Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 21:14:50 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TaPS.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 72 48 14 1312 706 116 Max 73 49 15 1314 721 117 Sum 2615 1741 517 47265 25613 4181 bravais-lattice index = 14 lattice parameter (alat) = 12.4830 a.u. unit-cell volume = 648.4201 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 48.00 number of Kohn-Sham states= 58 kinetic-energy cutoff = 44.0000 Ry charge density cutoff = 265.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 12.482973 celldm(2)= 1.000000 celldm(3)= 1.000000 celldm(4)= -0.865191 celldm(5)= -0.743855 celldm(6)= 0.609045 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.609045 0.793135 0.000000 ) a(3) = ( -0.743855 -0.519646 0.420296 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.767896 0.820424 ) b(2) = ( 0.000000 1.260819 1.558853 ) b(3) = ( 0.000000 0.000000 2.379277 ) 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 Ta read from file: /users/gautes/Pseudo/Ta.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: ce7a4fa75595c0f83f911fa846a48acf 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 1273 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 P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 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) Ta 13.00 180.94790 Ta( 1.00) P 5.00 30.97380 P( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 399 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 2) = ( -0.0054189 0.0109934 0.0168946), wk = 0.0025063 k( 3) = ( -0.0108378 0.0219868 0.0337891), wk = 0.0025063 k( 4) = ( -0.0162567 0.0329803 0.0506837), wk = 0.0025063 k( 5) = ( -0.0216756 0.0439737 0.0675783), wk = 0.0025063 k( 6) = ( -0.0270945 0.0549671 0.0844728), wk = 0.0025063 k( 7) = ( -0.0325135 0.0659605 0.1013674), wk = 0.0025063 k( 8) = ( -0.0379324 0.0769540 0.1182620), wk = 0.0025063 k( 9) = ( -0.0433513 0.0879474 0.1351566), wk = 0.0025063 k( 10) = ( -0.0487702 0.0989408 0.1520511), wk = 0.0025063 k( 11) = ( -0.0541891 0.1099342 0.1689457), wk = 0.0025063 k( 12) = ( -0.0596080 0.1209277 0.1858403), wk = 0.0025063 k( 13) = ( -0.0650269 0.1319211 0.2027348), wk = 0.0025063 k( 14) = ( -0.0704458 0.1429145 0.2196294), wk = 0.0025063 k( 15) = ( -0.0758647 0.1539079 0.2365240), wk = 0.0025063 k( 16) = ( -0.0812837 0.1649013 0.2534185), wk = 0.0025063 k( 17) = ( -0.0867026 0.1758948 0.2703131), wk = 0.0025063 k( 18) = ( -0.0921215 0.1868882 0.2872077), wk = 0.0025063 k( 19) = ( -0.0975404 0.1978816 0.3041023), wk = 0.0025063 k( 20) = ( -0.1029593 0.2088750 0.3209968), wk = 0.0025063 k( 21) = ( -0.1083782 0.2198685 0.3378914), wk = 0.0025063 k( 22) = ( -0.1137971 0.2308619 0.3547860), wk = 0.0025063 k( 23) = ( -0.1192160 0.2418553 0.3716806), wk = 0.0025063 k( 24) = ( -0.1246349 0.2528487 0.3885751), wk = 0.0025063 k( 25) = ( -0.1300539 0.2638422 0.4054697), wk = 0.0025063 k( 26) = ( -0.1354728 0.2748356 0.4223643), wk = 0.0025063 k( 27) = ( -0.1408917 0.2858290 0.4392588), wk = 0.0025063 k( 28) = ( -0.1463106 0.2968224 0.4561534), wk = 0.0025063 k( 29) = ( -0.1517295 0.3078158 0.4730480), wk = 0.0025063 k( 30) = ( -0.1571484 0.3188093 0.4899425), wk = 0.0025063 k( 31) = ( -0.1625673 0.3298027 0.5068371), wk = 0.0025063 k( 32) = ( -0.1679862 0.3407961 0.5237317), wk = 0.0025063 k( 33) = ( -0.1734052 0.3517895 0.5406263), wk = 0.0025063 k( 34) = ( -0.1788241 0.3627830 0.5575208), wk = 0.0025063 k( 35) = ( -0.1842430 0.3737764 0.5744154), wk = 0.0025063 k( 36) = ( -0.1896619 0.3847698 0.5913100), wk = 0.0025063 k( 37) = ( -0.1950808 0.3957632 0.6082045), wk = 0.0025063 k( 38) = ( -0.2004997 0.4067567 0.6250991), wk = 0.0025063 k( 39) = ( -0.2059186 0.4177501 0.6419937), wk = 0.0025063 k( 40) = ( -0.2113375 0.4287435 0.6588882), wk = 0.0025063 k( 41) = ( -0.2167564 0.4397369 0.6757828), wk = 0.0025063 k( 42) = ( -0.2221753 0.4507303 0.6926774), wk = 0.0025063 k( 43) = ( -0.2275942 0.4617238 0.7095719), wk = 0.0025063 k( 44) = ( -0.2330132 0.4727172 0.7264665), wk = 0.0025063 k( 45) = ( -0.2384321 0.4837106 0.7433611), wk = 0.0025063 k( 46) = ( -0.2438510 0.4947040 0.7602557), wk = 0.0025063 k( 47) = ( -0.2492699 0.5056975 0.7771502), wk = 0.0025063 k( 48) = ( -0.2546888 0.5166909 0.7940448), wk = 0.0025063 k( 49) = ( -0.2601077 0.5276843 0.8109394), wk = 0.0025063 k( 50) = ( -0.2655266 0.5386777 0.8278339), wk = 0.0025063 k( 51) = ( -0.2709455 0.5496712 0.8447285), wk = 0.0025063 k( 52) = ( -0.2709455 0.5496712 0.8447285), wk = 0.0025063 k( 53) = ( -0.2634383 0.5344411 0.8570467), wk = 0.0025063 k( 54) = ( -0.2559311 0.5192111 0.8693649), wk = 0.0025063 k( 55) = ( -0.2484239 0.5039811 0.8816832), wk = 0.0025063 k( 56) = ( -0.2409166 0.4887511 0.8940014), wk = 0.0025063 k( 57) = ( -0.2334094 0.4735211 0.9063196), wk = 0.0025063 k( 58) = ( -0.2259022 0.4582911 0.9186378), wk = 0.0025063 k( 59) = ( -0.2183950 0.4430611 0.9309560), wk = 0.0025063 k( 60) = ( -0.2108878 0.4278310 0.9432742), wk = 0.0025063 k( 61) = ( -0.2033805 0.4126010 0.9555925), wk = 0.0025063 k( 62) = ( -0.1958733 0.3973710 0.9679107), wk = 0.0025063 k( 63) = ( -0.1883661 0.3821410 0.9802289), wk = 0.0025063 k( 64) = ( -0.1808588 0.3669110 0.9925471), wk = 0.0025063 k( 65) = ( -0.1733516 0.3516810 1.0048653), wk = 0.0025063 k( 66) = ( -0.1658444 0.3364509 1.0171835), wk = 0.0025063 k( 67) = ( -0.1583372 0.3212209 1.0295018), wk = 0.0025063 k( 68) = ( -0.1508299 0.3059909 1.0418200), wk = 0.0025063 k( 69) = ( -0.1433227 0.2907609 1.0541382), wk = 0.0025063 k( 70) = ( -0.1358155 0.2755309 1.0664564), wk = 0.0025063 k( 71) = ( -0.1283083 0.2603009 1.0787746), wk = 0.0025063 k( 72) = ( -0.1208011 0.2450709 1.0910928), wk = 0.0025063 k( 73) = ( -0.1132938 0.2298408 1.1034111), wk = 0.0025063 k( 74) = ( -0.1057866 0.2146108 1.1157293), wk = 0.0025063 k( 75) = ( -0.0982794 0.1993808 1.1280475), wk = 0.0025063 k( 76) = ( -0.0907722 0.1841508 1.1403657), wk = 0.0025063 k( 77) = ( -0.0832649 0.1689208 1.1526839), wk = 0.0025063 k( 78) = ( -0.0757577 0.1536908 1.1650021), wk = 0.0025063 k( 79) = ( -0.0682505 0.1384608 1.1773204), wk = 0.0025063 k( 80) = ( -0.0607433 0.1232307 1.1896386), wk = 0.0025063 k( 81) = ( -0.0607433 0.1232307 1.1896386), wk = 0.0025063 k( 82) = ( -0.0520656 0.1056263 1.1896386), wk = 0.0025063 k( 83) = ( -0.0433880 0.0880220 1.1896386), wk = 0.0025063 k( 84) = ( -0.0347104 0.0704176 1.1896386), wk = 0.0025063 k( 85) = ( -0.0260328 0.0528132 1.1896386), wk = 0.0025063 k( 86) = ( -0.0173552 0.0352088 1.1896386), wk = 0.0025063 k( 87) = ( -0.0086776 0.0176044 1.1896386), wk = 0.0025063 k( 88) = ( 0.0000000 0.0000000 1.1896386), wk = 0.0025063 k( 89) = ( 0.0000000 0.0000000 1.1896386), wk = 0.0025063 k( 90) = ( 0.0178571 0.0088022 1.1896386), wk = 0.0025063 k( 91) = ( 0.0357143 0.0176044 1.1896386), wk = 0.0025063 k( 92) = ( 0.0535714 0.0264066 1.1896386), wk = 0.0025063 k( 93) = ( 0.0714286 0.0352088 1.1896386), wk = 0.0025063 k( 94) = ( 0.0892857 0.0440110 1.1896386), wk = 0.0025063 k( 95) = ( 0.1071429 0.0528132 1.1896386), wk = 0.0025063 k( 96) = ( 0.1250000 0.0616154 1.1896386), wk = 0.0025063 k( 97) = ( 0.1428571 0.0704176 1.1896386), wk = 0.0025063 k( 98) = ( 0.1607143 0.0792198 1.1896386), wk = 0.0025063 k( 99) = ( 0.1785714 0.0880220 1.1896386), wk = 0.0025063 k( 100) = ( 0.1964286 0.0968242 1.1896386), wk = 0.0025063 k( 101) = ( 0.2142857 0.1056263 1.1896386), wk = 0.0025063 k( 102) = ( 0.2321429 0.1144285 1.1896386), wk = 0.0025063 k( 103) = ( 0.2500000 0.1232307 1.1896386), wk = 0.0025063 k( 104) = ( 0.2500000 0.1232307 1.1896386), wk = 0.0025063 k( 105) = ( 0.2426471 0.1381478 1.1775735), wk = 0.0025063 k( 106) = ( 0.2352941 0.1530648 1.1655085), wk = 0.0025063 k( 107) = ( 0.2279412 0.1679818 1.1534434), wk = 0.0025063 k( 108) = ( 0.2205882 0.1828988 1.1413783), wk = 0.0025063 k( 109) = ( 0.2132353 0.1978158 1.1293133), wk = 0.0025063 k( 110) = ( 0.2058823 0.2127329 1.1172482), wk = 0.0025063 k( 111) = ( 0.1985294 0.2276499 1.1051831), wk = 0.0025063 k( 112) = ( 0.1911765 0.2425669 1.0931181), wk = 0.0025063 k( 113) = ( 0.1838235 0.2574839 1.0810530), wk = 0.0025063 k( 114) = ( 0.1764706 0.2724009 1.0689880), wk = 0.0025063 k( 115) = ( 0.1691177 0.2873179 1.0569229), wk = 0.0025063 k( 116) = ( 0.1617647 0.3022350 1.0448578), wk = 0.0025063 k( 117) = ( 0.1544118 0.3171520 1.0327928), wk = 0.0025063 k( 118) = ( 0.1470588 0.3320690 1.0207277), wk = 0.0025063 k( 119) = ( 0.1397059 0.3469860 1.0086626), wk = 0.0025063 k( 120) = ( 0.1323529 0.3619030 0.9965976), wk = 0.0025063 k( 121) = ( 0.1250000 0.3768201 0.9845325), wk = 0.0025063 k( 122) = ( 0.1176471 0.3917371 0.9724675), wk = 0.0025063 k( 123) = ( 0.1102941 0.4066541 0.9604024), wk = 0.0025063 k( 124) = ( 0.1029412 0.4215711 0.9483373), wk = 0.0025063 k( 125) = ( 0.0955882 0.4364881 0.9362723), wk = 0.0025063 k( 126) = ( 0.0882353 0.4514052 0.9242072), wk = 0.0025063 k( 127) = ( 0.0808824 0.4663222 0.9121422), wk = 0.0025063 k( 128) = ( 0.0735294 0.4812392 0.9000771), wk = 0.0025063 k( 129) = ( 0.0661765 0.4961562 0.8880120), wk = 0.0025063 k( 130) = ( 0.0588235 0.5110732 0.8759470), wk = 0.0025063 k( 131) = ( 0.0514706 0.5259902 0.8638819), wk = 0.0025063 k( 132) = ( 0.0441177 0.5409073 0.8518169), wk = 0.0025063 k( 133) = ( 0.0367647 0.5558243 0.8397518), wk = 0.0025063 k( 134) = ( 0.0294118 0.5707413 0.8276867), wk = 0.0025063 k( 135) = ( 0.0220588 0.5856583 0.8156217), wk = 0.0025063 k( 136) = ( 0.0147059 0.6005753 0.8035566), wk = 0.0025063 k( 137) = ( 0.0073529 0.6154924 0.7914915), wk = 0.0025063 k( 138) = ( 0.0000000 0.6304094 0.7794265), wk = 0.0025063 k( 139) = ( 0.0000000 0.6304094 0.7794265), wk = 0.0025063 k( 140) = ( 0.0193532 0.6361764 0.7747620), wk = 0.0025063 k( 141) = ( 0.0387065 0.6419434 0.7700976), wk = 0.0025063 k( 142) = ( 0.0580598 0.6477104 0.7654332), wk = 0.0025063 k( 143) = ( 0.0774130 0.6534774 0.7607688), wk = 0.0025063 k( 144) = ( 0.0967663 0.6592445 0.7561043), wk = 0.0025063 k( 145) = ( 0.1161195 0.6650115 0.7514399), wk = 0.0025063 k( 146) = ( 0.1354728 0.6707785 0.7467755), wk = 0.0025063 k( 147) = ( 0.1548260 0.6765455 0.7421110), wk = 0.0025063 k( 148) = ( 0.1741793 0.6823125 0.7374466), wk = 0.0025063 k( 149) = ( 0.1935325 0.6880795 0.7327822), wk = 0.0025063 k( 150) = ( 0.2128858 0.6938466 0.7281177), wk = 0.0025063 k( 151) = ( 0.2322390 0.6996136 0.7234533), wk = 0.0025063 k( 152) = ( 0.2515923 0.7053806 0.7187889), wk = 0.0025063 k( 153) = ( 0.2709455 0.7111476 0.7141244), wk = 0.0025063 k( 154) = ( 0.2709455 0.7111476 0.7141244), wk = 0.0025063 k( 155) = ( 0.2763992 0.7000836 0.6971215), wk = 0.0025063 k( 156) = ( 0.2818529 0.6890197 0.6801185), wk = 0.0025063 k( 157) = ( 0.2873066 0.6779557 0.6631156), wk = 0.0025063 k( 158) = ( 0.2927602 0.6668918 0.6461126), wk = 0.0025063 k( 159) = ( 0.2982139 0.6558278 0.6291096), wk = 0.0025063 k( 160) = ( 0.3036676 0.6447639 0.6121067), wk = 0.0025063 k( 161) = ( 0.3091213 0.6336999 0.5951037), wk = 0.0025063 k( 162) = ( 0.3145750 0.6226360 0.5781007), wk = 0.0025063 k( 163) = ( 0.3200286 0.6115720 0.5610978), wk = 0.0025063 k( 164) = ( 0.3254823 0.6005080 0.5440948), wk = 0.0025063 k( 165) = ( 0.3309360 0.5894441 0.5270919), wk = 0.0025063 k( 166) = ( 0.3363897 0.5783801 0.5100889), wk = 0.0025063 k( 167) = ( 0.3418433 0.5673162 0.4930859), wk = 0.0025063 k( 168) = ( 0.3472970 0.5562522 0.4760830), wk = 0.0025063 k( 169) = ( 0.3527507 0.5451883 0.4590800), wk = 0.0025063 k( 170) = ( 0.3582044 0.5341243 0.4420770), wk = 0.0025063 k( 171) = ( 0.3636581 0.5230604 0.4250741), wk = 0.0025063 k( 172) = ( 0.3691117 0.5119964 0.4080711), wk = 0.0025063 k( 173) = ( 0.3745654 0.5009325 0.3910682), wk = 0.0025063 k( 174) = ( 0.3800191 0.4898685 0.3740652), wk = 0.0025063 k( 175) = ( 0.3854728 0.4788045 0.3570622), wk = 0.0025063 k( 176) = ( 0.3909264 0.4677406 0.3400593), wk = 0.0025063 k( 177) = ( 0.3963801 0.4566766 0.3230563), wk = 0.0025063 k( 178) = ( 0.4018338 0.4456127 0.3060533), wk = 0.0025063 k( 179) = ( 0.4072875 0.4345487 0.2890504), wk = 0.0025063 k( 180) = ( 0.4127412 0.4234848 0.2720474), wk = 0.0025063 k( 181) = ( 0.4181948 0.4124208 0.2550444), wk = 0.0025063 k( 182) = ( 0.4236485 0.4013569 0.2380415), wk = 0.0025063 k( 183) = ( 0.4291022 0.3902929 0.2210385), wk = 0.0025063 k( 184) = ( 0.4345559 0.3792289 0.2040356), wk = 0.0025063 k( 185) = ( 0.4400096 0.3681650 0.1870326), wk = 0.0025063 k( 186) = ( 0.4454632 0.3571010 0.1700296), wk = 0.0025063 k( 187) = ( 0.4509169 0.3460371 0.1530267), wk = 0.0025063 k( 188) = ( 0.4563706 0.3349731 0.1360237), wk = 0.0025063 k( 189) = ( 0.4618243 0.3239092 0.1190207), wk = 0.0025063 k( 190) = ( 0.4672779 0.3128452 0.1020178), wk = 0.0025063 k( 191) = ( 0.4727316 0.3017813 0.0850148), wk = 0.0025063 k( 192) = ( 0.4781853 0.2907173 0.0680119), wk = 0.0025063 k( 193) = ( 0.4836390 0.2796533 0.0510089), wk = 0.0025063 k( 194) = ( 0.4890926 0.2685894 0.0340059), wk = 0.0025063 k( 195) = ( 0.4945463 0.2575254 0.0170030), wk = 0.0025063 k( 196) = ( 0.5000000 0.2464615 -0.0000000), wk = 0.0025063 k( 197) = ( 0.5000000 0.2464615 -0.0000000), wk = 0.0025063 k( 198) = ( 0.4814815 0.2373333 -0.0000000), wk = 0.0025063 k( 199) = ( 0.4629630 0.2282051 -0.0000000), wk = 0.0025063 k( 200) = ( 0.4444444 0.2190769 -0.0000000), wk = 0.0025063 k( 201) = ( 0.4259259 0.2099487 -0.0000000), wk = 0.0025063 k( 202) = ( 0.4074074 0.2008205 -0.0000000), wk = 0.0025063 k( 203) = ( 0.3888889 0.1916923 -0.0000000), wk = 0.0025063 k( 204) = ( 0.3703704 0.1825641 -0.0000000), wk = 0.0025063 k( 205) = ( 0.3518519 0.1734359 -0.0000000), wk = 0.0025063 k( 206) = ( 0.3333333 0.1643077 -0.0000000), wk = 0.0025063 k( 207) = ( 0.3148148 0.1551795 -0.0000000), wk = 0.0025063 k( 208) = ( 0.2962963 0.1460513 -0.0000000), wk = 0.0025063 k( 209) = ( 0.2777778 0.1369230 -0.0000000), wk = 0.0025063 k( 210) = ( 0.2592593 0.1277948 -0.0000000), wk = 0.0025063 k( 211) = ( 0.2407407 0.1186666 -0.0000000), wk = 0.0025063 k( 212) = ( 0.2222222 0.1095384 -0.0000000), wk = 0.0025063 k( 213) = ( 0.2037037 0.1004102 -0.0000000), wk = 0.0025063 k( 214) = ( 0.1851852 0.0912820 -0.0000000), wk = 0.0025063 k( 215) = ( 0.1666667 0.0821538 -0.0000000), wk = 0.0025063 k( 216) = ( 0.1481482 0.0730256 -0.0000000), wk = 0.0025063 k( 217) = ( 0.1296296 0.0638974 -0.0000000), wk = 0.0025063 k( 218) = ( 0.1111111 0.0547692 -0.0000000), wk = 0.0025063 k( 219) = ( 0.0925926 0.0456410 -0.0000000), wk = 0.0025063 k( 220) = ( 0.0740741 0.0365128 -0.0000000), wk = 0.0025063 k( 221) = ( 0.0555556 0.0273846 -0.0000000), wk = 0.0025063 k( 222) = ( 0.0370370 0.0182564 -0.0000000), wk = 0.0025063 k( 223) = ( 0.0185185 0.0091282 -0.0000000), wk = 0.0025063 k( 224) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 225) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 226) = ( 0.0074307 -0.0150748 0.0121927), wk = 0.0025063 k( 227) = ( 0.0148614 -0.0301496 0.0243853), wk = 0.0025063 k( 228) = ( 0.0222921 -0.0452244 0.0365780), wk = 0.0025063 k( 229) = ( 0.0297228 -0.0602992 0.0487707), wk = 0.0025063 k( 230) = ( 0.0371536 -0.0753739 0.0609633), wk = 0.0025063 k( 231) = ( 0.0445843 -0.0904488 0.0731560), wk = 0.0025063 k( 232) = ( 0.0520150 -0.1055235 0.0853487), wk = 0.0025063 k( 233) = ( 0.0594457 -0.1205983 0.0975414), wk = 0.0025063 k( 234) = ( 0.0668764 -0.1356731 0.1097340), wk = 0.0025063 k( 235) = ( 0.0743071 -0.1507479 0.1219267), wk = 0.0025063 k( 236) = ( 0.0817378 -0.1658227 0.1341194), wk = 0.0025063 k( 237) = ( 0.0891685 -0.1808975 0.1463120), wk = 0.0025063 k( 238) = ( 0.0965992 -0.1959723 0.1585047), wk = 0.0025063 k( 239) = ( 0.1040299 -0.2110471 0.1706974), wk = 0.0025063 k( 240) = ( 0.1114607 -0.2261219 0.1828900), wk = 0.0025063 k( 241) = ( 0.1188914 -0.2411967 0.1950827), wk = 0.0025063 k( 242) = ( 0.1263221 -0.2562715 0.2072754), wk = 0.0025063 k( 243) = ( 0.1337528 -0.2713463 0.2194681), wk = 0.0025063 k( 244) = ( 0.1411835 -0.2864210 0.2316607), wk = 0.0025063 k( 245) = ( 0.1486142 -0.3014958 0.2438534), wk = 0.0025063 k( 246) = ( 0.1560449 -0.3165706 0.2560461), wk = 0.0025063 k( 247) = ( 0.1634756 -0.3316454 0.2682387), wk = 0.0025063 k( 248) = ( 0.1709064 -0.3467202 0.2804314), wk = 0.0025063 k( 249) = ( 0.1783371 -0.3617950 0.2926241), wk = 0.0025063 k( 250) = ( 0.1857678 -0.3768698 0.3048167), wk = 0.0025063 k( 251) = ( 0.1931985 -0.3919446 0.3170094), wk = 0.0025063 k( 252) = ( 0.2006292 -0.4070194 0.3292021), wk = 0.0025063 k( 253) = ( 0.2080599 -0.4220941 0.3413947), wk = 0.0025063 k( 254) = ( 0.2154906 -0.4371690 0.3535874), wk = 0.0025063 k( 255) = ( 0.2229213 -0.4522437 0.3657801), wk = 0.0025063 k( 256) = ( 0.2303520 -0.4673185 0.3779728), wk = 0.0025063 k( 257) = ( 0.2377827 -0.4823933 0.3901654), wk = 0.0025063 k( 258) = ( 0.2452135 -0.4974681 0.4023581), wk = 0.0025063 k( 259) = ( 0.2526442 -0.5125429 0.4145508), wk = 0.0025063 k( 260) = ( 0.2600749 -0.5276177 0.4267434), wk = 0.0025063 k( 261) = ( 0.2675056 -0.5426925 0.4389361), wk = 0.0025063 k( 262) = ( 0.2749363 -0.5577673 0.4511288), wk = 0.0025063 k( 263) = ( 0.2823670 -0.5728421 0.4633214), wk = 0.0025063 k( 264) = ( 0.2897977 -0.5879168 0.4755141), wk = 0.0025063 k( 265) = ( 0.2897977 -0.5879168 0.4755141), wk = 0.0025063 k( 266) = ( 0.3038112 -0.5743189 0.4711607), wk = 0.0025063 k( 267) = ( 0.3178247 -0.5607210 0.4668072), wk = 0.0025063 k( 268) = ( 0.3318382 -0.5471231 0.4624537), wk = 0.0025063 k( 269) = ( 0.3458517 -0.5335251 0.4581002), wk = 0.0025063 k( 270) = ( 0.3598652 -0.5199272 0.4537468), wk = 0.0025063 k( 271) = ( 0.3738786 -0.5063293 0.4493933), wk = 0.0025063 k( 272) = ( 0.3878921 -0.4927313 0.4450398), wk = 0.0025063 k( 273) = ( 0.4019056 -0.4791334 0.4406864), wk = 0.0025063 k( 274) = ( 0.4159191 -0.4655355 0.4363329), wk = 0.0025063 k( 275) = ( 0.4299326 -0.4519375 0.4319794), wk = 0.0025063 k( 276) = ( 0.4439461 -0.4383396 0.4276260), wk = 0.0025063 k( 277) = ( 0.4579595 -0.4247417 0.4232725), wk = 0.0025063 k( 278) = ( 0.4719730 -0.4111438 0.4189190), wk = 0.0025063 k( 279) = ( 0.4859865 -0.3975458 0.4145656), wk = 0.0025063 k( 280) = ( 0.5000000 -0.3839479 0.4102121), wk = 0.0025063 k( 281) = ( 0.5000000 -0.3839479 0.4102121), wk = 0.0025063 k( 282) = ( 0.4945652 -0.3729223 0.4271561), wk = 0.0025063 k( 283) = ( 0.4891304 -0.3618966 0.4441002), wk = 0.0025063 k( 284) = ( 0.4836956 -0.3508710 0.4610443), wk = 0.0025063 k( 285) = ( 0.4782609 -0.3398454 0.4779883), wk = 0.0025063 k( 286) = ( 0.4728261 -0.3288198 0.4949324), wk = 0.0025063 k( 287) = ( 0.4673913 -0.3177941 0.5118764), wk = 0.0025063 k( 288) = ( 0.4619565 -0.3067685 0.5288205), wk = 0.0025063 k( 289) = ( 0.4565217 -0.2957429 0.5457645), wk = 0.0025063 k( 290) = ( 0.4510870 -0.2847173 0.5627086), wk = 0.0025063 k( 291) = ( 0.4456522 -0.2736917 0.5796526), wk = 0.0025063 k( 292) = ( 0.4402174 -0.2626660 0.5965967), wk = 0.0025063 k( 293) = ( 0.4347826 -0.2516404 0.6135407), wk = 0.0025063 k( 294) = ( 0.4293478 -0.2406148 0.6304848), wk = 0.0025063 k( 295) = ( 0.4239130 -0.2295892 0.6474289), wk = 0.0025063 k( 296) = ( 0.4184783 -0.2185636 0.6643729), wk = 0.0025063 k( 297) = ( 0.4130435 -0.2075379 0.6813170), wk = 0.0025063 k( 298) = ( 0.4076087 -0.1965123 0.6982610), wk = 0.0025063 k( 299) = ( 0.4021739 -0.1854867 0.7152051), wk = 0.0025063 k( 300) = ( 0.3967391 -0.1744611 0.7321491), wk = 0.0025063 k( 301) = ( 0.3913044 -0.1634354 0.7490932), wk = 0.0025063 k( 302) = ( 0.3858696 -0.1524098 0.7660372), wk = 0.0025063 k( 303) = ( 0.3804348 -0.1413842 0.7829813), wk = 0.0025063 k( 304) = ( 0.3750000 -0.1303586 0.7999253), wk = 0.0025063 k( 305) = ( 0.3695652 -0.1193330 0.8168694), wk = 0.0025063 k( 306) = ( 0.3641304 -0.1083073 0.8338135), wk = 0.0025063 k( 307) = ( 0.3586956 -0.0972817 0.8507575), wk = 0.0025063 k( 308) = ( 0.3532609 -0.0862561 0.8677015), wk = 0.0025063 k( 309) = ( 0.3478261 -0.0752305 0.8846456), wk = 0.0025063 k( 310) = ( 0.3423913 -0.0642048 0.9015897), wk = 0.0025063 k( 311) = ( 0.3369565 -0.0531792 0.9185337), wk = 0.0025063 k( 312) = ( 0.3315217 -0.0421536 0.9354778), wk = 0.0025063 k( 313) = ( 0.3260870 -0.0311280 0.9524218), wk = 0.0025063 k( 314) = ( 0.3206522 -0.0201023 0.9693659), wk = 0.0025063 k( 315) = ( 0.3152174 -0.0090767 0.9863099), wk = 0.0025063 k( 316) = ( 0.3097826 0.0019489 1.0032540), wk = 0.0025063 k( 317) = ( 0.3043478 0.0129745 1.0201980), wk = 0.0025063 k( 318) = ( 0.2989130 0.0240001 1.0371421), wk = 0.0025063 k( 319) = ( 0.2934783 0.0350258 1.0540861), wk = 0.0025063 k( 320) = ( 0.2880435 0.0460514 1.0710302), wk = 0.0025063 k( 321) = ( 0.2826087 0.0570770 1.0879742), wk = 0.0025063 k( 322) = ( 0.2771739 0.0681026 1.1049183), wk = 0.0025063 k( 323) = ( 0.2717391 0.0791283 1.1218624), wk = 0.0025063 k( 324) = ( 0.2663044 0.0901539 1.1388064), wk = 0.0025063 k( 325) = ( 0.2608696 0.1011795 1.1557504), wk = 0.0025063 k( 326) = ( 0.2554348 0.1122051 1.1726945), wk = 0.0025063 k( 327) = ( 0.2500000 0.1232307 1.1896386), wk = 0.0025063 k( 328) = ( 0.0607433 -0.1232307 1.1896386), wk = 0.0025063 k( 329) = ( 0.0661969 -0.1342947 1.1726356), wk = 0.0025063 k( 330) = ( 0.0716506 -0.1453587 1.1556326), wk = 0.0025063 k( 331) = ( 0.0771043 -0.1564226 1.1386297), wk = 0.0025063 k( 332) = ( 0.0825580 -0.1674866 1.1216267), wk = 0.0025063 k( 333) = ( 0.0880116 -0.1785505 1.1046238), wk = 0.0025063 k( 334) = ( 0.0934653 -0.1896145 1.0876208), wk = 0.0025063 k( 335) = ( 0.0989190 -0.2006784 1.0706178), wk = 0.0025063 k( 336) = ( 0.1043727 -0.2117424 1.0536149), wk = 0.0025063 k( 337) = ( 0.1098264 -0.2228063 1.0366119), wk = 0.0025063 k( 338) = ( 0.1152800 -0.2338703 1.0196089), wk = 0.0025063 k( 339) = ( 0.1207337 -0.2449343 1.0026060), wk = 0.0025063 k( 340) = ( 0.1261874 -0.2559982 0.9856030), wk = 0.0025063 k( 341) = ( 0.1316411 -0.2670622 0.9686001), wk = 0.0025063 k( 342) = ( 0.1370947 -0.2781261 0.9515971), wk = 0.0025063 k( 343) = ( 0.1425484 -0.2891901 0.9345941), wk = 0.0025063 k( 344) = ( 0.1480021 -0.3002540 0.9175912), wk = 0.0025063 k( 345) = ( 0.1534558 -0.3113180 0.9005882), wk = 0.0025063 k( 346) = ( 0.1589095 -0.3223819 0.8835852), wk = 0.0025063 k( 347) = ( 0.1643631 -0.3334459 0.8665823), wk = 0.0025063 k( 348) = ( 0.1698168 -0.3445099 0.8495793), wk = 0.0025063 k( 349) = ( 0.1752705 -0.3555738 0.8325764), wk = 0.0025063 k( 350) = ( 0.1807242 -0.3666378 0.8155734), wk = 0.0025063 k( 351) = ( 0.1861779 -0.3777017 0.7985704), wk = 0.0025063 k( 352) = ( 0.1916315 -0.3887657 0.7815675), wk = 0.0025063 k( 353) = ( 0.1970852 -0.3998296 0.7645645), wk = 0.0025063 k( 354) = ( 0.2025389 -0.4108936 0.7475615), wk = 0.0025063 k( 355) = ( 0.2079926 -0.4219575 0.7305586), wk = 0.0025063 k( 356) = ( 0.2134462 -0.4330215 0.7135556), wk = 0.0025063 k( 357) = ( 0.2188999 -0.4440855 0.6965526), wk = 0.0025063 k( 358) = ( 0.2243536 -0.4551494 0.6795497), wk = 0.0025063 k( 359) = ( 0.2298073 -0.4662133 0.6625467), wk = 0.0025063 k( 360) = ( 0.2352609 -0.4772773 0.6455438), wk = 0.0025063 k( 361) = ( 0.2407146 -0.4883413 0.6285408), wk = 0.0025063 k( 362) = ( 0.2461683 -0.4994052 0.6115378), wk = 0.0025063 k( 363) = ( 0.2516220 -0.5104692 0.5945349), wk = 0.0025063 k( 364) = ( 0.2570757 -0.5215331 0.5775319), wk = 0.0025063 k( 365) = ( 0.2625293 -0.5325971 0.5605289), wk = 0.0025063 k( 366) = ( 0.2679830 -0.5436610 0.5435260), wk = 0.0025063 k( 367) = ( 0.2734367 -0.5547250 0.5265230), wk = 0.0025063 k( 368) = ( 0.2788904 -0.5657889 0.5095201), wk = 0.0025063 k( 369) = ( 0.2843441 -0.5768529 0.4925171), wk = 0.0025063 k( 370) = ( 0.2897977 -0.5879168 0.4755141), wk = 0.0025063 k( 371) = ( 0.7102023 -0.1799789 0.3449101), wk = 0.0025063 k( 372) = ( 0.7026950 -0.1647489 0.3325918), wk = 0.0025063 k( 373) = ( 0.6951878 -0.1495189 0.3202736), wk = 0.0025063 k( 374) = ( 0.6876806 -0.1342889 0.3079554), wk = 0.0025063 k( 375) = ( 0.6801734 -0.1190589 0.2956372), wk = 0.0025063 k( 376) = ( 0.6726661 -0.1038288 0.2833190), wk = 0.0025063 k( 377) = ( 0.6651589 -0.0885988 0.2710008), wk = 0.0025063 k( 378) = ( 0.6576517 -0.0733688 0.2586826), wk = 0.0025063 k( 379) = ( 0.6501445 -0.0581388 0.2463643), wk = 0.0025063 k( 380) = ( 0.6426373 -0.0429088 0.2340461), wk = 0.0025063 k( 381) = ( 0.6351300 -0.0276788 0.2217279), wk = 0.0025063 k( 382) = ( 0.6276228 -0.0124488 0.2094097), wk = 0.0025063 k( 383) = ( 0.6201156 0.0027812 0.1970915), wk = 0.0025063 k( 384) = ( 0.6126084 0.0180113 0.1847732), wk = 0.0025063 k( 385) = ( 0.6051011 0.0332413 0.1724550), wk = 0.0025063 k( 386) = ( 0.5975939 0.0484713 0.1601368), wk = 0.0025063 k( 387) = ( 0.5900867 0.0637013 0.1478186), wk = 0.0025063 k( 388) = ( 0.5825795 0.0789313 0.1355004), wk = 0.0025063 k( 389) = ( 0.5750722 0.0941613 0.1231822), wk = 0.0025063 k( 390) = ( 0.5675650 0.1093913 0.1108640), wk = 0.0025063 k( 391) = ( 0.5600578 0.1246214 0.0985457), wk = 0.0025063 k( 392) = ( 0.5525506 0.1398514 0.0862275), wk = 0.0025063 k( 393) = ( 0.5450433 0.1550814 0.0739093), wk = 0.0025063 k( 394) = ( 0.5375361 0.1703114 0.0615911), wk = 0.0025063 k( 395) = ( 0.5300289 0.1855414 0.0492729), wk = 0.0025063 k( 396) = ( 0.5225217 0.2007714 0.0369546), wk = 0.0025063 k( 397) = ( 0.5150145 0.2160015 0.0246364), wk = 0.0025063 k( 398) = ( 0.5075072 0.2312315 0.0123182), wk = 0.0025063 k( 399) = ( 0.5000000 0.2464615 -0.0000000), wk = 0.0025063 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 2) = ( -0.0054189 0.0054189 0.0054189), wk = 0.0025063 k( 3) = ( -0.0108378 0.0108378 0.0108378), wk = 0.0025063 k( 4) = ( -0.0162567 0.0162567 0.0162567), wk = 0.0025063 k( 5) = ( -0.0216756 0.0216756 0.0216756), wk = 0.0025063 k( 6) = ( -0.0270945 0.0270945 0.0270945), wk = 0.0025063 k( 7) = ( -0.0325135 0.0325135 0.0325135), wk = 0.0025063 k( 8) = ( -0.0379324 0.0379324 0.0379324), wk = 0.0025063 k( 9) = ( -0.0433513 0.0433513 0.0433513), wk = 0.0025063 k( 10) = ( -0.0487702 0.0487702 0.0487702), wk = 0.0025063 k( 11) = ( -0.0541891 0.0541891 0.0541891), wk = 0.0025063 k( 12) = ( -0.0596080 0.0596080 0.0596080), wk = 0.0025063 k( 13) = ( -0.0650269 0.0650269 0.0650269), wk = 0.0025063 k( 14) = ( -0.0704458 0.0704458 0.0704458), wk = 0.0025063 k( 15) = ( -0.0758647 0.0758647 0.0758647), wk = 0.0025063 k( 16) = ( -0.0812837 0.0812837 0.0812837), wk = 0.0025063 k( 17) = ( -0.0867026 0.0867026 0.0867026), wk = 0.0025063 k( 18) = ( -0.0921215 0.0921215 0.0921215), wk = 0.0025063 k( 19) = ( -0.0975404 0.0975404 0.0975404), wk = 0.0025063 k( 20) = ( -0.1029593 0.1029593 0.1029593), wk = 0.0025063 k( 21) = ( -0.1083782 0.1083782 0.1083782), wk = 0.0025063 k( 22) = ( -0.1137971 0.1137971 0.1137971), wk = 0.0025063 k( 23) = ( -0.1192160 0.1192160 0.1192160), wk = 0.0025063 k( 24) = ( -0.1246349 0.1246350 0.1246349), wk = 0.0025063 k( 25) = ( -0.1300539 0.1300539 0.1300539), wk = 0.0025063 k( 26) = ( -0.1354728 0.1354728 0.1354728), wk = 0.0025063 k( 27) = ( -0.1408917 0.1408917 0.1408917), wk = 0.0025063 k( 28) = ( -0.1463106 0.1463106 0.1463106), wk = 0.0025063 k( 29) = ( -0.1517295 0.1517295 0.1517295), wk = 0.0025063 k( 30) = ( -0.1571484 0.1571484 0.1571484), wk = 0.0025063 k( 31) = ( -0.1625673 0.1625673 0.1625673), wk = 0.0025063 k( 32) = ( -0.1679862 0.1679862 0.1679862), wk = 0.0025063 k( 33) = ( -0.1734052 0.1734052 0.1734052), wk = 0.0025063 k( 34) = ( -0.1788241 0.1788241 0.1788241), wk = 0.0025063 k( 35) = ( -0.1842430 0.1842430 0.1842430), wk = 0.0025063 k( 36) = ( -0.1896619 0.1896619 0.1896619), wk = 0.0025063 k( 37) = ( -0.1950808 0.1950808 0.1950808), wk = 0.0025063 k( 38) = ( -0.2004997 0.2004997 0.2004997), wk = 0.0025063 k( 39) = ( -0.2059186 0.2059186 0.2059186), wk = 0.0025063 k( 40) = ( -0.2113375 0.2113375 0.2113375), wk = 0.0025063 k( 41) = ( -0.2167564 0.2167564 0.2167564), wk = 0.0025063 k( 42) = ( -0.2221753 0.2221753 0.2221753), wk = 0.0025063 k( 43) = ( -0.2275942 0.2275942 0.2275942), wk = 0.0025063 k( 44) = ( -0.2330132 0.2330132 0.2330132), wk = 0.0025063 k( 45) = ( -0.2384321 0.2384321 0.2384321), wk = 0.0025063 k( 46) = ( -0.2438510 0.2438510 0.2438510), wk = 0.0025063 k( 47) = ( -0.2492699 0.2492699 0.2492699), wk = 0.0025063 k( 48) = ( -0.2546888 0.2546888 0.2546888), wk = 0.0025063 k( 49) = ( -0.2601077 0.2601077 0.2601077), wk = 0.0025063 k( 50) = ( -0.2655266 0.2655266 0.2655266), wk = 0.0025063 k( 51) = ( -0.2709455 0.2709455 0.2709455), wk = 0.0025063 k( 52) = ( -0.2709455 0.2709455 0.2709455), wk = 0.0025063 k( 53) = ( -0.2634383 0.2634383 0.2784528), wk = 0.0025063 k( 54) = ( -0.2559311 0.2559311 0.2859600), wk = 0.0025063 k( 55) = ( -0.2484239 0.2484239 0.2934672), wk = 0.0025063 k( 56) = ( -0.2409166 0.2409166 0.3009744), wk = 0.0025063 k( 57) = ( -0.2334094 0.2334094 0.3084817), wk = 0.0025063 k( 58) = ( -0.2259022 0.2259022 0.3159889), wk = 0.0025063 k( 59) = ( -0.2183950 0.2183950 0.3234961), wk = 0.0025063 k( 60) = ( -0.2108878 0.2108878 0.3310033), wk = 0.0025063 k( 61) = ( -0.2033805 0.2033805 0.3385106), wk = 0.0025063 k( 62) = ( -0.1958733 0.1958733 0.3460178), wk = 0.0025063 k( 63) = ( -0.1883661 0.1883661 0.3535250), wk = 0.0025063 k( 64) = ( -0.1808588 0.1808589 0.3610322), wk = 0.0025063 k( 65) = ( -0.1733516 0.1733516 0.3685394), wk = 0.0025063 k( 66) = ( -0.1658444 0.1658444 0.3760467), wk = 0.0025063 k( 67) = ( -0.1583372 0.1583372 0.3835539), wk = 0.0025063 k( 68) = ( -0.1508299 0.1508300 0.3910611), wk = 0.0025063 k( 69) = ( -0.1433227 0.1433227 0.3985684), wk = 0.0025063 k( 70) = ( -0.1358155 0.1358155 0.4060756), wk = 0.0025063 k( 71) = ( -0.1283083 0.1283083 0.4135828), wk = 0.0025063 k( 72) = ( -0.1208011 0.1208011 0.4210900), wk = 0.0025063 k( 73) = ( -0.1132938 0.1132938 0.4285972), wk = 0.0025063 k( 74) = ( -0.1057866 0.1057866 0.4361045), wk = 0.0025063 k( 75) = ( -0.0982794 0.0982794 0.4436117), wk = 0.0025063 k( 76) = ( -0.0907722 0.0907722 0.4511189), wk = 0.0025063 k( 77) = ( -0.0832649 0.0832649 0.4586261), wk = 0.0025063 k( 78) = ( -0.0757577 0.0757577 0.4661334), wk = 0.0025063 k( 79) = ( -0.0682505 0.0682505 0.4736406), wk = 0.0025063 k( 80) = ( -0.0607433 0.0607433 0.4811478), wk = 0.0025063 k( 81) = ( -0.0607433 0.0607433 0.4811478), wk = 0.0025063 k( 82) = ( -0.0520656 0.0520656 0.4838410), wk = 0.0025063 k( 83) = ( -0.0433880 0.0433881 0.4865341), wk = 0.0025063 k( 84) = ( -0.0347104 0.0347104 0.4892273), wk = 0.0025063 k( 85) = ( -0.0260328 0.0260328 0.4919205), wk = 0.0025063 k( 86) = ( -0.0173552 0.0173552 0.4946137), wk = 0.0025063 k( 87) = ( -0.0086776 0.0086776 0.4973068), wk = 0.0025063 k( 88) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025063 k( 89) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0025063 k( 90) = ( 0.0178571 0.0178571 0.4821429), wk = 0.0025063 k( 91) = ( 0.0357143 0.0357143 0.4642857), wk = 0.0025063 k( 92) = ( 0.0535714 0.0535714 0.4464286), wk = 0.0025063 k( 93) = ( 0.0714286 0.0714286 0.4285714), wk = 0.0025063 k( 94) = ( 0.0892857 0.0892857 0.4107143), wk = 0.0025063 k( 95) = ( 0.1071429 0.1071429 0.3928571), wk = 0.0025063 k( 96) = ( 0.1250000 0.1250000 0.3750000), wk = 0.0025063 k( 97) = ( 0.1428571 0.1428571 0.3571429), wk = 0.0025063 k( 98) = ( 0.1607143 0.1607143 0.3392857), wk = 0.0025063 k( 99) = ( 0.1785714 0.1785714 0.3214286), wk = 0.0025063 k( 100) = ( 0.1964286 0.1964286 0.3035714), wk = 0.0025063 k( 101) = ( 0.2142857 0.2142857 0.2857143), wk = 0.0025063 k( 102) = ( 0.2321429 0.2321429 0.2678571), wk = 0.0025063 k( 103) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025063 k( 104) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025063 k( 105) = ( 0.2426471 0.2573529 0.2426471), wk = 0.0025063 k( 106) = ( 0.2352941 0.2647059 0.2352941), wk = 0.0025063 k( 107) = ( 0.2279412 0.2720588 0.2279412), wk = 0.0025063 k( 108) = ( 0.2205882 0.2794118 0.2205882), wk = 0.0025063 k( 109) = ( 0.2132353 0.2867647 0.2132353), wk = 0.0025063 k( 110) = ( 0.2058823 0.2941177 0.2058824), wk = 0.0025063 k( 111) = ( 0.1985294 0.3014706 0.1985294), wk = 0.0025063 k( 112) = ( 0.1911765 0.3088235 0.1911765), wk = 0.0025063 k( 113) = ( 0.1838235 0.3161765 0.1838235), wk = 0.0025063 k( 114) = ( 0.1764706 0.3235294 0.1764706), wk = 0.0025063 k( 115) = ( 0.1691177 0.3308823 0.1691177), wk = 0.0025063 k( 116) = ( 0.1617647 0.3382353 0.1617647), wk = 0.0025063 k( 117) = ( 0.1544118 0.3455882 0.1544118), wk = 0.0025063 k( 118) = ( 0.1470588 0.3529412 0.1470588), wk = 0.0025063 k( 119) = ( 0.1397059 0.3602941 0.1397059), wk = 0.0025063 k( 120) = ( 0.1323529 0.3676471 0.1323529), wk = 0.0025063 k( 121) = ( 0.1250000 0.3750000 0.1250000), wk = 0.0025063 k( 122) = ( 0.1176471 0.3823529 0.1176471), wk = 0.0025063 k( 123) = ( 0.1102941 0.3897059 0.1102941), wk = 0.0025063 k( 124) = ( 0.1029412 0.3970588 0.1029412), wk = 0.0025063 k( 125) = ( 0.0955882 0.4044118 0.0955882), wk = 0.0025063 k( 126) = ( 0.0882353 0.4117647 0.0882353), wk = 0.0025063 k( 127) = ( 0.0808824 0.4191177 0.0808824), wk = 0.0025063 k( 128) = ( 0.0735294 0.4264706 0.0735294), wk = 0.0025063 k( 129) = ( 0.0661765 0.4338235 0.0661765), wk = 0.0025063 k( 130) = ( 0.0588235 0.4411765 0.0588235), wk = 0.0025063 k( 131) = ( 0.0514706 0.4485294 0.0514706), wk = 0.0025063 k( 132) = ( 0.0441177 0.4558824 0.0441177), wk = 0.0025063 k( 133) = ( 0.0367647 0.4632353 0.0367647), wk = 0.0025063 k( 134) = ( 0.0294118 0.4705882 0.0294118), wk = 0.0025063 k( 135) = ( 0.0220588 0.4779412 0.0220588), wk = 0.0025063 k( 136) = ( 0.0147059 0.4852941 0.0147059), wk = 0.0025063 k( 137) = ( 0.0073529 0.4926471 0.0073529), wk = 0.0025063 k( 138) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025063 k( 139) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0025063 k( 140) = ( 0.0193532 0.5163610 -0.0193533), wk = 0.0025063 k( 141) = ( 0.0387065 0.5327221 -0.0387065), wk = 0.0025063 k( 142) = ( 0.0580598 0.5490831 -0.0580598), wk = 0.0025063 k( 143) = ( 0.0774130 0.5654441 -0.0774130), wk = 0.0025063 k( 144) = ( 0.0967663 0.5818052 -0.0967663), wk = 0.0025063 k( 145) = ( 0.1161195 0.5981662 -0.1161195), wk = 0.0025063 k( 146) = ( 0.1354728 0.6145272 -0.1354728), wk = 0.0025063 k( 147) = ( 0.1548260 0.6308883 -0.1548260), wk = 0.0025063 k( 148) = ( 0.1741793 0.6472493 -0.1741793), wk = 0.0025063 k( 149) = ( 0.1935325 0.6636103 -0.1935325), wk = 0.0025063 k( 150) = ( 0.2128858 0.6799714 -0.2128858), wk = 0.0025063 k( 151) = ( 0.2322390 0.6963324 -0.2322390), wk = 0.0025063 k( 152) = ( 0.2515923 0.7126934 -0.2515923), wk = 0.0025063 k( 153) = ( 0.2709455 0.7290545 -0.2709455), wk = 0.0025063 k( 154) = ( 0.2709455 0.7290545 -0.2709455), wk = 0.0025063 k( 155) = ( 0.2763992 0.7236008 -0.2763992), wk = 0.0025063 k( 156) = ( 0.2818529 0.7181471 -0.2818529), wk = 0.0025063 k( 157) = ( 0.2873066 0.7126934 -0.2873066), wk = 0.0025063 k( 158) = ( 0.2927602 0.7072397 -0.2927602), wk = 0.0025063 k( 159) = ( 0.2982139 0.7017861 -0.2982139), wk = 0.0025063 k( 160) = ( 0.3036676 0.6963324 -0.3036676), wk = 0.0025063 k( 161) = ( 0.3091213 0.6908787 -0.3091213), wk = 0.0025063 k( 162) = ( 0.3145750 0.6854250 -0.3145750), wk = 0.0025063 k( 163) = ( 0.3200286 0.6799714 -0.3200286), wk = 0.0025063 k( 164) = ( 0.3254823 0.6745177 -0.3254823), wk = 0.0025063 k( 165) = ( 0.3309360 0.6690640 -0.3309360), wk = 0.0025063 k( 166) = ( 0.3363897 0.6636103 -0.3363897), wk = 0.0025063 k( 167) = ( 0.3418433 0.6581567 -0.3418433), wk = 0.0025063 k( 168) = ( 0.3472970 0.6527030 -0.3472970), wk = 0.0025063 k( 169) = ( 0.3527507 0.6472493 -0.3527507), wk = 0.0025063 k( 170) = ( 0.3582044 0.6417956 -0.3582044), wk = 0.0025063 k( 171) = ( 0.3636581 0.6363419 -0.3636581), wk = 0.0025063 k( 172) = ( 0.3691117 0.6308883 -0.3691117), wk = 0.0025063 k( 173) = ( 0.3745654 0.6254346 -0.3745654), wk = 0.0025063 k( 174) = ( 0.3800191 0.6199809 -0.3800191), wk = 0.0025063 k( 175) = ( 0.3854728 0.6145272 -0.3854728), wk = 0.0025063 k( 176) = ( 0.3909264 0.6090735 -0.3909264), wk = 0.0025063 k( 177) = ( 0.3963801 0.6036199 -0.3963801), wk = 0.0025063 k( 178) = ( 0.4018338 0.5981662 -0.4018338), wk = 0.0025063 k( 179) = ( 0.4072875 0.5927125 -0.4072875), wk = 0.0025063 k( 180) = ( 0.4127412 0.5872588 -0.4127412), wk = 0.0025063 k( 181) = ( 0.4181948 0.5818052 -0.4181948), wk = 0.0025063 k( 182) = ( 0.4236485 0.5763515 -0.4236485), wk = 0.0025063 k( 183) = ( 0.4291022 0.5708978 -0.4291022), wk = 0.0025063 k( 184) = ( 0.4345559 0.5654441 -0.4345559), wk = 0.0025063 k( 185) = ( 0.4400096 0.5599905 -0.4400096), wk = 0.0025063 k( 186) = ( 0.4454632 0.5545368 -0.4454632), wk = 0.0025063 k( 187) = ( 0.4509169 0.5490831 -0.4509169), wk = 0.0025063 k( 188) = ( 0.4563706 0.5436294 -0.4563706), wk = 0.0025063 k( 189) = ( 0.4618243 0.5381757 -0.4618243), wk = 0.0025063 k( 190) = ( 0.4672779 0.5327221 -0.4672779), wk = 0.0025063 k( 191) = ( 0.4727316 0.5272684 -0.4727316), wk = 0.0025063 k( 192) = ( 0.4781853 0.5218147 -0.4781853), wk = 0.0025063 k( 193) = ( 0.4836390 0.5163610 -0.4836390), wk = 0.0025063 k( 194) = ( 0.4890926 0.5109074 -0.4890926), wk = 0.0025063 k( 195) = ( 0.4945463 0.5054537 -0.4945463), wk = 0.0025063 k( 196) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025063 k( 197) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025063 k( 198) = ( 0.4814815 0.4814815 -0.4814815), wk = 0.0025063 k( 199) = ( 0.4629630 0.4629630 -0.4629630), wk = 0.0025063 k( 200) = ( 0.4444444 0.4444444 -0.4444444), wk = 0.0025063 k( 201) = ( 0.4259259 0.4259259 -0.4259259), wk = 0.0025063 k( 202) = ( 0.4074074 0.4074074 -0.4074074), wk = 0.0025063 k( 203) = ( 0.3888889 0.3888889 -0.3888889), wk = 0.0025063 k( 204) = ( 0.3703704 0.3703704 -0.3703704), wk = 0.0025063 k( 205) = ( 0.3518519 0.3518519 -0.3518519), wk = 0.0025063 k( 206) = ( 0.3333333 0.3333333 -0.3333333), wk = 0.0025063 k( 207) = ( 0.3148148 0.3148148 -0.3148148), wk = 0.0025063 k( 208) = ( 0.2962963 0.2962963 -0.2962963), wk = 0.0025063 k( 209) = ( 0.2777778 0.2777778 -0.2777778), wk = 0.0025063 k( 210) = ( 0.2592593 0.2592593 -0.2592593), wk = 0.0025063 k( 211) = ( 0.2407407 0.2407407 -0.2407407), wk = 0.0025063 k( 212) = ( 0.2222222 0.2222222 -0.2222222), wk = 0.0025063 k( 213) = ( 0.2037037 0.2037037 -0.2037037), wk = 0.0025063 k( 214) = ( 0.1851852 0.1851852 -0.1851852), wk = 0.0025063 k( 215) = ( 0.1666667 0.1666667 -0.1666667), wk = 0.0025063 k( 216) = ( 0.1481482 0.1481481 -0.1481481), wk = 0.0025063 k( 217) = ( 0.1296296 0.1296296 -0.1296296), wk = 0.0025063 k( 218) = ( 0.1111111 0.1111111 -0.1111111), wk = 0.0025063 k( 219) = ( 0.0925926 0.0925926 -0.0925926), wk = 0.0025063 k( 220) = ( 0.0740741 0.0740741 -0.0740741), wk = 0.0025063 k( 221) = ( 0.0555556 0.0555556 -0.0555556), wk = 0.0025063 k( 222) = ( 0.0370370 0.0370370 -0.0370370), wk = 0.0025063 k( 223) = ( 0.0185185 0.0185185 -0.0185185), wk = 0.0025063 k( 224) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 225) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0025063 k( 226) = ( 0.0074307 -0.0074307 0.0074307), wk = 0.0025063 k( 227) = ( 0.0148614 -0.0148614 0.0148614), wk = 0.0025063 k( 228) = ( 0.0222921 -0.0222921 0.0222921), wk = 0.0025063 k( 229) = ( 0.0297228 -0.0297228 0.0297228), wk = 0.0025063 k( 230) = ( 0.0371536 -0.0371536 0.0371536), wk = 0.0025063 k( 231) = ( 0.0445843 -0.0445843 0.0445843), wk = 0.0025063 k( 232) = ( 0.0520150 -0.0520150 0.0520150), wk = 0.0025063 k( 233) = ( 0.0594457 -0.0594457 0.0594457), wk = 0.0025063 k( 234) = ( 0.0668764 -0.0668764 0.0668764), wk = 0.0025063 k( 235) = ( 0.0743071 -0.0743071 0.0743071), wk = 0.0025063 k( 236) = ( 0.0817378 -0.0817378 0.0817378), wk = 0.0025063 k( 237) = ( 0.0891685 -0.0891685 0.0891685), wk = 0.0025063 k( 238) = ( 0.0965992 -0.0965992 0.0965992), wk = 0.0025063 k( 239) = ( 0.1040299 -0.1040300 0.1040299), wk = 0.0025063 k( 240) = ( 0.1114607 -0.1114607 0.1114607), wk = 0.0025063 k( 241) = ( 0.1188914 -0.1188914 0.1188914), wk = 0.0025063 k( 242) = ( 0.1263221 -0.1263221 0.1263221), wk = 0.0025063 k( 243) = ( 0.1337528 -0.1337528 0.1337528), wk = 0.0025063 k( 244) = ( 0.1411835 -0.1411835 0.1411835), wk = 0.0025063 k( 245) = ( 0.1486142 -0.1486142 0.1486142), wk = 0.0025063 k( 246) = ( 0.1560449 -0.1560449 0.1560449), wk = 0.0025063 k( 247) = ( 0.1634756 -0.1634756 0.1634756), wk = 0.0025063 k( 248) = ( 0.1709064 -0.1709063 0.1709063), wk = 0.0025063 k( 249) = ( 0.1783371 -0.1783371 0.1783371), wk = 0.0025063 k( 250) = ( 0.1857678 -0.1857678 0.1857678), wk = 0.0025063 k( 251) = ( 0.1931985 -0.1931985 0.1931985), wk = 0.0025063 k( 252) = ( 0.2006292 -0.2006292 0.2006292), wk = 0.0025063 k( 253) = ( 0.2080599 -0.2080599 0.2080599), wk = 0.0025063 k( 254) = ( 0.2154906 -0.2154906 0.2154906), wk = 0.0025063 k( 255) = ( 0.2229213 -0.2229213 0.2229213), wk = 0.0025063 k( 256) = ( 0.2303520 -0.2303520 0.2303520), wk = 0.0025063 k( 257) = ( 0.2377827 -0.2377828 0.2377827), wk = 0.0025063 k( 258) = ( 0.2452135 -0.2452135 0.2452135), wk = 0.0025063 k( 259) = ( 0.2526442 -0.2526442 0.2526442), wk = 0.0025063 k( 260) = ( 0.2600749 -0.2600749 0.2600749), wk = 0.0025063 k( 261) = ( 0.2675056 -0.2675056 0.2675056), wk = 0.0025063 k( 262) = ( 0.2749363 -0.2749363 0.2749363), wk = 0.0025063 k( 263) = ( 0.2823670 -0.2823670 0.2823670), wk = 0.0025063 k( 264) = ( 0.2897977 -0.2897977 0.2897977), wk = 0.0025063 k( 265) = ( 0.2897977 -0.2897977 0.2897977), wk = 0.0025063 k( 266) = ( 0.3038112 -0.2704779 0.2704779), wk = 0.0025063 k( 267) = ( 0.3178247 -0.2511580 0.2511580), wk = 0.0025063 k( 268) = ( 0.3318382 -0.2318382 0.2318382), wk = 0.0025063 k( 269) = ( 0.3458517 -0.2125183 0.2125183), wk = 0.0025063 k( 270) = ( 0.3598652 -0.1931985 0.1931985), wk = 0.0025063 k( 271) = ( 0.3738786 -0.1738786 0.1738786), wk = 0.0025063 k( 272) = ( 0.3878921 -0.1545588 0.1545588), wk = 0.0025063 k( 273) = ( 0.4019056 -0.1352389 0.1352389), wk = 0.0025063 k( 274) = ( 0.4159191 -0.1159191 0.1159191), wk = 0.0025063 k( 275) = ( 0.4299326 -0.0965992 0.0965992), wk = 0.0025063 k( 276) = ( 0.4439461 -0.0772794 0.0772794), wk = 0.0025063 k( 277) = ( 0.4579595 -0.0579595 0.0579595), wk = 0.0025063 k( 278) = ( 0.4719730 -0.0386397 0.0386397), wk = 0.0025063 k( 279) = ( 0.4859865 -0.0193199 0.0193199), wk = 0.0025063 k( 280) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0025063 k( 281) = ( 0.5000000 -0.0000000 0.0000000), wk = 0.0025063 k( 282) = ( 0.4945652 0.0054348 0.0054348), wk = 0.0025063 k( 283) = ( 0.4891304 0.0108696 0.0108696), wk = 0.0025063 k( 284) = ( 0.4836956 0.0163043 0.0163043), wk = 0.0025063 k( 285) = ( 0.4782609 0.0217391 0.0217391), wk = 0.0025063 k( 286) = ( 0.4728261 0.0271739 0.0271739), wk = 0.0025063 k( 287) = ( 0.4673913 0.0326087 0.0326087), wk = 0.0025063 k( 288) = ( 0.4619565 0.0380435 0.0380435), wk = 0.0025063 k( 289) = ( 0.4565217 0.0434783 0.0434783), wk = 0.0025063 k( 290) = ( 0.4510870 0.0489130 0.0489130), wk = 0.0025063 k( 291) = ( 0.4456522 0.0543478 0.0543478), wk = 0.0025063 k( 292) = ( 0.4402174 0.0597826 0.0597826), wk = 0.0025063 k( 293) = ( 0.4347826 0.0652174 0.0652174), wk = 0.0025063 k( 294) = ( 0.4293478 0.0706522 0.0706522), wk = 0.0025063 k( 295) = ( 0.4239130 0.0760870 0.0760870), wk = 0.0025063 k( 296) = ( 0.4184783 0.0815217 0.0815217), wk = 0.0025063 k( 297) = ( 0.4130435 0.0869565 0.0869565), wk = 0.0025063 k( 298) = ( 0.4076087 0.0923913 0.0923913), wk = 0.0025063 k( 299) = ( 0.4021739 0.0978261 0.0978261), wk = 0.0025063 k( 300) = ( 0.3967391 0.1032609 0.1032609), wk = 0.0025063 k( 301) = ( 0.3913044 0.1086956 0.1086956), wk = 0.0025063 k( 302) = ( 0.3858696 0.1141304 0.1141304), wk = 0.0025063 k( 303) = ( 0.3804348 0.1195652 0.1195652), wk = 0.0025063 k( 304) = ( 0.3750000 0.1250000 0.1250000), wk = 0.0025063 k( 305) = ( 0.3695652 0.1304348 0.1304348), wk = 0.0025063 k( 306) = ( 0.3641304 0.1358696 0.1358696), wk = 0.0025063 k( 307) = ( 0.3586956 0.1413043 0.1413044), wk = 0.0025063 k( 308) = ( 0.3532609 0.1467391 0.1467391), wk = 0.0025063 k( 309) = ( 0.3478261 0.1521739 0.1521739), wk = 0.0025063 k( 310) = ( 0.3423913 0.1576087 0.1576087), wk = 0.0025063 k( 311) = ( 0.3369565 0.1630435 0.1630435), wk = 0.0025063 k( 312) = ( 0.3315217 0.1684783 0.1684783), wk = 0.0025063 k( 313) = ( 0.3260870 0.1739130 0.1739130), wk = 0.0025063 k( 314) = ( 0.3206522 0.1793478 0.1793478), wk = 0.0025063 k( 315) = ( 0.3152174 0.1847826 0.1847826), wk = 0.0025063 k( 316) = ( 0.3097826 0.1902174 0.1902174), wk = 0.0025063 k( 317) = ( 0.3043478 0.1956522 0.1956522), wk = 0.0025063 k( 318) = ( 0.2989130 0.2010870 0.2010870), wk = 0.0025063 k( 319) = ( 0.2934783 0.2065217 0.2065217), wk = 0.0025063 k( 320) = ( 0.2880435 0.2119565 0.2119565), wk = 0.0025063 k( 321) = ( 0.2826087 0.2173913 0.2173913), wk = 0.0025063 k( 322) = ( 0.2771739 0.2228261 0.2228261), wk = 0.0025063 k( 323) = ( 0.2717391 0.2282609 0.2282609), wk = 0.0025063 k( 324) = ( 0.2663044 0.2336957 0.2336957), wk = 0.0025063 k( 325) = ( 0.2608696 0.2391304 0.2391304), wk = 0.0025063 k( 326) = ( 0.2554348 0.2445652 0.2445652), wk = 0.0025063 k( 327) = ( 0.2500000 0.2500000 0.2500000), wk = 0.0025063 k( 328) = ( 0.0607433 -0.0607433 0.5188522), wk = 0.0025063 k( 329) = ( 0.0661969 -0.0661969 0.5133985), wk = 0.0025063 k( 330) = ( 0.0716506 -0.0716506 0.5079448), wk = 0.0025063 k( 331) = ( 0.0771043 -0.0771043 0.5024911), wk = 0.0025063 k( 332) = ( 0.0825580 -0.0825580 0.4970375), wk = 0.0025063 k( 333) = ( 0.0880116 -0.0880116 0.4915838), wk = 0.0025063 k( 334) = ( 0.0934653 -0.0934653 0.4861301), wk = 0.0025063 k( 335) = ( 0.0989190 -0.0989190 0.4806764), wk = 0.0025063 k( 336) = ( 0.1043727 -0.1043727 0.4752228), wk = 0.0025063 k( 337) = ( 0.1098264 -0.1098264 0.4697691), wk = 0.0025063 k( 338) = ( 0.1152800 -0.1152800 0.4643154), wk = 0.0025063 k( 339) = ( 0.1207337 -0.1207337 0.4588617), wk = 0.0025063 k( 340) = ( 0.1261874 -0.1261874 0.4534080), wk = 0.0025063 k( 341) = ( 0.1316411 -0.1316411 0.4479544), wk = 0.0025063 k( 342) = ( 0.1370947 -0.1370948 0.4425007), wk = 0.0025063 k( 343) = ( 0.1425484 -0.1425484 0.4370470), wk = 0.0025063 k( 344) = ( 0.1480021 -0.1480021 0.4315933), wk = 0.0025063 k( 345) = ( 0.1534558 -0.1534558 0.4261397), wk = 0.0025063 k( 346) = ( 0.1589095 -0.1589095 0.4206860), wk = 0.0025063 k( 347) = ( 0.1643631 -0.1643631 0.4152323), wk = 0.0025063 k( 348) = ( 0.1698168 -0.1698168 0.4097786), wk = 0.0025063 k( 349) = ( 0.1752705 -0.1752705 0.4043250), wk = 0.0025063 k( 350) = ( 0.1807242 -0.1807242 0.3988713), wk = 0.0025063 k( 351) = ( 0.1861779 -0.1861779 0.3934176), wk = 0.0025063 k( 352) = ( 0.1916315 -0.1916315 0.3879639), wk = 0.0025063 k( 353) = ( 0.1970852 -0.1970852 0.3825102), wk = 0.0025063 k( 354) = ( 0.2025389 -0.2025389 0.3770566), wk = 0.0025063 k( 355) = ( 0.2079926 -0.2079926 0.3716029), wk = 0.0025063 k( 356) = ( 0.2134462 -0.2134462 0.3661492), wk = 0.0025063 k( 357) = ( 0.2188999 -0.2188999 0.3606955), wk = 0.0025063 k( 358) = ( 0.2243536 -0.2243536 0.3552419), wk = 0.0025063 k( 359) = ( 0.2298073 -0.2298073 0.3497882), wk = 0.0025063 k( 360) = ( 0.2352609 -0.2352609 0.3443345), wk = 0.0025063 k( 361) = ( 0.2407146 -0.2407146 0.3388808), wk = 0.0025063 k( 362) = ( 0.2461683 -0.2461683 0.3334272), wk = 0.0025063 k( 363) = ( 0.2516220 -0.2516220 0.3279735), wk = 0.0025063 k( 364) = ( 0.2570757 -0.2570757 0.3225198), wk = 0.0025063 k( 365) = ( 0.2625293 -0.2625293 0.3170661), wk = 0.0025063 k( 366) = ( 0.2679830 -0.2679830 0.3116124), wk = 0.0025063 k( 367) = ( 0.2734367 -0.2734367 0.3061588), wk = 0.0025063 k( 368) = ( 0.2788904 -0.2788904 0.3007051), wk = 0.0025063 k( 369) = ( 0.2843441 -0.2843441 0.2952514), wk = 0.0025063 k( 370) = ( 0.2897977 -0.2897977 0.2897977), wk = 0.0025063 k( 371) = ( 0.7102023 0.2897977 -0.2897977), wk = 0.0025063 k( 372) = ( 0.7026950 0.2973050 -0.2973050), wk = 0.0025063 k( 373) = ( 0.6951878 0.3048122 -0.3048122), wk = 0.0025063 k( 374) = ( 0.6876806 0.3123194 -0.3123194), wk = 0.0025063 k( 375) = ( 0.6801734 0.3198266 -0.3198266), wk = 0.0025063 k( 376) = ( 0.6726661 0.3273338 -0.3273338), wk = 0.0025063 k( 377) = ( 0.6651589 0.3348411 -0.3348411), wk = 0.0025063 k( 378) = ( 0.6576517 0.3423483 -0.3423483), wk = 0.0025063 k( 379) = ( 0.6501445 0.3498555 -0.3498555), wk = 0.0025063 k( 380) = ( 0.6426373 0.3573627 -0.3573627), wk = 0.0025063 k( 381) = ( 0.6351300 0.3648700 -0.3648700), wk = 0.0025063 k( 382) = ( 0.6276228 0.3723772 -0.3723772), wk = 0.0025063 k( 383) = ( 0.6201156 0.3798844 -0.3798844), wk = 0.0025063 k( 384) = ( 0.6126084 0.3873916 -0.3873916), wk = 0.0025063 k( 385) = ( 0.6051011 0.3948989 -0.3948989), wk = 0.0025063 k( 386) = ( 0.5975939 0.4024061 -0.4024061), wk = 0.0025063 k( 387) = ( 0.5900867 0.4099133 -0.4099133), wk = 0.0025063 k( 388) = ( 0.5825795 0.4174205 -0.4174205), wk = 0.0025063 k( 389) = ( 0.5750722 0.4249278 -0.4249278), wk = 0.0025063 k( 390) = ( 0.5675650 0.4324350 -0.4324350), wk = 0.0025063 k( 391) = ( 0.5600578 0.4399422 -0.4399422), wk = 0.0025063 k( 392) = ( 0.5525506 0.4474494 -0.4474494), wk = 0.0025063 k( 393) = ( 0.5450433 0.4549567 -0.4549567), wk = 0.0025063 k( 394) = ( 0.5375361 0.4624639 -0.4624639), wk = 0.0025063 k( 395) = ( 0.5300289 0.4699711 -0.4699711), wk = 0.0025063 k( 396) = ( 0.5225217 0.4774783 -0.4774783), wk = 0.0025063 k( 397) = ( 0.5150145 0.4849855 -0.4849855), wk = 0.0025063 k( 398) = ( 0.5075072 0.4924928 -0.4924928), wk = 0.0025063 k( 399) = ( 0.5000000 0.5000000 -0.5000000), wk = 0.0025063 Dense grid: 47265 G-vectors FFT dimensions: ( 72, 72, 72) Smooth grid: 25613 G-vectors FFT dimensions: ( 54, 54, 54) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.16 Mb ( 184, 58) NL pseudopotentials 0.29 Mb ( 92, 204) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.01 Mb ( 1313) G-vector shells 0.01 Mb ( 1182) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.65 Mb ( 184, 232) Each subspace H/S matrix 0.05 Mb ( 58, 58) Each matrix 0.36 Mb ( 204, 2, 58) The potential is recalculated from file : ./TaPS.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.1 secs Computing kpt #: 2 total cpu time spent up to now is 5.9 secs Computing kpt #: 3 total cpu time spent up to now is 6.7 secs Computing kpt #: 4 total cpu time spent up to now is 7.5 secs Computing kpt #: 5 total cpu time spent up to now is 8.2 secs Computing kpt #: 6 total cpu time spent up to now is 8.9 secs Computing kpt #: 7 total cpu time spent up to now is 9.7 secs Computing kpt #: 8 total cpu time spent up to now is 10.4 secs Computing kpt #: 9 total cpu time spent up to now is 11.2 secs Computing kpt #: 10 total cpu time spent up to now is 11.9 secs Computing kpt #: 11 total cpu time spent up to now is 12.7 secs Computing kpt #: 12 total cpu time spent up to now is 13.5 secs Computing kpt #: 13 total cpu time spent up to now is 14.2 secs Computing kpt #: 14 total cpu time spent up to now is 15.0 secs Computing kpt #: 15 total cpu time spent up to now is 15.7 secs Computing kpt #: 16 total cpu time spent up to now is 16.5 secs Computing kpt #: 17 total cpu time spent up to now is 17.2 secs Computing kpt #: 18 total cpu time spent up to now is 18.0 secs Computing kpt #: 19 total cpu time spent up to now is 18.7 secs Computing kpt #: 20 total cpu time spent up to now is 19.4 secs Computing kpt #: 21 total cpu time spent up to now is 20.2 secs Computing kpt #: 22 total cpu time spent up to now is 20.9 secs Computing kpt #: 23 total cpu time spent up to now is 21.7 secs Computing kpt #: 24 total cpu time spent up to now is 22.4 secs Computing kpt #: 25 total cpu time spent up to now is 23.1 secs Computing kpt #: 26 total cpu time spent up to now is 23.8 secs Computing kpt #: 27 total cpu time spent up to now is 24.5 secs Computing kpt #: 28 total cpu time spent up to now is 25.2 secs Computing kpt #: 29 total cpu time spent up to now is 26.0 secs Computing kpt #: 30 total cpu time spent up to now is 26.7 secs Computing kpt #: 31 total cpu time spent up to now is 27.3 secs Computing kpt #: 32 total cpu time spent up to now is 28.0 secs Computing kpt #: 33 total cpu time spent up to now is 28.7 secs Computing kpt #: 34 total cpu time spent up to now is 29.4 secs Computing kpt #: 35 total cpu time spent up to now is 30.0 secs Computing kpt #: 36 total cpu time spent up to now is 30.7 secs Computing kpt #: 37 total cpu time spent up to now is 31.4 secs Computing kpt #: 38 total cpu time spent up to now is 32.0 secs Computing kpt #: 39 total cpu time spent up to now is 32.7 secs Computing kpt #: 40 total cpu time spent up to now is 33.4 secs Computing kpt #: 41 total cpu time spent up to now is 34.1 secs Computing kpt #: 42 total cpu time spent up to now is 34.7 secs Computing kpt #: 43 total cpu time spent up to now is 35.4 secs Computing kpt #: 44 total cpu time spent up to now is 36.1 secs Computing kpt #: 45 total cpu time spent up to now is 36.7 secs Computing kpt #: 46 total cpu time spent up to now is 37.4 secs Computing kpt #: 47 total cpu time spent up to now is 38.0 secs Computing kpt #: 48 total cpu time spent up to now is 38.7 secs Computing kpt #: 49 total cpu time spent up to now is 39.4 secs Computing kpt #: 50 total cpu time spent up to now is 40.1 secs Computing kpt #: 51 total cpu time spent up to now is 40.8 secs Computing kpt #: 52 total cpu time spent up to now is 41.4 secs Computing kpt #: 53 total cpu time spent up to now is 42.1 secs Computing kpt #: 54 total cpu time spent up to now is 42.8 secs Computing kpt #: 55 total cpu time spent up to now is 43.5 secs Computing kpt #: 56 total cpu time spent up to now is 44.2 secs Computing kpt #: 57 total cpu time spent up to now is 44.9 secs Computing kpt #: 58 total cpu time spent up to now is 45.6 secs Computing kpt #: 59 total cpu time spent up to now is 46.2 secs Computing kpt #: 60 total cpu time spent up to now is 46.9 secs Computing kpt #: 61 total cpu time spent up to now is 47.6 secs Computing kpt #: 62 total cpu time spent up to now is 48.3 secs Computing kpt #: 63 total cpu time spent up to now is 48.9 secs Computing kpt #: 64 total cpu time spent up to now is 49.6 secs Computing kpt #: 65 total cpu time spent up to now is 50.3 secs Computing kpt #: 66 total cpu time spent up to now is 51.0 secs Computing kpt #: 67 total cpu time spent up to now is 51.7 secs Computing kpt #: 68 total cpu time spent up to now is 52.3 secs Computing kpt #: 69 total cpu time spent up to now is 53.0 secs Computing kpt #: 70 total cpu time spent up to now is 53.7 secs Computing kpt #: 71 total cpu time spent up to now is 54.4 secs Computing kpt #: 72 total cpu time spent up to now is 55.0 secs Computing kpt #: 73 total cpu time spent up to now is 55.7 secs Computing kpt #: 74 total cpu time spent up to now is 56.4 secs Computing kpt #: 75 total cpu time spent up to now is 57.1 secs Computing kpt #: 76 total cpu time spent up to now is 57.8 secs Computing kpt #: 77 total cpu time spent up to now is 58.5 secs Computing kpt #: 78 total cpu time spent up to now is 59.2 secs Computing kpt #: 79 total cpu time spent up to now is 59.9 secs Computing kpt #: 80 total cpu time spent up to now is 60.6 secs Computing kpt #: 81 total cpu time spent up to now is 61.2 secs Computing kpt #: 82 total cpu time spent up to now is 62.0 secs Computing kpt #: 83 total cpu time spent up to now is 62.7 secs Computing kpt #: 84 total cpu time spent up to now is 63.4 secs Computing kpt #: 85 total cpu time spent up to now is 64.2 secs Computing kpt #: 86 total cpu time spent up to now is 64.9 secs Computing kpt #: 87 total cpu time spent up to now is 65.7 secs Computing kpt #: 88 total cpu time spent up to now is 66.4 secs Computing kpt #: 89 total cpu time spent up to now is 67.2 secs Computing kpt #: 90 total cpu time spent up to now is 67.9 secs Computing kpt #: 91 total cpu time spent up to now is 68.6 secs Computing kpt #: 92 total cpu time spent up to now is 69.4 secs Computing kpt #: 93 total cpu time spent up to now is 70.1 secs Computing kpt #: 94 total cpu time spent up to now is 70.8 secs Computing kpt #: 95 total cpu time spent up to now is 71.6 secs Computing kpt #: 96 total cpu time spent up to now is 72.3 secs Computing kpt #: 97 total cpu time spent up to now is 73.1 secs Computing kpt #: 98 total cpu time spent up to now is 73.8 secs Computing kpt #: 99 total cpu time spent up to now is 74.5 secs Computing kpt #: 100 total cpu time spent up to now is 75.2 secs Computing kpt #: 101 total cpu time spent up to now is 76.0 secs Computing kpt #: 102 total cpu time spent up to now is 76.7 secs Computing kpt #: 103 total cpu time spent up to now is 77.5 secs Computing kpt #: 104 total cpu time spent up to now is 78.2 secs Computing kpt #: 105 total cpu time spent up to now is 79.0 secs Computing kpt #: 106 total cpu time spent up to now is 79.7 secs Computing kpt #: 107 total cpu time spent up to now is 80.4 secs Computing kpt #: 108 total cpu time spent up to now is 81.2 secs Computing kpt #: 109 total cpu time spent up to now is 82.0 secs Computing kpt #: 110 total cpu time spent up to now is 82.7 secs Computing kpt #: 111 total cpu time spent up to now is 83.5 secs Computing kpt #: 112 total cpu time spent up to now is 84.2 secs Computing kpt #: 113 total cpu time spent up to now is 85.0 secs Computing kpt #: 114 total cpu time spent up to now is 85.7 secs Computing kpt #: 115 total cpu time spent up to now is 86.5 secs Computing kpt #: 116 total cpu time spent up to now is 87.2 secs Computing kpt #: 117 total cpu time spent up to now is 87.9 secs Computing kpt #: 118 total cpu time spent up to now is 88.7 secs Computing kpt #: 119 total cpu time spent up to now is 89.4 secs Computing kpt #: 120 total cpu time spent up to now is 90.1 secs Computing kpt #: 121 total cpu time spent up to now is 90.8 secs Computing kpt #: 122 total cpu time spent up to now is 91.6 secs Computing kpt #: 123 total cpu time spent up to now is 92.3 secs Computing kpt #: 124 total cpu time spent up to now is 93.0 secs Computing kpt #: 125 total cpu time spent up to now is 93.7 secs Computing kpt #: 126 total cpu time spent up to now is 94.4 secs Computing kpt #: 127 total cpu time spent up to now is 95.1 secs Computing kpt #: 128 total cpu time spent up to now is 95.8 secs Computing kpt #: 129 total cpu time spent up to now is 96.6 secs Computing kpt #: 130 total cpu time spent up to now is 97.2 secs Computing kpt #: 131 total cpu time spent up to now is 97.9 secs Computing kpt #: 132 total cpu time spent up to now is 98.6 secs Computing kpt #: 133 total cpu time spent up to now is 99.3 secs Computing kpt #: 134 total cpu time spent up to now is 100.0 secs Computing kpt #: 135 total cpu time spent up to now is 100.7 secs Computing kpt #: 136 total cpu time spent up to now is 101.3 secs Computing kpt #: 137 total cpu time spent up to now is 102.0 secs Computing kpt #: 138 total cpu time spent up to now is 102.7 secs Computing kpt #: 139 total cpu time spent up to now is 103.4 secs Computing kpt #: 140 total cpu time spent up to now is 104.0 secs Computing kpt #: 141 total cpu time spent up to now is 104.7 secs Computing kpt #: 142 total cpu time spent up to now is 105.4 secs Computing kpt #: 143 total cpu time spent up to now is 106.1 secs Computing kpt #: 144 total cpu time spent up to now is 106.8 secs Computing kpt #: 145 total cpu time spent up to now is 107.5 secs Computing kpt #: 146 total cpu time spent up to now is 108.2 secs Computing kpt #: 147 total cpu time spent up to now is 108.9 secs Computing kpt #: 148 total cpu time spent up to now is 109.5 secs Computing kpt #: 149 total cpu time spent up to now is 110.2 secs Computing kpt #: 150 total cpu time spent up to now is 110.9 secs Computing kpt #: 151 total cpu time spent up to now is 111.6 secs Computing kpt #: 152 total cpu time spent up to now is 112.3 secs Computing kpt #: 153 total cpu time spent up to now is 113.0 secs Computing kpt #: 154 total cpu time spent up to now is 113.7 secs Computing kpt #: 155 total cpu time spent up to now is 114.4 secs Computing kpt #: 156 total cpu time spent up to now is 115.1 secs Computing kpt #: 157 total cpu time spent up to now is 115.7 secs Computing kpt #: 158 total cpu time spent up to now is 116.4 secs Computing kpt #: 159 total cpu time spent up to now is 117.1 secs Computing kpt #: 160 total cpu time spent up to now is 117.8 secs Computing kpt #: 161 total cpu time spent up to now is 118.4 secs Computing kpt #: 162 total cpu time spent up to now is 119.1 secs Computing kpt #: 163 total cpu time spent up to now is 119.8 secs Computing kpt #: 164 total cpu time spent up to now is 120.4 secs Computing kpt #: 165 total cpu time spent up to now is 121.1 secs Computing kpt #: 166 total cpu time spent up to now is 121.8 secs Computing kpt #: 167 total cpu time spent up to now is 122.4 secs Computing kpt #: 168 total cpu time spent up to now is 123.1 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Computing kpt #: 184 total cpu time spent up to now is 134.2 secs Computing kpt #: 185 total cpu time spent up to now is 134.9 secs Computing kpt #: 186 total cpu time spent up to now is 135.5 secs Computing kpt #: 187 total cpu time spent up to now is 136.2 secs Computing kpt #: 188 total cpu time spent up to now is 136.9 secs Computing kpt #: 189 total cpu time spent up to now is 137.6 secs Computing kpt #: 190 total cpu time spent up to now is 138.6 secs Computing kpt #: 191 total cpu time spent up to now is 139.4 secs Computing kpt #: 192 total cpu time spent up to now is 140.1 secs Computing kpt #: 193 total cpu time spent up to now is 140.8 secs Computing kpt #: 194 total cpu time spent up to now is 141.5 secs Computing kpt #: 195 total cpu time spent up to now is 142.2 secs Computing kpt #: 196 total cpu time spent up to now is 142.9 secs Computing kpt #: 197 total cpu time spent up to now is 143.6 secs Computing kpt #: 198 total cpu time spent up to now is 144.3 secs Computing kpt #: 199 total cpu time spent up to now is 145.0 secs Computing kpt #: 200 total cpu time spent up to now is 145.7 secs Computing kpt #: 201 total cpu time spent up to now is 146.4 secs Computing kpt #: 202 total cpu time spent up to now is 147.1 secs Computing kpt #: 203 total cpu time spent up to now is 147.8 secs Computing kpt #: 204 total cpu time spent up to now is 148.5 secs Computing kpt #: 205 total cpu time spent up to now is 149.2 secs Computing kpt #: 206 total cpu time spent up to now is 149.8 secs Computing kpt #: 207 total cpu time spent up to now is 150.5 secs Computing kpt #: 208 total cpu time spent up to now is 151.2 secs Computing kpt #: 209 total cpu time spent up to now is 151.9 secs Computing kpt #: 210 total cpu time spent up to now is 152.6 secs Computing kpt #: 211 total cpu time spent up to now is 153.3 secs Computing kpt #: 212 total cpu time spent up to now is 154.0 secs Computing kpt #: 213 total cpu time spent up to now is 154.7 secs Computing kpt #: 214 total cpu time spent up to now is 155.5 secs Computing kpt #: 215 total cpu time spent up to now is 156.2 secs Computing kpt #: 216 total cpu time spent up to now is 156.9 secs Computing kpt #: 217 total cpu time spent up to now is 157.7 secs Computing kpt #: 218 total cpu time spent up to now is 158.5 secs Computing kpt #: 219 total cpu time spent up to now is 159.2 secs Computing kpt #: 220 total cpu time spent up to now is 160.0 secs Computing kpt #: 221 total cpu time spent up to now is 160.8 secs Computing kpt #: 222 total cpu time spent up to now is 161.5 secs Computing kpt #: 223 total cpu time spent up to now is 162.4 secs Computing kpt #: 224 total cpu time spent up to now is 163.2 secs Computing kpt #: 225 total cpu time spent up to now is 164.1 secs Computing kpt #: 226 total cpu time spent up to now is 165.0 secs Computing kpt #: 227 total cpu time spent up to now is 165.7 secs Computing kpt #: 228 total cpu time spent up to now is 166.6 secs Computing kpt #: 229 total cpu time spent up to now is 167.3 secs Computing kpt #: 230 total cpu time spent up to now is 168.1 secs Computing kpt #: 231 total cpu time spent up to now is 169.0 secs Computing kpt #: 232 total cpu time spent up to now is 169.8 secs Computing kpt #: 233 total cpu time spent up to now is 170.7 secs Computing kpt #: 234 total cpu time spent up to now is 171.5 secs Computing kpt #: 235 total cpu time spent up to now is 172.4 secs Computing kpt #: 236 total cpu time spent up to now is 173.2 secs Computing kpt #: 237 total cpu time spent up to now is 174.0 secs Computing kpt #: 238 total cpu time spent up to now is 174.9 secs Computing kpt #: 239 total cpu time spent up to now is 175.7 secs Computing kpt #: 240 total cpu time spent up to now is 176.5 secs Computing kpt #: 241 total cpu time spent up to now is 177.4 secs Computing kpt #: 242 total cpu time spent up to now is 178.2 secs Computing kpt #: 243 total cpu time spent up to now is 179.0 secs Computing kpt #: 244 total cpu time spent up to now is 179.9 secs Computing kpt #: 245 total cpu time spent up to now is 180.7 secs Computing kpt #: 246 total cpu time spent up to now is 181.5 secs Computing kpt #: 247 total cpu time spent up to now is 182.2 secs Computing kpt #: 248 total cpu time spent up to now is 182.9 secs Computing kpt #: 249 total cpu time spent up to now is 183.7 secs Computing kpt #: 250 total cpu time spent up to now is 184.5 secs Computing kpt #: 251 total cpu time spent up to now is 185.2 secs Computing kpt #: 252 total cpu time spent up to now is 185.9 secs Computing kpt #: 253 total cpu time spent up to now is 186.8 secs Computing kpt #: 254 total cpu time spent up to now is 187.6 secs Computing kpt #: 255 total cpu time spent up to now is 188.4 secs Computing kpt #: 256 total cpu time spent up to now is 189.5 secs Computing kpt #: 257 total cpu time spent up to now is 190.3 secs Computing kpt #: 258 total cpu time spent up to now is 191.1 secs Computing kpt #: 259 total cpu time spent up to now is 192.0 secs Computing kpt #: 260 total cpu time spent up to now is 192.8 secs Computing kpt #: 261 total cpu time spent up to now is 193.7 secs Computing kpt #: 262 total cpu time spent up to now is 194.5 secs Computing kpt #: 263 total cpu time spent up to now is 195.4 secs Computing kpt #: 264 total cpu time spent up to now is 196.2 secs Computing kpt #: 265 total cpu time spent up to now is 197.0 secs Computing kpt #: 266 total cpu time spent up to now is 197.8 secs Computing kpt #: 267 total cpu time spent up to now is 198.7 secs Computing kpt #: 268 total cpu time spent up to now is 199.5 secs Computing kpt #: 269 total cpu time spent up to now is 200.4 secs Computing kpt #: 270 total cpu time spent up to now is 201.2 secs Computing kpt #: 271 total cpu time spent up to now is 202.0 secs Computing kpt #: 272 total cpu time spent up to now is 202.9 secs Computing kpt #: 273 total cpu time spent up to now is 203.7 secs Computing kpt #: 274 total cpu time spent up to now is 204.5 secs Computing kpt #: 275 total cpu time spent up to now is 205.3 secs Computing kpt #: 276 total cpu time spent up to now is 206.1 secs Computing kpt #: 277 total cpu time spent up to now is 206.9 secs Computing kpt #: 278 total cpu time spent up to now is 207.6 secs Computing kpt #: 279 total cpu time spent up to now is 208.4 secs Computing kpt #: 280 total cpu time spent up to now is 209.1 secs Computing kpt #: 281 total cpu time spent up to now is 209.9 secs Computing kpt #: 282 total cpu time spent up to now is 210.7 secs Computing kpt #: 283 total cpu time spent up to now is 211.4 secs Computing kpt #: 284 total cpu time spent up to now is 212.2 secs Computing kpt #: 285 total cpu time spent up to now is 212.9 secs Computing kpt #: 286 total cpu time spent up to now is 213.7 secs Computing kpt #: 287 total cpu time spent up to now is 214.4 secs Computing kpt #: 288 total cpu time spent up to now is 215.1 secs Computing kpt #: 289 total cpu time spent up to now is 215.8 secs Computing kpt #: 290 total cpu time spent up to now is 216.5 secs Computing kpt #: 291 total cpu time spent up to now is 217.3 secs Computing kpt #: 292 total cpu time spent up to now is 218.0 secs Computing kpt #: 293 total cpu time spent up to now is 218.7 secs Computing kpt #: 294 total cpu time spent up to now is 219.7 secs Computing kpt #: 295 total cpu time spent up to now is 220.4 secs Computing kpt #: 296 total cpu time spent up to now is 221.1 secs Computing kpt #: 297 total cpu time spent up to now is 221.8 secs Computing kpt #: 298 total cpu time spent up to now is 222.5 secs Computing kpt #: 299 total cpu time spent up to now is 223.2 secs Computing kpt #: 300 total cpu time spent up to now is 223.9 secs Computing kpt #: 301 total cpu time spent up to now is 224.6 secs Computing kpt #: 302 total cpu time spent up to now is 225.4 secs Computing kpt #: 303 total cpu time spent up to now is 226.1 secs Computing kpt #: 304 total cpu time spent up to now is 226.8 secs Computing kpt #: 305 total cpu time spent up to now is 227.5 secs Computing kpt #: 306 total cpu time spent up to now is 228.2 secs Computing kpt #: 307 total cpu time spent up to now is 228.9 secs Computing kpt #: 308 total cpu time spent up to now is 229.6 secs Computing kpt #: 309 total cpu time spent up to now is 230.3 secs Computing kpt #: 310 total cpu time spent up to now is 231.0 secs Computing kpt #: 311 total cpu time spent up to now is 231.7 secs Computing kpt #: 312 total cpu time spent up to now is 232.4 secs Computing kpt #: 313 total cpu time spent up to now is 233.1 secs Computing kpt #: 314 total cpu time spent up to now is 233.8 secs Computing kpt #: 315 total cpu time spent up to now is 234.5 secs Computing kpt #: 316 total cpu time spent up to now is 235.2 secs Computing kpt #: 317 total cpu time spent up to now is 236.0 secs Computing kpt #: 318 total cpu time spent up to now is 236.7 secs Computing kpt #: 319 total cpu time spent up to now is 237.5 secs Computing kpt #: 320 total cpu time spent up to now is 238.2 secs Computing kpt #: 321 total cpu time spent up to now is 239.0 secs Computing kpt #: 322 total cpu time spent up to now is 239.7 secs Computing kpt #: 323 total cpu time spent up to now is 240.5 secs Computing kpt #: 324 total cpu time spent up to now is 241.2 secs Computing kpt #: 325 total cpu time spent up to now is 241.9 secs Computing kpt #: 326 total cpu time spent up to now is 242.7 secs Computing kpt #: 327 total cpu time spent up to now is 243.4 secs Computing kpt #: 328 total cpu time spent up to now is 244.1 secs Computing kpt #: 329 total cpu time spent up to now is 244.8 secs Computing kpt #: 330 total cpu time spent up to now is 245.5 secs Computing kpt #: 331 total cpu time spent up to now is 246.2 secs Computing kpt #: 332 total cpu time spent up to now is 246.9 secs Computing kpt #: 333 total cpu time spent up to now is 247.5 secs Computing kpt #: 334 total cpu time spent up to now is 248.2 secs Computing kpt #: 335 total cpu time spent up to now is 248.9 secs Computing kpt #: 336 total cpu time spent up to now is 249.6 secs Computing kpt #: 337 total cpu time spent up to now is 250.3 secs Computing kpt #: 338 total cpu time spent up to now is 251.0 secs Computing kpt #: 339 total cpu time spent up to now is 251.7 secs Computing kpt #: 340 total cpu time spent up to now is 252.4 secs Computing kpt #: 341 total cpu time spent up to now is 253.1 secs Computing kpt #: 342 total cpu time spent up to now is 253.8 secs Computing kpt #: 343 total cpu time spent up to now is 255.0 secs Computing kpt #: 344 total cpu time spent up to now is 255.7 secs Computing kpt #: 345 total cpu time spent up to now is 256.4 secs Computing kpt #: 346 total cpu time spent up to now is 257.1 secs Computing kpt #: 347 total cpu time spent up to now is 257.8 secs Computing kpt #: 348 total cpu time spent up to now is 258.5 secs Computing kpt #: 349 total cpu time spent up to now is 259.2 secs Computing kpt #: 350 total cpu time spent up to now is 260.0 secs Computing kpt #: 351 total cpu time spent up to now is 260.7 secs Computing kpt #: 352 total cpu time spent up to now is 261.4 secs Computing kpt #: 353 total cpu time spent up to now is 262.1 secs Computing kpt #: 354 total cpu time spent up to now is 262.8 secs Computing kpt #: 355 total cpu time spent up to now is 263.6 secs Computing kpt #: 356 total cpu time spent up to now is 264.3 secs Computing kpt #: 357 total cpu time spent up to now is 265.0 secs Computing kpt #: 358 total cpu time spent up to now is 265.8 secs Computing kpt #: 359 total cpu time spent up to now is 266.5 secs Computing kpt #: 360 total cpu time spent up to now is 267.2 secs Computing kpt #: 361 total cpu time spent up to now is 268.0 secs Computing kpt #: 362 total cpu time spent up to now is 268.7 secs Computing kpt #: 363 total cpu time spent up to now is 269.4 secs Computing kpt #: 364 total cpu time spent up to now is 270.2 secs Computing kpt #: 365 total cpu time spent up to now is 271.0 secs Computing kpt #: 366 total cpu time spent up to now is 271.9 secs Computing kpt #: 367 total cpu time spent up to now is 272.7 secs Computing kpt #: 368 total cpu time spent up to now is 273.5 secs Computing kpt #: 369 total cpu time spent up to now is 274.4 secs Computing kpt #: 370 total cpu time spent up to now is 275.2 secs Computing kpt #: 371 total cpu time spent up to now is 276.1 secs Computing kpt #: 372 total cpu time spent up to now is 276.9 secs Computing kpt #: 373 total cpu time spent up to now is 277.6 secs Computing kpt #: 374 total cpu time spent up to now is 278.4 secs Computing kpt #: 375 total cpu time spent up to now is 279.1 secs Computing kpt #: 376 total cpu time spent up to now is 279.8 secs Computing kpt #: 377 total cpu time spent up to now is 280.5 secs Computing kpt #: 378 total cpu time spent up to now is 281.2 secs Computing kpt #: 379 total cpu time spent up to now is 281.8 secs Computing kpt #: 380 total cpu time spent up to now is 282.5 secs Computing kpt #: 381 total cpu time spent up to now is 283.2 secs Computing kpt #: 382 total cpu time spent up to now is 283.9 secs Computing kpt #: 383 total cpu time spent up to now is 284.6 secs Computing kpt #: 384 total cpu time spent up to now is 285.3 secs Computing kpt #: 385 total cpu time spent up to now is 286.0 secs Computing kpt #: 386 total cpu time spent up to now is 286.7 secs Computing kpt #: 387 total cpu time spent up to now is 287.4 secs Computing kpt #: 388 total cpu time spent up to now is 288.1 secs Computing kpt #: 389 total cpu time spent up to now is 288.8 secs Computing kpt #: 390 total cpu time spent up to now is 289.7 secs Computing kpt #: 391 total cpu time spent up to now is 290.4 secs Computing kpt #: 392 total cpu time spent up to now is 291.1 secs Computing kpt #: 393 total cpu time spent up to now is 291.8 secs Computing kpt #: 394 total cpu time spent up to now is 292.6 secs Computing kpt #: 395 total cpu time spent up to now is 293.4 secs Computing kpt #: 396 total cpu time spent up to now is 294.2 secs Computing kpt #: 397 total cpu time spent up to now is 294.9 secs Computing kpt #: 398 total cpu time spent up to now is 295.6 secs Computing kpt #: 399 total cpu time spent up to now is 296.3 secs ethr = 2.08E-08, avg # of iterations = 18.4 total cpu time spent up to now is 296.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5797 -27.5797 -27.5206 -27.5206 -19.0052 -19.0052 -18.9112 -18.9112 -18.8433 -18.8433 -18.6804 -18.6804 -1.6991 -1.6991 0.8431 0.8431 1.1025 1.1025 5.2092 5.2092 5.8757 5.8757 6.1740 6.1740 7.2786 7.2786 9.7366 9.7366 10.0391 10.0391 10.1577 10.1577 11.5788 11.5788 11.7413 11.7413 12.0614 12.0614 12.1098 12.1098 12.6490 12.6490 13.5116 13.5116 14.1953 14.1953 14.5537 14.5537 15.6286 15.6286 16.0755 16.0755 16.2623 16.2623 k =-0.0054 0.0110 0.0169 ( 3213 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5796 -27.5796 -27.5206 -27.5206 -19.0050 -19.0050 -18.9113 -18.9113 -18.8434 -18.8434 -18.6804 -18.6804 -1.6977 -1.6977 0.8431 0.8431 1.1025 1.1025 5.2097 5.2097 5.8768 5.8768 6.1757 6.1757 7.2795 7.2795 9.7338 9.7338 10.0366 10.0366 10.1544 10.1544 11.5792 11.5792 11.7397 11.7397 12.0584 12.0584 12.1069 12.1069 12.6447 12.6447 13.5075 13.5075 14.1960 14.1960 14.5569 14.5569 15.6289 15.6289 16.0794 16.0794 16.2612 16.2612 k =-0.0108 0.0220 0.0338 ( 3213 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5796 -27.5796 -27.5208 -27.5208 -19.0049 -19.0049 -18.9116 -18.9116 -18.8437 -18.8437 -18.6807 -18.6807 -1.6938 -1.6938 0.8432 0.8432 1.1026 1.1026 5.2110 5.2110 5.8802 5.8802 6.1809 6.1809 7.2821 7.2821 9.7254 9.7254 10.0293 10.0293 10.1446 10.1446 11.5802 11.5802 11.7348 11.7348 12.0496 12.0496 12.0984 12.0984 12.6320 12.6320 13.4956 13.4956 14.1980 14.1980 14.5666 14.5666 15.6298 15.6298 16.0911 16.0911 16.2606 16.2606 k =-0.0163 0.0330 0.0507 ( 3205 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5796 -27.5796 -27.5209 -27.5209 -19.0047 -19.0047 -18.9120 -18.9120 -18.8443 -18.8443 -18.6810 -18.6810 -1.6873 -1.6873 0.8433 0.8433 1.1027 1.1027 5.2132 5.2132 5.8859 5.8859 6.1895 6.1895 7.2866 7.2866 9.7114 9.7114 10.0172 10.0172 10.1285 10.1285 11.5818 11.5818 11.7267 11.7267 12.0344 12.0344 12.0849 12.0849 12.6113 12.6113 13.4761 13.4761 14.2010 14.2010 14.5830 14.5830 15.6317 15.6317 16.1110 16.1110 16.2679 16.2679 k =-0.0217 0.0440 0.0676 ( 3201 PWs) bands (ev): -54.6763 -54.6763 -54.6556 -54.6556 -27.5797 -27.5797 -27.5211 -27.5211 -19.0044 -19.0044 -18.9126 -18.9126 -18.8452 -18.8452 -18.6814 -18.6814 -1.6781 -1.6781 0.8434 0.8434 1.1028 1.1028 5.2163 5.2163 5.8937 5.8937 6.2016 6.2016 7.2929 7.2929 9.6917 9.6917 10.0006 10.0006 10.1065 10.1065 11.5836 11.5836 11.7152 11.7152 12.0125 12.0125 12.0671 12.0671 12.5833 12.5833 13.4498 13.4498 14.2045 14.2045 14.6062 14.6062 15.6353 15.6353 16.1392 16.1392 16.2840 16.2840 k =-0.0271 0.0550 0.0845 ( 3205 PWs) bands (ev): -54.6763 -54.6763 -54.6556 -54.6556 -27.5800 -27.5800 -27.5214 -27.5214 -19.0041 -19.0041 -18.9134 -18.9134 -18.8464 -18.8464 -18.6819 -18.6819 -1.6663 -1.6663 0.8436 0.8436 1.1028 1.1028 5.2203 5.2203 5.9038 5.9038 6.2169 6.2169 7.3010 7.3010 9.6664 9.6664 9.9797 9.9797 10.0790 10.0790 11.5851 11.5851 11.7001 11.7001 11.9841 11.9841 12.0456 12.0456 12.5488 12.5488 13.4176 13.4176 14.2084 14.2084 14.6362 14.6362 15.6413 15.6413 16.1759 16.1759 16.3083 16.3083 k =-0.0325 0.0660 0.1014 ( 3209 PWs) bands (ev): -54.6762 -54.6762 -54.6555 -54.6555 -27.5802 -27.5802 -27.5217 -27.5217 -19.0037 -19.0037 -18.9144 -18.9144 -18.8479 -18.8479 -18.6825 -18.6825 -1.6520 -1.6520 0.8438 0.8438 1.1029 1.1029 5.2251 5.2251 5.9160 5.9160 6.2355 6.2355 7.3108 7.3108 9.6355 9.6355 9.9548 9.9548 10.0468 10.0468 11.5857 11.5857 11.6815 11.6815 11.9495 11.9495 12.0205 12.0205 12.5087 12.5087 13.3808 13.3808 14.2128 14.2128 14.6727 14.6727 15.6503 15.6503 16.2209 16.2209 16.3396 16.3396 k =-0.0379 0.0770 0.1183 ( 3209 PWs) bands (ev): -54.6762 -54.6762 -54.6555 -54.6555 -27.5804 -27.5804 -27.5221 -27.5221 -19.0032 -19.0032 -18.9155 -18.9155 -18.8495 -18.8495 -18.6833 -18.6833 -1.6351 -1.6351 0.8440 0.8440 1.1029 1.1029 5.2308 5.2308 5.9304 5.9304 6.2572 6.2572 7.3224 7.3224 9.5989 9.5989 9.9261 9.9261 10.0106 10.0106 11.5848 11.5848 11.6591 11.6591 11.9094 11.9094 11.9921 11.9921 12.4637 12.4637 13.3406 13.3406 14.2180 14.2180 14.7153 14.7153 15.6631 15.6631 16.2734 16.2734 16.3766 16.3766 k =-0.0434 0.0879 0.1352 ( 3201 PWs) bands (ev): -54.6761 -54.6761 -54.6554 -54.6554 -27.5806 -27.5806 -27.5225 -27.5225 -19.0026 -19.0026 -18.9168 -18.9168 -18.8514 -18.8514 -18.6841 -18.6841 -1.6157 -1.6157 0.8442 0.8442 1.1027 1.1027 5.2373 5.2373 5.9469 5.9469 6.2820 6.2820 7.3358 7.3358 9.5567 9.5567 9.8940 9.8940 9.9713 9.9713 11.5811 11.5811 11.6329 11.6329 11.8649 11.8649 11.9603 11.9603 12.4148 12.4148 13.2986 13.2986 14.2247 14.2247 14.7631 14.7631 15.6801 15.6801 16.3320 16.3320 16.4178 16.4178 k =-0.0488 0.0989 0.1521 ( 3197 PWs) bands (ev): -54.6760 -54.6760 -54.6553 -54.6553 -27.5810 -27.5810 -27.5229 -27.5229 -19.0021 -19.0021 -18.9182 -18.9182 -18.8535 -18.8535 -18.6850 -18.6850 -1.5937 -1.5937 0.8444 0.8444 1.1025 1.1025 5.2445 5.2445 5.9655 5.9655 6.3098 6.3098 7.3509 7.3509 9.5090 9.5090 9.8585 9.8585 9.9298 9.9298 11.5724 11.5724 11.6041 11.6041 11.8169 11.8169 11.9253 11.9253 12.3627 12.3627 13.2564 13.2564 14.2333 14.2333 14.8156 14.8156 15.7017 15.7017 16.3932 16.3932 16.4622 16.4622 k =-0.0542 0.1099 0.1689 ( 3199 PWs) bands (ev): -54.6759 -54.6759 -54.6552 -54.6552 -27.5813 -27.5813 -27.5234 -27.5234 -19.0015 -19.0015 -18.9198 -18.9198 -18.8558 -18.8558 -18.6859 -18.6859 -1.5693 -1.5693 0.8447 0.8447 1.1020 1.1020 5.2526 5.2526 5.9860 5.9860 6.3403 6.3403 7.3678 7.3678 9.4558 9.4558 9.8199 9.8199 9.8873 9.8873 11.5516 11.5516 11.5783 11.5783 11.7664 11.7664 11.8875 11.8875 12.3081 12.3081 13.2156 13.2156 14.2445 14.2445 14.8718 14.8718 15.7281 15.7281 16.4507 16.4507 16.5105 16.5105 k =-0.0596 0.1209 0.1858 ( 3191 PWs) bands (ev): -54.6758 -54.6758 -54.6551 -54.6551 -27.5817 -27.5817 -27.5238 -27.5238 -19.0008 -19.0008 -18.9216 -18.9216 -18.8583 -18.8583 -18.6869 -18.6869 -1.5424 -1.5424 0.8449 0.8449 1.1013 1.1013 5.2614 5.2614 6.0085 6.0085 6.3734 6.3734 7.3864 7.3864 9.3974 9.3974 9.7782 9.7782 9.8447 9.8447 11.5148 11.5148 11.5582 11.5582 11.7141 11.7141 11.8472 11.8472 12.2516 12.2516 13.1779 13.1779 14.2590 14.2590 14.9310 14.9310 15.7594 15.7594 16.4969 16.4969 16.5631 16.5631 k =-0.0650 0.1319 0.2027 ( 3195 PWs) bands (ev): -54.6757 -54.6757 -54.6550 -54.6550 -27.5822 -27.5822 -27.5244 -27.5244 -19.0001 -19.0001 -18.9235 -18.9235 -18.8611 -18.8611 -18.6879 -18.6879 -1.5131 -1.5131 0.8450 0.8450 1.1002 1.1002 5.2709 5.2709 6.0329 6.0329 6.4090 6.4090 7.4067 7.4067 9.3338 9.3338 9.7341 9.7341 9.8026 9.8026 11.4691 11.4691 11.5357 11.5357 11.6608 11.6608 11.8048 11.8048 12.1937 12.1937 13.1448 13.1448 14.2771 14.2771 14.9927 14.9927 15.7956 15.7956 16.5307 16.5307 16.6156 16.6156 k =-0.0704 0.1429 0.2196 ( 3195 PWs) bands (ev): -54.6755 -54.6755 -54.6549 -54.6549 -27.5826 -27.5826 -27.5251 -27.5251 -18.9993 -18.9993 -18.9257 -18.9257 -18.8640 -18.8640 -18.6890 -18.6890 -1.4815 -1.4815 0.8452 0.8452 1.0988 1.0988 5.2811 5.2811 6.0590 6.0590 6.4468 6.4468 7.4287 7.4287 9.2655 9.2655 9.6882 9.6882 9.7610 9.7610 11.4175 11.4175 11.5072 11.5072 11.6069 11.6069 11.7608 11.7608 12.1349 12.1349 13.1177 13.1177 14.2993 14.2993 15.0562 15.0562 15.8366 15.8366 16.5544 16.5544 16.6635 16.6635 k =-0.0759 0.1539 0.2365 ( 3209 PWs) bands (ev): -54.6754 -54.6754 -54.6548 -54.6548 -27.5832 -27.5832 -27.5258 -27.5258 -18.9987 -18.9987 -18.9280 -18.9280 -18.8671 -18.8671 -18.6901 -18.6901 -1.4475 -1.4475 0.8453 0.8453 1.0970 1.0970 5.2919 5.2919 6.0869 6.0869 6.4865 6.4865 7.4524 7.4524 9.1927 9.1927 9.6416 9.6416 9.7200 9.7200 11.3610 11.3610 11.4715 11.4715 11.5526 11.5526 11.7155 11.7155 12.0757 12.0757 13.0977 13.0977 14.3257 14.3257 15.1209 15.1209 15.8821 15.8821 16.5688 16.5688 16.7057 16.7057 k =-0.0813 0.1649 0.2534 ( 3209 PWs) bands (ev): -54.6753 -54.6753 -54.6547 -54.6547 -27.5837 -27.5837 -27.5264 -27.5264 -18.9979 -18.9979 -18.9304 -18.9304 -18.8703 -18.8703 -18.6912 -18.6912 -1.4113 -1.4113 0.8453 0.8453 1.0946 1.0946 5.3033 5.3033 6.1164 6.1164 6.5280 6.5280 7.4778 7.4778 9.1159 9.1159 9.5954 9.5954 9.6792 9.6792 11.3006 11.3006 11.4282 11.4282 11.4982 11.4982 11.6688 11.6688 12.0163 12.0163 13.0855 13.0855 14.3566 14.3566 15.1866 15.1866 15.9320 15.9320 16.5733 16.5733 16.7415 16.7415 k =-0.0867 0.1759 0.2703 ( 3203 PWs) bands (ev): -54.6751 -54.6751 -54.6545 -54.6545 -27.5842 -27.5842 -27.5271 -27.5271 -18.9970 -18.9970 -18.9330 -18.9330 -18.8734 -18.8734 -18.6924 -18.6924 -1.3728 -1.3728 0.8452 0.8452 1.0916 1.0916 5.3153 5.3153 6.1474 6.1474 6.5710 6.5710 7.5048 7.5048 9.0354 9.0354 9.5505 9.5505 9.6384 9.6384 11.2372 11.2372 11.3777 11.3777 11.4433 11.4433 11.6209 11.6209 11.9572 11.9572 13.0815 13.0815 14.3920 14.3920 15.2528 15.2528 15.9859 15.9859 16.5671 16.5671 16.7704 16.7704 k =-0.0921 0.1869 0.2872 ( 3199 PWs) bands (ev): -54.6750 -54.6750 -54.6544 -54.6544 -27.5847 -27.5847 -27.5279 -27.5279 -18.9961 -18.9961 -18.9357 -18.9357 -18.8768 -18.8768 -18.6935 -18.6935 -1.3322 -1.3322 0.8451 0.8451 1.0880 1.0880 5.3278 5.3278 6.1799 6.1799 6.6151 6.6151 7.5335 7.5335 8.9518 8.9518 9.5077 9.5077 9.5975 9.5975 11.1715 11.1715 11.3211 11.3211 11.3879 11.3879 11.5714 11.5714 11.8986 11.8986 13.0858 13.0858 14.4319 14.4319 15.3191 15.3191 16.0432 16.0432 16.5494 16.5494 16.7921 16.7921 k =-0.0975 0.1979 0.3041 ( 3195 PWs) bands (ev): -54.6748 -54.6748 -54.6542 -54.6542 -27.5852 -27.5852 -27.5286 -27.5286 -18.9952 -18.9952 -18.9385 -18.9385 -18.8802 -18.8802 -18.6946 -18.6946 -1.2894 -1.2894 0.8448 0.8448 1.0837 1.0837 5.3408 5.3408 6.2137 6.2137 6.6601 6.6601 7.5636 7.5636 8.8654 8.8654 9.4677 9.4677 9.5561 9.5561 11.1043 11.1043 11.2597 11.2597 11.3315 11.3315 11.5205 11.5205 11.8409 11.8409 13.0980 13.0980 14.4763 14.4763 15.3852 15.3852 16.1037 16.1037 16.5203 16.5203 16.8066 16.8066 k =-0.1030 0.2089 0.3210 ( 3197 PWs) bands (ev): -54.6747 -54.6747 -54.6541 -54.6541 -27.5858 -27.5858 -27.5294 -27.5294 -18.9943 -18.9943 -18.9414 -18.9414 -18.8837 -18.8837 -18.6957 -18.6957 -1.2446 -1.2446 0.8444 0.8444 1.0785 1.0785 5.3542 5.3542 6.2488 6.2488 6.7057 6.7057 7.5953 7.5953 8.7768 8.7768 9.4312 9.4312 9.5143 9.5143 11.0361 11.0361 11.1946 11.1946 11.2741 11.2741 11.4680 11.4680 11.7843 11.7843 13.1176 13.1176 14.5252 14.5252 15.4507 15.4507 16.1666 16.1666 16.4810 16.4810 16.8140 16.8140 k =-0.1084 0.2199 0.3379 ( 3191 PWs) bands (ev): -54.6745 -54.6745 -54.6539 -54.6539 -27.5863 -27.5863 -27.5302 -27.5302 -18.9934 -18.9934 -18.9445 -18.9445 -18.8872 -18.8872 -18.6967 -18.6967 -1.1978 -1.1978 0.8439 0.8439 1.0724 1.0724 5.3679 5.3679 6.2849 6.2849 6.7514 6.7514 7.6285 7.6285 8.6863 8.6863 9.3985 9.3985 9.4720 9.4720 10.9674 10.9674 11.1270 11.1270 11.2160 11.2160 11.4141 11.4141 11.7289 11.7289 13.1439 13.1439 14.5784 14.5784 15.5154 15.5154 16.2312 16.2312 16.4340 16.4340 16.8146 16.8146 k =-0.1138 0.2309 0.3548 ( 3199 PWs) bands (ev): -54.6744 -54.6744 -54.6538 -54.6538 -27.5870 -27.5870 -27.5310 -27.5310 -18.9926 -18.9926 -18.9476 -18.9476 -18.8908 -18.8908 -18.6978 -18.6978 -1.1491 -1.1491 0.8431 0.8431 1.0652 1.0652 5.3819 5.3819 6.3220 6.3220 6.7971 6.7971 7.6630 7.6630 8.5946 8.5946 9.3694 9.3694 9.4298 9.4298 10.8984 10.8984 11.0574 11.0574 11.1580 11.1580 11.3589 11.3589 11.6750 11.6750 13.1762 13.1762 14.6358 14.6358 15.5789 15.5789 16.2956 16.2956 16.3825 16.3825 16.8088 16.8088 k =-0.1192 0.2419 0.3717 ( 3195 PWs) bands (ev): -54.6742 -54.6742 -54.6536 -54.6536 -27.5876 -27.5876 -27.5318 -27.5318 -18.9917 -18.9917 -18.9508 -18.9508 -18.8943 -18.8943 -18.6988 -18.6988 -1.0986 -1.0986 0.8422 0.8422 1.0571 1.0571 5.3961 5.3961 6.3599 6.3599 6.8423 6.8423 7.6987 7.6987 8.5021 8.5021 9.3422 9.3422 9.3897 9.3897 10.8296 10.8296 10.9866 10.9866 11.1007 11.1007 11.3028 11.3028 11.6227 11.6227 13.2136 13.2136 14.6973 14.6973 15.6407 15.6407 16.3186 16.3186 16.3693 16.3693 16.7968 16.7968 k =-0.1246 0.2528 0.3886 ( 3193 PWs) bands (ev): -54.6740 -54.6740 -54.6535 -54.6535 -27.5882 -27.5882 -27.5327 -27.5327 -18.9909 -18.9909 -18.9541 -18.9541 -18.8978 -18.8978 -18.6998 -18.6998 -1.0463 -1.0463 0.8412 0.8412 1.0478 1.0478 5.4105 5.4105 6.3984 6.3984 6.8868 6.8868 7.7354 7.7354 8.4094 8.4094 9.3104 9.3104 9.3585 9.3585 10.7610 10.7610 10.9150 10.9150 11.0449 11.0449 11.2460 11.2460 11.5722 11.5722 13.2553 13.2553 14.7628 14.7628 15.7004 15.7004 16.2649 16.2649 16.4301 16.4301 16.7786 16.7786 k =-0.1301 0.2638 0.4055 ( 3197 PWs) bands (ev): -54.6739 -54.6739 -54.6533 -54.6533 -27.5888 -27.5888 -27.5335 -27.5335 -18.9901 -18.9901 -18.9575 -18.9575 -18.9012 -18.9012 -18.7007 -18.7007 -0.9924 -0.9924 0.8398 0.8398 1.0372 1.0372 5.4250 5.4250 6.4375 6.4375 6.9302 6.9302 7.7728 7.7728 8.3172 8.3172 9.2685 9.2685 9.3419 9.3419 10.6929 10.6929 10.8431 10.8431 10.9914 10.9914 11.1889 11.1889 11.5235 11.5235 13.3005 13.3005 14.8320 14.8320 15.7573 15.7573 16.2089 16.2089 16.4899 16.4899 16.7548 16.7548 k =-0.1355 0.2748 0.4224 ( 3197 PWs) bands (ev): -54.6737 -54.6737 -54.6532 -54.6532 -27.5894 -27.5894 -27.5344 -27.5344 -18.9894 -18.9894 -18.9608 -18.9608 -18.9045 -18.9045 -18.7016 -18.7016 -0.9369 -0.9369 0.8383 0.8383 1.0254 1.0254 5.4396 5.4396 6.4769 6.4769 6.9723 6.9723 7.8100 7.8100 8.2265 8.2265 9.2202 9.2202 9.3364 9.3364 10.6251 10.6251 10.7712 10.7712 10.9408 10.9408 11.1319 11.1319 11.4768 11.4768 13.3484 13.3484 14.9047 14.9047 15.8098 15.8098 16.1555 16.1555 16.5424 16.5424 16.7264 16.7264 k =-0.1409 0.2858 0.4393 ( 3189 PWs) bands (ev): -54.6735 -54.6735 -54.6530 -54.6530 -27.5899 -27.5899 -27.5351 -27.5351 -18.9888 -18.9888 -18.9641 -18.9641 -18.9077 -18.9077 -18.7024 -18.7024 -0.8799 -0.8799 0.8364 0.8364 1.0122 1.0122 5.4541 5.4541 6.5164 6.5164 7.0130 7.0130 7.8450 7.8450 8.1399 8.1399 9.1682 9.1682 9.3393 9.3393 10.5577 10.5577 10.6997 10.6997 10.8934 10.8934 11.0757 11.0757 11.4322 11.4322 13.3981 13.3981 14.9809 14.9809 15.8553 15.8553 16.1084 16.1084 16.5815 16.5815 16.6954 16.6954 k =-0.1463 0.2968 0.4562 ( 3187 PWs) bands (ev): -54.6734 -54.6734 -54.6529 -54.6529 -27.5905 -27.5905 -27.5359 -27.5359 -18.9882 -18.9882 -18.9675 -18.9675 -18.9107 -18.9107 -18.7033 -18.7033 -0.8215 -0.8215 0.8343 0.8343 0.9976 0.9976 5.4685 5.4685 6.5557 6.5557 7.0521 7.0521 7.8710 7.8710 8.0644 8.0644 9.1137 9.1137 9.3497 9.3497 10.4907 10.4907 10.6291 10.6291 10.8494 10.8494 11.0211 11.0211 11.3897 11.3897 13.4488 13.4488 15.0601 15.0601 15.8864 15.8864 16.0749 16.0749 16.5969 16.5969 16.6688 16.6688 k =-0.1517 0.3078 0.4730 ( 3187 PWs) bands (ev): -54.6732 -54.6732 -54.6527 -54.6527 -27.5910 -27.5910 -27.5368 -27.5368 -18.9877 -18.9877 -18.9709 -18.9709 -18.9136 -18.9136 -18.7040 -18.7040 -0.7618 -0.7618 0.8319 0.8319 0.9815 0.9815 5.4827 5.4827 6.5948 6.5948 7.0894 7.0894 7.8647 7.8647 8.0238 8.0238 9.0571 9.0571 9.3671 9.3671 10.4239 10.4239 10.5596 10.5596 10.8084 10.8084 10.9691 10.9691 11.3495 11.3495 13.4997 13.4997 15.1423 15.1423 15.8911 15.8911 16.0675 16.0675 16.5782 16.5782 16.6565 16.6565 k =-0.1571 0.3188 0.4899 ( 3189 PWs) bands (ev): -54.6731 -54.6731 -54.6526 -54.6526 -27.5915 -27.5915 -27.5376 -27.5376 -18.9873 -18.9873 -18.9742 -18.9742 -18.9163 -18.9163 -18.7048 -18.7048 -0.7010 -0.7010 0.8290 0.8290 0.9640 0.9640 5.4966 5.4966 6.6331 6.6331 7.1250 7.1250 7.8100 7.8100 8.0346 8.0346 8.9989 8.9989 9.3910 9.3910 10.3570 10.3570 10.4918 10.4918 10.7697 10.7697 10.9213 10.9213 11.3116 11.3116 13.5499 13.5499 15.2271 15.2271 15.8687 15.8687 16.0868 16.0868 16.5382 16.5382 16.6484 16.6484 k =-0.1626 0.3298 0.5068 ( 3177 PWs) bands (ev): -54.6729 -54.6729 -54.6524 -54.6524 -27.5920 -27.5920 -27.5382 -27.5382 -18.9870 -18.9870 -18.9773 -18.9773 -18.9188 -18.9188 -18.7055 -18.7055 -0.6391 -0.6391 0.8258 0.8258 0.9450 0.9450 5.5103 5.5103 6.6705 6.6705 7.1588 7.1588 7.7346 7.7346 8.0694 8.0694 8.9396 8.9396 9.4207 9.4207 10.2900 10.2900 10.4261 10.4261 10.7322 10.7322 10.8794 10.8794 11.2761 11.2761 13.5987 13.5987 15.3142 15.3142 15.8335 15.8335 16.1186 16.1186 16.4902 16.4902 16.6357 16.6357 k =-0.1680 0.3408 0.5237 ( 3181 PWs) bands (ev): -54.6728 -54.6728 -54.6523 -54.6523 -27.5925 -27.5925 -27.5390 -27.5390 -18.9868 -18.9868 -18.9805 -18.9805 -18.9212 -18.9212 -18.7062 -18.7062 -0.5763 -0.5763 0.8220 0.8220 0.9245 0.9245 5.5236 5.5236 6.7064 6.7064 7.1906 7.1906 7.6552 7.6552 8.1123 8.1123 8.8797 8.8797 9.4556 9.4556 10.2225 10.2225 10.3632 10.3632 10.6944 10.6944 10.8451 10.8451 11.2430 11.2430 13.6450 13.6450 15.4032 15.4032 15.7948 15.7948 16.1533 16.1533 16.4383 16.4383 16.6181 16.6181 k =-0.1734 0.3518 0.5406 ( 3181 PWs) bands (ev): -54.6726 -54.6726 -54.6522 -54.6522 -27.5930 -27.5930 -27.5398 -27.5398 -18.9868 -18.9868 -18.9835 -18.9835 -18.9233 -18.9233 -18.7068 -18.7068 -0.5127 -0.5127 0.8176 0.8176 0.9028 0.9028 5.5364 5.5364 6.7405 6.7405 7.2199 7.2199 7.5775 7.5775 8.1589 8.1589 8.8197 8.8197 9.4942 9.4942 10.1544 10.1544 10.3040 10.3040 10.6560 10.6560 10.8194 10.8194 11.2124 11.2124 13.6882 13.6882 15.4934 15.4934 15.7565 15.7565 16.1869 16.1869 16.3845 16.3845 16.5973 16.5973 k =-0.1788 0.3628 0.5575 ( 3187 PWs) bands (ev): -54.6725 -54.6725 -54.6521 -54.6521 -27.5935 -27.5935 -27.5405 -27.5405 -18.9872 -18.9872 -18.9861 -18.9861 -18.9252 -18.9252 -18.7075 -18.7075 -0.4485 -0.4485 0.8121 0.8121 0.8801 0.8801 5.5487 5.5487 6.7722 6.7722 7.2450 7.2450 7.5050 7.5050 8.2079 8.2079 8.7605 8.7605 9.5350 9.5350 10.0854 10.0854 10.2498 10.2498 10.6172 10.6172 10.8022 10.8022 11.1844 11.1844 13.7273 13.7273 15.5829 15.5829 15.7216 15.7216 16.2159 16.2159 16.3312 16.3312 16.5746 16.5746 k =-0.1842 0.3738 0.5744 ( 3191 PWs) bands (ev): -54.6724 -54.6724 -54.6520 -54.6520 -27.5939 -27.5939 -27.5412 -27.5412 -18.9896 -18.9896 -18.9867 -18.9867 -18.9268 -18.9268 -18.7081 -18.7081 -0.3839 -0.3839 0.8048 0.8048 0.8573 0.8573 5.5604 5.5604 6.8006 6.8006 7.2611 7.2611 7.4442 7.4442 8.2586 8.2586 8.7026 8.7026 9.5754 9.5754 10.0153 10.0153 10.2028 10.2028 10.5791 10.5791 10.7926 10.7926 11.1590 11.1590 13.7617 13.7617 15.6527 15.6527 15.7092 15.7092 16.2288 16.2288 16.2902 16.2902 16.5511 16.5511 k =-0.1897 0.3848 0.5913 ( 3197 PWs) bands (ev): -54.6723 -54.6723 -54.6519 -54.6519 -27.5943 -27.5943 -27.5419 -27.5419 -18.9923 -18.9923 -18.9869 -18.9869 -18.9283 -18.9283 -18.7087 -18.7087 -0.3190 -0.3190 0.7934 0.7934 0.8365 0.8365 5.5714 5.5714 6.8248 6.8248 7.2554 7.2554 7.4090 7.4090 8.3109 8.3109 8.6469 8.6469 9.6116 9.6116 9.9441 9.9441 10.1660 10.1660 10.5428 10.5428 10.7896 10.7896 11.1363 11.1363 13.7906 13.7906 15.6404 15.6404 15.7809 15.7809 16.1953 16.1953 16.2921 16.2921 16.5277 16.5277 k =-0.1951 0.3958 0.6082 ( 3201 PWs) bands (ev): -54.6722 -54.6722 -54.6518 -54.6518 -27.5947 -27.5947 -27.5425 -27.5425 -18.9949 -18.9949 -18.9871 -18.9871 -18.9295 -18.9295 -18.7092 -18.7092 -0.2540 -0.2540 0.7750 0.7750 0.8208 0.8208 5.5817 5.5817 6.8435 6.8435 7.2206 7.2206 7.4084 7.4084 8.3645 8.3645 8.5943 8.5943 9.6389 9.6389 9.8717 9.8717 10.1438 10.1438 10.5093 10.5093 10.7922 10.7922 11.1163 11.1163 13.8137 13.8137 15.6121 15.6121 15.8693 15.8693 16.1432 16.1432 16.3105 16.3105 16.5050 16.5050 k =-0.2005 0.4068 0.6251 ( 3201 PWs) bands (ev): -54.6721 -54.6721 -54.6517 -54.6517 -27.5950 -27.5950 -27.5431 -27.5431 -18.9972 -18.9972 -18.9873 -18.9873 -18.9305 -18.9305 -18.7098 -18.7098 -0.1892 -0.1892 0.7495 0.7495 0.8104 0.8104 5.5913 5.5913 6.8548 6.8548 7.1731 7.1731 7.4279 7.4279 8.4191 8.4191 8.5458 8.5458 9.6521 9.6521 9.7982 9.7982 10.1403 10.1403 10.4792 10.4792 10.7995 10.7995 11.0990 11.0990 13.8305 13.8305 15.5844 15.5844 15.9521 15.9521 16.0944 16.0944 16.3285 16.3285 16.4834 16.4834 k =-0.2059 0.4178 0.6420 ( 3205 PWs) bands (ev): -54.6720 -54.6720 -54.6516 -54.6516 -27.5953 -27.5953 -27.5436 -27.5436 -18.9995 -18.9995 -18.9876 -18.9876 -18.9314 -18.9314 -18.7103 -18.7103 -0.1247 -0.1247 0.7196 0.7196 0.8027 0.8027 5.6000 5.6000 6.8561 6.8561 7.1271 7.1271 7.4558 7.4558 8.4725 8.4725 8.5044 8.5044 9.6486 9.6486 9.7238 9.7238 10.1575 10.1575 10.4532 10.4532 10.8108 10.8108 11.0847 11.0847 13.8409 13.8409 15.5583 15.5583 15.9893 15.9893 16.0889 16.0889 16.3438 16.3438 16.4636 16.4636 k =-0.2113 0.4287 0.6589 ( 3207 PWs) bands (ev): -54.6719 -54.6719 -54.6516 -54.6516 -27.5956 -27.5956 -27.5441 -27.5441 -19.0015 -19.0015 -18.9878 -18.9878 -18.9320 -18.9320 -18.7108 -18.7108 -0.0610 -0.0610 0.6868 0.6868 0.7962 0.7962 5.6079 5.6079 6.8450 6.8450 7.0894 7.0894 7.4879 7.4879 8.4601 8.4601 8.5353 8.5353 9.6288 9.6288 9.6497 9.6497 10.1928 10.1928 10.4319 10.4319 10.8256 10.8256 11.0733 11.0733 13.8450 13.8450 15.5338 15.5338 15.9522 15.9522 16.1540 16.1540 16.3557 16.3557 16.4469 16.4469 k =-0.2168 0.4397 0.6758 ( 3203 PWs) bands (ev): -54.6718 -54.6718 -54.6515 -54.6515 -27.5958 -27.5958 -27.5445 -27.5445 -19.0032 -19.0032 -18.9880 -18.9880 -18.9325 -18.9325 -18.7113 -18.7113 0.0017 0.0017 0.6520 0.6520 0.7903 0.7903 5.6149 5.6149 6.8211 6.8211 7.0617 7.0617 7.5229 7.5229 8.4278 8.4278 8.5931 8.5931 9.5701 9.5701 9.6025 9.6025 10.2402 10.2402 10.4166 10.4166 10.8432 10.8432 11.0650 11.0650 13.8431 13.8431 15.5106 15.5106 15.9021 15.9021 16.2243 16.2243 16.3620 16.3620 16.4387 16.4387 k =-0.2222 0.4507 0.6927 ( 3199 PWs) bands (ev): -54.6717 -54.6717 -54.6515 -54.6515 -27.5959 -27.5959 -27.5448 -27.5448 -19.0048 -19.0048 -18.9881 -18.9881 -18.9328 -18.9328 -18.7117 -18.7117 0.0630 0.0630 0.6154 0.6154 0.7851 0.7851 5.6209 5.6209 6.7871 6.7871 7.0420 7.0420 7.5602 7.5602 8.4013 8.4013 8.6528 8.6528 9.4938 9.4938 9.5655 9.5655 10.2911 10.2911 10.4112 10.4112 10.8630 10.8630 11.0599 11.0599 13.8357 13.8357 15.4882 15.4882 15.8523 15.8523 16.2784 16.2784 16.3572 16.3572 16.4512 16.4512 k =-0.2276 0.4617 0.7096 ( 3207 PWs) bands (ev): -54.6717 -54.6717 -54.6514 -54.6514 -27.5962 -27.5962 -27.5452 -27.5452 -19.0062 -19.0062 -18.9882 -18.9882 -18.9331 -18.9331 -18.7122 -18.7122 0.1224 0.1224 0.5773 0.5773 0.7806 0.7806 5.6260 5.6260 6.7474 6.7474 7.0264 7.0264 7.5998 7.5998 8.3813 8.3813 8.7136 8.7136 9.4167 9.4167 9.5248 9.5248 10.3301 10.3301 10.4275 10.4275 10.8845 10.8845 11.0582 11.0582 13.8234 13.8234 15.4658 15.4658 15.8055 15.8055 16.3075 16.3075 16.3405 16.3405 16.4900 16.4900 k =-0.2330 0.4727 0.7265 ( 3209 PWs) bands (ev): -54.6717 -54.6717 -54.6514 -54.6514 -27.5962 -27.5962 -27.5455 -27.5455 -19.0074 -19.0074 -18.9882 -18.9882 -18.9332 -18.9332 -18.7127 -18.7127 0.1791 0.1791 0.5378 0.5378 0.7773 0.7773 5.6301 5.6301 6.7054 6.7054 7.0117 7.0117 7.6416 7.6416 8.3679 8.3679 8.7755 8.7755 9.3393 9.3393 9.4822 9.4822 10.3452 10.3452 10.4746 10.4746 10.9073 10.9073 11.0603 11.0603 13.8070 13.8070 15.4424 15.4424 15.7632 15.7632 16.3158 16.3158 16.3169 16.3169 16.5421 16.5421 k =-0.2384 0.4837 0.7434 ( 3213 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5458 -27.5458 -19.0083 -19.0083 -18.9880 -18.9880 -18.9332 -18.9332 -18.7132 -18.7132 0.2326 0.2326 0.4970 0.4970 0.7756 0.7756 5.6332 5.6332 6.6637 6.6637 6.9961 6.9961 7.6855 7.6855 8.3609 8.3609 8.8385 8.8385 9.2619 9.2619 9.4388 9.4388 10.3497 10.3497 10.5369 10.5369 10.9309 10.9309 11.0662 11.0662 13.7874 13.7874 15.4172 15.4172 15.7266 15.7266 16.2866 16.2866 16.3140 16.3140 16.5918 16.5918 k =-0.2439 0.4947 0.7603 ( 3211 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5459 -27.5459 -19.0090 -19.0090 -18.9878 -18.9878 -18.9331 -18.9331 -18.7136 -18.7136 0.2817 0.2817 0.4550 0.4550 0.7764 0.7764 5.6353 5.6353 6.6236 6.6236 6.9792 6.9792 7.7315 7.7315 8.3598 8.3598 8.9023 8.9023 9.1850 9.1850 9.3953 9.3953 10.3534 10.3534 10.6028 10.6028 10.9550 10.9550 11.0763 11.0763 13.7655 13.7655 15.3895 15.3895 15.6966 15.6966 16.2525 16.2525 16.3045 16.3045 16.6280 16.6280 k =-0.2493 0.5057 0.7772 ( 3203 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5459 -27.5459 -19.0093 -19.0093 -18.9874 -18.9874 -18.9329 -18.9329 -18.7140 -18.7140 0.3253 0.3253 0.4121 0.4121 0.7804 0.7804 5.6363 5.6363 6.5858 6.5858 6.9610 6.9610 7.7796 7.7796 8.3641 8.3641 8.9665 8.9665 9.1090 9.1090 9.3522 9.3522 10.3592 10.3592 10.6677 10.6677 10.9799 10.9799 11.0904 11.0904 13.7423 13.7423 15.3589 15.3589 15.6733 15.6733 16.2140 16.2140 16.2897 16.2897 16.6411 16.6411 k =-0.2547 0.5167 0.7940 ( 3197 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5960 -27.5960 -27.5460 -27.5460 -19.0095 -19.0095 -18.9868 -18.9868 -18.9326 -18.9326 -18.7144 -18.7144 0.3622 0.3622 0.3681 0.3681 0.7889 0.7889 5.6363 5.6363 6.5507 6.5507 6.9420 6.9420 7.8297 7.8297 8.3731 8.3731 9.0159 9.0159 9.0493 9.0493 9.3101 9.3101 10.3678 10.3678 10.7288 10.7288 11.0061 11.0061 11.1083 11.1083 13.7185 13.7185 15.3257 15.3257 15.6565 15.6565 16.1710 16.1710 16.2709 16.2709 16.6257 16.6257 k =-0.2601 0.5277 0.8109 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5958 -27.5958 -27.5460 -27.5460 -19.0095 -19.0095 -18.9861 -18.9861 -18.9322 -18.9322 -18.7148 -18.7148 0.3233 0.3233 0.3912 0.3912 0.8027 0.8027 5.6353 5.6353 6.5187 6.5187 6.9229 6.9229 7.8817 7.8817 8.3860 8.3860 8.9533 8.9533 9.1028 9.1028 9.2696 9.2696 10.3795 10.3795 10.7840 10.7840 11.0348 11.0348 11.1294 11.1294 13.6951 13.6951 15.2905 15.2905 15.6451 15.6451 16.1241 16.1241 16.2485 16.2485 16.5845 16.5845 k =-0.2655 0.5387 0.8278 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5957 -27.5957 -27.5459 -27.5459 -19.0092 -19.0092 -18.9854 -18.9854 -18.9319 -18.9319 -18.7153 -18.7153 0.2778 0.2778 0.4117 0.4117 0.8223 0.8223 5.6333 5.6333 6.4898 6.4898 6.9045 6.9045 7.9354 7.9354 8.4019 8.4019 8.8796 8.8796 9.1656 9.1656 9.2338 9.2338 10.3943 10.3943 10.8320 10.8320 11.0665 11.0665 11.1529 11.1529 13.6729 13.6729 15.2540 15.2540 15.6377 15.6377 16.0737 16.0737 16.2232 16.2232 16.5270 16.5270 k =-0.2709 0.5497 0.8447 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5458 -27.5458 -19.0087 -19.0087 -18.9845 -18.9845 -18.9314 -18.9314 -18.7156 -18.7156 0.2317 0.2317 0.4238 0.4238 0.8474 0.8474 5.6303 5.6303 6.4639 6.4639 6.8878 6.8878 7.9907 7.9907 8.4202 8.4202 8.8064 8.8064 9.1792 9.1792 9.2501 9.2501 10.4124 10.4124 10.8723 10.8723 11.1013 11.1013 11.1782 11.1782 13.6526 13.6526 15.2170 15.2170 15.6325 15.6325 16.0211 16.0211 16.1957 16.1957 16.4626 16.4626 k =-0.2709 0.5497 0.8447 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5458 -27.5458 -19.0087 -19.0087 -18.9845 -18.9845 -18.9314 -18.9314 -18.7156 -18.7156 0.2317 0.2317 0.4238 0.4238 0.8474 0.8474 5.6303 5.6303 6.4639 6.4639 6.8878 6.8878 7.9907 7.9907 8.4202 8.4202 8.8064 8.8064 9.1792 9.1792 9.2501 9.2501 10.4124 10.4124 10.8723 10.8723 11.1013 11.1013 11.1782 11.1782 13.6526 13.6526 15.2170 15.2170 15.6325 15.6325 16.0211 16.0211 16.1957 16.1957 16.4626 16.4626 k =-0.2634 0.5344 0.8570 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5458 -27.5458 -19.0087 -19.0087 -18.9844 -18.9844 -18.9314 -18.9314 -18.7157 -18.7157 0.2324 0.2324 0.4244 0.4244 0.8485 0.8485 5.6077 5.6077 6.4782 6.4782 6.8965 6.8965 7.9882 7.9882 8.4149 8.4149 8.8135 8.8135 9.1455 9.1455 9.2859 9.2859 10.4081 10.4081 10.8736 10.8736 11.0983 11.0983 11.1825 11.1825 13.6550 13.6550 15.2167 15.2167 15.6310 15.6310 16.0211 16.0211 16.1871 16.1871 16.4631 16.4631 k =-0.2559 0.5192 0.8694 ( 3205 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5459 -27.5459 -19.0088 -19.0088 -18.9845 -18.9845 -18.9314 -18.9314 -18.7157 -18.7157 0.2343 0.2343 0.4263 0.4263 0.8517 0.8517 5.5458 5.5458 6.5135 6.5135 6.9246 6.9246 7.9807 7.9807 8.4003 8.4003 8.8333 8.8333 9.0939 9.0939 9.3443 9.3443 10.3954 10.3954 10.8772 10.8772 11.0911 11.0911 11.1937 11.1937 13.6622 13.6622 15.2160 15.2160 15.6267 15.6267 16.0208 16.0208 16.1625 16.1625 16.4645 16.4645 k =-0.2484 0.5040 0.8817 ( 3205 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5459 -27.5459 -19.0088 -19.0088 -18.9845 -18.9845 -18.9315 -18.9315 -18.7157 -18.7157 0.2375 0.2375 0.4294 0.4294 0.8570 0.8570 5.4563 5.4563 6.5538 6.5538 6.9762 6.9762 7.9678 7.9678 8.3794 8.3794 8.8628 8.8628 9.0440 9.0440 9.4058 9.4058 10.3752 10.3752 10.8821 10.8821 11.0827 11.0827 11.2090 11.2090 13.6741 13.6741 15.2149 15.2149 15.6197 15.6197 16.0191 16.0191 16.1252 16.1252 16.4669 16.4669 k =-0.2409 0.4888 0.8940 ( 3201 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5459 -27.5459 -19.0088 -19.0088 -18.9845 -18.9845 -18.9316 -18.9316 -18.7157 -18.7157 0.2420 0.2420 0.4337 0.4337 0.8644 0.8644 5.3498 5.3498 6.5864 6.5864 7.0529 7.0529 7.9495 7.9495 8.3555 8.3555 8.8979 8.8979 8.9996 8.9996 9.4675 9.4675 10.3488 10.3488 10.8868 10.8868 11.0757 11.0757 11.2266 11.2266 13.6903 13.6903 15.2135 15.2135 15.6102 15.6102 16.0108 16.0108 16.0834 16.0834 16.4700 16.4700 k =-0.2334 0.4735 0.9063 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5955 -27.5955 -27.5459 -27.5459 -19.0089 -19.0089 -18.9845 -18.9845 -18.9316 -18.9316 -18.7158 -18.7158 0.2477 0.2477 0.4392 0.4392 0.8740 0.8740 5.2332 5.2332 6.6075 6.6075 7.1513 7.1513 7.9254 7.9254 8.3312 8.3312 8.9286 8.9286 8.9696 8.9696 9.5281 9.5281 10.3177 10.3177 10.8893 10.8893 11.0719 11.0719 11.2454 11.2454 13.7106 13.7106 15.2121 15.2121 15.5981 15.5981 15.9799 15.9799 16.0562 16.0562 16.4738 16.4738 k =-0.2259 0.4583 0.9186 ( 3203 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5459 -27.5459 -19.0090 -19.0090 -18.9846 -18.9846 -18.9318 -18.9318 -18.7158 -18.7158 0.2546 0.2546 0.4458 0.4458 0.8858 0.8858 5.1107 5.1107 6.6187 6.6187 7.2645 7.2645 7.8956 7.8956 8.3090 8.3090 8.9164 8.9164 8.9915 8.9915 9.5870 9.5870 10.2833 10.2833 10.8877 10.8877 11.0729 11.0729 11.2651 11.2651 13.7343 13.7343 15.2108 15.2108 15.5833 15.5833 15.9241 15.9241 16.0488 16.0488 16.4784 16.4784 k =-0.2184 0.4431 0.9310 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5954 -27.5954 -27.5459 -27.5459 -19.0090 -19.0090 -18.9846 -18.9846 -18.9318 -18.9318 -18.7158 -18.7158 0.2628 0.2628 0.4534 0.4534 0.8998 0.8998 4.9850 4.9850 6.6228 6.6228 7.3858 7.3858 7.8602 7.8602 8.2913 8.2913 8.8929 8.8929 9.0323 9.0323 9.6433 9.6433 10.2475 10.2475 10.8809 10.8809 11.0790 11.0790 11.2855 11.2855 13.7612 13.7612 15.2100 15.2100 15.5649 15.5649 15.8602 15.8602 16.0480 16.0480 16.4836 16.4836 k =-0.2109 0.4278 0.9433 ( 3192 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5954 -27.5954 -27.5459 -27.5459 -19.0090 -19.0090 -18.9847 -18.9847 -18.9320 -18.9320 -18.7158 -18.7158 0.2720 0.2720 0.4619 0.4619 0.9159 0.9159 4.8577 4.8577 6.6220 6.6220 7.5088 7.5088 7.8195 7.8195 8.2809 8.2809 8.8751 8.8751 9.0740 9.0740 9.6965 9.6965 10.2119 10.2119 10.8688 10.8688 11.0894 11.0894 11.3065 11.3065 13.7907 13.7907 15.2098 15.2098 15.5410 15.5410 15.7970 15.7970 16.0491 16.0491 16.4895 16.4895 k =-0.2034 0.4126 0.9556 ( 3196 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5955 -27.5955 -27.5460 -27.5460 -19.0091 -19.0091 -18.9847 -18.9847 -18.9322 -18.9322 -18.7158 -18.7158 0.2823 0.2823 0.4712 0.4712 0.9343 0.9343 4.7297 4.7297 6.6178 6.6178 7.6261 7.6261 7.7747 7.7747 8.2823 8.2823 8.8643 8.8643 9.1139 9.1139 9.7461 9.7461 10.1783 10.1783 10.8523 10.8523 11.1023 11.1023 11.3285 11.3285 13.8225 13.8225 15.2104 15.2104 15.5085 15.5085 15.7408 15.7408 16.0507 16.0507 16.4959 16.4959 k =-0.1959 0.3974 0.9679 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5955 -27.5955 -27.5460 -27.5460 -19.0092 -19.0092 -18.9848 -18.9848 -18.9324 -18.9324 -18.7159 -18.7159 0.2936 0.2936 0.4813 0.4813 0.9550 0.9550 4.6020 4.6020 6.6111 6.6111 7.7102 7.7102 7.7457 7.7457 8.3022 8.3022 8.8605 8.8605 9.1502 9.1502 9.7917 9.7917 10.1486 10.1486 10.8324 10.8324 11.1156 11.1156 11.3518 11.3518 13.8562 13.8562 15.2117 15.2117 15.4647 15.4647 15.6968 15.6968 16.0522 16.0522 16.5028 16.5028 k =-0.1884 0.3821 0.9802 ( 3196 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5956 -27.5956 -27.5460 -27.5460 -19.0093 -19.0093 -18.9849 -18.9849 -18.9326 -18.9326 -18.7159 -18.7159 0.3059 0.3059 0.4919 0.4919 0.9779 0.9779 4.4749 4.4749 6.6027 6.6027 7.6675 7.6675 7.8174 7.8174 8.3489 8.3489 8.8633 8.8633 9.1818 9.1818 9.8328 9.8328 10.1248 10.1248 10.8101 10.8101 11.1276 11.1276 11.3765 11.3765 13.8916 13.8916 15.2133 15.2133 15.4105 15.4105 15.6665 15.6665 16.0534 16.0534 16.5102 16.5102 k =-0.1809 0.3669 0.9925 ( 3200 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5956 -27.5956 -27.5460 -27.5460 -19.0094 -19.0094 -18.9850 -18.9850 -18.9328 -18.9328 -18.7159 -18.7159 0.3191 0.3191 0.5030 0.5030 1.0032 1.0032 4.3489 4.3489 6.5930 6.5930 7.6123 7.6123 7.8708 7.8708 8.4265 8.4265 8.8721 8.8721 9.2072 9.2072 9.8690 9.8690 10.1091 10.1091 10.7864 10.7864 11.1366 11.1366 11.4028 11.4028 13.9284 13.9284 15.2124 15.2124 15.3525 15.3525 15.6471 15.6471 16.0539 16.0539 16.5180 16.5180 k =-0.1734 0.3517 1.0049 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5957 -27.5957 -27.5460 -27.5460 -19.0094 -19.0094 -18.9851 -18.9851 -18.9331 -18.9331 -18.7159 -18.7159 0.3331 0.3331 0.5144 0.5144 1.0308 1.0308 4.2241 4.2241 6.5825 6.5825 7.5549 7.5549 7.8998 7.8998 8.5304 8.5304 8.8867 8.8867 9.2256 9.2256 9.8998 9.8998 10.1032 10.1032 10.7621 10.7621 11.1419 11.1419 11.4301 11.4301 13.9666 13.9666 15.1995 15.1995 15.3051 15.3051 15.6351 15.6351 16.0535 16.0535 16.5262 16.5262 k =-0.1658 0.3365 1.0172 ( 3192 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5957 -27.5957 -27.5460 -27.5460 -19.0094 -19.0094 -18.9852 -18.9852 -18.9333 -18.9333 -18.7158 -18.7158 0.3479 0.3479 0.5260 0.5260 1.0608 1.0608 4.1009 4.1009 6.5715 6.5715 7.4962 7.4962 7.9122 7.9122 8.6507 8.6507 8.9067 8.9067 9.2367 9.2367 9.9253 9.9253 10.1082 10.1082 10.7380 10.7380 11.1429 11.1429 11.4580 11.4580 14.0062 14.0062 15.1593 15.1593 15.2872 15.2872 15.6276 15.6276 16.0519 16.0519 16.5347 16.5347 k =-0.1583 0.3212 1.0295 ( 3202 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5958 -27.5958 -27.5460 -27.5460 -19.0096 -19.0096 -18.9854 -18.9854 -18.9337 -18.9337 -18.7159 -18.7159 0.3633 0.3633 0.5377 0.5377 1.0932 1.0932 3.9793 3.9793 6.5603 6.5603 7.4369 7.4369 7.9148 7.9148 8.7771 8.7771 8.9336 8.9336 9.2409 9.2409 9.9457 9.9457 10.1241 10.1241 10.7151 10.7151 11.1395 11.1395 11.4854 11.4854 14.0472 14.0472 15.1009 15.1009 15.2923 15.2923 15.6227 15.6227 16.0487 16.0487 16.5435 16.5435 k =-0.1508 0.3060 1.0418 ( 3206 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5959 -27.5959 -27.5461 -27.5461 -19.0097 -19.0097 -18.9855 -18.9855 -18.9340 -18.9340 -18.7159 -18.7159 0.3793 0.3793 0.5492 0.5492 1.1280 1.1280 3.8596 3.8596 6.5492 6.5492 7.3778 7.3778 7.9117 7.9117 8.8918 8.8918 8.9780 8.9780 9.2400 9.2400 9.9611 9.9611 10.1507 10.1507 10.6941 10.6941 11.1320 11.1320 11.5115 11.5115 14.0896 14.0896 15.0385 15.0385 15.3077 15.3077 15.6187 15.6187 16.0435 16.0435 16.5525 16.5525 k =-0.1433 0.2908 1.0541 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5959 -27.5959 -27.5461 -27.5461 -19.0098 -19.0098 -18.9856 -18.9856 -18.9342 -18.9342 -18.7159 -18.7159 0.3957 0.3957 0.5605 0.5605 1.1653 1.1653 3.7418 3.7418 6.5385 6.5385 7.3193 7.3193 7.9052 7.9052 8.9561 8.9561 9.0719 9.0719 9.2376 9.2376 9.9712 9.9712 10.1875 10.1875 10.6762 10.6762 11.1205 11.1205 11.5354 11.5354 14.1334 14.1334 14.9777 14.9777 15.3290 15.3290 15.6143 15.6143 16.0361 16.0361 16.5618 16.5618 k =-0.1358 0.2755 1.0665 ( 3206 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5960 -27.5960 -27.5461 -27.5461 -19.0098 -19.0098 -18.9857 -18.9857 -18.9345 -18.9345 -18.7159 -18.7159 0.4125 0.4125 0.5714 0.5714 1.2050 1.2050 3.6260 3.6260 6.5286 6.5286 7.2620 7.2620 7.8966 7.8966 8.9918 8.9918 9.1734 9.1734 9.2519 9.2519 9.9753 9.9753 10.2346 10.2346 10.6621 10.6621 11.1057 11.1057 11.5563 11.5563 14.1784 14.1784 14.9207 14.9207 15.3547 15.3547 15.6084 15.6084 16.0263 16.0263 16.5713 16.5713 k =-0.1283 0.2603 1.0788 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5961 -27.5961 -27.5461 -27.5461 -19.0099 -19.0099 -18.9859 -18.9859 -18.9348 -18.9348 -18.7159 -18.7159 0.4296 0.4296 0.5817 0.5817 1.2471 1.2471 3.5124 3.5124 6.5196 6.5196 7.2060 7.2060 7.8863 7.8863 9.0203 9.0203 9.2031 9.2031 9.3393 9.3393 9.9727 9.9727 10.2920 10.2920 10.6528 10.6528 11.0880 11.0880 11.5735 11.5735 14.2243 14.2243 14.8688 14.8688 15.3831 15.3831 15.6002 15.6002 16.0143 16.0143 16.5809 16.5809 k =-0.1208 0.2451 1.0911 ( 3196 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5961 -27.5961 -27.5460 -27.5460 -19.0099 -19.0099 -18.9860 -18.9860 -18.9350 -18.9350 -18.7158 -18.7158 0.4468 0.4468 0.5914 0.5914 1.2917 1.2917 3.4009 3.4009 6.5118 6.5118 7.1520 7.1520 7.8747 7.8747 9.0423 9.0423 9.2100 9.2100 9.4491 9.4491 9.9632 9.9632 10.3589 10.3589 10.6489 10.6489 11.0683 11.0683 11.5867 11.5867 14.2702 14.2702 14.8234 14.8234 15.4105 15.4105 15.5910 15.5910 16.0006 16.0006 16.5908 16.5908 k =-0.1133 0.2298 1.1034 ( 3193 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5960 -27.5960 -27.5460 -27.5460 -19.0100 -19.0100 -18.9860 -18.9860 -18.9352 -18.9352 -18.7158 -18.7158 0.4641 0.4641 0.6002 0.6002 1.3387 1.3387 3.2917 3.2917 6.5055 6.5055 7.1000 7.1000 7.8619 7.8619 9.0552 9.0552 9.2240 9.2240 9.5524 9.5524 9.9473 9.9473 10.4333 10.4333 10.6516 10.6516 11.0480 11.0480 11.5957 11.5957 14.3146 14.3146 14.7855 14.7855 15.4285 15.4285 15.5867 15.5867 15.9864 15.9864 16.6008 16.6008 k =-0.1058 0.2146 1.1157 ( 3189 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5460 -27.5460 -19.0100 -19.0100 -18.9861 -18.9861 -18.9354 -18.9354 -18.7158 -18.7158 0.4814 0.4814 0.6081 0.6081 1.3881 1.3881 3.1848 3.1848 6.5008 6.5008 7.0505 7.0505 7.8479 7.8479 9.0593 9.0593 9.2488 9.2488 9.6445 9.6445 9.9263 9.9263 10.5095 10.5095 10.6636 10.6636 11.0292 11.0292 11.6004 11.6004 14.3554 14.3554 14.7571 14.7571 15.4224 15.4224 15.5996 15.5996 15.9733 15.9733 16.6109 16.6109 k =-0.0983 0.1994 1.1280 ( 3193 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5461 -27.5461 -19.0101 -19.0101 -18.9863 -18.9863 -18.9357 -18.9357 -18.7158 -18.7158 0.4984 0.4984 0.6149 0.6149 1.4398 1.4398 3.0804 3.0804 6.4980 6.4980 7.0037 7.0037 7.8326 7.8326 9.0578 9.0578 9.2820 9.2820 9.7221 9.7221 9.9037 9.9037 10.5741 10.5741 10.6920 10.6920 11.0165 11.0165 11.6010 11.6010 14.3894 14.3894 14.7402 14.7402 15.3874 15.3874 15.6332 15.6332 15.9629 15.9629 16.6212 16.6212 k =-0.0908 0.1842 1.1404 ( 3193 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5461 -27.5461 -19.0102 -19.0102 -18.9864 -18.9864 -18.9359 -18.9359 -18.7158 -18.7158 0.5152 0.5152 0.6206 0.6206 1.4938 1.4938 2.9786 2.9786 6.4972 6.4972 6.9597 6.9597 7.8162 7.8162 9.0543 9.0543 9.3204 9.3204 9.7761 9.7761 9.8901 9.8901 10.6138 10.6138 10.7383 10.7383 11.0193 11.0193 11.5980 11.5980 14.4132 14.4132 14.7362 14.7362 15.3319 15.3319 15.6796 15.6796 15.9567 15.9567 16.6317 16.6317 k =-0.0833 0.1689 1.1527 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5461 -27.5461 -19.0102 -19.0102 -18.9865 -18.9865 -18.9361 -18.9361 -18.7157 -18.7157 0.5316 0.5316 0.6250 0.6250 1.5499 1.5499 2.8794 2.8794 6.4985 6.4985 6.9189 6.9189 7.7987 7.7987 9.0509 9.0509 9.3611 9.3611 9.7846 9.7846 9.9095 9.9095 10.6363 10.6363 10.7762 10.7762 11.0529 11.0529 11.5917 11.5917 14.4252 14.4252 14.7433 14.7433 15.2653 15.2653 15.7317 15.7317 15.9561 15.9561 16.6424 16.6424 k =-0.0758 0.1537 1.1650 ( 3197 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5461 -27.5461 -19.0103 -19.0103 -18.9867 -18.9867 -18.9363 -18.9363 -18.7158 -18.7158 0.5475 0.5475 0.6281 0.6281 1.6081 1.6081 2.7832 2.7832 6.5021 6.5021 6.8813 6.8813 7.7803 7.7803 9.0489 9.0489 9.4018 9.4018 9.7607 9.7607 9.9518 9.9518 10.6525 10.6525 10.7876 10.7876 11.1219 11.1219 11.5829 11.5829 14.4270 14.4270 14.7537 14.7537 15.1978 15.1978 15.7849 15.7849 15.9626 15.9626 16.6534 16.6534 k =-0.0683 0.1385 1.1773 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5461 -27.5461 -19.0103 -19.0103 -18.9867 -18.9867 -18.9364 -18.9364 -18.7158 -18.7158 0.5627 0.5627 0.6299 0.6299 1.6679 1.6679 2.6901 2.6901 6.5080 6.5080 6.8472 6.8472 7.7612 7.7612 9.0489 9.0489 9.4394 9.4394 9.7297 9.7297 9.9954 9.9954 10.6653 10.6653 10.7809 10.7809 11.2111 11.2111 11.5721 11.5721 14.4221 14.4221 14.7533 14.7533 15.1436 15.1436 15.8350 15.8350 15.9788 15.9788 16.6647 16.6647 k =-0.0607 0.1232 1.1896 ( 3194 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5963 -27.5963 -27.5461 -27.5461 -19.0103 -19.0103 -18.9868 -18.9868 -18.9366 -18.9366 -18.7157 -18.7157 0.5772 0.5772 0.6302 0.6302 1.7289 1.7289 2.6006 2.6006 6.5162 6.5162 6.8167 6.8167 7.7416 7.7416 9.0511 9.0511 9.4688 9.4688 9.7030 9.7030 10.0348 10.0348 10.6745 10.6745 10.7686 10.7686 11.3054 11.3054 11.5600 11.5600 14.4137 14.4137 14.7273 14.7273 15.1172 15.1172 15.8778 15.8778 16.0070 16.0070 16.6761 16.6761 k =-0.0607 0.1232 1.1896 ( 3194 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5963 -27.5963 -27.5461 -27.5461 -19.0103 -19.0103 -18.9868 -18.9868 -18.9366 -18.9366 -18.7157 -18.7157 0.5772 0.5772 0.6302 0.6302 1.7289 1.7289 2.6006 2.6006 6.5162 6.5162 6.8167 6.8167 7.7416 7.7416 9.0511 9.0511 9.4688 9.4688 9.7030 9.7030 10.0348 10.0348 10.6745 10.6745 10.7686 10.7686 11.3054 11.3054 11.5600 11.5600 14.4137 14.4137 14.7273 14.7273 15.1172 15.1172 15.8778 15.8778 16.0070 16.0070 16.6761 16.6761 k =-0.0521 0.1056 1.1896 ( 3196 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5964 -27.5964 -27.5462 -27.5462 -19.0107 -19.0107 -18.9872 -18.9872 -18.9369 -18.9369 -18.7157 -18.7157 0.5966 0.5966 0.6294 0.6294 1.7745 1.7745 2.5428 2.5428 6.5269 6.5269 6.7817 6.7817 7.7029 7.7029 9.0648 9.0648 9.4879 9.4879 9.6824 9.6824 10.0585 10.0585 10.6815 10.6815 10.7645 10.7645 11.3727 11.3727 11.5452 11.5452 14.4084 14.4084 14.6708 14.6708 15.1402 15.1402 15.9268 15.9268 16.0505 16.0505 16.6865 16.6865 k =-0.0434 0.0880 1.1896 ( 3200 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5965 -27.5965 -27.5463 -27.5463 -19.0111 -19.0111 -18.9876 -18.9876 -18.9372 -18.9372 -18.7156 -18.7156 0.6124 0.6124 0.6293 0.6293 1.8195 1.8195 2.4877 2.4877 6.5374 6.5374 6.7517 6.7517 7.6679 7.6679 9.0779 9.0779 9.5050 9.5050 9.6647 9.6647 10.0772 10.0772 10.6802 10.6802 10.7672 10.7672 11.4350 11.4350 11.5320 11.5320 14.4035 14.4035 14.6124 14.6124 15.1685 15.1685 15.9704 15.9704 16.0976 16.0976 16.6933 16.6933 k =-0.0347 0.0704 1.1896 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5966 -27.5966 -27.5465 -27.5465 -19.0114 -19.0114 -18.9879 -18.9879 -18.9374 -18.9374 -18.7156 -18.7156 0.6217 0.6217 0.6330 0.6330 1.8628 1.8628 2.4362 2.4362 6.5470 6.5470 6.7269 6.7269 7.6378 7.6378 9.0895 9.0895 9.5198 9.5198 9.6499 9.6499 10.0913 10.0913 10.6742 10.6742 10.7739 10.7739 11.4892 11.4892 11.5211 11.5211 14.3994 14.3994 14.5580 14.5580 15.1965 15.1965 16.0064 16.0064 16.1495 16.1495 16.6894 16.6894 k =-0.0260 0.0528 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5465 -27.5465 -19.0117 -19.0117 -18.9881 -18.9881 -18.9376 -18.9376 -18.7156 -18.7156 0.6234 0.6234 0.6414 0.6414 1.9028 1.9028 2.3900 2.3900 6.5553 6.5553 6.7074 6.7074 7.6133 7.6133 9.0993 9.0993 9.5318 9.5318 9.6383 9.6383 10.1014 10.1014 10.6673 10.6673 10.7813 10.7813 11.5102 11.5102 11.5362 11.5362 14.3964 14.3964 14.5116 14.5116 15.2211 15.2211 16.0338 16.0338 16.2057 16.2057 16.6555 16.6555 k =-0.0174 0.0352 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5466 -27.5466 -19.0118 -19.0118 -18.9882 -18.9882 -18.9377 -18.9377 -18.7156 -18.7156 0.6234 0.6234 0.6487 0.6487 1.9368 1.9368 2.3515 2.3515 6.5617 6.5617 6.6934 6.6934 7.5951 7.5951 9.1066 9.1066 9.5408 9.5408 9.6300 9.6300 10.1080 10.1080 10.6615 10.6615 10.7874 10.7874 11.5040 11.5040 11.5693 11.5693 14.3948 14.3948 14.4759 14.4759 15.2400 15.2400 16.0528 16.0528 16.2633 16.2633 16.5991 16.5991 k =-0.0087 0.0176 1.1896 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0119 -19.0119 -18.9883 -18.9883 -18.9378 -18.9378 -18.7156 -18.7156 0.6232 0.6232 0.6533 0.6533 1.9607 1.9607 2.3250 2.3250 6.5658 6.5658 6.6849 6.6849 7.5840 7.5840 9.1111 9.1111 9.5463 9.5463 9.6249 9.6249 10.1118 10.1118 10.6577 10.6577 10.7914 10.7914 11.5000 11.5000 11.5900 11.5900 14.3946 14.3946 14.4529 14.4529 15.2519 15.2519 16.0639 16.0639 16.3148 16.3148 16.5454 16.5454 k = 0.0000 0.0000 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0119 -19.0119 -18.9884 -18.9884 -18.9378 -18.9378 -18.7155 -18.7155 0.6232 0.6232 0.6548 0.6548 1.9695 1.9695 2.3153 2.3153 6.5672 6.5672 6.6821 6.6821 7.5803 7.5803 9.1126 9.1126 9.5482 9.5482 9.6232 9.6232 10.1130 10.1130 10.6565 10.6565 10.7927 10.7927 11.4987 11.4987 11.5971 11.5971 14.3949 14.3949 14.4447 14.4447 15.2559 15.2559 16.0676 16.0676 16.3393 16.3393 16.5199 16.5199 k = 0.0000 0.0000 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0119 -19.0119 -18.9884 -18.9884 -18.9378 -18.9378 -18.7155 -18.7155 0.6232 0.6232 0.6548 0.6548 1.9695 1.9695 2.3153 2.3153 6.5672 6.5672 6.6821 6.6821 7.5803 7.5803 9.1126 9.1126 9.5482 9.5482 9.6232 9.6232 10.1130 10.1130 10.6565 10.6565 10.7927 10.7927 11.4987 11.4987 11.5971 11.5971 14.3949 14.3949 14.4447 14.4447 15.2559 15.2559 16.0676 16.0676 16.3393 16.3393 16.5199 16.5199 k = 0.0179 0.0088 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0120 -19.0120 -18.9883 -18.9883 -18.9378 -18.9378 -18.7155 -18.7155 0.6233 0.6233 0.6547 0.6547 1.9695 1.9695 2.3153 2.3153 6.5491 6.5491 6.7029 6.7029 7.5804 7.5804 9.0972 9.0972 9.5374 9.5374 9.6476 9.6476 10.1141 10.1141 10.6569 10.6569 10.7928 10.7928 11.4966 11.4966 11.5965 11.5965 14.3876 14.3876 14.4520 14.4520 15.2564 15.2564 16.0689 16.0689 16.3375 16.3375 16.5222 16.5222 k = 0.0357 0.0176 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0120 -19.0120 -18.9883 -18.9883 -18.9378 -18.9378 -18.7155 -18.7155 0.6235 0.6235 0.6544 0.6544 1.9695 1.9695 2.3153 2.3153 6.5129 6.5129 6.7469 6.7469 7.5807 7.5807 9.0552 9.0552 9.5216 9.5216 9.7001 9.7001 10.1174 10.1174 10.6583 10.6583 10.7931 10.7931 11.4903 11.4903 11.5949 11.5949 14.3722 14.3722 14.4672 14.4672 15.2579 15.2579 16.0728 16.0728 16.3326 16.3326 16.5287 16.5287 k = 0.0536 0.0264 1.1896 ( 3210 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0121 -19.0121 -18.9882 -18.9882 -18.9379 -18.9379 -18.7156 -18.7156 0.6240 0.6240 0.6540 0.6540 1.9696 1.9696 2.3154 2.3154 6.4737 6.4737 6.7991 6.7991 7.5812 7.5812 8.9948 8.9948 9.5088 9.5088 9.7642 9.7642 10.1229 10.1229 10.6606 10.6606 10.7935 10.7935 11.4800 11.4800 11.5923 11.5923 14.3545 14.3545 14.4846 14.4846 15.2605 15.2605 16.0785 16.0785 16.3256 16.3256 16.5384 16.5384 k = 0.0714 0.0352 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0121 -19.0121 -18.9881 -18.9881 -18.9379 -18.9379 -18.7155 -18.7155 0.6246 0.6246 0.6533 0.6533 1.9696 1.9696 2.3154 2.3154 6.4357 6.4357 6.8551 6.8551 7.5818 7.5818 8.9239 8.9239 9.4983 9.4983 9.8326 9.8326 10.1309 10.1309 10.6640 10.6640 10.7940 10.7940 11.4657 11.4657 11.5889 11.5889 14.3366 14.3366 14.5023 14.5023 15.2641 15.2641 16.0853 16.0853 16.3177 16.3177 16.5500 16.5500 k = 0.0893 0.0440 1.1896 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5466 -27.5466 -19.0122 -19.0122 -18.9880 -18.9880 -18.9380 -18.9380 -18.7155 -18.7155 0.6253 0.6253 0.6526 0.6526 1.9697 1.9697 2.3154 2.3154 6.4001 6.4001 6.9130 6.9130 7.5827 7.5827 8.8474 8.8474 9.4891 9.4891 9.9009 9.9009 10.1417 10.1417 10.6684 10.6684 10.7947 10.7947 11.4477 11.4477 11.5848 11.5848 14.3190 14.3190 14.5195 14.5195 15.2689 15.2689 16.0920 16.0920 16.3100 16.3100 16.5619 16.5619 k = 0.1071 0.0528 1.1896 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0123 -19.0123 -18.9878 -18.9878 -18.9381 -18.9381 -18.7154 -18.7154 0.6263 0.6263 0.6516 0.6516 1.9698 1.9698 2.3155 2.3155 6.3676 6.3676 6.9719 6.9719 7.5837 7.5837 8.7689 8.7689 9.4806 9.4806 9.9648 9.9648 10.1565 10.1565 10.6741 10.6741 10.7954 10.7954 11.4263 11.4263 11.5803 11.5803 14.3024 14.3024 14.5358 14.5358 15.2749 15.2749 16.0978 16.0978 16.3036 16.3036 16.5730 16.5730 k = 0.1250 0.0616 1.1896 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0124 -19.0124 -18.9877 -18.9877 -18.9381 -18.9381 -18.7155 -18.7155 0.6273 0.6273 0.6505 0.6505 1.9698 1.9698 2.3155 2.3155 6.3385 6.3385 7.0307 7.0307 7.5849 7.5849 8.6909 8.6909 9.4726 9.4726 10.0198 10.0198 10.1774 10.1774 10.6812 10.6812 10.7962 10.7962 11.4021 11.4021 11.5756 11.5756 14.2870 14.2870 14.5509 14.5509 15.2818 15.2818 16.1016 16.1016 16.2991 16.2991 16.5820 16.5820 k = 0.1429 0.0704 1.1896 ( 3202 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0125 -19.0125 -18.9875 -18.9875 -18.9382 -18.9382 -18.7154 -18.7154 0.6284 0.6284 0.6494 0.6494 1.9699 1.9699 2.3156 2.3156 6.3130 6.3130 7.0881 7.0881 7.5861 7.5861 8.6155 8.6155 9.4652 9.4652 10.0615 10.0615 10.2066 10.2066 10.6897 10.6897 10.7970 10.7970 11.3758 11.3758 11.5709 11.5709 14.2730 14.2730 14.5645 14.5645 15.2895 15.2895 16.1032 16.1032 16.2967 16.2967 16.5883 16.5883 k = 0.1607 0.0792 1.1896 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5969 -27.5969 -27.5465 -27.5465 -19.0126 -19.0126 -18.9874 -18.9874 -18.9383 -18.9383 -18.7154 -18.7154 0.6297 0.6297 0.6481 0.6481 1.9700 1.9700 2.3156 2.3156 6.2912 6.2912 7.1427 7.1427 7.5876 7.5876 8.5447 8.5447 9.4585 9.4585 10.0894 10.0894 10.2426 10.2426 10.6997 10.6997 10.7977 10.7977 11.3483 11.3483 11.5665 11.5665 14.2608 14.2608 14.5765 14.5765 15.2973 15.2973 16.1027 16.1027 16.2962 16.2962 16.5919 16.5919 k = 0.1786 0.0880 1.1896 ( 3202 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0127 -19.0127 -18.9872 -18.9872 -18.9383 -18.9383 -18.7154 -18.7154 0.6309 0.6309 0.6469 0.6469 1.9701 1.9701 2.3157 2.3157 6.2732 6.2732 7.1926 7.1926 7.5891 7.5891 8.4809 8.4809 9.4527 9.4527 10.1069 10.1069 10.2800 10.2800 10.7110 10.7110 10.7984 10.7984 11.3213 11.3213 11.5625 11.5625 14.2505 14.2505 14.5866 14.5866 15.3050 15.3050 16.1007 16.1007 16.2969 16.2969 16.5932 16.5932 k = 0.1964 0.0968 1.1896 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9870 -18.9870 -18.9383 -18.9383 -18.7154 -18.7154 0.6321 0.6321 0.6456 0.6456 1.9701 1.9701 2.3157 2.3157 6.2592 6.2592 7.2356 7.2356 7.5907 7.5907 8.4265 8.4265 9.4480 9.4480 10.1181 10.1181 10.3130 10.3130 10.7227 10.7227 10.7989 10.7989 11.2964 11.2964 11.5592 11.5592 14.2424 14.2424 14.5946 14.5946 15.3119 15.3119 16.0981 16.0981 16.2982 16.2982 16.5931 16.5931 k = 0.2143 0.1056 1.1896 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6332 0.6332 0.6445 0.6445 1.9702 1.9702 2.3158 2.3158 6.2491 6.2491 7.2690 7.2690 7.5921 7.5921 8.3845 8.3845 9.4445 9.4445 10.1251 10.1251 10.3382 10.3382 10.7334 10.7334 10.7993 10.7993 11.2759 11.2759 11.5568 11.5568 14.2364 14.2364 14.6004 14.6004 15.3173 15.3173 16.0956 16.0956 16.2996 16.2996 16.5923 16.5923 k = 0.2321 0.1144 1.1896 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6340 0.6340 0.6437 0.6437 1.9702 1.9702 2.3158 2.3158 6.2430 6.2430 7.2903 7.2903 7.5932 7.5932 8.3578 8.3578 9.4424 9.4424 10.1290 10.1290 10.3538 10.3538 10.7411 10.7411 10.7996 10.7996 11.2623 11.2623 11.5552 11.5552 14.2328 14.2328 14.6040 14.6040 15.3207 15.3207 16.0938 16.0938 16.3006 16.3006 16.5914 16.5914 k = 0.2500 0.1232 1.1896 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6344 0.6344 0.6434 0.6434 1.9702 1.9702 2.3158 2.3158 6.2410 6.2410 7.2977 7.2977 7.5936 7.5936 8.3486 8.3486 9.4417 9.4417 10.1302 10.1302 10.3590 10.3590 10.7439 10.7439 10.7997 10.7997 11.2575 11.2575 11.5547 11.5547 14.2316 14.2316 14.6052 14.6052 15.3219 15.3219 16.0931 16.0931 16.3010 16.3010 16.5911 16.5911 k = 0.2500 0.1232 1.1896 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6344 0.6344 0.6434 0.6434 1.9702 1.9702 2.3158 2.3158 6.2410 6.2410 7.2977 7.2977 7.5936 7.5936 8.3486 8.3486 9.4417 9.4417 10.1302 10.1302 10.3590 10.3590 10.7439 10.7439 10.7997 10.7997 11.2575 11.2575 11.5547 11.5547 14.2316 14.2316 14.6052 14.6052 15.3219 15.3219 16.0931 16.0931 16.3010 16.3010 16.5911 16.5911 k = 0.2426 0.1381 1.1776 ( 3200 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6335 0.6335 0.6429 0.6429 1.9540 1.9540 2.3342 2.3342 6.2425 6.2425 7.2998 7.2998 7.5912 7.5912 8.3531 8.3531 9.4369 9.4369 10.1284 10.1284 10.3574 10.3574 10.7459 10.7459 10.8008 10.8008 11.2601 11.2601 11.5422 11.5422 14.2366 14.2366 14.6110 14.6110 15.3111 15.3111 16.0927 16.0927 16.3092 16.3092 16.5908 16.5908 k = 0.2353 0.1531 1.1655 ( 3200 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9383 -18.9383 -18.7154 -18.7154 0.6311 0.6311 0.6416 0.6416 1.9131 1.9131 2.3820 2.3820 6.2471 6.2471 7.3061 7.3061 7.5840 7.5840 8.3666 8.3666 9.4230 9.4230 10.1230 10.1230 10.3523 10.3523 10.7510 10.7510 10.8047 10.8047 11.2676 11.2676 11.5056 11.5056 14.2506 14.2506 14.6285 14.6285 15.2803 15.2803 16.0919 16.0919 16.3311 16.3311 16.5904 16.5904 k = 0.2279 0.1680 1.1534 ( 3200 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9383 -18.9383 -18.7154 -18.7154 0.6273 0.6273 0.6394 0.6394 1.8594 1.8594 2.4470 2.4470 6.2547 6.2547 7.3165 7.3165 7.5729 7.5729 8.3883 8.3883 9.4005 9.4005 10.1143 10.1143 10.3439 10.3439 10.7569 10.7569 10.8126 10.8126 11.2794 11.2794 11.4476 11.4476 14.2710 14.2710 14.6578 14.6578 15.2337 15.2337 16.0909 16.0909 16.3598 16.3598 16.5916 16.5916 k = 0.2206 0.1829 1.1414 ( 3200 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0127 -19.0127 -18.9869 -18.9869 -18.9382 -18.9382 -18.7154 -18.7154 0.6220 0.6220 0.6361 0.6361 1.8004 1.8004 2.5220 2.5220 6.2652 6.2652 7.3307 7.3307 7.5589 7.5589 8.4174 8.4174 9.3705 9.3705 10.1025 10.1025 10.3321 10.3321 10.7614 10.7614 10.8247 10.8247 11.2934 11.2934 11.3734 11.3734 14.2948 14.2948 14.6984 14.6984 15.1765 15.1765 16.0900 16.0900 16.3851 16.3851 16.5977 16.5977 k = 0.2132 0.1978 1.1293 ( 3202 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5465 -27.5465 -19.0126 -19.0126 -18.9870 -18.9870 -18.9381 -18.9381 -18.7153 -18.7153 0.6156 0.6156 0.6318 0.6318 1.7394 1.7394 2.6034 2.6034 6.2786 6.2786 7.3483 7.3483 7.5433 7.5433 8.4528 8.4528 9.3338 9.3338 10.0880 10.0880 10.3169 10.3169 10.7636 10.7636 10.8382 10.8382 11.2738 11.2738 11.3240 11.3240 14.3192 14.3192 14.7477 14.7477 15.1144 15.1144 16.0890 16.0890 16.3964 16.3964 16.6130 16.6130 k = 0.2059 0.2127 1.1172 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5465 -27.5465 -19.0125 -19.0125 -18.9870 -18.9870 -18.9380 -18.9380 -18.7153 -18.7153 0.6080 0.6080 0.6265 0.6265 1.6784 1.6784 2.6894 2.6894 6.2947 6.2947 7.3681 7.3681 7.5279 7.5279 8.4936 8.4936 9.2918 9.2918 10.0711 10.0711 10.2985 10.2985 10.7627 10.7627 10.8464 10.8464 11.1879 11.1879 11.3405 11.3405 14.3428 14.3428 14.7995 14.7995 15.0551 15.0551 16.0876 16.0876 16.3881 16.3881 16.6371 16.6371 k = 0.1985 0.2276 1.1052 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5464 -27.5464 -19.0124 -19.0124 -18.9871 -18.9871 -18.9378 -18.9378 -18.7153 -18.7153 0.5993 0.5993 0.6201 0.6201 1.6183 1.6183 2.7791 2.7791 6.3135 6.3135 7.3879 7.3879 7.5161 7.5161 8.5386 8.5386 9.2453 9.2453 10.0523 10.0523 10.2771 10.2771 10.7536 10.7536 10.8391 10.8391 11.1121 11.1121 11.3626 11.3626 14.3649 14.3649 14.8370 14.8370 15.0154 15.0154 16.0856 16.0856 16.3627 16.3627 16.6631 16.6631 k = 0.1912 0.2426 1.0931 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5464 -27.5464 -19.0123 -19.0123 -18.9871 -18.9871 -18.9377 -18.9377 -18.7153 -18.7153 0.5897 0.5897 0.6129 0.6129 1.5595 1.5595 2.8720 2.8720 6.3347 6.3347 7.4026 7.4026 7.5132 7.5132 8.5871 8.5871 9.1954 9.1954 10.0318 10.0318 10.2530 10.2530 10.7139 10.7139 10.8190 10.8190 11.0708 11.0708 11.3858 11.3858 14.3847 14.3847 14.8302 14.8302 15.0251 15.0251 16.0823 16.0823 16.3257 16.3257 16.6841 16.6841 k = 0.1838 0.2575 1.0811 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5464 -27.5464 -19.0121 -19.0121 -18.9872 -18.9872 -18.9375 -18.9375 -18.7152 -18.7152 0.5793 0.5793 0.6048 0.6048 1.5023 1.5023 2.9677 2.9677 6.3582 6.3582 7.4061 7.4061 7.5261 7.5261 8.6380 8.6380 9.1427 9.1427 10.0098 10.0098 10.2267 10.2267 10.6226 10.6226 10.8103 10.8103 11.0624 11.0624 11.4089 11.4089 14.4010 14.4010 14.7901 14.7901 15.0741 15.0741 16.0767 16.0767 16.2827 16.2827 16.6974 16.6974 k = 0.1765 0.2724 1.0690 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5464 -27.5464 -19.0120 -19.0120 -18.9872 -18.9872 -18.9373 -18.9373 -18.7152 -18.7152 0.5681 0.5681 0.5959 0.5959 1.4469 1.4469 3.0660 3.0660 6.3838 6.3838 7.3991 7.3991 7.5542 7.5542 8.6904 8.6904 9.0880 9.0880 9.9866 9.9866 10.1983 10.1983 10.4999 10.4999 10.8114 10.8114 11.0690 11.0690 11.4310 11.4310 14.4108 14.4108 14.7473 14.7473 15.1341 15.1341 16.0670 16.0670 16.2393 16.2393 16.7044 16.7044 k = 0.1691 0.2873 1.0569 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5464 -27.5464 -19.0118 -19.0118 -18.9873 -18.9873 -18.9371 -18.9371 -18.7151 -18.7151 0.5562 0.5562 0.5863 0.5863 1.3935 1.3935 3.1669 3.1669 6.4111 6.4111 7.3873 7.3873 7.5923 7.5923 8.7429 8.7429 9.0321 9.0321 9.9620 9.9620 10.1683 10.1683 10.3643 10.3643 10.8165 10.8165 11.0793 11.0793 11.4514 11.4514 14.4096 14.4096 14.7171 14.7171 15.1945 15.1945 16.0504 16.0504 16.2014 16.2014 16.7077 16.7077 k = 0.1618 0.3022 1.0449 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5463 -27.5463 -19.0116 -19.0116 -18.9875 -18.9875 -18.9368 -18.9368 -18.7150 -18.7150 0.5438 0.5438 0.5762 0.5762 1.3422 1.3422 3.2701 3.2701 6.4399 6.4399 7.3742 7.3742 7.6370 7.6370 8.7930 8.7930 8.9769 8.9769 9.9359 9.9359 10.1355 10.1355 10.2255 10.2255 10.8237 10.8237 11.0880 11.0880 11.4695 11.4695 14.3930 14.3930 14.7075 14.7075 15.2515 15.2515 16.0248 16.0248 16.1735 16.1735 16.7093 16.7093 k = 0.1544 0.3172 1.0328 ( 3206 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5463 -27.5463 -19.0114 -19.0114 -18.9875 -18.9875 -18.9365 -18.9365 -18.7150 -18.7150 0.5310 0.5310 0.5655 0.5655 1.2929 1.2929 3.3756 3.3756 6.4698 6.4698 7.3619 7.3619 7.6865 7.6865 8.8297 8.8297 8.9324 8.9324 9.9061 9.9061 10.0695 10.0695 10.1210 10.1210 10.8325 10.8325 11.0925 11.0925 11.4848 11.4848 14.3620 14.3620 14.7194 14.7194 15.3037 15.3037 15.9914 15.9914 16.1563 16.1563 16.7100 16.7100 k = 0.1471 0.3321 1.0207 ( 3208 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5966 -27.5966 -27.5463 -27.5463 -19.0112 -19.0112 -18.9876 -18.9876 -18.9363 -18.9363 -18.7149 -18.7149 0.5178 0.5178 0.5545 0.5545 1.2459 1.2459 3.4833 3.4833 6.5004 6.5004 7.3515 7.3515 7.7400 7.7400 8.8137 8.8137 8.9363 8.9363 9.8601 9.8601 9.9536 9.9536 10.0839 10.0839 10.8425 10.8425 11.0911 11.0911 11.4969 11.4969 14.3219 14.3219 14.7486 14.7486 15.3505 15.3505 15.9547 15.9547 16.1466 16.1466 16.7105 16.7105 k = 0.1397 0.3470 1.0087 ( 3204 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5966 -27.5966 -27.5462 -27.5462 -19.0110 -19.0110 -18.9877 -18.9877 -18.9360 -18.9360 -18.7148 -18.7148 0.5045 0.5045 0.5431 0.5431 1.2010 1.2010 3.5931 3.5931 6.5313 6.5313 7.3435 7.3435 7.7968 7.7968 8.7560 8.7560 8.9756 8.9756 9.7600 9.7600 9.8894 9.8894 10.0540 10.0540 10.8535 10.8535 11.0829 11.0829 11.5054 11.5054 14.2778 14.2778 14.7905 14.7905 15.3917 15.3917 15.9188 15.9188 16.1413 16.1413 16.7110 16.7110 k = 0.1324 0.3619 0.9966 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5965 -27.5965 -27.5462 -27.5462 -19.0108 -19.0108 -18.9878 -18.9878 -18.9356 -18.9356 -18.7147 -18.7147 0.4910 0.4910 0.5316 0.5316 1.1583 1.1583 3.7050 3.7050 6.5619 6.5619 7.3387 7.3387 7.8564 7.8564 8.6859 8.6859 9.0187 9.0187 9.6336 9.6336 9.8573 9.8573 10.0266 10.0266 10.8655 10.8655 11.0673 11.0673 11.5103 11.5103 14.2328 14.2328 14.8421 14.8421 15.4274 15.4274 15.8864 15.8864 16.1386 16.1386 16.7116 16.7116 k = 0.1250 0.3768 0.9845 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5965 -27.5965 -27.5461 -27.5461 -19.0106 -19.0106 -18.9879 -18.9879 -18.9353 -18.9353 -18.7147 -18.7147 0.4776 0.4776 0.5200 0.5200 1.1179 1.1179 3.8189 3.8189 6.5917 6.5917 7.3376 7.3376 7.9182 7.9182 8.6076 8.6076 9.0583 9.0583 9.5098 9.5098 9.8328 9.8328 10.0019 10.0019 10.8782 10.8782 11.0442 11.0442 11.5115 11.5115 14.1886 14.1886 14.9012 14.9012 15.4580 15.4580 15.8592 15.8592 16.1375 16.1375 16.7121 16.7121 k = 0.1176 0.3917 0.9725 ( 3192 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5964 -27.5964 -27.5461 -27.5461 -19.0104 -19.0104 -18.9879 -18.9879 -18.9350 -18.9350 -18.7146 -18.7146 0.4643 0.4643 0.5084 0.5084 1.0797 1.0797 3.9347 3.9347 6.6201 6.6201 7.3407 7.3407 7.9817 7.9817 8.5208 8.5208 9.0913 9.0913 9.3956 9.3956 9.8125 9.8125 9.9801 9.9801 10.8914 10.8914 11.0139 11.0139 11.5093 11.5093 14.1460 14.1460 14.9664 14.9664 15.4837 15.4837 15.8379 15.8379 16.1376 16.1376 16.7125 16.7125 k = 0.1103 0.4067 0.9604 ( 3194 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5963 -27.5963 -27.5461 -27.5461 -19.0102 -19.0102 -18.9880 -18.9880 -18.9347 -18.9347 -18.7146 -18.7146 0.4513 0.4513 0.4970 0.4970 1.0438 1.0438 4.0522 4.0522 6.6465 6.6465 7.3482 7.3482 8.0460 8.0460 8.4245 8.4245 9.1152 9.1152 9.2947 9.2947 9.7966 9.7966 9.9620 9.9620 10.9031 10.9031 10.9782 10.9782 11.5037 11.5037 14.1054 14.1054 15.0363 15.0363 15.5053 15.5053 15.8231 15.8231 16.1384 16.1384 16.7128 16.7128 k = 0.1029 0.4216 0.9483 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5963 -27.5963 -27.5462 -27.5462 -19.0100 -19.0100 -18.9881 -18.9881 -18.9344 -18.9344 -18.7146 -18.7146 0.4385 0.4385 0.4858 0.4858 1.0102 1.0102 4.1714 4.1714 6.6706 6.6706 7.3605 7.3605 8.1100 8.1100 8.3187 8.3187 9.1270 9.1270 9.2107 9.2107 9.7855 9.7855 9.9482 9.9482 10.9009 10.9009 10.9500 10.9500 11.4952 11.4952 14.0668 14.0668 15.1092 15.1092 15.5238 15.5238 15.8150 15.8150 16.1398 16.1398 16.7128 16.7128 k = 0.0956 0.4365 0.9363 ( 3202 PWs) bands (ev): -54.6716 -54.6716 -54.6513 -54.6513 -27.5963 -27.5963 -27.5462 -27.5462 -19.0098 -19.0098 -18.9882 -18.9882 -18.9342 -18.9342 -18.7146 -18.7146 0.4263 0.4263 0.4749 0.4749 0.9788 0.9788 4.2922 4.2922 6.6919 6.6919 7.3778 7.3778 8.1680 8.1680 8.2081 8.2081 9.1161 9.1161 9.1546 9.1546 9.7790 9.7790 9.9394 9.9394 10.8610 10.8610 10.9534 10.9534 11.4840 11.4840 14.0302 14.0302 15.1828 15.1828 15.5408 15.5408 15.8135 15.8135 16.1418 16.1418 16.7125 16.7125 k = 0.0882 0.4514 0.9242 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5962 -27.5962 -27.5461 -27.5461 -19.0096 -19.0096 -18.9883 -18.9883 -18.9339 -18.9339 -18.7145 -18.7145 0.4145 0.4145 0.4644 0.4644 0.9498 0.9498 4.4143 4.4143 6.7102 6.7102 7.3998 7.3998 8.0761 8.0761 8.2362 8.2362 9.0756 9.0756 9.1340 9.1340 9.7758 9.7758 9.9368 9.9368 10.8034 10.8034 10.9689 10.9689 11.4708 11.4708 13.9954 13.9954 15.2540 15.2540 15.5584 15.5584 15.8187 15.8187 16.1443 16.1443 16.7117 16.7117 k = 0.0809 0.4663 0.9121 ( 3198 PWs) bands (ev): -54.6716 -54.6716 -54.6513 -54.6513 -27.5962 -27.5962 -27.5461 -27.5461 -19.0094 -19.0094 -18.9884 -18.9884 -18.9337 -18.9337 -18.7144 -18.7144 0.4034 0.4034 0.4544 0.4544 0.9231 0.9231 4.5374 4.5374 6.7255 6.7255 7.4262 7.4262 7.9460 7.9460 8.2912 8.2912 9.0420 9.0420 9.1141 9.1141 9.7741 9.7741 9.9407 9.9407 10.7380 10.7380 10.9873 10.9873 11.4558 11.4558 13.9624 13.9624 15.3185 15.3185 15.5792 15.5792 15.8312 15.8312 16.1473 16.1473 16.7104 16.7104 k = 0.0735 0.4812 0.9001 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5963 -27.5963 -27.5461 -27.5461 -19.0093 -19.0093 -18.9885 -18.9885 -18.9335 -18.9335 -18.7144 -18.7144 0.3929 0.3929 0.4449 0.4449 0.8986 0.8986 4.6614 4.6614 6.7381 6.7381 7.4565 7.4565 7.8109 7.8109 8.3395 8.3395 9.0244 9.0244 9.0882 9.0882 9.7724 9.7724 9.9509 9.9509 10.6669 10.6669 11.0070 11.0070 11.4395 11.4395 13.9311 13.9311 15.3715 15.3715 15.6052 15.6052 15.8523 15.8523 16.1508 16.1508 16.7085 16.7085 k = 0.0662 0.4962 0.8880 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5963 -27.5963 -27.5461 -27.5461 -19.0091 -19.0091 -18.9885 -18.9885 -18.9333 -18.9333 -18.7143 -18.7143 0.3833 0.3833 0.4362 0.4362 0.8765 0.8765 4.7858 4.7858 6.7481 6.7481 7.4897 7.4897 7.6730 7.6730 8.3787 8.3787 9.0215 9.0215 9.0601 9.0601 9.7698 9.7698 9.9663 9.9663 10.5913 10.5913 11.0277 11.0277 11.4223 11.4223 13.9015 13.9015 15.4103 15.4103 15.6352 15.6352 15.8840 15.8840 16.1551 16.1551 16.7058 16.7058 k = 0.0588 0.5111 0.8759 ( 3202 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0089 -19.0089 -18.9886 -18.9886 -18.9331 -18.9331 -18.7142 -18.7142 0.3745 0.3745 0.4281 0.4281 0.8567 0.8567 4.9100 4.9100 6.7558 6.7558 7.5223 7.5223 7.5371 7.5371 8.4076 8.4076 9.0086 9.0086 9.0562 9.0562 9.7664 9.7664 9.9848 9.9848 10.5124 10.5124 11.0488 11.0488 11.4047 11.4047 13.8738 13.8738 15.4364 15.4364 15.6648 15.6648 15.9273 15.9273 16.1608 16.1608 16.7023 16.7023 k = 0.0515 0.5260 0.8639 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0088 -19.0088 -18.9887 -18.9887 -18.9330 -18.9330 -18.7142 -18.7142 0.3665 0.3665 0.4209 0.4209 0.8392 0.8392 5.0332 5.0332 6.7617 6.7617 7.3959 7.3959 7.5621 7.5621 8.4266 8.4266 8.9742 8.9742 9.0881 9.0881 9.7627 9.7627 10.0042 10.0042 10.4314 10.4314 11.0699 11.0699 11.3870 11.3870 13.8481 13.8481 15.4535 15.4535 15.6894 15.6894 15.9795 15.9795 16.1691 16.1691 16.6979 16.6979 k = 0.0441 0.5409 0.8518 ( 3210 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5461 -27.5461 -19.0087 -19.0087 -18.9888 -18.9888 -18.9328 -18.9328 -18.7142 -18.7142 0.3596 0.3596 0.4145 0.4145 0.8241 0.8241 5.1542 5.1542 6.7661 6.7661 7.2611 7.2611 7.5982 7.5982 8.4373 8.4373 8.9367 8.9367 9.1361 9.1361 9.7591 9.7591 10.0226 10.0226 10.3500 10.3500 11.0907 11.0907 11.3696 11.3696 13.8248 13.8248 15.4650 15.4650 15.7081 15.7081 16.0335 16.0335 16.1830 16.1830 16.6924 16.6924 k = 0.0368 0.5558 0.8398 ( 3208 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0086 -19.0086 -18.9888 -18.9888 -18.9327 -18.9327 -18.7142 -18.7142 0.3536 0.3536 0.4090 0.4090 0.8112 0.8112 5.2712 5.2712 6.7693 6.7693 7.1315 7.1315 7.6328 7.6328 8.4421 8.4421 8.9003 8.9003 9.1938 9.1938 9.7558 9.7558 10.0375 10.0375 10.2706 10.2706 11.1108 11.1108 11.3528 11.3528 13.8041 13.8041 15.4730 15.4730 15.7217 15.7217 16.0781 16.0781 16.2080 16.2080 16.6857 16.6857 k = 0.0294 0.5707 0.8277 ( 3206 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5460 -27.5460 -19.0085 -19.0085 -18.9888 -18.9888 -18.9325 -18.9325 -18.7142 -18.7142 0.3486 0.3486 0.4044 0.4044 0.8007 0.8007 5.3814 5.3814 6.7716 6.7716 7.0105 7.0105 7.6643 7.6643 8.4433 8.4433 8.8671 8.8671 9.2565 9.2565 9.7533 9.7533 10.0447 10.0447 10.1988 10.1988 11.1294 11.1294 11.3372 11.3372 13.7866 13.7866 15.4787 15.4787 15.7315 15.7315 16.1058 16.1058 16.2469 16.2469 16.6779 16.6779 k = 0.0221 0.5857 0.8156 ( 3206 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0084 -19.0084 -18.9889 -18.9889 -18.9324 -18.9324 -18.7142 -18.7142 0.3447 0.3447 0.4008 0.4008 0.7926 0.7926 5.4805 5.4805 6.7731 6.7731 6.9027 6.9027 7.6911 7.6911 8.4426 8.4426 8.8389 8.8389 9.3191 9.3191 9.7518 9.7518 10.0338 10.0338 10.1470 10.1470 11.1460 11.1460 11.3232 11.3232 13.7725 13.7725 15.4827 15.4827 15.7383 15.7383 16.1199 16.1199 16.2917 16.2917 16.6693 16.6693 k = 0.0147 0.6006 0.8036 ( 3208 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0083 -19.0083 -18.9889 -18.9889 -18.9325 -18.9325 -18.7141 -18.7141 0.3420 0.3420 0.3982 0.3982 0.7868 0.7868 5.5620 5.5620 6.7741 6.7741 6.8150 6.8150 7.7116 7.7116 8.4413 8.4413 8.8173 8.8173 9.3753 9.3753 9.7517 9.7517 9.9983 9.9983 10.1265 10.1265 11.1595 11.1595 11.3117 11.3117 13.7621 13.7621 15.4855 15.4855 15.7428 15.7428 16.1269 16.1269 16.3316 16.3316 16.6609 16.6609 k = 0.0074 0.6155 0.7915 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5459 -27.5459 -19.0083 -19.0083 -18.9889 -18.9889 -18.9324 -18.9324 -18.7141 -18.7141 0.3403 0.3403 0.3967 0.3967 0.7833 0.7833 5.6171 5.6171 6.7558 6.7558 6.7749 6.7749 7.7246 7.7246 8.4401 8.4401 8.8037 8.8037 9.4162 9.4162 9.7526 9.7526 9.9609 9.9609 10.1225 10.1225 11.1686 11.1686 11.3039 11.3039 13.7558 13.7558 15.4871 15.4871 15.7454 15.7454 16.1303 16.1303 16.3589 16.3589 16.6543 16.6543 k = 0.0000 0.6304 0.7794 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5459 -27.5459 -19.0083 -19.0083 -18.9889 -18.9889 -18.9324 -18.9324 -18.7141 -18.7141 0.3397 0.3397 0.3962 0.3962 0.7821 0.7821 5.6367 5.6367 6.7349 6.7349 6.7750 6.7750 7.7291 7.7291 8.4397 8.4397 8.7991 8.7991 9.4315 9.4315 9.7533 9.7533 9.9454 9.9454 10.1221 10.1221 11.1718 11.1718 11.3011 11.3011 13.7536 13.7536 15.4877 15.4877 15.7463 15.7463 16.1313 16.1313 16.3687 16.3687 16.6518 16.6518 k = 0.0000 0.6304 0.7794 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5459 -27.5459 -19.0083 -19.0083 -18.9889 -18.9889 -18.9324 -18.9324 -18.7141 -18.7141 0.3397 0.3397 0.3962 0.3962 0.7821 0.7821 5.6367 5.6367 6.7349 6.7349 6.7750 6.7750 7.7291 7.7291 8.4397 8.4397 8.7991 8.7991 9.4315 9.4315 9.7533 9.7533 9.9454 9.9454 10.1221 10.1221 11.1718 11.1718 11.3011 11.3011 13.7536 13.7536 15.4877 15.4877 15.7463 15.7463 16.1313 16.1313 16.3687 16.3687 16.6518 16.6518 k = 0.0194 0.6362 0.7748 ( 3204 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5459 -27.5459 -19.0083 -19.0083 -18.9889 -18.9889 -18.9324 -18.9324 -18.7141 -18.7141 0.3387 0.3387 0.3968 0.3968 0.7825 0.7825 5.6367 5.6367 6.7219 6.7219 6.7869 6.7869 7.7310 7.7310 8.4396 8.4396 8.8000 8.8000 9.4275 9.4275 9.7269 9.7269 9.9730 9.9730 10.1280 10.1280 11.1707 11.1707 11.3001 11.3001 13.7529 13.7529 15.4867 15.4867 15.7401 15.7401 16.1326 16.1326 16.3673 16.3673 16.6504 16.6504 k = 0.0387 0.6419 0.7701 ( 3209 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0083 -19.0083 -18.9888 -18.9888 -18.9324 -18.9324 -18.7142 -18.7142 0.3358 0.3358 0.3984 0.3984 0.7836 0.7836 5.6366 5.6366 6.6981 6.6981 6.8071 6.8071 7.7368 7.7368 8.4392 8.4392 8.8026 8.8026 9.4161 9.4161 9.6717 9.6717 10.0306 10.0306 10.1464 10.1464 11.1673 11.1673 11.2974 11.2974 13.7508 13.7508 15.4835 15.4835 15.7230 15.7230 16.1356 16.1356 16.3632 16.3632 16.6463 16.6463 k = 0.0581 0.6477 0.7654 ( 3208 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5962 -27.5962 -27.5460 -27.5460 -19.0084 -19.0084 -18.9886 -18.9886 -18.9324 -18.9324 -18.7142 -18.7142 0.3313 0.3313 0.4007 0.4007 0.7856 0.7856 5.6365 5.6365 6.6722 6.6722 6.8272 6.8272 7.7464 7.7464 8.4385 8.4385 8.8070 8.8070 9.3982 9.3982 9.6096 9.6096 10.0911 10.0911 10.1815 10.1815 11.1619 11.1619 11.2928 11.2928 13.7474 13.7474 15.4770 15.4770 15.6991 15.6991 16.1385 16.1385 16.3564 16.3564 16.6399 16.6399 k = 0.0774 0.6535 0.7608 ( 3210 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5460 -27.5460 -19.0085 -19.0085 -18.9883 -18.9883 -18.9323 -18.9323 -18.7143 -18.7143 0.3256 0.3256 0.4034 0.4034 0.7882 0.7882 5.6362 5.6362 6.6460 6.6460 6.8454 6.8454 7.7597 7.7597 8.4373 8.4373 8.8127 8.8127 9.3754 9.3754 9.5479 9.5479 10.1403 10.1403 10.2385 10.2385 11.1545 11.1545 11.2863 11.2863 13.7425 13.7425 15.4654 15.4654 15.6738 15.6738 16.1395 16.1395 16.3469 16.3469 16.6312 16.6312 k = 0.0968 0.6592 0.7561 ( 3213 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5961 -27.5961 -27.5460 -27.5460 -19.0087 -19.0087 -18.9880 -18.9880 -18.9323 -18.9323 -18.7144 -18.7144 0.3190 0.3190 0.4061 0.4061 0.7916 0.7916 5.6359 5.6359 6.6202 6.6202 6.8611 6.8611 7.7766 7.7766 8.4357 8.4357 8.8197 8.8197 9.3493 9.3493 9.4892 9.4892 10.1798 10.1798 10.3112 10.3112 11.1455 11.1455 11.2780 11.2780 13.7362 13.7362 15.4468 15.4468 15.6521 15.6521 16.1375 16.1375 16.3348 16.3348 16.6205 16.6205 k = 0.1161 0.6650 0.7514 ( 3209 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5960 -27.5960 -27.5460 -27.5460 -19.0088 -19.0088 -18.9876 -18.9876 -18.9322 -18.9322 -18.7146 -18.7146 0.3117 0.3117 0.4088 0.4088 0.7958 0.7958 5.6356 5.6356 6.5953 6.5953 6.8739 6.8739 7.7967 7.7967 8.4334 8.4334 8.8274 8.8274 9.3215 9.3215 9.4347 9.4347 10.2160 10.2160 10.3902 10.3902 11.1352 11.1352 11.2678 11.2678 13.7286 13.7286 15.4209 15.4209 15.6372 15.6372 16.1321 16.1321 16.3205 16.3205 16.6080 16.6080 k = 0.1355 0.6708 0.7468 ( 3200 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5959 -27.5959 -27.5460 -27.5460 -19.0088 -19.0088 -18.9871 -18.9871 -18.9321 -18.9321 -18.7147 -18.7147 0.3038 0.3038 0.4111 0.4111 0.8005 0.8005 5.6352 5.6352 6.5717 6.5717 6.8838 6.8838 7.8197 7.8197 8.4306 8.4306 8.8352 8.8352 9.2936 9.2936 9.3854 9.3854 10.2510 10.2510 10.4707 10.4707 11.1243 11.1243 11.2560 11.2560 13.7197 13.7197 15.3897 15.3897 15.6290 15.6290 16.1236 16.1236 16.3042 16.3042 16.5938 16.5938 k = 0.1548 0.6765 0.7421 ( 3198 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5958 -27.5958 -27.5459 -27.5459 -19.0089 -19.0089 -18.9867 -18.9867 -18.9321 -18.9321 -18.7148 -18.7148 0.2953 0.2953 0.4133 0.4133 0.8059 0.8059 5.6347 5.6347 6.5497 6.5497 6.8909 6.8909 7.8450 7.8450 8.4272 8.4272 8.8422 8.8422 9.2671 9.2671 9.3418 9.3418 10.2846 10.2846 10.5502 10.5502 11.1132 11.1132 11.2426 11.2426 13.7098 13.7098 15.3563 15.3563 15.6260 15.6260 16.1123 16.1123 16.2867 16.2867 16.5779 16.5779 k = 0.1742 0.6823 0.7374 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5958 -27.5958 -27.5459 -27.5459 -19.0090 -19.0090 -18.9862 -18.9862 -18.9320 -18.9320 -18.7149 -18.7149 0.2863 0.2863 0.4151 0.4151 0.8119 0.8119 5.6342 5.6342 6.5296 6.5296 6.8952 6.8952 7.8717 7.8717 8.4235 8.4235 8.8472 8.8472 9.2435 9.2435 9.3044 9.3044 10.3161 10.3161 10.6267 10.6267 11.1028 11.1028 11.2280 11.2280 13.6992 13.6992 15.3235 15.3235 15.6262 15.6262 16.0989 16.0989 16.2685 16.2685 16.5604 16.5604 k = 0.1935 0.6881 0.7328 ( 3197 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5957 -27.5957 -27.5459 -27.5459 -19.0090 -19.0090 -18.9858 -18.9858 -18.9318 -18.9318 -18.7151 -18.7151 0.2767 0.2767 0.4168 0.4168 0.8184 0.8184 5.6335 5.6335 6.5116 6.5116 6.8971 6.8971 7.8990 7.8990 8.4199 8.4199 8.8490 8.8490 9.2242 9.2242 9.2738 9.2738 10.3448 10.3448 10.6982 10.6982 11.0940 11.0940 11.2128 11.2128 13.6883 13.6883 15.2935 15.2935 15.6281 15.6281 16.0840 16.0840 16.2504 16.2504 16.5415 16.5415 k = 0.2129 0.6938 0.7281 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5957 -27.5957 -27.5459 -27.5459 -19.0090 -19.0090 -18.9855 -18.9855 -18.9318 -18.9318 -18.7153 -18.7153 0.2665 0.2665 0.4184 0.4184 0.8252 0.8252 5.6329 5.6329 6.4959 6.4959 6.8969 6.8969 7.9258 7.9258 8.4170 8.4170 8.8462 8.8462 9.2097 9.2097 9.2510 9.2510 10.3695 10.3695 10.7622 10.7622 11.0883 11.0883 11.1979 11.1979 13.6775 13.6775 15.2674 15.2674 15.6303 15.6303 16.0683 16.0683 16.2333 16.2333 16.5217 16.5217 k = 0.2322 0.6996 0.7235 ( 3201 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5956 -27.5956 -27.5459 -27.5459 -19.0090 -19.0090 -18.9851 -18.9851 -18.9317 -18.9317 -18.7154 -18.7154 0.2557 0.2557 0.4200 0.4200 0.8324 0.8324 5.6321 5.6321 6.4826 6.4826 6.8950 6.8950 7.9509 7.9509 8.4156 8.4156 8.8381 8.8381 9.1984 9.1984 9.2385 9.2385 10.3895 10.3895 10.8152 10.8152 11.0872 11.0872 11.1851 11.1851 13.6676 13.6676 15.2460 15.2460 15.6322 15.6322 16.0522 16.0522 16.2180 16.2180 16.5014 16.5014 k = 0.2516 0.7054 0.7188 ( 3196 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5955 -27.5955 -27.5458 -27.5458 -19.0089 -19.0089 -18.9847 -18.9847 -18.9315 -18.9315 -18.7155 -18.7155 0.2441 0.2441 0.4217 0.4217 0.8398 0.8398 5.6312 5.6312 6.4719 6.4719 6.8918 6.8918 7.9729 7.9729 8.4165 8.4165 8.8245 8.8245 9.1881 9.1881 9.2387 9.2387 10.4039 10.4039 10.8529 10.8529 11.0921 11.0921 11.1771 11.1771 13.6591 13.6591 15.2293 15.2293 15.6331 15.6331 16.0363 16.0363 16.2053 16.2053 16.4815 16.4815 k = 0.2709 0.7111 0.7141 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5458 -27.5458 -19.0087 -19.0087 -18.9845 -18.9845 -18.9314 -18.9314 -18.7156 -18.7156 0.2317 0.2317 0.4238 0.4238 0.8474 0.8474 5.6303 5.6303 6.4639 6.4639 6.8878 6.8878 7.9907 7.9907 8.4202 8.4202 8.8064 8.8064 9.1792 9.1792 9.2501 9.2501 10.4124 10.4124 10.8723 10.8723 11.1013 11.1013 11.1782 11.1782 13.6526 13.6526 15.2170 15.2170 15.6325 15.6325 16.0211 16.0211 16.1957 16.1957 16.4626 16.4626 k = 0.2709 0.7111 0.7141 ( 3195 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5955 -27.5955 -27.5458 -27.5458 -19.0087 -19.0087 -18.9845 -18.9845 -18.9314 -18.9314 -18.7156 -18.7156 0.2317 0.2317 0.4238 0.4238 0.8474 0.8474 5.6303 5.6303 6.4639 6.4639 6.8878 6.8878 7.9907 7.9907 8.4202 8.4202 8.8064 8.8064 9.1792 9.1792 9.2501 9.2501 10.4124 10.4124 10.8723 10.8723 11.1013 11.1013 11.1782 11.1782 13.6526 13.6526 15.2170 15.2170 15.6325 15.6325 16.0211 16.0211 16.1957 16.1957 16.4626 16.4626 k = 0.2764 0.7001 0.6971 ( 3199 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5952 -27.5952 -27.5456 -27.5456 -19.0080 -19.0080 -18.9834 -18.9834 -18.9308 -18.9308 -18.7160 -18.7160 0.1848 0.1848 0.4282 0.4282 0.8772 0.8772 5.6263 5.6263 6.4406 6.4406 6.8736 6.8736 8.0478 8.0478 8.4402 8.4402 8.7340 8.7340 9.1453 9.1453 9.3165 9.3165 10.4338 10.4338 10.9056 10.9056 11.1381 11.1381 11.2051 11.2051 13.6347 13.6347 15.1797 15.1797 15.6268 15.6268 15.9680 15.9680 16.1661 16.1661 16.3976 16.3976 k = 0.2819 0.6890 0.6801 ( 3207 PWs) bands (ev): -54.6717 -54.6717 -54.6516 -54.6516 -27.5949 -27.5949 -27.5455 -27.5455 -19.0072 -19.0072 -18.9823 -18.9823 -18.9301 -18.9301 -18.7165 -18.7165 0.1374 0.1374 0.4263 0.4263 0.9103 0.9103 5.6213 5.6213 6.4201 6.4201 6.8628 6.8628 8.1060 8.1060 8.4608 8.4608 8.6633 8.6633 9.1091 9.1091 9.3877 9.3877 10.4582 10.4582 10.9332 10.9332 11.1745 11.1745 11.2330 11.2330 13.6200 13.6200 15.1429 15.1429 15.6167 15.6167 15.9184 15.9184 16.1354 16.1354 16.3366 16.3366 k = 0.2873 0.6780 0.6631 ( 3211 PWs) bands (ev): -54.6718 -54.6718 -54.6517 -54.6517 -27.5946 -27.5946 -27.5453 -27.5453 -19.0061 -19.0061 -18.9811 -18.9811 -18.9293 -18.9293 -18.7169 -18.7169 0.0898 0.0898 0.4190 0.4190 0.9452 0.9452 5.6154 5.6154 6.4021 6.4021 6.8564 6.8564 8.1650 8.1650 8.4804 8.4804 8.5959 8.5959 9.0737 9.0737 9.4605 9.4605 10.4856 10.4856 10.9566 10.9566 11.2086 11.2086 11.2617 11.2617 13.6089 13.6089 15.1066 15.1066 15.5970 15.5970 15.8770 15.8770 16.1041 16.1041 16.2825 16.2825 k = 0.2928 0.6669 0.6461 ( 3205 PWs) bands (ev): -54.6718 -54.6718 -54.6517 -54.6517 -27.5942 -27.5942 -27.5449 -27.5449 -19.0047 -19.0047 -18.9798 -18.9798 -18.9284 -18.9284 -18.7172 -18.7172 0.0420 0.0420 0.4076 0.4076 0.9808 0.9808 5.6086 5.6086 6.3863 6.3863 6.8549 6.8549 8.2240 8.2240 8.4892 8.4892 8.5413 8.5413 9.0394 9.0394 9.5347 9.5347 10.5160 10.5160 10.9770 10.9770 11.2393 11.2393 11.2902 11.2902 13.6020 13.6020 15.0711 15.0711 15.5627 15.5627 15.8485 15.8485 16.0733 16.0733 16.2373 16.2373 k = 0.2982 0.6558 0.6291 ( 3205 PWs) bands (ev): -54.6719 -54.6719 -54.6518 -54.6518 -27.5938 -27.5938 -27.5445 -27.5445 -19.0031 -19.0031 -18.9784 -18.9784 -18.9273 -18.9273 -18.7175 -18.7175 -0.0060 -0.0060 0.3928 0.3928 1.0161 1.0161 5.6009 5.6009 6.3725 6.3725 6.8590 6.8590 8.2815 8.2815 8.4496 8.4496 8.5384 8.5384 9.0064 9.0064 9.6102 9.6102 10.5491 10.5491 10.9951 10.9951 11.2669 11.2669 11.3172 11.3172 13.5994 13.5994 15.0362 15.0362 15.5130 15.5130 15.8325 15.8325 16.0442 16.0442 16.2026 16.2026 k = 0.3037 0.6448 0.6121 ( 3217 PWs) bands (ev): -54.6720 -54.6720 -54.6520 -54.6520 -27.5934 -27.5934 -27.5443 -27.5443 -19.0015 -19.0015 -18.9771 -18.9771 -18.9261 -18.9261 -18.7179 -18.7179 -0.0539 -0.0539 0.3754 0.3754 1.0506 1.0506 5.5924 5.5924 6.3606 6.3606 6.8691 6.8691 8.3266 8.3266 8.4026 8.4026 8.5560 8.5560 8.9748 8.9748 9.6868 9.6868 10.5850 10.5850 11.0112 11.0112 11.2919 11.2919 11.3413 11.3413 13.6014 13.6014 15.0014 15.0014 15.4516 15.4516 15.8234 15.8234 16.0194 16.0194 16.1792 16.1792 k = 0.3091 0.6337 0.5951 ( 3221 PWs) bands (ev): -54.6721 -54.6721 -54.6521 -54.6521 -27.5929 -27.5929 -27.5439 -27.5439 -18.9997 -18.9997 -18.9757 -18.9757 -18.9247 -18.9247 -18.7182 -18.7182 -0.1017 -0.1017 0.3557 0.3557 1.0836 1.0836 5.5831 5.5831 6.3506 6.3506 6.8855 6.8855 8.3045 8.3045 8.4214 8.4214 8.5755 8.5755 8.9447 8.9447 9.7646 9.7646 10.6234 10.6234 11.0257 11.0257 11.3150 11.3150 11.3616 11.3616 13.6081 13.6081 14.9662 14.9662 15.3834 15.3834 15.8132 15.8132 16.0033 16.0033 16.1676 16.1676 k = 0.3146 0.6226 0.5781 ( 3219 PWs) bands (ev): -54.6722 -54.6722 -54.6522 -54.6522 -27.5924 -27.5924 -27.5433 -27.5433 -18.9978 -18.9978 -18.9743 -18.9743 -18.9231 -18.9231 -18.7184 -18.7184 -0.1493 -0.1493 0.3343 0.3343 1.1148 1.1148 5.5730 5.5730 6.3423 6.3423 6.9082 6.9082 8.2483 8.2483 8.4743 8.4743 8.5947 8.5947 8.9163 8.9163 9.8436 9.8436 10.6642 10.6642 11.0385 11.0385 11.3366 11.3366 11.3780 11.3780 13.6196 13.6196 14.9294 14.9294 15.3130 15.3130 15.7952 15.7952 15.9999 15.9999 16.1676 16.1676 k = 0.3200 0.6116 0.5611 ( 3219 PWs) bands (ev): -54.6723 -54.6723 -54.6523 -54.6523 -27.5918 -27.5918 -27.5428 -27.5428 -18.9958 -18.9958 -18.9729 -18.9729 -18.9212 -18.9212 -18.7186 -18.7186 -0.1966 -0.1966 0.3113 0.3113 1.1440 1.1440 5.5623 5.5623 6.3358 6.3358 6.9373 6.9373 8.1894 8.1894 8.5294 8.5294 8.6133 8.6133 8.8898 8.8898 9.9238 9.9238 10.7074 10.7074 11.0494 11.0494 11.3568 11.3568 11.3905 11.3905 13.6360 13.6360 14.8892 14.8892 15.2442 15.2442 15.7675 15.7675 16.0098 16.0098 16.1783 16.1783 k = 0.3255 0.6005 0.5441 ( 3219 PWs) bands (ev): -54.6725 -54.6725 -54.6525 -54.6525 -27.5912 -27.5912 -27.5422 -27.5422 -18.9937 -18.9937 -18.9715 -18.9715 -18.9192 -18.9192 -18.7188 -18.7188 -0.2435 -0.2435 0.2871 0.2871 1.1709 1.1709 5.5509 5.5509 6.3311 6.3311 6.9725 6.9725 8.1311 8.1311 8.5825 8.5825 8.6311 8.6311 8.8660 8.8660 10.0051 10.0051 10.7526 10.7526 11.0584 11.0584 11.3754 11.3754 11.4002 11.4002 13.6571 13.6571 14.8430 14.8430 15.1811 15.1811 15.7321 15.7321 16.0303 16.0303 16.1989 16.1989 k = 0.3309 0.5894 0.5271 ( 3223 PWs) bands (ev): -54.6726 -54.6726 -54.6526 -54.6526 -27.5906 -27.5906 -27.5417 -27.5417 -18.9916 -18.9916 -18.9701 -18.9701 -18.9169 -18.9169 -18.7190 -18.7190 -0.2899 -0.2899 0.2618 0.2618 1.1954 1.1954 5.5390 5.5390 6.3283 6.3283 7.0137 7.0137 8.0743 8.0743 8.6304 8.6304 8.6486 8.6486 8.8461 8.8461 10.0877 10.0877 10.7999 10.7999 11.0653 11.0653 11.3900 11.3900 11.4102 11.4102 13.6827 13.6827 14.7882 14.7882 15.1274 15.1274 15.6916 15.6916 16.0583 16.0583 16.2283 16.2283 k = 0.3364 0.5784 0.5101 ( 3221 PWs) bands (ev): -54.6727 -54.6727 -54.6527 -54.6527 -27.5899 -27.5899 -27.5411 -27.5411 -18.9895 -18.9895 -18.9687 -18.9687 -18.9144 -18.9144 -18.7191 -18.7191 -0.3357 -0.3357 0.2357 0.2357 1.2175 1.2175 5.5265 5.5265 6.3275 6.3275 7.0606 7.0606 8.0191 8.0191 8.6611 8.6611 8.6743 8.6743 8.8334 8.8334 10.1714 10.1714 10.8488 10.8488 11.0699 11.0699 11.3971 11.3971 11.4250 11.4250 13.7126 13.7126 14.7232 14.7232 15.0854 15.0854 15.6480 15.6480 16.0919 16.0919 16.2651 16.2651 k = 0.3418 0.5673 0.4931 ( 3225 PWs) bands (ev): -54.6729 -54.6729 -54.6529 -54.6529 -27.5893 -27.5893 -27.5405 -27.5405 -18.9875 -18.9875 -18.9673 -18.9673 -18.9117 -18.9117 -18.7191 -18.7191 -0.3808 -0.3808 0.2089 0.2089 1.2373 1.2373 5.5135 5.5135 6.3287 6.3287 7.1126 7.1126 7.9656 7.9656 8.6760 8.6760 8.7008 8.7008 8.8337 8.8337 10.2563 10.2563 10.8989 10.8989 11.0722 11.0722 11.3994 11.3994 11.4432 11.4432 13.7464 13.7464 14.6489 14.6489 15.0552 15.0552 15.6023 15.6023 16.1296 16.1296 16.3078 16.3078 k = 0.3473 0.5563 0.4761 ( 3211 PWs) bands (ev): -54.6730 -54.6730 -54.6530 -54.6530 -27.5886 -27.5886 -27.5397 -27.5397 -18.9854 -18.9854 -18.9658 -18.9658 -18.9087 -18.9087 -18.7190 -18.7190 -0.4252 -0.4252 0.1815 0.1815 1.2546 1.2546 5.5002 5.5002 6.3319 6.3319 7.1695 7.1695 7.9141 7.9141 8.6846 8.6846 8.7145 8.7145 8.8503 8.8503 10.3424 10.3424 10.9494 10.9494 11.0727 11.0727 11.4002 11.4002 11.4626 11.4626 13.7832 13.7832 14.5677 14.5677 15.0352 15.0352 15.5553 15.5553 16.1705 16.1705 16.3551 16.3551 k = 0.3528 0.5452 0.4591 ( 3207 PWs) bands (ev): -54.6731 -54.6731 -54.6532 -54.6532 -27.5879 -27.5879 -27.5389 -27.5389 -18.9837 -18.9837 -18.9642 -18.9642 -18.9056 -18.9056 -18.7189 -18.7189 -0.4687 -0.4687 0.1537 0.1537 1.2696 1.2696 5.4865 5.4865 6.3369 6.3369 7.2307 7.2307 7.8643 7.8643 8.6817 8.6817 8.7269 8.7269 8.8773 8.8773 10.4297 10.4297 10.9965 10.9965 11.0742 11.0742 11.4015 11.4015 11.4827 11.4827 13.8217 13.8217 14.4828 14.4828 15.0236 15.0236 15.5076 15.5076 16.2139 16.2139 16.4054 16.4054 k = 0.3582 0.5341 0.4421 ( 3209 PWs) bands (ev): -54.6733 -54.6733 -54.6533 -54.6533 -27.5872 -27.5872 -27.5383 -27.5383 -18.9822 -18.9822 -18.9625 -18.9625 -18.9023 -18.9023 -18.7187 -18.7187 -0.5114 -0.5114 0.1257 0.1257 1.2824 1.2824 5.4726 5.4726 6.3438 6.3438 7.2957 7.2957 7.8165 7.8165 8.6696 8.6696 8.7435 8.7435 8.9066 8.9066 10.5180 10.5180 11.0247 11.0247 11.0916 11.0916 11.4049 11.4049 11.5033 11.5033 13.8591 13.8591 14.3986 14.3986 15.0186 15.0186 15.4595 15.4595 16.2591 16.2591 16.4570 16.4570 k = 0.3637 0.5231 0.4251 ( 3211 PWs) bands (ev): -54.6734 -54.6734 -54.6535 -54.6535 -27.5865 -27.5865 -27.5376 -27.5376 -18.9809 -18.9809 -18.9607 -18.9607 -18.8989 -18.8989 -18.7185 -18.7185 -0.5530 -0.5530 0.0975 0.0975 1.2930 1.2930 5.4584 5.4584 6.3525 6.3525 7.3639 7.3639 7.7707 7.7707 8.6535 8.6535 8.7636 8.7636 8.9341 8.9341 10.6073 10.6073 11.0226 11.0226 11.1356 11.1356 11.4118 11.4118 11.5243 11.5243 13.8894 13.8894 14.3220 14.3220 15.0187 15.0187 15.4115 15.4115 16.3054 16.3054 16.5082 16.5082 k = 0.3691 0.5120 0.4081 ( 3207 PWs) bands (ev): -54.6736 -54.6736 -54.6536 -54.6536 -27.5857 -27.5857 -27.5369 -27.5369 -18.9798 -18.9798 -18.9587 -18.9587 -18.8953 -18.8953 -18.7182 -18.7182 -0.5936 -0.5936 0.0693 0.0693 1.3016 1.3016 5.4441 5.4441 6.3627 6.3627 7.4347 7.4347 7.7268 7.7268 8.6359 8.6359 8.7870 8.7870 8.9579 8.9579 10.6976 10.6976 11.0061 11.0061 11.1895 11.1895 11.4235 11.4235 11.5458 11.5458 13.9003 13.9003 14.2659 14.2659 15.0226 15.0226 15.3646 15.3646 16.3524 16.3524 16.5570 16.5570 k = 0.3746 0.5009 0.3911 ( 3197 PWs) bands (ev): -54.6737 -54.6737 -54.6538 -54.6538 -27.5850 -27.5850 -27.5360 -27.5360 -18.9789 -18.9789 -18.9565 -18.9565 -18.8916 -18.8916 -18.7178 -18.7178 -0.6331 -0.6331 0.0413 0.0413 1.3083 1.3083 5.4298 5.4298 6.3743 6.3743 7.5075 7.5075 7.6848 7.6848 8.6179 8.6179 8.8140 8.8140 8.9771 8.9771 10.7884 10.7884 10.9821 10.9821 11.2462 11.2462 11.4407 11.4407 11.5678 11.5678 13.8757 13.8757 14.2467 14.2467 15.0286 15.0286 15.3197 15.3197 16.3994 16.3994 16.6017 16.6017 k = 0.3800 0.4899 0.3741 ( 3209 PWs) bands (ev): -54.6738 -54.6738 -54.6540 -54.6540 -27.5844 -27.5844 -27.5353 -27.5353 -18.9784 -18.9784 -18.9543 -18.9543 -18.8881 -18.8881 -18.7174 -18.7174 -0.6714 -0.6714 0.0134 0.0134 1.3133 1.3133 5.4154 5.4154 6.3870 6.3870 7.5814 7.5814 7.6451 7.6451 8.5999 8.5999 8.8453 8.8453 8.9914 8.9914 10.8773 10.8773 10.9542 10.9542 11.3041 11.3041 11.4639 11.4639 11.5902 11.5902 13.8133 13.8133 14.2667 14.2667 15.0342 15.0342 15.2792 15.2792 16.4455 16.4455 16.6410 16.6410 k = 0.3855 0.4788 0.3571 ( 3209 PWs) bands (ev): -54.6740 -54.6740 -54.6542 -54.6542 -27.5837 -27.5837 -27.5346 -27.5346 -18.9780 -18.9780 -18.9520 -18.9520 -18.8844 -18.8844 -18.7169 -18.7169 -0.7085 -0.7085 -0.0140 -0.0140 1.3167 1.3167 5.4011 5.4011 6.4007 6.4007 7.6058 7.6058 7.6576 7.6576 8.5821 8.5821 8.8813 8.8813 9.0012 9.0012 10.9048 10.9048 10.9824 10.9824 11.3623 11.3623 11.4930 11.4930 11.6136 11.6136 13.7266 13.7266 14.3122 14.3122 15.0352 15.0352 15.2472 15.2472 16.4896 16.4896 16.6738 16.6738 k = 0.3909 0.4677 0.3401 ( 3205 PWs) bands (ev): -54.6741 -54.6741 -54.6543 -54.6543 -27.5830 -27.5830 -27.5339 -27.5339 -18.9778 -18.9778 -18.9497 -18.9497 -18.8805 -18.8805 -18.7164 -18.7164 -0.7442 -0.7442 -0.0410 -0.0410 1.3187 1.3187 5.3870 5.3870 6.4150 6.4150 7.5700 7.5700 7.7322 7.7322 8.5646 8.5646 8.9218 8.9218 9.0075 9.0075 10.8650 10.8650 11.0728 11.0728 11.4206 11.4206 11.5270 11.5270 11.6383 11.6383 13.6270 13.6270 14.3713 14.3713 15.0260 15.0260 15.2291 15.2291 16.5301 16.5301 16.7005 16.7005 k = 0.3964 0.4567 0.3231 ( 3205 PWs) bands (ev): -54.6743 -54.6743 -54.6545 -54.6545 -27.5823 -27.5823 -27.5331 -27.5331 -18.9777 -18.9777 -18.9473 -18.9473 -18.8768 -18.8768 -18.7158 -18.7158 -0.7785 -0.7785 -0.0675 -0.0675 1.3195 1.3195 5.3731 5.3731 6.4297 6.4297 7.5358 7.5358 7.8068 7.8068 8.5476 8.5476 8.9624 8.9624 9.0158 9.0158 10.8169 10.8169 11.1667 11.1667 11.4786 11.4786 11.5644 11.5644 11.6655 11.6655 13.5202 13.5202 14.4371 14.4371 15.0039 15.0039 15.2283 15.2283 16.5644 16.5644 16.7229 16.7229 k = 0.4018 0.4456 0.3061 ( 3199 PWs) bands (ev): -54.6744 -54.6744 -54.6546 -54.6546 -27.5816 -27.5816 -27.5324 -27.5324 -18.9777 -18.9777 -18.9449 -18.9449 -18.8730 -18.8730 -18.7151 -18.7151 -0.8115 -0.8115 -0.0932 -0.0932 1.3191 1.3191 5.3594 5.3594 6.4446 6.4446 7.5034 7.5034 7.8806 7.8806 8.5309 8.5309 8.9825 8.9825 9.0477 9.0477 10.7634 10.7634 11.2616 11.2616 11.5361 11.5361 11.6027 11.6027 11.6972 11.6972 13.4091 13.4091 14.5052 14.5052 14.9727 14.9727 15.2421 15.2421 16.5887 16.5887 16.7444 16.7444 k = 0.4073 0.4345 0.2891 ( 3195 PWs) bands (ev): -54.6746 -54.6746 -54.6547 -54.6547 -27.5809 -27.5809 -27.5317 -27.5317 -18.9778 -18.9778 -18.9427 -18.9427 -18.8693 -18.8693 -18.7144 -18.7144 -0.8429 -0.8429 -0.1182 -0.1182 1.3178 1.3178 5.3460 5.3460 6.4594 6.4594 7.4729 7.4729 7.9534 7.9534 8.5148 8.5148 8.9805 8.9805 9.1054 9.1054 10.7050 10.7050 11.3568 11.3568 11.5918 11.5918 11.6398 11.6398 11.7354 11.7354 13.2949 13.2949 14.5703 14.5703 14.9403 14.9403 15.2658 15.2658 16.5997 16.5997 16.7687 16.7687 k = 0.4127 0.4235 0.2720 ( 3193 PWs) bands (ev): -54.6747 -54.6747 -54.6549 -54.6549 -27.5803 -27.5803 -27.5310 -27.5310 -18.9780 -18.9780 -18.9405 -18.9405 -18.8657 -18.8657 -18.7136 -18.7136 -0.8729 -0.8729 -0.1423 -0.1423 1.3157 1.3157 5.3331 5.3331 6.4738 6.4738 7.4443 7.4443 8.0251 8.0251 8.4992 8.4992 8.9714 8.9714 9.1750 9.1750 10.6423 10.6423 11.4519 11.4519 11.6413 11.6413 11.6786 11.6786 11.7810 11.7810 13.1785 13.1785 14.6230 14.6230 14.9180 14.9180 15.2959 15.2959 16.5966 16.5966 16.7971 16.7971 k = 0.4182 0.4124 0.2550 ( 3193 PWs) bands (ev): -54.6748 -54.6748 -54.6550 -54.6550 -27.5797 -27.5797 -27.5304 -27.5304 -18.9782 -18.9782 -18.9384 -18.9384 -18.8622 -18.8622 -18.7129 -18.7129 -0.9012 -0.9012 -0.1654 -0.1654 1.3130 1.3130 5.3206 5.3206 6.4876 6.4876 7.4174 7.4174 8.0958 8.0958 8.4841 8.4841 8.9590 8.9590 9.2530 9.2530 10.5758 10.5758 11.5463 11.5463 11.6771 11.6771 11.7270 11.7270 11.8326 11.8326 13.0604 13.0604 14.6475 14.6475 14.9224 14.9224 15.3303 15.3303 16.5818 16.5818 16.8280 16.8280 k = 0.4236 0.4014 0.2380 ( 3204 PWs) bands (ev): -54.6750 -54.6750 -54.6552 -54.6552 -27.5792 -27.5792 -27.5298 -27.5298 -18.9785 -18.9785 -18.9364 -18.9364 -18.8590 -18.8590 -18.7121 -18.7121 -0.9279 -0.9279 -0.1875 -0.1875 1.3097 1.3097 5.3086 5.3086 6.5007 6.5007 7.3924 7.3924 8.1656 8.1656 8.4696 8.4696 8.9444 8.9444 9.3386 9.3386 10.5058 10.5058 11.6375 11.6375 11.7050 11.7050 11.7821 11.7821 11.8881 11.8881 12.9410 12.9410 14.6357 14.6357 14.9615 14.9615 15.3677 15.3677 16.5582 16.5582 16.8593 16.8593 k = 0.4291 0.3903 0.2210 ( 3196 PWs) bands (ev): -54.6751 -54.6751 -54.6553 -54.6553 -27.5786 -27.5786 -27.5291 -27.5291 -18.9788 -18.9788 -18.9345 -18.9345 -18.8557 -18.8557 -18.7112 -18.7112 -0.9530 -0.9530 -0.2084 -0.2084 1.3061 1.3061 5.2972 5.2972 6.5129 6.5129 7.3692 7.3692 8.2349 8.2349 8.4557 8.4557 8.9286 8.9286 9.4307 9.4307 10.4327 10.4327 11.7054 11.7054 11.7505 11.7505 11.8383 11.8383 11.9462 11.9462 12.8208 12.8208 14.5988 14.5988 15.0239 15.0239 15.4074 15.4074 16.5281 16.5281 16.8892 16.8892 k = 0.4346 0.3792 0.2040 ( 3200 PWs) bands (ev): -54.6752 -54.6752 -54.6554 -54.6554 -27.5781 -27.5781 -27.5287 -27.5287 -18.9790 -18.9790 -18.9328 -18.9328 -18.8526 -18.8526 -18.7105 -18.7105 -0.9764 -0.9764 -0.2281 -0.2281 1.3022 1.3022 5.2865 5.2865 6.5242 6.5242 7.3479 7.3479 8.3040 8.3040 8.4425 8.4425 8.9122 8.9122 9.5287 9.5287 10.3571 10.3571 11.7311 11.7311 11.8333 11.8333 11.8937 11.8937 12.0060 12.0060 12.7001 12.7001 14.5492 14.5492 15.0965 15.0965 15.4484 15.4484 16.4934 16.4934 16.9167 16.9167 k = 0.4400 0.3682 0.1870 ( 3200 PWs) bands (ev): -54.6753 -54.6753 -54.6555 -54.6555 -27.5776 -27.5776 -27.5282 -27.5282 -18.9793 -18.9793 -18.9312 -18.9312 -18.8497 -18.8497 -18.7097 -18.7097 -0.9980 -0.9980 -0.2465 -0.2465 1.2982 1.2982 5.2764 5.2764 6.5343 6.5343 7.3282 7.3282 8.3728 8.3728 8.4306 8.4306 8.8956 8.8956 9.6316 9.6316 10.2796 10.2796 11.7481 11.7481 11.9183 11.9183 11.9479 11.9479 12.0672 12.0672 12.5799 12.5799 14.4933 14.4933 15.1724 15.1724 15.4903 15.4903 16.4557 16.4557 16.9409 16.9409 k = 0.4455 0.3571 0.1700 ( 3196 PWs) bands (ev): -54.6754 -54.6754 -54.6556 -54.6556 -27.5771 -27.5771 -27.5277 -27.5277 -18.9796 -18.9796 -18.9297 -18.9297 -18.8470 -18.8470 -18.7089 -18.7089 -1.0179 -1.0179 -0.2635 -0.2635 1.2942 1.2942 5.2670 5.2670 6.5434 6.5434 7.3104 7.3104 8.4151 8.4151 8.4465 8.4465 8.8794 8.8794 9.7379 9.7379 10.2012 10.2012 11.7625 11.7625 11.9880 11.9880 12.0089 12.0089 12.1300 12.1300 12.4619 12.4619 14.4341 14.4341 15.2481 15.2481 15.5324 15.5324 16.4162 16.4162 16.9613 16.9613 k = 0.4509 0.3460 0.1530 ( 3196 PWs) bands (ev): -54.6755 -54.6755 -54.6557 -54.6557 -27.5767 -27.5767 -27.5272 -27.5272 -18.9799 -18.9799 -18.9283 -18.9283 -18.8445 -18.8445 -18.7082 -18.7082 -1.0359 -1.0359 -0.2791 -0.2791 1.2903 1.2903 5.2584 5.2584 6.5514 6.5514 7.2942 7.2942 8.4056 8.4056 8.5157 8.5157 8.8638 8.8638 9.8444 9.8444 10.1247 10.1247 11.7750 11.7750 12.0331 12.0331 12.0773 12.0773 12.1952 12.1952 12.3511 12.3511 14.3732 14.3732 15.3214 15.3214 15.5740 15.5740 16.3762 16.3762 16.9776 16.9776 k = 0.4564 0.3350 0.1360 ( 3196 PWs) bands (ev): -54.6756 -54.6756 -54.6558 -54.6558 -27.5763 -27.5763 -27.5268 -27.5268 -18.9802 -18.9802 -18.9271 -18.9271 -18.8423 -18.8423 -18.7075 -18.7075 -1.0522 -1.0522 -0.2933 -0.2933 1.2865 1.2865 5.2505 5.2505 6.5583 6.5583 7.2799 7.2799 8.3956 8.3956 8.5872 8.5872 8.8492 8.8492 9.9339 9.9339 10.0669 10.0669 11.7861 11.7861 12.0561 12.0561 12.1264 12.1264 12.2592 12.2592 12.2739 12.2739 14.3120 14.3120 15.3906 15.3906 15.6143 15.6143 16.3369 16.3369 16.9898 16.9898 k = 0.4618 0.3239 0.1190 ( 3192 PWs) bands (ev): -54.6757 -54.6757 -54.6559 -54.6559 -27.5760 -27.5760 -27.5264 -27.5264 -18.9804 -18.9804 -18.9260 -18.9260 -18.8402 -18.8402 -18.7068 -18.7068 -1.0665 -1.0665 -0.3059 -0.3059 1.2830 1.2830 5.2435 5.2435 6.5642 6.5642 7.2672 7.2672 8.3864 8.3864 8.6597 8.6597 8.8360 8.8360 9.9217 9.9217 10.1121 10.1121 11.7957 11.7957 12.0141 12.0141 12.1515 12.1515 12.2620 12.2620 12.3358 12.3358 14.2516 14.2516 15.4546 15.4546 15.6524 15.6524 16.2992 16.2992 16.9981 16.9981 k = 0.4673 0.3128 0.1020 ( 3198 PWs) bands (ev): -54.6758 -54.6758 -54.6560 -54.6560 -27.5757 -27.5757 -27.5262 -27.5262 -18.9807 -18.9807 -18.9251 -18.9251 -18.8385 -18.8385 -18.7063 -18.7063 -1.0791 -1.0791 -0.3169 -0.3169 1.2798 1.2798 5.2374 5.2374 6.5691 6.5691 7.2562 7.2562 8.3782 8.3782 8.7326 8.7326 8.8242 8.8242 9.8497 9.8497 10.2181 10.2181 11.8037 11.8037 11.9166 11.9166 12.1789 12.1789 12.2970 12.2970 12.4060 12.4060 14.1934 14.1934 15.5127 15.5127 15.6871 15.6871 16.2644 16.2644 17.0031 17.0031 k = 0.4727 0.3018 0.0850 ( 3208 PWs) bands (ev): -54.6759 -54.6759 -54.6560 -54.6560 -27.5755 -27.5755 -27.5260 -27.5260 -18.9809 -18.9809 -18.9244 -18.9244 -18.8370 -18.8370 -18.7059 -18.7059 -1.0897 -1.0897 -0.3262 -0.3262 1.2770 1.2770 5.2322 5.2322 6.5731 6.5731 7.2470 7.2470 8.3711 8.3711 8.8029 8.8029 8.8167 8.8167 9.7709 9.7709 10.3311 10.3311 11.7981 11.7981 11.8178 11.8178 12.2061 12.2061 12.3349 12.3349 12.4727 12.4727 14.1387 14.1387 15.5642 15.5642 15.7170 15.7170 16.2334 16.2334 17.0055 17.0055 k = 0.4782 0.2907 0.0680 ( 3210 PWs) bands (ev): -54.6759 -54.6759 -54.6561 -54.6561 -27.5753 -27.5753 -27.5258 -27.5258 -18.9810 -18.9810 -18.9238 -18.9238 -18.8357 -18.8357 -18.7055 -18.7055 -1.0984 -1.0984 -0.3340 -0.3340 1.2747 1.2747 5.2279 5.2279 6.5763 6.5763 7.2394 7.2394 8.3651 8.3651 8.8045 8.8045 8.8783 8.8783 9.6927 9.6927 10.4430 10.4430 11.6918 11.6918 11.8180 11.8180 12.2299 12.2299 12.3683 12.3683 12.5326 12.5326 14.0895 14.0895 15.6088 15.6088 15.7408 15.7408 16.2073 16.2073 17.0061 17.0061 k = 0.4836 0.2797 0.0510 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5751 -27.5751 -27.5257 -27.5257 -18.9811 -18.9811 -18.9233 -18.9233 -18.8347 -18.8347 -18.7052 -18.7052 -1.1052 -1.1052 -0.3400 -0.3400 1.2728 1.2728 5.2245 5.2245 6.5787 6.5787 7.2335 7.2335 8.3604 8.3604 8.7980 8.7980 8.9464 8.9464 9.6188 9.6188 10.5488 10.5488 11.5859 11.5859 11.8222 11.8222 12.2490 12.2490 12.3953 12.3953 12.5832 12.5832 14.0477 14.0477 15.6462 15.6462 15.7574 15.7574 16.1868 16.1868 17.0056 17.0056 k = 0.4891 0.2686 0.0340 ( 3212 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5750 -27.5750 -27.5256 -27.5256 -18.9812 -18.9812 -18.9230 -18.9230 -18.8340 -18.8340 -18.7050 -18.7050 -1.1101 -1.1101 -0.3443 -0.3443 1.2714 1.2714 5.2221 5.2221 6.5804 6.5804 7.2293 7.2293 8.3570 8.3570 8.7932 8.7932 9.0070 9.0070 9.5540 9.5540 10.6415 10.6415 11.4929 11.4929 11.8253 11.8253 12.2629 12.2629 12.4150 12.4150 12.6217 12.6217 14.0157 14.0157 15.6757 15.6757 15.7668 15.7668 16.1722 16.1722 17.0047 17.0047 k = 0.4945 0.2575 0.0170 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5748 -27.5748 -27.5255 -27.5255 -18.9813 -18.9813 -18.9227 -18.9227 -18.8335 -18.8335 -18.7048 -18.7048 -1.1130 -1.1130 -0.3469 -0.3469 1.2706 1.2706 5.2206 5.2206 6.5814 6.5814 7.2268 7.2268 8.3549 8.3549 8.7903 8.7903 9.0520 9.0520 9.5064 9.5064 10.7091 10.7091 11.4251 11.4251 11.8272 11.8272 12.2713 12.2713 12.4270 12.4270 12.6459 12.6459 13.9955 13.9955 15.6956 15.6956 15.7702 15.7702 16.1637 16.1637 17.0040 17.0040 k = 0.5000 0.2465-0.0000 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5748 -27.5748 -27.5255 -27.5255 -18.9813 -18.9813 -18.9227 -18.9227 -18.8334 -18.8334 -18.7048 -18.7048 -1.1139 -1.1139 -0.3478 -0.3478 1.2703 1.2703 5.2202 5.2202 6.5817 6.5817 7.2260 7.2260 8.3542 8.3542 8.7893 8.7893 9.0693 9.0693 9.4882 9.4882 10.7348 10.7348 11.3994 11.3994 11.8279 11.8279 12.2742 12.2742 12.4310 12.4310 12.6542 12.6542 13.9885 13.9885 15.7028 15.7028 15.7707 15.7707 16.1609 16.1609 17.0037 17.0037 k = 0.5000 0.2465-0.0000 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5748 -27.5748 -27.5255 -27.5255 -18.9813 -18.9813 -18.9227 -18.9227 -18.8334 -18.8334 -18.7048 -18.7048 -1.1139 -1.1139 -0.3478 -0.3478 1.2703 1.2703 5.2202 5.2202 6.5817 6.5817 7.2260 7.2260 8.3542 8.3542 8.7893 8.7893 9.0693 9.0693 9.4882 9.4882 10.7348 10.7348 11.3994 11.3994 11.8279 11.8279 12.2742 12.2742 12.4310 12.4310 12.6542 12.6542 13.9885 13.9885 15.7028 15.7028 15.7707 15.7707 16.1609 16.1609 17.0037 17.0037 k = 0.4815 0.2373-0.0000 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5748 -27.5748 -27.5255 -27.5255 -18.9814 -18.9814 -18.9226 -18.9226 -18.8334 -18.8334 -18.7047 -18.7047 -1.1181 -1.1181 -0.3423 -0.3423 1.2703 1.2703 5.2201 5.2201 6.5780 6.5780 7.2261 7.2261 8.3301 8.3301 8.7857 8.7857 9.1036 9.1036 9.4888 9.4888 10.7324 10.7324 11.4006 11.4006 11.8278 11.8278 12.2737 12.2737 12.4345 12.4345 12.6542 12.6542 13.9901 13.9901 15.6624 15.6624 15.8089 15.8089 16.1580 16.1580 16.9960 16.9960 k = 0.4630 0.2282-0.0000 ( 3202 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5749 -27.5749 -27.5253 -27.5253 -18.9816 -18.9816 -18.9224 -18.9224 -18.8335 -18.8335 -18.7044 -18.7044 -1.1302 -1.1302 -0.3262 -0.3262 1.2704 1.2704 5.2200 5.2200 6.5669 6.5669 7.2265 7.2265 8.2641 8.2641 8.7858 8.7858 9.1889 9.1889 9.4907 9.4907 10.7254 10.7254 11.4045 11.4045 11.8276 11.8276 12.2721 12.2721 12.4450 12.4450 12.6544 12.6544 13.9947 13.9947 15.5987 15.5987 15.8656 15.8656 16.1496 16.1496 16.9740 16.9740 k = 0.4444 0.2191-0.0000 ( 3200 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5750 -27.5750 -27.5252 -27.5252 -18.9821 -18.9821 -18.9222 -18.9222 -18.8337 -18.8337 -18.7039 -18.7039 -1.1492 -1.1492 -0.3006 -0.3006 1.2705 1.2705 5.2198 5.2198 6.5489 6.5489 7.2271 7.2271 8.1702 8.1702 8.7995 8.7995 9.3008 9.3008 9.4939 9.4939 10.7139 10.7139 11.4108 11.4108 11.8272 11.8272 12.2695 12.2695 12.4623 12.4623 12.6547 12.6547 14.0023 14.0023 15.5312 15.5312 15.9199 15.9199 16.1375 16.1375 16.9409 16.9409 k = 0.4259 0.2099-0.0000 ( 3206 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5752 -27.5752 -27.5251 -27.5251 -18.9828 -18.9828 -18.9219 -18.9219 -18.8340 -18.8340 -18.7033 -18.7033 -1.1739 -1.1739 -0.2668 -0.2668 1.2705 1.2705 5.2196 5.2196 6.5247 6.5247 7.2279 7.2279 8.0608 8.0608 8.8268 8.8268 9.4245 9.4245 9.5000 9.5000 10.6983 10.6983 11.4197 11.4197 11.8267 11.8267 12.2657 12.2657 12.4859 12.4859 12.6554 12.6554 14.0128 14.0128 15.4624 15.4624 15.9659 15.9659 16.1255 16.1255 16.9002 16.9002 k = 0.4074 0.2008-0.0000 ( 3202 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5753 -27.5753 -27.5250 -27.5250 -18.9835 -18.9835 -18.9216 -18.9216 -18.8342 -18.8342 -18.7025 -18.7025 -1.2027 -1.2027 -0.2263 -0.2263 1.2705 1.2705 5.2193 5.2193 6.4951 6.4951 7.2288 7.2288 7.9437 7.9437 8.8654 8.8654 9.4973 9.4973 9.5653 9.5653 10.6791 10.6791 11.4310 11.4310 11.8261 11.8261 12.2608 12.2608 12.5149 12.5149 12.6570 12.6570 14.0260 14.0260 15.3927 15.3927 15.9939 15.9939 16.1230 16.1230 16.8551 16.8551 k = 0.3889 0.1917-0.0000 ( 3202 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5754 -27.5754 -27.5248 -27.5248 -18.9844 -18.9844 -18.9212 -18.9212 -18.8345 -18.8345 -18.7016 -18.7016 -1.2344 -1.2344 -0.1803 -0.1803 1.2704 1.2704 5.2189 5.2189 6.4609 6.4609 7.2298 7.2298 7.8234 7.8234 8.9132 8.9132 9.5060 9.5060 9.6996 9.6996 10.6568 10.6568 11.4447 11.4447 11.8253 11.8253 12.2547 12.2547 12.5478 12.5478 12.6606 12.6606 14.0416 14.0416 15.3228 15.3228 15.9938 15.9938 16.1403 16.1403 16.8079 16.8079 k = 0.3704 0.1826-0.0000 ( 3202 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5756 -27.5756 -27.5246 -27.5246 -18.9854 -18.9854 -18.9207 -18.9207 -18.8349 -18.8349 -18.7006 -18.7006 -1.2679 -1.2679 -0.1302 -0.1302 1.2701 1.2701 5.2185 5.2185 6.4232 6.4232 7.2306 7.2306 7.7026 7.7026 8.9684 8.9684 9.5136 9.5136 9.8378 9.8378 10.6319 10.6319 11.4606 11.4606 11.8243 11.8243 12.2477 12.2477 12.5811 12.5811 12.6691 12.6691 14.0595 14.0595 15.2529 15.2529 15.9726 15.9726 16.1704 16.1704 16.7603 16.7603 k = 0.3519 0.1734-0.0000 ( 3198 PWs) bands (ev): -54.6761 -54.6761 -54.6560 -54.6560 -27.5758 -27.5758 -27.5244 -27.5244 -18.9865 -18.9865 -18.9202 -18.9202 -18.8353 -18.8353 -18.6995 -18.6995 -1.3024 -1.3024 -0.0768 -0.0768 1.2694 1.2694 5.2180 5.2180 6.3827 6.3827 7.2310 7.2310 7.5832 7.5832 9.0295 9.0295 9.5219 9.5219 9.9766 9.9766 10.6051 10.6051 11.4788 11.4788 11.8232 11.8232 12.2399 12.2399 12.6077 12.6077 12.6890 12.6890 14.0793 14.0793 15.1833 15.1833 15.9416 15.9416 16.2021 16.2021 16.7135 16.7135 k = 0.3333 0.1643-0.0000 ( 3198 PWs) bands (ev): -54.6761 -54.6761 -54.6560 -54.6560 -27.5760 -27.5760 -27.5242 -27.5242 -18.9877 -18.9877 -18.9197 -18.9197 -18.8358 -18.8358 -18.6983 -18.6983 -1.3372 -1.3372 -0.0208 -0.0208 1.2684 1.2684 5.2175 5.2175 6.3405 6.3405 7.2297 7.2297 7.4674 7.4674 9.0954 9.0954 9.5310 9.5310 10.1143 10.1143 10.5772 10.5772 11.4991 11.4991 11.8220 11.8220 12.2314 12.2314 12.6222 12.6222 12.7250 12.7250 14.1006 14.1006 15.1144 15.1144 15.9064 15.9064 16.2299 16.2299 16.6683 16.6683 k = 0.3148 0.1552-0.0000 ( 3196 PWs) bands (ev): -54.6761 -54.6761 -54.6560 -54.6560 -27.5762 -27.5762 -27.5239 -27.5239 -18.9890 -18.9890 -18.9190 -18.9190 -18.8362 -18.8362 -18.6969 -18.6969 -1.3717 -1.3717 0.0369 0.0369 1.2669 1.2669 5.2170 5.2170 6.2973 6.2973 7.2223 7.2223 7.3603 7.3603 9.1649 9.1649 9.5410 9.5410 10.2490 10.2490 10.5496 10.5496 11.5215 11.5215 11.8207 11.8207 12.2224 12.2224 12.6287 12.6287 12.7724 12.7724 14.1231 14.1231 15.0463 15.0463 15.8694 15.8694 16.2513 16.2513 16.6254 16.6254 k = 0.2963 0.1461-0.0000 ( 3198 PWs) bands (ev): -54.6761 -54.6761 -54.6560 -54.6560 -27.5765 -27.5765 -27.5236 -27.5236 -18.9904 -18.9904 -18.9184 -18.9184 -18.8367 -18.8367 -18.6956 -18.6956 -1.4055 -1.4055 0.0960 0.0960 1.2647 1.2647 5.2164 5.2164 6.2539 6.2539 7.1858 7.1858 7.2856 7.2856 9.2370 9.2370 9.5519 9.5519 10.3749 10.3749 10.5275 10.5275 11.5457 11.5457 11.8195 11.8195 12.2131 12.2131 12.6319 12.6319 12.8259 12.8259 14.1464 14.1464 14.9796 14.9796 15.8321 15.8321 16.2653 16.2653 16.5851 16.5851 k = 0.2778 0.1369-0.0000 ( 3194 PWs) bands (ev): -54.6762 -54.6762 -54.6559 -54.6559 -27.5767 -27.5767 -27.5234 -27.5234 -18.9917 -18.9917 -18.9178 -18.9178 -18.8373 -18.8373 -18.6942 -18.6942 -1.4382 -1.4382 0.1558 0.1558 1.2618 1.2618 5.2158 5.2158 6.2109 6.2109 7.0998 7.0998 7.2642 7.2642 9.3107 9.3107 9.5635 9.5635 10.4477 10.4477 10.5548 10.5548 11.5716 11.5716 11.8185 11.8185 12.2036 12.2036 12.6337 12.6337 12.8829 12.8829 14.1698 14.1698 14.9147 14.9147 15.7956 15.7956 16.2712 16.2712 16.5477 16.5477 k = 0.2593 0.1278-0.0000 ( 3192 PWs) bands (ev): -54.6762 -54.6762 -54.6559 -54.6559 -27.5769 -27.5769 -27.5231 -27.5231 -18.9930 -18.9930 -18.9171 -18.9171 -18.8378 -18.8378 -18.6928 -18.6928 -1.4697 -1.4697 0.2160 0.2160 1.2580 1.2580 5.2152 5.2152 6.1689 6.1689 7.0003 7.0003 7.2604 7.2604 9.3852 9.3852 9.5759 9.5759 10.4355 10.4355 10.6627 10.6627 11.5989 11.5989 11.8180 11.8180 12.1940 12.1940 12.6350 12.6350 12.9419 12.9419 14.1930 14.1930 14.8520 14.8520 15.7608 15.7608 16.2694 16.2694 16.5131 16.5131 k = 0.2407 0.1187-0.0000 ( 3198 PWs) bands (ev): -54.6762 -54.6762 -54.6559 -54.6559 -27.5773 -27.5773 -27.5228 -27.5228 -18.9944 -18.9944 -18.9165 -18.9165 -18.8384 -18.8384 -18.6914 -18.6914 -1.4996 -1.4996 0.2762 0.2762 1.2531 1.2531 5.2146 5.2146 6.1284 6.1284 6.9014 6.9014 7.2604 7.2604 9.4595 9.4595 9.5890 9.5890 10.4080 10.4080 10.7809 10.7809 11.6271 11.6271 11.8183 11.8183 12.1846 12.1846 12.6361 12.6361 13.0018 13.0018 14.2152 14.2152 14.7923 14.7923 15.7284 15.7284 16.2606 16.2606 16.4808 16.4808 k = 0.2222 0.1095-0.0000 ( 3194 PWs) bands (ev): -54.6762 -54.6762 -54.6559 -54.6559 -27.5775 -27.5775 -27.5225 -27.5225 -18.9958 -18.9958 -18.9158 -18.9158 -18.8389 -18.8389 -18.6900 -18.6900 -1.5279 -1.5279 0.3360 0.3360 1.2471 1.2471 5.2139 5.2139 6.0901 6.0901 6.8061 6.8061 7.2617 7.2617 9.5328 9.5328 9.6027 9.6027 10.3783 10.3783 10.8955 10.8955 11.6556 11.6556 11.8203 11.8203 12.1753 12.1753 12.6371 12.6371 13.0619 13.0619 14.2356 14.2356 14.7364 14.7364 15.6991 15.6991 16.2461 16.2461 16.4505 16.4505 k = 0.2037 0.1004-0.0000 ( 3194 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5778 -27.5778 -27.5223 -27.5223 -18.9971 -18.9971 -18.9152 -18.9152 -18.8395 -18.8395 -18.6886 -18.6886 -1.5543 -1.5543 0.3950 0.3950 1.2397 1.2397 5.2133 5.2133 6.0541 6.0541 6.7155 6.7155 7.2635 7.2635 9.6039 9.6039 9.6173 9.6173 10.3485 10.3485 11.0038 11.0038 11.6830 11.6830 11.8251 11.8251 12.1664 12.1664 12.6382 12.6382 13.1213 13.1213 14.2531 14.2531 14.6854 14.6854 15.6733 15.6733 16.2276 16.2276 16.4218 16.4218 k = 0.1852 0.0913-0.0000 ( 3196 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5780 -27.5780 -27.5220 -27.5220 -18.9983 -18.9983 -18.9146 -18.9146 -18.8400 -18.8400 -18.6874 -18.6874 -1.5788 -1.5788 0.4529 0.4529 1.2309 1.2309 5.2127 5.2127 6.0211 6.0211 6.6302 6.6302 7.2655 7.2655 9.6310 9.6310 9.6734 9.6734 10.3194 10.3194 11.1043 11.1043 11.7071 11.7071 11.8348 11.8348 12.1579 12.1579 12.6393 12.6393 13.1792 13.1792 14.2664 14.2664 14.6408 14.6408 15.6516 15.6516 16.2066 16.2066 16.3943 16.3943 k = 0.1667 0.0822-0.0000 ( 3195 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5783 -27.5783 -27.5218 -27.5218 -18.9995 -18.9995 -18.9140 -18.9140 -18.8405 -18.8405 -18.6861 -18.6861 -1.6011 -1.6011 0.5093 0.5093 1.2206 1.2206 5.2121 5.2121 5.9912 5.9912 6.5506 6.5506 7.2676 7.2676 9.6457 9.6457 9.7386 9.7386 10.2912 10.2912 11.1960 11.1960 11.7255 11.7255 11.8516 11.8516 12.1500 12.1500 12.6406 12.6406 13.2348 13.2348 14.2742 14.2742 14.6041 14.6041 15.6343 15.6343 16.1843 16.1843 16.3683 16.3683 k = 0.1481 0.0730-0.0000 ( 3199 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5785 -27.5785 -27.5216 -27.5216 -19.0006 -19.0006 -18.9135 -18.9135 -18.8410 -18.8410 -18.6850 -18.6850 -1.6214 -1.6214 0.5638 0.5638 1.2088 1.2088 5.2116 5.2116 5.9647 5.9647 6.4773 6.4773 7.2696 7.2696 9.6604 9.6604 9.7995 9.7995 10.2646 10.2646 11.2780 11.2780 11.7371 11.7371 11.8759 11.8759 12.1426 12.1426 12.6418 12.6418 13.2874 13.2874 14.2752 14.2752 14.5766 14.5766 15.6215 15.6215 16.1619 16.1619 16.3441 16.3441 k = 0.1296 0.0639-0.0000 ( 3203 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5787 -27.5787 -27.5214 -27.5214 -19.0015 -19.0015 -18.9130 -18.9130 -18.8415 -18.8415 -18.6841 -18.6841 -1.6394 -1.6394 0.6159 0.6159 1.1953 1.1953 5.2111 5.2111 5.9417 5.9417 6.4107 6.4107 7.2715 7.2715 9.6747 9.6747 9.8551 9.8551 10.2398 10.2398 11.3499 11.3499 11.7433 11.7433 11.9058 11.9058 12.1359 12.1359 12.6431 12.6431 13.3361 13.3361 14.2694 14.2694 14.5587 14.5587 15.6134 15.6134 16.1405 16.1405 16.3221 16.3221 k = 0.1111 0.0548-0.0000 ( 3203 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5789 -27.5789 -27.5212 -27.5212 -19.0024 -19.0024 -18.9126 -18.9126 -18.8419 -18.8419 -18.6831 -18.6831 -1.6551 -1.6551 0.6653 0.6653 1.1804 1.1804 5.2106 5.2106 5.9224 5.9224 6.3512 6.3512 7.2733 7.2733 9.6886 9.6886 9.9047 9.9047 10.2174 10.2174 11.4115 11.4115 11.7458 11.7458 11.9382 11.9382 12.1299 12.1299 12.6444 12.6444 13.3801 13.3801 14.2579 14.2579 14.5494 14.5494 15.6097 15.6097 16.1209 16.1209 16.3030 16.3030 k = 0.0926 0.0456-0.0000 ( 3207 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5791 -27.5791 -27.5211 -27.5211 -19.0032 -19.0032 -18.9122 -18.9122 -18.8423 -18.8423 -18.6823 -18.6823 -1.6684 -1.6684 0.7112 0.7112 1.1643 1.1643 5.2102 5.2102 5.9068 5.9068 6.2993 6.2993 7.2748 7.2748 9.7015 9.7015 9.9473 9.9473 10.1979 10.1979 11.4631 11.4631 11.7463 11.7463 11.9703 11.9703 12.1246 12.1246 12.6456 12.6456 13.4187 13.4187 14.2434 14.2434 14.5462 14.5462 15.6098 15.6098 16.1042 16.1042 16.2872 16.2872 k = 0.0741 0.0365-0.0000 ( 3207 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5792 -27.5792 -27.5209 -27.5209 -19.0038 -19.0038 -18.9119 -18.9119 -18.8427 -18.8427 -18.6817 -18.6817 -1.6794 -1.6794 0.7527 0.7527 1.1476 1.1476 5.2099 5.2099 5.8947 5.8947 6.2556 6.2556 7.2761 7.2761 9.7131 9.7131 9.9820 9.9820 10.1819 10.1819 11.5048 11.5048 11.7455 11.7455 11.9999 11.9999 12.1200 12.1200 12.6467 12.6467 13.4514 13.4514 14.2282 14.2282 14.5467 14.5467 15.6130 15.6130 16.0912 16.0912 16.2751 16.2751 k = 0.0556 0.0274-0.0000 ( 3211 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5794 -27.5794 -27.5208 -27.5208 -19.0044 -19.0044 -18.9116 -18.9116 -18.8429 -18.8429 -18.6811 -18.6811 -1.6880 -1.6880 0.7888 0.7888 1.1312 1.1312 5.2096 5.2096 5.8859 5.8859 6.2206 6.2206 7.2772 7.2772 9.7229 9.7229 10.0084 10.0084 10.1701 10.1701 11.5371 11.5371 11.7442 11.7442 12.0252 12.0252 12.1161 12.1161 12.6477 12.6477 13.4774 13.4774 14.2147 14.2147 14.5489 14.5489 15.6180 15.6180 16.0823 16.0823 16.2673 16.2673 k = 0.0370 0.0183-0.0000 ( 3213 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5795 -27.5795 -27.5207 -27.5207 -19.0047 -19.0047 -18.9114 -18.9114 -18.8431 -18.8431 -18.6807 -18.6807 -1.6941 -1.6941 0.8175 0.8175 1.1167 1.1167 5.2094 5.2094 5.8801 5.8801 6.1949 6.1949 7.2779 7.2779 9.7303 9.7303 10.0261 10.0261 10.1625 10.1625 11.5602 11.5602 11.7428 11.7428 12.0446 12.0446 12.1129 12.1129 12.6484 12.6484 13.4963 13.4963 14.2042 14.2042 14.5513 14.5513 15.6232 15.6232 16.0775 16.0775 16.2640 16.2640 k = 0.0185 0.0091-0.0000 ( 3213 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5796 -27.5796 -27.5206 -27.5206 -19.0050 -19.0050 -18.9113 -18.9113 -18.8432 -18.8432 -18.6805 -18.6805 -1.6978 -1.6978 0.8364 0.8364 1.1063 1.1063 5.2093 5.2093 5.8768 5.8768 6.1793 6.1793 7.2784 7.2784 9.7350 9.7350 10.0360 10.0360 10.1588 10.1588 11.5742 11.5742 11.7417 11.7417 12.0570 12.0570 12.1106 12.1106 12.6488 12.6488 13.5077 13.5077 14.1976 14.1976 14.5531 14.5531 15.6272 15.6272 16.0758 16.0758 16.2644 16.2644 k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5797 -27.5797 -27.5206 -27.5206 -19.0052 -19.0052 -18.9112 -18.9112 -18.8433 -18.8433 -18.6804 -18.6804 -1.6991 -1.6991 0.8431 0.8431 1.1025 1.1025 5.2092 5.2092 5.8757 5.8757 6.1740 6.1740 7.2786 7.2786 9.7366 9.7366 10.0391 10.0391 10.1577 10.1577 11.5788 11.5788 11.7413 11.7413 12.0614 12.0614 12.1098 12.1098 12.6490 12.6490 13.5116 13.5116 14.1953 14.1953 14.5537 14.5537 15.6286 15.6286 16.0755 16.0755 16.2623 16.2623 k = 0.0000 0.0000 0.0000 ( 3221 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5797 -27.5797 -27.5206 -27.5206 -19.0052 -19.0052 -18.9112 -18.9112 -18.8433 -18.8433 -18.6804 -18.6804 -1.6991 -1.6991 0.8431 0.8431 1.1025 1.1025 5.2092 5.2092 5.8757 5.8757 6.1740 6.1740 7.2786 7.2786 9.7366 9.7366 10.0391 10.0391 10.1577 10.1577 11.5788 11.5788 11.7413 11.7413 12.0614 12.0614 12.1098 12.1098 12.6490 12.6490 13.5116 13.5116 14.1953 14.1953 14.5537 14.5537 15.6286 15.6286 16.0755 16.0755 16.2623 16.2623 k = 0.0074-0.0151 0.0122 ( 3211 PWs) bands (ev): -54.6764 -54.6764 -54.6558 -54.6558 -27.5796 -27.5796 -27.5206 -27.5206 -19.0051 -19.0051 -18.9112 -18.9112 -18.8432 -18.8432 -18.6804 -18.6804 -1.6977 -1.6977 0.8440 0.8440 1.1015 1.1015 5.1763 5.1763 5.9097 5.9097 6.1720 6.1720 7.2836 7.2836 9.7368 9.7368 10.0404 10.0404 10.1584 10.1584 11.5785 11.5785 11.7378 11.7378 12.0594 12.0594 12.1071 12.1071 12.6442 12.6442 13.5117 13.5117 14.1976 14.1976 14.5543 14.5543 15.6302 15.6302 16.0730 16.0730 16.2596 16.2596 k = 0.0149-0.0301 0.0244 ( 3211 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5795 -27.5795 -27.5207 -27.5207 -19.0050 -19.0050 -18.9113 -18.9113 -18.8432 -18.8432 -18.6805 -18.6805 -1.6935 -1.6935 0.8465 0.8465 1.0984 1.0984 5.0921 5.0921 5.9967 5.9967 6.1663 6.1663 7.2986 7.2986 9.7372 9.7372 10.0443 10.0443 10.1605 10.1605 11.5775 11.5775 11.7274 11.7274 12.0532 12.0532 12.0993 12.0993 12.6305 12.6305 13.5119 13.5119 14.2040 14.2040 14.5560 14.5560 15.6347 15.6347 16.0642 16.0642 16.2472 16.2472 k = 0.0223-0.0452 0.0366 ( 3211 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5795 -27.5795 -27.5207 -27.5207 -19.0050 -19.0050 -18.9114 -18.9114 -18.8432 -18.8432 -18.6806 -18.6806 -1.6865 -1.6865 0.8507 0.8507 1.0933 1.0933 4.9800 4.9800 6.1129 6.1129 6.1580 6.1580 7.3230 7.3230 9.7378 9.7378 10.0508 10.0508 10.1640 10.1640 11.5754 11.5754 11.7103 11.7103 12.0423 12.0423 12.0869 12.0869 12.6090 12.6090 13.5118 13.5118 14.2140 14.2140 14.5590 14.5590 15.6420 15.6420 16.0458 16.0458 16.2335 16.2335 k = 0.0297-0.0603 0.0488 ( 3207 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5795 -27.5795 -27.5207 -27.5207 -19.0049 -19.0049 -18.9116 -18.9116 -18.8432 -18.8432 -18.6806 -18.6806 -1.6767 -1.6767 0.8566 0.8566 1.0862 1.0862 4.8543 4.8543 6.1445 6.1445 6.2473 6.2473 7.3561 7.3561 9.7387 9.7387 10.0598 10.0598 10.1691 10.1691 11.5711 11.5711 11.6876 11.6876 12.0258 12.0258 12.0705 12.0705 12.5819 12.5819 13.5111 13.5111 14.2263 14.2263 14.5635 14.5635 15.6516 15.6516 16.0149 16.0149 16.2244 16.2244 k = 0.0372-0.0754 0.0610 ( 3207 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5795 -27.5795 -27.5208 -27.5208 -19.0048 -19.0048 -18.9118 -18.9118 -18.8432 -18.8432 -18.6807 -18.6807 -1.6641 -1.6641 0.8642 0.8642 1.0770 1.0770 4.7220 4.7220 6.1314 6.1314 6.3881 6.3881 7.3969 7.3969 9.7398 9.7398 10.0711 10.0711 10.1758 10.1758 11.5619 11.5619 11.6617 11.6617 12.0027 12.0027 12.0504 12.0504 12.5516 12.5516 13.5091 13.5091 14.2397 14.2397 14.5699 14.5699 15.6619 15.6619 15.9724 15.9724 16.2218 16.2218 k = 0.0446-0.0904 0.0732 ( 3203 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5794 -27.5794 -27.5208 -27.5208 -19.0047 -19.0047 -18.9120 -18.9120 -18.8432 -18.8432 -18.6809 -18.6809 -1.6488 -1.6488 0.8733 0.8733 1.0659 1.0659 4.5865 4.5865 6.1173 6.1173 6.5341 6.5341 7.4446 7.4446 9.7411 9.7411 10.0845 10.0845 10.1844 10.1844 11.5425 11.5425 11.6381 11.6381 11.9728 11.9728 12.0263 12.0263 12.5212 12.5212 13.5052 13.5052 14.2531 14.2531 14.5782 14.5782 15.6688 15.6688 15.9249 15.9249 16.2245 16.2245 k = 0.0520-0.1055 0.0853 ( 3199 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5793 -27.5793 -27.5209 -27.5209 -19.0046 -19.0046 -18.9122 -18.9122 -18.8431 -18.8431 -18.6810 -18.6810 -1.6307 -1.6307 0.8839 0.8839 1.0529 1.0529 4.4496 4.4496 6.1033 6.1033 6.6833 6.6833 7.4983 7.4983 9.7427 9.7427 10.0998 10.0998 10.1950 10.1950 11.5075 11.5075 11.6222 11.6222 11.9361 11.9361 11.9973 11.9973 12.4936 12.4936 13.4990 13.4990 14.2653 14.2653 14.5887 14.5887 15.6624 15.6624 15.8857 15.8857 16.2305 16.2305 k = 0.0594-0.1206 0.0975 ( 3197 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5793 -27.5793 -27.5209 -27.5209 -19.0045 -19.0045 -18.9124 -18.9124 -18.8431 -18.8431 -18.6812 -18.6812 -1.6099 -1.6099 0.8957 0.8957 1.0383 1.0383 4.3122 4.3122 6.0903 6.0903 6.8345 6.8345 7.5570 7.5570 9.7444 9.7444 10.1165 10.1165 10.2081 10.2081 11.4576 11.4576 11.6135 11.6135 11.8926 11.8926 11.9633 11.9633 12.4710 12.4710 13.4900 13.4900 14.2756 14.2756 14.6014 14.6014 15.6288 15.6288 15.8714 15.8714 16.2381 16.2381 k = 0.0669-0.1357 0.1097 ( 3187 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5792 -27.5792 -27.5209 -27.5209 -19.0044 -19.0044 -18.9126 -18.9126 -18.8431 -18.8431 -18.6813 -18.6813 -1.5864 -1.5864 0.9082 0.9082 1.0225 1.0225 4.1752 4.1752 6.0789 6.0789 6.9868 6.9868 7.6201 7.6201 9.7463 9.7463 10.1342 10.1342 10.2240 10.2240 11.3966 11.3966 11.6078 11.6078 11.8425 11.8425 11.9248 11.9248 12.4547 12.4547 13.4779 13.4779 14.2838 14.2838 14.6161 14.6161 15.5672 15.5672 15.8851 15.8851 16.2462 16.2462 k = 0.0743-0.1507 0.1219 ( 3191 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5792 -27.5792 -27.5210 -27.5210 -19.0042 -19.0042 -18.9130 -18.9130 -18.8431 -18.8431 -18.6816 -18.6816 -1.5603 -1.5603 0.9200 0.9200 1.0069 1.0069 4.0388 4.0388 6.0700 6.0700 7.1398 7.1398 7.6869 7.6869 9.7484 9.7484 10.1522 10.1522 10.2432 10.2432 11.3272 11.3272 11.6018 11.6018 11.7871 11.7871 11.8832 11.8832 12.4449 12.4449 13.4625 13.4625 14.2895 14.2895 14.6324 14.6324 15.4885 15.4885 15.9169 15.9169 16.2543 16.2543 k = 0.0817-0.1658 0.1341 ( 3195 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5791 -27.5791 -27.5211 -27.5211 -19.0041 -19.0041 -18.9134 -18.9134 -18.8431 -18.8431 -18.6820 -18.6820 -1.5316 -1.5316 0.9270 0.9270 0.9958 0.9958 3.9034 3.9034 6.0638 6.0638 7.2928 7.2928 7.7569 7.7569 9.7506 9.7506 10.1704 10.1704 10.2660 10.2660 11.2510 11.2510 11.5903 11.5903 11.7305 11.7305 11.8398 11.8398 12.4410 12.4410 13.4439 13.4439 14.2931 14.2931 14.6499 14.6499 15.4009 15.4009 15.9591 15.9591 16.2627 16.2627 k = 0.0892-0.1809 0.1463 ( 3191 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5791 -27.5791 -27.5212 -27.5212 -19.0039 -19.0039 -18.9137 -18.9137 -18.8431 -18.8431 -18.6823 -18.6823 -1.5002 -1.5002 0.9216 0.9216 0.9966 0.9966 3.7691 3.7691 6.0611 6.0611 7.4456 7.4456 7.8295 7.8295 9.7529 9.7529 10.1883 10.1883 10.2923 10.2923 11.1692 11.1692 11.5626 11.5626 11.6841 11.6841 11.7959 11.7959 12.4420 12.4420 13.4221 13.4221 14.2949 14.2949 14.6680 14.6680 15.3085 15.3085 16.0071 16.0071 16.2726 16.2726 k = 0.0966-0.1960 0.1585 ( 3195 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5791 -27.5791 -27.5213 -27.5213 -19.0037 -19.0037 -18.9142 -18.9142 -18.8431 -18.8431 -18.6826 -18.6826 -1.4664 -1.4664 0.9034 0.9034 1.0099 1.0099 3.6362 3.6362 6.0620 6.0620 7.5976 7.5976 7.9043 7.9043 9.7553 9.7553 10.2061 10.2061 10.3217 10.3217 11.0828 11.0828 11.5083 11.5083 11.6584 11.6584 11.7526 11.7526 12.4468 12.4468 13.3974 13.3974 14.2951 14.2951 14.6864 14.6864 15.2135 15.2135 16.0566 16.0566 16.2864 16.2864 k = 0.1040-0.2110 0.1707 ( 3199 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5791 -27.5791 -27.5214 -27.5214 -19.0036 -19.0036 -18.9146 -18.9146 -18.8431 -18.8431 -18.6829 -18.6829 -1.4300 -1.4300 0.8780 0.8780 1.0299 1.0299 3.5047 3.5047 6.0669 6.0669 7.7485 7.7485 7.9810 7.9810 9.7577 9.7577 10.2240 10.2240 10.3536 10.3536 10.9932 10.9932 11.4347 11.4347 11.6448 11.6448 11.7127 11.7127 12.4544 12.4544 13.3701 13.3701 14.2942 14.2942 14.7048 14.7048 15.1171 15.1171 16.1022 16.1022 16.3084 16.3084 k = 0.1115-0.2261 0.1829 ( 3193 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5790 -27.5790 -27.5215 -27.5215 -19.0034 -19.0034 -18.9150 -18.9150 -18.8431 -18.8431 -18.6832 -18.6832 -1.3912 -1.3912 0.8485 0.8485 1.0538 1.0538 3.3747 3.3747 6.0760 6.0760 7.8978 7.8978 8.0592 8.0592 9.7601 9.7601 10.2420 10.2420 10.3865 10.3865 10.9021 10.9021 11.3520 11.3520 11.6261 11.6261 11.6847 11.6847 12.4637 12.4637 13.3407 13.3407 14.2924 14.2924 14.7227 14.7227 15.0202 15.0202 16.1382 16.1382 16.3430 16.3430 k = 0.1189-0.2412 0.1951 ( 3201 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5790 -27.5790 -27.5217 -27.5217 -19.0032 -19.0032 -18.9155 -18.9155 -18.8431 -18.8431 -18.6836 -18.6836 -1.3501 -1.3501 0.8160 0.8160 1.0804 1.0804 3.2464 3.2464 6.0895 6.0895 8.0450 8.0450 8.1386 8.1386 9.7625 9.7625 10.2602 10.2602 10.4176 10.4176 10.8128 10.8128 11.2645 11.2645 11.5922 11.5922 11.6752 11.6752 12.4739 12.4739 13.3095 13.3095 14.2898 14.2898 14.7401 14.7401 14.9234 14.9234 16.1622 16.1622 16.3901 16.3901 k = 0.1263-0.2563 0.2073 ( 3205 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5790 -27.5790 -27.5218 -27.5218 -19.0030 -19.0030 -18.9160 -18.9160 -18.8431 -18.8431 -18.6840 -18.6840 -1.3066 -1.3066 0.7809 0.7809 1.1094 1.1094 3.1198 3.1198 6.1076 6.1076 8.1896 8.1896 8.2191 8.2191 9.7649 9.7649 10.2783 10.2783 10.4400 10.4400 10.7331 10.7331 11.1742 11.1742 11.5505 11.5505 11.6757 11.6757 12.4842 12.4842 13.2770 13.2770 14.2867 14.2867 14.7557 14.7557 14.8284 14.8284 16.1771 16.1771 16.4412 16.4412 k = 0.1338-0.2713 0.2195 ( 3205 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5789 -27.5789 -27.5219 -27.5219 -19.0028 -19.0028 -18.9164 -18.9164 -18.8430 -18.8430 -18.6844 -18.6844 -1.2608 -1.2608 0.7436 0.7436 1.1405 1.1405 2.9950 2.9950 6.1303 6.1303 8.3000 8.3000 8.3315 8.3315 9.7673 9.7673 10.2950 10.2950 10.4369 10.4369 10.6814 10.6814 11.0825 11.0825 11.5067 11.5067 11.6803 11.6803 12.4941 12.4941 13.2437 13.2437 14.2827 14.2827 14.7258 14.7258 14.7794 14.7794 16.1870 16.1870 16.4802 16.4802 k = 0.1412-0.2864 0.2317 ( 3207 PWs) bands (ev): -54.6764 -54.6764 -54.6557 -54.6557 -27.5789 -27.5789 -27.5220 -27.5220 -19.0025 -19.0025 -18.9169 -18.9169 -18.8430 -18.8430 -18.6848 -18.6848 -1.2129 -1.2129 0.7042 0.7042 1.1737 1.1737 2.8720 2.8720 6.1576 6.1576 8.3817 8.3817 8.4693 8.4693 9.7695 9.7695 10.3028 10.3028 10.3985 10.3985 10.6754 10.6754 10.9901 10.9901 11.4623 11.4623 11.6872 11.6872 12.5030 12.5030 13.2100 13.2100 14.2774 14.2774 14.6345 14.6345 14.7935 14.7935 16.1944 16.1944 16.4931 16.4931 k = 0.1486-0.3015 0.2439 ( 3201 PWs) bands (ev): -54.6763 -54.6763 -54.6557 -54.6557 -27.5788 -27.5788 -27.5221 -27.5221 -19.0022 -19.0022 -18.9174 -18.9174 -18.8429 -18.8429 -18.6852 -18.6852 -1.1629 -1.1629 0.6629 0.6629 1.2090 1.2090 2.7509 2.7509 6.1896 6.1896 8.4638 8.4638 8.6030 8.6030 9.7716 9.7716 10.2652 10.2652 10.3736 10.3736 10.7029 10.7029 10.8976 10.8976 11.4180 11.4180 11.6958 11.6958 12.5102 12.5102 13.1762 13.1762 14.2689 14.2689 14.5447 14.5447 14.8100 14.8100 16.2008 16.2008 16.4817 16.4817 k = 0.1560-0.3166 0.2560 ( 3205 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5787 -27.5787 -27.5223 -27.5223 -19.0019 -19.0019 -18.9179 -18.9179 -18.8428 -18.8428 -18.6857 -18.6857 -1.1109 -1.1109 0.6197 0.6197 1.2463 1.2463 2.6317 2.6317 6.2262 6.2262 8.5459 8.5459 8.7319 8.7319 9.7735 9.7735 10.1777 10.1777 10.3851 10.3851 10.7446 10.7446 10.8065 10.8065 11.3743 11.3743 11.7058 11.7058 12.5154 12.5154 13.1427 13.1427 14.2527 14.2527 14.4629 14.4629 14.8271 14.8271 16.2057 16.2057 16.4546 16.4546 k = 0.1635-0.3316 0.2682 ( 3209 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5787 -27.5787 -27.5224 -27.5224 -19.0016 -19.0016 -18.9184 -18.9184 -18.8428 -18.8428 -18.6862 -18.6862 -1.0569 -1.0569 0.5750 0.5750 1.2857 1.2857 2.5146 2.5146 6.2675 6.2675 8.6281 8.6281 8.8551 8.8551 9.7752 9.7752 10.0754 10.0754 10.4062 10.4062 10.7110 10.7110 10.7986 10.7986 11.3315 11.3315 11.7170 11.7170 12.5183 12.5183 13.1099 13.1099 14.2188 14.2188 14.3996 14.3996 14.8450 14.8450 16.2068 16.2068 16.4196 16.4196 k = 0.1709-0.3467 0.2804 ( 3199 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5786 -27.5786 -27.5225 -27.5225 -19.0012 -19.0012 -18.9188 -18.9188 -18.8427 -18.8427 -18.6866 -18.6866 -1.0011 -1.0011 0.5287 0.5287 1.3271 1.3271 2.3995 2.3995 6.3132 6.3132 8.7100 8.7100 8.9722 8.9722 9.7764 9.7764 9.9683 9.9683 10.4305 10.4305 10.6209 10.6209 10.8517 10.8517 11.2901 11.2901 11.7293 11.7293 12.5186 12.5186 13.0780 13.0780 14.1584 14.1584 14.3639 14.3639 14.8641 14.8641 16.1980 16.1980 16.3862 16.3862 k = 0.1783-0.3618 0.2926 ( 3203 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5785 -27.5785 -27.5227 -27.5227 -19.0009 -19.0009 -18.9193 -18.9193 -18.8426 -18.8426 -18.6871 -18.6871 -0.9436 -0.9436 0.4811 0.4811 1.3705 1.3705 2.2865 2.2865 6.3632 6.3632 8.7916 8.7916 9.0824 9.0824 9.7757 9.7757 9.8605 9.8605 10.4564 10.4564 10.5315 10.5315 10.9067 10.9067 11.2511 11.2511 11.7424 11.7424 12.5162 12.5162 13.0473 13.0473 14.0784 14.0784 14.3490 14.3490 14.8848 14.8848 16.1704 16.1704 16.3661 16.3661 k = 0.1858-0.3769 0.3048 ( 3203 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5784 -27.5784 -27.5228 -27.5228 -19.0005 -19.0005 -18.9198 -18.9198 -18.8424 -18.8424 -18.6876 -18.6876 -0.8845 -0.8845 0.4323 0.4323 1.4159 1.4159 2.1758 2.1758 6.4175 6.4175 8.8726 8.8726 9.1851 9.1851 9.7379 9.7379 9.7887 9.7887 10.4415 10.4415 10.4860 10.4860 10.9597 10.9597 11.2166 11.2166 11.7557 11.7557 12.5109 12.5109 13.0178 13.0178 13.9899 13.9899 14.3446 14.3446 14.9072 14.9072 16.1214 16.1214 16.3646 16.3646 k = 0.1932-0.3919 0.3170 ( 3191 PWs) bands (ev): -54.6763 -54.6763 -54.6558 -54.6558 -27.5783 -27.5783 -27.5228 -27.5228 -19.0000 -19.0000 -18.9201 -18.9201 -18.8423 -18.8423 -18.6880 -18.6880 -0.8239 -0.8239 0.3823 0.3823 1.4633 1.4633 2.0675 2.0675 6.4759 6.4759 8.9528 8.9528 9.2798 9.2798 9.6319 9.6319 9.7846 9.7846 10.3556 10.3556 10.5146 10.5146 11.0041 11.0041 11.1924 11.1924 11.7688 11.7688 12.5030 12.5030 12.9897 12.9897 13.8989 13.8989 14.3454 14.3454 14.9317 14.9317 16.0584 16.0584 16.3767 16.3767 k = 0.2006-0.4070 0.3292 ( 3189 PWs) bands (ev): -54.6762 -54.6762 -54.6558 -54.6558 -27.5782 -27.5782 -27.5229 -27.5229 -18.9996 -18.9996 -18.9205 -18.9205 -18.8422 -18.8422 -18.6885 -18.6885 -0.7618 -0.7618 0.3315 0.3315 1.5123 1.5123 1.9619 1.9619 6.5381 6.5381 9.0318 9.0318 9.3658 9.3658 9.5222 9.5222 9.7847 9.7847 10.2711 10.2711 10.5453 10.5453 11.0260 11.0260 11.1914 11.1914 11.7806 11.7806 12.4924 12.4924 12.9631 12.9631 13.8090 13.8090 14.3491 14.3491 14.9585 14.9585 15.9890 15.9890 16.3972 16.3972 k = 0.2081-0.4221 0.3414 ( 3185 PWs) bands (ev): -54.6762 -54.6762 -54.6558 -54.6558 -27.5781 -27.5781 -27.5230 -27.5230 -18.9992 -18.9992 -18.9209 -18.9209 -18.8420 -18.8420 -18.6890 -18.6890 -0.6986 -0.6986 0.2799 0.2799 1.5623 1.5623 1.8598 1.8598 6.6040 6.6040 9.1091 9.1091 9.4091 9.4091 9.4469 9.4469 9.7850 9.7850 10.1890 10.1890 10.5773 10.5773 11.0179 11.0179 11.2200 11.2200 11.7898 11.7898 12.4796 12.4796 12.9380 12.9380 13.7229 13.7229 14.3548 14.3548 14.9877 14.9877 15.9180 15.9180 16.4229 16.4229 k = 0.2155-0.4372 0.3536 ( 3183 PWs) bands (ev): -54.6762 -54.6762 -54.6558 -54.6558 -27.5780 -27.5780 -27.5231 -27.5231 -18.9987 -18.9987 -18.9212 -18.9212 -18.8418 -18.8418 -18.6895 -18.6895 -0.6343 -0.6343 0.2276 0.2276 1.6092 1.6092 1.7653 1.7653 6.6734 6.6734 9.1828 9.1828 9.3046 9.3046 9.5132 9.5132 9.7851 9.7851 10.1102 10.1102 10.6106 10.6106 10.9923 10.9923 11.2645 11.2645 11.7950 11.7950 12.4647 12.4647 12.9144 12.9144 13.6435 13.6435 14.3618 14.3618 15.0194 15.0194 15.8486 15.8486 16.4524 16.4524 k = 0.2229-0.4522 0.3658 ( 3181 PWs) bands (ev): -54.6762 -54.6762 -54.6558 -54.6558 -27.5779 -27.5779 -27.5232 -27.5232 -18.9982 -18.9982 -18.9215 -18.9215 -18.8417 -18.8417 -18.6901 -18.6901 -0.5691 -0.5691 0.1749 0.1749 1.6166 1.6166 1.7150 1.7150 6.7459 6.7459 9.1864 9.1864 9.2664 9.2664 9.5726 9.5726 9.7845 9.7845 10.0356 10.0356 10.6451 10.6451 10.9603 10.9603 11.3120 11.3120 11.7943 11.7943 12.4481 12.4481 12.8922 12.8922 13.5741 13.5741 14.3699 14.3699 15.0536 15.0536 15.7829 15.7829 16.4845 16.4845 k = 0.2304-0.4673 0.3780 ( 3181 PWs) bands (ev): -54.6762 -54.6762 -54.6558 -54.6558 -27.5778 -27.5778 -27.5233 -27.5233 -18.9977 -18.9977 -18.9219 -18.9219 -18.8415 -18.8415 -18.6906 -18.6906 -0.5031 -0.5031 0.1219 0.1219 1.5414 1.5414 1.7521 1.7521 6.8214 6.8214 9.0845 9.0845 9.3312 9.3312 9.6231 9.6231 9.7829 9.7829 9.9674 9.9674 10.6807 10.6807 10.9265 10.9265 11.3557 11.3557 11.7866 11.7866 12.4303 12.4303 12.8712 12.8712 13.5181 13.5181 14.3786 14.3786 15.0902 15.0902 15.7225 15.7225 16.5188 16.5188 k = 0.2378-0.4824 0.3902 ( 3169 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5776 -27.5776 -27.5234 -27.5234 -18.9971 -18.9971 -18.9222 -18.9222 -18.8411 -18.8411 -18.6911 -18.6911 -0.4366 -0.4366 0.0687 0.0687 1.4509 1.4509 1.8094 1.8094 6.8996 6.8996 8.9806 8.9806 9.3926 9.3926 9.6647 9.6647 9.7792 9.7792 9.9095 9.9095 10.7170 10.7170 10.8930 10.8930 11.3897 11.3897 11.7724 11.7724 12.4116 12.4116 12.8514 12.8514 13.4786 13.4786 14.3879 14.3879 15.1290 15.1290 15.6683 15.6683 16.5546 16.5546 k = 0.2452-0.4975 0.4024 ( 3169 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5774 -27.5774 -27.5235 -27.5235 -18.9966 -18.9966 -18.9225 -18.9225 -18.8409 -18.8409 -18.6917 -18.6917 -0.3699 -0.3699 0.0156 0.0156 1.3601 1.3601 1.8720 1.8720 6.9800 6.9800 8.8783 8.8783 9.4419 9.4419 9.6972 9.6972 9.7726 9.7726 9.8686 9.8686 10.7524 10.7524 10.8620 10.8620 11.4065 11.4065 11.7553 11.7553 12.3926 12.3926 12.8327 12.8327 13.4581 13.4581 14.3974 14.3974 15.1697 15.1697 15.6211 15.6211 16.5915 16.5915 k = 0.2526-0.5125 0.4146 ( 3173 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5774 -27.5774 -27.5237 -27.5237 -18.9961 -18.9961 -18.9228 -18.9228 -18.8407 -18.8407 -18.6923 -18.6923 -0.3032 -0.3032 -0.0372 -0.0372 1.2710 1.2710 1.9380 1.9380 7.0625 7.0625 8.7781 8.7781 9.4693 9.4693 9.7197 9.7197 9.7682 9.7682 9.8505 9.8505 10.7790 10.7790 10.8421 10.8421 11.3967 11.3967 11.7430 11.7430 12.3736 12.3736 12.8150 12.8150 13.4577 13.4577 14.4069 14.4069 15.2122 15.2122 15.5815 15.5815 16.6291 16.6291 k = 0.2601-0.5276 0.4267 ( 3177 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5773 -27.5773 -27.5238 -27.5238 -18.9955 -18.9955 -18.9231 -18.9231 -18.8405 -18.8405 -18.6929 -18.6929 -0.2375 -0.2375 -0.0889 -0.0889 1.1844 1.1844 2.0070 2.0070 7.1466 7.1466 8.6802 8.6802 9.4659 9.4659 9.7334 9.7334 9.7746 9.7746 9.8546 9.8546 10.7730 10.7730 10.8574 10.8574 11.3532 11.3532 11.7421 11.7421 12.3552 12.3552 12.7982 12.7982 13.4767 13.4767 14.4164 14.4164 15.2562 15.2562 15.5497 15.5497 16.6670 16.6670 k = 0.2675-0.5427 0.4389 ( 3175 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5771 -27.5771 -27.5239 -27.5239 -18.9949 -18.9949 -18.9233 -18.9233 -18.8402 -18.8402 -18.6934 -18.6934 -0.1804 -0.1804 -0.1322 -0.1322 1.1005 1.1005 2.0787 2.0787 7.2321 7.2321 8.5849 8.5849 9.4354 9.4354 9.7427 9.7427 9.7843 9.7843 9.8807 9.8807 10.7478 10.7478 10.8943 10.8943 11.2776 11.2776 11.7520 11.7520 12.3377 12.3377 12.7824 12.7824 13.5135 13.5135 14.4256 14.4256 15.3013 15.3013 15.5260 15.5260 16.7047 16.7047 k = 0.2749-0.5578 0.4511 ( 3173 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5770 -27.5770 -27.5240 -27.5240 -18.9944 -18.9944 -18.9235 -18.9235 -18.8400 -18.8400 -18.6939 -18.6939 -0.2016 -0.2016 -0.0974 -0.0974 1.0197 1.0197 2.1533 2.1533 7.3184 7.3184 8.4924 8.4924 9.3892 9.3892 9.7478 9.7478 9.7889 9.7889 9.9262 9.9262 10.7199 10.7199 10.9365 10.9365 11.1770 11.1770 11.7678 11.7678 12.3214 12.3214 12.7675 12.7675 13.5658 13.5658 14.4344 14.4344 15.3472 15.3472 15.5106 15.5106 16.7417 16.7417 k = 0.2824-0.5728 0.4633 ( 3179 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5770 -27.5770 -27.5241 -27.5241 -18.9938 -18.9938 -18.9236 -18.9236 -18.8397 -18.8397 -18.6945 -18.6945 -0.2510 -0.2510 -0.0353 -0.0353 0.9424 0.9424 2.2307 2.2307 7.4052 7.4052 8.4027 8.4027 9.3358 9.3358 9.7489 9.7489 9.7878 9.7878 9.9831 9.9831 10.6920 10.6920 10.9793 10.9793 11.0603 11.0603 11.7849 11.7849 12.3068 12.3068 12.7533 12.7533 13.6307 13.6307 14.4426 14.4426 15.3935 15.3935 15.5034 15.5034 16.7774 16.7774 k = 0.2898-0.5879 0.4755 ( 3176 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9933 -18.9933 -18.9237 -18.9237 -18.8395 -18.8395 -18.6950 -18.6950 -0.3013 -0.3013 0.0266 0.0266 0.8691 0.8691 2.3109 2.3109 7.4920 7.4920 8.3160 8.3160 9.2796 9.2796 9.7468 9.7468 9.7823 9.7823 10.0457 10.0457 10.6634 10.6634 10.9235 10.9235 11.0322 11.0322 11.8005 11.8005 12.2942 12.2942 12.7397 12.7397 13.7057 13.7057 14.4500 14.4500 15.4400 15.4400 15.5045 15.5045 16.8106 16.8106 k = 0.2898-0.5879 0.4755 ( 3176 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9933 -18.9933 -18.9237 -18.9237 -18.8395 -18.8395 -18.6950 -18.6950 -0.3013 -0.3013 0.0266 0.0266 0.8691 0.8691 2.3109 2.3109 7.4920 7.4920 8.3160 8.3160 9.2796 9.2796 9.7468 9.7468 9.7823 9.7823 10.0457 10.0457 10.6634 10.6634 10.9235 10.9235 11.0322 11.0322 11.8005 11.8005 12.2942 12.2942 12.7397 12.7397 13.7057 13.7057 14.4500 14.4500 15.4400 15.4400 15.5045 15.5045 16.8106 16.8106 k = 0.3038-0.5743 0.4712 ( 3177 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9935 -18.9935 -18.9237 -18.9237 -18.8396 -18.8396 -18.6948 -18.6948 -0.2849 -0.2849 0.0052 0.0052 0.8971 0.8971 2.2806 2.2806 7.4620 7.4620 8.3439 8.3439 9.2882 9.2882 9.7528 9.7528 9.7938 9.7938 10.0257 10.0257 10.6652 10.6652 10.9656 10.9656 11.0321 11.0321 11.7949 11.7949 12.2957 12.2957 12.7391 12.7391 13.6777 13.6777 14.4524 14.4524 15.4096 15.4096 15.5203 15.5203 16.7963 16.7963 k = 0.3178-0.5607 0.4668 ( 3177 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9937 -18.9937 -18.9237 -18.9237 -18.8396 -18.8396 -18.6946 -18.6946 -0.2713 -0.2713 -0.0153 -0.0153 0.9302 0.9302 2.2479 2.2479 7.4345 7.4345 8.3662 8.3662 9.2769 9.2769 9.7609 9.7609 9.8210 9.8210 10.0179 10.0179 10.6491 10.6491 10.9983 10.9983 11.0633 11.0633 11.7882 11.7882 12.2914 12.2914 12.7279 12.7279 13.6505 13.6505 14.4644 14.4644 15.3714 15.3714 15.5517 15.5517 16.7765 16.7765 k = 0.3318-0.5471 0.4625 ( 3174 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5769 -27.5769 -27.5241 -27.5241 -18.9939 -18.9939 -18.9236 -18.9236 -18.8397 -18.8397 -18.6944 -18.6944 -0.2601 -0.2601 -0.0351 -0.0351 0.9681 0.9681 2.2128 2.2128 7.4100 7.4100 8.3822 8.3822 9.2544 9.2544 9.7674 9.7674 9.8433 9.8433 10.0388 10.0388 10.6190 10.6190 11.0321 11.0321 11.1106 11.1106 11.7801 11.7801 12.2813 12.2813 12.7064 12.7064 13.6245 13.6245 14.4854 14.4854 15.3350 15.3350 15.5894 15.5894 16.7519 16.7519 k = 0.3459-0.5335 0.4581 ( 3168 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5770 -27.5770 -27.5240 -27.5240 -18.9941 -18.9941 -18.9236 -18.9236 -18.8398 -18.8398 -18.6940 -18.6940 -0.2510 -0.2510 -0.0540 -0.0540 1.0102 1.0102 2.1752 2.1752 7.3890 7.3890 8.3911 8.3911 9.2288 9.2288 9.7727 9.7727 9.8436 9.8436 10.0974 10.0974 10.5808 10.5808 11.0718 11.0718 11.1629 11.1629 11.7705 11.7705 12.2651 12.2651 12.6752 12.6752 13.6001 13.6001 14.5145 14.5145 15.3022 15.3022 15.6315 15.6315 16.7229 16.7229 k = 0.3599-0.5199 0.4537 ( 3165 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5770 -27.5770 -27.5239 -27.5239 -18.9944 -18.9944 -18.9235 -18.9235 -18.8398 -18.8398 -18.6938 -18.6938 -0.2437 -0.2437 -0.0719 -0.0719 1.0561 1.0561 2.1352 2.1352 7.3714 7.3714 8.3930 8.3930 9.2054 9.2054 9.7748 9.7748 9.8315 9.8315 10.1810 10.1810 10.5392 10.5392 11.1153 11.1153 11.2173 11.2173 11.7590 11.7590 12.2431 12.2431 12.6356 12.6356 13.5776 13.5776 14.5500 14.5500 15.2736 15.2736 15.6774 15.6774 16.6901 16.6901 k = 0.3739-0.5063 0.4494 ( 3166 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5771 -27.5771 -27.5238 -27.5238 -18.9947 -18.9947 -18.9235 -18.9235 -18.8399 -18.8399 -18.6935 -18.6935 -0.2377 -0.2377 -0.0889 -0.0889 1.1053 1.1053 2.0927 2.0927 7.3572 7.3572 8.3880 8.3880 9.1871 9.1871 9.7671 9.7671 9.8232 9.8232 10.2758 10.2758 10.4976 10.4976 11.1599 11.1599 11.2730 11.2730 11.7452 11.7452 12.2159 12.2159 12.5888 12.5888 13.5572 13.5572 14.5901 14.5901 15.2493 15.2493 15.7266 15.7266 16.6539 16.6539 k = 0.3879-0.4927 0.4450 ( 3169 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5772 -27.5772 -27.5238 -27.5238 -18.9949 -18.9949 -18.9235 -18.9235 -18.8400 -18.8400 -18.6933 -18.6933 -0.2327 -0.2327 -0.1048 -0.1048 1.1572 1.1572 2.0479 2.0479 7.3462 7.3462 8.3770 8.3770 9.1751 9.1751 9.7466 9.7466 9.8260 9.8260 10.3692 10.3692 10.4640 10.4640 11.2034 11.2034 11.3298 11.3298 11.7287 11.7287 12.1845 12.1845 12.5360 12.5360 13.5391 13.5391 14.6329 14.6329 15.2296 15.2296 15.7787 15.7787 16.6149 16.6149 k = 0.4019-0.4791 0.4407 ( 3169 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5772 -27.5772 -27.5237 -27.5237 -18.9952 -18.9952 -18.9234 -18.9234 -18.8400 -18.8400 -18.6930 -18.6930 -0.2283 -0.2283 -0.1198 -0.1198 1.2114 1.2114 2.0009 2.0009 7.3381 7.3381 8.3615 8.3615 9.1695 9.1695 9.7201 9.7201 9.8352 9.8352 10.3940 10.3940 10.5030 10.5030 11.2440 11.2440 11.3870 11.3870 11.7097 11.7097 12.1501 12.1501 12.4787 12.4787 13.5234 13.5234 14.6760 14.6760 15.2146 15.2146 15.8331 15.8331 16.5738 16.5738 k = 0.4159-0.4655 0.4363 ( 3175 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5773 -27.5773 -27.5237 -27.5237 -18.9954 -18.9954 -18.9235 -18.9235 -18.8401 -18.8401 -18.6928 -18.6928 -0.2242 -0.2242 -0.1336 -0.1336 1.2675 1.2675 1.9516 1.9516 7.3327 7.3327 8.3431 8.3431 9.1693 9.1693 9.6923 9.6923 9.8472 9.8472 10.3621 10.3621 10.6016 10.6016 11.2803 11.2803 11.4430 11.4430 11.6887 11.6887 12.1145 12.1145 12.4183 12.4183 13.5100 13.5100 14.7174 14.7174 15.2045 15.2045 15.8888 15.8888 16.5318 16.5318 k = 0.4299-0.4519 0.4320 ( 3174 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5773 -27.5773 -27.5237 -27.5237 -18.9956 -18.9956 -18.9235 -18.9235 -18.8401 -18.8401 -18.6926 -18.6926 -0.2202 -0.2202 -0.1463 -0.1463 1.3249 1.3249 1.9005 1.9005 7.3293 7.3293 8.3237 8.3237 9.1734 9.1734 9.6653 9.6653 9.8603 9.8603 10.3277 10.3277 10.7042 10.7042 11.3106 11.3106 11.4930 11.4930 11.6699 11.6699 12.0795 12.0795 12.3565 12.3565 13.4989 13.4989 14.7548 14.7548 15.1993 15.1993 15.9450 15.9450 16.4908 16.4908 k = 0.4439-0.4383 0.4276 ( 3172 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5774 -27.5774 -27.5236 -27.5236 -18.9957 -18.9957 -18.9234 -18.9234 -18.8402 -18.8402 -18.6925 -18.6925 -0.2160 -0.2160 -0.1580 -0.1580 1.3832 1.3832 1.8475 1.8475 7.3275 7.3275 8.3050 8.3050 9.1802 9.1802 9.6405 9.6405 9.8736 9.8736 10.2963 10.2963 10.8044 10.8044 11.3332 11.3332 11.5240 11.5240 11.6658 11.6658 12.0470 12.0470 12.2951 12.2951 13.4900 13.4900 14.7866 14.7866 15.1985 15.1985 16.0000 16.0000 16.4529 16.4529 k = 0.4580-0.4247 0.4233 ( 3172 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5774 -27.5774 -27.5236 -27.5236 -18.9959 -18.9959 -18.9234 -18.9234 -18.8402 -18.8402 -18.6923 -18.6923 -0.2115 -0.2115 -0.1685 -0.1685 1.4421 1.4421 1.7929 1.7929 7.3267 7.3267 8.2887 8.2887 9.1880 9.1880 9.6193 9.6193 9.8860 9.8860 10.2696 10.2696 10.8989 10.8989 11.3450 11.3450 11.5234 11.5234 11.6906 11.6906 12.0183 12.0183 12.2370 12.2370 13.4833 13.4833 14.8114 14.8114 15.2010 15.2010 16.0516 16.0516 16.4205 16.4205 k = 0.4720-0.4111 0.4189 ( 3178 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5775 -27.5775 -27.5236 -27.5236 -18.9960 -18.9960 -18.9235 -18.9235 -18.8402 -18.8402 -18.6923 -18.6923 -0.2064 -0.2064 -0.1780 -0.1780 1.5011 1.5011 1.7372 1.7372 7.3266 7.3266 8.2761 8.2761 9.1951 9.1951 9.6028 9.6028 9.8963 9.8963 10.2490 10.2490 10.9831 10.9831 11.3422 11.3422 11.5070 11.5070 11.7313 11.7313 11.9941 11.9941 12.1868 12.1868 13.4785 13.4785 14.8289 14.8289 15.2050 15.2050 16.0963 16.0963 16.3963 16.3963 k = 0.4860-0.3975 0.4146 ( 3182 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5775 -27.5775 -27.5236 -27.5236 -18.9961 -18.9961 -18.9235 -18.9235 -18.8402 -18.8402 -18.6922 -18.6922 -0.2006 -0.2006 -0.1865 -0.1865 1.5593 1.5593 1.6809 1.6809 7.3267 7.3267 8.2681 8.2681 9.2001 9.2001 9.5923 9.5923 9.9032 9.9032 10.2358 10.2358 11.0478 11.0478 11.3267 11.3267 11.4942 11.4942 11.7678 11.7678 11.9756 11.9756 12.1511 12.1511 13.4757 13.4757 14.8392 14.8392 15.2085 15.2085 16.1283 16.1283 16.3823 16.3823 k = 0.5000-0.3839 0.4102 ( 3182 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5775 -27.5775 -27.5236 -27.5236 -18.9961 -18.9961 -18.9235 -18.9235 -18.8402 -18.8402 -18.6922 -18.6922 -0.1940 -0.1940 -0.1939 -0.1939 1.6041 1.6041 1.6368 1.6368 7.3268 7.3268 8.2654 8.2654 9.2019 9.2019 9.5887 9.5887 9.9056 9.9056 10.2313 10.2313 11.0742 11.0742 11.3162 11.3162 11.4901 11.4901 11.7831 11.7831 11.9679 11.9679 12.1380 12.1380 13.4747 13.4747 14.8425 14.8425 15.2099 15.2099 16.1403 16.1403 16.3783 16.3783 k = 0.5000-0.3839 0.4102 ( 3182 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5775 -27.5775 -27.5236 -27.5236 -18.9961 -18.9961 -18.9235 -18.9235 -18.8402 -18.8402 -18.6922 -18.6922 -0.1940 -0.1940 -0.1939 -0.1939 1.6041 1.6041 1.6368 1.6368 7.3268 7.3268 8.2654 8.2654 9.2019 9.2019 9.5887 9.5887 9.9056 9.9056 10.2313 10.2313 11.0742 11.0742 11.3162 11.3162 11.4901 11.4901 11.7831 11.7831 11.9679 11.9679 12.1380 12.1380 13.4747 13.4747 14.8425 14.8425 15.2099 15.2099 16.1403 16.1403 16.3783 16.3783 k = 0.4946-0.3729 0.4272 ( 3180 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5775 -27.5775 -27.5236 -27.5236 -18.9961 -18.9961 -18.9236 -18.9236 -18.8403 -18.8403 -18.6922 -18.6922 -0.1944 -0.1944 -0.1918 -0.1918 1.6046 1.6046 1.6372 1.6372 7.3281 7.3281 8.2647 8.2647 9.1994 9.1994 9.5852 9.5852 9.9064 9.9064 10.2314 10.2314 11.0731 11.0731 11.3159 11.3159 11.4824 11.4824 11.7356 11.7356 12.0095 12.0095 12.1486 12.1486 13.4774 13.4774 14.8404 14.8404 15.2100 15.2100 16.1423 16.1423 16.3758 16.3758 k = 0.4891-0.3619 0.4441 ( 3180 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5776 -27.5776 -27.5237 -27.5237 -18.9960 -18.9960 -18.9238 -18.9238 -18.8408 -18.8408 -18.6924 -18.6924 -0.1932 -0.1932 -0.1878 -0.1878 1.6062 1.6062 1.6387 1.6387 7.3321 7.3321 8.2627 8.2627 9.1917 9.1917 9.5747 9.5747 9.9086 9.9086 10.2318 10.2318 11.0697 11.0697 11.3149 11.3149 11.4590 11.4590 11.6494 11.6494 12.0666 12.0666 12.1932 12.1932 13.4855 13.4855 14.8335 14.8335 15.2108 15.2108 16.1476 16.1476 16.3692 16.3692 k = 0.4837-0.3509 0.4610 ( 3182 PWs) bands (ev): -54.6761 -54.6761 -54.6558 -54.6558 -27.5777 -27.5777 -27.5238 -27.5238 -18.9958 -18.9958 -18.9241 -18.9241 -18.8415 -18.8415 -18.6927 -18.6927 -0.1903 -0.1903 -0.1820 -0.1820 1.6087 1.6087 1.6410 1.6410 7.3387 7.3387 8.2594 8.2594 9.1788 9.1788 9.5574 9.5574 9.9123 9.9123 10.2322 10.2322 11.0638 11.0638 11.3113 11.3113 11.4189 11.4189 11.5636 11.5636 12.0955 12.0955 12.2793 12.2793 13.4988 13.4988 14.8211 14.8211 15.2138 15.2138 16.1547 16.1547 16.3607 16.3607 k = 0.4783-0.3398 0.4780 ( 3184 PWs) bands (ev): -54.6761 -54.6761 -54.6557 -54.6557 -27.5779 -27.5779 -27.5241 -27.5241 -18.9956 -18.9956 -18.9247 -18.9247 -18.8424 -18.8424 -18.6931 -18.6931 -0.1857 -0.1857 -0.1744 -0.1744 1.6123 1.6123 1.6443 1.6443 7.3479 7.3479 8.2549 8.2549 9.1607 9.1607 9.5339 9.5339 9.9174 9.9174 10.2324 10.2324 11.0550 11.0550 11.2960 11.2960 11.3690 11.3690 11.4905 11.4905 12.1103 12.1103 12.3838 12.3838 13.5171 13.5171 14.8021 14.8021 15.2209 15.2209 16.1610 16.1610 16.3528 16.3528 k = 0.4728-0.3288 0.4949 ( 3182 PWs) bands (ev): -54.6760 -54.6760 -54.6557 -54.6557 -27.5781 -27.5781 -27.5243 -27.5243 -18.9954 -18.9954 -18.9254 -18.9254 -18.8437 -18.8437 -18.6936 -18.6936 -0.1795 -0.1795 -0.1650 -0.1650 1.6169 1.6169 1.6485 1.6485 7.3594 7.3594 8.2491 8.2491 9.1373 9.1373 9.5047 9.5047 9.9236 9.9236 10.2321 10.2321 11.0425 11.0425 11.2417 11.2417 11.3413 11.3413 11.4303 11.4303 12.1205 12.1205 12.4939 12.4939 13.5403 13.5403 14.7762 14.7762 15.2334 15.2334 16.1633 16.1633 16.3489 16.3489 k = 0.4674-0.3178 0.5119 ( 3184 PWs) bands (ev): -54.6760 -54.6760 -54.6556 -54.6556 -27.5783 -27.5783 -27.5246 -27.5246 -18.9950 -18.9950 -18.9263 -18.9263 -18.8452 -18.8452 -18.6942 -18.6942 -0.1718 -0.1718 -0.1539 -0.1539 1.6224 1.6224 1.6536 1.6536 7.3732 7.3732 8.2422 8.2422 9.1085 9.1085 9.4704 9.4704 9.9308 9.9308 10.2307 10.2307 11.0251 11.0251 11.1607 11.1607 11.3329 11.3329 11.3782 11.3782 12.1279 12.1279 12.6056 12.6056 13.5680 13.5680 14.7438 14.7438 15.2520 15.2520 16.1589 16.1589 16.3513 16.3513 k = 0.4620-0.3068 0.5288 ( 3182 PWs) bands (ev): -54.6759 -54.6759 -54.6556 -54.6556 -27.5785 -27.5785 -27.5249 -27.5249 -18.9946 -18.9946 -18.9273 -18.9273 -18.8469 -18.8469 -18.6948 -18.6948 -0.1625 -0.1625 -0.1410 -0.1410 1.6288 1.6288 1.6597 1.6597 7.3890 7.3890 8.2342 8.2342 9.0742 9.0742 9.4318 9.4318 9.9388 9.9388 10.2275 10.2275 10.9989 10.9989 11.0784 11.0784 11.3161 11.3161 11.3431 11.3431 12.1328 12.1328 12.7170 12.7170 13.5998 13.5998 14.7061 14.7061 15.2762 15.2762 16.1475 16.1475 16.3606 16.3606 k = 0.4565-0.2957 0.5458 ( 3184 PWs) bands (ev): -54.6758 -54.6758 -54.6555 -54.6555 -27.5789 -27.5789 -27.5253 -27.5253 -18.9942 -18.9942 -18.9284 -18.9284 -18.8489 -18.8489 -18.6956 -18.6956 -0.1518 -0.1518 -0.1264 -0.1264 1.6361 1.6361 1.6668 1.6668 7.4065 7.4065 8.2252 8.2252 9.0341 9.0341 9.3897 9.3897 9.9473 9.9473 10.2219 10.2219 10.9518 10.9518 11.0131 11.0131 11.2752 11.2752 11.3368 11.3368 12.1351 12.1351 12.8275 12.8275 13.6352 13.6352 14.6647 14.6647 15.3052 15.3052 16.1305 16.1305 16.3748 16.3748 k = 0.4511-0.2847 0.5627 ( 3184 PWs) bands (ev): -54.6757 -54.6757 -54.6554 -54.6554 -27.5792 -27.5792 -27.5257 -27.5257 -18.9938 -18.9938 -18.9297 -18.9297 -18.8511 -18.8511 -18.6964 -18.6964 -0.1395 -0.1395 -0.1101 -0.1101 1.6442 1.6442 1.6748 1.6748 7.4254 7.4254 8.2154 8.2154 8.9882 8.9882 9.3451 9.3451 9.9561 9.9561 10.2128 10.2128 10.8814 10.8814 10.9700 10.9700 11.2348 11.2348 11.3349 11.3349 12.1347 12.1347 12.9362 12.9362 13.6740 13.6740 14.6212 14.6212 15.3379 15.3379 16.1103 16.1103 16.3919 16.3919 k = 0.4457-0.2737 0.5797 ( 3182 PWs) bands (ev): -54.6756 -54.6756 -54.6553 -54.6553 -27.5796 -27.5796 -27.5262 -27.5262 -18.9933 -18.9933 -18.9312 -18.9312 -18.8535 -18.8535 -18.6973 -18.6973 -0.1259 -0.1259 -0.0923 -0.0923 1.6532 1.6532 1.6837 1.6837 7.4453 7.4453 8.2049 8.2049 8.9363 8.9363 9.2989 9.2989 9.9646 9.9646 10.1989 10.1989 10.8075 10.8075 10.9315 10.9315 11.1991 11.1991 11.3330 11.3330 12.1316 12.1316 13.0428 13.0428 13.7154 13.7154 14.5771 14.5771 15.3731 15.3731 16.0885 16.0885 16.4097 16.4097 k = 0.4402-0.2627 0.5966 ( 3178 PWs) bands (ev): -54.6755 -54.6755 -54.6552 -54.6552 -27.5800 -27.5800 -27.5267 -27.5267 -18.9927 -18.9927 -18.9327 -18.9327 -18.8561 -18.8561 -18.6982 -18.6982 -0.1109 -0.1109 -0.0728 -0.0728 1.6629 1.6629 1.6935 1.6935 7.4657 7.4657 8.1938 8.1938 8.8785 8.8785 9.2520 9.2520 9.9723 9.9723 10.1792 10.1792 10.7380 10.7380 10.8931 10.8931 11.1685 11.1685 11.3303 11.3303 12.1257 12.1257 13.1468 13.1468 13.7590 13.7590 14.5340 14.5340 15.4098 15.4098 16.0666 16.0666 16.4270 16.4270 k = 0.4348-0.2516 0.6135 ( 3176 PWs) bands (ev): -54.6754 -54.6754 -54.6551 -54.6551 -27.5804 -27.5804 -27.5273 -27.5273 -18.9921 -18.9921 -18.9345 -18.9345 -18.8589 -18.8589 -18.6992 -18.6992 -0.0945 -0.0945 -0.0520 -0.0520 1.6733 1.6733 1.7042 1.7042 7.4861 7.4861 8.1822 8.1822 8.8147 8.8147 9.2056 9.2056 9.9785 9.9785 10.1525 10.1525 10.6751 10.6751 10.8560 10.8560 11.1420 11.1420 11.3263 11.3263 12.1171 12.1171 13.2479 13.2479 13.8042 13.8042 14.4932 14.4932 15.4472 15.4472 16.0455 16.0455 16.4426 16.4426 k = 0.4293-0.2406 0.6305 ( 3178 PWs) bands (ev): -54.6753 -54.6753 -54.6550 -54.6550 -27.5809 -27.5809 -27.5279 -27.5279 -18.9915 -18.9915 -18.9364 -18.9364 -18.8619 -18.8619 -18.7002 -18.7002 -0.0769 -0.0769 -0.0297 -0.0297 1.6844 1.6844 1.7159 1.7159 7.5057 7.5057 8.1704 8.1704 8.7450 8.7450 9.1608 9.1608 9.9816 9.9816 10.1190 10.1190 10.6196 10.6196 10.8227 10.8227 11.1186 11.1186 11.3209 11.3209 12.1062 12.1062 13.3456 13.3456 13.8504 13.8504 14.4559 14.4559 15.4844 15.4844 16.0261 16.0261 16.4561 16.4561 k = 0.4239-0.2296 0.6474 ( 3182 PWs) bands (ev): -54.6752 -54.6752 -54.6548 -54.6548 -27.5814 -27.5814 -27.5285 -27.5285 -18.9909 -18.9909 -18.9384 -18.9384 -18.8651 -18.8651 -18.7012 -18.7012 -0.0580 -0.0580 -0.0062 -0.0062 1.6961 1.6961 1.7284 1.7284 7.5239 7.5239 8.1583 8.1583 8.6699 8.6699 9.1188 9.1188 9.9774 9.9774 10.0817 10.0817 10.5719 10.5719 10.7952 10.7952 11.0972 11.0972 11.3137 11.3137 12.0929 12.0929 13.4397 13.4397 13.8970 13.8970 14.4231 14.4231 15.5208 15.5208 16.0088 16.0088 16.4669 16.4669 k = 0.4185-0.2186 0.6644 ( 3184 PWs) bands (ev): -54.6751 -54.6751 -54.6547 -54.6547 -27.5820 -27.5820 -27.5292 -27.5292 -18.9903 -18.9903 -18.9406 -18.9406 -18.8684 -18.8684 -18.7023 -18.7023 -0.0380 -0.0380 0.0184 0.0184 1.7084 1.7084 1.7417 1.7417 7.5399 7.5399 8.1462 8.1462 8.5898 8.5898 9.0809 9.0809 9.9552 9.9552 10.0511 10.0511 10.5320 10.5320 10.7745 10.7745 11.0771 11.0771 11.3046 11.3046 12.0775 12.0775 13.5297 13.5297 13.9433 13.9433 14.3959 14.3959 15.5561 15.5561 15.9941 15.9941 16.4751 16.4751 k = 0.4130-0.2075 0.6813 ( 3190 PWs) bands (ev): -54.6749 -54.6749 -54.6546 -54.6546 -27.5826 -27.5826 -27.5299 -27.5299 -18.9897 -18.9897 -18.9429 -18.9429 -18.8719 -18.8719 -18.7033 -18.7033 -0.0168 -0.0168 0.0441 0.0441 1.7213 1.7213 1.7558 1.7558 7.5529 7.5529 8.1340 8.1340 8.5053 8.5053 9.0482 9.0482 9.9063 9.9063 10.0365 10.0365 10.4997 10.4997 10.7607 10.7607 11.0577 11.0577 11.2936 11.2936 12.0602 12.0602 13.6152 13.6152 13.9889 13.9889 14.3752 14.3752 15.5897 15.5897 15.9826 15.9826 16.4808 16.4808 k = 0.4076-0.1965 0.6983 ( 3196 PWs) bands (ev): -54.6748 -54.6748 -54.6545 -54.6545 -27.5832 -27.5832 -27.5306 -27.5306 -18.9892 -18.9892 -18.9453 -18.9453 -18.8755 -18.8755 -18.7043 -18.7043 0.0054 0.0054 0.0707 0.0707 1.7346 1.7346 1.7707 1.7707 7.5619 7.5619 8.1214 8.1214 8.4173 8.4173 9.0220 9.0220 9.8387 9.8387 10.0311 10.0311 10.4745 10.4745 10.7529 10.7529 11.0388 11.0388 11.2806 11.2806 12.0413 12.0413 13.6955 13.6955 14.0330 14.0330 14.3619 14.3619 15.6215 15.6215 15.9745 15.9745 16.4844 16.4844 k = 0.4022-0.1855 0.7152 ( 3190 PWs) bands (ev): -54.6746 -54.6746 -54.6543 -54.6543 -27.5838 -27.5838 -27.5313 -27.5313 -18.9885 -18.9885 -18.9477 -18.9477 -18.8790 -18.8790 -18.7052 -18.7052 0.0287 0.0287 0.0981 0.0981 1.7484 1.7484 1.7864 1.7864 7.5665 7.5665 8.1078 8.1078 8.3274 8.3274 9.0034 9.0034 9.7604 9.7604 10.0283 10.0283 10.4555 10.4555 10.7504 10.7504 11.0201 11.0201 11.2659 11.2659 12.0210 12.0210 13.7702 13.7702 14.0755 14.0755 14.3568 14.3568 15.6511 15.6511 15.9702 15.9702 16.4866 16.4866 k = 0.3967-0.1745 0.7321 ( 3200 PWs) bands (ev): -54.6745 -54.6745 -54.6542 -54.6542 -27.5845 -27.5845 -27.5321 -27.5321 -18.9880 -18.9880 -18.9504 -18.9504 -18.8828 -18.8828 -18.7062 -18.7062 0.0529 0.0529 0.1262 0.1262 1.7625 1.7625 1.8028 1.8028 7.5658 7.5658 8.0900 8.0900 8.2396 8.2396 8.9931 8.9931 9.6753 9.6753 10.0259 10.0259 10.4417 10.4417 10.7518 10.7518 11.0016 11.0016 11.2497 11.2497 11.9994 11.9994 13.8384 13.8384 14.1160 14.1160 14.3604 14.3604 15.6786 15.6786 15.9701 15.9701 16.4878 16.4878 k = 0.3913-0.1634 0.7491 ( 3204 PWs) bands (ev): -54.6744 -54.6744 -54.6540 -54.6540 -27.5851 -27.5851 -27.5329 -27.5329 -18.9874 -18.9874 -18.9531 -18.9531 -18.8865 -18.8865 -18.7071 -18.7071 0.0779 0.0779 0.1547 0.1547 1.7768 1.7768 1.8200 1.8200 7.5599 7.5599 8.0563 8.0563 8.1663 8.1663 8.9917 8.9917 9.5853 9.5853 10.0233 10.0233 10.4318 10.4318 10.7563 10.7563 10.9835 10.9835 11.2325 11.2325 11.9769 11.9769 13.8994 13.8994 14.1547 14.1547 14.3731 14.3731 15.7037 15.7037 15.9743 15.9743 16.4889 16.4889 k = 0.3859-0.1524 0.7660 ( 3198 PWs) bands (ev): -54.6742 -54.6742 -54.6539 -54.6539 -27.5858 -27.5858 -27.5336 -27.5336 -18.9869 -18.9869 -18.9557 -18.9557 -18.8902 -18.8902 -18.7079 -18.7079 0.1037 0.1037 0.1836 0.1836 1.7913 1.7913 1.8380 1.8380 7.5485 7.5485 7.9882 7.9882 8.1269 8.1269 8.9993 8.9993 9.4920 9.4920 10.0203 10.0203 10.4247 10.4247 10.7627 10.7627 10.9658 10.9658 11.2146 11.2146 11.9537 11.9537 13.9528 13.9528 14.1919 14.1919 14.3945 14.3945 15.7267 15.7267 15.9829 15.9829 16.4906 16.4906 k = 0.3804-0.1414 0.7830 ( 3194 PWs) bands (ev): -54.6740 -54.6740 -54.6537 -54.6537 -27.5864 -27.5864 -27.5343 -27.5343 -18.9865 -18.9865 -18.9585 -18.9585 -18.8939 -18.8939 -18.7087 -18.7087 0.1303 0.1303 0.2127 0.2127 1.8057 1.8057 1.8567 1.8567 7.5321 7.5321 7.8975 7.8975 8.1104 8.1104 9.0158 9.0158 9.3964 9.3964 10.0167 10.0167 10.4191 10.4191 10.7702 10.7702 10.9491 10.9491 11.1969 11.1969 11.9299 11.9299 13.9985 13.9985 14.2278 14.2278 14.4241 14.4241 15.7476 15.7476 15.9958 15.9958 16.4933 16.4933 k = 0.3750-0.1304 0.7999 ( 3194 PWs) bands (ev): -54.6739 -54.6739 -54.6536 -54.6536 -27.5870 -27.5870 -27.5351 -27.5351 -18.9861 -18.9861 -18.9612 -18.9612 -18.8976 -18.8976 -18.7095 -18.7095 0.1574 0.1574 0.2419 0.2419 1.8201 1.8201 1.8763 1.8763 7.5112 7.5112 7.7997 7.7997 8.1021 8.1021 9.0404 9.0404 9.2995 9.2995 10.0124 10.0124 10.4141 10.4141 10.7774 10.7774 10.9337 10.9337 11.1799 11.1799 11.9058 11.9058 14.0371 14.0371 14.2624 14.2624 14.4609 14.4609 15.7669 15.7669 16.0127 16.0127 16.4972 16.4972 k = 0.3696-0.1193 0.8169 ( 3194 PWs) bands (ev): -54.6737 -54.6737 -54.6534 -54.6534 -27.5877 -27.5877 -27.5359 -27.5359 -18.9859 -18.9859 -18.9640 -18.9640 -18.9012 -18.9012 -18.7102 -18.7102 0.1850 0.1850 0.2710 0.2710 1.8342 1.8342 1.8966 1.8966 7.4861 7.4861 7.6999 7.6999 8.0979 8.0979 9.0718 9.0718 9.2026 9.2026 10.0073 10.0073 10.4089 10.4089 10.7833 10.7833 10.9207 10.9207 11.1644 11.1644 11.8816 11.8816 14.0697 14.0697 14.2953 14.2953 14.5041 14.5041 15.7849 15.7849 16.0332 16.0332 16.5024 16.5024 k = 0.3641-0.1083 0.8338 ( 3198 PWs) bands (ev): -54.6735 -54.6735 -54.6533 -54.6533 -27.5884 -27.5884 -27.5367 -27.5367 -18.9859 -18.9859 -18.9666 -18.9666 -18.9048 -18.9048 -18.7108 -18.7108 0.2131 0.2131 0.2998 0.2998 1.8480 1.8480 1.9178 1.9178 7.4571 7.4571 7.6008 7.6008 8.0964 8.0964 9.0883 9.0883 9.1271 9.1271 10.0010 10.0010 10.4028 10.4028 10.7862 10.7862 10.9112 10.9112 11.1510 11.1510 11.8573 11.8573 14.0974 14.0974 14.3260 14.3260 14.5525 14.5525 15.8021 15.8021 16.0568 16.0568 16.5082 16.5082 k = 0.3587-0.0973 0.8508 ( 3194 PWs) bands (ev): -54.6734 -54.6734 -54.6531 -54.6531 -27.5890 -27.5890 -27.5374 -27.5374 -18.9861 -18.9861 -18.9691 -18.9691 -18.9083 -18.9083 -18.7114 -18.7114 0.2414 0.2414 0.3281 0.3281 1.8613 1.8613 1.9397 1.9397 7.4218 7.4218 7.5066 7.5066 8.0973 8.0973 9.0009 9.0009 9.1615 9.1615 9.9930 9.9930 10.3956 10.3956 10.7849 10.7849 10.9061 10.9061 11.1405 11.1405 11.8333 11.8333 14.1209 14.1209 14.3546 14.3546 14.6052 14.6052 15.8190 15.8190 16.0829 16.0829 16.5137 16.5137 k = 0.3533-0.0863 0.8677 ( 3194 PWs) bands (ev): -54.6732 -54.6732 -54.6530 -54.6530 -27.5897 -27.5897 -27.5381 -27.5381 -18.9865 -18.9865 -18.9713 -18.9713 -18.9116 -18.9116 -18.7119 -18.7119 0.2699 0.2699 0.3560 0.3560 1.8740 1.8740 1.9624 1.9624 7.3659 7.3659 7.4333 7.4333 8.1003 8.1003 8.9041 8.9041 9.2109 9.2109 9.9828 9.9828 10.3875 10.3875 10.7789 10.7789 10.9057 10.9057 11.1331 11.1331 11.8096 11.8096 14.1409 14.1409 14.3811 14.3811 14.6613 14.6613 15.8358 15.8358 16.1110 16.1110 16.5170 16.5170 k = 0.3478-0.0752 0.8846 ( 3198 PWs) bands (ev): -54.6731 -54.6731 -54.6528 -54.6528 -27.5903 -27.5903 -27.5389 -27.5389 -18.9874 -18.9874 -18.9734 -18.9734 -18.9148 -18.9148 -18.7125 -18.7125 0.2984 0.2984 0.3831 0.3831 1.8860 1.8860 1.9858 1.9858 7.2811 7.2811 7.3904 7.3904 8.1055 8.1055 8.8076 8.8076 9.2648 9.2648 9.9700 9.9700 10.3788 10.3788 10.7692 10.7692 10.9089 10.9089 11.1291 11.1291 11.7863 11.7863 14.1577 14.1577 14.4057 14.4057 14.7200 14.7200 15.8527 15.8527 16.1404 16.1404 16.5160 16.5160 k = 0.3424-0.0642 0.9016 ( 3192 PWs) bands (ev): -54.6729 -54.6729 -54.6527 -54.6527 -27.5909 -27.5909 -27.5396 -27.5396 -18.9885 -18.9885 -18.9750 -18.9750 -18.9178 -18.9178 -18.7129 -18.7129 0.3269 0.3269 0.4093 0.4093 1.8973 1.8973 2.0098 2.0098 7.1883 7.1883 7.3583 7.3583 8.1127 8.1127 8.7121 8.7121 9.3219 9.3219 9.9541 9.9541 10.3701 10.3701 10.7569 10.7569 10.9143 10.9143 11.1284 11.1284 11.7637 11.7637 14.1715 14.1715 14.4288 14.4288 14.7806 14.7806 15.8698 15.8698 16.1706 16.1706 16.5085 16.5085 k = 0.3370-0.0532 0.9185 ( 3192 PWs) bands (ev): -54.6728 -54.6728 -54.6525 -54.6525 -27.5914 -27.5914 -27.5404 -27.5404 -18.9901 -18.9901 -18.9764 -18.9764 -18.9205 -18.9205 -18.7133 -18.7133 0.3551 0.3551 0.4346 0.4346 1.9077 1.9077 2.0342 2.0342 7.0956 7.0956 7.3302 7.3302 8.1219 8.1219 8.6180 8.6180 9.3810 9.3810 9.9348 9.9348 10.3619 10.3619 10.7433 10.7433 10.9204 10.9204 11.1308 11.1308 11.7418 11.7418 14.1827 14.1827 14.4504 14.4504 14.8423 14.8423 15.8870 15.8870 16.2005 16.2005 16.4938 16.4938 k = 0.3315-0.0422 0.9355 ( 3190 PWs) bands (ev): -54.6726 -54.6726 -54.6524 -54.6524 -27.5920 -27.5920 -27.5410 -27.5410 -18.9919 -18.9919 -18.9775 -18.9775 -18.9231 -18.9231 -18.7136 -18.7136 0.3829 0.3829 0.4588 0.4588 1.9174 1.9174 2.0590 2.0590 7.0050 7.0050 7.3049 7.3049 8.1329 8.1329 8.5258 8.5258 9.4409 9.4409 9.9125 9.9125 10.3550 10.3550 10.7293 10.7293 10.9264 10.9264 11.1359 11.1359 11.7208 11.7208 14.1916 14.1916 14.4705 14.4705 14.9045 14.9045 15.9044 15.9044 16.2284 16.2284 16.4742 16.4742 k = 0.3261-0.0311 0.9524 ( 3192 PWs) bands (ev): -54.6725 -54.6725 -54.6523 -54.6523 -27.5925 -27.5925 -27.5417 -27.5417 -18.9940 -18.9940 -18.9784 -18.9784 -18.9255 -18.9255 -18.7140 -18.7140 0.4101 0.4101 0.4817 0.4817 1.9261 1.9261 2.0840 2.0840 6.9172 6.9172 7.2826 7.2826 8.1455 8.1455 8.4356 8.4356 9.5002 9.5002 9.8880 9.8880 10.3496 10.3496 10.7157 10.7157 10.9315 10.9315 11.1433 11.1433 11.7007 11.7007 14.1985 14.1985 14.4891 14.4891 14.9663 14.9663 15.9217 15.9217 16.2515 16.2515 16.4548 16.4548 k = 0.3207-0.0201 0.9694 ( 3194 PWs) bands (ev): -54.6724 -54.6724 -54.6521 -54.6521 -27.5931 -27.5931 -27.5423 -27.5423 -18.9961 -18.9961 -18.9793 -18.9793 -18.9276 -18.9276 -18.7143 -18.7143 0.4367 0.4367 0.5034 0.5034 1.9339 1.9339 2.1090 2.1090 6.8329 6.8329 7.2635 7.2635 8.1596 8.1596 8.3480 8.3480 9.5565 9.5565 9.8632 9.8632 10.3459 10.3459 10.7028 10.7028 10.9351 10.9351 11.1525 11.1525 11.6817 11.6817 14.2038 14.2038 14.5063 14.5063 15.0265 15.0265 15.9389 15.9389 16.2654 16.2654 16.4432 16.4432 k = 0.3152-0.0091 0.9863 ( 3196 PWs) bands (ev): -54.6723 -54.6723 -54.6520 -54.6520 -27.5936 -27.5936 -27.5429 -27.5429 -18.9982 -18.9982 -18.9801 -18.9801 -18.9295 -18.9295 -18.7145 -18.7145 0.4623 0.4623 0.5237 0.5237 1.9408 1.9408 2.1337 2.1337 6.7526 6.7526 7.2478 7.2478 8.1742 8.1742 8.2640 8.2640 9.6056 9.6056 9.8423 9.8423 10.3438 10.3438 10.6912 10.6912 10.9369 10.9369 11.1629 11.1629 11.6638 11.6638 14.2080 14.2080 14.5219 14.5219 15.0840 15.0840 15.9558 15.9558 16.2665 16.2665 16.4453 16.4453 k = 0.3098 0.0019 1.0033 ( 3198 PWs) bands (ev): -54.6722 -54.6722 -54.6519 -54.6519 -27.5941 -27.5941 -27.5435 -27.5435 -19.0003 -19.0003 -18.9809 -18.9809 -18.9312 -18.9312 -18.7147 -18.7147 0.4868 0.4868 0.5425 0.5425 1.9468 1.9468 2.1580 2.1580 6.6767 6.6767 7.2358 7.2358 8.1691 8.1691 8.2035 8.2035 9.6391 9.6391 9.8337 9.8337 10.3432 10.3432 10.6813 10.6813 10.9366 10.9366 11.1742 11.1742 11.6470 11.6470 14.2113 14.2113 14.5360 14.5360 15.1373 15.1373 15.9721 15.9721 16.2577 16.2577 16.4607 16.4607 k = 0.3043 0.0130 1.0202 ( 3194 PWs) bands (ev): -54.6720 -54.6720 -54.6518 -54.6518 -27.5945 -27.5945 -27.5439 -27.5439 -19.0023 -19.0023 -18.9817 -18.9817 -18.9327 -18.9327 -18.7148 -18.7148 0.5101 0.5101 0.5599 0.5599 1.9520 1.9520 2.1815 2.1815 6.6057 6.6057 7.2276 7.2276 8.0969 8.0969 8.2143 8.2143 9.6473 9.6473 9.8473 9.8473 10.3438 10.3438 10.6735 10.6735 10.9340 10.9340 11.1858 11.1858 11.6315 11.6315 14.2142 14.2142 14.5486 14.5486 15.1852 15.1852 15.9877 15.9877 16.2460 16.2460 16.4837 16.4837 k = 0.2989 0.0240 1.0371 ( 3192 PWs) bands (ev): -54.6719 -54.6719 -54.6517 -54.6517 -27.5949 -27.5949 -27.5444 -27.5444 -19.0042 -19.0042 -18.9825 -18.9825 -18.9339 -18.9339 -18.7149 -18.7149 0.5320 0.5320 0.5756 0.5756 1.9563 1.9563 2.2041 2.2041 6.5399 6.5399 7.2233 7.2233 8.0215 8.0215 8.2322 8.2322 9.6327 9.6327 9.8806 9.8806 10.3452 10.3452 10.6681 10.6681 10.9287 10.9287 11.1974 11.1974 11.6173 11.6173 14.2167 14.2167 14.5598 14.5598 15.2262 15.2262 16.0025 16.0025 16.2367 16.2367 16.5094 16.5094 k = 0.2935 0.0350 1.0541 ( 3190 PWs) bands (ev): -54.6718 -54.6718 -54.6516 -54.6516 -27.5952 -27.5952 -27.5448 -27.5448 -19.0059 -19.0059 -18.9832 -18.9832 -18.9349 -18.9349 -18.7150 -18.7150 0.5521 0.5521 0.5898 0.5898 1.9599 1.9599 2.2253 2.2253 6.4797 6.4797 7.2230 7.2230 7.9493 7.9493 8.2509 8.2509 9.6066 9.6066 9.9225 9.9225 10.3472 10.3472 10.6656 10.6656 10.9209 10.9209 11.2086 11.2086 11.6044 11.6044 14.2191 14.2191 14.5696 14.5696 15.2594 15.2594 16.0165 16.0165 16.2328 16.2328 16.5346 16.5346 k = 0.2880 0.0461 1.0710 ( 3192 PWs) bands (ev): -54.6718 -54.6718 -54.6516 -54.6516 -27.5956 -27.5956 -27.5452 -27.5452 -19.0075 -19.0075 -18.9840 -18.9840 -18.9358 -18.9358 -18.7151 -18.7151 0.5705 0.5705 0.6023 0.6023 1.9628 1.9628 2.2449 2.2449 6.4255 6.4255 7.2265 7.2265 7.8810 7.8810 8.2695 8.2695 9.5763 9.5763 9.9657 9.9657 10.3494 10.3494 10.6663 10.6663 10.9104 10.9104 11.2191 11.2191 11.5930 11.5930 14.2213 14.2213 14.5781 14.5781 15.2846 15.2846 16.0300 16.0300 16.2350 16.2350 16.5571 16.5571 k = 0.2826 0.0571 1.0880 ( 3198 PWs) bands (ev): -54.6717 -54.6717 -54.6515 -54.6515 -27.5959 -27.5959 -27.5456 -27.5456 -19.0089 -19.0089 -18.9847 -18.9847 -18.9366 -18.9366 -18.7152 -18.7152 0.5868 0.5868 0.6132 0.6132 1.9651 1.9651 2.2627 2.2627 6.3777 6.3777 7.2336 7.2336 7.8171 7.8171 8.2875 8.2875 9.5456 9.5456 10.0066 10.0066 10.3517 10.3517 10.6705 10.6705 10.8973 10.8973 11.2287 11.2287 11.5829 11.5829 14.2236 14.2236 14.5854 14.5854 15.3022 15.3022 16.0430 16.0430 16.2426 16.2426 16.5751 16.5751 k = 0.2772 0.0681 1.1049 ( 3202 PWs) bands (ev): -54.6717 -54.6717 -54.6515 -54.6515 -27.5962 -27.5962 -27.5459 -27.5459 -19.0101 -19.0101 -18.9854 -18.9854 -18.9372 -18.9372 -18.7153 -18.7153 0.6009 0.6009 0.6224 0.6224 1.9669 1.9669 2.2783 2.2783 6.3367 6.3367 7.2439 7.2439 7.7585 7.7585 8.3043 8.3043 9.5169 9.5169 10.0430 10.0430 10.3538 10.3538 10.6783 10.6783 10.8818 10.8818 11.2372 11.2372 11.5744 11.5744 14.2257 14.2257 14.5914 14.5914 15.3132 15.3132 16.0556 16.0556 16.2541 16.2541 16.5875 16.5875 k = 0.2717 0.0791 1.1219 ( 3202 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5964 -27.5964 -27.5461 -27.5461 -19.0111 -19.0111 -18.9859 -18.9859 -18.9376 -18.9376 -18.7153 -18.7153 0.6128 0.6128 0.6300 0.6300 1.9682 1.9682 2.2914 2.2914 6.3026 6.3026 7.2566 7.2566 7.7059 7.7059 8.3191 8.3191 9.4914 9.4914 10.0739 10.0739 10.3557 10.3557 10.6897 10.6897 10.8643 10.8643 11.2443 11.2443 11.5673 11.5673 14.2276 14.2276 14.5964 14.5964 15.3191 15.3191 16.0675 16.0675 16.2673 16.2673 16.5939 16.5939 k = 0.2663 0.0902 1.1388 ( 3202 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5966 -27.5966 -27.5463 -27.5463 -19.0119 -19.0119 -18.9863 -18.9863 -18.9380 -18.9380 -18.7154 -18.7154 0.6221 0.6221 0.6358 0.6358 1.9691 1.9691 2.3019 2.3019 6.2758 6.2758 7.2707 7.2707 7.6608 7.6608 8.3315 8.3315 9.4703 9.4703 10.0983 10.0983 10.3571 10.3571 10.7041 10.7041 10.8452 10.8452 11.2500 11.2500 11.5618 11.5618 14.2293 14.2293 14.6002 14.6002 15.3216 15.3216 16.0778 16.0778 16.2803 16.2803 16.5955 16.5955 k = 0.2609 0.1012 1.1558 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5967 -27.5967 -27.5464 -27.5464 -19.0124 -19.0124 -18.9866 -18.9866 -18.9382 -18.9382 -18.7154 -18.7154 0.6289 0.6289 0.6400 0.6400 1.9697 1.9697 2.3096 2.3096 6.2565 6.2565 7.2840 7.2840 7.6252 7.6252 8.3408 8.3408 9.4546 9.4546 10.1160 10.1160 10.3582 10.3582 10.7205 10.7205 10.8256 10.8256 11.2542 11.2542 11.5579 11.5579 14.2305 14.2305 14.6030 14.6030 15.3222 15.3222 16.0860 16.0860 16.2912 16.2912 16.5941 16.5941 k = 0.2554 0.1122 1.1727 ( 3198 PWs) bands (ev): -54.6715 -54.6715 -54.6514 -54.6514 -27.5968 -27.5968 -27.5464 -27.5464 -19.0127 -19.0127 -18.9868 -18.9868 -18.9383 -18.9383 -18.7154 -18.7154 0.6330 0.6330 0.6425 0.6425 1.9701 1.9701 2.3142 2.3142 6.2449 6.2449 7.2939 7.2939 7.6018 7.6018 8.3466 8.3466 9.4449 9.4449 10.1267 10.1267 10.3588 10.3588 10.7362 10.7362 10.8080 10.8080 11.2567 11.2567 11.5555 11.5555 14.2313 14.2313 14.6046 14.6046 15.3221 15.3221 16.0913 16.0913 16.2984 16.2984 16.5920 16.5920 k = 0.2500 0.1232 1.1896 ( 3196 PWs) bands (ev): -54.6715 -54.6715 -54.6513 -54.6513 -27.5968 -27.5968 -27.5465 -27.5465 -19.0128 -19.0128 -18.9869 -18.9869 -18.9384 -18.9384 -18.7154 -18.7154 0.6344 0.6344 0.6434 0.6434 1.9702 1.9702 2.3158 2.3158 6.2410 6.2410 7.2977 7.2977 7.5936 7.5936 8.3486 8.3486 9.4417 9.4417 10.1302 10.1302 10.3590 10.3590 10.7439 10.7439 10.7997 10.7997 11.2575 11.2575 11.5547 11.5547 14.2316 14.2316 14.6052 14.6052 15.3219 15.3219 16.0931 16.0931 16.3010 16.3010 16.5911 16.5911 k = 0.0607-0.1232 1.1896 ( 3194 PWs) bands (ev): -54.6716 -54.6716 -54.6514 -54.6514 -27.5963 -27.5963 -27.5461 -27.5461 -19.0103 -19.0103 -18.9868 -18.9868 -18.9366 -18.9366 -18.7157 -18.7157 0.5772 0.5772 0.6302 0.6302 1.7289 1.7289 2.6006 2.6006 6.5162 6.5162 6.8167 6.8167 7.7416 7.7416 9.0511 9.0511 9.4688 9.4688 9.7030 9.7030 10.0348 10.0348 10.6745 10.6745 10.7686 10.7686 11.3054 11.3054 11.5600 11.5600 14.4137 14.4137 14.7273 14.7273 15.1172 15.1172 15.8778 15.8778 16.0070 16.0070 16.6761 16.6761 k = 0.0662-0.1343 1.1726 ( 3194 PWs) bands (ev): -54.6716 -54.6716 -54.6515 -54.6515 -27.5960 -27.5960 -27.5459 -27.5459 -19.0094 -19.0094 -18.9862 -18.9862 -18.9361 -18.9361 -18.7158 -18.7158 0.5579 0.5579 0.6303 0.6303 1.7295 1.7295 2.5868 2.5868 6.5125 6.5125 6.8479 6.8479 7.7908 7.7908 9.0293 9.0293 9.4510 9.4510 9.7257 9.7257 10.0379 10.0379 10.6617 10.6617 10.7668 10.7668 11.3083 11.3083 11.5713 11.5713 14.4090 14.4090 14.7670 14.7670 15.0706 15.0706 15.8294 15.8294 15.9865 15.9865 16.6721 16.6721 k = 0.0717-0.1454 1.1556 ( 3190 PWs) bands (ev): -54.6717 -54.6717 -54.6515 -54.6515 -27.5958 -27.5958 -27.5456 -27.5456 -19.0083 -19.0083 -18.9854 -18.9854 -18.9355 -18.9355 -18.7158 -18.7158 0.5370 0.5370 0.6282 0.6282 1.7281 1.7281 2.5719 2.5719 6.5148 6.5148 6.8836 6.8836 7.8457 7.8457 9.0064 9.0064 9.4152 9.4152 9.7646 9.7646 10.0415 10.0415 10.6463 10.6463 10.7676 10.7676 11.3107 11.3107 11.5829 11.5829 14.4015 14.4015 14.8052 14.8052 15.0246 15.0246 15.7664 15.7664 15.9804 15.9804 16.6697 16.6697 k = 0.0771-0.1564 1.1386 ( 3192 PWs) bands (ev): -54.6717 -54.6717 -54.6516 -54.6516 -27.5954 -27.5954 -27.5453 -27.5453 -19.0071 -19.0071 -18.9845 -18.9845 -18.9348 -18.9348 -18.7158 -18.7158 0.5147 0.5147 0.6239 0.6239 1.7247 1.7247 2.5562 2.5562 6.5230 6.5230 6.9237 6.9237 7.9061 7.9061 8.9832 8.9832 9.3699 9.3699 9.8108 9.8108 10.0452 10.0452 10.6286 10.6286 10.7707 10.7707 11.3125 11.3125 11.5948 11.5948 14.3919 14.3919 14.8383 14.8383 14.9825 14.9825 15.6957 15.6957 15.9824 15.9824 16.6689 16.6689 k = 0.0826-0.1675 1.1216 ( 3194 PWs) bands (ev): -54.6718 -54.6718 -54.6517 -54.6517 -27.5951 -27.5951 -27.5450 -27.5450 -19.0056 -19.0056 -18.9837 -18.9837 -18.9340 -18.9340 -18.7159 -18.7159 0.4911 0.4911 0.6175 0.6175 1.7188 1.7188 2.5400 2.5400 6.5371 6.5371 6.9679 6.9679 7.9714 7.9714 8.9604 8.9604 9.3196 9.3196 9.8596 9.8596 10.0488 10.0488 10.6091 10.6091 10.7758 10.7758 11.3136 11.3136 11.6072 11.6072 14.3808 14.3808 14.8551 14.8551 14.9546 14.9546 15.6222 15.6222 15.9892 15.9892 16.6694 16.6694 k = 0.0880-0.1786 1.1046 ( 3194 PWs) bands (ev): -54.6719 -54.6719 -54.6517 -54.6517 -27.5947 -27.5947 -27.5446 -27.5446 -19.0039 -19.0039 -18.9827 -18.9827 -18.9329 -18.9329 -18.7159 -18.7159 0.4663 0.4663 0.6092 0.6092 1.7104 1.7104 2.5236 2.5236 6.5570 6.5570 7.0162 7.0162 8.0411 8.0411 8.9385 8.9385 9.2663 9.2663 9.9088 9.9088 10.0521 10.0521 10.5881 10.5881 10.7827 10.7827 11.3138 11.3138 11.6201 11.6201 14.3690 14.3690 14.8389 14.8389 14.9557 14.9557 15.5498 15.5498 15.9991 15.9991 16.6709 16.6709 k = 0.0935-0.1896 1.0876 ( 3201 PWs) bands (ev): -54.6720 -54.6720 -54.6518 -54.6518 -27.5944 -27.5944 -27.5442 -27.5442 -19.0022 -19.0022 -18.9817 -18.9817 -18.9318 -18.9318 -18.7159 -18.7159 0.4405 0.4405 0.5990 0.5990 1.6993 1.6993 2.5073 2.5073 6.5826 6.5826 7.0684 7.0684 8.1147 8.1147 8.9180 8.9180 9.2113 9.2113 9.9568 9.9568 10.0556 10.0556 10.5658 10.5658 10.7911 10.7911 11.3131 11.3131 11.6336 11.6336 14.3567 14.3567 14.8018 14.8018 14.9702 14.9702 15.4835 15.4835 16.0115 16.0115 16.6731 16.6731 k = 0.0989-0.2007 1.0706 ( 3198 PWs) bands (ev): -54.6721 -54.6721 -54.6519 -54.6519 -27.5939 -27.5939 -27.5437 -27.5437 -19.0003 -19.0003 -18.9807 -18.9807 -18.9303 -18.9303 -18.7158 -18.7158 0.4138 0.4138 0.5871 0.5871 1.6854 1.6854 2.4915 2.4915 6.6138 6.6138 7.1244 7.1244 8.1914 8.1914 8.8993 8.8993 9.1554 9.1554 10.0015 10.0015 10.0607 10.0607 10.5427 10.5427 10.8006 10.8006 11.3113 11.3113 11.6477 11.6477 14.3445 14.3445 14.7593 14.7593 14.9773 14.9773 15.4300 15.4300 16.0260 16.0260 16.6755 16.6755 k = 0.1044-0.2117 1.0536 ( 3197 PWs) bands (ev): -54.6722 -54.6722 -54.6521 -54.6521 -27.5934 -27.5934 -27.5431 -27.5431 -18.9983 -18.9983 -18.9797 -18.9797 -18.9287 -18.9287 -18.7157 -18.7157 0.3863 0.3863 0.5736 0.5736 1.6687 1.6687 2.4763 2.4763 6.6504 6.6504 7.1838 7.1838 8.2704 8.2704 8.8826 8.8826 9.0997 9.0997 10.0342 10.0342 10.0759 10.0759 10.5187 10.5187 10.8110 10.8110 11.3086 11.3086 11.6624 11.6624 14.3324 14.3324 14.7155 14.7155 14.9662 14.9662 15.3968 15.3968 16.0424 16.0424 16.6777 16.6777 k = 0.1098-0.2228 1.0366 ( 3197 PWs) bands (ev): -54.6723 -54.6723 -54.6522 -54.6522 -27.5929 -27.5929 -27.5426 -27.5426 -18.9963 -18.9963 -18.9787 -18.9787 -18.9269 -18.9269 -18.7155 -18.7155 0.3582 0.3582 0.5587 0.5587 1.6493 1.6493 2.4619 2.4619 6.6920 6.6920 7.2465 7.2465 8.3504 8.3504 8.8677 8.8677 9.0458 9.0458 10.0452 10.0452 10.1105 10.1105 10.4943 10.4943 10.8220 10.8220 11.3047 11.3047 11.6779 11.6779 14.3203 14.3203 14.6718 14.6718 14.9326 14.9326 15.3878 15.3878 16.0608 16.0608 16.6794 16.6794 k = 0.1153-0.2339 1.0196 ( 3193 PWs) bands (ev): -54.6725 -54.6725 -54.6523 -54.6523 -27.5924 -27.5924 -27.5419 -27.5419 -18.9942 -18.9942 -18.9776 -18.9776 -18.9248 -18.9248 -18.7153 -18.7153 0.3295 0.3295 0.5424 0.5424 1.6273 1.6273 2.4485 2.4485 6.7384 6.7384 7.3123 7.3123 8.4294 8.4294 8.8526 8.8526 8.9978 8.9978 10.0478 10.0478 10.1515 10.1515 10.4696 10.4696 10.8333 10.8333 11.2999 11.2999 11.6942 11.6942 14.3076 14.3076 14.6285 14.6285 14.8806 14.8806 15.4000 15.4000 16.0810 16.0810 16.6804 16.6804 k = 0.1207-0.2449 1.0026 ( 3198 PWs) bands (ev): -54.6726 -54.6726 -54.6524 -54.6524 -27.5918 -27.5918 -27.5413 -27.5413 -18.9923 -18.9923 -18.9765 -18.9765 -18.9226 -18.9226 -18.7151 -18.7151 0.3004 0.3004 0.5250 0.5250 1.6027 1.6027 2.4360 2.4360 6.7893 6.7893 7.3808 7.3808 8.5043 8.5043 8.8317 8.8317 8.9645 8.9645 10.0483 10.0483 10.1921 10.1921 10.4452 10.4452 10.8447 10.8447 11.2941 11.2941 11.7113 11.7113 14.2934 14.2934 14.5856 14.5856 14.8182 14.8182 15.4267 15.4267 16.1032 16.1032 16.6804 16.6804 k = 0.1262-0.2560 0.9856 ( 3194 PWs) bands (ev): -54.6727 -54.6727 -54.6526 -54.6526 -27.5912 -27.5912 -27.5406 -27.5406 -18.9904 -18.9904 -18.9752 -18.9752 -18.9200 -18.9200 -18.7149 -18.7149 0.2710 0.2710 0.5065 0.5065 1.5759 1.5759 2.4246 2.4246 6.8443 6.8443 7.4519 7.4519 8.5701 8.5701 8.7982 8.7982 8.9576 8.9576 10.0482 10.0482 10.2306 10.2306 10.4217 10.4217 10.8556 10.8556 11.2876 11.2876 11.7294 11.7294 14.2759 14.2759 14.5433 14.5433 14.7527 14.7527 15.4626 15.4626 16.1272 16.1272 16.6793 16.6793 k = 0.1316-0.2671 0.9686 ( 3194 PWs) bands (ev): -54.6729 -54.6729 -54.6527 -54.6527 -27.5905 -27.5905 -27.5400 -27.5400 -18.9888 -18.9888 -18.9737 -18.9737 -18.9173 -18.9173 -18.7146 -18.7146 0.2415 0.2415 0.4871 0.4871 1.5471 1.5471 2.4142 2.4142 6.9031 6.9031 7.5251 7.5251 8.6194 8.6194 8.7562 8.7562 8.9804 8.9804 10.0481 10.0481 10.2649 10.2649 10.4011 10.4011 10.8660 10.8660 11.2803 11.2803 11.7484 11.7484 14.2523 14.2523 14.5023 14.5023 14.6898 14.6898 15.5042 15.5042 16.1531 16.1531 16.6768 16.6768 k = 0.1371-0.2781 0.9516 ( 3196 PWs) bands (ev): -54.6730 -54.6730 -54.6528 -54.6528 -27.5900 -27.5900 -27.5393 -27.5393 -18.9875 -18.9875 -18.9720 -18.9720 -18.9143 -18.9143 -18.7142 -18.7142 0.2118 0.2118 0.4669 0.4669 1.5166 1.5166 2.4048 2.4048 6.9653 6.9653 7.6000 7.6000 8.6374 8.6374 8.7247 8.7247 9.0288 9.0288 10.0486 10.0486 10.2902 10.2902 10.3883 10.3883 10.8755 10.8755 11.2727 11.2727 11.7685 11.7685 14.2192 14.2192 14.4639 14.4639 14.6337 14.6337 15.5496 15.5496 16.1807 16.1807 16.6725 16.6725 k = 0.1425-0.2892 0.9346 ( 3192 PWs) bands (ev): -54.6732 -54.6732 -54.6530 -54.6530 -27.5893 -27.5893 -27.5385 -27.5385 -18.9864 -18.9864 -18.9701 -18.9701 -18.9112 -18.9112 -18.7138 -18.7138 0.1822 0.1822 0.4460 0.4460 1.4847 1.4847 2.3963 2.3963 7.0305 7.0305 7.6762 7.6762 8.6087 8.6087 8.7254 8.7254 9.0962 9.0962 10.0500 10.0500 10.2972 10.2972 10.3928 10.3928 10.8840 10.8840 11.2648 11.2648 11.7897 11.7897 14.1735 14.1735 14.4296 14.4296 14.5868 14.5868 15.5976 15.5976 16.2099 16.2099 16.6660 16.6660 k = 0.1480-0.3003 0.9176 ( 3188 PWs) bands (ev): -54.6733 -54.6733 -54.6531 -54.6531 -27.5886 -27.5886 -27.5378 -27.5378 -18.9857 -18.9857 -18.9680 -18.9680 -18.9078 -18.9078 -18.7133 -18.7133 0.1528 0.1528 0.4246 0.4246 1.4516 1.4516 2.3886 2.3886 7.0982 7.0982 7.7527 7.7527 8.5593 8.5593 8.7393 8.7393 9.1755 9.1755 10.0528 10.0528 10.2863 10.2863 10.4142 10.4142 10.8911 10.8911 11.2571 11.2571 11.8119 11.8119 14.1150 14.1150 14.3988 14.3988 14.5505 14.5505 15.6477 15.6477 16.2403 16.2403 16.6563 16.6563 k = 0.1535-0.3113 0.9006 ( 3186 PWs) bands (ev): -54.6735 -54.6735 -54.6533 -54.6533 -27.5879 -27.5879 -27.5370 -27.5370 -18.9852 -18.9852 -18.9656 -18.9656 -18.9044 -18.9044 -18.7128 -18.7128 0.1236 0.1236 0.4028 0.4028 1.4177 1.4177 2.3816 2.3816 7.1679 7.1679 7.8286 7.8286 8.5069 8.5069 8.7547 8.7547 9.2612 9.2612 10.0575 10.0575 10.2682 10.2682 10.4425 10.4425 10.8969 10.8969 11.2498 11.2498 11.8353 11.8353 14.0460 14.0460 14.3695 14.3695 14.5248 14.5248 15.6992 15.6992 16.2717 16.2717 16.6418 16.6418 k = 0.1589-0.3224 0.8836 ( 3188 PWs) bands (ev): -54.6736 -54.6736 -54.6534 -54.6534 -27.5873 -27.5873 -27.5363 -27.5363 -18.9850 -18.9850 -18.9631 -18.9631 -18.9009 -18.9009 -18.7122 -18.7122 0.0948 0.0948 0.3807 0.3807 1.3833 1.3833 2.3752 2.3752 7.2393 7.2393 7.9019 7.9019 8.4569 8.4569 8.7709 8.7709 9.3491 9.3491 10.0642 10.0642 10.2486 10.2486 10.4724 10.4724 10.9014 10.9014 11.2433 11.2433 11.8599 11.8599 13.9698 13.9698 14.3395 14.3395 14.5085 14.5085 15.7518 15.7518 16.3038 16.3038 16.6205 16.6205 k = 0.1644-0.3334 0.8666 ( 3189 PWs) bands (ev): -54.6738 -54.6738 -54.6536 -54.6536 -27.5866 -27.5866 -27.5355 -27.5355 -18.9850 -18.9850 -18.9605 -18.9605 -18.8973 -18.8973 -18.7116 -18.7116 0.0664 0.0664 0.3584 0.3584 1.3487 1.3487 2.3695 2.3695 7.3118 7.3118 7.9690 7.9690 8.4139 8.4139 8.7887 8.7887 9.4362 9.4362 10.0731 10.0731 10.2302 10.2302 10.5023 10.5023 10.9049 10.9049 11.2378 11.2378 11.8855 11.8855 13.8890 13.8890 14.3079 14.3079 14.4997 14.4997 15.8048 15.8048 16.3359 16.3359 16.5902 16.5902 k = 0.1698-0.3445 0.8496 ( 3187 PWs) bands (ev): -54.6740 -54.6740 -54.6537 -54.6537 -27.5859 -27.5859 -27.5347 -27.5347 -18.9851 -18.9851 -18.9579 -18.9579 -18.8935 -18.8935 -18.7109 -18.7109 0.0385 0.0385 0.3361 0.3361 1.3141 1.3141 2.3642 2.3642 7.3849 7.3849 8.0231 8.0231 8.3850 8.3850 8.8084 8.8084 9.5199 9.5199 10.0833 10.0833 10.2153 10.2153 10.5315 10.5315 10.9080 10.9080 11.2336 11.2336 11.9121 11.9121 13.8057 13.8057 14.2748 14.2748 14.4963 14.4963 15.8576 15.8576 16.3675 16.3675 16.5495 16.5495 k = 0.1753-0.3556 0.8326 ( 3185 PWs) bands (ev): -54.6741 -54.6741 -54.6539 -54.6539 -27.5853 -27.5853 -27.5339 -27.5339 -18.9854 -18.9854 -18.9552 -18.9552 -18.8898 -18.8898 -18.7101 -18.7101 0.0113 0.0113 0.3138 0.3138 1.2798 1.2798 2.3593 2.3593 7.4581 7.4581 8.0532 8.0532 8.3810 8.3810 8.8307 8.8307 9.5980 9.5980 10.0921 10.0921 10.2078 10.2078 10.5599 10.5599 10.9112 10.9112 11.2310 11.2310 11.9397 11.9397 13.7211 13.7211 14.2406 14.2406 14.4964 14.4964 15.9092 15.9092 16.3968 16.3968 16.4998 16.4998 k = 0.1807-0.3666 0.8156 ( 3190 PWs) bands (ev): -54.6743 -54.6743 -54.6541 -54.6541 -27.5847 -27.5847 -27.5332 -27.5332 -18.9858 -18.9858 -18.9526 -18.9526 -18.8861 -18.8861 -18.7093 -18.7093 -0.0151 -0.0151 0.2916 0.2916 1.2459 1.2459 2.3548 2.3548 7.5307 7.5307 8.0529 8.0529 8.4085 8.4085 8.8555 8.8555 9.6687 9.6687 10.0953 10.0953 10.2121 10.2121 10.5873 10.5873 10.9156 10.9156 11.2304 11.2304 11.9680 11.9680 13.6362 13.6362 14.2056 14.2056 14.4986 14.4986 15.9583 15.9583 16.4090 16.4090 16.4575 16.4575 k = 0.1862-0.3777 0.7986 ( 3188 PWs) bands (ev): -54.6744 -54.6744 -54.6542 -54.6542 -27.5840 -27.5840 -27.5324 -27.5324 -18.9862 -18.9862 -18.9500 -18.9500 -18.8824 -18.8824 -18.7084 -18.7084 -0.0408 -0.0408 0.2698 0.2698 1.2127 1.2127 2.3506 2.3506 7.6024 7.6024 8.0288 8.0288 8.4606 8.4606 8.8832 8.8832 9.7311 9.7311 10.0910 10.0910 10.2296 10.2296 10.6140 10.6140 10.9223 10.9223 11.2324 11.2324 11.9969 11.9969 13.5516 13.5516 14.1702 14.1702 14.5019 14.5019 16.0029 16.0029 16.3598 16.3598 16.4701 16.4701 k = 0.1916-0.3888 0.7816 ( 3192 PWs) bands (ev): -54.6746 -54.6746 -54.6544 -54.6544 -27.5834 -27.5834 -27.5317 -27.5317 -18.9867 -18.9867 -18.9475 -18.9475 -18.8787 -18.8787 -18.7076 -18.7076 -0.0657 -0.0657 0.2483 0.2483 1.1804 1.1804 2.3467 2.3467 7.6724 7.6724 7.9923 7.9923 8.5257 8.5257 8.9136 8.9136 9.7851 9.7851 10.0818 10.0818 10.2559 10.2559 10.6399 10.6399 10.9321 10.9321 11.2379 11.2379 12.0261 12.0261 13.4680 13.4680 14.1345 14.1345 14.5056 14.5056 16.0394 16.0394 16.2938 16.2938 16.4966 16.4966 k = 0.1971-0.3998 0.7646 ( 3190 PWs) bands (ev): -54.6747 -54.6747 -54.6545 -54.6545 -27.5828 -27.5828 -27.5310 -27.5310 -18.9872 -18.9872 -18.9451 -18.9451 -18.8751 -18.8751 -18.7067 -18.7067 -0.0895 -0.0895 0.2273 0.2273 1.1492 1.1492 2.3430 2.3430 7.7401 7.7401 7.9504 7.9504 8.5966 8.5966 8.9469 8.9469 9.8316 9.8316 10.0708 10.0708 10.2851 10.2851 10.6652 10.6652 10.9454 10.9454 11.2482 11.2482 12.0554 12.0554 13.3856 13.3856 14.0989 14.0989 14.5090 14.5090 16.0609 16.0609 16.2311 16.2311 16.5239 16.5239 k = 0.2025-0.4109 0.7476 ( 3190 PWs) bands (ev): -54.6749 -54.6749 -54.6547 -54.6547 -27.5822 -27.5822 -27.5303 -27.5303 -18.9877 -18.9877 -18.9427 -18.9427 -18.8715 -18.8715 -18.7057 -18.7057 -0.1124 -0.1124 0.2069 0.2069 1.1191 1.1191 2.3395 2.3395 7.8041 7.8041 7.9076 7.9076 8.6693 8.6693 8.9830 8.9830 9.8718 9.8718 10.0602 10.0602 10.3126 10.3126 10.6900 10.6900 10.9612 10.9612 11.2653 11.2653 12.0843 12.0843 13.3051 13.3051 14.0635 14.0635 14.5116 14.5116 16.0534 16.0534 16.1858 16.1858 16.5507 16.5507 k = 0.2080-0.4220 0.7306 ( 3185 PWs) bands (ev): -54.6750 -54.6750 -54.6548 -54.6548 -27.5816 -27.5816 -27.5296 -27.5296 -18.9882 -18.9882 -18.9404 -18.9404 -18.8681 -18.8681 -18.7047 -18.7047 -0.1342 -0.1342 0.1871 0.1871 1.0903 1.0903 2.3362 2.3362 7.8473 7.8473 7.8826 7.8826 8.7414 8.7414 9.0217 9.0217 9.9068 9.9068 10.0512 10.0512 10.3356 10.3356 10.7147 10.7147 10.9776 10.9776 11.2915 11.2915 12.1125 12.1125 13.2268 13.2268 14.0285 14.0285 14.5133 14.5133 16.0095 16.0095 16.1637 16.1637 16.5772 16.5772 k = 0.2134-0.4330 0.7136 ( 3189 PWs) bands (ev): -54.6751 -54.6751 -54.6549 -54.6549 -27.5811 -27.5811 -27.5290 -27.5290 -18.9887 -18.9887 -18.9384 -18.9384 -18.8648 -18.8648 -18.7038 -18.7038 -0.1548 -0.1548 0.1682 0.1682 1.0630 1.0630 2.3332 2.3332 7.8145 7.8145 7.9311 7.9311 8.8114 8.8114 9.0630 9.0630 9.9367 9.9367 10.0449 10.0449 10.3533 10.3533 10.7393 10.7393 10.9916 10.9916 11.3283 11.3283 12.1396 12.1396 13.1513 13.1513 13.9942 13.9942 14.5137 14.5137 15.9478 15.9478 16.1456 16.1456 16.6033 16.6033 k = 0.2189-0.4441 0.6966 ( 3189 PWs) bands (ev): -54.6753 -54.6753 -54.6551 -54.6551 -27.5805 -27.5805 -27.5284 -27.5284 -18.9893 -18.9893 -18.9364 -18.9364 -18.8616 -18.8616 -18.7028 -18.7028 -0.1743 -0.1743 0.1501 0.1501 1.0372 1.0372 2.3303 2.3303 7.7740 7.7740 7.9852 7.9852 8.8782 8.8782 9.1066 9.1066 9.9609 9.9609 10.0427 10.0427 10.3666 10.3666 10.7642 10.7642 11.0014 11.0014 11.3757 11.3757 12.1652 12.1652 13.0793 13.0793 13.9608 13.9608 14.5128 14.5128 15.8821 15.8821 16.1180 16.1180 16.6292 16.6292 k = 0.2244-0.4551 0.6795 ( 3187 PWs) bands (ev): -54.6754 -54.6754 -54.6552 -54.6552 -27.5800 -27.5800 -27.5278 -27.5278 -18.9898 -18.9898 -18.9346 -18.9346 -18.8585 -18.8585 -18.7019 -18.7019 -0.1925 -0.1925 0.1329 0.1329 1.0130 1.0130 2.3276 2.3276 7.7348 7.7348 8.0359 8.0359 8.9409 8.9409 9.1524 9.1524 9.9779 9.9779 10.0454 10.0454 10.3778 10.3778 10.7893 10.7893 11.0063 11.0063 11.4317 11.4317 12.1888 12.1888 13.0113 13.0113 13.9285 13.9285 14.5103 14.5103 15.8175 15.8175 16.0783 16.0783 16.6546 16.6546 k = 0.2298-0.4662 0.6625 ( 3179 PWs) bands (ev): -54.6755 -54.6755 -54.6553 -54.6553 -27.5795 -27.5795 -27.5272 -27.5272 -18.9902 -18.9902 -18.9328 -18.9328 -18.8556 -18.8556 -18.7009 -18.7009 -0.2095 -0.2095 0.1168 0.1168 0.9906 0.9906 2.3250 2.3250 7.6978 7.6978 8.0825 8.0825 8.9988 8.9988 9.2001 9.2001 9.9879 9.9879 10.0515 10.0515 10.3896 10.3896 10.8147 10.8147 11.0068 11.0068 11.4927 11.4927 12.2102 12.2102 12.9485 12.9485 13.8976 13.8976 14.5065 14.5065 15.7562 15.7562 16.0277 16.0277 16.6794 16.6794 k = 0.2353-0.4773 0.6455 ( 3181 PWs) bands (ev): -54.6756 -54.6756 -54.6554 -54.6554 -27.5791 -27.5791 -27.5267 -27.5267 -18.9907 -18.9907 -18.9312 -18.9312 -18.8530 -18.8530 -18.7000 -18.7000 -0.2251 -0.2251 0.1018 0.1018 0.9699 0.9699 2.3227 2.3227 7.6633 7.6633 8.1247 8.1247 9.0514 9.0514 9.2495 9.2495 9.9933 9.9933 10.0566 10.0566 10.4047 10.4047 10.8404 10.8404 11.0038 11.0038 11.5550 11.5550 12.2290 12.2290 12.8918 12.8918 13.8681 13.8681 14.5013 14.5013 15.6993 15.6993 15.9692 15.9692 16.7031 16.7031 k = 0.2407-0.4883 0.6285 ( 3179 PWs) bands (ev): -54.6757 -54.6757 -54.6555 -54.6555 -27.5787 -27.5787 -27.5262 -27.5262 -18.9912 -18.9912 -18.9298 -18.9298 -18.8505 -18.8505 -18.6992 -18.6992 -0.2393 -0.2393 0.0880 0.0880 0.9510 0.9510 2.3205 2.3205 7.6317 7.6317 8.1625 8.1625 9.0983 9.0983 9.3002 9.3002 9.9969 9.9969 10.0568 10.0568 10.4253 10.4253 10.8661 10.8661 10.9984 10.9984 11.6149 11.6149 12.2450 12.2450 12.8425 12.8425 13.8404 13.8404 14.4952 14.4952 15.6475 15.6475 15.9058 15.9058 16.7256 16.7256 k = 0.2462-0.4994 0.6115 ( 3173 PWs) bands (ev): -54.6757 -54.6757 -54.6555 -54.6555 -27.5782 -27.5782 -27.5258 -27.5258 -18.9915 -18.9915 -18.9285 -18.9285 -18.8482 -18.8482 -18.6983 -18.6983 -0.2522 -0.2522 0.0755 0.0755 0.9340 0.9340 2.3186 2.3186 7.6030 7.6030 8.1959 8.1959 9.1394 9.1394 9.3519 9.3519 9.9989 9.9989 10.0510 10.0510 10.4517 10.4517 10.8913 10.8913 10.9916 10.9916 11.6691 11.6691 12.2582 12.2582 12.8016 12.8016 13.8147 13.8147 14.4883 14.4883 15.6013 15.6013 15.8404 15.8404 16.7466 16.7466 k = 0.2516-0.5105 0.5945 ( 3176 PWs) bands (ev): -54.6758 -54.6758 -54.6556 -54.6556 -27.5779 -27.5779 -27.5254 -27.5254 -18.9919 -18.9919 -18.9274 -18.9274 -18.8462 -18.8462 -18.6976 -18.6976 -0.2636 -0.2636 0.0643 0.0643 0.9189 0.9189 2.3168 2.3168 7.5773 7.5773 8.2249 8.2249 9.1747 9.1747 9.4043 9.4043 9.9975 9.9975 10.0414 10.0414 10.4832 10.4832 10.9149 10.9149 10.9847 10.9847 11.7148 11.7148 12.2688 12.2688 12.7702 12.7702 13.7911 13.7911 14.4811 14.4811 15.5610 15.5610 15.7754 15.7754 16.7659 16.7659 k = 0.2571-0.5215 0.5775 ( 3176 PWs) bands (ev): -54.6759 -54.6759 -54.6557 -54.6557 -27.5776 -27.5776 -27.5251 -27.5251 -18.9922 -18.9922 -18.9264 -18.9264 -18.8445 -18.8445 -18.6970 -18.6970 -0.2735 -0.2735 0.0544 0.0544 0.9058 0.9058 2.3153 2.3153 7.5549 7.5549 8.2497 8.2497 9.2042 9.2042 9.4570 9.4570 9.9866 9.9866 10.0346 10.0346 10.5178 10.5178 10.9343 10.9343 10.9802 10.9802 11.7503 11.7503 12.2770 12.2770 12.7487 12.7487 13.7698 13.7698 14.4740 14.4740 15.5266 15.5266 15.7132 15.7132 16.7830 16.7830 k = 0.2625-0.5326 0.5605 ( 3188 PWs) bands (ev): -54.6760 -54.6760 -54.6558 -54.6558 -27.5775 -27.5775 -27.5249 -27.5249 -18.9926 -18.9926 -18.9256 -18.9256 -18.8431 -18.8431 -18.6964 -18.6964 -0.2820 -0.2820 0.0460 0.0460 0.8946 0.8946 2.3139 2.3139 7.5358 7.5358 8.2703 8.2703 9.2283 9.2283 9.5098 9.5098 9.9638 9.9638 10.0341 10.0341 10.5534 10.5534 10.9434 10.9434 10.9841 10.9841 11.7750 11.7750 12.2833 12.2833 12.7364 12.7364 13.7512 13.7512 14.4673 14.4673 15.4982 15.4982 15.6559 15.6559 16.7975 16.7975 k = 0.2680-0.5437 0.5435 ( 3182 PWs) bands (ev): -54.6760 -54.6760 -54.6558 -54.6558 -27.5773 -27.5773 -27.5246 -27.5246 -18.9929 -18.9929 -18.9250 -18.9250 -18.8418 -18.8418 -18.6959 -18.6959 -0.2889 -0.2889 0.0391 0.0391 0.8854 0.8854 2.3128 2.3128 7.5201 7.5201 8.2870 8.2870 9.2474 9.2474 9.5623 9.5623 9.9327 9.9327 10.0368 10.0368 10.5877 10.5877 10.9413 10.9413 10.9970 10.9970 11.7901 11.7901 12.2878 12.2878 12.7318 12.7318 13.7354 13.7354 14.4614 14.4614 15.4757 15.4757 15.6054 15.6054 16.8089 16.8089 k = 0.2734-0.5547 0.5265 ( 3182 PWs) bands (ev): -54.6760 -54.6760 -54.6558 -54.6558 -27.5771 -27.5771 -27.5244 -27.5244 -18.9930 -18.9930 -18.9244 -18.9244 -18.8408 -18.8408 -18.6955 -18.6955 -0.2944 -0.2944 0.0336 0.0336 0.8783 0.8783 2.3120 2.3120 7.5078 7.5078 8.2997 8.2997 9.2618 9.2618 9.6141 9.6141 9.8963 9.8963 10.0402 10.0402 10.6180 10.6180 10.9353 10.9353 11.0110 11.0110 11.7976 11.7976 12.2909 12.2909 12.7324 12.7324 13.7227 13.7227 14.4565 14.4565 15.4590 15.4590 15.5634 15.5634 16.8157 16.8157 k = 0.2789-0.5658 0.5095 ( 3186 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5770 -27.5770 -27.5243 -27.5243 -18.9932 -18.9932 -18.9241 -18.9241 -18.8401 -18.8401 -18.6953 -18.6953 -0.2982 -0.2982 0.0297 0.0297 0.8732 0.8732 2.3114 2.3114 7.4990 7.4990 8.3088 8.3088 9.2718 9.2718 9.6647 9.6647 9.8561 9.8561 10.0431 10.0431 10.6422 10.6422 10.9294 10.9294 11.0225 11.0225 11.8002 11.8002 12.2929 12.2929 12.7355 12.7355 13.7133 13.7133 14.4529 14.4529 15.4479 15.4479 15.5316 15.5316 16.8162 16.8162 k = 0.2843-0.5769 0.4925 ( 3178 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5242 -27.5242 -18.9932 -18.9932 -18.9238 -18.9238 -18.8396 -18.8396 -18.6951 -18.6951 -0.3006 -0.3006 0.0274 0.0274 0.8701 0.8701 2.3110 2.3110 7.4937 7.4937 8.3142 8.3142 9.2777 9.2777 9.7131 9.7131 9.8139 9.8139 10.0450 10.0450 10.6579 10.6579 10.9251 10.9251 11.0297 11.0297 11.8006 11.8006 12.2939 12.2939 12.7385 12.7385 13.7076 13.7076 14.4508 14.4508 15.4418 15.4418 15.5114 15.5114 16.8126 16.8126 k = 0.2898-0.5879 0.4755 ( 3176 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9933 -18.9933 -18.9237 -18.9237 -18.8395 -18.8395 -18.6950 -18.6950 -0.3013 -0.3013 0.0266 0.0266 0.8691 0.8691 2.3109 2.3109 7.4920 7.4920 8.3160 8.3160 9.2796 9.2796 9.7468 9.7468 9.7823 9.7823 10.0457 10.0457 10.6634 10.6634 10.9235 10.9235 11.0322 11.0322 11.8005 11.8005 12.2942 12.2942 12.7397 12.7397 13.7057 13.7057 14.4500 14.4500 15.4400 15.4400 15.5045 15.5045 16.8106 16.8106 k = 0.7102-0.1800 0.3449 ( 3176 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5769 -27.5769 -27.5241 -27.5241 -18.9933 -18.9933 -18.9237 -18.9237 -18.8395 -18.8395 -18.6950 -18.6950 -0.3013 -0.3013 0.0266 0.0266 0.8691 0.8691 2.3109 2.3109 7.4920 7.4920 8.3160 8.3160 9.2796 9.2796 9.7468 9.7468 9.7823 9.7823 10.0457 10.0457 10.6634 10.6634 10.9235 10.9235 11.0322 11.0322 11.8005 11.8005 12.2942 12.2942 12.7397 12.7397 13.7057 13.7057 14.4500 14.4500 15.4400 15.4400 15.5045 15.5045 16.8106 16.8106 k = 0.7027-0.1647 0.3326 ( 3172 PWs) bands (ev): -54.6761 -54.6761 -54.6559 -54.6559 -27.5767 -27.5767 -27.5242 -27.5242 -18.9926 -18.9926 -18.9238 -18.9238 -18.8392 -18.8392 -18.6955 -18.6955 -0.3518 -0.3518 0.0864 0.0864 0.8000 0.8000 2.3948 2.3948 7.5792 7.5792 8.2316 8.2316 9.2221 9.2221 9.7418 9.7418 9.7727 9.7727 10.1117 10.1117 10.6288 10.6288 10.7908 10.7908 11.0795 11.0795 11.8133 11.8133 12.2837 12.2837 12.7263 12.7263 13.7895 13.7895 14.4566 14.4566 15.4867 15.4867 15.5138 15.5138 16.8283 16.8283 k = 0.6952-0.1495 0.3203 ( 3174 PWs) bands (ev): -54.6760 -54.6760 -54.6559 -54.6559 -27.5766 -27.5766 -27.5243 -27.5243 -18.9920 -18.9920 -18.9239 -18.9239 -18.8389 -18.8389 -18.6961 -18.6961 -0.4014 -0.4014 0.1417 0.1417 0.7375 0.7375 2.4816 2.4816 7.6653 7.6653 8.1507 8.1507 9.1651 9.1651 9.7336 9.7336 9.7604 9.7604 10.1779 10.1779 10.5606 10.5606 10.6862 10.6862 11.1295 11.1295 11.8221 11.8221 12.2758 12.2758 12.7132 12.7132 13.8793 13.8793 14.4619 14.4619 15.5301 15.5301 15.5340 15.5340 16.8092 16.8092 k = 0.6877-0.1343 0.3080 ( 3176 PWs) bands (ev): -54.6760 -54.6760 -54.6559 -54.6559 -27.5766 -27.5766 -27.5243 -27.5243 -18.9914 -18.9914 -18.9239 -18.9239 -18.8387 -18.8387 -18.6966 -18.6966 -0.4501 -0.4501 0.1895 0.1895 0.6840 0.6840 2.5713 2.5713 7.7496 7.7496 8.0735 8.0735 9.1093 9.1093 9.7207 9.7207 9.7469 9.7469 10.2384 10.2384 10.4369 10.4369 10.6405 10.6405 11.1809 11.1809 11.8266 11.8266 12.2704 12.2704 12.7000 12.7000 13.9734 13.9734 14.4660 14.4660 15.5561 15.5561 15.5784 15.5784 16.7862 16.7862 k = 0.6802-0.1191 0.2956 ( 3176 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5765 -27.5765 -27.5244 -27.5244 -18.9908 -18.9908 -18.9239 -18.9239 -18.8384 -18.8384 -18.6971 -18.6971 -0.4977 -0.4977 0.2255 0.2255 0.6441 0.6441 2.6640 2.6640 7.8306 7.8306 8.0013 8.0013 9.0550 9.0550 9.7015 9.7015 9.7341 9.7341 10.2270 10.2270 10.3613 10.3613 10.6182 10.6182 11.2336 11.2336 11.8268 11.8268 12.2679 12.2679 12.6867 12.6867 14.0704 14.0704 14.4686 14.4686 15.5887 15.5887 15.6225 15.6225 16.7613 16.7613 k = 0.6727-0.1038 0.2833 ( 3174 PWs) bands (ev): -54.6760 -54.6760 -54.6559 -54.6559 -27.5763 -27.5763 -27.5245 -27.5245 -18.9901 -18.9901 -18.9240 -18.9240 -18.8381 -18.8381 -18.6976 -18.6976 -0.5440 -0.5440 0.2438 0.2438 0.6231 0.6231 2.7596 2.7596 7.8923 7.8923 7.9493 7.9493 9.0026 9.0026 9.6759 9.6759 9.7217 9.7217 10.0842 10.0842 10.4110 10.4110 10.6036 10.6036 11.2872 11.2872 11.8227 11.8227 12.2681 12.2681 12.6731 12.6731 14.1689 14.1689 14.4698 14.4698 15.6278 15.6278 15.6652 15.6652 16.7347 16.7347 k = 0.6652-0.0886 0.2710 ( 3176 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5762 -27.5762 -27.5246 -27.5246 -18.9895 -18.9895 -18.9240 -18.9240 -18.8378 -18.8378 -18.6982 -18.6982 -0.5891 -0.5891 0.2407 0.2407 0.6249 0.6249 2.8582 2.8582 7.8523 7.8523 7.9996 7.9996 8.9522 8.9522 9.6428 9.6428 9.7084 9.7084 9.9236 9.9236 10.4794 10.4794 10.5937 10.5937 11.3417 11.3417 11.8149 11.8149 12.2712 12.2712 12.6590 12.6590 14.2674 14.2674 14.4699 14.4699 15.6726 15.6726 15.7068 15.7068 16.7067 16.7067 k = 0.6577-0.0734 0.2587 ( 3184 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5761 -27.5761 -27.5247 -27.5247 -18.9889 -18.9889 -18.9241 -18.9241 -18.8375 -18.8375 -18.6987 -18.6987 -0.6327 -0.6327 0.2187 0.2187 0.6466 0.6466 2.9597 2.9597 7.7911 7.7911 8.0713 8.0713 8.9041 8.9041 9.5935 9.5935 9.6903 9.6903 9.7750 9.7750 10.5504 10.5504 10.5883 10.5883 11.3967 11.3967 11.8038 11.8038 12.2768 12.2768 12.6445 12.6445 14.3622 14.3622 14.4716 14.4716 15.7200 15.7200 15.7492 15.7492 16.6771 16.6771 k = 0.6501-0.0581 0.2464 ( 3184 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5760 -27.5760 -27.5248 -27.5248 -18.9883 -18.9883 -18.9241 -18.9241 -18.8371 -18.8371 -18.6992 -18.6992 -0.6749 -0.6749 0.1846 0.1846 0.6814 0.6814 3.0641 3.0641 7.7317 7.7317 8.1408 8.1408 8.8585 8.8585 9.4954 9.4954 9.6433 9.6433 9.6988 9.6988 10.5811 10.5811 10.6282 10.6282 11.4517 11.4517 11.7903 11.7903 12.2850 12.2850 12.6296 12.6296 14.4286 14.4286 14.4988 14.4988 15.7628 15.7628 15.7985 15.7985 16.6461 16.6461 k = 0.6426-0.0429 0.2340 ( 3182 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5758 -27.5758 -27.5249 -27.5249 -18.9877 -18.9877 -18.9240 -18.9240 -18.8368 -18.8368 -18.6997 -18.6997 -0.7155 -0.7155 0.1441 0.1441 0.7235 0.7235 3.1713 3.1713 7.6754 7.6754 8.2063 8.2063 8.8155 8.8155 9.3431 9.3431 9.5912 9.5912 9.6780 9.6780 10.5812 10.5812 10.7029 10.7029 11.5056 11.5056 11.7758 11.7758 12.2953 12.2953 12.6142 12.6142 14.4361 14.4361 14.5812 14.5812 15.7972 15.7972 15.8577 15.8577 16.6138 16.6138 k = 0.6351-0.0277 0.2217 ( 3186 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5757 -27.5757 -27.5250 -27.5250 -18.9871 -18.9871 -18.9240 -18.9240 -18.8365 -18.8365 -18.7002 -18.7002 -0.7545 -0.7545 0.1009 0.1009 0.7688 0.7688 3.2814 3.2814 7.6226 7.6226 8.2669 8.2669 8.7753 8.7753 9.1732 9.1732 9.5493 9.5493 9.6623 9.6623 10.5831 10.5831 10.7796 10.7796 11.5563 11.5563 11.7630 11.7630 12.3074 12.3074 12.5986 12.5986 14.4277 14.4277 14.6750 14.6750 15.8255 15.8255 15.9233 15.9233 16.5803 16.5803 k = 0.6276-0.0124 0.2094 ( 3194 PWs) bands (ev): -54.6760 -54.6760 -54.6560 -54.6560 -27.5757 -27.5757 -27.5251 -27.5251 -18.9866 -18.9866 -18.9239 -18.9239 -18.8363 -18.8363 -18.7007 -18.7007 -0.7918 -0.7918 0.0572 0.0572 0.8153 0.8153 3.3940 3.3940 7.5733 7.5733 8.3218 8.3218 8.7381 8.7381 8.9989 8.9989 9.5103 9.5103 9.6473 9.6473 10.5871 10.5871 10.8576 10.8576 11.5980 11.5980 11.7579 11.7579 12.3208 12.3208 12.5831 12.5831 14.4142 14.4142 14.7689 14.7689 15.8486 15.8486 15.9932 15.9932 16.5458 16.5458 k = 0.6201 0.0028 0.1971 ( 3202 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5757 -27.5757 -27.5252 -27.5252 -18.9861 -18.9861 -18.9239 -18.9239 -18.8361 -18.8361 -18.7011 -18.7011 -0.8273 -0.8273 0.0143 0.0143 0.8616 0.8616 3.5093 3.5093 7.5275 7.5275 8.3701 8.3701 8.7023 8.7023 8.8260 8.8260 9.4720 9.4720 9.6324 9.6324 10.5931 10.5931 10.9365 10.9365 11.6205 11.6205 11.7710 11.7710 12.3348 12.3348 12.5680 12.5680 14.3971 14.3971 14.8608 14.8608 15.8670 15.8670 16.0660 16.0660 16.5108 16.5108 k = 0.6126 0.0180 0.1848 ( 3210 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5756 -27.5756 -27.5253 -27.5253 -18.9856 -18.9856 -18.9239 -18.9239 -18.8358 -18.8358 -18.7016 -18.7016 -0.8609 -0.8609 -0.0273 -0.0273 0.9068 0.9068 3.6271 3.6271 7.4852 7.4852 8.4102 8.4102 8.6267 8.6267 8.6989 8.6989 9.4340 9.4340 9.6178 9.6178 10.6008 10.6008 11.0161 11.0161 11.6201 11.6201 11.8066 11.8066 12.3485 12.3485 12.5542 12.5542 14.3767 14.3767 14.9500 14.9500 15.8807 15.8807 16.1409 16.1409 16.4758 16.4758 k = 0.6051 0.0332 0.1725 ( 3214 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5755 -27.5755 -27.5254 -27.5254 -18.9851 -18.9851 -18.9238 -18.9238 -18.8355 -18.8355 -18.7020 -18.7020 -0.8926 -0.8926 -0.0670 -0.0670 0.9503 0.9503 3.7471 3.7471 7.4462 7.4462 8.4364 8.4364 8.4651 8.4651 8.6701 8.6701 9.3963 9.3963 9.6033 9.6033 10.6099 10.6099 11.0959 11.0959 11.6060 11.6060 11.8554 11.8554 12.3607 12.3607 12.5427 12.5427 14.3533 14.3533 15.0360 15.0360 15.8898 15.8898 16.2164 16.2164 16.4420 16.4420 k = 0.5976 0.0485 0.1601 ( 3214 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5755 -27.5755 -27.5254 -27.5254 -18.9846 -18.9846 -18.9237 -18.9237 -18.8353 -18.8353 -18.7024 -18.7024 -0.9224 -0.9224 -0.1045 -0.1045 0.9919 0.9919 3.8691 3.8691 7.4106 7.4106 8.2867 8.2867 8.4592 8.4592 8.6607 8.6607 9.3592 9.3592 9.5893 9.5893 10.6203 10.6203 11.1755 11.1755 11.5861 11.5861 11.9099 11.9099 12.3697 12.3697 12.5350 12.5350 14.3269 14.3269 15.1182 15.1182 15.8944 15.8944 16.2892 16.2892 16.4123 16.4123 k = 0.5901 0.0637 0.1478 ( 3216 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5754 -27.5754 -27.5254 -27.5254 -18.9842 -18.9842 -18.9236 -18.9236 -18.8350 -18.8350 -18.7027 -18.7027 -0.9502 -0.9502 -0.1396 -0.1396 1.0312 1.0312 3.9930 3.9930 7.3780 7.3780 8.1146 8.1146 8.4633 8.4633 8.6636 8.6636 9.3229 9.3229 9.5758 9.5758 10.6316 10.6316 11.2541 11.2541 11.5641 11.5641 11.9663 11.9663 12.3739 12.3739 12.5326 12.5326 14.2981 14.2981 15.1962 15.1962 15.8950 15.8950 16.3369 16.3369 16.4091 16.4091 k = 0.5826 0.0789 0.1355 ( 3216 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5753 -27.5753 -27.5255 -27.5255 -18.9837 -18.9837 -18.9235 -18.9235 -18.8348 -18.8348 -18.7030 -18.7030 -0.9759 -0.9759 -0.1723 -0.1723 1.0680 1.0680 4.1184 4.1184 7.3482 7.3482 7.9445 7.9445 8.4574 8.4574 8.6752 8.6752 9.2878 9.2878 9.5629 9.5629 10.6434 10.6434 11.3311 11.3311 11.5416 11.5416 12.0231 12.0231 12.3726 12.3726 12.5361 12.5361 14.2669 14.2669 15.2697 15.2697 15.8918 15.8918 16.3249 16.3249 16.4667 16.4667 k = 0.5751 0.0942 0.1232 ( 3220 PWs) bands (ev): -54.6761 -54.6761 -54.6561 -54.6561 -27.5753 -27.5753 -27.5255 -27.5255 -18.9834 -18.9834 -18.9234 -18.9234 -18.8346 -18.8346 -18.7034 -18.7034 -0.9996 -0.9996 -0.2023 -0.2023 1.1021 1.1021 4.2449 4.2449 7.3208 7.3208 7.7778 7.7778 8.4458 8.4458 8.6911 8.6911 9.2541 9.2541 9.5507 9.5507 10.6557 10.6557 11.4057 11.4057 11.5196 11.5196 12.0792 12.0792 12.3663 12.3663 12.5449 12.5449 14.2341 14.2341 15.3382 15.3382 15.8853 15.8853 16.2988 16.2988 16.5391 16.5391 k = 0.5676 0.1094 0.1109 ( 3216 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5752 -27.5752 -27.5255 -27.5255 -18.9830 -18.9830 -18.9232 -18.9232 -18.8344 -18.8344 -18.7036 -18.7036 -1.0210 -1.0210 -0.2297 -0.2297 1.1333 1.1333 4.3719 4.3719 7.2945 7.2945 7.6161 7.6161 8.4318 8.4318 8.7083 8.7083 9.2222 9.2222 9.5394 9.5394 10.6679 10.6679 11.4770 11.4770 11.4986 11.4986 12.1337 12.1337 12.3567 12.3567 12.5575 12.5575 14.2001 14.2001 15.4016 15.4016 15.8761 15.8761 16.2727 16.2727 16.6119 16.6119 k = 0.5601 0.1246 0.0985 ( 3214 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5752 -27.5752 -27.5254 -27.5254 -18.9827 -18.9827 -18.9230 -18.9230 -18.8342 -18.8342 -18.7038 -18.7038 -1.0404 -1.0404 -0.2543 -0.2543 1.1616 1.1616 4.4986 4.4986 7.2654 7.2654 7.4642 7.4642 8.4173 8.4173 8.7248 8.7248 9.1925 9.1925 9.5291 9.5291 10.6799 10.6799 11.4790 11.4790 11.5441 11.5441 12.1856 12.1856 12.3455 12.3455 12.5722 12.5722 14.1657 14.1657 15.4595 15.4595 15.8646 15.8646 16.2486 16.2486 16.6823 16.6823 k = 0.5526 0.1399 0.0862 ( 3214 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5751 -27.5751 -27.5254 -27.5254 -18.9824 -18.9824 -18.9230 -18.9230 -18.8341 -18.8341 -18.7040 -18.7040 -1.0575 -1.0575 -0.2761 -0.2761 1.1867 1.1867 4.6240 4.6240 7.2151 7.2151 7.3415 7.3415 8.4035 8.4035 8.7399 8.7399 9.1653 9.1653 9.5198 9.5198 10.6913 10.6913 11.4611 11.4611 11.6060 11.6060 12.2335 12.2335 12.3346 12.3346 12.5876 12.5876 14.1316 14.1316 15.5116 15.5116 15.8516 15.8516 16.2272 16.2272 16.7489 16.7489 k = 0.5450 0.1551 0.0739 ( 3210 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5750 -27.5750 -27.5254 -27.5254 -18.9821 -18.9821 -18.9228 -18.9228 -18.8339 -18.8339 -18.7042 -18.7042 -1.0724 -1.0724 -0.2950 -0.2950 1.2087 1.2087 4.7467 4.7467 7.1093 7.1093 7.2836 7.2836 8.3910 8.3910 8.7531 8.7531 9.1409 9.1409 9.5116 9.5116 10.7019 10.7019 11.4452 11.4452 11.6619 11.6619 12.2738 12.2738 12.3278 12.3278 12.6028 12.6028 14.0989 14.0989 15.5578 15.5578 15.8375 15.8375 16.2089 16.2089 16.8103 16.8103 k = 0.5375 0.1703 0.0616 ( 3218 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5751 -27.5751 -27.5254 -27.5254 -18.9819 -18.9819 -18.9228 -18.9228 -18.8338 -18.8338 -18.7044 -18.7044 -1.0851 -1.0851 -0.3111 -0.3111 1.2274 1.2274 4.8645 4.8645 6.9806 6.9806 7.2601 7.2601 8.3800 8.3800 8.7642 8.7642 9.1197 9.1197 9.5045 9.5045 10.7113 10.7113 11.4315 11.4315 11.7108 11.7108 12.2924 12.2924 12.3389 12.3389 12.6169 12.6169 14.0686 14.0686 15.5980 15.5980 15.8230 15.8230 16.1937 16.1937 16.8654 16.8654 k = 0.5300 0.1855 0.0493 ( 3222 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5751 -27.5751 -27.5255 -27.5255 -18.9818 -18.9818 -18.9228 -18.9228 -18.8337 -18.8337 -18.7046 -18.7046 -1.0954 -1.0954 -0.3243 -0.3243 1.2428 1.2428 4.9743 4.9743 6.8566 6.8566 7.2463 7.2463 8.3708 8.3708 8.7733 8.7733 9.1019 9.1019 9.4987 9.4987 10.7195 10.7195 11.4201 11.4201 11.7520 11.7520 12.2898 12.2898 12.3669 12.3669 12.6295 12.6295 14.0417 14.0417 15.6323 15.6323 15.8087 15.8087 16.1816 16.1816 16.9128 16.9128 k = 0.5225 0.2008 0.0370 ( 3216 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5750 -27.5750 -27.5254 -27.5254 -18.9816 -18.9816 -18.9227 -18.9227 -18.8336 -18.8336 -18.7046 -18.7046 -1.1035 -1.1035 -0.3346 -0.3346 1.2548 1.2548 5.0716 5.0716 6.7470 6.7470 7.2369 7.2369 8.3636 8.3636 8.7803 8.7803 9.0878 9.0878 9.4941 9.4941 10.7260 10.7260 11.4111 11.4111 11.7848 11.7848 12.2837 12.2837 12.3936 12.3936 12.6399 12.6399 14.0193 14.0193 15.6605 15.6605 15.7952 15.7952 16.1724 16.1724 16.9514 16.9514 k = 0.5150 0.2160 0.0246 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5749 -27.5749 -27.5254 -27.5254 -18.9814 -18.9814 -18.9226 -18.9226 -18.8336 -18.8336 -18.7047 -18.7047 -1.1093 -1.1093 -0.3419 -0.3419 1.2634 1.2634 5.1500 5.1500 6.6594 6.6594 7.2307 7.2307 8.3584 8.3584 8.7854 8.7854 9.0776 9.0776 9.4909 9.4909 10.7309 10.7309 11.4046 11.4046 11.8086 11.8086 12.2786 12.2786 12.4140 12.4140 12.6477 12.6477 14.0025 14.0025 15.6824 15.6824 15.7833 15.7833 16.1659 16.1659 16.9801 16.9801 k = 0.5075 0.2312 0.0123 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6562 -54.6562 -27.5749 -27.5749 -27.5254 -27.5254 -18.9813 -18.9813 -18.9226 -18.9226 -18.8335 -18.8335 -18.7047 -18.7047 -1.1128 -1.1128 -0.3463 -0.3463 1.2686 1.2686 5.2019 5.2019 6.6019 6.6019 7.2271 7.2271 8.3553 8.3553 8.7883 8.7883 9.0714 9.0714 9.4889 9.4889 10.7338 10.7338 11.4007 11.4007 11.8230 11.8230 12.2753 12.2753 12.4267 12.4267 12.6526 12.6526 13.9921 13.9921 15.6973 15.6973 15.7743 15.7743 16.1621 16.1621 16.9977 16.9977 k = 0.5000 0.2465-0.0000 ( 3208 PWs) bands (ev): -54.6760 -54.6760 -54.6561 -54.6561 -27.5748 -27.5748 -27.5255 -27.5255 -18.9813 -18.9813 -18.9227 -18.9227 -18.8334 -18.8334 -18.7048 -18.7048 -1.1139 -1.1139 -0.3478 -0.3478 1.2703 1.2703 5.2202 5.2202 6.5817 6.5817 7.2260 7.2260 8.3542 8.3542 8.7893 8.7893 9.0693 9.0693 9.4882 9.4882 10.7348 10.7348 11.3994 11.3994 11.8279 11.8279 12.2742 12.2742 12.4310 12.4310 12.6542 12.6542 13.9885 13.9885 15.7028 15.7028 15.7707 15.7707 16.1609 16.1609 17.0037 17.0037 Writing output data file TaPS.save init_run : 0.38s CPU 1.42s WALL ( 1 calls) electrons : 287.60s CPU 292.10s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.86s WALL ( 1 calls) potinit : 0.03s CPU 0.10s WALL ( 1 calls) Called by electrons: c_bands : 287.59s CPU 292.08s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.12s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.09s WALL ( 399 calls) cegterg : 260.95s CPU 263.62s WALL ( 454 calls) Called by sum_band: Called by *egterg: h_psi : 178.23s CPU 180.56s WALL ( 8193 calls) s_psi : 9.15s CPU 9.25s WALL ( 8193 calls) g_psi : 0.22s CPU 0.23s WALL ( 7340 calls) cdiaghg : 77.06s CPU 78.09s WALL ( 7739 calls) cegterg:over : 7.16s CPU 7.03s WALL ( 7340 calls) cegterg:upda : 5.98s CPU 5.72s WALL ( 7340 calls) cegterg:last : 2.90s CPU 2.95s WALL ( 1255 calls) cdiaghg:chol : 4.24s CPU 4.43s WALL ( 7739 calls) cdiaghg:inve : 3.21s CPU 3.17s WALL ( 7739 calls) cdiaghg:para : 5.26s CPU 5.21s WALL ( 15478 calls) Called by h_psi: h_psi:vloc : 158.73s CPU 160.75s WALL ( 8193 calls) h_psi:vnl : 19.28s CPU 19.56s WALL ( 8193 calls) add_vuspsi : 11.04s CPU 11.07s WALL ( 8193 calls) General routines calbec : 8.22s CPU 8.48s WALL ( 8193 calls) fft : 0.02s CPU 0.02s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 148.85s CPU 150.99s WALL ( 1009068 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.24s CPU 0.23s WALL ( 798 calls) Parallel routines fft_scatter : 45.52s CPU 45.89s WALL ( 1009091 calls) PWSCF : 5m 6.93s CPU 6m25.28s WALL This run was terminated on: 21:21:15 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=