Program PWSCF v.5.1.1 starts on 5Dec2015 at 4:58: 0 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./FexSi2O3x2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 48 28 8 4376 1924 311 Max 49 29 9 4393 1955 317 Sum 2347 1369 409 210687 93269 15047 bravais-lattice index = 14 lattice parameter (alat) = 10.2631 a.u. unit-cell volume = 2140.0664 (a.u.)^3 number of atoms/cell = 11 number of atomic types = 3 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.263102 celldm(2)= 1.000000 celldm(3)= 2.310093 celldm(4)= -0.072215 celldm(5)= -0.072077 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( -0.166504 -0.288762 2.285918 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 0.145771 ) b(2) = ( 0.000000 1.154701 0.145864 ) b(3) = ( 0.000000 0.000000 0.437461 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 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 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Fe read from file: /home/autes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Fe 8.00 55.84500 Fe( 1.00) Si 4.00 28.08550 Si( 1.00) No symmetry found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_1 (1) there are 2 classes and 1 irreducible representations the character table: E -E G_2 1.00 -1.00 the symmetry operations in each class: E 1 -E -1 Cartesian axes number of k points= 250 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.5773503 -0.0729320), wk = 0.0040000 k( 2) = ( 0.0000000 -0.5603694 -0.0707870), wk = 0.0040000 k( 3) = ( 0.0000000 -0.5433885 -0.0686419), wk = 0.0040000 k( 4) = ( 0.0000000 -0.5264076 -0.0664969), wk = 0.0040000 k( 5) = ( 0.0000000 -0.5094267 -0.0643518), wk = 0.0040000 k( 6) = ( 0.0000000 -0.4924458 -0.0622067), wk = 0.0040000 k( 7) = ( 0.0000000 -0.4754649 -0.0600617), wk = 0.0040000 k( 8) = ( 0.0000000 -0.4584840 -0.0579166), wk = 0.0040000 k( 9) = ( 0.0000000 -0.4415031 -0.0557716), wk = 0.0040000 k( 10) = ( 0.0000000 -0.4245223 -0.0536265), wk = 0.0040000 k( 11) = ( 0.0000000 -0.4075414 -0.0514814), wk = 0.0040000 k( 12) = ( 0.0000000 -0.3905605 -0.0493364), wk = 0.0040000 k( 13) = ( 0.0000000 -0.3735796 -0.0471913), wk = 0.0040000 k( 14) = ( 0.0000000 -0.3565987 -0.0450463), wk = 0.0040000 k( 15) = ( 0.0000000 -0.3396178 -0.0429012), wk = 0.0040000 k( 16) = ( 0.0000000 -0.3226369 -0.0407561), wk = 0.0040000 k( 17) = ( 0.0000000 -0.3056560 -0.0386111), wk = 0.0040000 k( 18) = ( 0.0000000 -0.2886751 -0.0364660), wk = 0.0040000 k( 19) = ( 0.0000000 -0.2716942 -0.0343210), wk = 0.0040000 k( 20) = ( 0.0000000 -0.2547134 -0.0321759), wk = 0.0040000 k( 21) = ( 0.0000000 -0.2377325 -0.0300308), wk = 0.0040000 k( 22) = ( 0.0000000 -0.2207516 -0.0278858), wk = 0.0040000 k( 23) = ( 0.0000000 -0.2037707 -0.0257407), wk = 0.0040000 k( 24) = ( 0.0000000 -0.1867898 -0.0235957), wk = 0.0040000 k( 25) = ( 0.0000000 -0.1698089 -0.0214506), wk = 0.0040000 k( 26) = ( 0.0000000 -0.1528280 -0.0193055), wk = 0.0040000 k( 27) = ( 0.0000000 -0.1358471 -0.0171605), wk = 0.0040000 k( 28) = ( 0.0000000 -0.1188662 -0.0150154), wk = 0.0040000 k( 29) = ( 0.0000000 -0.1018853 -0.0128704), wk = 0.0040000 k( 30) = ( 0.0000000 -0.0849044 -0.0107253), wk = 0.0040000 k( 31) = ( 0.0000000 -0.0679236 -0.0085802), wk = 0.0040000 k( 32) = ( 0.0000000 -0.0509427 -0.0064352), wk = 0.0040000 k( 33) = ( 0.0000000 -0.0339618 -0.0042901), wk = 0.0040000 k( 34) = ( 0.0000000 -0.0169809 -0.0021451), wk = 0.0040000 k( 35) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 36) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 37) = ( 0.0147059 0.0084904 0.0021437), wk = 0.0040000 k( 38) = ( 0.0294118 0.0169809 0.0042874), wk = 0.0040000 k( 39) = ( 0.0441177 0.0254713 0.0064311), wk = 0.0040000 k( 40) = ( 0.0588235 0.0339618 0.0085748), wk = 0.0040000 k( 41) = ( 0.0735294 0.0424522 0.0107184), wk = 0.0040000 k( 42) = ( 0.0882353 0.0509427 0.0128621), wk = 0.0040000 k( 43) = ( 0.1029412 0.0594331 0.0150058), wk = 0.0040000 k( 44) = ( 0.1176471 0.0679236 0.0171495), wk = 0.0040000 k( 45) = ( 0.1323529 0.0764140 0.0192932), wk = 0.0040000 k( 46) = ( 0.1470588 0.0849044 0.0214369), wk = 0.0040000 k( 47) = ( 0.1617647 0.0933949 0.0235806), wk = 0.0040000 k( 48) = ( 0.1764706 0.1018853 0.0257243), wk = 0.0040000 k( 49) = ( 0.1911765 0.1103758 0.0278680), wk = 0.0040000 k( 50) = ( 0.2058823 0.1188662 0.0300116), wk = 0.0040000 k( 51) = ( 0.2205882 0.1273567 0.0321553), wk = 0.0040000 k( 52) = ( 0.2352941 0.1358471 0.0342990), wk = 0.0040000 k( 53) = ( 0.2500000 0.1443376 0.0364427), wk = 0.0040000 k( 54) = ( 0.2647059 0.1528280 0.0385864), wk = 0.0040000 k( 55) = ( 0.2794118 0.1613185 0.0407301), wk = 0.0040000 k( 56) = ( 0.2941177 0.1698089 0.0428738), wk = 0.0040000 k( 57) = ( 0.3088235 0.1782993 0.0450175), wk = 0.0040000 k( 58) = ( 0.3235294 0.1867898 0.0471612), wk = 0.0040000 k( 59) = ( 0.3382353 0.1952802 0.0493049), wk = 0.0040000 k( 60) = ( 0.3529412 0.2037707 0.0514485), wk = 0.0040000 k( 61) = ( 0.3676471 0.2122611 0.0535922), wk = 0.0040000 k( 62) = ( 0.3823529 0.2207516 0.0557359), wk = 0.0040000 k( 63) = ( 0.3970588 0.2292420 0.0578796), wk = 0.0040000 k( 64) = ( 0.4117647 0.2377325 0.0600233), wk = 0.0040000 k( 65) = ( 0.4264706 0.2462229 0.0621670), wk = 0.0040000 k( 66) = ( 0.4411765 0.2547134 0.0643107), wk = 0.0040000 k( 67) = ( 0.4558823 0.2632038 0.0664544), wk = 0.0040000 k( 68) = ( 0.4705882 0.2716942 0.0685981), wk = 0.0040000 k( 69) = ( 0.4852941 0.2801847 0.0707417), wk = 0.0040000 k( 70) = ( 0.5000000 0.2886751 0.0728854), wk = 0.0040000 k( 71) = ( 0.5000000 -0.2886751 -0.0000466), wk = 0.0040000 k( 72) = ( 0.4852941 -0.2801847 -0.0000452), wk = 0.0040000 k( 73) = ( 0.4705882 -0.2716942 -0.0000439), wk = 0.0040000 k( 74) = ( 0.4558823 -0.2632038 -0.0000425), wk = 0.0040000 k( 75) = ( 0.4411765 -0.2547134 -0.0000411), wk = 0.0040000 k( 76) = ( 0.4264706 -0.2462229 -0.0000398), wk = 0.0040000 k( 77) = ( 0.4117647 -0.2377325 -0.0000384), wk = 0.0040000 k( 78) = ( 0.3970588 -0.2292420 -0.0000370), wk = 0.0040000 k( 79) = ( 0.3823529 -0.2207516 -0.0000356), wk = 0.0040000 k( 80) = ( 0.3676471 -0.2122611 -0.0000343), wk = 0.0040000 k( 81) = ( 0.3529412 -0.2037707 -0.0000329), wk = 0.0040000 k( 82) = ( 0.3382353 -0.1952802 -0.0000315), wk = 0.0040000 k( 83) = ( 0.3235294 -0.1867898 -0.0000302), wk = 0.0040000 k( 84) = ( 0.3088235 -0.1782993 -0.0000288), wk = 0.0040000 k( 85) = ( 0.2941177 -0.1698089 -0.0000274), wk = 0.0040000 k( 86) = ( 0.2794118 -0.1613185 -0.0000260), wk = 0.0040000 k( 87) = ( 0.2647059 -0.1528280 -0.0000247), wk = 0.0040000 k( 88) = ( 0.2500000 -0.1443376 -0.0000233), wk = 0.0040000 k( 89) = ( 0.2352941 -0.1358471 -0.0000219), wk = 0.0040000 k( 90) = ( 0.2205882 -0.1273567 -0.0000206), wk = 0.0040000 k( 91) = ( 0.2058823 -0.1188662 -0.0000192), wk = 0.0040000 k( 92) = ( 0.1911765 -0.1103758 -0.0000178), wk = 0.0040000 k( 93) = ( 0.1764706 -0.1018853 -0.0000164), wk = 0.0040000 k( 94) = ( 0.1617647 -0.0933949 -0.0000151), wk = 0.0040000 k( 95) = ( 0.1470588 -0.0849044 -0.0000137), wk = 0.0040000 k( 96) = ( 0.1323529 -0.0764140 -0.0000123), wk = 0.0040000 k( 97) = ( 0.1176471 -0.0679236 -0.0000110), wk = 0.0040000 k( 98) = ( 0.1029412 -0.0594331 -0.0000096), wk = 0.0040000 k( 99) = ( 0.0882353 -0.0509427 -0.0000082), wk = 0.0040000 k( 100) = ( 0.0735294 -0.0424522 -0.0000069), wk = 0.0040000 k( 101) = ( 0.0588235 -0.0339618 -0.0000055), wk = 0.0040000 k( 102) = ( 0.0441177 -0.0254713 -0.0000041), wk = 0.0040000 k( 103) = ( 0.0294118 -0.0169809 -0.0000027), wk = 0.0040000 k( 104) = ( 0.0147059 -0.0084904 -0.0000014), wk = 0.0040000 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 107) = ( -0.0142857 -0.0082479 0.0041670), wk = 0.0040000 k( 108) = ( -0.0285714 -0.0164957 0.0083340), wk = 0.0040000 k( 109) = ( -0.0428571 -0.0247436 0.0125010), wk = 0.0040000 k( 110) = ( -0.0571429 -0.0329914 0.0166680), wk = 0.0040000 k( 111) = ( -0.0714286 -0.0412393 0.0208350), wk = 0.0040000 k( 112) = ( -0.0857143 -0.0494872 0.0250020), wk = 0.0040000 k( 113) = ( -0.1000000 -0.0577350 0.0291690), wk = 0.0040000 k( 114) = ( -0.1142857 -0.0659829 0.0333360), wk = 0.0040000 k( 115) = ( -0.1285714 -0.0742307 0.0375030), wk = 0.0040000 k( 116) = ( -0.1428571 -0.0824786 0.0416700), wk = 0.0040000 k( 117) = ( -0.1571429 -0.0907265 0.0458370), wk = 0.0040000 k( 118) = ( -0.1714286 -0.0989743 0.0500040), wk = 0.0040000 k( 119) = ( -0.1857143 -0.1072222 0.0541710), wk = 0.0040000 k( 120) = ( -0.2000000 -0.1154701 0.0583380), wk = 0.0040000 k( 121) = ( -0.2142857 -0.1237179 0.0625050), wk = 0.0040000 k( 122) = ( -0.2285714 -0.1319658 0.0666720), wk = 0.0040000 k( 123) = ( -0.2428571 -0.1402136 0.0708390), wk = 0.0040000 k( 124) = ( -0.2571429 -0.1484615 0.0750060), wk = 0.0040000 k( 125) = ( -0.2714286 -0.1567094 0.0791730), wk = 0.0040000 k( 126) = ( -0.2857143 -0.1649572 0.0833400), wk = 0.0040000 k( 127) = ( -0.3000000 -0.1732051 0.0875070), wk = 0.0040000 k( 128) = ( -0.3142857 -0.1814529 0.0916740), wk = 0.0040000 k( 129) = ( -0.3285714 -0.1897008 0.0958410), wk = 0.0040000 k( 130) = ( -0.3428571 -0.1979487 0.1000080), wk = 0.0040000 k( 131) = ( -0.3571429 -0.2061965 0.1041750), wk = 0.0040000 k( 132) = ( -0.3714286 -0.2144444 0.1083420), wk = 0.0040000 k( 133) = ( -0.3857143 -0.2226922 0.1125090), wk = 0.0040000 k( 134) = ( -0.4000000 -0.2309401 0.1166760), wk = 0.0040000 k( 135) = ( -0.4142857 -0.2391880 0.1208430), wk = 0.0040000 k( 136) = ( -0.4285714 -0.2474358 0.1250100), wk = 0.0040000 k( 137) = ( -0.4428571 -0.2556837 0.1291770), wk = 0.0040000 k( 138) = ( -0.4571429 -0.2639316 0.1333440), wk = 0.0040000 k( 139) = ( -0.4714286 -0.2721794 0.1375110), wk = 0.0040000 k( 140) = ( -0.4857143 -0.2804273 0.1416780), wk = 0.0040000 k( 141) = ( -0.5000000 -0.2886751 0.1458450), wk = 0.0040000 k( 142) = ( -0.5000000 -0.8660254 0.0729130), wk = 0.0040000 k( 143) = ( -0.4913793 -0.8510939 0.0716559), wk = 0.0040000 k( 144) = ( -0.4827586 -0.8361625 0.0703988), wk = 0.0040000 k( 145) = ( -0.4741379 -0.8212310 0.0691416), wk = 0.0040000 k( 146) = ( -0.4655172 -0.8062995 0.0678845), wk = 0.0040000 k( 147) = ( -0.4568966 -0.7913680 0.0666274), wk = 0.0040000 k( 148) = ( -0.4482759 -0.7764366 0.0653703), wk = 0.0040000 k( 149) = ( -0.4396552 -0.7615051 0.0641132), wk = 0.0040000 k( 150) = ( -0.4310345 -0.7465736 0.0628560), wk = 0.0040000 k( 151) = ( -0.4224138 -0.7316421 0.0615989), wk = 0.0040000 k( 152) = ( -0.4137931 -0.7167107 0.0603418), wk = 0.0040000 k( 153) = ( -0.4051724 -0.7017792 0.0590847), wk = 0.0040000 k( 154) = ( -0.3965517 -0.6868477 0.0578276), wk = 0.0040000 k( 155) = ( -0.3879310 -0.6719163 0.0565704), wk = 0.0040000 k( 156) = ( -0.3793103 -0.6569848 0.0553133), wk = 0.0040000 k( 157) = ( -0.3706897 -0.6420533 0.0540562), wk = 0.0040000 k( 158) = ( -0.3620690 -0.6271219 0.0527991), wk = 0.0040000 k( 159) = ( -0.3534483 -0.6121904 0.0515420), wk = 0.0040000 k( 160) = ( -0.3448276 -0.5972589 0.0502848), wk = 0.0040000 k( 161) = ( -0.3362069 -0.5823274 0.0490277), wk = 0.0040000 k( 162) = ( -0.3275862 -0.5673960 0.0477706), wk = 0.0040000 k( 163) = ( -0.3189655 -0.5524645 0.0465135), wk = 0.0040000 k( 164) = ( -0.3103448 -0.5375330 0.0452564), wk = 0.0040000 k( 165) = ( -0.3017241 -0.5226015 0.0439992), wk = 0.0040000 k( 166) = ( -0.2931034 -0.5076701 0.0427421), wk = 0.0040000 k( 167) = ( -0.2844828 -0.4927386 0.0414850), wk = 0.0040000 k( 168) = ( -0.2758621 -0.4778071 0.0402279), wk = 0.0040000 k( 169) = ( -0.2672414 -0.4628756 0.0389707), wk = 0.0040000 k( 170) = ( -0.2586207 -0.4479442 0.0377136), wk = 0.0040000 k( 171) = ( -0.2500000 -0.4330127 0.0364565), wk = 0.0040000 k( 172) = ( -0.2413793 -0.4180812 0.0351994), wk = 0.0040000 k( 173) = ( -0.2327586 -0.4031498 0.0339423), wk = 0.0040000 k( 174) = ( -0.2241379 -0.3882183 0.0326851), wk = 0.0040000 k( 175) = ( -0.2155172 -0.3732868 0.0314280), wk = 0.0040000 k( 176) = ( -0.2068966 -0.3583553 0.0301709), wk = 0.0040000 k( 177) = ( -0.1982759 -0.3434239 0.0289138), wk = 0.0040000 k( 178) = ( -0.1896552 -0.3284924 0.0276567), wk = 0.0040000 k( 179) = ( -0.1810345 -0.3135609 0.0263995), wk = 0.0040000 k( 180) = ( -0.1724138 -0.2986294 0.0251424), wk = 0.0040000 k( 181) = ( -0.1637931 -0.2836980 0.0238853), wk = 0.0040000 k( 182) = ( -0.1551724 -0.2687665 0.0226282), wk = 0.0040000 k( 183) = ( -0.1465517 -0.2538350 0.0213711), wk = 0.0040000 k( 184) = ( -0.1379310 -0.2389036 0.0201139), wk = 0.0040000 k( 185) = ( -0.1293103 -0.2239721 0.0188568), wk = 0.0040000 k( 186) = ( -0.1206897 -0.2090406 0.0175997), wk = 0.0040000 k( 187) = ( -0.1120690 -0.1941091 0.0163426), wk = 0.0040000 k( 188) = ( -0.1034483 -0.1791777 0.0150855), wk = 0.0040000 k( 189) = ( -0.0948276 -0.1642462 0.0138283), wk = 0.0040000 k( 190) = ( -0.0862069 -0.1493147 0.0125712), wk = 0.0040000 k( 191) = ( -0.0775862 -0.1343833 0.0113141), wk = 0.0040000 k( 192) = ( -0.0689655 -0.1194518 0.0100570), wk = 0.0040000 k( 193) = ( -0.0603448 -0.1045203 0.0087998), wk = 0.0040000 k( 194) = ( -0.0517241 -0.0895888 0.0075427), wk = 0.0040000 k( 195) = ( -0.0431035 -0.0746574 0.0062856), wk = 0.0040000 k( 196) = ( -0.0344828 -0.0597259 0.0050285), wk = 0.0040000 k( 197) = ( -0.0258621 -0.0447944 0.0037714), wk = 0.0040000 k( 198) = ( -0.0172414 -0.0298629 0.0025142), wk = 0.0040000 k( 199) = ( -0.0086207 -0.0149315 0.0012571), wk = 0.0040000 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 201) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 202) = ( 0.0000000 0.0000000 0.0168254), wk = 0.0040000 k( 203) = ( 0.0000000 0.0000000 0.0336508), wk = 0.0040000 k( 204) = ( 0.0000000 0.0000000 0.0504763), wk = 0.0040000 k( 205) = ( 0.0000000 0.0000000 0.0673017), wk = 0.0040000 k( 206) = ( 0.0000000 0.0000000 0.0841271), wk = 0.0040000 k( 207) = ( 0.0000000 0.0000000 0.1009525), wk = 0.0040000 k( 208) = ( 0.0000000 0.0000000 0.1177780), wk = 0.0040000 k( 209) = ( 0.0000000 0.0000000 0.1346034), wk = 0.0040000 k( 210) = ( 0.0000000 0.0000000 0.1514288), wk = 0.0040000 k( 211) = ( 0.0000000 0.0000000 0.1682542), wk = 0.0040000 k( 212) = ( 0.0000000 0.0000000 0.1850796), wk = 0.0040000 k( 213) = ( 0.0000000 0.0000000 0.2019051), wk = 0.0040000 k( 214) = ( 0.0000000 0.0000000 0.2187305), wk = 0.0040000 k( 215) = ( 0.0000000 -0.5773503 0.1457984), wk = 0.0040000 k( 216) = ( 0.0000000 -0.5608546 0.1416328), wk = 0.0040000 k( 217) = ( 0.0000000 -0.5443588 0.1374671), wk = 0.0040000 k( 218) = ( 0.0000000 -0.5278631 0.1333014), wk = 0.0040000 k( 219) = ( 0.0000000 -0.5113674 0.1291358), wk = 0.0040000 k( 220) = ( 0.0000000 -0.4948717 0.1249701), wk = 0.0040000 k( 221) = ( 0.0000000 -0.4783759 0.1208044), wk = 0.0040000 k( 222) = ( 0.0000000 -0.4618802 0.1166388), wk = 0.0040000 k( 223) = ( 0.0000000 -0.4453845 0.1124731), wk = 0.0040000 k( 224) = ( 0.0000000 -0.4288888 0.1083074), wk = 0.0040000 k( 225) = ( 0.0000000 -0.4123931 0.1041417), wk = 0.0040000 k( 226) = ( 0.0000000 -0.3958973 0.0999761), wk = 0.0040000 k( 227) = ( 0.0000000 -0.3794016 0.0958104), wk = 0.0040000 k( 228) = ( 0.0000000 -0.3629059 0.0916447), wk = 0.0040000 k( 229) = ( 0.0000000 -0.3464102 0.0874791), wk = 0.0040000 k( 230) = ( 0.0000000 -0.3299144 0.0833134), wk = 0.0040000 k( 231) = ( 0.0000000 -0.3134187 0.0791477), wk = 0.0040000 k( 232) = ( 0.0000000 -0.2969230 0.0749821), wk = 0.0040000 k( 233) = ( 0.0000000 -0.2804273 0.0708164), wk = 0.0040000 k( 234) = ( 0.0000000 -0.2639316 0.0666507), wk = 0.0040000 k( 235) = ( 0.0000000 -0.2474358 0.0624850), wk = 0.0040000 k( 236) = ( 0.0000000 -0.2309401 0.0583194), wk = 0.0040000 k( 237) = ( 0.0000000 -0.2144444 0.0541537), wk = 0.0040000 k( 238) = ( 0.0000000 -0.1979487 0.0499880), wk = 0.0040000 k( 239) = ( 0.0000000 -0.1814529 0.0458224), wk = 0.0040000 k( 240) = ( 0.0000000 -0.1649572 0.0416567), wk = 0.0040000 k( 241) = ( 0.0000000 -0.1484615 0.0374910), wk = 0.0040000 k( 242) = ( 0.0000000 -0.1319658 0.0333254), wk = 0.0040000 k( 243) = ( 0.0000000 -0.1154701 0.0291597), wk = 0.0040000 k( 244) = ( 0.0000000 -0.0989743 0.0249940), wk = 0.0040000 k( 245) = ( 0.0000000 -0.0824786 0.0208283), wk = 0.0040000 k( 246) = ( 0.0000000 -0.0659829 0.0166627), wk = 0.0040000 k( 247) = ( 0.0000000 -0.0494872 0.0124970), wk = 0.0040000 k( 248) = ( 0.0000000 -0.0329914 0.0083313), wk = 0.0040000 k( 249) = ( 0.0000000 -0.0164957 0.0041657), wk = 0.0040000 k( 250) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 0.0000000), wk = 0.0040000 k( 2) = ( 0.0000000 -0.4852941 -0.0000000), wk = 0.0040000 k( 3) = ( 0.0000000 -0.4705882 0.0000000), wk = 0.0040000 k( 4) = ( 0.0000000 -0.4558823 0.0000000), wk = 0.0040000 k( 5) = ( 0.0000000 -0.4411765 0.0000000), wk = 0.0040000 k( 6) = ( 0.0000000 -0.4264706 0.0000000), wk = 0.0040000 k( 7) = ( 0.0000000 -0.4117647 0.0000000), wk = 0.0040000 k( 8) = ( 0.0000000 -0.3970588 0.0000000), wk = 0.0040000 k( 9) = ( 0.0000000 -0.3823529 0.0000000), wk = 0.0040000 k( 10) = ( 0.0000000 -0.3676471 -0.0000000), wk = 0.0040000 k( 11) = ( 0.0000000 -0.3529412 0.0000000), wk = 0.0040000 k( 12) = ( 0.0000000 -0.3382353 0.0000000), wk = 0.0040000 k( 13) = ( 0.0000000 -0.3235294 -0.0000000), wk = 0.0040000 k( 14) = ( 0.0000000 -0.3088235 0.0000000), wk = 0.0040000 k( 15) = ( 0.0000000 -0.2941176 0.0000000), wk = 0.0040000 k( 16) = ( 0.0000000 -0.2794118 0.0000000), wk = 0.0040000 k( 17) = ( 0.0000000 -0.2647059 0.0000000), wk = 0.0040000 k( 18) = ( 0.0000000 -0.2500000 0.0000000), wk = 0.0040000 k( 19) = ( 0.0000000 -0.2352941 0.0000000), wk = 0.0040000 k( 20) = ( 0.0000000 -0.2205882 0.0000000), wk = 0.0040000 k( 21) = ( 0.0000000 -0.2058823 0.0000000), wk = 0.0040000 k( 22) = ( 0.0000000 -0.1911765 0.0000000), wk = 0.0040000 k( 23) = ( 0.0000000 -0.1764706 0.0000000), wk = 0.0040000 k( 24) = ( 0.0000000 -0.1617647 0.0000000), wk = 0.0040000 k( 25) = ( 0.0000000 -0.1470588 0.0000000), wk = 0.0040000 k( 26) = ( 0.0000000 -0.1323529 0.0000000), wk = 0.0040000 k( 27) = ( 0.0000000 -0.1176471 0.0000000), wk = 0.0040000 k( 28) = ( 0.0000000 -0.1029412 0.0000000), wk = 0.0040000 k( 29) = ( 0.0000000 -0.0882353 0.0000000), wk = 0.0040000 k( 30) = ( 0.0000000 -0.0735294 0.0000000), wk = 0.0040000 k( 31) = ( 0.0000000 -0.0588235 0.0000000), wk = 0.0040000 k( 32) = ( 0.0000000 -0.0441177 0.0000000), wk = 0.0040000 k( 33) = ( 0.0000000 -0.0294118 0.0000000), wk = 0.0040000 k( 34) = ( 0.0000000 -0.0147059 0.0000000), wk = 0.0040000 k( 35) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 36) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 37) = ( 0.0147059 -0.0000000 0.0000000), wk = 0.0040000 k( 38) = ( 0.0294118 -0.0000000 0.0000000), wk = 0.0040000 k( 39) = ( 0.0441177 0.0000000 0.0000000), wk = 0.0040000 k( 40) = ( 0.0588235 0.0000000 0.0000000), wk = 0.0040000 k( 41) = ( 0.0735294 -0.0000000 0.0000000), wk = 0.0040000 k( 42) = ( 0.0882353 0.0000000 -0.0000000), wk = 0.0040000 k( 43) = ( 0.1029412 -0.0000000 0.0000000), wk = 0.0040000 k( 44) = ( 0.1176471 0.0000000 0.0000000), wk = 0.0040000 k( 45) = ( 0.1323529 0.0000000 -0.0000000), wk = 0.0040000 k( 46) = ( 0.1470588 -0.0000000 0.0000000), wk = 0.0040000 k( 47) = ( 0.1617647 0.0000000 0.0000000), wk = 0.0040000 k( 48) = ( 0.1764706 0.0000000 -0.0000000), wk = 0.0040000 k( 49) = ( 0.1911765 0.0000000 -0.0000000), wk = 0.0040000 k( 50) = ( 0.2058823 -0.0000000 0.0000000), wk = 0.0040000 k( 51) = ( 0.2205882 -0.0000000 -0.0000000), wk = 0.0040000 k( 52) = ( 0.2352941 0.0000000 0.0000000), wk = 0.0040000 k( 53) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0040000 k( 54) = ( 0.2647059 0.0000000 -0.0000000), wk = 0.0040000 k( 55) = ( 0.2794118 0.0000000 0.0000000), wk = 0.0040000 k( 56) = ( 0.2941177 0.0000000 0.0000000), wk = 0.0040000 k( 57) = ( 0.3088235 -0.0000000 0.0000000), wk = 0.0040000 k( 58) = ( 0.3235294 -0.0000000 -0.0000000), wk = 0.0040000 k( 59) = ( 0.3382353 -0.0000000 0.0000000), wk = 0.0040000 k( 60) = ( 0.3529412 0.0000000 -0.0000000), wk = 0.0040000 k( 61) = ( 0.3676471 0.0000000 0.0000000), wk = 0.0040000 k( 62) = ( 0.3823529 0.0000000 -0.0000000), wk = 0.0040000 k( 63) = ( 0.3970588 -0.0000000 0.0000000), wk = 0.0040000 k( 64) = ( 0.4117647 0.0000000 0.0000000), wk = 0.0040000 k( 65) = ( 0.4264706 -0.0000000 0.0000000), wk = 0.0040000 k( 66) = ( 0.4411765 -0.0000000 0.0000000), wk = 0.0040000 k( 67) = ( 0.4558823 0.0000000 0.0000000), wk = 0.0040000 k( 68) = ( 0.4705882 0.0000000 0.0000000), wk = 0.0040000 k( 69) = ( 0.4852941 -0.0000000 0.0000000), wk = 0.0040000 k( 70) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0040000 k( 71) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0040000 k( 72) = ( 0.4852941 -0.4852941 -0.0000000), wk = 0.0040000 k( 73) = ( 0.4705882 -0.4705882 0.0000000), wk = 0.0040000 k( 74) = ( 0.4558823 -0.4558823 0.0000000), wk = 0.0040000 k( 75) = ( 0.4411765 -0.4411765 0.0000000), wk = 0.0040000 k( 76) = ( 0.4264706 -0.4264706 0.0000000), wk = 0.0040000 k( 77) = ( 0.4117647 -0.4117647 -0.0000000), wk = 0.0040000 k( 78) = ( 0.3970588 -0.3970588 0.0000000), wk = 0.0040000 k( 79) = ( 0.3823529 -0.3823529 0.0000000), wk = 0.0040000 k( 80) = ( 0.3676471 -0.3676471 -0.0000000), wk = 0.0040000 k( 81) = ( 0.3529412 -0.3529412 -0.0000000), wk = 0.0040000 k( 82) = ( 0.3382353 -0.3382353 0.0000000), wk = 0.0040000 k( 83) = ( 0.3235294 -0.3235294 -0.0000000), wk = 0.0040000 k( 84) = ( 0.3088235 -0.3088235 0.0000000), wk = 0.0040000 k( 85) = ( 0.2941177 -0.2941177 -0.0000000), wk = 0.0040000 k( 86) = ( 0.2794118 -0.2794118 -0.0000000), wk = 0.0040000 k( 87) = ( 0.2647059 -0.2647059 -0.0000000), wk = 0.0040000 k( 88) = ( 0.2500000 -0.2500000 -0.0000000), wk = 0.0040000 k( 89) = ( 0.2352941 -0.2352941 0.0000000), wk = 0.0040000 k( 90) = ( 0.2205882 -0.2205882 -0.0000000), wk = 0.0040000 k( 91) = ( 0.2058823 -0.2058823 -0.0000000), wk = 0.0040000 k( 92) = ( 0.1911765 -0.1911765 0.0000000), wk = 0.0040000 k( 93) = ( 0.1764706 -0.1764706 -0.0000000), wk = 0.0040000 k( 94) = ( 0.1617647 -0.1617647 -0.0000000), wk = 0.0040000 k( 95) = ( 0.1470588 -0.1470588 0.0000000), wk = 0.0040000 k( 96) = ( 0.1323529 -0.1323529 -0.0000000), wk = 0.0040000 k( 97) = ( 0.1176471 -0.1176471 0.0000000), wk = 0.0040000 k( 98) = ( 0.1029412 -0.1029412 0.0000000), wk = 0.0040000 k( 99) = ( 0.0882353 -0.0882353 -0.0000000), wk = 0.0040000 k( 100) = ( 0.0735294 -0.0735294 0.0000000), wk = 0.0040000 k( 101) = ( 0.0588235 -0.0588235 0.0000000), wk = 0.0040000 k( 102) = ( 0.0441177 -0.0441176 -0.0000000), wk = 0.0040000 k( 103) = ( 0.0294118 -0.0294118 -0.0000000), wk = 0.0040000 k( 104) = ( 0.0147059 -0.0147059 -0.0000000), wk = 0.0040000 k( 105) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 106) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 107) = ( -0.0142857 0.0000000 0.0142857), wk = 0.0040000 k( 108) = ( -0.0285714 0.0000000 0.0285714), wk = 0.0040000 k( 109) = ( -0.0428571 0.0000000 0.0428571), wk = 0.0040000 k( 110) = ( -0.0571429 0.0000000 0.0571429), wk = 0.0040000 k( 111) = ( -0.0714286 0.0000000 0.0714286), wk = 0.0040000 k( 112) = ( -0.0857143 0.0000000 0.0857143), wk = 0.0040000 k( 113) = ( -0.1000000 0.0000000 0.1000000), wk = 0.0040000 k( 114) = ( -0.1142857 0.0000000 0.1142857), wk = 0.0040000 k( 115) = ( -0.1285714 0.0000000 0.1285714), wk = 0.0040000 k( 116) = ( -0.1428571 0.0000000 0.1428571), wk = 0.0040000 k( 117) = ( -0.1571429 0.0000000 0.1571429), wk = 0.0040000 k( 118) = ( -0.1714286 0.0000000 0.1714286), wk = 0.0040000 k( 119) = ( -0.1857143 0.0000000 0.1857143), wk = 0.0040000 k( 120) = ( -0.2000000 0.0000000 0.2000000), wk = 0.0040000 k( 121) = ( -0.2142857 0.0000000 0.2142857), wk = 0.0040000 k( 122) = ( -0.2285714 0.0000000 0.2285714), wk = 0.0040000 k( 123) = ( -0.2428571 0.0000000 0.2428571), wk = 0.0040000 k( 124) = ( -0.2571429 0.0000000 0.2571429), wk = 0.0040000 k( 125) = ( -0.2714286 0.0000000 0.2714286), wk = 0.0040000 k( 126) = ( -0.2857143 0.0000000 0.2857143), wk = 0.0040000 k( 127) = ( -0.3000000 0.0000000 0.3000000), wk = 0.0040000 k( 128) = ( -0.3142857 0.0000000 0.3142857), wk = 0.0040000 k( 129) = ( -0.3285714 0.0000000 0.3285714), wk = 0.0040000 k( 130) = ( -0.3428571 0.0000000 0.3428571), wk = 0.0040000 k( 131) = ( -0.3571429 0.0000000 0.3571429), wk = 0.0040000 k( 132) = ( -0.3714286 0.0000000 0.3714286), wk = 0.0040000 k( 133) = ( -0.3857143 0.0000000 0.3857143), wk = 0.0040000 k( 134) = ( -0.4000000 0.0000000 0.4000000), wk = 0.0040000 k( 135) = ( -0.4142857 0.0000000 0.4142857), wk = 0.0040000 k( 136) = ( -0.4285714 0.0000000 0.4285714), wk = 0.0040000 k( 137) = ( -0.4428571 0.0000000 0.4428571), wk = 0.0040000 k( 138) = ( -0.4571429 0.0000000 0.4571429), wk = 0.0040000 k( 139) = ( -0.4714286 0.0000000 0.4714286), wk = 0.0040000 k( 140) = ( -0.4857143 0.0000000 0.4857143), wk = 0.0040000 k( 141) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0040000 k( 142) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0040000 k( 143) = ( -0.4913793 -0.4913793 0.4913793), wk = 0.0040000 k( 144) = ( -0.4827586 -0.4827586 0.4827586), wk = 0.0040000 k( 145) = ( -0.4741379 -0.4741379 0.4741379), wk = 0.0040000 k( 146) = ( -0.4655172 -0.4655172 0.4655172), wk = 0.0040000 k( 147) = ( -0.4568966 -0.4568965 0.4568965), wk = 0.0040000 k( 148) = ( -0.4482759 -0.4482759 0.4482759), wk = 0.0040000 k( 149) = ( -0.4396552 -0.4396552 0.4396552), wk = 0.0040000 k( 150) = ( -0.4310345 -0.4310345 0.4310345), wk = 0.0040000 k( 151) = ( -0.4224138 -0.4224138 0.4224138), wk = 0.0040000 k( 152) = ( -0.4137931 -0.4137931 0.4137931), wk = 0.0040000 k( 153) = ( -0.4051724 -0.4051724 0.4051724), wk = 0.0040000 k( 154) = ( -0.3965517 -0.3965517 0.3965517), wk = 0.0040000 k( 155) = ( -0.3879310 -0.3879310 0.3879310), wk = 0.0040000 k( 156) = ( -0.3793103 -0.3793103 0.3793103), wk = 0.0040000 k( 157) = ( -0.3706897 -0.3706897 0.3706897), wk = 0.0040000 k( 158) = ( -0.3620690 -0.3620690 0.3620690), wk = 0.0040000 k( 159) = ( -0.3534483 -0.3534483 0.3534483), wk = 0.0040000 k( 160) = ( -0.3448276 -0.3448276 0.3448276), wk = 0.0040000 k( 161) = ( -0.3362069 -0.3362069 0.3362069), wk = 0.0040000 k( 162) = ( -0.3275862 -0.3275862 0.3275862), wk = 0.0040000 k( 163) = ( -0.3189655 -0.3189655 0.3189655), wk = 0.0040000 k( 164) = ( -0.3103448 -0.3103448 0.3103448), wk = 0.0040000 k( 165) = ( -0.3017241 -0.3017241 0.3017241), wk = 0.0040000 k( 166) = ( -0.2931034 -0.2931034 0.2931034), wk = 0.0040000 k( 167) = ( -0.2844828 -0.2844828 0.2844828), wk = 0.0040000 k( 168) = ( -0.2758621 -0.2758621 0.2758621), wk = 0.0040000 k( 169) = ( -0.2672414 -0.2672414 0.2672414), wk = 0.0040000 k( 170) = ( -0.2586207 -0.2586207 0.2586207), wk = 0.0040000 k( 171) = ( -0.2500000 -0.2500000 0.2500000), wk = 0.0040000 k( 172) = ( -0.2413793 -0.2413793 0.2413793), wk = 0.0040000 k( 173) = ( -0.2327586 -0.2327586 0.2327586), wk = 0.0040000 k( 174) = ( -0.2241379 -0.2241379 0.2241379), wk = 0.0040000 k( 175) = ( -0.2155172 -0.2155172 0.2155172), wk = 0.0040000 k( 176) = ( -0.2068966 -0.2068966 0.2068966), wk = 0.0040000 k( 177) = ( -0.1982759 -0.1982759 0.1982759), wk = 0.0040000 k( 178) = ( -0.1896552 -0.1896552 0.1896552), wk = 0.0040000 k( 179) = ( -0.1810345 -0.1810345 0.1810345), wk = 0.0040000 k( 180) = ( -0.1724138 -0.1724138 0.1724138), wk = 0.0040000 k( 181) = ( -0.1637931 -0.1637931 0.1637931), wk = 0.0040000 k( 182) = ( -0.1551724 -0.1551724 0.1551724), wk = 0.0040000 k( 183) = ( -0.1465517 -0.1465517 0.1465517), wk = 0.0040000 k( 184) = ( -0.1379310 -0.1379310 0.1379310), wk = 0.0040000 k( 185) = ( -0.1293103 -0.1293103 0.1293103), wk = 0.0040000 k( 186) = ( -0.1206897 -0.1206897 0.1206897), wk = 0.0040000 k( 187) = ( -0.1120690 -0.1120690 0.1120690), wk = 0.0040000 k( 188) = ( -0.1034483 -0.1034483 0.1034483), wk = 0.0040000 k( 189) = ( -0.0948276 -0.0948276 0.0948276), wk = 0.0040000 k( 190) = ( -0.0862069 -0.0862069 0.0862069), wk = 0.0040000 k( 191) = ( -0.0775862 -0.0775862 0.0775862), wk = 0.0040000 k( 192) = ( -0.0689655 -0.0689655 0.0689655), wk = 0.0040000 k( 193) = ( -0.0603448 -0.0603448 0.0603448), wk = 0.0040000 k( 194) = ( -0.0517241 -0.0517241 0.0517241), wk = 0.0040000 k( 195) = ( -0.0431035 -0.0431034 0.0431035), wk = 0.0040000 k( 196) = ( -0.0344828 -0.0344828 0.0344828), wk = 0.0040000 k( 197) = ( -0.0258621 -0.0258621 0.0258621), wk = 0.0040000 k( 198) = ( -0.0172414 -0.0172414 0.0172414), wk = 0.0040000 k( 199) = ( -0.0086207 -0.0086207 0.0086207), wk = 0.0040000 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 201) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 k( 202) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0040000 k( 203) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0040000 k( 204) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0040000 k( 205) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0040000 k( 206) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0040000 k( 207) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0040000 k( 208) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0040000 k( 209) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0040000 k( 210) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0040000 k( 211) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0040000 k( 212) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0040000 k( 213) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0040000 k( 214) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040000 k( 215) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0040000 k( 216) = ( 0.0000000 -0.4857143 0.4857143), wk = 0.0040000 k( 217) = ( 0.0000000 -0.4714286 0.4714286), wk = 0.0040000 k( 218) = ( 0.0000000 -0.4571429 0.4571429), wk = 0.0040000 k( 219) = ( 0.0000000 -0.4428571 0.4428571), wk = 0.0040000 k( 220) = ( 0.0000000 -0.4285714 0.4285714), wk = 0.0040000 k( 221) = ( 0.0000000 -0.4142857 0.4142857), wk = 0.0040000 k( 222) = ( 0.0000000 -0.4000000 0.4000000), wk = 0.0040000 k( 223) = ( 0.0000000 -0.3857143 0.3857143), wk = 0.0040000 k( 224) = ( 0.0000000 -0.3714286 0.3714286), wk = 0.0040000 k( 225) = ( 0.0000000 -0.3571429 0.3571429), wk = 0.0040000 k( 226) = ( 0.0000000 -0.3428571 0.3428571), wk = 0.0040000 k( 227) = ( 0.0000000 -0.3285714 0.3285714), wk = 0.0040000 k( 228) = ( 0.0000000 -0.3142857 0.3142857), wk = 0.0040000 k( 229) = ( 0.0000000 -0.3000000 0.3000000), wk = 0.0040000 k( 230) = ( 0.0000000 -0.2857143 0.2857143), wk = 0.0040000 k( 231) = ( 0.0000000 -0.2714286 0.2714286), wk = 0.0040000 k( 232) = ( 0.0000000 -0.2571429 0.2571429), wk = 0.0040000 k( 233) = ( 0.0000000 -0.2428571 0.2428571), wk = 0.0040000 k( 234) = ( 0.0000000 -0.2285714 0.2285714), wk = 0.0040000 k( 235) = ( 0.0000000 -0.2142857 0.2142857), wk = 0.0040000 k( 236) = ( 0.0000000 -0.2000000 0.2000000), wk = 0.0040000 k( 237) = ( 0.0000000 -0.1857143 0.1857143), wk = 0.0040000 k( 238) = ( 0.0000000 -0.1714286 0.1714286), wk = 0.0040000 k( 239) = ( 0.0000000 -0.1571429 0.1571429), wk = 0.0040000 k( 240) = ( 0.0000000 -0.1428571 0.1428571), wk = 0.0040000 k( 241) = ( 0.0000000 -0.1285714 0.1285714), wk = 0.0040000 k( 242) = ( 0.0000000 -0.1142857 0.1142857), wk = 0.0040000 k( 243) = ( 0.0000000 -0.1000000 0.1000000), wk = 0.0040000 k( 244) = ( 0.0000000 -0.0857143 0.0857143), wk = 0.0040000 k( 245) = ( 0.0000000 -0.0714286 0.0714286), wk = 0.0040000 k( 246) = ( 0.0000000 -0.0571429 0.0571429), wk = 0.0040000 k( 247) = ( 0.0000000 -0.0428571 0.0428571), wk = 0.0040000 k( 248) = ( 0.0000000 -0.0285714 0.0285714), wk = 0.0040000 k( 249) = ( 0.0000000 -0.0142857 0.0142857), wk = 0.0040000 k( 250) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040000 Dense grid: 210687 G-vectors FFT dimensions: ( 60, 60, 135) Smooth grid: 93269 G-vectors FFT dimensions: ( 45, 45, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.55 Mb ( 502, 72) NL pseudopotentials 0.97 Mb ( 251, 254) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.03 Mb ( 4393) G-vector shells 0.03 Mb ( 4393) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.21 Mb ( 502, 288) Each subspace H/S matrix 1.27 Mb ( 288, 288) Each matrix 0.56 Mb ( 254, 2, 72) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./FexSi2O3x2.save/charge-density.dat Starting wfc are 98 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 49.1 secs Computing kpt #: 2 total cpu time spent up to now is 57.9 secs Computing kpt #: 3 total cpu time spent up to now is 67.5 secs Computing kpt #: 4 total cpu time spent up to now is 76.7 secs Computing kpt #: 5 total cpu time spent up to now is 85.2 secs Computing kpt #: 6 total cpu time spent up to now is 93.6 secs Computing kpt #: 7 total cpu time spent up to now is 103.1 secs Computing kpt #: 8 total cpu time spent up to now is 113.4 secs Computing kpt #: 9 total cpu time spent up to now is 122.1 secs Computing kpt #: 10 total cpu time spent up to now is 130.1 secs Computing kpt #: 11 total cpu time spent up to now is 138.4 secs Computing kpt #: 12 total cpu time spent up to now is 146.5 secs Computing kpt #: 13 total cpu time spent up to now is 155.0 secs Computing kpt #: 14 total cpu time spent up to now is 164.1 secs Computing kpt #: 15 total cpu time spent up to now is 176.2 secs Computing kpt #: 16 total cpu time spent up to now is 184.8 secs Computing kpt #: 17 total cpu time spent up to now is 193.5 secs Computing kpt #: 18 total cpu time spent up to now is 201.4 secs Computing kpt #: 19 total cpu time spent up to now is 210.0 secs Computing kpt #: 20 total cpu time spent up to now is 219.4 secs Computing kpt #: 21 total cpu time spent up to now is 231.1 secs Computing kpt #: 22 total cpu time spent up to now is 243.3 secs Computing kpt #: 23 total cpu time spent up to now is 254.8 secs Computing kpt #: 24 total cpu time spent up to now is 265.3 secs Computing kpt #: 25 total cpu time spent up to now is 275.9 secs Computing kpt #: 26 total cpu time spent up to now is 286.6 secs Computing kpt #: 27 total cpu time spent up to now is 298.6 secs Computing kpt #: 28 total cpu time spent up to now is 310.0 secs Computing kpt #: 29 total cpu time spent up to now is 321.4 secs Computing kpt #: 30 total cpu time spent up to now is 333.2 secs Computing kpt #: 31 total cpu time spent up to now is 345.5 secs Computing kpt #: 32 total cpu time spent up to now is 357.5 secs Computing kpt #: 33 total cpu time spent up to now is 370.5 secs Computing kpt #: 34 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 383.3 secs Computing kpt #: 35 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 395.8 secs Computing kpt #: 36 total cpu time spent up to now is 408.0 secs Computing kpt #: 37 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 421.2 secs Computing kpt #: 38 total cpu time spent up to now is 434.0 secs Computing kpt #: 39 total cpu time spent up to now is 447.2 secs Computing kpt #: 40 total cpu time spent up to now is 459.4 secs Computing kpt #: 41 total cpu time spent up to now is 472.0 secs Computing kpt #: 42 total cpu time spent up to now is 484.9 secs Computing kpt #: 43 total cpu time spent up to now is 497.5 secs Computing kpt #: 44 total cpu time spent up to now is 510.1 secs Computing kpt #: 45 total cpu time spent up to now is 522.6 secs Computing kpt #: 46 total cpu time spent up to now is 535.4 secs Computing kpt #: 47 total cpu time spent up to now is 548.5 secs Computing kpt #: 48 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 562.1 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 575.7 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 589.6 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 602.9 secs Computing kpt #: 52 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 617.8 secs Computing kpt #: 53 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 630.9 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 643.8 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 657.8 secs Computing kpt #: 56 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 673.7 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 687.0 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 700.8 secs Computing kpt #: 59 total cpu time spent up to now is 711.4 secs Computing kpt #: 60 total cpu time spent up to now is 720.2 secs Computing kpt #: 61 total cpu time spent up to now is 730.9 secs Computing kpt #: 62 total cpu time spent up to now is 739.4 secs Computing kpt #: 63 total cpu time spent up to now is 751.4 secs Computing kpt #: 64 total cpu time spent up to now is 762.8 secs Computing kpt #: 65 total cpu time spent up to now is 772.4 secs Computing kpt #: 66 total cpu time spent up to now is 782.3 secs Computing kpt #: 67 total cpu time spent up to now is 792.5 secs Computing kpt #: 68 total cpu time spent up to now is 803.6 secs Computing kpt #: 69 total cpu time spent up to now is 811.8 secs Computing kpt #: 70 total cpu time spent up to now is 821.5 secs Computing kpt #: 71 total cpu time spent up to now is 831.9 secs Computing kpt #: 72 total cpu time spent up to now is 840.6 secs Computing kpt #: 73 total cpu time spent up to now is 850.2 secs Computing kpt #: 74 total cpu time spent up to now is 859.1 secs Computing kpt #: 75 total cpu time spent up to now is 867.6 secs Computing kpt #: 76 total cpu time spent up to now is 876.6 secs Computing kpt #: 77 total cpu time spent up to now is 885.2 secs Computing kpt #: 78 total cpu time spent up to now is 893.7 secs Computing kpt #: 79 total cpu time spent up to now is 902.7 secs Computing kpt #: 80 total cpu time spent up to now is 911.1 secs Computing kpt #: 81 total cpu time spent up to now is 920.2 secs Computing kpt #: 82 total cpu time spent up to now is 928.4 secs Computing kpt #: 83 total cpu time spent up to now is 936.5 secs Computing kpt #: 84 total cpu time spent up to now is 945.7 secs Computing kpt #: 85 total cpu time spent up to now is 954.6 secs Computing kpt #: 86 total cpu time spent up to now is 964.9 secs Computing kpt #: 87 total cpu time spent up to now is 973.5 secs Computing kpt #: 88 total cpu time spent up to now is 982.9 secs Computing kpt #: 89 total cpu time spent up to now is 991.4 secs Computing kpt #: 90 total cpu time spent up to now is 999.9 secs Computing kpt #: 91 total cpu time spent up to now is 1009.1 secs Computing kpt #: 92 total cpu time spent up to now is 1017.6 secs Computing kpt #: 93 total cpu time spent up to now is 1028.9 secs Computing kpt #: 94 total cpu time spent up to now is 1038.6 secs Computing kpt #: 95 total cpu time spent up to now is 1048.4 secs Computing kpt #: 96 total cpu time spent up to now is 1058.6 secs Computing kpt #: 97 total cpu time spent up to now is 1069.4 secs Computing kpt #: 98 total cpu time spent up to now is 1080.0 secs Computing kpt #: 99 total cpu time spent up to now is 1092.3 secs Computing kpt #: 100 total cpu time spent up to now is 1103.7 secs Computing kpt #: 101 total cpu time spent up to now is 1115.3 secs Computing kpt #: 102 total cpu time spent up to now is 1128.4 secs Computing kpt #: 103 total cpu time spent up to now is 1141.0 secs Computing kpt #: 104 total cpu time spent up to now is 1154.7 secs Computing kpt #: 105 total cpu time spent up to now is 1167.6 secs Computing kpt #: 106 total cpu time spent up to now is 1179.7 secs Computing kpt #: 107 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1192.3 secs Computing kpt #: 108 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1205.3 secs Computing kpt #: 109 total cpu time spent up to now is 1217.6 secs Computing kpt #: 110 total cpu time spent up to now is 1230.8 secs Computing kpt #: 111 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1243.7 secs Computing kpt #: 112 total cpu time spent up to now is 1256.5 secs Computing kpt #: 113 total cpu time spent up to now is 1271.9 secs Computing kpt #: 114 total cpu time spent up to now is 1284.0 secs Computing kpt #: 115 total cpu time spent up to now is 1296.6 secs Computing kpt #: 116 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1309.8 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1324.5 secs Computing kpt #: 118 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1338.4 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1351.6 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1364.9 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1378.9 secs Computing kpt #: 122 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1392.7 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1405.9 secs Computing kpt #: 124 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1419.5 secs Computing kpt #: 125 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1432.8 secs Computing kpt #: 126 total cpu time spent up to now is 1443.5 secs Computing kpt #: 127 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1456.7 secs Computing kpt #: 128 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1469.9 secs Computing kpt #: 129 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1483.4 secs Computing kpt #: 130 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1497.2 secs Computing kpt #: 131 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1511.7 secs Computing kpt #: 132 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1525.2 secs Computing kpt #: 133 total cpu time spent up to now is 1533.5 secs Computing kpt #: 134 total cpu time spent up to now is 1543.6 secs Computing kpt #: 135 total cpu time spent up to now is 1554.2 secs Computing kpt #: 136 total cpu time spent up to now is 1564.7 secs Computing kpt #: 137 total cpu time spent up to now is 1575.5 secs Computing kpt #: 138 total cpu time spent up to now is 1585.0 secs Computing kpt #: 139 total cpu time spent up to now is 1594.3 secs Computing kpt #: 140 total cpu time spent up to now is 1603.5 secs Computing kpt #: 141 total cpu time spent up to now is 1612.3 secs Computing kpt #: 142 total cpu time spent up to now is 1620.9 secs Computing kpt #: 143 total cpu time spent up to now is 1630.1 secs Computing kpt #: 144 total cpu time spent up to now is 1639.0 secs Computing kpt #: 145 total cpu time spent up to now is 1647.9 secs Computing kpt #: 146 total cpu time spent up to now is 1656.8 secs Computing kpt #: 147 total cpu time spent up to now is 1666.5 secs Computing kpt #: 148 total cpu time spent up to now is 1674.7 secs Computing kpt #: 149 total cpu time spent up to now is 1683.1 secs Computing kpt #: 150 total cpu time spent up to now is 1691.9 secs Computing kpt #: 151 total cpu time spent up to now is 1700.9 secs Computing kpt #: 152 total cpu time spent up to now is 1710.2 secs Computing kpt #: 153 total cpu time spent up to now is 1720.4 secs Computing kpt #: 154 total cpu time spent up to now is 1729.0 secs Computing kpt #: 155 total cpu time spent up to now is 1737.8 secs Computing kpt #: 156 total cpu time spent up to now is 1746.8 secs Computing kpt #: 157 total cpu time spent up to now is 1755.6 secs Computing kpt #: 158 total cpu time spent up to now is 1765.9 secs Computing kpt #: 159 total cpu time spent up to now is 1774.7 secs Computing kpt #: 160 total cpu time spent up to now is 1783.7 secs Computing kpt #: 161 total cpu time spent up to now is 1792.8 secs Computing kpt #: 162 total cpu time spent up to now is 1802.3 secs Computing kpt #: 163 total cpu time spent up to now is 1810.9 secs Computing kpt #: 164 total cpu time spent up to now is 1819.2 secs Computing kpt #: 165 total cpu time spent up to now is 1828.3 secs Computing kpt #: 166 total cpu time spent up to now is 1837.0 secs Computing kpt #: 167 total cpu time spent up to now is 1846.2 secs Computing kpt #: 168 total cpu time spent up to now is 1855.8 secs Computing kpt #: 169 total cpu time spent up to now is 1867.1 secs Computing kpt #: 170 total cpu time spent up to now is 1876.6 secs Computing kpt #: 171 total cpu time spent up to now is 1885.1 secs Computing kpt #: 172 total cpu time spent up to now is 1893.7 secs Computing kpt #: 173 total cpu time spent up to now is 1903.2 secs Computing kpt #: 174 total cpu time spent up to now is 1912.0 secs Computing kpt #: 175 total cpu time spent up to now is 1921.1 secs Computing kpt #: 176 total cpu time spent up to now is 1929.7 secs Computing kpt #: 177 total cpu time spent up to now is 1938.7 secs Computing kpt #: 178 total cpu time spent up to now is 1947.9 secs Computing kpt #: 179 total cpu time spent up to now is 1956.9 secs Computing kpt #: 180 total cpu time spent up to now is 1966.6 secs Computing kpt #: 181 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1980.5 secs Computing kpt #: 182 total cpu time spent up to now is 1989.8 secs Computing kpt #: 183 total cpu time spent up to now is 1999.6 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2012.8 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2026.6 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2040.0 secs Computing kpt #: 187 total cpu time spent up to now is 2054.0 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2067.3 secs Computing kpt #: 189 total cpu time spent up to now is 2080.8 secs Computing kpt #: 190 total cpu time spent up to now is 2094.1 secs Computing kpt #: 191 total cpu time spent up to now is 2106.8 secs Computing kpt #: 192 total cpu time spent up to now is 2119.1 secs Computing kpt #: 193 total cpu time spent up to now is 2133.0 secs Computing kpt #: 194 total cpu time spent up to now is 2146.7 secs Computing kpt #: 195 total cpu time spent up to now is 2159.0 secs Computing kpt #: 196 total cpu time spent up to now is 2172.9 secs Computing kpt #: 197 total cpu time spent up to now is 2185.9 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2199.1 secs Computing kpt #: 199 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2212.3 secs Computing kpt #: 200 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2224.6 secs Computing kpt #: 201 total cpu time spent up to now is 2236.7 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2250.1 secs Computing kpt #: 203 total cpu time spent up to now is 2262.7 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2276.3 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2289.1 secs Computing kpt #: 206 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2302.4 secs Computing kpt #: 207 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2315.3 secs Computing kpt #: 208 total cpu time spent up to now is 2328.1 secs Computing kpt #: 209 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2340.4 secs Computing kpt #: 210 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2354.2 secs Computing kpt #: 211 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2366.9 secs Computing kpt #: 212 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2379.7 secs Computing kpt #: 213 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 2393.0 secs Computing kpt #: 214 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2405.4 secs Computing kpt #: 215 total cpu time spent up to now is 2414.7 secs Computing kpt #: 216 total cpu time spent up to now is 2424.9 secs Computing kpt #: 217 total cpu time spent up to now is 2434.0 secs Computing kpt #: 218 total cpu time spent up to now is 2444.0 secs Computing kpt #: 219 total cpu time spent up to now is 2453.1 secs Computing kpt #: 220 total cpu time spent up to now is 2462.9 secs Computing kpt #: 221 total cpu time spent up to now is 2473.1 secs Computing kpt #: 222 total cpu time spent up to now is 2482.2 secs Computing kpt #: 223 total cpu time spent up to now is 2491.3 secs Computing kpt #: 224 total cpu time spent up to now is 2499.8 secs Computing kpt #: 225 total cpu time spent up to now is 2508.9 secs Computing kpt #: 226 total cpu time spent up to now is 2517.6 secs Computing kpt #: 227 total cpu time spent up to now is 2527.7 secs Computing kpt #: 228 total cpu time spent up to now is 2536.3 secs Computing kpt #: 229 total cpu time spent up to now is 2545.1 secs Computing kpt #: 230 total cpu time spent up to now is 2553.9 secs Computing kpt #: 231 total cpu time spent up to now is 2561.9 secs Computing kpt #: 232 total cpu time spent up to now is 2570.5 secs Computing kpt #: 233 total cpu time spent up to now is 2578.7 secs Computing kpt #: 234 total cpu time spent up to now is 2588.1 secs Computing kpt #: 235 total cpu time spent up to now is 2599.6 secs Computing kpt #: 236 total cpu time spent up to now is 2611.5 secs Computing kpt #: 237 total cpu time spent up to now is 2622.8 secs Computing kpt #: 238 total cpu time spent up to now is 2633.9 secs Computing kpt #: 239 total cpu time spent up to now is 2645.7 secs Computing kpt #: 240 total cpu time spent up to now is 2656.6 secs Computing kpt #: 241 total cpu time spent up to now is 2669.4 secs Computing kpt #: 242 total cpu time spent up to now is 2681.7 secs Computing kpt #: 243 total cpu time spent up to now is 2694.0 secs Computing kpt #: 244 total cpu time spent up to now is 2706.5 secs Computing kpt #: 245 total cpu time spent up to now is 2718.3 secs Computing kpt #: 246 total cpu time spent up to now is 2731.1 secs Computing kpt #: 247 total cpu time spent up to now is 2743.3 secs Computing kpt #: 248 total cpu time spent up to now is 2756.0 secs Computing kpt #: 249 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 2771.2 secs Computing kpt #: 250 total cpu time spent up to now is 2783.6 secs ethr = 1.67E-11, avg # of iterations = 77.8 total cpu time spent up to now is 2783.8 secs End of band structure calculation k = 0.0000-0.5774-0.0729 ( 11650 PWs) bands (ev): -19.6282 -19.6282 -19.3077 -19.3077 -18.6599 -18.6599 -17.9949 -17.9949 -17.3580 -17.3580 -16.2560 -16.2560 -10.5423 -10.5423 -8.7130 -8.7130 -6.5801 -6.5801 -6.0207 -6.0207 -5.2242 -5.2242 -4.8334 -4.8334 -4.6592 -4.6592 -4.4843 -4.4843 -4.3163 -4.3163 -4.0728 -4.0728 -3.7930 -3.7930 -3.2785 -3.2785 -3.0920 -3.0920 -2.7554 -2.7554 -2.6690 -2.6690 -2.4480 -2.4480 -2.0121 -2.0121 -1.7013 -1.7013 -1.5226 -1.5226 -1.1707 -1.1707 -1.0641 -1.0641 -1.0253 -1.0253 -0.9434 -0.9434 -0.8745 -0.8745 -0.8173 -0.8173 -0.6352 -0.6352 -0.0688 -0.0688 0.1179 0.1179 1.2655 1.2655 1.3460 1.3460 k = 0.0000-0.5604-0.0708 ( 11646 PWs) bands (ev): -19.6282 -19.6282 -19.3077 -19.3077 -18.6599 -18.6599 -17.9949 -17.9949 -17.3580 -17.3580 -16.2560 -16.2560 -10.5420 -10.5420 -8.7126 -8.7126 -6.5801 -6.5801 -6.0207 -6.0207 -5.2247 -5.2246 -4.8335 -4.8334 -4.6592 -4.6592 -4.4849 -4.4846 -4.3166 -4.3163 -4.0730 -4.0729 -3.7930 -3.7928 -3.2785 -3.2784 -3.0921 -3.0918 -2.7554 -2.7551 -2.6693 -2.6684 -2.4484 -2.4478 -2.0122 -2.0119 -1.7033 -1.7025 -1.5241 -1.5221 -1.1712 -1.1694 -1.0652 -1.0631 -1.0273 -1.0242 -0.9443 -0.9423 -0.8751 -0.8736 -0.8178 -0.8166 -0.6356 -0.6354 -0.0695 -0.0689 0.1167 0.1168 1.2636 1.2648 1.3474 1.3482 k = 0.0000-0.5434-0.0686 ( 11641 PWs) bands (ev): -19.6283 -19.6283 -19.3077 -19.3077 -18.6599 -18.6599 -17.9949 -17.9949 -17.3580 -17.3580 -16.2560 -16.2560 -10.5412 -10.5412 -8.7114 -8.7114 -6.5800 -6.5800 -6.0208 -6.0207 -5.2260 -5.2259 -4.8335 -4.8333 -4.6591 -4.6590 -4.4863 -4.4858 -4.3172 -4.3167 -4.0732 -4.0731 -3.7930 -3.7926 -3.2783 -3.2782 -3.0920 -3.0914 -2.7553 -2.7546 -2.6693 -2.6676 -2.4491 -2.4479 -2.0122 -2.0116 -1.7084 -1.7068 -1.5263 -1.5226 -1.1710 -1.1674 -1.0664 -1.0623 -1.0299 -1.0238 -0.9450 -0.9409 -0.8754 -0.8726 -0.8182 -0.8159 -0.6365 -0.6361 -0.0708 -0.0696 0.1133 0.1135 1.2591 1.2613 1.3529 1.3544 k = 0.0000-0.5264-0.0665 ( 11636 PWs) bands (ev): -19.6284 -19.6284 -19.3077 -19.3077 -18.6599 -18.6599 -17.9949 -17.9949 -17.3580 -17.3580 -16.2561 -16.2561 -10.5397 -10.5397 -8.7094 -8.7093 -6.5799 -6.5798 -6.0208 -6.0208 -5.2282 -5.2280 -4.8335 -4.8332 -4.6588 -4.6587 -4.4885 -4.4878 -4.3181 -4.3175 -4.0737 -4.0734 -3.7928 -3.7922 -3.2779 -3.2778 -3.0918 -3.0910 -2.7549 -2.7539 -2.6691 -2.6665 -2.4502 -2.4484 -2.0123 -2.0112 -1.7166 -1.7144 -1.5292 -1.5239 -1.1702 -1.1648 -1.0677 -1.0618 -1.0331 -1.0242 -0.9454 -0.9394 -0.8755 -0.8713 -0.8185 -0.8150 -0.6378 -0.6373 -0.0727 -0.0710 0.1077 0.1081 1.2516 1.2546 1.3630 1.3648 k = 0.0000-0.5094-0.0644 ( 11634 PWs) bands (ev): -19.6286 -19.6286 -19.3077 -19.3077 -18.6600 -18.6600 -17.9949 -17.9949 -17.3580 -17.3580 -16.2562 -16.2562 -10.5378 -10.5377 -8.7066 -8.7065 -6.5797 -6.5796 -6.0210 -6.0209 -5.2312 -5.2310 -4.8335 -4.8331 -4.6585 -4.6583 -4.4915 -4.4907 -4.3194 -4.3185 -4.0743 -4.0740 -3.7926 -3.7917 -3.2774 -3.2772 -3.0915 -3.0904 -2.7544 -2.7530 -2.6686 -2.6652 -2.4516 -2.4492 -2.0123 -2.0109 -1.7278 -1.7250 -1.5323 -1.5257 -1.1687 -1.1618 -1.0693 -1.0615 -1.0368 -1.0250 -0.9457 -0.9378 -0.8754 -0.8700 -0.8185 -0.8141 -0.6397 -0.6391 -0.0751 -0.0729 0.1001 0.1007 1.2412 1.2446 1.3776 1.3797 k = 0.0000-0.4924-0.0622 ( 11627 PWs) bands (ev): -19.6287 -19.6287 -19.3077 -19.3077 -18.6600 -18.6600 -17.9950 -17.9950 -17.3581 -17.3581 -16.2563 -16.2563 -10.5352 -10.5352 -8.7030 -8.7029 -6.5794 -6.5794 -6.0211 -6.0210 -5.2351 -5.2349 -4.8335 -4.8330 -4.6580 -4.6578 -4.4953 -4.4943 -4.3208 -4.3197 -4.0751 -4.0747 -3.7922 -3.7912 -3.2767 -3.2766 -3.0911 -3.0897 -2.7537 -2.7520 -2.6678 -2.6636 -2.4533 -2.4503 -2.0124 -2.0106 -1.7416 -1.7384 -1.5354 -1.5277 -1.1667 -1.1585 -1.0713 -1.0618 -1.0406 -1.0260 -0.9459 -0.9363 -0.8752 -0.8686 -0.8183 -0.8130 -0.6422 -0.6414 -0.0779 -0.0752 0.0908 0.0915 1.2280 1.2317 1.3965 1.3987 k = 0.0000-0.4755-0.0601 ( 11639 PWs) bands (ev): -19.6290 -19.6290 -19.3078 -19.3078 -18.6601 -18.6601 -17.9950 -17.9950 -17.3581 -17.3581 -16.2565 -16.2565 -10.5322 -10.5322 -8.6987 -8.6986 -6.5791 -6.5791 -6.0212 -6.0212 -5.2399 -5.2396 -4.8336 -4.8330 -4.6574 -4.6572 -4.4998 -4.4985 -4.3223 -4.3211 -4.0760 -4.0756 -3.7917 -3.7905 -3.2759 -3.2757 -3.0906 -3.0889 -2.7529 -2.7510 -2.6667 -2.6618 -2.4555 -2.4519 -2.0126 -2.0105 -1.7577 -1.7542 -1.5382 -1.5298 -1.1644 -1.1550 -1.0736 -1.0628 -1.0443 -1.0272 -0.9462 -0.9348 -0.8748 -0.8672 -0.8177 -0.8118 -0.6452 -0.6444 -0.0809 -0.0778 0.0798 0.0807 1.2124 1.2163 1.4192 1.4214 k = 0.0000-0.4585-0.0579 ( 11639 PWs) bands (ev): -19.6292 -19.6292 -19.3078 -19.3078 -18.6602 -18.6601 -17.9950 -17.9950 -17.3582 -17.3581 -16.2567 -16.2566 -10.5287 -10.5286 -8.6936 -8.6935 -6.5787 -6.5787 -6.0214 -6.0213 -5.2457 -5.2453 -4.8337 -4.8330 -4.6568 -4.6566 -4.5048 -4.5034 -4.3240 -4.3226 -4.0772 -4.0766 -3.7912 -3.7898 -3.2750 -3.2748 -3.0900 -3.0881 -2.7520 -2.7499 -2.6654 -2.6599 -2.4581 -2.4539 -2.0132 -2.0106 -1.7755 -1.7717 -1.5406 -1.5318 -1.1618 -1.1515 -1.0766 -1.0649 -1.0474 -1.0281 -0.9465 -0.9334 -0.8744 -0.8660 -0.8167 -0.8104 -0.6487 -0.6479 -0.0842 -0.0808 0.0675 0.0687 1.1947 1.1988 1.4455 1.4477 k = 0.0000-0.4415-0.0558 ( 11635 PWs) bands (ev): -19.6295 -19.6295 -19.3078 -19.3078 -18.6603 -18.6602 -17.9951 -17.9951 -17.3582 -17.3582 -16.2569 -16.2568 -10.5247 -10.5246 -8.6879 -8.6878 -6.5783 -6.5783 -6.0216 -6.0215 -5.2523 -5.2519 -4.8338 -4.8330 -4.6560 -4.6558 -4.5104 -4.5088 -4.3257 -4.3242 -4.0785 -4.0779 -3.7906 -3.7890 -3.2740 -3.2737 -3.0893 -3.0873 -2.7511 -2.7490 -2.6638 -2.6577 -2.4613 -2.4564 -2.0143 -2.0112 -1.7943 -1.7903 -1.5425 -1.5334 -1.1593 -1.1481 -1.0801 -1.0683 -1.0496 -1.0287 -0.9470 -0.9322 -0.8740 -0.8648 -0.8153 -0.8088 -0.6528 -0.6521 -0.0877 -0.0840 0.0543 0.0558 1.1754 1.1795 1.4749 1.4770 k = 0.0000-0.4245-0.0536 ( 11626 PWs) bands (ev): -19.6299 -19.6298 -19.3079 -19.3079 -18.6603 -18.6603 -17.9951 -17.9951 -17.3583 -17.3583 -16.2571 -16.2571 -10.5202 -10.5202 -8.6816 -8.6814 -6.5778 -6.5778 -6.0219 -6.0217 -5.2599 -5.2595 -4.8340 -4.8331 -4.6552 -4.6549 -4.5163 -4.5146 -4.3274 -4.3258 -4.0799 -4.0793 -3.7899 -3.7882 -3.2728 -3.2726 -3.0887 -3.0864 -2.7504 -2.7482 -2.6620 -2.6554 -2.4649 -2.4595 -2.0160 -2.0125 -1.8133 -1.8089 -1.5440 -1.5347 -1.1568 -1.1449 -1.0842 -1.0728 -1.0508 -1.0289 -0.9477 -0.9311 -0.8737 -0.8639 -0.8135 -0.8070 -0.6575 -0.6570 -0.0915 -0.0876 0.0406 0.0424 1.1547 1.1588 1.5073 1.5093 k = 0.0000-0.4075-0.0515 ( 11632 PWs) bands (ev): -19.6302 -19.6302 -19.3079 -19.3079 -18.6604 -18.6604 -17.9952 -17.9952 -17.3583 -17.3583 -16.2573 -16.2573 -10.5153 -10.5153 -8.6746 -8.6745 -6.5774 -6.5773 -6.0221 -6.0220 -5.2684 -5.2680 -4.8343 -4.8333 -4.6543 -4.6540 -4.5224 -4.5206 -4.3290 -4.3273 -4.0816 -4.0809 -3.7891 -3.7873 -3.2716 -3.2713 -3.0881 -3.0856 -2.7499 -2.7478 -2.6599 -2.6529 -2.4692 -2.4632 -2.0187 -2.0147 -1.8316 -1.8269 -1.5450 -1.5357 -1.1546 -1.1422 -1.0889 -1.0781 -1.0515 -1.0289 -0.9487 -0.9303 -0.8736 -0.8631 -0.8113 -0.8049 -0.6629 -0.6625 -0.0958 -0.0917 0.0270 0.0291 1.1330 1.1370 1.5423 1.5442 k = 0.0000-0.3906-0.0493 ( 11631 PWs) bands (ev): -19.6306 -19.6306 -19.3080 -19.3080 -18.6605 -18.6605 -17.9952 -17.9952 -17.3584 -17.3584 -16.2576 -16.2576 -10.5101 -10.5100 -8.6671 -8.6670 -6.5768 -6.5768 -6.0224 -6.0223 -5.2778 -5.2773 -4.8347 -4.8337 -4.6533 -4.6530 -4.5286 -4.5267 -4.3306 -4.3288 -4.0834 -4.0827 -3.7883 -3.7864 -3.2702 -3.2699 -3.0874 -3.0848 -2.7499 -2.7479 -2.6575 -2.6503 -2.4740 -2.4675 -2.0224 -2.0180 -1.8483 -1.8432 -1.5457 -1.5364 -1.1530 -1.1401 -1.0938 -1.0837 -1.0517 -1.0286 -0.9499 -0.9296 -0.8736 -0.8624 -0.8086 -0.8025 -0.6688 -0.6685 -0.1010 -0.0968 0.0141 0.0166 1.1104 1.1145 1.5798 1.5816 k = 0.0000-0.3736-0.0472 ( 11634 PWs) bands (ev): -19.6310 -19.6310 -19.3080 -19.3080 -18.6606 -18.6606 -17.9953 -17.9953 -17.3585 -17.3585 -16.2579 -16.2578 -10.5045 -10.5045 -8.6592 -8.6590 -6.5763 -6.5762 -6.0227 -6.0226 -5.2881 -5.2876 -4.8353 -4.8342 -4.6523 -4.6519 -4.5348 -4.5328 -4.3321 -4.3303 -4.0854 -4.0847 -3.7874 -3.7854 -3.2688 -3.2685 -3.0869 -3.0840 -2.7504 -2.7486 -2.6549 -2.6477 -2.4794 -2.4724 -2.0273 -2.0227 -1.8627 -1.8573 -1.5461 -1.5368 -1.1522 -1.1390 -1.0988 -1.0892 -1.0517 -1.0282 -0.9513 -0.9293 -0.8739 -0.8619 -0.8056 -0.7999 -0.6756 -0.6750 -0.1074 -0.1031 0.0026 0.0055 1.0874 1.0914 1.6194 1.6212 k = 0.0000-0.3566-0.0450 ( 11629 PWs) bands (ev): -19.6314 -19.6314 -19.3081 -19.3081 -18.6608 -18.6607 -17.9954 -17.9954 -17.3586 -17.3585 -16.2582 -16.2581 -10.4987 -10.4986 -8.6508 -8.6506 -6.5757 -6.5757 -6.0231 -6.0229 -5.2992 -5.2987 -4.8360 -4.8349 -4.6511 -4.6507 -4.5408 -4.5387 -4.3335 -4.3317 -4.0876 -4.0869 -3.7866 -3.7845 -3.2673 -3.2670 -3.0864 -3.0834 -2.7517 -2.7503 -2.6520 -2.6449 -2.4851 -2.4778 -2.0334 -2.0287 -1.8741 -1.8685 -1.5462 -1.5369 -1.1526 -1.1392 -1.1036 -1.0941 -1.0515 -1.0276 -0.9530 -0.9293 -0.8743 -0.8616 -0.8022 -0.7971 -0.6829 -0.6818 -0.1155 -0.1110 -0.0069 -0.0036 1.0642 1.0681 1.6610 1.6627 k = 0.0000-0.3396-0.0429 ( 11625 PWs) bands (ev): -19.6318 -19.6318 -19.3082 -19.3081 -18.6609 -18.6608 -17.9954 -17.9954 -17.3586 -17.3586 -16.2585 -16.2584 -10.4926 -10.4925 -8.6420 -8.6418 -6.5751 -6.5751 -6.0234 -6.0232 -5.3110 -5.3105 -4.8369 -4.8357 -4.6500 -4.6495 -4.5464 -4.5443 -4.3348 -4.3330 -4.0900 -4.0892 -3.7857 -3.7835 -3.2657 -3.2654 -3.0859 -3.0828 -2.7542 -2.7530 -2.6488 -2.6421 -2.4910 -2.4835 -2.0404 -2.0358 -1.8825 -1.8769 -1.5460 -1.5368 -1.1545 -1.1412 -1.1077 -1.0981 -1.0512 -1.0271 -0.9550 -0.9296 -0.8749 -0.8614 -0.7985 -0.7940 -0.6906 -0.6891 -0.1253 -0.1207 -0.0139 -0.0104 1.0409 1.0447 1.7042 1.7059 k = 0.0000-0.3226-0.0408 ( 11621 PWs) bands (ev): -19.6323 -19.6323 -19.3082 -19.3082 -18.6610 -18.6610 -17.9955 -17.9955 -17.3587 -17.3587 -16.2588 -16.2587 -10.4863 -10.4862 -8.6330 -8.6328 -6.5745 -6.5744 -6.0238 -6.0236 -5.3235 -5.3230 -4.8380 -4.8368 -4.6488 -4.6483 -4.5517 -4.5496 -4.3361 -4.3342 -4.0925 -4.0917 -3.7848 -3.7826 -3.2641 -3.2638 -3.0856 -3.0824 -2.7580 -2.7570 -2.6453 -2.6392 -2.4969 -2.4893 -2.0477 -2.0435 -1.8880 -1.8825 -1.5457 -1.5365 -1.1582 -1.1453 -1.1107 -1.1011 -1.0510 -1.0267 -0.9573 -0.9302 -0.8757 -0.8615 -0.7947 -0.7908 -0.6987 -0.6966 -0.1368 -0.1320 -0.0184 -0.0147 1.0179 1.0216 1.7488 1.7504 k = 0.0000-0.3057-0.0386 ( 11633 PWs) bands (ev): -19.6327 -19.6327 -19.3083 -19.3083 -18.6611 -18.6611 -17.9956 -17.9956 -17.3588 -17.3588 -16.2591 -16.2590 -10.4798 -10.4798 -8.6237 -8.6235 -6.5739 -6.5738 -6.0242 -6.0240 -5.3366 -5.3361 -4.8393 -4.8381 -4.6475 -4.6471 -4.5565 -4.5543 -4.3372 -4.3353 -4.0951 -4.0944 -3.7839 -3.7817 -3.2625 -3.2621 -3.0853 -3.0820 -2.7635 -2.7624 -2.6415 -2.6362 -2.5025 -2.4951 -2.0549 -2.0511 -1.8909 -1.8857 -1.5452 -1.5361 -1.1635 -1.1514 -1.1128 -1.1032 -1.0508 -1.0264 -0.9598 -0.9314 -0.8767 -0.8618 -0.7906 -0.7874 -0.7069 -0.7041 -0.1495 -0.1445 -0.0206 -0.0169 0.9953 0.9989 1.7945 1.7961 k = 0.0000-0.2887-0.0365 ( 11625 PWs) bands (ev): -19.6332 -19.6332 -19.3083 -19.3083 -18.6612 -18.6612 -17.9956 -17.9956 -17.3589 -17.3589 -16.2594 -16.2594 -10.4733 -10.4733 -8.6143 -8.6141 -6.5733 -6.5732 -6.0246 -6.0244 -5.3501 -5.3496 -4.8408 -4.8396 -4.6463 -4.6458 -4.5607 -4.5586 -4.3382 -4.3364 -4.0979 -4.0972 -3.7830 -3.7808 -3.2608 -3.2604 -3.0851 -3.0818 -2.7707 -2.7694 -2.6375 -2.6330 -2.5076 -2.5005 -2.0616 -2.0582 -1.8917 -1.8868 -1.5447 -1.5356 -1.1703 -1.1590 -1.1141 -1.1048 -1.0507 -1.0263 -0.9626 -0.9329 -0.8778 -0.8624 -0.7865 -0.7840 -0.7150 -0.7116 -0.1628 -0.1576 -0.0211 -0.0174 0.9733 0.9767 1.8409 1.8425 k = 0.0000-0.2717-0.0343 ( 11623 PWs) bands (ev): -19.6336 -19.6336 -19.3084 -19.3084 -18.6614 -18.6613 -17.9957 -17.9957 -17.3590 -17.3590 -16.2597 -16.2597 -10.4668 -10.4667 -8.6048 -8.6047 -6.5726 -6.5726 -6.0250 -6.0248 -5.3640 -5.3635 -4.8426 -4.8413 -4.6450 -4.6445 -4.5643 -4.5623 -4.3392 -4.3374 -4.1009 -4.1002 -3.7822 -3.7800 -3.2590 -3.2587 -3.0850 -3.0816 -2.7796 -2.7781 -2.6332 -2.6297 -2.5118 -2.5053 -2.0672 -2.0644 -1.8908 -1.8862 -1.5441 -1.5350 -1.1783 -1.1678 -1.1152 -1.1065 -1.0507 -1.0264 -0.9655 -0.9350 -0.8790 -0.8633 -0.7823 -0.7805 -0.7228 -0.7187 -0.1763 -0.1709 -0.0201 -0.0165 0.9521 0.9554 1.8877 1.8893 k = 0.0000-0.2547-0.0322 ( 11624 PWs) bands (ev): -19.6341 -19.6341 -19.3085 -19.3084 -18.6615 -18.6614 -17.9958 -17.9958 -17.3591 -17.3590 -16.2600 -16.2600 -10.4603 -10.4602 -8.5954 -8.5952 -6.5720 -6.5720 -6.0255 -6.0253 -5.3780 -5.3775 -4.8445 -4.8432 -4.6438 -4.6432 -4.5674 -4.5654 -4.3401 -4.3384 -4.1039 -4.1032 -3.7814 -3.7792 -3.2573 -3.2569 -3.0849 -3.0815 -2.7902 -2.7885 -2.6288 -2.6263 -2.5151 -2.5094 -2.0717 -2.0693 -1.8887 -1.8843 -1.5436 -1.5345 -1.1871 -1.1773 -1.1165 -1.1084 -1.0508 -1.0268 -0.9686 -0.9375 -0.8803 -0.8644 -0.7783 -0.7769 -0.7299 -0.7252 -0.1896 -0.1840 -0.0181 -0.0146 0.9317 0.9348 1.9347 1.9363 k = 0.0000-0.2377-0.0300 ( 11628 PWs) bands (ev): -19.6345 -19.6345 -19.3085 -19.3085 -18.6616 -18.6616 -17.9958 -17.9958 -17.3591 -17.3591 -16.2603 -16.2603 -10.4538 -10.4538 -8.5861 -8.5859 -6.5714 -6.5714 -6.0259 -6.0257 -5.3920 -5.3915 -4.8465 -4.8453 -4.6425 -4.6419 -4.5698 -4.5679 -4.3410 -4.3393 -4.1070 -4.1063 -3.7807 -3.7785 -3.2555 -3.2552 -3.0848 -3.0814 -2.8022 -2.8004 -2.6244 -2.6227 -2.5175 -2.5125 -2.0749 -2.0730 -1.8854 -1.8814 -1.5430 -1.5340 -1.1966 -1.1874 -1.1182 -1.1109 -1.0511 -1.0276 -0.9716 -0.9405 -0.8815 -0.8659 -0.7750 -0.7732 -0.7362 -0.7309 -0.2023 -0.1966 -0.0153 -0.0120 0.9124 0.9153 1.9814 1.9831 k = 0.0000-0.2208-0.0279 ( 11626 PWs) bands (ev): -19.6350 -19.6350 -19.3086 -19.3086 -18.6617 -18.6617 -17.9959 -17.9959 -17.3592 -17.3592 -16.2606 -16.2606 -10.4475 -10.4475 -8.5769 -8.5767 -6.5709 -6.5708 -6.0264 -6.0262 -5.4059 -5.4054 -4.8487 -4.8476 -4.6413 -4.6407 -4.5717 -4.5698 -4.3418 -4.3402 -4.1101 -4.1095 -3.7800 -3.7779 -3.2538 -3.2534 -3.0847 -3.0814 -2.8153 -2.8135 -2.6201 -2.6188 -2.5189 -2.5146 -2.0769 -2.0753 -1.8813 -1.8775 -1.5426 -1.5337 -1.2065 -1.1978 -1.1207 -1.1141 -1.0516 -1.0288 -0.9745 -0.9437 -0.8827 -0.8676 -0.7723 -0.7695 -0.7414 -0.7354 -0.2143 -0.2085 -0.0119 -0.0088 0.8942 0.8970 2.0276 2.0293 k = 0.0000-0.2038-0.0257 ( 11631 PWs) bands (ev): -19.6354 -19.6354 -19.3086 -19.3086 -18.6618 -18.6618 -17.9960 -17.9960 -17.3593 -17.3593 -16.2609 -16.2609 -10.4414 -10.4413 -8.5680 -8.5678 -6.5703 -6.5703 -6.0269 -6.0267 -5.4195 -5.4191 -4.8511 -4.8499 -4.6401 -4.6394 -4.5731 -4.5713 -4.3426 -4.3411 -4.1132 -4.1127 -3.7794 -3.7774 -3.2521 -3.2517 -3.0845 -3.0813 -2.8293 -2.8275 -2.6160 -2.6147 -2.5195 -2.5159 -2.0777 -2.0765 -1.8764 -1.8729 -1.5424 -1.5335 -1.2166 -1.2085 -1.1240 -1.1182 -1.0520 -1.0303 -0.9771 -0.9472 -0.8838 -0.8695 -0.7706 -0.7662 -0.7451 -0.7386 -0.2255 -0.2197 -0.0083 -0.0053 0.8772 0.8798 2.0730 2.0747 k = 0.0000-0.1868-0.0236 ( 11638 PWs) bands (ev): -19.6358 -19.6358 -19.3087 -19.3087 -18.6619 -18.6619 -17.9960 -17.9960 -17.3594 -17.3594 -16.2612 -16.2612 -10.4355 -10.4355 -8.5595 -8.5593 -6.5698 -6.5698 -6.0273 -6.0272 -5.4326 -5.4322 -4.8535 -4.8524 -4.6390 -4.6383 -4.5740 -4.5723 -4.3433 -4.3419 -4.1163 -4.1158 -3.7788 -3.7769 -3.2504 -3.2501 -3.0842 -3.0811 -2.8438 -2.8421 -2.6122 -2.6105 -2.5194 -2.5162 -2.0776 -2.0767 -1.8710 -1.8677 -1.5423 -1.5336 -1.2269 -1.2192 -1.1283 -1.1231 -1.0525 -1.0321 -0.9792 -0.9507 -0.8848 -0.8714 -0.7697 -0.7639 -0.7471 -0.7401 -0.2357 -0.2299 -0.0044 -0.0017 0.8614 0.8639 2.1172 2.1190 k = 0.0000-0.1698-0.0215 ( 11641 PWs) bands (ev): -19.6362 -19.6361 -19.3088 -19.3087 -18.6620 -18.6620 -17.9961 -17.9961 -17.3594 -17.3594 -16.2614 -16.2614 -10.4300 -10.4299 -8.5513 -8.5512 -6.5693 -6.5693 -6.0278 -6.0276 -5.4452 -5.4448 -4.8559 -4.8549 -4.6379 -4.6372 -4.5745 -4.5730 -4.3440 -4.3427 -4.1194 -4.1188 -3.7783 -3.7765 -3.2488 -3.2484 -3.0838 -3.0808 -2.8584 -2.8567 -2.6086 -2.6065 -2.5187 -2.5158 -2.0767 -2.0760 -1.8650 -1.8619 -1.5426 -1.5341 -1.2372 -1.2298 -1.1335 -1.1289 -1.0530 -1.0342 -0.9807 -0.9541 -0.8856 -0.8734 -0.7696 -0.7630 -0.7470 -0.7402 -0.2449 -0.2393 -0.0005 0.0020 0.8470 0.8493 2.1599 2.1617 k = 0.0000-0.1528-0.0193 ( 11650 PWs) bands (ev): -19.6365 -19.6365 -19.3088 -19.3088 -18.6621 -18.6621 -17.9961 -17.9961 -17.3595 -17.3595 -16.2617 -16.2617 -10.4248 -10.4247 -8.5437 -8.5436 -6.5689 -6.5689 -6.0283 -6.0281 -5.4570 -5.4566 -4.8583 -4.8574 -4.6369 -4.6361 -4.5747 -4.5733 -4.3446 -4.3434 -4.1223 -4.1218 -3.7779 -3.7762 -3.2473 -3.2469 -3.0833 -3.0803 -2.8728 -2.8712 -2.6051 -2.6027 -2.5176 -2.5149 -2.0752 -2.0746 -1.8587 -1.8558 -1.5431 -1.5349 -1.2473 -1.2402 -1.1395 -1.1354 -1.0533 -1.0364 -0.9817 -0.9574 -0.8863 -0.8753 -0.7699 -0.7633 -0.7453 -0.7392 -0.2531 -0.2478 0.0033 0.0056 0.8340 0.8361 2.2008 2.2027 k = 0.0000-0.1358-0.0172 ( 11658 PWs) bands (ev): -19.6368 -19.6368 -19.3089 -19.3088 -18.6622 -18.6622 -17.9962 -17.9962 -17.3596 -17.3596 -16.2619 -16.2619 -10.4199 -10.4199 -8.5367 -8.5365 -6.5685 -6.5684 -6.0287 -6.0286 -5.4679 -5.4676 -4.8606 -4.8598 -4.6359 -4.6352 -4.5746 -4.5733 -4.3452 -4.3441 -4.1250 -4.1246 -3.7775 -3.7760 -3.2458 -3.2455 -3.0825 -3.0797 -2.8867 -2.8852 -2.6018 -2.5993 -2.5161 -2.5135 -2.0732 -2.0728 -1.8522 -1.8495 -1.5440 -1.5361 -1.2569 -1.2503 -1.1461 -1.1424 -1.0535 -1.0385 -0.9821 -0.9603 -0.8868 -0.8770 -0.7704 -0.7641 -0.7428 -0.7376 -0.2604 -0.2553 0.0070 0.0091 0.8224 0.8243 2.2396 2.2414 k = 0.0000-0.1189-0.0150 ( 11653 PWs) bands (ev): -19.6371 -19.6371 -19.3089 -19.3089 -18.6623 -18.6623 -17.9962 -17.9962 -17.3596 -17.3596 -16.2621 -16.2621 -10.4156 -10.4156 -8.5303 -8.5302 -6.5681 -6.5681 -6.0292 -6.0290 -5.4778 -5.4775 -4.8628 -4.8621 -4.6350 -4.6343 -4.5744 -4.5732 -4.3457 -4.3448 -4.1275 -4.1271 -3.7772 -3.7758 -3.2445 -3.2442 -3.0816 -3.0789 -2.8998 -2.8983 -2.5988 -2.5963 -2.5145 -2.5120 -2.0710 -2.0707 -1.8455 -1.8431 -1.5451 -1.5378 -1.2659 -1.2598 -1.1528 -1.1495 -1.0535 -1.0404 -0.9822 -0.9630 -0.8871 -0.8787 -0.7707 -0.7651 -0.7400 -0.7357 -0.2666 -0.2620 0.0104 0.0123 0.8122 0.8138 2.2758 2.2776 k = 0.0000-0.1019-0.0129 ( 11653 PWs) bands (ev): -19.6374 -19.6374 -19.3089 -19.3089 -18.6624 -18.6623 -17.9963 -17.9963 -17.3597 -17.3597 -16.2623 -16.2623 -10.4117 -10.4117 -8.5246 -8.5245 -6.5678 -6.5678 -6.0295 -6.0294 -5.4866 -5.4864 -4.8648 -4.8642 -4.6342 -4.6336 -4.5740 -4.5730 -4.3462 -4.3454 -4.1298 -4.1295 -3.7769 -3.7757 -3.2433 -3.2430 -3.0804 -3.0780 -2.9119 -2.9105 -2.5960 -2.5937 -2.5127 -2.5104 -2.0687 -2.0685 -1.8389 -1.8367 -1.5466 -1.5398 -1.2742 -1.2686 -1.1593 -1.1566 -1.0534 -1.0422 -0.9818 -0.9655 -0.8873 -0.8801 -0.7709 -0.7659 -0.7373 -0.7337 -0.2719 -0.2677 0.0135 0.0151 0.8034 0.8048 2.3092 2.3109 k = 0.0000-0.0849-0.0107 ( 11650 PWs) bands (ev): -19.6376 -19.6376 -19.3090 -19.3090 -18.6624 -18.6624 -17.9963 -17.9963 -17.3597 -17.3597 -16.2624 -16.2624 -10.4084 -10.4084 -8.5197 -8.5196 -6.5675 -6.5675 -6.0299 -6.0298 -5.4942 -5.4940 -4.8666 -4.8661 -4.6335 -4.6330 -4.5735 -4.5727 -4.3466 -4.3459 -4.1318 -4.1315 -3.7766 -3.7756 -3.2422 -3.2420 -3.0791 -3.0770 -2.9227 -2.9214 -2.5937 -2.5915 -2.5109 -2.5088 -2.0665 -2.0663 -1.8326 -1.8307 -1.5482 -1.5422 -1.2814 -1.2765 -1.1654 -1.1632 -1.0531 -1.0439 -0.9813 -0.9677 -0.8873 -0.8814 -0.7709 -0.7667 -0.7349 -0.7319 -0.2762 -0.2727 0.0162 0.0176 0.7960 0.7972 2.3391 2.3407 k = 0.0000-0.0679-0.0086 ( 11651 PWs) bands (ev): -19.6378 -19.6378 -19.3090 -19.3090 -18.6625 -18.6624 -17.9963 -17.9963 -17.3597 -17.3597 -16.2626 -16.2625 -10.4056 -10.4056 -8.5156 -8.5155 -6.5673 -6.5673 -6.0302 -6.0301 -5.5006 -5.5004 -4.8682 -4.8677 -4.6329 -4.6324 -4.5731 -4.5724 -4.3470 -4.3464 -4.1335 -4.1332 -3.7764 -3.7756 -3.2414 -3.2411 -3.0778 -3.0760 -2.9319 -2.9307 -2.5916 -2.5898 -2.5092 -2.5074 -2.0645 -2.0644 -1.8269 -1.8252 -1.5498 -1.5448 -1.2874 -1.2833 -1.1708 -1.1690 -1.0526 -1.0453 -0.9805 -0.9696 -0.8873 -0.8825 -0.7708 -0.7673 -0.7327 -0.7304 -0.2797 -0.2767 0.0186 0.0197 0.7900 0.7910 2.3652 2.3666 k = 0.0000-0.0509-0.0064 ( 11655 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3598 -17.3598 -16.2627 -16.2626 -10.4034 -10.4034 -8.5124 -8.5123 -6.5671 -6.5671 -6.0304 -6.0304 -5.5055 -5.5054 -4.8694 -4.8691 -4.6324 -4.6320 -4.5726 -4.5721 -4.3472 -4.3468 -4.1348 -4.1346 -3.7762 -3.7756 -3.2406 -3.2405 -3.0764 -3.0750 -2.9393 -2.9384 -2.5900 -2.5885 -2.5077 -2.5063 -2.0628 -2.0627 -1.8219 -1.8206 -1.5512 -1.5473 -1.2921 -1.2889 -1.1752 -1.1739 -1.0521 -1.0466 -0.9795 -0.9714 -0.8871 -0.8835 -0.7705 -0.7679 -0.7309 -0.7292 -0.2822 -0.2800 0.0204 0.0213 0.7854 0.7861 2.3866 2.3878 k = 0.0000-0.0340-0.0043 ( 11657 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2627 -16.2627 -10.4018 -10.4018 -8.5100 -8.5100 -6.5670 -6.5670 -6.0306 -6.0306 -5.5091 -5.5091 -4.8703 -4.8700 -4.6320 -4.6318 -4.5723 -4.5719 -4.3474 -4.3471 -4.1357 -4.1356 -3.7760 -3.7756 -3.2401 -3.2400 -3.0753 -3.0743 -2.9448 -2.9441 -2.5887 -2.5877 -2.5065 -2.5056 -2.0616 -2.0615 -1.8181 -1.8172 -1.5522 -1.5495 -1.2953 -1.2932 -1.1784 -1.1775 -1.0515 -1.0478 -0.9784 -0.9731 -0.8868 -0.8844 -0.7702 -0.7684 -0.7295 -0.7284 -0.2839 -0.2824 0.0218 0.0224 0.7822 0.7827 2.4028 2.4036 k = 0.0000-0.0170-0.0021 ( 11662 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4009 -10.4009 -8.5086 -8.5086 -6.5669 -6.5669 -6.0307 -6.0307 -5.5113 -5.5113 -4.8708 -4.8707 -4.6317 -4.6316 -4.5720 -4.5718 -4.3474 -4.3473 -4.1363 -4.1363 -3.7759 -3.7757 -3.2398 -3.2397 -3.0744 -3.0739 -2.9481 -2.9477 -2.5878 -2.5873 -2.5057 -2.5052 -2.0608 -2.0608 -1.8155 -1.8151 -1.5527 -1.5513 -1.2971 -1.2960 -1.1802 -1.1798 -1.0507 -1.0489 -0.9772 -0.9746 -0.8864 -0.8852 -0.7698 -0.7689 -0.7286 -0.7280 -0.2848 -0.2840 0.0227 0.0230 0.7803 0.7805 2.4129 2.4134 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k = 0.0147 0.0085 0.0021 ( 11662 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5082 -8.5082 -6.5671 -6.5671 -6.0310 -6.0310 -5.5121 -5.5120 -4.8710 -4.8709 -4.6323 -4.6319 -4.5720 -4.5715 -4.3476 -4.3474 -4.1365 -4.1363 -3.7760 -3.7759 -3.2398 -3.2398 -3.0739 -3.0738 -2.9491 -2.9489 -2.5896 -2.5881 -2.5047 -2.5030 -2.0606 -2.0603 -1.8155 -1.8149 -1.5529 -1.5515 -1.2975 -1.2965 -1.1811 -1.1803 -1.0509 -1.0487 -0.9770 -0.9750 -0.8882 -0.8832 -0.7731 -0.7671 -0.7292 -0.7250 -0.2859 -0.2852 0.0259 0.0265 0.7815 0.7816 2.4165 2.4167 k = 0.0294 0.0170 0.0043 ( 11657 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3599 -17.3599 -16.2627 -16.2627 -10.4005 -10.4005 -8.5085 -8.5085 -6.5679 -6.5679 -6.0317 -6.0317 -5.5121 -5.5120 -4.8711 -4.8709 -4.6340 -4.6331 -4.5719 -4.5710 -4.3479 -4.3476 -4.1364 -4.1359 -3.7764 -3.7763 -3.2403 -3.2401 -3.0738 -3.0737 -2.9491 -2.9487 -2.5942 -2.5915 -2.5015 -2.4984 -2.0605 -2.0601 -1.8179 -1.8166 -1.5532 -1.5503 -1.2971 -1.2952 -1.1813 -1.1797 -1.0518 -1.0475 -0.9781 -0.9742 -0.8904 -0.8804 -0.7778 -0.7669 -0.7280 -0.7205 -0.2884 -0.2871 0.0346 0.0358 0.7869 0.7870 2.4165 2.4168 k = 0.0441 0.0255 0.0064 ( 11654 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9961 -17.9961 -17.3600 -17.3600 -16.2627 -16.2627 -10.4005 -10.4005 -8.5089 -8.5089 -6.5692 -6.5691 -6.0330 -6.0329 -5.5122 -5.5120 -4.8713 -4.8709 -4.6365 -4.6353 -4.5716 -4.5704 -4.3484 -4.3479 -4.1361 -4.1354 -3.7772 -3.7771 -3.2410 -3.2408 -3.0735 -3.0734 -2.9491 -2.9485 -2.6005 -2.5970 -2.4963 -2.4922 -2.0603 -2.0597 -1.8215 -1.8195 -1.5531 -1.5490 -1.2961 -1.2935 -1.1813 -1.1791 -1.0526 -1.0462 -0.9792 -0.9735 -0.8922 -0.8775 -0.7830 -0.7682 -0.7247 -0.7151 -0.2922 -0.2903 0.0490 0.0509 0.7959 0.7961 2.4165 2.4170 k = 0.0588 0.0340 0.0086 ( 11652 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9959 -17.9959 -17.3601 -17.3601 -16.2626 -16.2626 -10.4004 -10.4004 -8.5096 -8.5095 -6.5710 -6.5709 -6.0346 -6.0345 -5.5123 -5.5121 -4.8715 -4.8710 -4.6398 -4.6383 -4.5712 -4.5698 -4.3490 -4.3483 -4.1357 -4.1347 -3.7782 -3.7781 -3.2419 -3.2417 -3.0732 -3.0730 -2.9491 -2.9483 -2.6077 -2.6039 -2.4897 -2.4849 -2.0601 -2.0593 -1.8262 -1.8236 -1.5528 -1.5475 -1.2946 -1.2914 -1.1809 -1.1783 -1.0532 -1.0448 -0.9804 -0.9729 -0.8937 -0.8746 -0.7881 -0.7705 -0.7202 -0.7092 -0.2968 -0.2945 0.0689 0.0712 0.8086 0.8088 2.4166 2.4171 k = 0.0735 0.0425 0.0107 ( 11650 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6624 -18.6624 -17.9957 -17.9957 -17.3603 -17.3603 -16.2626 -16.2625 -10.4003 -10.4003 -8.5103 -8.5103 -6.5732 -6.5731 -6.0367 -6.0366 -5.5124 -5.5121 -4.8719 -4.8712 -4.6439 -4.6421 -4.5707 -4.5691 -4.3498 -4.3489 -4.1351 -4.1339 -3.7796 -3.7794 -3.2432 -3.2429 -3.0728 -3.0726 -2.9492 -2.9483 -2.6154 -2.6113 -2.4822 -2.4770 -2.0598 -2.0588 -1.8317 -1.8286 -1.5521 -1.5458 -1.2928 -1.2891 -1.1802 -1.1773 -1.0537 -1.0434 -0.9814 -0.9725 -0.8948 -0.8718 -0.7932 -0.7733 -0.7150 -0.7032 -0.3021 -0.2994 0.0937 0.0965 0.8247 0.8251 2.4166 2.4172 k = 0.0882 0.0509 0.0129 ( 11652 PWs) bands (ev): -19.6378 -19.6378 -19.3090 -19.3090 -18.6624 -18.6624 -17.9954 -17.9954 -17.3605 -17.3605 -16.2625 -16.2624 -10.4002 -10.4002 -8.5113 -8.5112 -6.5760 -6.5759 -6.0392 -6.0391 -5.5126 -5.5122 -4.8723 -4.8715 -4.6485 -4.6465 -4.5702 -4.5684 -4.3506 -4.3496 -4.1344 -4.1330 -3.7812 -3.7809 -3.2446 -3.2443 -3.0724 -3.0721 -2.9497 -2.9485 -2.6230 -2.6188 -2.4743 -2.4688 -2.0596 -2.0584 -1.8378 -1.8342 -1.5511 -1.5441 -1.2907 -1.2867 -1.1790 -1.1760 -1.0540 -1.0420 -0.9824 -0.9721 -0.8957 -0.8692 -0.7979 -0.7762 -0.7095 -0.6972 -0.3077 -0.3048 0.1231 0.1263 0.8445 0.8449 2.4165 2.4173 k = 0.1029 0.0594 0.0150 ( 11652 PWs) bands (ev): -19.6377 -19.6377 -19.3089 -19.3089 -18.6624 -18.6624 -17.9950 -17.9950 -17.3607 -17.3607 -16.2623 -16.2623 -10.4001 -10.4001 -8.5123 -8.5123 -6.5792 -6.5791 -6.0421 -6.0419 -5.5127 -5.5123 -4.8729 -4.8720 -4.6537 -4.6516 -4.5697 -4.5678 -4.3517 -4.3505 -4.1336 -4.1321 -3.7830 -3.7827 -3.2464 -3.2459 -3.0719 -3.0716 -2.9504 -2.9492 -2.6301 -2.6260 -2.4662 -2.4605 -2.0594 -2.0580 -1.8442 -1.8403 -1.5499 -1.5423 -1.2884 -1.2842 -1.1774 -1.1744 -1.0542 -1.0405 -0.9833 -0.9718 -0.8963 -0.8669 -0.8022 -0.7790 -0.7040 -0.6914 -0.3135 -0.3104 0.1566 0.1602 0.8678 0.8683 2.4164 2.4173 k = 0.1176 0.0679 0.0171 ( 11658 PWs) bands (ev): -19.6375 -19.6375 -19.3089 -19.3089 -18.6623 -18.6623 -17.9947 -17.9947 -17.3610 -17.3610 -16.2622 -16.2622 -10.4000 -10.3999 -8.5136 -8.5135 -6.5828 -6.5827 -6.0453 -6.0451 -5.5129 -5.5124 -4.8736 -4.8726 -4.6593 -4.6571 -4.5692 -4.5672 -4.3528 -4.3515 -4.1327 -4.1310 -3.7851 -3.7848 -3.2483 -3.2478 -3.0715 -3.0711 -2.9517 -2.9503 -2.6364 -2.6324 -2.4580 -2.4522 -2.0593 -2.0577 -1.8508 -1.8465 -1.5485 -1.5405 -1.2861 -1.2817 -1.1753 -1.1722 -1.0541 -1.0391 -0.9842 -0.9714 -0.8967 -0.8649 -0.8061 -0.7817 -0.6987 -0.6858 -0.3194 -0.3162 0.1939 0.1977 0.8945 0.8952 2.4162 2.4171 k = 0.1324 0.0764 0.0193 ( 11652 PWs) bands (ev): -19.6374 -19.6374 -19.3089 -19.3089 -18.6622 -18.6622 -17.9942 -17.9942 -17.3613 -17.3613 -16.2621 -16.2620 -10.3998 -10.3998 -8.5149 -8.5148 -6.5868 -6.5867 -6.0487 -6.0485 -5.5131 -5.5125 -4.8745 -4.8734 -4.6653 -4.6630 -4.5688 -4.5668 -4.3540 -4.3527 -4.1317 -4.1299 -3.7874 -3.7870 -3.2505 -3.2499 -3.0711 -3.0707 -2.9537 -2.9521 -2.6417 -2.6379 -2.4499 -2.4440 -2.0594 -2.0577 -1.8571 -1.8525 -1.5469 -1.5386 -1.2839 -1.2791 -1.1728 -1.1695 -1.0539 -1.0376 -0.9848 -0.9711 -0.8970 -0.8633 -0.8095 -0.7841 -0.6937 -0.6807 -0.3252 -0.3219 0.2345 0.2386 0.9247 0.9256 2.4158 2.4168 k = 0.1471 0.0849 0.0214 ( 11641 PWs) bands (ev): -19.6372 -19.6372 -19.3089 -19.3088 -18.6622 -18.6622 -17.9938 -17.9938 -17.3616 -17.3616 -16.2619 -16.2619 -10.3996 -10.3996 -8.5164 -8.5163 -6.5913 -6.5911 -6.0524 -6.0522 -5.5132 -5.5126 -4.8756 -4.8744 -4.6715 -4.6692 -4.5685 -4.5665 -4.3554 -4.3540 -4.1307 -4.1288 -3.7898 -3.7894 -3.2528 -3.2522 -3.0709 -3.0704 -2.9563 -2.9546 -2.6458 -2.6421 -2.4419 -2.4360 -2.0598 -2.0580 -1.8631 -1.8582 -1.5451 -1.5368 -1.2818 -1.2764 -1.1701 -1.1662 -1.0535 -1.0360 -0.9854 -0.9706 -0.8970 -0.8621 -0.8123 -0.7863 -0.6890 -0.6759 -0.3309 -0.3275 0.2781 0.2823 0.9582 0.9593 2.4153 2.4163 k = 0.1618 0.0934 0.0236 ( 11638 PWs) bands (ev): -19.6371 -19.6371 -19.3088 -19.3088 -18.6621 -18.6621 -17.9933 -17.9933 -17.3619 -17.3619 -16.2617 -16.2617 -10.3995 -10.3994 -8.5179 -8.5178 -6.5961 -6.5959 -6.0562 -6.0560 -5.5134 -5.5127 -4.8770 -4.8757 -4.6779 -4.6756 -4.5682 -4.5662 -4.3568 -4.3553 -4.1297 -4.1276 -3.7924 -3.7920 -3.2554 -3.2547 -3.0709 -3.0703 -2.9597 -2.9579 -2.6484 -2.6450 -2.4341 -2.4282 -2.0607 -2.0586 -1.8683 -1.8633 -1.5432 -1.5349 -1.2797 -1.2735 -1.1671 -1.1625 -1.0529 -1.0345 -0.9859 -0.9701 -0.8970 -0.8613 -0.8145 -0.7883 -0.6847 -0.6717 -0.3364 -0.3330 0.3242 0.3286 0.9951 0.9964 2.4147 2.4157 k = 0.1765 0.1019 0.0257 ( 11633 PWs) bands (ev): -19.6369 -19.6369 -19.3088 -19.3088 -18.6620 -18.6620 -17.9927 -17.9927 -17.3623 -17.3623 -16.2616 -16.2615 -10.3993 -10.3992 -8.5195 -8.5194 -6.6012 -6.6010 -6.0601 -6.0600 -5.5135 -5.5128 -4.8787 -4.8773 -4.6844 -4.6822 -4.5681 -4.5661 -4.3583 -4.3568 -4.1287 -4.1265 -3.7952 -3.7947 -3.2581 -3.2574 -3.0711 -3.0705 -2.9638 -2.9619 -2.6496 -2.6463 -2.4266 -2.4206 -2.0619 -2.0598 -1.8728 -1.8675 -1.5412 -1.5331 -1.2777 -1.2705 -1.1639 -1.1584 -1.0521 -1.0330 -0.9862 -0.9694 -0.8969 -0.8610 -0.8161 -0.7901 -0.6808 -0.6679 -0.3416 -0.3382 0.3724 0.3770 1.0351 1.0366 2.4138 2.4149 k = 0.1912 0.1104 0.0279 ( 11623 PWs) bands (ev): -19.6367 -19.6367 -19.3087 -19.3087 -18.6620 -18.6620 -17.9922 -17.9922 -17.3627 -17.3627 -16.2614 -16.2613 -10.3991 -10.3990 -8.5213 -8.5211 -6.6065 -6.6064 -6.0642 -6.0640 -5.5137 -5.5129 -4.8807 -4.8793 -4.6909 -4.6887 -4.5680 -4.5661 -4.3599 -4.3583 -4.1277 -4.1254 -3.7980 -3.7975 -3.2610 -3.2602 -3.0716 -3.0709 -2.9685 -2.9665 -2.6492 -2.6461 -2.4193 -2.4134 -2.0637 -2.0614 -1.8762 -1.8708 -1.5391 -1.5312 -1.2755 -1.2673 -1.1605 -1.1542 -1.0510 -1.0315 -0.9863 -0.9686 -0.8968 -0.8611 -0.8173 -0.7916 -0.6773 -0.6645 -0.3466 -0.3432 0.4225 0.4271 1.0782 1.0799 2.4128 2.4138 k = 0.2059 0.1189 0.0300 ( 11628 PWs) bands (ev): -19.6365 -19.6365 -19.3087 -19.3087 -18.6619 -18.6619 -17.9916 -17.9916 -17.3631 -17.3631 -16.2612 -16.2611 -10.3989 -10.3988 -8.5230 -8.5229 -6.6122 -6.6120 -6.0683 -6.0681 -5.5138 -5.5130 -4.8830 -4.8815 -4.6973 -4.6952 -4.5680 -4.5661 -4.3616 -4.3600 -4.1267 -4.1244 -3.8009 -3.8004 -3.2640 -3.2632 -3.0726 -3.0718 -2.9736 -2.9716 -2.6474 -2.6445 -2.4124 -2.4066 -2.0660 -2.0636 -1.8784 -1.8731 -1.5370 -1.5295 -1.2731 -1.2637 -1.1571 -1.1499 -1.0498 -1.0300 -0.9863 -0.9676 -0.8965 -0.8614 -0.8179 -0.7929 -0.6742 -0.6617 -0.3513 -0.3480 0.4739 0.4786 1.1241 1.1261 2.4116 2.4127 k = 0.2206 0.1274 0.0322 ( 11624 PWs) bands (ev): -19.6363 -19.6363 -19.3087 -19.3086 -18.6618 -18.6618 -17.9910 -17.9910 -17.3635 -17.3635 -16.2610 -16.2609 -10.3986 -10.3986 -8.5248 -8.5247 -6.6180 -6.6178 -6.0723 -6.0721 -5.5139 -5.5131 -4.8857 -4.8841 -4.7036 -4.7016 -4.5680 -4.5663 -4.3633 -4.3617 -4.1258 -4.1235 -3.8039 -3.8034 -3.2671 -3.2663 -3.0742 -3.0732 -2.9789 -2.9769 -2.6443 -2.6415 -2.4059 -2.4001 -2.0688 -2.0664 -1.8795 -1.8742 -1.5349 -1.5277 -1.2704 -1.2598 -1.1537 -1.1456 -1.0484 -1.0285 -0.9860 -0.9664 -0.8963 -0.8620 -0.8182 -0.7941 -0.6715 -0.6592 -0.3557 -0.3525 0.5263 0.5311 1.1728 1.1750 2.4103 2.4113 k = 0.2353 0.1358 0.0343 ( 11622 PWs) bands (ev): -19.6361 -19.6361 -19.3086 -19.3086 -18.6617 -18.6617 -17.9904 -17.9904 -17.3639 -17.3639 -16.2608 -16.2607 -10.3984 -10.3984 -8.5267 -8.5265 -6.6239 -6.6238 -6.0763 -6.0761 -5.5140 -5.5132 -4.8887 -4.8871 -4.7097 -4.7078 -4.5681 -4.5665 -4.3650 -4.3634 -4.1249 -4.1226 -3.8069 -3.8063 -3.2704 -3.2695 -3.0763 -3.0753 -2.9842 -2.9822 -2.6400 -2.6373 -2.3998 -2.3941 -2.0722 -2.0697 -1.8794 -1.8742 -1.5328 -1.5261 -1.2672 -1.2555 -1.1504 -1.1416 -1.0468 -1.0270 -0.9856 -0.9650 -0.8960 -0.8628 -0.8181 -0.7950 -0.6691 -0.6572 -0.3598 -0.3566 0.5794 0.5841 1.2239 1.2263 2.4088 2.4098 k = 0.2500 0.1443 0.0364 ( 11624 PWs) bands (ev): -19.6359 -19.6359 -19.3086 -19.3085 -18.6616 -18.6616 -17.9898 -17.9897 -17.3643 -17.3643 -16.2606 -16.2605 -10.3982 -10.3982 -8.5285 -8.5284 -6.6300 -6.6298 -6.0803 -6.0801 -5.5140 -5.5132 -4.8921 -4.8904 -4.7155 -4.7137 -4.5683 -4.5667 -4.3668 -4.3652 -4.1241 -4.1218 -3.8098 -3.8093 -3.2737 -3.2728 -3.0791 -3.0780 -2.9893 -2.9872 -2.6346 -2.6321 -2.3941 -2.3885 -2.0759 -2.0734 -1.8782 -1.8731 -1.5308 -1.5246 -1.2636 -1.2506 -1.1473 -1.1378 -1.0450 -1.0256 -0.9849 -0.9635 -0.8956 -0.8636 -0.8178 -0.7959 -0.6670 -0.6556 -0.3636 -0.3605 0.6327 0.6374 1.2772 1.2798 2.4071 2.4081 k = 0.2647 0.1528 0.0386 ( 11632 PWs) bands (ev): -19.6357 -19.6357 -19.3085 -19.3085 -18.6615 -18.6615 -17.9891 -17.9891 -17.3647 -17.3647 -16.2604 -16.2603 -10.3980 -10.3980 -8.5303 -8.5302 -6.6361 -6.6359 -6.0841 -6.0839 -5.5141 -5.5132 -4.8957 -4.8941 -4.7210 -4.7193 -4.5685 -4.5671 -4.3685 -4.3670 -4.1234 -4.1212 -3.8127 -3.8122 -3.2771 -3.2762 -3.0827 -3.0815 -2.9938 -2.9918 -2.6285 -2.6260 -2.3889 -2.3834 -2.0800 -2.0775 -1.8760 -1.8711 -1.5289 -1.5232 -1.2593 -1.2453 -1.1444 -1.1343 -1.0432 -1.0241 -0.9840 -0.9618 -0.8952 -0.8645 -0.8173 -0.7966 -0.6652 -0.6543 -0.3671 -0.3640 0.6860 0.6906 1.3323 1.3350 2.4053 2.4062 k = 0.2794 0.1613 0.0407 ( 11621 PWs) bands (ev): -19.6355 -19.6355 -19.3085 -19.3085 -18.6615 -18.6615 -17.9885 -17.9885 -17.3652 -17.3651 -16.2602 -16.2601 -10.3978 -10.3977 -8.5321 -8.5320 -6.6421 -6.6420 -6.0878 -6.0876 -5.5141 -5.5132 -4.8996 -4.8980 -4.7261 -4.7245 -4.5688 -4.5674 -4.3703 -4.3688 -4.1228 -4.1206 -3.8156 -3.8150 -3.2805 -3.2796 -3.0869 -3.0857 -2.9977 -2.9958 -2.6217 -2.6192 -2.3843 -2.3789 -2.0843 -2.0818 -1.8729 -1.8682 -1.5271 -1.5220 -1.2546 -1.2395 -1.1417 -1.1312 -1.0413 -1.0228 -0.9829 -0.9600 -0.8947 -0.8654 -0.8166 -0.7972 -0.6637 -0.6533 -0.3701 -0.3672 0.7389 0.7434 1.3887 1.3916 2.4032 2.4042 k = 0.2941 0.1698 0.0429 ( 11624 PWs) bands (ev): -19.6353 -19.6353 -19.3084 -19.3084 -18.6614 -18.6614 -17.9879 -17.9879 -17.3656 -17.3656 -16.2600 -16.2599 -10.3975 -10.3975 -8.5339 -8.5338 -6.6481 -6.6480 -6.0913 -6.0911 -5.5140 -5.5132 -4.9038 -4.9022 -4.7309 -4.7293 -4.5691 -4.5678 -4.3720 -4.3706 -4.1223 -4.1201 -3.8184 -3.8178 -3.2840 -3.2831 -3.0917 -3.0905 -3.0009 -2.9991 -2.6144 -2.6120 -2.3802 -2.3750 -2.0887 -2.0862 -1.8691 -1.8646 -1.5256 -1.5209 -1.2492 -1.2332 -1.1393 -1.1284 -1.0395 -1.0215 -0.9815 -0.9580 -0.8941 -0.8661 -0.8158 -0.7977 -0.6624 -0.6525 -0.3729 -0.3701 0.7911 0.7955 1.4461 1.4491 2.4008 2.4017 k = 0.3088 0.1783 0.0450 ( 11628 PWs) bands (ev): -19.6351 -19.6351 -19.3084 -19.3084 -18.6613 -18.6613 -17.9873 -17.9873 -17.3660 -17.3660 -16.2598 -16.2597 -10.3973 -10.3973 -8.5356 -8.5355 -6.6540 -6.6539 -6.0947 -6.0945 -5.5140 -5.5132 -4.9081 -4.9066 -4.7352 -4.7338 -4.5694 -4.5682 -4.3737 -4.3724 -4.1218 -4.1198 -3.8210 -3.8205 -3.2874 -3.2866 -3.0970 -3.0959 -3.0035 -3.0018 -2.6068 -2.6045 -2.3767 -2.3716 -2.0931 -2.0906 -1.8647 -1.8605 -1.5242 -1.5201 -1.2433 -1.2264 -1.1372 -1.1261 -1.0377 -1.0203 -0.9798 -0.9559 -0.8934 -0.8669 -0.8149 -0.7981 -0.6613 -0.6521 -0.3753 -0.3726 0.8423 0.8465 1.5038 1.5069 2.3976 2.3986 k = 0.3235 0.1868 0.0472 ( 11633 PWs) bands (ev): -19.6349 -19.6349 -19.3084 -19.3083 -18.6612 -18.6612 -17.9868 -17.9868 -17.3664 -17.3664 -16.2596 -16.2595 -10.3971 -10.3971 -8.5373 -8.5372 -6.6597 -6.6596 -6.0978 -6.0976 -5.5139 -5.5131 -4.9125 -4.9110 -4.7391 -4.7378 -4.5697 -4.5686 -4.3754 -4.3741 -4.1215 -4.1195 -3.8236 -3.8230 -3.2909 -3.2900 -3.1026 -3.1015 -3.0054 -3.0039 -2.5991 -2.5969 -2.3737 -2.3689 -2.0973 -2.0950 -1.8598 -1.8559 -1.5231 -1.5195 -1.2369 -1.2193 -1.1353 -1.1240 -1.0361 -1.0193 -0.9779 -0.9539 -0.8927 -0.8675 -0.8139 -0.7984 -0.6604 -0.6518 -0.3774 -0.3748 0.8921 0.8962 1.5614 1.5645 2.3923 2.3935 k = 0.3382 0.1953 0.0493 ( 11631 PWs) bands (ev): -19.6347 -19.6347 -19.3083 -19.3083 -18.6611 -18.6611 -17.9862 -17.9862 -17.3667 -17.3667 -16.2594 -16.2593 -10.3969 -10.3969 -8.5389 -8.5388 -6.6652 -6.6651 -6.1007 -6.1006 -5.5138 -5.5131 -4.9170 -4.9155 -4.7427 -4.7415 -4.5701 -4.5690 -4.3770 -4.3757 -4.1212 -4.1193 -3.8259 -3.8254 -3.2942 -3.2933 -3.1082 -3.1072 -3.0068 -3.0054 -2.5914 -2.5892 -2.3713 -2.3667 -2.1014 -2.0991 -1.8547 -1.8512 -1.5222 -1.5190 -1.2300 -1.2119 -1.1336 -1.1224 -1.0346 -1.0185 -0.9758 -0.9519 -0.8917 -0.8680 -0.8128 -0.7987 -0.6596 -0.6517 -0.3791 -0.3767 0.9402 0.9441 1.6180 1.6212 2.3789 2.3807 k = 0.3529 0.2038 0.0514 ( 11632 PWs) bands (ev): -19.6346 -19.6346 -19.3083 -19.3083 -18.6611 -18.6611 -17.9857 -17.9857 -17.3671 -17.3671 -16.2592 -16.2592 -10.3967 -10.3967 -8.5403 -8.5402 -6.6704 -6.6703 -6.1034 -6.1033 -5.5137 -5.5130 -4.9214 -4.9200 -4.7458 -4.7447 -4.5704 -4.5695 -4.3785 -4.3773 -4.1209 -4.1192 -3.8281 -3.8276 -3.2974 -3.2966 -3.1138 -3.1129 -3.0078 -3.0066 -2.5838 -2.5817 -2.3694 -2.3650 -2.1052 -2.1031 -1.8495 -1.8463 -1.5216 -1.5188 -1.2229 -1.2045 -1.1321 -1.1210 -1.0333 -1.0179 -0.9734 -0.9500 -0.8906 -0.8685 -0.8117 -0.7989 -0.6590 -0.6518 -0.3805 -0.3782 0.9863 0.9900 1.6732 1.6764 2.3475 2.3506 k = 0.3676 0.2123 0.0536 ( 11627 PWs) bands (ev): -19.6344 -19.6344 -19.3083 -19.3082 -18.6610 -18.6610 -17.9852 -17.9852 -17.3674 -17.3674 -16.2590 -16.2590 -10.3966 -10.3965 -8.5417 -8.5416 -6.6752 -6.6751 -6.1059 -6.1057 -5.5136 -5.5129 -4.9256 -4.9244 -4.7486 -4.7476 -4.5707 -4.5699 -4.3799 -4.3788 -4.1208 -4.1192 -3.8302 -3.8297 -3.3005 -3.2997 -3.1192 -3.1184 -3.0085 -3.0074 -2.5765 -2.5745 -2.3680 -2.3639 -2.1086 -2.1067 -1.8443 -1.8414 -1.5211 -1.5187 -1.2155 -1.1971 -1.1308 -1.1198 -1.0322 -1.0175 -0.9709 -0.9484 -0.8894 -0.8689 -0.8105 -0.7991 -0.6584 -0.6520 -0.3816 -0.3795 1.0300 1.0334 1.7260 1.7293 2.3079 2.3119 k = 0.3824 0.2208 0.0557 ( 11635 PWs) bands (ev): -19.6343 -19.6343 -19.3082 -19.3082 -18.6609 -18.6609 -17.9848 -17.9848 -17.3677 -17.3677 -16.2589 -16.2589 -10.3964 -10.3964 -8.5430 -8.5429 -6.6797 -6.6796 -6.1081 -6.1080 -5.5134 -5.5128 -4.9297 -4.9285 -4.7510 -4.7501 -4.5710 -4.5703 -4.3811 -4.3802 -4.1206 -4.1192 -3.8320 -3.8316 -3.3034 -3.3027 -3.1242 -3.1235 -3.0089 -3.0079 -2.5695 -2.5677 -2.3670 -2.3633 -2.1117 -2.1099 -1.8393 -1.8367 -1.5209 -1.5188 -1.2082 -1.1901 -1.1295 -1.1189 -1.0312 -1.0174 -0.9684 -0.9470 -0.8880 -0.8693 -0.8093 -0.7992 -0.6580 -0.6522 -0.3824 -0.3805 1.0708 1.0740 1.7758 1.7791 2.2687 2.2734 k = 0.3971 0.2292 0.0579 ( 11640 PWs) bands (ev): -19.6341 -19.6341 -19.3082 -19.3082 -18.6609 -18.6609 -17.9844 -17.9844 -17.3680 -17.3680 -16.2588 -16.2587 -10.3963 -10.3962 -8.5441 -8.5440 -6.6837 -6.6837 -6.1101 -6.1100 -5.5133 -5.5127 -4.9334 -4.9324 -4.7531 -4.7523 -4.5713 -4.5706 -4.3823 -4.3815 -4.1206 -4.1193 -3.8336 -3.8332 -3.3061 -3.3054 -3.1288 -3.1282 -3.0092 -3.0083 -2.5630 -2.5613 -2.3664 -2.3630 -2.1144 -2.1128 -1.8345 -1.8323 -1.5208 -1.5191 -1.2010 -1.1836 -1.1283 -1.1181 -1.0304 -1.0175 -0.9658 -0.9460 -0.8864 -0.8696 -0.8081 -0.7993 -0.6576 -0.6526 -0.3830 -0.3813 1.1085 1.1114 1.8217 1.8252 2.2322 2.2375 k = 0.4118 0.2377 0.0600 ( 11640 PWs) bands (ev): -19.6340 -19.6340 -19.3082 -19.3082 -18.6608 -18.6608 -17.9840 -17.9840 -17.3683 -17.3682 -16.2586 -16.2586 -10.3961 -10.3961 -8.5451 -8.5450 -6.6873 -6.6873 -6.1118 -6.1117 -5.5131 -5.5127 -4.9368 -4.9359 -4.7548 -4.7542 -4.5715 -4.5710 -4.3833 -4.3826 -4.1205 -4.1194 -3.8350 -3.8347 -3.3085 -3.3079 -3.1328 -3.1323 -3.0093 -3.0086 -2.5572 -2.5556 -2.3661 -2.3631 -2.1168 -2.1154 -1.8301 -1.8282 -1.5208 -1.5194 -1.1941 -1.1778 -1.1270 -1.1176 -1.0296 -1.0179 -0.9632 -0.9454 -0.8847 -0.8700 -0.8069 -0.7995 -0.6572 -0.6530 -0.3834 -0.3818 1.1424 1.1450 1.8629 1.8667 2.1994 2.2053 k = 0.4265 0.2462 0.0622 ( 11627 PWs) bands (ev): -19.6339 -19.6339 -19.3082 -19.3081 -18.6608 -18.6608 -17.9837 -17.9837 -17.3685 -17.3685 -16.2585 -16.2585 -10.3960 -10.3960 -8.5460 -8.5459 -6.6904 -6.6904 -6.1132 -6.1131 -5.5130 -5.5126 -4.9398 -4.9390 -4.7563 -4.7557 -4.5717 -4.5713 -4.3842 -4.3836 -4.1205 -4.1195 -3.8362 -3.8360 -3.3105 -3.3100 -3.1363 -3.1359 -3.0093 -3.0087 -2.5519 -2.5506 -2.3660 -2.3635 -2.1187 -2.1175 -1.8262 -1.8247 -1.5209 -1.5197 -1.1877 -1.1730 -1.1256 -1.1171 -1.0288 -1.0186 -0.9606 -0.9452 -0.8828 -0.8704 -0.8057 -0.7996 -0.6569 -0.6534 -0.3835 -0.3822 1.1722 1.1745 1.8987 1.9029 2.1711 2.1774 k = 0.4412 0.2547 0.0643 ( 11634 PWs) bands (ev): -19.6338 -19.6338 -19.3081 -19.3081 -18.6608 -18.6608 -17.9835 -17.9835 -17.3686 -17.3686 -16.2584 -16.2584 -10.3959 -10.3959 -8.5467 -8.5466 -6.6930 -6.6930 -6.1144 -6.1143 -5.5129 -5.5125 -4.9423 -4.9417 -4.7574 -4.7570 -4.5719 -4.5715 -4.3849 -4.3844 -4.1204 -4.1197 -3.8372 -3.8370 -3.3123 -3.3119 -3.1392 -3.1389 -3.0093 -3.0088 -2.5475 -2.5464 -2.3661 -2.3640 -2.1202 -2.1192 -1.8229 -1.8216 -1.5210 -1.5201 -1.1819 -1.1694 -1.1242 -1.1169 -1.0281 -1.0194 -0.9581 -0.9454 -0.8810 -0.8710 -0.8046 -0.7998 -0.6566 -0.6538 -0.3836 -0.3825 1.1975 1.1994 1.9285 1.9329 2.1479 2.1543 k = 0.4559 0.2632 0.0665 ( 11636 PWs) bands (ev): -19.6338 -19.6338 -19.3081 -19.3081 -18.6607 -18.6607 -17.9833 -17.9833 -17.3688 -17.3688 -16.2584 -16.2584 -10.3958 -10.3958 -8.5472 -8.5472 -6.6951 -6.6950 -6.1153 -6.1153 -5.5128 -5.5125 -4.9442 -4.9438 -4.7583 -4.7580 -4.5720 -4.5717 -4.3855 -4.3851 -4.1204 -4.1198 -3.8380 -3.8378 -3.3137 -3.3134 -3.1415 -3.1413 -3.0093 -3.0089 -2.5439 -2.5430 -2.3661 -2.3645 -2.1214 -2.1206 -1.8202 -1.8193 -1.5211 -1.5205 -1.1768 -1.1670 -1.1226 -1.1169 -1.0272 -1.0205 -0.9558 -0.9460 -0.8793 -0.8716 -0.8036 -0.8000 -0.6563 -0.6543 -0.3836 -0.3827 1.2177 1.2192 1.9517 1.9561 2.1303 2.1363 k = 0.4706 0.2717 0.0686 ( 11641 PWs) bands (ev): -19.6337 -19.6337 -19.3081 -19.3081 -18.6607 -18.6607 -17.9831 -17.9831 -17.3689 -17.3689 -16.2583 -16.2583 -10.3958 -10.3958 -8.5476 -8.5476 -6.6965 -6.6965 -6.1160 -6.1160 -5.5127 -5.5125 -4.9457 -4.9453 -4.7589 -4.7587 -4.5721 -4.5719 -4.3858 -4.3856 -4.1203 -4.1199 -3.8385 -3.8384 -3.3147 -3.3144 -3.1431 -3.1430 -3.0092 -3.0089 -2.5412 -2.5406 -2.3662 -2.3651 -2.1221 -2.1216 -1.8182 -1.8175 -1.5212 -1.5208 -1.1726 -1.1658 -1.1211 -1.1171 -1.0263 -1.0216 -0.9535 -0.9469 -0.8776 -0.8725 -0.8027 -0.8003 -0.6561 -0.6547 -0.3835 -0.3829 1.2326 1.2336 1.9683 1.9720 2.1186 2.1234 k = 0.4853 0.2802 0.0707 ( 11646 PWs) bands (ev): -19.6337 -19.6337 -19.3081 -19.3081 -18.6607 -18.6607 -17.9830 -17.9830 -17.3689 -17.3689 -16.2583 -16.2583 -10.3958 -10.3958 -8.5479 -8.5479 -6.6974 -6.6974 -6.1164 -6.1164 -5.5126 -5.5125 -4.9465 -4.9463 -4.7592 -4.7591 -4.5721 -4.5720 -4.3860 -4.3859 -4.1202 -4.1201 -3.8389 -3.8388 -3.3152 -3.3151 -3.1441 -3.1440 -3.0091 -3.0090 -2.5395 -2.5392 -2.3661 -2.3656 -2.1225 -2.1223 -1.8169 -1.8166 -1.5212 -1.5210 -1.1693 -1.1658 -1.1197 -1.1177 -1.0252 -1.0228 -0.9515 -0.9482 -0.8760 -0.8735 -0.8019 -0.8007 -0.6557 -0.6550 -0.3833 -0.3831 1.2417 1.2422 1.9785 1.9807 2.1127 2.1154 k = 0.5000 0.2887 0.0729 ( 11648 PWs) bands (ev): -19.6337 -19.6337 -19.3081 -19.3081 -18.6607 -18.6607 -17.9830 -17.9830 -17.3690 -17.3690 -16.2583 -16.2583 -10.3957 -10.3957 -8.5479 -8.5479 -6.6977 -6.6977 -6.1165 -6.1165 -5.5125 -5.5125 -4.9467 -4.9467 -4.7593 -4.7593 -4.5721 -4.5721 -4.3861 -4.3861 -4.1202 -4.1202 -3.8389 -3.8389 -3.3154 -3.3154 -3.1444 -3.1444 -3.0091 -3.0091 -2.5388 -2.5388 -2.3659 -2.3659 -2.1226 -2.1226 -1.8163 -1.8163 -1.5212 -1.5212 -1.1670 -1.1670 -1.1186 -1.1186 -1.0241 -1.0241 -0.9497 -0.9497 -0.8747 -0.8747 -0.8013 -0.8013 -0.6554 -0.6554 -0.3832 -0.3832 1.2450 1.2450 1.9827 1.9827 2.1118 2.1118 k = 0.5000-0.2887-0.0000 ( 11658 PWs) bands (ev): -19.6296 -19.6296 -19.3053 -19.3053 -18.6595 -18.6595 -17.9861 -17.9861 -17.3730 -17.3730 -16.2576 -16.2576 -10.5425 -10.5425 -8.4588 -8.4588 -6.6463 -6.6463 -6.0784 -6.0784 -5.2614 -5.2614 -4.8540 -4.8540 -4.7656 -4.7656 -4.5188 -4.5188 -4.3787 -4.3787 -4.1387 -4.1387 -3.8599 -3.8599 -3.3402 -3.3402 -3.1875 -3.1875 -2.9425 -2.9425 -2.9014 -2.9014 -2.3599 -2.3599 -2.0335 -2.0335 -1.7753 -1.7753 -1.4786 -1.4786 -1.2641 -1.2641 -1.1646 -1.1646 -1.0682 -1.0682 -0.9560 -0.9560 -0.9074 -0.9074 -0.8448 -0.8448 -0.6678 -0.6678 -0.3642 -0.3642 1.2767 1.2767 1.5236 1.5236 2.1079 2.1079 k = 0.4853-0.2802-0.0000 ( 11660 PWs) bands (ev): -19.6296 -19.6296 -19.3053 -19.3053 -18.6595 -18.6595 -17.9861 -17.9861 -17.3729 -17.3729 -16.2576 -16.2576 -10.5422 -10.5422 -8.4589 -8.4589 -6.6461 -6.6461 -6.0783 -6.0783 -5.2617 -5.2616 -4.8542 -4.8540 -4.7654 -4.7652 -4.5191 -4.5189 -4.3790 -4.3787 -4.1388 -4.1386 -3.8598 -3.8596 -3.3400 -3.3399 -3.1874 -3.1873 -2.9426 -2.9423 -2.9012 -2.9010 -2.3602 -2.3600 -2.0337 -2.0335 -1.7753 -1.7752 -1.4788 -1.4785 -1.2646 -1.2638 -1.1651 -1.1641 -1.0685 -1.0675 -0.9576 -0.9548 -0.9082 -0.9067 -0.8454 -0.8440 -0.6688 -0.6670 -0.3646 -0.3637 1.2767 1.2773 1.5205 1.5212 2.1045 2.1050 k = 0.4706-0.2717-0.0000 ( 11654 PWs) bands (ev): -19.6297 -19.6297 -19.3053 -19.3053 -18.6595 -18.6595 -17.9862 -17.9862 -17.3729 -17.3729 -16.2576 -16.2576 -10.5414 -10.5414 -8.4592 -8.4592 -6.6454 -6.6454 -6.0780 -6.0780 -5.2625 -5.2624 -4.8546 -4.8542 -4.7647 -4.7643 -4.5199 -4.5196 -4.3794 -4.3789 -4.1389 -4.1386 -3.8593 -3.8590 -3.3393 -3.3391 -3.1870 -3.1869 -2.9427 -2.9421 -2.9005 -2.9000 -2.3610 -2.3606 -2.0340 -2.0336 -1.7752 -1.7750 -1.4791 -1.4787 -1.2652 -1.2636 -1.1656 -1.1636 -1.0686 -1.0667 -0.9596 -0.9540 -0.9090 -0.9060 -0.8459 -0.8432 -0.6698 -0.6662 -0.3649 -0.3633 1.2770 1.2781 1.5122 1.5135 2.0948 2.0958 k = 0.4559-0.2632-0.0000 ( 11650 PWs) bands (ev): -19.6298 -19.6298 -19.3053 -19.3053 -18.6596 -18.6596 -17.9863 -17.9863 -17.3727 -17.3727 -16.2577 -16.2577 -10.5400 -10.5399 -8.4599 -8.4598 -6.6443 -6.6442 -6.0775 -6.0775 -5.2639 -5.2638 -4.8551 -4.8546 -4.7635 -4.7629 -4.5212 -4.5207 -4.3800 -4.3793 -4.1391 -4.1386 -3.8585 -3.8580 -3.3382 -3.3379 -3.1863 -3.1861 -2.9427 -2.9418 -2.8991 -2.8985 -2.3622 -2.3616 -2.0345 -2.0339 -1.7751 -1.7747 -1.4796 -1.4789 -1.2658 -1.2635 -1.1660 -1.1631 -1.0685 -1.0656 -0.9620 -0.9537 -0.9099 -0.9051 -0.8462 -0.8422 -0.6707 -0.6654 -0.3652 -0.3628 1.2764 1.2780 1.5003 1.5021 2.0789 2.0803 k = 0.4412-0.2547-0.0000 ( 11655 PWs) bands (ev): -19.6299 -19.6299 -19.3054 -19.3054 -18.6596 -18.6596 -17.9865 -17.9864 -17.3725 -17.3725 -16.2578 -16.2578 -10.5380 -10.5380 -8.4607 -8.4606 -6.6427 -6.6426 -6.0769 -6.0768 -5.2659 -5.2657 -4.8559 -4.8552 -4.7617 -4.7609 -4.5229 -4.5222 -4.3807 -4.3798 -4.1392 -4.1386 -3.8573 -3.8566 -3.3365 -3.3361 -3.1854 -3.1851 -2.9427 -2.9415 -2.8972 -2.8964 -2.3639 -2.3631 -2.0351 -2.0343 -1.7749 -1.7744 -1.4802 -1.4793 -1.2666 -1.2636 -1.1665 -1.1627 -1.0681 -1.0644 -0.9648 -0.9537 -0.9109 -0.9042 -0.8464 -0.8412 -0.6717 -0.6648 -0.3654 -0.3622 1.2731 1.2752 1.4872 1.4895 2.0570 2.0588 k = 0.4265-0.2462-0.0000 ( 11657 PWs) bands (ev): -19.6301 -19.6301 -19.3055 -19.3055 -18.6597 -18.6597 -17.9866 -17.9866 -17.3723 -17.3723 -16.2579 -16.2579 -10.5355 -10.5354 -8.4618 -8.4617 -6.6407 -6.6406 -6.0760 -6.0759 -5.2685 -5.2683 -4.8568 -4.8561 -4.7595 -4.7585 -4.5251 -4.5243 -4.3815 -4.3804 -4.1394 -4.1386 -3.8557 -3.8549 -3.3344 -3.3339 -3.1841 -3.1838 -2.9426 -2.9412 -2.8947 -2.8937 -2.3660 -2.3650 -2.0358 -2.0349 -1.7746 -1.7740 -1.4810 -1.4799 -1.2674 -1.2638 -1.1670 -1.1623 -1.0675 -1.0629 -0.9680 -0.9542 -0.9119 -0.9030 -0.8463 -0.8401 -0.6727 -0.6642 -0.3656 -0.3616 1.2641 1.2666 1.4765 1.4789 2.0295 2.0315 k = 0.4118-0.2377-0.0000 ( 11646 PWs) bands (ev): -19.6303 -19.6303 -19.3055 -19.3055 -18.6597 -18.6597 -17.9869 -17.9869 -17.3720 -17.3720 -16.2580 -16.2580 -10.5324 -10.5324 -8.4630 -8.4629 -6.6384 -6.6383 -6.0750 -6.0749 -5.2718 -5.2715 -4.8579 -4.8570 -4.7567 -4.7557 -4.5276 -4.5267 -4.3822 -4.3809 -4.1396 -4.1387 -3.8538 -3.8528 -3.3319 -3.3312 -3.1826 -3.1822 -2.9424 -2.9409 -2.8915 -2.8904 -2.3685 -2.3673 -2.0367 -2.0356 -1.7743 -1.7737 -1.4820 -1.4807 -1.2683 -1.2641 -1.1674 -1.1620 -1.0666 -1.0612 -0.9715 -0.9552 -0.9129 -0.9017 -0.8462 -0.8390 -0.6737 -0.6637 -0.3655 -0.3608 1.2467 1.2495 1.4716 1.4738 1.9968 1.9990 k = 0.3971-0.2292-0.0000 ( 11658 PWs) bands (ev): -19.6305 -19.6305 -19.3056 -19.3056 -18.6598 -18.6598 -17.9872 -17.9872 -17.3716 -17.3716 -16.2581 -16.2581 -10.5289 -10.5288 -8.4645 -8.4644 -6.6356 -6.6355 -6.0738 -6.0737 -5.2758 -5.2755 -4.8591 -4.8582 -4.7535 -4.7524 -4.5306 -4.5294 -4.3829 -4.3814 -4.1398 -4.1387 -3.8516 -3.8505 -3.3289 -3.3281 -3.1808 -3.1803 -2.9423 -2.9406 -2.8878 -2.8865 -2.3714 -2.3699 -2.0377 -2.0365 -1.7741 -1.7733 -1.4832 -1.4817 -1.2692 -1.2645 -1.1680 -1.1618 -1.0656 -1.0595 -0.9754 -0.9566 -0.9138 -0.9001 -0.8459 -0.8378 -0.6746 -0.6633 -0.3654 -0.3600 1.2196 1.2225 1.4741 1.4757 1.9600 1.9621 k = 0.3824-0.2208-0.0000 ( 11654 PWs) bands (ev): -19.6307 -19.6307 -19.3058 -19.3057 -18.6599 -18.6599 -17.9875 -17.9875 -17.3712 -17.3712 -16.2583 -16.2583 -10.5248 -10.5248 -8.4661 -8.4660 -6.6326 -6.6325 -6.0724 -6.0723 -5.2805 -5.2802 -4.8604 -4.8595 -4.7498 -4.7487 -4.5338 -4.5325 -4.3834 -4.3817 -4.1400 -4.1387 -3.8491 -3.8478 -3.3255 -3.3246 -3.1786 -3.1781 -2.9421 -2.9402 -2.8834 -2.8821 -2.3746 -2.3730 -2.0388 -2.0374 -1.7738 -1.7730 -1.4845 -1.4828 -1.2701 -1.2650 -1.1686 -1.1618 -1.0643 -1.0575 -0.9795 -0.9584 -0.9146 -0.8983 -0.8454 -0.8365 -0.6754 -0.6629 -0.3650 -0.3590 1.1835 1.1866 1.4829 1.4838 1.9201 1.9220 k = 0.3676-0.2123-0.0000 ( 11650 PWs) bands (ev): -19.6310 -19.6310 -19.3059 -19.3059 -18.6600 -18.6600 -17.9878 -17.9878 -17.3708 -17.3708 -16.2585 -16.2584 -10.5204 -10.5203 -8.4679 -8.4678 -6.6294 -6.6292 -6.0709 -6.0708 -5.2860 -5.2856 -4.8618 -4.8609 -4.7458 -4.7446 -4.5372 -4.5358 -4.3836 -4.3818 -4.1401 -4.1387 -3.8463 -3.8449 -3.3217 -3.3207 -3.1762 -3.1756 -2.9419 -2.9399 -2.8783 -2.8770 -2.3782 -2.3764 -2.0400 -2.0385 -1.7737 -1.7727 -1.4861 -1.4842 -1.2710 -1.2656 -1.1693 -1.1619 -1.0629 -1.0555 -0.9837 -0.9605 -0.9152 -0.8963 -0.8449 -0.8351 -0.6762 -0.6626 -0.3645 -0.3579 1.1403 1.1436 1.4952 1.4961 1.8791 1.8806 k = 0.3529-0.2038-0.0000 ( 11650 PWs) bands (ev): -19.6313 -19.6313 -19.3060 -19.3060 -18.6601 -18.6601 -17.9882 -17.9882 -17.3703 -17.3703 -16.2586 -16.2586 -10.5155 -10.5155 -8.4698 -8.4697 -6.6259 -6.6257 -6.0692 -6.0691 -5.2924 -5.2919 -4.8633 -4.8623 -4.7414 -4.7402 -4.5407 -4.5392 -4.3837 -4.3817 -4.1402 -4.1386 -3.8433 -3.8418 -3.3175 -3.3165 -3.1735 -3.1727 -2.9417 -2.9396 -2.8727 -2.8713 -2.3822 -2.3800 -2.0412 -2.0396 -1.7736 -1.7725 -1.4879 -1.4858 -1.2719 -1.2662 -1.1702 -1.1623 -1.0613 -1.0534 -0.9880 -0.9630 -0.9156 -0.8940 -0.8443 -0.8335 -0.6769 -0.6623 -0.3637 -0.3566 1.0917 1.0953 1.5071 1.5091 1.8398 1.8407 k = 0.3382-0.1953-0.0000 ( 11640 PWs) bands (ev): -19.6316 -19.6316 -19.3062 -19.3061 -18.6602 -18.6602 -17.9886 -17.9886 -17.3698 -17.3698 -16.2588 -16.2588 -10.5103 -10.5102 -8.4719 -8.4717 -6.6222 -6.6221 -6.0674 -6.0673 -5.2996 -5.2991 -4.8648 -4.8639 -4.7367 -4.7355 -4.5443 -4.5426 -4.3834 -4.3813 -4.1402 -4.1385 -3.8401 -3.8385 -3.3131 -3.3119 -3.1704 -3.1696 -2.9415 -2.9394 -2.8663 -2.8650 -2.3863 -2.3840 -2.0425 -2.0408 -1.7737 -1.7725 -1.4900 -1.4876 -1.2728 -1.2669 -1.1711 -1.1629 -1.0596 -1.0512 -0.9923 -0.9656 -0.9157 -0.8916 -0.8436 -0.8318 -0.6775 -0.6621 -0.3626 -0.3551 1.0392 1.0431 1.5142 1.5176 1.8063 1.8072 k = 0.3235-0.1868-0.0000 ( 11642 PWs) bands (ev): -19.6320 -19.6320 -19.3063 -19.3063 -18.6604 -18.6603 -17.9890 -17.9890 -17.3693 -17.3693 -16.2590 -16.2590 -10.5047 -10.5046 -8.4740 -8.4739 -6.6184 -6.6183 -6.0655 -6.0653 -5.3077 -5.3071 -4.8663 -4.8654 -4.7317 -4.7304 -4.5478 -4.5460 -4.3828 -4.3806 -4.1402 -4.1384 -3.8366 -3.8349 -3.3084 -3.3071 -3.1670 -3.1661 -2.9414 -2.9392 -2.8593 -2.8579 -2.3908 -2.3882 -2.0439 -2.0420 -1.7739 -1.7727 -1.4922 -1.4897 -1.2736 -1.2677 -1.1723 -1.1638 -1.0578 -1.0491 -0.9964 -0.9683 -0.9157 -0.8890 -0.8429 -0.8300 -0.6781 -0.6620 -0.3613 -0.3534 0.9838 0.9880 1.5103 1.5152 1.7847 1.7864 k = 0.3088-0.1783-0.0000 ( 11644 PWs) bands (ev): -19.6323 -19.6323 -19.3065 -19.3065 -18.6605 -18.6605 -17.9894 -17.9894 -17.3687 -17.3687 -16.2593 -16.2592 -10.4988 -10.4988 -8.4762 -8.4761 -6.6146 -6.6144 -6.0635 -6.0633 -5.3166 -5.3160 -4.8677 -4.8669 -4.7264 -4.7252 -4.5511 -4.5492 -4.3820 -4.3797 -4.1401 -4.1382 -3.8330 -3.8313 -3.3035 -3.3021 -3.1633 -3.1622 -2.9413 -2.9390 -2.8515 -2.8501 -2.3955 -2.3927 -2.0452 -2.0433 -1.7743 -1.7730 -1.4947 -1.4919 -1.2744 -1.2685 -1.1735 -1.1649 -1.0560 -1.0470 -1.0003 -0.9710 -0.9155 -0.8864 -0.8421 -0.8280 -0.6786 -0.6621 -0.3597 -0.3515 0.9263 0.9309 1.4908 1.4967 1.7804 1.7828 k = 0.2941-0.1698-0.0000 ( 11643 PWs) bands (ev): -19.6327 -19.6327 -19.3066 -19.3066 -18.6606 -18.6606 -17.9899 -17.9899 -17.3681 -17.3681 -16.2595 -16.2595 -10.4927 -10.4927 -8.4785 -8.4783 -6.6107 -6.6106 -6.0613 -6.0612 -5.3263 -5.3258 -4.8691 -4.8684 -4.7209 -4.7197 -4.5542 -4.5522 -4.3809 -4.3785 -4.1400 -4.1380 -3.8293 -3.8275 -3.2984 -3.2970 -3.1593 -3.1580 -2.9412 -2.9389 -2.8430 -2.8416 -2.4003 -2.3973 -2.0466 -2.0447 -1.7750 -1.7736 -1.4974 -1.4944 -1.2752 -1.2693 -1.1749 -1.1662 -1.0542 -1.0450 -1.0037 -0.9734 -0.9151 -0.8836 -0.8413 -0.8258 -0.6792 -0.6622 -0.3578 -0.3494 0.8675 0.8723 1.4566 1.4628 1.7930 1.7956 k = 0.2794-0.1613-0.0000 ( 11636 PWs) bands (ev): -19.6331 -19.6331 -19.3068 -19.3068 -18.6608 -18.6607 -17.9903 -17.9903 -17.3675 -17.3675 -16.2597 -16.2597 -10.4864 -10.4863 -8.4807 -8.4806 -6.6069 -6.6067 -6.0591 -6.0590 -5.3369 -5.3363 -4.8704 -4.8697 -4.7153 -4.7140 -4.5570 -4.5550 -4.3795 -4.3771 -4.1398 -4.1378 -3.8255 -3.8236 -3.2933 -3.2919 -3.1549 -3.1535 -2.9413 -2.9389 -2.8337 -2.8322 -2.4054 -2.4021 -2.0480 -2.0460 -1.7759 -1.7745 -1.5002 -1.4971 -1.2760 -1.2703 -1.1764 -1.1677 -1.0524 -1.0431 -1.0067 -0.9756 -0.9145 -0.8808 -0.8404 -0.8234 -0.6797 -0.6625 -0.3557 -0.3471 0.8076 0.8127 1.4123 1.4185 1.8179 1.8203 k = 0.2647-0.1528-0.0000 ( 11638 PWs) bands (ev): -19.6335 -19.6335 -19.3070 -19.3070 -18.6609 -18.6609 -17.9908 -17.9908 -17.3669 -17.3669 -16.2600 -16.2599 -10.4800 -10.4799 -8.4830 -8.4829 -6.6031 -6.6029 -6.0569 -6.0567 -5.3481 -5.3475 -4.8716 -4.8709 -4.7095 -4.7082 -4.5596 -4.5574 -4.3780 -4.3755 -4.1397 -4.1375 -3.8216 -3.8197 -3.2882 -3.2867 -3.1503 -3.1486 -2.9414 -2.9390 -2.8236 -2.8221 -2.4106 -2.4071 -2.0494 -2.0474 -1.7771 -1.7756 -1.5033 -1.5000 -1.2768 -1.2713 -1.1779 -1.1693 -1.0508 -1.0416 -1.0091 -0.9775 -0.9139 -0.8779 -0.8394 -0.8209 -0.6804 -0.6629 -0.3532 -0.3446 0.7473 0.7526 1.3624 1.3683 1.8504 1.8525 k = 0.2500-0.1443-0.0000 ( 11651 PWs) bands (ev): -19.6339 -19.6339 -19.3072 -19.3071 -18.6610 -18.6610 -17.9913 -17.9913 -17.3663 -17.3663 -16.2602 -16.2602 -10.4734 -10.4734 -8.4853 -8.4852 -6.5993 -6.5992 -6.0546 -6.0545 -5.3599 -5.3594 -4.8725 -4.8719 -4.7036 -4.7022 -4.5618 -4.5596 -4.3762 -4.3737 -4.1394 -4.1373 -3.8177 -3.8158 -3.2831 -3.2817 -3.1453 -3.1434 -2.9415 -2.9392 -2.8127 -2.8110 -2.4159 -2.4121 -2.0507 -2.0487 -1.7786 -1.7770 -1.5065 -1.5031 -1.2776 -1.2724 -1.1794 -1.1710 -1.0494 -1.0404 -1.0108 -0.9790 -0.9131 -0.8752 -0.8383 -0.8182 -0.6812 -0.6636 -0.3505 -0.3418 0.6869 0.6923 1.3100 1.3157 1.8876 1.8893 k = 0.2353-0.1358-0.0000 ( 11658 PWs) bands (ev): -19.6343 -19.6343 -19.3073 -19.3073 -18.6612 -18.6611 -17.9918 -17.9918 -17.3657 -17.3657 -16.2604 -16.2604 -10.4669 -10.4668 -8.4876 -8.4874 -6.5958 -6.5956 -6.0524 -6.0522 -5.3722 -5.3717 -4.8733 -4.8728 -4.6976 -4.6962 -4.5637 -4.5615 -4.3743 -4.3717 -4.1392 -4.1370 -3.8138 -3.8119 -3.2782 -3.2768 -3.1401 -3.1380 -2.9418 -2.9394 -2.8010 -2.7991 -2.4213 -2.4173 -2.0520 -2.0500 -1.7803 -1.7787 -1.5098 -1.5063 -1.2785 -1.2737 -1.1809 -1.1727 -1.0482 -1.0396 -1.0116 -0.9801 -0.9123 -0.8726 -0.8369 -0.8153 -0.6822 -0.6646 -0.3475 -0.3389 0.6267 0.6323 1.2570 1.2623 1.9276 1.9291 k = 0.2206-0.1274-0.0000 ( 11649 PWs) bands (ev): -19.6347 -19.6346 -19.3075 -19.3075 -18.6613 -18.6613 -17.9922 -17.9922 -17.3651 -17.3651 -16.2607 -16.2607 -10.4604 -10.4603 -8.4898 -8.4896 -6.5923 -6.5921 -6.0501 -6.0499 -5.3849 -5.3843 -4.8739 -4.8734 -4.6917 -4.6901 -4.5653 -4.5630 -4.3722 -4.3696 -4.1390 -4.1368 -3.8099 -3.8080 -3.2735 -3.2721 -3.1346 -3.1323 -2.9421 -2.9397 -2.7884 -2.7863 -2.4268 -2.4226 -2.0532 -2.0512 -1.7823 -1.7806 -1.5132 -1.5096 -1.2795 -1.2751 -1.1822 -1.1743 -1.0473 -1.0393 -1.0115 -0.9806 -0.9113 -0.8701 -0.8353 -0.8123 -0.6834 -0.6659 -0.3442 -0.3357 0.5672 0.5730 1.2047 1.2096 1.9693 1.9705 k = 0.2059-0.1189-0.0000 ( 11645 PWs) bands (ev): -19.6350 -19.6350 -19.3077 -19.3077 -18.6615 -18.6614 -17.9927 -17.9927 -17.3645 -17.3645 -16.2609 -16.2609 -10.4539 -10.4538 -8.4919 -8.4918 -6.5891 -6.5889 -6.0479 -6.0477 -5.3977 -5.3972 -4.8743 -4.8739 -4.6857 -4.6841 -4.5666 -4.5643 -4.3700 -4.3675 -4.1388 -4.1365 -3.8061 -3.8043 -3.2691 -3.2677 -3.1290 -3.1265 -2.9425 -2.9401 -2.7750 -2.7726 -2.4324 -2.4279 -2.0544 -2.0524 -1.7846 -1.7829 -1.5167 -1.5131 -1.2807 -1.2766 -1.1835 -1.1758 -1.0467 -1.0394 -1.0107 -0.9808 -0.9103 -0.8680 -0.8334 -0.8091 -0.6850 -0.6676 -0.3407 -0.3323 0.5087 0.5146 1.1539 1.1584 2.0117 2.0128 k = 0.1912-0.1104-0.0000 ( 11644 PWs) bands (ev): -19.6354 -19.6354 -19.3078 -19.3078 -18.6616 -18.6616 -17.9931 -17.9931 -17.3640 -17.3640 -16.2611 -16.2611 -10.4476 -10.4475 -8.4940 -8.4938 -6.5860 -6.5858 -6.0458 -6.0456 -5.4105 -5.4100 -4.8745 -4.8741 -4.6798 -4.6782 -4.5677 -4.5654 -4.3678 -4.3653 -4.1385 -4.1363 -3.8025 -3.8006 -3.2649 -3.2636 -3.1234 -3.1207 -2.9430 -2.9406 -2.7609 -2.7582 -2.4380 -2.4333 -2.0555 -2.0536 -1.7871 -1.7853 -1.5203 -1.5166 -1.2819 -1.2782 -1.1845 -1.1770 -1.0465 -1.0398 -1.0092 -0.9805 -0.9093 -0.8663 -0.8310 -0.8057 -0.6869 -0.6697 -0.3369 -0.3287 0.4517 0.4576 1.1051 1.1094 2.0544 2.0552 k = 0.1765-0.1019-0.0000 ( 11639 PWs) bands (ev): -19.6358 -19.6358 -19.3080 -19.3080 -18.6617 -18.6617 -17.9936 -17.9936 -17.3634 -17.3634 -16.2614 -16.2613 -10.4415 -10.4414 -8.4959 -8.4958 -6.5831 -6.5830 -6.0437 -6.0435 -5.4232 -5.4227 -4.8745 -4.8742 -4.6741 -4.6723 -4.5686 -4.5662 -4.3655 -4.3631 -4.1383 -4.1361 -3.7989 -3.7972 -3.2610 -3.2598 -3.1177 -3.1148 -2.9436 -2.9412 -2.7460 -2.7430 -2.4437 -2.4388 -2.0565 -2.0546 -1.7897 -1.7880 -1.5239 -1.5202 -1.2833 -1.2800 -1.1853 -1.1780 -1.0465 -1.0405 -1.0072 -0.9799 -0.9082 -0.8650 -0.8281 -0.8022 -0.6892 -0.6722 -0.3329 -0.3250 0.3966 0.4024 1.0590 1.0628 2.0966 2.0974 k = 0.1618-0.0934-0.0000 ( 11637 PWs) bands (ev): -19.6361 -19.6361 -19.3081 -19.3081 -18.6618 -18.6618 -17.9940 -17.9940 -17.3629 -17.3629 -16.2616 -16.2615 -10.4356 -10.4355 -8.4978 -8.4977 -6.5805 -6.5804 -6.0418 -6.0416 -5.4356 -5.4352 -4.8744 -4.8741 -4.6685 -4.6667 -4.5693 -4.5670 -4.3633 -4.3609 -4.1381 -4.1360 -3.7956 -3.7939 -3.2575 -3.2564 -3.1120 -3.1091 -2.9442 -2.9418 -2.7305 -2.7272 -2.4495 -2.4443 -2.0574 -2.0556 -1.7925 -1.7908 -1.5275 -1.5238 -1.2848 -1.2819 -1.1858 -1.1788 -1.0467 -1.0412 -1.0049 -0.9790 -0.9070 -0.8643 -0.8247 -0.7985 -0.6919 -0.6753 -0.3286 -0.3210 0.3436 0.3494 1.0158 1.0192 2.1379 2.1388 k = 0.1471-0.0849-0.0000 ( 11663 PWs) bands (ev): -19.6364 -19.6364 -19.3083 -19.3083 -18.6620 -18.6619 -17.9944 -17.9944 -17.3624 -17.3624 -16.2618 -16.2617 -10.4300 -10.4300 -8.4995 -8.4994 -6.5781 -6.5780 -6.0399 -6.0398 -5.4475 -5.4471 -4.8742 -4.8739 -4.6631 -4.6612 -4.5699 -4.5676 -4.3610 -4.3588 -4.1379 -4.1359 -3.7924 -3.7908 -3.2543 -3.2533 -3.1065 -3.1035 -2.9448 -2.9426 -2.7146 -2.7109 -2.4554 -2.4500 -2.0582 -2.0565 -1.7954 -1.7937 -1.5310 -1.5275 -1.2865 -1.2838 -1.1861 -1.1793 -1.0472 -1.0421 -1.0023 -0.9780 -0.9059 -0.8641 -0.8209 -0.7948 -0.6952 -0.6789 -0.3241 -0.3169 0.2934 0.2990 0.9757 0.9788 2.1780 2.1789 k = 0.1324-0.0764-0.0000 ( 11652 PWs) bands (ev): -19.6367 -19.6367 -19.3084 -19.3084 -18.6621 -18.6620 -17.9947 -17.9947 -17.3619 -17.3619 -16.2619 -16.2619 -10.4248 -10.4247 -8.5011 -8.5010 -6.5759 -6.5758 -6.0382 -6.0381 -5.4587 -5.4584 -4.8738 -4.8736 -4.6579 -4.6561 -4.5704 -4.5681 -4.3589 -4.3568 -4.1377 -4.1358 -3.7895 -3.7880 -3.2515 -3.2505 -3.1012 -3.0982 -2.9455 -2.9433 -2.6983 -2.6943 -2.4613 -2.4557 -2.0589 -2.0572 -1.7983 -1.7967 -1.5345 -1.5311 -1.2881 -1.2858 -1.1861 -1.1796 -1.0477 -1.0430 -0.9995 -0.9768 -0.9046 -0.8645 -0.8166 -0.7909 -0.6988 -0.6829 -0.3194 -0.3127 0.2462 0.2517 0.9391 0.9419 2.2163 2.2174 k = 0.1176-0.0679-0.0000 ( 11658 PWs) bands (ev): -19.6370 -19.6370 -19.3085 -19.3085 -18.6622 -18.6621 -17.9951 -17.9951 -17.3615 -17.3615 -16.2621 -16.2621 -10.4200 -10.4199 -8.5025 -8.5024 -6.5740 -6.5739 -6.0367 -6.0366 -5.4692 -5.4689 -4.8734 -4.8732 -4.6531 -4.6513 -4.5708 -4.5686 -4.3568 -4.3549 -4.1375 -4.1358 -3.7868 -3.7854 -3.2489 -3.2481 -3.0962 -3.0933 -2.9462 -2.9441 -2.6819 -2.6777 -2.4673 -2.4616 -2.0594 -2.0579 -1.8012 -1.7997 -1.5378 -1.5346 -1.2898 -1.2877 -1.1859 -1.1798 -1.0483 -1.0439 -0.9966 -0.9757 -0.9033 -0.8654 -0.8119 -0.7870 -0.7029 -0.6875 -0.3146 -0.3084 0.2025 0.2077 0.9060 0.9084 2.2527 2.2538 k = 0.1029-0.0594-0.0000 ( 11654 PWs) bands (ev): -19.6373 -19.6372 -19.3087 -19.3086 -18.6622 -18.6622 -17.9954 -17.9954 -17.3611 -17.3611 -16.2623 -16.2622 -10.4156 -10.4156 -8.5038 -8.5037 -6.5723 -6.5722 -6.0353 -6.0352 -5.4788 -5.4785 -4.8730 -4.8728 -4.6486 -4.6469 -4.5712 -4.5691 -4.3549 -4.3531 -4.1374 -4.1358 -3.7843 -3.7832 -3.2467 -3.2460 -3.0915 -3.0888 -2.9469 -2.9449 -2.6657 -2.6612 -2.4735 -2.4676 -2.0599 -2.0585 -1.8040 -1.8026 -1.5410 -1.5380 -1.2914 -1.2896 -1.1855 -1.1798 -1.0489 -1.0448 -0.9937 -0.9746 -0.9019 -0.8668 -0.8068 -0.7829 -0.7074 -0.6925 -0.3097 -0.3040 0.1627 0.1675 0.8766 0.8787 2.2866 2.2878 k = 0.0882-0.0509-0.0000 ( 11652 PWs) bands (ev): -19.6375 -19.6375 -19.3088 -19.3087 -18.6623 -18.6623 -17.9956 -17.9956 -17.3608 -17.3608 -16.2624 -16.2624 -10.4117 -10.4117 -8.5050 -8.5049 -6.5709 -6.5708 -6.0341 -6.0340 -5.4873 -5.4871 -4.8725 -4.8724 -4.6445 -4.6429 -4.5715 -4.5695 -4.3531 -4.3516 -4.1372 -4.1359 -3.7822 -3.7812 -3.2449 -3.2442 -3.0873 -3.0848 -2.9475 -2.9458 -2.6499 -2.6452 -2.4797 -2.4738 -2.0602 -2.0590 -1.8066 -1.8053 -1.5439 -1.5412 -1.2929 -1.2914 -1.1849 -1.1798 -1.0494 -1.0458 -0.9907 -0.9737 -0.9003 -0.8687 -0.8014 -0.7789 -0.7121 -0.6979 -0.3048 -0.2997 0.1271 0.1315 0.8510 0.8527 2.3177 2.3189 k = 0.0735-0.0425-0.0000 ( 11649 PWs) bands (ev): -19.6377 -19.6377 -19.3088 -19.3088 -18.6624 -18.6624 -17.9959 -17.9958 -17.3605 -17.3605 -16.2625 -16.2625 -10.4084 -10.4084 -8.5059 -8.5059 -6.5696 -6.5696 -6.0331 -6.0330 -5.4947 -5.4945 -4.8721 -4.8720 -4.6409 -4.6394 -4.5717 -4.5700 -4.3516 -4.3503 -4.1371 -4.1359 -3.7803 -3.7795 -3.2433 -3.2428 -3.0836 -3.0813 -2.9481 -2.9465 -2.6347 -2.6300 -2.4859 -2.4801 -2.0604 -2.0594 -1.8089 -1.8078 -1.5465 -1.5442 -1.2942 -1.2930 -1.1842 -1.1797 -1.0498 -1.0466 -0.9878 -0.9731 -0.8985 -0.8710 -0.7957 -0.7750 -0.7170 -0.7036 -0.3000 -0.2955 0.0961 0.1000 0.8292 0.8306 2.3455 2.3467 k = 0.0588-0.0340-0.0000 ( 11649 PWs) bands (ev): -19.6378 -19.6378 -19.3089 -19.3089 -18.6624 -18.6624 -17.9960 -17.9960 -17.3602 -17.3602 -16.2626 -16.2626 -10.4056 -10.4056 -8.5067 -8.5067 -6.5686 -6.5686 -6.0323 -6.0322 -5.5008 -5.5007 -4.8717 -4.8716 -4.6378 -4.6365 -4.5719 -4.5704 -4.3502 -4.3491 -4.1370 -4.1360 -3.7788 -3.7781 -3.2420 -3.2416 -3.0804 -3.0785 -2.9486 -2.9473 -2.6207 -2.6161 -2.4919 -2.4864 -2.0606 -2.0597 -1.8109 -1.8100 -1.5487 -1.5468 -1.2954 -1.2944 -1.1835 -1.1797 -1.0501 -1.0475 -0.9850 -0.9728 -0.8964 -0.8736 -0.7899 -0.7714 -0.7217 -0.7093 -0.2955 -0.2918 0.0702 0.0734 0.8113 0.8125 2.3696 2.3706 k = 0.0441-0.0255-0.0000 ( 11656 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6625 -18.6625 -17.9962 -17.9962 -17.3601 -17.3601 -16.2627 -16.2627 -10.4034 -10.4034 -8.5073 -8.5073 -6.5679 -6.5678 -6.0316 -6.0315 -5.5057 -5.5056 -4.8714 -4.8713 -4.6353 -4.6343 -4.5720 -4.5709 -4.3491 -4.3483 -4.1369 -4.1361 -3.7775 -3.7770 -3.2410 -3.2407 -3.0778 -3.0763 -2.9489 -2.9479 -2.6082 -2.6040 -2.4975 -2.4927 -2.0607 -2.0600 -1.8125 -1.8118 -1.5504 -1.5490 -1.2963 -1.2955 -1.1827 -1.1798 -1.0502 -1.0482 -0.9824 -0.9729 -0.8941 -0.8765 -0.7841 -0.7685 -0.7258 -0.7149 -0.2915 -0.2886 0.0496 0.0521 0.7974 0.7983 2.3893 2.3902 k = 0.0294-0.0170-0.0000 ( 11651 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3599 -17.3599 -16.2627 -16.2627 -10.4018 -10.4018 -8.5078 -8.5078 -6.5673 -6.5673 -6.0311 -6.0311 -5.5092 -5.5091 -4.8711 -4.8711 -4.6334 -4.6327 -4.5721 -4.5713 -4.3483 -4.3477 -4.1367 -4.1362 -3.7766 -3.7763 -3.2403 -3.2401 -3.0758 -3.0748 -2.9491 -2.9484 -2.5979 -2.5946 -2.5021 -2.4983 -2.0607 -2.0602 -1.8137 -1.8132 -1.5516 -1.5507 -1.2969 -1.2964 -1.1820 -1.1800 -1.0502 -1.0489 -0.9799 -0.9735 -0.8916 -0.8796 -0.7785 -0.7668 -0.7286 -0.7202 -0.2882 -0.2862 0.0347 0.0365 0.7875 0.7881 2.4041 2.4047 k = 0.0147-0.0085-0.0000 ( 11658 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4009 -10.4009 -8.5081 -8.5080 -6.5670 -6.5670 -6.0308 -6.0308 -5.5113 -5.5113 -4.8710 -4.8710 -4.6321 -4.6318 -4.5720 -4.5716 -4.3477 -4.3474 -4.1366 -4.1364 -3.7760 -3.7759 -3.2398 -3.2397 -3.0745 -3.0740 -2.9492 -2.9488 -2.5907 -2.5887 -2.5050 -2.5028 -2.0606 -2.0604 -1.8144 -1.8141 -1.5523 -1.5518 -1.2973 -1.2970 -1.1813 -1.1803 -1.0501 -1.0494 -0.9778 -0.9745 -0.8888 -0.8827 -0.7734 -0.7670 -0.7295 -0.7248 -0.2859 -0.2849 0.0258 0.0267 0.7816 0.7819 2.4133 2.4136 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k =-0.0143-0.0082 0.0042 ( 11659 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5082 -8.5082 -6.5671 -6.5670 -6.0310 -6.0310 -5.5120 -5.5120 -4.8710 -4.8708 -4.6324 -4.6321 -4.5720 -4.5717 -4.3476 -4.3470 -4.1365 -4.1358 -3.7759 -3.7758 -3.2407 -3.2403 -3.0737 -3.0732 -2.9491 -2.9489 -2.5894 -2.5879 -2.5048 -2.5033 -2.0606 -2.0604 -1.8156 -1.8148 -1.5530 -1.5514 -1.2976 -1.2965 -1.1814 -1.1798 -1.0514 -1.0485 -0.9772 -0.9747 -0.8879 -0.8834 -0.7723 -0.7677 -0.7281 -0.7264 -0.2861 -0.2853 0.0257 0.0263 0.7815 0.7816 2.4165 2.4167 k =-0.0286-0.0165 0.0083 ( 11655 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3599 -17.3599 -16.2627 -16.2627 -10.4005 -10.4005 -8.5085 -8.5085 -6.5677 -6.5676 -6.0319 -6.0319 -5.5121 -5.5120 -4.8710 -4.8706 -4.6346 -4.6341 -4.5721 -4.5716 -4.3475 -4.3463 -4.1358 -4.1344 -3.7763 -3.7760 -3.2434 -3.2427 -3.0725 -3.0716 -2.9489 -2.9486 -2.5935 -2.5908 -2.5021 -2.4992 -2.0605 -2.0601 -1.8180 -1.8163 -1.5531 -1.5500 -1.2973 -1.2953 -1.1819 -1.1787 -1.0530 -1.0473 -0.9784 -0.9733 -0.8895 -0.8807 -0.7761 -0.7674 -0.7264 -0.7236 -0.2889 -0.2873 0.0339 0.0351 0.7870 0.7872 2.4165 2.4168 k =-0.0429-0.0247 0.0125 ( 11654 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9961 -17.9961 -17.3600 -17.3600 -16.2627 -16.2627 -10.4005 -10.4005 -8.5089 -8.5089 -6.5686 -6.5686 -6.0334 -6.0334 -5.5122 -5.5120 -4.8709 -4.8704 -4.6381 -4.6373 -4.5723 -4.5715 -4.3471 -4.3455 -4.1344 -4.1324 -3.7768 -3.7763 -3.2476 -3.2467 -3.0704 -3.0692 -2.9485 -2.9481 -2.5991 -2.5956 -2.4976 -2.4937 -2.0604 -2.0599 -1.8215 -1.8191 -1.5529 -1.5484 -1.2966 -1.2938 -1.1821 -1.1772 -1.0547 -1.0462 -0.9796 -0.9719 -0.8906 -0.8778 -0.7802 -0.7685 -0.7231 -0.7199 -0.2931 -0.2908 0.0475 0.0493 0.7961 0.7964 2.4166 2.4171 k =-0.0571-0.0330 0.0167 ( 11643 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9960 -17.9960 -17.3601 -17.3601 -16.2626 -16.2626 -10.4004 -10.4004 -8.5095 -8.5095 -6.5700 -6.5699 -6.0354 -6.0354 -5.5122 -5.5120 -4.8708 -4.8701 -4.6428 -4.6418 -4.5723 -4.5714 -4.3466 -4.3445 -4.1323 -4.1297 -3.7775 -3.7769 -3.2533 -3.2521 -3.0677 -3.0662 -2.9481 -2.9475 -2.6057 -2.6016 -2.4917 -2.4872 -2.0603 -2.0596 -1.8260 -1.8229 -1.5523 -1.5466 -1.2956 -1.2921 -1.1819 -1.1753 -1.0566 -1.0454 -0.9807 -0.9702 -0.8913 -0.8749 -0.7845 -0.7704 -0.7186 -0.7158 -0.2983 -0.2954 0.0660 0.0684 0.8089 0.8093 2.4166 2.4173 k =-0.0714-0.0412 0.0208 ( 11649 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6624 -18.6624 -17.9957 -17.9957 -17.3602 -17.3602 -16.2626 -16.2625 -10.4003 -10.4003 -8.5103 -8.5102 -6.5717 -6.5716 -6.0380 -6.0379 -5.5123 -5.5121 -4.8706 -4.8698 -4.6486 -4.6475 -4.5723 -4.5713 -4.3460 -4.3435 -4.1296 -4.1264 -3.7784 -3.7776 -3.2601 -3.2587 -3.0645 -3.0627 -2.9477 -2.9469 -2.6126 -2.6082 -2.4850 -2.4801 -2.0602 -2.0593 -1.8313 -1.8276 -1.5513 -1.5446 -1.2942 -1.2903 -1.1812 -1.1730 -1.0586 -1.0447 -0.9819 -0.9684 -0.8916 -0.8721 -0.7886 -0.7729 -0.7136 -0.7114 -0.3041 -0.3006 0.0892 0.0919 0.8253 0.8258 2.4167 2.4174 k =-0.0857-0.0495 0.0250 ( 11655 PWs) bands (ev): -19.6378 -19.6378 -19.3090 -19.3090 -18.6624 -18.6624 -17.9955 -17.9955 -17.3604 -17.3604 -16.2625 -16.2625 -10.4002 -10.4002 -8.5112 -8.5111 -6.5737 -6.5736 -6.0411 -6.0410 -5.5124 -5.5121 -4.8704 -4.8695 -4.6555 -4.6542 -4.5723 -4.5712 -4.3454 -4.3425 -4.1262 -4.1225 -3.7794 -3.7785 -3.2680 -3.2665 -3.0609 -3.0590 -2.9474 -2.9465 -2.6195 -2.6149 -2.4779 -2.4727 -2.0601 -2.0591 -1.8370 -1.8328 -1.5500 -1.5426 -1.2928 -1.2887 -1.1799 -1.1700 -1.0608 -1.0443 -0.9829 -0.9664 -0.8915 -0.8695 -0.7924 -0.7755 -0.7084 -0.7068 -0.3103 -0.3063 0.1164 0.1196 0.8453 0.8459 2.4167 2.4175 k =-0.1000-0.0577 0.0292 ( 11652 PWs) bands (ev): -19.6377 -19.6377 -19.3090 -19.3090 -18.6623 -18.6623 -17.9951 -17.9951 -17.3607 -17.3606 -16.2624 -16.2623 -10.4001 -10.4001 -8.5122 -8.5122 -6.5761 -6.5760 -6.0446 -6.0446 -5.5126 -5.5122 -4.8702 -4.8691 -4.6632 -4.6618 -4.5721 -4.5710 -4.3449 -4.3416 -4.1222 -4.1181 -3.7807 -3.7797 -3.2767 -3.2752 -3.0572 -3.0551 -2.9474 -2.9463 -2.6260 -2.6213 -2.4704 -2.4651 -2.0602 -2.0590 -1.8431 -1.8384 -1.5484 -1.5404 -1.2913 -1.2872 -1.1779 -1.1663 -1.0631 -1.0441 -0.9838 -0.9641 -0.8913 -0.8671 -0.7957 -0.7782 -0.7036 -0.7019 -0.3165 -0.3121 0.1474 0.1510 0.8688 0.8695 2.4166 2.4175 k =-0.1143-0.0660 0.0333 ( 11649 PWs) bands (ev): -19.6376 -19.6375 -19.3090 -19.3089 -18.6623 -18.6623 -17.9948 -17.9948 -17.3609 -17.3609 -16.2622 -16.2622 -10.4000 -10.4000 -8.5134 -8.5134 -6.5788 -6.5787 -6.0487 -6.0486 -5.5127 -5.5123 -4.8699 -4.8688 -4.6716 -4.6702 -4.5719 -4.5708 -4.3445 -4.3410 -4.1176 -4.1131 -3.7822 -3.7810 -3.2861 -3.2846 -3.0534 -3.0512 -2.9478 -2.9466 -2.6317 -2.6271 -2.4629 -2.4575 -2.0605 -2.0592 -1.8491 -1.8441 -1.5466 -1.5383 -1.2899 -1.2860 -1.1751 -1.1620 -1.0655 -1.0441 -0.9845 -0.9618 -0.8909 -0.8652 -0.7986 -0.7808 -0.6994 -0.6967 -0.3227 -0.3178 0.1817 0.1856 0.8958 0.8967 2.4163 2.4174 k =-0.1286-0.0742 0.0375 ( 11646 PWs) bands (ev): -19.6374 -19.6374 -19.3089 -19.3089 -18.6622 -18.6622 -17.9944 -17.9944 -17.3612 -17.3612 -16.2621 -16.2621 -10.3998 -10.3998 -8.5148 -8.5147 -6.5819 -6.5817 -6.0531 -6.0530 -5.5128 -5.5124 -4.8697 -4.8684 -4.6806 -4.6792 -4.5716 -4.5705 -4.3444 -4.3405 -4.1126 -4.1077 -3.7839 -3.7826 -3.2961 -3.2946 -3.0496 -3.0475 -2.9488 -2.9474 -2.6364 -2.6318 -2.4553 -2.4499 -2.0610 -2.0596 -1.8549 -1.8496 -1.5446 -1.5361 -1.2886 -1.2850 -1.1717 -1.1570 -1.0681 -1.0444 -0.9850 -0.9593 -0.8904 -0.8636 -0.8009 -0.7832 -0.6956 -0.6915 -0.3287 -0.3233 0.2191 0.2233 0.9261 0.9272 2.4160 2.4171 k =-0.1429-0.0825 0.0417 ( 11643 PWs) bands (ev): -19.6373 -19.6372 -19.3089 -19.3089 -18.6621 -18.6621 -17.9939 -17.9939 -17.3615 -17.3615 -16.2620 -16.2619 -10.3997 -10.3996 -8.5162 -8.5161 -6.5851 -6.5850 -6.0579 -6.0578 -5.5130 -5.5125 -4.8695 -4.8681 -4.6900 -4.6886 -4.5712 -4.5702 -4.3444 -4.3404 -4.1071 -4.1019 -3.7859 -3.7844 -3.3066 -3.3051 -3.0460 -3.0439 -2.9505 -2.9490 -2.6398 -2.6354 -2.4478 -2.4424 -2.0619 -2.0604 -1.8603 -1.8546 -1.5423 -1.5339 -1.2875 -1.2841 -1.1675 -1.1513 -1.0709 -1.0449 -0.9853 -0.9568 -0.8899 -0.8623 -0.8027 -0.7854 -0.6923 -0.6867 -0.3344 -0.3284 0.2592 0.2636 0.9598 0.9610 2.4154 2.4166 k =-0.1571-0.0907 0.0458 ( 11643 PWs) bands (ev): -19.6371 -19.6371 -19.3089 -19.3089 -18.6621 -18.6621 -17.9935 -17.9935 -17.3618 -17.3618 -16.2618 -16.2618 -10.3995 -10.3995 -8.5177 -8.5176 -6.5887 -6.5885 -6.0630 -6.0630 -5.5131 -5.5126 -4.8693 -4.8679 -4.6997 -4.6983 -4.5707 -4.5698 -4.3447 -4.3406 -4.1013 -4.0959 -3.7881 -3.7865 -3.3174 -3.3160 -3.0426 -3.0404 -2.9530 -2.9514 -2.6418 -2.6375 -2.4404 -2.4351 -2.0633 -2.0617 -1.8650 -1.8592 -1.5400 -1.5318 -1.2865 -1.2832 -1.1628 -1.1452 -1.0739 -1.0457 -0.9852 -0.9542 -0.8894 -0.8615 -0.8040 -0.7872 -0.6894 -0.6821 -0.3397 -0.3331 0.3016 0.3063 0.9967 0.9981 2.4147 2.4159 k =-0.1714-0.0990 0.0500 ( 11638 PWs) bands (ev): -19.6369 -19.6369 -19.3089 -19.3088 -18.6620 -18.6620 -17.9930 -17.9930 -17.3621 -17.3621 -16.2616 -16.2616 -10.3993 -10.3993 -8.5193 -8.5192 -6.5925 -6.5923 -6.0685 -6.0684 -5.5133 -5.5128 -4.8693 -4.8678 -4.7095 -4.7081 -4.5702 -4.5693 -4.3452 -4.3410 -4.0952 -4.0896 -3.7905 -3.7889 -3.3284 -3.3271 -3.0393 -3.0373 -2.9564 -2.9547 -2.6423 -2.6381 -2.4332 -2.4280 -2.0650 -2.0634 -1.8689 -1.8629 -1.5375 -1.5296 -1.2855 -1.2821 -1.1577 -1.1388 -1.0770 -1.0469 -0.9850 -0.9517 -0.8890 -0.8608 -0.8047 -0.7886 -0.6869 -0.6780 -0.3446 -0.3374 0.3461 0.3510 1.0367 1.0383 2.4138 2.4150 k =-0.1857-0.1072 0.0542 ( 11637 PWs) bands (ev): -19.6367 -19.6367 -19.3088 -19.3088 -18.6619 -18.6619 -17.9924 -17.9924 -17.3625 -17.3625 -16.2614 -16.2614 -10.3991 -10.3991 -8.5210 -8.5209 -6.5964 -6.5963 -6.0741 -6.0740 -5.5135 -5.5129 -4.8694 -4.8678 -4.7192 -4.7180 -4.5696 -4.5688 -4.3459 -4.3417 -4.0890 -4.0832 -3.7933 -3.7915 -3.3396 -3.3384 -3.0363 -3.0343 -2.9607 -2.9589 -2.6411 -2.6372 -2.4263 -2.4212 -2.0673 -2.0657 -1.8718 -1.8658 -1.5349 -1.5274 -1.2845 -1.2807 -1.1523 -1.1321 -1.0802 -1.0483 -0.9845 -0.9493 -0.8886 -0.8603 -0.8052 -0.7897 -0.6849 -0.6743 -0.3490 -0.3412 0.3924 0.3974 1.0796 1.0813 2.4127 2.4139 k =-0.2000-0.1155 0.0583 ( 11636 PWs) bands (ev): -19.6366 -19.6365 -19.3088 -19.3088 -18.6618 -18.6618 -17.9919 -17.9919 -17.3629 -17.3629 -16.2613 -16.2612 -10.3989 -10.3989 -8.5228 -8.5227 -6.6006 -6.6004 -6.0799 -6.0798 -5.5136 -5.5130 -4.8697 -4.8680 -4.7289 -4.7276 -4.5690 -4.5682 -4.3469 -4.3427 -4.0826 -4.0768 -3.7963 -3.7944 -3.3508 -3.3497 -3.0336 -3.0316 -2.9658 -2.9639 -2.6385 -2.6346 -2.4196 -2.4146 -2.0701 -2.0685 -1.8738 -1.8678 -1.5323 -1.5252 -1.2833 -1.2788 -1.1468 -1.1254 -1.0835 -1.0500 -0.9837 -0.9471 -0.8881 -0.8599 -0.8053 -0.7902 -0.6832 -0.6710 -0.3530 -0.3446 0.4401 0.4452 1.1252 1.1272 2.4115 2.4126 k =-0.2143-0.1237 0.0625 ( 11631 PWs) bands (ev): -19.6364 -19.6363 -19.3088 -19.3087 -18.6617 -18.6617 -17.9913 -17.9913 -17.3633 -17.3633 -16.2611 -16.2610 -10.3987 -10.3987 -8.5246 -8.5244 -6.6049 -6.6047 -6.0858 -6.0857 -5.5138 -5.5132 -4.8703 -4.8686 -4.7382 -4.7370 -4.5683 -4.5676 -4.3480 -4.3439 -4.0763 -4.0705 -3.7996 -3.7976 -3.3620 -3.3610 -3.0311 -3.0292 -2.9717 -2.9696 -2.6344 -2.6307 -2.4133 -2.4084 -2.0734 -2.0718 -1.8747 -1.8687 -1.5297 -1.5231 -1.2817 -1.2764 -1.1414 -1.1189 -1.0868 -1.0520 -0.9828 -0.9451 -0.8876 -0.8595 -0.8054 -0.7903 -0.6819 -0.6682 -0.3564 -0.3475 0.4890 0.4941 1.1734 1.1755 2.4101 2.4112 k =-0.2286-0.1320 0.0667 ( 11638 PWs) bands (ev): -19.6362 -19.6361 -19.3087 -19.3087 -18.6616 -18.6616 -17.9907 -17.9907 -17.3637 -17.3637 -16.2609 -16.2608 -10.3985 -10.3985 -8.5264 -8.5263 -6.6093 -6.6091 -6.0919 -6.0918 -5.5140 -5.5133 -4.8712 -4.8694 -4.7470 -4.7459 -4.5675 -4.5669 -4.3493 -4.3452 -4.0700 -4.0642 -3.8032 -3.8011 -3.3730 -3.3720 -3.0290 -3.0272 -2.9781 -2.9759 -2.6291 -2.6255 -2.4073 -2.4025 -2.0772 -2.0756 -1.8746 -1.8687 -1.5272 -1.5211 -1.2797 -1.2734 -1.1362 -1.1130 -1.0897 -1.0542 -0.9817 -0.9433 -0.8868 -0.8590 -0.8053 -0.7899 -0.6810 -0.6657 -0.3594 -0.3500 0.5388 0.5438 1.2238 1.2261 2.4085 2.4096 k =-0.2429-0.1402 0.0708 ( 11644 PWs) bands (ev): -19.6360 -19.6359 -19.3087 -19.3087 -18.6615 -18.6615 -17.9901 -17.9901 -17.3641 -17.3641 -16.2607 -16.2606 -10.3983 -10.3982 -8.5282 -8.5281 -6.6137 -6.6135 -6.0979 -6.0978 -5.5141 -5.5135 -4.8725 -4.8707 -4.7553 -4.7542 -4.5668 -4.5661 -4.3506 -4.3466 -4.0639 -4.0582 -3.8070 -3.8049 -3.3838 -3.3828 -3.0272 -3.0254 -2.9847 -2.9826 -2.6226 -2.6192 -2.4017 -2.3970 -2.0813 -2.0798 -1.8735 -1.8678 -1.5248 -1.5192 -1.2770 -1.2697 -1.1314 -1.1082 -1.0915 -1.0566 -0.9805 -0.9418 -0.8859 -0.8584 -0.8052 -0.7892 -0.6803 -0.6637 -0.3619 -0.3521 0.5891 0.5940 1.2763 1.2787 2.4068 2.4078 k =-0.2571-0.1485 0.0750 ( 11645 PWs) bands (ev): -19.6358 -19.6357 -19.3087 -19.3087 -18.6614 -18.6614 -17.9896 -17.9895 -17.3645 -17.3645 -16.2605 -16.2604 -10.3981 -10.3980 -8.5301 -8.5299 -6.6182 -6.6180 -6.1039 -6.1038 -5.5143 -5.5136 -4.8743 -4.8725 -4.7628 -4.7618 -4.5659 -4.5653 -4.3521 -4.3482 -4.0581 -4.0524 -3.8112 -3.8089 -3.3942 -3.3933 -3.0260 -3.0242 -2.9913 -2.9892 -2.6153 -2.6119 -2.3965 -2.3920 -2.0857 -2.0842 -1.8716 -1.8660 -1.5226 -1.5174 -1.2736 -1.2653 -1.1272 -1.1060 -1.0910 -1.0592 -0.9791 -0.9406 -0.8846 -0.8577 -0.8050 -0.7882 -0.6798 -0.6620 -0.3640 -0.3538 0.6396 0.6445 1.3304 1.3330 2.4049 2.4059 k =-0.2714-0.1567 0.0792 ( 11648 PWs) bands (ev): -19.6356 -19.6355 -19.3086 -19.3086 -18.6613 -18.6613 -17.9890 -17.9890 -17.3649 -17.3649 -16.2603 -16.2602 -10.3978 -10.3978 -8.5319 -8.5318 -6.6227 -6.6225 -6.1099 -6.1098 -5.5144 -5.5138 -4.8767 -4.8749 -4.7695 -4.7685 -4.5650 -4.5645 -4.3535 -4.3497 -4.0526 -4.0470 -3.8155 -3.8132 -3.4043 -3.4033 -3.0256 -3.0239 -2.9974 -2.9954 -2.6073 -2.6040 -2.3918 -2.3875 -2.0903 -2.0888 -1.8688 -1.8634 -1.5208 -1.5158 -1.2695 -1.2602 -1.1240 -1.1064 -1.0878 -1.0618 -0.9776 -0.9397 -0.8831 -0.8569 -0.8047 -0.7870 -0.6794 -0.6607 -0.3656 -0.3552 0.6902 0.6949 1.3858 1.3885 2.4030 2.4039 k =-0.2857-0.1650 0.0833 ( 11657 PWs) bands (ev): -19.6354 -19.6353 -19.3086 -19.3086 -18.6613 -18.6612 -17.9884 -17.9884 -17.3653 -17.3653 -16.2601 -16.2600 -10.3976 -10.3976 -8.5337 -8.5336 -6.6271 -6.6270 -6.1157 -6.1156 -5.5145 -5.5139 -4.8796 -4.8778 -4.7753 -4.7744 -4.5641 -4.5635 -4.3549 -4.3513 -4.0474 -4.0420 -3.8200 -3.8177 -3.4139 -3.4129 -3.0266 -3.0249 -3.0023 -3.0004 -2.5987 -2.5956 -2.3876 -2.3834 -2.0950 -2.0936 -1.8653 -1.8602 -1.5193 -1.5144 -1.2646 -1.2543 -1.1224 -1.1075 -1.0835 -1.0643 -0.9760 -0.9389 -0.8812 -0.8559 -0.8042 -0.7857 -0.6790 -0.6596 -0.3669 -0.3564 0.7404 0.7450 1.4421 1.4449 2.4009 2.4018 k =-0.3000-0.1732 0.0875 ( 11649 PWs) bands (ev): -19.6352 -19.6351 -19.3086 -19.3086 -18.6612 -18.6612 -17.9878 -17.9878 -17.3657 -17.3657 -16.2599 -16.2598 -10.3974 -10.3974 -8.5354 -8.5353 -6.6315 -6.6313 -6.1214 -6.1213 -5.5146 -5.5140 -4.8830 -4.8812 -4.7802 -4.7794 -4.5631 -4.5626 -4.3563 -4.3528 -4.0427 -4.0375 -3.8246 -3.8223 -3.4229 -3.4218 -3.0295 -3.0277 -3.0052 -3.0037 -2.5899 -2.5869 -2.3839 -2.3798 -2.0997 -2.0984 -1.8613 -1.8564 -1.5182 -1.5132 -1.2590 -1.2477 -1.1226 -1.1078 -1.0793 -1.0666 -0.9743 -0.9384 -0.8790 -0.8549 -0.8036 -0.7843 -0.6786 -0.6588 -0.3677 -0.3572 0.7901 0.7945 1.4987 1.5016 2.3986 2.3994 k =-0.3143-0.1815 0.0917 ( 11645 PWs) bands (ev): -19.6350 -19.6350 -19.3086 -19.3085 -18.6611 -18.6611 -17.9872 -17.9872 -17.3661 -17.3661 -16.2597 -16.2596 -10.3972 -10.3972 -8.5371 -8.5370 -6.6358 -6.6356 -6.1269 -6.1268 -5.5147 -5.5141 -4.8869 -4.8852 -4.7843 -4.7835 -4.5621 -4.5616 -4.3576 -4.3543 -4.0385 -4.0334 -3.8292 -3.8269 -3.4313 -3.4302 -3.0342 -3.0324 -3.0063 -3.0052 -2.5809 -2.5780 -2.3807 -2.3768 -2.1043 -2.1030 -1.8567 -1.8521 -1.5174 -1.5124 -1.2527 -1.2405 -1.1245 -1.1074 -1.0758 -1.0681 -0.9725 -0.9381 -0.8766 -0.8538 -0.8028 -0.7830 -0.6782 -0.6582 -0.3682 -0.3578 0.8388 0.8431 1.5553 1.5582 2.3958 2.3965 k =-0.3286-0.1897 0.0958 ( 11645 PWs) bands (ev): -19.6348 -19.6348 -19.3085 -19.3085 -18.6610 -18.6610 -17.9867 -17.9867 -17.3665 -17.3665 -16.2595 -16.2595 -10.3970 -10.3970 -8.5388 -8.5386 -6.6399 -6.6397 -6.1322 -6.1320 -5.5148 -5.5142 -4.8912 -4.8895 -4.7875 -4.7868 -4.5611 -4.5606 -4.3587 -4.3556 -4.0347 -4.0299 -3.8339 -3.8316 -3.4391 -3.4379 -3.0398 -3.0380 -3.0062 -3.0054 -2.5719 -2.5691 -2.3780 -2.3743 -2.1088 -2.1076 -1.8519 -1.8476 -1.5170 -1.5120 -1.2457 -1.2328 -1.1272 -1.1071 -1.0742 -1.0678 -0.9706 -0.9379 -0.8740 -0.8527 -0.8019 -0.7819 -0.6776 -0.6578 -0.3683 -0.3583 0.8864 0.8904 1.6111 1.6141 2.3913 2.3920 k =-0.3429-0.1979 0.1000 ( 11644 PWs) bands (ev): -19.6346 -19.6346 -19.3085 -19.3085 -18.6609 -18.6609 -17.9862 -17.9862 -17.3668 -17.3668 -16.2593 -16.2593 -10.3968 -10.3968 -8.5403 -8.5402 -6.6438 -6.6436 -6.1371 -6.1370 -5.5149 -5.5143 -4.8957 -4.8941 -4.7900 -4.7893 -4.5601 -4.5596 -4.3598 -4.3569 -4.0315 -4.0270 -3.8385 -3.8362 -3.4462 -3.4450 -3.0458 -3.0441 -3.0057 -3.0049 -2.5631 -2.5604 -2.3758 -2.3723 -2.1130 -2.1119 -1.8468 -1.8428 -1.5169 -1.5118 -1.2382 -1.2248 -1.1302 -1.1073 -1.0744 -1.0657 -0.9686 -0.9378 -0.8713 -0.8515 -0.8008 -0.7809 -0.6769 -0.6576 -0.3682 -0.3585 0.9324 0.9362 1.6656 1.6686 2.3762 2.3781 k =-0.3571-0.2062 0.1042 ( 11641 PWs) bands (ev): -19.6344 -19.6344 -19.3085 -19.3084 -18.6608 -18.6608 -17.9857 -17.9857 -17.3672 -17.3672 -16.2592 -16.2591 -10.3966 -10.3966 -8.5417 -8.5416 -6.6475 -6.6474 -6.1418 -6.1416 -5.5149 -5.5144 -4.9002 -4.8988 -4.7919 -4.7913 -4.5591 -4.5586 -4.3606 -4.3580 -4.0288 -4.0246 -3.8428 -3.8407 -3.4526 -3.4514 -3.0518 -3.0501 -3.0048 -3.0042 -2.5545 -2.5519 -2.3741 -2.3708 -2.1170 -2.1160 -1.8416 -1.8379 -1.5171 -1.5121 -1.2304 -1.2166 -1.1333 -1.1081 -1.0749 -1.0634 -0.9666 -0.9379 -0.8684 -0.8504 -0.7996 -0.7801 -0.6760 -0.6575 -0.3678 -0.3587 0.9765 0.9801 1.7181 1.7212 2.3399 2.3434 k =-0.3714-0.2144 0.1083 ( 11641 PWs) bands (ev): -19.6343 -19.6343 -19.3084 -19.3084 -18.6608 -18.6608 -17.9852 -17.9852 -17.3675 -17.3675 -16.2590 -16.2590 -10.3965 -10.3965 -8.5431 -8.5430 -6.6510 -6.6508 -6.1461 -6.1459 -5.5150 -5.5144 -4.9048 -4.9035 -4.7933 -4.7928 -4.5581 -4.5576 -4.3614 -4.3589 -4.0266 -4.0227 -3.8470 -3.8449 -3.4583 -3.4571 -3.0574 -3.0558 -3.0039 -3.0033 -2.5464 -2.5439 -2.3728 -2.3697 -2.1207 -2.1198 -1.8364 -1.8330 -1.5176 -1.5126 -1.2223 -1.2084 -1.1362 -1.1096 -1.0752 -1.0614 -0.9645 -0.9381 -0.8655 -0.8493 -0.7982 -0.7795 -0.6750 -0.6575 -0.3673 -0.3587 1.0184 1.0217 1.7680 1.7712 2.2998 2.3041 k =-0.3857-0.2227 0.1125 ( 11639 PWs) bands (ev): -19.6342 -19.6341 -19.3084 -19.3084 -18.6607 -18.6607 -17.9848 -17.9848 -17.3678 -17.3678 -16.2589 -16.2588 -10.3963 -10.3963 -8.5443 -8.5442 -6.6541 -6.6540 -6.1500 -6.1499 -5.5150 -5.5145 -4.9091 -4.9080 -4.7943 -4.7939 -4.5571 -4.5567 -4.3619 -4.3597 -4.0249 -4.0214 -3.8507 -3.8489 -3.4633 -3.4622 -3.0627 -3.0612 -3.0029 -3.0024 -2.5387 -2.5364 -2.3719 -2.3690 -2.1240 -2.1232 -1.8314 -1.8283 -1.5182 -1.5135 -1.2141 -1.2003 -1.1389 -1.1116 -1.0751 -1.0599 -0.9623 -0.9385 -0.8626 -0.8483 -0.7967 -0.7791 -0.6739 -0.6577 -0.3665 -0.3587 1.0576 1.0607 1.8145 1.8179 2.2618 2.2667 k =-0.4000-0.2309 0.1167 ( 11646 PWs) bands (ev): -19.6340 -19.6340 -19.3084 -19.3084 -18.6607 -18.6607 -17.9844 -17.9844 -17.3680 -17.3680 -16.2587 -16.2587 -10.3962 -10.3962 -8.5454 -8.5453 -6.6570 -6.6569 -6.1535 -6.1534 -5.5150 -5.5145 -4.9132 -4.9122 -4.7950 -4.7947 -4.5562 -4.5558 -4.3624 -4.3604 -4.0237 -4.0205 -3.8542 -3.8524 -3.4676 -3.4666 -3.0674 -3.0661 -3.0020 -3.0015 -2.5316 -2.5294 -2.3713 -2.3687 -2.1270 -2.1263 -1.8265 -1.8239 -1.5189 -1.5145 -1.2061 -1.1926 -1.1413 -1.1139 -1.0748 -1.0589 -0.9602 -0.9390 -0.8598 -0.8474 -0.7951 -0.7789 -0.6726 -0.6580 -0.3657 -0.3587 1.0938 1.0965 1.8568 1.8605 2.2270 2.2325 k =-0.4143-0.2392 0.1208 ( 11656 PWs) bands (ev): -19.6339 -19.6339 -19.3084 -19.3084 -18.6606 -18.6606 -17.9841 -17.9841 -17.3683 -17.3683 -16.2586 -16.2586 -10.3961 -10.3960 -8.5464 -8.5463 -6.6596 -6.6595 -6.1566 -6.1565 -5.5150 -5.5146 -4.9169 -4.9160 -4.7955 -4.7952 -4.5554 -4.5550 -4.3627 -4.3609 -4.0227 -4.0200 -3.8571 -3.8556 -3.4713 -3.4704 -3.0716 -3.0705 -3.0011 -3.0007 -2.5251 -2.5232 -2.3710 -2.3687 -2.1296 -2.1290 -1.8221 -1.8198 -1.5197 -1.5157 -1.1985 -1.1855 -1.1434 -1.1165 -1.0741 -1.0584 -0.9581 -0.9396 -0.8572 -0.8467 -0.7934 -0.7790 -0.6712 -0.6584 -0.3648 -0.3586 1.1264 1.1289 1.8942 1.8983 2.1963 2.2022 k =-0.4286-0.2474 0.1250 ( 11649 PWs) bands (ev): -19.6338 -19.6338 -19.3084 -19.3083 -18.6606 -18.6606 -17.9838 -17.9838 -17.3685 -17.3685 -16.2585 -16.2585 -10.3959 -10.3959 -8.5472 -8.5472 -6.6618 -6.6617 -6.1593 -6.1592 -5.5150 -5.5146 -4.9202 -4.9194 -4.7959 -4.7956 -4.5547 -4.5544 -4.3628 -4.3614 -4.0221 -4.0198 -3.8596 -3.8583 -3.4744 -3.4735 -3.0752 -3.0742 -3.0003 -3.0000 -2.5195 -2.5178 -2.3709 -2.3689 -2.1318 -2.1312 -1.8181 -1.8161 -1.5204 -1.5170 -1.1914 -1.1792 -1.1449 -1.1194 -1.0732 -1.0585 -0.9560 -0.9404 -0.8547 -0.8461 -0.7917 -0.7792 -0.6698 -0.6589 -0.3638 -0.3586 1.1551 1.1573 1.9260 1.9305 2.1703 2.1766 k =-0.4429-0.2557 0.1292 ( 11643 PWs) bands (ev): -19.6337 -19.6337 -19.3083 -19.3083 -18.6605 -18.6605 -17.9836 -17.9836 -17.3686 -17.3686 -16.2584 -16.2584 -10.3959 -10.3958 -8.5479 -8.5479 -6.6636 -6.6635 -6.1615 -6.1614 -5.5149 -5.5147 -4.9229 -4.9223 -4.7961 -4.7959 -4.5540 -4.5538 -4.3629 -4.3617 -4.0217 -4.0198 -3.8617 -3.8606 -3.4768 -3.4761 -3.0782 -3.0774 -2.9997 -2.9994 -2.5147 -2.5133 -2.3709 -2.3693 -2.1336 -2.1331 -1.8146 -1.8130 -1.5210 -1.5182 -1.1851 -1.1739 -1.1456 -1.1225 -1.0720 -1.0590 -0.9539 -0.9413 -0.8525 -0.8457 -0.7899 -0.7797 -0.6684 -0.6595 -0.3629 -0.3586 1.1795 1.1812 1.9517 1.9564 2.1498 2.1561 k =-0.4571-0.2639 0.1333 ( 11638 PWs) bands (ev): -19.6337 -19.6337 -19.3083 -19.3083 -18.6605 -18.6605 -17.9834 -17.9834 -17.3688 -17.3688 -16.2584 -16.2584 -10.3958 -10.3958 -8.5484 -8.5484 -6.6650 -6.6650 -6.1632 -6.1631 -5.5149 -5.5147 -4.9250 -4.9246 -4.7962 -4.7961 -4.5535 -4.5533 -4.3629 -4.3620 -4.0215 -4.0200 -3.8632 -3.8624 -3.4787 -3.4781 -3.0805 -3.0799 -2.9991 -2.9990 -2.5108 -2.5097 -2.3709 -2.3697 -2.1349 -2.1346 -1.8117 -1.8106 -1.5215 -1.5193 -1.1797 -1.1702 -1.1452 -1.1258 -1.0704 -1.0600 -0.9519 -0.9424 -0.8506 -0.8455 -0.7882 -0.7804 -0.6670 -0.6602 -0.3620 -0.3588 1.1990 1.2003 1.9709 1.9754 2.1350 2.1408 k =-0.4714-0.2722 0.1375 ( 11642 PWs) bands (ev): -19.6336 -19.6336 -19.3083 -19.3083 -18.6605 -18.6605 -17.9833 -17.9833 -17.3688 -17.3688 -16.2583 -16.2583 -10.3957 -10.3957 -8.5488 -8.5488 -6.6660 -6.6660 -6.1644 -6.1644 -5.5149 -5.5147 -4.9266 -4.9263 -4.7963 -4.7962 -4.5531 -4.5530 -4.3628 -4.3622 -4.0213 -4.0203 -3.8643 -3.8637 -3.4799 -3.4796 -3.0821 -3.0817 -2.9987 -2.9986 -2.5079 -2.5072 -2.3709 -2.3701 -2.1359 -2.1357 -1.8096 -1.8088 -1.5218 -1.5203 -1.1752 -1.1682 -1.1435 -1.1294 -1.0687 -1.0614 -0.9500 -0.9436 -0.8490 -0.8456 -0.7866 -0.7813 -0.6656 -0.6611 -0.3611 -0.3590 1.2133 1.2142 1.9839 1.9876 2.1260 2.1306 k =-0.4857-0.2804 0.1417 ( 11645 PWs) bands (ev): -19.6336 -19.6336 -19.3083 -19.3083 -18.6605 -18.6605 -17.9832 -17.9832 -17.3689 -17.3689 -16.2583 -16.2583 -10.3957 -10.3957 -8.5491 -8.5491 -6.6666 -6.6666 -6.1652 -6.1651 -5.5148 -5.5148 -4.9275 -4.9273 -4.7963 -4.7963 -4.5529 -4.5528 -4.3627 -4.3624 -4.0211 -4.0206 -3.8649 -3.8646 -3.4807 -3.4805 -3.0830 -3.0828 -2.9985 -2.9984 -2.5060 -2.5057 -2.3709 -2.3705 -2.1365 -2.1364 -1.8082 -1.8078 -1.5218 -1.5211 -1.1718 -1.1681 -1.1405 -1.1331 -1.0668 -1.0631 -0.9482 -0.9450 -0.8477 -0.8460 -0.7850 -0.7824 -0.6644 -0.6621 -0.3604 -0.3593 1.2221 1.2225 1.9915 1.9936 2.1220 2.1245 k =-0.5000-0.2887 0.1458 ( 11644 PWs) bands (ev): -19.6336 -19.6336 -19.3083 -19.3083 -18.6605 -18.6605 -17.9831 -17.9831 -17.3689 -17.3689 -16.2583 -16.2583 -10.3957 -10.3957 -8.5491 -8.5491 -6.6669 -6.6669 -6.1654 -6.1654 -5.5148 -5.5148 -4.9277 -4.9277 -4.7963 -4.7963 -4.5528 -4.5528 -4.3626 -4.3626 -4.0208 -4.0208 -3.8650 -3.8650 -3.4808 -3.4808 -3.0833 -3.0833 -2.9984 -2.9984 -2.5053 -2.5053 -2.3707 -2.3707 -2.1366 -2.1366 -1.8076 -1.8076 -1.5216 -1.5216 -1.1693 -1.1693 -1.1369 -1.1369 -1.0649 -1.0649 -0.9466 -0.9466 -0.8467 -0.8467 -0.7836 -0.7836 -0.6632 -0.6632 -0.3598 -0.3598 1.2252 1.2252 1.9947 1.9947 2.1218 2.1218 k =-0.5000-0.8660 0.0729 ( 11676 PWs) bands (ev): -19.6295 -19.6295 -19.3055 -19.3055 -18.6592 -18.6592 -17.9863 -17.9863 -17.3729 -17.3729 -16.2576 -16.2576 -10.5425 -10.5425 -8.4596 -8.4596 -6.6113 -6.6113 -6.1436 -6.1436 -5.2081 -5.2081 -4.9442 -4.9442 -4.7502 -4.7502 -4.4484 -4.4484 -4.3516 -4.3516 -4.0499 -4.0499 -3.9616 -3.9616 -3.4516 -3.4516 -3.1062 -3.1062 -2.9762 -2.9762 -2.8786 -2.8786 -2.3592 -2.3592 -2.0299 -2.0299 -1.7648 -1.7648 -1.4527 -1.4527 -1.3383 -1.3383 -1.1388 -1.1388 -1.0788 -1.0788 -0.9658 -0.9658 -0.8682 -0.8682 -0.7930 -0.7930 -0.7395 -0.7395 -0.3389 -0.3389 1.2802 1.2802 1.5104 1.5104 2.0793 2.0793 k =-0.4914-0.8511 0.0717 ( 11672 PWs) bands (ev): -19.6295 -19.6295 -19.3055 -19.3055 -18.6593 -18.6592 -17.9863 -17.9863 -17.3729 -17.3729 -16.2576 -16.2576 -10.5424 -10.5424 -8.4601 -8.4601 -6.6114 -6.6114 -6.1436 -6.1435 -5.2083 -5.2082 -4.9440 -4.9438 -4.7505 -4.7504 -4.4486 -4.4485 -4.3515 -4.3512 -4.0511 -4.0504 -3.9611 -3.9602 -3.4516 -3.4516 -3.1067 -3.1065 -2.9768 -2.9764 -2.8766 -2.8762 -2.3594 -2.3592 -2.0297 -2.0297 -1.7648 -1.7646 -1.4535 -1.4528 -1.3382 -1.3378 -1.1392 -1.1381 -1.0797 -1.0776 -0.9681 -0.9634 -0.8699 -0.8665 -0.7947 -0.7920 -0.7412 -0.7373 -0.3395 -0.3386 1.2806 1.2807 1.5095 1.5099 2.0782 2.0785 k =-0.4828-0.8362 0.0704 ( 11666 PWs) bands (ev): -19.6295 -19.6295 -19.3055 -19.3055 -18.6593 -18.6592 -17.9863 -17.9863 -17.3729 -17.3729 -16.2576 -16.2576 -10.5421 -10.5421 -8.4616 -8.4616 -6.6117 -6.6116 -6.1434 -6.1433 -5.2088 -5.2086 -4.9432 -4.9430 -4.7513 -4.7510 -4.4492 -4.4490 -4.3509 -4.3502 -4.0540 -4.0527 -3.9586 -3.9569 -3.4517 -3.4516 -3.1079 -3.1075 -2.9780 -2.9773 -2.8706 -2.8697 -2.3597 -2.3593 -2.0290 -2.0288 -1.7648 -1.7644 -1.4552 -1.4538 -1.3373 -1.3366 -1.1393 -1.1371 -1.0804 -1.0762 -0.9703 -0.9610 -0.8716 -0.8649 -0.7968 -0.7915 -0.7425 -0.7349 -0.3404 -0.3385 1.2818 1.2820 1.5072 1.5079 2.0752 2.0758 k =-0.4741-0.8212 0.0691 ( 11651 PWs) bands (ev): -19.6295 -19.6295 -19.3055 -19.3055 -18.6593 -18.6592 -17.9863 -17.9863 -17.3728 -17.3728 -16.2576 -16.2575 -10.5416 -10.5416 -8.4641 -8.4640 -6.6121 -6.6120 -6.1430 -6.1429 -5.2097 -5.2094 -4.9419 -4.9416 -4.7526 -4.7521 -4.4501 -4.4498 -4.3497 -4.3488 -4.0582 -4.0564 -3.9545 -3.9522 -3.4518 -3.4517 -3.1097 -3.1092 -2.9795 -2.9786 -2.8608 -2.8596 -2.3602 -2.3595 -2.0276 -2.0275 -1.7647 -1.7641 -1.4579 -1.4558 -1.3358 -1.3347 -1.1391 -1.1359 -1.0808 -1.0746 -0.9723 -0.9585 -0.8732 -0.8632 -0.7993 -0.7918 -0.7432 -0.7322 -0.3415 -0.3387 1.2839 1.2842 1.5034 1.5044 2.0703 2.0713 k =-0.4655-0.8063 0.0679 ( 11647 PWs) bands (ev): -19.6295 -19.6295 -19.3056 -19.3056 -18.6593 -18.6593 -17.9863 -17.9863 -17.3727 -17.3726 -16.2575 -16.2575 -10.5408 -10.5408 -8.4675 -8.4674 -6.6126 -6.6126 -6.1425 -6.1423 -5.2109 -5.2106 -4.9401 -4.9396 -4.7542 -4.7536 -4.4513 -4.4510 -4.3481 -4.3469 -4.0633 -4.0612 -3.9491 -3.9463 -3.4519 -3.4518 -3.1120 -3.1114 -2.9812 -2.9802 -2.8479 -2.8464 -2.3608 -2.3599 -2.0258 -2.0255 -1.7645 -1.7637 -1.4614 -1.4588 -1.3335 -1.3322 -1.1389 -1.1346 -1.0810 -1.0729 -0.9741 -0.9560 -0.8748 -0.8617 -0.8021 -0.7928 -0.7433 -0.7293 -0.3428 -0.3391 1.2867 1.2872 1.4981 1.4995 2.0636 2.0648 k =-0.4569-0.7914 0.0666 ( 11650 PWs) bands (ev): -19.6295 -19.6295 -19.3056 -19.3056 -18.6593 -18.6593 -17.9863 -17.9863 -17.3725 -17.3725 -16.2575 -16.2575 -10.5399 -10.5399 -8.4719 -8.4718 -6.6134 -6.6133 -6.1418 -6.1416 -5.2124 -5.2120 -4.9379 -4.9373 -4.7563 -4.7556 -4.4528 -4.4525 -4.3460 -4.3446 -4.0689 -4.0666 -3.9429 -3.9396 -3.4520 -3.4518 -3.1145 -3.1137 -2.9829 -2.9817 -2.8324 -2.8307 -2.3615 -2.3604 -2.0233 -2.0230 -1.7641 -1.7632 -1.4659 -1.4627 -1.3305 -1.3290 -1.1385 -1.1331 -1.0809 -1.0710 -0.9756 -0.9535 -0.8763 -0.8602 -0.8051 -0.7945 -0.7428 -0.7264 -0.3443 -0.3397 1.2904 1.2910 1.4914 1.4932 2.0550 2.0565 k =-0.4483-0.7764 0.0654 ( 11659 PWs) bands (ev): -19.6295 -19.6295 -19.3057 -19.3057 -18.6593 -18.6593 -17.9863 -17.9863 -17.3723 -17.3723 -16.2574 -16.2574 -10.5388 -10.5387 -8.4770 -8.4769 -6.6142 -6.6141 -6.1410 -6.1408 -5.2143 -5.2138 -4.9352 -4.9345 -4.7587 -4.7578 -4.4546 -4.4542 -4.3436 -4.3419 -4.0749 -4.0724 -3.9360 -3.9325 -3.4520 -3.4518 -3.1169 -3.1161 -2.9844 -2.9832 -2.8148 -2.8129 -2.3624 -2.3611 -2.0201 -2.0198 -1.7635 -1.7625 -1.4712 -1.4675 -1.3267 -1.3250 -1.1382 -1.1316 -1.0806 -1.0691 -0.9768 -0.9512 -0.8778 -0.8588 -0.8082 -0.7967 -0.7419 -0.7233 -0.3460 -0.3405 1.2947 1.2954 1.4833 1.4854 2.0446 2.0464 k =-0.4397-0.7615 0.0641 ( 11654 PWs) bands (ev): -19.6294 -19.6294 -19.3057 -19.3057 -18.6593 -18.6593 -17.9863 -17.9863 -17.3721 -17.3721 -16.2574 -16.2573 -10.5374 -10.5374 -8.4830 -8.4829 -6.6151 -6.6151 -6.1400 -6.1397 -5.2165 -5.2160 -4.9321 -4.9313 -4.7614 -4.7604 -4.4567 -4.4563 -4.3408 -4.3390 -4.0810 -4.0783 -3.9288 -3.9249 -3.4520 -3.4517 -3.1192 -3.1183 -2.9858 -2.9846 -2.7956 -2.7934 -2.3635 -2.3620 -2.0162 -2.0158 -1.7627 -1.7615 -1.4773 -1.4731 -1.3222 -1.3203 -1.1380 -1.1301 -1.0799 -1.0671 -0.9776 -0.9488 -0.8792 -0.8575 -0.8114 -0.7992 -0.7405 -0.7202 -0.3478 -0.3414 1.2995 1.3005 1.4738 1.4762 2.0325 2.0346 k =-0.4310-0.7466 0.0629 ( 11649 PWs) bands (ev): -19.6294 -19.6294 -19.3058 -19.3058 -18.6593 -18.6593 -17.9863 -17.9863 -17.3718 -17.3718 -16.2573 -16.2573 -10.5359 -10.5358 -8.4897 -8.4895 -6.6161 -6.6161 -6.1389 -6.1386 -5.2190 -5.2184 -4.9288 -4.9279 -4.7644 -4.7633 -4.4590 -4.4586 -4.3378 -4.3359 -4.0870 -4.0842 -3.9213 -3.9172 -3.4519 -3.4515 -3.1212 -3.1202 -2.9871 -2.9858 -2.7752 -2.7728 -2.3647 -2.3630 -2.0117 -2.0112 -1.7616 -1.7603 -1.4841 -1.4796 -1.3171 -1.3149 -1.1380 -1.1288 -1.0791 -1.0651 -0.9780 -0.9466 -0.8805 -0.8564 -0.8145 -0.8020 -0.7388 -0.7171 -0.3497 -0.3424 1.3047 1.3058 1.4631 1.4658 2.0188 2.0211 k =-0.4224-0.7316 0.0616 ( 11660 PWs) bands (ev): -19.6294 -19.6294 -19.3059 -19.3059 -18.6593 -18.6593 -17.9864 -17.9863 -17.3715 -17.3715 -16.2572 -16.2572 -10.5341 -10.5341 -8.4970 -8.4968 -6.6172 -6.6171 -6.1376 -6.1373 -5.2218 -5.2212 -4.9252 -4.9242 -4.7675 -4.7663 -4.4616 -4.4612 -4.3346 -4.3326 -4.0928 -4.0899 -3.9137 -3.9095 -3.4516 -3.4512 -3.1227 -3.1217 -2.9882 -2.9869 -2.7541 -2.7515 -2.3661 -2.3642 -2.0064 -2.0058 -1.7601 -1.7586 -1.4916 -1.4868 -1.3113 -1.3087 -1.1382 -1.1277 -1.0780 -1.0631 -0.9779 -0.9445 -0.8817 -0.8555 -0.8176 -0.8049 -0.7369 -0.7140 -0.3516 -0.3435 1.3097 1.3111 1.4517 1.4547 2.0036 2.0060 k =-0.4138-0.7167 0.0603 ( 11657 PWs) bands (ev): -19.6294 -19.6294 -19.3059 -19.3059 -18.6593 -18.6593 -17.9864 -17.9864 -17.3712 -17.3712 -16.2572 -16.2571 -10.5322 -10.5322 -8.5049 -8.5047 -6.6182 -6.6182 -6.1362 -6.1358 -5.2250 -5.2244 -4.9214 -4.9204 -4.7707 -4.7694 -4.4644 -4.4640 -4.3313 -4.3293 -4.0983 -4.0953 -3.9061 -3.9017 -3.4511 -3.4506 -3.1238 -3.1227 -2.9893 -2.9878 -2.7325 -2.7297 -2.3677 -2.3656 -2.0005 -1.9998 -1.7580 -1.7565 -1.4997 -1.4947 -1.3050 -1.3017 -1.1387 -1.1268 -1.0768 -1.0612 -0.9772 -0.9425 -0.8829 -0.8547 -0.8204 -0.8077 -0.7347 -0.7109 -0.3534 -0.3445 1.3138 1.3155 1.4404 1.4434 1.9871 1.9896 k =-0.4052-0.7018 0.0591 ( 11670 PWs) bands (ev): -19.6294 -19.6294 -19.3060 -19.3060 -18.6593 -18.6593 -17.9864 -17.9864 -17.3709 -17.3709 -16.2571 -16.2570 -10.5301 -10.5301 -8.5132 -8.5130 -6.6193 -6.6192 -6.1346 -6.1343 -5.2285 -5.2278 -4.9175 -4.9164 -4.7739 -4.7726 -4.4675 -4.4670 -4.3280 -4.3259 -4.1033 -4.1002 -3.8985 -3.8939 -3.4503 -3.4498 -3.1243 -3.1231 -2.9903 -2.9887 -2.7110 -2.7080 -2.3695 -2.3672 -1.9941 -1.9932 -1.7554 -1.7538 -1.5083 -1.5030 -1.2981 -1.2941 -1.1395 -1.1264 -1.0755 -1.0593 -0.9761 -0.9407 -0.8839 -0.8542 -0.8230 -0.8103 -0.7324 -0.7079 -0.3551 -0.3454 1.3155 1.3176 1.4303 1.4334 1.9693 1.9719 k =-0.3966-0.6868 0.0578 ( 11664 PWs) bands (ev): -19.6293 -19.6293 -19.3061 -19.3061 -18.6593 -18.6593 -17.9865 -17.9865 -17.3705 -17.3705 -16.2570 -16.2570 -10.5278 -10.5278 -8.5218 -8.5216 -6.6204 -6.6203 -6.1329 -6.1325 -5.2323 -5.2316 -4.9136 -4.9125 -4.7770 -4.7756 -4.4707 -4.4703 -4.3247 -4.3227 -4.1080 -4.1046 -3.8910 -3.8863 -3.4493 -3.4487 -3.1242 -3.1230 -2.9911 -2.9894 -2.6899 -2.6867 -2.3714 -2.3690 -1.9873 -1.9862 -1.7520 -1.7503 -1.5171 -1.5117 -1.2907 -1.2859 -1.1406 -1.1263 -1.0742 -1.0573 -0.9744 -0.9390 -0.8847 -0.8538 -0.8253 -0.8126 -0.7301 -0.7049 -0.3566 -0.3462 1.3130 1.3156 1.4236 1.4264 1.9505 1.9531 k =-0.3879-0.6719 0.0566 ( 11653 PWs) bands (ev): -19.6293 -19.6293 -19.3062 -19.3062 -18.6594 -18.6593 -17.9865 -17.9865 -17.3702 -17.3701 -16.2569 -16.2569 -10.5254 -10.5254 -8.5307 -8.5305 -6.6214 -6.6213 -6.1311 -6.1307 -5.2365 -5.2358 -4.9098 -4.9087 -4.7799 -4.7785 -4.4741 -4.4737 -4.3215 -4.3196 -4.1120 -4.1085 -3.8837 -3.8789 -3.4480 -3.4474 -3.1235 -3.1222 -2.9919 -2.9901 -2.6696 -2.6662 -2.3735 -2.3710 -1.9804 -1.9791 -1.7478 -1.7459 -1.5261 -1.5205 -1.2827 -1.2771 -1.1420 -1.1265 -1.0729 -1.0554 -0.9723 -0.9375 -0.8854 -0.8536 -0.8273 -0.8146 -0.7276 -0.7020 -0.3578 -0.3468 1.3045 1.3075 1.4221 1.4243 1.9307 1.9333 k =-0.3793-0.6570 0.0553 ( 11663 PWs) bands (ev): -19.6293 -19.6293 -19.3063 -19.3063 -18.6594 -18.6594 -17.9866 -17.9866 -17.3698 -17.3697 -16.2569 -16.2568 -10.5228 -10.5228 -8.5398 -8.5396 -6.6223 -6.6222 -6.1292 -6.1288 -5.2410 -5.2403 -4.9062 -4.9050 -4.7825 -4.7811 -4.4778 -4.4773 -4.3186 -4.3168 -4.1154 -4.1118 -3.8765 -3.8716 -3.4464 -3.4456 -3.1222 -3.1207 -2.9925 -2.9906 -2.6503 -2.6468 -2.3758 -2.3732 -1.9738 -1.9723 -1.7427 -1.7407 -1.5350 -1.5293 -1.2742 -1.2677 -1.1436 -1.1272 -1.0717 -1.0533 -0.9699 -0.9361 -0.8860 -0.8536 -0.8290 -0.8161 -0.7251 -0.6992 -0.3588 -0.3471 1.2894 1.2928 1.4260 1.4277 1.9103 1.9128 k =-0.3707-0.6421 0.0541 ( 11663 PWs) bands (ev): -19.6293 -19.6293 -19.3064 -19.3064 -18.6594 -18.6594 -17.9866 -17.9866 -17.3693 -17.3693 -16.2568 -16.2568 -10.5200 -10.5200 -8.5489 -8.5487 -6.6232 -6.6231 -6.1271 -6.1267 -5.2458 -5.2451 -4.9028 -4.9016 -4.7848 -4.7832 -4.4816 -4.4810 -4.3158 -4.3143 -4.1182 -4.1143 -3.8695 -3.8646 -3.4444 -3.4436 -3.1202 -3.1186 -2.9931 -2.9911 -2.6323 -2.6287 -2.3783 -2.3755 -1.9677 -1.9661 -1.7369 -1.7346 -1.5435 -1.5377 -1.2652 -1.2579 -1.1454 -1.1282 -1.0705 -1.0511 -0.9673 -0.9348 -0.8864 -0.8536 -0.8304 -0.8171 -0.7226 -0.6965 -0.3593 -0.3472 1.2689 1.2726 1.4344 1.4356 1.8892 1.8917 k =-0.3621-0.6271 0.0528 ( 11660 PWs) bands (ev): -19.6294 -19.6294 -19.3065 -19.3065 -18.6594 -18.6594 -17.9867 -17.9867 -17.3689 -17.3689 -16.2567 -16.2567 -10.5171 -10.5171 -8.5579 -8.5577 -6.6240 -6.6239 -6.1249 -6.1245 -5.2509 -5.2502 -4.8997 -4.8985 -4.7865 -4.7849 -4.4855 -4.4849 -4.3135 -4.3121 -4.1203 -4.1161 -3.8628 -3.8578 -3.4420 -3.4411 -3.1176 -3.1158 -2.9935 -2.9914 -2.6158 -2.6122 -2.3809 -2.3780 -1.9627 -1.9609 -1.7306 -1.7280 -1.5511 -1.5453 -1.2557 -1.2476 -1.1473 -1.1294 -1.0694 -1.0488 -0.9647 -0.9336 -0.8866 -0.8537 -0.8314 -0.8176 -0.7201 -0.6940 -0.3595 -0.3469 1.2442 1.2482 1.4459 1.4467 1.8679 1.8703 k =-0.3534-0.6122 0.0515 ( 11664 PWs) bands (ev): -19.6294 -19.6294 -19.3067 -19.3066 -18.6595 -18.6594 -17.9868 -17.9868 -17.3685 -17.3685 -16.2567 -16.2566 -10.5141 -10.5141 -8.5668 -8.5666 -6.6246 -6.6245 -6.1227 -6.1223 -5.2563 -5.2557 -4.8970 -4.8957 -4.7877 -4.7860 -4.4896 -4.4889 -4.3115 -4.3103 -4.1217 -4.1172 -3.8563 -3.8513 -3.4391 -3.4382 -3.1143 -3.1124 -2.9938 -2.9916 -2.6010 -2.5973 -2.3836 -2.3807 -1.9589 -1.9571 -1.7244 -1.7214 -1.5573 -1.5515 -1.2457 -1.2369 -1.1491 -1.1307 -1.0684 -1.0464 -0.9622 -0.9323 -0.8868 -0.8538 -0.8320 -0.8177 -0.7176 -0.6917 -0.3591 -0.3462 1.2164 1.2205 1.4591 1.4599 1.8465 1.8488 k =-0.3448-0.5973 0.0503 ( 11646 PWs) bands (ev): -19.6294 -19.6294 -19.3068 -19.3068 -18.6595 -18.6595 -17.9869 -17.9869 -17.3680 -17.3680 -16.2566 -16.2566 -10.5110 -10.5109 -8.5755 -8.5753 -6.6251 -6.6250 -6.1203 -6.1199 -5.2621 -5.2614 -4.8947 -4.8934 -4.7882 -4.7865 -4.4938 -4.4931 -4.3099 -4.3089 -4.1223 -4.1176 -3.8501 -3.8451 -3.4359 -3.4350 -3.1105 -3.1084 -2.9938 -2.9915 -2.5880 -2.5843 -2.3863 -2.3834 -1.9567 -1.9549 -1.7190 -1.7157 -1.5614 -1.5557 -1.2352 -1.2259 -1.1508 -1.1318 -1.0673 -1.0439 -0.9599 -0.9308 -0.8869 -0.8538 -0.8321 -0.8173 -0.7151 -0.6896 -0.3583 -0.3451 1.1861 1.1903 1.4734 1.4744 1.8255 1.8277 k =-0.3362-0.5823 0.0490 ( 11633 PWs) bands (ev): -19.6295 -19.6295 -19.3069 -19.3069 -18.6595 -18.6595 -17.9870 -17.9870 -17.3676 -17.3676 -16.2566 -16.2566 -10.5077 -10.5076 -8.5838 -8.5836 -6.6255 -6.6254 -6.1179 -6.1175 -5.2681 -5.2676 -4.8928 -4.8915 -4.7880 -4.7863 -4.4980 -4.4973 -4.3088 -4.3079 -4.1223 -4.1173 -3.8442 -3.8392 -3.4323 -3.4313 -3.1060 -3.1038 -2.9936 -2.9913 -2.5768 -2.5732 -2.3891 -2.3863 -1.9562 -1.9545 -1.7154 -1.7119 -1.5627 -1.5573 -1.2241 -1.2149 -1.1523 -1.1324 -1.0663 -1.0414 -0.9580 -0.9292 -0.8869 -0.8538 -0.8318 -0.8165 -0.7126 -0.6877 -0.3569 -0.3435 1.1538 1.1580 1.4880 1.4893 1.8053 1.8075 k =-0.3276-0.5674 0.0478 ( 11651 PWs) bands (ev): -19.6295 -19.6295 -19.3070 -19.3070 -18.6596 -18.6596 -17.9872 -17.9872 -17.3671 -17.3671 -16.2566 -16.2565 -10.5043 -10.5043 -8.5918 -8.5916 -6.6258 -6.6257 -6.1154 -6.1150 -5.2745 -5.2740 -4.8913 -4.8901 -4.7871 -4.7854 -4.5024 -4.5015 -4.3082 -4.3072 -4.1216 -4.1164 -3.8387 -3.8336 -3.4283 -3.4273 -3.1011 -3.0986 -2.9930 -2.9907 -2.5674 -2.5639 -2.3919 -2.3892 -1.9574 -1.9558 -1.7143 -1.7108 -1.5608 -1.5560 -1.2127 -1.2042 -1.1536 -1.1323 -1.0653 -1.0389 -0.9566 -0.9274 -0.8868 -0.8538 -0.8311 -0.8155 -0.7102 -0.6860 -0.3549 -0.3415 1.1198 1.1239 1.5021 1.5038 1.7869 1.7890 k =-0.3190-0.5525 0.0465 ( 11656 PWs) bands (ev): -19.6296 -19.6296 -19.3071 -19.3071 -18.6596 -18.6596 -17.9873 -17.9873 -17.3667 -17.3667 -16.2566 -16.2565 -10.5009 -10.5008 -8.5992 -8.5990 -6.6259 -6.6257 -6.1129 -6.1125 -5.2811 -5.2807 -4.8902 -4.8890 -4.7855 -4.7838 -4.5068 -4.5058 -4.3080 -4.3068 -4.1203 -4.1148 -3.8334 -3.8283 -3.4239 -3.4229 -3.0956 -3.0929 -2.9920 -2.9897 -2.5599 -2.5565 -2.3947 -2.3921 -1.9604 -1.9589 -1.7161 -1.7128 -1.5561 -1.5519 -1.2010 -1.1940 -1.1543 -1.1308 -1.0642 -1.0364 -0.9555 -0.9255 -0.8866 -0.8538 -0.8299 -0.8140 -0.7079 -0.6846 -0.3524 -0.3390 1.0843 1.0883 1.5145 1.5167 1.7711 1.7732 k =-0.3103-0.5375 0.0453 ( 11662 PWs) bands (ev): -19.6297 -19.6297 -19.3072 -19.3072 -18.6597 -18.6597 -17.9875 -17.9875 -17.3663 -17.3662 -16.2566 -16.2565 -10.4973 -10.4973 -8.6061 -8.6059 -6.6258 -6.6257 -6.1103 -6.1099 -5.2881 -5.2877 -4.8894 -4.8881 -4.7834 -4.7816 -4.5112 -4.5102 -4.3082 -4.3068 -4.1185 -4.1128 -3.8285 -3.8234 -3.4192 -3.4182 -3.0898 -3.0869 -2.9905 -2.9882 -2.5540 -2.5509 -2.3973 -2.3950 -1.9650 -1.9636 -1.7205 -1.7176 -1.5491 -1.5456 -1.1896 -1.1849 -1.1545 -1.1274 -1.0632 -1.0339 -0.9549 -0.9237 -0.8862 -0.8538 -0.8282 -0.8124 -0.7057 -0.6835 -0.3493 -0.3360 1.0474 1.0513 1.5242 1.5267 1.7593 1.7613 k =-0.3017-0.5226 0.0440 ( 11664 PWs) bands (ev): -19.6298 -19.6298 -19.3074 -19.3073 -18.6597 -18.6597 -17.9877 -17.9877 -17.3658 -17.3658 -16.2566 -16.2566 -10.4937 -10.4936 -8.6123 -8.6122 -6.6256 -6.6254 -6.1077 -6.1072 -5.2953 -5.2950 -4.8888 -4.8875 -4.7807 -4.7789 -4.5156 -4.5145 -4.3087 -4.3071 -4.1163 -4.1104 -3.8239 -3.8189 -3.4142 -3.4131 -3.0838 -3.0807 -2.9881 -2.9860 -2.5499 -2.5471 -2.3998 -2.3978 -1.9711 -1.9697 -1.7270 -1.7246 -1.5410 -1.5382 -1.1804 -1.1760 -1.1537 -1.1218 -1.0621 -1.0315 -0.9545 -0.9221 -0.8855 -0.8538 -0.8262 -0.8105 -0.7036 -0.6826 -0.3458 -0.3326 1.0093 1.0131 1.5296 1.5325 1.7526 1.7545 k =-0.2931-0.5077 0.0427 ( 11667 PWs) bands (ev): -19.6300 -19.6300 -19.3075 -19.3075 -18.6598 -18.6598 -17.9879 -17.9879 -17.3654 -17.3654 -16.2567 -16.2566 -10.4900 -10.4899 -8.6179 -8.6177 -6.6252 -6.6251 -6.1050 -6.1046 -5.3028 -5.3025 -4.8883 -4.8870 -4.7775 -4.7757 -4.5200 -4.5188 -4.3095 -4.3076 -4.1137 -4.1076 -3.8196 -3.8146 -3.4089 -3.4079 -3.0777 -3.0745 -2.9849 -2.9829 -2.5474 -2.5450 -2.4022 -2.4005 -1.9786 -1.9771 -1.7351 -1.7332 -1.5328 -1.5303 -1.1747 -1.1676 -1.1505 -1.1142 -1.0610 -1.0292 -0.9543 -0.9209 -0.8844 -0.8538 -0.8238 -0.8084 -0.7016 -0.6820 -0.3418 -0.3288 0.9700 0.9736 1.5298 1.5330 1.7518 1.7535 k =-0.2845-0.4927 0.0415 ( 11667 PWs) bands (ev): -19.6301 -19.6301 -19.3076 -19.3076 -18.6599 -18.6598 -17.9881 -17.9881 -17.3650 -17.3650 -16.2567 -16.2567 -10.4862 -10.4862 -8.6227 -8.6226 -6.6246 -6.6245 -6.1023 -6.1019 -5.3105 -5.3103 -4.8878 -4.8864 -4.7739 -4.7722 -4.5243 -4.5230 -4.3105 -4.3084 -4.1109 -4.1046 -3.8156 -3.8107 -3.4034 -3.4024 -3.0719 -3.0684 -2.9804 -2.9787 -2.5466 -2.5445 -2.4044 -2.4031 -1.9874 -1.9856 -1.7441 -1.7427 -1.5253 -1.5227 -1.1708 -1.1629 -1.1432 -1.1054 -1.0598 -1.0270 -0.9542 -0.9201 -0.8830 -0.8537 -0.8212 -0.8062 -0.6998 -0.6816 -0.3374 -0.3246 0.9296 0.9331 1.5243 1.5276 1.7565 1.7580 k =-0.2759-0.4778 0.0402 ( 11664 PWs) bands (ev): -19.6303 -19.6303 -19.3077 -19.3077 -18.6600 -18.6599 -17.9883 -17.9883 -17.3645 -17.3645 -16.2568 -16.2568 -10.4825 -10.4824 -8.6268 -8.6267 -6.6239 -6.6238 -6.0996 -6.0992 -5.3185 -5.3182 -4.8872 -4.8858 -4.7700 -4.7683 -4.5285 -4.5272 -4.3117 -4.3093 -4.1079 -4.1015 -3.8119 -3.8071 -3.3977 -3.3967 -3.0665 -3.0629 -2.9745 -2.9731 -2.5473 -2.5456 -2.4064 -2.4054 -1.9972 -1.9951 -1.7538 -1.7527 -1.5188 -1.5160 -1.1679 -1.1609 -1.1334 -1.0964 -1.0585 -1.0250 -0.9542 -0.9198 -0.8813 -0.8535 -0.8183 -0.8039 -0.6982 -0.6815 -0.3329 -0.3203 0.8882 0.8916 1.5133 1.5168 1.7651 1.7666 k =-0.2672-0.4629 0.0390 ( 11665 PWs) bands (ev): -19.6305 -19.6305 -19.3078 -19.3078 -18.6600 -18.6600 -17.9885 -17.9885 -17.3641 -17.3641 -16.2569 -16.2569 -10.4787 -10.4786 -8.6301 -8.6300 -6.6231 -6.6229 -6.0968 -6.0964 -5.3267 -5.3264 -4.8866 -4.8851 -4.7659 -4.7641 -4.5327 -4.5313 -4.3129 -4.3104 -4.1048 -4.0984 -3.8086 -3.8038 -3.3919 -3.3910 -3.0617 -3.0580 -2.9670 -2.9659 -2.5496 -2.5482 -2.4084 -2.4074 -2.0078 -2.0054 -1.7640 -1.7628 -1.5137 -1.5104 -1.1655 -1.1597 -1.1234 -1.0881 -1.0569 -1.0233 -0.9542 -0.9198 -0.8793 -0.8534 -0.8154 -0.8018 -0.6969 -0.6816 -0.3282 -0.3159 0.8459 0.8491 1.4973 1.5010 1.7758 1.7778 k =-0.2586-0.4479 0.0377 ( 11671 PWs) bands (ev): -19.6307 -19.6307 -19.3079 -19.3079 -18.6601 -18.6601 -17.9888 -17.9888 -17.3638 -17.3638 -16.2570 -16.2570 -10.4748 -10.4748 -8.6325 -8.6324 -6.6220 -6.6219 -6.0941 -6.0937 -5.3350 -5.3347 -4.8857 -4.8842 -4.7615 -4.7598 -4.5367 -4.5352 -4.3143 -4.3116 -4.1018 -4.0953 -3.8055 -3.8009 -3.3860 -3.3851 -3.0577 -3.0540 -2.9578 -2.9571 -2.5533 -2.5522 -2.4104 -2.4091 -2.0189 -2.0162 -1.7744 -1.7729 -1.5099 -1.5061 -1.1637 -1.1586 -1.1141 -1.0814 -1.0548 -1.0221 -0.9542 -0.9202 -0.8773 -0.8531 -0.8123 -0.7998 -0.6960 -0.6820 -0.3236 -0.3116 0.8029 0.8060 1.4769 1.4807 1.7876 1.7902 k =-0.2500-0.4330 0.0365 ( 11670 PWs) bands (ev): -19.6309 -19.6309 -19.3080 -19.3080 -18.6602 -18.6602 -17.9891 -17.9891 -17.3634 -17.3634 -16.2571 -16.2571 -10.4710 -10.4709 -8.6341 -8.6340 -6.6208 -6.6207 -6.0913 -6.0910 -5.3435 -5.3432 -4.8847 -4.8831 -4.7570 -4.7553 -4.5406 -4.5391 -4.3157 -4.3128 -4.0989 -4.0923 -3.8027 -3.7981 -3.3800 -3.3792 -3.0545 -3.0508 -2.9472 -2.9466 -2.5584 -2.5575 -2.4124 -2.4106 -2.0303 -2.0273 -1.7849 -1.7829 -1.5075 -1.5032 -1.1622 -1.1572 -1.1058 -1.0766 -1.0521 -1.0214 -0.9540 -0.9206 -0.8753 -0.8528 -0.8093 -0.7979 -0.6954 -0.6827 -0.3192 -0.3074 0.7593 0.7623 1.4525 1.4564 1.8018 1.8047 k =-0.2414-0.4181 0.0352 ( 11661 PWs) bands (ev): -19.6312 -19.6311 -19.3081 -19.3081 -18.6603 -18.6602 -17.9894 -17.9893 -17.3630 -17.3630 -16.2573 -16.2573 -10.4671 -10.4671 -8.6349 -8.6348 -6.6195 -6.6194 -6.0885 -6.0882 -5.3521 -5.3517 -4.8835 -4.8818 -4.7524 -4.7508 -4.5443 -4.5427 -4.3171 -4.3141 -4.0961 -4.0896 -3.8001 -3.7957 -3.3740 -3.3733 -3.0522 -3.0484 -2.9352 -2.9344 -2.5650 -2.5640 -2.4143 -2.4120 -2.0417 -2.0385 -1.7951 -1.7927 -1.5062 -1.5015 -1.1612 -1.1557 -1.0988 -1.0738 -1.0492 -1.0214 -0.9538 -0.9211 -0.8734 -0.8524 -0.8064 -0.7963 -0.6952 -0.6835 -0.3151 -0.3036 0.7153 0.7183 1.4247 1.4287 1.8202 1.8232 k =-0.2328-0.4031 0.0339 ( 11650 PWs) bands (ev): -19.6314 -19.6314 -19.3082 -19.3082 -18.6604 -18.6603 -17.9897 -17.9896 -17.3627 -17.3627 -16.2574 -16.2574 -10.4633 -10.4633 -8.6348 -8.6347 -6.6180 -6.6179 -6.0858 -6.0855 -5.3608 -5.3604 -4.8821 -4.8803 -4.7477 -4.7461 -4.5478 -4.5463 -4.3185 -4.3154 -4.0937 -4.0871 -3.7978 -3.7934 -3.3680 -3.3673 -3.0505 -3.0467 -2.9221 -2.9209 -2.5727 -2.5716 -2.4163 -2.4133 -2.0529 -2.0495 -1.8052 -1.8023 -1.5061 -1.5009 -1.1604 -1.1541 -1.0932 -1.0725 -1.0464 -1.0221 -0.9535 -0.9215 -0.8718 -0.8520 -0.8037 -0.7950 -0.6953 -0.6846 -0.3115 -0.3001 0.6714 0.6743 1.3942 1.3982 1.8445 1.8475 k =-0.2241-0.3882 0.0327 ( 11644 PWs) bands (ev): -19.6317 -19.6317 -19.3083 -19.3082 -18.6605 -18.6604 -17.9900 -17.9899 -17.3624 -17.3624 -16.2576 -16.2576 -10.4595 -10.4595 -8.6339 -8.6338 -6.6164 -6.6163 -6.0830 -6.0827 -5.3695 -5.3691 -4.8805 -4.8786 -4.7429 -4.7414 -4.5512 -4.5496 -4.3199 -4.3167 -4.0915 -4.0850 -3.7957 -3.7914 -3.3621 -3.3614 -3.0494 -3.0457 -2.9080 -2.9064 -2.5816 -2.5803 -2.4183 -2.4147 -2.0637 -2.0602 -1.8150 -1.8117 -1.5068 -1.5013 -1.1600 -1.1526 -1.0888 -1.0723 -1.0442 -1.0237 -0.9533 -0.9218 -0.8706 -0.8516 -0.8014 -0.7939 -0.6959 -0.6858 -0.3083 -0.2971 0.6276 0.6305 1.3618 1.3658 1.8750 1.8779 k =-0.2155-0.3733 0.0314 ( 11653 PWs) bands (ev): -19.6320 -19.6320 -19.3084 -19.3083 -18.6606 -18.6605 -17.9903 -17.9903 -17.3621 -17.3621 -16.2578 -16.2578 -10.4558 -10.4557 -8.6321 -8.6321 -6.6146 -6.6145 -6.0803 -6.0800 -5.3783 -5.3778 -4.8787 -4.8768 -4.7381 -4.7366 -4.5543 -4.5527 -4.3213 -4.3179 -4.0897 -4.0832 -3.7938 -3.7896 -3.3561 -3.3554 -3.0488 -3.0451 -2.8933 -2.8913 -2.5914 -2.5899 -2.4203 -2.4162 -2.0737 -2.0702 -1.8245 -1.8208 -1.5084 -1.5025 -1.1599 -1.1514 -1.0858 -1.0728 -1.0428 -1.0259 -0.9532 -0.9220 -0.8698 -0.8511 -0.7996 -0.7930 -0.6967 -0.6873 -0.3056 -0.2946 0.5842 0.5872 1.3280 1.3319 1.9113 1.9140 k =-0.2069-0.3584 0.0302 ( 11653 PWs) bands (ev): -19.6323 -19.6323 -19.3084 -19.3084 -18.6607 -18.6606 -17.9906 -17.9906 -17.3618 -17.3618 -16.2581 -16.2580 -10.4521 -10.4520 -8.6296 -8.6296 -6.6127 -6.6126 -6.0776 -6.0773 -5.3870 -5.3864 -4.8767 -4.8748 -4.7333 -4.7318 -4.5573 -4.5557 -4.3227 -4.3192 -4.0883 -4.0819 -3.7920 -3.7879 -3.3502 -3.3495 -3.0486 -3.0449 -2.8782 -2.8759 -2.6018 -2.6002 -2.4226 -2.4179 -2.0828 -2.0793 -1.8336 -1.8295 -1.5105 -1.5044 -1.1601 -1.1507 -1.0840 -1.0738 -1.0424 -1.0284 -0.9534 -0.9221 -0.8696 -0.8505 -0.7985 -0.7921 -0.6978 -0.6889 -0.3034 -0.2926 0.5416 0.5446 1.2934 1.2972 1.9518 1.9542 k =-0.1983-0.3434 0.0289 ( 11647 PWs) bands (ev): -19.6326 -19.6326 -19.3085 -19.3085 -18.6608 -18.6607 -17.9909 -17.9909 -17.3616 -17.3616 -16.2583 -16.2583 -10.4484 -10.4484 -8.6264 -8.6263 -6.6107 -6.6106 -6.0749 -6.0746 -5.3956 -5.3951 -4.8747 -4.8727 -4.7283 -4.7269 -4.5600 -4.5584 -4.3240 -4.3205 -4.0874 -4.0810 -3.7904 -3.7865 -3.3444 -3.3436 -3.0487 -3.0450 -2.8633 -2.8606 -2.6128 -2.6110 -2.4250 -2.4198 -2.0908 -2.0873 -1.8423 -1.8380 -1.5131 -1.5067 -1.1609 -1.1506 -1.0835 -1.0752 -1.0431 -1.0309 -0.9540 -0.9221 -0.8699 -0.8499 -0.7980 -0.7912 -0.6991 -0.6907 -0.3017 -0.2910 0.5000 0.5029 1.2585 1.2621 1.9935 1.9956 k =-0.1897-0.3285 0.0277 ( 11651 PWs) bands (ev): -19.6329 -19.6329 -19.3086 -19.3085 -18.6609 -18.6609 -17.9913 -17.9913 -17.3614 -17.3614 -16.2585 -16.2585 -10.4448 -10.4448 -8.6225 -8.6224 -6.6086 -6.6085 -6.0722 -6.0719 -5.4042 -5.4036 -4.8726 -4.8706 -4.7234 -4.7220 -4.5624 -4.5608 -4.3253 -4.3217 -4.0869 -4.0806 -3.7890 -3.7851 -3.3385 -3.3377 -3.0491 -3.0454 -2.8488 -2.8458 -2.6238 -2.6220 -2.4277 -2.4220 -2.0975 -2.0941 -1.8506 -1.8460 -1.5161 -1.5093 -1.1622 -1.1513 -1.0842 -1.0768 -1.0449 -1.0330 -0.9550 -0.9223 -0.8707 -0.8494 -0.7981 -0.7902 -0.7005 -0.6926 -0.3004 -0.2899 0.4595 0.4624 1.2236 1.2270 2.0324 2.0343 k =-0.1810-0.3136 0.0264 ( 11653 PWs) bands (ev): -19.6332 -19.6332 -19.3086 -19.3086 -18.6610 -18.6610 -17.9916 -17.9916 -17.3612 -17.3611 -16.2588 -16.2588 -10.4413 -10.4413 -8.6179 -8.6178 -6.6064 -6.6063 -6.0695 -6.0693 -5.4126 -5.4120 -4.8706 -4.8685 -4.7184 -4.7170 -4.5646 -4.5631 -4.3265 -4.3230 -4.0869 -4.0808 -3.7877 -3.7840 -3.3326 -3.3318 -3.0497 -3.0461 -2.8355 -2.8323 -2.6346 -2.6327 -2.4306 -2.4246 -2.1028 -2.0995 -1.8583 -1.8535 -1.5192 -1.5121 -1.1642 -1.1530 -1.0861 -1.0785 -1.0477 -1.0345 -0.9565 -0.9226 -0.8719 -0.8489 -0.7986 -0.7892 -0.7019 -0.6945 -0.2994 -0.2891 0.4204 0.4233 1.1890 1.1923 2.0668 2.0686 k =-0.1724-0.2986 0.0251 ( 11648 PWs) bands (ev): -19.6336 -19.6336 -19.3087 -19.3086 -18.6611 -18.6611 -17.9920 -17.9919 -17.3610 -17.3609 -16.2590 -16.2590 -10.4379 -10.4378 -8.6127 -8.6126 -6.6041 -6.6040 -6.0668 -6.0666 -5.4208 -5.4202 -4.8687 -4.8666 -4.7133 -4.7120 -4.5666 -4.5651 -4.3278 -4.3242 -4.0875 -4.0814 -3.7865 -3.7829 -3.3268 -3.3259 -3.0506 -3.0470 -2.8239 -2.8206 -2.6443 -2.6424 -2.4339 -2.4276 -2.1066 -2.1035 -1.8655 -1.8605 -1.5224 -1.5150 -1.1670 -1.1556 -1.0892 -1.0803 -1.0510 -1.0356 -0.9583 -0.9233 -0.8733 -0.8487 -0.7992 -0.7882 -0.7034 -0.6965 -0.2987 -0.2886 0.3828 0.3857 1.1550 1.1581 2.0977 2.0994 k =-0.1638-0.2837 0.0239 ( 11644 PWs) bands (ev): -19.6339 -19.6339 -19.3087 -19.3087 -18.6612 -18.6612 -17.9923 -17.9923 -17.3608 -17.3608 -16.2593 -16.2593 -10.4346 -10.4345 -8.6070 -8.6069 -6.6017 -6.6016 -6.0642 -6.0640 -5.4289 -5.4282 -4.8668 -4.8648 -4.7081 -4.7069 -4.5683 -4.5669 -4.3290 -4.3254 -4.0885 -4.0826 -3.7854 -3.7819 -3.3210 -3.3200 -3.0516 -3.0480 -2.8150 -2.8116 -2.6524 -2.6503 -2.4375 -2.4310 -2.1089 -2.1059 -1.8719 -1.8669 -1.5256 -1.5179 -1.1707 -1.1595 -1.0931 -1.0822 -1.0544 -1.0365 -0.9605 -0.9244 -0.8749 -0.8487 -0.7999 -0.7872 -0.7048 -0.6985 -0.2981 -0.2883 0.3468 0.3498 1.1218 1.1246 2.1263 2.1281 k =-0.1552-0.2688 0.0226 ( 11638 PWs) bands (ev): -19.6343 -19.6342 -19.3088 -19.3087 -18.6613 -18.6613 -17.9926 -17.9926 -17.3606 -17.3606 -16.2596 -16.2595 -10.4314 -10.4313 -8.6008 -8.6007 -6.5993 -6.5992 -6.0615 -6.0614 -5.4367 -5.4360 -4.8652 -4.8631 -4.7029 -4.7017 -4.5698 -4.5684 -4.3302 -4.3267 -4.0900 -4.0843 -3.7844 -3.7811 -3.3152 -3.3141 -3.0528 -3.0493 -2.8097 -2.8063 -2.6579 -2.6556 -2.4414 -2.4347 -2.1097 -2.1068 -1.8776 -1.8724 -1.5286 -1.5207 -1.1754 -1.1645 -1.0976 -1.0842 -1.0576 -1.0373 -0.9630 -0.9260 -0.8765 -0.8491 -0.8005 -0.7861 -0.7062 -0.7004 -0.2977 -0.2881 0.3127 0.3156 1.0895 1.0922 2.1533 2.1551 k =-0.1466-0.2538 0.0214 ( 11624 PWs) bands (ev): -19.6346 -19.6346 -19.3088 -19.3088 -18.6614 -18.6614 -17.9930 -17.9930 -17.3605 -17.3605 -16.2598 -16.2598 -10.4283 -10.4282 -8.5943 -8.5942 -6.5968 -6.5967 -6.0590 -6.0588 -5.4442 -5.4436 -4.8638 -4.8618 -4.6977 -4.6965 -4.5711 -4.5697 -4.3314 -4.3279 -4.0920 -4.0864 -3.7835 -3.7803 -3.3093 -3.3082 -3.0541 -3.0506 -2.8086 -2.8053 -2.6601 -2.6576 -2.4456 -2.4389 -2.1090 -2.1064 -1.8823 -1.8771 -1.5315 -1.5233 -1.1811 -1.1707 -1.1026 -1.0868 -1.0604 -1.0381 -0.9656 -0.9282 -0.8780 -0.8499 -0.8008 -0.7850 -0.7075 -0.7023 -0.2972 -0.2879 0.2804 0.2832 1.0583 1.0608 2.1790 2.1808 k =-0.1379-0.2389 0.0201 ( 11620 PWs) bands (ev): -19.6349 -19.6349 -19.3088 -19.3088 -18.6616 -18.6615 -17.9933 -17.9933 -17.3604 -17.3604 -16.2601 -16.2601 -10.4253 -10.4253 -8.5875 -8.5873 -6.5942 -6.5941 -6.0564 -6.0563 -5.4515 -5.4509 -4.8627 -4.8607 -4.6923 -4.6912 -4.5721 -4.5708 -4.3326 -4.3292 -4.0944 -4.0890 -3.7827 -3.7796 -3.3035 -3.3024 -3.0556 -3.0521 -2.8118 -2.8087 -2.6591 -2.6562 -2.4501 -2.4434 -2.1071 -2.1046 -1.8860 -1.8807 -1.5342 -1.5257 -1.1877 -1.1781 -1.1077 -1.0900 -1.0626 -1.0388 -0.9682 -0.9308 -0.8794 -0.8511 -0.8007 -0.7838 -0.7088 -0.7042 -0.2968 -0.2878 0.2500 0.2528 1.0284 1.0307 2.2036 2.2054 k =-0.1293-0.2240 0.0189 ( 11626 PWs) bands (ev): -19.6353 -19.6352 -19.3089 -19.3088 -18.6617 -18.6616 -17.9936 -17.9936 -17.3603 -17.3603 -16.2604 -16.2604 -10.4225 -10.4224 -8.5804 -8.5803 -6.5917 -6.5916 -6.0539 -6.0538 -5.4584 -5.4578 -4.8619 -4.8600 -4.6870 -4.6859 -4.5729 -4.5716 -4.3338 -4.3305 -4.0972 -4.0920 -3.7819 -3.7790 -3.2977 -3.2966 -3.0571 -3.0538 -2.8186 -2.8159 -2.6552 -2.6520 -2.4548 -2.4481 -2.1040 -2.1017 -1.8885 -1.8832 -1.5366 -1.5278 -1.1952 -1.1864 -1.1129 -1.0942 -1.0642 -1.0395 -0.9708 -0.9340 -0.8806 -0.8528 -0.8002 -0.7826 -0.7101 -0.7061 -0.2963 -0.2877 0.2215 0.2242 0.9998 1.0019 2.2269 2.2287 k =-0.1207-0.2090 0.0176 ( 11610 PWs) bands (ev): -19.6356 -19.6356 -19.3089 -19.3089 -18.6618 -18.6617 -17.9939 -17.9939 -17.3602 -17.3602 -16.2607 -16.2606 -10.4198 -10.4197 -8.5733 -8.5731 -6.5891 -6.5890 -6.0514 -6.0513 -5.4650 -5.4644 -4.8615 -4.8596 -4.6816 -4.6805 -4.5735 -4.5723 -4.3350 -4.3318 -4.1003 -4.0954 -3.7812 -3.7784 -3.2920 -3.2908 -3.0588 -3.0554 -2.8282 -2.8257 -2.6495 -2.6460 -2.4596 -2.4532 -2.1001 -2.0980 -1.8896 -1.8844 -1.5387 -1.5298 -1.2035 -1.1956 -1.1183 -1.0994 -1.0651 -1.0401 -0.9732 -0.9374 -0.8816 -0.8548 -0.7993 -0.7812 -0.7114 -0.7080 -0.2958 -0.2875 0.1950 0.1977 0.9726 0.9745 2.2491 2.2509 k =-0.1121-0.1941 0.0163 ( 11611 PWs) bands (ev): -19.6359 -19.6359 -19.3089 -19.3089 -18.6619 -18.6618 -17.9942 -17.9942 -17.3601 -17.3601 -16.2609 -16.2609 -10.4172 -10.4172 -8.5661 -8.5660 -6.5866 -6.5865 -6.0491 -6.0489 -5.4712 -5.4707 -4.8614 -4.8596 -4.6762 -4.6751 -4.5739 -4.5728 -4.3363 -4.3332 -4.1037 -4.0990 -3.7805 -3.7780 -3.2864 -3.2851 -3.0605 -3.0572 -2.8395 -2.8373 -2.6427 -2.6390 -2.4646 -2.4583 -2.0956 -2.0937 -1.8893 -1.8841 -1.5406 -1.5315 -1.2124 -1.2053 -1.1238 -1.1054 -1.0653 -1.0406 -0.9753 -0.9410 -0.8826 -0.8570 -0.7980 -0.7798 -0.7128 -0.7099 -0.2952 -0.2873 0.1705 0.1731 0.9470 0.9487 2.2701 2.2720 k =-0.1034-0.1792 0.0151 ( 11611 PWs) bands (ev): -19.6362 -19.6362 -19.3089 -19.3089 -18.6619 -18.6619 -17.9945 -17.9945 -17.3600 -17.3600 -16.2612 -16.2611 -10.4149 -10.4148 -8.5590 -8.5588 -6.5842 -6.5841 -6.0467 -6.0466 -5.4771 -5.4766 -4.8616 -4.8599 -4.6709 -4.6698 -4.5742 -4.5730 -4.3375 -4.3346 -4.1072 -4.1029 -3.7799 -3.7775 -3.2808 -3.2795 -3.0622 -3.0590 -2.8518 -2.8498 -2.6355 -2.6317 -2.4696 -2.4636 -2.0907 -2.0891 -1.8875 -1.8824 -1.5423 -1.5330 -1.2217 -1.2154 -1.1295 -1.1122 -1.0651 -1.0412 -0.9771 -0.9447 -0.8835 -0.8595 -0.7964 -0.7782 -0.7142 -0.7117 -0.2945 -0.2871 0.1480 0.1504 0.9230 0.9246 2.2900 2.2918 k =-0.0948-0.1642 0.0138 ( 11618 PWs) bands (ev): -19.6365 -19.6364 -19.3090 -19.3089 -18.6620 -18.6620 -17.9948 -17.9948 -17.3600 -17.3600 -16.2614 -16.2614 -10.4126 -10.4126 -8.5520 -8.5519 -6.5818 -6.5817 -6.0445 -6.0444 -5.4825 -5.4820 -4.8620 -4.8604 -4.6657 -4.6646 -4.5744 -4.5732 -4.3388 -4.3360 -4.1109 -4.1068 -3.7793 -3.7771 -3.2754 -3.2741 -3.0639 -3.0608 -2.8645 -2.8627 -2.6284 -2.6245 -2.4745 -2.4688 -2.0859 -2.0844 -1.8841 -1.8791 -1.5438 -1.5344 -1.2313 -1.2256 -1.1353 -1.1195 -1.0646 -1.0416 -0.9786 -0.9484 -0.8844 -0.8621 -0.7945 -0.7767 -0.7156 -0.7135 -0.2937 -0.2868 0.1275 0.1297 0.9007 0.9021 2.3086 2.3104 k =-0.0862-0.1493 0.0126 ( 11635 PWs) bands (ev): -19.6367 -19.6367 -19.3090 -19.3090 -18.6621 -18.6621 -17.9951 -17.9951 -17.3600 -17.3599 -16.2616 -16.2616 -10.4106 -10.4106 -8.5453 -8.5452 -6.5795 -6.5794 -6.0424 -6.0423 -5.4875 -5.4871 -4.8628 -4.8613 -4.6607 -4.6596 -4.5744 -4.5732 -4.3400 -4.3374 -4.1146 -4.1108 -3.7788 -3.7768 -3.2701 -3.2689 -3.0656 -3.0626 -2.8772 -2.8754 -2.6216 -2.6177 -2.4793 -2.4740 -2.0812 -2.0799 -1.8792 -1.8743 -1.5451 -1.5357 -1.2411 -1.2356 -1.1413 -1.1271 -1.0638 -1.0421 -0.9798 -0.9519 -0.8852 -0.8648 -0.7924 -0.7751 -0.7172 -0.7153 -0.2929 -0.2864 0.1088 0.1110 0.8801 0.8813 2.3259 2.3276 k =-0.0776-0.1344 0.0113 ( 11642 PWs) bands (ev): -19.6370 -19.6370 -19.3090 -19.3090 -18.6622 -18.6622 -17.9953 -17.9953 -17.3599 -17.3599 -16.2618 -16.2618 -10.4087 -10.4087 -8.5389 -8.5388 -6.5773 -6.5772 -6.0404 -6.0403 -5.4921 -5.4917 -4.8637 -4.8623 -4.6559 -4.6547 -4.5743 -4.5731 -4.3413 -4.3388 -4.1182 -4.1148 -3.7783 -3.7765 -3.2651 -3.2639 -3.0672 -3.0644 -2.8894 -2.8878 -2.6153 -2.6115 -2.4839 -2.4790 -2.0769 -2.0758 -1.8729 -1.8683 -1.5463 -1.5371 -1.2507 -1.2454 -1.1473 -1.1348 -1.0628 -1.0425 -0.9806 -0.9553 -0.8859 -0.8675 -0.7901 -0.7735 -0.7189 -0.7169 -0.2920 -0.2861 0.0921 0.0941 0.8613 0.8624 2.3419 2.3436 k =-0.0690-0.1195 0.0101 ( 11651 PWs) bands (ev): -19.6372 -19.6372 -19.3090 -19.3090 -18.6623 -18.6623 -17.9955 -17.9955 -17.3599 -17.3599 -16.2620 -16.2620 -10.4070 -10.4070 -8.5329 -8.5328 -6.5753 -6.5752 -6.0385 -6.0384 -5.4963 -5.4959 -4.8648 -4.8635 -4.6513 -4.6502 -4.5741 -4.5729 -4.3425 -4.3402 -4.1218 -4.1187 -3.7779 -3.7763 -3.2604 -3.2592 -3.0687 -3.0661 -2.9010 -2.8994 -2.6097 -2.6060 -2.4883 -2.4837 -2.0732 -2.0721 -1.8655 -1.8611 -1.5475 -1.5385 -1.2600 -1.2546 -1.1533 -1.1425 -1.0616 -1.0429 -0.9811 -0.9584 -0.8866 -0.8701 -0.7876 -0.7719 -0.7207 -0.7185 -0.2910 -0.2857 0.0773 0.0791 0.8444 0.8453 2.3566 2.3582 k =-0.0603-0.1045 0.0088 ( 11660 PWs) bands (ev): -19.6374 -19.6374 -19.3090 -19.3090 -18.6623 -18.6623 -17.9957 -17.9957 -17.3599 -17.3599 -16.2622 -16.2622 -10.4055 -10.4055 -8.5275 -8.5274 -6.5734 -6.5734 -6.0368 -6.0367 -5.4999 -5.4996 -4.8659 -4.8648 -4.6471 -4.6460 -4.5738 -4.5727 -4.3436 -4.3416 -4.1250 -4.1223 -3.7775 -3.7761 -3.2560 -3.2549 -3.0701 -3.0676 -2.9116 -2.9102 -2.6047 -2.6012 -2.4923 -2.4881 -2.0699 -2.0690 -1.8572 -1.8532 -1.5487 -1.5401 -1.2687 -1.2633 -1.1591 -1.1500 -1.0602 -1.0434 -0.9813 -0.9614 -0.8872 -0.8727 -0.7851 -0.7705 -0.7224 -0.7200 -0.2901 -0.2853 0.0643 0.0660 0.8293 0.8302 2.3699 2.3714 k =-0.0517-0.0896 0.0075 ( 11664 PWs) bands (ev): -19.6376 -19.6376 -19.3090 -19.3090 -18.6624 -18.6624 -17.9959 -17.9959 -17.3598 -17.3598 -16.2623 -16.2623 -10.4042 -10.4042 -8.5226 -8.5225 -6.5718 -6.5717 -6.0353 -6.0352 -5.5031 -5.5028 -4.8670 -4.8661 -4.6433 -4.6423 -4.5735 -4.5725 -4.3446 -4.3429 -4.1280 -4.1257 -3.7771 -3.7759 -3.2520 -3.2510 -3.0713 -3.0691 -2.9212 -2.9199 -2.6003 -2.5972 -2.4958 -2.4921 -2.0673 -2.0665 -1.8486 -1.8449 -1.5498 -1.5418 -1.2765 -1.2713 -1.1645 -1.1570 -1.0588 -1.0440 -0.9812 -0.9641 -0.8876 -0.8752 -0.7825 -0.7693 -0.7241 -0.7215 -0.2891 -0.2849 0.0532 0.0546 0.8162 0.8169 2.3817 2.3830 k =-0.0431-0.0747 0.0063 ( 11655 PWs) bands (ev): -19.6377 -19.6377 -19.3090 -19.3090 -18.6624 -18.6624 -17.9960 -17.9960 -17.3598 -17.3598 -16.2625 -16.2625 -10.4031 -10.4031 -8.5183 -8.5182 -6.5703 -6.5703 -6.0339 -6.0339 -5.5059 -5.5056 -4.8681 -4.8673 -4.6399 -4.6390 -4.5732 -4.5722 -4.3455 -4.3440 -4.1306 -4.1287 -3.7768 -3.7758 -3.2485 -3.2476 -3.0723 -3.0703 -2.9295 -2.9284 -2.5966 -2.5938 -2.4989 -2.4957 -2.0651 -2.0645 -1.8400 -1.8368 -1.5509 -1.5437 -1.2832 -1.2784 -1.1695 -1.1634 -1.0573 -1.0447 -0.9808 -0.9666 -0.8879 -0.8775 -0.7799 -0.7682 -0.7256 -0.7229 -0.2882 -0.2846 0.0438 0.0451 0.8051 0.8057 2.3919 2.3931 k =-0.0345-0.0597 0.0050 ( 11648 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6625 -18.6625 -17.9962 -17.9962 -17.3598 -17.3598 -16.2626 -16.2626 -10.4022 -10.4022 -8.5147 -8.5146 -6.5691 -6.5691 -6.0328 -6.0328 -5.5081 -5.5079 -4.8691 -4.8685 -4.6371 -4.6363 -4.5728 -4.5720 -4.3463 -4.3451 -4.1328 -4.1312 -3.7765 -3.7757 -3.2455 -3.2447 -3.0731 -3.0714 -2.9365 -2.9356 -2.5935 -2.5912 -2.5014 -2.4988 -2.0634 -2.0629 -1.8320 -1.8293 -1.5519 -1.5457 -1.2887 -1.2845 -1.1737 -1.1689 -1.0557 -1.0454 -0.9802 -0.9688 -0.8879 -0.8796 -0.7774 -0.7676 -0.7268 -0.7242 -0.2873 -0.2844 0.0363 0.0372 0.7959 0.7964 2.4005 2.4015 k =-0.0259-0.0448 0.0038 ( 11653 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3598 -17.3598 -16.2627 -16.2627 -10.4015 -10.4015 -8.5119 -8.5118 -6.5681 -6.5681 -6.0319 -6.0319 -5.5098 -5.5097 -4.8699 -4.8694 -4.6348 -4.6342 -4.5725 -4.5719 -4.3469 -4.3460 -4.1346 -4.1333 -3.7763 -3.7757 -3.2430 -3.2425 -3.0736 -3.0723 -2.9421 -2.9413 -2.5911 -2.5892 -2.5033 -2.5013 -2.0621 -2.0618 -1.8251 -1.8229 -1.5526 -1.5478 -1.2930 -1.2895 -1.1771 -1.1736 -1.0542 -1.0463 -0.9795 -0.9709 -0.8878 -0.8815 -0.7750 -0.7673 -0.7277 -0.7255 -0.2865 -0.2843 0.0304 0.0312 0.7888 0.7892 2.4073 2.4081 k =-0.0172-0.0299 0.0025 ( 11656 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9963 -17.9963 -17.3598 -17.3598 -16.2627 -16.2627 -10.4010 -10.4010 -8.5098 -8.5098 -6.5674 -6.5674 -6.0313 -6.0312 -5.5111 -5.5110 -4.8705 -4.8702 -4.6331 -4.6327 -4.5722 -4.5718 -4.3473 -4.3467 -4.1358 -4.1349 -3.7761 -3.7757 -3.2412 -3.2409 -3.0740 -3.0731 -2.9460 -2.9455 -2.5892 -2.5880 -2.5046 -2.5032 -2.0613 -2.0610 -1.8196 -1.8181 -1.5530 -1.5496 -1.2958 -1.2934 -1.1794 -1.1772 -1.0527 -1.0474 -0.9785 -0.9728 -0.8874 -0.8832 -0.7728 -0.7675 -0.7282 -0.7266 -0.2858 -0.2843 0.0263 0.0268 0.7837 0.7840 2.4123 2.4129 k =-0.0086-0.0149 0.0013 ( 11659 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4007 -10.4007 -8.5086 -8.5086 -6.5670 -6.5670 -6.0309 -6.0309 -5.5118 -5.5117 -4.8709 -4.8707 -4.6320 -4.6318 -4.5720 -4.5718 -4.3475 -4.3472 -4.1364 -4.1360 -3.7759 -3.7757 -3.2401 -3.2399 -3.0741 -3.0736 -2.9484 -2.9481 -2.5880 -2.5874 -2.5053 -2.5046 -2.0607 -2.0606 -1.8160 -1.8152 -1.5530 -1.5512 -1.2972 -1.2960 -1.1807 -1.1796 -1.0512 -1.0486 -0.9773 -0.9744 -0.8867 -0.8846 -0.7709 -0.7682 -0.7284 -0.7275 -0.2852 -0.2845 0.0239 0.0241 0.7807 0.7808 2.4154 2.4157 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 k = 0.0000 0.0000 0.0168 ( 11657 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5082 -8.5082 -6.5665 -6.5665 -6.0313 -6.0312 -5.5121 -5.5120 -4.8709 -4.8707 -4.6330 -4.6323 -4.5720 -4.5716 -4.3464 -4.3454 -4.1363 -4.1351 -3.7761 -3.7758 -3.2440 -3.2433 -3.0720 -3.0709 -2.9488 -2.9486 -2.5875 -2.5873 -2.5054 -2.5052 -2.0605 -2.0602 -1.8147 -1.8142 -1.5522 -1.5517 -1.2980 -1.2975 -1.1833 -1.1783 -1.0528 -1.0488 -0.9805 -0.9707 -0.8897 -0.8809 -0.7710 -0.7674 -0.7313 -0.7239 -0.2852 -0.2843 0.0221 0.0221 0.7805 0.7806 2.4157 2.4162 k = 0.0000 0.0000 0.0337 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5082 -8.5082 -6.5655 -6.5655 -6.0329 -6.0327 -5.5122 -5.5121 -4.8706 -4.8704 -4.6364 -4.6351 -4.5720 -4.5714 -4.3425 -4.3405 -4.1345 -4.1322 -3.7767 -3.7761 -3.2555 -3.2542 -3.0657 -3.0639 -2.9477 -2.9473 -2.5876 -2.5872 -2.5057 -2.5051 -2.0601 -2.0597 -1.8146 -1.8137 -1.5512 -1.5502 -1.2997 -1.2987 -1.1860 -1.1762 -1.0577 -1.0498 -0.9838 -0.9657 -0.8923 -0.8756 -0.7721 -0.7653 -0.7334 -0.7191 -0.2855 -0.2837 0.0191 0.0192 0.7827 0.7830 2.4137 2.4146 k = 0.0000 0.0000 0.0505 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3091 -19.3091 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5083 -8.5083 -6.5639 -6.5638 -6.0354 -6.0352 -5.5124 -5.5122 -4.8702 -4.8698 -4.6413 -4.6396 -4.5720 -4.5712 -4.3362 -4.3333 -4.1309 -4.1276 -3.7777 -3.7768 -3.2720 -3.2704 -3.0569 -3.0546 -2.9458 -2.9453 -2.5876 -2.5871 -2.5060 -2.5052 -2.0595 -2.0588 -1.8145 -1.8131 -1.5493 -1.5479 -1.3023 -1.3009 -1.1885 -1.1744 -1.0640 -1.0523 -0.9855 -0.9618 -0.8931 -0.8701 -0.7728 -0.7633 -0.7339 -0.7137 -0.2855 -0.2830 0.0142 0.0144 0.7864 0.7867 2.4107 2.4119 k = 0.0000 0.0000 0.0673 ( 11673 PWs) bands (ev): -19.6381 -19.6381 -19.3091 -19.3091 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5084 -8.5084 -6.5617 -6.5616 -6.0387 -6.0385 -5.5126 -5.5124 -4.8695 -4.8691 -4.6473 -4.6453 -4.5718 -4.5709 -4.3283 -4.3247 -4.1254 -4.1212 -3.7791 -3.7780 -3.2917 -3.2900 -3.0473 -3.0448 -2.9431 -2.9425 -2.5876 -2.5870 -2.5063 -2.5054 -2.0585 -2.0578 -1.8142 -1.8125 -1.5467 -1.5449 -1.3058 -1.3041 -1.1907 -1.1732 -1.0711 -1.0560 -0.9859 -0.9593 -0.8920 -0.8651 -0.7730 -0.7617 -0.7326 -0.7081 -0.2854 -0.2822 0.0079 0.0080 0.7912 0.7916 2.4067 2.4082 k = 0.0000 0.0000 0.0841 ( 11668 PWs) bands (ev): -19.6381 -19.6381 -19.3091 -19.3091 -18.6624 -18.6624 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5085 -8.5085 -6.5590 -6.5589 -6.0426 -6.0424 -5.5128 -5.5126 -4.8688 -4.8683 -4.6539 -4.6517 -4.5716 -4.5707 -4.3196 -4.3156 -4.1178 -4.1128 -3.7812 -3.7798 -3.3131 -3.3114 -3.0380 -3.0354 -2.9398 -2.9390 -2.5875 -2.5868 -2.5067 -2.5057 -2.0574 -2.0565 -1.8138 -1.8119 -1.5434 -1.5412 -1.3101 -1.3080 -1.1926 -1.1725 -1.0784 -1.0605 -0.9853 -0.9583 -0.8894 -0.8607 -0.7726 -0.7607 -0.7293 -0.7025 -0.2851 -0.2814 0.0003 0.0005 0.7969 0.7974 2.4021 2.4037 k = 0.0000 0.0000 0.1010 ( 11668 PWs) bands (ev): -19.6381 -19.6381 -19.3092 -19.3091 -18.6624 -18.6624 -17.9965 -17.9965 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5086 -8.5086 -6.5561 -6.5559 -6.0470 -6.0467 -5.5130 -5.5128 -4.8679 -4.8673 -4.6606 -4.6584 -4.5714 -4.5706 -4.3110 -4.3068 -4.1080 -4.1026 -3.7838 -3.7822 -3.3350 -3.3334 -3.0296 -3.0273 -2.9359 -2.9351 -2.5873 -2.5865 -2.5072 -2.5062 -2.0561 -2.0551 -1.8134 -1.8114 -1.5394 -1.5369 -1.3150 -1.3128 -1.1939 -1.1725 -1.0853 -1.0655 -0.9840 -0.9585 -0.8858 -0.8572 -0.7719 -0.7603 -0.7245 -0.6970 -0.2845 -0.2805 -0.0081 -0.0078 0.8031 0.8036 2.3970 2.3987 k = 0.0000 0.0000 0.1178 ( 11659 PWs) bands (ev): -19.6380 -19.6380 -19.3092 -19.3092 -18.6624 -18.6624 -17.9965 -17.9965 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5087 -8.5087 -6.5530 -6.5529 -6.0515 -6.0513 -5.5133 -5.5130 -4.8670 -4.8664 -4.6671 -4.6650 -4.5712 -4.5704 -4.3031 -4.2990 -4.0963 -4.0907 -3.7872 -3.7854 -3.3562 -3.3547 -3.0226 -3.0205 -2.9318 -2.9310 -2.5869 -2.5862 -2.5077 -2.5067 -2.0547 -2.0537 -1.8131 -1.8110 -1.5349 -1.5322 -1.3205 -1.3180 -1.1946 -1.1731 -1.0912 -1.0706 -0.9824 -0.9595 -0.8816 -0.8548 -0.7708 -0.7601 -0.7184 -0.6920 -0.2836 -0.2795 -0.0167 -0.0165 0.8094 0.8098 2.3918 2.3935 k = 0.0000 0.0000 0.1346 ( 11670 PWs) bands (ev): -19.6380 -19.6380 -19.3092 -19.3092 -18.6623 -18.6623 -17.9965 -17.9965 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5089 -8.5089 -6.5500 -6.5498 -6.0560 -6.0557 -5.5135 -5.5133 -4.8660 -4.8655 -4.6730 -4.6711 -4.5709 -4.5703 -4.2963 -4.2925 -4.0830 -4.0776 -3.7913 -3.7894 -3.3759 -3.3747 -3.0169 -3.0151 -2.9277 -2.9269 -2.5864 -2.5857 -2.5082 -2.5072 -2.0532 -2.0523 -1.8127 -1.8108 -1.5301 -1.5274 -1.3262 -1.3235 -1.1947 -1.1745 -1.0958 -1.0758 -0.9805 -0.9610 -0.8772 -0.8535 -0.7695 -0.7602 -0.7117 -0.6878 -0.2825 -0.2786 -0.0253 -0.0250 0.8154 0.8159 2.3868 2.3884 k = 0.0000 0.0000 0.1514 ( 11662 PWs) bands (ev): -19.6380 -19.6380 -19.3092 -19.3092 -18.6623 -18.6623 -17.9965 -17.9965 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5090 -8.5090 -6.5472 -6.5470 -6.0600 -6.0598 -5.5137 -5.5135 -4.8651 -4.8646 -4.6781 -4.6764 -4.5707 -4.5702 -4.2907 -4.2874 -4.0692 -4.0643 -3.7959 -3.7940 -3.3933 -3.3923 -3.0125 -3.0110 -2.9240 -2.9232 -2.5859 -2.5852 -2.5087 -2.5079 -2.0518 -2.0510 -1.8124 -1.8107 -1.5253 -1.5227 -1.3316 -1.3290 -1.1942 -1.1765 -1.0987 -1.0808 -0.9785 -0.9627 -0.8729 -0.8531 -0.7680 -0.7605 -0.7049 -0.6845 -0.2812 -0.2777 -0.0331 -0.0329 0.8209 0.8213 2.3823 2.3836 k = 0.0000 0.0000 0.1683 ( 11658 PWs) bands (ev): -19.6380 -19.6380 -19.3093 -19.3093 -18.6623 -18.6623 -17.9966 -17.9966 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5091 -8.5091 -6.5447 -6.5446 -6.0635 -6.0633 -5.5138 -5.5137 -4.8643 -4.8639 -4.6822 -4.6809 -4.5705 -4.5701 -4.2863 -4.2838 -4.0560 -4.0519 -3.8006 -3.7989 -3.4077 -3.4069 -3.0092 -3.0081 -2.9208 -2.9201 -2.5853 -2.5848 -2.5091 -2.5084 -2.0506 -2.0500 -1.8122 -1.8108 -1.5209 -1.5186 -1.3364 -1.3341 -1.1932 -1.1790 -1.1002 -1.0856 -0.9765 -0.9646 -0.8689 -0.8535 -0.7666 -0.7608 -0.6984 -0.6823 -0.2799 -0.2770 -0.0398 -0.0397 0.8256 0.8259 2.3785 2.3795 k = 0.0000 0.0000 0.1851 ( 11672 PWs) bands (ev): -19.6380 -19.6380 -19.3093 -19.3093 -18.6622 -18.6622 -17.9966 -17.9966 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5091 -8.5091 -6.5429 -6.5428 -6.0662 -6.0660 -5.5139 -5.5138 -4.8636 -4.8634 -4.6851 -4.6842 -4.5704 -4.5701 -4.2832 -4.2815 -4.0447 -4.0417 -3.8048 -3.8035 -3.4183 -3.4178 -3.0069 -3.0062 -2.9183 -2.9179 -2.5848 -2.5844 -2.5094 -2.5090 -2.0497 -2.0492 -1.8119 -1.8109 -1.5171 -1.5155 -1.3401 -1.3384 -1.1917 -1.1818 -1.1002 -1.0899 -0.9745 -0.9665 -0.8652 -0.8548 -0.7652 -0.7613 -0.6926 -0.6816 -0.2786 -0.2766 -0.0450 -0.0449 0.8291 0.8293 2.3756 2.3763 k = 0.0000 0.0000 0.2019 ( 11666 PWs) bands (ev): -19.6380 -19.6380 -19.3093 -19.3093 -18.6622 -18.6622 -17.9966 -17.9966 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5092 -8.5092 -6.5417 -6.5416 -6.0678 -6.0677 -5.5140 -5.5139 -4.8632 -4.8631 -4.6868 -4.6863 -4.5702 -4.5701 -4.2812 -4.2803 -4.0368 -4.0353 -3.8076 -3.8069 -3.4249 -3.4246 -3.0055 -3.0051 -2.9168 -2.9165 -2.5844 -2.5842 -2.5096 -2.5093 -2.0490 -2.0488 -1.8116 -1.8111 -1.5145 -1.5136 -1.3423 -1.3413 -1.1896 -1.1846 -1.0990 -1.0937 -0.9725 -0.9685 -0.8619 -0.8566 -0.7639 -0.7620 -0.6879 -0.6822 -0.2776 -0.2765 -0.0482 -0.0482 0.8313 0.8314 2.3739 2.3743 k = 0.0000 0.0000 0.2187 ( 11684 PWs) bands (ev): -19.6380 -19.6380 -19.3093 -19.3093 -18.6622 -18.6622 -17.9966 -17.9966 -17.3598 -17.3598 -16.2628 -16.2628 -10.4005 -10.4005 -8.5092 -8.5092 -6.5413 -6.5413 -6.0683 -6.0683 -5.5140 -5.5140 -4.8630 -4.8630 -4.6872 -4.6872 -4.5702 -4.5702 -4.2802 -4.2802 -4.0335 -4.0335 -3.8084 -3.8084 -3.4270 -3.4270 -3.0049 -3.0049 -2.9162 -2.9162 -2.5842 -2.5842 -2.5096 -2.5096 -2.0487 -2.0487 -1.8114 -1.8114 -1.5133 -1.5133 -1.3427 -1.3427 -1.1873 -1.1873 -1.0968 -1.0968 -0.9705 -0.9705 -0.8590 -0.8590 -0.7629 -0.7629 -0.6843 -0.6843 -0.2769 -0.2769 -0.0493 -0.0493 0.8320 0.8320 2.3735 2.3735 k = 0.0000-0.5774 0.1458 ( 11644 PWs) bands (ev): -19.6281 -19.6281 -19.3079 -19.3079 -18.6596 -18.6596 -17.9951 -17.9951 -17.3579 -17.3579 -16.2560 -16.2560 -10.5422 -10.5422 -8.7141 -8.7141 -6.5521 -6.5521 -6.0680 -6.0680 -5.1985 -5.1985 -4.8297 -4.8297 -4.7262 -4.7262 -4.4963 -4.4963 -4.2430 -4.2430 -3.9569 -3.9569 -3.8344 -3.8344 -3.4371 -3.4371 -3.0247 -3.0247 -2.7597 -2.7597 -2.6622 -2.6622 -2.4339 -2.4339 -2.0317 -2.0317 -1.6723 -1.6723 -1.5382 -1.5382 -1.1845 -1.1845 -1.1038 -1.1038 -1.0045 -1.0045 -0.9468 -0.9468 -0.8433 -0.8433 -0.7693 -0.7693 -0.6365 -0.6365 -0.1213 -0.1213 0.1072 0.1072 1.2653 1.2653 1.3921 1.3921 k = 0.0000-0.5609 0.1416 ( 11643 PWs) bands (ev): -19.6282 -19.6282 -19.3079 -19.3079 -18.6596 -18.6596 -17.9951 -17.9951 -17.3579 -17.3579 -16.2560 -16.2560 -10.5419 -10.5419 -8.7137 -8.7137 -6.5521 -6.5521 -6.0679 -6.0678 -5.1990 -5.1990 -4.8298 -4.8297 -4.7261 -4.7259 -4.4967 -4.4966 -4.2433 -4.2431 -3.9578 -3.9569 -3.8344 -3.8337 -3.4368 -3.4367 -3.0250 -3.0246 -2.7596 -2.7595 -2.6626 -2.6617 -2.4343 -2.4337 -2.0319 -2.0315 -1.6751 -1.6742 -1.5378 -1.5367 -1.1867 -1.1841 -1.1053 -1.1016 -1.0052 -1.0041 -0.9474 -0.9460 -0.8442 -0.8426 -0.7699 -0.7690 -0.6370 -0.6364 -0.1217 -0.1211 0.1061 0.1062 1.2641 1.2650 1.3936 1.3941 k = 0.0000-0.5444 0.1375 ( 11642 PWs) bands (ev): -19.6282 -19.6282 -19.3079 -19.3079 -18.6597 -18.6597 -17.9951 -17.9951 -17.3580 -17.3580 -16.2560 -16.2560 -10.5411 -10.5411 -8.7126 -8.7125 -6.5523 -6.5522 -6.0676 -6.0675 -5.2005 -5.2005 -4.8301 -4.8298 -4.7255 -4.7252 -4.4978 -4.4977 -4.2442 -4.2438 -3.9597 -3.9580 -3.8338 -3.8324 -3.4359 -3.4358 -3.0253 -3.0245 -2.7593 -2.7590 -2.6627 -2.6610 -2.4350 -2.4339 -2.0320 -2.0313 -1.6823 -1.6806 -1.5357 -1.5334 -1.1902 -1.1854 -1.1058 -1.0988 -1.0060 -1.0037 -0.9478 -0.9450 -0.8450 -0.8420 -0.7705 -0.7688 -0.6378 -0.6366 -0.1225 -0.1213 0.1028 0.1031 1.2615 1.2632 1.3984 1.3994 k = 0.0000-0.5279 0.1333 ( 11639 PWs) bands (ev): -19.6283 -19.6283 -19.3079 -19.3079 -18.6597 -18.6597 -17.9951 -17.9951 -17.3580 -17.3580 -16.2561 -16.2561 -10.5398 -10.5398 -8.7106 -8.7106 -6.5525 -6.5524 -6.0671 -6.0670 -5.2030 -5.2029 -4.8305 -4.8301 -4.7245 -4.7241 -4.4996 -4.4994 -4.2456 -4.2450 -3.9625 -3.9600 -3.8327 -3.8305 -3.4343 -3.4341 -3.0257 -3.0246 -2.7586 -2.7581 -2.6627 -2.6602 -2.4361 -2.4343 -2.0321 -2.0311 -1.6933 -1.6908 -1.5324 -1.5291 -1.1946 -1.1882 -1.1053 -1.0957 -1.0071 -1.0035 -0.9480 -0.9439 -0.8459 -0.8416 -0.7712 -0.7689 -0.6389 -0.6371 -0.1235 -0.1217 0.0975 0.0979 1.2569 1.2594 1.4064 1.4079 k = 0.0000-0.5114 0.1291 ( 11645 PWs) bands (ev): -19.6285 -19.6284 -19.3079 -19.3079 -18.6597 -18.6597 -17.9951 -17.9951 -17.3580 -17.3580 -16.2562 -16.2562 -10.5379 -10.5379 -8.7080 -8.7079 -6.5528 -6.5527 -6.0664 -6.0663 -5.2064 -5.2063 -4.8309 -4.8304 -4.7231 -4.7226 -4.5021 -4.5017 -4.2475 -4.2467 -3.9662 -3.9629 -3.8309 -3.8282 -3.4321 -3.4319 -3.0262 -3.0247 -2.7576 -2.7570 -2.6626 -2.6592 -2.4374 -2.4351 -2.0322 -2.0308 -1.7072 -1.7041 -1.5285 -1.5244 -1.1994 -1.1920 -1.1042 -1.0927 -1.0086 -1.0036 -0.9481 -0.9426 -0.8467 -0.8413 -0.7719 -0.7692 -0.6404 -0.6381 -0.1246 -0.1223 0.0902 0.0907 1.2499 1.2530 1.4176 1.4194 k = 0.0000-0.4949 0.1250 ( 11649 PWs) bands (ev): -19.6286 -19.6286 -19.3079 -19.3079 -18.6598 -18.6598 -17.9951 -17.9951 -17.3580 -17.3580 -16.2563 -16.2563 -10.5355 -10.5355 -8.7046 -8.7045 -6.5531 -6.5531 -6.0655 -6.0653 -5.2109 -5.2108 -4.8315 -4.8308 -4.7213 -4.7207 -4.5052 -4.5047 -4.2498 -4.2488 -3.9705 -3.9667 -3.8287 -3.8255 -3.4293 -3.4291 -3.0269 -3.0250 -2.7564 -2.7556 -2.6623 -2.6581 -2.4391 -2.4362 -2.0324 -2.0307 -1.7233 -1.7198 -1.5247 -1.5198 -1.2042 -1.1963 -1.1027 -1.0897 -1.0106 -1.0041 -0.9481 -0.9413 -0.8473 -0.8413 -0.7726 -0.7697 -0.6422 -0.6395 -0.1258 -0.1230 0.0811 0.0818 1.2401 1.2437 1.4321 1.4342 k = 0.0000-0.4784 0.1208 ( 11656 PWs) bands (ev): -19.6288 -19.6288 -19.3080 -19.3080 -18.6599 -18.6598 -17.9952 -17.9951 -17.3581 -17.3581 -16.2564 -16.2564 -10.5327 -10.5326 -8.7004 -8.7004 -6.5536 -6.5535 -6.0644 -6.0643 -5.2164 -5.2162 -4.8322 -4.8314 -4.7192 -4.7184 -4.5088 -4.5082 -4.2525 -4.2513 -3.9756 -3.9712 -3.8261 -3.8225 -3.4259 -3.4256 -3.0277 -3.0255 -2.7549 -2.7540 -2.6620 -2.6569 -2.4413 -2.4377 -2.0328 -2.0306 -1.7411 -1.7371 -1.5212 -1.5157 -1.2086 -1.2006 -1.1010 -1.0870 -1.0132 -1.0050 -0.9480 -0.9399 -0.8479 -0.8414 -0.7736 -0.7701 -0.6444 -0.6413 -0.1268 -0.1235 0.0703 0.0712 1.2276 1.2315 1.4503 1.4525 k = 0.0000-0.4619 0.1166 ( 11646 PWs) bands (ev): -19.6291 -19.6291 -19.3080 -19.3080 -18.6599 -18.6599 -17.9952 -17.9952 -17.3581 -17.3581 -16.2566 -16.2566 -10.5293 -10.5293 -8.6956 -8.6955 -6.5541 -6.5540 -6.0632 -6.0630 -5.2228 -5.2226 -4.8329 -4.8320 -4.7167 -4.7159 -4.5130 -4.5122 -4.2556 -4.2541 -3.9813 -3.9764 -3.8232 -3.8192 -3.4220 -3.4216 -3.0286 -3.0261 -2.7532 -2.7522 -2.6615 -2.6556 -2.4439 -2.4397 -2.0334 -2.0309 -1.7598 -1.7554 -1.5185 -1.5123 -1.2123 -1.2043 -1.0992 -1.0845 -1.0164 -1.0065 -0.9479 -0.9384 -0.8484 -0.8414 -0.7749 -0.7703 -0.6471 -0.6437 -0.1276 -0.1239 0.0581 0.0591 1.2124 1.2166 1.4721 1.4743 k = 0.0000-0.4454 0.1125 ( 11638 PWs) bands (ev): -19.6294 -19.6294 -19.3080 -19.3080 -18.6600 -18.6600 -17.9952 -17.9952 -17.3582 -17.3582 -16.2568 -16.2568 -10.5255 -10.5255 -8.6902 -8.6901 -6.5546 -6.5545 -6.0618 -6.0616 -5.2303 -5.2300 -4.8336 -4.8326 -4.7139 -4.7130 -4.5175 -4.5167 -4.2590 -4.2572 -3.9874 -3.9821 -3.8201 -3.8158 -3.4174 -3.4171 -3.0296 -3.0268 -2.7515 -2.7503 -2.6610 -2.6544 -2.4470 -2.4422 -2.0344 -2.0314 -1.7790 -1.7741 -1.5165 -1.5097 -1.2151 -1.2072 -1.0974 -1.0823 -1.0203 -1.0086 -0.9480 -0.9370 -0.8490 -0.8413 -0.7765 -0.7702 -0.6503 -0.6467 -0.1281 -0.1241 0.0447 0.0460 1.1950 1.1992 1.4974 1.4997 k = 0.0000-0.4289 0.1083 ( 11641 PWs) bands (ev): -19.6297 -19.6297 -19.3081 -19.3081 -18.6601 -18.6601 -17.9953 -17.9953 -17.3582 -17.3582 -16.2570 -16.2570 -10.5213 -10.5212 -8.6841 -8.6840 -6.5552 -6.5551 -6.0603 -6.0601 -5.2387 -5.2384 -4.8345 -4.8334 -4.7108 -4.7098 -4.5224 -4.5214 -4.2625 -4.2605 -3.9940 -3.9884 -3.8168 -3.8123 -3.4123 -3.4120 -3.0308 -3.0278 -2.7497 -2.7484 -2.6605 -2.6531 -2.4507 -2.4453 -2.0358 -2.0325 -1.7979 -1.7925 -1.5154 -1.5080 -1.2169 -1.2090 -1.0959 -1.0803 -1.0247 -1.0113 -0.9483 -0.9357 -0.8498 -0.8409 -0.7785 -0.7699 -0.6540 -0.6502 -0.1284 -0.1241 0.0305 0.0319 1.1756 1.1799 1.5260 1.5282 k = 0.0000-0.4124 0.1041 ( 11641 PWs) bands (ev): -19.6300 -19.6300 -19.3081 -19.3081 -18.6602 -18.6602 -17.9953 -17.9953 -17.3583 -17.3583 -16.2573 -16.2572 -10.5167 -10.5166 -8.6775 -8.6773 -6.5559 -6.5557 -6.0587 -6.0584 -5.2481 -5.2478 -4.8354 -4.8341 -4.7075 -4.7064 -4.5275 -4.5263 -4.2663 -4.2641 -4.0009 -3.9951 -3.8134 -3.8088 -3.4067 -3.4064 -3.0322 -3.0289 -2.7480 -2.7467 -2.6599 -2.6518 -2.4549 -2.4489 -2.0379 -2.0341 -1.8159 -1.8102 -1.5151 -1.5072 -1.2177 -1.2098 -1.0946 -1.0787 -1.0297 -1.0145 -0.9488 -0.9345 -0.8507 -0.8403 -0.7807 -0.7694 -0.6582 -0.6543 -0.1286 -0.1239 0.0158 0.0174 1.1547 1.1590 1.5577 1.5598 k = 0.0000-0.3959 0.1000 ( 11645 PWs) bands (ev): -19.6304 -19.6304 -19.3081 -19.3081 -18.6603 -18.6603 -17.9954 -17.9954 -17.3584 -17.3584 -16.2575 -16.2575 -10.5117 -10.5116 -8.6703 -8.6702 -6.5565 -6.5564 -6.0570 -6.0567 -5.2584 -5.2581 -4.8363 -4.8350 -4.7039 -4.7028 -4.5327 -4.5314 -4.2702 -4.2677 -4.0082 -4.0021 -3.8100 -3.8053 -3.4006 -3.4003 -3.0337 -3.0302 -2.7465 -2.7453 -2.6591 -2.6505 -2.4597 -2.4532 -2.0406 -2.0365 -1.8326 -1.8265 -1.5155 -1.5072 -1.2177 -1.2095 -1.0937 -1.0773 -1.0351 -1.0182 -0.9497 -0.9334 -0.8519 -0.8393 -0.7830 -0.7687 -0.6630 -0.6590 -0.1289 -0.1238 0.0011 0.0029 1.1327 1.1370 1.5922 1.5942 k = 0.0000-0.3794 0.0958 ( 11645 PWs) bands (ev): -19.6308 -19.6308 -19.3082 -19.3082 -18.6604 -18.6604 -17.9954 -17.9954 -17.3584 -17.3584 -16.2578 -16.2577 -10.5064 -10.5063 -8.6627 -8.6625 -6.5572 -6.5571 -6.0552 -6.0549 -5.2695 -5.2692 -4.8373 -4.8359 -4.7002 -4.6990 -4.5380 -4.5365 -4.2742 -4.2715 -4.0157 -4.0095 -3.8066 -3.8019 -3.3941 -3.3937 -3.0354 -3.0318 -2.7456 -2.7444 -2.6582 -2.6493 -2.4651 -2.4581 -2.0441 -2.0398 -1.8473 -1.8409 -1.5165 -1.5078 -1.2169 -1.2083 -1.0932 -1.0763 -1.0409 -1.0223 -0.9510 -0.9325 -0.8533 -0.8383 -0.7852 -0.7679 -0.6683 -0.6643 -0.1295 -0.1241 -0.0131 -0.0110 1.1099 1.1141 1.6291 1.6311 k = 0.0000-0.3629 0.0916 ( 11643 PWs) bands (ev): -19.6312 -19.6312 -19.3082 -19.3082 -18.6605 -18.6605 -17.9955 -17.9955 -17.3585 -17.3585 -16.2581 -16.2580 -10.5008 -10.5007 -8.6546 -8.6544 -6.5579 -6.5578 -6.0533 -6.0531 -5.2815 -5.2812 -4.8383 -4.8368 -4.6963 -4.6950 -4.5432 -4.5416 -4.2783 -4.2753 -4.0234 -4.0171 -3.8033 -3.7986 -3.3871 -3.3867 -3.0373 -3.0335 -2.7454 -2.7444 -2.6570 -2.6480 -2.4709 -2.4635 -2.0483 -2.0438 -1.8597 -1.8530 -1.5180 -1.5090 -1.2156 -1.2064 -1.0931 -1.0756 -1.0468 -1.0266 -0.9528 -0.9317 -0.8550 -0.8373 -0.7871 -0.7671 -0.6743 -0.6699 -0.1312 -0.1253 -0.0259 -0.0235 1.0866 1.0907 1.6683 1.6701 k = 0.0000-0.3464 0.0875 ( 11650 PWs) bands (ev): -19.6316 -19.6316 -19.3083 -19.3083 -18.6607 -18.6606 -17.9955 -17.9955 -17.3586 -17.3586 -16.2583 -16.2583 -10.4950 -10.4949 -8.6462 -8.6460 -6.5586 -6.5585 -6.0515 -6.0512 -5.2942 -5.2939 -4.8394 -4.8379 -4.6923 -4.6909 -4.5482 -4.5465 -4.2824 -4.2792 -4.0313 -4.0249 -3.8001 -3.7955 -3.3798 -3.3794 -3.0393 -3.0354 -2.7462 -2.7455 -2.6554 -2.6465 -2.4770 -2.4693 -2.0530 -2.0485 -1.8695 -1.8628 -1.5198 -1.5105 -1.2138 -1.2041 -1.0935 -1.0755 -1.0528 -1.0309 -0.9550 -0.9311 -0.8568 -0.8365 -0.7886 -0.7663 -0.6808 -0.6759 -0.1344 -0.1281 -0.0365 -0.0339 1.0630 1.0670 1.7093 1.7111 k = 0.0000-0.3299 0.0833 ( 11655 PWs) bands (ev): -19.6320 -19.6320 -19.3083 -19.3083 -18.6608 -18.6607 -17.9956 -17.9956 -17.3587 -17.3587 -16.2586 -16.2586 -10.4889 -10.4889 -8.6375 -8.6373 -6.5594 -6.5592 -6.0496 -6.0493 -5.3075 -5.3072 -4.8406 -4.8391 -4.6882 -4.6867 -4.5529 -4.5511 -4.2865 -4.2831 -4.0392 -4.0328 -3.7971 -3.7925 -3.3721 -3.3717 -3.0415 -3.0375 -2.7484 -2.7480 -2.6533 -2.6448 -2.4831 -2.4754 -2.0580 -2.0536 -1.8768 -1.8701 -1.5218 -1.5123 -1.2120 -1.2018 -1.0944 -1.0761 -1.0586 -1.0351 -0.9577 -0.9307 -0.8590 -0.8361 -0.7895 -0.7656 -0.6877 -0.6821 -0.1399 -0.1331 -0.0441 -0.0413 1.0396 1.0434 1.7519 1.7536 k = 0.0000-0.3134 0.0791 ( 11649 PWs) bands (ev): -19.6325 -19.6325 -19.3084 -19.3084 -18.6609 -18.6609 -17.9956 -17.9956 -17.3588 -17.3587 -16.2589 -16.2589 -10.4827 -10.4827 -8.6285 -8.6283 -6.5601 -6.5599 -6.0477 -6.0475 -5.3214 -5.3211 -4.8419 -4.8403 -4.6840 -4.6825 -4.5573 -4.5554 -4.2906 -4.2871 -4.0472 -4.0408 -3.7942 -3.7897 -3.3642 -3.3636 -3.0439 -3.0398 -2.7525 -2.7520 -2.6505 -2.6428 -2.4892 -2.4815 -2.0630 -2.0588 -1.8817 -1.8751 -1.5239 -1.5143 -1.2104 -1.1997 -1.0958 -1.0776 -1.0636 -1.0391 -0.9608 -0.9305 -0.8614 -0.8362 -0.7896 -0.7650 -0.6949 -0.6883 -0.1478 -0.1406 -0.0483 -0.0453 1.0164 1.0201 1.7957 1.7974 k = 0.0000-0.2969 0.0750 ( 11642 PWs) bands (ev): -19.6329 -19.6329 -19.3084 -19.3084 -18.6610 -18.6610 -17.9957 -17.9957 -17.3588 -17.3588 -16.2592 -16.2592 -10.4765 -10.4764 -8.6194 -8.6192 -6.5608 -6.5606 -6.0459 -6.0456 -5.3356 -5.3353 -4.8434 -4.8417 -4.6798 -4.6782 -4.5614 -4.5594 -4.2946 -4.2911 -4.0551 -4.0488 -3.7916 -3.7872 -3.3560 -3.3554 -3.0464 -3.0422 -2.7586 -2.7577 -2.6472 -2.6404 -2.4948 -2.4875 -2.0677 -2.0638 -1.8845 -1.8781 -1.5260 -1.5163 -1.2093 -1.1984 -1.0975 -1.0802 -1.0677 -1.0428 -0.9643 -0.9305 -0.8641 -0.8369 -0.7889 -0.7646 -0.7023 -0.6944 -0.1578 -0.1503 -0.0494 -0.0463 0.9937 0.9973 1.8405 1.8422 k = 0.0000-0.2804 0.0708 ( 11644 PWs) bands (ev): -19.6334 -19.6333 -19.3085 -19.3085 -18.6612 -18.6611 -17.9958 -17.9957 -17.3589 -17.3589 -16.2596 -16.2595 -10.4701 -10.4701 -8.6102 -8.6100 -6.5614 -6.5613 -6.0441 -6.0439 -5.3501 -5.3498 -4.8449 -4.8432 -4.6756 -4.6740 -4.5649 -4.5629 -4.2987 -4.2951 -4.0630 -4.0568 -3.7892 -3.7849 -3.3476 -3.3469 -3.0490 -3.0448 -2.7666 -2.7653 -2.6433 -2.6375 -2.4999 -2.4930 -2.0717 -2.0682 -1.8855 -1.8794 -1.5281 -1.5183 -1.2091 -1.1981 -1.0995 -1.0839 -1.0707 -1.0464 -0.9681 -0.9309 -0.8672 -0.8383 -0.7874 -0.7645 -0.7095 -0.7002 -0.1692 -0.1615 -0.0479 -0.0448 0.9716 0.9750 1.8859 1.8876 k = 0.0000-0.2639 0.0667 ( 11639 PWs) bands (ev): -19.6338 -19.6338 -19.3085 -19.3085 -18.6613 -18.6612 -17.9958 -17.9958 -17.3590 -17.3590 -16.2599 -16.2598 -10.4638 -10.4637 -8.6009 -8.6007 -6.5621 -6.5619 -6.0425 -6.0422 -5.3648 -5.3645 -4.8465 -4.8449 -4.6714 -4.6698 -4.5680 -4.5660 -4.3027 -4.2991 -4.0707 -4.0647 -3.7870 -3.7829 -3.3390 -3.3382 -3.0517 -3.0475 -2.7763 -2.7747 -2.6389 -2.6342 -2.5042 -2.4980 -2.0750 -2.0718 -1.8850 -1.8792 -1.5301 -1.5202 -1.2099 -1.1993 -1.1015 -1.0878 -1.0730 -1.0497 -0.9720 -0.9317 -0.8704 -0.8401 -0.7853 -0.7646 -0.7165 -0.7055 -0.1813 -0.1734 -0.0447 -0.0416 0.9504 0.9536 1.9316 1.9333 k = 0.0000-0.2474 0.0625 ( 11631 PWs) bands (ev): -19.6343 -19.6342 -19.3086 -19.3086 -18.6614 -18.6614 -17.9959 -17.9959 -17.3591 -17.3591 -16.2602 -16.2601 -10.4575 -10.4574 -8.5917 -8.5915 -6.5627 -6.5625 -6.0409 -6.0406 -5.3794 -5.3791 -4.8483 -4.8467 -4.6673 -4.6657 -4.5706 -4.5686 -4.3067 -4.3031 -4.0782 -4.0724 -3.7850 -3.7811 -3.3304 -3.3295 -3.0545 -3.0502 -2.7877 -2.7859 -2.6341 -2.6304 -2.5076 -2.5023 -2.0774 -2.0745 -1.8832 -1.8777 -1.5319 -1.5221 -1.2122 -1.2020 -1.1041 -1.0912 -1.0751 -1.0529 -0.9759 -0.9328 -0.8737 -0.8424 -0.7828 -0.7650 -0.7230 -0.7100 -0.1934 -0.1854 -0.0402 -0.0372 0.9301 0.9332 1.9772 1.9789 k = 0.0000-0.2309 0.0583 ( 11635 PWs) bands (ev): -19.6347 -19.6347 -19.3086 -19.3086 -18.6615 -18.6615 -17.9959 -17.9959 -17.3592 -17.3591 -16.2604 -16.2604 -10.4512 -10.4512 -8.5827 -8.5825 -6.5632 -6.5631 -6.0394 -6.0391 -5.3939 -5.3936 -4.8502 -4.8486 -4.6633 -4.6616 -4.5727 -4.5707 -4.3107 -4.3071 -4.0854 -4.0798 -3.7833 -3.7796 -3.3217 -3.3207 -3.0573 -3.0530 -2.8004 -2.7986 -2.6292 -2.6264 -2.5103 -2.5057 -2.0788 -2.0763 -1.8804 -1.8751 -1.5337 -1.5238 -1.2159 -1.2064 -1.1076 -1.0936 -1.0773 -1.0557 -0.9795 -0.9344 -0.8770 -0.8450 -0.7801 -0.7657 -0.7289 -0.7138 -0.2053 -0.1973 -0.0349 -0.0320 0.9108 0.9138 2.0225 2.0241 k = 0.0000-0.2144 0.0542 ( 11638 PWs) bands (ev): -19.6351 -19.6351 -19.3087 -19.3087 -18.6617 -18.6616 -17.9960 -17.9960 -17.3592 -17.3592 -16.2607 -16.2607 -10.4452 -10.4451 -8.5738 -8.5736 -6.5638 -6.5636 -6.0380 -6.0378 -5.4080 -5.4078 -4.8521 -4.8506 -4.6594 -4.6578 -4.5743 -4.5723 -4.3146 -4.3111 -4.0923 -4.0870 -3.7818 -3.7783 -3.3131 -3.3120 -3.0600 -3.0558 -2.8141 -2.8123 -2.6242 -2.6222 -2.5121 -2.5082 -2.0794 -2.0772 -1.8767 -1.8717 -1.5353 -1.5255 -1.2210 -1.2123 -1.1123 -1.0955 -1.0793 -1.0578 -0.9827 -0.9364 -0.8801 -0.8479 -0.7774 -0.7662 -0.7341 -0.7167 -0.2166 -0.2086 -0.0291 -0.0263 0.8928 0.8955 2.0670 2.0686 k = 0.0000-0.1979 0.0500 ( 11639 PWs) bands (ev): -19.6355 -19.6355 -19.3087 -19.3087 -18.6618 -18.6617 -17.9960 -17.9960 -17.3593 -17.3593 -16.2610 -16.2610 -10.4393 -10.4393 -8.5653 -8.5651 -6.5642 -6.5641 -6.0367 -6.0365 -5.4218 -5.4215 -4.8542 -4.8527 -4.6556 -4.6541 -4.5754 -4.5735 -4.3185 -4.3151 -4.0988 -4.0939 -3.7806 -3.7773 -3.3045 -3.3033 -3.0627 -3.0585 -2.8284 -2.8268 -2.6193 -2.6178 -2.5132 -2.5099 -2.0792 -2.0773 -1.8723 -1.8676 -1.5368 -1.5271 -1.2275 -1.2194 -1.1181 -1.0986 -1.0803 -1.0588 -0.9853 -0.9388 -0.8829 -0.8511 -0.7754 -0.7662 -0.7385 -0.7187 -0.2272 -0.2193 -0.0231 -0.0205 0.8759 0.8785 2.1104 2.1121 k = 0.0000-0.1815 0.0458 ( 11645 PWs) bands (ev): -19.6359 -19.6359 -19.3088 -19.3088 -18.6619 -18.6619 -17.9961 -17.9961 -17.3594 -17.3594 -16.2613 -16.2612 -10.4337 -10.4337 -8.5570 -8.5569 -6.5647 -6.5646 -6.0356 -6.0354 -5.4349 -5.4346 -4.8562 -4.8548 -4.6521 -4.6506 -4.5761 -4.5743 -4.3223 -4.3191 -4.1049 -4.1003 -3.7795 -3.7764 -3.2961 -3.2948 -3.0653 -3.0612 -2.8432 -2.8416 -2.6147 -2.6133 -2.5138 -2.5109 -2.0783 -2.0767 -1.8673 -1.8628 -1.5383 -1.5287 -1.2350 -1.2274 -1.1247 -1.1040 -1.0796 -1.0587 -0.9872 -0.9417 -0.8853 -0.8544 -0.7744 -0.7652 -0.7421 -0.7202 -0.2369 -0.2293 -0.0170 -0.0145 0.8604 0.8627 2.1524 2.1541 k = 0.0000-0.1650 0.0417 ( 11643 PWs) bands (ev): -19.6362 -19.6362 -19.3088 -19.3088 -18.6620 -18.6620 -17.9961 -17.9961 -17.3595 -17.3594 -16.2615 -16.2615 -10.4284 -10.4284 -8.5493 -8.5491 -6.5651 -6.5650 -6.0346 -6.0344 -5.4473 -5.4471 -4.8583 -4.8570 -4.6488 -4.6474 -4.5764 -4.5747 -4.3260 -4.3230 -4.1105 -4.1063 -3.7787 -3.7758 -3.2879 -3.2866 -3.0676 -3.0636 -2.8579 -2.8565 -2.6104 -2.6089 -2.5139 -2.5111 -2.0769 -2.0755 -1.8618 -1.8576 -1.5398 -1.5304 -1.2432 -1.2359 -1.1319 -1.1115 -1.0775 -1.0576 -0.9886 -0.9447 -0.8872 -0.8577 -0.7742 -0.7636 -0.7446 -0.7211 -0.2458 -0.2385 -0.0111 -0.0087 0.8462 0.8483 2.1926 2.1943 k = 0.0000-0.1485 0.0375 ( 11646 PWs) bands (ev): -19.6366 -19.6366 -19.3089 -19.3088 -18.6621 -18.6621 -17.9962 -17.9962 -17.3595 -17.3595 -16.2617 -16.2617 -10.4235 -10.4234 -8.5420 -8.5418 -6.5655 -6.5654 -6.0338 -6.0336 -5.4589 -5.4587 -4.8603 -4.8592 -4.6457 -4.6444 -4.5764 -4.5748 -4.3296 -4.3268 -4.1156 -4.1118 -3.7780 -3.7754 -3.2800 -3.2787 -3.0697 -3.0658 -2.8724 -2.8710 -2.6065 -2.6047 -2.5135 -2.5108 -2.0751 -2.0738 -1.8559 -1.8520 -1.5413 -1.5323 -1.2518 -1.2448 -1.1393 -1.1203 -1.0747 -1.0561 -0.9893 -0.9479 -0.8887 -0.8611 -0.7743 -0.7622 -0.7458 -0.7217 -0.2538 -0.2468 -0.0053 -0.0032 0.8333 0.8352 2.2306 2.2323 k = 0.0000-0.1320 0.0333 ( 11649 PWs) bands (ev): -19.6369 -19.6369 -19.3089 -19.3089 -18.6622 -18.6622 -17.9962 -17.9962 -17.3596 -17.3596 -16.2620 -16.2619 -10.4189 -10.4189 -8.5353 -8.5351 -6.5658 -6.5657 -6.0331 -6.0329 -5.4696 -5.4694 -4.8623 -4.8612 -4.6429 -4.6417 -4.5761 -4.5746 -4.3330 -4.3304 -4.1202 -4.1167 -3.7775 -3.7751 -3.2726 -3.2712 -3.0715 -3.0678 -2.8864 -2.8850 -2.6028 -2.6009 -2.5128 -2.5101 -2.0729 -2.0719 -1.8498 -1.8462 -1.5430 -1.5343 -1.2604 -1.2537 -1.1469 -1.1296 -1.0714 -1.0543 -0.9894 -0.9512 -0.8899 -0.8645 -0.7744 -0.7617 -0.7455 -0.7220 -0.2608 -0.2544 0.0001 0.0020 0.8218 0.8236 2.2662 2.2678 k = 0.0000-0.1155 0.0292 ( 11652 PWs) bands (ev): -19.6372 -19.6372 -19.3089 -19.3089 -18.6623 -18.6622 -17.9963 -17.9962 -17.3596 -17.3596 -16.2621 -16.2621 -10.4148 -10.4147 -8.5292 -8.5290 -6.5660 -6.5660 -6.0324 -6.0323 -5.4792 -5.4790 -4.8642 -4.8632 -4.6403 -4.6393 -4.5756 -4.5743 -4.3362 -4.3339 -4.1242 -4.1212 -3.7771 -3.7750 -3.2656 -3.2643 -3.0730 -3.0694 -2.8996 -2.8982 -2.5995 -2.5975 -2.5119 -2.5092 -2.0707 -2.0698 -1.8436 -1.8402 -1.5447 -1.5366 -1.2686 -1.2624 -1.1543 -1.1391 -1.0680 -1.0525 -0.9890 -0.9545 -0.8906 -0.8677 -0.7743 -0.7621 -0.7440 -0.7223 -0.2669 -0.2611 0.0051 0.0068 0.8118 0.8133 2.2989 2.3004 k = 0.0000-0.0990 0.0250 ( 11655 PWs) bands (ev): -19.6374 -19.6374 -19.3090 -19.3089 -18.6623 -18.6623 -17.9963 -17.9963 -17.3597 -17.3597 -16.2623 -16.2623 -10.4111 -10.4111 -8.5238 -8.5237 -6.5663 -6.5662 -6.0319 -6.0318 -5.4877 -5.4876 -4.8659 -4.8651 -4.6381 -4.6372 -4.5750 -4.5738 -4.3391 -4.3371 -4.1277 -4.1251 -3.7768 -3.7750 -3.2593 -3.2581 -3.0740 -3.0707 -2.9117 -2.9103 -2.5966 -2.5946 -2.5108 -2.5082 -2.0684 -2.0677 -1.8375 -1.8344 -1.5465 -1.5391 -1.2762 -1.2705 -1.1613 -1.1482 -1.0646 -1.0509 -0.9882 -0.9578 -0.8909 -0.8709 -0.7741 -0.7629 -0.7418 -0.7227 -0.2722 -0.2670 0.0096 0.0111 0.8031 0.8044 2.3283 2.3297 k = 0.0000-0.0825 0.0208 ( 11649 PWs) bands (ev): -19.6376 -19.6376 -19.3090 -19.3090 -18.6624 -18.6624 -17.9963 -17.9963 -17.3597 -17.3597 -16.2624 -16.2624 -10.4079 -10.4079 -8.5191 -8.5190 -6.5665 -6.5664 -6.0316 -6.0315 -5.4950 -5.4949 -4.8674 -4.8667 -4.6362 -4.6354 -4.5743 -4.5733 -4.3416 -4.3399 -4.1306 -4.1284 -3.7765 -3.7750 -3.2537 -3.2526 -3.0747 -3.0717 -2.9225 -2.9212 -2.5940 -2.5922 -2.5096 -2.5072 -2.0663 -2.0657 -1.8316 -1.8289 -1.5483 -1.5417 -1.2829 -1.2778 -1.1676 -1.1567 -1.0614 -1.0495 -0.9869 -0.9610 -0.8909 -0.8739 -0.7736 -0.7640 -0.7392 -0.7231 -0.2765 -0.2720 0.0135 0.0148 0.7958 0.7969 2.3541 2.3553 k = 0.0000-0.0660 0.0167 ( 11642 PWs) bands (ev): -19.6378 -19.6378 -19.3090 -19.3090 -18.6625 -18.6624 -17.9963 -17.9963 -17.3597 -17.3597 -16.2626 -16.2626 -10.4053 -10.4053 -8.5152 -8.5151 -6.5666 -6.5666 -6.0312 -6.0312 -5.5011 -5.5010 -4.8687 -4.8681 -4.6346 -4.6340 -4.5736 -4.5728 -4.3438 -4.3424 -4.1329 -4.1311 -3.7764 -3.7752 -3.2489 -3.2480 -3.0749 -3.0724 -2.9318 -2.9306 -2.5918 -2.5902 -2.5084 -2.5064 -2.0644 -2.0639 -1.8262 -1.8240 -1.5500 -1.5445 -1.2885 -1.2842 -1.1728 -1.1641 -1.0583 -1.0486 -0.9853 -0.9641 -0.8905 -0.8767 -0.7729 -0.7651 -0.7366 -0.7236 -0.2799 -0.2762 0.0168 0.0179 0.7899 0.7908 2.3758 2.3769 k = 0.0000-0.0495 0.0125 ( 11654 PWs) bands (ev): -19.6379 -19.6379 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2627 -16.2626 -10.4033 -10.4032 -8.5121 -8.5121 -6.5667 -6.5667 -6.0310 -6.0310 -5.5059 -5.5058 -4.8697 -4.8693 -4.6334 -4.6329 -4.5729 -4.5723 -4.3455 -4.3444 -4.1346 -4.1333 -3.7762 -3.7753 -3.2450 -3.2443 -3.0749 -3.0729 -2.9393 -2.9383 -2.5901 -2.5888 -2.5073 -2.5057 -2.0628 -2.0624 -1.8216 -1.8198 -1.5514 -1.5471 -1.2927 -1.2894 -1.1770 -1.1705 -1.0557 -1.0482 -0.9833 -0.9672 -0.8898 -0.8793 -0.7721 -0.7662 -0.7342 -0.7244 -0.2824 -0.2796 0.0195 0.0202 0.7854 0.7860 2.3933 2.3941 k = 0.0000-0.0330 0.0083 ( 11654 PWs) bands (ev): -19.6380 -19.6380 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2627 -16.2627 -10.4018 -10.4017 -8.5099 -8.5099 -6.5668 -6.5668 -6.0309 -6.0308 -5.5093 -5.5092 -4.8704 -4.8701 -4.6324 -4.6321 -4.5724 -4.5720 -4.3467 -4.3460 -4.1358 -4.1349 -3.7761 -3.7755 -3.2422 -3.2416 -3.0747 -3.0733 -2.9448 -2.9441 -2.5887 -2.5879 -2.5064 -2.5053 -2.0616 -2.0613 -1.8179 -1.8167 -1.5524 -1.5494 -1.2957 -1.2934 -1.1797 -1.1754 -1.0533 -1.0482 -0.9811 -0.9702 -0.8888 -0.8817 -0.7713 -0.7673 -0.7319 -0.7253 -0.2841 -0.2822 0.0214 0.0219 0.7822 0.7826 2.4060 2.4066 k = 0.0000-0.0165 0.0042 ( 11660 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4009 -10.4009 -8.5086 -8.5086 -6.5669 -6.5668 -6.0308 -6.0307 -5.5113 -5.5113 -4.8708 -4.8707 -4.6319 -4.6317 -4.5720 -4.5718 -4.3473 -4.3470 -4.1364 -4.1360 -3.7759 -3.7756 -3.2404 -3.2401 -3.0743 -3.0736 -2.9481 -2.9477 -2.5878 -2.5874 -2.5057 -2.5051 -2.0608 -2.0607 -1.8155 -1.8149 -1.5527 -1.5512 -1.2972 -1.2960 -1.1810 -1.1789 -1.0514 -1.0488 -0.9786 -0.9732 -0.8875 -0.8839 -0.7703 -0.7683 -0.7299 -0.7266 -0.2849 -0.2839 0.0226 0.0229 0.7803 0.7805 2.4138 2.4141 k = 0.0000 0.0000 0.0000 ( 11665 PWs) bands (ev): -19.6381 -19.6381 -19.3090 -19.3090 -18.6625 -18.6625 -17.9964 -17.9964 -17.3598 -17.3598 -16.2628 -16.2628 -10.4006 -10.4006 -8.5081 -8.5081 -6.5669 -6.5669 -6.0307 -6.0307 -5.5120 -5.5120 -4.8709 -4.8709 -4.6316 -4.6316 -4.5718 -4.5718 -4.3474 -4.3474 -4.1365 -4.1365 -3.7758 -3.7758 -3.2397 -3.2397 -3.0739 -3.0739 -2.9491 -2.9491 -2.5874 -2.5874 -2.5052 -2.5052 -2.0605 -2.0605 -1.8145 -1.8145 -1.5524 -1.5524 -1.2973 -1.2973 -1.1808 -1.1808 -1.0499 -1.0499 -0.9760 -0.9760 -0.8858 -0.8858 -0.7694 -0.7694 -0.7281 -0.7281 -0.2848 -0.2848 0.0231 0.0231 0.7797 0.7797 2.4166 2.4166 Writing output data file FexSi2O3x2.save init_run : 3.91s CPU 11.43s WALL ( 1 calls) electrons : 2722.15s CPU 2745.92s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.71s CPU 1.59s WALL ( 1 calls) Called by electrons: c_bands : 2722.12s CPU 2745.71s WALL ( 1 calls) v_of_rho : 0.29s CPU 0.85s WALL ( 1 calls) v_h : 0.05s CPU 0.05s WALL ( 1 calls) v_xc : 0.23s CPU 0.62s WALL ( 1 calls) newd : 1.04s CPU 1.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.19s CPU 0.34s WALL ( 250 calls) cegterg : 2422.64s CPU 2439.99s WALL ( 1066 calls) Called by sum_band: Called by *egterg: h_psi : 1128.77s CPU 1142.77s WALL ( 20765 calls) s_psi : 137.84s CPU 138.06s WALL ( 20765 calls) g_psi : 3.12s CPU 3.14s WALL ( 19449 calls) cdiaghg : 771.99s CPU 768.16s WALL ( 19699 calls) cegterg:over : 204.16s CPU 197.98s WALL ( 19449 calls) cegterg:upda : 86.55s CPU 92.19s WALL ( 19449 calls) cegterg:last : 56.48s CPU 57.38s WALL ( 2415 calls) Called by h_psi: h_psi:vloc : 842.65s CPU 852.96s WALL ( 20765 calls) h_psi:vnl : 283.93s CPU 286.47s WALL ( 20765 calls) add_vuspsi : 115.25s CPU 121.94s WALL ( 20765 calls) General routines calbec : 168.58s CPU 164.40s WALL ( 20765 calls) fft : 0.67s CPU 1.42s WALL ( 19 calls) ffts : 0.04s CPU 0.04s WALL ( 4 calls) fftw : 797.18s CPU 802.71s WALL ( 2029096 calls) interpolate : 0.22s CPU 0.26s WALL ( 4 calls) davcio : 0.04s CPU 10.53s WALL ( 500 calls) Parallel routines fft_scatter : 449.72s CPU 448.45s WALL ( 2029119 calls) PWSCF : 48m16.64s CPU 55m50.82s WALL This run was terminated on: 5:53:50 5Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=