.4767 2.6181 2.6381 2.6669 2.8147 2.8476 2.8721 2.9158 2.9767 3.0191 3.0818 3.1243 3.1658 3.2286 3.4434 3.4925 3.7494 3.7892 4.0066 4.0527 4.1285 4.1729 4.4106 4.4378 4.5407 4.5738 4.6371 4.6751 4.8089 4.8430 5.1309 5.1898 5.2847 5.3177 5.4837 5.5786 5.6856 5.7450 6.0429 6.0823 6.1340 6.2405 6.4593 6.5225 6.6320 6.7031 6.8625 6.8897 7.1042 7.1446 7.2087 7.3000 7.3954 7.4091 7.5061 7.5401 7.6203 7.6995 7.7450 7.8043 7.9942 8.0361 k = 0.3750 0.3367-0.2119 ( 16917 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3243-150.3217-146.9324-146.9287-145.5749-145.5715-141.2674-141.2638 -137.5668-137.5627-134.2926-134.2893-134.2298-134.2269-128.2578-128.2560 -33.0492 -33.0444 -32.9726 -32.9671 -31.2211 -31.2162 -31.0458 -31.0394 -26.9597 -26.9547 -25.3906 -25.3862 -24.9409 -24.9370 -23.0464 -23.0428 -19.5063 -19.5052 -19.4640 -19.4624 -18.7964 -18.7951 -17.1803 -17.1795 -16.3942 -16.3887 -16.2830 -16.2782 -16.0747 -16.0711 -15.0383 -15.0372 -14.2801 -14.2753 -13.6592 -13.6578 -13.4489 -13.4474 -12.3882 -12.3838 -11.7631 -11.7620 -11.0694 -11.0659 -10.7490 -10.7461 -9.4274 -9.4205 -9.2641 -9.2540 -8.8458 -8.8431 -7.9906 -7.9897 -7.6603 -7.6555 -7.5198 -7.5145 -7.4272 -7.4197 -7.1343 -7.1317 -6.7700 -6.7684 -2.3703 -2.3553 -1.7284 -1.7175 -0.6675 -0.6316 -0.4340 -0.4047 -0.2103 -0.1820 0.1642 0.2190 0.3804 0.4066 0.5737 0.6530 0.8250 0.8825 0.9269 0.9911 1.0563 1.0936 1.2944 1.3370 1.7129 1.7815 1.8524 1.9589 2.0198 2.1020 2.1458 2.2122 2.3088 2.3756 2.4714 2.6140 2.6326 2.6651 2.8105 2.8494 2.8788 2.9062 2.9803 3.0255 3.0776 3.1235 3.1615 3.2199 3.4477 3.5012 3.7578 3.7944 3.9962 4.0412 4.1251 4.1700 4.4138 4.4389 4.5421 4.5728 4.6410 4.6736 4.8072 4.8399 5.1363 5.1925 5.2862 5.3156 5.4976 5.5896 5.6889 5.7444 6.0317 6.0646 6.1335 6.2337 6.4614 6.5188 6.6396 6.7066 6.8652 6.8902 7.1095 7.1473 7.2165 7.3063 7.4079 7.4178 7.5183 7.5506 7.6270 7.6941 7.7500 7.8025 8.0003 8.0321 k = 0.3929 0.3528-0.2220 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3190-150.3159-146.9267-146.9229-145.5694-145.5660-141.2643-141.2613 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3.7986 3.9868 4.0301 4.1245 4.1677 4.4175 4.4406 4.5439 4.5729 4.6464 4.6733 4.8066 4.8372 5.1434 5.1949 5.2886 5.3145 5.5130 5.6001 5.6930 5.7437 6.0211 6.0480 6.1366 6.2276 6.4642 6.5152 6.6482 6.7098 6.8684 6.8914 7.1142 7.1480 7.2262 7.3112 7.4218 7.4291 7.5317 7.5605 7.6330 7.6872 7.7583 7.8024 8.0058 8.0298 k = 0.4107 0.3688-0.2320 ( 16896 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3170-150.3138-146.9234-146.9194-145.5657-145.5623-141.2614-141.2581 -137.5634-137.5585-134.2863-134.2827-134.2240-134.2222-128.2522-128.2508 -33.0384 -33.0334 -32.9598 -32.9536 -31.2107 -31.2058 -31.0342 -31.0275 -26.9466 -26.9408 -25.3808 -25.3757 -24.9302 -24.9271 -23.0364 -23.0336 -19.4998 -19.4987 -19.4576 -19.4561 -18.7903 -18.7890 -17.1741 -17.1734 -16.3888 -16.3833 -16.2783 -16.2722 -16.0675 -16.0641 -15.0326 -15.0313 -14.2740 -14.2690 -13.6531 -13.6515 -13.4450 -13.4436 -12.3836 -12.3787 -11.7577 -11.7568 -11.0641 -11.0606 -10.7427 -10.7412 -9.4238 -9.4195 -9.2608 -9.2531 -8.8444 -8.8422 -7.9907 -7.9901 -7.6631 -7.6592 -7.5171 -7.5133 -7.4280 -7.4225 -7.1328 -7.1306 -6.7700 -6.7688 -2.3671 -2.3561 -1.7258 -1.7178 -0.6520 -0.6230 -0.4356 -0.4196 -0.2068 -0.1852 0.1767 0.2222 0.3914 0.4198 0.5679 0.6522 0.8269 0.8713 0.9386 0.9935 1.0395 1.0618 1.3172 1.3518 1.7140 1.7664 1.8601 1.9470 2.0253 2.0907 2.1475 2.2162 2.3082 2.3609 2.4668 2.5909 2.6303 2.6606 2.8072 2.8485 2.8843 2.9046 2.9913 3.0340 3.0773 3.1224 3.1538 3.2017 3.4614 3.5141 3.7736 3.8011 3.9782 4.0187 4.1253 4.1643 4.4203 4.4409 4.5455 4.5713 4.6507 4.6721 4.8057 4.8334 5.1507 5.1966 5.2906 5.3128 5.5273 5.6073 5.6962 5.7423 6.0105 6.0322 6.1416 6.2211 6.4670 6.5107 6.6571 6.7115 6.8714 6.8917 7.1180 7.1468 7.2361 7.3128 7.4350 7.4420 7.5441 7.5694 7.6353 7.6791 7.7674 7.8021 8.0086 8.0291 k = 0.4286 0.3849-0.2421 ( 16905 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3187-150.3155-146.9253-146.9222-145.5677-145.5652-141.2631-141.2606 -137.5683-137.5655-134.2885-134.2854-134.2262-134.2244-128.2542-128.2530 -33.0467 -33.0429 -32.9627 -32.9572 -31.2137 -31.2097 -31.0397 -31.0346 -26.9498 -26.9458 -25.3852 -25.3808 -24.9335 -24.9307 -23.0400 -23.0374 -19.5037 -19.5026 -19.4609 -19.4596 -18.7922 -18.7910 -17.1779 -17.1776 -16.3909 -16.3875 -16.2799 -16.2747 -16.0693 -16.0664 -15.0349 -15.0339 -14.2766 -14.2728 -13.6551 -13.6538 -13.4460 -13.4450 -12.3850 -12.3813 -11.7603 -11.7594 -11.0665 -11.0631 -10.7456 -10.7434 -9.4241 -9.4202 -9.2602 -9.2544 -8.8439 -8.8419 -7.9908 -7.9903 -7.6642 -7.6610 -7.5159 -7.5128 -7.4283 -7.4238 -7.1320 -7.1303 -6.7700 -6.7690 -2.3658 -2.3568 -1.7246 -1.7182 -0.6449 -0.6206 -0.4379 -0.4269 -0.2058 -0.1870 0.1830 0.2213 0.3964 0.4238 0.5694 0.6482 0.8277 0.8632 0.9461 0.9950 1.0298 1.0477 1.3275 1.3564 1.7155 1.7587 1.8648 1.9380 2.0285 2.0829 2.1531 2.2152 2.3102 2.3532 2.4685 2.5748 2.6316 2.6576 2.8075 2.8438 2.8865 2.9085 2.9972 3.0337 3.0815 3.1211 3.1512 3.1923 3.4692 3.5164 3.7799 3.8020 3.9711 4.0076 4.1265 4.1596 4.4228 4.4406 4.5473 4.5682 4.6543 4.6707 4.8053 4.8288 5.1566 5.1954 5.2919 5.3100 5.5415 5.6111 5.6990 5.7392 6.0004 6.0179 6.1469 6.2129 6.4695 6.5056 6.6650 6.7109 6.8740 6.8911 7.1205 7.1439 7.2458 7.3111 7.4463 7.4553 7.5542 7.5787 7.6331 7.6706 7.7758 7.8018 8.0095 8.0294 k = 0.4464 0.4009-0.2522 ( 16905 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3184-150.3175-146.9249-146.9241-145.5673-145.5666-141.2636-141.2627 -137.5659-137.5645-134.2881-134.2866-134.2266-134.2255-128.2546-128.2541 -33.0460 -33.0454 -32.9599 -32.9576 -31.2125 -31.2115 -31.0367 -31.0361 -26.9492 -26.9473 -25.3837 -25.3820 -24.9325 -24.9316 -23.0393 -23.0383 -19.5035 -19.5030 -19.4600 -19.4596 -18.7923 -18.7918 -17.1765 -17.1763 -16.3878 -16.3871 -16.2792 -16.2771 -16.0690 -16.0680 -15.0345 -15.0339 -14.2746 -14.2741 -13.6553 -13.6548 -13.4463 -13.4458 -12.3838 -12.3821 -11.7599 -11.7593 -11.0658 -11.0645 -10.7446 -10.7435 -9.4238 -9.4207 -9.2593 -9.2551 -8.8433 -8.8418 -7.9909 -7.9905 -7.6650 -7.6625 -7.5149 -7.5126 -7.4283 -7.4249 -7.1314 -7.1300 -6.7700 -6.7692 -2.3644 -2.3576 -1.7235 -1.7186 -0.6377 -0.6184 -0.4402 -0.4334 -0.2040 -0.1888 0.1897 0.2195 0.4020 0.4260 0.5749 0.6419 0.8293 0.8555 0.9546 0.9970 1.0203 1.0361 1.3372 1.3594 1.7181 1.7513 1.8708 1.9279 2.0328 2.0748 2.1609 2.2120 2.3135 2.3460 2.4739 2.5579 2.6338 2.6542 2.8091 2.8377 2.8911 2.9114 3.0032 3.0314 3.0877 3.1192 3.1502 3.1832 3.4778 3.5165 3.7852 3.8019 3.9674 3.9976 4.1292 4.1552 4.4258 4.4400 4.5491 4.5655 4.6578 4.6697 4.8062 4.8246 5.1638 5.1940 5.2942 5.3080 5.5556 5.6119 5.7031 5.7357 5.9926 6.0062 6.1539 6.2046 6.4724 6.5000 6.6730 6.7089 6.8770 6.8906 7.1232 7.1410 7.2564 7.3076 7.4569 7.4675 7.5619 7.5898 7.6285 7.6638 7.7833 7.8017 8.0105 8.0295 k = 0.4643 0.4169-0.2623 ( 16895 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3140-150.3134-146.9203-146.9194-145.5636-145.5632-141.2618-141.2606 -137.5600-137.5587-134.2839-134.2824-134.2238-134.2234-128.2527-128.2517 -33.0394 -33.0389 -32.9539 -32.9513 -31.2088 -31.2074 -31.0302 -31.0288 -26.9443 -26.9427 -25.3783 -25.3766 -24.9277 -24.9269 -23.0346 -23.0338 -19.4994 -19.4989 -19.4568 -19.4562 -18.7897 -18.7894 -17.1737 -17.1735 -16.3854 -16.3849 -16.2778 -16.2758 -16.0663 -16.0651 -15.0307 -15.0302 -14.2724 -14.2714 -13.6533 -13.6528 -13.4452 -13.4447 -12.3803 -12.3789 -11.7577 -11.7572 -11.0633 -11.0621 -10.7423 -10.7421 -9.4225 -9.4207 -9.2581 -9.2552 -8.8428 -8.8417 -7.9909 -7.9906 -7.6654 -7.6636 -7.5140 -7.5125 -7.4282 -7.4259 -7.1308 -7.1299 -6.7699 -6.7693 -2.3630 -2.3585 -1.7223 -1.7191 -0.6311 -0.6176 -0.4419 -0.4379 -0.2015 -0.1906 0.1964 0.2168 0.4081 0.4258 0.5841 0.6328 0.8316 0.8488 0.9639 0.9978 1.0122 1.0269 1.3457 1.3609 1.7219 1.7444 1.8781 1.9172 2.0382 2.0668 2.1702 2.2066 2.3176 2.3392 2.4827 2.5407 2.6366 2.6508 2.8121 2.8316 2.8968 2.9122 3.0091 3.0282 3.0946 3.1162 3.1516 3.1748 3.4871 3.5145 3.7897 3.8009 3.9670 3.9885 4.1331 4.1511 4.4296 4.4396 4.5518 4.5631 4.6612 4.6691 4.8080 4.8208 5.1713 5.1918 5.2967 5.3061 5.5696 5.6091 5.7087 5.7321 5.9880 5.9971 6.1620 6.1964 6.4760 6.4947 6.6816 6.7061 6.8797 6.8895 7.1261 7.1380 7.2667 7.3019 7.4669 7.4765 7.5691 7.5977 7.6257 7.6576 7.7893 7.8014 8.0127 8.0281 k = 0.4821 0.4330-0.2724 ( 16893 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3133-150.3128-146.9193-146.9190-145.5629-145.5625-141.2612-141.2610 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3.7989 3.9693 3.9805 4.1376 4.1466 4.4323 4.4375 4.5544 4.5601 4.6637 4.6675 4.8107 4.8167 5.1780 5.1884 5.2995 5.3042 5.5823 5.6029 5.7145 5.7267 5.9857 5.9906 6.1704 6.1878 6.4802 6.4897 6.6891 6.7015 6.8824 6.8874 7.1291 7.1350 7.2769 7.2947 7.4749 7.4807 7.5775 7.5956 7.6310 7.6500 7.7938 7.8001 8.0162 8.0248 k = 0.5000 0.4490-0.2825 ( 16894 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3127-150.3127-146.9197-146.9197-145.5628-145.5628-141.2607-141.2607 -137.5617-137.5617-134.2829-134.2829-134.2228-134.2228-128.2516-128.2516 -33.0402 -33.0402 -32.9507 -32.9507 -31.2084 -31.2084 -31.0310 -31.0310 -26.9427 -26.9427 -25.3773 -25.3773 -24.9252 -24.9252 -23.0327 -23.0327 -19.5006 -19.5006 -19.4563 -19.4563 -18.7871 -18.7871 -17.1726 -17.1726 -16.3839 -16.3839 -16.2775 -16.2775 -16.0642 -16.0642 -15.0310 -15.0310 -14.2708 -14.2708 -13.6536 -13.6536 -13.4453 -13.4453 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************************************************************************ ************************************************************************ -150.3127-150.3127-146.9197-146.9197-145.5628-145.5628-141.2607-141.2607 -137.5617-137.5617-134.2829-134.2829-134.2228-134.2228-128.2516-128.2516 -33.0402 -33.0402 -32.9507 -32.9507 -31.2084 -31.2084 -31.0310 -31.0310 -26.9427 -26.9427 -25.3773 -25.3773 -24.9252 -24.9252 -23.0327 -23.0327 -19.5006 -19.5006 -19.4563 -19.4563 -18.7871 -18.7871 -17.1726 -17.1726 -16.3839 -16.3839 -16.2775 -16.2775 -16.0642 -16.0642 -15.0310 -15.0310 -14.2708 -14.2708 -13.6536 -13.6536 -13.4453 -13.4453 -12.3801 -12.3801 -11.7576 -11.7576 -11.0630 -11.0630 -10.7426 -10.7426 -9.4217 -9.4217 -9.2564 -9.2564 -8.8420 -8.8420 -7.9908 -7.9908 -7.6652 -7.6652 -7.5128 -7.5128 -7.4274 -7.4274 -7.1301 -7.1301 -6.7696 -6.7696 -2.3605 -2.3605 -1.7205 -1.7205 -0.6218 -0.6218 -0.4430 -0.4430 -0.1956 -0.1956 0.2081 0.2081 0.4190 0.4190 0.6087 0.6087 0.8381 0.8381 0.9835 0.9835 1.0136 1.0136 1.3574 1.3574 1.7319 1.7319 1.8960 1.8960 2.0512 2.0512 2.1898 2.1898 2.3272 2.3272 2.5082 2.5082 2.6434 2.6434 2.8204 2.8204 2.9073 2.9073 3.0195 3.0195 3.1070 3.1070 3.1602 3.1602 3.5035 3.5035 3.7963 3.7963 3.9736 3.9736 4.1422 4.1422 4.4349 4.4349 4.5573 4.5573 4.6658 4.6658 4.8133 4.8133 5.1835 5.1835 5.3020 5.3020 5.5935 5.5935 5.7206 5.7206 5.9867 5.9867 6.1791 6.1791 6.4850 6.4850 6.6956 6.6956 6.8850 6.8850 7.1319 7.1319 7.2863 7.2863 7.4796 7.4796 7.5867 7.5867 7.6407 7.6407 7.7973 7.7973 8.0205 8.0206 k = 0.5077 0.4559-0.2578 ( 16906 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3159-150.3147-146.9238-146.9226-145.5668-145.5660-141.2647-141.2636 -137.5661-137.5647-134.2860-134.2843-134.2282-134.2273-128.2563-128.2552 -33.0490 -33.0467 -32.9587 -32.9572 -31.2138 -31.2121 -31.0394 -31.0381 -26.9489 -26.9481 -25.3832 -25.3818 -24.9324 -24.9310 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6.6998 6.8787 6.8913 7.1224 7.1406 7.2839 7.2877 7.4707 7.4857 7.5829 7.5877 7.6369 7.6463 7.7923 7.8017 8.0138 8.0249 k = 0.5154 0.4628-0.2332 ( 16891 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3112-150.3107-146.9193-146.9190-145.5632-145.5624-141.2613-141.2602 -137.5599-137.5588-134.2809-134.2797-134.2247-134.2233-128.2523-128.2510 -33.0405 -33.0389 -32.9502 -32.9480 -31.2060 -31.2046 -31.0299 -31.0290 -26.9402 -26.9399 -25.3757 -25.3750 -24.9248 -24.9234 -23.0320 -23.0305 -19.4986 -19.4984 -19.4559 -19.4556 -18.7877 -18.7875 -17.1717 -17.1715 -16.3836 -16.3827 -16.2770 -16.2760 -16.0655 -16.0644 -15.0296 -15.0295 -14.2708 -14.2700 -13.6532 -13.6527 -13.4438 -13.4431 -12.3792 -12.3790 -11.7569 -11.7563 -11.0623 -11.0616 -10.7429 -10.7414 -9.4209 -9.4205 -9.2576 -9.2545 -8.8433 -8.8404 -7.9927 -7.9901 -7.6658 -7.6641 -7.5135 -7.5123 -7.4278 -7.4267 -7.1308 -7.1300 -6.7700 -6.7693 -2.3624 -2.3550 -1.7212 -1.7189 -0.6264 -0.6170 -0.4445 -0.4375 -0.1992 -0.1933 0.2008 0.2149 0.3994 0.4321 0.6018 0.6142 0.8262 0.8475 0.9696 0.9931 1.0073 1.0238 1.3548 1.3606 1.7228 1.7392 1.8846 1.9119 2.0283 2.0745 2.1791 2.2026 2.3213 2.3345 2.4959 2.5126 2.6424 2.6504 2.8105 2.8297 2.8959 2.9193 3.0050 3.0298 3.0965 3.1147 3.1515 3.1715 3.4984 3.5107 3.7895 3.7995 3.9663 3.9871 4.1381 4.1466 4.4337 4.4400 4.5488 4.5667 4.6530 4.6786 4.8039 4.8232 5.1746 5.1902 5.2886 5.3169 5.5802 5.6056 5.7077 5.7329 5.9855 5.9902 6.1697 6.1909 6.4794 6.4906 6.6847 6.7049 6.8741 6.8986 7.1144 7.1498 7.2816 7.2893 7.4611 7.4905 7.5792 7.5869 7.6364 7.6544 7.7892 7.8071 8.0056 8.0280 k = 0.5231 0.4698-0.2085 ( 16884 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3096-150.3078-146.9182-146.9173-145.5620-145.5611-141.2588-141.2573 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3.7999 3.9650 3.9953 4.1367 4.1493 4.4346 4.4440 4.5459 4.5715 4.6471 4.6842 4.7999 4.8283 5.1703 5.1927 5.2840 5.3247 5.5739 5.6107 5.7016 5.7380 5.9854 5.9926 6.1661 6.1975 6.4770 6.4935 6.6790 6.7089 6.8705 6.9060 7.1070 7.1581 7.2789 7.2901 7.4504 7.4922 7.5755 7.5841 7.6374 7.6633 7.7868 7.8117 7.9956 8.0288 k = 0.5308 0.4767-0.1839 ( 16887 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3110-150.3100-146.9184-146.9178-145.5619-145.5613-141.2597-141.2580 -137.5618-137.5608-134.2814-134.2806-134.2243-134.2224-128.2522-128.2507 -33.0381 -33.0372 -32.9474 -32.9455 -31.2026 -31.2006 -31.0278 -31.0266 -26.9415 -26.9400 -25.3748 -25.3738 -24.9217 -24.9192 -23.0298 -23.0275 -19.4997 -19.4993 -19.4551 -19.4547 -18.7873 -18.7866 -17.1710 -17.1707 -16.3819 -16.3811 -16.2766 -16.2750 -16.0654 -16.0636 -15.0299 -15.0296 -14.2699 -14.2690 -13.6524 -13.6520 -13.4408 -13.4398 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************************************************************************ ************************************************************************ -150.3097-150.3087-146.9161-146.9155-145.5595-145.5591-141.2563-141.2553 -137.5569-137.5563-134.2792-134.2787-134.2208-134.2196-128.2491-128.2478 -33.0297 -33.0290 -32.9431 -32.9422 -31.1974 -31.1969 -31.0200 -31.0197 -26.9382 -26.9380 -25.3696 -25.3689 -24.9183 -24.9170 -23.0262 -23.0250 -19.4959 -19.4953 -19.4531 -19.4525 -18.7856 -18.7852 -17.1686 -17.1682 -16.3807 -16.3796 -16.2727 -16.2722 -16.0630 -16.0627 -15.0271 -15.0268 -14.2681 -14.2675 -13.6500 -13.6497 -13.4383 -13.4376 -12.3765 -12.3762 -11.7537 -11.7533 -11.0612 -11.0603 -10.7405 -10.7391 -9.4186 -9.4170 -9.2566 -9.2501 -8.8446 -8.8378 -7.9971 -7.9912 -7.6660 -7.6617 -7.5148 -7.5118 -7.4276 -7.4251 -7.1329 -7.1311 -6.7707 -6.7691 -2.3578 -2.3406 -1.7204 -1.7149 -0.6322 -0.6108 -0.4384 -0.4234 -0.2061 -0.1906 0.1901 0.2220 0.3638 0.4370 0.5886 0.6196 0.8062 0.8550 0.9512 0.9788 1.0190 1.0439 1.3521 1.3671 1.7086 1.7484 1.8775 1.9384 1.9995 2.1045 2.1696 2.2250 2.3161 2.3464 2.4659 2.5053 2.6466 2.6714 2.7954 2.8413 2.8806 2.9319 2.9838 3.0340 3.0827 3.1172 3.1464 3.1872 3.4953 3.5240 3.7729 3.7991 3.9670 4.0123 4.1338 4.1543 4.4366 4.4512 4.5432 4.5779 4.6364 4.6910 4.7935 4.8368 5.1607 5.1952 5.2787 5.3384 5.5602 5.6188 5.6899 5.7449 5.9859 5.9994 6.1614 6.2114 6.4720 6.4990 6.6672 6.7142 6.8648 6.9188 7.0968 7.1721 7.2720 7.2908 7.4261 7.4866 7.5671 7.5778 7.6395 7.6809 7.7874 7.8192 7.9712 8.0248 k = 0.5463 0.4905-0.1346 ( 16876 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3084-150.3078-146.9159-146.9147-145.5594-145.5587-141.2544-141.2524 -137.5561-137.5550-134.2784-134.2779-134.2194-134.2172-128.2476-128.2459 -33.0282 -33.0272 -32.9417 -32.9395 -31.1972 -31.1946 -31.0195 -31.0178 -26.9370 -26.9368 -25.3680 -25.3669 -24.9186 -24.9163 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6.7159 6.8628 6.9240 7.0941 7.1775 7.2677 7.2907 7.4136 7.4799 7.5616 7.5765 7.6382 7.6888 7.7904 7.8218 7.9576 8.0203 k = 0.5540 0.4975-0.1099 ( 16880 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3085-150.3076-146.9182-146.9163-145.5622-145.5606-141.2571-141.2546 -137.5554-137.5544-134.2777-134.2772-134.2208-134.2186-128.2485-128.2470 -33.0287 -33.0266 -32.9477 -32.9451 -31.1996 -31.1965 -31.0213 -31.0188 -26.9393 -26.9391 -25.3713 -25.3697 -24.9213 -24.9192 -23.0290 -23.0270 -19.4946 -19.4941 -19.4538 -19.4524 -18.7864 -18.7859 -17.1711 -17.1703 -16.3844 -16.3822 -16.2734 -16.2719 -16.0647 -16.0620 -15.0260 -15.0256 -14.2700 -14.2679 -13.6500 -13.6495 -13.4393 -13.4388 -12.3760 -12.3753 -11.7539 -11.7529 -11.0601 -11.0588 -10.7407 -10.7386 -9.4186 -9.4170 -9.2571 -9.2486 -8.8450 -8.8364 -8.0009 -7.9933 -7.6655 -7.6598 -7.5157 -7.5118 -7.4272 -7.4238 -7.1349 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3.7964 3.9815 4.0386 4.1302 4.1608 4.4361 4.4624 4.5490 4.5807 4.6274 4.6895 4.7929 4.8484 5.1448 5.1898 5.2834 5.3545 5.5416 5.6228 5.6751 5.7425 5.9845 6.0176 6.1597 6.2300 6.4670 6.5052 6.6518 6.7191 6.8579 6.9317 7.0946 7.1864 7.2572 7.2892 7.3882 7.4603 7.5470 7.5754 7.6299 7.7005 7.7996 7.8262 7.9303 8.0067 k = 0.5694 0.5113-0.0606 ( 16875 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3066-150.3054-146.9177-146.9162-145.5618-145.5604-141.2571-141.2542 -137.5561-137.5534-134.2768-134.2750-134.2226-134.2186-128.2498-128.2463 -33.0266 -33.0251 -32.9463 -32.9429 -31.1963 -31.1924 -31.0200 -31.0179 -26.9370 -26.9344 -25.3690 -25.3667 -24.9192 -24.9144 -23.0283 -23.0234 -19.4938 -19.4931 -19.4530 -19.4517 -18.7854 -18.7844 -17.1693 -17.1686 -16.3837 -16.3816 -16.2724 -16.2696 -16.0649 -16.0611 -15.0245 -15.0241 -14.2690 -14.2669 -13.6497 -13.6490 -13.4356 -13.4339 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6.7198 6.8477 6.9330 7.1034 7.1945 7.2402 7.2868 7.3524 7.4229 7.5202 7.5716 7.6058 7.6993 7.8111 7.8343 7.8998 7.9796 k = 0.5925 0.5321 0.0133 ( 16883 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3147-150.3090-146.9198-146.9171-145.5633-145.5613-141.2598-141.2552 -137.5604-137.5555-134.2838-134.2785-134.2226-134.2174-128.2504-128.2453 -33.0266 -33.0218 -32.9591 -32.9508 -31.2049 -31.1976 -31.0289 -31.0231 -26.9420 -26.9347 -25.3748 -25.3682 -24.9249 -24.9171 -23.0336 -23.0258 -19.4980 -19.4967 -19.4549 -19.4532 -18.7871 -18.7851 -17.1702 -17.1697 -16.3859 -16.3819 -16.2782 -16.2682 -16.0683 -16.0616 -15.0300 -15.0288 -14.2714 -14.2669 -13.6532 -13.6511 -13.4392 -13.4369 -12.3821 -12.3760 -11.7560 -11.7537 -11.0648 -11.0597 -10.7435 -10.7378 -9.4186 -9.4152 -9.2568 -9.2433 -8.8441 -8.8344 -8.0104 -8.0018 -7.6628 -7.6542 -7.5181 -7.5125 -7.4249 -7.4200 -7.1407 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3.8008 4.0192 4.0721 4.1338 4.1729 4.4314 4.4753 4.5631 4.5799 4.6234 4.6682 4.8105 4.8641 5.1266 5.1723 5.3175 5.3705 5.5105 5.6091 5.6503 5.7098 5.9818 6.0594 6.1697 6.2547 6.4691 6.5073 6.6408 6.7200 6.8403 6.9262 7.1067 7.1919 7.2341 7.2830 7.3306 7.3986 7.5010 7.5629 7.5904 7.6859 7.8056 7.8453 7.8918 7.9672 k = 0.6002 0.5390 0.0380 ( 16887 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3138-150.3091-146.9212-146.9198-145.5648-145.5641-141.2614-141.2568 -137.5604-137.5557-134.2828-134.2784-134.2238-134.2189-128.2517-128.2471 -33.0265 -33.0238 -32.9620 -32.9552 -31.2062 -31.2002 -31.0288 -31.0251 -26.9437 -26.9378 -25.3776 -25.3725 -24.9265 -24.9200 -23.0349 -23.0283 -19.4990 -19.4979 -19.4562 -19.4549 -18.7883 -18.7867 -17.1718 -17.1714 -16.3868 -16.3839 -16.2783 -16.2701 -16.0682 -16.0625 -15.0313 -15.0304 -14.2720 -14.2691 -13.6540 -13.6523 -13.4408 -13.4389 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6.7172 6.8493 6.9328 7.1105 7.1848 7.2320 7.2795 7.3053 7.3861 7.4898 7.5560 7.5943 7.6701 7.8028 7.8493 7.8845 7.9476 k = 0.5752 0.5165 0.1086 ( 16908 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3238-150.3185-146.9267-146.9233-145.5698-145.5673-141.2664-141.2626 -137.5657-137.5604-134.2907-134.2866-134.2274-134.2228-128.2551-128.2517 -33.0377 -33.0324 -32.9737 -32.9661 -31.2180 -31.2119 -31.0402 -31.0340 -26.9573 -26.9503 -25.3873 -25.3810 -24.9365 -24.9312 -23.0444 -23.0395 -19.5055 -19.5043 -19.4618 -19.4613 -18.7954 -18.7937 -17.1792 -17.1784 -16.3932 -16.3883 -16.2843 -16.2753 -16.0735 -16.0691 -15.0362 -15.0350 -14.2794 -14.2744 -13.6588 -13.6568 -13.4482 -13.4467 -12.3863 -12.3807 -11.7625 -11.7610 -11.0709 -11.0662 -10.7479 -10.7444 -9.4221 -9.4198 -9.2575 -9.2465 -8.8433 -8.8349 -8.0148 -8.0080 -7.6571 -7.6473 -7.5205 -7.5142 -7.4224 -7.4183 -7.1458 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3.8090 4.0446 4.0803 4.1437 4.1874 4.4338 4.4822 4.5652 4.6045 4.6358 4.6617 4.8251 4.8758 5.1255 5.1613 5.3520 5.3820 5.5243 5.5938 5.6344 5.6935 6.0042 6.0939 6.1975 6.2551 6.4647 6.5063 6.6325 6.7122 6.8595 6.9339 7.1147 7.1736 7.2268 7.2604 7.2985 7.3775 7.4756 7.5404 7.6032 7.6485 7.8004 7.8538 7.8830 7.9369 k = 0.5585 0.5015 0.1557 ( 16914 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3250-150.3224-146.9320-146.9296-145.5745-145.5726-141.2665-141.2645 -137.5668-137.5641-134.2920-134.2893-134.2278-134.2250-128.2555-128.2535 -33.0413 -33.0390 -32.9747 -32.9697 -31.2196 -31.2165 -31.0430 -31.0399 -26.9593 -26.9568 -25.3886 -25.3849 -24.9372 -24.9339 -23.0454 -23.0419 -19.5089 -19.5077 -19.4656 -19.4640 -18.7950 -18.7939 -17.1809 -17.1801 -16.3941 -16.3910 -16.2831 -16.2793 -16.0746 -16.0723 -15.0380 -15.0378 -14.2813 -14.2781 -13.6606 -13.6595 -13.4482 -13.4473 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************************************************************************ ************************************************************************ -150.3242-150.3224-146.9334-146.9316-145.5758-145.5743-141.2660-141.2646 -137.5692-137.5669-134.2916-134.2896-134.2277-134.2257-128.2555-128.2539 -33.0409 -33.0397 -32.9767 -32.9733 -31.2195 -31.2172 -31.0433 -31.0413 -26.9603 -26.9585 -25.3892 -25.3870 -24.9369 -24.9342 -23.0450 -23.0423 -19.5097 -19.5086 -19.4679 -19.4669 -18.7946 -18.7938 -17.1833 -17.1827 -16.3956 -16.3933 -16.2825 -16.2798 -16.0746 -16.0730 -15.0385 -15.0383 -14.2832 -14.2810 -13.6606 -13.6599 -13.4476 -13.4466 -12.3859 -12.3846 -11.7641 -11.7630 -11.0724 -11.0700 -10.7505 -10.7484 -9.4213 -9.4200 -9.2552 -9.2474 -8.8426 -8.8361 -8.0164 -8.0116 -7.6507 -7.6422 -7.5223 -7.5167 -7.4203 -7.4174 -7.1494 -7.1474 -6.7724 -6.7711 -2.2894 -2.2749 -1.7030 -1.6949 -0.6060 -0.5792 -0.3974 -0.3809 -0.2901 -0.2551 0.1746 0.1965 0.2848 0.3379 0.5440 0.6015 0.7549 0.8134 0.8788 0.9582 1.0905 1.1472 1.2868 1.3638 1.7693 1.8267 1.8765 1.9319 2.0252 2.0787 2.1546 2.2344 2.3622 2.4048 2.4828 2.5174 2.6155 2.6735 2.7142 2.7642 2.8460 2.9032 2.9324 3.0033 3.0738 3.1105 3.1901 3.2038 3.4594 3.5033 3.7362 3.8068 4.0575 4.0844 4.1528 4.1934 4.4379 4.4838 4.5665 4.6139 4.6443 4.6641 4.8337 4.8785 5.1284 5.1553 5.3646 5.3864 5.5381 5.5863 5.6276 5.6825 6.0231 6.1046 6.2143 6.2577 6.4646 6.5070 6.6326 6.7056 6.8717 6.9320 7.1216 7.1660 7.2162 7.2365 7.3049 7.3744 7.4621 7.5272 7.6079 7.6288 7.8076 7.8550 7.8837 7.9356 k = 0.5418 0.4865 0.2028 ( 16911 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3243-150.3215-146.9309-146.9290-145.5734-145.5718-141.2648-141.2628 -137.5679-137.5649-134.2914-134.2885-134.2249-134.2225-128.2525-128.2509 -33.0401 -33.0372 -32.9740 -32.9700 -31.2182 -31.2145 -31.0424 -31.0388 -26.9575 -26.9542 -25.3875 -25.3846 -24.9373 -24.9346 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6.7010 6.8779 6.9294 7.1254 7.1639 7.2085 7.2256 7.3091 7.3727 7.4581 7.5209 7.6078 7.6203 7.8141 7.8546 7.8842 7.9361 k = 0.5334 0.4790 0.2263 ( 16908 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3231-150.3215-146.9305-146.9290-145.5726-145.5712-141.2633-141.2614 -137.5684-137.5664-134.2907-134.2885-134.2229-134.2213-128.2506-128.2497 -33.0382 -33.0363 -32.9714 -32.9686 -31.2166 -31.2138 -31.0400 -31.0375 -26.9555 -26.9536 -25.3858 -25.3837 -24.9341 -24.9324 -23.0412 -23.0398 -19.5071 -19.5065 -19.4647 -19.4641 -18.7916 -18.7908 -17.1813 -17.1806 -16.3938 -16.3916 -16.2789 -16.2757 -16.0723 -16.0708 -15.0366 -15.0363 -14.2810 -14.2788 -13.6567 -13.6559 -13.4461 -13.4453 -12.3843 -12.3828 -11.7620 -11.7613 -11.0700 -11.0683 -10.7472 -10.7459 -9.4204 -9.4194 -9.2536 -9.2481 -8.8419 -8.8373 -8.0169 -8.0135 -7.6465 -7.6401 -7.5228 -7.5187 -7.4190 -7.4170 -7.1511 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3.7956 4.0731 4.0868 4.1703 4.1949 4.4483 4.4776 4.5788 4.6130 4.6580 4.6687 4.8473 4.8744 5.1351 5.1480 5.3776 5.3901 5.5599 5.5781 5.6252 5.6621 6.0552 6.1038 6.2382 6.2595 6.4715 6.5007 6.6445 6.6894 6.8901 6.9221 7.1355 7.1639 7.1924 7.2059 7.3204 7.3647 7.4607 7.5081 7.6049 7.6099 7.8280 7.8521 7.8909 7.9341 k = 0.5167 0.4640 0.2734 ( 16901 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3219-150.3199-146.9271-146.9257-145.5690-145.5681-141.2611-141.2604 -137.5663-137.5654-134.2892-134.2876-134.2213-134.2203-128.2491-128.2484 -33.0349 -33.0337 -32.9668 -32.9642 -31.2137 -31.2122 -31.0377 -31.0356 -26.9494 -26.9473 -25.3829 -25.3809 -24.9305 -24.9298 -23.0374 -23.0368 -19.5054 -19.5048 -19.4610 -19.4608 -18.7890 -18.7886 -17.1775 -17.1772 -16.3903 -16.3891 -16.2771 -16.2742 -16.0693 -16.0686 -15.0363 -15.0359 -14.2773 -14.2756 -13.6542 -13.6537 -13.4441 -13.4439 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************************************************************************ ************************************************************************ -150.3218-150.3211-146.9276-146.9267-145.5698-145.5690-141.2621-141.2614 -137.5659-137.5654-134.2892-134.2886-134.2225-134.2224-128.2507-128.2506 -33.0359 -33.0352 -32.9678 -32.9661 -31.2143 -31.2132 -31.0378 -31.0370 -26.9522 -26.9512 -25.3834 -25.3821 -24.9311 -24.9303 -23.0386 -23.0376 -19.5063 -19.5058 -19.4619 -19.4617 -18.7907 -18.7904 -17.1785 -17.1783 -16.3903 -16.3897 -16.2781 -16.2767 -16.0708 -16.0696 -15.0361 -15.0358 -14.2778 -14.2770 -13.6557 -13.6554 -13.4453 -13.4448 -12.3832 -12.3822 -11.7612 -11.7608 -11.0686 -11.0676 -10.7458 -10.7450 -9.4196 -9.4193 -9.2515 -9.2499 -8.8404 -8.8392 -8.0165 -8.0156 -7.6415 -7.6397 -7.5224 -7.5212 -7.4176 -7.4171 -7.1523 -7.1520 -6.7720 -6.7717 -2.2756 -2.2731 -1.6967 -1.6952 -0.5772 -0.5714 -0.3978 -0.3940 -0.3009 -0.2931 0.1942 0.2008 0.2808 0.2939 0.5640 0.5748 0.7710 0.7810 0.9222 0.9408 1.1273 1.1398 1.3012 1.3200 1.8004 1.8154 1.9128 1.9317 2.0517 2.0625 2.1572 2.1760 2.3945 2.4047 2.5413 2.5466 2.6064 2.6174 2.7097 2.7159 2.8766 2.8907 2.9493 2.9637 3.0758 3.0889 3.2035 3.2087 3.4480 3.4579 3.7708 3.7843 4.0805 4.0851 4.1814 4.1902 4.4577 4.4683 4.5910 4.6037 4.6642 4.6683 4.8572 4.8668 5.1388 5.1431 5.3832 5.3878 5.5688 5.5743 5.6316 5.6457 6.0751 6.0921 6.2490 6.2562 6.4791 6.4898 6.6586 6.6745 6.9015 6.9122 7.1479 7.1609 7.1831 7.1905 7.3338 7.3497 7.4745 7.4919 7.6022 7.6043 7.8386 7.8463 7.9066 7.9239 k = 0.5000 0.4490 0.3205 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3230-150.3230-146.9252-146.9252-145.5676-145.5676-141.2617-141.2617 -137.5637-137.5637-134.2901-134.2901-134.2225-134.2225-128.2505-128.2505 -33.0355 -33.0355 -32.9645 -32.9645 -31.2135 -31.2135 -31.0367 -31.0367 -26.9499 -26.9499 -25.3809 -25.3809 -24.9306 -24.9306 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6.6668 6.9070 6.9070 7.1548 7.1548 7.1854 7.1854 7.3417 7.3417 7.4832 7.4832 7.6027 7.6027 7.8427 7.8427 7.9157 7.9157 k = 0.5000 0.4490 0.3205 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3230-150.3230-146.9252-146.9252-145.5676-145.5676-141.2617-141.2617 -137.5637-137.5637-134.2901-134.2901-134.2225-134.2225-128.2505-128.2505 -33.0355 -33.0355 -32.9645 -32.9645 -31.2135 -31.2135 -31.0367 -31.0367 -26.9499 -26.9499 -25.3809 -25.3809 -24.9306 -24.9306 -23.0375 -23.0375 -19.5048 -19.5048 -19.4604 -19.4604 -18.7909 -18.7909 -17.1778 -17.1778 -16.3899 -16.3899 -16.2762 -16.2762 -16.0703 -16.0703 -15.0352 -15.0352 -14.2769 -14.2769 -13.6541 -13.6541 -13.4445 -13.4445 -12.3814 -12.3814 -11.7604 -11.7604 -11.0676 -11.0676 -10.7446 -10.7446 -9.4192 -9.4192 -9.2507 -9.2507 -8.8398 -8.8398 -8.0161 -8.0161 -7.6404 -7.6404 -7.5219 -7.5219 -7.4173 -7.4173 -7.1523 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3.7802 4.0757 4.0911 4.1822 4.1914 4.4602 4.4660 4.5940 4.6005 4.6642 4.6698 4.8575 4.8672 5.1395 5.1426 5.3761 5.3935 5.5648 5.5776 5.6352 5.6430 6.0804 6.0898 6.2487 6.2582 6.4826 6.4865 6.6640 6.6698 6.9027 6.9102 7.1466 7.1626 7.1772 7.1936 7.3314 7.3510 7.4778 7.4888 7.5951 7.6129 7.8350 7.8504 7.9145 7.9184 k = 0.5330 0.4123 0.3205 ( 16886 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3178-150.3159-146.9231-146.9214-145.5656-145.5639-141.2568-141.2555 -137.5600-137.5583-134.2851-134.2839-134.2184-134.2163-128.2462-128.2443 -33.0269 -33.0243 -32.9565 -32.9525 -31.2057 -31.2035 -31.0283 -31.0251 -26.9439 -26.9413 -25.3742 -25.3716 -24.9230 -24.9202 -23.0314 -23.0289 -19.4998 -19.4987 -19.4572 -19.4563 -18.7855 -18.7850 -17.1731 -17.1728 -16.3866 -16.3845 -16.2742 -16.2723 -16.0672 -16.0653 -15.0311 -15.0305 -14.2745 -14.2718 -13.6515 -13.6510 -13.4407 -13.4396 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************************************************************************ ************************************************************************ -150.3173-150.3157-146.9221-146.9212-145.5649-145.5638-141.2556-141.2540 -137.5593-137.5579-134.2846-134.2840-134.2165-134.2140-128.2446-128.2423 -33.0273 -33.0257 -32.9542 -32.9506 -31.2037 -31.2014 -31.0272 -31.0247 -26.9435 -26.9417 -25.3727 -25.3705 -24.9230 -24.9205 -23.0310 -23.0287 -19.4991 -19.4979 -19.4560 -19.4548 -18.7855 -18.7851 -17.1730 -17.1727 -16.3871 -16.3848 -16.2719 -16.2704 -16.0678 -16.0658 -15.0294 -15.0289 -14.2739 -14.2718 -13.6504 -13.6499 -13.4393 -13.4382 -12.3776 -12.3763 -11.7558 -11.7552 -11.0650 -11.0623 -10.7416 -10.7404 -9.4190 -9.4136 -9.2505 -9.2470 -8.8401 -8.8394 -8.0163 -8.0157 -7.6415 -7.6395 -7.5247 -7.5198 -7.4183 -7.4157 -7.1521 -7.1515 -6.7720 -6.7715 -2.2787 -2.2706 -1.6998 -1.6946 -0.5823 -0.5672 -0.4035 -0.3836 -0.3056 -0.2869 0.1878 0.2074 0.2815 0.2936 0.5621 0.5839 0.7725 0.7881 0.9168 0.9459 1.1247 1.1443 1.2988 1.3221 1.7805 1.8241 1.9036 1.9299 2.0326 2.0905 2.1553 2.1751 2.3725 2.4315 2.5214 2.5491 2.6125 2.6234 2.6963 2.7378 2.8756 2.8962 2.9395 2.9790 3.0740 3.0953 3.1982 3.2113 3.4460 3.4619 3.7695 3.7851 4.0625 4.1070 4.1785 4.2045 4.4549 4.4718 4.5849 4.6040 4.6612 4.6761 4.8478 4.8773 5.1380 5.1470 5.3520 5.4003 5.5510 5.5805 5.6337 5.6549 6.0762 6.1031 6.2418 6.2689 6.4809 6.4922 6.6590 6.6760 6.8899 6.9130 7.1272 7.1605 7.1779 7.2058 7.3132 7.3639 7.4671 7.4978 7.5875 7.6385 7.8196 7.8583 7.9182 7.9253 k = 0.5659 0.3756 0.3205 ( 16896 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3210-150.3196-146.9251-146.9249-145.5676-145.5669-141.2595-141.2573 -137.5636-137.5626-134.2884-134.2879-134.2218-134.2192-128.2497-128.2472 -33.0316 -33.0309 -32.9628 -32.9595 -31.2098 -31.2071 -31.0324 -31.0307 -26.9490 -26.9477 -25.3792 -25.3773 -24.9287 -24.9263 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6.6782 6.8813 6.9125 7.1150 7.1541 7.1835 7.2076 7.3072 7.3662 7.4613 7.5000 7.5871 7.6530 7.8114 7.8569 7.9208 7.9315 k = 0.5824 0.3572 0.3205 ( 16900 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3217-150.3199-146.9261-146.9254-145.5686-145.5676-141.2606-141.2587 -137.5644-137.5635-134.2894-134.2882-134.2244-134.2217-128.2522-128.2497 -33.0331 -33.0311 -32.9661 -32.9627 -31.2117 -31.2092 -31.0347 -31.0324 -26.9508 -26.9490 -25.3810 -25.3786 -24.9302 -24.9275 -23.0373 -23.0349 -19.5025 -19.5015 -19.4616 -19.4610 -18.7901 -18.7897 -17.1786 -17.1784 -16.3920 -16.3894 -16.2761 -16.2742 -16.0705 -16.0684 -15.0342 -15.0338 -14.2786 -14.2763 -13.6539 -13.6534 -13.4423 -13.4409 -12.3816 -12.3805 -11.7597 -11.7590 -11.0677 -11.0647 -10.7447 -10.7433 -9.4218 -9.4137 -9.2532 -9.2470 -8.8405 -8.8393 -8.0163 -8.0155 -7.6424 -7.6391 -7.5268 -7.5190 -7.4188 -7.4145 -7.1515 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3.7887 4.0459 4.1234 4.1817 4.2274 4.4450 4.4716 4.5687 4.6028 4.6574 4.6784 4.8332 4.8872 5.1357 5.1503 5.3078 5.3837 5.5357 5.5661 5.6302 5.6727 6.0763 6.1222 6.2360 6.2828 6.4788 6.5022 6.6493 6.6816 6.8609 6.9082 7.0898 7.1431 7.1917 7.2058 7.3062 7.3654 7.4511 7.5028 7.5936 7.6822 7.7956 7.8491 7.9222 7.9519 k = 0.6154 0.3205 0.3205 ( 16904 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3212-150.3200-146.9289-146.9283-145.5713-145.5706-141.2604-141.2600 -137.5653-137.5648-134.2897-134.2884-134.2247-134.2241-128.2528-128.2519 -33.0349 -33.0346 -32.9670 -32.9654 -31.2140 -31.2131 -31.0355 -31.0353 -26.9529 -26.9524 -25.3824 -25.3815 -24.9304 -24.9298 -23.0378 -23.0373 -19.5031 -19.5024 -19.4632 -19.4623 -18.7888 -18.7886 -17.1801 -17.1799 -16.3929 -16.3917 -16.2776 -16.2768 -16.0695 -16.0688 -15.0351 -15.0348 -14.2789 -14.2786 -13.6560 -13.6555 -13.4423 -13.4415 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************************************************************************ ************************************************************************ -150.3203-150.3186-146.9289-146.9278-145.5716-145.5703-141.2618-141.2610 -137.5638-137.5629-134.2885-134.2865-134.2261-134.2256-128.2536-128.2532 -33.0368 -33.0359 -32.9662 -32.9635 -31.2144 -31.2133 -31.0356 -31.0350 -26.9516 -26.9513 -25.3823 -25.3810 -24.9304 -24.9299 -23.0377 -23.0374 -19.5028 -19.5019 -19.4632 -19.4617 -18.7892 -18.7887 -17.1795 -17.1792 -16.3929 -16.3914 -16.2784 -16.2771 -16.0695 -16.0686 -15.0346 -15.0342 -14.2786 -14.2779 -13.6566 -13.6560 -13.4432 -13.4421 -12.3821 -12.3815 -11.7600 -11.7594 -11.0666 -11.0653 -10.7450 -10.7443 -9.4230 -9.4128 -9.2563 -9.2457 -8.8409 -8.8393 -8.0163 -8.0149 -7.6438 -7.6390 -7.5300 -7.5187 -7.4190 -7.4125 -7.1500 -7.1487 -6.7719 -6.7707 -2.2882 -2.2683 -1.7106 -1.6975 -0.6019 -0.5676 -0.4092 -0.3546 -0.3131 -0.2713 0.1739 0.2136 0.2748 0.3049 0.5647 0.6110 0.7880 0.8228 0.8930 0.9512 1.1256 1.1531 1.2771 1.3356 1.7267 1.8123 1.8560 1.9117 2.0178 2.1239 2.1601 2.1900 2.3358 2.4577 2.5014 2.5397 2.6118 2.6566 2.6907 2.7719 2.8651 2.9038 2.9516 3.0152 3.0748 3.1197 3.1843 3.2197 3.4433 3.4776 3.7540 3.7899 4.0378 4.1306 4.1894 4.2455 4.4394 4.4645 4.5599 4.6027 4.6549 4.6764 4.8264 4.8886 5.1373 5.1524 5.2786 5.3638 5.5254 5.5569 5.6220 5.6852 6.0804 6.1314 6.2392 6.2925 6.4795 6.5112 6.6435 6.6841 6.8390 6.8985 7.0659 7.1328 7.1895 7.2102 7.3148 7.3605 7.4393 7.5031 7.6060 7.7055 7.7772 7.8384 7.9204 7.9749 k = 0.6484 0.2838 0.3205 ( 16910 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3233-150.3211-146.9302-146.9285-145.5724-145.5704-141.2634-141.2623 -137.5659-137.5628-134.2915-134.2894-134.2286-134.2278-128.2566-128.2561 -33.0395 -33.0379 -32.9699 -32.9672 -31.2181 -31.2173 -31.0379 -31.0364 -26.9552 -26.9529 -25.3858 -25.3849 -24.9337 -24.9332 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6.6851 6.8279 6.8912 7.0554 7.1273 7.1876 7.2143 7.3204 7.3582 7.4327 7.5035 7.6120 7.7095 7.7680 7.8341 7.9183 7.9859 k = 0.6649 0.2654 0.3205 ( 16906 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3196-150.3171-146.9283-146.9266-145.5704-145.5685-141.2643-141.2627 -137.5658-137.5634-134.2882-134.2856-134.2292-134.2281-128.2572-128.2557 -33.0381 -33.0364 -32.9694 -32.9659 -31.2157 -31.2154 -31.0366 -31.0350 -26.9504 -26.9491 -25.3851 -25.3835 -24.9315 -24.9306 -23.0387 -23.0374 -19.5041 -19.5033 -19.4632 -19.4618 -18.7906 -18.7900 -17.1790 -17.1785 -16.3924 -16.3908 -16.2784 -16.2766 -16.0683 -16.0674 -15.0359 -15.0353 -14.2783 -14.2765 -13.6562 -13.6557 -13.4450 -13.4433 -12.3835 -12.3823 -11.7595 -11.7585 -11.0669 -11.0649 -10.7435 -10.7429 -9.4250 -9.4122 -9.2585 -9.2459 -8.8413 -8.8393 -8.0161 -8.0145 -7.6447 -7.6391 -7.5319 -7.5190 -7.4189 -7.4111 -7.1487 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3.7896 4.0320 4.1356 4.1982 4.2634 4.4329 4.4527 4.5525 4.6016 4.6522 4.6724 4.8222 4.8859 5.1381 5.1527 5.2509 5.3457 5.5090 5.5513 5.6102 5.6951 6.0851 6.1359 6.2454 6.3021 6.4814 6.5223 6.6369 6.6861 6.8176 6.8829 7.0468 7.1219 7.1867 7.2194 7.3266 7.3569 7.4260 7.5041 7.6177 7.7062 7.7608 7.8322 7.9163 7.9959 k = 0.3175-0.3536 0.6030 ( 16890 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3132-150.3116-146.9228-146.9220-145.5652-145.5639-141.2585-141.2567 -137.5634-137.5611-134.2828-134.2808-134.2238-134.2231-128.2517-128.2502 -33.0302 -33.0290 -32.9587 -32.9569 -31.2053 -31.2047 -31.0288 -31.0276 -26.9422 -26.9400 -25.3762 -25.3755 -24.9236 -24.9230 -23.0314 -23.0306 -19.5001 -19.4986 -19.4578 -19.4560 -18.7867 -18.7862 -17.1745 -17.1738 -16.3889 -16.3869 -16.2736 -16.2720 -16.0649 -16.0641 -15.0312 -15.0304 -14.2732 -14.2720 -13.6525 -13.6519 -13.4402 -13.4389 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************************************************************************ ************************************************************************ -150.3073-150.3056-146.9173-146.9158-145.5604-145.5584-141.2558-141.2536 -137.5603-137.5570-134.2778-134.2756-134.2206-134.2203-128.2489-128.2476 -33.0240 -33.0217 -32.9512 -32.9490 -31.1990 -31.1975 -31.0211 -31.0191 -26.9357 -26.9324 -25.3705 -25.3698 -24.9177 -24.9167 -23.0259 -23.0246 -19.4958 -19.4945 -19.4553 -19.4533 -18.7842 -18.7835 -17.1715 -17.1707 -16.3859 -16.3837 -16.2708 -16.2697 -16.0614 -16.0601 -15.0279 -15.0268 -14.2707 -14.2689 -13.6497 -13.6491 -13.4383 -13.4373 -12.3782 -12.3753 -11.7533 -11.7522 -11.0598 -11.0593 -10.7383 -10.7370 -9.4218 -9.4086 -9.2580 -9.2436 -8.8415 -8.8392 -8.0158 -8.0139 -7.6454 -7.6394 -7.5336 -7.5196 -7.4185 -7.4097 -7.1471 -7.1457 -6.7715 -6.7701 -2.2954 -2.2691 -1.7197 -1.7017 -0.6154 -0.5731 -0.4102 -0.3306 -0.3069 -0.2567 0.1696 0.2142 0.2676 0.3130 0.5683 0.6192 0.8138 0.8551 0.8823 0.9422 1.1379 1.1627 1.2583 1.3378 1.6961 1.7774 1.8209 1.8952 2.0186 2.1181 2.1835 2.2140 2.3239 2.4268 2.5406 2.5622 2.6048 2.6790 2.6980 2.7710 2.8627 2.9019 2.9716 3.0385 3.0931 3.1420 3.1839 3.2346 3.4480 3.4913 3.7461 3.7893 4.0275 4.1399 4.2091 4.2818 4.4263 4.4392 4.5458 4.5970 4.6522 4.6679 4.8223 4.8806 5.1326 5.1518 5.2330 5.3352 5.4894 5.5452 5.5998 5.7037 6.0903 6.1392 6.2542 6.3140 6.4865 6.5352 6.6320 6.6887 6.7991 6.8623 7.0347 7.1114 7.1888 7.2327 7.3351 7.3614 7.4117 7.5064 7.6232 7.6774 7.7516 7.8360 7.9135 8.0097 k = 0.2822-0.3143 0.6030 ( 16882 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3087-150.3068-146.9182-146.9171-145.5613-145.5597-141.2567-141.2555 -137.5607-137.5587-134.2788-134.2767-134.2220-134.2211-128.2503-128.2488 -33.0254 -33.0233 -32.9545 -32.9523 -31.2004 -31.1996 -31.0226 -31.0212 -26.9378 -26.9360 -25.3736 -25.3725 -24.9200 -24.9193 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6.6891 6.7911 6.8511 7.0303 7.1060 7.1909 7.2399 7.3349 7.3670 7.4042 7.5060 7.6188 7.6582 7.7481 7.8386 7.9126 8.0122 k = 0.2646-0.2946 0.6030 ( 16882 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3089-150.3078-146.9164-146.9157-145.5597-145.5586-141.2590-141.2579 -137.5590-137.5574-134.2781-134.2768-134.2212-134.2202-128.2498-128.2480 -33.0254 -33.0237 -32.9541 -32.9522 -31.2019 -31.2004 -31.0216 -31.0202 -26.9380 -26.9361 -25.3732 -25.3725 -24.9205 -24.9194 -23.0286 -23.0272 -19.4996 -19.4983 -19.4559 -19.4540 -18.7873 -18.7868 -17.1716 -17.1709 -16.3857 -16.3833 -16.2712 -16.2704 -16.0635 -16.0620 -15.0285 -15.0277 -14.2715 -14.2699 -13.6504 -13.6499 -13.4414 -13.4405 -12.3776 -12.3758 -11.7539 -11.7528 -11.0633 -11.0623 -10.7390 -10.7373 -9.4233 -9.4096 -9.2599 -9.2452 -8.8420 -8.8394 -8.0154 -8.0133 -7.6460 -7.6399 -7.5349 -7.5206 -7.4181 -7.4086 -7.1457 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3.7858 4.0178 4.1382 4.2233 4.3015 4.4140 4.4208 4.5310 4.5789 4.6455 4.6682 4.8274 4.8669 5.0983 5.1449 5.2291 5.3318 5.4578 5.5237 5.5940 5.7091 6.0920 6.1381 6.2609 6.3284 6.4958 6.5459 6.6309 6.6914 6.7792 6.8316 7.0260 7.0963 7.1982 7.2592 7.3313 7.3824 7.3923 7.5005 7.5934 7.6307 7.7450 7.8414 7.9145 8.0094 k = 0.2293-0.2554 0.6030 ( 16864 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3039-150.3021-146.9134-146.9116-145.5565-145.5546-141.2512-141.2482 -137.5531-137.5517-134.2744-134.2731-134.2166-134.2152-128.2464-128.2441 -33.0116 -33.0088 -32.9460 -32.9436 -31.1921 -31.1885 -31.0115 -31.0090 -26.9334 -26.9298 -25.3631 -25.3612 -24.9130 -24.9101 -23.0217 -23.0191 -19.4908 -19.4897 -19.4503 -19.4485 -18.7824 -18.7816 -17.1664 -17.1655 -16.3829 -16.3787 -16.2679 -16.2663 -16.0595 -16.0564 -15.0233 -15.0222 -14.2665 -14.2640 -13.6479 -13.6475 -13.4342 -13.4338 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1.1343 1.1834 1.2417 1.3220 1.6898 1.7530 1.8045 1.8875 2.0209 2.0915 2.2082 2.2525 2.3315 2.4003 2.5522 2.5987 2.6397 2.7005 2.7332 2.7513 2.8648 2.8959 2.9853 3.0454 3.1302 3.1589 3.2059 3.2496 3.4576 3.5069 3.7381 3.7827 4.0081 4.1293 4.2303 4.3087 4.4045 4.4113 4.5190 4.5627 4.6385 4.6702 4.8315 4.8567 5.0692 5.1339 5.2337 5.3328 5.4392 5.5059 5.5937 5.7063 6.0904 6.1357 6.2610 6.3311 6.5060 6.5463 6.6342 6.6925 6.7696 6.8169 7.0236 7.0863 7.2087 7.2806 7.3230 7.3809 7.3996 7.4784 7.5627 7.6134 7.7451 7.8394 7.9208 8.0000 k = 0.1940-0.2161 0.6030 ( 16890 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3130-150.3120-146.9189-146.9171-145.5615-145.5596-141.2580-141.2557 -137.5622-137.5593-134.2830-134.2821-134.2262-134.2248-128.2556-128.2541 -33.0248 -33.0213 -32.9638 -32.9617 -31.2057 -31.2037 -31.0281 -31.0246 -26.9450 -26.9402 -25.3766 -25.3746 -24.9261 -24.9236 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6.6933 6.7653 6.8113 7.0232 7.0817 7.2149 7.2902 7.3184 7.3776 7.4062 7.4627 7.5510 7.6079 7.7445 7.8370 7.9249 7.9934 k = 0.1764-0.1964 0.6030 ( 16886 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3125-150.3108-146.9185-146.9154-145.5613-145.5584-141.2562-141.2547 -137.5614-137.5585-134.2824-134.2804-134.2224-134.2209-128.2519-128.2504 -33.0228 -33.0186 -32.9621 -32.9593 -31.2037 -31.2009 -31.0263 -31.0221 -26.9437 -26.9384 -25.3758 -25.3730 -24.9255 -24.9224 -23.0320 -23.0292 -19.4980 -19.4964 -19.4570 -19.4548 -18.7897 -18.7891 -17.1736 -17.1730 -16.3893 -16.3849 -16.2716 -16.2704 -16.0642 -16.0617 -15.0320 -15.0306 -14.2727 -14.2690 -13.6515 -13.6508 -13.4401 -13.4394 -12.3822 -12.3781 -11.7546 -11.7539 -11.0638 -11.0611 -10.7403 -10.7382 -9.4212 -9.4097 -9.2621 -9.2473 -8.8425 -8.8400 -8.0140 -8.0119 -7.6467 -7.6416 -7.5364 -7.5241 -7.4163 -7.4071 -7.1425 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3.7762 3.9941 4.1065 4.2373 4.3099 4.3959 4.3997 4.5020 4.5374 4.6340 4.6717 4.8323 4.8497 5.0329 5.1075 5.2444 5.3286 5.4262 5.4838 5.5937 5.6932 6.0875 6.1311 6.2583 6.3248 6.5277 6.5489 6.6316 6.6978 6.7597 6.8018 7.0239 7.0735 7.2299 7.2928 7.3243 7.3761 7.4103 7.4404 7.5331 7.6044 7.7406 7.8317 7.9369 7.9797 k = 0.1411-0.1571 0.6030 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3178-150.3150-146.9237-146.9202-145.5665-145.5630-141.2633-141.2606 -137.5675-137.5637-134.2870-134.2848-134.2287-134.2260-128.2575-128.2549 -33.0319 -33.0264 -32.9743 -32.9697 -31.2144 -31.2100 -31.0348 -31.0293 -26.9505 -26.9444 -25.3856 -25.3816 -24.9344 -24.9297 -23.0392 -23.0351 -19.5021 -19.5002 -19.4641 -19.4616 -18.7934 -18.7924 -17.1799 -17.1792 -16.3947 -16.3895 -16.2756 -16.2736 -16.0680 -16.0645 -15.0366 -15.0350 -14.2792 -14.2743 -13.6549 -13.6541 -13.4445 -13.4435 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3.7395 4.0183 4.0183 4.2634 4.2634 4.3943 4.3943 4.4898 4.4898 4.6676 4.6676 4.8336 4.8336 5.0242 5.0242 5.2765 5.2765 5.4720 5.4720 5.6143 5.6143 6.1055 6.1055 6.2728 6.2728 6.5713 6.5713 6.6688 6.6688 6.7665 6.7665 7.0537 7.0537 7.2226 7.2226 7.3944 7.3944 7.4578 7.4578 7.5616 7.5616 7.7263 7.7263 7.9756 7.9758 k = 0.0190 0.0171 0.6030 ( 16888 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3127-150.3109-146.9209-146.9191-145.5627-145.5614-141.2575-141.2561 -137.5681-137.5670-134.2834-134.2820-134.2209-134.2197-128.2504-128.2493 -33.0248 -33.0227 -32.9685 -32.9657 -31.2048 -31.2024 -31.0296 -31.0272 -26.9381 -26.9355 -25.3836 -25.3810 -24.9293 -24.9274 -23.0332 -23.0312 -19.5006 -19.5001 -19.4578 -19.4572 -18.7887 -18.7881 -17.1751 -17.1748 -16.3902 -16.3887 -16.2682 -16.2650 -16.0623 -16.0602 -15.0373 -15.0368 -14.2730 -14.2712 -13.6486 -13.6478 -13.4383 -13.4378 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************************************************************************ ************************************************************************ -150.3089-150.3074-146.9161-146.9141-145.5581-145.5564-141.2544-141.2528 -137.5648-137.5637-134.2804-134.2788-134.2193-134.2175-128.2489-128.2472 -33.0183 -33.0154 -32.9615 -32.9587 -31.1981 -31.1953 -31.0228 -31.0196 -26.9335 -26.9314 -25.3773 -25.3749 -24.9239 -24.9214 -23.0287 -23.0261 -19.4968 -19.4959 -19.4541 -19.4533 -18.7870 -18.7863 -17.1714 -17.1710 -16.3866 -16.3848 -16.2664 -16.2627 -16.0598 -16.0575 -15.0333 -15.0328 -14.2693 -14.2669 -13.6461 -13.6454 -13.4359 -13.4353 -12.3838 -12.3819 -11.7518 -11.7511 -11.0599 -11.0583 -10.7347 -10.7327 -9.4136 -9.4122 -9.2576 -9.2533 -8.8420 -8.8417 -8.0117 -8.0104 -7.6456 -7.6452 -7.5325 -7.5312 -7.4110 -7.4096 -7.1401 -7.1391 -6.7706 -6.7700 -2.2947 -2.2879 -1.7145 -1.7131 -0.6383 -0.6179 -0.3733 -0.3518 -0.2200 -0.1967 0.1665 0.1858 0.2386 0.2574 0.5267 0.5410 0.7737 0.8147 0.9884 0.9963 1.1394 1.1598 1.2363 1.2579 1.7709 1.7843 1.8667 1.8803 2.0173 2.0417 2.2381 2.2605 2.4057 2.4459 2.5486 2.5738 2.6726 2.6824 2.7678 2.8081 2.8916 2.9121 3.0412 3.0594 3.1196 3.1461 3.2651 3.2883 3.4746 3.4999 3.7167 3.7599 4.0030 4.0380 4.2562 4.2653 4.3888 4.4055 4.4786 4.5038 4.6575 4.6768 4.8303 4.8377 5.0242 5.0297 5.2727 5.2830 5.4648 5.4810 5.6074 5.6232 6.1001 6.1094 6.2532 6.2883 6.5601 6.5831 6.6541 6.6757 6.7602 6.7790 7.0432 7.0656 7.2167 7.2349 7.3836 7.4062 7.4435 7.4773 7.5532 7.5763 7.7056 7.7478 7.9523 7.9988 k = 0.0571 0.0513 0.6030 ( 16871 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3072-150.3055-146.9134-146.9116-145.5556-145.5543-141.2528-141.2520 -137.5606-137.5602-134.2785-134.2769-134.2170-134.2162-128.2469-128.2461 -33.0140 -33.0120 -32.9565 -32.9548 -31.1948 -31.1935 -31.0180 -31.0158 -26.9286 -26.9275 -25.3727 -25.3713 -24.9200 -24.9189 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6.6748 6.7601 6.7858 7.0395 7.0702 7.2165 7.2421 7.3798 7.4102 7.4398 7.4857 7.5514 7.5864 7.6950 7.7590 7.9418 8.0066 k = 0.0761 0.0684 0.6030 ( 16871 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3085-150.3054-146.9133-146.9112-145.5567-145.5550-141.2531-141.2507 -137.5574-137.5559-134.2790-134.2772-134.2184-134.2143-128.2478-128.2448 -33.0145 -33.0113 -32.9557 -32.9515 -31.1973 -31.1932 -31.0178 -31.0150 -26.9304 -26.9292 -25.3718 -25.3688 -24.9222 -24.9180 -23.0274 -23.0231 -19.4927 -19.4913 -19.4522 -19.4505 -18.7862 -18.7853 -17.1708 -17.1707 -16.3873 -16.3857 -16.2657 -16.2638 -16.0605 -16.0563 -15.0295 -15.0291 -14.2683 -14.2657 -13.6455 -13.6446 -13.4358 -13.4349 -12.3793 -12.3784 -11.7514 -11.7503 -11.0580 -11.0551 -10.7364 -10.7316 -9.4157 -9.4104 -9.2580 -9.2520 -8.8420 -8.8413 -8.0123 -8.0097 -7.6473 -7.6464 -7.5317 -7.5293 -7.4122 -7.4094 -7.1405 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3.7713 3.9955 4.0634 4.2354 4.2568 4.3934 4.4185 4.4726 4.5234 4.6428 4.6824 4.8251 4.8424 5.0333 5.0458 5.2721 5.2961 5.4565 5.4943 5.6005 5.6363 6.0872 6.1074 6.2218 6.2981 6.5417 6.5935 6.6386 6.6678 6.7613 6.7985 7.0357 7.0775 7.2197 7.2546 7.3771 7.4126 7.4367 7.4951 7.5514 7.6130 7.6746 7.7820 7.9259 8.0131 k = 0.1142 0.1026 0.6030 ( 16858 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3056-150.3026-146.9077-146.9054-145.5510-145.5488-141.2503-141.2484 -137.5550-137.5548-134.2763-134.2743-134.2137-134.2109-128.2433-128.2411 -33.0071 -33.0032 -32.9480 -32.9443 -31.1903 -31.1867 -31.0100 -31.0064 -26.9247 -26.9237 -25.3650 -25.3626 -24.9150 -24.9116 -23.0212 -23.0183 -19.4899 -19.4894 -19.4494 -19.4479 -18.7831 -18.7820 -17.1672 -17.1668 -16.3834 -16.3818 -16.2629 -16.2590 -16.0567 -16.0541 -15.0250 -15.0246 -14.2657 -14.2627 -13.6415 -13.6407 -13.4338 -13.4329 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1.0942 1.1197 1.2735 1.3083 1.7373 1.7814 1.8596 1.8907 2.0096 2.0834 2.2194 2.3019 2.3552 2.4702 2.5072 2.5897 2.6223 2.6468 2.7680 2.8495 2.8654 2.9344 3.0125 3.0536 3.0951 3.1429 3.2488 3.2914 3.5052 3.5748 3.6727 3.7644 4.0030 4.0753 4.2175 4.2445 4.4011 4.4224 4.4789 4.5336 4.6359 4.6804 4.8211 4.8443 5.0455 5.0609 5.2756 5.3052 5.4527 5.5043 5.5987 5.6443 6.0747 6.1001 6.2033 6.2964 6.5266 6.5880 6.6432 6.6610 6.7640 6.8089 7.0387 7.0834 7.2243 7.2644 7.3786 7.4156 7.4359 7.4959 7.5549 7.6431 7.6608 7.8056 7.9172 8.0175 k = 0.1523 0.1368 0.6030 ( 16875 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3116-150.3089-146.9152-146.9144-145.5569-145.5563-141.2530-141.2520 -137.5619-137.5605-134.2820-134.2795-134.2182-134.2169-128.2477-128.2465 -33.0173 -33.0158 -32.9554 -32.9519 -31.1979 -31.1961 -31.0192 -31.0169 -26.9347 -26.9332 -25.3722 -25.3702 -24.9209 -24.9191 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6.6608 6.7653 6.8135 7.0423 7.0869 7.2263 7.2680 7.3779 7.4181 7.4373 7.4935 7.5573 7.6453 7.6684 7.8164 7.9151 8.0198 k = 0.1713 0.1539 0.6030 ( 16876 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3131-150.3098-146.9185-146.9166-145.5598-145.5579-141.2533-141.2530 -137.5592-137.5588-134.2821-134.2799-134.2179-134.2163-128.2476-128.2461 -33.0163 -33.0135 -32.9558 -32.9527 -31.1989 -31.1977 -31.0185 -31.0161 -26.9362 -26.9357 -25.3718 -25.3696 -24.9213 -24.9194 -23.0280 -23.0263 -19.4971 -19.4957 -19.4560 -19.4535 -18.7865 -18.7860 -17.1703 -17.1700 -16.3865 -16.3830 -16.2697 -16.2655 -16.0605 -16.0596 -15.0308 -15.0305 -14.2707 -14.2680 -13.6487 -13.6479 -13.4392 -13.4386 -12.3800 -12.3790 -11.7524 -11.7519 -11.0620 -11.0593 -10.7368 -10.7345 -9.4192 -9.4113 -9.2594 -9.2470 -8.8417 -8.8396 -8.0136 -8.0083 -7.6540 -7.6513 -7.5267 -7.5226 -7.4164 -7.4107 -7.1410 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3.7426 4.0205 4.0834 4.1921 4.2197 4.4125 4.4283 4.4972 4.5431 4.6309 4.6721 4.8146 4.8458 5.0696 5.0878 5.2855 5.3212 5.4518 5.5241 5.5999 5.6555 6.0520 6.0853 6.1810 6.2882 6.5036 6.5684 6.6506 6.6692 6.7706 6.8214 7.0537 7.0970 7.2300 7.2726 7.3726 7.4154 7.4508 7.4887 7.5649 7.6383 7.6988 7.8343 7.9155 8.0244 k = 0.2094 0.1880 0.6030 ( 16888 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3157-150.3140-146.9246-146.9229-145.5665-145.5645-141.2586-141.2567 -137.5610-137.5601-134.2844-134.2829-134.2216-134.2203-128.2509-128.2493 -33.0233 -33.0221 -32.9622 -32.9605 -31.2054 -31.2040 -31.0258 -31.0247 -26.9440 -26.9427 -25.3764 -25.3750 -24.9255 -24.9241 -23.0327 -23.0315 -19.5002 -19.4995 -19.4592 -19.4581 -18.7890 -18.7885 -17.1733 -17.1727 -16.3873 -16.3850 -16.2746 -16.2710 -16.0659 -16.0646 -15.0330 -15.0328 -14.2735 -14.2721 -13.6533 -13.6527 -13.4411 -13.4408 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************************************************************************ ************************************************************************ -150.3138-150.3111-146.9219-146.9203-145.5647-145.5630-141.2586-141.2569 -137.5597-137.5582-134.2829-134.2803-134.2201-134.2196-128.2498-128.2487 -33.0219 -33.0204 -32.9608 -32.9590 -31.2033 -31.2021 -31.0241 -31.0229 -26.9433 -26.9418 -25.3759 -25.3740 -24.9241 -24.9234 -23.0314 -23.0308 -19.4997 -19.4990 -19.4560 -19.4547 -18.7878 -18.7874 -17.1720 -17.1713 -16.3862 -16.3834 -16.2743 -16.2701 -16.0644 -16.0634 -15.0309 -15.0307 -14.2715 -14.2699 -13.6519 -13.6513 -13.4401 -13.4398 -12.3804 -12.3788 -11.7541 -11.7534 -11.0643 -11.0619 -10.7390 -10.7377 -9.4204 -9.4121 -9.2590 -9.2452 -8.8417 -8.8383 -8.0140 -8.0074 -7.6583 -7.6539 -7.5232 -7.5187 -7.4193 -7.4124 -7.1412 -7.1367 -6.7721 -6.7695 -2.3059 -2.2773 -1.7133 -1.7108 -0.6906 -0.6392 -0.3824 -0.3409 -0.1843 -0.1097 0.1565 0.1746 0.2814 0.3430 0.5187 0.5535 0.7418 0.8645 0.8805 0.9611 1.0560 1.0936 1.3319 1.3520 1.6972 1.7591 1.8800 1.9018 2.0203 2.1205 2.1885 2.3188 2.3474 2.4054 2.4866 2.5554 2.5973 2.6370 2.7871 2.8173 2.8579 2.9449 3.0070 3.0452 3.1027 3.1477 3.1979 3.2487 3.5584 3.6084 3.6990 3.7333 4.0287 4.0835 4.1775 4.2020 4.4213 4.4327 4.5104 4.5466 4.6293 4.6657 4.8112 4.8471 5.0851 5.1073 5.2922 5.3315 5.4550 5.5407 5.6034 5.6630 6.0334 6.0746 6.1693 6.2824 6.4911 6.5519 6.6522 6.6814 6.7795 6.8296 7.0665 7.1119 7.2346 7.2713 7.3663 7.4027 7.4722 7.4859 7.5720 7.6376 7.7251 7.8451 7.9182 8.0285 k = 0.2475 0.2222 0.6030 ( 16890 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3155-150.3122-146.9223-146.9212-145.5655-145.5641-141.2600-141.2578 -137.5620-137.5591-134.2843-134.2813-134.2216-134.2209-128.2508-128.2498 -33.0256 -33.0243 -32.9636 -32.9610 -31.2071 -31.2054 -31.0285 -31.0272 -26.9457 -26.9433 -25.3780 -25.3755 -24.9277 -24.9265 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6.6878 6.7855 6.8351 7.0729 7.1211 7.2379 7.2684 7.3650 7.3949 7.4813 7.4876 7.5744 7.6404 7.7359 7.8487 7.9191 8.0314 k = 0.2665 0.2393 0.6030 ( 16890 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3147-150.3124-146.9243-146.9219-145.5675-145.5653-141.2601-141.2585 -137.5618-137.5590-134.2838-134.2810-134.2225-134.2213-128.2512-128.2501 -33.0265 -33.0249 -32.9626 -32.9616 -31.2065 -31.2057 -31.0289 -31.0273 -26.9461 -26.9443 -25.3776 -25.3764 -24.9259 -24.9248 -23.0337 -23.0326 -19.5012 -19.5006 -19.4570 -19.4562 -18.7882 -18.7878 -17.1735 -17.1726 -16.3877 -16.3841 -16.2770 -16.2739 -16.0658 -16.0653 -15.0321 -15.0318 -14.2724 -14.2710 -13.6549 -13.6539 -13.4421 -13.4416 -12.3818 -12.3802 -11.7571 -11.7561 -11.0650 -11.0632 -10.7421 -10.7404 -9.4214 -9.4136 -9.2590 -9.2452 -8.8418 -8.8372 -8.0140 -8.0068 -7.6605 -7.6550 -7.5212 -7.5164 -7.4210 -7.4139 -7.1413 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3.7608 4.0318 4.0804 4.1608 4.1797 4.4312 4.4462 4.5304 4.5562 4.6234 4.6632 4.8082 4.8509 5.1058 5.1364 5.3019 5.3490 5.4664 5.5705 5.6151 5.6773 6.0060 6.0636 6.1601 6.2764 6.4793 6.5301 6.6508 6.7013 6.7981 6.8528 7.0856 7.1426 7.2459 7.2602 7.3634 7.3820 7.4868 7.5061 7.5787 7.6516 7.7548 7.8547 7.9177 8.0374 k = 0.3046 0.2735 0.6030 ( 16886 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3130-150.3105-146.9221-146.9200-145.5656-145.5634-141.2584-141.2553 -137.5635-137.5591-134.2826-134.2798-134.2205-134.2188-128.2492-128.2476 -33.0257 -33.0236 -32.9604 -32.9577 -31.2034 -31.2001 -31.0280 -31.0261 -26.9461 -26.9423 -25.3755 -25.3729 -24.9241 -24.9219 -23.0323 -23.0302 -19.5006 -19.4996 -19.4553 -19.4544 -18.7877 -18.7873 -17.1724 -17.1715 -16.3863 -16.3822 -16.2773 -16.2722 -16.0668 -16.0639 -15.0308 -15.0300 -14.2714 -14.2695 -13.6546 -13.6536 -13.4405 -13.4401 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************************************************************************ ************************************************************************ -150.3117-150.3094-146.9206-146.9181-145.5640-145.5614-141.2590-141.2553 -137.5636-137.5598-134.2818-134.2792-134.2199-134.2181-128.2486-128.2469 -33.0248 -33.0215 -32.9590 -32.9554 -31.2024 -31.1981 -31.0267 -31.0239 -26.9442 -26.9402 -25.3747 -25.3717 -24.9218 -24.9191 -23.0309 -23.0281 -19.5007 -19.4995 -19.4550 -19.4542 -18.7864 -18.7858 -17.1711 -17.1702 -16.3851 -16.3802 -16.2769 -16.2716 -16.0662 -16.0623 -15.0300 -15.0292 -14.2708 -14.2684 -13.6539 -13.6528 -13.4402 -13.4398 -12.3809 -12.3776 -11.7562 -11.7550 -11.0660 -11.0624 -10.7418 -10.7401 -9.4196 -9.4141 -9.2575 -9.2436 -8.8422 -8.8356 -8.0136 -8.0057 -7.6624 -7.6552 -7.5191 -7.5140 -7.4232 -7.4162 -7.1414 -7.1370 -6.7725 -6.7698 -2.3102 -2.2818 -1.7120 -1.7058 -0.6752 -0.6315 -0.3851 -0.3536 -0.2029 -0.1418 0.1707 0.1820 0.3046 0.3730 0.5417 0.5728 0.7887 0.8027 0.8775 0.9373 1.0307 1.0959 1.3621 1.3773 1.6895 1.7516 1.8969 1.9153 2.0328 2.1088 2.1824 2.3132 2.3267 2.3794 2.4375 2.5035 2.6098 2.6615 2.7800 2.8114 2.8528 2.9340 2.9916 3.0524 3.0913 3.1325 3.1824 3.2023 3.5394 3.6045 3.7016 3.7809 4.0280 4.0785 4.1490 4.1725 4.4322 4.4585 4.5417 4.5652 4.6181 4.6644 4.8079 4.8550 5.1161 5.1532 5.3067 5.3590 5.4779 5.5887 5.6261 5.6874 5.9912 6.0594 6.1593 6.2708 6.4746 6.5188 6.6472 6.7126 6.8100 6.8769 7.0960 7.1642 7.2449 7.2624 7.3520 7.3837 7.4895 7.5251 7.5819 7.6656 7.7708 7.8593 7.9092 8.0249 k = 0.3427 0.3077 0.6030 ( 16877 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3103-150.3075-146.9155-146.9143-145.5595-145.5581-141.2576-141.2537 -137.5602-137.5563-134.2799-134.2774-134.2190-134.2157-128.2475-128.2448 -33.0185 -33.0173 -32.9558 -32.9523 -31.2005 -31.1962 -31.0206 -31.0196 -26.9406 -26.9364 -25.3716 -25.3684 -24.9209 -24.9174 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6.7169 6.8167 6.8901 7.0999 7.1737 7.2414 7.2683 7.3455 7.3875 7.4912 7.5347 7.5836 7.6724 7.7791 7.8601 7.9040 8.0106 k = 0.3617 0.3248 0.6030 ( 16874 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3081-150.3052-146.9139-146.9129-145.5579-145.5572-141.2585-141.2545 -137.5586-137.5545-134.2778-134.2753-134.2203-134.2163-128.2483-128.2449 -33.0177 -33.0158 -32.9546 -32.9503 -31.1991 -31.1947 -31.0192 -31.0174 -26.9372 -26.9323 -25.3708 -25.3669 -24.9193 -24.9148 -23.0284 -23.0239 -19.4966 -19.4955 -19.4510 -19.4503 -18.7853 -18.7843 -17.1682 -17.1676 -16.3827 -16.3796 -16.2750 -16.2680 -16.0633 -16.0590 -15.0266 -15.0257 -14.2678 -14.2659 -13.6506 -13.6494 -13.4397 -13.4385 -12.3783 -12.3742 -11.7534 -11.7520 -11.0627 -11.0589 -10.7391 -10.7361 -9.4186 -9.4150 -9.2567 -9.2430 -8.8428 -8.8348 -8.0129 -8.0048 -7.6626 -7.6544 -7.5186 -7.5130 -7.4240 -7.4177 -7.1416 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3.7988 4.0214 4.0748 4.1367 4.1723 4.4325 4.4735 4.5593 4.5776 4.6207 4.6679 4.8104 4.8626 5.1261 5.1701 5.3157 5.3701 5.5022 5.6070 5.6462 5.7047 5.9812 6.0587 6.1666 6.2599 6.4710 6.5097 6.6425 6.7210 6.8325 6.9156 7.1054 7.1882 7.2363 7.2800 7.3350 7.3953 7.4972 7.5541 7.5877 7.6829 7.7972 7.8532 7.8956 7.9802 k = 0.3998 0.3590 0.6030 ( 16887 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3138-150.3091-146.9212-146.9198-145.5648-145.5641-141.2614-141.2568 -137.5604-137.5557-134.2828-134.2784-134.2238-134.2189-128.2517-128.2471 -33.0265 -33.0238 -32.9620 -32.9552 -31.2062 -31.2002 -31.0288 -31.0251 -26.9437 -26.9378 -25.3776 -25.3725 -24.9265 -24.9200 -23.0349 -23.0283 -19.4990 -19.4979 -19.4562 -19.4549 -18.7883 -18.7867 -17.1718 -17.1714 -16.3868 -16.3839 -16.2783 -16.2701 -16.0682 -16.0625 -15.0313 -15.0304 -14.2720 -14.2691 -13.6540 -13.6523 -13.4408 -13.4389 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************************************************************************ ************************************************************************ -150.3127-150.3127-146.9197-146.9197-145.5628-145.5628-141.2607-141.2607 -137.5617-137.5617-134.2829-134.2829-134.2228-134.2228-128.2516-128.2516 -33.0402 -33.0402 -32.9507 -32.9507 -31.2084 -31.2084 -31.0310 -31.0310 -26.9427 -26.9427 -25.3773 -25.3773 -24.9252 -24.9252 -23.0327 -23.0327 -19.5006 -19.5006 -19.4563 -19.4563 -18.7871 -18.7871 -17.1726 -17.1726 -16.3839 -16.3839 -16.2775 -16.2775 -16.0642 -16.0642 -15.0310 -15.0310 -14.2708 -14.2708 -13.6536 -13.6536 -13.4453 -13.4453 -12.3801 -12.3801 -11.7576 -11.7576 -11.0630 -11.0630 -10.7426 -10.7426 -9.4217 -9.4217 -9.2564 -9.2564 -8.8420 -8.8420 -7.9908 -7.9908 -7.6652 -7.6652 -7.5128 -7.5128 -7.4274 -7.4274 -7.1301 -7.1301 -6.7696 -6.7696 -2.3605 -2.3605 -1.7205 -1.7205 -0.6218 -0.6218 -0.4430 -0.4430 -0.1956 -0.1956 0.2081 0.2081 0.4190 0.4190 0.6087 0.6087 0.8381 0.8381 0.9835 0.9835 1.0136 1.0136 1.3574 1.3574 1.7319 1.7319 1.8960 1.8960 2.0512 2.0512 2.1898 2.1898 2.3272 2.3272 2.5082 2.5082 2.6434 2.6434 2.8204 2.8204 2.9073 2.9073 3.0195 3.0195 3.1070 3.1070 3.1602 3.1602 3.5035 3.5035 3.7963 3.7963 3.9736 3.9736 4.1422 4.1422 4.4349 4.4349 4.5573 4.5573 4.6658 4.6658 4.8133 4.8133 5.1835 5.1835 5.3020 5.3020 5.5935 5.5935 5.7206 5.7206 5.9867 5.9867 6.1791 6.1791 6.4850 6.4850 6.6956 6.6956 6.8850 6.8850 7.1319 7.1319 7.2863 7.2863 7.4796 7.4796 7.5867 7.5867 7.6407 7.6407 7.7973 7.7973 8.0206 8.0206 k = 0.5128 0.4348-0.2825 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3173-150.3159-146.9242-146.9235-145.5671-145.5665-141.2627-141.2621 -137.5632-137.5621-134.2865-134.2851-134.2249-134.2240-128.2532-128.2526 -33.0477 -33.0464 -32.9527 -32.9522 -31.2123 -31.2118 -31.0356 -31.0350 -26.9488 -26.9487 -25.3806 -25.3800 -24.9299 -24.9295 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6.6977 6.8806 6.8893 7.1279 7.1350 7.2835 7.2888 7.4766 7.4813 7.5819 7.5900 7.6360 7.6447 7.7910 7.8029 8.0164 8.0250 k = 0.4872-0.5426 0.0000 ( 16902 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3173-150.3159-146.9242-146.9235-145.5671-145.5665-141.2627-141.2621 -137.5632-137.5621-134.2865-134.2851-134.2249-134.2240-128.2532-128.2526 -33.0477 -33.0464 -32.9527 -32.9522 -31.2123 -31.2118 -31.0356 -31.0350 -26.9488 -26.9487 -25.3806 -25.3800 -24.9299 -24.9295 -23.0373 -23.0368 -19.5030 -19.5028 -19.4584 -19.4582 -18.7898 -18.7896 -17.1751 -17.1750 -16.3864 -16.3859 -16.2802 -16.2795 -16.0677 -16.0673 -15.0326 -15.0324 -14.2736 -14.2731 -13.6561 -13.6560 -13.4467 -13.4464 -12.3814 -12.3813 -11.7592 -11.7591 -11.0653 -11.0648 -10.7448 -10.7445 -9.4228 -9.4216 -9.2573 -9.2564 -8.8422 -8.8419 -7.9910 -7.9907 -7.6654 -7.6649 -7.5129 -7.5128 -7.4277 -7.4271 -7.1302 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1.0063 1.0358 1.3492 1.3640 1.7264 1.7531 1.8797 1.9263 2.0321 2.0595 2.1784 2.2145 2.3164 2.3445 2.4901 2.5302 2.6276 2.6596 2.7938 2.8371 2.8917 2.9318 3.0133 3.0242 3.1002 3.1277 3.1460 3.1928 3.4905 3.5174 3.7802 3.7926 3.9585 3.9935 4.1285 4.1436 4.4197 4.4395 4.5447 4.5684 4.6431 4.6896 4.8052 4.8340 5.1743 5.1892 5.2894 5.3144 5.5724 5.5925 5.6992 5.7335 5.9633 6.0154 6.1705 6.2016 6.4794 6.4994 6.6762 6.7016 6.8667 6.9069 7.1122 7.1471 7.2742 7.2992 7.4620 7.4826 7.5564 7.5893 7.6277 7.6599 7.7719 7.8253 8.0106 8.0392 k = 0.4176-0.4651 0.0000 ( 16888 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3140-150.3118-146.9186-146.9170-145.5619-145.5600-141.2580-141.2559 -137.5581-137.5573-134.2845-134.2805-134.2223-134.2185-128.2500-128.2479 -33.0337 -33.0316 -32.9499 -32.9471 -31.2050 -31.2027 -31.0264 -31.0237 -26.9405 -26.9386 -25.3741 -25.3717 -24.9261 -24.9236 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3.7779 3.9585 4.0039 4.1111 4.1370 4.4031 4.4295 4.5369 4.5731 4.6289 4.7004 4.8113 4.8543 5.1675 5.1902 5.2794 5.3204 5.5461 5.5713 5.6808 5.7324 5.9574 6.0367 6.1761 6.2230 6.4841 6.5140 6.6537 6.6917 6.8576 6.9189 7.0917 7.1553 7.2674 7.3077 7.4377 7.4751 7.5245 7.5689 7.6272 7.6669 7.7582 7.8382 7.9926 8.0296 k = 0.3654-0.4069 0.0000 ( 16904 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3206-150.3199-146.9240-146.9218-145.5665-145.5643-141.2624-141.2607 -137.5641-137.5614-134.2903-134.2878-134.2269-134.2235-128.2543-128.2526 -33.0410 -33.0384 -32.9613 -32.9588 -31.2131 -31.2111 -31.0353 -31.0322 -26.9510 -26.9469 -25.3816 -25.3791 -24.9338 -24.9312 -23.0402 -23.0380 -19.5011 -19.5001 -19.4608 -19.4603 -18.7927 -18.7923 -17.1778 -17.1769 -16.3911 -16.3888 -16.2772 -16.2751 -16.0698 -16.0675 -15.0332 -15.0323 -14.2765 -14.2739 -13.6542 -13.6533 -13.4450 -13.4441 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1.0184 1.0748 1.4105 1.4349 1.7064 1.7432 1.8249 1.8701 2.0512 2.0768 2.1955 2.2407 2.4598 2.4783 2.5757 2.5924 2.6385 2.6670 2.8925 2.9190 2.9304 2.9748 3.0732 3.1176 3.1351 3.1833 3.3047 3.3366 3.4790 3.5463 3.6609 3.7358 3.9440 4.0159 4.1525 4.1756 4.3306 4.3619 4.5120 4.5330 4.6370 4.6790 4.8571 4.9011 5.1166 5.1437 5.2048 5.2523 5.3971 5.4605 5.6530 5.6855 6.1224 6.1711 6.2174 6.2562 6.4141 6.4620 6.6377 6.6648 6.7563 6.8384 6.9265 7.0197 7.2254 7.2741 7.3107 7.3468 7.3907 7.4127 7.5807 7.6289 7.7704 7.8061 7.8995 7.9618 k = 0.0696-0.0775 0.0000 ( 16873 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3061-150.3055-146.9099-146.9093-145.5538-145.5533-141.2526-141.2517 -137.5551-137.5539-134.2771-134.2764-134.2134-134.2127-128.2443-128.2440 -33.0146 -33.0130 -32.9524 -32.9511 -31.1981 -31.1973 -31.0146 -31.0132 -26.9325 -26.9310 -25.3730 -25.3718 -24.9196 -24.9186 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6.6662 6.7590 6.8285 6.9233 6.9985 7.2326 7.2761 7.3053 7.3435 7.3834 7.4008 7.5874 7.6264 7.7753 7.8057 7.9011 7.9555 k = 0.0522-0.0581 0.0000 ( 16871 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3058-150.3048-146.9101-146.9089-145.5542-145.5530-141.2516-141.2514 -137.5543-137.5521-134.2766-134.2760-134.2127-134.2117-128.2434-128.2429 -33.0135 -33.0115 -32.9507 -32.9494 -31.1976 -31.1972 -31.0126 -31.0116 -26.9317 -26.9298 -25.3710 -25.3705 -24.9186 -24.9181 -23.0234 -23.0231 -19.4929 -19.4922 -19.4501 -19.4494 -18.7818 -18.7816 -17.1686 -17.1683 -16.3833 -16.3826 -16.2648 -16.2641 -16.0562 -16.0558 -15.0289 -15.0284 -14.2669 -14.2661 -13.6428 -13.6426 -13.4355 -13.4353 -12.3782 -12.3770 -11.7499 -11.7492 -11.0565 -11.0558 -10.7339 -10.7330 -9.4252 -9.4195 -9.2671 -9.2613 -8.8467 -8.8454 -7.9905 -7.9894 -7.6503 -7.6494 -7.5189 -7.5183 -7.4060 -7.4040 -7.1342 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3.7194 3.9631 3.9944 4.1701 4.1804 4.3467 4.3605 4.5155 4.5262 4.6466 4.6643 4.8653 4.8848 5.1212 5.1316 5.2036 5.2235 5.4127 5.4414 5.6674 5.6813 6.1551 6.1845 6.2152 6.2391 6.4087 6.4332 6.6551 6.6668 6.7714 6.8092 6.9262 6.9641 7.2493 7.2750 7.3043 7.3320 7.3753 7.3840 7.6014 7.6210 7.7850 7.8031 7.9116 7.9426 k = 0.0174-0.0194 0.0000 ( 16833 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2949-150.2942-146.8966-146.8953-145.5407-145.5393-141.2385-141.2378 -137.5457-137.5443-134.2675-134.2667-134.2016-134.2003-128.2334-128.2324 -32.9901 -32.9881 -32.9301 -32.9289 -31.1780 -31.1767 -30.9914 -30.9897 -26.9143 -26.9120 -25.3525 -25.3511 -24.9000 -24.8985 -23.0053 -23.0040 -19.4821 -19.4820 -19.4384 -19.4375 -18.7717 -18.7712 -17.1570 -17.1566 -16.3725 -16.3713 -16.2545 -16.2536 -16.0468 -16.0456 -15.0202 -15.0195 -14.2566 -14.2550 -13.6327 -13.6324 -13.4256 -13.4251 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************************************************************************ ************************************************************************ -150.2960-150.2960-146.8960-146.8960-145.5402-145.5402-141.2394-141.2394 -137.5438-137.5438-134.2674-134.2674-134.2029-134.2029-128.2342-128.2342 -32.9916 -32.9916 -32.9291 -32.9291 -31.1786 -31.1786 -30.9919 -30.9919 -26.9142 -26.9142 -25.3519 -25.3519 -24.9006 -24.9006 -23.0059 -23.0059 -19.4829 -19.4829 -19.4375 -19.4375 -18.7732 -18.7732 -17.1566 -17.1566 -16.3722 -16.3722 -16.2548 -16.2548 -16.0475 -16.0475 -15.0198 -15.0198 -14.2554 -14.2554 -13.6330 -13.6330 -13.4262 -13.4262 -12.3692 -12.3692 -11.7407 -11.7407 -11.0495 -11.0495 -10.7258 -10.7258 -9.4189 -9.4189 -9.2609 -9.2609 -8.8458 -8.8458 -7.9898 -7.9898 -7.6494 -7.6494 -7.5187 -7.5187 -7.4042 -7.4042 -7.1341 -7.1341 -6.7672 -6.7672 -2.3895 -2.3895 -1.7276 -1.7276 -0.6431 -0.6431 -0.5236 -0.5236 -0.1725 -0.1725 0.2232 0.2232 0.3575 0.3575 0.6699 0.6699 0.7751 0.7751 0.9221 0.9221 1.0444 1.0444 1.4334 1.4334 1.7198 1.7198 1.8332 1.8332 2.0599 2.0599 2.2181 2.2181 2.4651 2.4651 2.6028 2.6028 2.6552 2.6552 2.9190 2.9190 2.9618 2.9618 3.1210 3.1210 3.1677 3.1677 3.3066 3.3066 3.5116 3.5116 3.7047 3.7047 3.9788 3.9788 4.1773 4.1773 4.3554 4.3554 4.5206 4.5206 4.6555 4.6555 4.8743 4.8743 5.1262 5.1262 5.2101 5.2101 5.4272 5.4272 5.6760 5.6760 6.1740 6.1740 6.2265 6.2265 6.4177 6.4177 6.6628 6.6628 6.7890 6.7890 6.9397 6.9397 7.2651 7.2651 7.3161 7.3161 7.3761 7.3761 7.6128 7.6128 7.7949 7.7949 7.9271 7.9271 k = 0.0000 0.0000 0.0000 ( 16835 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2960-150.2960-146.8960-146.8960-145.5402-145.5402-141.2394-141.2394 -137.5438-137.5438-134.2674-134.2674-134.2029-134.2029-128.2342-128.2342 -32.9916 -32.9916 -32.9291 -32.9291 -31.1786 -31.1786 -30.9919 -30.9919 -26.9142 -26.9142 -25.3519 -25.3519 -24.9006 -24.9006 -23.0059 -23.0059 -19.4829 -19.4829 -19.4375 -19.4375 -18.7732 -18.7732 -17.1566 -17.1566 -16.3722 -16.3722 -16.2548 -16.2548 -16.0475 -16.0475 -15.0198 -15.0198 -14.2554 -14.2554 -13.6330 -13.6330 -13.4262 -13.4262 -12.3692 -12.3692 -11.7407 -11.7407 -11.0495 -11.0495 -10.7258 -10.7258 -9.4189 -9.4189 -9.2609 -9.2609 -8.8458 -8.8458 -7.9898 -7.9898 -7.6494 -7.6494 -7.5187 -7.5187 -7.4042 -7.4042 -7.1341 -7.1341 -6.7672 -6.7672 -2.3895 -2.3895 -1.7276 -1.7276 -0.6431 -0.6431 -0.5236 -0.5236 -0.1725 -0.1725 0.2232 0.2232 0.3575 0.3575 0.6699 0.6699 0.7751 0.7751 0.9221 0.9221 1.0444 1.0444 1.4334 1.4334 1.7198 1.7198 1.8332 1.8332 2.0599 2.0599 2.2181 2.2181 2.4651 2.4651 2.6028 2.6028 2.6552 2.6552 2.9190 2.9190 2.9618 2.9618 3.1210 3.1210 3.1677 3.1677 3.3066 3.3066 3.5116 3.5116 3.7047 3.7047 3.9788 3.9788 4.1773 4.1773 4.3554 4.3554 4.5206 4.5206 4.6555 4.6555 4.8743 4.8743 5.1262 5.1262 5.2101 5.2101 5.4272 5.4272 5.6760 5.6760 6.1740 6.1740 6.2265 6.2265 6.4177 6.4177 6.6628 6.6628 6.7890 6.7890 6.9397 6.9397 7.2651 7.2651 7.3161 7.3161 7.3761 7.3761 7.6128 7.6128 7.7949 7.7949 7.9271 7.9271 k = 0.0250-0.0027-0.0071 ( 16834 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2972-150.2963-146.8970-146.8959-145.5401-145.5396-141.2387-141.2379 -137.5439-137.5431-134.2689-134.2680-134.2020-134.2017-128.2336-128.2334 -32.9924 -32.9910 -32.9287 -32.9280 -31.1782 -31.1770 -30.9909 -30.9903 -26.9138 -26.9129 -25.3524 -25.3515 -24.9002 -24.8997 -23.0057 -23.0050 -19.4820 -19.4817 -19.4373 -19.4368 -18.7732 -18.7729 -17.1570 -17.1567 -16.3733 -16.3724 -16.2549 -16.2539 -16.0476 -16.0459 -15.0200 -15.0194 -14.2559 -14.2556 -13.6330 -13.6326 -13.4261 -13.4258 -12.3699 -12.3693 -11.7416 -11.7415 -11.0491 -11.0483 -10.7272 -10.7267 -9.4194 -9.4183 -9.2615 -9.2605 -8.8462 -8.8455 -7.9901 -7.9896 -7.6496 -7.6493 -7.5192 -7.5182 -7.4046 -7.4039 -7.1342 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3.7270 3.9669 3.9977 4.1697 4.1826 4.3535 4.3579 4.5142 4.5289 4.6428 4.6692 4.8630 4.8840 5.1191 5.1349 5.2068 5.2162 5.4154 5.4383 5.6609 5.6904 6.1521 6.1870 6.2187 6.2408 6.4093 6.4322 6.6487 6.6758 6.7789 6.8046 6.9326 6.9589 7.2409 7.2795 7.3102 7.3254 7.3724 7.3871 7.5955 7.6264 7.7751 7.8130 7.9115 7.9463 k = 0.0750-0.0081-0.0212 ( 16858 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3030-150.3018-146.9067-146.9064-145.5472-145.5461-141.2450-141.2438 -137.5501-137.5483-134.2747-134.2737-134.2115-134.2100-128.2423-128.2414 -33.0074 -33.0048 -32.9423 -32.9405 -31.1933 -31.1923 -31.0052 -31.0043 -26.9261 -26.9239 -25.3648 -25.3641 -24.9124 -24.9116 -23.0167 -23.0162 -19.4886 -19.4873 -19.4434 -19.4424 -18.7770 -18.7768 -17.1661 -17.1654 -16.3819 -16.3793 -16.2602 -16.2586 -16.0515 -16.0502 -15.0244 -15.0236 -14.2640 -14.2631 -13.6374 -13.6369 -13.4324 -13.4320 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************************************************************************ ************************************************************************ -150.3023-150.3013-146.9084-146.9081-145.5465-145.5455-141.2470-141.2445 -137.5510-137.5493-134.2741-134.2738-134.2091-134.2073-128.2402-128.2391 -33.0095 -33.0075 -32.9397 -32.9379 -31.1921 -31.1904 -31.0047 -31.0038 -26.9267 -26.9244 -25.3647 -25.3635 -24.9114 -24.9110 -23.0163 -23.0160 -19.4895 -19.4882 -19.4433 -19.4420 -18.7760 -18.7756 -17.1655 -17.1647 -16.3802 -16.3781 -16.2595 -16.2578 -16.0522 -16.0501 -15.0247 -15.0240 -14.2630 -14.2624 -13.6367 -13.6360 -13.4310 -13.4309 -12.3756 -12.3740 -11.7477 -11.7472 -11.0522 -11.0509 -10.7323 -10.7319 -9.4212 -9.4182 -9.2648 -9.2601 -8.8477 -8.8449 -7.9909 -7.9892 -7.6501 -7.6488 -7.5207 -7.5170 -7.4061 -7.4033 -7.1347 -7.1342 -6.7680 -6.7671 -2.3938 -2.3805 -1.7317 -1.7262 -0.6640 -0.6266 -0.5271 -0.5082 -0.1978 -0.1481 0.2027 0.2386 0.3524 0.3655 0.6451 0.6764 0.7671 0.7846 0.9232 0.9338 1.0389 1.0633 1.3949 1.4510 1.7004 1.7380 1.8286 1.8502 2.0584 2.0744 2.1940 2.2504 2.4601 2.4773 2.5907 2.6041 2.6500 2.6662 2.8856 2.9128 2.9382 2.9656 3.0936 3.1300 3.1550 3.1801 3.2926 3.3106 3.4601 3.5195 3.6678 3.7466 3.9632 4.0203 4.1611 4.1844 4.3511 4.3601 4.5109 4.5383 4.6335 4.6831 4.8527 4.8906 5.1127 5.1444 5.2058 5.2240 5.4041 5.4481 5.6478 5.7028 6.1277 6.1839 6.2265 6.2565 6.4110 6.4493 6.6336 6.6875 6.7748 6.8226 6.9371 6.9898 7.2180 7.2727 7.3187 7.3295 7.3810 7.4031 7.5765 7.6365 7.7585 7.8238 7.9021 7.9665 k = 0.1250-0.0135-0.0353 ( 16868 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3057-150.3049-146.9124-146.9118-145.5495-145.5487-141.2498-141.2474 -137.5548-137.5531-134.2768-134.2761-134.2140-134.2123-128.2443-128.2435 -33.0144 -33.0131 -32.9471 -32.9456 -31.1983 -31.1968 -31.0116 -31.0103 -26.9311 -26.9287 -25.3695 -25.3684 -24.9171 -24.9165 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6.6923 6.7739 6.8310 6.9435 7.0089 7.2078 7.2659 7.3179 7.3349 7.3886 7.4130 7.5676 7.6395 7.7523 7.8261 7.9001 7.9763 k = 0.1500-0.0162-0.0424 ( 16878 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3108-150.3097-146.9160-146.9155-145.5540-145.5531-141.2508-141.2476 -137.5571-137.5549-134.2807-134.2801-134.2178-134.2154-128.2479-128.2460 -33.0189 -33.0166 -32.9521 -32.9490 -31.2040 -31.2011 -31.0185 -31.0164 -26.9364 -26.9334 -25.3729 -25.3703 -24.9230 -24.9211 -23.0277 -23.0255 -19.4977 -19.4972 -19.4494 -19.4486 -18.7825 -18.7818 -17.1723 -17.1717 -16.3864 -16.3839 -16.2659 -16.2639 -16.0564 -16.0537 -15.0312 -15.0305 -14.2710 -14.2689 -13.6435 -13.6426 -13.4372 -13.4364 -12.3812 -12.3794 -11.7538 -11.7530 -11.0602 -11.0572 -10.7384 -10.7376 -9.4240 -9.4186 -9.2677 -9.2613 -8.8487 -8.8449 -7.9915 -7.9892 -7.6504 -7.6486 -7.5215 -7.5164 -7.4072 -7.4034 -7.1352 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3.7709 3.9698 4.0503 4.1493 4.1812 4.3492 4.3648 4.5158 4.5520 4.6268 4.7031 4.8408 4.8940 5.1072 5.1607 5.2061 5.2379 5.3949 5.4601 5.6349 5.7165 6.0933 6.1681 6.2473 6.2798 6.4298 6.4789 6.6124 6.7008 6.7766 6.8470 6.9637 7.0513 7.1934 7.2515 7.3098 7.3489 7.4036 7.4376 7.5544 7.6426 7.7464 7.8280 7.8986 7.9920 k = 0.2000-0.0216-0.0565 ( 16874 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3093-150.3084-146.9165-146.9149-145.5513-145.5502-141.2515-141.2489 -137.5575-137.5552-134.2806-134.2789-134.2183-134.2162-128.2472-128.2467 -33.0184 -33.0166 -32.9533 -32.9503 -31.1999 -31.1982 -31.0153 -31.0120 -26.9356 -26.9309 -25.3716 -25.3692 -24.9198 -24.9182 -23.0253 -23.0234 -19.4951 -19.4945 -19.4478 -19.4470 -18.7816 -18.7810 -17.1702 -17.1696 -16.3835 -16.3808 -16.2643 -16.2629 -16.0541 -16.0524 -15.0279 -15.0265 -14.2708 -14.2680 -13.6427 -13.6418 -13.4375 -13.4373 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************************************************************************ ************************************************************************ -150.3098-150.3090-146.9190-146.9176-145.5542-145.5521-141.2503-141.2494 -137.5589-137.5570-134.2815-134.2796-134.2192-134.2172-128.2481-128.2477 -33.0204 -33.0180 -32.9538 -32.9516 -31.2004 -31.1989 -31.0163 -31.0136 -26.9374 -26.9333 -25.3724 -25.3700 -24.9196 -24.9181 -23.0252 -23.0235 -19.4962 -19.4954 -19.4507 -19.4494 -18.7822 -18.7818 -17.1722 -17.1713 -16.3837 -16.3822 -16.2654 -16.2639 -16.0556 -16.0544 -15.0294 -15.0280 -14.2722 -14.2705 -13.6440 -13.6433 -13.4378 -13.4376 -12.3813 -12.3789 -11.7561 -11.7556 -11.0602 -11.0577 -10.7415 -10.7404 -9.4224 -9.4165 -9.2683 -9.2597 -8.8501 -8.8454 -7.9922 -7.9893 -7.6506 -7.6484 -7.5222 -7.5160 -7.4087 -7.4040 -7.1360 -7.1351 -6.7696 -6.7680 -2.3902 -2.3676 -1.7385 -1.7291 -0.6795 -0.6237 -0.5170 -0.4704 -0.2265 -0.1246 0.1818 0.2477 0.3536 0.3758 0.6069 0.6540 0.7673 0.7941 0.9478 0.9547 1.0532 1.0942 1.3351 1.4354 1.7015 1.7493 1.8380 1.8915 2.0609 2.1129 2.1934 2.2717 2.4573 2.5028 2.5600 2.5864 2.6449 2.6810 2.8346 2.8581 2.9135 2.9439 3.0482 3.0901 3.1605 3.1830 3.2684 3.2926 3.3860 3.4408 3.6832 3.7840 3.9785 4.0621 4.1449 4.1764 4.3500 4.3697 4.5251 4.5606 4.6284 4.7137 4.8385 4.8936 5.1066 5.1731 5.2057 5.2479 5.3970 5.4686 5.6325 5.7219 6.0753 6.1579 6.2598 6.2951 6.4474 6.5042 6.6018 6.7075 6.7818 6.8593 6.9915 7.0911 7.1892 7.2403 7.3024 7.3615 7.4140 7.4652 7.5501 7.6427 7.7502 7.8296 7.8974 7.9974 k = 0.2500-0.0270-0.0706 ( 16869 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3068-150.3055-146.9154-146.9146-145.5510-145.5485-141.2491-141.2473 -137.5575-137.5557-134.2788-134.2776-134.2175-134.2147-128.2464-128.2459 -33.0158 -33.0123 -32.9491 -32.9470 -31.1956 -31.1935 -31.0114 -31.0098 -26.9334 -26.9300 -25.3678 -25.3656 -24.9159 -24.9148 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6.7108 6.7846 6.8637 7.0062 7.1049 7.1908 7.2389 7.3001 7.3673 7.4166 7.4787 7.5522 7.6432 7.7553 7.8306 7.8972 7.9986 k = 0.2750-0.0296-0.0777 ( 16869 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3049-150.3032-146.9157-146.9138-145.5506-145.5476-141.2500-141.2476 -137.5600-137.5576-134.2779-134.2761-134.2170-134.2140-128.2455-128.2445 -33.0163 -33.0122 -32.9491 -32.9451 -31.1952 -31.1922 -31.0125 -31.0099 -26.9339 -26.9301 -25.3682 -25.3649 -24.9164 -24.9148 -23.0228 -23.0211 -19.4945 -19.4938 -19.4503 -19.4484 -18.7801 -18.7796 -17.1705 -17.1695 -16.3811 -16.3778 -16.2630 -16.2614 -16.0549 -16.0519 -15.0270 -15.0259 -14.2702 -14.2683 -13.6420 -13.6408 -13.4356 -13.4352 -12.3799 -12.3767 -11.7529 -11.7523 -11.0603 -11.0565 -10.7379 -10.7364 -9.4199 -9.4134 -9.2664 -9.2580 -8.8506 -8.8459 -7.9924 -7.9896 -7.6506 -7.6484 -7.5223 -7.5160 -7.4095 -7.4047 -7.1365 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3.7979 3.9932 4.0679 4.1415 4.1668 4.3531 4.3764 4.5428 4.5713 4.6370 4.7216 4.8408 4.8896 5.1119 5.1821 5.2089 5.2572 5.4131 5.4796 5.6365 5.7242 6.0582 6.1408 6.2746 6.3109 6.4747 6.5389 6.6003 6.7158 6.7905 6.8685 7.0318 7.1157 7.1911 7.2505 7.3028 7.3782 7.4183 7.4994 7.5594 7.6481 7.7669 7.8328 7.8984 7.9986 k = 0.3250-0.0350-0.0918 ( 16865 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3027-150.3020-146.9150-146.9134-145.5468-145.5455-141.2492-141.2477 -137.5582-137.5563-134.2760-134.2751-134.2167-134.2150-128.2449-128.2440 -33.0125 -33.0109 -32.9442 -32.9428 -31.1900 -31.1884 -31.0097 -31.0075 -26.9325 -26.9293 -25.3632 -25.3619 -24.9138 -24.9129 -23.0216 -23.0203 -19.4922 -19.4917 -19.4493 -19.4482 -18.7802 -18.7798 -17.1697 -17.1687 -16.3798 -16.3780 -16.2613 -16.2609 -16.0532 -16.0517 -15.0247 -15.0236 -14.2687 -14.2671 -13.6409 -13.6401 -13.4354 -13.4350 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************************************************************************ ************************************************************************ -150.3042-150.3035-146.9168-146.9158-145.5469-145.5461-141.2488-141.2477 -137.5579-137.5562-134.2771-134.2766-134.2186-134.2163-128.2468-128.2455 -33.0138 -33.0129 -32.9442 -32.9433 -31.1909 -31.1895 -31.0105 -31.0090 -26.9334 -26.9306 -25.3637 -25.3630 -24.9155 -24.9146 -23.0235 -23.0224 -19.4933 -19.4928 -19.4483 -19.4476 -18.7797 -18.7793 -17.1700 -17.1693 -16.3808 -16.3792 -16.2625 -16.2621 -16.0519 -16.0509 -15.0251 -15.0240 -14.2691 -14.2679 -13.6420 -13.6413 -13.4356 -13.4351 -12.3784 -12.3767 -11.7536 -11.7530 -11.0591 -11.0578 -10.7396 -10.7387 -9.4171 -9.4119 -9.2653 -9.2576 -8.8511 -8.8472 -7.9926 -7.9903 -7.6504 -7.6486 -7.5218 -7.5166 -7.4102 -7.4062 -7.1371 -7.1364 -6.7708 -6.7695 -2.3787 -2.3598 -1.7433 -1.7355 -0.6767 -0.6353 -0.4949 -0.4414 -0.2302 -0.1264 0.1825 0.2421 0.3655 0.3832 0.5789 0.6143 0.7719 0.8032 0.9668 0.9827 1.0864 1.1234 1.2897 1.3796 1.7273 1.7584 1.8672 1.9655 2.0403 2.1560 2.2082 2.2538 2.4486 2.4964 2.5409 2.5679 2.6303 2.6698 2.7828 2.8491 2.9146 2.9408 3.0125 3.0561 3.1115 3.1678 3.2397 3.2648 3.3388 3.3552 3.7306 3.8020 4.0030 4.0660 4.1386 4.1599 4.3572 4.3802 4.5537 4.5766 4.6472 4.7205 4.8449 4.8856 5.1185 5.1776 5.2173 5.2592 5.4299 5.4850 5.6433 5.7197 6.0556 6.1274 6.2831 6.3154 6.4919 6.5450 6.6202 6.7198 6.7973 6.8689 7.0492 7.1119 7.1912 7.2610 7.3253 7.3892 7.4216 7.5109 7.5663 7.6577 7.7769 7.8384 7.9071 8.0015 k = 0.3750-0.0404-0.1059 ( 16872 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3056-150.3055-146.9190-146.9175-145.5499-145.5486-141.2487-141.2478 -137.5603-137.5586-134.2793-134.2787-134.2200-134.2179-128.2476-128.2470 -33.0159 -33.0139 -32.9485 -32.9477 -31.1923 -31.1903 -31.0160 -31.0144 -26.9361 -26.9336 -25.3664 -25.3653 -24.9190 -24.9184 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6.7208 6.8006 6.8660 7.0546 7.1066 7.1944 7.2606 7.3407 7.3934 7.4254 7.5117 7.5702 7.6596 7.7822 7.8408 7.9149 8.0031 k = 0.4000-0.0431-0.1130 ( 16878 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3076-150.3062-146.9226-146.9211-145.5511-145.5500-141.2499-141.2490 -137.5613-137.5601-134.2804-134.2795-134.2208-134.2187-128.2483-128.2473 -33.0187 -33.0177 -32.9508 -32.9499 -31.1952 -31.1936 -31.0205 -31.0196 -26.9394 -26.9377 -25.3678 -25.3674 -24.9218 -24.9213 -23.0299 -23.0291 -19.4970 -19.4964 -19.4507 -19.4502 -18.7818 -18.7816 -17.1736 -17.1729 -16.3841 -16.3828 -16.2648 -16.2639 -16.0559 -16.0550 -15.0276 -15.0271 -14.2715 -14.2705 -13.6446 -13.6440 -13.4372 -13.4368 -12.3812 -12.3800 -11.7563 -11.7558 -11.0608 -11.0604 -10.7421 -10.7414 -9.4160 -9.4122 -9.2643 -9.2586 -8.8510 -8.8482 -7.9926 -7.9909 -7.6501 -7.6489 -7.5211 -7.5173 -7.4102 -7.4073 -7.1374 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3.7981 4.0180 4.0544 4.1367 4.1495 4.3654 4.3804 4.5647 4.5779 4.6658 4.7080 4.8529 4.8760 5.1318 5.1633 5.2327 5.2556 5.4553 5.4851 5.6595 5.7035 6.0617 6.1034 6.2955 6.3138 6.5122 6.5380 6.6640 6.7184 6.8105 6.8560 7.0615 7.0930 7.2065 7.2531 7.3674 7.3976 7.4419 7.5042 7.5831 7.6518 7.7979 7.8406 7.9369 8.0015 k = 0.4500-0.0485-0.1271 ( 16878 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3061-150.3057-146.9212-146.9202-145.5530-145.5512-141.2490-141.2488 -137.5618-137.5602-134.2803-134.2795-134.2205-134.2203-128.2492-128.2487 -33.0178 -33.0152 -32.9526 -32.9523 -31.1962 -31.1956 -31.0212 -31.0199 -26.9390 -26.9365 -25.3694 -25.3683 -24.9217 -24.9205 -23.0291 -23.0277 -19.4983 -19.4982 -19.4519 -19.4511 -18.7814 -18.7813 -17.1731 -17.1727 -16.3838 -16.3821 -16.2646 -16.2642 -16.0555 -16.0551 -15.0288 -15.0282 -14.2724 -14.2714 -13.6447 -13.6443 -13.4382 -13.4377 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1.1219 1.1299 1.2929 1.3117 1.7521 1.7578 1.9265 1.9557 2.0901 2.1277 2.2237 2.2280 2.4433 2.4509 2.5575 2.5619 2.6289 2.6358 2.8061 2.8195 2.9339 2.9386 3.0186 3.0345 3.0910 3.1175 3.2250 3.2318 3.3227 3.3251 3.7757 3.7891 4.0306 4.0433 4.1386 4.1433 4.3717 4.3769 4.5711 4.5758 4.6811 4.6957 4.8608 4.8688 5.1428 5.1535 5.2417 5.2496 5.4694 5.4798 5.6736 5.6889 6.0730 6.0874 6.3032 6.3096 6.5229 6.5312 6.6901 6.7087 6.8250 6.8415 7.0688 7.0794 7.2235 7.2403 7.3855 7.3952 7.4650 7.4874 7.6045 7.6298 7.8169 7.8324 7.9634 7.9875 k = 0.5000-0.0539-0.1412 ( 16872 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.3051-150.3051-146.9174-146.9174-145.5495-145.5495-141.2479-141.2479 -137.5606-137.5606-134.2790-134.2790-134.2190-134.2190-128.2477-128.2477 -33.0119 -33.0119 -32.9504 -32.9504 -31.1935 -31.1935 -31.0175 -31.0175 -26.9340 -26.9340 -25.3672 -25.3672 -24.9185 -24.9185 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************************************************************************ ************************************************************************ -150.2963-150.2926-146.9017-146.9000-145.5462-145.5435-141.2412-141.2384 -137.5466-137.5422-134.2679-134.2646-134.2104-134.2077-128.2407-128.2385 -32.9962 -32.9914 -32.9373 -32.9315 -31.1856 -31.1817 -31.0029 -30.9986 -26.9203 -26.9155 -25.3590 -25.3538 -24.9075 -24.9042 -23.0124 -23.0097 -19.4829 -19.4810 -19.4402 -19.4396 -18.7751 -18.7741 -17.1615 -17.1613 -16.3799 -16.3756 -16.2591 -16.2525 -16.0507 -16.0479 -15.0216 -15.0205 -14.2604 -14.2570 -13.6353 -13.6336 -13.4307 -13.4298 -12.3737 -12.3690 -11.7434 -11.7430 -11.0494 -11.0462 -10.7286 -10.7267 -9.4209 -9.4182 -9.2632 -9.2606 -8.8474 -8.8440 -7.9922 -7.9893 -7.6499 -7.6491 -7.5195 -7.5177 -7.4055 -7.4041 -7.1347 -7.1338 -6.7679 -6.7669 -2.3926 -2.3795 -1.7298 -1.7246 -0.6548 -0.6340 -0.5288 -0.5059 -0.1805 -0.1593 0.2062 0.2365 0.3491 0.3625 0.6357 0.6713 0.7668 0.7844 0.9229 0.9301 1.0368 1.0572 1.4220 1.4414 1.7120 1.7349 1.8338 1.8495 2.0491 2.0642 2.2056 2.2341 2.4494 2.4792 2.5786 2.6075 2.6458 2.6623 2.9006 2.9214 2.9509 2.9753 3.0989 3.1328 3.1567 3.1832 3.2925 3.3090 3.4899 3.5374 3.6899 3.7233 3.9563 4.0057 4.1543 4.2037 4.3511 4.3632 4.5124 4.5319 4.6489 4.6675 4.8610 4.8866 5.1068 5.1415 5.2068 5.2154 5.4178 5.4391 5.6489 5.6914 6.1599 6.1791 6.2175 6.2374 6.4054 6.4345 6.6399 6.6938 6.7601 6.8128 6.9374 6.9545 7.2355 7.2773 7.3054 7.3312 7.3711 7.3985 7.5985 7.6123 7.7653 7.8195 7.9053 7.9677 k = 0.0385-0.0041 0.0355 ( 16842 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2974-150.2943-146.8974-146.8965-145.5435-145.5414-141.2404-141.2377 -137.5472-137.5440-134.2697-134.2668-134.2095-134.2082-128.2408-128.2396 -32.9948 -32.9910 -32.9354 -32.9309 -31.1841 -31.1801 -30.9992 -30.9960 -26.9178 -26.9144 -25.3567 -25.3528 -24.9052 -24.9030 -23.0101 -23.0082 -19.4839 -19.4828 -19.4390 -19.4383 -18.7756 -18.7744 -17.1597 -17.1596 -16.3768 -16.3731 -16.2596 -16.2548 -16.0502 -16.0473 -15.0214 -15.0204 -14.2589 -14.2564 -13.6361 -13.6347 -13.4289 -13.4282 -12.3728 -12.3697 -11.7430 -11.7428 -11.0508 -11.0484 -10.7283 -10.7269 -9.4204 -9.4187 -9.2626 -9.2608 -8.8469 -8.8446 -7.9912 -7.9893 -7.6498 -7.6492 -7.5193 -7.5181 -7.4050 -7.4041 -7.1345 -7.1339 -6.7677 -6.7669 -2.3924 -2.3835 -1.7291 -1.7257 -0.6507 -0.6368 -0.5288 -0.5133 -0.1784 -0.1639 0.2122 0.2326 0.3523 0.3611 0.6495 0.6751 0.7689 0.7819 0.9218 0.9266 1.0386 1.0526 1.4258 1.4390 1.7133 1.7295 1.8322 1.8417 2.0533 2.0636 2.2093 2.2285 2.4546 2.4749 2.5880 2.6089 2.6484 2.6607 2.9080 2.9225 2.9550 2.9700 3.1063 3.1315 3.1586 3.1784 3.2980 3.3098 3.4964 3.5288 3.6941 3.7168 3.9628 3.9966 4.1614 4.1948 4.3522 4.3603 4.5145 4.5278 4.6498 4.6627 4.8653 4.8827 5.1139 5.1369 5.2073 5.2138 5.4202 5.4346 5.6589 5.6873 6.1647 6.1788 6.2194 6.2339 6.4089 6.4285 6.6466 6.6828 6.7697 6.8056 6.9364 6.9485 7.2442 7.2785 7.3063 7.3270 7.3692 7.3901 7.6044 7.6138 7.7746 7.8132 7.9087 7.9543 k = 0.0192-0.0021 0.0178 ( 16841 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2982-150.2969-146.8993-146.8981-145.5431-145.5404-141.2413-141.2396 -137.5461-137.5440-134.2699-134.2686-134.2041-134.2033-128.2360-128.2353 -32.9947 -32.9915 -32.9348 -32.9320 -31.1818 -31.1792 -30.9959 -30.9930 -26.9184 -26.9160 -25.3558 -25.3534 -24.9044 -24.9031 -23.0089 -23.0078 -19.4840 -19.4832 -19.4397 -19.4390 -18.7756 -18.7747 -17.1597 -17.1594 -16.3759 -16.3725 -16.2575 -16.2544 -16.0493 -16.0477 -15.0220 -15.0212 -14.2587 -14.2565 -13.6351 -13.6344 -13.4283 -13.4277 -12.3726 -12.3703 -11.7432 -11.7431 -11.0512 -11.0497 -10.7282 -10.7273 -9.4201 -9.4193 -9.2625 -9.2615 -8.8464 -8.8453 -7.9904 -7.9894 -7.6496 -7.6493 -7.5190 -7.5184 -7.4045 -7.4041 -7.1343 -7.1340 -6.7675 -6.7671 -2.3914 -2.3869 -1.7284 -1.7266 -0.6468 -0.6399 -0.5270 -0.5191 -0.1757 -0.1684 0.2178 0.2281 0.3549 0.3594 0.6612 0.6745 0.7715 0.7785 0.9215 0.9239 1.0411 1.0482 1.4297 1.4365 1.7159 1.7243 1.8319 1.8363 2.0569 2.0621 2.2135 2.2232 2.4598 2.4700 2.5961 2.6070 2.6517 2.6583 2.9141 2.9219 2.9583 2.9656 3.1138 3.1273 3.1626 3.1731 3.3028 3.3090 3.5035 3.5202 3.6990 3.7105 3.9705 3.9876 4.1691 4.1860 4.3537 4.3578 4.5169 4.5237 4.6522 4.6584 4.8700 4.8785 5.1198 5.1318 5.2084 5.2119 5.4231 5.4304 5.6676 5.6820 6.1696 6.1768 6.2223 6.2300 6.4128 6.4225 6.6538 6.6721 6.7793 6.7978 6.9374 6.9437 7.2545 7.2739 7.3097 7.3217 7.3716 7.3825 7.6092 7.6141 7.7845 7.8045 7.9161 7.9397 k = 0.0000 0.0000 0.0000 ( 16835 PWs) bands (ev): ************************************************************************ ************************************************************************ -150.2960-150.2960-146.8960-146.8960-145.5402-145.5402-141.2394-141.2394 -137.5438-137.5438-134.2674-134.2674-134.2029-134.2029-128.2342-128.2342 -32.9916 -32.9916 -32.9291 -32.9291 -31.1786 -31.1786 -30.9919 -30.9919 -26.9142 -26.9142 -25.3519 -25.3519 -24.9006 -24.9006 -23.0059 -23.0059 -19.4829 -19.4829 -19.4375 -19.4375 -18.7732 -18.7732 -17.1566 -17.1566 -16.3722 -16.3722 -16.2548 -16.2548 -16.0475 -16.0475 -15.0198 -15.0198 -14.2554 -14.2554 -13.6330 -13.6330 -13.4262 -13.4262 -12.3692 -12.3692 -11.7407 -11.7407 -11.0495 -11.0495 -10.7258 -10.7258 -9.4189 -9.4189 -9.2609 -9.2609 -8.8458 -8.8458 -7.9898 -7.9898 -7.6494 -7.6494 -7.5187 -7.5187 -7.4042 -7.4042 -7.1341 -7.1341 -6.7672 -6.7672 -2.3895 -2.3895 -1.7276 -1.7276 -0.6431 -0.6431 -0.5236 -0.5236 -0.1725 -0.1725 0.2232 0.2232 0.3575 0.3575 0.6699 0.6699 0.7751 0.7751 0.9221 0.9221 1.0444 1.0444 1.4334 1.4334 1.7198 1.7198 1.8332 1.8332 2.0599 2.0599 2.2181 2.2181 2.4651 2.4651 2.6028 2.6028 2.6552 2.6552 2.9190 2.9190 2.9618 2.9618 3.1210 3.1210 3.1677 3.1677 3.3066 3.3066 3.5116 3.5116 3.7047 3.7047 3.9788 3.9788 4.1773 4.1773 4.3554 4.3554 4.5206 4.5206 4.6555 4.6555 4.8743 4.8743 5.1262 5.1262 5.2101 5.2101 5.4272 5.4272 5.6760 5.6760 6.1740 6.1740 6.2265 6.2265 6.4177 6.4177 6.6628 6.6628 6.7890 6.7890 6.9397 6.9397 7.2651 7.2651 7.3161 7.3161 7.3761 7.3761 7.6128 7.6128 7.7949 7.7949 7.9271 7.9271 Writing output data file Tl4SiS4.save init_run : 1.78s CPU 1.28s WALL ( 1 calls) electrons : 6396.82s CPU 6172.06s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.10s CPU 0.25s WALL ( 1 calls) Called by electrons: c_bands : 6396.80s CPU 6172.03s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.01s WALL ( 1 calls) newd : 0.68s CPU 0.42s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.56s CPU 0.47s WALL ( 188 calls) cegterg : 6211.69s CPU 6031.88s WALL ( 1089 calls) Called by sum_band: Called by *egterg: h_psi : 2806.80s CPU 2562.58s WALL ( 22155 calls) s_psi : 314.34s CPU 314.95s WALL ( 22155 calls) g_psi : 3.73s CPU 3.79s WALL ( 20878 calls) cdiaghg : 2503.92s CPU 2514.15s WALL ( 21066 calls) cegterg:over : 314.24s CPU 314.62s WALL ( 20878 calls) cegterg:upda : 210.80s CPU 211.97s WALL ( 20878 calls) cegterg:last : 142.38s CPU 143.69s WALL ( 2824 calls) cdiaghg:chol : 98.17s CPU 98.54s WALL ( 21066 calls) cdiaghg:inve : 83.20s CPU 84.58s WALL ( 21066 calls) cdiaghg:para : 190.52s CPU 194.05s WALL ( 42132 calls) Called by h_psi: h_psi:vloc : 2272.18s CPU 2023.55s WALL ( 22155 calls) h_psi:vnl : 528.85s CPU 533.19s WALL ( 22155 calls) add_vuspsi : 270.30s CPU 273.80s WALL ( 22155 calls) General routines calbec : 258.36s CPU 259.30s WALL ( 22155 calls) fft : 0.08s CPU 0.05s WALL ( 19 calls) ffts : 0.04s CPU 0.03s WALL ( 4 calls) fftw : 2225.44s CPU 1976.23s WALL ( 5860908 calls) interpolate : 0.06s CPU 0.03s WALL ( 4 calls) davcio : 0.52s CPU 27.14s WALL ( 376 calls) Parallel routines fft_scatter : 1487.67s CPU 1532.23s WALL ( 5860931 calls) PWSCF : 1h52m CPU 1h53m WALL This run was terminated on: 20:45:16 28Mar2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=