Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:27:53 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./H2C2I.save/ file I.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 32 18 5 3085 1295 198 Max 33 19 6 3106 1321 213 Sum 2373 1325 383 223007 94081 14663 bravais-lattice index = 14 lattice parameter (alat) = 8.3293 a.u. unit-cell volume = 2234.6978 (a.u.)^3 number of atoms/cell = 20 number of atomic types = 3 number of electrons = 68.00 number of Kohn-Sham states= 82 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.329345 celldm(2)= 1.327109 celldm(3)= 2.941398 celldm(4)= -0.001065 celldm(5)= -0.052162 celldm(6)= -0.125905 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.167089 1.316549 0.000000 ) a(3) = ( -0.153428 -0.022629 2.937307 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.126915 0.053212 ) b(2) = ( 0.000000 0.759562 0.005852 ) b(3) = ( 0.000000 0.000000 0.340448 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for I read from file: /users/gautes/Pseudo/I.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 7c65668ffc3f6431347fa26e98076fd5 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1247 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 C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 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 1073 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 atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) I 7.00 126.90450 I( 1.00) C 4.00 12.01070 C( 1.00) 2 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 inversion cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) double point group C_i (-1) there are 4 classes and 2 irreducible representations the character table: E -E i -i G_2+ 1.00 -1.00 1.00 -1.00 G_2- 1.00 -1.00 -1.00 1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E i 2 inversion -i -2 inversion E Cartesian axes number of k points= 244 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 -0.3797809 -0.0029258), wk = 0.0040984 k( 2) = ( 0.0000000 -0.3662173 -0.0028213), wk = 0.0040984 k( 3) = ( 0.0000000 -0.3526537 -0.0027168), wk = 0.0040984 k( 4) = ( 0.0000000 -0.3390901 -0.0026123), wk = 0.0040984 k( 5) = ( 0.0000000 -0.3255265 -0.0025078), wk = 0.0040984 k( 6) = ( 0.0000000 -0.3119629 -0.0024034), wk = 0.0040984 k( 7) = ( 0.0000000 -0.2983992 -0.0022989), wk = 0.0040984 k( 8) = ( 0.0000000 -0.2848356 -0.0021944), wk = 0.0040984 k( 9) = ( 0.0000000 -0.2712720 -0.0020899), wk = 0.0040984 k( 10) = ( 0.0000000 -0.2577084 -0.0019854), wk = 0.0040984 k( 11) = ( 0.0000000 -0.2441448 -0.0018809), wk = 0.0040984 k( 12) = ( 0.0000000 -0.2305812 -0.0017764), wk = 0.0040984 k( 13) = ( 0.0000000 -0.2170176 -0.0016719), wk = 0.0040984 k( 14) = ( 0.0000000 -0.2034540 -0.0015674), wk = 0.0040984 k( 15) = ( 0.0000000 -0.1898904 -0.0014629), wk = 0.0040984 k( 16) = ( 0.0000000 -0.1763268 -0.0013584), wk = 0.0040984 k( 17) = ( 0.0000000 -0.1627632 -0.0012539), wk = 0.0040984 k( 18) = ( 0.0000000 -0.1491996 -0.0011494), wk = 0.0040984 k( 19) = ( 0.0000000 -0.1356360 -0.0010449), wk = 0.0040984 k( 20) = ( 0.0000000 -0.1220724 -0.0009404), wk = 0.0040984 k( 21) = ( 0.0000000 -0.1085088 -0.0008359), wk = 0.0040984 k( 22) = ( 0.0000000 -0.0949452 -0.0007315), wk = 0.0040984 k( 23) = ( 0.0000000 -0.0813816 -0.0006270), wk = 0.0040984 k( 24) = ( 0.0000000 -0.0678180 -0.0005225), wk = 0.0040984 k( 25) = ( 0.0000000 -0.0542544 -0.0004180), wk = 0.0040984 k( 26) = ( 0.0000000 -0.0406908 -0.0003135), wk = 0.0040984 k( 27) = ( 0.0000000 -0.0271272 -0.0002090), wk = 0.0040984 k( 28) = ( 0.0000000 -0.0135636 -0.0001045), wk = 0.0040984 k( 29) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 30) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 31) = ( 0.0138889 0.0017627 0.0007391), wk = 0.0040984 k( 32) = ( 0.0277778 0.0035254 0.0014781), wk = 0.0040984 k( 33) = ( 0.0416667 0.0052881 0.0022172), wk = 0.0040984 k( 34) = ( 0.0555556 0.0070508 0.0029562), wk = 0.0040984 k( 35) = ( 0.0694444 0.0088135 0.0036953), wk = 0.0040984 k( 36) = ( 0.0833333 0.0105762 0.0044343), wk = 0.0040984 k( 37) = ( 0.0972222 0.0123389 0.0051734), wk = 0.0040984 k( 38) = ( 0.1111111 0.0141016 0.0059125), wk = 0.0040984 k( 39) = ( 0.1250000 0.0158643 0.0066515), wk = 0.0040984 k( 40) = ( 0.1388889 0.0176270 0.0073906), wk = 0.0040984 k( 41) = ( 0.1527778 0.0193897 0.0081296), wk = 0.0040984 k( 42) = ( 0.1666667 0.0211524 0.0088687), wk = 0.0040984 k( 43) = ( 0.1805556 0.0229151 0.0096077), wk = 0.0040984 k( 44) = ( 0.1944444 0.0246778 0.0103468), wk = 0.0040984 k( 45) = ( 0.2083333 0.0264405 0.0110858), wk = 0.0040984 k( 46) = ( 0.2222222 0.0282032 0.0118249), wk = 0.0040984 k( 47) = ( 0.2361111 0.0299659 0.0125640), wk = 0.0040984 k( 48) = ( 0.2500000 0.0317286 0.0133030), wk = 0.0040984 k( 49) = ( 0.2638889 0.0334913 0.0140421), wk = 0.0040984 k( 50) = ( 0.2777778 0.0352540 0.0147811), wk = 0.0040984 k( 51) = ( 0.2916667 0.0370168 0.0155202), wk = 0.0040984 k( 52) = ( 0.3055556 0.0387795 0.0162592), wk = 0.0040984 k( 53) = ( 0.3194444 0.0405422 0.0169983), wk = 0.0040984 k( 54) = ( 0.3333333 0.0423049 0.0177374), wk = 0.0040984 k( 55) = ( 0.3472222 0.0440676 0.0184764), wk = 0.0040984 k( 56) = ( 0.3611111 0.0458303 0.0192155), wk = 0.0040984 k( 57) = ( 0.3750000 0.0475930 0.0199545), wk = 0.0040984 k( 58) = ( 0.3888889 0.0493557 0.0206936), wk = 0.0040984 k( 59) = ( 0.4027778 0.0511184 0.0214326), wk = 0.0040984 k( 60) = ( 0.4166667 0.0528811 0.0221717), wk = 0.0040984 k( 61) = ( 0.4305556 0.0546438 0.0229108), wk = 0.0040984 k( 62) = ( 0.4444444 0.0564065 0.0236498), wk = 0.0040984 k( 63) = ( 0.4583333 0.0581692 0.0243889), wk = 0.0040984 k( 64) = ( 0.4722222 0.0599319 0.0251279), wk = 0.0040984 k( 65) = ( 0.4861111 0.0616946 0.0258670), wk = 0.0040984 k( 66) = ( 0.5000000 0.0634573 0.0266060), wk = 0.0040984 k( 67) = ( 0.5000000 -0.3163236 0.0236802), wk = 0.0040984 k( 68) = ( 0.4883721 -0.3089672 0.0231295), wk = 0.0040984 k( 69) = ( 0.4767442 -0.3016109 0.0225788), wk = 0.0040984 k( 70) = ( 0.4651163 -0.2942545 0.0220281), wk = 0.0040984 k( 71) = ( 0.4534884 -0.2868981 0.0214774), wk = 0.0040984 k( 72) = ( 0.4418605 -0.2795418 0.0209267), wk = 0.0040984 k( 73) = ( 0.4302326 -0.2721854 0.0203760), wk = 0.0040984 k( 74) = ( 0.4186047 -0.2648290 0.0198253), wk = 0.0040984 k( 75) = ( 0.4069767 -0.2574727 0.0192746), wk = 0.0040984 k( 76) = ( 0.3953488 -0.2501163 0.0187239), wk = 0.0040984 k( 77) = ( 0.3837209 -0.2427600 0.0181732), wk = 0.0040984 k( 78) = ( 0.3720930 -0.2354036 0.0176225), wk = 0.0040984 k( 79) = ( 0.3604651 -0.2280472 0.0170718), wk = 0.0040984 k( 80) = ( 0.3488372 -0.2206909 0.0165211), wk = 0.0040984 k( 81) = ( 0.3372093 -0.2133345 0.0159704), wk = 0.0040984 k( 82) = ( 0.3255814 -0.2059781 0.0154197), wk = 0.0040984 k( 83) = ( 0.3139535 -0.1986218 0.0148690), wk = 0.0040984 k( 84) = ( 0.3023256 -0.1912654 0.0143183), wk = 0.0040984 k( 85) = ( 0.2906977 -0.1839091 0.0137676), wk = 0.0040984 k( 86) = ( 0.2790698 -0.1765527 0.0132169), wk = 0.0040984 k( 87) = ( 0.2674419 -0.1691963 0.0126662), wk = 0.0040984 k( 88) = ( 0.2558140 -0.1618400 0.0121155), wk = 0.0040984 k( 89) = ( 0.2441860 -0.1544836 0.0115648), wk = 0.0040984 k( 90) = ( 0.2325581 -0.1471272 0.0110141), wk = 0.0040984 k( 91) = ( 0.2209302 -0.1397709 0.0104633), wk = 0.0040984 k( 92) = ( 0.2093023 -0.1324145 0.0099126), wk = 0.0040984 k( 93) = ( 0.1976744 -0.1250582 0.0093619), wk = 0.0040984 k( 94) = ( 0.1860465 -0.1177018 0.0088112), wk = 0.0040984 k( 95) = ( 0.1744186 -0.1103454 0.0082605), wk = 0.0040984 k( 96) = ( 0.1627907 -0.1029891 0.0077098), wk = 0.0040984 k( 97) = ( 0.1511628 -0.0956327 0.0071591), wk = 0.0040984 k( 98) = ( 0.1395349 -0.0882763 0.0066084), wk = 0.0040984 k( 99) = ( 0.1279070 -0.0809200 0.0060577), wk = 0.0040984 k( 100) = ( 0.1162791 -0.0735636 0.0055070), wk = 0.0040984 k( 101) = ( 0.1046512 -0.0662073 0.0049563), wk = 0.0040984 k( 102) = ( 0.0930233 -0.0588509 0.0044056), wk = 0.0040984 k( 103) = ( 0.0813954 -0.0514945 0.0038549), wk = 0.0040984 k( 104) = ( 0.0697674 -0.0441382 0.0033042), wk = 0.0040984 k( 105) = ( 0.0581395 -0.0367818 0.0027535), wk = 0.0040984 k( 106) = ( 0.0465116 -0.0294255 0.0022028), wk = 0.0040984 k( 107) = ( 0.0348837 -0.0220691 0.0016521), wk = 0.0040984 k( 108) = ( 0.0232558 -0.0147127 0.0011014), wk = 0.0040984 k( 109) = ( 0.0116279 -0.0073564 0.0005507), wk = 0.0040984 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 112) = ( -0.0131579 -0.0016699 0.0037794), wk = 0.0040984 k( 113) = ( -0.0263158 -0.0033399 0.0075588), wk = 0.0040984 k( 114) = ( -0.0394737 -0.0050098 0.0113383), wk = 0.0040984 k( 115) = ( -0.0526316 -0.0066797 0.0151177), wk = 0.0040984 k( 116) = ( -0.0657895 -0.0083496 0.0188971), wk = 0.0040984 k( 117) = ( -0.0789474 -0.0100196 0.0226765), wk = 0.0040984 k( 118) = ( -0.0921053 -0.0116895 0.0264559), wk = 0.0040984 k( 119) = ( -0.1052632 -0.0133594 0.0302354), wk = 0.0040984 k( 120) = ( -0.1184210 -0.0150294 0.0340148), wk = 0.0040984 k( 121) = ( -0.1315790 -0.0166993 0.0377942), wk = 0.0040984 k( 122) = ( -0.1447368 -0.0183692 0.0415736), wk = 0.0040984 k( 123) = ( -0.1578947 -0.0200391 0.0453530), wk = 0.0040984 k( 124) = ( -0.1710526 -0.0217091 0.0491325), wk = 0.0040984 k( 125) = ( -0.1842105 -0.0233790 0.0529119), wk = 0.0040984 k( 126) = ( -0.1973684 -0.0250489 0.0566913), wk = 0.0040984 k( 127) = ( -0.2105263 -0.0267189 0.0604707), wk = 0.0040984 k( 128) = ( -0.2236842 -0.0283888 0.0642501), wk = 0.0040984 k( 129) = ( -0.2368421 -0.0300587 0.0680296), wk = 0.0040984 k( 130) = ( -0.2500000 -0.0317286 0.0718090), wk = 0.0040984 k( 131) = ( -0.2631579 -0.0333986 0.0755884), wk = 0.0040984 k( 132) = ( -0.2763158 -0.0350685 0.0793678), wk = 0.0040984 k( 133) = ( -0.2894737 -0.0367384 0.0831472), wk = 0.0040984 k( 134) = ( -0.3026316 -0.0384084 0.0869266), wk = 0.0040984 k( 135) = ( -0.3157895 -0.0400783 0.0907061), wk = 0.0040984 k( 136) = ( -0.3289474 -0.0417482 0.0944855), wk = 0.0040984 k( 137) = ( -0.3421053 -0.0434181 0.0982649), wk = 0.0040984 k( 138) = ( -0.3552632 -0.0450881 0.1020443), wk = 0.0040984 k( 139) = ( -0.3684211 -0.0467580 0.1058237), wk = 0.0040984 k( 140) = ( -0.3815789 -0.0484279 0.1096032), wk = 0.0040984 k( 141) = ( -0.3947368 -0.0500979 0.1133826), wk = 0.0040984 k( 142) = ( -0.4078947 -0.0517678 0.1171620), wk = 0.0040984 k( 143) = ( -0.4210526 -0.0534377 0.1209414), wk = 0.0040984 k( 144) = ( -0.4342105 -0.0551076 0.1247208), wk = 0.0040984 k( 145) = ( -0.4473684 -0.0567776 0.1285003), wk = 0.0040984 k( 146) = ( -0.4605263 -0.0584475 0.1322797), wk = 0.0040984 k( 147) = ( -0.4736842 -0.0601174 0.1360591), wk = 0.0040984 k( 148) = ( -0.4868421 -0.0617874 0.1398385), wk = 0.0040984 k( 149) = ( -0.5000000 -0.0634573 0.1436179), wk = 0.0040984 k( 150) = ( -0.5000000 -0.4432381 0.1406921), wk = 0.0040984 k( 151) = ( -0.4897959 -0.4341925 0.1378208), wk = 0.0040984 k( 152) = ( -0.4795918 -0.4251468 0.1349496), wk = 0.0040984 k( 153) = ( -0.4693878 -0.4161011 0.1320783), wk = 0.0040984 k( 154) = ( -0.4591837 -0.4070554 0.1292070), wk = 0.0040984 k( 155) = ( -0.4489796 -0.3980098 0.1263358), wk = 0.0040984 k( 156) = ( -0.4387755 -0.3889641 0.1234645), wk = 0.0040984 k( 157) = ( -0.4285714 -0.3799184 0.1205932), wk = 0.0040984 k( 158) = ( -0.4183674 -0.3708727 0.1177220), wk = 0.0040984 k( 159) = ( -0.4081633 -0.3618271 0.1148507), wk = 0.0040984 k( 160) = ( -0.3979592 -0.3527814 0.1119794), wk = 0.0040984 k( 161) = ( -0.3877551 -0.3437357 0.1091082), wk = 0.0040984 k( 162) = ( -0.3775510 -0.3346900 0.1062369), wk = 0.0040984 k( 163) = ( -0.3673469 -0.3256444 0.1033656), wk = 0.0040984 k( 164) = ( -0.3571429 -0.3165987 0.1004944), wk = 0.0040984 k( 165) = ( -0.3469388 -0.3075530 0.0976231), wk = 0.0040984 k( 166) = ( -0.3367347 -0.2985073 0.0947518), wk = 0.0040984 k( 167) = ( -0.3265306 -0.2894616 0.0918806), wk = 0.0040984 k( 168) = ( -0.3163265 -0.2804160 0.0890093), wk = 0.0040984 k( 169) = ( -0.3061224 -0.2713703 0.0861380), wk = 0.0040984 k( 170) = ( -0.2959184 -0.2623246 0.0832668), wk = 0.0040984 k( 171) = ( -0.2857143 -0.2532789 0.0803955), wk = 0.0040984 k( 172) = ( -0.2755102 -0.2442333 0.0775242), wk = 0.0040984 k( 173) = ( -0.2653061 -0.2351876 0.0746530), wk = 0.0040984 k( 174) = ( -0.2551020 -0.2261419 0.0717817), wk = 0.0040984 k( 175) = ( -0.2448980 -0.2170962 0.0689104), wk = 0.0040984 k( 176) = ( -0.2346939 -0.2080506 0.0660392), wk = 0.0040984 k( 177) = ( -0.2244898 -0.1990049 0.0631679), wk = 0.0040984 k( 178) = ( -0.2142857 -0.1899592 0.0602966), wk = 0.0040984 k( 179) = ( -0.2040816 -0.1809135 0.0574254), wk = 0.0040984 k( 180) = ( -0.1938776 -0.1718679 0.0545541), wk = 0.0040984 k( 181) = ( -0.1836735 -0.1628222 0.0516828), wk = 0.0040984 k( 182) = ( -0.1734694 -0.1537765 0.0488116), wk = 0.0040984 k( 183) = ( -0.1632653 -0.1447308 0.0459403), wk = 0.0040984 k( 184) = ( -0.1530612 -0.1356851 0.0430690), wk = 0.0040984 k( 185) = ( -0.1428571 -0.1266395 0.0401977), wk = 0.0040984 k( 186) = ( -0.1326531 -0.1175938 0.0373265), wk = 0.0040984 k( 187) = ( -0.1224490 -0.1085481 0.0344552), wk = 0.0040984 k( 188) = ( -0.1122449 -0.0995024 0.0315839), wk = 0.0040984 k( 189) = ( -0.1020408 -0.0904568 0.0287127), wk = 0.0040984 k( 190) = ( -0.0918367 -0.0814111 0.0258414), wk = 0.0040984 k( 191) = ( -0.0816327 -0.0723654 0.0229701), wk = 0.0040984 k( 192) = ( -0.0714286 -0.0633197 0.0200989), wk = 0.0040984 k( 193) = ( -0.0612245 -0.0542741 0.0172276), wk = 0.0040984 k( 194) = ( -0.0510204 -0.0452284 0.0143563), wk = 0.0040984 k( 195) = ( -0.0408163 -0.0361827 0.0114851), wk = 0.0040984 k( 196) = ( -0.0306122 -0.0271370 0.0086138), wk = 0.0040984 k( 197) = ( -0.0204082 -0.0180914 0.0057425), wk = 0.0040984 k( 198) = ( -0.0102041 -0.0090457 0.0028713), wk = 0.0040984 k( 199) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 201) = ( 0.0000000 0.0000000 0.0130942), wk = 0.0040984 k( 202) = ( 0.0000000 0.0000000 0.0261883), wk = 0.0040984 k( 203) = ( 0.0000000 0.0000000 0.0392825), wk = 0.0040984 k( 204) = ( 0.0000000 0.0000000 0.0523766), wk = 0.0040984 k( 205) = ( 0.0000000 0.0000000 0.0654708), wk = 0.0040984 k( 206) = ( 0.0000000 0.0000000 0.0785649), wk = 0.0040984 k( 207) = ( 0.0000000 0.0000000 0.0916591), wk = 0.0040984 k( 208) = ( 0.0000000 0.0000000 0.1047532), wk = 0.0040984 k( 209) = ( 0.0000000 0.0000000 0.1178474), wk = 0.0040984 k( 210) = ( 0.0000000 0.0000000 0.1309415), wk = 0.0040984 k( 211) = ( 0.0000000 0.0000000 0.1440357), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.1571298), wk = 0.0040984 k( 213) = ( 0.0000000 0.0000000 0.1702240), wk = 0.0040984 k( 214) = ( 0.0000000 -0.3797809 0.1672981), wk = 0.0040984 k( 215) = ( 0.0000000 -0.3671215 0.1617215), wk = 0.0040984 k( 216) = ( 0.0000000 -0.3544621 0.1561449), wk = 0.0040984 k( 217) = ( 0.0000000 -0.3418028 0.1505683), wk = 0.0040984 k( 218) = ( 0.0000000 -0.3291434 0.1449917), wk = 0.0040984 k( 219) = ( 0.0000000 -0.3164841 0.1394151), wk = 0.0040984 k( 220) = ( 0.0000000 -0.3038247 0.1338385), wk = 0.0040984 k( 221) = ( 0.0000000 -0.2911653 0.1282619), wk = 0.0040984 k( 222) = ( 0.0000000 -0.2785060 0.1226853), wk = 0.0040984 k( 223) = ( 0.0000000 -0.2658466 0.1171087), wk = 0.0040984 k( 224) = ( 0.0000000 -0.2531872 0.1115321), wk = 0.0040984 k( 225) = ( 0.0000000 -0.2405279 0.1059555), wk = 0.0040984 k( 226) = ( 0.0000000 -0.2278685 0.1003789), wk = 0.0040984 k( 227) = ( 0.0000000 -0.2152092 0.0948023), wk = 0.0040984 k( 228) = ( 0.0000000 -0.2025498 0.0892257), wk = 0.0040984 k( 229) = ( 0.0000000 -0.1898904 0.0836491), wk = 0.0040984 k( 230) = ( 0.0000000 -0.1772311 0.0780725), wk = 0.0040984 k( 231) = ( 0.0000000 -0.1645717 0.0724959), wk = 0.0040984 k( 232) = ( 0.0000000 -0.1519123 0.0669193), wk = 0.0040984 k( 233) = ( 0.0000000 -0.1392530 0.0613427), wk = 0.0040984 k( 234) = ( 0.0000000 -0.1265936 0.0557661), wk = 0.0040984 k( 235) = ( 0.0000000 -0.1139343 0.0501894), wk = 0.0040984 k( 236) = ( 0.0000000 -0.1012749 0.0446128), wk = 0.0040984 k( 237) = ( 0.0000000 -0.0886155 0.0390362), wk = 0.0040984 k( 238) = ( 0.0000000 -0.0759562 0.0334596), wk = 0.0040984 k( 239) = ( 0.0000000 -0.0632968 0.0278830), wk = 0.0040984 k( 240) = ( 0.0000000 -0.0506375 0.0223064), wk = 0.0040984 k( 241) = ( 0.0000000 -0.0379781 0.0167298), wk = 0.0040984 k( 242) = ( 0.0000000 -0.0253187 0.0111532), wk = 0.0040984 k( 243) = ( 0.0000000 -0.0126594 0.0055766), wk = 0.0040984 k( 244) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 cryst. coord. k( 1) = ( 0.0000000 -0.5000000 -0.0000000), wk = 0.0040984 k( 2) = ( 0.0000000 -0.4821429 0.0000000), wk = 0.0040984 k( 3) = ( 0.0000000 -0.4642857 0.0000000), wk = 0.0040984 k( 4) = ( 0.0000000 -0.4464286 0.0000000), wk = 0.0040984 k( 5) = ( 0.0000000 -0.4285714 -0.0000000), wk = 0.0040984 k( 6) = ( 0.0000000 -0.4107143 -0.0000000), wk = 0.0040984 k( 7) = ( 0.0000000 -0.3928571 -0.0000000), wk = 0.0040984 k( 8) = ( 0.0000000 -0.3750000 -0.0000000), wk = 0.0040984 k( 9) = ( 0.0000000 -0.3571429 0.0000000), wk = 0.0040984 k( 10) = ( 0.0000000 -0.3392857 0.0000000), wk = 0.0040984 k( 11) = ( 0.0000000 -0.3214286 -0.0000000), wk = 0.0040984 k( 12) = ( 0.0000000 -0.3035714 -0.0000000), wk = 0.0040984 k( 13) = ( 0.0000000 -0.2857143 0.0000000), wk = 0.0040984 k( 14) = ( 0.0000000 -0.2678571 -0.0000000), wk = 0.0040984 k( 15) = ( 0.0000000 -0.2500000 -0.0000000), wk = 0.0040984 k( 16) = ( 0.0000000 -0.2321429 0.0000000), wk = 0.0040984 k( 17) = ( 0.0000000 -0.2142857 0.0000000), wk = 0.0040984 k( 18) = ( 0.0000000 -0.1964286 -0.0000000), wk = 0.0040984 k( 19) = ( 0.0000000 -0.1785714 0.0000000), wk = 0.0040984 k( 20) = ( 0.0000000 -0.1607143 0.0000000), wk = 0.0040984 k( 21) = ( 0.0000000 -0.1428571 0.0000000), wk = 0.0040984 k( 22) = ( 0.0000000 -0.1250000 -0.0000000), wk = 0.0040984 k( 23) = ( 0.0000000 -0.1071429 -0.0000000), wk = 0.0040984 k( 24) = ( 0.0000000 -0.0892857 -0.0000000), wk = 0.0040984 k( 25) = ( 0.0000000 -0.0714286 0.0000000), wk = 0.0040984 k( 26) = ( 0.0000000 -0.0535714 -0.0000000), wk = 0.0040984 k( 27) = ( 0.0000000 -0.0357143 0.0000000), wk = 0.0040984 k( 28) = ( 0.0000000 -0.0178571 -0.0000000), wk = 0.0040984 k( 29) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 30) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 31) = ( 0.0138889 -0.0000000 0.0000000), wk = 0.0040984 k( 32) = ( 0.0277778 -0.0000000 0.0000000), wk = 0.0040984 k( 33) = ( 0.0416667 -0.0000000 -0.0000000), wk = 0.0040984 k( 34) = ( 0.0555556 -0.0000000 0.0000000), wk = 0.0040984 k( 35) = ( 0.0694444 -0.0000000 -0.0000000), wk = 0.0040984 k( 36) = ( 0.0833333 -0.0000000 0.0000000), wk = 0.0040984 k( 37) = ( 0.0972222 -0.0000000 0.0000000), wk = 0.0040984 k( 38) = ( 0.1111111 -0.0000000 0.0000000), wk = 0.0040984 k( 39) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0040984 k( 40) = ( 0.1388889 -0.0000000 -0.0000000), wk = 0.0040984 k( 41) = ( 0.1527778 -0.0000000 0.0000000), wk = 0.0040984 k( 42) = ( 0.1666667 -0.0000000 0.0000000), wk = 0.0040984 k( 43) = ( 0.1805556 -0.0000000 -0.0000000), wk = 0.0040984 k( 44) = ( 0.1944444 -0.0000000 0.0000000), wk = 0.0040984 k( 45) = ( 0.2083333 -0.0000000 -0.0000000), wk = 0.0040984 k( 46) = ( 0.2222222 -0.0000000 0.0000000), wk = 0.0040984 k( 47) = ( 0.2361111 -0.0000000 0.0000000), wk = 0.0040984 k( 48) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0040984 k( 49) = ( 0.2638889 -0.0000000 0.0000000), wk = 0.0040984 k( 50) = ( 0.2777778 -0.0000000 -0.0000000), wk = 0.0040984 k( 51) = ( 0.2916667 -0.0000000 -0.0000000), wk = 0.0040984 k( 52) = ( 0.3055556 -0.0000000 0.0000000), wk = 0.0040984 k( 53) = ( 0.3194444 -0.0000000 0.0000000), wk = 0.0040984 k( 54) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0040984 k( 55) = ( 0.3472222 -0.0000000 0.0000000), wk = 0.0040984 k( 56) = ( 0.3611111 -0.0000000 0.0000000), wk = 0.0040984 k( 57) = ( 0.3750000 -0.0000000 0.0000000), wk = 0.0040984 k( 58) = ( 0.3888889 -0.0000000 0.0000000), wk = 0.0040984 k( 59) = ( 0.4027778 -0.0000000 0.0000000), wk = 0.0040984 k( 60) = ( 0.4166667 -0.0000000 -0.0000000), wk = 0.0040984 k( 61) = ( 0.4305556 -0.0000000 0.0000000), wk = 0.0040984 k( 62) = ( 0.4444444 -0.0000000 0.0000000), wk = 0.0040984 k( 63) = ( 0.4583333 -0.0000000 0.0000000), wk = 0.0040984 k( 64) = ( 0.4722222 -0.0000000 0.0000000), wk = 0.0040984 k( 65) = ( 0.4861111 -0.0000000 0.0000000), wk = 0.0040984 k( 66) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0040984 k( 67) = ( 0.5000000 -0.5000000 0.0000000), wk = 0.0040984 k( 68) = ( 0.4883721 -0.4883721 0.0000000), wk = 0.0040984 k( 69) = ( 0.4767442 -0.4767442 0.0000000), wk = 0.0040984 k( 70) = ( 0.4651163 -0.4651163 -0.0000000), wk = 0.0040984 k( 71) = ( 0.4534884 -0.4534884 0.0000000), wk = 0.0040984 k( 72) = ( 0.4418605 -0.4418605 -0.0000000), wk = 0.0040984 k( 73) = ( 0.4302326 -0.4302326 -0.0000000), wk = 0.0040984 k( 74) = ( 0.4186047 -0.4186047 0.0000000), wk = 0.0040984 k( 75) = ( 0.4069767 -0.4069767 0.0000000), wk = 0.0040984 k( 76) = ( 0.3953488 -0.3953488 0.0000000), wk = 0.0040984 k( 77) = ( 0.3837209 -0.3837209 0.0000000), wk = 0.0040984 k( 78) = ( 0.3720930 -0.3720930 -0.0000000), wk = 0.0040984 k( 79) = ( 0.3604651 -0.3604651 -0.0000000), wk = 0.0040984 k( 80) = ( 0.3488372 -0.3488372 -0.0000000), wk = 0.0040984 k( 81) = ( 0.3372093 -0.3372093 0.0000000), wk = 0.0040984 k( 82) = ( 0.3255814 -0.3255814 0.0000000), wk = 0.0040984 k( 83) = ( 0.3139535 -0.3139535 0.0000000), wk = 0.0040984 k( 84) = ( 0.3023256 -0.3023256 -0.0000000), wk = 0.0040984 k( 85) = ( 0.2906977 -0.2906977 0.0000000), wk = 0.0040984 k( 86) = ( 0.2790698 -0.2790698 0.0000000), wk = 0.0040984 k( 87) = ( 0.2674419 -0.2674419 -0.0000000), wk = 0.0040984 k( 88) = ( 0.2558140 -0.2558140 0.0000000), wk = 0.0040984 k( 89) = ( 0.2441860 -0.2441861 0.0000000), wk = 0.0040984 k( 90) = ( 0.2325581 -0.2325581 -0.0000000), wk = 0.0040984 k( 91) = ( 0.2209302 -0.2209302 0.0000000), wk = 0.0040984 k( 92) = ( 0.2093023 -0.2093023 -0.0000000), wk = 0.0040984 k( 93) = ( 0.1976744 -0.1976744 0.0000000), wk = 0.0040984 k( 94) = ( 0.1860465 -0.1860465 -0.0000000), wk = 0.0040984 k( 95) = ( 0.1744186 -0.1744186 0.0000000), wk = 0.0040984 k( 96) = ( 0.1627907 -0.1627907 0.0000000), wk = 0.0040984 k( 97) = ( 0.1511628 -0.1511628 -0.0000000), wk = 0.0040984 k( 98) = ( 0.1395349 -0.1395349 -0.0000000), wk = 0.0040984 k( 99) = ( 0.1279070 -0.1279070 0.0000000), wk = 0.0040984 k( 100) = ( 0.1162791 -0.1162791 -0.0000000), wk = 0.0040984 k( 101) = ( 0.1046512 -0.1046512 -0.0000000), wk = 0.0040984 k( 102) = ( 0.0930233 -0.0930233 -0.0000000), wk = 0.0040984 k( 103) = ( 0.0813954 -0.0813954 0.0000000), wk = 0.0040984 k( 104) = ( 0.0697674 -0.0697674 -0.0000000), wk = 0.0040984 k( 105) = ( 0.0581395 -0.0581395 0.0000000), wk = 0.0040984 k( 106) = ( 0.0465116 -0.0465116 -0.0000000), wk = 0.0040984 k( 107) = ( 0.0348837 -0.0348837 -0.0000000), wk = 0.0040984 k( 108) = ( 0.0232558 -0.0232558 0.0000000), wk = 0.0040984 k( 109) = ( 0.0116279 -0.0116279 0.0000000), wk = 0.0040984 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 112) = ( -0.0131579 0.0000000 0.0131579), wk = 0.0040984 k( 113) = ( -0.0263158 0.0000000 0.0263158), wk = 0.0040984 k( 114) = ( -0.0394737 0.0000000 0.0394737), wk = 0.0040984 k( 115) = ( -0.0526316 0.0000000 0.0526316), wk = 0.0040984 k( 116) = ( -0.0657895 0.0000000 0.0657895), wk = 0.0040984 k( 117) = ( -0.0789474 0.0000000 0.0789474), wk = 0.0040984 k( 118) = ( -0.0921053 0.0000000 0.0921053), wk = 0.0040984 k( 119) = ( -0.1052632 0.0000000 0.1052632), wk = 0.0040984 k( 120) = ( -0.1184210 0.0000000 0.1184211), wk = 0.0040984 k( 121) = ( -0.1315790 0.0000000 0.1315790), wk = 0.0040984 k( 122) = ( -0.1447368 0.0000000 0.1447368), wk = 0.0040984 k( 123) = ( -0.1578947 0.0000000 0.1578947), wk = 0.0040984 k( 124) = ( -0.1710526 0.0000000 0.1710526), wk = 0.0040984 k( 125) = ( -0.1842105 0.0000000 0.1842105), wk = 0.0040984 k( 126) = ( -0.1973684 0.0000000 0.1973684), wk = 0.0040984 k( 127) = ( -0.2105263 0.0000000 0.2105263), wk = 0.0040984 k( 128) = ( -0.2236842 0.0000000 0.2236842), wk = 0.0040984 k( 129) = ( -0.2368421 0.0000000 0.2368421), wk = 0.0040984 k( 130) = ( -0.2500000 0.0000000 0.2500000), wk = 0.0040984 k( 131) = ( -0.2631579 0.0000000 0.2631579), wk = 0.0040984 k( 132) = ( -0.2763158 0.0000000 0.2763158), wk = 0.0040984 k( 133) = ( -0.2894737 0.0000000 0.2894737), wk = 0.0040984 k( 134) = ( -0.3026316 0.0000000 0.3026316), wk = 0.0040984 k( 135) = ( -0.3157895 0.0000000 0.3157895), wk = 0.0040984 k( 136) = ( -0.3289474 0.0000000 0.3289474), wk = 0.0040984 k( 137) = ( -0.3421053 0.0000000 0.3421053), wk = 0.0040984 k( 138) = ( -0.3552632 0.0000000 0.3552632), wk = 0.0040984 k( 139) = ( -0.3684211 0.0000000 0.3684211), wk = 0.0040984 k( 140) = ( -0.3815789 0.0000000 0.3815789), wk = 0.0040984 k( 141) = ( -0.3947368 0.0000000 0.3947368), wk = 0.0040984 k( 142) = ( -0.4078947 0.0000000 0.4078947), wk = 0.0040984 k( 143) = ( -0.4210526 0.0000000 0.4210526), wk = 0.0040984 k( 144) = ( -0.4342105 0.0000000 0.4342105), wk = 0.0040984 k( 145) = ( -0.4473684 0.0000000 0.4473684), wk = 0.0040984 k( 146) = ( -0.4605263 0.0000000 0.4605263), wk = 0.0040984 k( 147) = ( -0.4736842 0.0000000 0.4736842), wk = 0.0040984 k( 148) = ( -0.4868421 0.0000000 0.4868421), wk = 0.0040984 k( 149) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0040984 k( 150) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0040984 k( 151) = ( -0.4897959 -0.4897959 0.4897959), wk = 0.0040984 k( 152) = ( -0.4795918 -0.4795918 0.4795918), wk = 0.0040984 k( 153) = ( -0.4693878 -0.4693878 0.4693878), wk = 0.0040984 k( 154) = ( -0.4591837 -0.4591837 0.4591837), wk = 0.0040984 k( 155) = ( -0.4489796 -0.4489796 0.4489796), wk = 0.0040984 k( 156) = ( -0.4387755 -0.4387755 0.4387755), wk = 0.0040984 k( 157) = ( -0.4285714 -0.4285714 0.4285714), wk = 0.0040984 k( 158) = ( -0.4183674 -0.4183673 0.4183674), wk = 0.0040984 k( 159) = ( -0.4081633 -0.4081633 0.4081633), wk = 0.0040984 k( 160) = ( -0.3979592 -0.3979592 0.3979592), wk = 0.0040984 k( 161) = ( -0.3877551 -0.3877551 0.3877551), wk = 0.0040984 k( 162) = ( -0.3775510 -0.3775510 0.3775510), wk = 0.0040984 k( 163) = ( -0.3673469 -0.3673469 0.3673469), wk = 0.0040984 k( 164) = ( -0.3571429 -0.3571429 0.3571429), wk = 0.0040984 k( 165) = ( -0.3469388 -0.3469388 0.3469388), wk = 0.0040984 k( 166) = ( -0.3367347 -0.3367347 0.3367347), wk = 0.0040984 k( 167) = ( -0.3265306 -0.3265306 0.3265306), wk = 0.0040984 k( 168) = ( -0.3163265 -0.3163265 0.3163265), wk = 0.0040984 k( 169) = ( -0.3061224 -0.3061224 0.3061224), wk = 0.0040984 k( 170) = ( -0.2959184 -0.2959184 0.2959184), wk = 0.0040984 k( 171) = ( -0.2857143 -0.2857143 0.2857143), wk = 0.0040984 k( 172) = ( -0.2755102 -0.2755102 0.2755102), wk = 0.0040984 k( 173) = ( -0.2653061 -0.2653061 0.2653061), wk = 0.0040984 k( 174) = ( -0.2551020 -0.2551020 0.2551020), wk = 0.0040984 k( 175) = ( -0.2448980 -0.2448980 0.2448980), wk = 0.0040984 k( 176) = ( -0.2346939 -0.2346939 0.2346939), wk = 0.0040984 k( 177) = ( -0.2244898 -0.2244898 0.2244898), wk = 0.0040984 k( 178) = ( -0.2142857 -0.2142857 0.2142857), wk = 0.0040984 k( 179) = ( -0.2040816 -0.2040816 0.2040816), wk = 0.0040984 k( 180) = ( -0.1938776 -0.1938776 0.1938776), wk = 0.0040984 k( 181) = ( -0.1836735 -0.1836735 0.1836735), wk = 0.0040984 k( 182) = ( -0.1734694 -0.1734694 0.1734694), wk = 0.0040984 k( 183) = ( -0.1632653 -0.1632653 0.1632653), wk = 0.0040984 k( 184) = ( -0.1530612 -0.1530612 0.1530612), wk = 0.0040984 k( 185) = ( -0.1428571 -0.1428571 0.1428571), wk = 0.0040984 k( 186) = ( -0.1326531 -0.1326531 0.1326531), wk = 0.0040984 k( 187) = ( -0.1224490 -0.1224490 0.1224490), wk = 0.0040984 k( 188) = ( -0.1122449 -0.1122449 0.1122449), wk = 0.0040984 k( 189) = ( -0.1020408 -0.1020408 0.1020408), wk = 0.0040984 k( 190) = ( -0.0918367 -0.0918367 0.0918367), wk = 0.0040984 k( 191) = ( -0.0816327 -0.0816326 0.0816327), wk = 0.0040984 k( 192) = ( -0.0714286 -0.0714286 0.0714286), wk = 0.0040984 k( 193) = ( -0.0612245 -0.0612245 0.0612245), wk = 0.0040984 k( 194) = ( -0.0510204 -0.0510204 0.0510204), wk = 0.0040984 k( 195) = ( -0.0408163 -0.0408163 0.0408163), wk = 0.0040984 k( 196) = ( -0.0306122 -0.0306122 0.0306122), wk = 0.0040984 k( 197) = ( -0.0204082 -0.0204082 0.0204082), wk = 0.0040984 k( 198) = ( -0.0102041 -0.0102041 0.0102041), wk = 0.0040984 k( 199) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 200) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 201) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0040984 k( 202) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0040984 k( 203) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0040984 k( 204) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0040984 k( 205) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0040984 k( 206) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0040984 k( 207) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0040984 k( 208) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0040984 k( 209) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0040984 k( 210) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0040984 k( 211) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0040984 k( 213) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040984 k( 214) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0040984 k( 215) = ( 0.0000000 -0.4833333 0.4833333), wk = 0.0040984 k( 216) = ( 0.0000000 -0.4666667 0.4666667), wk = 0.0040984 k( 217) = ( 0.0000000 -0.4500000 0.4500000), wk = 0.0040984 k( 218) = ( 0.0000000 -0.4333333 0.4333333), wk = 0.0040984 k( 219) = ( 0.0000000 -0.4166667 0.4166667), wk = 0.0040984 k( 220) = ( 0.0000000 -0.4000000 0.4000000), wk = 0.0040984 k( 221) = ( 0.0000000 -0.3833333 0.3833333), wk = 0.0040984 k( 222) = ( 0.0000000 -0.3666667 0.3666667), wk = 0.0040984 k( 223) = ( 0.0000000 -0.3500000 0.3500000), wk = 0.0040984 k( 224) = ( 0.0000000 -0.3333333 0.3333333), wk = 0.0040984 k( 225) = ( 0.0000000 -0.3166667 0.3166667), wk = 0.0040984 k( 226) = ( 0.0000000 -0.3000000 0.3000000), wk = 0.0040984 k( 227) = ( 0.0000000 -0.2833333 0.2833333), wk = 0.0040984 k( 228) = ( 0.0000000 -0.2666667 0.2666667), wk = 0.0040984 k( 229) = ( 0.0000000 -0.2500000 0.2500000), wk = 0.0040984 k( 230) = ( 0.0000000 -0.2333333 0.2333333), wk = 0.0040984 k( 231) = ( 0.0000000 -0.2166667 0.2166667), wk = 0.0040984 k( 232) = ( 0.0000000 -0.2000000 0.2000000), wk = 0.0040984 k( 233) = ( 0.0000000 -0.1833333 0.1833333), wk = 0.0040984 k( 234) = ( 0.0000000 -0.1666667 0.1666667), wk = 0.0040984 k( 235) = ( 0.0000000 -0.1500000 0.1500000), wk = 0.0040984 k( 236) = ( 0.0000000 -0.1333333 0.1333333), wk = 0.0040984 k( 237) = ( 0.0000000 -0.1166667 0.1166667), wk = 0.0040984 k( 238) = ( 0.0000000 -0.1000000 0.1000000), wk = 0.0040984 k( 239) = ( 0.0000000 -0.0833333 0.0833333), wk = 0.0040984 k( 240) = ( 0.0000000 -0.0666667 0.0666667), wk = 0.0040984 k( 241) = ( 0.0000000 -0.0500000 0.0500000), wk = 0.0040984 k( 242) = ( 0.0000000 -0.0333333 0.0333333), wk = 0.0040984 k( 243) = ( 0.0000000 -0.0166667 0.0166667), wk = 0.0040984 k( 244) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 Dense grid: 223007 G-vectors FFT dimensions: ( 48, 64, 144) Smooth grid: 94081 G-vectors FFT dimensions: ( 36, 48, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.44 Mb ( 352, 82) NL pseudopotentials 0.71 Mb ( 176, 264) Each V/rho on FFT grid 0.09 Mb ( 6144) Each G-vector array 0.02 Mb ( 3104) G-vector shells 0.02 Mb ( 3034) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.76 Mb ( 352, 328) Each subspace H/S matrix 0.04 Mb ( 54, 54) Each matrix 0.66 Mb ( 264, 2, 82) Check: negative/imaginary core charge= -0.000004 0.000000 The potential is recalculated from file : ./H2C2I.save/charge-density.dat Starting wfc are 112 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.3 secs Computing kpt #: 2 total cpu time spent up to now is 4.7 secs Computing kpt #: 3 total cpu time spent up to now is 6.0 secs Computing kpt #: 4 total cpu time spent up to now is 7.4 secs Computing kpt #: 5 total cpu time spent up to now is 8.7 secs Computing kpt #: 6 total cpu time spent up to now is 10.1 secs Computing kpt #: 7 total cpu time spent up to now is 11.5 secs Computing kpt #: 8 total cpu time spent up to now is 12.8 secs Computing kpt #: 9 total cpu time spent up to now is 14.2 secs Computing kpt #: 10 total cpu time spent up to now is 15.8 secs Computing kpt #: 11 total cpu time spent up to now is 17.4 secs Computing kpt #: 12 total cpu time spent up to now is 18.8 secs Computing kpt #: 13 total cpu time spent up to now is 20.3 secs Computing kpt #: 14 total cpu time spent up to now is 21.9 secs Computing kpt #: 15 total cpu time spent up to now is 23.4 secs Computing kpt #: 16 total cpu time spent up to now is 25.0 secs Computing kpt #: 17 total cpu time spent up to now is 26.5 secs Computing kpt #: 18 total cpu time spent up to now is 28.1 secs Computing kpt #: 19 total cpu time spent up to now is 29.6 secs Computing kpt #: 20 total cpu time spent up to now is 31.2 secs Computing kpt #: 21 total cpu time spent up to now is 32.8 secs Computing kpt #: 22 total cpu time spent up to now is 34.3 secs Computing kpt #: 23 total cpu time spent up to now is 35.8 secs Computing kpt #: 24 total cpu time spent up to now is 37.4 secs Computing kpt #: 25 total cpu time spent up to now is 38.9 secs Computing kpt #: 26 total cpu time spent up to now is 40.4 secs Computing kpt #: 27 total cpu time spent up to now is 41.9 secs Computing kpt #: 28 total cpu time spent up to now is 43.5 secs Computing kpt #: 29 total cpu time spent up to now is 44.8 secs Computing kpt #: 30 total cpu time spent up to now is 46.3 secs Computing kpt #: 31 total cpu time spent up to now is 47.9 secs Computing kpt #: 32 total cpu time spent up to now is 49.4 secs Computing kpt #: 33 total cpu time spent up to now is 50.9 secs Computing kpt #: 34 total cpu time spent up to now is 52.5 secs Computing kpt #: 35 total cpu time spent up to now is 54.0 secs Computing kpt #: 36 total cpu time spent up to now is 55.5 secs Computing kpt #: 37 total cpu time spent up to now is 57.1 secs Computing kpt #: 38 total cpu time spent up to now is 58.8 secs Computing kpt #: 39 total cpu time spent up to now is 60.4 secs Computing kpt #: 40 total cpu time spent up to now is 61.9 secs Computing kpt #: 41 total cpu time spent up to now is 63.4 secs Computing kpt #: 42 total cpu time spent up to now is 65.0 secs Computing kpt #: 43 total cpu time spent up to now is 66.5 secs Computing kpt #: 44 total cpu time spent up to now is 68.0 secs Computing kpt #: 45 total cpu time spent up to now is 69.4 secs Computing kpt #: 46 total cpu time spent up to now is 70.9 secs Computing kpt #: 47 total cpu time spent up to now is 72.4 secs Computing kpt #: 48 total cpu time spent up to now is 74.0 secs Computing kpt #: 49 total cpu time spent up to now is 75.5 secs Computing kpt #: 50 total cpu time spent up to now is 77.0 secs Computing kpt #: 51 total cpu time spent up to now is 78.5 secs Computing kpt #: 52 total cpu time spent up to now is 80.1 secs Computing kpt #: 53 total cpu time spent up to now is 81.4 secs Computing kpt #: 54 total cpu time spent up to now is 82.8 secs Computing kpt #: 55 total cpu time spent up to now is 84.3 secs Computing kpt #: 56 total cpu time spent up to now is 85.7 secs Computing kpt #: 57 total cpu time spent up to now is 87.0 secs Computing kpt #: 58 total cpu time spent up to now is 88.4 secs Computing kpt #: 59 total cpu time spent up to now is 89.7 secs Computing kpt #: 60 total cpu time spent up to now is 91.0 secs Computing kpt #: 61 total cpu time spent up to now is 92.4 secs Computing kpt #: 62 total cpu time spent up to now is 93.7 secs Computing kpt #: 63 total cpu time spent up to now is 95.0 secs Computing kpt #: 64 total cpu time spent up to now is 96.4 secs Computing kpt #: 65 total cpu time spent up to now is 97.7 secs Computing kpt #: 66 total cpu time spent up to now is 99.0 secs Computing kpt #: 67 total cpu time spent up to now is 100.3 secs Computing kpt #: 68 total cpu time spent up to now is 101.6 secs Computing kpt #: 69 total cpu time spent up to now is 102.8 secs Computing kpt #: 70 total cpu time spent up to now is 104.1 secs Computing kpt #: 71 total cpu time spent up to now is 105.4 secs Computing kpt #: 72 total cpu time spent up to now is 106.7 secs Computing kpt #: 73 total cpu time spent up to now is 107.9 secs Computing kpt #: 74 total cpu time spent up to now is 109.2 secs Computing kpt #: 75 total cpu time spent up to now is 110.5 secs Computing kpt #: 76 total cpu time spent up to now is 111.8 secs Computing kpt #: 77 total cpu time spent up to now is 113.1 secs Computing kpt #: 78 total cpu time spent up to now is 114.4 secs Computing kpt #: 79 total cpu time spent up to now is 115.7 secs Computing kpt #: 80 total cpu time spent up to now is 116.9 secs Computing kpt #: 81 total cpu time spent up to now is 118.2 secs Computing kpt #: 82 total cpu time spent up to now is 119.5 secs Computing kpt #: 83 total cpu time spent up to now is 120.8 secs Computing kpt #: 84 total cpu time spent up to now is 122.1 secs Computing kpt #: 85 total cpu time spent up to now is 123.4 secs Computing kpt #: 86 total cpu time spent up to now is 124.7 secs Computing kpt #: 87 total cpu time spent up to now is 126.0 secs Computing kpt #: 88 total cpu time spent up to now is 127.4 secs Computing kpt #: 89 total cpu time spent up to now is 128.7 secs Computing kpt #: 90 total cpu time spent up to now is 130.1 secs Computing kpt #: 91 total cpu time spent up to now is 131.4 secs Computing kpt #: 92 total cpu time spent up to now is 132.8 secs Computing kpt #: 93 total cpu time spent up to now is 134.1 secs Computing kpt #: 94 total cpu time spent up to now is 135.5 secs Computing kpt #: 95 total cpu time spent up to now is 136.9 secs Computing kpt #: 96 total cpu time spent up to now is 138.2 secs Computing kpt #: 97 total cpu time spent up to now is 139.8 secs Computing kpt #: 98 total cpu time spent up to now is 141.3 secs Computing kpt #: 99 total cpu time spent up to now is 142.8 secs Computing kpt #: 100 total cpu time spent up to now is 144.4 secs Computing kpt #: 101 total cpu time spent up to now is 145.9 secs Computing kpt #: 102 total cpu time spent up to now is 147.4 secs Computing kpt #: 103 total cpu time spent up to now is 148.9 secs Computing kpt #: 104 total cpu time spent up to now is 150.5 secs Computing kpt #: 105 total cpu time spent up to now is 152.1 secs Computing kpt #: 106 total cpu time spent up to now is 153.6 secs Computing kpt #: 107 total cpu time spent up to now is 155.1 secs Computing kpt #: 108 total cpu time spent up to now is 156.6 secs Computing kpt #: 109 total cpu time spent up to now is 158.2 secs Computing kpt #: 110 total cpu time spent up to now is 159.7 secs Computing kpt #: 111 total cpu time spent up to now is 161.2 secs Computing kpt #: 112 total cpu time spent up to now is 162.6 secs Computing kpt #: 113 total cpu time spent up to now is 163.9 secs Computing kpt #: 114 total cpu time spent up to now is 165.4 secs Computing kpt #: 115 total cpu time spent up to now is 167.0 secs Computing kpt #: 116 total cpu time spent up to now is 168.5 secs Computing kpt #: 117 total cpu time spent up to now is 170.1 secs Computing kpt #: 118 total cpu time spent up to now is 171.6 secs Computing kpt #: 119 total cpu time spent up to now is 173.1 secs Computing kpt #: 120 total cpu time spent up to now is 174.7 secs Computing kpt #: 121 total cpu time spent up to now is 176.2 secs Computing kpt #: 122 total cpu time spent up to now is 177.7 secs Computing kpt #: 123 total cpu time spent up to now is 179.2 secs Computing kpt #: 124 total cpu time spent up to now is 180.8 secs Computing kpt #: 125 total cpu time spent up to now is 182.3 secs Computing kpt #: 126 total cpu time spent up to now is 183.8 secs Computing kpt #: 127 total cpu time spent up to now is 185.4 secs Computing kpt #: 128 total cpu time spent up to now is 186.9 secs Computing kpt #: 129 total cpu time spent up to now is 188.4 secs Computing kpt #: 130 total cpu time spent up to now is 190.0 secs Computing kpt #: 131 total cpu time spent up to now is 191.5 secs Computing kpt #: 132 total cpu time spent up to now is 193.1 secs Computing kpt #: 133 total cpu time spent up to now is 194.6 secs Computing kpt #: 134 total cpu time spent up to now is 196.1 secs Computing kpt #: 135 total cpu time spent up to now is 197.7 secs Computing kpt #: 136 total cpu time spent up to now is 199.0 secs Computing kpt #: 137 total cpu time spent up to now is 200.5 secs Computing kpt #: 138 total cpu time spent up to now is 201.9 secs Computing kpt #: 139 total cpu time spent up to now is 203.4 secs Computing kpt #: 140 total cpu time spent up to now is 204.9 secs Computing kpt #: 141 total cpu time spent up to now is 206.5 secs Computing kpt #: 142 total cpu time spent up to now is 208.3 secs Computing kpt #: 143 total cpu time spent up to now is 209.9 secs Computing kpt #: 144 total cpu time spent up to now is 211.2 secs Computing kpt #: 145 total cpu time spent up to now is 212.7 secs Computing kpt #: 146 total cpu time spent up to now is 214.2 secs Computing kpt #: 147 total cpu time spent up to now is 215.7 secs Computing kpt #: 148 total cpu time spent up to now is 217.3 secs Computing kpt #: 149 total cpu time spent up to now is 218.8 secs Computing kpt #: 150 total cpu time spent up to now is 220.1 secs Computing kpt #: 151 total cpu time spent up to now is 221.4 secs Computing kpt #: 152 total cpu time spent up to now is 222.7 secs Computing kpt #: 153 total cpu time spent up to now is 224.0 secs Computing kpt #: 154 total cpu time spent up to now is 225.3 secs Computing kpt #: 155 total cpu time spent up to now is 226.6 secs Computing kpt #: 156 total cpu time spent up to now is 227.9 secs Computing kpt #: 157 total cpu time spent up to now is 229.2 secs Computing kpt #: 158 total cpu time spent up to now is 230.5 secs Computing kpt #: 159 total cpu time spent up to now is 231.8 secs Computing kpt #: 160 total cpu time spent up to now is 233.1 secs Computing kpt #: 161 total cpu time spent up to now is 234.4 secs Computing kpt #: 162 total cpu time spent up to now is 235.8 secs Computing kpt #: 163 total cpu time spent up to now is 237.1 secs Computing kpt #: 164 total cpu time spent up to now is 238.5 secs Computing kpt #: 165 total cpu time spent up to now is 240.0 secs Computing kpt #: 166 total cpu time spent up to now is 241.6 secs Computing kpt #: 167 total cpu time spent up to now is 243.2 secs Computing kpt #: 168 total cpu time spent up to now is 244.7 secs Computing kpt #: 169 total cpu time spent up to now is 246.3 secs Computing kpt #: 170 total cpu time spent up to now is 247.8 secs Computing kpt #: 171 total cpu time spent up to now is 249.2 secs Computing kpt #: 172 total cpu time spent up to now is 250.5 secs Computing kpt #: 173 total cpu time spent up to now is 251.9 secs Computing kpt #: 174 total cpu time spent up to now is 253.2 secs Computing kpt #: 175 total cpu time spent up to now is 254.5 secs Computing kpt #: 176 total cpu time spent up to now is 255.9 secs Computing kpt #: 177 total cpu time spent up to now is 257.3 secs Computing kpt #: 178 total cpu time spent up to now is 258.6 secs Computing kpt #: 179 total cpu time spent up to now is 260.0 secs Computing kpt #: 180 total cpu time spent up to now is 261.3 secs Computing kpt #: 181 total cpu time spent up to now is 262.6 secs Computing kpt #: 182 total cpu time spent up to now is 264.0 secs Computing kpt #: 183 total cpu time spent up to now is 265.3 secs Computing kpt #: 184 total cpu time spent up to now is 266.7 secs Computing kpt #: 185 total cpu time spent up to now is 268.1 secs Computing kpt #: 186 total cpu time spent up to now is 269.4 secs Computing kpt #: 187 total cpu time spent up to now is 270.8 secs Computing kpt #: 188 total cpu time spent up to now is 272.1 secs Computing kpt #: 189 total cpu time spent up to now is 273.5 secs Computing kpt #: 190 total cpu time spent up to now is 275.0 secs Computing kpt #: 191 total cpu time spent up to now is 276.6 secs Computing kpt #: 192 total cpu time spent up to now is 278.1 secs Computing kpt #: 193 total cpu time spent up to now is 279.7 secs Computing kpt #: 194 total cpu time spent up to now is 281.2 secs Computing kpt #: 195 total cpu time spent up to now is 282.8 secs Computing kpt #: 196 total cpu time spent up to now is 284.3 secs Computing kpt #: 197 total cpu time spent up to now is 285.9 secs Computing kpt #: 198 total cpu time spent up to now is 287.4 secs Computing kpt #: 199 total cpu time spent up to now is 288.9 secs Computing kpt #: 200 total cpu time spent up to now is 290.5 secs Computing kpt #: 201 total cpu time spent up to now is 292.0 secs Computing kpt #: 202 total cpu time spent up to now is 293.6 secs Computing kpt #: 203 total cpu time spent up to now is 295.1 secs Computing kpt #: 204 total cpu time spent up to now is 296.7 secs Computing kpt #: 205 total cpu time spent up to now is 298.2 secs Computing kpt #: 206 total cpu time spent up to now is 299.8 secs Computing kpt #: 207 total cpu time spent up to now is 301.3 secs Computing kpt #: 208 total cpu time spent up to now is 302.8 secs Computing kpt #: 209 total cpu time spent up to now is 304.4 secs Computing kpt #: 210 total cpu time spent up to now is 306.0 secs Computing kpt #: 211 total cpu time spent up to now is 307.5 secs Computing kpt #: 212 total cpu time spent up to now is 309.1 secs Computing kpt #: 213 total cpu time spent up to now is 310.7 secs Computing kpt #: 214 total cpu time spent up to now is 312.1 secs Computing kpt #: 215 total cpu time spent up to now is 313.4 secs Computing kpt #: 216 total cpu time spent up to now is 314.7 secs Computing kpt #: 217 total cpu time spent up to now is 316.1 secs Computing kpt #: 218 total cpu time spent up to now is 317.4 secs Computing kpt #: 219 total cpu time spent up to now is 318.8 secs Computing kpt #: 220 total cpu time spent up to now is 320.1 secs Computing kpt #: 221 total cpu time spent up to now is 321.5 secs Computing kpt #: 222 total cpu time spent up to now is 322.9 secs Computing kpt #: 223 total cpu time spent up to now is 324.3 secs Computing kpt #: 224 total cpu time spent up to now is 325.7 secs Computing kpt #: 225 total cpu time spent up to now is 327.0 secs Computing kpt #: 226 total cpu time spent up to now is 328.4 secs Computing kpt #: 227 total cpu time spent up to now is 329.8 secs Computing kpt #: 228 total cpu time spent up to now is 331.3 secs Computing kpt #: 229 total cpu time spent up to now is 332.9 secs Computing kpt #: 230 total cpu time spent up to now is 334.4 secs Computing kpt #: 231 total cpu time spent up to now is 336.0 secs Computing kpt #: 232 total cpu time spent up to now is 337.5 secs Computing kpt #: 233 total cpu time spent up to now is 339.1 secs Computing kpt #: 234 total cpu time spent up to now is 340.7 secs Computing kpt #: 235 total cpu time spent up to now is 342.2 secs Computing kpt #: 236 total cpu time spent up to now is 343.8 secs Computing kpt #: 237 total cpu time spent up to now is 345.3 secs Computing kpt #: 238 total cpu time spent up to now is 346.8 secs Computing kpt #: 239 total cpu time spent up to now is 348.4 secs Computing kpt #: 240 total cpu time spent up to now is 349.9 secs Computing kpt #: 241 total cpu time spent up to now is 351.5 secs Computing kpt #: 242 total cpu time spent up to now is 353.0 secs Computing kpt #: 243 total cpu time spent up to now is 354.5 secs Computing kpt #: 244 total cpu time spent up to now is 356.0 secs ethr = 1.47E-08, avg # of iterations = 20.3 total cpu time spent up to now is 356.0 secs End of band structure calculation k = 0.0000-0.3798-0.0029 ( 11772 PWs) bands (ev): -14.0720 -14.0720 -13.9673 -13.9673 -12.6410 -12.6410 -12.5953 -12.5953 -10.8913 -10.8913 -10.8649 -10.8649 -9.9305 -9.9305 -9.8790 -9.8790 -8.2004 -8.2004 -8.0625 -8.0625 -7.8661 -7.8661 -7.8656 -7.8656 -5.1772 -5.1772 -5.1224 -5.1224 -4.5163 -4.5163 -4.5138 -4.5138 -3.1764 -3.1764 -3.0909 -3.0909 -2.6411 -2.6411 -2.5658 -2.5658 -1.8379 -1.8379 -1.7754 -1.7754 -1.4805 -1.4805 -1.4577 -1.4577 -0.4107 -0.4107 -0.3744 -0.3744 0.1521 0.1521 0.3457 0.3457 0.7035 0.7035 0.7525 0.7525 0.9758 0.9758 1.0648 1.0648 1.5124 1.5124 1.5690 1.5690 4.4044 4.4044 4.5536 4.5536 5.2156 5.2156 5.3305 5.3305 5.7305 5.7305 5.7809 5.7809 6.5098 6.5098 k = 0.0000-0.3662-0.0028 ( 11771 PWs) bands (ev): -14.0721 -14.0721 -13.9675 -13.9675 -12.6408 -12.6408 -12.5950 -12.5950 -10.8931 -10.8931 -10.8632 -10.8632 -9.9309 -9.9309 -9.8786 -9.8786 -8.2002 -8.2002 -8.0623 -8.0623 -7.8687 -7.8687 -7.8628 -7.8628 -5.1774 -5.1774 -5.1226 -5.1226 -4.5172 -4.5172 -4.5125 -4.5125 -3.1762 -3.1762 -3.0908 -3.0908 -2.6411 -2.6411 -2.5659 -2.5659 -1.8387 -1.8387 -1.7737 -1.7737 -1.4832 -1.4832 -1.4563 -1.4563 -0.4128 -0.4128 -0.3735 -0.3735 0.1517 0.1517 0.3449 0.3449 0.7010 0.7010 0.7535 0.7535 0.9757 0.9757 1.0650 1.0650 1.5121 1.5121 1.5701 1.5701 4.4054 4.4054 4.5545 4.5545 5.2151 5.2151 5.3326 5.3326 5.7295 5.7295 5.7816 5.7816 6.5107 6.5107 k = 0.0000-0.3527-0.0027 ( 11774 PWs) bands (ev): -14.0725 -14.0725 -13.9682 -13.9682 -12.6399 -12.6399 -12.5944 -12.5944 -10.8977 -10.8977 -10.8589 -10.8589 -9.9321 -9.9321 -9.8777 -9.8777 -8.1998 -8.1998 -8.0616 -8.0616 -7.8714 -7.8714 -7.8597 -7.8597 -5.1782 -5.1782 -5.1230 -5.1230 -4.5186 -4.5186 -4.5100 -4.5100 -3.1758 -3.1758 -3.0904 -3.0904 -2.6410 -2.6410 -2.5662 -2.5662 -1.8407 -1.8407 -1.7687 -1.7687 -1.4900 -1.4900 -1.4536 -1.4536 -0.4186 -0.4186 -0.3714 -0.3714 0.1505 0.1505 0.3423 0.3423 0.6940 0.6940 0.7561 0.7561 0.9753 0.9753 1.0654 1.0654 1.5114 1.5114 1.5731 1.5731 4.4084 4.4084 4.5574 4.5574 5.2138 5.2138 5.3388 5.3388 5.7270 5.7270 5.7834 5.7834 6.5135 6.5135 k = 0.0000-0.3391-0.0026 ( 11768 PWs) bands (ev): -14.0730 -14.0730 -13.9692 -13.9692 -12.6386 -12.6386 -12.5933 -12.5933 -10.9035 -10.9035 -10.8535 -10.8535 -9.9340 -9.9340 -9.8763 -9.8763 -8.1991 -8.1991 -8.0606 -8.0606 -7.8737 -7.8737 -7.8566 -7.8566 -5.1794 -5.1794 -5.1237 -5.1237 -4.5197 -4.5197 -4.5070 -4.5070 -3.1751 -3.1751 -3.0899 -3.0899 -2.6409 -2.6409 -2.5667 -2.5667 -1.8433 -1.8433 -1.7612 -1.7612 -1.4990 -1.4990 -1.4511 -1.4511 -0.4270 -0.4270 -0.3690 -0.3690 0.1484 0.1484 0.3383 0.3383 0.6837 0.6837 0.7594 0.7594 0.9746 0.9746 1.0660 1.0660 1.5105 1.5105 1.5778 1.5778 4.4134 4.4134 4.5622 4.5622 5.2119 5.2119 5.3487 5.3487 5.7235 5.7235 5.7859 5.7859 6.5181 6.5181 k = 0.0000-0.3255-0.0025 ( 11766 PWs) bands (ev): -14.0738 -14.0738 -13.9707 -13.9707 -12.6368 -12.6368 -12.5918 -12.5918 -10.9098 -10.9098 -10.8477 -10.8477 -9.9365 -9.9365 -9.8743 -9.8743 -8.1980 -8.1980 -8.0593 -8.0593 -7.8757 -7.8757 -7.8535 -7.8535 -5.1811 -5.1811 -5.1246 -5.1246 -4.5206 -4.5206 -4.5036 -4.5036 -3.1740 -3.1740 -3.0891 -3.0891 -2.6409 -2.6409 -2.5673 -2.5673 -1.8461 -1.8461 -1.7518 -1.7518 -1.5094 -1.5094 -1.4497 -1.4497 -0.4373 -0.4373 -0.3670 -0.3670 0.1451 0.1451 0.3330 0.3330 0.6710 0.6710 0.7628 0.7628 0.9735 0.9735 1.0668 1.0668 1.5099 1.5099 1.5835 1.5835 4.4203 4.4203 4.5689 4.5689 5.2096 5.2096 5.3621 5.3621 5.7198 5.7198 5.7883 5.7883 6.5245 6.5245 k = 0.0000-0.3120-0.0024 ( 11758 PWs) bands (ev): -14.0747 -14.0747 -13.9725 -13.9725 -12.6347 -12.6347 -12.5897 -12.5897 -10.9164 -10.9164 -10.8418 -10.8418 -9.9397 -9.9397 -9.8720 -9.8720 -8.1965 -8.1965 -8.0577 -8.0577 -7.8773 -7.8773 -7.8505 -7.8505 -5.1832 -5.1832 -5.1258 -5.1258 -4.5213 -4.5213 -4.4997 -4.4997 -3.1727 -3.1727 -3.0880 -3.0880 -2.6410 -2.6410 -2.5680 -2.5680 -1.8487 -1.8487 -1.7411 -1.7411 -1.5205 -1.5205 -1.4495 -1.4495 -0.4491 -0.4491 -0.3658 -0.3658 0.1404 0.1404 0.3268 0.3268 0.6567 0.6567 0.7660 0.7660 0.9719 0.9719 1.0676 1.0676 1.5098 1.5098 1.5898 1.5898 4.4288 4.4288 4.5774 4.5774 5.2072 5.2072 5.3783 5.3783 5.7164 5.7164 5.7902 5.7902 6.5326 6.5326 k = 0.0000-0.2984-0.0023 ( 11754 PWs) bands (ev): -14.0759 -14.0759 -13.9747 -13.9747 -12.6323 -12.6323 -12.5871 -12.5871 -10.9231 -10.9231 -10.8359 -10.8359 -9.9433 -9.9433 -9.8693 -9.8693 -8.1946 -8.1946 -8.0559 -8.0559 -7.8785 -7.8785 -7.8477 -7.8477 -5.1857 -5.1857 -5.1273 -5.1273 -4.5218 -4.5218 -4.4954 -4.4954 -3.1712 -3.1712 -3.0865 -3.0865 -2.6414 -2.6414 -2.5687 -2.5687 -1.8511 -1.8511 -1.7293 -1.7293 -1.5322 -1.5322 -1.4506 -1.4506 -0.4621 -0.4621 -0.3658 -0.3658 0.1342 0.1342 0.3200 0.3200 0.6413 0.6413 0.7690 0.7690 0.9697 0.9697 1.0684 1.0684 1.5104 1.5104 1.5963 1.5963 4.4389 4.4389 4.5876 4.5876 5.2049 5.2049 5.3969 5.3969 5.7137 5.7137 5.7915 5.7915 6.5422 6.5422 k = 0.0000-0.2848-0.0022 ( 11755 PWs) bands (ev): -14.0772 -14.0772 -13.9771 -13.9771 -12.6297 -12.6297 -12.5839 -12.5839 -10.9296 -10.9296 -10.8303 -10.8303 -9.9474 -9.9474 -9.8664 -9.8664 -8.1922 -8.1922 -8.0540 -8.0540 -7.8793 -7.8793 -7.8451 -7.8451 -5.1884 -5.1884 -5.1291 -5.1291 -4.5221 -4.5221 -4.4906 -4.4906 -3.1693 -3.1693 -3.0848 -3.0848 -2.6422 -2.6422 -2.5694 -2.5694 -1.8533 -1.8533 -1.7167 -1.7167 -1.5439 -1.5439 -1.4528 -1.4528 -0.4761 -0.4761 -0.3671 -0.3671 0.1263 0.1263 0.3131 0.3131 0.6254 0.6254 0.7717 0.7717 0.9670 0.9670 1.0689 1.0689 1.5117 1.5117 1.6028 1.6028 4.4504 4.4504 4.5996 4.5996 5.2029 5.2029 5.4174 5.4174 5.7120 5.7120 5.7921 5.7921 6.5534 6.5534 k = 0.0000-0.2713-0.0021 ( 11760 PWs) bands (ev): -14.0787 -14.0787 -13.9799 -13.9799 -12.6270 -12.6270 -12.5801 -12.5801 -10.9361 -10.9361 -10.8248 -10.8248 -9.9518 -9.9518 -9.8634 -9.8634 -8.1893 -8.1893 -8.0520 -8.0520 -7.8796 -7.8796 -7.8428 -7.8428 -5.1915 -5.1915 -5.1311 -5.1311 -4.5222 -4.5222 -4.4855 -4.4855 -3.1672 -3.1672 -3.0826 -3.0826 -2.6437 -2.6437 -2.5697 -2.5697 -1.8555 -1.8555 -1.7037 -1.7037 -1.5554 -1.5554 -1.4561 -1.4561 -0.4908 -0.4908 -0.3701 -0.3701 0.1165 0.1165 0.3063 0.3063 0.6094 0.6094 0.7742 0.7742 0.9638 0.9638 1.0691 1.0691 1.5138 1.5138 1.6090 1.6090 4.4629 4.4629 4.6133 4.6133 5.2014 5.2014 5.4392 5.4392 5.7114 5.7114 5.7921 5.7921 6.5659 6.5659 k = 0.0000-0.2577-0.0020 ( 11758 PWs) bands (ev): -14.0803 -14.0803 -13.9829 -13.9829 -12.6243 -12.6243 -12.5758 -12.5758 -10.9424 -10.9424 -10.8196 -10.8196 -9.9566 -9.9566 -9.8602 -9.8602 -8.1858 -8.1858 -8.0499 -8.0499 -7.8796 -7.8796 -7.8408 -7.8408 -5.1948 -5.1948 -5.1334 -5.1334 -4.5222 -4.5222 -4.4800 -4.4800 -3.1648 -3.1648 -3.0799 -3.0799 -2.6460 -2.6460 -2.5696 -2.5696 -1.8580 -1.8580 -1.6902 -1.6902 -1.5662 -1.5662 -1.4601 -1.4601 -0.5060 -0.5060 -0.3748 -0.3748 0.1050 0.1050 0.3000 0.3000 0.5937 0.5937 0.7764 0.7764 0.9600 0.9600 1.0689 1.0689 1.5166 1.5166 1.6147 1.6147 4.4764 4.4764 4.6285 4.6285 5.2003 5.2003 5.4616 5.4616 5.7117 5.7117 5.7923 5.7923 6.5797 6.5797 k = 0.0000-0.2441-0.0019 ( 11743 PWs) bands (ev): -14.0820 -14.0820 -13.9861 -13.9861 -12.6218 -12.6218 -12.5709 -12.5709 -10.9484 -10.9484 -10.8146 -10.8146 -9.9616 -9.9616 -9.8569 -9.8569 -8.1817 -8.1817 -8.0479 -8.0479 -7.8791 -7.8791 -7.8392 -7.8392 -5.1982 -5.1982 -5.1359 -5.1359 -4.5222 -4.5222 -4.4742 -4.4742 -3.1621 -3.1621 -3.0769 -3.0769 -2.6495 -2.6495 -2.5689 -2.5689 -1.8612 -1.8612 -1.6767 -1.6767 -1.5760 -1.5760 -1.4647 -1.4647 -0.5215 -0.5215 -0.3815 -0.3815 0.0920 0.0920 0.2943 0.2943 0.5786 0.5786 0.7785 0.7785 0.9559 0.9559 1.0682 1.0682 1.5200 1.5200 1.6199 1.6199 4.4904 4.4904 4.6451 4.6451 5.1999 5.1999 5.4838 5.4838 5.7124 5.7124 5.7936 5.7936 6.5948 6.5948 k = 0.0000-0.2306-0.0018 ( 11745 PWs) bands (ev): -14.0839 -14.0839 -13.9894 -13.9894 -12.6193 -12.6193 -12.5654 -12.5654 -10.9542 -10.9542 -10.8099 -10.8099 -9.9668 -9.9668 -9.8536 -9.8536 -8.1771 -8.1771 -8.0459 -8.0459 -7.8783 -7.8783 -7.8380 -7.8380 -5.2018 -5.2018 -5.1386 -5.1386 -4.5220 -4.5220 -4.4681 -4.4681 -3.1591 -3.1591 -3.0733 -3.0733 -2.6541 -2.6541 -2.5676 -2.5676 -1.8654 -1.8654 -1.6636 -1.6636 -1.5840 -1.5840 -1.4694 -1.4694 -0.5371 -0.5371 -0.3905 -0.3905 0.0781 0.0781 0.2891 0.2891 0.5643 0.5643 0.7804 0.7804 0.9513 0.9513 1.0670 1.0670 1.5239 1.5239 1.6245 1.6245 4.5049 4.5049 4.6630 4.6630 5.2003 5.2003 5.5051 5.5051 5.7124 5.7124 5.7976 5.7976 6.6111 6.6111 k = 0.0000-0.2170-0.0017 ( 11739 PWs) bands (ev): -14.0858 -14.0858 -13.9928 -13.9928 -12.6170 -12.6170 -12.5595 -12.5595 -10.9597 -10.9597 -10.8055 -10.8055 -9.9722 -9.9722 -9.8503 -9.8503 -8.1718 -8.1718 -8.0439 -8.0439 -7.8773 -7.8773 -7.8372 -7.8372 -5.2054 -5.2054 -5.1414 -5.1414 -4.5217 -4.5217 -4.4618 -4.4618 -3.1558 -3.1558 -3.0692 -3.0692 -2.6600 -2.6600 -2.5654 -2.5654 -1.8709 -1.8709 -1.6521 -1.6521 -1.5891 -1.5891 -1.4739 -1.4739 -0.5528 -0.5528 -0.4017 -0.4017 0.0636 0.0636 0.2845 0.2845 0.5510 0.5510 0.7822 0.7822 0.9464 0.9464 1.0653 1.0653 1.5282 1.5282 1.6284 1.6284 4.5195 4.5195 4.6819 4.6819 5.2015 5.2015 5.5249 5.5249 5.7105 5.7105 5.8056 5.8056 6.6286 6.6286 k = 0.0000-0.2035-0.0016 ( 11730 PWs) bands (ev): -14.0877 -14.0877 -13.9963 -13.9963 -12.6149 -12.6149 -12.5533 -12.5533 -10.9649 -10.9649 -10.8014 -10.8014 -9.9777 -9.9777 -9.8471 -9.8471 -8.1660 -8.1660 -8.0420 -8.0420 -7.8762 -7.8762 -7.8367 -7.8367 -5.2090 -5.2090 -5.1444 -5.1444 -4.5214 -4.5214 -4.4554 -4.4554 -3.1522 -3.1522 -3.0647 -3.0647 -2.6671 -2.6671 -2.5626 -2.5626 -1.8778 -1.8778 -1.6445 -1.6445 -1.5890 -1.5890 -1.4779 -1.4779 -0.5683 -0.5683 -0.4153 -0.4153 0.0492 0.0492 0.2802 0.2802 0.5387 0.5387 0.7840 0.7840 0.9412 0.9412 1.0631 1.0631 1.5327 1.5327 1.6318 1.6318 4.5341 4.5341 4.7017 4.7017 5.2037 5.2037 5.5425 5.5425 5.7065 5.7065 5.8184 5.8184 6.6474 6.6474 k = 0.0000-0.1899-0.0015 ( 11739 PWs) bands (ev): -14.0897 -14.0897 -13.9998 -13.9998 -12.6130 -12.6130 -12.5469 -12.5469 -10.9698 -10.9698 -10.7976 -10.7976 -9.9833 -9.9833 -9.8440 -9.8440 -8.1596 -8.1596 -8.0402 -8.0402 -7.8749 -7.8749 -7.8367 -7.8367 -5.2127 -5.2127 -5.1475 -5.1475 -4.5210 -4.5210 -4.4490 -4.4490 -3.1484 -3.1484 -3.0596 -3.0596 -2.6754 -2.6754 -2.5591 -2.5591 -1.8862 -1.8862 -1.6431 -1.6431 -1.5815 -1.5815 -1.4810 -1.4810 -0.5839 -0.5839 -0.4311 -0.4311 0.0353 0.0353 0.2763 0.2763 0.5276 0.5276 0.7857 0.7857 0.9357 0.9357 1.0604 1.0604 1.5373 1.5373 1.6346 1.6346 4.5485 4.5485 4.7220 4.7220 5.2068 5.2068 5.5573 5.5573 5.7009 5.7009 5.8354 5.8354 6.6676 6.6676 k = 0.0000-0.1763-0.0014 ( 11750 PWs) bands (ev): -14.0916 -14.0916 -14.0033 -14.0033 -12.6112 -12.6112 -12.5403 -12.5403 -10.9744 -10.9744 -10.7940 -10.7940 -9.9888 -9.9888 -9.8410 -9.8410 -8.1528 -8.1528 -8.0384 -8.0384 -7.8737 -7.8737 -7.8371 -7.8371 -5.2162 -5.2162 -5.1506 -5.1506 -4.5206 -4.5206 -4.4425 -4.4425 -3.1443 -3.1443 -3.0541 -3.0541 -2.6848 -2.6848 -2.5551 -2.5551 -1.8960 -1.8960 -1.6469 -1.6469 -1.5679 -1.5679 -1.4831 -1.4831 -0.5994 -0.5994 -0.4488 -0.4488 0.0223 0.0223 0.2727 0.2727 0.5175 0.5175 0.7875 0.7875 0.9300 0.9300 1.0573 1.0573 1.5419 1.5419 1.6370 1.6370 4.5626 4.5626 4.7426 4.7426 5.2109 5.2109 5.5682 5.5682 5.6955 5.6955 5.8555 5.8555 6.6893 6.6893 k = 0.0000-0.1628-0.0013 ( 11744 PWs) bands (ev): -14.0936 -14.0936 -14.0067 -14.0067 -12.6095 -12.6095 -12.5337 -12.5337 -10.9786 -10.9786 -10.7907 -10.7907 -9.9943 -9.9943 -9.8381 -9.8381 -8.1454 -8.1454 -8.0367 -8.0367 -7.8728 -7.8728 -7.8377 -7.8377 -5.2197 -5.2197 -5.1538 -5.1538 -4.5201 -4.5201 -4.4361 -4.4361 -3.1399 -3.1399 -3.0481 -3.0481 -2.6952 -2.6952 -2.5507 -2.5507 -1.9069 -1.9069 -1.6536 -1.6536 -1.5506 -1.5506 -1.4840 -1.4840 -0.6150 -0.6150 -0.4678 -0.4678 0.0105 0.0105 0.2693 0.2693 0.5084 0.5084 0.7894 0.7894 0.9240 0.9240 1.0540 1.0540 1.5463 1.5463 1.6390 1.6390 4.5763 4.5763 4.7632 4.7632 5.2162 5.2162 5.5740 5.5740 5.6924 5.6924 5.8775 5.8775 6.7124 6.7124 k = 0.0000-0.1492-0.0011 ( 11740 PWs) bands (ev): -14.0954 -14.0954 -14.0100 -14.0100 -12.6080 -12.6080 -12.5272 -12.5272 -10.9824 -10.9824 -10.7877 -10.7877 -9.9996 -9.9996 -9.8354 -9.8354 -8.1377 -8.1377 -8.0350 -8.0350 -7.8721 -7.8721 -7.8385 -7.8385 -5.2230 -5.2230 -5.1569 -5.1569 -4.5196 -4.5196 -4.4299 -4.4299 -3.1355 -3.1355 -3.0415 -3.0415 -2.7064 -2.7064 -2.5459 -2.5459 -1.9187 -1.9187 -1.6617 -1.6617 -1.5314 -1.5314 -1.4836 -1.4836 -0.6311 -0.6311 -0.4876 -0.4876 0.0001 0.0001 0.2660 0.2660 0.5003 0.5003 0.7914 0.7914 0.9178 0.9178 1.0504 1.0504 1.5505 1.5505 1.6407 1.6407 4.5894 4.5894 4.7835 4.7835 5.2225 5.2225 5.5734 5.5734 5.6936 5.6936 5.9001 5.9001 6.7365 6.7365 k = 0.0000-0.1356-0.0010 ( 11736 PWs) bands (ev): -14.0973 -14.0973 -14.0131 -14.0131 -12.6066 -12.6066 -12.5209 -12.5209 -10.9859 -10.9859 -10.7850 -10.7850 -10.0047 -10.0047 -9.8329 -9.8329 -8.1298 -8.1298 -8.0334 -8.0334 -7.8719 -7.8719 -7.8394 -7.8394 -5.2261 -5.2261 -5.1599 -5.1599 -4.5191 -4.5191 -4.4239 -4.4239 -3.1309 -3.1309 -3.0344 -3.0344 -2.7183 -2.7183 -2.5410 -2.5410 -1.9310 -1.9310 -1.6706 -1.6706 -1.5117 -1.5117 -1.4814 -1.4814 -0.6480 -0.6480 -0.5072 -0.5072 -0.0090 -0.0090 0.2629 0.2629 0.4931 0.4931 0.7936 0.7936 0.9114 0.9114 1.0468 1.0468 1.5542 1.5542 1.6422 1.6422 4.6018 4.6018 4.8031 4.8031 5.2299 5.2299 5.5662 5.5662 5.6998 5.6998 5.9223 5.9223 6.7603 6.7603 k = 0.0000-0.1221-0.0009 ( 11736 PWs) bands (ev): -14.0990 -14.0990 -14.0160 -14.0160 -12.6054 -12.6054 -12.5148 -12.5148 -10.9890 -10.9890 -10.7826 -10.7826 -10.0096 -10.0096 -9.8306 -9.8306 -8.1217 -8.1217 -8.0318 -8.0318 -7.8722 -7.8722 -7.8402 -7.8402 -5.2290 -5.2290 -5.1627 -5.1627 -4.5185 -4.5185 -4.4182 -4.4182 -3.1263 -3.1263 -3.0269 -3.0269 -2.7307 -2.7307 -2.5360 -2.5360 -1.9435 -1.9435 -1.6797 -1.6797 -1.4951 -1.4951 -1.4747 -1.4747 -0.6660 -0.6660 -0.5257 -0.5257 -0.0167 -0.0167 0.2600 0.2600 0.4867 0.4867 0.7960 0.7960 0.9049 0.9049 1.0431 1.0431 1.5576 1.5576 1.6436 1.6436 4.6135 4.6135 4.8219 4.8219 5.2384 5.2384 5.5538 5.5538 5.7101 5.7101 5.9431 5.9431 6.7791 6.7791 k = 0.0000-0.1085-0.0008 ( 11736 PWs) bands (ev): -14.1006 -14.1006 -14.0187 -14.0187 -12.6043 -12.6043 -12.5092 -12.5092 -10.9918 -10.9918 -10.7804 -10.7804 -10.0141 -10.0141 -9.8285 -9.8285 -8.1136 -8.1136 -8.0303 -8.0303 -7.8732 -7.8732 -7.8408 -7.8408 -5.2317 -5.2317 -5.1655 -5.1655 -4.5180 -4.5180 -4.4129 -4.4129 -3.1219 -3.1219 -3.0189 -3.0189 -2.7436 -2.7436 -2.5310 -2.5310 -1.9559 -1.9559 -1.6887 -1.6887 -1.4871 -1.4871 -1.4584 -1.4584 -0.6853 -0.6853 -0.5424 -0.5424 -0.0232 -0.0232 0.2573 0.2573 0.4810 0.4810 0.7986 0.7986 0.8983 0.8983 1.0396 1.0396 1.5605 1.5605 1.6449 1.6449 4.6243 4.6243 4.8395 4.8395 5.2479 5.2479 5.5379 5.5379 5.7231 5.7231 5.9620 5.9620 6.7894 6.7894 k = 0.0000-0.0949-0.0007 ( 11728 PWs) bands (ev): -14.1020 -14.1020 -14.0212 -14.0212 -12.6033 -12.6033 -12.5040 -12.5040 -10.9942 -10.9942 -10.7785 -10.7785 -10.0183 -10.0183 -9.8267 -9.8267 -8.1057 -8.1057 -8.0288 -8.0288 -7.8749 -7.8749 -7.8412 -7.8412 -5.2342 -5.2342 -5.1679 -5.1679 -4.5175 -4.5175 -4.4081 -4.4081 -3.1177 -3.1177 -3.0105 -3.0105 -2.7566 -2.7566 -2.5261 -2.5261 -1.9677 -1.9677 -1.6973 -1.6973 -1.4836 -1.4836 -1.4376 -1.4376 -0.7057 -0.7057 -0.5568 -0.5568 -0.0286 -0.0286 0.2548 0.2548 0.4760 0.4760 0.8015 0.8015 0.8918 0.8918 1.0362 1.0362 1.5629 1.5629 1.6461 1.6461 4.6343 4.6343 4.8556 4.8556 5.2584 5.2584 5.5198 5.5198 5.7376 5.7376 5.9785 5.9785 6.7950 6.7950 k = 0.0000-0.0814-0.0006 ( 11734 PWs) bands (ev): -14.1033 -14.1033 -14.0234 -14.0234 -12.6025 -12.6025 -12.4994 -12.4994 -10.9963 -10.9963 -10.7768 -10.7768 -10.0220 -10.0220 -9.8251 -9.8251 -8.0982 -8.0982 -8.0275 -8.0275 -7.8771 -7.8771 -7.8414 -7.8414 -5.2363 -5.2363 -5.1702 -5.1702 -4.5171 -4.5171 -4.4037 -4.4037 -3.1138 -3.1138 -3.0019 -3.0019 -2.7695 -2.7695 -2.5216 -2.5216 -1.9787 -1.9787 -1.7052 -1.7052 -1.4812 -1.4812 -1.4161 -1.4161 -0.7267 -0.7267 -0.5686 -0.5686 -0.0329 -0.0329 0.2526 0.2526 0.4717 0.4717 0.8046 0.8046 0.8853 0.8853 1.0331 1.0331 1.5648 1.5648 1.6473 1.6473 4.6431 4.6431 4.8701 4.8701 5.2698 5.2698 5.5006 5.5006 5.7524 5.7524 5.9925 5.9925 6.7986 6.7986 k = 0.0000-0.0678-0.0005 ( 11735 PWs) bands (ev): -14.1045 -14.1045 -14.0253 -14.0253 -12.6018 -12.6018 -12.4954 -12.4954 -10.9981 -10.9981 -10.7754 -10.7754 -10.0252 -10.0252 -9.8238 -9.8238 -8.0912 -8.0912 -8.0262 -8.0262 -7.8795 -7.8795 -7.8414 -7.8414 -5.2382 -5.2382 -5.1721 -5.1721 -4.5166 -4.5166 -4.3999 -4.3999 -3.1104 -3.1104 -2.9932 -2.9932 -2.7821 -2.7821 -2.5174 -2.5174 -1.9887 -1.9887 -1.7122 -1.7122 -1.4792 -1.4792 -1.3956 -1.3956 -0.7475 -0.7475 -0.5780 -0.5780 -0.0363 -0.0363 0.2507 0.2507 0.4681 0.4681 0.8079 0.8079 0.8790 0.8790 1.0303 1.0303 1.5663 1.5663 1.6483 1.6483 4.6509 4.6509 4.8827 4.8827 5.2819 5.2819 5.4809 5.4809 5.7668 5.7668 6.0038 6.0038 6.8012 6.8012 k = 0.0000-0.0543-0.0004 ( 11732 PWs) bands (ev): -14.1054 -14.1054 -14.0268 -14.0268 -12.6012 -12.6012 -12.4920 -12.4920 -10.9995 -10.9995 -10.7743 -10.7743 -10.0280 -10.0280 -9.8227 -9.8227 -8.0851 -8.0851 -8.0251 -8.0251 -7.8821 -7.8821 -7.8413 -7.8413 -5.2397 -5.2397 -5.1738 -5.1738 -4.5163 -4.5163 -4.3967 -4.3967 -3.1075 -3.1075 -2.9848 -2.9848 -2.7938 -2.7938 -2.5138 -2.5138 -1.9973 -1.9973 -1.7181 -1.7181 -1.4776 -1.4776 -1.3769 -1.3769 -0.7669 -0.7669 -0.5852 -0.5852 -0.0390 -0.0390 0.2491 0.2491 0.4650 0.4650 0.8112 0.8112 0.8731 0.8731 1.0280 1.0280 1.5674 1.5674 1.6493 1.6493 4.6574 4.6574 4.8932 4.8932 5.2947 5.2947 5.4615 5.4615 5.7799 5.7799 6.0125 6.0125 6.8032 6.8032 k = 0.0000-0.0407-0.0003 ( 11729 PWs) bands (ev): -14.1061 -14.1061 -14.0281 -14.0281 -12.6007 -12.6007 -12.4893 -12.4893 -11.0006 -11.0006 -10.7734 -10.7734 -10.0301 -10.0301 -9.8218 -9.8218 -8.0801 -8.0801 -8.0242 -8.0242 -7.8845 -7.8845 -7.8412 -7.8412 -5.2410 -5.2410 -5.1751 -5.1751 -4.5160 -4.5160 -4.3942 -4.3942 -3.1051 -3.1051 -2.9771 -2.9771 -2.8041 -2.8041 -2.5109 -2.5109 -2.0042 -2.0042 -1.7229 -1.7229 -1.4764 -1.4764 -1.3609 -1.3609 -0.7838 -0.7838 -0.5905 -0.5905 -0.0409 -0.0409 0.2479 0.2479 0.4627 0.4627 0.8145 0.8145 0.8678 0.8678 1.0261 1.0261 1.5682 1.5682 1.6501 1.6501 4.6626 4.6626 4.9016 4.9016 5.3075 5.3075 5.4431 5.4431 5.7911 5.7911 6.0189 6.0189 6.8047 6.8047 k = 0.0000-0.0271-0.0002 ( 11731 PWs) bands (ev): -14.1067 -14.1067 -14.0289 -14.0289 -12.6004 -12.6004 -12.4874 -12.4874 -11.0014 -11.0014 -10.7728 -10.7728 -10.0317 -10.0317 -9.8212 -9.8212 -8.0763 -8.0763 -8.0234 -8.0234 -7.8865 -7.8865 -7.8411 -7.8411 -5.2418 -5.2418 -5.1760 -5.1760 -4.5158 -4.5158 -4.3924 -4.3924 -3.1034 -3.1034 -2.9707 -2.9707 -2.8124 -2.8124 -2.5086 -2.5086 -2.0093 -2.0093 -1.7263 -1.7263 -1.4755 -1.4755 -1.3486 -1.3486 -0.7969 -0.7969 -0.5941 -0.5941 -0.0423 -0.0423 0.2470 0.2470 0.4610 0.4610 0.8174 0.8174 0.8634 0.8634 1.0247 1.0247 1.5688 1.5688 1.6507 1.6507 4.6664 4.6664 4.9077 4.9077 5.3197 5.3197 5.4268 5.4268 5.7996 5.7996 6.0232 6.0232 6.8057 6.8057 k = 0.0000-0.0136-0.0001 ( 11734 PWs) bands (ev): -14.1070 -14.1070 -14.0295 -14.0295 -12.6002 -12.6002 -12.4862 -12.4862 -11.0019 -11.0019 -10.7724 -10.7724 -10.0326 -10.0326 -9.8208 -9.8208 -8.0739 -8.0739 -8.0230 -8.0230 -7.8877 -7.8877 -7.8410 -7.8410 -5.2424 -5.2424 -5.1766 -5.1766 -4.5156 -4.5156 -4.3913 -4.3913 -3.1024 -3.1024 -2.9665 -2.9665 -2.8178 -2.8178 -2.5073 -2.5073 -2.0125 -2.0125 -1.7284 -1.7284 -1.4749 -1.4749 -1.3408 -1.3408 -0.8053 -0.8053 -0.5962 -0.5962 -0.0430 -0.0430 0.2464 0.2464 0.4599 0.4599 0.8195 0.8195 0.8604 0.8604 1.0239 1.0239 1.5691 1.5691 1.6510 1.6510 4.6686 4.6686 4.9113 4.9113 5.3294 5.3294 5.4146 5.4146 5.8049 5.8049 6.0257 6.0257 6.8062 6.8062 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k = 0.0139 0.0018 0.0007 ( 11727 PWs) bands (ev): -14.1069 -14.1069 -14.0294 -14.0294 -12.6000 -12.6000 -12.4859 -12.4859 -11.0017 -11.0017 -10.7726 -10.7726 -10.0325 -10.0325 -9.8210 -9.8210 -8.0733 -8.0733 -8.0231 -8.0231 -7.8880 -7.8880 -7.8411 -7.8411 -5.2425 -5.2425 -5.1769 -5.1769 -4.5153 -4.5153 -4.3909 -4.3909 -3.1020 -3.1020 -2.9654 -2.9654 -2.8192 -2.8192 -2.5075 -2.5075 -2.0134 -2.0134 -1.7298 -1.7298 -1.4764 -1.4764 -1.3393 -1.3393 -0.8078 -0.8078 -0.5967 -0.5967 -0.0429 -0.0429 0.2447 0.2447 0.4600 0.4600 0.8160 0.8160 0.8611 0.8611 1.0226 1.0226 1.5698 1.5698 1.6506 1.6506 4.6699 4.6699 4.9128 4.9128 5.3327 5.3327 5.4097 5.4097 5.8059 5.8059 6.0268 6.0268 6.8076 6.8076 k = 0.0278 0.0035 0.0015 ( 11727 PWs) bands (ev): -14.1062 -14.1062 -14.0287 -14.0287 -12.5998 -12.5998 -12.4861 -12.4861 -11.0007 -11.0007 -10.7737 -10.7737 -10.0311 -10.0311 -9.8218 -9.8218 -8.0737 -8.0737 -8.0239 -8.0239 -7.8876 -7.8876 -7.8414 -7.8414 -5.2424 -5.2424 -5.1771 -5.1771 -4.5145 -4.5145 -4.3906 -4.3906 -3.1017 -3.1017 -2.9665 -2.9665 -2.8178 -2.8178 -2.5093 -2.5093 -2.0129 -2.0129 -1.7318 -1.7318 -1.4813 -1.4813 -1.3430 -1.3430 -0.8069 -0.8069 -0.5961 -0.5961 -0.0417 -0.0417 0.2401 0.2401 0.4612 0.4612 0.8050 0.8050 0.8645 0.8645 1.0197 1.0197 1.5716 1.5716 1.6489 1.6489 4.6713 4.6713 4.9135 4.9135 5.3307 5.3307 5.4093 5.4093 5.8035 5.8035 6.0278 6.0278 6.8110 6.8110 k = 0.0417 0.0053 0.0022 ( 11730 PWs) bands (ev): -14.1050 -14.1050 -14.0276 -14.0276 -12.5993 -12.5993 -12.4865 -12.4865 -10.9990 -10.9990 -10.7755 -10.7755 -10.0288 -10.0288 -9.8231 -9.8231 -8.0745 -8.0745 -8.0252 -8.0252 -7.8870 -7.8870 -7.8421 -7.8421 -5.2421 -5.2421 -5.1774 -5.1774 -4.5132 -4.5132 -4.3903 -4.3903 -3.1013 -3.1013 -2.9683 -2.9683 -2.8156 -2.8156 -2.5124 -2.5124 -2.0122 -2.0122 -1.7353 -1.7353 -1.4891 -1.4891 -1.3490 -1.3490 -0.8057 -0.8057 -0.5951 -0.5951 -0.0397 -0.0397 0.2329 0.2329 0.4627 0.4627 0.7901 0.7901 0.8668 0.8668 1.0150 1.0150 1.5742 1.5742 1.6463 1.6463 4.6737 4.6737 4.9148 4.9148 5.3276 5.3276 5.4085 5.4085 5.7996 5.7996 6.0293 6.0293 6.8168 6.8168 k = 0.0556 0.0071 0.0030 ( 11731 PWs) bands (ev): -14.1034 -14.1034 -14.0260 -14.0260 -12.5986 -12.5986 -12.4870 -12.4870 -10.9968 -10.9968 -10.7779 -10.7779 -10.0256 -10.0256 -9.8250 -9.8250 -8.0756 -8.0756 -8.0270 -8.0270 -7.8860 -7.8860 -7.8430 -7.8430 -5.2419 -5.2419 -5.1778 -5.1778 -4.5114 -4.5114 -4.3898 -4.3898 -3.1007 -3.1007 -2.9708 -2.9708 -2.8126 -2.8126 -2.5167 -2.5167 -2.0113 -2.0113 -1.7402 -1.7402 -1.4996 -1.4996 -1.3573 -1.3573 -0.8044 -0.8044 -0.5936 -0.5936 -0.0373 -0.0373 0.2234 0.2234 0.4643 0.4643 0.7727 0.7727 0.8671 0.8671 1.0087 1.0087 1.5769 1.5769 1.6435 1.6435 4.6769 4.6769 4.9167 4.9167 5.3235 5.3235 5.4073 5.4073 5.7948 5.7948 6.0313 6.0313 6.8250 6.8250 k = 0.0694 0.0088 0.0037 ( 11733 PWs) bands (ev): -14.1014 -14.1014 -14.0240 -14.0240 -12.5978 -12.5978 -12.4877 -12.4877 -10.9938 -10.9938 -10.7810 -10.7810 -10.0216 -10.0216 -9.8273 -9.8273 -8.0769 -8.0769 -8.0293 -8.0293 -7.8849 -7.8849 -7.8441 -7.8441 -5.2416 -5.2416 -5.1783 -5.1783 -4.5091 -4.5091 -4.3891 -4.3891 -3.1000 -3.1000 -2.9737 -2.9737 -2.8089 -2.8089 -2.5221 -2.5221 -2.0103 -2.0103 -1.7466 -1.7466 -1.5123 -1.5123 -1.3677 -1.3677 -0.8036 -0.8036 -0.5916 -0.5916 -0.0346 -0.0346 0.2122 0.2122 0.4653 0.4653 0.7537 0.7537 0.8648 0.8648 1.0012 1.0012 1.5790 1.5790 1.6411 1.6411 4.6811 4.6811 4.9194 4.9194 5.3187 5.3187 5.4057 5.4057 5.7893 5.7893 6.0334 6.0334 6.8358 6.8358 k = 0.0833 0.0106 0.0044 ( 11734 PWs) bands (ev): -14.0989 -14.0989 -14.0215 -14.0215 -12.5968 -12.5968 -12.4885 -12.4885 -10.9903 -10.9903 -10.7847 -10.7847 -10.0168 -10.0168 -9.8302 -9.8302 -8.0785 -8.0785 -8.0321 -8.0321 -7.8836 -7.8836 -7.8455 -7.8455 -5.2413 -5.2413 -5.1787 -5.1787 -4.5063 -4.5063 -4.3884 -4.3884 -3.0991 -3.0991 -2.9770 -2.9770 -2.8047 -2.8047 -2.5287 -2.5287 -2.0092 -2.0092 -1.7546 -1.7546 -1.5267 -1.5267 -1.3800 -1.3800 -0.8034 -0.8034 -0.5891 -0.5891 -0.0319 -0.0319 0.1999 0.1999 0.4654 0.4654 0.7337 0.7337 0.8597 0.8597 0.9928 0.9928 1.5793 1.5793 1.6402 1.6402 4.6860 4.6860 4.9230 4.9230 5.3134 5.3134 5.4035 5.4035 5.7837 5.7837 6.0356 6.0356 6.8490 6.8490 k = 0.0972 0.0123 0.0052 ( 11740 PWs) bands (ev): -14.0960 -14.0960 -14.0186 -14.0186 -12.5956 -12.5956 -12.4895 -12.4895 -10.9861 -10.9861 -10.7890 -10.7890 -10.0112 -10.0112 -9.8336 -9.8336 -8.0803 -8.0803 -8.0354 -8.0354 -7.8821 -7.8821 -7.8471 -7.8471 -5.2411 -5.2411 -5.1791 -5.1791 -4.5031 -4.5031 -4.3875 -4.3875 -3.0980 -3.0980 -2.9805 -2.9805 -2.7999 -2.7999 -2.5363 -2.5363 -2.0082 -2.0082 -1.7643 -1.7643 -1.5422 -1.5422 -1.3942 -1.3942 -0.8044 -0.8044 -0.5861 -0.5861 -0.0296 -0.0296 0.1870 0.1870 0.4640 0.4640 0.7131 0.7131 0.8519 0.8519 0.9837 0.9837 1.5772 1.5772 1.6414 1.6414 4.6918 4.6918 4.9278 4.9278 5.3079 5.3079 5.4006 5.4006 5.7784 5.7784 6.0377 6.0377 6.8648 6.8648 k = 0.1111 0.0141 0.0059 ( 11742 PWs) bands (ev): -14.0928 -14.0928 -14.0154 -14.0154 -12.5944 -12.5944 -12.4906 -12.4906 -10.9814 -10.9814 -10.7938 -10.7938 -10.0050 -10.0050 -9.8375 -9.8375 -8.0824 -8.0824 -8.0390 -8.0390 -7.8804 -7.8804 -7.8488 -7.8488 -5.2411 -5.2411 -5.1793 -5.1793 -4.4995 -4.4995 -4.3866 -4.3866 -3.0968 -3.0968 -2.9842 -2.9842 -2.7949 -2.7949 -2.5450 -2.5450 -2.0074 -2.0074 -1.7755 -1.7755 -1.5582 -1.5582 -1.4099 -1.4099 -0.8068 -0.8068 -0.5828 -0.5828 -0.0280 -0.0280 0.1741 0.1741 0.4610 0.4610 0.6925 0.6925 0.8415 0.8415 0.9741 0.9741 1.5726 1.5726 1.6446 1.6446 4.6984 4.6984 4.9338 4.9338 5.3026 5.3026 5.3971 5.3971 5.7738 5.7738 6.0394 6.0394 6.8832 6.8832 k = 0.1250 0.0159 0.0067 ( 11749 PWs) bands (ev): -14.0891 -14.0891 -14.0117 -14.0117 -12.5929 -12.5929 -12.4919 -12.4919 -10.9760 -10.9760 -10.7990 -10.7990 -9.9980 -9.9980 -9.8418 -9.8418 -8.0846 -8.0846 -8.0431 -8.0431 -7.8786 -7.8786 -7.8508 -7.8508 -5.2412 -5.2412 -5.1792 -5.1792 -4.4955 -4.4955 -4.3857 -4.3857 -3.0954 -3.0954 -2.9879 -2.9879 -2.7895 -2.7895 -2.5545 -2.5545 -2.0071 -2.0071 -1.7882 -1.7882 -1.5744 -1.5744 -1.4270 -1.4270 -0.8107 -0.8107 -0.5795 -0.5795 -0.0277 -0.0277 0.1619 0.1619 0.4560 0.4560 0.6721 0.6721 0.8290 0.8290 0.9642 0.9642 1.5662 1.5662 1.6494 1.6494 4.7056 4.7056 4.9412 4.9412 5.2976 5.2976 5.3928 5.3928 5.7701 5.7701 6.0406 6.0406 6.9039 6.9039 k = 0.1389 0.0176 0.0074 ( 11748 PWs) bands (ev): -14.0851 -14.0851 -14.0078 -14.0078 -12.5914 -12.5914 -12.4933 -12.4933 -10.9702 -10.9702 -10.8047 -10.8047 -9.9905 -9.9905 -9.8467 -9.8467 -8.0870 -8.0870 -8.0475 -8.0475 -7.8769 -7.8769 -7.8528 -7.8528 -5.2416 -5.2416 -5.1788 -5.1788 -4.4912 -4.4912 -4.3847 -4.3847 -3.0938 -3.0938 -2.9915 -2.9915 -2.7839 -2.7839 -2.5650 -2.5650 -2.0074 -2.0074 -1.8023 -1.8023 -1.5903 -1.5903 -1.4453 -1.4453 -0.8162 -0.8162 -0.5763 -0.5763 -0.0289 -0.0289 0.1506 0.1506 0.4491 0.4491 0.6520 0.6520 0.8147 0.8147 0.9540 0.9540 1.5587 1.5587 1.6549 1.6549 4.7136 4.7136 4.9502 4.9502 5.2934 5.2934 5.3879 5.3879 5.7675 5.7675 6.0411 6.0411 6.9268 6.9268 k = 0.1528 0.0194 0.0081 ( 11757 PWs) bands (ev): -14.0808 -14.0808 -14.0034 -14.0034 -12.5898 -12.5898 -12.4948 -12.4948 -10.9638 -10.9638 -10.8107 -10.8107 -9.9825 -9.9825 -9.8519 -9.8519 -8.0895 -8.0895 -8.0522 -8.0522 -7.8751 -7.8751 -7.8548 -7.8548 -5.2422 -5.2422 -5.1781 -5.1781 -4.4867 -4.4867 -4.3837 -4.3837 -3.0921 -3.0921 -2.9950 -2.9950 -2.7782 -2.7782 -2.5762 -2.5762 -2.0089 -2.0089 -1.8173 -1.8173 -1.6058 -1.6058 -1.4645 -1.4645 -0.8233 -0.8233 -0.5736 -0.5736 -0.0320 -0.0320 0.1409 0.1409 0.4405 0.4405 0.6323 0.6323 0.7991 0.7991 0.9436 0.9436 1.5507 1.5507 1.6607 1.6607 4.7222 4.7222 4.9608 4.9608 5.2900 5.2900 5.3824 5.3824 5.7662 5.7662 6.0409 6.0409 6.9517 6.9517 k = 0.1667 0.0212 0.0089 ( 11762 PWs) bands (ev): -14.0762 -14.0762 -13.9988 -13.9988 -12.5881 -12.5881 -12.4964 -12.4964 -10.9569 -10.9569 -10.8170 -10.8170 -9.9740 -9.9740 -9.8577 -9.8577 -8.0922 -8.0922 -8.0572 -8.0572 -7.8736 -7.8736 -7.8567 -7.8567 -5.2432 -5.2432 -5.1769 -5.1769 -4.4819 -4.4819 -4.3828 -4.3828 -3.0903 -3.0903 -2.9983 -2.9983 -2.7724 -2.7724 -2.5880 -2.5880 -2.0118 -2.0118 -1.8325 -1.8325 -1.6205 -1.6205 -1.4846 -1.4846 -0.8319 -0.8319 -0.5718 -0.5718 -0.0370 -0.0370 0.1327 0.1327 0.4304 0.4304 0.6128 0.6128 0.7828 0.7828 0.9328 0.9328 1.5428 1.5428 1.6663 1.6663 4.7315 4.7315 4.9731 4.9731 5.2877 5.2877 5.3763 5.3763 5.7662 5.7662 6.0398 6.0398 6.9782 6.9782 k = 0.1806 0.0229 0.0096 ( 11765 PWs) bands (ev): -14.0713 -14.0713 -13.9939 -13.9939 -12.5864 -12.5864 -12.4981 -12.4981 -10.9496 -10.9496 -10.8236 -10.8236 -9.9651 -9.9651 -9.8638 -9.8638 -8.0949 -8.0949 -8.0625 -8.0625 -7.8727 -7.8727 -7.8581 -7.8581 -5.2445 -5.2445 -5.1753 -5.1753 -4.4769 -4.4769 -4.3818 -4.3818 -3.0884 -3.0884 -3.0012 -3.0012 -2.7666 -2.7666 -2.6005 -2.6005 -2.0168 -2.0168 -1.8474 -1.8474 -1.6346 -1.6346 -1.5051 -1.5051 -0.8420 -0.8420 -0.5711 -0.5711 -0.0439 -0.0439 0.1261 0.1261 0.4193 0.4193 0.5934 0.5934 0.7662 0.7662 0.9219 0.9219 1.5353 1.5353 1.6715 1.6715 4.7413 4.7413 4.9870 4.9870 5.2867 5.2867 5.3698 5.3698 5.7674 5.7674 6.0378 6.0378 7.0061 7.0061 k = 0.1944 0.0247 0.0103 ( 11765 PWs) bands (ev): -14.0662 -14.0662 -13.9888 -13.9888 -12.5847 -12.5847 -12.5000 -12.5000 -10.9420 -10.9420 -10.8302 -10.8302 -9.9560 -9.9560 -9.8702 -9.8702 -8.0976 -8.0976 -8.0680 -8.0680 -7.8727 -7.8727 -7.8587 -7.8587 -5.2461 -5.2461 -5.1732 -5.1732 -4.4717 -4.4717 -4.3809 -4.3809 -3.0865 -3.0865 -3.0037 -3.0037 -2.7610 -2.7610 -2.6132 -2.6132 -2.0244 -2.0244 -1.8611 -1.8611 -1.6482 -1.6482 -1.5260 -1.5260 -0.8534 -0.8534 -0.5719 -0.5719 -0.0524 -0.0524 0.1209 0.1209 0.4077 0.4077 0.5739 0.5739 0.7498 0.7498 0.9107 0.9107 1.5283 1.5283 1.6761 1.6761 4.7517 4.7517 5.0027 5.0027 5.2871 5.2871 5.3631 5.3631 5.7698 5.7698 6.0347 6.0347 7.0349 7.0349 k = 0.2083 0.0264 0.0111 ( 11764 PWs) bands (ev): -14.0609 -14.0609 -13.9835 -13.9835 -12.5829 -12.5829 -12.5018 -12.5018 -10.9340 -10.9340 -10.8370 -10.8370 -9.9466 -9.9466 -9.8770 -9.8770 -8.1004 -8.1004 -8.0736 -8.0736 -7.8738 -7.8738 -7.8581 -7.8581 -5.2481 -5.2481 -5.1707 -5.1707 -4.4665 -4.4665 -4.3801 -4.3801 -3.0846 -3.0846 -3.0058 -3.0058 -2.7555 -2.7555 -2.6262 -2.6262 -2.0349 -2.0349 -1.8728 -1.8728 -1.6613 -1.6613 -1.5469 -1.5469 -0.8659 -0.8659 -0.5741 -0.5741 -0.0621 -0.0621 0.1167 0.1167 0.3961 0.3961 0.5541 0.5541 0.7337 0.7337 0.8994 0.8994 1.5221 1.5221 1.6800 1.6800 4.7626 4.7626 5.0200 5.0200 5.2889 5.2889 5.3563 5.3563 5.7731 5.7731 6.0307 6.0307 7.0640 7.0640 k = 0.2222 0.0282 0.0118 ( 11770 PWs) bands (ev): -14.0554 -14.0554 -13.9780 -13.9780 -12.5812 -12.5812 -12.5038 -12.5038 -10.9258 -10.9258 -10.8437 -10.8437 -9.9371 -9.9371 -9.8841 -9.8841 -8.1032 -8.1032 -8.0794 -8.0794 -7.8759 -7.8759 -7.8567 -7.8567 -5.2502 -5.2502 -5.1677 -5.1677 -4.4612 -4.4612 -4.3794 -4.3794 -3.0828 -3.0828 -3.0073 -3.0073 -2.7506 -2.7506 -2.6391 -2.6391 -2.0484 -2.0484 -1.8823 -1.8823 -1.6741 -1.6741 -1.5677 -1.5677 -0.8794 -0.8794 -0.5780 -0.5780 -0.0727 -0.0727 0.1130 0.1130 0.3847 0.3847 0.5343 0.5343 0.7182 0.7182 0.8880 0.8880 1.5166 1.5166 1.6832 1.6832 4.7739 4.7739 5.0387 5.0387 5.2921 5.2921 5.3497 5.3497 5.7773 5.7773 6.0256 6.0256 7.0931 7.0931 k = 0.2361 0.0300 0.0126 ( 11783 PWs) bands (ev): -14.0499 -14.0499 -13.9724 -13.9724 -12.5796 -12.5796 -12.5057 -12.5057 -10.9175 -10.9175 -10.8502 -10.8502 -9.9277 -9.9277 -9.8913 -9.8913 -8.1060 -8.1060 -8.0852 -8.0852 -7.8786 -7.8786 -7.8548 -7.8548 -5.2526 -5.2526 -5.1644 -5.1644 -4.4559 -4.4559 -4.3788 -4.3788 -3.0810 -3.0810 -3.0082 -3.0082 -2.7465 -2.7465 -2.6514 -2.6514 -2.0647 -2.0647 -1.8895 -1.8895 -1.6868 -1.6868 -1.5880 -1.5880 -0.8938 -0.8938 -0.5835 -0.5835 -0.0838 -0.0838 0.1097 0.1097 0.3738 0.3738 0.5145 0.5145 0.7035 0.7035 0.8766 0.8766 1.5119 1.5119 1.6857 1.6857 4.7855 4.7855 5.0588 5.0588 5.2967 5.2967 5.3436 5.3436 5.7820 5.7820 6.0195 6.0195 7.1216 7.1216 k = 0.2500 0.0317 0.0133 ( 11787 PWs) bands (ev): -14.0442 -14.0442 -13.9667 -13.9667 -12.5780 -12.5780 -12.5077 -12.5077 -10.9094 -10.9094 -10.8562 -10.8562 -9.9187 -9.9187 -9.8983 -9.8983 -8.1087 -8.1087 -8.0911 -8.0911 -7.8816 -7.8816 -7.8526 -7.8526 -5.2551 -5.2551 -5.1609 -5.1609 -4.4506 -4.4506 -4.3782 -4.3782 -3.0794 -3.0794 -3.0085 -3.0085 -2.7440 -2.7440 -2.6625 -2.6625 -2.0831 -2.0831 -1.8947 -1.8947 -1.6995 -1.6995 -1.6076 -1.6076 -0.9089 -0.9089 -0.5906 -0.5906 -0.0954 -0.0954 0.1064 0.1064 0.3636 0.3636 0.4951 0.4951 0.6895 0.6895 0.8652 0.8652 1.5080 1.5080 1.6876 1.6876 4.7973 4.7973 5.0799 5.0799 5.3022 5.3022 5.3386 5.3386 5.7871 5.7871 6.0125 6.0125 7.1489 7.1489 k = 0.2639 0.0335 0.0140 ( 11790 PWs) bands (ev): -14.0385 -14.0385 -13.9610 -13.9610 -12.5765 -12.5765 -12.5096 -12.5096 -10.9021 -10.9021 -10.8613 -10.8613 -9.9131 -9.9131 -9.9021 -9.9021 -8.1114 -8.1114 -8.0969 -8.0969 -7.8848 -7.8848 -7.8502 -7.8502 -5.2577 -5.2577 -5.1570 -5.1570 -4.4454 -4.4454 -4.3778 -4.3778 -3.0780 -3.0780 -3.0081 -3.0081 -2.7438 -2.7438 -2.6714 -2.6714 -2.1030 -2.1030 -1.8985 -1.8985 -1.7125 -1.7125 -1.6263 -1.6263 -0.9245 -0.9245 -0.5989 -0.5989 -0.1073 -0.1073 0.1029 0.1029 0.3542 0.3542 0.4766 0.4766 0.6764 0.6764 0.8540 0.8540 1.5048 1.5048 1.6888 1.6888 4.8092 4.8092 5.1019 5.1019 5.3077 5.3077 5.3357 5.3357 5.7923 5.7923 6.0047 6.0047 7.1746 7.1746 k = 0.2778 0.0353 0.0148 ( 11786 PWs) bands (ev): -14.0329 -14.0329 -13.9552 -13.9552 -12.5752 -12.5752 -12.5115 -12.5115 -10.8965 -10.8965 -10.8643 -10.8643 -9.9175 -9.9175 -9.8962 -9.8962 -8.1140 -8.1140 -8.1027 -8.1027 -7.8881 -7.8881 -7.8478 -7.8478 -5.2603 -5.2603 -5.1530 -5.1530 -4.4404 -4.4404 -4.3775 -4.3775 -3.0767 -3.0767 -3.0070 -3.0070 -2.7472 -2.7472 -2.6769 -2.6769 -2.1238 -2.1238 -1.9012 -1.9012 -1.7257 -1.7257 -1.6438 -1.6438 -0.9404 -0.9404 -0.6084 -0.6084 -0.1195 -0.1195 0.0991 0.0991 0.3453 0.3453 0.4594 0.4594 0.6642 0.6642 0.8430 0.8430 1.5022 1.5022 1.6894 1.6894 4.8211 4.8211 5.1245 5.1245 5.3110 5.3110 5.3372 5.3372 5.7974 5.7974 5.9963 5.9963 7.1982 7.1982 k = 0.2917 0.0370 0.0155 ( 11786 PWs) bands (ev): -14.0273 -14.0273 -13.9495 -13.9495 -12.5740 -12.5740 -12.5133 -12.5133 -10.8945 -10.8945 -10.8635 -10.8635 -9.9249 -9.9249 -9.8875 -9.8875 -8.1166 -8.1166 -8.1084 -8.1084 -7.8915 -7.8915 -7.8454 -7.8454 -5.2630 -5.2630 -5.1488 -5.1488 -4.4355 -4.4355 -4.3772 -4.3772 -3.0756 -3.0756 -3.0053 -3.0053 -2.7543 -2.7543 -2.6787 -2.6787 -2.1447 -2.1447 -1.9033 -1.9033 -1.7393 -1.7393 -1.6600 -1.6600 -0.9565 -0.9565 -0.6187 -0.6187 -0.1319 -0.1319 0.0948 0.0948 0.3367 0.3367 0.4442 0.4442 0.6528 0.6528 0.8322 0.8322 1.5001 1.5001 1.6895 1.6895 4.8327 4.8327 5.1472 5.1472 5.3111 5.3111 5.3445 5.3445 5.8022 5.8022 5.9874 5.9874 7.2194 7.2194 k = 0.3056 0.0388 0.0163 ( 11784 PWs) bands (ev): -14.0217 -14.0217 -13.9439 -13.9439 -12.5730 -12.5730 -12.5150 -12.5150 -10.8963 -10.8963 -10.8587 -10.8587 -9.9328 -9.9328 -9.8786 -9.8786 -8.1190 -8.1190 -8.1140 -8.1140 -7.8949 -7.8949 -7.8431 -7.8431 -5.2656 -5.2656 -5.1446 -5.1446 -4.4308 -4.4308 -4.3771 -4.3771 -3.0745 -3.0745 -3.0030 -3.0030 -2.7646 -2.7646 -2.6774 -2.6774 -2.1654 -2.1654 -1.9051 -1.9051 -1.7532 -1.7532 -1.6748 -1.6748 -0.9726 -0.9726 -0.6295 -0.6295 -0.1445 -0.1445 0.0902 0.0902 0.3283 0.3283 0.4314 0.4314 0.6424 0.6424 0.8216 0.8216 1.4985 1.4985 1.6892 1.6892 4.8440 4.8440 5.1699 5.1699 5.3095 5.3095 5.3558 5.3558 5.8062 5.8062 5.9784 5.9784 7.2379 7.2379 k = 0.3194 0.0405 0.0170 ( 11778 PWs) bands (ev): -14.0163 -14.0163 -13.9384 -13.9384 -12.5722 -12.5722 -12.5166 -12.5166 -10.9003 -10.9003 -10.8516 -10.8516 -9.9408 -9.9408 -9.8699 -9.8699 -8.1213 -8.1213 -8.1193 -8.1193 -7.8982 -7.8982 -7.8407 -7.8407 -5.2682 -5.2682 -5.1403 -5.1403 -4.4264 -4.4264 -4.3770 -4.3770 -3.0734 -3.0734 -3.0002 -3.0002 -2.7769 -2.7769 -2.6742 -2.6742 -2.1856 -2.1856 -1.9068 -1.9068 -1.7672 -1.7672 -1.6882 -1.6882 -0.9885 -0.9885 -0.6406 -0.6406 -0.1573 -0.1573 0.0852 0.0852 0.3196 0.3196 0.4214 0.4214 0.6328 0.6328 0.8113 0.8113 1.4972 1.4972 1.6885 1.6885 4.8547 4.8547 5.1921 5.1921 5.3079 5.3079 5.3697 5.3697 5.8093 5.8093 5.9694 5.9694 7.2536 7.2536 k = 0.3333 0.0423 0.0177 ( 11779 PWs) bands (ev): -14.0112 -14.0112 -13.9331 -13.9331 -12.5716 -12.5716 -12.5180 -12.5180 -10.9050 -10.9050 -10.8436 -10.8436 -9.9488 -9.9488 -9.8615 -9.8615 -8.1245 -8.1245 -8.1234 -8.1234 -7.9014 -7.9014 -7.8384 -7.8384 -5.2706 -5.2706 -5.1361 -5.1361 -4.4222 -4.4222 -4.3770 -4.3770 -3.0724 -3.0724 -2.9971 -2.9971 -2.7903 -2.7903 -2.6698 -2.6698 -2.2048 -2.2048 -1.9085 -1.9085 -1.7810 -1.7810 -1.7003 -1.7003 -1.0041 -1.0041 -0.6516 -0.6516 -0.1701 -0.1701 0.0797 0.0797 0.3105 0.3105 0.4145 0.4145 0.6240 0.6240 0.8013 0.8013 1.4963 1.4963 1.6876 1.6876 4.8647 4.8647 5.2135 5.2135 5.3068 5.3068 5.3854 5.3854 5.8111 5.8111 5.9608 5.9608 7.2666 7.2666 k = 0.3472 0.0441 0.0185 ( 11771 PWs) bands (ev): -14.0062 -14.0062 -13.9280 -13.9280 -12.5712 -12.5712 -12.5192 -12.5192 -10.9100 -10.9100 -10.8353 -10.8353 -9.9566 -9.9566 -9.8534 -9.8534 -8.1294 -8.1294 -8.1255 -8.1255 -7.9045 -7.9045 -7.8363 -7.8363 -5.2730 -5.2730 -5.1320 -5.1320 -4.4184 -4.4184 -4.3770 -4.3770 -3.0712 -3.0712 -2.9937 -2.9937 -2.8041 -2.8041 -2.6648 -2.6648 -2.2229 -2.2229 -1.9104 -1.9104 -1.7944 -1.7944 -1.7112 -1.7112 -1.0191 -1.0191 -0.6624 -0.6624 -0.1830 -0.1830 0.0739 0.0739 0.3012 0.3012 0.4105 0.4105 0.6161 0.6161 0.7916 0.7916 1.4956 1.4956 1.6865 1.6865 4.8738 4.8738 5.2336 5.2336 5.3067 5.3067 5.4026 5.4026 5.8112 5.8112 5.9530 5.9530 7.2771 7.2771 k = 0.3611 0.0458 0.0192 ( 11770 PWs) bands (ev): -14.0015 -14.0015 -13.9232 -13.9232 -12.5710 -12.5710 -12.5203 -12.5203 -10.9148 -10.9148 -10.8271 -10.8271 -9.9641 -9.9641 -9.8459 -9.8459 -8.1340 -8.1340 -8.1274 -8.1274 -7.9075 -7.9075 -7.8342 -7.8342 -5.2752 -5.2752 -5.1280 -5.1280 -4.4148 -4.4148 -4.3771 -4.3771 -3.0698 -3.0698 -2.9902 -2.9902 -2.8181 -2.8181 -2.6597 -2.6597 -2.2398 -2.2398 -1.9126 -1.9126 -1.8071 -1.8071 -1.7210 -1.7210 -1.0335 -1.0335 -0.6726 -0.6726 -0.1956 -0.1956 0.0679 0.0679 0.2919 0.2919 0.4090 0.4090 0.6091 0.6091 0.7822 0.7822 1.4951 1.4951 1.6852 1.6852 4.8821 4.8821 5.2522 5.2522 5.3077 5.3077 5.4208 5.4208 5.8094 5.8094 5.9464 5.9464 7.2851 7.2851 k = 0.3750 0.0476 0.0200 ( 11765 PWs) bands (ev): -13.9971 -13.9971 -13.9187 -13.9187 -12.5710 -12.5710 -12.5211 -12.5211 -10.9194 -10.9194 -10.8191 -10.8191 -9.9712 -9.9712 -9.8389 -9.8389 -8.1383 -8.1383 -8.1291 -8.1291 -7.9103 -7.9103 -7.8323 -7.8323 -5.2772 -5.2772 -5.1242 -5.1242 -4.4116 -4.4116 -4.3772 -4.3772 -3.0682 -3.0682 -2.9866 -2.9866 -2.8319 -2.8319 -2.6546 -2.6546 -2.2551 -2.2551 -1.9150 -1.9150 -1.8188 -1.8188 -1.7299 -1.7299 -1.0470 -1.0470 -0.6822 -0.6822 -0.2079 -0.2079 0.0618 0.0618 0.2829 0.2829 0.4097 0.4097 0.6028 0.6028 0.7733 0.7733 1.4947 1.4947 1.6839 1.6839 4.8894 4.8894 5.2687 5.2687 5.3101 5.3101 5.4398 5.4398 5.8055 5.8055 5.9411 5.9411 7.2911 7.2911 k = 0.3889 0.0494 0.0207 ( 11768 PWs) bands (ev): -13.9931 -13.9931 -13.9146 -13.9146 -12.5711 -12.5711 -12.5218 -12.5218 -10.9236 -10.9236 -10.8116 -10.8116 -9.9780 -9.9780 -9.8325 -9.8325 -8.1422 -8.1422 -8.1306 -8.1306 -7.9129 -7.9129 -7.8306 -7.8306 -5.2791 -5.2791 -5.1206 -5.1206 -4.4087 -4.4087 -4.3774 -4.3774 -3.0664 -3.0664 -2.9830 -2.9830 -2.8452 -2.8452 -2.6497 -2.6497 -2.2690 -2.2690 -1.9176 -1.9176 -1.8295 -1.8295 -1.7378 -1.7378 -1.0595 -1.0595 -0.6910 -0.6910 -0.2196 -0.2196 0.0558 0.0558 0.2744 0.2744 0.4121 0.4121 0.5972 0.5972 0.7648 0.7648 1.4944 1.4944 1.6825 1.6825 4.8957 4.8957 5.2825 5.2825 5.3143 5.3143 5.4591 5.4591 5.7997 5.7997 5.9372 5.9372 7.2953 7.2953 k = 0.4028 0.0511 0.0214 ( 11762 PWs) bands (ev): -13.9894 -13.9894 -13.9108 -13.9108 -12.5713 -12.5713 -12.5224 -12.5224 -10.9275 -10.9275 -10.8047 -10.8047 -9.9842 -9.9842 -9.8267 -9.8267 -8.1457 -8.1457 -8.1320 -8.1320 -7.9153 -7.9153 -7.8290 -7.8290 -5.2808 -5.2808 -5.1173 -5.1173 -4.4062 -4.4062 -4.3775 -4.3775 -3.0644 -3.0644 -2.9795 -2.9795 -2.8579 -2.8579 -2.6452 -2.6452 -2.2812 -2.2812 -1.9205 -1.9205 -1.8388 -1.8388 -1.7448 -1.7448 -1.0709 -1.0709 -0.6989 -0.6989 -0.2306 -0.2306 0.0500 0.0500 0.2666 0.2666 0.4155 0.4155 0.5923 0.5923 0.7568 0.7568 1.4942 1.4942 1.6812 1.6812 4.9011 4.9011 5.2928 5.2928 5.3209 5.3209 5.4783 5.4783 5.7921 5.7921 5.9346 5.9346 7.2981 7.2981 k = 0.4167 0.0529 0.0222 ( 11767 PWs) bands (ev): -13.9862 -13.9862 -13.9075 -13.9075 -12.5716 -12.5716 -12.5228 -12.5228 -10.9309 -10.9309 -10.7985 -10.7985 -9.9897 -9.9897 -9.8216 -9.8216 -8.1488 -8.1488 -8.1332 -8.1332 -7.9174 -7.9174 -7.8276 -7.8276 -5.2822 -5.2822 -5.1144 -5.1144 -4.4041 -4.4041 -4.3776 -4.3776 -3.0622 -3.0622 -2.9763 -2.9763 -2.8697 -2.8697 -2.6411 -2.6411 -2.2918 -2.2918 -1.9234 -1.9234 -1.8469 -1.8469 -1.7509 -1.7509 -1.0810 -1.0810 -0.7058 -0.7058 -0.2406 -0.2406 0.0446 0.0446 0.2598 0.2598 0.4196 0.4196 0.5881 0.5881 0.7495 0.7495 1.4941 1.4941 1.6800 1.6800 4.9055 4.9055 5.2998 5.2998 5.3294 5.3294 5.4970 5.4970 5.7833 5.7833 5.9330 5.9330 7.2997 7.2997 k = 0.4306 0.0546 0.0229 ( 11758 PWs) bands (ev): -13.9834 -13.9834 -13.9046 -13.9046 -12.5720 -12.5720 -12.5231 -12.5231 -10.9338 -10.9338 -10.7930 -10.7930 -9.9946 -9.9946 -9.8173 -9.8173 -8.1514 -8.1514 -8.1342 -8.1342 -7.9193 -7.9193 -7.8263 -7.8263 -5.2835 -5.2835 -5.1119 -5.1119 -4.4023 -4.4023 -4.3776 -4.3776 -3.0600 -3.0600 -2.9733 -2.9733 -2.8804 -2.8804 -2.6376 -2.6376 -2.3007 -2.3007 -1.9263 -1.9263 -1.8536 -1.8536 -1.7562 -1.7562 -1.0898 -1.0898 -0.7117 -0.7117 -0.2494 -0.2494 0.0397 0.0397 0.2540 0.2540 0.4240 0.4240 0.5845 0.5845 0.7430 0.7430 1.4940 1.4940 1.6790 1.6790 4.9090 4.9090 5.3045 5.3045 5.3383 5.3383 5.5147 5.5147 5.7737 5.7737 5.9322 5.9322 7.3004 7.3004 k = 0.4444 0.0564 0.0236 ( 11765 PWs) bands (ev): -13.9811 -13.9811 -13.9022 -13.9022 -12.5723 -12.5723 -12.5233 -12.5233 -10.9363 -10.9363 -10.7884 -10.7884 -9.9987 -9.9987 -9.8136 -9.8136 -8.1536 -8.1536 -8.1350 -8.1350 -7.9208 -7.9208 -7.8253 -7.8253 -5.2845 -5.2845 -5.1097 -5.1097 -4.4009 -4.4009 -4.3777 -4.3777 -3.0578 -3.0578 -2.9708 -2.9708 -2.8898 -2.8898 -2.6346 -2.6346 -2.3079 -2.3079 -1.9290 -1.9290 -1.8589 -1.8589 -1.7605 -1.7605 -1.0970 -1.0970 -0.7165 -0.7165 -0.2568 -0.2568 0.0354 0.0354 0.2491 0.2491 0.4283 0.4283 0.5814 0.5814 0.7375 0.7375 1.4939 1.4939 1.6781 1.6781 4.9118 4.9118 5.3080 5.3080 5.3466 5.3466 5.5308 5.5308 5.7641 5.7641 5.9318 5.9318 7.3006 7.3006 k = 0.4583 0.0582 0.0244 ( 11774 PWs) bands (ev): -13.9793 -13.9793 -13.9003 -13.9003 -12.5726 -12.5726 -12.5235 -12.5235 -10.9382 -10.9382 -10.7848 -10.7848 -10.0020 -10.0020 -9.8108 -9.8108 -8.1554 -8.1554 -8.1357 -8.1357 -7.9220 -7.9220 -7.8246 -7.8246 -5.2854 -5.2854 -5.1080 -5.1080 -4.3998 -4.3998 -4.3777 -4.3777 -3.0558 -3.0558 -2.9686 -2.9686 -2.8976 -2.8976 -2.6323 -2.6323 -2.3135 -2.3135 -1.9313 -1.9313 -1.8630 -1.8630 -1.7639 -1.7639 -1.1028 -1.1028 -0.7203 -0.7203 -0.2628 -0.2628 0.0320 0.0320 0.2454 0.2454 0.4320 0.4320 0.5790 0.5790 0.7329 0.7329 1.4939 1.4939 1.6773 1.6773 4.9139 4.9139 5.3106 5.3106 5.3534 5.3534 5.5446 5.5446 5.7552 5.7552 5.9318 5.9318 7.3005 7.3005 k = 0.4722 0.0599 0.0251 ( 11775 PWs) bands (ev): -13.9780 -13.9780 -13.8990 -13.8990 -12.5729 -12.5729 -12.5236 -12.5236 -10.9396 -10.9396 -10.7821 -10.7821 -10.0044 -10.0044 -9.8088 -9.8088 -8.1566 -8.1566 -8.1362 -8.1362 -7.9229 -7.9229 -7.8240 -7.8240 -5.2859 -5.2859 -5.1068 -5.1068 -4.3990 -4.3990 -4.3777 -4.3777 -3.0542 -3.0542 -2.9670 -2.9670 -2.9034 -2.9034 -2.6307 -2.6307 -2.3175 -2.3175 -1.9331 -1.9331 -1.8659 -1.8659 -1.7663 -1.7663 -1.1070 -1.1070 -0.7230 -0.7230 -0.2671 -0.2671 0.0295 0.0295 0.2427 0.2427 0.4349 0.4349 0.5773 0.5773 0.7296 0.7296 1.4938 1.4938 1.6768 1.6768 4.9153 4.9153 5.3125 5.3125 5.3585 5.3585 5.5554 5.5554 5.7479 5.7479 5.9319 5.9319 7.3003 7.3003 k = 0.4861 0.0617 0.0259 ( 11781 PWs) bands (ev): -13.9772 -13.9772 -13.8981 -13.8981 -12.5730 -12.5730 -12.5236 -12.5236 -10.9404 -10.9404 -10.7805 -10.7805 -10.0058 -10.0058 -9.8075 -9.8075 -8.1574 -8.1574 -8.1365 -8.1365 -7.9234 -7.9234 -7.8236 -7.8236 -5.2863 -5.2863 -5.1061 -5.1061 -4.3986 -4.3986 -4.3777 -4.3777 -3.0531 -3.0531 -2.9659 -2.9659 -2.9071 -2.9071 -2.6296 -2.6296 -2.3198 -2.3198 -1.9342 -1.9342 -1.8676 -1.8676 -1.7678 -1.7678 -1.1095 -1.1095 -0.7246 -0.7246 -0.2698 -0.2698 0.0279 0.0279 0.2411 0.2411 0.4368 0.4368 0.5762 0.5762 0.7276 0.7276 1.4938 1.4938 1.6764 1.6764 4.9162 4.9162 5.3136 5.3136 5.3616 5.3616 5.5624 5.5624 5.7430 5.7430 5.9319 5.9319 7.3001 7.3001 k = 0.5000 0.0635 0.0266 ( 11782 PWs) bands (ev): -13.9769 -13.9769 -13.8979 -13.8979 -12.5731 -12.5731 -12.5236 -12.5236 -10.9407 -10.9407 -10.7799 -10.7799 -10.0063 -10.0063 -9.8071 -9.8071 -8.1576 -8.1576 -8.1366 -8.1366 -7.9236 -7.9236 -7.8235 -7.8235 -5.2864 -5.2864 -5.1058 -5.1058 -4.3984 -4.3984 -4.3777 -4.3777 -3.0527 -3.0527 -2.9656 -2.9656 -2.9083 -2.9083 -2.6293 -2.6293 -2.3206 -2.3206 -1.9346 -1.9346 -1.8682 -1.8682 -1.7683 -1.7683 -1.1103 -1.1103 -0.7251 -0.7251 -0.2707 -0.2707 0.0274 0.0274 0.2406 0.2406 0.4375 0.4375 0.5759 0.5759 0.7269 0.7269 1.4938 1.4938 1.6763 1.6763 4.9164 4.9164 5.3140 5.3140 5.3626 5.3626 5.5648 5.5648 5.7412 5.7412 5.9320 5.9320 7.3000 7.3000 k = 0.5000-0.3163 0.0237 ( 11762 PWs) bands (ev): -13.9726 -13.9726 -13.8572 -13.8572 -12.5676 -12.5676 -12.5287 -12.5287 -10.9043 -10.9043 -10.8932 -10.8932 -9.9311 -9.9311 -9.8909 -9.8909 -8.2145 -8.2145 -8.1274 -8.1274 -7.9427 -7.9427 -7.8413 -7.8413 -5.2044 -5.2044 -5.1772 -5.1772 -4.5000 -4.5000 -4.3640 -4.3640 -3.0544 -3.0544 -3.0467 -3.0467 -2.6123 -2.6123 -2.5850 -2.5850 -2.3798 -2.3798 -2.2214 -2.2214 -1.7000 -1.7000 -1.6814 -1.6814 -1.0272 -1.0272 -0.6553 -0.6553 -0.1864 -0.1864 -0.1451 -0.1451 0.3688 0.3688 0.4102 0.4102 0.8695 0.8695 0.8890 0.8890 1.4813 1.4813 1.6545 1.6545 4.7758 4.7758 5.1653 5.1653 5.3542 5.3542 5.3960 5.3960 5.8546 5.8546 5.9358 5.9358 6.9343 6.9343 k = 0.4884-0.3090 0.0231 ( 11772 PWs) bands (ev): -13.9727 -13.9727 -13.8574 -13.8574 -12.5677 -12.5677 -12.5287 -12.5287 -10.9046 -10.9046 -10.8925 -10.8925 -9.9312 -9.9312 -9.8907 -9.8907 -8.2143 -8.2143 -8.1273 -8.1273 -7.9426 -7.9426 -7.8415 -7.8415 -5.2047 -5.2047 -5.1765 -5.1765 -4.5002 -4.5002 -4.3641 -4.3641 -3.0580 -3.0580 -3.0431 -3.0431 -2.6136 -2.6136 -2.5841 -2.5841 -2.3793 -2.3793 -2.2206 -2.2206 -1.7000 -1.7000 -1.6812 -1.6812 -1.0267 -1.0267 -0.6547 -0.6547 -0.1856 -0.1856 -0.1438 -0.1438 0.3664 0.3664 0.4126 0.4126 0.8673 0.8673 0.8898 0.8898 1.4817 1.4817 1.6547 1.6547 4.7759 4.7759 5.1642 5.1642 5.3533 5.3533 5.3981 5.3981 5.8535 5.8535 5.9358 5.9358 6.9341 6.9341 k = 0.4767-0.3016 0.0226 ( 11779 PWs) bands (ev): -13.9733 -13.9733 -13.8579 -13.8579 -12.5682 -12.5682 -12.5289 -12.5289 -10.9055 -10.9055 -10.8909 -10.8909 -9.9317 -9.9317 -9.8901 -9.8901 -8.2137 -8.2137 -8.1270 -8.1270 -7.9425 -7.9425 -7.8422 -7.8422 -5.2056 -5.2056 -5.1746 -5.1746 -4.5009 -4.5009 -4.3643 -4.3643 -3.0637 -3.0637 -3.0373 -3.0373 -2.6172 -2.6172 -2.5821 -2.5821 -2.3779 -2.3779 -2.2183 -2.2183 -1.6998 -1.6998 -1.6803 -1.6803 -1.0251 -1.0251 -0.6530 -0.6530 -0.1833 -0.1833 -0.1400 -0.1400 0.3602 0.3602 0.4186 0.4186 0.8613 0.8613 0.8913 0.8913 1.4830 1.4830 1.6553 1.6553 4.7759 4.7759 5.1608 5.1608 5.3511 5.3511 5.4039 5.4039 5.8500 5.8500 5.9358 5.9358 6.9335 6.9335 k = 0.4651-0.2943 0.0220 ( 11777 PWs) bands (ev): -13.9742 -13.9742 -13.8589 -13.8589 -12.5689 -12.5689 -12.5292 -12.5292 -10.9065 -10.9065 -10.8886 -10.8886 -9.9323 -9.9323 -9.8891 -9.8891 -8.2128 -8.2128 -8.1266 -8.1266 -7.9424 -7.9424 -7.8433 -7.8433 -5.2067 -5.2067 -5.1716 -5.1716 -4.5019 -4.5019 -4.3648 -4.3648 -3.0694 -3.0694 -3.0314 -3.0314 -2.6222 -2.6222 -2.5794 -2.5794 -2.3754 -2.3754 -2.2144 -2.2144 -1.6996 -1.6996 -1.6789 -1.6789 -1.0224 -1.0224 -0.6502 -0.6502 -0.1793 -0.1793 -0.1336 -0.1336 0.3520 0.3520 0.4264 0.4264 0.8530 0.8530 0.8922 0.8922 1.4851 1.4851 1.6564 1.6564 4.7760 4.7760 5.1553 5.1553 5.3485 5.3485 5.4124 5.4124 5.8443 5.8443 5.9359 5.9359 6.9326 6.9326 k = 0.4535-0.2869 0.0215 ( 11794 PWs) bands (ev): -13.9755 -13.9755 -13.8602 -13.8602 -12.5698 -12.5698 -12.5295 -12.5295 -10.9074 -10.9074 -10.8859 -10.8859 -9.9330 -9.9330 -9.8879 -9.8879 -8.2115 -8.2115 -8.1260 -8.1260 -7.9422 -7.9422 -7.8449 -7.8449 -5.2079 -5.2079 -5.1680 -5.1680 -4.5032 -4.5032 -4.3654 -4.3654 -3.0748 -3.0748 -3.0258 -3.0258 -2.6283 -2.6283 -2.5767 -2.5767 -2.3717 -2.3717 -2.2090 -2.2090 -1.6995 -1.6995 -1.6768 -1.6768 -1.0186 -1.0186 -0.6463 -0.6463 -0.1738 -0.1738 -0.1249 -0.1249 0.3430 0.3430 0.4351 0.4351 0.8430 0.8430 0.8921 0.8921 1.4879 1.4879 1.6578 1.6578 4.7761 4.7761 5.1480 5.1480 5.3458 5.3458 5.4228 5.4228 5.8364 5.8364 5.9360 5.9360 6.9313 6.9313 k = 0.4419-0.2795 0.0209 ( 11791 PWs) bands (ev): -13.9771 -13.9771 -13.8619 -13.8619 -12.5709 -12.5709 -12.5300 -12.5300 -10.9081 -10.9081 -10.8830 -10.8830 -9.9338 -9.9338 -9.8866 -9.8866 -8.2099 -8.2099 -8.1252 -8.1252 -7.9419 -7.9419 -7.8468 -7.8468 -5.2090 -5.2090 -5.1638 -5.1638 -4.5047 -4.5047 -4.3664 -4.3664 -3.0798 -3.0798 -3.0205 -3.0205 -2.6351 -2.6351 -2.5742 -2.5742 -2.3667 -2.3667 -2.2023 -2.2023 -1.6996 -1.6996 -1.6739 -1.6739 -1.0138 -1.0138 -0.6414 -0.6414 -0.1667 -0.1667 -0.1140 -0.1140 0.3337 0.3337 0.4442 0.4442 0.8314 0.8314 0.8910 0.8910 1.4914 1.4914 1.6596 1.6596 4.7762 4.7762 5.1392 5.1392 5.3434 5.3434 5.4345 5.4345 5.8266 5.8266 5.9360 5.9360 6.9297 6.9297 k = 0.4302-0.2722 0.0204 ( 11787 PWs) bands (ev): -13.9791 -13.9791 -13.8640 -13.8640 -12.5722 -12.5722 -12.5305 -12.5305 -10.9085 -10.9085 -10.8801 -10.8801 -9.9344 -9.9344 -9.8852 -9.8852 -8.2080 -8.2080 -8.1243 -8.1243 -7.9415 -7.9415 -7.8490 -7.8490 -5.2100 -5.2100 -5.1593 -5.1593 -4.5063 -4.5063 -4.3677 -4.3677 -3.0843 -3.0843 -3.0159 -3.0159 -2.6423 -2.6423 -2.5719 -2.5719 -2.3602 -2.3602 -2.1943 -2.1943 -1.7001 -1.7001 -1.6704 -1.6704 -1.0079 -1.0079 -0.6356 -0.6356 -0.1580 -0.1580 -0.1011 -0.1011 0.3243 0.3243 0.4536 0.4536 0.8187 0.8187 0.8887 0.8887 1.4954 1.4954 1.6616 1.6616 4.7763 4.7763 5.1291 5.1291 5.3414 5.3414 5.4471 5.4471 5.8149 5.8149 5.9360 5.9360 6.9277 6.9277 k = 0.4186-0.2648 0.0198 ( 11787 PWs) bands (ev): -13.9814 -13.9814 -13.8664 -13.8664 -12.5736 -12.5736 -12.5312 -12.5312 -10.9086 -10.9086 -10.8771 -10.8771 -9.9350 -9.9350 -9.8838 -9.8838 -8.2058 -8.2058 -8.1231 -8.1231 -7.9411 -7.9411 -7.8515 -7.8515 -5.2108 -5.2108 -5.1545 -5.1545 -4.5079 -4.5079 -4.3695 -4.3695 -3.0882 -3.0882 -3.0118 -3.0118 -2.6498 -2.6498 -2.5702 -2.5702 -2.3523 -2.3523 -2.1851 -2.1851 -1.7011 -1.7011 -1.6661 -1.6661 -1.0010 -1.0010 -0.6290 -0.6290 -0.1479 -0.1479 -0.0863 -0.0863 0.3151 0.3151 0.4632 0.4632 0.8049 0.8049 0.8854 0.8854 1.4999 1.4999 1.6638 1.6638 4.7764 4.7764 5.1180 5.1180 5.3398 5.3398 5.4602 5.4602 5.8017 5.8017 5.9360 5.9360 6.9253 6.9253 k = 0.4070-0.2575 0.0193 ( 11779 PWs) bands (ev): -13.9840 -13.9840 -13.8693 -13.8693 -12.5750 -12.5750 -12.5320 -12.5320 -10.9084 -10.9084 -10.8743 -10.8743 -9.9352 -9.9352 -9.8826 -9.8826 -8.2033 -8.2033 -8.1218 -8.1218 -7.9405 -7.9405 -7.8542 -7.8542 -5.2114 -5.2114 -5.1496 -5.1496 -4.5094 -4.5094 -4.3717 -4.3717 -3.0915 -3.0915 -3.0085 -3.0085 -2.6573 -2.6573 -2.5688 -2.5688 -2.3427 -2.3427 -2.1748 -2.1748 -1.7025 -1.7025 -1.6611 -1.6611 -0.9930 -0.9930 -0.6217 -0.6217 -0.1363 -0.1363 -0.0698 -0.0698 0.3062 0.3062 0.4730 0.4730 0.7903 0.7903 0.8814 0.8814 1.5046 1.5046 1.6661 1.6661 4.7764 4.7764 5.1059 5.1059 5.3386 5.3386 5.4734 5.4734 5.7871 5.7871 5.9360 5.9360 6.9225 6.9225 k = 0.3953-0.2501 0.0187 ( 11768 PWs) bands (ev): -13.9870 -13.9870 -13.8724 -13.8724 -12.5765 -12.5765 -12.5329 -12.5329 -10.9078 -10.9078 -10.8716 -10.8716 -9.9352 -9.9352 -9.8815 -9.8815 -8.2006 -8.2006 -8.1202 -8.1202 -7.9399 -7.9399 -7.8570 -7.8570 -5.2117 -5.2117 -5.1447 -5.1447 -4.5108 -4.5108 -4.3744 -4.3744 -3.0942 -3.0942 -3.0060 -3.0060 -2.6646 -2.6646 -2.5680 -2.5680 -2.3315 -2.3315 -2.1634 -2.1634 -1.7046 -1.7046 -1.6555 -1.6555 -0.9840 -0.9840 -0.6138 -0.6138 -0.1236 -0.1236 -0.0520 -0.0520 0.2980 0.2980 0.4829 0.4829 0.7750 0.7750 0.8766 0.8766 1.5096 1.5096 1.6685 1.6685 4.7764 4.7764 5.0930 5.0930 5.3379 5.3379 5.4863 5.4863 5.7717 5.7717 5.9360 5.9360 6.9192 6.9192 k = 0.3837-0.2428 0.0182 ( 11773 PWs) bands (ev): -13.9902 -13.9902 -13.8760 -13.8760 -12.5779 -12.5779 -12.5339 -12.5339 -10.9071 -10.9071 -10.8692 -10.8692 -9.9348 -9.9348 -9.8806 -9.8806 -8.1976 -8.1976 -8.1185 -8.1185 -7.9393 -7.9393 -7.8598 -7.8598 -5.2119 -5.2119 -5.1399 -5.1399 -4.5118 -4.5118 -4.3777 -4.3777 -3.0963 -3.0963 -3.0042 -3.0042 -2.6716 -2.6716 -2.5677 -2.5677 -2.3188 -2.3188 -2.1509 -2.1509 -1.7072 -1.7072 -1.6493 -1.6493 -0.9742 -0.9742 -0.6054 -0.6054 -0.1098 -0.1098 -0.0330 -0.0330 0.2904 0.2904 0.4929 0.4929 0.7592 0.7592 0.8714 0.8714 1.5146 1.5146 1.6710 1.6710 4.7762 4.7762 5.0796 5.0796 5.3377 5.3377 5.4985 5.4985 5.7558 5.7558 5.9360 5.9360 6.9155 6.9155 k = 0.3721-0.2354 0.0176 ( 11766 PWs) bands (ev): -13.9936 -13.9936 -13.8799 -13.8799 -12.5792 -12.5792 -12.5349 -12.5349 -10.9060 -10.9060 -10.8671 -10.8671 -9.9341 -9.9341 -9.8799 -9.8799 -8.1944 -8.1944 -8.1166 -8.1166 -7.9385 -7.9385 -7.8627 -7.8627 -5.2120 -5.2120 -5.1351 -5.1351 -4.5125 -4.5125 -4.3814 -4.3814 -3.0979 -3.0979 -3.0031 -3.0031 -2.6781 -2.6781 -2.5679 -2.5679 -2.3047 -2.3047 -2.1375 -2.1375 -1.7103 -1.7103 -1.6426 -1.6426 -0.9635 -0.9635 -0.5966 -0.5966 -0.0951 -0.0951 -0.0132 -0.0132 0.2839 0.2839 0.5030 0.5030 0.7433 0.7433 0.8660 0.8660 1.5196 1.5196 1.6733 1.6733 4.7760 4.7760 5.0655 5.0655 5.3379 5.3379 5.5096 5.5096 5.7401 5.7401 5.9360 5.9360 6.9113 6.9113 k = 0.3605-0.2280 0.0171 ( 11778 PWs) bands (ev): -13.9974 -13.9974 -13.8841 -13.8841 -12.5804 -12.5804 -12.5361 -12.5361 -10.9048 -10.9048 -10.8652 -10.8652 -9.9331 -9.9331 -9.8796 -9.8796 -8.1910 -8.1910 -8.1146 -8.1146 -7.9376 -7.9376 -7.8655 -7.8655 -5.2121 -5.2121 -5.1306 -5.1306 -4.5129 -4.5129 -4.3856 -4.3856 -3.0991 -3.0991 -3.0027 -3.0027 -2.6839 -2.6839 -2.5686 -2.5686 -2.2891 -2.2891 -2.1231 -2.1231 -1.7139 -1.7139 -1.6356 -1.6356 -0.9520 -0.9520 -0.5876 -0.5876 -0.0799 -0.0799 0.0073 0.0073 0.2784 0.2784 0.5131 0.5131 0.7273 0.7273 0.8606 0.8606 1.5245 1.5245 1.6756 1.6756 4.7756 4.7756 5.0511 5.0511 5.3384 5.3384 5.5188 5.5188 5.7256 5.7256 5.9359 5.9359 6.9065 6.9065 k = 0.3488-0.2207 0.0165 ( 11785 PWs) bands (ev): -14.0013 -14.0013 -13.8887 -13.8887 -12.5814 -12.5814 -12.5373 -12.5373 -10.9035 -10.9035 -10.8636 -10.8636 -9.9317 -9.9317 -9.8795 -9.8795 -8.1875 -8.1875 -8.1123 -8.1123 -7.9366 -7.9366 -7.8681 -7.8681 -5.2120 -5.2120 -5.1264 -5.1264 -4.5128 -4.5128 -4.3902 -4.3902 -3.1000 -3.1000 -3.0028 -3.0028 -2.6889 -2.6889 -2.5699 -2.5699 -2.2723 -2.2723 -2.1078 -2.1078 -1.7180 -1.7180 -1.6282 -1.6282 -0.9398 -0.9398 -0.5784 -0.5784 -0.0645 -0.0645 0.0281 0.0281 0.2743 0.2743 0.5233 0.5233 0.7118 0.7118 0.8554 0.8554 1.5291 1.5291 1.6777 1.6777 4.7751 4.7751 5.0363 5.0363 5.3391 5.3391 5.5255 5.5255 5.7132 5.7132 5.9357 5.9357 6.9010 6.9010 k = 0.3372-0.2133 0.0160 ( 11782 PWs) bands (ev): -14.0054 -14.0054 -13.8936 -13.8936 -12.5822 -12.5822 -12.5385 -12.5385 -10.9021 -10.9021 -10.8623 -10.8623 -9.9301 -9.9301 -9.8797 -9.8797 -8.1837 -8.1837 -8.1099 -8.1099 -7.9354 -7.9354 -7.8706 -7.8706 -5.2120 -5.2120 -5.1225 -5.1225 -4.5123 -4.5123 -4.3951 -4.3951 -3.1006 -3.1006 -3.0034 -3.0034 -2.6929 -2.6929 -2.5716 -2.5716 -2.2543 -2.2543 -2.0916 -2.0916 -1.7222 -1.7222 -1.6207 -1.6207 -0.9270 -0.9270 -0.5693 -0.5693 -0.0491 -0.0491 0.0490 0.0490 0.2716 0.2716 0.5332 0.5332 0.6971 0.6971 0.8506 0.8506 1.5335 1.5335 1.6795 1.6795 4.7744 4.7744 5.0213 5.0213 5.3399 5.3399 5.5289 5.5289 5.7040 5.7040 5.9354 5.9354 6.8949 6.8949 k = 0.3256-0.2060 0.0154 ( 11790 PWs) bands (ev): -14.0098 -14.0098 -13.8987 -13.8987 -12.5828 -12.5828 -12.5397 -12.5397 -10.9009 -10.9009 -10.8612 -10.8612 -9.9282 -9.9282 -9.8802 -9.8802 -8.1799 -8.1799 -8.1073 -8.1073 -7.9341 -7.9341 -7.8728 -7.8728 -5.2120 -5.2120 -5.1191 -5.1191 -4.5114 -4.5114 -4.4003 -4.4003 -3.1012 -3.1012 -3.0043 -3.0043 -2.6960 -2.6960 -2.5738 -2.5738 -2.2354 -2.2354 -2.0746 -2.0746 -1.7267 -1.7267 -1.6131 -1.6131 -0.9137 -0.9137 -0.5604 -0.5604 -0.0343 -0.0343 0.0698 0.0698 0.2704 0.2704 0.5429 0.5429 0.6837 0.6837 0.8466 0.8466 1.5377 1.5377 1.6812 1.6812 4.7735 4.7735 5.0062 5.0062 5.3405 5.3405 5.5288 5.5288 5.6988 5.6988 5.9347 5.9347 6.8881 6.8881 k = 0.3140-0.1986 0.0149 ( 11785 PWs) bands (ev): -14.0143 -14.0143 -13.9042 -13.9042 -12.5832 -12.5832 -12.5409 -12.5409 -10.8999 -10.8999 -10.8601 -10.8601 -9.9262 -9.9262 -9.8808 -9.8808 -8.1758 -8.1758 -8.1046 -8.1046 -7.9325 -7.9325 -7.8747 -7.8747 -5.2121 -5.2121 -5.1162 -5.1162 -4.5100 -4.5100 -4.4056 -4.4056 -3.1017 -3.1017 -3.0054 -3.0054 -2.6981 -2.6981 -2.5765 -2.5765 -2.2156 -2.2156 -2.0568 -2.0568 -1.7310 -1.7310 -1.6056 -1.6056 -0.9001 -0.9001 -0.5519 -0.5519 -0.0203 -0.0203 0.0902 0.0902 0.2708 0.2708 0.5519 0.5519 0.6723 0.6723 0.8435 0.8435 1.5415 1.5415 1.6825 1.6825 4.7724 4.7724 4.9912 4.9912 5.3405 5.3405 5.5254 5.5254 5.6979 5.6979 5.9336 5.9336 6.8807 6.8807 k = 0.3023-0.1913 0.0143 ( 11784 PWs) bands (ev): -14.0189 -14.0189 -13.9099 -13.9099 -12.5833 -12.5833 -12.5420 -12.5420 -10.8994 -10.8994 -10.8589 -10.8589 -9.9244 -9.9244 -9.8814 -9.8814 -8.1717 -8.1717 -8.1018 -8.1018 -7.9308 -7.9308 -7.8764 -7.8764 -5.2122 -5.2122 -5.1138 -5.1138 -4.5082 -4.5082 -4.4111 -4.4111 -3.1023 -3.1023 -3.0066 -3.0066 -2.6991 -2.6991 -2.5797 -2.5797 -2.1953 -2.1953 -2.0382 -2.0382 -1.7352 -1.7352 -1.5982 -1.5982 -0.8861 -0.8861 -0.5438 -0.5438 -0.0074 -0.0074 0.1098 0.1098 0.2728 0.2728 0.5598 0.5598 0.6638 0.6638 0.8414 0.8414 1.5450 1.5450 1.6835 1.6835 4.7711 4.7711 4.9765 4.9765 5.3397 5.3397 5.5197 5.5197 5.7009 5.7009 5.9320 5.9320 6.8727 6.8727 k = 0.2907-0.1839 0.0138 ( 11780 PWs) bands (ev): -14.0236 -14.0236 -13.9158 -13.9158 -12.5833 -12.5833 -12.5429 -12.5429 -10.8996 -10.8996 -10.8574 -10.8574 -9.9229 -9.9229 -9.8819 -9.8819 -8.1674 -8.1674 -8.0988 -8.0988 -7.9288 -7.9288 -7.8778 -7.8778 -5.2124 -5.2124 -5.1121 -5.1121 -4.5061 -4.5061 -4.4165 -4.4165 -3.1029 -3.1029 -3.0079 -3.0079 -2.6990 -2.6990 -2.5833 -2.5833 -2.1745 -2.1745 -2.0189 -2.0189 -1.7389 -1.7389 -1.5911 -1.5911 -0.8720 -0.8720 -0.5365 -0.5365 0.0041 0.0041 0.1281 0.1281 0.2766 0.2766 0.5660 0.5660 0.6591 0.6591 0.8405 0.8405 1.5482 1.5482 1.6841 1.6841 4.7695 4.7695 4.9621 4.9621 5.3376 5.3376 5.5132 5.5132 5.7068 5.7068 5.9298 5.9298 6.8643 6.8643 k = 0.2791-0.1766 0.0132 ( 11776 PWs) bands (ev): -14.0284 -14.0284 -13.9218 -13.9218 -12.5831 -12.5831 -12.5436 -12.5436 -10.9005 -10.9005 -10.8555 -10.8555 -9.9221 -9.9221 -9.8820 -9.8820 -8.1630 -8.1630 -8.0956 -8.0956 -7.9266 -7.9266 -7.8789 -7.8789 -5.2127 -5.2127 -5.1111 -5.1111 -4.5037 -4.5037 -4.4218 -4.4218 -3.1035 -3.1035 -3.0092 -3.0092 -2.6979 -2.6979 -2.5874 -2.5874 -2.1536 -2.1536 -1.9991 -1.9991 -1.7418 -1.7418 -1.5843 -1.5843 -0.8577 -0.8577 -0.5300 -0.5300 0.0143 0.0143 0.1443 0.1443 0.2822 0.2822 0.5701 0.5701 0.6590 0.6590 0.8409 0.8409 1.5511 1.5511 1.6844 1.6844 4.7677 4.7677 4.9482 4.9482 5.3338 5.3338 5.5071 5.5071 5.7148 5.7148 5.9269 5.9269 6.8555 6.8555 k = 0.2674-0.1692 0.0127 ( 11771 PWs) bands (ev): -14.0333 -14.0333 -13.9281 -13.9281 -12.5829 -12.5829 -12.5441 -12.5441 -10.9022 -10.9022 -10.8531 -10.8531 -9.9221 -9.9221 -9.8815 -9.8815 -8.1584 -8.1584 -8.0924 -8.0924 -7.9241 -7.9241 -7.8797 -7.8797 -5.2131 -5.2131 -5.1109 -5.1109 -4.5009 -4.5009 -4.4269 -4.4269 -3.1041 -3.1041 -3.0107 -3.0107 -2.6958 -2.6958 -2.5919 -2.5919 -2.1329 -2.1329 -1.9786 -1.9786 -1.7437 -1.7437 -1.5779 -1.5779 -0.8434 -0.8434 -0.5245 -0.5245 0.0231 0.0231 0.1575 0.1575 0.2903 0.2903 0.5723 0.5723 0.6636 0.6636 0.8427 0.8427 1.5539 1.5539 1.6842 1.6842 4.7655 4.7655 4.9351 4.9351 5.3284 5.3284 5.5024 5.5024 5.7242 5.7242 5.9234 5.9234 6.8465 6.8465 k = 0.2558-0.1618 0.0121 ( 11772 PWs) bands (ev): -14.0382 -14.0382 -13.9344 -13.9344 -12.5827 -12.5827 -12.5441 -12.5441 -10.9049 -10.9049 -10.8502 -10.8502 -9.9234 -9.9234 -9.8801 -9.8801 -8.1538 -8.1538 -8.0890 -8.0890 -7.9214 -7.9214 -7.8802 -7.8802 -5.2135 -5.2135 -5.1115 -5.1115 -4.4979 -4.4979 -4.4317 -4.4317 -3.1044 -3.1044 -3.0124 -3.0124 -2.6928 -2.6928 -2.5967 -2.5967 -2.1127 -2.1127 -1.9578 -1.9578 -1.7443 -1.7443 -1.5720 -1.5720 -0.8292 -0.8292 -0.5201 -0.5201 0.0309 0.0309 0.1667 0.1667 0.3013 0.3013 0.5733 0.5733 0.6723 0.6723 0.8458 0.8458 1.5565 1.5565 1.6835 1.6835 4.7630 4.7630 4.9230 4.9230 5.3213 5.3213 5.4994 5.4994 5.7345 5.7345 5.9194 5.9194 6.8374 6.8374 k = 0.2442-0.1545 0.0116 ( 11767 PWs) bands (ev): -14.0430 -14.0430 -13.9409 -13.9409 -12.5825 -12.5825 -12.5437 -12.5437 -10.9083 -10.9083 -10.8468 -10.8468 -9.9259 -9.9259 -9.8778 -9.8778 -8.1490 -8.1490 -8.0855 -8.0855 -7.9184 -7.9184 -7.8805 -7.8805 -5.2139 -5.2139 -5.1128 -5.1128 -4.4948 -4.4948 -4.4361 -4.4361 -3.1044 -3.1044 -3.0143 -3.0143 -2.6891 -2.6891 -2.6017 -2.6017 -2.0934 -2.0934 -1.9366 -1.9366 -1.7431 -1.7431 -1.5666 -1.5666 -0.8152 -0.8152 -0.5171 -0.5171 0.0377 0.0377 0.1711 0.1711 0.3155 0.3155 0.5741 0.5741 0.6841 0.6841 0.8502 0.8502 1.5590 1.5590 1.6824 1.6824 4.7600 4.7600 4.9119 4.9119 5.3131 5.3131 5.4982 5.4982 5.7452 5.7452 5.9150 5.9150 6.8285 6.8285 k = 0.2326-0.1471 0.0110 ( 11771 PWs) bands (ev): -14.0479 -14.0479 -13.9473 -13.9473 -12.5826 -12.5826 -12.5427 -12.5427 -10.9125 -10.9125 -10.8429 -10.8429 -9.9295 -9.9295 -9.8749 -9.8749 -8.1442 -8.1442 -8.0819 -8.0819 -7.9153 -7.9153 -7.8806 -7.8806 -5.2144 -5.2144 -5.1149 -5.1149 -4.4915 -4.4915 -4.4401 -4.4401 -3.1040 -3.1040 -3.0165 -3.0165 -2.6850 -2.6850 -2.6067 -2.6067 -2.0753 -2.0753 -1.9152 -1.9152 -1.7398 -1.7398 -1.5617 -1.5617 -0.8014 -0.8014 -0.5156 -0.5156 0.0439 0.0439 0.1711 0.1711 0.3325 0.3325 0.5754 0.5754 0.6982 0.6982 0.8557 0.8557 1.5615 1.5615 1.6807 1.6807 4.7566 4.7566 4.9021 4.9021 5.3043 5.3043 5.4983 5.4983 5.7558 5.7558 5.9107 5.9107 6.8199 6.8199 k = 0.2209-0.1398 0.0105 ( 11767 PWs) bands (ev): -14.0527 -14.0527 -13.9538 -13.9538 -12.5829 -12.5829 -12.5411 -12.5411 -10.9173 -10.9173 -10.8388 -10.8388 -9.9340 -9.9340 -9.8714 -9.8714 -8.1393 -8.1393 -8.0782 -8.0782 -7.9119 -7.9119 -7.8804 -7.8804 -5.2150 -5.2150 -5.1178 -5.1178 -4.4884 -4.4884 -4.4435 -4.4435 -3.1030 -3.1030 -3.0191 -3.0191 -2.6809 -2.6809 -2.6112 -2.6112 -2.0590 -2.0590 -1.8939 -1.8939 -1.7340 -1.7340 -1.5573 -1.5573 -0.7881 -0.7881 -0.5157 -0.5157 0.0494 0.0494 0.1675 0.1675 0.3515 0.3515 0.5776 0.5776 0.7138 0.7138 0.8624 0.8624 1.5641 1.5641 1.6786 1.6786 4.7528 4.7528 4.8936 4.8936 5.2953 5.2953 5.4994 5.4994 5.7660 5.7660 5.9069 5.9069 6.8118 6.8118 k = 0.2093-0.1324 0.0099 ( 11760 PWs) bands (ev): -14.0575 -14.0575 -13.9602 -13.9602 -12.5834 -12.5834 -12.5390 -12.5390 -10.9225 -10.9225 -10.8343 -10.8343 -9.9393 -9.9393 -9.8676 -9.8676 -8.1342 -8.1342 -8.0744 -8.0744 -7.9085 -7.9085 -7.8800 -7.8800 -5.2156 -5.2156 -5.1214 -5.1214 -4.4856 -4.4856 -4.4460 -4.4460 -3.1014 -3.1014 -3.0220 -3.0220 -2.6777 -2.6777 -2.6146 -2.6146 -2.0447 -2.0447 -1.8728 -1.8728 -1.7252 -1.7252 -1.5533 -1.5533 -0.7752 -0.7752 -0.5174 -0.5174 0.0543 0.0543 0.1614 0.1614 0.3716 0.3716 0.5808 0.5808 0.7305 0.7305 0.8700 0.8700 1.5667 1.5667 1.6759 1.6759 4.7484 4.7484 4.8867 4.8867 5.2868 5.2868 5.5010 5.5010 5.7752 5.7752 5.9042 5.9042 6.8043 6.8043 k = 0.1977-0.1251 0.0094 ( 11757 PWs) bands (ev): -14.0621 -14.0621 -13.9666 -13.9666 -12.5842 -12.5842 -12.5364 -12.5364 -10.9282 -10.9282 -10.8297 -10.8297 -9.9452 -9.9452 -9.8636 -9.8636 -8.1292 -8.1292 -8.0706 -8.0706 -7.9050 -7.9050 -7.8792 -7.8792 -5.2163 -5.2163 -5.1255 -5.1255 -4.4836 -4.4836 -4.4474 -4.4474 -3.0991 -3.0991 -3.0252 -3.0252 -2.6763 -2.6763 -2.6159 -2.6159 -2.0326 -2.0326 -1.8523 -1.8523 -1.7133 -1.7133 -1.5496 -1.5496 -0.7630 -0.7630 -0.5208 -0.5208 0.0582 0.0582 0.1542 0.1542 0.3919 0.3919 0.5851 0.5851 0.7479 0.7479 0.8784 0.8784 1.5694 1.5694 1.6728 1.6728 4.7436 4.7436 4.8813 4.8813 5.2792 5.2792 5.5025 5.5025 5.7829 5.7829 5.9035 5.9035 6.7975 6.7975 k = 0.1860-0.1177 0.0088 ( 11758 PWs) bands (ev): -14.0667 -14.0667 -13.9728 -13.9728 -12.5852 -12.5852 -12.5332 -12.5332 -10.9341 -10.9341 -10.8249 -10.8249 -9.9516 -9.9516 -9.8595 -9.8595 -8.1242 -8.1242 -8.0667 -8.0667 -7.9017 -7.9017 -7.8782 -7.8782 -5.2170 -5.2170 -5.1302 -5.1302 -4.4825 -4.4825 -4.4474 -4.4474 -3.0962 -3.0962 -3.0287 -3.0287 -2.6777 -2.6777 -2.6145 -2.6145 -2.0228 -2.0228 -1.8328 -1.8328 -1.6981 -1.6981 -1.5461 -1.5461 -0.7516 -0.7516 -0.5259 -0.5259 0.0605 0.0605 0.1473 0.1473 0.4117 0.4117 0.5906 0.5906 0.7656 0.7656 0.8876 0.8876 1.5723 1.5723 1.6693 1.6693 4.7383 4.7383 4.8775 4.8775 5.2727 5.2727 5.5035 5.5035 5.7887 5.7887 5.9053 5.9053 6.7916 6.7916 k = 0.1744-0.1103 0.0083 ( 11768 PWs) bands (ev): -14.0711 -14.0711 -13.9789 -13.9789 -12.5863 -12.5863 -12.5297 -12.5297 -10.9403 -10.9403 -10.8201 -10.8201 -9.9583 -9.9583 -9.8554 -9.8554 -8.1192 -8.1192 -8.0627 -8.0627 -7.8986 -7.8986 -7.8767 -7.8767 -5.2178 -5.2178 -5.1352 -5.1352 -4.4827 -4.4827 -4.4458 -4.4458 -3.0927 -3.0927 -3.0322 -3.0322 -2.6819 -2.6819 -2.6101 -2.6101 -2.0153 -2.0153 -1.8145 -1.8145 -1.6796 -1.6796 -1.5426 -1.5426 -0.7412 -0.7412 -0.5326 -0.5326 0.0603 0.0603 0.1424 0.1424 0.4303 0.4303 0.5974 0.5974 0.7831 0.7831 0.8973 0.8973 1.5753 1.5753 1.6654 1.6654 4.7327 4.7327 4.8752 4.8752 5.2676 5.2676 5.5037 5.5037 5.7924 5.7924 5.9100 5.9100 6.7867 6.7867 k = 0.1628-0.1030 0.0077 ( 11754 PWs) bands (ev): -14.0753 -14.0753 -13.9848 -13.9848 -12.5876 -12.5876 -12.5259 -12.5259 -10.9465 -10.9465 -10.8152 -10.8152 -9.9653 -9.9653 -9.8514 -9.8514 -8.1142 -8.1142 -8.0587 -8.0587 -7.8959 -7.8959 -7.8747 -7.8747 -5.2188 -5.2188 -5.1404 -5.1404 -4.4841 -4.4841 -4.4428 -4.4428 -3.0889 -3.0889 -3.0354 -3.0354 -2.6886 -2.6886 -2.6034 -2.6034 -2.0098 -2.0098 -1.7979 -1.7979 -1.6581 -1.6581 -1.5388 -1.5388 -0.7320 -0.7320 -0.5407 -0.5407 0.0568 0.0568 0.1409 0.1409 0.4470 0.4470 0.6057 0.6057 0.8003 0.8003 0.9075 0.9075 1.5783 1.5783 1.6613 1.6613 4.7269 4.7269 4.8742 4.8742 5.2640 5.2640 5.5029 5.5029 5.7943 5.7943 5.9173 5.9173 6.7828 6.7828 k = 0.1512-0.0956 0.0072 ( 11746 PWs) bands (ev): -14.0793 -14.0793 -13.9904 -13.9904 -12.5889 -12.5889 -12.5219 -12.5219 -10.9527 -10.9527 -10.8104 -10.8104 -9.9725 -9.9725 -9.8475 -9.8475 -8.1093 -8.1093 -8.0548 -8.0548 -7.8938 -7.8938 -7.8722 -7.8722 -5.2199 -5.2199 -5.1456 -5.1456 -4.4862 -4.4862 -4.4388 -4.4388 -3.0851 -3.0851 -3.0379 -3.0379 -2.6971 -2.6971 -2.5951 -2.5951 -2.0061 -2.0061 -1.7831 -1.7831 -1.6342 -1.6342 -1.5346 -1.5346 -0.7244 -0.7244 -0.5500 -0.5500 0.0501 0.0501 0.1430 0.1430 0.4610 0.4610 0.6159 0.6159 0.8168 0.8168 0.9180 0.9180 1.5812 1.5812 1.6570 1.6570 4.7209 4.7209 4.8746 4.8746 5.2622 5.2622 5.5009 5.5009 5.7951 5.7951 5.9267 5.9267 6.7800 6.7800 k = 0.1395-0.0883 0.0066 ( 11743 PWs) bands (ev): -14.0832 -14.0832 -13.9958 -13.9958 -12.5903 -12.5903 -12.5178 -12.5178 -10.9589 -10.9589 -10.8056 -10.8056 -9.9796 -9.9796 -9.8438 -9.8438 -8.1046 -8.1046 -8.0509 -8.0509 -7.8921 -7.8921 -7.8693 -7.8693 -5.2212 -5.2212 -5.1507 -5.1507 -4.4889 -4.4889 -4.4341 -4.4341 -3.0820 -3.0820 -3.0391 -3.0391 -2.7068 -2.7068 -2.5860 -2.5860 -2.0039 -2.0039 -1.7702 -1.7702 -1.6084 -1.6084 -1.5296 -1.5296 -0.7187 -0.7187 -0.5599 -0.5599 0.0410 0.0410 0.1484 0.1484 0.4720 0.4720 0.6281 0.6281 0.8321 0.8321 0.9287 0.9287 1.5838 1.5838 1.6529 1.6529 4.7148 4.7148 4.8760 4.8760 5.2619 5.2619 5.4975 5.4975 5.7952 5.7952 5.9375 5.9375 6.7783 6.7783 k = 0.1279-0.0809 0.0061 ( 11743 PWs) bands (ev): -14.0868 -14.0868 -14.0009 -14.0009 -12.5916 -12.5916 -12.5136 -12.5136 -10.9649 -10.9649 -10.8010 -10.8010 -9.9867 -9.9867 -9.8403 -9.8403 -8.1001 -8.1001 -8.0471 -8.0471 -7.8908 -7.8908 -7.8660 -7.8660 -5.2227 -5.2227 -5.1555 -5.1555 -4.4920 -4.4920 -4.4290 -4.4290 -3.0803 -3.0803 -3.0381 -3.0381 -2.7173 -2.7173 -2.5764 -2.5764 -2.0029 -2.0029 -1.7594 -1.7594 -1.5816 -1.5816 -1.5234 -1.5234 -0.7154 -0.7154 -0.5698 -0.5698 0.0305 0.0305 0.1560 0.1560 0.4797 0.4797 0.6425 0.6425 0.8460 0.8460 0.9396 0.9396 1.5860 1.5860 1.6491 1.6491 4.7088 4.7088 4.8784 4.8784 5.2634 5.2634 5.4928 5.4928 5.7953 5.7953 5.9491 5.9491 6.7779 6.7779 k = 0.1163-0.0736 0.0055 ( 11739 PWs) bands (ev): -14.0902 -14.0902 -14.0057 -14.0057 -12.5929 -12.5929 -12.5095 -12.5095 -10.9706 -10.9706 -10.7966 -10.7966 -9.9936 -9.9936 -9.8370 -9.8370 -8.0958 -8.0958 -8.0434 -8.0434 -7.8899 -7.8899 -7.8626 -7.8626 -5.2245 -5.2245 -5.1600 -5.1600 -4.4951 -4.4951 -4.4237 -4.4237 -3.0804 -3.0804 -3.0345 -3.0345 -2.7285 -2.7285 -2.5667 -2.5667 -2.0028 -2.0028 -1.7505 -1.7505 -1.5554 -1.5554 -1.5151 -1.5151 -0.7153 -0.7153 -0.5789 -0.5789 0.0196 0.0196 0.1652 0.1652 0.4842 0.4842 0.6588 0.6588 0.8580 0.8580 0.9506 0.9506 1.5873 1.5873 1.6460 1.6460 4.7029 4.7029 4.8816 4.8816 5.2664 5.2664 5.4869 5.4869 5.7957 5.7957 5.9608 5.9608 6.7786 6.7786 k = 0.1047-0.0662 0.0050 ( 11738 PWs) bands (ev): -14.0933 -14.0933 -14.0100 -14.0100 -12.5942 -12.5942 -12.5056 -12.5056 -10.9761 -10.9761 -10.7924 -10.7924 -10.0003 -10.0003 -9.8340 -9.8340 -8.0918 -8.0918 -8.0399 -8.0399 -7.8893 -7.8893 -7.8592 -7.8592 -5.2266 -5.2266 -5.1639 -5.1639 -4.4983 -4.4983 -4.4185 -4.4185 -3.0822 -3.0822 -3.0286 -3.0286 -2.7401 -2.7401 -2.5570 -2.5570 -2.0034 -2.0034 -1.7436 -1.7436 -1.5328 -1.5328 -1.5019 -1.5019 -0.7187 -0.7187 -0.5865 -0.5865 0.0088 0.0088 0.1755 0.1755 0.4859 0.4859 0.6767 0.6767 0.8677 0.8677 0.9616 0.9616 1.5876 1.5876 1.6440 1.6440 4.6973 4.6973 4.8853 4.8853 5.2709 5.2709 5.4798 5.4798 5.7964 5.7964 5.9723 5.9723 6.7803 6.7803 k = 0.0930-0.0589 0.0044 ( 11736 PWs) bands (ev): -14.0961 -14.0961 -14.0140 -14.0140 -12.5953 -12.5953 -12.5018 -12.5018 -10.9812 -10.9812 -10.7885 -10.7885 -10.0065 -10.0065 -9.8313 -9.8313 -8.0881 -8.0881 -8.0367 -8.0367 -7.8889 -7.8889 -7.8558 -7.8558 -5.2289 -5.2289 -5.1672 -5.1672 -4.5014 -4.5014 -4.4134 -4.4134 -3.0849 -3.0849 -3.0210 -3.0210 -2.7520 -2.7520 -2.5478 -2.5478 -2.0045 -2.0045 -1.7384 -1.7384 -1.5177 -1.5177 -1.4811 -1.4811 -0.7258 -0.7258 -0.5921 -0.5921 -0.0014 -0.0014 0.1863 0.1863 0.4853 0.4853 0.6955 0.6955 0.8751 0.8751 0.9724 0.9724 1.5867 1.5867 1.6430 1.6430 4.6920 4.6920 4.8894 4.8894 5.2768 5.2768 5.4718 5.4718 5.7974 5.7974 5.9832 5.9832 6.7830 6.7830 k = 0.0814-0.0515 0.0039 ( 11734 PWs) bands (ev): -14.0986 -14.0986 -14.0176 -14.0176 -12.5964 -12.5964 -12.4983 -12.4983 -10.9858 -10.9858 -10.7849 -10.7849 -10.0123 -10.0123 -9.8288 -9.8288 -8.0847 -8.0847 -8.0336 -8.0336 -7.8886 -7.8886 -7.8526 -7.8526 -5.2313 -5.2313 -5.1699 -5.1699 -4.5044 -4.5044 -4.4087 -4.4087 -3.0881 -3.0881 -3.0124 -3.0124 -2.7639 -2.7639 -2.5391 -2.5391 -2.0059 -2.0059 -1.7347 -1.7347 -1.5076 -1.5076 -1.4557 -1.4557 -0.7362 -0.7362 -0.5956 -0.5956 -0.0108 -0.0108 0.1972 0.1972 0.4830 0.4830 0.7149 0.7149 0.8799 0.8799 0.9828 0.9828 1.5847 1.5847 1.6432 1.6432 4.6871 4.6871 4.8937 4.8937 5.2839 5.2839 5.4630 5.4630 5.7988 5.7988 5.9931 5.9931 6.7865 6.7865 k = 0.0698-0.0441 0.0033 ( 11728 PWs) bands (ev): -14.1008 -14.1008 -14.0208 -14.0208 -12.5974 -12.5974 -12.4952 -12.4952 -10.9899 -10.9899 -10.7817 -10.7817 -10.0175 -10.0175 -9.8267 -9.8267 -8.0817 -8.0817 -8.0309 -8.0309 -7.8884 -7.8884 -7.8497 -7.8497 -5.2338 -5.2338 -5.1720 -5.1720 -4.5071 -4.5071 -4.4043 -4.4043 -3.0913 -3.0913 -3.0032 -3.0032 -2.7755 -2.7755 -2.5311 -2.5311 -2.0074 -2.0074 -1.7322 -1.7322 -1.4994 -1.4994 -1.4298 -1.4298 -0.7490 -0.7490 -0.5974 -0.5974 -0.0192 -0.0192 0.2080 0.2080 0.4793 0.4793 0.7343 0.7343 0.8821 0.8821 0.9926 0.9926 1.5820 1.5820 1.6442 1.6442 4.6827 4.6827 4.8980 4.8980 5.2919 5.2919 5.4537 5.4537 5.8004 5.8004 6.0019 6.0019 6.7904 6.7904 k = 0.0581-0.0368 0.0028 ( 11726 PWs) bands (ev): -14.1027 -14.1027 -14.0234 -14.0234 -12.5982 -12.5982 -12.4924 -12.4924 -10.9935 -10.9935 -10.7789 -10.7789 -10.0220 -10.0220 -9.8249 -9.8249 -8.0791 -8.0791 -8.0285 -8.0285 -7.8883 -7.8883 -7.8471 -7.8471 -5.2361 -5.2361 -5.1737 -5.1737 -4.5096 -4.5096 -4.4004 -4.4004 -3.0943 -3.0943 -2.9939 -2.9939 -2.7867 -2.7867 -2.5241 -2.5241 -2.0090 -2.0090 -1.7307 -1.7307 -1.4923 -1.4923 -1.4052 -1.4052 -0.7630 -0.7630 -0.5981 -0.5981 -0.0264 -0.0264 0.2182 0.2182 0.4750 0.4750 0.7534 0.7534 0.8818 0.8818 1.0015 1.0015 1.5789 1.5789 1.6457 1.6457 4.6788 4.6788 4.9019 4.9019 5.3005 5.3005 5.4441 5.4441 5.8020 5.8020 6.0094 6.0094 6.7945 6.7945 k = 0.0465-0.0294 0.0022 ( 11729 PWs) bands (ev): -14.1043 -14.1043 -14.0257 -14.0257 -12.5989 -12.5989 -12.4901 -12.4901 -10.9965 -10.9965 -10.7766 -10.7766 -10.0259 -10.0259 -9.8234 -9.8234 -8.0770 -8.0770 -8.0265 -8.0265 -7.8882 -7.8882 -7.8449 -7.8449 -5.2383 -5.2383 -5.1749 -5.1749 -4.5117 -4.5117 -4.3971 -4.3971 -3.0969 -3.0969 -2.9851 -2.9851 -2.7971 -2.7971 -2.5181 -2.5181 -2.0105 -2.0105 -1.7298 -1.7298 -1.4863 -1.4863 -1.3830 -1.3830 -0.7769 -0.7769 -0.5980 -0.5980 -0.0324 -0.0324 0.2274 0.2274 0.4704 0.4704 0.7717 0.7717 0.8792 0.8792 1.0091 1.0091 1.5758 1.5758 1.6473 1.6473 4.6755 4.6755 4.9055 4.9055 5.3095 5.3095 5.4345 5.4345 5.8035 5.8035 6.0156 6.0156 6.7984 6.7984 k = 0.0349-0.0221 0.0017 ( 11726 PWs) bands (ev): -14.1055 -14.1055 -14.0274 -14.0274 -12.5994 -12.5994 -12.4882 -12.4882 -10.9989 -10.9989 -10.7747 -10.7747 -10.0289 -10.0289 -9.8222 -9.8222 -8.0753 -8.0753 -8.0249 -8.0249 -7.8882 -7.8882 -7.8432 -7.8432 -5.2401 -5.2401 -5.1758 -5.1758 -4.5134 -4.5134 -4.3944 -4.3944 -3.0991 -3.0991 -2.9771 -2.9771 -2.8062 -2.8062 -2.5132 -2.5132 -2.0117 -2.0117 -1.7293 -1.7293 -1.4814 -1.4814 -1.3643 -1.3643 -0.7895 -0.7895 -0.5977 -0.5977 -0.0372 -0.0372 0.2352 0.2352 0.4662 0.4662 0.7888 0.7888 0.8746 0.8746 1.0153 1.0153 1.5731 1.5731 1.6489 1.6489 4.6729 4.6729 4.9085 4.9085 5.3182 5.3182 5.4254 5.4254 5.8049 5.8049 6.0204 6.0204 6.8017 6.8017 k = 0.0233-0.0147 0.0011 ( 11734 PWs) bands (ev): -14.1064 -14.1064 -14.0287 -14.0287 -12.5998 -12.5998 -12.4869 -12.4869 -11.0006 -11.0006 -10.7734 -10.7734 -10.0311 -10.0311 -9.8214 -9.8214 -8.0741 -8.0741 -8.0237 -8.0237 -7.8882 -7.8882 -7.8420 -7.8420 -5.2414 -5.2414 -5.1764 -5.1764 -4.5146 -4.5146 -4.3925 -4.3925 -3.1007 -3.1007 -2.9707 -2.9707 -2.8134 -2.8134 -2.5097 -2.5097 -2.0127 -2.0127 -1.7292 -1.7292 -1.4777 -1.4777 -1.3501 -1.3501 -0.7995 -0.7995 -0.5972 -0.5972 -0.0406 -0.0406 0.2412 0.2412 0.4627 0.4627 0.8038 0.8038 0.8686 0.8686 1.0199 1.0199 1.5710 1.5710 1.6501 1.6501 4.6710 4.6710 4.9107 4.9107 5.3258 5.3258 5.4175 5.4175 5.8059 5.8059 6.0238 6.0238 6.8043 6.8043 k = 0.0116-0.0074 0.0006 ( 11729 PWs) bands (ev): -14.1069 -14.1069 -14.0294 -14.0294 -12.6001 -12.6001 -12.4861 -12.4861 -11.0017 -11.0017 -10.7725 -10.7725 -10.0325 -10.0325 -9.8209 -9.8209 -8.0734 -8.0734 -8.0230 -8.0230 -7.8882 -7.8882 -7.8412 -7.8412 -5.2423 -5.2423 -5.1767 -5.1767 -4.5153 -4.5153 -4.3913 -4.3913 -3.1017 -3.1017 -2.9665 -2.9665 -2.8181 -2.8181 -2.5076 -2.5076 -2.0133 -2.0133 -1.7291 -1.7291 -1.4755 -1.4755 -1.3412 -1.3412 -0.8059 -0.8059 -0.5969 -0.5969 -0.0426 -0.0426 0.2450 0.2450 0.4604 0.4604 0.8154 0.8154 0.8624 0.8624 1.0227 1.0227 1.5696 1.5696 1.6509 1.6509 4.6698 4.6698 4.9121 4.9121 5.3313 5.3313 5.4119 5.4119 5.8065 5.8065 6.0258 6.0258 6.8059 6.8059 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k =-0.0132-0.0017 0.0038 ( 11726 PWs) bands (ev): -14.1069 -14.1069 -14.0295 -14.0295 -12.6000 -12.6000 -12.4860 -12.4860 -11.0014 -11.0014 -10.7731 -10.7731 -10.0320 -10.0320 -9.8213 -9.8213 -8.0733 -8.0733 -8.0231 -8.0231 -7.8880 -7.8880 -7.8410 -7.8410 -5.2424 -5.2424 -5.1770 -5.1770 -4.5152 -4.5152 -4.3910 -4.3910 -3.1019 -3.1019 -2.9656 -2.9656 -2.8188 -2.8188 -2.5080 -2.5080 -2.0129 -2.0129 -1.7303 -1.7303 -1.4757 -1.4757 -1.3392 -1.3392 -0.8078 -0.8078 -0.5972 -0.5972 -0.0424 -0.0424 0.2445 0.2445 0.4605 0.4605 0.8136 0.8136 0.8635 0.8635 1.0226 1.0226 1.5702 1.5702 1.6503 1.6503 4.6699 4.6699 4.9127 4.9127 5.3326 5.3326 5.4094 5.4094 5.8065 5.8065 6.0268 6.0268 6.8075 6.8075 k =-0.0263-0.0033 0.0076 ( 11726 PWs) bands (ev): -14.1063 -14.1063 -14.0289 -14.0289 -12.5994 -12.5994 -12.4865 -12.4865 -10.9994 -10.9994 -10.7756 -10.7756 -10.0292 -10.0292 -9.8231 -9.8231 -8.0738 -8.0738 -8.0239 -8.0239 -7.8875 -7.8875 -7.8412 -7.8412 -5.2420 -5.2420 -5.1777 -5.1777 -4.5140 -4.5140 -4.3911 -4.3911 -3.1014 -3.1014 -2.9673 -2.9673 -2.8162 -2.8162 -2.5114 -2.5114 -2.0112 -2.0112 -1.7337 -1.7337 -1.4783 -1.4783 -1.3424 -1.3424 -0.8069 -0.8069 -0.5983 -0.5983 -0.0399 -0.0399 0.2394 0.2394 0.4631 0.4631 0.7982 0.7982 0.8711 0.8711 1.0196 1.0196 1.5729 1.5729 1.6478 1.6478 4.6712 4.6712 4.9133 4.9133 5.3305 5.3305 5.4079 5.4079 5.8058 5.8058 6.0278 6.0278 6.8107 6.8107 k =-0.0395-0.0050 0.0113 ( 11728 PWs) bands (ev): -14.1052 -14.1052 -14.0279 -14.0279 -12.5985 -12.5985 -12.4874 -12.4874 -10.9962 -10.9962 -10.7796 -10.7796 -10.0247 -10.0247 -9.8260 -9.8260 -8.0746 -8.0746 -8.0252 -8.0252 -7.8868 -7.8868 -7.8416 -7.8416 -5.2414 -5.2414 -5.1787 -5.1787 -4.5121 -4.5121 -4.3912 -4.3912 -3.1005 -3.1005 -2.9699 -2.9699 -2.8122 -2.8122 -2.5169 -2.5169 -2.0085 -2.0085 -1.7394 -1.7394 -1.4827 -1.4827 -1.3478 -1.3478 -0.8057 -0.8057 -0.5998 -0.5998 -0.0360 -0.0360 0.2314 0.2314 0.4668 0.4668 0.7788 0.7788 0.8778 0.8778 1.0150 1.0150 1.5767 1.5767 1.6441 1.6441 4.6734 4.6734 4.9143 4.9143 5.3271 5.3271 5.4053 5.4053 5.8049 5.8049 6.0292 6.0292 6.8161 6.8161 k =-0.0526-0.0067 0.0151 ( 11728 PWs) bands (ev): -14.1037 -14.1037 -14.0265 -14.0265 -12.5973 -12.5973 -12.4886 -12.4886 -10.9917 -10.9917 -10.7851 -10.7851 -10.0186 -10.0186 -9.8300 -9.8300 -8.0758 -8.0758 -8.0271 -8.0271 -7.8858 -7.8858 -7.8421 -7.8421 -5.2405 -5.2405 -5.1800 -5.1800 -4.5095 -4.5095 -4.3914 -4.3914 -3.0993 -3.0993 -2.9734 -2.9734 -2.8068 -2.8068 -2.5245 -2.5245 -2.0049 -2.0049 -1.7472 -1.7472 -1.4886 -1.4886 -1.3553 -1.3553 -0.8044 -0.8044 -0.6014 -0.6014 -0.0310 -0.0310 0.2211 0.2211 0.4709 0.4709 0.7574 0.7574 0.8820 0.8820 1.0091 1.0091 1.5804 1.5804 1.6404 1.6404 4.6765 4.6765 4.9158 4.9158 5.3229 5.3229 5.4014 5.4014 5.8042 5.8042 6.0308 6.0308 6.8238 6.8238 k =-0.0658-0.0083 0.0189 ( 11730 PWs) bands (ev): -14.1018 -14.1018 -14.0247 -14.0247 -12.5957 -12.5957 -12.4902 -12.4902 -10.9860 -10.9860 -10.7919 -10.7919 -10.0109 -10.0109 -9.8351 -9.8351 -8.0772 -8.0772 -8.0294 -8.0294 -7.8846 -7.8846 -7.8427 -7.8427 -5.2396 -5.2396 -5.1815 -5.1815 -4.5062 -4.5062 -4.3917 -4.3917 -3.0978 -3.0978 -2.9773 -2.9773 -2.8004 -2.8004 -2.5338 -2.5338 -2.0009 -2.0009 -1.7571 -1.7571 -1.4959 -1.4959 -1.3647 -1.3647 -0.8034 -0.8034 -0.6028 -0.6028 -0.0254 -0.0254 0.2090 0.2090 0.4747 0.4747 0.7348 0.7348 0.8831 0.8831 1.0025 1.0025 1.5822 1.5822 1.6382 1.6382 4.6803 4.6803 4.9181 4.9181 5.3182 5.3182 5.3961 5.3961 5.8043 5.8043 6.0323 6.0323 6.8338 6.8338 k =-0.0789-0.0100 0.0227 ( 11732 PWs) bands (ev): -14.0995 -14.0995 -14.0226 -14.0226 -12.5939 -12.5939 -12.4920 -12.4920 -10.9792 -10.9792 -10.7998 -10.7998 -10.0019 -10.0019 -9.8413 -9.8413 -8.0789 -8.0789 -8.0322 -8.0322 -7.8832 -7.8832 -7.8435 -7.8435 -5.2386 -5.2386 -5.1831 -5.1831 -4.5023 -4.5023 -4.3921 -4.3921 -3.0959 -3.0959 -2.9816 -2.9816 -2.7933 -2.7933 -2.5445 -2.5445 -1.9967 -1.9967 -1.7686 -1.7686 -1.5043 -1.5043 -1.3760 -1.3760 -0.8031 -0.8031 -0.6037 -0.6037 -0.0196 -0.0196 0.1958 0.1958 0.4773 0.4773 0.7119 0.7119 0.8807 0.8807 0.9956 0.9956 1.5801 1.5801 1.6392 1.6392 4.6849 4.6849 4.9212 4.9212 5.3132 5.3132 5.3893 5.3893 5.8054 5.8054 6.0332 6.0332 6.8461 6.8461 k =-0.0921-0.0117 0.0265 ( 11734 PWs) bands (ev): -14.0969 -14.0969 -14.0201 -14.0201 -12.5918 -12.5918 -12.4940 -12.4940 -10.9712 -10.9712 -10.8088 -10.8088 -9.9917 -9.9917 -9.8484 -9.8484 -8.0808 -8.0808 -8.0355 -8.0355 -7.8817 -7.8817 -7.8444 -7.8444 -5.2378 -5.2378 -5.1845 -5.1845 -4.4979 -4.4979 -4.3925 -4.3925 -3.0936 -3.0936 -2.9860 -2.9860 -2.7857 -2.7857 -2.5565 -2.5565 -1.9928 -1.9928 -1.7815 -1.7815 -1.5137 -1.5137 -1.3891 -1.3891 -0.8038 -0.8038 -0.6038 -0.6038 -0.0144 -0.0144 0.1823 0.1823 0.4781 0.4781 0.6895 0.6895 0.8749 0.8749 0.9889 0.9889 1.5739 1.5739 1.6437 1.6437 4.6901 4.6901 4.9254 4.9254 5.3084 5.3084 5.3813 5.3813 5.8077 5.8077 6.0334 6.0334 6.8610 6.8610 k =-0.1053-0.0134 0.0302 ( 11738 PWs) bands (ev): -14.0938 -14.0938 -14.0173 -14.0173 -12.5895 -12.5895 -12.4963 -12.4963 -10.9623 -10.9623 -10.8185 -10.8185 -9.9806 -9.9806 -9.8565 -9.8565 -8.0830 -8.0830 -8.0390 -8.0390 -7.8801 -7.8801 -7.8455 -7.8455 -5.2372 -5.2372 -5.1856 -5.1856 -4.4930 -4.4930 -4.3931 -4.3931 -3.0910 -3.0910 -2.9904 -2.9904 -2.7779 -2.7779 -2.5693 -2.5693 -1.9898 -1.9898 -1.7953 -1.7953 -1.5240 -1.5240 -1.4036 -1.4036 -0.8056 -0.8056 -0.6032 -0.6032 -0.0103 -0.0103 0.1691 0.1691 0.4765 0.4765 0.6683 0.6683 0.8656 0.8656 0.9825 0.9825 1.5650 1.5650 1.6504 1.6504 4.6959 4.6959 4.9307 4.9307 5.3040 5.3040 5.3721 5.3721 5.8115 5.8115 6.0325 6.0325 6.8782 6.8782 k =-0.1184-0.0150 0.0340 ( 11740 PWs) bands (ev): -14.0905 -14.0905 -14.0140 -14.0140 -12.5871 -12.5871 -12.4987 -12.4987 -10.9525 -10.9525 -10.8289 -10.8289 -9.9688 -9.9688 -9.8653 -9.8653 -8.0853 -8.0853 -8.0430 -8.0430 -7.8786 -7.8786 -7.8466 -7.8466 -5.2370 -5.2370 -5.1861 -5.1861 -4.4878 -4.4878 -4.3937 -4.3937 -3.0881 -3.0881 -2.9947 -2.9947 -2.7703 -2.7703 -2.5826 -2.5826 -1.9884 -1.9884 -1.8092 -1.8092 -1.5352 -1.5352 -1.4193 -1.4193 -0.8087 -0.8087 -0.6022 -0.6022 -0.0081 -0.0081 0.1570 0.1570 0.4719 0.4719 0.6487 0.6487 0.8533 0.8533 0.9761 0.9761 1.5547 1.5547 1.6580 1.6580 4.7024 4.7024 4.9373 4.9373 5.3004 5.3004 5.3622 5.3622 5.8166 5.8166 6.0303 6.0303 6.8978 6.8978 k =-0.1316-0.0167 0.0378 ( 11751 PWs) bands (ev): -14.0868 -14.0868 -14.0105 -14.0105 -12.5845 -12.5845 -12.5011 -12.5011 -10.9419 -10.9419 -10.8396 -10.8396 -9.9564 -9.9564 -9.8748 -9.8748 -8.0878 -8.0878 -8.0472 -8.0472 -7.8771 -7.8771 -7.8478 -7.8478 -5.2375 -5.2375 -5.1858 -5.1858 -4.4823 -4.4823 -4.3945 -4.3945 -3.0848 -3.0848 -2.9988 -2.9988 -2.7631 -2.7631 -2.5958 -2.5958 -1.9894 -1.9894 -1.8225 -1.8225 -1.5472 -1.5472 -1.4360 -1.4360 -0.8128 -0.8128 -0.6011 -0.6011 -0.0083 -0.0083 0.1468 0.1468 0.4644 0.4644 0.6311 0.6311 0.8384 0.8384 0.9696 0.9696 1.5442 1.5442 1.6655 1.6655 4.7093 4.7093 4.9452 4.9452 5.2975 5.2975 5.3521 5.3521 5.8228 5.8228 6.0268 6.0268 6.9197 6.9197 k =-0.1447-0.0184 0.0416 ( 11752 PWs) bands (ev): -14.0828 -14.0828 -14.0067 -14.0067 -12.5820 -12.5820 -12.5036 -12.5036 -10.9307 -10.9307 -10.8504 -10.8504 -9.9437 -9.9437 -9.8849 -9.8849 -8.0903 -8.0903 -8.0517 -8.0517 -7.8758 -7.8758 -7.8489 -7.8489 -5.2386 -5.2386 -5.1846 -5.1846 -4.4766 -4.4766 -4.3953 -4.3953 -3.0812 -3.0812 -3.0025 -3.0025 -2.7569 -2.7569 -2.6084 -2.6084 -1.9938 -1.9938 -1.8342 -1.8342 -1.5602 -1.5602 -1.4530 -1.4530 -0.8180 -0.8180 -0.6004 -0.6004 -0.0112 -0.0112 0.1390 0.1390 0.4543 0.4543 0.6153 0.6153 0.8215 0.8215 0.9624 0.9624 1.5344 1.5344 1.6725 1.6725 4.7168 4.7168 4.9545 4.9545 5.2953 5.2953 5.3426 5.3426 5.8300 5.8300 6.0217 6.0217 6.9437 6.9437 k =-0.1579-0.0200 0.0454 ( 11751 PWs) bands (ev): -14.0785 -14.0785 -14.0026 -14.0026 -12.5795 -12.5795 -12.5060 -12.5060 -10.9193 -10.9193 -10.8610 -10.8610 -9.9312 -9.9312 -9.8951 -9.8951 -8.0929 -8.0929 -8.0565 -8.0565 -7.8749 -7.8749 -7.8499 -7.8499 -5.2403 -5.2403 -5.1826 -5.1826 -4.4708 -4.4708 -4.3961 -4.3961 -3.0775 -3.0775 -3.0059 -3.0059 -2.7522 -2.7522 -2.6195 -2.6195 -2.0023 -2.0023 -1.8435 -1.8435 -1.5743 -1.5743 -1.4701 -1.4701 -0.8240 -0.8240 -0.6008 -0.6008 -0.0167 -0.0167 0.1337 0.1337 0.4420 0.4420 0.6009 0.6009 0.8031 0.8031 0.9543 0.9543 1.5258 1.5258 1.6786 1.6786 4.7248 4.7248 4.9650 4.9650 5.2930 5.2930 5.3352 5.3352 5.8377 5.8377 6.0153 6.0153 6.9696 6.9696 k =-0.1711-0.0217 0.0491 ( 11753 PWs) bands (ev): -14.0740 -14.0740 -13.9982 -13.9982 -12.5771 -12.5771 -12.5083 -12.5083 -10.9082 -10.9082 -10.8706 -10.8706 -9.9207 -9.9207 -9.9038 -9.9038 -8.0956 -8.0956 -8.0614 -8.0614 -7.8746 -7.8746 -7.8505 -7.8505 -5.2426 -5.2426 -5.1797 -5.1797 -4.4650 -4.4650 -4.3969 -4.3969 -3.0736 -3.0736 -3.0089 -3.0089 -2.7499 -2.7499 -2.6283 -2.6283 -2.0151 -2.0151 -1.8500 -1.8500 -1.5896 -1.5896 -1.4867 -1.4867 -0.8308 -0.8308 -0.6027 -0.6027 -0.0242 -0.0242 0.1307 0.1307 0.4284 0.4284 0.5875 0.5875 0.7837 0.7837 0.9450 0.9450 1.5188 1.5188 1.6835 1.6835 4.7333 4.7333 4.9769 4.9769 5.2893 5.2893 5.3317 5.3317 5.8454 5.8454 6.0077 6.0077 6.9971 6.9971 k =-0.1842-0.0234 0.0529 ( 11757 PWs) bands (ev): -14.0693 -14.0693 -13.9935 -13.9935 -12.5750 -12.5750 -12.5104 -12.5104 -10.9004 -10.9004 -10.8765 -10.8765 -9.9221 -9.9221 -9.9008 -9.9008 -8.0983 -8.0983 -8.0665 -8.0665 -7.8749 -7.8749 -7.8506 -7.8506 -5.2453 -5.2453 -5.1762 -5.1762 -4.4592 -4.4592 -4.3977 -4.3977 -3.0697 -3.0697 -3.0114 -3.0114 -2.7506 -2.7506 -2.6339 -2.6339 -2.0320 -2.0320 -1.8542 -1.8542 -1.6062 -1.6062 -1.5025 -1.5025 -0.8383 -0.8383 -0.6067 -0.6067 -0.0328 -0.0328 0.1294 0.1294 0.4140 0.4140 0.5746 0.5746 0.7634 0.7634 0.9343 0.9343 1.5136 1.5136 1.6873 1.6873 4.7423 4.7423 4.9899 4.9899 5.2832 5.2832 5.3333 5.3333 5.8525 5.8525 5.9994 5.9994 7.0260 7.0260 k =-0.1974-0.0250 0.0567 ( 11768 PWs) bands (ev): -14.0643 -14.0643 -13.9887 -13.9887 -12.5732 -12.5732 -12.5122 -12.5122 -10.9018 -10.9018 -10.8726 -10.8726 -9.9321 -9.9321 -9.8898 -9.8898 -8.1009 -8.1009 -8.0718 -8.0718 -7.8759 -7.8759 -7.8502 -7.8502 -5.2483 -5.2483 -5.1722 -5.1722 -4.4536 -4.4536 -4.3984 -4.3984 -3.0659 -3.0659 -3.0134 -3.0134 -2.7545 -2.7545 -2.6360 -2.6360 -2.0520 -2.0520 -1.8567 -1.8567 -1.6239 -1.6239 -1.5170 -1.5170 -0.8464 -0.8464 -0.6131 -0.6131 -0.0416 -0.0416 0.1290 0.1290 0.3995 0.3995 0.5621 0.5621 0.7427 0.7427 0.9223 0.9223 1.5105 1.5105 1.6899 1.6899 4.7518 4.7518 5.0040 5.0040 5.2755 5.2755 5.3398 5.3398 5.8580 5.8580 5.9910 5.9910 7.0558 7.0558 k =-0.2105-0.0267 0.0605 ( 11774 PWs) bands (ev): -14.0593 -14.0593 -13.9836 -13.9836 -12.5718 -12.5718 -12.5136 -12.5136 -10.9093 -10.9093 -10.8621 -10.8621 -9.9431 -9.9431 -9.8781 -9.8781 -8.1036 -8.1036 -8.0771 -8.0771 -7.8777 -7.8777 -7.8494 -7.8494 -5.2513 -5.2513 -5.1677 -5.1677 -4.4483 -4.4483 -4.3990 -4.3990 -3.0625 -3.0625 -3.0148 -3.0148 -2.7614 -2.7614 -2.6348 -2.6348 -2.0744 -2.0744 -1.8582 -1.8582 -1.6426 -1.6426 -1.5304 -1.5304 -0.8551 -0.8551 -0.6221 -0.6221 -0.0498 -0.0498 0.1290 0.1290 0.3852 0.3852 0.5498 0.5498 0.7218 0.7218 0.9090 0.9090 1.5091 1.5091 1.6914 1.6914 4.7618 4.7618 5.0190 5.0190 5.2672 5.2672 5.3504 5.3504 5.8606 5.8606 5.9837 5.9837 7.0862 7.0862 k =-0.2237-0.0284 0.0643 ( 11776 PWs) bands (ev): -14.0541 -14.0541 -13.9784 -13.9784 -12.5708 -12.5708 -12.5146 -12.5146 -10.9178 -10.9178 -10.8502 -10.8502 -9.9541 -9.9541 -9.8668 -9.8668 -8.1061 -8.1061 -8.0825 -8.0825 -7.8799 -7.8799 -7.8482 -7.8482 -5.2545 -5.2545 -5.1631 -5.1631 -4.4433 -4.4433 -4.3992 -4.3992 -3.0595 -3.0595 -3.0155 -3.0155 -2.7702 -2.7702 -2.6311 -2.6311 -2.0984 -2.0984 -1.8596 -1.8596 -1.6618 -1.6618 -1.5424 -1.5424 -0.8645 -0.8645 -0.6337 -0.6337 -0.0570 -0.0570 0.1288 0.1288 0.3715 0.3715 0.5378 0.5378 0.7010 0.7010 0.8947 0.8947 1.5094 1.5094 1.6918 1.6918 4.7723 4.7723 5.0348 5.0348 5.2592 5.2592 5.3642 5.3642 5.8591 5.8591 5.9787 5.9787 7.1168 7.1168 k =-0.2368-0.0301 0.0680 ( 11777 PWs) bands (ev): -14.0488 -14.0488 -13.9730 -13.9730 -12.5703 -12.5703 -12.5152 -12.5152 -10.9260 -10.9260 -10.8382 -10.8382 -9.9648 -9.9648 -9.8562 -9.8562 -8.1086 -8.1086 -8.0880 -8.0880 -7.8826 -7.8826 -7.8467 -7.8467 -5.2575 -5.2575 -5.1583 -5.1583 -4.4387 -4.4387 -4.3991 -4.3991 -3.0572 -3.0572 -3.0156 -3.0156 -2.7799 -2.7799 -2.6258 -2.6258 -2.1233 -2.1233 -1.8614 -1.8614 -1.6809 -1.6809 -1.5534 -1.5534 -0.8746 -0.8746 -0.6477 -0.6477 -0.0630 -0.0630 0.1281 0.1281 0.3584 0.3584 0.5263 0.5263 0.6803 0.6803 0.8796 0.8796 1.5111 1.5111 1.6912 1.6912 4.7832 4.7832 5.0513 5.0513 5.2520 5.2520 5.3810 5.3810 5.8526 5.8526 5.9768 5.9768 7.1471 7.1471 k =-0.2500-0.0317 0.0718 ( 11769 PWs) bands (ev): -14.0435 -14.0435 -13.9676 -13.9676 -12.5702 -12.5702 -12.5155 -12.5155 -10.9335 -10.9335 -10.8265 -10.8265 -9.9748 -9.9748 -9.8465 -9.8465 -8.1110 -8.1110 -8.0934 -8.0934 -7.8854 -7.8854 -7.8451 -7.8451 -5.2604 -5.2604 -5.1534 -5.1534 -4.4346 -4.4346 -4.3986 -4.3986 -3.0555 -3.0555 -3.0152 -3.0152 -2.7898 -2.7898 -2.6197 -2.6197 -2.1487 -2.1487 -1.8642 -1.8642 -1.6993 -1.6993 -1.5634 -1.5634 -0.8853 -0.8853 -0.6638 -0.6638 -0.0677 -0.0677 0.1264 0.1264 0.3461 0.3461 0.5156 0.5156 0.6600 0.6600 0.8642 0.8642 1.5139 1.5139 1.6898 1.6898 4.7944 4.7944 5.0683 5.0683 5.2459 5.2459 5.4002 5.4002 5.8412 5.8412 5.9781 5.9781 7.1765 7.1765 k =-0.2632-0.0334 0.0756 ( 11769 PWs) bands (ev): -14.0381 -14.0381 -13.9621 -13.9621 -12.5705 -12.5705 -12.5155 -12.5155 -10.9402 -10.9402 -10.8156 -10.8156 -9.9840 -9.9840 -9.8377 -9.8377 -8.1133 -8.1133 -8.0988 -8.0988 -7.8885 -7.8885 -7.8435 -7.8435 -5.2632 -5.2632 -5.1487 -5.1487 -4.4310 -4.4310 -4.3976 -4.3976 -3.0545 -3.0545 -3.0144 -3.0144 -2.7992 -2.7992 -2.6134 -2.6134 -2.1740 -2.1740 -1.8684 -1.8684 -1.7165 -1.7165 -1.5725 -1.5725 -0.8967 -0.8967 -0.6816 -0.6816 -0.0712 -0.0712 0.1234 0.1234 0.3346 0.3346 0.5059 0.5059 0.6402 0.6402 0.8486 0.8486 1.5173 1.5173 1.6877 1.6877 4.8060 4.8060 5.0857 5.0857 5.2411 5.2411 5.4214 5.4214 5.8257 5.8257 5.9818 5.9818 7.2044 7.2044 k =-0.2763-0.0351 0.0794 ( 11773 PWs) bands (ev): -14.0328 -14.0328 -13.9566 -13.9566 -12.5710 -12.5710 -12.5153 -12.5153 -10.9460 -10.9460 -10.8057 -10.8057 -9.9920 -9.9920 -9.8301 -9.8301 -8.1156 -8.1156 -8.1042 -8.1042 -7.8916 -7.8916 -7.8418 -7.8418 -5.2658 -5.2658 -5.1442 -5.1442 -4.4279 -4.4279 -4.3961 -4.3961 -3.0541 -3.0541 -3.0135 -3.0135 -2.8075 -2.8075 -2.6075 -2.6075 -2.1990 -2.1990 -1.8742 -1.8742 -1.7319 -1.7319 -1.5809 -1.5809 -0.9087 -0.9087 -0.7006 -0.7006 -0.0737 -0.0737 0.1190 0.1190 0.3240 0.3240 0.4975 0.4975 0.6213 0.6213 0.8333 0.8333 1.5211 1.5211 1.6851 1.6851 4.8178 4.8178 5.1034 5.1034 5.2378 5.2378 5.4442 5.4442 5.8073 5.8073 5.9869 5.9869 7.2303 7.2303 k =-0.2895-0.0367 0.0831 ( 11772 PWs) bands (ev): -14.0275 -14.0275 -13.9512 -13.9512 -12.5718 -12.5718 -12.5150 -12.5150 -10.9506 -10.9506 -10.7970 -10.7970 -9.9989 -9.9989 -9.8237 -9.8237 -8.1177 -8.1177 -8.1094 -8.1094 -7.8946 -7.8946 -7.8402 -7.8402 -5.2681 -5.2681 -5.1399 -5.1399 -4.4252 -4.4252 -4.3942 -4.3942 -3.0541 -3.0541 -3.0128 -3.0128 -2.8144 -2.8144 -2.6023 -2.6023 -2.2232 -2.2232 -1.8817 -1.8817 -1.7452 -1.7452 -1.5887 -1.5887 -0.9214 -0.9214 -0.7204 -0.7204 -0.0756 -0.0756 0.1130 0.1130 0.3143 0.3143 0.4905 0.4905 0.6035 0.6035 0.8183 0.8183 1.5251 1.5251 1.6820 1.6820 4.8298 4.8298 5.1210 5.1210 5.2362 5.2362 5.4677 5.4677 5.7874 5.7874 5.9925 5.9925 7.2533 7.2533 k =-0.3026-0.0384 0.0869 ( 11780 PWs) bands (ev): -14.0223 -14.0223 -13.9458 -13.9458 -12.5726 -12.5726 -12.5147 -12.5147 -10.9541 -10.9541 -10.7896 -10.7896 -10.0042 -10.0042 -9.8185 -9.8185 -8.1198 -8.1198 -8.1146 -8.1146 -7.8976 -7.8976 -7.8387 -7.8387 -5.2702 -5.2702 -5.1359 -5.1359 -4.4229 -4.4229 -4.3920 -4.3920 -3.0543 -3.0543 -3.0126 -3.0126 -2.8196 -2.8196 -2.5983 -2.5983 -2.2464 -2.2464 -1.8908 -1.8908 -1.7564 -1.7564 -1.5960 -1.5960 -0.9345 -0.9345 -0.7405 -0.7405 -0.0771 -0.0771 0.1055 0.1055 0.3055 0.3055 0.4847 0.4847 0.5872 0.5872 0.8039 0.8039 1.5289 1.5289 1.6786 1.6786 4.8418 4.8418 5.1384 5.1384 5.2364 5.2364 5.4913 5.4913 5.7671 5.7671 5.9981 5.9981 7.2728 7.2728 k =-0.3158-0.0401 0.0907 ( 11786 PWs) bands (ev): -14.0172 -14.0172 -13.9405 -13.9405 -12.5734 -12.5734 -12.5145 -12.5145 -10.9564 -10.9564 -10.7839 -10.7839 -10.0079 -10.0079 -9.8147 -9.8147 -8.1217 -8.1217 -8.1196 -8.1196 -7.9003 -7.9003 -7.8374 -7.8374 -5.2721 -5.2721 -5.1323 -5.1323 -4.4206 -4.4206 -4.3897 -4.3897 -3.0547 -3.0547 -3.0130 -3.0130 -2.8230 -2.8230 -2.5958 -2.5958 -2.2682 -2.2682 -1.9008 -1.9008 -1.7655 -1.7655 -1.6028 -1.6028 -0.9481 -0.9481 -0.7606 -0.7606 -0.0783 -0.0783 0.0964 0.0964 0.2976 0.2976 0.4799 0.4799 0.5729 0.5729 0.7902 0.7902 1.5324 1.5324 1.6751 1.6751 4.8538 4.8538 5.1553 5.1553 5.2386 5.2386 5.5135 5.5135 5.7479 5.7479 6.0033 6.0033 7.2884 7.2884 k =-0.3289-0.0417 0.0945 ( 11780 PWs) bands (ev): -14.0123 -14.0123 -13.9353 -13.9353 -12.5741 -12.5741 -12.5144 -12.5144 -10.9574 -10.9574 -10.7798 -10.7798 -10.0099 -10.0099 -9.8123 -9.8123 -8.1244 -8.1244 -8.1235 -8.1235 -7.9029 -7.9029 -7.8361 -7.8361 -5.2737 -5.2737 -5.1292 -5.1292 -4.4184 -4.4184 -4.3873 -4.3873 -3.0551 -3.0551 -3.0140 -3.0140 -2.8245 -2.8245 -2.5951 -2.5951 -2.2885 -2.2885 -1.9114 -1.9114 -1.7727 -1.7727 -1.6093 -1.6093 -0.9618 -0.9618 -0.7804 -0.7804 -0.0795 -0.0795 0.0860 0.0860 0.2906 0.2906 0.4753 0.4753 0.5613 0.5613 0.7773 0.7773 1.5356 1.5356 1.6714 1.6714 4.8656 4.8656 5.1713 5.1713 5.2430 5.2430 5.5325 5.5325 5.7318 5.7318 6.0078 6.0078 7.3003 7.3003 k =-0.3421-0.0434 0.0983 ( 11773 PWs) bands (ev): -14.0076 -14.0076 -13.9304 -13.9304 -12.5747 -12.5747 -12.5145 -12.5145 -10.9572 -10.9572 -10.7776 -10.7776 -10.0100 -10.0100 -9.8114 -9.8114 -8.1290 -8.1290 -8.1252 -8.1252 -7.9052 -7.9052 -7.8350 -7.8350 -5.2750 -5.2750 -5.1264 -5.1264 -4.4162 -4.4162 -4.3850 -4.3850 -3.0555 -3.0555 -3.0156 -3.0156 -2.8242 -2.8242 -2.5966 -2.5966 -2.3070 -2.3070 -1.9220 -1.9220 -1.7785 -1.7785 -1.6154 -1.6154 -0.9755 -0.9755 -0.7996 -0.7996 -0.0808 -0.0808 0.0744 0.0744 0.2845 0.2845 0.4703 0.4703 0.5532 0.5532 0.7651 0.7651 1.5382 1.5382 1.6678 1.6678 4.8771 4.8771 5.1860 5.1860 5.2497 5.2497 5.5455 5.5455 5.7215 5.7215 6.0115 6.0115 7.3091 7.3091 k =-0.3553-0.0451 0.1020 ( 11778 PWs) bands (ev): -14.0031 -14.0031 -13.9256 -13.9256 -12.5752 -12.5752 -12.5149 -12.5149 -10.9558 -10.9558 -10.7772 -10.7772 -10.0083 -10.0083 -9.8118 -9.8118 -8.1333 -8.1333 -8.1269 -8.1269 -7.9072 -7.9072 -7.8340 -7.8340 -5.2761 -5.2761 -5.1241 -5.1241 -4.4138 -4.4138 -4.3830 -4.3830 -3.0559 -3.0559 -3.0176 -3.0176 -2.8222 -2.8222 -2.6003 -2.6003 -2.3237 -2.3237 -1.9320 -1.9320 -1.7831 -1.7831 -1.6213 -1.6213 -0.9891 -0.9891 -0.8179 -0.8179 -0.0822 -0.0822 0.0621 0.0621 0.2791 0.2791 0.4642 0.4642 0.5491 0.5491 0.7537 0.7537 1.5403 1.5403 1.6643 1.6643 4.8883 4.8883 5.1992 5.1992 5.2587 5.2587 5.5496 5.5496 5.7199 5.7199 6.0142 6.0142 7.3154 7.3154 k =-0.3684-0.0468 0.1058 ( 11775 PWs) bands (ev): -13.9989 -13.9989 -13.9212 -13.9212 -12.5754 -12.5754 -12.5155 -12.5155 -10.9531 -10.9531 -10.7786 -10.7786 -10.0047 -10.0047 -9.8138 -9.8138 -8.1374 -8.1374 -8.1284 -8.1284 -7.9090 -7.9090 -7.8331 -7.8331 -5.2770 -5.2770 -5.1222 -5.1222 -4.4113 -4.4113 -4.3811 -4.3811 -3.0561 -3.0561 -3.0199 -3.0199 -2.8188 -2.8188 -2.6062 -2.6062 -2.3384 -2.3384 -1.9411 -1.9411 -1.7866 -1.7866 -1.6269 -1.6269 -1.0021 -1.0021 -0.8354 -0.8354 -0.0836 -0.0836 0.0494 0.0494 0.2746 0.2746 0.4569 0.4569 0.5487 0.5487 0.7429 0.7429 1.5420 1.5420 1.6608 1.6608 4.8991 4.8991 5.2109 5.2109 5.2696 5.2696 5.5441 5.5441 5.7275 5.7275 6.0159 6.0159 7.3200 7.3200 k =-0.3816-0.0484 0.1096 ( 11771 PWs) bands (ev): -13.9949 -13.9949 -13.9170 -13.9170 -12.5755 -12.5755 -12.5163 -12.5163 -10.9493 -10.9493 -10.7817 -10.7817 -9.9993 -9.9993 -9.8172 -9.8172 -8.1411 -8.1411 -8.1298 -8.1298 -7.9104 -7.9104 -7.8324 -7.8324 -5.2777 -5.2777 -5.1208 -5.1208 -4.4086 -4.4086 -4.3796 -4.3796 -3.0563 -3.0563 -3.0223 -3.0223 -2.8140 -2.8140 -2.6142 -2.6142 -2.3513 -2.3513 -1.9491 -1.9491 -1.7892 -1.7892 -1.6324 -1.6324 -1.0144 -1.0144 -0.8518 -0.8518 -0.0852 -0.0852 0.0365 0.0365 0.2708 0.2708 0.4490 0.4490 0.5515 0.5515 0.7328 0.7328 1.5431 1.5431 1.6576 1.6576 4.9093 4.9093 5.2215 5.2215 5.2819 5.2819 5.5312 5.5312 5.7421 5.7421 6.0167 6.0167 7.3235 7.3235 k =-0.3947-0.0501 0.1134 ( 11773 PWs) bands (ev): -13.9913 -13.9913 -13.9132 -13.9132 -12.5754 -12.5754 -12.5173 -12.5173 -10.9443 -10.9443 -10.7865 -10.7865 -9.9923 -9.9923 -9.8219 -9.8219 -8.1446 -8.1446 -8.1312 -8.1312 -7.9116 -7.9116 -7.8319 -7.8319 -5.2782 -5.2782 -5.1197 -5.1197 -4.4059 -4.4059 -4.3783 -4.3783 -3.0564 -3.0564 -3.0246 -3.0246 -2.8082 -2.8082 -2.6240 -2.6240 -2.3625 -2.3625 -1.9560 -1.9560 -1.7910 -1.7910 -1.6376 -1.6376 -1.0259 -1.0259 -0.8670 -0.8670 -0.0867 -0.0867 0.0238 0.0238 0.2676 0.2676 0.4409 0.4409 0.5567 0.5567 0.7232 0.7232 1.5440 1.5440 1.6546 1.6546 4.9189 4.9189 5.2313 5.2313 5.2948 5.2948 5.5139 5.5139 5.7605 5.7605 6.0165 6.0165 7.3263 7.3263 k =-0.4079-0.0518 0.1172 ( 11771 PWs) bands (ev): -13.9880 -13.9880 -13.9098 -13.9098 -12.5751 -12.5751 -12.5184 -12.5184 -10.9382 -10.9382 -10.7928 -10.7928 -9.9837 -9.9837 -9.8281 -9.8281 -8.1477 -8.1477 -8.1324 -8.1324 -7.9125 -7.9125 -7.8314 -7.8314 -5.2786 -5.2786 -5.1189 -5.1189 -4.4030 -4.4030 -4.3774 -4.3774 -3.0565 -3.0565 -3.0266 -3.0266 -2.8013 -2.8013 -2.6354 -2.6354 -2.3720 -2.3720 -1.9616 -1.9616 -1.7920 -1.7920 -1.6427 -1.6427 -1.0362 -1.0362 -0.8809 -0.8809 -0.0882 -0.0882 0.0116 0.0116 0.2649 0.2649 0.4332 0.4332 0.5635 0.5635 0.7140 0.7140 1.5445 1.5445 1.6517 1.6517 4.9278 4.9278 5.2407 5.2407 5.3075 5.3075 5.4946 5.4946 5.7804 5.7804 6.0155 6.0155 7.3288 7.3288 k =-0.4211-0.0534 0.1209 ( 11775 PWs) bands (ev): -13.9851 -13.9851 -13.9067 -13.9067 -12.5747 -12.5747 -12.5197 -12.5197 -10.9312 -10.9312 -10.8003 -10.8003 -9.9739 -9.9739 -9.8355 -9.8355 -8.1504 -8.1504 -8.1334 -8.1334 -7.9132 -7.9132 -7.8311 -7.8311 -5.2789 -5.2789 -5.1184 -5.1184 -4.4002 -4.4002 -4.3769 -4.3769 -3.0567 -3.0567 -3.0282 -3.0282 -2.7936 -2.7936 -2.6478 -2.6478 -2.3801 -2.3801 -1.9661 -1.9661 -1.7924 -1.7924 -1.6475 -1.6475 -1.0452 -1.0452 -0.8935 -0.8935 -0.0894 -0.0894 0.0002 0.0002 0.2627 0.2627 0.4262 0.4262 0.5713 0.5713 0.7053 0.7053 1.5447 1.5447 1.6492 1.6492 4.9359 4.9359 5.2499 5.2499 5.3197 5.3197 5.4746 5.4746 5.8000 5.8000 6.0137 6.0137 7.3312 7.3312 k =-0.4342-0.0551 0.1247 ( 11782 PWs) bands (ev): -13.9826 -13.9826 -13.9041 -13.9041 -12.5741 -12.5741 -12.5209 -12.5209 -10.9234 -10.9234 -10.8087 -10.8087 -9.9631 -9.9631 -9.8440 -9.8440 -8.1527 -8.1527 -8.1344 -8.1344 -7.9137 -7.9137 -7.8309 -7.8309 -5.2790 -5.2790 -5.1181 -5.1181 -4.3975 -4.3975 -4.3766 -4.3766 -3.0569 -3.0569 -3.0294 -3.0294 -2.7851 -2.7851 -2.6610 -2.6610 -2.3868 -2.3868 -1.9696 -1.9696 -1.7923 -1.7923 -1.6520 -1.6520 -1.0530 -1.0530 -0.9044 -0.9044 -0.0904 -0.0904 -0.0102 -0.0102 0.2609 0.2609 0.4201 0.4201 0.5796 0.5796 0.6970 0.6970 1.5449 1.5449 1.6469 1.6469 4.9430 4.9430 5.2590 5.2590 5.3310 5.3310 5.4550 5.4550 5.8185 5.8185 6.0113 6.0113 7.3335 7.3335 k =-0.4474-0.0568 0.1285 ( 11784 PWs) bands (ev): -13.9806 -13.9806 -13.9019 -13.9019 -12.5736 -12.5736 -12.5221 -12.5221 -10.9149 -10.9149 -10.8179 -10.8179 -9.9514 -9.9514 -9.8536 -9.8536 -8.1547 -8.1547 -8.1352 -8.1352 -7.9140 -7.9140 -7.8307 -7.8307 -5.2791 -5.2791 -5.1180 -5.1180 -4.3948 -4.3948 -4.3767 -4.3767 -3.0572 -3.0572 -3.0303 -3.0303 -2.7759 -2.7759 -2.6746 -2.6746 -2.3923 -2.3923 -1.9723 -1.9723 -1.7918 -1.7918 -1.6559 -1.6559 -1.0593 -1.0593 -0.9136 -0.9136 -0.0910 -0.0910 -0.0192 -0.0192 0.2595 0.2595 0.4151 0.4151 0.5879 0.5879 0.6891 0.6891 1.5449 1.5449 1.6450 1.6450 4.9490 4.9490 5.2676 5.2676 5.3412 5.3412 5.4364 5.4364 5.8349 5.8349 6.0086 6.0086 7.3356 7.3356 k =-0.4605-0.0584 0.1323 ( 11800 PWs) bands (ev): -13.9789 -13.9789 -13.9002 -13.9002 -12.5730 -12.5730 -12.5232 -12.5232 -10.9062 -10.9062 -10.8272 -10.8272 -9.9391 -9.9391 -9.8642 -9.8642 -8.1562 -8.1562 -8.1358 -8.1358 -7.9142 -7.9142 -7.8306 -7.8306 -5.2791 -5.2791 -5.1180 -5.1180 -4.3925 -4.3925 -4.3770 -4.3770 -3.0574 -3.0574 -3.0308 -3.0308 -2.7660 -2.7660 -2.6881 -2.6881 -2.3965 -2.3965 -1.9742 -1.9742 -1.7912 -1.7912 -1.6593 -1.6593 -1.0642 -1.0642 -0.9210 -0.9210 -0.0914 -0.0914 -0.0267 -0.0267 0.2584 0.2584 0.4112 0.4112 0.5958 0.5958 0.6820 0.6820 1.5449 1.5449 1.6435 1.6435 4.9539 4.9539 5.2757 5.2757 5.3502 5.3502 5.4194 5.4194 5.8486 5.8486 6.0058 6.0058 7.3375 7.3375 k =-0.4737-0.0601 0.1361 ( 11795 PWs) bands (ev): -13.9778 -13.9778 -13.8990 -13.8990 -12.5726 -12.5726 -12.5240 -12.5240 -10.8979 -10.8979 -10.8361 -10.8361 -9.9265 -9.9265 -9.8754 -9.8754 -8.1573 -8.1573 -8.1363 -8.1363 -7.9144 -7.9144 -7.8306 -7.8306 -5.2791 -5.2791 -5.1180 -5.1180 -4.3906 -4.3906 -4.3774 -4.3774 -3.0577 -3.0577 -3.0311 -3.0311 -2.7558 -2.7558 -2.7011 -2.7011 -2.3995 -2.3995 -1.9755 -1.9755 -1.7905 -1.7905 -1.6618 -1.6618 -1.0677 -1.0677 -0.9264 -0.9264 -0.0915 -0.0915 -0.0324 -0.0324 0.2576 0.2576 0.4084 0.4084 0.6025 0.6025 0.6759 0.6759 1.5448 1.5448 1.6424 1.6424 4.9575 4.9575 5.2825 5.2825 5.3581 5.3581 5.4047 5.4047 5.8590 5.8590 6.0034 6.0034 7.3391 7.3391 k =-0.4868-0.0618 0.1398 ( 11799 PWs) bands (ev): -13.9770 -13.9770 -13.8983 -13.8983 -12.5723 -12.5723 -12.5245 -12.5245 -10.8911 -10.8911 -10.8432 -10.8432 -9.9140 -9.9140 -9.8871 -9.8871 -8.1579 -8.1579 -8.1365 -8.1365 -7.9144 -7.9144 -7.8306 -7.8306 -5.2791 -5.2791 -5.1180 -5.1180 -4.3893 -4.3893 -4.3778 -4.3778 -3.0579 -3.0579 -3.0312 -3.0312 -2.7459 -2.7459 -2.7128 -2.7128 -2.4013 -2.4013 -1.9763 -1.9763 -1.7900 -1.7900 -1.6634 -1.6634 -1.0697 -1.0697 -0.9297 -0.9297 -0.0914 -0.0914 -0.0359 -0.0359 0.2571 0.2571 0.4068 0.4068 0.6072 0.6072 0.6716 0.6716 1.5448 1.5448 1.6417 1.6417 4.9597 4.9597 5.2872 5.2872 5.3648 5.3648 5.3931 5.3931 5.8656 5.8656 6.0017 6.0017 7.3401 7.3401 k =-0.5000-0.0635 0.1436 ( 11794 PWs) bands (ev): -13.9768 -13.9768 -13.8980 -13.8980 -12.5722 -12.5722 -12.5247 -12.5247 -10.8883 -10.8883 -10.8462 -10.8462 -9.9050 -9.9050 -9.8959 -9.8959 -8.1581 -8.1581 -8.1366 -8.1366 -7.9144 -7.9144 -7.8305 -7.8305 -5.2791 -5.2791 -5.1180 -5.1180 -4.3888 -4.3888 -4.3780 -4.3780 -3.0579 -3.0579 -3.0313 -3.0313 -2.7403 -2.7403 -2.7189 -2.7189 -2.4019 -2.4019 -1.9765 -1.9765 -1.7898 -1.7898 -1.6640 -1.6640 -1.0704 -1.0704 -0.9308 -0.9308 -0.0914 -0.0914 -0.0371 -0.0371 0.2570 0.2570 0.4062 0.4062 0.6089 0.6089 0.6701 0.6701 1.5448 1.5448 1.6415 1.6415 4.9604 4.9604 5.2889 5.2889 5.3684 5.3684 5.3878 5.3878 5.8678 5.8678 6.0011 6.0011 7.3404 7.3404 k =-0.5000-0.4432 0.1407 ( 11766 PWs) bands (ev): -13.9726 -13.9726 -13.8572 -13.8572 -12.5703 -12.5703 -12.5258 -12.5258 -10.9244 -10.9244 -10.8721 -10.8721 -9.9431 -9.9431 -9.8802 -9.8802 -8.2148 -8.2148 -8.1241 -8.1241 -7.9470 -7.9470 -7.8395 -7.8395 -5.2192 -5.2192 -5.1581 -5.1581 -4.5278 -4.5278 -4.3407 -4.3407 -3.0920 -3.0920 -2.9772 -2.9772 -2.7108 -2.7108 -2.5924 -2.5924 -2.3190 -2.3190 -2.1206 -2.1206 -1.7969 -1.7969 -1.7002 -1.7002 -1.0301 -1.0301 -0.5962 -0.5962 -0.2678 -0.2678 0.0382 0.0382 0.0979 0.0979 0.6531 0.6531 0.7020 0.7020 0.9460 0.9460 1.4648 1.4648 1.6856 1.6856 4.7375 4.7375 5.0983 5.0983 5.4150 5.4150 5.5991 5.5991 5.6515 5.6515 5.9681 5.9681 6.8875 6.8875 k =-0.4898-0.4342 0.1378 ( 11763 PWs) bands (ev): -13.9727 -13.9727 -13.8573 -13.8573 -12.5702 -12.5702 -12.5260 -12.5260 -10.9240 -10.9240 -10.8723 -10.8723 -9.9428 -9.9428 -9.8806 -9.8806 -8.2148 -8.2148 -8.1241 -8.1241 -7.9467 -7.9467 -7.8395 -7.8395 -5.2193 -5.2193 -5.1582 -5.1582 -4.5274 -4.5274 -4.3409 -4.3409 -3.0924 -3.0924 -2.9779 -2.9779 -2.7100 -2.7100 -2.5919 -2.5919 -2.3196 -2.3196 -2.1208 -2.1208 -1.7957 -1.7957 -1.6994 -1.6994 -1.0293 -1.0293 -0.5965 -0.5965 -0.2668 -0.2668 0.0371 0.0371 0.0999 0.0999 0.6507 0.6507 0.7035 0.7035 0.9458 0.9458 1.4654 1.4654 1.6851 1.6851 4.7380 4.7380 5.0971 5.0971 5.4143 5.4143 5.5914 5.5914 5.6591 5.6591 5.9678 5.9678 6.8888 6.8888 k =-0.4796-0.4251 0.1349 ( 11767 PWs) bands (ev): -13.9729 -13.9729 -13.8579 -13.8579 -12.5700 -12.5700 -12.5266 -12.5266 -10.9231 -10.9231 -10.8732 -10.8732 -9.9417 -9.9417 -9.8817 -9.8817 -8.2148 -8.2148 -8.1240 -8.1240 -7.9457 -7.9457 -7.8396 -7.8396 -5.2195 -5.2195 -5.1586 -5.1586 -4.5261 -4.5261 -4.3414 -4.3414 -3.0934 -3.0934 -2.9800 -2.9800 -2.7077 -2.7077 -2.5905 -2.5905 -2.3212 -2.3212 -2.1215 -2.1215 -1.7924 -1.7924 -1.6971 -1.6971 -1.0269 -1.0269 -0.5975 -0.5975 -0.2639 -0.2639 0.0341 0.0341 0.1056 0.1056 0.6443 0.6443 0.7072 0.7072 0.9453 0.9453 1.4672 1.4672 1.6838 1.6838 4.7395 4.7395 5.0936 5.0936 5.4121 5.4121 5.5750 5.5750 5.6750 5.6750 5.9670 5.9670 6.8928 6.8928 k =-0.4694-0.4161 0.1321 ( 11765 PWs) bands (ev): -13.9733 -13.9733 -13.8588 -13.8588 -12.5697 -12.5697 -12.5276 -12.5276 -10.9215 -10.9215 -10.8746 -10.8746 -9.9399 -9.9399 -9.8834 -9.8834 -8.2148 -8.2148 -8.1238 -8.1238 -7.9441 -7.9441 -7.8397 -7.8397 -5.2198 -5.2198 -5.1593 -5.1593 -4.5241 -4.5241 -4.3423 -4.3423 -3.0952 -3.0952 -2.9833 -2.9833 -2.7042 -2.7042 -2.5881 -2.5881 -2.3234 -2.3234 -2.1223 -2.1223 -1.7875 -1.7875 -1.6931 -1.6931 -1.0229 -1.0229 -0.5990 -0.5990 -0.2591 -0.2591 0.0301 0.0301 0.1140 0.1140 0.6355 0.6355 0.7116 0.7116 0.9445 0.9445 1.4702 1.4702 1.6815 1.6815 4.7420 4.7420 5.0878 5.0878 5.4087 5.4087 5.5564 5.5564 5.6928 5.6928 5.9655 5.9655 6.8995 6.8995 k =-0.4592-0.4071 0.1292 ( 11778 PWs) bands (ev): -13.9739 -13.9739 -13.8600 -13.8600 -12.5692 -12.5692 -12.5290 -12.5290 -10.9194 -10.9194 -10.8765 -10.8765 -9.9376 -9.9376 -9.8856 -9.8856 -8.2147 -8.2147 -8.1235 -8.1235 -7.9419 -7.9419 -7.8398 -7.8398 -5.2203 -5.2203 -5.1602 -5.1602 -4.5214 -4.5214 -4.3435 -4.3435 -3.0974 -3.0974 -2.9879 -2.9879 -2.7000 -2.7000 -2.5847 -2.5847 -2.3256 -2.3256 -2.1232 -2.1232 -1.7817 -1.7817 -1.6875 -1.6875 -1.0173 -1.0173 -0.6010 -0.6010 -0.2525 -0.2525 0.0260 0.0260 0.1244 0.1244 0.6252 0.6252 0.7159 0.7159 0.9433 0.9433 1.4742 1.4742 1.6783 1.6783 4.7452 4.7452 5.0798 5.0798 5.4039 5.4039 5.5377 5.5377 5.7105 5.7105 5.9635 5.9635 6.9087 6.9087 k =-0.4490-0.3980 0.1263 ( 11768 PWs) bands (ev): -13.9746 -13.9746 -13.8616 -13.8616 -12.5686 -12.5686 -12.5307 -12.5307 -10.9168 -10.9168 -10.8788 -10.8788 -9.9349 -9.9349 -9.8883 -9.8883 -8.2146 -8.2146 -8.1230 -8.1230 -7.9392 -7.9392 -7.8398 -7.8398 -5.2208 -5.2208 -5.1614 -5.1614 -4.5179 -4.5179 -4.3450 -4.3450 -3.1000 -3.1000 -2.9936 -2.9936 -2.6956 -2.6956 -2.5803 -2.5803 -2.3273 -2.3273 -2.1237 -2.1237 -1.7756 -1.7756 -1.6805 -1.6805 -1.0102 -1.0102 -0.6033 -0.6033 -0.2441 -0.2441 0.0221 0.0221 0.1363 0.1363 0.6143 0.6143 0.7194 0.7194 0.9418 0.9418 1.4791 1.4791 1.6743 1.6743 4.7490 4.7490 5.0697 5.0697 5.3979 5.3979 5.5199 5.5199 5.7275 5.7275 5.9606 5.9606 6.9205 6.9205 k =-0.4388-0.3890 0.1235 ( 11775 PWs) bands (ev): -13.9756 -13.9756 -13.8636 -13.8636 -12.5679 -12.5679 -12.5327 -12.5327 -10.9137 -10.9137 -10.8814 -10.8814 -9.9321 -9.9321 -9.8910 -9.8910 -8.2144 -8.2144 -8.1225 -8.1225 -7.9362 -7.9362 -7.8398 -7.8398 -5.2214 -5.2214 -5.1628 -5.1628 -4.5138 -4.5138 -4.3469 -4.3469 -3.1029 -3.1029 -3.0002 -3.0002 -2.6915 -2.6915 -2.5751 -2.5751 -2.3275 -2.3275 -2.1238 -2.1238 -1.7698 -1.7698 -1.6723 -1.6723 -1.0017 -1.0017 -0.6057 -0.6057 -0.2341 -0.2341 0.0189 0.0189 0.1493 0.1493 0.6030 0.6030 0.7221 0.7221 0.9400 0.9400 1.4847 1.4847 1.6695 1.6695 4.7533 4.7533 5.0578 5.0578 5.3907 5.3907 5.5033 5.5033 5.7433 5.7433 5.9570 5.9570 6.9347 6.9347 k =-0.4286-0.3799 0.1206 ( 11777 PWs) bands (ev): -13.9767 -13.9767 -13.8659 -13.8659 -12.5671 -12.5671 -12.5349 -12.5349 -10.9104 -10.9104 -10.8842 -10.8842 -9.9297 -9.9297 -9.8934 -9.8934 -8.2141 -8.2141 -8.1219 -8.1219 -7.9329 -7.9329 -7.8396 -7.8396 -5.2221 -5.2221 -5.1645 -5.1645 -4.5092 -4.5092 -4.3491 -4.3491 -3.1059 -3.1059 -3.0076 -3.0076 -2.6883 -2.6883 -2.5692 -2.5692 -2.3255 -2.3255 -2.1232 -2.1232 -1.7645 -1.7645 -1.6635 -1.6635 -0.9919 -0.9919 -0.6080 -0.6080 -0.2225 -0.2225 0.0165 0.0165 0.1633 0.1633 0.5917 0.5917 0.7238 0.7238 0.9378 0.9378 1.4908 1.4908 1.6639 1.6639 4.7577 4.7577 5.0444 5.0444 5.3825 5.3825 5.4882 5.4882 5.7579 5.7579 5.9526 5.9526 6.9511 6.9511 k =-0.4184-0.3709 0.1177 ( 11785 PWs) bands (ev): -13.9779 -13.9779 -13.8685 -13.8685 -12.5662 -12.5662 -12.5375 -12.5375 -10.9072 -10.9072 -10.8868 -10.8868 -9.9284 -9.9284 -9.8948 -9.8948 -8.2137 -8.2137 -8.1212 -8.1212 -7.9295 -7.9295 -7.8391 -7.8391 -5.2227 -5.2227 -5.1664 -5.1664 -4.5041 -4.5041 -4.3515 -4.3515 -3.1089 -3.1089 -3.0158 -3.0158 -2.6862 -2.6862 -2.5629 -2.5629 -2.3205 -2.3205 -2.1218 -2.1218 -1.7599 -1.7599 -1.6546 -1.6546 -0.9808 -0.9808 -0.6099 -0.6099 -0.2096 -0.2096 0.0153 0.0153 0.1779 0.1779 0.5806 0.5806 0.7248 0.7248 0.9352 0.9352 1.4974 1.4974 1.6577 1.6577 4.7620 4.7620 5.0299 5.0299 5.3733 5.3733 5.4747 5.4747 5.7711 5.7711 5.9475 5.9475 6.9696 6.9696 k =-0.4082-0.3618 0.1149 ( 11791 PWs) bands (ev): -13.9794 -13.9794 -13.8714 -13.8714 -12.5652 -12.5652 -12.5402 -12.5402 -10.9045 -10.9045 -10.8888 -10.8888 -9.9289 -9.9289 -9.8944 -9.8944 -8.2131 -8.2131 -8.1203 -8.1203 -7.9261 -7.9261 -7.8383 -7.8383 -5.2234 -5.2234 -5.1684 -5.1684 -4.4987 -4.4987 -4.3542 -4.3542 -3.1117 -3.1117 -3.0244 -3.0244 -2.6854 -2.6854 -2.5565 -2.5565 -2.3122 -2.3122 -2.1194 -2.1194 -1.7558 -1.7558 -1.6464 -1.6464 -0.9686 -0.9686 -0.6113 -0.6113 -0.1956 -0.1956 0.0152 0.0152 0.1930 0.1930 0.5699 0.5699 0.7250 0.7250 0.9323 0.9323 1.5043 1.5043 1.6508 1.6508 4.7657 4.7657 5.0147 5.0147 5.3634 5.3634 5.4628 5.4628 5.7831 5.7831 5.9419 5.9419 6.9899 6.9899 k =-0.3980-0.3528 0.1120 ( 11796 PWs) bands (ev): -13.9811 -13.9811 -13.8747 -13.8747 -12.5641 -12.5641 -12.5430 -12.5430 -10.9035 -10.9035 -10.8889 -10.8889 -9.9313 -9.9313 -9.8923 -9.8923 -8.2123 -8.2123 -8.1194 -8.1194 -7.9230 -7.9230 -7.8371 -7.8371 -5.2240 -5.2240 -5.1707 -5.1707 -4.4931 -4.4931 -4.3570 -4.3570 -3.1143 -3.1143 -3.0335 -3.0335 -2.6859 -2.6859 -2.5506 -2.5506 -2.3004 -2.3004 -2.1158 -2.1158 -1.7523 -1.7523 -1.6393 -1.6393 -0.9553 -0.9553 -0.6120 -0.6120 -0.1808 -0.1808 0.0165 0.0165 0.2083 0.2083 0.5596 0.5596 0.7249 0.7249 0.9290 0.9290 1.5113 1.5113 1.6435 1.6435 4.7685 4.7685 4.9993 4.9993 5.3529 5.3529 5.4525 5.4525 5.7938 5.7938 5.9358 5.9358 7.0118 7.0118 k =-0.3878-0.3437 0.1091 ( 11801 PWs) bands (ev): -13.9829 -13.9829 -13.8782 -13.8782 -12.5630 -12.5630 -12.5460 -12.5460 -10.9045 -10.9045 -10.8869 -10.8869 -9.9352 -9.9352 -9.8887 -9.8887 -8.2114 -8.2114 -8.1183 -8.1183 -7.9201 -7.9201 -7.8354 -7.8354 -5.2245 -5.2245 -5.1731 -5.1731 -4.4873 -4.4873 -4.3601 -4.3601 -3.1165 -3.1165 -3.0427 -3.0427 -2.6874 -2.6874 -2.5452 -2.5452 -2.2851 -2.2851 -2.1109 -2.1109 -1.7491 -1.7491 -1.6338 -1.6338 -0.9410 -0.9410 -0.6118 -0.6118 -0.1655 -0.1655 0.0193 0.0193 0.2236 0.2236 0.5499 0.5499 0.7245 0.7245 0.9253 0.9253 1.5182 1.5182 1.6359 1.6359 4.7699 4.7699 4.9843 4.9843 5.3422 5.3422 5.4434 5.4434 5.8031 5.8031 5.9297 5.9297 7.0348 7.0348 k =-0.3776-0.3347 0.1062 ( 11808 PWs) bands (ev): -13.9850 -13.9850 -13.8820 -13.8820 -12.5618 -12.5618 -12.5490 -12.5490 -10.9068 -10.9068 -10.8836 -10.8836 -9.9399 -9.9399 -9.8843 -9.8843 -8.2103 -8.2103 -8.1170 -8.1170 -7.9175 -7.9175 -7.8331 -7.8331 -5.2250 -5.2250 -5.1757 -5.1757 -4.4815 -4.4815 -4.3632 -4.3632 -3.1184 -3.1184 -3.0521 -3.0521 -2.6896 -2.6896 -2.5407 -2.5407 -2.2669 -2.2669 -2.1044 -2.1044 -1.7464 -1.7464 -1.6300 -1.6300 -0.9258 -0.9258 -0.6106 -0.6106 -0.1501 -0.1501 0.0237 0.0237 0.2386 0.2386 0.5410 0.5410 0.7242 0.7242 0.9212 0.9212 1.5248 1.5248 1.6283 1.6283 4.7697 4.7697 4.9699 4.9699 5.3314 5.3314 5.4354 5.4354 5.8112 5.8112 5.9237 5.9237 7.0587 7.0587 k =-0.3673-0.3256 0.1034 ( 11805 PWs) bands (ev): -13.9872 -13.9872 -13.8861 -13.8861 -12.5608 -12.5608 -12.5518 -12.5518 -10.9095 -10.9095 -10.8798 -10.8798 -9.9450 -9.9450 -9.8796 -9.8796 -8.2089 -8.2089 -8.1156 -8.1156 -7.9155 -7.9155 -7.8303 -7.8303 -5.2253 -5.2253 -5.1784 -5.1784 -4.4759 -4.4759 -4.3663 -4.3663 -3.1198 -3.1198 -3.0613 -3.0613 -2.6923 -2.6923 -2.5371 -2.5371 -2.2465 -2.2465 -2.0960 -2.0960 -1.7441 -1.7441 -1.6279 -1.6279 -0.9099 -0.9099 -0.6083 -0.6083 -0.1350 -0.1350 0.0297 0.0297 0.2530 0.2530 0.5330 0.5330 0.7242 0.7242 0.9167 0.9167 1.5308 1.5308 1.6210 1.6210 4.7674 4.7674 4.9566 4.9566 5.3211 5.3211 5.4281 5.4281 5.8180 5.8180 5.9183 5.9183 7.0829 7.0829 k =-0.3571-0.3166 0.1005 ( 11799 PWs) bands (ev): -13.9897 -13.9897 -13.8903 -13.8903 -12.5601 -12.5601 -12.5542 -12.5542 -10.9122 -10.9122 -10.8760 -10.8760 -9.9503 -9.9503 -9.8748 -9.8748 -8.2074 -8.2074 -8.1141 -8.1141 -7.9138 -7.9138 -7.8269 -7.8269 -5.2255 -5.2255 -5.1812 -5.1812 -4.4706 -4.4706 -4.3694 -4.3694 -3.1209 -3.1209 -3.0703 -3.0703 -2.6951 -2.6951 -2.5345 -2.5345 -2.2250 -2.2250 -2.0851 -2.0851 -1.7422 -1.7422 -1.6275 -1.6275 -0.8935 -0.8935 -0.6049 -0.6049 -0.1206 -0.1206 0.0373 0.0373 0.2666 0.2666 0.5261 0.5261 0.7249 0.7249 0.9119 0.9119 1.5356 1.5356 1.6148 1.6148 4.7630 4.7630 4.9446 4.9446 5.3114 5.3114 5.4214 5.4214 5.8233 5.8233 5.9136 5.9136 7.1071 7.1071 k =-0.3469-0.3076 0.0976 ( 11801 PWs) bands (ev): -13.9923 -13.9923 -13.8949 -13.8949 -12.5609 -12.5609 -12.5551 -12.5551 -10.9147 -10.9147 -10.8725 -10.8725 -9.9553 -9.9553 -9.8703 -9.8703 -8.2057 -8.2057 -8.1125 -8.1125 -7.9126 -7.9126 -7.8231 -7.8231 -5.2257 -5.2257 -5.1841 -5.1841 -4.4657 -4.4657 -4.3723 -4.3723 -3.1218 -3.1218 -3.0786 -3.0786 -2.6978 -2.6978 -2.5328 -2.5328 -2.2033 -2.2033 -2.0714 -2.0714 -1.7409 -1.7409 -1.6283 -1.6283 -0.8766 -0.8766 -0.6004 -0.6004 -0.1074 -0.1074 0.0464 0.0464 0.2792 0.2792 0.5208 0.5208 0.7263 0.7263 0.9068 0.9068 1.5383 1.5383 1.6104 1.6104 4.7566 4.7566 4.9338 4.9338 5.3028 5.3028 5.4151 5.4151 5.8273 5.8273 5.9099 5.9099 7.1306 7.1306 k =-0.3367-0.2985 0.0948 ( 11811 PWs) bands (ev): -13.9952 -13.9952 -13.8996 -13.8996 -12.5630 -12.5630 -12.5545 -12.5545 -10.9168 -10.9168 -10.8693 -10.8693 -9.9600 -9.9600 -9.8660 -9.8660 -8.2038 -8.2038 -8.1107 -8.1107 -7.9117 -7.9117 -7.8190 -7.8190 -5.2257 -5.2257 -5.1870 -5.1870 -4.4614 -4.4614 -4.3749 -4.3749 -3.1228 -3.1228 -3.0860 -3.0860 -2.7003 -2.7003 -2.5320 -2.5320 -2.1824 -2.1824 -2.0543 -2.0543 -1.7401 -1.7401 -1.6298 -1.6298 -0.8596 -0.8596 -0.5947 -0.5947 -0.0957 -0.0957 0.0567 0.0567 0.2904 0.2904 0.5174 0.5174 0.7286 0.7286 0.9015 0.9015 1.5380 1.5380 1.6090 1.6090 4.7485 4.7485 4.9241 4.9241 5.2954 5.2954 5.4089 5.4089 5.8298 5.8298 5.9072 5.9072 7.1529 7.1529 k =-0.3265-0.2895 0.0919 ( 11801 PWs) bands (ev): -13.9982 -13.9982 -13.9045 -13.9045 -12.5656 -12.5656 -12.5533 -12.5533 -10.9184 -10.9184 -10.8667 -10.8667 -9.9641 -9.9641 -9.8623 -9.8623 -8.2018 -8.2018 -8.1087 -8.1087 -7.9111 -7.9111 -7.8147 -7.8147 -5.2256 -5.2256 -5.1899 -5.1899 -4.4578 -4.4578 -4.3771 -4.3771 -3.1242 -3.1242 -3.0917 -3.0917 -2.7024 -2.7024 -2.5323 -2.5323 -2.1632 -2.1632 -2.0337 -2.0337 -1.7401 -1.7401 -1.6316 -1.6316 -0.8427 -0.8427 -0.5880 -0.5880 -0.0856 -0.0856 0.0677 0.0677 0.3002 0.3002 0.5161 0.5161 0.7320 0.7320 0.8963 0.8963 1.5344 1.5344 1.6108 1.6108 4.7392 4.7392 4.9152 4.9152 5.2894 5.2894 5.4028 5.4028 5.8311 5.8311 5.9054 5.9054 7.1728 7.1728 k =-0.3163-0.2804 0.0890 ( 11804 PWs) bands (ev): -14.0015 -14.0015 -13.9096 -13.9096 -12.5682 -12.5682 -12.5518 -12.5518 -10.9196 -10.9196 -10.8647 -10.8647 -9.9676 -9.9676 -9.8592 -9.8592 -8.1996 -8.1996 -8.1066 -8.1066 -7.9105 -7.9105 -7.8103 -7.8103 -5.2255 -5.2255 -5.1927 -5.1927 -4.4552 -4.4552 -4.3787 -4.3787 -3.1268 -3.1268 -3.0951 -3.0951 -2.7039 -2.7039 -2.5335 -2.5335 -2.1457 -2.1457 -2.0100 -2.0100 -1.7409 -1.7409 -1.6330 -1.6330 -0.8263 -0.8263 -0.5803 -0.5803 -0.0772 -0.0772 0.0788 0.0788 0.3086 0.3086 0.5172 0.5172 0.7363 0.7363 0.8913 0.8913 1.5280 1.5280 1.6155 1.6155 4.7292 4.7292 4.9069 4.9069 5.2850 5.2850 5.3967 5.3967 5.8314 5.8314 5.9042 5.9042 7.1883 7.1883 k =-0.3061-0.2714 0.0861 ( 11795 PWs) bands (ev): -14.0049 -14.0049 -13.9148 -13.9148 -12.5708 -12.5708 -12.5503 -12.5503 -10.9202 -10.9202 -10.8635 -10.8635 -9.9703 -9.9703 -9.8567 -9.8567 -8.1972 -8.1972 -8.1044 -8.1044 -7.9100 -7.9100 -7.8059 -7.8059 -5.2254 -5.2254 -5.1954 -5.1954 -4.4536 -4.4536 -4.3796 -4.3796 -3.1307 -3.1307 -3.0960 -3.0960 -2.7049 -2.7049 -2.5358 -2.5358 -2.1298 -2.1298 -1.9840 -1.9840 -1.7424 -1.7424 -1.6334 -1.6334 -0.8106 -0.8106 -0.5714 -0.5714 -0.0704 -0.0704 0.0892 0.0892 0.3159 0.3159 0.5210 0.5210 0.7415 0.7415 0.8869 0.8869 1.5197 1.5197 1.6221 1.6221 4.7189 4.7189 4.8991 4.8991 5.2822 5.2822 5.3907 5.3907 5.8309 5.8309 5.9030 5.9030 7.1946 7.1946 k =-0.2959-0.2623 0.0833 ( 11793 PWs) bands (ev): -14.0085 -14.0085 -13.9201 -13.9201 -12.5732 -12.5732 -12.5486 -12.5486 -10.9202 -10.9202 -10.8630 -10.8630 -9.9721 -9.9721 -9.8551 -9.8551 -8.1947 -8.1947 -8.1020 -8.1020 -7.9094 -7.9094 -7.8017 -7.8017 -5.2253 -5.2253 -5.1979 -5.1979 -4.4531 -4.4531 -4.3799 -4.3799 -3.1355 -3.1355 -3.0947 -3.0947 -2.7053 -2.7053 -2.5391 -2.5391 -2.1150 -2.1150 -1.9568 -1.9568 -1.7444 -1.7444 -1.6326 -1.6326 -0.7960 -0.7960 -0.5614 -0.5614 -0.0653 -0.0653 0.0983 0.0983 0.3225 0.3225 0.5274 0.5274 0.7474 0.7474 0.8834 0.8834 1.5102 1.5102 1.6299 1.6299 4.7087 4.7087 4.8916 4.8916 5.2808 5.2808 5.3847 5.3847 5.8299 5.8299 5.9017 5.9017 7.1863 7.1863 k =-0.2857-0.2533 0.0804 ( 11791 PWs) bands (ev): -14.0123 -14.0123 -13.9255 -13.9255 -12.5754 -12.5754 -12.5470 -12.5470 -10.9196 -10.9196 -10.8634 -10.8634 -9.9729 -9.9729 -9.8543 -9.8543 -8.1920 -8.1920 -8.0995 -8.0995 -7.9087 -7.9087 -7.7978 -7.7978 -5.2255 -5.2255 -5.1999 -5.1999 -4.4536 -4.4536 -4.3795 -4.3795 -3.1406 -3.1406 -3.0918 -3.0918 -2.7051 -2.7051 -2.5434 -2.5434 -2.1008 -2.1008 -1.9296 -1.9296 -1.7464 -1.7464 -1.6301 -1.6301 -0.7829 -0.7829 -0.5504 -0.5504 -0.0615 -0.0615 0.1055 0.1055 0.3288 0.3288 0.5362 0.5362 0.7538 0.7538 0.8812 0.8812 1.5002 1.5002 1.6382 1.6382 4.6990 4.6990 4.8846 4.8846 5.2806 5.2806 5.3790 5.3790 5.8284 5.8284 5.8999 5.8999 7.1679 7.1679 k =-0.2755-0.2442 0.0775 ( 11786 PWs) bands (ev): -14.0163 -14.0163 -13.9310 -13.9310 -12.5775 -12.5775 -12.5452 -12.5452 -10.9183 -10.9183 -10.8646 -10.8646 -9.9728 -9.9728 -9.8543 -9.8543 -8.1892 -8.1892 -8.0969 -8.0969 -7.9079 -7.9079 -7.7943 -7.7943 -5.2259 -5.2259 -5.2016 -5.2016 -4.4550 -4.4550 -4.3787 -4.3787 -3.1455 -3.1455 -3.0878 -3.0878 -2.7043 -2.7043 -2.5487 -2.5487 -2.0870 -2.0870 -1.9036 -1.9036 -1.7478 -1.7478 -1.6259 -1.6259 -0.7717 -0.7717 -0.5383 -0.5383 -0.0591 -0.0591 0.1105 0.1105 0.3354 0.3354 0.5470 0.5470 0.7602 0.7602 0.8807 0.8807 1.4901 1.4901 1.6467 1.6467 4.6900 4.6900 4.8782 4.8782 5.2814 5.2814 5.3738 5.3738 5.8266 5.8266 5.8975 5.8975 7.1462 7.1462 k =-0.2653-0.2352 0.0747 ( 11782 PWs) bands (ev): -14.0204 -14.0204 -13.9366 -13.9366 -12.5794 -12.5794 -12.5433 -12.5433 -10.9164 -10.9164 -10.8667 -10.8667 -9.9717 -9.9717 -9.8553 -9.8553 -8.1863 -8.1863 -8.0942 -8.0942 -7.9067 -7.9067 -7.7912 -7.7912 -5.2266 -5.2266 -5.2026 -5.2026 -4.4572 -4.4572 -4.3774 -4.3774 -3.1500 -3.1500 -3.0829 -3.0829 -2.7030 -2.7030 -2.5549 -2.5549 -2.0734 -2.0734 -1.8800 -1.8800 -1.7476 -1.7476 -1.6199 -1.6199 -0.7624 -0.7624 -0.5253 -0.5253 -0.0578 -0.0578 0.1134 0.1134 0.3424 0.3424 0.5594 0.5594 0.7664 0.7664 0.8823 0.8823 1.4802 1.4802 1.6549 1.6549 4.6818 4.6818 4.8726 4.8726 5.2826 5.2826 5.3694 5.3694 5.8243 5.8243 5.8946 5.8946 7.1240 7.1240 k =-0.2551-0.2261 0.0718 ( 11775 PWs) bands (ev): -14.0246 -14.0246 -13.9422 -13.9422 -12.5811 -12.5811 -12.5414 -12.5414 -10.9138 -10.9138 -10.8696 -10.8696 -9.9696 -9.9696 -9.8573 -9.8573 -8.1832 -8.1832 -8.0913 -8.0913 -7.9054 -7.9054 -7.7886 -7.7886 -5.2278 -5.2278 -5.2031 -5.2031 -4.4599 -4.4599 -4.3760 -4.3760 -3.1539 -3.1539 -3.0773 -3.0773 -2.7012 -2.7012 -2.5619 -2.5619 -2.0597 -2.0597 -1.8603 -1.8603 -1.7448 -1.7448 -1.6121 -1.6121 -0.7554 -0.7554 -0.5116 -0.5116 -0.0575 -0.0575 0.1143 0.1143 0.3503 0.3503 0.5726 0.5726 0.7724 0.7724 0.8862 0.8862 1.4708 1.4708 1.6626 1.6626 4.6744 4.6744 4.8679 4.8679 5.2836 5.2836 5.3665 5.3665 5.8214 5.8214 5.8915 5.8915 7.1024 7.1024 k =-0.2449-0.2171 0.0689 ( 11778 PWs) bands (ev): -14.0290 -14.0290 -13.9477 -13.9477 -12.5827 -12.5827 -12.5394 -12.5394 -10.9106 -10.9106 -10.8733 -10.8733 -9.9664 -9.9664 -9.8602 -9.8602 -8.1799 -8.1799 -8.0883 -8.0883 -7.9038 -7.9038 -7.7867 -7.7867 -5.2293 -5.2293 -5.2030 -5.2030 -4.4631 -4.4631 -4.3746 -4.3746 -3.1571 -3.1571 -3.0712 -3.0712 -2.6992 -2.6992 -2.5695 -2.5695 -2.0459 -2.0459 -1.8455 -1.8455 -1.7385 -1.7385 -1.6025 -1.6025 -0.7505 -0.7505 -0.4975 -0.4975 -0.0582 -0.0582 0.1140 0.1140 0.3589 0.3589 0.5859 0.5859 0.7782 0.7782 0.8925 0.8925 1.4621 1.4621 1.6696 1.6696 4.6680 4.6680 4.8644 4.8644 5.2836 5.2836 5.3655 5.3655 5.8176 5.8176 5.8885 5.8885 7.0818 7.0818 k =-0.2347-0.2081 0.0660 ( 11769 PWs) bands (ev): -14.0334 -14.0334 -13.9533 -13.9533 -12.5841 -12.5841 -12.5373 -12.5373 -10.9067 -10.9067 -10.8778 -10.8778 -9.9624 -9.9624 -9.8640 -9.8640 -8.1764 -8.1764 -8.0852 -8.0852 -7.9019 -7.9019 -7.7853 -7.7853 -5.2309 -5.2309 -5.2024 -5.2024 -4.4665 -4.4665 -4.3733 -4.3733 -3.1596 -3.1596 -3.0648 -3.0648 -2.6969 -2.6969 -2.5776 -2.5776 -2.0320 -2.0320 -1.8356 -1.8356 -1.7287 -1.7287 -1.5912 -1.5912 -0.7478 -0.7478 -0.4836 -0.4836 -0.0598 -0.0598 0.1130 0.1130 0.3683 0.3683 0.5988 0.5988 0.7840 0.7840 0.9009 0.9009 1.4546 1.4546 1.6757 1.6757 4.6625 4.6625 4.8621 4.8621 5.2821 5.2821 5.3670 5.3670 5.8126 5.8126 5.8864 5.8864 7.0622 7.0622 k =-0.2245-0.1990 0.0632 ( 11766 PWs) bands (ev): -14.0380 -14.0380 -13.9588 -13.9588 -12.5854 -12.5854 -12.5350 -12.5350 -10.9023 -10.9023 -10.8829 -10.8829 -9.9575 -9.9575 -9.8688 -9.8688 -8.1728 -8.1728 -8.0821 -8.0821 -7.8999 -7.8999 -7.7846 -7.7846 -5.2327 -5.2327 -5.2015 -5.2015 -4.4701 -4.4701 -4.3721 -4.3721 -3.1613 -3.1613 -3.0581 -3.0581 -2.6947 -2.6947 -2.5858 -2.5858 -2.0181 -2.0181 -1.8298 -1.8298 -1.7165 -1.7165 -1.5782 -1.5782 -0.7471 -0.7471 -0.4703 -0.4703 -0.0621 -0.0621 0.1122 0.1122 0.3783 0.3783 0.6104 0.6104 0.7902 0.7902 0.9110 0.9110 1.4483 1.4483 1.6808 1.6808 4.6578 4.6578 4.8611 4.8611 5.2788 5.2788 5.3710 5.3710 5.8062 5.8062 5.8856 5.8856 7.0439 7.0439 k =-0.2143-0.1900 0.0603 ( 11763 PWs) bands (ev): -14.0426 -14.0426 -13.9642 -13.9642 -12.5866 -12.5866 -12.5327 -12.5327 -10.8976 -10.8976 -10.8883 -10.8883 -9.9518 -9.9518 -9.8744 -9.8744 -8.1689 -8.1689 -8.0788 -8.0788 -7.8976 -7.8976 -7.7846 -7.7846 -5.2346 -5.2346 -5.2003 -5.2003 -4.4738 -4.4738 -4.3712 -4.3712 -3.1623 -3.1623 -3.0512 -3.0512 -2.6928 -2.6928 -2.5936 -2.5936 -2.0043 -2.0043 -1.8267 -1.8267 -1.7031 -1.7031 -1.5639 -1.5639 -0.7481 -0.7481 -0.4583 -0.4583 -0.0650 -0.0650 0.1123 0.1123 0.3889 0.3889 0.6204 0.6204 0.7970 0.7970 0.9223 0.9223 1.4435 1.4435 1.6847 1.6847 4.6539 4.6539 4.8614 4.8614 5.2739 5.2739 5.3772 5.3772 5.7987 5.7987 5.8866 5.8866 7.0267 7.0267 k =-0.2041-0.1809 0.0574 ( 11764 PWs) bands (ev): -14.0472 -14.0472 -13.9696 -13.9696 -12.5877 -12.5877 -12.5302 -12.5302 -10.8967 -10.8967 -10.8899 -10.8899 -9.9454 -9.9454 -9.8808 -9.8808 -8.1648 -8.1648 -8.0754 -8.0754 -7.8951 -7.8951 -7.7853 -7.7853 -5.2363 -5.2363 -5.1989 -5.1989 -4.4775 -4.4775 -4.3706 -4.3706 -3.1625 -3.1625 -3.0443 -3.0443 -2.6918 -2.6918 -2.6006 -2.6006 -1.9907 -1.9907 -1.8250 -1.8250 -1.6894 -1.6894 -1.5486 -1.5486 -0.7506 -0.7506 -0.4481 -0.4481 -0.0682 -0.0682 0.1139 0.1139 0.3998 0.3998 0.6286 0.6286 0.8046 0.8046 0.9344 0.9344 1.4406 1.4406 1.6876 1.6876 4.6508 4.6508 4.8629 4.8629 5.2680 5.2680 5.3850 5.3850 5.7902 5.7902 5.8894 5.8894 7.0107 7.0107 k =-0.1939-0.1719 0.0546 ( 11762 PWs) bands (ev): -14.0518 -14.0518 -13.9748 -13.9748 -12.5887 -12.5887 -12.5277 -12.5277 -10.9027 -10.9027 -10.8846 -10.8846 -9.9385 -9.9385 -9.8878 -9.8878 -8.1605 -8.1605 -8.0720 -8.0720 -7.8926 -7.8926 -7.7867 -7.7867 -5.2379 -5.2379 -5.1975 -5.1975 -4.4811 -4.4811 -4.3703 -4.3703 -3.1620 -3.1620 -3.0375 -3.0375 -2.6922 -2.6922 -2.6059 -2.6059 -1.9775 -1.9775 -1.8241 -1.8241 -1.6759 -1.6759 -1.5327 -1.5327 -0.7543 -0.7543 -0.4405 -0.4405 -0.0714 -0.0714 0.1172 0.1172 0.4108 0.4108 0.6352 0.6352 0.8128 0.8128 0.9466 0.9466 1.4398 1.4398 1.6892 1.6892 4.6483 4.6483 4.8654 4.8654 5.2614 5.2614 5.3938 5.3938 5.7814 5.7814 5.8941 5.8941 6.9959 6.9959 k =-0.1837-0.1628 0.0517 ( 11755 PWs) bands (ev): -14.0564 -14.0564 -13.9799 -13.9799 -12.5896 -12.5896 -12.5250 -12.5250 -10.9096 -10.9096 -10.8781 -10.8781 -9.9314 -9.9314 -9.8954 -9.8954 -8.1559 -8.1559 -8.0686 -8.0686 -7.8899 -7.8899 -7.7887 -7.7887 -5.2394 -5.2394 -5.1959 -5.1959 -4.4846 -4.4846 -4.3703 -4.3703 -3.1608 -3.1608 -3.0307 -3.0307 -2.6946 -2.6946 -2.6090 -2.6090 -1.9652 -1.9652 -1.8234 -1.8234 -1.6626 -1.6626 -1.5165 -1.5165 -0.7587 -0.7587 -0.4361 -0.4361 -0.0740 -0.0740 0.1225 0.1225 0.4217 0.4217 0.6407 0.6407 0.8214 0.8214 0.9586 0.9586 1.4412 1.4412 1.6896 1.6896 4.6464 4.6464 4.8688 4.8688 5.2549 5.2549 5.4028 5.4028 5.7726 5.7726 5.9007 5.9007 6.9824 6.9824 k =-0.1735-0.1538 0.0488 ( 11754 PWs) bands (ev): -14.0610 -14.0610 -13.9848 -13.9848 -12.5905 -12.5905 -12.5222 -12.5222 -10.9170 -10.9170 -10.8711 -10.8711 -9.9248 -9.9248 -9.9026 -9.9026 -8.1510 -8.1510 -8.0651 -8.0651 -7.8873 -7.8873 -7.7914 -7.7914 -5.2407 -5.2407 -5.1943 -5.1943 -4.4880 -4.4880 -4.3706 -4.3706 -3.1589 -3.1589 -3.0242 -3.0242 -2.6992 -2.6992 -2.6095 -2.6095 -1.9540 -1.9540 -1.8225 -1.8225 -1.6494 -1.6494 -1.5004 -1.5004 -0.7637 -0.7637 -0.4352 -0.4352 -0.0755 -0.0755 0.1296 0.1296 0.4320 0.4320 0.6455 0.6455 0.8299 0.8299 0.9697 0.9697 1.4449 1.4449 1.6888 1.6888 4.6452 4.6452 4.8729 4.8729 5.2489 5.2489 5.4116 5.4116 5.7644 5.7644 5.9091 5.9091 6.9702 6.9702 k =-0.1633-0.1447 0.0459 ( 11755 PWs) bands (ev): -14.0655 -14.0655 -13.9895 -13.9895 -12.5914 -12.5914 -12.5193 -12.5193 -10.9245 -10.9245 -10.8638 -10.8638 -9.9220 -9.9220 -9.9063 -9.9063 -8.1460 -8.1460 -8.0616 -8.0616 -7.8847 -7.8847 -7.7947 -7.7947 -5.2418 -5.2418 -5.1927 -5.1927 -4.4912 -4.4912 -4.3712 -4.3712 -3.1564 -3.1564 -3.0179 -3.0179 -2.7059 -2.7059 -2.6075 -2.6075 -1.9445 -1.9445 -1.8211 -1.8211 -1.6363 -1.6363 -1.4847 -1.4847 -0.7689 -0.7689 -0.4381 -0.4381 -0.0755 -0.0755 0.1381 0.1381 0.4414 0.4414 0.6503 0.6503 0.8381 0.8381 0.9797 0.9797 1.4512 1.4512 1.6868 1.6868 4.6445 4.6445 4.8773 4.8773 5.2439 5.2439 5.4197 5.4197 5.7570 5.7570 5.9191 5.9191 6.9594 6.9594 k =-0.1531-0.1357 0.0431 ( 11761 PWs) bands (ev): -14.0698 -14.0698 -13.9941 -13.9941 -12.5923 -12.5923 -12.5164 -12.5164 -10.9321 -10.9321 -10.8562 -10.8562 -9.9274 -9.9274 -9.9020 -9.9020 -8.1407 -8.1407 -8.0581 -8.0581 -7.8821 -7.8821 -7.7986 -7.7986 -5.2427 -5.2427 -5.1910 -5.1910 -4.4943 -4.4943 -4.3722 -4.3722 -3.1534 -3.1534 -3.0119 -3.0119 -2.7142 -2.7142 -2.6033 -2.6033 -1.9372 -1.9372 -1.8186 -1.8186 -1.6231 -1.6231 -1.4693 -1.4693 -0.7739 -0.7739 -0.4447 -0.4447 -0.0738 -0.0738 0.1477 0.1477 0.4497 0.4497 0.6558 0.6558 0.8459 0.8459 0.9884 0.9884 1.4597 1.4597 1.6838 1.6838 4.6444 4.6444 4.8819 4.8819 5.2403 5.2403 5.4268 5.4268 5.7508 5.7508 5.9306 5.9306 6.9500 6.9500 k =-0.1429-0.1266 0.0402 ( 11754 PWs) bands (ev): -14.0741 -14.0741 -13.9984 -13.9984 -12.5931 -12.5931 -12.5134 -12.5134 -10.9396 -10.9396 -10.8483 -10.8483 -9.9362 -9.9362 -9.8945 -9.8945 -8.1351 -8.1351 -8.0547 -8.0547 -7.8797 -7.8797 -7.8028 -7.8028 -5.2434 -5.2434 -5.1895 -5.1895 -4.4971 -4.4971 -4.3733 -4.3733 -3.1498 -3.1498 -3.0063 -3.0063 -2.7235 -2.7235 -2.5975 -2.5975 -1.9328 -1.9328 -1.8148 -1.8148 -1.6099 -1.6099 -1.4545 -1.4545 -0.7786 -0.7786 -0.4547 -0.4547 -0.0706 -0.0706 0.1579 0.1579 0.4565 0.4565 0.6624 0.6624 0.8529 0.8529 0.9955 0.9955 1.4704 1.4704 1.6798 1.6798 4.6448 4.6448 4.8863 4.8863 5.2384 5.2384 5.4326 5.4326 5.7459 5.7459 5.9431 5.9431 6.9421 6.9421 k =-0.1327-0.1176 0.0373 ( 11753 PWs) bands (ev): -14.0782 -14.0782 -14.0025 -14.0025 -12.5939 -12.5939 -12.5104 -12.5104 -10.9470 -10.9470 -10.8404 -10.8404 -9.9459 -9.9459 -9.8864 -9.8864 -8.1294 -8.1294 -8.0513 -8.0513 -7.8776 -7.8776 -7.8075 -7.8075 -5.2439 -5.2439 -5.1879 -5.1879 -4.4998 -4.4998 -4.3747 -4.3747 -3.1459 -3.1459 -3.0010 -3.0010 -2.7333 -2.7333 -2.5906 -2.5906 -1.9313 -1.9313 -1.8094 -1.8094 -1.5965 -1.5965 -1.4404 -1.4404 -0.7827 -0.7827 -0.4676 -0.4676 -0.0661 -0.0661 0.1683 0.1683 0.4617 0.4617 0.6705 0.6705 0.8590 0.8590 1.0012 1.0012 1.4828 1.4828 1.6748 1.6748 4.6456 4.6456 4.8904 4.8904 5.2387 5.2387 5.4370 5.4370 5.7426 5.7426 5.9564 5.9564 6.9355 6.9355 k =-0.1224-0.1085 0.0345 ( 11750 PWs) bands (ev): -14.0821 -14.0821 -14.0064 -14.0064 -12.5947 -12.5947 -12.5074 -12.5074 -10.9542 -10.9542 -10.8324 -10.8324 -9.9559 -9.9559 -9.8783 -9.8783 -8.1236 -8.1236 -8.0480 -8.0480 -7.8757 -7.8757 -7.8124 -7.8124 -5.2442 -5.2442 -5.1864 -5.1864 -4.5022 -4.5022 -4.3762 -4.3762 -3.1417 -3.1417 -2.9960 -2.9960 -2.7434 -2.7434 -2.5828 -2.5828 -1.9330 -1.9330 -1.8024 -1.8024 -1.5831 -1.5831 -1.4268 -1.4268 -0.7861 -0.7861 -0.4825 -0.4825 -0.0609 -0.0609 0.1786 0.1786 0.4653 0.4653 0.6803 0.6803 0.8643 0.8643 1.0057 1.0057 1.4966 1.4966 1.6692 1.6692 4.6469 4.6469 4.8941 4.8941 5.2411 5.2411 5.4398 5.4398 5.7408 5.7408 5.9698 5.9698 6.9297 6.9297 k =-0.1122-0.0995 0.0316 ( 11747 PWs) bands (ev): -14.0858 -14.0858 -14.0100 -14.0100 -12.5954 -12.5954 -12.5045 -12.5045 -10.9611 -10.9611 -10.8246 -10.8246 -9.9659 -9.9659 -9.8703 -9.8703 -8.1176 -8.1176 -8.0448 -8.0448 -7.8743 -7.8743 -7.8174 -7.8174 -5.2444 -5.2444 -5.1850 -5.1850 -4.5044 -4.5044 -4.3778 -4.3778 -3.1372 -3.1372 -2.9914 -2.9914 -2.7535 -2.7535 -2.5745 -2.5745 -1.9373 -1.9373 -1.7944 -1.7944 -1.5698 -1.5698 -1.4140 -1.4140 -0.7889 -0.7889 -0.4987 -0.4987 -0.0553 -0.0553 0.1884 0.1884 0.4675 0.4675 0.6916 0.6916 0.8686 0.8686 1.0090 1.0090 1.5110 1.5110 1.6629 1.6629 4.6486 4.6486 4.8974 4.8974 5.2457 5.2457 5.4413 5.4413 5.7407 5.7407 5.9829 5.9829 6.9238 6.9238 k =-0.1020-0.0905 0.0287 ( 11743 PWs) bands (ev): -14.0893 -14.0893 -14.0133 -14.0133 -12.5961 -12.5961 -12.5017 -12.5017 -10.9677 -10.9677 -10.8169 -10.8169 -9.9757 -9.9757 -9.8626 -9.8626 -8.1117 -8.1117 -8.0417 -8.0417 -7.8733 -7.8733 -7.8223 -7.8223 -5.2444 -5.2444 -5.1837 -5.1837 -4.5064 -4.5064 -4.3796 -4.3796 -3.1326 -3.1326 -2.9871 -2.9871 -2.7633 -2.7633 -2.5659 -2.5659 -1.9438 -1.9438 -1.7857 -1.7857 -1.5566 -1.5566 -1.4019 -1.4019 -0.7910 -0.7910 -0.5153 -0.5153 -0.0501 -0.0501 0.1975 0.1975 0.4684 0.4684 0.7043 0.7043 0.8719 0.8719 1.0116 1.0116 1.5256 1.5256 1.6565 1.6565 4.6506 4.6506 4.9001 4.9001 5.2523 5.2523 5.4413 5.4413 5.7424 5.7424 5.9951 5.9951 6.9161 6.9161 k =-0.0918-0.0814 0.0258 ( 11752 PWs) bands (ev): -14.0925 -14.0925 -14.0163 -14.0163 -12.5968 -12.5968 -12.4990 -12.4990 -10.9738 -10.9738 -10.8095 -10.8095 -9.9852 -9.9852 -9.8553 -9.8553 -8.1058 -8.1058 -8.0387 -8.0387 -7.8729 -7.8729 -7.8269 -7.8269 -5.2443 -5.2443 -5.1825 -5.1825 -4.5082 -4.5082 -4.3813 -4.3813 -3.1280 -3.1280 -2.9832 -2.9832 -2.7727 -2.7727 -2.5572 -2.5572 -1.9519 -1.9519 -1.7767 -1.7767 -1.5438 -1.5438 -1.3906 -1.3906 -0.7927 -0.7927 -0.5316 -0.5316 -0.0455 -0.0455 0.2059 0.2059 0.4684 0.4684 0.7180 0.7180 0.8743 0.8743 1.0135 1.0135 1.5396 1.5396 1.6501 1.6501 4.6529 4.6529 4.9025 4.9025 5.2607 5.2607 5.4400 5.4400 5.7459 5.7459 6.0059 6.0059 6.9048 6.9048 k =-0.0816-0.0724 0.0230 ( 11745 PWs) bands (ev): -14.0955 -14.0955 -14.0191 -14.0191 -12.5975 -12.5975 -12.4964 -12.4964 -10.9795 -10.9795 -10.8025 -10.8025 -9.9942 -9.9942 -9.8485 -9.8485 -8.1001 -8.1001 -8.0359 -8.0359 -7.8733 -7.8733 -7.8309 -7.8309 -5.2442 -5.2442 -5.1813 -5.1813 -4.5098 -4.5098 -4.3830 -4.3830 -3.1234 -3.1234 -2.9797 -2.9797 -2.7815 -2.7815 -2.5485 -2.5485 -1.9609 -1.9609 -1.7679 -1.7679 -1.5314 -1.5314 -1.3802 -1.3802 -0.7941 -0.7941 -0.5469 -0.5469 -0.0419 -0.0419 0.2135 0.2135 0.4678 0.4678 0.7324 0.7324 0.8756 0.8756 1.0152 1.0152 1.5523 1.5523 1.6444 1.6444 4.6553 4.6553 4.9045 4.9045 5.2703 5.2703 5.4376 5.4376 5.7510 5.7510 6.0150 6.0150 6.8902 6.8902 k =-0.0714-0.0633 0.0201 ( 11739 PWs) bands (ev): -14.0981 -14.0981 -14.0215 -14.0215 -12.5981 -12.5981 -12.4941 -12.4941 -10.9845 -10.9845 -10.7960 -10.7960 -10.0025 -10.0025 -9.8423 -9.8423 -8.0945 -8.0945 -8.0333 -8.0333 -7.8745 -7.8745 -7.8342 -7.8342 -5.2439 -5.2439 -5.1803 -5.1803 -4.5112 -4.5112 -4.3847 -4.3847 -3.1190 -3.1190 -2.9764 -2.9764 -2.7897 -2.7897 -2.5402 -2.5402 -1.9705 -1.9705 -1.7595 -1.7595 -1.5197 -1.5197 -1.3708 -1.3708 -0.7956 -0.7956 -0.5604 -0.5604 -0.0396 -0.0396 0.2204 0.2204 0.4667 0.4667 0.7471 0.7471 0.8760 0.8760 1.0166 1.0166 1.5626 1.5626 1.6402 1.6402 4.6579 4.6579 4.9062 4.9062 5.2809 5.2809 5.4343 5.4343 5.7578 5.7578 6.0219 6.0219 6.8740 6.8740 k =-0.0612-0.0543 0.0172 ( 11747 PWs) bands (ev): -14.1005 -14.1005 -14.0237 -14.0237 -12.5986 -12.5986 -12.4920 -12.4920 -10.9891 -10.9891 -10.7901 -10.7901 -10.0101 -10.0101 -9.8368 -9.8368 -8.0894 -8.0894 -8.0308 -8.0308 -7.8765 -7.8765 -7.8368 -7.8368 -5.2436 -5.2436 -5.1794 -5.1794 -4.5124 -4.5124 -4.3862 -4.3862 -3.1150 -3.1150 -2.9736 -2.9736 -2.7972 -2.7972 -2.5323 -2.5323 -1.9801 -1.9801 -1.7519 -1.7519 -1.5088 -1.5088 -1.3624 -1.3624 -0.7973 -0.7973 -0.5719 -0.5719 -0.0385 -0.0385 0.2266 0.2266 0.4654 0.4654 0.7617 0.7617 0.8753 0.8753 1.0180 1.0180 1.5698 1.5698 1.6381 1.6381 4.6604 4.6604 4.9078 4.9078 5.2917 5.2917 5.4303 5.4303 5.7659 5.7659 6.0266 6.0266 6.8579 6.8579 k =-0.0510-0.0452 0.0144 ( 11743 PWs) bands (ev): -14.1025 -14.1025 -14.0255 -14.0255 -12.5991 -12.5991 -12.4902 -12.4902 -10.9929 -10.9929 -10.7849 -10.7849 -10.0168 -10.0168 -9.8320 -9.8320 -8.0848 -8.0848 -8.0286 -8.0286 -7.8790 -7.8790 -7.8385 -7.8385 -5.2434 -5.2434 -5.1786 -5.1786 -4.5134 -4.5134 -4.3876 -4.3876 -3.1113 -3.1113 -2.9711 -2.9711 -2.8037 -2.8037 -2.5251 -2.5251 -1.9892 -1.9892 -1.7452 -1.7452 -1.4991 -1.4991 -1.3552 -1.3552 -0.7994 -0.7994 -0.5809 -0.5809 -0.0386 -0.0386 0.2321 0.2321 0.4640 0.4640 0.7757 0.7757 0.8736 0.8736 1.0194 1.0194 1.5733 1.5733 1.6388 1.6388 4.6628 4.6628 4.9091 4.9091 5.3023 5.3023 5.4258 5.4258 5.7749 5.7749 6.0292 6.0292 6.8432 6.8432 k =-0.0408-0.0362 0.0115 ( 11738 PWs) bands (ev): -14.1041 -14.1041 -14.0270 -14.0270 -12.5994 -12.5994 -12.4886 -12.4886 -10.9962 -10.9962 -10.7804 -10.7804 -10.0225 -10.0225 -9.8280 -9.8280 -8.0808 -8.0808 -8.0267 -8.0267 -7.8817 -7.8817 -7.8396 -7.8396 -5.2431 -5.2431 -5.1780 -5.1780 -4.5142 -4.5142 -4.3887 -4.3887 -3.1081 -3.1081 -2.9689 -2.9689 -2.8093 -2.8093 -2.5189 -2.5189 -1.9973 -1.9973 -1.7395 -1.7395 -1.4907 -1.4907 -1.3491 -1.3491 -0.8017 -0.8017 -0.5876 -0.5876 -0.0394 -0.0394 0.2369 0.2369 0.4626 0.4626 0.7889 0.7889 0.8710 0.8710 1.0207 1.0207 1.5738 1.5738 1.6414 1.6414 4.6650 4.6650 4.9103 4.9103 5.3121 5.3121 5.4213 5.4213 5.7842 5.7842 6.0299 6.0299 6.8304 6.8304 k =-0.0306-0.0271 0.0086 ( 11734 PWs) bands (ev): -14.1054 -14.1054 -14.0282 -14.0282 -12.5997 -12.5997 -12.4874 -12.4874 -10.9987 -10.9987 -10.7769 -10.7769 -10.0270 -10.0270 -9.8248 -9.8248 -8.0775 -8.0775 -8.0251 -8.0251 -7.8842 -7.8842 -7.8403 -7.8403 -5.2429 -5.2429 -5.1775 -5.1775 -4.5148 -4.5148 -4.3897 -4.3897 -3.1055 -3.1055 -2.9673 -2.9673 -2.8137 -2.8137 -2.5138 -2.5138 -2.0041 -2.0041 -1.7350 -1.7350 -1.4839 -1.4839 -1.3444 -1.3444 -0.8041 -0.8041 -0.5921 -0.5921 -0.0407 -0.0407 0.2408 0.2408 0.4614 0.4614 0.8007 0.8007 0.8677 0.8677 1.0218 1.0218 1.5726 1.5726 1.6450 1.6450 4.6669 4.6669 4.9112 4.9112 5.3207 5.3207 5.4169 5.4169 5.7929 5.7929 6.0293 6.0293 6.8201 6.8201 k =-0.0204-0.0181 0.0057 ( 11736 PWs) bands (ev): -14.1064 -14.1064 -14.0290 -14.0290 -12.6000 -12.6000 -12.4865 -12.4865 -11.0005 -11.0005 -10.7744 -10.7744 -10.0303 -10.0303 -9.8226 -9.8226 -8.0751 -8.0751 -8.0238 -8.0238 -7.8863 -7.8863 -7.8407 -7.8407 -5.2427 -5.2427 -5.1771 -5.1771 -4.5152 -4.5152 -4.3904 -4.3904 -3.1036 -3.1036 -2.9660 -2.9660 -2.8170 -2.8170 -2.5100 -2.5100 -2.0093 -2.0093 -1.7318 -1.7318 -1.4789 -1.4789 -1.3409 -1.3409 -0.8062 -0.8062 -0.5949 -0.5949 -0.0420 -0.0420 0.2438 0.2438 0.4604 0.4604 0.8106 0.8106 0.8640 0.8640 1.0228 1.0228 1.5710 1.5710 1.6482 1.6482 4.6683 4.6683 4.9120 4.9120 5.3274 5.3274 5.4132 5.4132 5.8002 5.8002 6.0281 6.0281 6.8126 6.8126 k =-0.0102-0.0090 0.0029 ( 11731 PWs) bands (ev): -14.1069 -14.1069 -14.0295 -14.0295 -12.6001 -12.6001 -12.4860 -12.4860 -11.0016 -11.0016 -10.7728 -10.7728 -10.0323 -10.0323 -9.8212 -9.8212 -8.0736 -8.0736 -8.0231 -8.0231 -7.8877 -7.8877 -7.8409 -7.8409 -5.2426 -5.2426 -5.1769 -5.1769 -4.5155 -4.5155 -4.3908 -4.3908 -3.1025 -3.1025 -2.9652 -2.9652 -2.8190 -2.8190 -2.5076 -2.5076 -2.0124 -2.0124 -1.7298 -1.7298 -1.4758 -1.4758 -1.3388 -1.3388 -0.8076 -0.8076 -0.5964 -0.5964 -0.0430 -0.0430 0.2456 0.2456 0.4598 0.4598 0.8176 0.8176 0.8607 0.8607 1.0234 1.0234 1.5697 1.5697 1.6504 1.6504 4.6691 4.6691 4.9124 4.9124 5.3318 5.3318 5.4107 5.4107 5.8051 5.8051 6.0269 6.0269 6.8080 6.8080 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 k = 0.0000 0.0000 0.0131 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.5999 -12.5999 -12.4861 -12.4861 -11.0013 -11.0013 -10.7733 -10.7733 -10.0320 -10.0320 -9.8214 -9.8214 -8.0732 -8.0732 -8.0229 -8.0229 -7.8880 -7.8880 -7.8408 -7.8408 -5.2424 -5.2424 -5.1770 -5.1770 -4.5152 -4.5152 -4.3913 -4.3913 -3.1016 -3.1016 -2.9656 -2.9656 -2.8189 -2.8189 -2.5081 -2.5081 -2.0126 -2.0126 -1.7298 -1.7298 -1.4738 -1.4738 -1.3381 -1.3381 -0.8082 -0.8082 -0.5982 -0.5982 -0.0422 -0.0422 0.2458 0.2458 0.4604 0.4604 0.8146 0.8146 0.8644 0.8644 1.0235 1.0235 1.5696 1.5696 1.6510 1.6510 4.6697 4.6697 4.9119 4.9119 5.3323 5.3323 5.4093 5.4093 5.8086 5.8086 6.0266 6.0266 6.8070 6.8070 k = 0.0000 0.0000 0.0262 ( 11722 PWs) bands (ev): -14.1070 -14.1070 -14.0298 -14.0298 -12.5990 -12.5990 -12.4871 -12.4871 -10.9991 -10.9991 -10.7763 -10.7763 -10.0291 -10.0291 -9.8233 -9.8233 -8.0735 -8.0735 -8.0233 -8.0233 -7.8877 -7.8877 -7.8404 -7.8404 -5.2420 -5.2420 -5.1778 -5.1778 -4.5140 -4.5140 -4.3922 -4.3922 -3.1004 -3.1004 -2.9673 -2.9673 -2.8166 -2.8166 -2.5117 -2.5117 -2.0099 -2.0099 -1.7318 -1.7318 -1.4710 -1.4710 -1.3382 -1.3382 -0.8082 -0.8082 -0.6021 -0.6021 -0.0388 -0.0388 0.2444 0.2444 0.4626 0.4626 0.8022 0.8022 0.8749 0.8749 1.0232 1.0232 1.5709 1.5709 1.6505 1.6505 4.6707 4.6707 4.9098 4.9098 5.3294 5.3294 5.4076 5.4076 5.8141 5.8141 6.0269 6.0269 6.8089 6.8089 k = 0.0000 0.0000 0.0393 ( 11720 PWs) bands (ev): -14.1069 -14.1069 -14.0300 -14.0300 -12.5976 -12.5976 -12.4886 -12.4886 -10.9955 -10.9955 -10.7812 -10.7812 -10.0244 -10.0244 -9.8265 -9.8265 -8.0740 -8.0740 -8.0239 -8.0239 -7.8871 -7.8871 -7.8398 -7.8398 -5.2413 -5.2413 -5.1791 -5.1791 -4.5121 -4.5121 -4.3938 -4.3938 -3.0983 -3.0983 -2.9701 -2.9701 -2.8129 -2.8129 -2.5176 -2.5176 -2.0055 -2.0055 -1.7350 -1.7350 -1.4666 -1.4666 -1.3383 -1.3383 -0.8082 -0.8082 -0.6085 -0.6085 -0.0333 -0.0333 0.2421 0.2421 0.4664 0.4664 0.7873 0.7873 0.8868 0.8868 1.0227 1.0227 1.5730 1.5730 1.6496 1.6496 4.6722 4.6722 4.9064 4.9064 5.3247 5.3247 5.4051 5.4051 5.8227 5.8227 6.0274 6.0274 6.8120 6.8120 k = 0.0000 0.0000 0.0524 ( 11727 PWs) bands (ev): -14.1067 -14.1067 -14.0302 -14.0302 -12.5958 -12.5958 -12.4907 -12.4907 -10.9905 -10.9905 -10.7879 -10.7879 -10.0181 -10.0181 -9.8309 -9.8309 -8.0746 -8.0746 -8.0248 -8.0248 -7.8864 -7.8864 -7.8390 -7.8390 -5.2403 -5.2403 -5.1808 -5.1808 -4.5094 -4.5094 -4.3959 -4.3959 -3.0955 -3.0955 -2.9739 -2.9739 -2.8079 -2.8079 -2.5255 -2.5255 -1.9998 -1.9998 -1.7392 -1.7392 -1.4608 -1.4608 -1.3384 -1.3384 -0.8080 -0.8080 -0.6171 -0.6171 -0.0261 -0.0261 0.2389 0.2389 0.4715 0.4715 0.7713 0.7713 0.8986 0.8986 1.0220 1.0220 1.5758 1.5758 1.6484 1.6484 4.6744 4.6744 4.9017 4.9017 5.3187 5.3187 5.4020 5.4020 5.8338 5.8338 6.0280 6.0280 6.8162 6.8162 k = 0.0000 0.0000 0.0655 ( 11717 PWs) bands (ev): -14.1065 -14.1065 -14.0305 -14.0305 -12.5934 -12.5934 -12.4933 -12.4933 -10.9842 -10.9842 -10.7962 -10.7962 -10.0102 -10.0102 -9.8365 -9.8365 -8.0753 -8.0753 -8.0257 -8.0257 -7.8855 -7.8855 -7.8380 -7.8380 -5.2391 -5.2391 -5.1829 -5.1829 -4.5062 -4.5062 -4.3985 -4.3985 -3.0919 -3.0919 -2.9784 -2.9784 -2.8018 -2.8018 -2.5349 -2.5349 -1.9930 -1.9930 -1.7442 -1.7442 -1.4541 -1.4541 -1.3386 -1.3386 -0.8074 -0.8074 -0.6275 -0.6275 -0.0175 -0.0175 0.2350 0.2350 0.4779 0.4779 0.7549 0.7549 0.9098 0.9098 1.0210 1.0210 1.5793 1.5793 1.6469 1.6469 4.6771 4.6771 4.8960 4.8960 5.3119 5.3119 5.3987 5.3987 5.8466 5.8466 6.0287 6.0287 6.8213 6.8213 k = 0.0000 0.0000 0.0786 ( 11711 PWs) bands (ev): -14.1062 -14.1062 -14.0307 -14.0307 -12.5907 -12.5907 -12.4963 -12.4963 -10.9766 -10.9766 -10.8059 -10.8059 -10.0010 -10.0010 -9.8432 -9.8432 -8.0760 -8.0760 -8.0268 -8.0268 -7.8846 -7.8846 -7.8369 -7.8369 -5.2376 -5.2376 -5.1852 -5.1852 -4.5025 -4.5025 -4.4016 -4.4016 -3.0876 -3.0876 -2.9837 -2.9837 -2.7948 -2.7948 -2.5454 -2.5454 -1.9856 -1.9856 -1.7496 -1.7496 -1.4468 -1.4468 -1.3388 -1.3388 -0.8064 -0.8064 -0.6392 -0.6392 -0.0078 -0.0078 0.2304 0.2304 0.4853 0.4853 0.7385 0.7385 0.9202 0.9202 1.0198 1.0198 1.5833 1.5833 1.6450 1.6450 4.6803 4.6803 4.8894 4.8894 5.3047 5.3047 5.3953 5.3953 5.8603 5.8603 6.0291 6.0291 6.8273 6.8273 k = 0.0000 0.0000 0.0917 ( 11714 PWs) bands (ev): -14.1060 -14.1060 -14.0310 -14.0310 -12.5878 -12.5878 -12.4996 -12.4996 -10.9678 -10.9678 -10.8167 -10.8167 -9.9908 -9.9908 -9.8510 -9.8510 -8.0768 -8.0768 -8.0278 -8.0278 -7.8837 -7.8837 -7.8359 -7.8359 -5.2360 -5.2360 -5.1878 -5.1878 -4.4985 -4.4985 -4.4050 -4.4050 -3.0828 -3.0828 -2.9895 -2.9895 -2.7871 -2.7871 -2.5567 -2.5567 -1.9779 -1.9779 -1.7552 -1.7552 -1.4393 -1.4393 -1.3390 -1.3390 -0.8047 -0.8047 -0.6518 -0.6518 0.0025 0.0025 0.2253 0.2253 0.4936 0.4936 0.7222 0.7222 0.9298 0.9298 1.0184 1.0184 1.5878 1.5878 1.6427 1.6427 4.6839 4.6839 4.8822 4.8822 5.2977 5.2977 5.3920 5.3920 5.8741 5.8741 6.0294 6.0294 6.8340 6.8340 k = 0.0000 0.0000 0.1048 ( 11710 PWs) bands (ev): -14.1057 -14.1057 -14.0313 -14.0313 -12.5846 -12.5846 -12.5030 -12.5030 -10.9580 -10.9580 -10.8286 -10.8286 -9.9796 -9.9796 -9.8597 -9.8597 -8.0776 -8.0776 -8.0289 -8.0289 -7.8828 -7.8828 -7.8348 -7.8348 -5.2342 -5.2342 -5.1905 -5.1905 -4.4942 -4.4942 -4.4086 -4.4086 -3.0775 -3.0775 -2.9957 -2.9957 -2.7792 -2.7792 -2.5681 -2.5681 -1.9703 -1.9703 -1.7607 -1.7607 -1.4322 -1.4322 -1.3392 -1.3392 -0.8024 -0.8024 -0.6647 -0.6647 0.0128 0.0128 0.2199 0.2199 0.5025 0.5025 0.7066 0.7066 0.9384 0.9384 1.0168 1.0168 1.5927 1.5927 1.6400 1.6400 4.6878 4.6878 4.8747 4.8747 5.2912 5.2912 5.3889 5.3889 5.8874 5.8874 6.0295 6.0295 6.8409 6.8409 k = 0.0000 0.0000 0.1178 ( 11707 PWs) bands (ev): -14.1055 -14.1055 -14.0316 -14.0316 -12.5816 -12.5816 -12.5063 -12.5063 -10.9473 -10.9473 -10.8412 -10.8412 -9.9679 -9.9679 -9.8693 -9.8693 -8.0783 -8.0783 -8.0298 -8.0298 -7.8819 -7.8819 -7.8339 -7.8339 -5.2324 -5.2324 -5.1932 -5.1932 -4.4900 -4.4900 -4.4122 -4.4122 -3.0718 -3.0718 -3.0021 -3.0021 -2.7714 -2.7714 -2.5790 -2.5790 -1.9633 -1.9633 -1.7659 -1.7659 -1.4257 -1.4257 -1.3395 -1.3395 -0.7994 -0.7994 -0.6773 -0.6773 0.0225 0.0225 0.2146 0.2146 0.5115 0.5115 0.6920 0.6920 0.9459 0.9459 1.0150 1.0150 1.5976 1.5976 1.6370 1.6370 4.6917 4.6917 4.8675 4.8675 5.2855 5.2855 5.3863 5.3863 5.8996 5.8996 6.0292 6.0292 6.8477 6.8477 k = 0.0000 0.0000 0.1309 ( 11699 PWs) bands (ev): -14.1053 -14.1053 -14.0318 -14.0318 -12.5787 -12.5787 -12.5093 -12.5093 -10.9358 -10.9358 -10.8542 -10.8542 -9.9558 -9.9558 -9.8796 -9.8796 -8.0788 -8.0788 -8.0306 -8.0306 -7.8813 -7.8813 -7.8331 -7.8331 -5.2306 -5.2306 -5.1957 -5.1957 -4.4862 -4.4862 -4.4155 -4.4155 -3.0662 -3.0662 -3.0084 -3.0084 -2.7641 -2.7641 -2.5888 -2.5888 -1.9572 -1.9572 -1.7704 -1.7704 -1.4202 -1.4202 -1.3397 -1.3397 -0.7959 -0.7959 -0.6888 -0.6888 0.0311 0.0311 0.2097 0.2097 0.5201 0.5201 0.6790 0.6790 0.9521 0.9521 1.0133 1.0133 1.6026 1.6026 1.6337 1.6337 4.6952 4.6952 4.8610 4.8610 5.2809 5.2809 5.3841 5.3841 5.9098 5.9098 6.0287 6.0287 6.8539 6.8539 k = 0.0000 0.0000 0.1440 ( 11705 PWs) bands (ev): -14.1052 -14.1052 -14.0320 -14.0320 -12.5764 -12.5764 -12.5118 -12.5118 -10.9238 -10.9238 -10.8673 -10.8673 -9.9437 -9.9437 -9.8904 -9.8904 -8.0793 -8.0793 -8.0311 -8.0311 -7.8808 -7.8808 -7.8325 -7.8325 -5.2291 -5.2291 -5.1977 -5.1977 -4.4830 -4.4830 -4.4183 -4.4183 -3.0609 -3.0609 -3.0141 -3.0141 -2.7581 -2.7581 -2.5968 -2.5968 -1.9526 -1.9526 -1.7739 -1.7739 -1.4161 -1.4161 -1.3398 -1.3398 -0.7925 -0.7925 -0.6984 -0.6984 0.0380 0.0380 0.2056 0.2056 0.5274 0.5274 0.6685 0.6685 0.9569 0.9569 1.0117 1.0117 1.6073 1.6073 1.6303 1.6303 4.6982 4.6982 4.8558 4.8558 5.2776 5.2776 5.3824 5.3824 5.9177 5.9177 6.0282 6.0282 6.8590 6.8590 k = 0.0000 0.0000 0.1571 ( 11706 PWs) bands (ev): -14.1051 -14.1051 -14.0321 -14.0321 -12.5749 -12.5749 -12.5135 -12.5135 -10.9120 -10.9120 -10.8799 -10.8799 -9.9325 -9.9325 -9.9007 -9.9007 -8.0795 -8.0795 -8.0315 -8.0315 -7.8804 -7.8804 -7.8322 -7.8322 -5.2281 -5.2281 -5.1991 -5.1991 -4.4809 -4.4809 -4.4202 -4.4202 -3.0569 -3.0569 -3.0184 -3.0184 -2.7541 -2.7541 -2.6020 -2.6020 -1.9496 -1.9496 -1.7761 -1.7761 -1.4135 -1.4135 -1.3399 -1.3399 -0.7898 -0.7898 -0.7049 -0.7049 0.0424 0.0424 0.2030 0.2030 0.5325 0.5325 0.6614 0.6614 0.9599 0.9599 1.0106 1.0106 1.6112 1.6112 1.6272 1.6272 4.7002 4.7002 4.8525 4.8525 5.2756 5.2756 5.3814 5.3814 5.9227 5.9227 6.0277 6.0277 6.8624 6.8624 k = 0.0000 0.0000 0.1702 ( 11702 PWs) bands (ev): -14.1051 -14.1051 -14.0322 -14.0322 -12.5743 -12.5743 -12.5141 -12.5141 -10.9047 -10.9047 -10.8874 -10.8874 -9.9264 -9.9264 -9.9066 -9.9066 -8.0796 -8.0796 -8.0316 -8.0316 -7.8803 -7.8803 -7.8320 -7.8320 -5.2277 -5.2277 -5.1996 -5.1996 -4.4801 -4.4801 -4.4209 -4.4209 -3.0553 -3.0553 -3.0201 -3.0201 -2.7527 -2.7527 -2.6038 -2.6038 -1.9486 -1.9486 -1.7769 -1.7769 -1.4126 -1.4126 -1.3400 -1.3400 -0.7888 -0.7888 -0.7072 -0.7072 0.0439 0.0439 0.2020 0.2020 0.5344 0.5344 0.6590 0.6590 0.9609 0.9609 1.0102 1.0102 1.6129 1.6129 1.6257 1.6257 4.7009 4.7009 4.8513 4.8513 5.2749 5.2749 5.3811 5.3811 5.9244 5.9244 6.0275 6.0275 6.8636 6.8636 k = 0.0000-0.3798 0.1673 ( 11774 PWs) bands (ev): -14.0720 -14.0720 -13.9673 -13.9673 -12.6462 -12.6462 -12.5899 -12.5899 -10.9051 -10.9051 -10.8504 -10.8504 -9.9364 -9.9364 -9.8748 -9.8748 -8.1920 -8.1920 -8.0330 -8.0330 -7.9660 -7.9660 -7.8023 -7.8023 -5.2010 -5.2010 -5.0935 -5.0935 -4.5912 -4.5912 -4.4454 -4.4454 -3.1675 -3.1675 -3.0604 -3.0604 -2.6932 -2.6932 -2.5796 -2.5796 -1.7428 -1.7428 -1.7142 -1.7142 -1.5942 -1.5942 -1.5003 -1.5003 -0.4594 -0.4594 -0.1927 -0.1927 -0.0086 -0.0086 0.4527 0.4527 0.5399 0.5399 0.8906 0.8906 0.9316 0.9316 1.0989 1.0989 1.4559 1.4559 1.6157 1.6157 4.3781 4.3781 4.5585 4.5585 5.1985 5.1985 5.4155 5.4155 5.6461 5.6461 5.8185 5.8185 6.5096 6.5096 k = 0.0000-0.3671 0.1617 ( 11773 PWs) bands (ev): -14.0721 -14.0721 -13.9674 -13.9674 -12.6459 -12.6459 -12.5897 -12.5897 -10.9054 -10.9054 -10.8502 -10.8502 -9.9361 -9.9361 -9.8751 -9.8751 -8.1919 -8.1919 -8.0332 -8.0332 -7.9656 -7.9656 -7.8022 -7.8022 -5.2012 -5.2012 -5.0937 -5.0937 -4.5910 -4.5910 -4.4454 -4.4454 -3.1675 -3.1675 -3.0605 -3.0605 -2.6928 -2.6928 -2.5796 -2.5796 -1.7486 -1.7486 -1.7094 -1.7094 -1.5936 -1.5936 -1.5000 -1.5000 -0.4600 -0.4600 -0.1955 -0.1955 -0.0068 -0.0068 0.4503 0.4503 0.5404 0.5404 0.8900 0.8900 0.9317 0.9317 1.0988 1.0988 1.4562 1.4562 1.6160 1.6160 4.3795 4.3795 4.5592 4.5592 5.1983 5.1983 5.4162 5.4162 5.6467 5.6467 5.8184 5.8184 6.5104 6.5104 k = 0.0000-0.3545 0.1561 ( 11759 PWs) bands (ev): -14.0724 -14.0724 -13.9680 -13.9680 -12.6451 -12.6451 -12.5893 -12.5893 -10.9065 -10.9065 -10.8496 -10.8496 -9.9353 -9.9353 -9.8759 -9.8759 -8.1917 -8.1917 -8.0337 -8.0337 -7.9642 -7.9642 -7.8019 -7.8019 -5.2016 -5.2016 -5.0943 -5.0943 -4.5902 -4.5902 -4.4452 -4.4452 -3.1673 -3.1673 -3.0607 -3.0607 -2.6916 -2.6916 -2.5796 -2.5796 -1.7603 -1.7603 -1.7007 -1.7007 -1.5918 -1.5918 -1.4990 -1.4990 -0.4619 -0.4619 -0.2035 -0.2035 -0.0017 -0.0017 0.4437 0.4437 0.5418 0.5418 0.8881 0.8881 0.9320 0.9320 1.0985 1.0985 1.4571 1.4571 1.6172 1.6172 4.3836 4.3836 4.5611 4.5611 5.1979 5.1979 5.4184 5.4184 5.6486 5.6486 5.8179 5.8179 6.5127 6.5127 k = 0.0000-0.3418 0.1506 ( 11760 PWs) bands (ev): -14.0729 -14.0729 -13.9690 -13.9690 -12.6437 -12.6437 -12.5886 -12.5886 -10.9081 -10.9081 -10.8486 -10.8486 -9.9340 -9.9340 -9.8771 -9.8771 -8.1914 -8.1914 -8.0345 -8.0345 -7.9621 -7.9621 -7.8014 -7.8014 -5.2023 -5.2023 -5.0952 -5.0952 -4.5888 -4.5888 -4.4450 -4.4450 -3.1670 -3.1670 -3.0610 -3.0610 -2.6897 -2.6897 -2.5797 -2.5797 -1.7732 -1.7732 -1.6925 -1.6925 -1.5891 -1.5891 -1.4975 -1.4975 -0.4649 -0.4649 -0.2158 -0.2158 0.0057 0.0057 0.4337 0.4337 0.5433 0.5433 0.8853 0.8853 0.9324 0.9324 1.0981 1.0981 1.4586 1.4586 1.6190 1.6190 4.3904 4.3904 4.5644 4.5644 5.1973 5.1973 5.4221 5.4221 5.6516 5.6516 5.8172 5.8172 6.5166 6.5166 k = 0.0000-0.3291 0.1450 ( 11759 PWs) bands (ev): -14.0735 -14.0735 -13.9703 -13.9703 -12.6418 -12.6418 -12.5876 -12.5876 -10.9105 -10.9105 -10.8471 -10.8471 -9.9323 -9.9323 -9.8789 -9.8789 -8.1909 -8.1909 -8.0355 -8.0355 -7.9593 -7.9593 -7.8007 -7.8007 -5.2033 -5.2033 -5.0965 -5.0965 -4.5870 -4.5870 -4.4446 -4.4446 -3.1666 -3.1666 -3.0613 -3.0613 -2.6871 -2.6871 -2.5799 -2.5799 -1.7856 -1.7856 -1.6863 -1.6863 -1.5856 -1.5856 -1.4953 -1.4953 -0.4690 -0.4690 -0.2311 -0.2311 0.0142 0.0142 0.4213 0.4213 0.5442 0.5442 0.8816 0.8816 0.9327 0.9327 1.0974 1.0974 1.4607 1.4607 1.6213 1.6213 4.3998 4.3998 4.5690 4.5690 5.1965 5.1965 5.4276 5.4276 5.6551 5.6551 5.8162 5.8162 6.5220 6.5220 k = 0.0000-0.3165 0.1394 ( 11751 PWs) bands (ev): -14.0744 -14.0744 -13.9719 -13.9719 -12.6395 -12.6395 -12.5862 -12.5862 -10.9134 -10.9134 -10.8453 -10.8453 -9.9303 -9.9303 -9.8809 -9.8809 -8.1901 -8.1901 -8.0366 -8.0366 -7.9559 -7.9559 -7.8000 -7.8000 -5.2045 -5.2045 -5.0982 -5.0982 -4.5847 -4.5847 -4.4441 -4.4441 -3.1660 -3.1660 -3.0615 -3.0615 -2.6841 -2.6841 -2.5803 -2.5803 -1.7969 -1.7969 -1.6823 -1.6823 -1.5820 -1.5820 -1.4927 -1.4927 -0.4742 -0.4742 -0.2483 -0.2483 0.0228 0.0228 0.4075 0.4075 0.5439 0.5439 0.8774 0.8774 0.9328 0.9328 1.0965 1.0965 1.4633 1.4633 1.6240 1.6240 4.4113 4.4113 4.5749 4.5749 5.1958 5.1958 5.4351 5.4351 5.6589 5.6589 5.8150 5.8150 6.5290 6.5290 k = 0.0000-0.3038 0.1338 ( 11746 PWs) bands (ev): -14.0753 -14.0753 -13.9738 -13.9738 -12.6368 -12.6368 -12.5845 -12.5845 -10.9169 -10.9169 -10.8430 -10.8430 -9.9282 -9.9282 -9.8832 -9.8832 -8.1891 -8.1891 -8.0377 -8.0377 -7.9519 -7.9519 -7.7993 -7.7993 -5.2060 -5.2060 -5.1003 -5.1003 -4.5820 -4.5820 -4.4434 -4.4434 -3.1654 -3.1654 -3.0616 -3.0616 -2.6808 -2.6808 -2.5810 -2.5810 -1.8064 -1.8064 -1.6804 -1.6804 -1.5785 -1.5785 -1.4898 -1.4898 -0.4804 -0.4804 -0.2666 -0.2666 0.0307 0.0307 0.3930 0.3930 0.5421 0.5421 0.8729 0.8729 0.9326 0.9326 1.0953 1.0953 1.4667 1.4667 1.6268 1.6268 4.4248 4.4248 4.5822 4.5822 5.1953 5.1953 5.4447 5.4447 5.6624 5.6624 5.8136 5.8136 6.5376 6.5376 k = 0.0000-0.2912 0.1283 ( 11753 PWs) bands (ev): -14.0765 -14.0765 -13.9761 -13.9761 -12.6338 -12.6338 -12.5824 -12.5824 -10.9209 -10.9209 -10.8404 -10.8404 -9.9264 -9.9264 -9.8853 -9.8853 -8.1877 -8.1877 -8.0387 -8.0387 -7.9476 -7.9476 -7.7988 -7.7988 -5.2077 -5.2077 -5.1027 -5.1027 -4.5789 -4.5789 -4.4425 -4.4425 -3.1645 -3.1645 -3.0614 -3.0614 -2.6774 -2.6774 -2.5820 -2.5820 -1.8138 -1.8138 -1.6804 -1.6804 -1.5756 -1.5756 -1.4869 -1.4869 -0.4875 -0.4875 -0.2854 -0.2854 0.0371 0.0371 0.3785 0.3785 0.5388 0.5388 0.8682 0.8682 0.9319 0.9319 1.0939 1.0939 1.4706 1.4706 1.6297 1.6297 4.4398 4.4398 4.5910 4.5910 5.1950 5.1950 5.4566 5.4566 5.6653 5.6653 5.8121 5.8121 6.5477 6.5477 k = 0.0000-0.2785 0.1227 ( 11757 PWs) bands (ev): -14.0778 -14.0778 -13.9785 -13.9785 -12.6307 -12.6307 -12.5798 -12.5798 -10.9254 -10.9254 -10.8374 -10.8374 -9.9252 -9.9252 -9.8870 -9.8870 -8.1859 -8.1859 -8.0396 -8.0396 -7.9429 -7.9429 -7.7984 -7.7984 -5.2096 -5.2096 -5.1054 -5.1054 -4.5755 -4.5755 -4.4414 -4.4414 -3.1635 -3.1635 -3.0608 -3.0608 -2.6740 -2.6740 -2.5833 -2.5833 -1.8190 -1.8190 -1.6822 -1.6822 -1.5733 -1.5733 -1.4843 -1.4843 -0.4955 -0.4955 -0.3043 -0.3043 0.0417 0.0417 0.3648 0.3648 0.5340 0.5340 0.8636 0.8636 0.9307 0.9307 1.0921 1.0921 1.4751 1.4751 1.6324 1.6324 4.4560 4.4560 4.6012 4.6012 5.1951 5.1951 5.4708 5.4708 5.6672 5.6672 5.8108 5.8108 6.5594 6.5594 k = 0.0000-0.2658 0.1171 ( 11755 PWs) bands (ev): -14.0792 -14.0792 -13.9813 -13.9813 -12.6275 -12.6275 -12.5767 -12.5767 -10.9302 -10.9302 -10.8341 -10.8341 -9.9252 -9.9252 -9.8877 -9.8877 -8.1836 -8.1836 -8.0403 -8.0403 -7.9379 -7.9379 -7.7982 -7.7982 -5.2116 -5.2116 -5.1085 -5.1085 -4.5718 -4.5718 -4.4401 -4.4401 -3.1623 -3.1623 -3.0598 -3.0598 -2.6709 -2.6709 -2.5850 -2.5850 -1.8220 -1.8220 -1.6855 -1.6855 -1.5716 -1.5716 -1.4821 -1.4821 -0.5045 -0.5045 -0.3228 -0.3228 0.0439 0.0439 0.3523 0.3523 0.5278 0.5278 0.8591 0.8591 0.9291 0.9291 1.0900 1.0900 1.4802 1.4802 1.6348 1.6348 4.4728 4.4728 4.6131 4.6131 5.1956 5.1956 5.4871 5.4871 5.6679 5.6679 5.8098 5.8098 6.5725 6.5725 k = 0.0000-0.2532 0.1115 ( 11743 PWs) bands (ev): -14.0807 -14.0807 -13.9842 -13.9842 -12.6244 -12.6244 -12.5732 -12.5732 -10.9352 -10.9352 -10.8306 -10.8306 -9.9268 -9.9268 -9.8871 -9.8871 -8.1809 -8.1809 -8.0408 -8.0408 -7.9327 -7.9327 -7.7984 -7.7984 -5.2138 -5.2138 -5.1118 -5.1118 -4.5679 -4.5679 -4.4385 -4.4385 -3.1608 -3.1608 -3.0584 -3.0584 -2.6683 -2.6683 -2.5868 -2.5868 -1.8230 -1.8230 -1.6900 -1.6900 -1.5705 -1.5705 -1.4805 -1.4805 -0.5145 -0.5145 -0.3409 -0.3409 0.0437 0.0437 0.3416 0.3416 0.5204 0.5204 0.8548 0.8548 0.9270 0.9270 1.0875 1.0875 1.4858 1.4858 1.6367 1.6367 4.4898 4.4898 4.6265 4.6265 5.1966 5.1966 5.5054 5.5054 5.6673 5.6673 5.8095 5.8095 6.5870 6.5870 k = 0.0000-0.2405 0.1060 ( 11736 PWs) bands (ev): -14.0823 -14.0823 -13.9872 -13.9872 -12.6214 -12.6214 -12.5691 -12.5691 -10.9404 -10.9404 -10.8268 -10.8268 -9.9301 -9.9301 -9.8850 -9.8850 -8.1775 -8.1775 -8.0412 -8.0412 -7.9274 -7.9274 -7.7990 -7.7990 -5.2160 -5.2160 -5.1154 -5.1154 -4.5639 -4.5639 -4.4367 -4.4367 -3.1591 -3.1591 -3.0564 -3.0564 -2.6667 -2.6667 -2.5884 -2.5884 -1.8225 -1.8225 -1.6954 -1.6954 -1.5697 -1.5697 -1.4795 -1.4795 -0.5254 -0.5254 -0.3585 -0.3585 0.0411 0.0411 0.3329 0.3329 0.5121 0.5121 0.8507 0.8507 0.9243 0.9243 1.0847 1.0847 1.4920 1.4920 1.6382 1.6382 4.5066 4.5066 4.6416 4.6416 5.1980 5.1980 5.5249 5.5249 5.6654 5.6654 5.8104 5.8104 6.6029 6.6029 k = 0.0000-0.2279 0.1004 ( 11735 PWs) bands (ev): -14.0840 -14.0840 -13.9904 -13.9904 -12.6186 -12.6186 -12.5645 -12.5645 -10.9458 -10.9458 -10.8228 -10.8228 -9.9347 -9.9347 -9.8818 -9.8818 -8.1736 -8.1736 -8.0413 -8.0413 -7.9221 -7.9221 -7.8000 -7.8000 -5.2183 -5.2183 -5.1193 -5.1193 -4.5598 -4.5598 -4.4346 -4.4346 -3.1571 -3.1571 -3.0539 -3.0539 -2.6664 -2.6664 -2.5896 -2.5896 -1.8213 -1.8213 -1.7012 -1.7012 -1.5689 -1.5689 -1.4789 -1.4789 -0.5373 -0.5373 -0.3758 -0.3758 0.0364 0.0364 0.3260 0.3260 0.5033 0.5033 0.8470 0.8470 0.9212 0.9212 1.0816 1.0816 1.4986 1.4986 1.6391 1.6391 4.5228 4.5228 4.6583 4.6583 5.2000 5.2000 5.5448 5.5448 5.6627 5.6627 5.8129 5.8129 6.6201 6.6201 k = 0.0000-0.2152 0.0948 ( 11741 PWs) bands (ev): -14.0857 -14.0857 -13.9936 -13.9936 -12.6160 -12.6160 -12.5594 -12.5594 -10.9511 -10.9511 -10.8187 -10.8187 -9.9405 -9.9405 -9.8778 -9.8778 -8.1692 -8.1692 -8.0411 -8.0411 -7.9167 -7.9167 -7.8015 -7.8015 -5.2206 -5.2206 -5.1233 -5.1233 -4.5557 -4.5557 -4.4323 -4.4323 -3.1548 -3.1548 -3.0509 -3.0509 -2.6678 -2.6678 -2.5899 -2.5899 -1.8207 -1.8207 -1.7066 -1.7066 -1.5677 -1.5677 -1.4784 -1.4784 -0.5500 -0.5500 -0.3931 -0.3931 0.0301 0.0301 0.3208 0.3208 0.4944 0.4944 0.8435 0.8435 0.9177 0.9177 1.0783 1.0783 1.5055 1.5055 1.6395 1.6395 4.5381 4.5381 4.6764 4.6764 5.2025 5.2025 5.5635 5.5635 5.6600 5.6600 5.8176 5.8176 6.6384 6.6384 k = 0.0000-0.2025 0.0892 ( 11737 PWs) bands (ev): -14.0875 -14.0875 -13.9969 -13.9969 -12.6137 -12.6137 -12.5539 -12.5539 -10.9564 -10.9564 -10.8146 -10.8146 -9.9470 -9.9470 -9.8733 -9.8733 -8.1641 -8.1641 -8.0408 -8.0408 -7.9113 -7.9113 -7.8036 -7.8036 -5.2229 -5.2229 -5.1276 -5.1276 -4.5516 -4.5516 -4.4297 -4.4297 -3.1522 -3.1522 -3.0474 -3.0474 -2.6712 -2.6712 -2.5888 -2.5888 -1.8222 -1.8222 -1.7106 -1.7106 -1.5657 -1.5657 -1.4780 -1.4780 -0.5635 -0.5635 -0.4107 -0.4107 0.0228 0.0228 0.3166 0.3166 0.4858 0.4858 0.8403 0.8403 0.9139 0.9139 1.0746 1.0746 1.5126 1.5126 1.6396 1.6396 4.5523 4.5523 4.6957 4.6957 5.2056 5.2056 5.5785 5.5785 5.6590 5.6590 5.8253 5.8253 6.6579 6.6579 k = 0.0000-0.1899 0.0836 ( 11731 PWs) bands (ev): -14.0894 -14.0894 -14.0002 -14.0002 -12.6116 -12.6116 -12.5481 -12.5481 -10.9615 -10.9615 -10.8104 -10.8104 -9.9540 -9.9540 -9.8686 -9.8686 -8.1585 -8.1585 -8.0402 -8.0402 -7.9061 -7.9061 -7.8061 -7.8061 -5.2252 -5.2252 -5.1319 -5.1319 -4.5476 -4.5476 -4.4269 -4.4269 -3.1493 -3.1493 -3.0434 -3.0434 -2.6767 -2.6767 -2.5864 -2.5864 -1.8271 -1.8271 -1.7127 -1.7127 -1.5622 -1.5622 -1.4774 -1.4774 -0.5776 -0.5776 -0.4288 -0.4288 0.0151 0.0151 0.3130 0.3130 0.4779 0.4779 0.8374 0.8374 0.9097 0.9097 1.0707 1.0707 1.5198 1.5198 1.6393 1.6393 4.5654 4.5654 4.7157 4.7157 5.2094 5.2094 5.5868 5.5868 5.6622 5.6622 5.8363 5.8363 6.6784 6.6784 k = 0.0000-0.1772 0.0781 ( 11734 PWs) bands (ev): -14.0912 -14.0912 -14.0034 -14.0034 -12.6098 -12.6098 -12.5421 -12.5421 -10.9665 -10.9665 -10.8062 -10.8062 -9.9613 -9.9613 -9.8637 -9.8637 -8.1523 -8.1523 -8.0395 -8.0395 -7.9010 -7.9010 -7.8092 -7.8092 -5.2274 -5.2274 -5.1363 -5.1363 -4.5438 -4.5438 -4.4238 -4.4238 -3.1460 -3.1460 -3.0390 -3.0390 -2.6841 -2.6841 -2.5826 -2.5826 -1.8359 -1.8359 -1.7129 -1.7129 -1.5567 -1.5567 -1.4763 -1.4763 -0.5922 -0.5922 -0.4476 -0.4476 0.0075 0.0075 0.3093 0.3093 0.4711 0.4711 0.8347 0.8347 0.9053 0.9053 1.0667 1.0667 1.5270 1.5270 1.6389 1.6389 4.5776 4.5776 4.7362 4.7362 5.2139 5.2139 5.5867 5.5867 5.6704 5.6704 5.8509 5.8509 6.6998 6.6998 k = 0.0000-0.1646 0.0725 ( 11730 PWs) bands (ev): -14.0930 -14.0930 -14.0066 -14.0066 -12.6082 -12.6082 -12.5360 -12.5360 -10.9713 -10.9713 -10.8022 -10.8022 -9.9689 -9.9689 -9.8588 -9.8588 -8.1457 -8.1457 -8.0386 -8.0386 -7.8963 -7.8963 -7.8127 -7.8127 -5.2294 -5.2294 -5.1408 -5.1408 -4.5401 -4.5401 -4.4207 -4.4207 -3.1425 -3.1425 -3.0341 -3.0341 -2.6930 -2.6930 -2.5776 -2.5776 -1.8483 -1.8483 -1.7119 -1.7119 -1.5487 -1.5487 -1.4748 -1.4748 -0.6074 -0.6074 -0.4669 -0.4669 0.0004 0.0004 0.3052 0.3052 0.4656 0.4656 0.8322 0.8322 0.9008 0.9008 1.0625 1.0625 1.5339 1.5339 1.6384 1.6384 4.5887 4.5887 4.7568 4.7568 5.2192 5.2192 5.5803 5.5803 5.6817 5.6817 5.8688 5.8688 6.7220 6.7220 k = 0.0000-0.1519 0.0669 ( 11734 PWs) bands (ev): -14.0948 -14.0948 -14.0097 -14.0097 -12.6068 -12.6068 -12.5299 -12.5299 -10.9757 -10.9757 -10.7982 -10.7982 -9.9765 -9.9765 -9.8540 -9.8540 -8.1387 -8.1387 -8.0375 -8.0375 -7.8918 -7.8918 -7.8166 -7.8166 -5.2314 -5.2314 -5.1452 -5.1452 -4.5366 -4.5366 -4.4174 -4.4174 -3.1387 -3.1387 -3.0289 -3.0289 -2.7033 -2.7033 -2.5717 -2.5717 -1.8634 -1.8634 -1.7109 -1.7109 -1.5380 -1.5380 -1.4725 -1.4725 -0.6231 -0.6231 -0.4865 -0.4865 -0.0060 -0.0060 0.3004 0.3004 0.4616 0.4616 0.8300 0.8300 0.8962 0.8962 1.0582 1.0582 1.5404 1.5404 1.6381 1.6381 4.5991 4.5991 4.7770 4.7770 5.2254 5.2254 5.5698 5.5698 5.6939 5.6939 5.8891 5.8891 6.7445 6.7445 k = 0.0000-0.1393 0.0613 ( 11733 PWs) bands (ev): -14.0965 -14.0965 -14.0126 -14.0126 -12.6056 -12.6056 -12.5239 -12.5239 -10.9799 -10.9799 -10.7944 -10.7944 -9.9840 -9.9840 -9.8493 -9.8493 -8.1314 -8.1314 -8.0363 -8.0363 -7.8878 -7.8878 -7.8207 -7.8207 -5.2332 -5.2332 -5.1495 -5.1495 -4.5333 -4.5333 -4.4141 -4.4141 -3.1347 -3.1347 -3.0233 -3.0233 -2.7144 -2.7144 -2.5652 -2.5652 -1.8803 -1.8803 -1.7105 -1.7105 -1.5253 -1.5253 -1.4690 -1.4690 -0.6395 -0.6395 -0.5056 -0.5056 -0.0118 -0.0118 0.2948 0.2948 0.4589 0.4589 0.8280 0.8280 0.8915 0.8915 1.0539 1.0539 1.5463 1.5463 1.6380 1.6380 4.6087 4.6087 4.7965 4.7965 5.2324 5.2324 5.5569 5.5569 5.7062 5.7062 5.9107 5.9107 6.7650 6.7650 k = 0.0000-0.1266 0.0558 ( 11733 PWs) bands (ev): -14.0982 -14.0982 -14.0154 -14.0154 -12.6046 -12.6046 -12.5180 -12.5180 -10.9837 -10.9837 -10.7909 -10.7909 -9.9914 -9.9914 -9.8448 -9.8448 -8.1239 -8.1239 -8.0350 -8.0350 -7.8843 -7.8843 -7.8249 -7.8249 -5.2349 -5.2349 -5.1536 -5.1536 -4.5303 -4.5303 -4.4108 -4.4108 -3.1305 -3.1305 -3.0174 -3.0174 -2.7263 -2.7263 -2.5581 -2.5581 -1.8981 -1.8981 -1.7110 -1.7110 -1.5119 -1.5119 -1.4635 -1.4635 -0.6569 -0.6569 -0.5238 -0.5238 -0.0169 -0.0169 0.2887 0.2887 0.4575 0.4575 0.8262 0.8262 0.8870 0.8870 1.0496 1.0496 1.5516 1.5516 1.6384 1.6384 4.6176 4.6176 4.8152 4.8152 5.2405 5.2405 5.5424 5.5424 5.7183 5.7183 5.9323 5.9323 6.7779 6.7779 k = 0.0000-0.1139 0.0502 ( 11732 PWs) bands (ev): -14.0997 -14.0997 -14.0179 -14.0179 -12.6036 -12.6036 -12.5125 -12.5125 -10.9872 -10.9872 -10.7875 -10.7875 -9.9984 -9.9984 -9.8406 -9.8406 -8.1164 -8.1164 -8.0336 -8.0336 -7.8816 -7.8816 -7.8291 -7.8291 -5.2364 -5.2364 -5.1576 -5.1576 -4.5275 -4.5275 -4.4076 -4.4076 -3.1263 -3.1263 -3.0113 -3.0113 -2.7385 -2.7385 -2.5508 -2.5508 -1.9162 -1.9162 -1.7124 -1.7124 -1.4998 -1.4998 -1.4547 -1.4547 -0.6754 -0.6754 -0.5402 -0.5402 -0.0214 -0.0214 0.2821 0.2821 0.4569 0.4569 0.8247 0.8247 0.8826 0.8826 1.0454 1.0454 1.5561 1.5561 1.6392 1.6392 4.6260 4.6260 4.8326 4.8326 5.2494 5.2494 5.5269 5.5269 5.7303 5.7303 5.9527 5.9527 6.7852 6.7852 k = 0.0000-0.1013 0.0446 ( 11732 PWs) bands (ev): -14.1012 -14.1012 -14.0203 -14.0203 -12.6028 -12.6028 -12.5073 -12.5073 -10.9903 -10.9903 -10.7845 -10.7845 -10.0050 -10.0050 -9.8367 -9.8367 -8.1089 -8.1089 -8.0321 -8.0321 -7.8797 -7.8797 -7.8328 -7.8328 -5.2377 -5.2377 -5.1613 -5.1613 -4.5250 -4.5250 -4.4045 -4.4045 -3.1221 -3.1221 -3.0049 -3.0049 -2.7510 -2.7510 -2.5435 -2.5435 -1.9339 -1.9339 -1.7145 -1.7145 -1.4910 -1.4910 -1.4414 -1.4414 -0.6948 -0.6948 -0.5545 -0.5545 -0.0255 -0.0255 0.2756 0.2756 0.4570 0.4570 0.8234 0.8234 0.8783 0.8783 1.0414 1.0414 1.5597 1.5597 1.6404 1.6404 4.6339 4.6339 4.8487 4.8487 5.2591 5.2591 5.5109 5.5109 5.7421 5.7421 5.9711 5.9711 6.7908 6.7908 k = 0.0000-0.0886 0.0390 ( 11733 PWs) bands (ev): -14.1025 -14.1025 -14.0224 -14.0224 -12.6022 -12.6022 -12.5025 -12.5025 -10.9931 -10.9931 -10.7817 -10.7817 -10.0111 -10.0111 -9.8331 -9.8331 -8.1017 -8.1017 -8.0306 -8.0306 -7.8788 -7.8788 -7.8360 -7.8360 -5.2389 -5.2389 -5.1647 -5.1647 -4.5228 -4.5228 -4.4016 -4.4016 -3.1180 -3.1180 -2.9984 -2.9984 -2.7635 -2.7635 -2.5363 -2.5363 -1.9507 -1.9507 -1.7169 -1.7169 -1.4853 -1.4853 -1.4248 -1.4248 -0.7149 -0.7149 -0.5663 -0.5663 -0.0292 -0.0292 0.2693 0.2693 0.4574 0.4574 0.8224 0.8224 0.8744 0.8744 1.0376 1.0376 1.5626 1.5626 1.6420 1.6420 4.6412 4.6412 4.8632 4.8632 5.2696 5.2696 5.4945 5.4945 5.7539 5.7539 5.9868 5.9868 6.7955 6.7955 k = 0.0000-0.0760 0.0335 ( 11732 PWs) bands (ev): -14.1037 -14.1037 -14.0243 -14.0243 -12.6016 -12.6016 -12.4983 -12.4983 -10.9955 -10.9955 -10.7793 -10.7793 -10.0166 -10.0166 -9.8299 -9.8299 -8.0949 -8.0949 -8.0291 -8.0291 -7.8791 -7.8791 -7.8384 -7.8384 -5.2399 -5.2399 -5.1678 -5.1678 -4.5209 -4.5209 -4.3989 -4.3989 -3.1142 -3.1142 -2.9918 -2.9918 -2.7756 -2.7756 -2.5294 -2.5294 -1.9661 -1.9661 -1.7196 -1.7196 -1.4817 -1.4817 -1.4066 -1.4066 -0.7351 -0.7351 -0.5758 -0.5758 -0.0325 -0.0325 0.2634 0.2634 0.4579 0.4579 0.8216 0.8216 0.8707 0.8707 1.0342 1.0342 1.5648 1.5648 1.6438 1.6438 4.6479 4.6479 4.8760 4.8760 5.2805 5.2805 5.4783 5.4783 5.7653 5.7653 5.9997 5.9997 6.7994 6.7994 k = 0.0000-0.0633 0.0279 ( 11734 PWs) bands (ev): -14.1047 -14.1047 -14.0259 -14.0259 -12.6012 -12.6012 -12.4946 -12.4946 -10.9975 -10.9975 -10.7772 -10.7772 -10.0214 -10.0214 -9.8272 -9.8272 -8.0887 -8.0887 -8.0276 -8.0276 -7.8804 -7.8804 -7.8399 -7.8399 -5.2407 -5.2407 -5.1705 -5.1705 -4.5193 -4.5193 -4.3966 -4.3966 -3.1107 -3.1107 -2.9852 -2.9852 -2.7871 -2.7871 -2.5231 -2.5231 -1.9799 -1.9799 -1.7221 -1.7221 -1.4792 -1.4792 -1.3886 -1.3886 -0.7544 -0.7544 -0.5831 -0.5831 -0.0355 -0.0355 0.2583 0.2583 0.4584 0.4584 0.8210 0.8210 0.8675 0.8675 1.0311 1.0311 1.5664 1.5664 1.6456 1.6456 4.6540 4.6540 4.8870 4.8870 5.2918 5.2918 5.4624 5.4624 5.7762 5.7762 6.0096 6.0096 6.8023 6.8023 k = 0.0000-0.0506 0.0223 ( 11732 PWs) bands (ev): -14.1056 -14.1056 -14.0273 -14.0273 -12.6008 -12.6008 -12.4915 -12.4915 -10.9991 -10.9991 -10.7754 -10.7754 -10.0255 -10.0255 -9.8249 -9.8249 -8.0834 -8.0834 -8.0261 -8.0261 -7.8823 -7.8823 -7.8407 -7.8407 -5.2414 -5.2414 -5.1727 -5.1727 -4.5179 -4.5179 -4.3946 -4.3946 -3.1077 -3.1077 -2.9790 -2.9790 -2.7976 -2.7976 -2.5176 -2.5176 -1.9916 -1.9916 -1.7245 -1.7245 -1.4774 -1.4774 -1.3721 -1.3721 -0.7720 -0.7720 -0.5885 -0.5885 -0.0382 -0.0382 0.2540 0.2540 0.4589 0.4589 0.8207 0.8207 0.8647 0.8647 1.0285 1.0285 1.5676 1.5676 1.6474 1.6474 4.6593 4.6593 4.8961 4.8961 5.3031 5.3031 5.4472 5.4472 5.7861 5.7861 6.0167 6.0167 6.8043 6.8043 k = 0.0000-0.0380 0.0167 ( 11727 PWs) bands (ev): -14.1062 -14.1062 -14.0283 -14.0283 -12.6005 -12.6005 -12.4890 -12.4890 -11.0004 -11.0004 -10.7741 -10.7741 -10.0287 -10.0287 -9.8231 -9.8231 -8.0790 -8.0790 -8.0248 -8.0248 -7.8845 -7.8845 -7.8410 -7.8410 -5.2419 -5.2419 -5.1745 -5.1745 -4.5169 -4.5169 -4.3930 -4.3930 -3.1053 -3.1053 -2.9735 -2.9735 -2.8066 -2.8066 -2.5130 -2.5130 -2.0010 -2.0010 -1.7264 -1.7264 -1.4762 -1.4762 -1.3580 -1.3580 -0.7870 -0.7870 -0.5924 -0.5924 -0.0403 -0.0403 0.2506 0.2506 0.4592 0.4592 0.8204 0.8204 0.8624 0.8624 1.0264 1.0264 1.5683 1.5683 1.6490 1.6490 4.6636 4.6636 4.9033 4.9033 5.3139 5.3139 5.4333 5.4333 5.7946 5.7946 6.0215 6.0215 6.8055 6.8055 k = 0.0000-0.0253 0.0112 ( 11728 PWs) bands (ev): -14.1067 -14.1067 -14.0291 -14.0291 -12.6003 -12.6003 -12.4872 -12.4872 -11.0013 -11.0013 -10.7731 -10.7731 -10.0310 -10.0310 -9.8218 -9.8218 -8.0758 -8.0758 -8.0237 -8.0237 -7.8864 -7.8864 -7.8410 -7.8410 -5.2423 -5.2423 -5.1758 -5.1758 -4.5162 -4.5162 -4.3919 -4.3919 -3.1035 -3.1035 -2.9690 -2.9690 -2.8136 -2.8136 -2.5096 -2.5096 -2.0079 -2.0079 -1.7279 -1.7279 -1.4754 -1.4754 -1.3472 -1.3472 -0.7985 -0.7985 -0.5949 -0.5949 -0.0419 -0.0419 0.2482 0.2482 0.4594 0.4594 0.8203 0.8203 0.8607 0.8607 1.0249 1.0249 1.5688 1.5688 1.6502 1.6502 4.6668 4.6668 4.9084 4.9084 5.3235 5.3235 5.4214 5.4214 5.8012 5.8012 6.0244 6.0244 6.8061 6.8061 k = 0.0000-0.0127 0.0056 ( 11736 PWs) bands (ev): -14.1070 -14.1070 -14.0295 -14.0295 -12.6002 -12.6002 -12.4862 -12.4862 -11.0018 -11.0018 -10.7725 -10.7725 -10.0324 -10.0324 -9.8210 -9.8210 -8.0738 -8.0738 -8.0230 -8.0230 -7.8877 -7.8877 -7.8410 -7.8410 -5.2425 -5.2425 -5.1765 -5.1765 -4.5157 -4.5157 -4.3912 -4.3912 -3.1024 -3.1024 -2.9660 -2.9660 -2.8181 -2.8181 -2.5075 -2.5075 -2.0121 -2.0121 -1.7288 -1.7288 -1.4749 -1.4749 -1.3404 -1.3404 -0.8057 -0.8057 -0.5964 -0.5964 -0.0430 -0.0430 0.2468 0.2468 0.4595 0.4595 0.8203 0.8203 0.8597 0.8597 1.0239 1.0239 1.5691 1.5691 1.6509 1.6509 4.6687 4.6687 4.9115 4.9115 5.3306 5.3306 5.4130 5.4130 5.8053 5.8053 6.0260 6.0260 6.8064 6.8064 k = 0.0000 0.0000 0.0000 ( 11729 PWs) bands (ev): -14.1071 -14.1071 -14.0297 -14.0297 -12.6001 -12.6001 -12.4858 -12.4858 -11.0020 -11.0020 -10.7723 -10.7723 -10.0329 -10.0329 -9.8207 -9.8207 -8.0731 -8.0731 -8.0228 -8.0228 -7.8882 -7.8882 -7.8409 -7.8409 -5.2425 -5.2425 -5.1768 -5.1768 -4.5156 -4.5156 -4.3909 -4.3909 -3.1021 -3.1021 -2.9650 -2.9650 -2.8197 -2.8197 -2.5068 -2.5068 -2.0135 -2.0135 -1.7291 -1.7291 -1.4747 -1.4747 -1.3381 -1.3381 -0.8082 -0.8082 -0.5968 -0.5968 -0.0433 -0.0433 0.2463 0.2463 0.4596 0.4596 0.8203 0.8203 0.8594 0.8594 1.0236 1.0236 1.5692 1.5692 1.6512 1.6512 4.6694 4.6694 4.9126 4.9126 5.3333 5.3333 5.4098 5.4098 5.8068 5.8068 6.0265 6.0265 6.8064 6.8064 Writing output data file H2C2I.save init_run : 0.40s CPU 0.54s WALL ( 1 calls) electrons : 350.23s CPU 354.12s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 350.22s CPU 354.11s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.11s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.12s CPU 0.11s WALL ( 244 calls) cegterg : 318.44s CPU 321.31s WALL ( 380 calls) Called by sum_band: Called by *egterg: h_psi : 186.49s CPU 189.40s WALL ( 5574 calls) s_psi : 13.73s CPU 13.91s WALL ( 5574 calls) g_psi : 0.37s CPU 0.36s WALL ( 4950 calls) cdiaghg : 104.11s CPU 104.35s WALL ( 5194 calls) cegterg:over : 16.96s CPU 17.01s WALL ( 4950 calls) cegterg:upda : 11.75s CPU 11.78s WALL ( 4950 calls) cegterg:last : 6.94s CPU 6.98s WALL ( 868 calls) cdiaghg:chol : 4.54s CPU 4.62s WALL ( 5194 calls) cdiaghg:inve : 3.39s CPU 3.38s WALL ( 5194 calls) cdiaghg:para : 6.44s CPU 6.53s WALL ( 10388 calls) Called by h_psi: h_psi:vloc : 159.23s CPU 161.91s WALL ( 5574 calls) h_psi:vnl : 26.85s CPU 27.08s WALL ( 5574 calls) add_vuspsi : 13.05s CPU 13.21s WALL ( 5574 calls) General routines calbec : 13.76s CPU 13.85s WALL ( 5574 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 153.18s CPU 155.97s WALL ( 926976 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.22s CPU 0.32s WALL ( 488 calls) Parallel routines fft_scatter : 100.74s CPU 103.13s WALL ( 926999 calls) PWSCF : 6m37.80s CPU 7m 1.55s WALL This run was terminated on: 4:34:54 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=