Program PWSCF v.5.3.0 (svn rev. 11974) starts on 31Jan2017 at 4:26:22 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: ./CdH6C2I2xNOx2.save/ file Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4D 4D renormalized 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 80 23 6 6001 944 142 Max 81 24 7 6007 972 150 Sum 5787 1705 489 432241 69003 10533 bravais-lattice index = 14 lattice parameter (alat) = 7.8972 a.u. unit-cell volume = 1584.7163 (a.u.)^3 number of atoms/cell = 15 number of atomic types = 6 number of electrons = 62.00 number of Kohn-Sham states= 74 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 639.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.897165 celldm(2)= 1.828428 celldm(3)= 1.968892 celldm(4)= -0.428777 celldm(5)= -0.093587 celldm(6)= -0.060526 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.110667 1.825076 0.000000 ) a(3) = ( -0.184263 -0.856940 1.763019 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.060637 0.133989 ) b(2) = ( 0.000000 0.547922 0.266325 ) b(3) = ( 0.000000 0.000000 0.567209 ) 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 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 PseudoPot. # 3 for N read from file: /users/gautes/Pseudo/N.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e87e56825df8daeb07642eb4d268bcfd Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1085 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 5 for Cd read from file: /users/gautes/Pseudo/Cd.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1d41bce1441572f114805845d9d822b0 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1239 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. # 6 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 atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) C 4.00 12.01070 C( 1.00) N 5.00 14.00670 N( 1.00) O 6.00 15.99940 O( 1.00) Cd 12.00 112.41100 Cd( 1.00) I 7.00 126.90450 I( 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 -0.2739612 -0.1331627), wk = 0.0040984 k( 2) = ( 0.0000000 -0.2620499 -0.1273730), wk = 0.0040984 k( 3) = ( 0.0000000 -0.2501385 -0.1215834), wk = 0.0040984 k( 4) = ( 0.0000000 -0.2382272 -0.1157937), wk = 0.0040984 k( 5) = ( 0.0000000 -0.2263158 -0.1100040), wk = 0.0040984 k( 6) = ( 0.0000000 -0.2144045 -0.1042143), wk = 0.0040984 k( 7) = ( 0.0000000 -0.2024931 -0.0984246), wk = 0.0040984 k( 8) = ( 0.0000000 -0.1905817 -0.0926349), wk = 0.0040984 k( 9) = ( 0.0000000 -0.1786704 -0.0868453), wk = 0.0040984 k( 10) = ( 0.0000000 -0.1667590 -0.0810556), wk = 0.0040984 k( 11) = ( 0.0000000 -0.1548477 -0.0752659), wk = 0.0040984 k( 12) = ( 0.0000000 -0.1429363 -0.0694762), wk = 0.0040984 k( 13) = ( 0.0000000 -0.1310249 -0.0636865), wk = 0.0040984 k( 14) = ( 0.0000000 -0.1191136 -0.0578968), wk = 0.0040984 k( 15) = ( 0.0000000 -0.1072022 -0.0521072), wk = 0.0040984 k( 16) = ( 0.0000000 -0.0952909 -0.0463175), wk = 0.0040984 k( 17) = ( 0.0000000 -0.0833795 -0.0405278), wk = 0.0040984 k( 18) = ( 0.0000000 -0.0714681 -0.0347381), wk = 0.0040984 k( 19) = ( 0.0000000 -0.0595568 -0.0289484), wk = 0.0040984 k( 20) = ( 0.0000000 -0.0476454 -0.0231587), wk = 0.0040984 k( 21) = ( 0.0000000 -0.0357341 -0.0173691), wk = 0.0040984 k( 22) = ( 0.0000000 -0.0238227 -0.0115794), wk = 0.0040984 k( 23) = ( 0.0000000 -0.0119114 -0.0057897), wk = 0.0040984 k( 24) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 25) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 26) = ( 0.0131579 0.0007979 0.0017630), wk = 0.0040984 k( 27) = ( 0.0263158 0.0015957 0.0035260), wk = 0.0040984 k( 28) = ( 0.0394737 0.0023936 0.0052890), wk = 0.0040984 k( 29) = ( 0.0526316 0.0031914 0.0070521), wk = 0.0040984 k( 30) = ( 0.0657895 0.0039893 0.0088151), wk = 0.0040984 k( 31) = ( 0.0789474 0.0047871 0.0105781), wk = 0.0040984 k( 32) = ( 0.0921053 0.0055850 0.0123411), wk = 0.0040984 k( 33) = ( 0.1052632 0.0063829 0.0141041), wk = 0.0040984 k( 34) = ( 0.1184210 0.0071807 0.0158671), wk = 0.0040984 k( 35) = ( 0.1315790 0.0079786 0.0176301), wk = 0.0040984 k( 36) = ( 0.1447368 0.0087764 0.0193931), wk = 0.0040984 k( 37) = ( 0.1578947 0.0095743 0.0211562), wk = 0.0040984 k( 38) = ( 0.1710526 0.0103721 0.0229192), wk = 0.0040984 k( 39) = ( 0.1842105 0.0111700 0.0246822), wk = 0.0040984 k( 40) = ( 0.1973684 0.0119678 0.0264452), wk = 0.0040984 k( 41) = ( 0.2105263 0.0127657 0.0282082), wk = 0.0040984 k( 42) = ( 0.2236842 0.0135636 0.0299712), wk = 0.0040984 k( 43) = ( 0.2368421 0.0143614 0.0317342), wk = 0.0040984 k( 44) = ( 0.2500000 0.0151593 0.0334972), wk = 0.0040984 k( 45) = ( 0.2631579 0.0159571 0.0352603), wk = 0.0040984 k( 46) = ( 0.2763158 0.0167550 0.0370233), wk = 0.0040984 k( 47) = ( 0.2894737 0.0175528 0.0387863), wk = 0.0040984 k( 48) = ( 0.3026316 0.0183507 0.0405493), wk = 0.0040984 k( 49) = ( 0.3157895 0.0191486 0.0423123), wk = 0.0040984 k( 50) = ( 0.3289474 0.0199464 0.0440753), wk = 0.0040984 k( 51) = ( 0.3421053 0.0207443 0.0458383), wk = 0.0040984 k( 52) = ( 0.3552632 0.0215421 0.0476013), wk = 0.0040984 k( 53) = ( 0.3684211 0.0223400 0.0493644), wk = 0.0040984 k( 54) = ( 0.3815789 0.0231378 0.0511274), wk = 0.0040984 k( 55) = ( 0.3947368 0.0239357 0.0528904), wk = 0.0040984 k( 56) = ( 0.4078947 0.0247335 0.0546534), wk = 0.0040984 k( 57) = ( 0.4210526 0.0255314 0.0564164), wk = 0.0040984 k( 58) = ( 0.4342105 0.0263293 0.0581794), wk = 0.0040984 k( 59) = ( 0.4473684 0.0271271 0.0599424), wk = 0.0040984 k( 60) = ( 0.4605263 0.0279250 0.0617054), wk = 0.0040984 k( 61) = ( 0.4736842 0.0287228 0.0634685), wk = 0.0040984 k( 62) = ( 0.4868421 0.0295207 0.0652315), wk = 0.0040984 k( 63) = ( 0.5000000 0.0303185 0.0669945), wk = 0.0040984 k( 64) = ( 0.5000000 -0.2436427 -0.0661682), wk = 0.0040984 k( 65) = ( 0.4883721 -0.2379766 -0.0646294), wk = 0.0040984 k( 66) = ( 0.4767442 -0.2323105 -0.0630907), wk = 0.0040984 k( 67) = ( 0.4651163 -0.2266444 -0.0615519), wk = 0.0040984 k( 68) = ( 0.4534884 -0.2209783 -0.0600131), wk = 0.0040984 k( 69) = ( 0.4418605 -0.2153122 -0.0584743), wk = 0.0040984 k( 70) = ( 0.4302326 -0.2096460 -0.0569355), wk = 0.0040984 k( 71) = ( 0.4186047 -0.2039799 -0.0553967), wk = 0.0040984 k( 72) = ( 0.4069767 -0.1983138 -0.0538579), wk = 0.0040984 k( 73) = ( 0.3953488 -0.1926477 -0.0523191), wk = 0.0040984 k( 74) = ( 0.3837209 -0.1869816 -0.0507803), wk = 0.0040984 k( 75) = ( 0.3720930 -0.1813155 -0.0492415), wk = 0.0040984 k( 76) = ( 0.3604651 -0.1756494 -0.0477027), wk = 0.0040984 k( 77) = ( 0.3488372 -0.1699833 -0.0461639), wk = 0.0040984 k( 78) = ( 0.3372093 -0.1643172 -0.0446251), wk = 0.0040984 k( 79) = ( 0.3255814 -0.1586511 -0.0430863), wk = 0.0040984 k( 80) = ( 0.3139535 -0.1529850 -0.0415475), wk = 0.0040984 k( 81) = ( 0.3023256 -0.1473188 -0.0400087), wk = 0.0040984 k( 82) = ( 0.2906977 -0.1416527 -0.0384699), wk = 0.0040984 k( 83) = ( 0.2790698 -0.1359866 -0.0369311), wk = 0.0040984 k( 84) = ( 0.2674419 -0.1303205 -0.0353923), wk = 0.0040984 k( 85) = ( 0.2558140 -0.1246544 -0.0338535), wk = 0.0040984 k( 86) = ( 0.2441860 -0.1189883 -0.0323147), wk = 0.0040984 k( 87) = ( 0.2325581 -0.1133222 -0.0307759), wk = 0.0040984 k( 88) = ( 0.2209302 -0.1076561 -0.0292371), wk = 0.0040984 k( 89) = ( 0.2093023 -0.1019900 -0.0276983), wk = 0.0040984 k( 90) = ( 0.1976744 -0.0963239 -0.0261595), wk = 0.0040984 k( 91) = ( 0.1860465 -0.0906577 -0.0246207), wk = 0.0040984 k( 92) = ( 0.1744186 -0.0849916 -0.0230819), wk = 0.0040984 k( 93) = ( 0.1627907 -0.0793255 -0.0215431), wk = 0.0040984 k( 94) = ( 0.1511628 -0.0736594 -0.0200044), wk = 0.0040984 k( 95) = ( 0.1395349 -0.0679933 -0.0184656), wk = 0.0040984 k( 96) = ( 0.1279070 -0.0623272 -0.0169268), wk = 0.0040984 k( 97) = ( 0.1162791 -0.0566611 -0.0153880), wk = 0.0040984 k( 98) = ( 0.1046512 -0.0509950 -0.0138492), wk = 0.0040984 k( 99) = ( 0.0930233 -0.0453289 -0.0123104), wk = 0.0040984 k( 100) = ( 0.0813954 -0.0396628 -0.0107716), wk = 0.0040984 k( 101) = ( 0.0697674 -0.0339967 -0.0092328), wk = 0.0040984 k( 102) = ( 0.0581395 -0.0283305 -0.0076940), wk = 0.0040984 k( 103) = ( 0.0465116 -0.0226644 -0.0061552), wk = 0.0040984 k( 104) = ( 0.0348837 -0.0169983 -0.0046164), wk = 0.0040984 k( 105) = ( 0.0232558 -0.0113322 -0.0030776), wk = 0.0040984 k( 106) = ( 0.0116279 -0.0056661 -0.0015388), wk = 0.0040984 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 109) = ( -0.0119048 -0.0007219 0.0051574), wk = 0.0040984 k( 110) = ( -0.0238095 -0.0014437 0.0103148), wk = 0.0040984 k( 111) = ( -0.0357143 -0.0021656 0.0154721), wk = 0.0040984 k( 112) = ( -0.0476191 -0.0028875 0.0206295), wk = 0.0040984 k( 113) = ( -0.0595238 -0.0036093 0.0257869), wk = 0.0040984 k( 114) = ( -0.0714286 -0.0043312 0.0309443), wk = 0.0040984 k( 115) = ( -0.0833333 -0.0050531 0.0361017), wk = 0.0040984 k( 116) = ( -0.0952381 -0.0057750 0.0412590), wk = 0.0040984 k( 117) = ( -0.1071429 -0.0064968 0.0464164), wk = 0.0040984 k( 118) = ( -0.1190476 -0.0072187 0.0515738), wk = 0.0040984 k( 119) = ( -0.1309524 -0.0079406 0.0567312), wk = 0.0040984 k( 120) = ( -0.1428571 -0.0086624 0.0618885), wk = 0.0040984 k( 121) = ( -0.1547619 -0.0093843 0.0670459), wk = 0.0040984 k( 122) = ( -0.1666667 -0.0101062 0.0722033), wk = 0.0040984 k( 123) = ( -0.1785714 -0.0108280 0.0773607), wk = 0.0040984 k( 124) = ( -0.1904762 -0.0115499 0.0825181), wk = 0.0040984 k( 125) = ( -0.2023810 -0.0122718 0.0876754), wk = 0.0040984 k( 126) = ( -0.2142857 -0.0129937 0.0928328), wk = 0.0040984 k( 127) = ( -0.2261905 -0.0137155 0.0979902), wk = 0.0040984 k( 128) = ( -0.2380952 -0.0144374 0.1031476), wk = 0.0040984 k( 129) = ( -0.2500000 -0.0151593 0.1083050), wk = 0.0040984 k( 130) = ( -0.2619048 -0.0158811 0.1134623), wk = 0.0040984 k( 131) = ( -0.2738095 -0.0166030 0.1186197), wk = 0.0040984 k( 132) = ( -0.2857143 -0.0173249 0.1237771), wk = 0.0040984 k( 133) = ( -0.2976190 -0.0180467 0.1289345), wk = 0.0040984 k( 134) = ( -0.3095238 -0.0187686 0.1340919), wk = 0.0040984 k( 135) = ( -0.3214286 -0.0194905 0.1392492), wk = 0.0040984 k( 136) = ( -0.3333333 -0.0202124 0.1444066), wk = 0.0040984 k( 137) = ( -0.3452381 -0.0209342 0.1495640), wk = 0.0040984 k( 138) = ( -0.3571429 -0.0216561 0.1547214), wk = 0.0040984 k( 139) = ( -0.3690476 -0.0223780 0.1598788), wk = 0.0040984 k( 140) = ( -0.3809524 -0.0230998 0.1650361), wk = 0.0040984 k( 141) = ( -0.3928571 -0.0238217 0.1701935), wk = 0.0040984 k( 142) = ( -0.4047619 -0.0245436 0.1753509), wk = 0.0040984 k( 143) = ( -0.4166667 -0.0252654 0.1805083), wk = 0.0040984 k( 144) = ( -0.4285714 -0.0259873 0.1856656), wk = 0.0040984 k( 145) = ( -0.4404762 -0.0267092 0.1908230), wk = 0.0040984 k( 146) = ( -0.4523810 -0.0274311 0.1959804), wk = 0.0040984 k( 147) = ( -0.4642857 -0.0281529 0.2011378), wk = 0.0040984 k( 148) = ( -0.4761905 -0.0288748 0.2062952), wk = 0.0040984 k( 149) = ( -0.4880952 -0.0295967 0.2114525), wk = 0.0040984 k( 150) = ( -0.5000000 -0.0303185 0.2166099), wk = 0.0040984 k( 151) = ( -0.5000000 -0.3042798 0.0834472), wk = 0.0040984 k( 152) = ( -0.4888889 -0.2975180 0.0815928), wk = 0.0040984 k( 153) = ( -0.4777778 -0.2907562 0.0797384), wk = 0.0040984 k( 154) = ( -0.4666667 -0.2839945 0.0778841), wk = 0.0040984 k( 155) = ( -0.4555556 -0.2772327 0.0760297), wk = 0.0040984 k( 156) = ( -0.4444444 -0.2704709 0.0741753), wk = 0.0040984 k( 157) = ( -0.4333333 -0.2637091 0.0723209), wk = 0.0040984 k( 158) = ( -0.4222222 -0.2569474 0.0704665), wk = 0.0040984 k( 159) = ( -0.4111111 -0.2501856 0.0686121), wk = 0.0040984 k( 160) = ( -0.4000000 -0.2434238 0.0667578), wk = 0.0040984 k( 161) = ( -0.3888889 -0.2366621 0.0649034), wk = 0.0040984 k( 162) = ( -0.3777778 -0.2299003 0.0630490), wk = 0.0040984 k( 163) = ( -0.3666667 -0.2231385 0.0611946), wk = 0.0040984 k( 164) = ( -0.3555556 -0.2163767 0.0593402), wk = 0.0040984 k( 165) = ( -0.3444444 -0.2096150 0.0574858), wk = 0.0040984 k( 166) = ( -0.3333333 -0.2028532 0.0556315), wk = 0.0040984 k( 167) = ( -0.3222222 -0.1960914 0.0537771), wk = 0.0040984 k( 168) = ( -0.3111111 -0.1893296 0.0519227), wk = 0.0040984 k( 169) = ( -0.3000000 -0.1825679 0.0500683), wk = 0.0040984 k( 170) = ( -0.2888889 -0.1758061 0.0482139), wk = 0.0040984 k( 171) = ( -0.2777778 -0.1690443 0.0463596), wk = 0.0040984 k( 172) = ( -0.2666667 -0.1622826 0.0445052), wk = 0.0040984 k( 173) = ( -0.2555556 -0.1555208 0.0426508), wk = 0.0040984 k( 174) = ( -0.2444444 -0.1487590 0.0407964), wk = 0.0040984 k( 175) = ( -0.2333333 -0.1419972 0.0389420), wk = 0.0040984 k( 176) = ( -0.2222222 -0.1352355 0.0370876), wk = 0.0040984 k( 177) = ( -0.2111111 -0.1284737 0.0352333), wk = 0.0040984 k( 178) = ( -0.2000000 -0.1217119 0.0333789), wk = 0.0040984 k( 179) = ( -0.1888889 -0.1149501 0.0315245), wk = 0.0040984 k( 180) = ( -0.1777778 -0.1081884 0.0296701), wk = 0.0040984 k( 181) = ( -0.1666667 -0.1014266 0.0278157), wk = 0.0040984 k( 182) = ( -0.1555556 -0.0946648 0.0259614), wk = 0.0040984 k( 183) = ( -0.1444444 -0.0879030 0.0241070), wk = 0.0040984 k( 184) = ( -0.1333333 -0.0811413 0.0222526), wk = 0.0040984 k( 185) = ( -0.1222222 -0.0743795 0.0203982), wk = 0.0040984 k( 186) = ( -0.1111111 -0.0676177 0.0185438), wk = 0.0040984 k( 187) = ( -0.1000000 -0.0608560 0.0166894), wk = 0.0040984 k( 188) = ( -0.0888889 -0.0540942 0.0148351), wk = 0.0040984 k( 189) = ( -0.0777778 -0.0473324 0.0129807), wk = 0.0040984 k( 190) = ( -0.0666667 -0.0405706 0.0111263), wk = 0.0040984 k( 191) = ( -0.0555556 -0.0338089 0.0092719), wk = 0.0040984 k( 192) = ( -0.0444444 -0.0270471 0.0074175), wk = 0.0040984 k( 193) = ( -0.0333333 -0.0202853 0.0055631), wk = 0.0040984 k( 194) = ( -0.0222222 -0.0135235 0.0037088), wk = 0.0040984 k( 195) = ( -0.0111111 -0.0067618 0.0018544), wk = 0.0040984 k( 196) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 197) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 198) = ( 0.0000000 0.0000000 0.0128911), wk = 0.0040984 k( 199) = ( 0.0000000 0.0000000 0.0257822), wk = 0.0040984 k( 200) = ( 0.0000000 0.0000000 0.0386733), wk = 0.0040984 k( 201) = ( 0.0000000 0.0000000 0.0515644), wk = 0.0040984 k( 202) = ( 0.0000000 0.0000000 0.0644555), wk = 0.0040984 k( 203) = ( 0.0000000 0.0000000 0.0773467), wk = 0.0040984 k( 204) = ( 0.0000000 0.0000000 0.0902378), wk = 0.0040984 k( 205) = ( 0.0000000 0.0000000 0.1031289), wk = 0.0040984 k( 206) = ( 0.0000000 0.0000000 0.1160200), wk = 0.0040984 k( 207) = ( 0.0000000 0.0000000 0.1289111), wk = 0.0040984 k( 208) = ( 0.0000000 0.0000000 0.1418022), wk = 0.0040984 k( 209) = ( 0.0000000 0.0000000 0.1546933), wk = 0.0040984 k( 210) = ( 0.0000000 0.0000000 0.1675844), wk = 0.0040984 k( 211) = ( 0.0000000 0.0000000 0.1804755), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.1933666), wk = 0.0040984 k( 213) = ( 0.0000000 0.0000000 0.2062577), wk = 0.0040984 k( 214) = ( 0.0000000 0.0000000 0.2191489), wk = 0.0040984 k( 215) = ( 0.0000000 0.0000000 0.2320400), wk = 0.0040984 k( 216) = ( 0.0000000 0.0000000 0.2449311), wk = 0.0040984 k( 217) = ( 0.0000000 0.0000000 0.2578222), wk = 0.0040984 k( 218) = ( 0.0000000 0.0000000 0.2707133), wk = 0.0040984 k( 219) = ( 0.0000000 0.0000000 0.2836044), wk = 0.0040984 k( 220) = ( 0.0000000 -0.2739612 0.1504417), wk = 0.0040984 k( 221) = ( 0.0000000 -0.2625462 0.1441733), wk = 0.0040984 k( 222) = ( 0.0000000 -0.2511311 0.1379049), wk = 0.0040984 k( 223) = ( 0.0000000 -0.2397161 0.1316365), wk = 0.0040984 k( 224) = ( 0.0000000 -0.2283010 0.1253681), wk = 0.0040984 k( 225) = ( 0.0000000 -0.2168860 0.1190997), wk = 0.0040984 k( 226) = ( 0.0000000 -0.2054709 0.1128313), wk = 0.0040984 k( 227) = ( 0.0000000 -0.1940559 0.1065629), wk = 0.0040984 k( 228) = ( 0.0000000 -0.1826408 0.1002945), wk = 0.0040984 k( 229) = ( 0.0000000 -0.1712258 0.0940261), wk = 0.0040984 k( 230) = ( 0.0000000 -0.1598107 0.0877576), wk = 0.0040984 k( 231) = ( 0.0000000 -0.1483957 0.0814892), wk = 0.0040984 k( 232) = ( 0.0000000 -0.1369806 0.0752208), wk = 0.0040984 k( 233) = ( 0.0000000 -0.1255656 0.0689524), wk = 0.0040984 k( 234) = ( 0.0000000 -0.1141505 0.0626840), wk = 0.0040984 k( 235) = ( 0.0000000 -0.1027355 0.0564156), wk = 0.0040984 k( 236) = ( 0.0000000 -0.0913204 0.0501472), wk = 0.0040984 k( 237) = ( 0.0000000 -0.0799054 0.0438788), wk = 0.0040984 k( 238) = ( 0.0000000 -0.0684903 0.0376104), wk = 0.0040984 k( 239) = ( 0.0000000 -0.0570753 0.0313420), wk = 0.0040984 k( 240) = ( 0.0000000 -0.0456602 0.0250736), wk = 0.0040984 k( 241) = ( 0.0000000 -0.0342452 0.0188052), wk = 0.0040984 k( 242) = ( 0.0000000 -0.0228301 0.0125368), wk = 0.0040984 k( 243) = ( 0.0000000 -0.0114151 0.0062684), 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 -0.4782609 -0.0000000), wk = 0.0040984 k( 3) = ( 0.0000000 -0.4565217 0.0000000), wk = 0.0040984 k( 4) = ( 0.0000000 -0.4347826 -0.0000000), wk = 0.0040984 k( 5) = ( 0.0000000 -0.4130435 -0.0000000), wk = 0.0040984 k( 6) = ( 0.0000000 -0.3913044 -0.0000000), wk = 0.0040984 k( 7) = ( 0.0000000 -0.3695652 0.0000000), wk = 0.0040984 k( 8) = ( 0.0000000 -0.3478261 -0.0000000), wk = 0.0040984 k( 9) = ( 0.0000000 -0.3260870 -0.0000000), wk = 0.0040984 k( 10) = ( 0.0000000 -0.3043478 -0.0000000), wk = 0.0040984 k( 11) = ( 0.0000000 -0.2826087 -0.0000000), wk = 0.0040984 k( 12) = ( 0.0000000 -0.2608696 -0.0000000), wk = 0.0040984 k( 13) = ( 0.0000000 -0.2391304 -0.0000000), wk = 0.0040984 k( 14) = ( 0.0000000 -0.2173913 -0.0000000), wk = 0.0040984 k( 15) = ( 0.0000000 -0.1956522 -0.0000000), wk = 0.0040984 k( 16) = ( 0.0000000 -0.1739130 -0.0000000), wk = 0.0040984 k( 17) = ( 0.0000000 -0.1521739 -0.0000000), wk = 0.0040984 k( 18) = ( 0.0000000 -0.1304348 -0.0000000), wk = 0.0040984 k( 19) = ( 0.0000000 -0.1086956 -0.0000000), wk = 0.0040984 k( 20) = ( 0.0000000 -0.0869565 -0.0000000), wk = 0.0040984 k( 21) = ( 0.0000000 -0.0652174 -0.0000000), wk = 0.0040984 k( 22) = ( 0.0000000 -0.0434783 -0.0000000), wk = 0.0040984 k( 23) = ( 0.0000000 -0.0217391 -0.0000000), wk = 0.0040984 k( 24) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 25) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 26) = ( 0.0131579 -0.0000000 -0.0000000), wk = 0.0040984 k( 27) = ( 0.0263158 -0.0000000 -0.0000000), wk = 0.0040984 k( 28) = ( 0.0394737 -0.0000000 -0.0000000), wk = 0.0040984 k( 29) = ( 0.0526316 -0.0000000 -0.0000000), wk = 0.0040984 k( 30) = ( 0.0657895 -0.0000000 0.0000000), wk = 0.0040984 k( 31) = ( 0.0789474 -0.0000000 -0.0000000), wk = 0.0040984 k( 32) = ( 0.0921053 -0.0000000 -0.0000000), wk = 0.0040984 k( 33) = ( 0.1052632 -0.0000000 -0.0000000), wk = 0.0040984 k( 34) = ( 0.1184210 -0.0000000 -0.0000000), wk = 0.0040984 k( 35) = ( 0.1315790 -0.0000000 -0.0000000), wk = 0.0040984 k( 36) = ( 0.1447368 -0.0000000 -0.0000000), wk = 0.0040984 k( 37) = ( 0.1578947 -0.0000000 -0.0000000), wk = 0.0040984 k( 38) = ( 0.1710526 -0.0000000 0.0000000), wk = 0.0040984 k( 39) = ( 0.1842105 -0.0000000 -0.0000000), wk = 0.0040984 k( 40) = ( 0.1973684 -0.0000000 -0.0000000), wk = 0.0040984 k( 41) = ( 0.2105263 -0.0000000 -0.0000000), wk = 0.0040984 k( 42) = ( 0.2236842 -0.0000000 -0.0000000), wk = 0.0040984 k( 43) = ( 0.2368421 -0.0000000 0.0000000), wk = 0.0040984 k( 44) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0040984 k( 45) = ( 0.2631579 0.0000000 -0.0000000), wk = 0.0040984 k( 46) = ( 0.2763158 0.0000000 -0.0000000), wk = 0.0040984 k( 47) = ( 0.2894737 -0.0000000 -0.0000000), wk = 0.0040984 k( 48) = ( 0.3026316 -0.0000000 -0.0000000), wk = 0.0040984 k( 49) = ( 0.3157895 0.0000000 0.0000000), wk = 0.0040984 k( 50) = ( 0.3289474 -0.0000000 0.0000000), wk = 0.0040984 k( 51) = ( 0.3421053 -0.0000000 0.0000000), wk = 0.0040984 k( 52) = ( 0.3552632 -0.0000000 -0.0000000), wk = 0.0040984 k( 53) = ( 0.3684211 -0.0000000 -0.0000000), wk = 0.0040984 k( 54) = ( 0.3815789 -0.0000000 -0.0000000), wk = 0.0040984 k( 55) = ( 0.3947368 -0.0000000 -0.0000000), wk = 0.0040984 k( 56) = ( 0.4078947 -0.0000000 -0.0000000), wk = 0.0040984 k( 57) = ( 0.4210526 -0.0000000 -0.0000000), wk = 0.0040984 k( 58) = ( 0.4342105 -0.0000000 0.0000000), wk = 0.0040984 k( 59) = ( 0.4473684 -0.0000000 -0.0000000), wk = 0.0040984 k( 60) = ( 0.4605263 0.0000000 -0.0000000), wk = 0.0040984 k( 61) = ( 0.4736842 -0.0000000 0.0000000), wk = 0.0040984 k( 62) = ( 0.4868421 -0.0000000 -0.0000000), wk = 0.0040984 k( 63) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0040984 k( 64) = ( 0.5000000 -0.5000000 -0.0000000), wk = 0.0040984 k( 65) = ( 0.4883721 -0.4883721 -0.0000000), wk = 0.0040984 k( 66) = ( 0.4767442 -0.4767442 -0.0000000), wk = 0.0040984 k( 67) = ( 0.4651163 -0.4651163 -0.0000000), wk = 0.0040984 k( 68) = ( 0.4534884 -0.4534884 -0.0000000), wk = 0.0040984 k( 69) = ( 0.4418605 -0.4418605 -0.0000000), wk = 0.0040984 k( 70) = ( 0.4302326 -0.4302326 -0.0000000), wk = 0.0040984 k( 71) = ( 0.4186047 -0.4186047 -0.0000000), wk = 0.0040984 k( 72) = ( 0.4069767 -0.4069767 -0.0000000), wk = 0.0040984 k( 73) = ( 0.3953488 -0.3953488 -0.0000000), wk = 0.0040984 k( 74) = ( 0.3837209 -0.3837209 -0.0000000), wk = 0.0040984 k( 75) = ( 0.3720930 -0.3720930 -0.0000000), wk = 0.0040984 k( 76) = ( 0.3604651 -0.3604651 -0.0000000), wk = 0.0040984 k( 77) = ( 0.3488372 -0.3488372 -0.0000000), wk = 0.0040984 k( 78) = ( 0.3372093 -0.3372093 -0.0000000), wk = 0.0040984 k( 79) = ( 0.3255814 -0.3255814 -0.0000000), wk = 0.0040984 k( 80) = ( 0.3139535 -0.3139535 -0.0000000), wk = 0.0040984 k( 81) = ( 0.3023256 -0.3023256 -0.0000000), wk = 0.0040984 k( 82) = ( 0.2906977 -0.2906977 -0.0000000), wk = 0.0040984 k( 83) = ( 0.2790698 -0.2790698 -0.0000000), wk = 0.0040984 k( 84) = ( 0.2674419 -0.2674419 -0.0000000), wk = 0.0040984 k( 85) = ( 0.2558140 -0.2558139 -0.0000000), wk = 0.0040984 k( 86) = ( 0.2441860 -0.2441861 -0.0000000), wk = 0.0040984 k( 87) = ( 0.2325581 -0.2325581 -0.0000000), wk = 0.0040984 k( 88) = ( 0.2209302 -0.2209302 -0.0000000), wk = 0.0040984 k( 89) = ( 0.2093023 -0.2093023 -0.0000000), wk = 0.0040984 k( 90) = ( 0.1976744 -0.1976744 -0.0000000), wk = 0.0040984 k( 91) = ( 0.1860465 -0.1860465 -0.0000000), wk = 0.0040984 k( 92) = ( 0.1744186 -0.1744186 -0.0000000), wk = 0.0040984 k( 93) = ( 0.1627907 -0.1627907 -0.0000000), wk = 0.0040984 k( 94) = ( 0.1511628 -0.1511628 -0.0000000), wk = 0.0040984 k( 95) = ( 0.1395349 -0.1395349 0.0000000), wk = 0.0040984 k( 96) = ( 0.1279070 -0.1279070 -0.0000000), wk = 0.0040984 k( 97) = ( 0.1162791 -0.1162791 -0.0000000), wk = 0.0040984 k( 98) = ( 0.1046512 -0.1046512 -0.0000000), wk = 0.0040984 k( 99) = ( 0.0930233 -0.0930233 -0.0000000), wk = 0.0040984 k( 100) = ( 0.0813954 -0.0813954 -0.0000000), wk = 0.0040984 k( 101) = ( 0.0697674 -0.0697674 0.0000000), wk = 0.0040984 k( 102) = ( 0.0581395 -0.0581395 -0.0000000), wk = 0.0040984 k( 103) = ( 0.0465116 -0.0465116 -0.0000000), wk = 0.0040984 k( 104) = ( 0.0348837 -0.0348837 0.0000000), wk = 0.0040984 k( 105) = ( 0.0232558 -0.0232558 -0.0000000), wk = 0.0040984 k( 106) = ( 0.0116279 -0.0116279 -0.0000000), wk = 0.0040984 k( 107) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 108) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 109) = ( -0.0119048 0.0000000 0.0119048), wk = 0.0040984 k( 110) = ( -0.0238095 0.0000000 0.0238095), wk = 0.0040984 k( 111) = ( -0.0357143 0.0000000 0.0357143), wk = 0.0040984 k( 112) = ( -0.0476191 0.0000000 0.0476191), wk = 0.0040984 k( 113) = ( -0.0595238 0.0000000 0.0595238), wk = 0.0040984 k( 114) = ( -0.0714286 -0.0000000 0.0714286), wk = 0.0040984 k( 115) = ( -0.0833333 0.0000000 0.0833333), wk = 0.0040984 k( 116) = ( -0.0952381 0.0000000 0.0952381), wk = 0.0040984 k( 117) = ( -0.1071429 0.0000000 0.1071429), wk = 0.0040984 k( 118) = ( -0.1190476 0.0000000 0.1190476), wk = 0.0040984 k( 119) = ( -0.1309524 0.0000000 0.1309524), wk = 0.0040984 k( 120) = ( -0.1428571 -0.0000000 0.1428571), wk = 0.0040984 k( 121) = ( -0.1547619 0.0000000 0.1547619), wk = 0.0040984 k( 122) = ( -0.1666667 0.0000000 0.1666667), wk = 0.0040984 k( 123) = ( -0.1785714 0.0000000 0.1785714), wk = 0.0040984 k( 124) = ( -0.1904762 0.0000000 0.1904762), wk = 0.0040984 k( 125) = ( -0.2023810 0.0000000 0.2023810), wk = 0.0040984 k( 126) = ( -0.2142857 0.0000000 0.2142857), wk = 0.0040984 k( 127) = ( -0.2261905 0.0000000 0.2261905), wk = 0.0040984 k( 128) = ( -0.2380952 0.0000000 0.2380952), wk = 0.0040984 k( 129) = ( -0.2500000 0.0000000 0.2500000), wk = 0.0040984 k( 130) = ( -0.2619048 0.0000000 0.2619048), wk = 0.0040984 k( 131) = ( -0.2738095 0.0000000 0.2738095), wk = 0.0040984 k( 132) = ( -0.2857143 0.0000000 0.2857143), wk = 0.0040984 k( 133) = ( -0.2976190 0.0000000 0.2976190), wk = 0.0040984 k( 134) = ( -0.3095238 0.0000000 0.3095238), wk = 0.0040984 k( 135) = ( -0.3214286 0.0000000 0.3214286), wk = 0.0040984 k( 136) = ( -0.3333333 0.0000000 0.3333333), wk = 0.0040984 k( 137) = ( -0.3452381 0.0000000 0.3452381), wk = 0.0040984 k( 138) = ( -0.3571429 0.0000000 0.3571429), wk = 0.0040984 k( 139) = ( -0.3690476 0.0000000 0.3690476), wk = 0.0040984 k( 140) = ( -0.3809524 0.0000000 0.3809524), wk = 0.0040984 k( 141) = ( -0.3928571 0.0000000 0.3928571), wk = 0.0040984 k( 142) = ( -0.4047619 0.0000000 0.4047619), wk = 0.0040984 k( 143) = ( -0.4166667 0.0000000 0.4166667), wk = 0.0040984 k( 144) = ( -0.4285714 0.0000000 0.4285714), wk = 0.0040984 k( 145) = ( -0.4404762 0.0000000 0.4404762), wk = 0.0040984 k( 146) = ( -0.4523810 0.0000000 0.4523810), wk = 0.0040984 k( 147) = ( -0.4642857 0.0000000 0.4642857), wk = 0.0040984 k( 148) = ( -0.4761905 0.0000000 0.4761905), wk = 0.0040984 k( 149) = ( -0.4880952 0.0000000 0.4880952), wk = 0.0040984 k( 150) = ( -0.5000000 0.0000000 0.5000000), wk = 0.0040984 k( 151) = ( -0.5000000 -0.5000000 0.5000000), wk = 0.0040984 k( 152) = ( -0.4888889 -0.4888889 0.4888889), wk = 0.0040984 k( 153) = ( -0.4777778 -0.4777778 0.4777778), wk = 0.0040984 k( 154) = ( -0.4666667 -0.4666667 0.4666667), wk = 0.0040984 k( 155) = ( -0.4555556 -0.4555556 0.4555556), wk = 0.0040984 k( 156) = ( -0.4444444 -0.4444444 0.4444444), wk = 0.0040984 k( 157) = ( -0.4333333 -0.4333333 0.4333333), wk = 0.0040984 k( 158) = ( -0.4222222 -0.4222222 0.4222222), wk = 0.0040984 k( 159) = ( -0.4111111 -0.4111111 0.4111111), wk = 0.0040984 k( 160) = ( -0.4000000 -0.4000000 0.4000000), wk = 0.0040984 k( 161) = ( -0.3888889 -0.3888889 0.3888889), wk = 0.0040984 k( 162) = ( -0.3777778 -0.3777778 0.3777778), wk = 0.0040984 k( 163) = ( -0.3666667 -0.3666667 0.3666667), wk = 0.0040984 k( 164) = ( -0.3555556 -0.3555556 0.3555556), wk = 0.0040984 k( 165) = ( -0.3444444 -0.3444444 0.3444444), wk = 0.0040984 k( 166) = ( -0.3333333 -0.3333333 0.3333333), wk = 0.0040984 k( 167) = ( -0.3222222 -0.3222222 0.3222222), wk = 0.0040984 k( 168) = ( -0.3111111 -0.3111111 0.3111111), wk = 0.0040984 k( 169) = ( -0.3000000 -0.3000000 0.3000000), wk = 0.0040984 k( 170) = ( -0.2888889 -0.2888889 0.2888889), wk = 0.0040984 k( 171) = ( -0.2777778 -0.2777778 0.2777778), wk = 0.0040984 k( 172) = ( -0.2666667 -0.2666667 0.2666667), wk = 0.0040984 k( 173) = ( -0.2555556 -0.2555556 0.2555556), wk = 0.0040984 k( 174) = ( -0.2444444 -0.2444444 0.2444444), wk = 0.0040984 k( 175) = ( -0.2333333 -0.2333333 0.2333333), wk = 0.0040984 k( 176) = ( -0.2222222 -0.2222222 0.2222222), wk = 0.0040984 k( 177) = ( -0.2111111 -0.2111111 0.2111111), wk = 0.0040984 k( 178) = ( -0.2000000 -0.2000000 0.2000000), wk = 0.0040984 k( 179) = ( -0.1888889 -0.1888889 0.1888889), wk = 0.0040984 k( 180) = ( -0.1777778 -0.1777778 0.1777778), wk = 0.0040984 k( 181) = ( -0.1666667 -0.1666667 0.1666667), wk = 0.0040984 k( 182) = ( -0.1555556 -0.1555556 0.1555556), wk = 0.0040984 k( 183) = ( -0.1444444 -0.1444444 0.1444444), wk = 0.0040984 k( 184) = ( -0.1333333 -0.1333333 0.1333333), wk = 0.0040984 k( 185) = ( -0.1222222 -0.1222222 0.1222222), wk = 0.0040984 k( 186) = ( -0.1111111 -0.1111111 0.1111111), wk = 0.0040984 k( 187) = ( -0.1000000 -0.1000000 0.1000000), wk = 0.0040984 k( 188) = ( -0.0888889 -0.0888889 0.0888889), wk = 0.0040984 k( 189) = ( -0.0777778 -0.0777778 0.0777778), wk = 0.0040984 k( 190) = ( -0.0666667 -0.0666667 0.0666667), wk = 0.0040984 k( 191) = ( -0.0555556 -0.0555556 0.0555556), wk = 0.0040984 k( 192) = ( -0.0444444 -0.0444444 0.0444444), wk = 0.0040984 k( 193) = ( -0.0333333 -0.0333333 0.0333333), wk = 0.0040984 k( 194) = ( -0.0222222 -0.0222222 0.0222222), wk = 0.0040984 k( 195) = ( -0.0111111 -0.0111111 0.0111111), wk = 0.0040984 k( 196) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 197) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 k( 198) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0040984 k( 199) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0040984 k( 200) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0040984 k( 201) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0040984 k( 202) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0040984 k( 203) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0040984 k( 204) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0040984 k( 205) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0040984 k( 206) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0040984 k( 207) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0040984 k( 208) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0040984 k( 209) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0040984 k( 210) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0040984 k( 211) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0040984 k( 212) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0040984 k( 213) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0040984 k( 214) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0040984 k( 215) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0040984 k( 216) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0040984 k( 217) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0040984 k( 218) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0040984 k( 219) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0040984 k( 220) = ( 0.0000000 -0.5000000 0.5000000), wk = 0.0040984 k( 221) = ( 0.0000000 -0.4791667 0.4791667), wk = 0.0040984 k( 222) = ( 0.0000000 -0.4583333 0.4583333), wk = 0.0040984 k( 223) = ( 0.0000000 -0.4375000 0.4375000), wk = 0.0040984 k( 224) = ( 0.0000000 -0.4166667 0.4166667), wk = 0.0040984 k( 225) = ( 0.0000000 -0.3958333 0.3958333), wk = 0.0040984 k( 226) = ( 0.0000000 -0.3750000 0.3750000), wk = 0.0040984 k( 227) = ( 0.0000000 -0.3541667 0.3541667), wk = 0.0040984 k( 228) = ( 0.0000000 -0.3333333 0.3333333), wk = 0.0040984 k( 229) = ( 0.0000000 -0.3125000 0.3125000), wk = 0.0040984 k( 230) = ( 0.0000000 -0.2916667 0.2916667), wk = 0.0040984 k( 231) = ( 0.0000000 -0.2708333 0.2708333), wk = 0.0040984 k( 232) = ( 0.0000000 -0.2500000 0.2500000), wk = 0.0040984 k( 233) = ( 0.0000000 -0.2291667 0.2291667), wk = 0.0040984 k( 234) = ( 0.0000000 -0.2083333 0.2083333), wk = 0.0040984 k( 235) = ( 0.0000000 -0.1875000 0.1875000), wk = 0.0040984 k( 236) = ( 0.0000000 -0.1666667 0.1666667), wk = 0.0040984 k( 237) = ( 0.0000000 -0.1458333 0.1458333), wk = 0.0040984 k( 238) = ( 0.0000000 -0.1250000 0.1250000), wk = 0.0040984 k( 239) = ( 0.0000000 -0.1041667 0.1041667), wk = 0.0040984 k( 240) = ( 0.0000000 -0.0833333 0.0833333), wk = 0.0040984 k( 241) = ( 0.0000000 -0.0625000 0.0625000), wk = 0.0040984 k( 242) = ( 0.0000000 -0.0416667 0.0416667), wk = 0.0040984 k( 243) = ( 0.0000000 -0.0208333 0.0208333), wk = 0.0040984 k( 244) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0040984 Dense grid: 432241 G-vectors FFT dimensions: ( 64, 120, 125) Smooth grid: 69003 G-vectors FFT dimensions: ( 36, 64, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.28 Mb ( 248, 74) NL pseudopotentials 0.37 Mb ( 124, 198) Each V/rho on FFT grid 0.23 Mb ( 15360) Each G-vector array 0.05 Mb ( 6002) G-vector shells 0.05 Mb ( 5946) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.12 Mb ( 248, 296) Each subspace H/S matrix 0.04 Mb ( 49, 49) Each matrix 0.45 Mb ( 198, 2, 74) The potential is recalculated from file : ./CdH6C2I2xNOx2.save/charge-density.dat Starting wfc are 94 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 5.3 secs Computing kpt #: 2 total cpu time spent up to now is 6.5 secs Computing kpt #: 3 total cpu time spent up to now is 7.7 secs Computing kpt #: 4 total cpu time spent up to now is 8.9 secs Computing kpt #: 5 total cpu time spent up to now is 10.0 secs Computing kpt #: 6 total cpu time spent up to now is 11.2 secs Computing kpt #: 7 total cpu time spent up to now is 12.4 secs Computing kpt #: 8 total cpu time spent up to now is 13.6 secs Computing kpt #: 9 total cpu time spent up to now is 14.8 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 16.9 secs Computing kpt #: 12 total cpu time spent up to now is 17.9 secs Computing kpt #: 13 total cpu time spent up to now is 19.0 secs Computing kpt #: 14 total cpu time spent up to now is 20.1 secs Computing kpt #: 15 total cpu time spent up to now is 21.1 secs Computing kpt #: 16 total cpu time spent up to now is 22.2 secs Computing kpt #: 17 total cpu time spent up to now is 23.3 secs Computing kpt #: 18 total cpu time spent up to now is 24.3 secs Computing kpt #: 19 total cpu time spent up to now is 25.3 secs Computing kpt #: 20 total cpu time spent up to now is 26.4 secs Computing kpt #: 21 total cpu time spent up to now is 27.4 secs Computing kpt #: 22 total cpu time spent up to now is 28.5 secs Computing kpt #: 23 total cpu time spent up to now is 29.6 secs Computing kpt #: 24 total cpu time spent up to now is 30.6 secs Computing kpt #: 25 total cpu time spent up to now is 31.6 secs Computing kpt #: 26 total cpu time spent up to now is 32.7 secs Computing kpt #: 27 total cpu time spent up to now is 33.7 secs Computing kpt #: 28 total cpu time spent up to now is 34.7 secs Computing kpt #: 29 total cpu time spent up to now is 35.8 secs Computing kpt #: 30 total cpu time spent up to now is 36.8 secs Computing kpt #: 31 total cpu time spent up to now is 37.8 secs Computing kpt #: 32 total cpu time spent up to now is 38.9 secs Computing kpt #: 33 total cpu time spent up to now is 39.9 secs Computing kpt #: 34 total cpu time spent up to now is 40.9 secs Computing kpt #: 35 total cpu time spent up to now is 42.0 secs Computing kpt #: 36 total cpu time spent up to now is 43.2 secs Computing kpt #: 37 total cpu time spent up to now is 44.3 secs Computing kpt #: 38 total cpu time spent up to now is 45.5 secs Computing kpt #: 39 total cpu time spent up to now is 46.7 secs Computing kpt #: 40 total cpu time spent up to now is 47.9 secs Computing kpt #: 41 total cpu time spent up to now is 49.1 secs Computing kpt #: 42 total cpu time spent up to now is 50.3 secs Computing kpt #: 43 total cpu time spent up to now is 51.5 secs Computing kpt #: 44 total cpu time spent up to now is 52.7 secs Computing kpt #: 45 total cpu time spent up to now is 53.9 secs Computing kpt #: 46 total cpu time spent up to now is 55.1 secs Computing kpt #: 47 total cpu time spent up to now is 56.3 secs Computing kpt #: 48 total cpu time spent up to now is 57.6 secs Computing kpt #: 49 total cpu time spent up to now is 58.8 secs Computing kpt #: 50 total cpu time spent up to now is 59.9 secs Computing kpt #: 51 total cpu time spent up to now is 61.1 secs Computing kpt #: 52 total cpu time spent up to now is 62.3 secs Computing kpt #: 53 total cpu time spent up to now is 63.5 secs Computing kpt #: 54 total cpu time spent up to now is 64.7 secs Computing kpt #: 55 total cpu time spent up to now is 65.9 secs Computing kpt #: 56 total cpu time spent up to now is 67.1 secs Computing kpt #: 57 total cpu time spent up to now is 68.3 secs Computing kpt #: 58 total cpu time spent up to now is 69.5 secs Computing kpt #: 59 total cpu time spent up to now is 70.7 secs Computing kpt #: 60 total cpu time spent up to now is 71.9 secs Computing kpt #: 61 total cpu time spent up to now is 73.1 secs Computing kpt #: 62 total cpu time spent up to now is 74.3 secs Computing kpt #: 63 total cpu time spent up to now is 75.4 secs Computing kpt #: 64 total cpu time spent up to now is 76.5 secs Computing kpt #: 65 total cpu time spent up to now is 77.6 secs Computing kpt #: 66 total cpu time spent up to now is 78.9 secs Computing kpt #: 67 total cpu time spent up to now is 79.9 secs Computing kpt #: 68 total cpu time spent up to now is 81.0 secs Computing kpt #: 69 total cpu time spent up to now is 82.0 secs Computing kpt #: 70 total cpu time spent up to now is 83.1 secs Computing kpt #: 71 total cpu time spent up to now is 84.1 secs Computing kpt #: 72 total cpu time spent up to now is 85.2 secs Computing kpt #: 73 total cpu time spent up to now is 86.2 secs Computing kpt #: 74 total cpu time spent up to now is 87.4 secs Computing kpt #: 75 total cpu time spent up to now is 88.6 secs Computing kpt #: 76 total cpu time spent up to now is 89.8 secs Computing kpt #: 77 total cpu time spent up to now is 91.0 secs Computing kpt #: 78 total cpu time spent up to now is 92.1 secs Computing kpt #: 79 total cpu time spent up to now is 93.3 secs Computing kpt #: 80 total cpu time spent up to now is 94.5 secs Computing kpt #: 81 total cpu time spent up to now is 95.7 secs Computing kpt #: 82 total cpu time spent up to now is 96.8 secs Computing kpt #: 83 total cpu time spent up to now is 98.0 secs Computing kpt #: 84 total cpu time spent up to now is 99.2 secs Computing kpt #: 85 total cpu time spent up to now is 100.4 secs Computing kpt #: 86 total cpu time spent up to now is 101.6 secs Computing kpt #: 87 total cpu time spent up to now is 102.8 secs Computing kpt #: 88 total cpu time spent up to now is 104.0 secs Computing kpt #: 89 total cpu time spent up to now is 105.2 secs Computing kpt #: 90 total cpu time spent up to now is 106.4 secs Computing kpt #: 91 total cpu time spent up to now is 107.6 secs Computing kpt #: 92 total cpu time spent up to now is 108.8 secs Computing kpt #: 93 total cpu time spent up to now is 110.0 secs Computing kpt #: 94 total cpu time spent up to now is 111.1 secs Computing kpt #: 95 total cpu time spent up to now is 112.3 secs Computing kpt #: 96 total cpu time spent up to now is 113.5 secs Computing kpt #: 97 total cpu time spent up to now is 114.7 secs Computing kpt #: 98 total cpu time spent up to now is 115.8 secs Computing kpt #: 99 total cpu time spent up to now is 116.9 secs Computing kpt #: 100 total cpu time spent up to now is 117.9 secs Computing kpt #: 101 total cpu time spent up to now is 118.9 secs Computing kpt #: 102 total cpu time spent up to now is 120.0 secs Computing kpt #: 103 total cpu time spent up to now is 121.0 secs Computing kpt #: 104 total cpu time spent up to now is 122.1 secs Computing kpt #: 105 total cpu time spent up to now is 123.1 secs Computing kpt #: 106 total cpu time spent up to now is 124.2 secs Computing kpt #: 107 total cpu time spent up to now is 125.2 secs Computing kpt #: 108 total cpu time spent up to now is 126.2 secs Computing kpt #: 109 total cpu time spent up to now is 127.3 secs Computing kpt #: 110 total cpu time spent up to now is 128.3 secs Computing kpt #: 111 total cpu time spent up to now is 129.4 secs Computing kpt #: 112 total cpu time spent up to now is 130.4 secs Computing kpt #: 113 total cpu time spent up to now is 131.4 secs Computing kpt #: 114 total cpu time spent up to now is 132.5 secs Computing kpt #: 115 total cpu time spent up to now is 133.5 secs Computing kpt #: 116 total cpu time spent up to now is 134.6 secs Computing kpt #: 117 total cpu time spent up to now is 135.6 secs Computing kpt #: 118 total cpu time spent up to now is 136.6 secs Computing kpt #: 119 total cpu time spent up to now is 137.7 secs Computing kpt #: 120 total cpu time spent up to now is 138.7 secs Computing kpt #: 121 total cpu time spent up to now is 139.8 secs Computing kpt #: 122 total cpu time spent up to now is 141.0 secs Computing kpt #: 123 total cpu time spent up to now is 142.2 secs Computing kpt #: 124 total cpu time spent up to now is 143.4 secs Computing kpt #: 125 total cpu time spent up to now is 144.6 secs Computing kpt #: 126 total cpu time spent up to now is 145.8 secs Computing kpt #: 127 total cpu time spent up to now is 147.1 secs Computing kpt #: 128 total cpu time spent up to now is 148.3 secs Computing kpt #: 129 total cpu time spent up to now is 149.5 secs Computing kpt #: 130 total cpu time spent up to now is 150.8 secs Computing kpt #: 131 total cpu time spent up to now is 152.0 secs Computing kpt #: 132 total cpu time spent up to now is 153.5 secs Computing kpt #: 133 total cpu time spent up to now is 154.7 secs Computing kpt #: 134 total cpu time spent up to now is 155.9 secs Computing kpt #: 135 total cpu time spent up to now is 157.1 secs Computing kpt #: 136 total cpu time spent up to now is 158.3 secs Computing kpt #: 137 total cpu time spent up to now is 159.5 secs Computing kpt #: 138 total cpu time spent up to now is 160.7 secs Computing kpt #: 139 total cpu time spent up to now is 161.9 secs Computing kpt #: 140 total cpu time spent up to now is 163.1 secs Computing kpt #: 141 total cpu time spent up to now is 164.2 secs Computing kpt #: 142 total cpu time spent up to now is 165.4 secs Computing kpt #: 143 total cpu time spent up to now is 166.6 secs Computing kpt #: 144 total cpu time spent up to now is 167.9 secs Computing kpt #: 145 total cpu time spent up to now is 169.1 secs Computing kpt #: 146 total cpu time spent up to now is 170.3 secs Computing kpt #: 147 total cpu time spent up to now is 171.5 secs Computing kpt #: 148 total cpu time spent up to now is 172.6 secs Computing kpt #: 149 total cpu time spent up to now is 173.9 secs Computing kpt #: 150 total cpu time spent up to now is 175.1 secs Computing kpt #: 151 total cpu time spent up to now is 176.4 secs Computing kpt #: 152 total cpu time spent up to now is 177.6 secs Computing kpt #: 153 total cpu time spent up to now is 178.9 secs Computing kpt #: 154 total cpu time spent up to now is 180.0 secs Computing kpt #: 155 total cpu time spent up to now is 181.2 secs Computing kpt #: 156 total cpu time spent up to now is 182.4 secs Computing kpt #: 157 total cpu time spent up to now is 183.6 secs Computing kpt #: 158 total cpu time spent up to now is 184.8 secs Computing kpt #: 159 total cpu time spent up to now is 185.9 secs Computing kpt #: 160 total cpu time spent up to now is 187.1 secs Computing kpt #: 161 total cpu time spent up to now is 188.3 secs Computing kpt #: 162 total cpu time spent up to now is 189.5 secs Computing kpt #: 163 total cpu time spent up to now is 190.7 secs Computing kpt #: 164 total cpu time spent up to now is 192.0 secs Computing kpt #: 165 total cpu time spent up to now is 193.2 secs Computing kpt #: 166 total cpu time spent up to now is 194.5 secs Computing kpt #: 167 total cpu time spent up to now is 195.7 secs Computing kpt #: 168 total cpu time spent up to now is 196.9 secs Computing kpt #: 169 total cpu time spent up to now is 198.1 secs Computing kpt #: 170 total cpu time spent up to now is 199.3 secs Computing kpt #: 171 total cpu time spent up to now is 200.5 secs Computing kpt #: 172 total cpu time spent up to now is 201.7 secs Computing kpt #: 173 total cpu time spent up to now is 202.9 secs Computing kpt #: 174 total cpu time spent up to now is 204.1 secs Computing kpt #: 175 total cpu time spent up to now is 205.4 secs Computing kpt #: 176 total cpu time spent up to now is 206.6 secs Computing kpt #: 177 total cpu time spent up to now is 207.8 secs Computing kpt #: 178 total cpu time spent up to now is 209.0 secs Computing kpt #: 179 total cpu time spent up to now is 210.2 secs Computing kpt #: 180 total cpu time spent up to now is 211.4 secs Computing kpt #: 181 total cpu time spent up to now is 212.6 secs Computing kpt #: 182 total cpu time spent up to now is 213.7 secs Computing kpt #: 183 total cpu time spent up to now is 214.9 secs Computing kpt #: 184 total cpu time spent up to now is 216.1 secs Computing kpt #: 185 total cpu time spent up to now is 217.2 secs Computing kpt #: 186 total cpu time spent up to now is 218.5 secs Computing kpt #: 187 total cpu time spent up to now is 219.5 secs Computing kpt #: 188 total cpu time spent up to now is 220.6 secs Computing kpt #: 189 total cpu time spent up to now is 221.6 secs Computing kpt #: 190 total cpu time spent up to now is 222.6 secs Computing kpt #: 191 total cpu time spent up to now is 223.7 secs Computing kpt #: 192 total cpu time spent up to now is 224.7 secs Computing kpt #: 193 total cpu time spent up to now is 225.7 secs Computing kpt #: 194 total cpu time spent up to now is 226.8 secs Computing kpt #: 195 total cpu time spent up to now is 227.8 secs Computing kpt #: 196 total cpu time spent up to now is 228.8 secs Computing kpt #: 197 total cpu time spent up to now is 229.9 secs Computing kpt #: 198 total cpu time spent up to now is 230.9 secs Computing kpt #: 199 total cpu time spent up to now is 232.0 secs Computing kpt #: 200 total cpu time spent up to now is 233.0 secs Computing kpt #: 201 total cpu time spent up to now is 234.1 secs Computing kpt #: 202 total cpu time spent up to now is 235.1 secs Computing kpt #: 203 total cpu time spent up to now is 236.2 secs Computing kpt #: 204 total cpu time spent up to now is 237.2 secs Computing kpt #: 205 total cpu time spent up to now is 238.3 secs Computing kpt #: 206 total cpu time spent up to now is 239.3 secs Computing kpt #: 207 total cpu time spent up to now is 240.4 secs Computing kpt #: 208 total cpu time spent up to now is 241.4 secs Computing kpt #: 209 total cpu time spent up to now is 242.4 secs Computing kpt #: 210 total cpu time spent up to now is 243.5 secs Computing kpt #: 211 total cpu time spent up to now is 244.6 secs Computing kpt #: 212 total cpu time spent up to now is 245.7 secs Computing kpt #: 213 total cpu time spent up to now is 246.9 secs Computing kpt #: 214 total cpu time spent up to now is 248.1 secs Computing kpt #: 215 total cpu time spent up to now is 249.3 secs Computing kpt #: 216 total cpu time spent up to now is 250.5 secs Computing kpt #: 217 total cpu time spent up to now is 251.7 secs Computing kpt #: 218 total cpu time spent up to now is 252.9 secs Computing kpt #: 219 total cpu time spent up to now is 254.1 secs Computing kpt #: 220 total cpu time spent up to now is 255.4 secs Computing kpt #: 221 total cpu time spent up to now is 256.6 secs Computing kpt #: 222 total cpu time spent up to now is 257.8 secs Computing kpt #: 223 total cpu time spent up to now is 259.0 secs Computing kpt #: 224 total cpu time spent up to now is 260.2 secs Computing kpt #: 225 total cpu time spent up to now is 261.4 secs Computing kpt #: 226 total cpu time spent up to now is 262.6 secs Computing kpt #: 227 total cpu time spent up to now is 264.1 secs Computing kpt #: 228 total cpu time spent up to now is 265.3 secs Computing kpt #: 229 total cpu time spent up to now is 266.5 secs Computing kpt #: 230 total cpu time spent up to now is 267.5 secs Computing kpt #: 231 total cpu time spent up to now is 268.6 secs Computing kpt #: 232 total cpu time spent up to now is 269.6 secs Computing kpt #: 233 total cpu time spent up to now is 270.7 secs Computing kpt #: 234 total cpu time spent up to now is 271.8 secs Computing kpt #: 235 total cpu time spent up to now is 272.8 secs Computing kpt #: 236 total cpu time spent up to now is 273.9 secs Computing kpt #: 237 total cpu time spent up to now is 274.9 secs Computing kpt #: 238 total cpu time spent up to now is 276.0 secs Computing kpt #: 239 total cpu time spent up to now is 277.0 secs Computing kpt #: 240 total cpu time spent up to now is 278.1 secs Computing kpt #: 241 total cpu time spent up to now is 279.1 secs Computing kpt #: 242 total cpu time spent up to now is 280.1 secs Computing kpt #: 243 total cpu time spent up to now is 281.2 secs Computing kpt #: 244 total cpu time spent up to now is 282.2 secs ethr = 1.61E-08, avg # of iterations = 21.1 total cpu time spent up to now is 282.2 secs End of band structure calculation k = 0.0000-0.2740-0.1332 ( 8616 PWs) bands (ev): -19.7769 -19.7769 -19.6660 -19.6660 -17.4384 -17.4384 -17.3496 -17.3496 -10.1008 -10.1008 -9.8493 -9.8493 -9.5070 -9.5070 -9.3261 -9.3261 -8.4889 -8.4889 -8.3087 -8.3087 -6.2924 -6.2924 -6.0377 -6.0377 -5.7346 -5.7346 -5.6298 -5.6298 -5.1689 -5.1689 -5.0766 -5.0766 -4.8895 -4.8895 -4.1902 -4.1902 -3.6908 -3.6908 -3.5677 -3.5677 -3.5444 -3.5444 -0.8935 -0.8935 -0.4045 -0.4045 -0.3177 -0.3177 0.0832 0.0832 0.3537 0.3537 0.3685 0.3685 1.0090 1.0090 1.1632 1.1632 1.4881 1.4881 2.0995 2.0995 5.6246 5.6246 5.7650 5.7650 6.2919 6.2919 6.9028 6.9028 7.7258 7.7258 7.9262 7.9262 k = 0.0000-0.2620-0.1274 ( 8610 PWs) bands (ev): -19.7769 -19.7769 -19.6660 -19.6660 -17.4384 -17.4384 -17.3496 -17.3496 -10.1009 -10.1009 -9.8493 -9.8493 -9.5076 -9.5076 -9.3256 -9.3256 -8.4885 -8.4885 -8.3089 -8.3089 -6.2923 -6.2923 -6.0377 -6.0377 -5.7346 -5.7346 -5.6299 -5.6299 -5.1689 -5.1689 -5.0766 -5.0766 -4.8895 -4.8895 -4.1901 -4.1901 -3.6910 -3.6910 -3.5676 -3.5676 -3.5444 -3.5444 -0.8947 -0.8947 -0.4042 -0.4042 -0.3179 -0.3179 0.0842 0.0842 0.3524 0.3524 0.3705 0.3705 1.0091 1.0091 1.1631 1.1631 1.4882 1.4882 2.0993 2.0993 5.6205 5.6205 5.7661 5.7661 6.2913 6.2913 6.9056 6.9056 7.7262 7.7262 7.9279 7.9279 k = 0.0000-0.2501-0.1216 ( 8613 PWs) bands (ev): -19.7769 -19.7769 -19.6660 -19.6660 -17.4383 -17.4383 -17.3497 -17.3497 -10.1009 -10.1009 -9.8491 -9.8491 -9.5093 -9.5093 -9.3243 -9.3243 -8.4876 -8.4876 -8.3095 -8.3095 -6.2920 -6.2920 -6.0377 -6.0377 -5.7347 -5.7347 -5.6301 -5.6301 -5.1690 -5.1690 -5.0766 -5.0766 -4.8895 -4.8895 -4.1898 -4.1898 -3.6914 -3.6914 -3.5676 -3.5676 -3.5447 -3.5447 -0.8982 -0.8982 -0.4034 -0.4034 -0.3181 -0.3181 0.0871 0.0871 0.3499 0.3499 0.3752 0.3752 1.0093 1.0093 1.1627 1.1627 1.4886 1.4886 2.0989 2.0989 5.6085 5.6085 5.7692 5.7692 6.2895 6.2895 6.9137 6.9137 7.7278 7.7278 7.9330 7.9330 k = 0.0000-0.2382-0.1158 ( 8612 PWs) bands (ev): -19.7769 -19.7769 -19.6660 -19.6660 -17.4383 -17.4383 -17.3497 -17.3497 -10.1010 -10.1010 -9.8488 -9.8488 -9.5121 -9.5121 -9.3220 -9.3220 -8.4859 -8.4859 -8.3106 -8.3106 -6.2914 -6.2914 -6.0377 -6.0377 -5.7347 -5.7347 -5.6305 -5.6305 -5.1690 -5.1690 -5.0767 -5.0767 -4.8895 -4.8895 -4.1894 -4.1894 -3.6921 -3.6921 -3.5675 -3.5675 -3.5451 -3.5451 -0.9038 -0.9038 -0.4021 -0.4021 -0.3186 -0.3186 0.0918 0.0918 0.3473 0.3473 0.3814 0.3814 1.0095 1.0095 1.1621 1.1621 1.4891 1.4891 2.0982 2.0982 5.5893 5.5893 5.7737 5.7737 6.2865 6.2865 6.9269 6.9269 7.7304 7.7304 7.9409 7.9409 k = 0.0000-0.2263-0.1100 ( 8621 PWs) bands (ev): -19.7769 -19.7769 -19.6660 -19.6660 -17.4382 -17.4382 -17.3497 -17.3497 -10.1012 -10.1012 -9.8483 -9.8483 -9.5159 -9.5159 -9.3191 -9.3191 -8.4837 -8.4837 -8.3119 -8.3119 -6.2907 -6.2907 -6.0378 -6.0378 -5.7348 -5.7348 -5.6310 -5.6310 -5.1692 -5.1692 -5.0767 -5.0767 -4.8895 -4.8895 -4.1888 -4.1888 -3.6930 -3.6930 -3.5674 -3.5674 -3.5457 -3.5457 -0.9114 -0.9114 -0.4003 -0.4003 -0.3192 -0.3192 0.0982 0.0982 0.3451 0.3451 0.3885 0.3885 1.0096 1.0096 1.1616 1.1616 1.4899 1.4899 2.0973 2.0973 5.5641 5.5641 5.7794 5.7794 6.2824 6.2824 6.9446 6.9446 7.7344 7.7344 7.9506 7.9506 k = 0.0000-0.2144-0.1042 ( 8611 PWs) bands (ev): -19.7770 -19.7770 -19.6659 -19.6659 -17.4382 -17.4382 -17.3498 -17.3498 -10.1013 -10.1013 -9.8478 -9.8478 -9.5204 -9.5204 -9.3155 -9.3155 -8.4810 -8.4810 -8.3136 -8.3136 -6.2898 -6.2898 -6.0378 -6.0378 -5.7348 -5.7348 -5.6316 -5.6316 -5.1693 -5.1693 -5.0768 -5.0768 -4.8895 -4.8895 -4.1880 -4.1880 -3.6942 -3.6942 -3.5672 -3.5672 -3.5464 -3.5464 -0.9209 -0.9209 -0.3982 -0.3982 -0.3199 -0.3199 0.1060 0.1060 0.3437 0.3437 0.3962 0.3962 1.0094 1.0094 1.1612 1.1612 1.4908 1.4908 2.0961 2.0961 5.5338 5.5338 5.7860 5.7860 6.2772 6.2772 6.9664 6.9664 7.7397 7.7397 7.9609 7.9609 k = 0.0000-0.2025-0.0984 ( 8620 PWs) bands (ev): -19.7770 -19.7770 -19.6659 -19.6659 -17.4381 -17.4381 -17.3498 -17.3498 -10.1016 -10.1016 -9.8471 -9.8471 -9.5257 -9.5257 -9.3115 -9.3115 -8.4778 -8.4778 -8.3157 -8.3157 -6.2887 -6.2887 -6.0379 -6.0379 -5.7350 -5.7350 -5.6324 -5.6324 -5.1695 -5.1695 -5.0769 -5.0769 -4.8895 -4.8895 -4.1870 -4.1870 -3.6956 -3.6956 -3.5671 -3.5671 -3.5473 -3.5473 -0.9318 -0.9318 -0.3957 -0.3957 -0.3207 -0.3207 0.1149 0.1149 0.3430 0.3430 0.4046 0.4046 1.0086 1.0086 1.1613 1.1613 1.4918 1.4918 2.0946 2.0946 5.4994 5.4994 5.7933 5.7933 6.2710 6.2710 6.9915 6.9915 7.7466 7.7466 7.9706 7.9706 k = 0.0000-0.1906-0.0926 ( 8627 PWs) bands (ev): -19.7771 -19.7771 -19.6659 -19.6659 -17.4380 -17.4380 -17.3499 -17.3499 -10.1018 -10.1018 -9.8464 -9.8464 -9.5314 -9.5314 -9.3072 -9.3072 -8.4742 -8.4742 -8.3179 -8.3179 -6.2875 -6.2875 -6.0381 -6.0381 -5.7351 -5.7351 -5.6333 -5.6333 -5.1698 -5.1698 -5.0770 -5.0770 -4.8895 -4.8895 -4.1859 -4.1859 -3.6973 -3.6973 -3.5670 -3.5670 -3.5482 -3.5482 -0.9439 -0.9439 -0.3930 -0.3930 -0.3215 -0.3215 0.1246 0.1246 0.3433 0.3433 0.4134 0.4134 1.0071 1.0071 1.1620 1.1620 1.4929 1.4929 2.0930 2.0930 5.4618 5.4618 5.8014 5.8014 6.2639 6.2639 7.0194 7.0194 7.7548 7.7548 7.9783 7.9783 k = 0.0000-0.1787-0.0868 ( 8632 PWs) bands (ev): -19.7771 -19.7771 -19.6658 -19.6658 -17.4379 -17.4379 -17.3499 -17.3499 -10.1021 -10.1021 -9.8455 -9.8455 -9.5374 -9.5374 -9.3026 -9.3026 -8.4703 -8.4703 -8.3203 -8.3203 -6.2862 -6.2862 -6.0382 -6.0382 -5.7352 -5.7352 -5.6343 -5.6343 -5.1700 -5.1700 -5.0771 -5.0771 -4.8895 -4.8895 -4.1846 -4.1846 -3.6991 -3.6991 -3.5668 -3.5668 -3.5493 -3.5493 -0.9569 -0.9569 -0.3901 -0.3901 -0.3223 -0.3223 0.1348 0.1348 0.3444 0.3444 0.4227 0.4227 1.0047 1.0047 1.1635 1.1635 1.4940 1.4940 2.0912 2.0912 5.4219 5.4219 5.8101 5.8101 6.2559 6.2559 7.0494 7.0494 7.7641 7.7641 7.9830 7.9830 k = 0.0000-0.1668-0.0811 ( 8632 PWs) bands (ev): -19.7772 -19.7772 -19.6658 -19.6658 -17.4378 -17.4378 -17.3500 -17.3500 -10.1024 -10.1024 -9.8445 -9.8445 -9.5437 -9.5437 -9.2979 -9.2979 -8.4662 -8.4662 -8.3229 -8.3229 -6.2847 -6.2847 -6.0383 -6.0383 -5.7354 -5.7354 -5.6353 -5.6353 -5.1703 -5.1703 -5.0772 -5.0772 -4.8896 -4.8896 -4.1832 -4.1832 -3.7011 -3.7011 -3.5667 -3.5667 -3.5503 -3.5503 -0.9706 -0.9706 -0.3871 -0.3871 -0.3230 -0.3230 0.1452 0.1452 0.3466 0.3466 0.4321 0.4321 1.0013 1.0013 1.1658 1.1658 1.4952 1.4952 2.0892 2.0892 5.3805 5.3805 5.8195 5.8195 6.2472 6.2472 7.0811 7.0811 7.7742 7.7742 7.9842 7.9842 k = 0.0000-0.1548-0.0753 ( 8627 PWs) bands (ev): -19.7772 -19.7772 -19.6657 -19.6657 -17.4377 -17.4377 -17.3501 -17.3501 -10.1028 -10.1028 -9.8435 -9.8435 -9.5500 -9.5500 -9.2932 -9.2932 -8.4620 -8.4620 -8.3254 -8.3254 -6.2831 -6.2831 -6.0385 -6.0385 -5.7355 -5.7355 -5.6363 -5.6363 -5.1706 -5.1706 -5.0773 -5.0773 -4.8896 -4.8896 -4.1817 -4.1817 -3.7033 -3.7033 -3.5666 -3.5666 -3.5514 -3.5514 -0.9846 -0.9846 -0.3841 -0.3841 -0.3238 -0.3238 0.1554 0.1554 0.3498 0.3498 0.4418 0.4418 0.9968 0.9968 1.1690 1.1690 1.4964 1.4964 2.0871 2.0871 5.3384 5.3384 5.8295 5.8295 6.2377 6.2377 7.1141 7.1141 7.7845 7.7845 7.9823 7.9823 k = 0.0000-0.1429-0.0695 ( 8628 PWs) bands (ev): -19.7773 -19.7773 -19.6657 -19.6657 -17.4376 -17.4376 -17.3501 -17.3501 -10.1031 -10.1031 -9.8424 -9.8424 -9.5564 -9.5564 -9.2886 -9.2886 -8.4578 -8.4578 -8.3280 -8.3280 -6.2815 -6.2815 -6.0386 -6.0386 -5.7357 -5.7357 -5.6375 -5.6375 -5.1709 -5.1709 -5.0774 -5.0774 -4.8896 -4.8896 -4.1801 -4.1801 -3.7056 -3.7056 -3.5666 -3.5666 -3.5525 -3.5525 -0.9986 -0.9986 -0.3811 -0.3811 -0.3244 -0.3244 0.1652 0.1652 0.3540 0.3540 0.4515 0.4515 0.9915 0.9915 1.1729 1.1729 1.4975 1.4975 2.0849 2.0849 5.2963 5.2963 5.8400 5.8400 6.2277 6.2277 7.1479 7.1479 7.7939 7.7939 7.9783 7.9783 k = 0.0000-0.1310-0.0637 ( 8633 PWs) bands (ev): -19.7774 -19.7774 -19.6656 -19.6656 -17.4375 -17.4375 -17.3502 -17.3502 -10.1035 -10.1035 -9.8412 -9.8412 -9.5626 -9.5626 -9.2841 -9.2841 -8.4537 -8.4537 -8.3304 -8.3304 -6.2798 -6.2798 -6.0388 -6.0388 -5.7359 -5.7359 -5.6386 -5.6386 -5.1712 -5.1712 -5.0775 -5.0775 -4.8896 -4.8896 -4.1785 -4.1785 -3.7079 -3.7079 -3.5666 -3.5666 -3.5535 -3.5535 -1.0124 -1.0124 -0.3782 -0.3782 -0.3250 -0.3250 0.1742 0.1742 0.3593 0.3593 0.4611 0.4611 0.9853 0.9853 1.1773 1.1773 1.4986 1.4986 2.0827 2.0827 5.2550 5.2550 5.8511 5.8511 6.2171 6.2171 7.1823 7.1823 7.8012 7.8012 7.9738 7.9738 k = 0.0000-0.1191-0.0579 ( 8636 PWs) bands (ev): -19.7774 -19.7774 -19.6656 -19.6656 -17.4373 -17.4373 -17.3503 -17.3503 -10.1039 -10.1039 -9.8401 -9.8401 -9.5685 -9.5685 -9.2798 -9.2798 -8.4498 -8.4498 -8.3326 -8.3326 -6.2782 -6.2782 -6.0390 -6.0390 -5.7361 -5.7361 -5.6397 -5.6397 -5.1715 -5.1715 -5.0776 -5.0776 -4.8896 -4.8896 -4.1768 -4.1768 -3.7103 -3.7103 -3.5666 -3.5666 -3.5545 -3.5545 -1.0258 -1.0258 -0.3754 -0.3754 -0.3256 -0.3256 0.1823 0.1823 0.3656 0.3656 0.4704 0.4704 0.9787 0.9787 1.1822 1.1822 1.4997 1.4997 2.0804 2.0804 5.2150 5.2150 5.8625 5.8625 6.2062 6.2062 7.2169 7.2169 7.8048 7.8048 7.9709 7.9709 k = 0.0000-0.1072-0.0521 ( 8640 PWs) bands (ev): -19.7775 -19.7775 -19.6655 -19.6655 -17.4372 -17.4372 -17.3503 -17.3503 -10.1043 -10.1043 -9.8389 -9.8389 -9.5742 -9.5742 -9.2758 -9.2758 -8.4463 -8.4463 -8.3346 -8.3346 -6.2765 -6.2765 -6.0392 -6.0392 -5.7364 -5.7364 -5.6408 -5.6408 -5.1718 -5.1718 -5.0777 -5.0777 -4.8896 -4.8896 -4.1751 -4.1751 -3.7127 -3.7127 -3.5668 -3.5668 -3.5554 -3.5554 -1.0385 -1.0385 -0.3727 -0.3727 -0.3261 -0.3261 0.1894 0.1894 0.3727 0.3727 0.4793 0.4793 0.9717 0.9717 1.1872 1.1872 1.5007 1.5007 2.0782 2.0782 5.1770 5.1770 5.8742 5.8742 6.1949 6.1949 7.2514 7.2514 7.8033 7.8033 7.9712 7.9712 k = 0.0000-0.0953-0.0463 ( 8635 PWs) bands (ev): -19.7775 -19.7775 -19.6655 -19.6655 -17.4371 -17.4371 -17.3504 -17.3504 -10.1047 -10.1047 -9.8377 -9.8377 -9.5795 -9.5795 -9.2720 -9.2720 -8.4431 -8.4431 -8.3364 -8.3364 -6.2750 -6.2750 -6.0394 -6.0394 -5.7366 -5.7366 -5.6419 -5.6419 -5.1720 -5.1720 -5.0777 -5.0777 -4.8896 -4.8896 -4.1734 -4.1734 -3.7151 -3.7151 -3.5670 -3.5670 -3.5562 -3.5562 -1.0504 -1.0504 -0.3702 -0.3702 -0.3265 -0.3265 0.1955 0.1955 0.3804 0.3804 0.4877 0.4877 0.9646 0.9646 1.1923 1.1923 1.5016 1.5016 2.0761 2.0761 5.1415 5.1415 5.8860 5.8860 6.1836 6.1836 7.2856 7.2856 7.7961 7.7961 7.9756 7.9756 k = 0.0000-0.0834-0.0405 ( 8643 PWs) bands (ev): -19.7776 -19.7776 -19.6654 -19.6654 -17.4370 -17.4370 -17.3505 -17.3505 -10.1050 -10.1050 -9.8366 -9.8366 -9.5844 -9.5844 -9.2687 -9.2687 -8.4403 -8.4403 -8.3378 -8.3378 -6.2735 -6.2735 -6.0396 -6.0396 -5.7368 -5.7368 -5.6429 -5.6429 -5.1723 -5.1723 -5.0778 -5.0778 -4.8896 -4.8896 -4.1718 -4.1718 -3.7173 -3.7173 -3.5672 -3.5672 -3.5568 -3.5568 -1.0612 -1.0612 -0.3679 -0.3679 -0.3269 -0.3269 0.2005 0.2005 0.3884 0.3884 0.4953 0.4953 0.9577 0.9577 1.1971 1.1971 1.5025 1.5025 2.0741 2.0741 5.1090 5.1090 5.8978 5.8978 6.1722 6.1722 7.3192 7.3192 7.7840 7.7840 7.9835 7.9835 k = 0.0000-0.0715-0.0347 ( 8646 PWs) bands (ev): -19.7777 -19.7777 -19.6654 -19.6654 -17.4369 -17.4369 -17.3505 -17.3505 -10.1054 -10.1054 -9.8355 -9.8355 -9.5887 -9.5887 -9.2656 -9.2656 -8.4380 -8.4380 -8.3390 -8.3390 -6.2722 -6.2722 -6.0398 -6.0398 -5.7370 -5.7370 -5.6438 -5.6438 -5.1725 -5.1725 -5.0779 -5.0779 -4.8896 -4.8896 -4.1704 -4.1704 -3.7194 -3.7194 -3.5675 -3.5675 -3.5573 -3.5573 -1.0709 -1.0709 -0.3658 -0.3658 -0.3272 -0.3272 0.2046 0.2046 0.3964 0.3964 0.5021 0.5021 0.9512 0.9512 1.2015 1.2015 1.5033 1.5033 2.0722 2.0722 5.0799 5.0799 5.9093 5.9093 6.1611 6.1611 7.3519 7.3519 7.7681 7.7681 7.9936 7.9936 k = 0.0000-0.0596-0.0289 ( 8639 PWs) bands (ev): -19.7777 -19.7777 -19.6653 -19.6653 -17.4368 -17.4368 -17.3506 -17.3506 -10.1057 -10.1057 -9.8346 -9.8346 -9.5925 -9.5925 -9.2630 -9.2630 -8.4361 -8.4361 -8.3398 -8.3398 -6.2709 -6.2709 -6.0400 -6.0400 -5.7371 -5.7371 -5.6445 -5.6445 -5.1727 -5.1727 -5.0779 -5.0779 -4.8896 -4.8896 -4.1690 -4.1690 -3.7212 -3.7212 -3.5678 -3.5678 -3.5577 -3.5577 -1.0793 -1.0793 -0.3640 -0.3640 -0.3275 -0.3275 0.2079 0.2079 0.4039 0.4039 0.5080 0.5080 0.9453 0.9453 1.2055 1.2055 1.5040 1.5040 2.0705 2.0705 5.0546 5.0546 5.9203 5.9203 6.1505 6.1505 7.3832 7.3832 7.7499 7.7499 8.0045 8.0045 k = 0.0000-0.0476-0.0232 ( 8639 PWs) bands (ev): -19.7777 -19.7777 -19.6653 -19.6653 -17.4368 -17.4368 -17.3506 -17.3506 -10.1059 -10.1059 -9.8338 -9.8338 -9.5956 -9.5956 -9.2609 -9.2609 -8.4347 -8.4347 -8.3404 -8.3404 -6.2699 -6.2699 -6.0402 -6.0402 -5.7373 -5.7373 -5.6452 -5.6452 -5.1729 -5.1729 -5.0780 -5.0780 -4.8896 -4.8896 -4.1679 -4.1679 -3.7228 -3.7228 -3.5681 -3.5681 -3.5581 -3.5581 -1.0863 -1.0863 -0.3625 -0.3625 -0.3277 -0.3277 0.2104 0.2104 0.4108 0.4108 0.5128 0.5128 0.9402 0.9402 1.2088 1.2088 1.5046 1.5046 2.0691 2.0691 5.0335 5.0335 5.9304 5.9304 6.1408 6.1408 7.4124 7.4124 7.7307 7.7307 8.0152 8.0152 k = 0.0000-0.0357-0.0174 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3506 -17.3506 -10.1062 -10.1062 -9.8331 -9.8331 -9.5981 -9.5981 -9.2592 -9.2592 -8.4336 -8.4336 -8.3408 -8.3408 -6.2691 -6.2691 -6.0403 -6.0403 -5.7374 -5.7374 -5.6457 -5.6457 -5.1731 -5.1731 -5.0780 -5.0780 -4.8896 -4.8896 -4.1669 -4.1669 -3.7241 -3.7241 -3.5684 -3.5684 -3.5583 -3.5583 -1.0919 -1.0919 -0.3613 -0.3613 -0.3279 -0.3279 0.2123 0.2123 0.4165 0.4165 0.5165 0.5165 0.9361 0.9361 1.2115 1.2115 1.5050 1.5050 2.0680 2.0680 5.0168 5.0168 5.9391 5.9391 6.1323 6.1323 7.4387 7.4387 7.7119 7.7119 8.0245 8.0245 k = 0.0000-0.0238-0.0116 ( 8638 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1063 -10.1063 -9.8326 -9.8326 -9.5999 -9.5999 -9.2579 -9.2579 -8.4329 -8.4329 -8.3410 -8.3410 -6.2685 -6.2685 -6.0404 -6.0404 -5.7375 -5.7375 -5.6461 -5.6461 -5.1732 -5.1732 -5.0780 -5.0780 -4.8896 -4.8896 -4.1663 -4.1663 -3.7250 -3.7250 -3.5685 -3.5685 -3.5584 -3.5584 -1.0959 -1.0959 -0.3604 -0.3604 -0.3281 -0.3281 0.2136 0.2136 0.4209 0.4209 0.5192 0.5192 0.9330 0.9330 1.2135 1.2135 1.5054 1.5054 2.0671 2.0671 5.0047 5.0047 5.9460 5.9460 6.1257 6.1257 7.4603 7.4603 7.6955 7.6955 8.0317 8.0317 k = 0.0000-0.0119-0.0058 ( 8638 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8323 -9.8323 -9.6010 -9.6010 -9.2572 -9.2572 -8.4324 -8.4324 -8.3411 -8.3411 -6.2681 -6.2681 -6.0405 -6.0405 -5.7375 -5.7375 -5.6463 -5.6463 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1658 -4.1658 -3.7256 -3.7256 -3.5687 -3.5687 -3.5585 -3.5585 -1.0983 -1.0983 -0.3599 -0.3599 -0.3282 -0.3282 0.2143 0.2143 0.4236 0.4236 0.5208 0.5208 0.9311 0.9311 1.2147 1.2147 1.5056 1.5056 2.0666 2.0666 4.9973 4.9973 5.9504 5.9504 6.1214 6.1214 7.4751 7.4751 7.6837 7.6837 8.0362 8.0362 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k = 0.0132 0.0008 0.0018 ( 8642 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4366 -17.4366 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6009 -9.6009 -9.2568 -9.2568 -8.4324 -8.4324 -8.3412 -8.3412 -6.2681 -6.2681 -6.0405 -6.0405 -5.7373 -5.7373 -5.6463 -5.6463 -5.1733 -5.1733 -5.0778 -5.0778 -4.8896 -4.8896 -4.1656 -4.1656 -3.7260 -3.7260 -3.5726 -3.5726 -3.5556 -3.5556 -1.0988 -1.0988 -0.3611 -0.3611 -0.3274 -0.3274 0.2145 0.2145 0.4244 0.4244 0.5208 0.5208 0.9306 0.9306 1.2156 1.2156 1.5016 1.5016 2.0619 2.0619 4.9999 4.9999 5.9522 5.9522 6.1199 6.1199 7.4880 7.4880 7.6791 7.6791 8.0397 8.0397 k = 0.0263 0.0016 0.0035 ( 8642 PWs) bands (ev): -19.7776 -19.7776 -19.6652 -19.6652 -17.4366 -17.4366 -17.3506 -17.3506 -10.1064 -10.1064 -9.8322 -9.8322 -9.5992 -9.5992 -9.2564 -9.2564 -8.4326 -8.4326 -8.3412 -8.3412 -6.2682 -6.2682 -6.0406 -6.0406 -5.7367 -5.7367 -5.6461 -5.6461 -5.1733 -5.1733 -5.0770 -5.0770 -4.8896 -4.8896 -4.1653 -4.1653 -3.7265 -3.7265 -3.5801 -3.5801 -3.5510 -3.5510 -1.0980 -1.0980 -0.3651 -0.3651 -0.3254 -0.3254 0.2142 0.2142 0.4238 0.4238 0.5195 0.5195 0.9307 0.9307 1.2172 1.2172 1.4896 1.4896 2.0483 2.0483 5.0147 5.0147 5.9530 5.9530 6.1198 6.1198 7.5102 7.5102 7.6781 7.6781 8.0452 8.0452 k = 0.0395 0.0024 0.0053 ( 8641 PWs) bands (ev): -19.7774 -19.7774 -19.6652 -19.6652 -17.4366 -17.4366 -17.3505 -17.3505 -10.1063 -10.1063 -9.8321 -9.8321 -9.5964 -9.5964 -9.2557 -9.2557 -8.4329 -8.4329 -8.3412 -8.3412 -6.2685 -6.2685 -6.0407 -6.0407 -5.7356 -5.7356 -5.6457 -5.6457 -5.1735 -5.1735 -5.0756 -5.0756 -4.8897 -4.8897 -4.1649 -4.1649 -3.7274 -3.7274 -3.5890 -3.5890 -3.5469 -3.5469 -1.0967 -1.0967 -0.3709 -0.3709 -0.3229 -0.3229 0.2138 0.2138 0.4226 0.4226 0.5174 0.5174 0.9308 0.9308 1.2198 1.2198 1.4703 1.4703 2.0262 2.0262 5.0389 5.0389 5.9543 5.9543 6.1195 6.1195 7.5458 7.5458 7.6770 7.6770 8.0545 8.0545 k = 0.0526 0.0032 0.0071 ( 8649 PWs) bands (ev): -19.7771 -19.7771 -19.6651 -19.6651 -17.4365 -17.4365 -17.3504 -17.3504 -10.1063 -10.1063 -9.8321 -9.8321 -9.5925 -9.5925 -9.2547 -9.2547 -8.4334 -8.4334 -8.3413 -8.3413 -6.2689 -6.2689 -6.0409 -6.0409 -5.7341 -5.7341 -5.6451 -5.6451 -5.1737 -5.1737 -5.0738 -5.0738 -4.8898 -4.8898 -4.1643 -4.1643 -3.7286 -3.7286 -3.5988 -3.5988 -3.5437 -3.5437 -1.0949 -1.0949 -0.3782 -0.3782 -0.3203 -0.3203 0.2132 0.2132 0.4208 0.4208 0.5143 0.5143 0.9310 0.9310 1.2233 1.2233 1.4443 1.4443 1.9962 1.9962 5.0716 5.0716 5.9560 5.9560 6.1192 6.1192 7.5898 7.5898 7.6791 7.6791 8.0673 8.0673 k = 0.0658 0.0040 0.0088 ( 8652 PWs) bands (ev): -19.7768 -19.7768 -19.6650 -19.6650 -17.4364 -17.4364 -17.3503 -17.3503 -10.1062 -10.1062 -9.8320 -9.8320 -9.5876 -9.5876 -9.2535 -9.2535 -8.4340 -8.4340 -8.3414 -8.3414 -6.2694 -6.2694 -6.0412 -6.0412 -5.7321 -5.7321 -5.6444 -5.6444 -5.1739 -5.1739 -5.0714 -5.0714 -4.8899 -4.8899 -4.1635 -4.1635 -3.7302 -3.7302 -3.6096 -3.6096 -3.5414 -3.5414 -1.0926 -1.0926 -0.3865 -0.3865 -0.3179 -0.3179 0.2124 0.2124 0.4180 0.4180 0.5104 0.5104 0.9312 0.9312 1.2274 1.2274 1.4130 1.4130 1.9592 1.9592 5.1119 5.1119 5.9581 5.9581 6.1187 6.1187 7.6218 7.6218 7.7026 7.7026 8.0835 8.0835 k = 0.0789 0.0048 0.0106 ( 8657 PWs) bands (ev): -19.7763 -19.7763 -19.6649 -19.6649 -17.4363 -17.4363 -17.3501 -17.3501 -10.1060 -10.1060 -9.8319 -9.8319 -9.5816 -9.5816 -9.2520 -9.2520 -8.4347 -8.4347 -8.3416 -8.3416 -6.2700 -6.2700 -6.0415 -6.0415 -5.7299 -5.7299 -5.6434 -5.6434 -5.1743 -5.1743 -5.0684 -5.0684 -4.8901 -4.8901 -4.1625 -4.1625 -3.7322 -3.7322 -3.6211 -3.6211 -3.5400 -3.5400 -1.0898 -1.0898 -0.3958 -0.3958 -0.3160 -0.3160 0.2112 0.2112 0.4139 0.4139 0.5058 0.5058 0.9314 0.9314 1.2316 1.2316 1.3777 1.3777 1.9164 1.9164 5.1586 5.1586 5.9604 5.9604 6.1181 6.1181 7.6218 7.6218 7.7650 7.7650 8.1032 8.1032 k = 0.0921 0.0056 0.0123 ( 8652 PWs) bands (ev): -19.7758 -19.7758 -19.6647 -19.6647 -17.4362 -17.4362 -17.3499 -17.3499 -10.1059 -10.1059 -9.8318 -9.8318 -9.5746 -9.5746 -9.2502 -9.2502 -8.4356 -8.4356 -8.3417 -8.3417 -6.2707 -6.2707 -6.0418 -6.0418 -5.7273 -5.7273 -5.6423 -5.6423 -5.1746 -5.1746 -5.0650 -5.0650 -4.8902 -4.8902 -4.1614 -4.1614 -3.7345 -3.7345 -3.6333 -3.6333 -3.5395 -3.5395 -1.0866 -1.0866 -0.4060 -0.4060 -0.3145 -0.3145 0.2098 0.2098 0.4080 0.4080 0.5004 0.5004 0.9313 0.9313 1.2351 1.2351 1.3403 1.3403 1.8691 1.8691 5.2104 5.2104 5.9630 5.9630 6.1174 6.1174 7.6053 7.6053 7.8471 7.8471 8.1266 8.1266 k = 0.1053 0.0064 0.0141 ( 8646 PWs) bands (ev): -19.7753 -19.7753 -19.6646 -19.6646 -17.4361 -17.4361 -17.3496 -17.3496 -10.1058 -10.1058 -9.8316 -9.8316 -9.5666 -9.5666 -9.2482 -9.2482 -8.4366 -8.4366 -8.3418 -8.3418 -6.2714 -6.2714 -6.0422 -6.0422 -5.7243 -5.7243 -5.6409 -5.6409 -5.1750 -5.1750 -5.0610 -5.0610 -4.8903 -4.8903 -4.1601 -4.1601 -3.7372 -3.7372 -3.6462 -3.6462 -3.5398 -3.5398 -1.0830 -1.0830 -0.4170 -0.4170 -0.3137 -0.3137 0.2078 0.2078 0.3998 0.3998 0.4944 0.4944 0.9310 0.9310 1.2356 1.2356 1.3043 1.3043 1.8189 1.8189 5.2658 5.2658 5.9657 5.9657 6.1165 6.1165 7.5795 7.5795 7.9372 7.9372 8.1555 8.1555 k = 0.1184 0.0072 0.0159 ( 8642 PWs) bands (ev): -19.7746 -19.7746 -19.6644 -19.6644 -17.4359 -17.4359 -17.3493 -17.3493 -10.1056 -10.1056 -9.8315 -9.8315 -9.5576 -9.5576 -9.2460 -9.2460 -8.4377 -8.4377 -8.3419 -8.3419 -6.2722 -6.2722 -6.0427 -6.0427 -5.7212 -5.7212 -5.6392 -5.6392 -5.1755 -5.1755 -5.0566 -5.0566 -4.8904 -4.8904 -4.1587 -4.1587 -3.7404 -3.7404 -3.6596 -3.6596 -3.5410 -3.5410 -1.0789 -1.0789 -0.4290 -0.4290 -0.3134 -0.3134 0.2053 0.2053 0.3887 0.3887 0.4880 0.4880 0.9300 0.9300 1.2257 1.2257 1.2777 1.2777 1.7676 1.7676 5.3234 5.3234 5.9683 5.9683 6.1154 6.1154 7.5457 7.5457 8.0252 8.0252 8.1956 8.1956 k = 0.1316 0.0080 0.0176 ( 8633 PWs) bands (ev): -19.7739 -19.7739 -19.6642 -19.6642 -17.4358 -17.4358 -17.3490 -17.3490 -10.1054 -10.1054 -9.8313 -9.8313 -9.5478 -9.5478 -9.2436 -9.2436 -8.4390 -8.4390 -8.3420 -8.3420 -6.2731 -6.2731 -6.0433 -6.0433 -5.7179 -5.7179 -5.6373 -5.6373 -5.1760 -5.1760 -5.0516 -5.0516 -4.8905 -4.8905 -4.1572 -4.1572 -3.7440 -3.7440 -3.6735 -3.6735 -3.5430 -3.5430 -1.0746 -1.0746 -0.4418 -0.4418 -0.3138 -0.3138 0.2022 0.2022 0.3742 0.3742 0.4812 0.4812 0.9281 0.9281 1.1990 1.1990 1.2677 1.2677 1.7174 1.7174 5.3816 5.3816 5.9709 5.9709 6.1142 6.1142 7.5051 7.5051 8.0961 8.0961 8.2584 8.2584 k = 0.1447 0.0088 0.0194 ( 8627 PWs) bands (ev): -19.7731 -19.7731 -19.6640 -19.6640 -17.4356 -17.4356 -17.3487 -17.3487 -10.1052 -10.1052 -9.8311 -9.8311 -9.5370 -9.5370 -9.2410 -9.2410 -8.4404 -8.4404 -8.3422 -8.3422 -6.2741 -6.2741 -6.0439 -6.0439 -5.7144 -5.7144 -5.6351 -5.6351 -5.1766 -5.1766 -5.0463 -5.0463 -4.8906 -4.8906 -4.1555 -4.1555 -3.7480 -3.7480 -3.6877 -3.6877 -3.5457 -3.5457 -1.0699 -1.0699 -0.4554 -0.4554 -0.3150 -0.3150 0.1982 0.1982 0.3561 0.3561 0.4742 0.4742 0.9246 0.9246 1.1659 1.1659 1.2642 1.2642 1.6707 1.6707 5.4389 5.4389 5.9733 5.9733 6.1129 6.1129 7.4591 7.4591 8.1429 8.1429 8.3470 8.3470 k = 0.1579 0.0096 0.0212 ( 8627 PWs) bands (ev): -19.7723 -19.7723 -19.6638 -19.6638 -17.4354 -17.4354 -17.3483 -17.3483 -10.1050 -10.1050 -9.8309 -9.8309 -9.5255 -9.5255 -9.2382 -9.2382 -8.4420 -8.4420 -8.3423 -8.3423 -6.2750 -6.2750 -6.0445 -6.0445 -5.7109 -5.7109 -5.6326 -5.6326 -5.1773 -5.1773 -5.0405 -5.0405 -4.8907 -4.8907 -4.1538 -4.1538 -3.7526 -3.7526 -3.7022 -3.7022 -3.5491 -3.5491 -1.0649 -1.0649 -0.4700 -0.4700 -0.3169 -0.3169 0.1932 0.1932 0.3342 0.3342 0.4669 0.4669 0.9187 0.9187 1.1341 1.1341 1.2597 1.2597 1.6301 1.6301 5.4936 5.4936 5.9756 5.9756 6.1115 6.1115 7.4099 7.4099 8.1754 8.1754 8.4460 8.4460 k = 0.1711 0.0104 0.0229 ( 8625 PWs) bands (ev): -19.7714 -19.7714 -19.6635 -19.6635 -17.4352 -17.4352 -17.3480 -17.3480 -10.1048 -10.1048 -9.8307 -9.8307 -9.5132 -9.5132 -9.2353 -9.2353 -8.4437 -8.4437 -8.3424 -8.3424 -6.2760 -6.2760 -6.0452 -6.0452 -5.7075 -5.7075 -5.6297 -5.6297 -5.1780 -5.1780 -5.0343 -5.0343 -4.8908 -4.8908 -4.1520 -4.1520 -3.7577 -3.7577 -3.7167 -3.7167 -3.5531 -3.5531 -1.0598 -1.0598 -0.4855 -0.4855 -0.3198 -0.3198 0.1867 0.1867 0.3090 0.3090 0.4591 0.4591 0.9091 0.9091 1.1067 1.1067 1.2516 1.2516 1.5979 1.5979 5.5440 5.5440 5.9777 5.9777 6.1100 6.1100 7.3597 7.3597 8.2021 8.2021 8.5387 8.5387 k = 0.1842 0.0112 0.0247 ( 8623 PWs) bands (ev): -19.7705 -19.7705 -19.6633 -19.6633 -17.4350 -17.4350 -17.3476 -17.3476 -10.1045 -10.1045 -9.8305 -9.8305 -9.5003 -9.5003 -9.2323 -9.2323 -8.4456 -8.4456 -8.3426 -8.3426 -6.2770 -6.2770 -6.0460 -6.0460 -5.7041 -5.7041 -5.6264 -5.6264 -5.1787 -5.1787 -5.0278 -5.0278 -4.8908 -4.8908 -4.1501 -4.1501 -3.7635 -3.7635 -3.7311 -3.7311 -3.5576 -3.5576 -1.0545 -1.0545 -0.5019 -0.5019 -0.3236 -0.3236 0.1780 0.1780 0.2813 0.2813 0.4507 0.4507 0.8949 0.8949 1.0850 1.0850 1.2393 1.2393 1.5758 1.5758 5.5884 5.5884 5.9796 5.9796 6.1085 6.1085 7.3112 7.3112 8.2264 8.2264 8.6121 8.6121 k = 0.1974 0.0120 0.0264 ( 8627 PWs) bands (ev): -19.7696 -19.7696 -19.6631 -19.6631 -17.4348 -17.4348 -17.3472 -17.3472 -10.1043 -10.1043 -9.8303 -9.8303 -9.4867 -9.4867 -9.2291 -9.2291 -8.4476 -8.4476 -8.3427 -8.3427 -6.2781 -6.2781 -6.0468 -6.0468 -5.7009 -5.7009 -5.6228 -5.6228 -5.1795 -5.1795 -5.0209 -5.0209 -4.8908 -4.8908 -4.1482 -4.1482 -3.7704 -3.7704 -3.7450 -3.7450 -3.5625 -3.5625 -1.0492 -1.0492 -0.5192 -0.5192 -0.3284 -0.3284 0.1660 0.1660 0.2528 0.2528 0.4418 0.4418 0.8752 0.8752 1.0698 1.0698 1.2238 1.2238 1.5638 1.5638 5.6250 5.6250 5.9817 5.9817 6.1070 6.1070 7.2670 7.2670 8.2494 8.2494 8.6616 8.6616 k = 0.2105 0.0128 0.0282 ( 8625 PWs) bands (ev): -19.7686 -19.7686 -19.6628 -19.6628 -17.4346 -17.4346 -17.3468 -17.3468 -10.1041 -10.1041 -9.8301 -9.8301 -9.4725 -9.4725 -9.2258 -9.2258 -8.4497 -8.4497 -8.3428 -8.3428 -6.2791 -6.2791 -6.0477 -6.0477 -5.6978 -5.6978 -5.6189 -5.6189 -5.1803 -5.1803 -5.0138 -5.0138 -4.8908 -4.8908 -4.1462 -4.1462 -3.7786 -3.7786 -3.7579 -3.7579 -3.5678 -3.5678 -1.0439 -1.0439 -0.5374 -0.5374 -0.3344 -0.3344 0.1484 0.1484 0.2260 0.2260 0.4323 0.4323 0.8504 0.8504 1.0605 1.0605 1.2071 1.2071 1.5605 1.5605 5.6521 5.6521 5.9841 5.9841 6.1057 6.1057 7.2291 7.2291 8.2714 8.2714 8.6920 8.6920 k = 0.2237 0.0136 0.0300 ( 8625 PWs) bands (ev): -19.7676 -19.7676 -19.6626 -19.6626 -17.4343 -17.4343 -17.3464 -17.3464 -10.1039 -10.1039 -9.8298 -9.8298 -9.4579 -9.4579 -9.2225 -9.2225 -8.4519 -8.4519 -8.3429 -8.3429 -6.2801 -6.2801 -6.0487 -6.0487 -5.6950 -5.6950 -5.6145 -5.6145 -5.1811 -5.1811 -5.0064 -5.0064 -4.8907 -4.8907 -4.1442 -4.1442 -3.7889 -3.7889 -3.7690 -3.7690 -3.5734 -3.5734 -1.0388 -1.0388 -0.5565 -0.5565 -0.3415 -0.3415 0.1229 0.1229 0.2040 0.2040 0.4223 0.4223 0.8216 0.8216 1.0560 1.0560 1.1912 1.1912 1.5642 1.5642 5.6684 5.6684 5.9869 5.9869 6.1046 6.1046 7.1995 7.1995 8.2920 8.2920 8.7105 8.7105 k = 0.2368 0.0144 0.0317 ( 8622 PWs) bands (ev): -19.7666 -19.7666 -19.6623 -19.6623 -17.4341 -17.4341 -17.3459 -17.3459 -10.1036 -10.1036 -9.8296 -9.8296 -9.4430 -9.4430 -9.2191 -9.2191 -8.4543 -8.4543 -8.3429 -8.3429 -6.2811 -6.2811 -6.0496 -6.0496 -5.6924 -5.6924 -5.6099 -5.6099 -5.1819 -5.1819 -4.9987 -4.9987 -4.8906 -4.8906 -4.1422 -4.1422 -3.8010 -3.8010 -3.7785 -3.7785 -3.5793 -3.5793 -1.0339 -1.0339 -0.5764 -0.5764 -0.3498 -0.3498 0.0897 0.0897 0.1871 0.1871 0.4121 0.4121 0.7902 0.7902 1.0553 1.0553 1.1777 1.1777 1.5730 1.5730 5.6732 5.6732 5.9902 5.9902 6.1037 6.1037 7.1794 7.1794 8.3102 8.3102 8.7221 8.7221 k = 0.2500 0.0152 0.0335 ( 8625 PWs) bands (ev): -19.7656 -19.7656 -19.6621 -19.6621 -17.4339 -17.4339 -17.3455 -17.3455 -10.1034 -10.1034 -9.8294 -9.8294 -9.4277 -9.4277 -9.2157 -9.2157 -8.4568 -8.4568 -8.3429 -8.3429 -6.2820 -6.2820 -6.0507 -6.0507 -5.6900 -5.6900 -5.6050 -5.6050 -5.1828 -5.1828 -4.9910 -4.9910 -4.8905 -4.8905 -4.1403 -4.1403 -3.8141 -3.8141 -3.7870 -3.7870 -3.5852 -3.5852 -1.0293 -1.0293 -0.5969 -0.5969 -0.3593 -0.3593 0.0510 0.0510 0.1737 0.1737 0.4019 0.4019 0.7577 0.7577 1.0574 1.0574 1.1673 1.1673 1.5855 1.5855 5.6669 5.6669 5.9937 5.9937 6.1030 6.1030 7.1692 7.1692 8.3251 8.3251 8.7293 8.7293 k = 0.2632 0.0160 0.0353 ( 8630 PWs) bands (ev): -19.7645 -19.7645 -19.6618 -19.6618 -17.4337 -17.4337 -17.3451 -17.3451 -10.1032 -10.1032 -9.8291 -9.8291 -9.4123 -9.4123 -9.2123 -9.2123 -8.4593 -8.4593 -8.3430 -8.3430 -6.2829 -6.2829 -6.0517 -6.0517 -5.6879 -5.6879 -5.5999 -5.5999 -5.1837 -5.1837 -4.9831 -4.9831 -4.8903 -4.8903 -4.1383 -4.1383 -3.8275 -3.8275 -3.7952 -3.7952 -3.5913 -3.5913 -1.0253 -1.0253 -0.6180 -0.6180 -0.3700 -0.3700 0.0089 0.0089 0.1624 0.1624 0.3920 0.3920 0.7252 0.7252 1.0614 1.0614 1.1599 1.1599 1.6006 1.6006 5.6504 5.6504 5.9970 5.9970 6.1027 6.1027 7.1688 7.1688 8.3354 8.3354 8.7322 8.7322 k = 0.2763 0.0168 0.0370 ( 8631 PWs) bands (ev): -19.7635 -19.7635 -19.6616 -19.6616 -17.4334 -17.4334 -17.3446 -17.3446 -10.1030 -10.1030 -9.8289 -9.8289 -9.3967 -9.3967 -9.2090 -9.2090 -8.4620 -8.4620 -8.3430 -8.3430 -6.2838 -6.2838 -6.0528 -6.0528 -5.6860 -5.6860 -5.5946 -5.5946 -5.1845 -5.1845 -4.9751 -4.9751 -4.8900 -4.8900 -4.1364 -4.1364 -3.8408 -3.8408 -3.8034 -3.8034 -3.5973 -3.5973 -1.0219 -1.0219 -0.6393 -0.6393 -0.3817 -0.3817 -0.0351 -0.0351 0.1527 0.1527 0.3825 0.3825 0.6934 0.6934 1.0670 1.0670 1.1554 1.1554 1.6175 1.6175 5.6252 5.6252 5.9997 5.9997 6.1025 6.1025 7.1773 7.1773 8.3402 8.3402 8.7262 8.7262 k = 0.2895 0.0176 0.0388 ( 8624 PWs) bands (ev): -19.7625 -19.7625 -19.6614 -19.6614 -17.4332 -17.4332 -17.3442 -17.3442 -10.1028 -10.1028 -9.8286 -9.8286 -9.3812 -9.3812 -9.2056 -9.2056 -8.4647 -8.4647 -8.3430 -8.3430 -6.2846 -6.2846 -6.0540 -6.0540 -5.6843 -5.6843 -5.5892 -5.5892 -5.1853 -5.1853 -4.9671 -4.9671 -4.8897 -4.8897 -4.1346 -4.1346 -3.8538 -3.8538 -3.8115 -3.8115 -3.6033 -3.6033 -1.0193 -1.0193 -0.6607 -0.6607 -0.3943 -0.3943 -0.0802 -0.0802 0.1445 0.1445 0.3736 0.3736 0.6630 0.6630 1.0738 1.0738 1.1533 1.1533 1.6355 1.6355 5.5932 5.5932 6.0016 6.0016 6.1024 6.1024 7.1934 7.1934 8.3392 8.3392 8.7052 8.7052 k = 0.3026 0.0184 0.0405 ( 8616 PWs) bands (ev): -19.7615 -19.7615 -19.6611 -19.6611 -17.4330 -17.4330 -17.3438 -17.3438 -10.1026 -10.1026 -9.8284 -9.8284 -9.3658 -9.3658 -9.2024 -9.2024 -8.4675 -8.4675 -8.3429 -8.3429 -6.2854 -6.2854 -6.0551 -6.0551 -5.6829 -5.6829 -5.5838 -5.5838 -5.1861 -5.1861 -4.9592 -4.9592 -4.8893 -4.8893 -4.1328 -4.1328 -3.8663 -3.8663 -3.8197 -3.8197 -3.6091 -3.6091 -1.0177 -1.0177 -0.6818 -0.6818 -0.4077 -0.4077 -0.1256 -0.1256 0.1379 0.1379 0.3655 0.3655 0.6342 0.6342 1.0814 1.0814 1.1532 1.1532 1.6543 1.6543 5.5561 5.5561 6.0026 6.0026 6.1024 6.1024 7.2157 7.2157 8.3324 8.3324 8.6723 8.6723 k = 0.3158 0.0191 0.0423 ( 8607 PWs) bands (ev): -19.7605 -19.7605 -19.6609 -19.6609 -17.4328 -17.4328 -17.3434 -17.3434 -10.1024 -10.1024 -9.8282 -9.8282 -9.3506 -9.3506 -9.1992 -9.1992 -8.4703 -8.4703 -8.3428 -8.3428 -6.2861 -6.2861 -6.0562 -6.0562 -5.6816 -5.6816 -5.5784 -5.5784 -5.1869 -5.1869 -4.9514 -4.9514 -4.8889 -4.8889 -4.1312 -4.1312 -3.8782 -3.8782 -3.8280 -3.8280 -3.6148 -3.6148 -1.0173 -1.0173 -0.7022 -0.7022 -0.4216 -0.4216 -0.1706 -0.1706 0.1332 0.1332 0.3582 0.3582 0.6069 0.6069 1.0895 1.0895 1.1545 1.1545 1.6734 1.6734 5.5156 5.5156 6.0029 6.0029 6.1023 6.1023 7.2423 7.2423 8.3209 8.3209 8.6341 8.6341 k = 0.3289 0.0199 0.0441 ( 8607 PWs) bands (ev): -19.7596 -19.7596 -19.6607 -19.6607 -17.4326 -17.4326 -17.3430 -17.3430 -10.1022 -10.1022 -9.8279 -9.8279 -9.3358 -9.3358 -9.1962 -9.1962 -8.4731 -8.4731 -8.3428 -8.3428 -6.2868 -6.2868 -6.0574 -6.0574 -5.6805 -5.6805 -5.5732 -5.5732 -5.1876 -5.1876 -4.9438 -4.9438 -4.8884 -4.8884 -4.1296 -4.1296 -3.8894 -3.8894 -3.8362 -3.8362 -3.6202 -3.6202 -1.0181 -1.0181 -0.7218 -0.7218 -0.4359 -0.4359 -0.2144 -0.2144 0.1303 0.1303 0.3515 0.3515 0.5812 0.5812 1.0981 1.0981 1.1570 1.1570 1.6926 1.6926 5.4732 5.4732 6.0027 6.0027 6.1022 6.1022 7.2717 7.2717 8.3057 8.3057 8.5944 8.5944 k = 0.3421 0.0207 0.0458 ( 8604 PWs) bands (ev): -19.7587 -19.7587 -19.6605 -19.6605 -17.4324 -17.4324 -17.3426 -17.3426 -10.1020 -10.1020 -9.8277 -9.8277 -9.3214 -9.3214 -9.1933 -9.1933 -8.4759 -8.4759 -8.3427 -8.3427 -6.2874 -6.2874 -6.0585 -6.0585 -5.6795 -5.6795 -5.5681 -5.5681 -5.1883 -5.1883 -4.9366 -4.9366 -4.8878 -4.8878 -4.1282 -4.1282 -3.8999 -3.8999 -3.8444 -3.8444 -3.6254 -3.6254 -1.0203 -1.0203 -0.7403 -0.7403 -0.4504 -0.4504 -0.2563 -0.2563 0.1294 0.1294 0.3454 0.3454 0.5569 0.5569 1.1067 1.1067 1.1603 1.1603 1.7115 1.7115 5.4301 5.4301 6.0020 6.0020 6.1020 6.1020 7.3024 7.3024 8.2884 8.2884 8.5551 8.5551 k = 0.3553 0.0215 0.0476 ( 8609 PWs) bands (ev): -19.7578 -19.7578 -19.6603 -19.6603 -17.4322 -17.4322 -17.3423 -17.3423 -10.1019 -10.1019 -9.8275 -9.8275 -9.3076 -9.3076 -9.1906 -9.1906 -8.4786 -8.4786 -8.3426 -8.3426 -6.2879 -6.2879 -6.0596 -6.0596 -5.6787 -5.6787 -5.5633 -5.5633 -5.1890 -5.1890 -4.9297 -4.9297 -4.8871 -4.8871 -4.1269 -4.1269 -3.9096 -3.9096 -3.8524 -3.8524 -3.6302 -3.6302 -1.0238 -1.0238 -0.7575 -0.7575 -0.4649 -0.4649 -0.2957 -0.2957 0.1304 0.1304 0.3398 0.3398 0.5340 0.5340 1.1154 1.1154 1.1642 1.1642 1.7298 1.7298 5.3875 5.3875 6.0010 6.0010 6.1017 6.1017 7.3330 7.3330 8.2700 8.2700 8.5172 8.5172 k = 0.3684 0.0223 0.0494 ( 8614 PWs) bands (ev): -19.7570 -19.7570 -19.6602 -19.6602 -17.4321 -17.4321 -17.3420 -17.3420 -10.1018 -10.1018 -9.8273 -9.8273 -9.2945 -9.2945 -9.1880 -9.1880 -8.4813 -8.4813 -8.3426 -8.3426 -6.2884 -6.2884 -6.0607 -6.0607 -5.6780 -5.6780 -5.5588 -5.5588 -5.1896 -5.1896 -4.9234 -4.9234 -4.8862 -4.8862 -4.1257 -4.1257 -3.9185 -3.9185 -3.8601 -3.8601 -3.6348 -3.6348 -1.0286 -1.0286 -0.7734 -0.7734 -0.4790 -0.4790 -0.3320 -0.3320 0.1332 0.1332 0.3345 0.3345 0.5123 0.5123 1.1238 1.1238 1.1684 1.1684 1.7474 1.7474 5.3462 5.3462 5.9998 5.9998 6.1013 6.1013 7.3624 7.3624 8.2518 8.2518 8.4813 8.4813 k = 0.3816 0.0231 0.0511 ( 8615 PWs) bands (ev): -19.7563 -19.7563 -19.6600 -19.6600 -17.4319 -17.4319 -17.3416 -17.3416 -10.1016 -10.1016 -9.8271 -9.8271 -9.2822 -9.2822 -9.1857 -9.1857 -8.4838 -8.4838 -8.3425 -8.3425 -6.2888 -6.2888 -6.0617 -6.0617 -5.6773 -5.6773 -5.5546 -5.5546 -5.1901 -5.1901 -4.9177 -4.9177 -4.8852 -4.8852 -4.1247 -4.1247 -3.9265 -3.9265 -3.8675 -3.8675 -3.6389 -3.6389 -1.0342 -1.0342 -0.7881 -0.7881 -0.4926 -0.4926 -0.3648 -0.3648 0.1378 0.1378 0.3294 0.3294 0.4919 0.4919 1.1319 1.1319 1.1726 1.1726 1.7640 1.7640 5.3071 5.3071 5.9986 5.9986 6.1008 6.1008 7.3896 7.3896 8.2344 8.2344 8.4478 8.4478 k = 0.3947 0.0239 0.0529 ( 8611 PWs) bands (ev): -19.7556 -19.7556 -19.6599 -19.6599 -17.4318 -17.4318 -17.3414 -17.3414 -10.1015 -10.1015 -9.8270 -9.8270 -9.2708 -9.2708 -9.1836 -9.1836 -8.4862 -8.4862 -8.3424 -8.3424 -6.2891 -6.2891 -6.0627 -6.0627 -5.6768 -5.6768 -5.5507 -5.5507 -5.1906 -5.1906 -4.9127 -4.9127 -4.8838 -4.8838 -4.1238 -4.1238 -3.9336 -3.9336 -3.8744 -3.8744 -3.6427 -3.6427 -1.0406 -1.0406 -0.8016 -0.8016 -0.5054 -0.5054 -0.3938 -0.3938 0.1439 0.1439 0.3242 0.3242 0.4728 0.4728 1.1394 1.1394 1.1769 1.1769 1.7794 1.7794 5.2707 5.2707 5.9974 5.9974 6.1001 6.1001 7.4139 7.4139 8.2185 8.2185 8.4172 8.4172 k = 0.4079 0.0247 0.0547 ( 8602 PWs) bands (ev): -19.7549 -19.7549 -19.6597 -19.6597 -17.4316 -17.4316 -17.3411 -17.3411 -10.1014 -10.1014 -9.8268 -9.8268 -9.2604 -9.2604 -9.1816 -9.1816 -8.4885 -8.4885 -8.3423 -8.3423 -6.2895 -6.2895 -6.0636 -6.0636 -5.6764 -5.6764 -5.5472 -5.5472 -5.1910 -5.1910 -4.9086 -4.9086 -4.8822 -4.8822 -4.1231 -4.1231 -3.9398 -3.9398 -3.8809 -3.8809 -3.6461 -3.6461 -1.0473 -1.0473 -0.8141 -0.8141 -0.5168 -0.5168 -0.4190 -0.4190 0.1514 0.1514 0.3189 0.3189 0.4553 0.4553 1.1464 1.1464 1.1810 1.1810 1.7935 1.7935 5.2375 5.2375 5.9963 5.9963 6.0995 6.0995 7.4349 7.4349 8.2044 8.2044 8.3896 8.3896 k = 0.4211 0.0255 0.0564 ( 8605 PWs) bands (ev): -19.7544 -19.7544 -19.6596 -19.6596 -17.4315 -17.4315 -17.3409 -17.3409 -10.1013 -10.1013 -9.8267 -9.8267 -9.2512 -9.2512 -9.1800 -9.1800 -8.4905 -8.4905 -8.3422 -8.3422 -6.2897 -6.2897 -6.0644 -6.0644 -5.6760 -5.6760 -5.5441 -5.5441 -5.1914 -5.1914 -4.9053 -4.9053 -4.8803 -4.8803 -4.1225 -4.1225 -3.9451 -3.9451 -3.8867 -3.8867 -3.6491 -3.6491 -1.0538 -1.0538 -0.8256 -0.8256 -0.5267 -0.5267 -0.4405 -0.4405 0.1600 0.1600 0.3131 0.3131 0.4395 0.4395 1.1526 1.1526 1.1848 1.1848 1.8060 1.8060 5.2081 5.2081 5.9954 5.9954 6.0987 6.0987 7.4524 7.4524 8.1921 8.1921 8.3653 8.3653 k = 0.4342 0.0263 0.0582 ( 8605 PWs) bands (ev): -19.7539 -19.7539 -19.6595 -19.6595 -17.4314 -17.4314 -17.3407 -17.3407 -10.1012 -10.1012 -9.8266 -9.8266 -9.2432 -9.2432 -9.1786 -9.1786 -8.4923 -8.4923 -8.3421 -8.3421 -6.2899 -6.2899 -6.0651 -6.0651 -5.6757 -5.6757 -5.5415 -5.5415 -5.1918 -5.1918 -4.9028 -4.9028 -4.8783 -4.8783 -4.1220 -4.1220 -3.9496 -3.9496 -3.8917 -3.8917 -3.6516 -3.6516 -1.0600 -1.0600 -0.8360 -0.8360 -0.5346 -0.5346 -0.4587 -0.4587 0.1695 0.1695 0.3067 0.3067 0.4257 0.4257 1.1580 1.1580 1.1881 1.1881 1.8169 1.8169 5.1826 5.1826 5.9945 5.9945 6.0980 6.0980 7.4663 7.4663 8.1818 8.1818 8.3444 8.3444 k = 0.4474 0.0271 0.0599 ( 8600 PWs) bands (ev): -19.7535 -19.7535 -19.6595 -19.6595 -17.4313 -17.4313 -17.3405 -17.3405 -10.1012 -10.1012 -9.8265 -9.8265 -9.2365 -9.2365 -9.1774 -9.1774 -8.4938 -8.4938 -8.3421 -8.3421 -6.2901 -6.2901 -6.0657 -6.0657 -5.6755 -5.6755 -5.5393 -5.5393 -5.1920 -5.1920 -4.9010 -4.9010 -4.8764 -4.8764 -4.1216 -4.1216 -3.9532 -3.9532 -3.8960 -3.8960 -3.6537 -3.6537 -1.0654 -1.0654 -0.8451 -0.8451 -0.5405 -0.5405 -0.4736 -0.4736 0.1795 0.1795 0.2996 0.2996 0.4142 0.4142 1.1625 1.1625 1.1910 1.1910 1.8260 1.8260 5.1615 5.1615 5.9938 5.9938 6.0974 6.0974 7.4770 7.4770 8.1733 8.1733 8.3271 8.3271 k = 0.4605 0.0279 0.0617 ( 8597 PWs) bands (ev): -19.7532 -19.7532 -19.6594 -19.6594 -17.4313 -17.4313 -17.3404 -17.3404 -10.1011 -10.1011 -9.8264 -9.8264 -9.2312 -9.2312 -9.1765 -9.1765 -8.4950 -8.4950 -8.3420 -8.3420 -6.2902 -6.2902 -6.0661 -6.0661 -5.6753 -5.6753 -5.5376 -5.5376 -5.1922 -5.1922 -4.8998 -4.8998 -4.8746 -4.8746 -4.1213 -4.1213 -3.9559 -3.9559 -3.8995 -3.8995 -3.6553 -3.6553 -1.0699 -1.0699 -0.8526 -0.8526 -0.5445 -0.5445 -0.4855 -0.4855 0.1895 0.1895 0.2921 0.2921 0.4052 0.4052 1.1661 1.1661 1.1933 1.1933 1.8332 1.8332 5.1448 5.1448 5.9933 5.9933 6.0968 6.0968 7.4848 7.4848 8.1667 8.1667 8.3136 8.3136 k = 0.4737 0.0287 0.0635 ( 8592 PWs) bands (ev): -19.7530 -19.7530 -19.6594 -19.6594 -17.4312 -17.4312 -17.3403 -17.3403 -10.1011 -10.1011 -9.8263 -9.8263 -9.2274 -9.2274 -9.1759 -9.1759 -8.4958 -8.4958 -8.3420 -8.3420 -6.2903 -6.2903 -6.0665 -6.0665 -5.6752 -5.6752 -5.5364 -5.5364 -5.1924 -5.1924 -4.8990 -4.8990 -4.8733 -4.8733 -4.1211 -4.1211 -3.9578 -3.9578 -3.9019 -3.9019 -3.6565 -3.6565 -1.0732 -1.0732 -0.8582 -0.8582 -0.5469 -0.5469 -0.4943 -0.4943 0.1985 0.1985 0.2848 0.2848 0.3988 0.3988 1.1687 1.1687 1.1950 1.1950 1.8384 1.8384 5.1328 5.1328 5.9930 5.9930 6.0964 6.0964 7.4900 7.4900 8.1619 8.1619 8.3038 8.3038 k = 0.4868 0.0295 0.0652 ( 8588 PWs) bands (ev): -19.7529 -19.7529 -19.6593 -19.6593 -17.4312 -17.4312 -17.3403 -17.3403 -10.1011 -10.1011 -9.8263 -9.8263 -9.2250 -9.2250 -9.1755 -9.1755 -8.4964 -8.4964 -8.3419 -8.3419 -6.2903 -6.2903 -6.0667 -6.0667 -5.6751 -5.6751 -5.5356 -5.5356 -5.1924 -5.1924 -4.8986 -4.8986 -4.8724 -4.8724 -4.1210 -4.1210 -3.9590 -3.9590 -3.9035 -3.9035 -3.6572 -3.6572 -1.0753 -1.0753 -0.8617 -0.8617 -0.5480 -0.5480 -0.4998 -0.4998 0.2053 0.2053 0.2791 0.2791 0.3950 0.3950 1.1702 1.1702 1.1960 1.1960 1.8415 1.8415 5.1255 5.1255 5.9927 5.9927 6.0962 6.0962 7.4930 7.4930 8.1590 8.1590 8.2979 8.2979 k = 0.5000 0.0303 0.0670 ( 8592 PWs) bands (ev): -19.7528 -19.7528 -19.6593 -19.6593 -17.4312 -17.4312 -17.3402 -17.3402 -10.1010 -10.1010 -9.8263 -9.8263 -9.2243 -9.2243 -9.1754 -9.1754 -8.4965 -8.4965 -8.3419 -8.3419 -6.2903 -6.2903 -6.0667 -6.0667 -5.6751 -5.6751 -5.5354 -5.5354 -5.1925 -5.1925 -4.8984 -4.8984 -4.8721 -4.8721 -4.1210 -4.1210 -3.9594 -3.9594 -3.9040 -3.9040 -3.6574 -3.6574 -1.0759 -1.0759 -0.8629 -0.8629 -0.5483 -0.5483 -0.5016 -0.5016 0.2078 0.2078 0.2768 0.2768 0.3938 0.3938 1.1708 1.1708 1.1964 1.1964 1.8426 1.8426 5.1231 5.1231 5.9927 5.9927 6.0961 6.0961 7.4940 7.4940 8.1581 8.1581 8.2959 8.2959 k = 0.5000-0.2436-0.0662 ( 8618 PWs) bands (ev): -19.7522 -19.7522 -19.6599 -19.6599 -17.4314 -17.4314 -17.3404 -17.3404 -10.0894 -10.0894 -9.8380 -9.8380 -9.2283 -9.2283 -9.1745 -9.1745 -8.4597 -8.4597 -8.3708 -8.3708 -6.3066 -6.3066 -6.0601 -6.0601 -5.6669 -5.6669 -5.5321 -5.5321 -5.1929 -5.1929 -4.9028 -4.9028 -4.8710 -4.8710 -4.1288 -4.1288 -4.0095 -4.0095 -3.8908 -3.8908 -3.6653 -3.6653 -1.1049 -1.1049 -0.6580 -0.6580 -0.5735 -0.5735 -0.3971 -0.3971 0.0734 0.0734 0.2962 0.2962 0.4422 0.4422 1.0119 1.0119 1.4195 1.4195 1.6274 1.6274 5.0783 5.0783 5.6961 5.6961 6.2168 6.2168 7.8298 7.8298 7.9694 7.9694 8.3973 8.3973 k = 0.4884-0.2380-0.0646 ( 8612 PWs) bands (ev): -19.7523 -19.7523 -19.6599 -19.6599 -17.4314 -17.4314 -17.3404 -17.3404 -10.0894 -10.0894 -9.8380 -9.8380 -9.2285 -9.2285 -9.1749 -9.1749 -8.4601 -8.4601 -8.3705 -8.3705 -6.3066 -6.3066 -6.0600 -6.0600 -5.6670 -5.6670 -5.5323 -5.5323 -5.1928 -5.1928 -4.9029 -4.9029 -4.8712 -4.8712 -4.1289 -4.1289 -4.0091 -4.0091 -3.8903 -3.8903 -3.6650 -3.6650 -1.1039 -1.1039 -0.6566 -0.6566 -0.5731 -0.5731 -0.3968 -0.3968 0.0730 0.0730 0.2962 0.2962 0.4424 0.4424 1.0118 1.0118 1.4189 1.4189 1.6273 1.6273 5.0808 5.0808 5.6967 5.6967 6.2169 6.2169 7.8311 7.8311 7.9718 7.9718 8.3878 8.3878 k = 0.4767-0.2323-0.0631 ( 8620 PWs) bands (ev): -19.7524 -19.7524 -19.6599 -19.6599 -17.4314 -17.4314 -17.3404 -17.3404 -10.0895 -10.0895 -9.8380 -9.8380 -9.2290 -9.2290 -9.1761 -9.1761 -8.4610 -8.4610 -8.3696 -8.3696 -6.3066 -6.3066 -6.0599 -6.0599 -5.6670 -5.6670 -5.5329 -5.5329 -5.1928 -5.1928 -4.9033 -4.9033 -4.8718 -4.8718 -4.1290 -4.1290 -4.0079 -4.0079 -3.8890 -3.8890 -3.6643 -3.6643 -1.1009 -1.1009 -0.6527 -0.6527 -0.5717 -0.5717 -0.3958 -0.3958 0.0717 0.0717 0.2964 0.2964 0.4432 0.4432 1.0114 1.0114 1.4171 1.4171 1.6270 1.6270 5.0880 5.0880 5.6983 5.6983 6.2169 6.2169 7.8349 7.8349 7.9789 7.9789 8.3616 8.3616 k = 0.4651-0.2266-0.0616 ( 8625 PWs) bands (ev): -19.7526 -19.7526 -19.6599 -19.6599 -17.4315 -17.4315 -17.3405 -17.3405 -10.0896 -10.0896 -9.8381 -9.8381 -9.2298 -9.2298 -9.1780 -9.1780 -8.4626 -8.4626 -8.3683 -8.3683 -6.3065 -6.3065 -6.0598 -6.0598 -5.6671 -5.6671 -5.5339 -5.5339 -5.1926 -5.1926 -4.9040 -4.9040 -4.8728 -4.8728 -4.1293 -4.1293 -4.0060 -4.0060 -3.8868 -3.8868 -3.6631 -3.6631 -1.0959 -1.0959 -0.6464 -0.6464 -0.5693 -0.5693 -0.3942 -0.3942 0.0696 0.0696 0.2968 0.2968 0.4444 0.4444 1.0109 1.0109 1.4142 1.4142 1.6265 1.6265 5.1001 5.1001 5.7010 5.7010 6.2170 6.2170 7.8410 7.8410 7.9908 7.9908 8.3232 8.3232 k = 0.4535-0.2210-0.0600 ( 8621 PWs) bands (ev): -19.7528 -19.7528 -19.6600 -19.6600 -17.4315 -17.4315 -17.3406 -17.3406 -10.0898 -10.0898 -9.8381 -9.8381 -9.2312 -9.2312 -9.1806 -9.1806 -8.4646 -8.4646 -8.3665 -8.3665 -6.3064 -6.3064 -6.0595 -6.0595 -5.6673 -5.6673 -5.5352 -5.5352 -5.1923 -5.1923 -4.9049 -4.9049 -4.8740 -4.8740 -4.1296 -4.1296 -4.0033 -4.0033 -3.8837 -3.8837 -3.6615 -3.6615 -1.0890 -1.0890 -0.6382 -0.6382 -0.5655 -0.5655 -0.3917 -0.3917 0.0668 0.0668 0.2975 0.2975 0.4461 0.4461 1.0102 1.0102 1.4101 1.4101 1.6256 1.6256 5.1168 5.1168 5.7047 5.7047 6.2171 6.2171 7.8491 7.8491 8.0071 8.0071 8.2770 8.2770 k = 0.4419-0.2153-0.0585 ( 8615 PWs) bands (ev): -19.7531 -19.7531 -19.6600 -19.6600 -17.4316 -17.4316 -17.3407 -17.3407 -10.0900 -10.0900 -9.8381 -9.8381 -9.2330 -9.2330 -9.1838 -9.1838 -8.4670 -8.4670 -8.3643 -8.3643 -6.3062 -6.3062 -6.0592 -6.0592 -5.6674 -5.6674 -5.5369 -5.5369 -5.1919 -5.1919 -4.9063 -4.9063 -4.8755 -4.8755 -4.1301 -4.1301 -3.9998 -3.9998 -3.8798 -3.8798 -3.6594 -3.6594 -1.0803 -1.0803 -0.6288 -0.6288 -0.5599 -0.5599 -0.3883 -0.3883 0.0634 0.0634 0.2985 0.2985 0.4483 0.4483 1.0092 1.0092 1.4051 1.4051 1.6244 1.6244 5.1381 5.1381 5.7094 5.7094 6.2172 6.2172 7.8586 7.8586 8.0274 8.0274 8.2265 8.2265 k = 0.4302-0.2096-0.0569 ( 8613 PWs) bands (ev): -19.7535 -19.7535 -19.6601 -19.6601 -17.4317 -17.4317 -17.3408 -17.3408 -10.0903 -10.0903 -9.8382 -9.8382 -9.2356 -9.2356 -9.1873 -9.1873 -8.4696 -8.4696 -8.3619 -8.3619 -6.3060 -6.3060 -6.0589 -6.0589 -5.6677 -5.6677 -5.5390 -5.5390 -5.1915 -5.1915 -4.9081 -4.9081 -4.8772 -4.8772 -4.1307 -4.1307 -3.9955 -3.9955 -3.8751 -3.8751 -3.6569 -3.6569 -1.0698 -1.0698 -0.6191 -0.6191 -0.5519 -0.5519 -0.3839 -0.3839 0.0595 0.0595 0.3000 0.3000 0.4510 0.4510 1.0081 1.0081 1.3992 1.3992 1.6228 1.6228 5.1638 5.1638 5.7151 5.7151 6.2173 6.2173 7.8682 7.8682 8.0503 8.0503 8.1758 8.1758 k = 0.4186-0.2040-0.0554 ( 8614 PWs) bands (ev): -19.7539 -19.7539 -19.6602 -19.6602 -17.4319 -17.4319 -17.3409 -17.3409 -10.0906 -10.0906 -9.8382 -9.8382 -9.2390 -9.2390 -9.1911 -9.1911 -8.4725 -8.4725 -8.3593 -8.3593 -6.3058 -6.3058 -6.0585 -6.0585 -5.6680 -5.6680 -5.5415 -5.5415 -5.1911 -5.1911 -4.9104 -4.9104 -4.8789 -4.8789 -4.1314 -4.1314 -3.9905 -3.9905 -3.8698 -3.8698 -3.6539 -3.6539 -1.0577 -1.0577 -0.6101 -0.6101 -0.5411 -0.5411 -0.3782 -0.3782 0.0554 0.0554 0.3020 0.3020 0.4542 0.4542 1.0069 1.0069 1.3924 1.3924 1.6207 1.6207 5.1936 5.1936 5.7216 5.7216 6.2175 6.2175 7.8753 7.8753 8.0687 8.0687 8.1355 8.1355 k = 0.4070-0.1983-0.0539 ( 8610 PWs) bands (ev): -19.7544 -19.7544 -19.6603 -19.6603 -17.4320 -17.4320 -17.3411 -17.3411 -10.0909 -10.0909 -9.8382 -9.8382 -9.2434 -9.2434 -9.1949 -9.1949 -8.4754 -8.4754 -8.3566 -8.3566 -6.3055 -6.3055 -6.0580 -6.0580 -5.6683 -5.6683 -5.5443 -5.5443 -5.1906 -5.1906 -4.9133 -4.9133 -4.8806 -4.8806 -4.1322 -4.1322 -3.9846 -3.9846 -3.8639 -3.8639 -3.6506 -3.6506 -1.0443 -1.0443 -0.6022 -0.6022 -0.5275 -0.5275 -0.3707 -0.3707 0.0512 0.0512 0.3047 0.3047 0.4580 0.4580 1.0055 1.0055 1.3850 1.3850 1.6182 1.6182 5.2273 5.2273 5.7290 5.7290 6.2177 6.2177 7.8746 7.8746 8.0568 8.0568 8.1368 8.1368 k = 0.3953-0.1926-0.0523 ( 8607 PWs) bands (ev): -19.7550 -19.7550 -19.6604 -19.6604 -17.4322 -17.4322 -17.3412 -17.3412 -10.0913 -10.0913 -9.8383 -9.8383 -9.2490 -9.2490 -9.1985 -9.1985 -8.4782 -8.4782 -8.3538 -8.3538 -6.3051 -6.3051 -6.0575 -6.0575 -5.6687 -5.6687 -5.5474 -5.5474 -5.1900 -5.1900 -4.9167 -4.9167 -4.8821 -4.8821 -4.1332 -4.1332 -3.9780 -3.9780 -3.8574 -3.8574 -3.6469 -3.6469 -1.0297 -1.0297 -0.5956 -0.5956 -0.5117 -0.5117 -0.3612 -0.3612 0.0474 0.0474 0.3080 0.3080 0.4625 0.4625 1.0041 1.0041 1.3769 1.3769 1.6151 1.6151 5.2646 5.2646 5.7372 5.7372 6.2178 6.2178 7.8568 7.8568 8.0361 8.0361 8.1675 8.1675 k = 0.3837-0.1870-0.0508 ( 8606 PWs) bands (ev): -19.7556 -19.7556 -19.6605 -19.6605 -17.4323 -17.4323 -17.3414 -17.3414 -10.0918 -10.0918 -9.8383 -9.8383 -9.2559 -9.2559 -9.2018 -9.2018 -8.4810 -8.4810 -8.3510 -8.3510 -6.3047 -6.3047 -6.0569 -6.0569 -5.6692 -5.6692 -5.5508 -5.5508 -5.1894 -5.1894 -4.9208 -4.9208 -4.8834 -4.8834 -4.1342 -4.1342 -3.9706 -3.9706 -3.8504 -3.8504 -3.6429 -3.6429 -1.0142 -1.0142 -0.5898 -0.5898 -0.4947 -0.4947 -0.3490 -0.3490 0.0443 0.0443 0.3120 0.3120 0.4678 0.4678 1.0026 1.0026 1.3684 1.3684 1.6115 1.6115 5.3051 5.3051 5.7461 5.7461 6.2180 6.2180 7.8178 7.8178 8.0320 8.0320 8.2052 8.2052 k = 0.3721-0.1813-0.0492 ( 8604 PWs) bands (ev): -19.7562 -19.7562 -19.6606 -19.6606 -17.4325 -17.4325 -17.3417 -17.3417 -10.0922 -10.0922 -9.8383 -9.8383 -9.2640 -9.2640 -9.2047 -9.2047 -8.4835 -8.4835 -8.3483 -8.3483 -6.3043 -6.3043 -6.0563 -6.0563 -5.6698 -5.6698 -5.5545 -5.5545 -5.1887 -5.1887 -4.9254 -4.9254 -4.8847 -4.8847 -4.1354 -4.1354 -3.9625 -3.9625 -3.8431 -3.8431 -3.6385 -3.6385 -0.9983 -0.9983 -0.5847 -0.5847 -0.4778 -0.4778 -0.3338 -0.3338 0.0421 0.0421 0.3167 0.3167 0.4740 0.4740 1.0012 1.0012 1.3594 1.3594 1.6073 1.6073 5.3483 5.3483 5.7556 5.7556 6.2182 6.2182 7.7642 7.7642 8.0416 8.0416 8.2453 8.2453 k = 0.3605-0.1756-0.0477 ( 8613 PWs) bands (ev): -19.7569 -19.7569 -19.6607 -19.6607 -17.4327 -17.4327 -17.3419 -17.3419 -10.0927 -10.0927 -9.8383 -9.8383 -9.2734 -9.2734 -9.2074 -9.2074 -8.4858 -8.4858 -8.3457 -8.3457 -6.3037 -6.3037 -6.0557 -6.0557 -5.6705 -5.6705 -5.5584 -5.5584 -5.1880 -5.1880 -4.9305 -4.9305 -4.8857 -4.8857 -4.1367 -4.1367 -3.9538 -3.9538 -3.8354 -3.8354 -3.6339 -3.6339 -0.9824 -0.9824 -0.5797 -0.5797 -0.4618 -0.4618 -0.3153 -0.3153 0.0414 0.0414 0.3221 0.3221 0.4815 0.4815 1.0000 1.0000 1.3502 1.3502 1.6027 1.6027 5.3937 5.3937 5.7656 5.7656 6.2183 6.2183 7.7033 7.7033 8.0578 8.0578 8.2850 8.2850 k = 0.3488-0.1700-0.0462 ( 8611 PWs) bands (ev): -19.7577 -19.7577 -19.6609 -19.6609 -17.4329 -17.4329 -17.3421 -17.3421 -10.0933 -10.0933 -9.8383 -9.8383 -9.2838 -9.2838 -9.2097 -9.2097 -8.4878 -8.4878 -8.3433 -8.3433 -6.3031 -6.3031 -6.0551 -6.0551 -5.6713 -5.6713 -5.5626 -5.5626 -5.1873 -5.1873 -4.9361 -4.9361 -4.8866 -4.8866 -4.1381 -4.1381 -3.9443 -3.9443 -3.8274 -3.8274 -3.6290 -3.6290 -0.9669 -0.9669 -0.5746 -0.5746 -0.4471 -0.4471 -0.2935 -0.2935 0.0425 0.0425 0.3282 0.3282 0.4905 0.4905 0.9989 0.9989 1.3407 1.3407 1.5976 1.5976 5.4406 5.4406 5.7761 5.7761 6.2184 6.2184 7.6395 7.6395 8.0762 8.0762 8.3214 8.3214 k = 0.3372-0.1643-0.0446 ( 8619 PWs) bands (ev): -19.7585 -19.7585 -19.6610 -19.6610 -17.4331 -17.4331 -17.3424 -17.3424 -10.0938 -10.0938 -9.8383 -9.8383 -9.2952 -9.2952 -9.2119 -9.2119 -8.4893 -8.4893 -8.3410 -8.3410 -6.3024 -6.3024 -6.0544 -6.0544 -5.6722 -5.6722 -5.5670 -5.5670 -5.1866 -5.1866 -4.9420 -4.9420 -4.8874 -4.8874 -4.1396 -4.1396 -3.9343 -3.9343 -3.8193 -3.8193 -3.6239 -3.6239 -0.9524 -0.9524 -0.5692 -0.5692 -0.4338 -0.4338 -0.2691 -0.2691 0.0457 0.0457 0.3347 0.3347 0.5014 0.5014 0.9980 0.9980 1.3312 1.3312 1.5921 1.5921 5.4885 5.4885 5.7869 5.7869 6.2185 6.2185 7.5749 7.5749 8.0936 8.0936 8.3521 8.3521 k = 0.3256-0.1587-0.0431 ( 8615 PWs) bands (ev): -19.7593 -19.7593 -19.6612 -19.6612 -17.4334 -17.4334 -17.3427 -17.3427 -10.0944 -10.0944 -9.8382 -9.8382 -9.3074 -9.3074 -9.2140 -9.2140 -8.4905 -8.4905 -8.3389 -8.3389 -6.3016 -6.3016 -6.0537 -6.0537 -5.6733 -5.6733 -5.5715 -5.5715 -5.1858 -5.1858 -4.9482 -4.9482 -4.8880 -4.8880 -4.1412 -4.1412 -3.9237 -3.9237 -3.8110 -3.8110 -3.6186 -3.6186 -0.9395 -0.9395 -0.5634 -0.5634 -0.4217 -0.4217 -0.2425 -0.2425 0.0512 0.0512 0.3416 0.3416 0.5145 0.5145 0.9976 0.9976 1.3216 1.3216 1.5863 1.5863 5.5363 5.5363 5.7979 5.7979 6.2185 6.2185 7.5111 7.5111 8.1078 8.1078 8.3767 8.3767 k = 0.3140-0.1530-0.0415 ( 8609 PWs) bands (ev): -19.7601 -19.7601 -19.6614 -19.6614 -17.4336 -17.4336 -17.3430 -17.3430 -10.0950 -10.0950 -9.8382 -9.8382 -9.3203 -9.3203 -9.2160 -9.2160 -8.4912 -8.4912 -8.3370 -8.3370 -6.3007 -6.3007 -6.0530 -6.0530 -5.6744 -5.6744 -5.5761 -5.5761 -5.1850 -5.1850 -4.9547 -4.9547 -4.8886 -4.8886 -4.1428 -4.1428 -3.9125 -3.9125 -3.8027 -3.8027 -3.6132 -3.6132 -0.9286 -0.9286 -0.5569 -0.5569 -0.4104 -0.4104 -0.2145 -0.2145 0.0592 0.0592 0.3487 0.3487 0.5303 0.5303 0.9977 0.9977 1.3121 1.3121 1.5804 1.5804 5.5832 5.5832 5.8091 5.8091 6.2184 6.2184 7.4496 7.4496 8.1168 8.1168 8.3981 8.3981 k = 0.3023-0.1473-0.0400 ( 8611 PWs) bands (ev): -19.7610 -19.7610 -19.6616 -19.6616 -17.4338 -17.4338 -17.3433 -17.3433 -10.0957 -10.0957 -9.8381 -9.8381 -9.3338 -9.3338 -9.2179 -9.2179 -8.4915 -8.4915 -8.3354 -8.3354 -6.2997 -6.2997 -6.0523 -6.0523 -5.6758 -5.6758 -5.5808 -5.5808 -5.1842 -5.1842 -4.9613 -4.9613 -4.8891 -4.8891 -4.1444 -4.1444 -3.9010 -3.9010 -3.7944 -3.7944 -3.6077 -3.6077 -0.9202 -0.9202 -0.5498 -0.5498 -0.3998 -0.3998 -0.1854 -0.1854 0.0696 0.0696 0.3559 0.3559 0.5491 0.5491 0.9984 0.9984 1.3028 1.3028 1.5744 1.5744 5.6281 5.6281 5.8203 5.8203 6.2180 6.2180 7.3915 7.3915 8.1198 8.1198 8.4201 8.4201 k = 0.2907-0.1417-0.0385 ( 8612 PWs) bands (ev): -19.7619 -19.7619 -19.6617 -19.6617 -17.4340 -17.4340 -17.3437 -17.3437 -10.0963 -10.0963 -9.8379 -9.8379 -9.3478 -9.3478 -9.2199 -9.2199 -8.4912 -8.4912 -8.3339 -8.3339 -6.2987 -6.2987 -6.0515 -6.0515 -5.6773 -5.6773 -5.5855 -5.5855 -5.1834 -5.1834 -4.9681 -4.9681 -4.8895 -4.8895 -4.1461 -4.1461 -3.8890 -3.8890 -3.7861 -3.7861 -3.6021 -3.6021 -0.9145 -0.9145 -0.5419 -0.5419 -0.3898 -0.3898 -0.1555 -0.1555 0.0820 0.0820 0.3630 0.3630 0.5711 0.5711 0.9999 0.9999 1.2939 1.2939 1.5686 1.5686 5.6697 5.6697 5.8313 5.8313 6.2173 6.2173 7.3382 7.3382 8.1172 8.1172 8.4449 8.4449 k = 0.2791-0.1360-0.0369 ( 8610 PWs) bands (ev): -19.7628 -19.7628 -19.6619 -19.6619 -17.4342 -17.4342 -17.3440 -17.3440 -10.0970 -10.0970 -9.8378 -9.8378 -9.3621 -9.3621 -9.2218 -9.2218 -8.4906 -8.4906 -8.3328 -8.3328 -6.2976 -6.2976 -6.0508 -6.0508 -5.6790 -5.6790 -5.5902 -5.5902 -5.1826 -5.1826 -4.9749 -4.9749 -4.8899 -4.8899 -4.1477 -4.1477 -3.8768 -3.8768 -3.7779 -3.7779 -3.5964 -3.5964 -0.9117 -0.9117 -0.5335 -0.5335 -0.3803 -0.3803 -0.1248 -0.1248 0.0960 0.0960 0.3700 0.3700 0.5966 0.5966 1.0022 1.0022 1.2855 1.2855 1.5632 1.5632 5.7067 5.7067 5.8419 5.8419 6.2160 6.2160 7.2913 7.2913 8.1104 8.1104 8.4729 8.4729 k = 0.2674-0.1303-0.0354 ( 8613 PWs) bands (ev): -19.7638 -19.7638 -19.6621 -19.6621 -17.4344 -17.4344 -17.3444 -17.3444 -10.0976 -10.0976 -9.8376 -9.8376 -9.3767 -9.3767 -9.2238 -9.2238 -8.4894 -8.4894 -8.3319 -8.3319 -6.2963 -6.2963 -6.0501 -6.0501 -5.6809 -5.6809 -5.5949 -5.5949 -5.1818 -5.1818 -4.9817 -4.9817 -4.8902 -4.8902 -4.1494 -4.1494 -3.8643 -3.8643 -3.7698 -3.7698 -3.5909 -3.5909 -0.9117 -0.9117 -0.5246 -0.5246 -0.3715 -0.3715 -0.0932 -0.0932 0.1113 0.1113 0.3767 0.3767 0.6253 0.6253 1.0057 1.0057 1.2778 1.2778 1.5586 1.5586 5.7381 5.7381 5.8518 5.8518 6.2138 6.2138 7.2524 7.2524 8.1009 8.1009 8.5032 8.5032 k = 0.2558-0.1247-0.0339 ( 8621 PWs) bands (ev): -19.7647 -19.7647 -19.6623 -19.6623 -17.4346 -17.4346 -17.3447 -17.3447 -10.0983 -10.0983 -9.8375 -9.8375 -9.3915 -9.3915 -9.2258 -9.2258 -8.4879 -8.4879 -8.3312 -8.3312 -6.2951 -6.2951 -6.0494 -6.0494 -5.6829 -5.6829 -5.5995 -5.5995 -5.1811 -5.1811 -4.9886 -4.9886 -4.8905 -4.8905 -4.1510 -4.1510 -3.8517 -3.8517 -3.7618 -3.7618 -3.5853 -3.5853 -0.9144 -0.9144 -0.5153 -0.5153 -0.3634 -0.3634 -0.0609 -0.0609 0.1271 0.1271 0.3833 0.3833 0.6569 0.6569 1.0103 1.0103 1.2709 1.2709 1.5549 1.5549 5.7624 5.7624 5.8607 5.8607 6.2104 6.2104 7.2229 7.2229 8.0900 8.0900 8.5344 8.5344 k = 0.2442-0.1190-0.0323 ( 8617 PWs) bands (ev): -19.7656 -19.7656 -19.6625 -19.6625 -17.4348 -17.4348 -17.3451 -17.3451 -10.0989 -10.0989 -9.8373 -9.8373 -9.4063 -9.4063 -9.2278 -9.2278 -8.4859 -8.4859 -8.3308 -8.3308 -6.2937 -6.2937 -6.0487 -6.0487 -5.6852 -5.6852 -5.6040 -5.6040 -5.1803 -5.1803 -4.9954 -4.9954 -4.8907 -4.8907 -4.1526 -4.1526 -3.8391 -3.8391 -3.7539 -3.7539 -3.5799 -3.5799 -0.9195 -0.9195 -0.5058 -0.5058 -0.3560 -0.3560 -0.0278 -0.0278 0.1434 0.1434 0.3898 0.3898 0.6907 0.6907 1.0162 1.0162 1.2652 1.2652 1.5528 1.5528 5.7783 5.7783 5.8686 5.8686 6.2056 6.2056 7.2042 7.2042 8.0788 8.0788 8.5653 8.5653 k = 0.2326-0.1133-0.0308 ( 8621 PWs) bands (ev): -19.7666 -19.7666 -19.6627 -19.6627 -17.4350 -17.4350 -17.3455 -17.3455 -10.0996 -10.0996 -9.8370 -9.8370 -9.4211 -9.4211 -9.2298 -9.2298 -8.4835 -8.4835 -8.3306 -8.3306 -6.2922 -6.2922 -6.0480 -6.0480 -5.6877 -5.6877 -5.6083 -5.6083 -5.1796 -5.1796 -5.0021 -5.0021 -4.8909 -4.8909 -4.1541 -4.1541 -3.8266 -3.8266 -3.7460 -3.7460 -3.5746 -3.5746 -0.9267 -0.9267 -0.4962 -0.4962 -0.3494 -0.3494 0.0054 0.0054 0.1598 0.1598 0.3962 0.3962 0.7260 0.7260 1.0235 1.0235 1.2607 1.2607 1.5528 1.5528 5.7843 5.7843 5.8760 5.8760 6.1994 6.1994 7.1970 7.1970 8.0678 8.0678 8.5946 8.5946 k = 0.2209-0.1077-0.0292 ( 8622 PWs) bands (ev): -19.7675 -19.7675 -19.6629 -19.6629 -17.4352 -17.4352 -17.3459 -17.3459 -10.1002 -10.1002 -9.8368 -9.8368 -9.4358 -9.4358 -9.2318 -9.2318 -8.4808 -8.4808 -8.3306 -8.3306 -6.2907 -6.2907 -6.0473 -6.0473 -5.6903 -5.6903 -5.6124 -5.6124 -5.1789 -5.1789 -5.0087 -5.0087 -4.8910 -4.8910 -4.1556 -4.1556 -3.8144 -3.8144 -3.7382 -3.7382 -3.5695 -3.5695 -0.9355 -0.9355 -0.4867 -0.4867 -0.3436 -0.3436 0.0381 0.0381 0.1765 0.1765 0.4026 0.4026 0.7617 0.7617 1.0323 1.0323 1.2576 1.2576 1.5555 1.5555 5.7790 5.7790 5.8835 5.8835 6.1921 6.1921 7.2013 7.2013 8.0574 8.0574 8.6211 8.6211 k = 0.2093-0.1020-0.0277 ( 8626 PWs) bands (ev): -19.7684 -19.7684 -19.6631 -19.6631 -17.4354 -17.4354 -17.3463 -17.3463 -10.1008 -10.1008 -9.8365 -9.8365 -9.4503 -9.4503 -9.2339 -9.2339 -8.4779 -8.4779 -8.3308 -8.3308 -6.2892 -6.2892 -6.0466 -6.0466 -5.6932 -5.6932 -5.6162 -5.6162 -5.1782 -5.1782 -5.0151 -5.0151 -4.8911 -4.8911 -4.1569 -4.1569 -3.8026 -3.8026 -3.7303 -3.7303 -3.5646 -3.5646 -0.9457 -0.9457 -0.4772 -0.4772 -0.3386 -0.3386 0.0692 0.0692 0.1939 0.1939 0.4092 0.4092 0.7966 0.7966 1.0426 1.0426 1.2559 1.2559 1.5618 1.5618 5.7619 5.7619 5.8914 5.8914 6.1840 6.1840 7.2163 7.2163 8.0480 8.0480 8.6431 8.6431 k = 0.1977-0.0963-0.0262 ( 8626 PWs) bands (ev): -19.7693 -19.7693 -19.6633 -19.6633 -17.4355 -17.4355 -17.3466 -17.3466 -10.1014 -10.1014 -9.8363 -9.8363 -9.4645 -9.4645 -9.2359 -9.2359 -8.4746 -8.4746 -8.3312 -8.3312 -6.2876 -6.2876 -6.0460 -6.0460 -5.6962 -5.6962 -5.6199 -5.6199 -5.1776 -5.1776 -5.0213 -5.0213 -4.8911 -4.8911 -4.1582 -4.1582 -3.7914 -3.7914 -3.7221 -3.7221 -3.5600 -3.5600 -0.9569 -0.9569 -0.4678 -0.4678 -0.3342 -0.3342 0.0976 0.0976 0.2124 0.2124 0.4159 0.4159 0.8298 0.8298 1.0547 1.0547 1.2556 1.2556 1.5725 1.5725 5.7339 5.7339 5.8994 5.8994 6.1759 6.1759 7.2407 7.2407 8.0395 8.0395 8.6575 8.6575 k = 0.1860-0.0907-0.0246 ( 8624 PWs) bands (ev): -19.7701 -19.7701 -19.6635 -19.6635 -17.4357 -17.4357 -17.3470 -17.3470 -10.1020 -10.1020 -9.8360 -9.8360 -9.4784 -9.4784 -9.2379 -9.2379 -8.4712 -8.4712 -8.3317 -8.3317 -6.2860 -6.2860 -6.0454 -6.0454 -5.6994 -5.6994 -5.6232 -5.6232 -5.1770 -5.1770 -5.0273 -5.0273 -4.8911 -4.8911 -4.1594 -4.1594 -3.7810 -3.7810 -3.7136 -3.7136 -3.5558 -3.5558 -0.9688 -0.9688 -0.4586 -0.4586 -0.3306 -0.3306 0.1221 0.1221 0.2327 0.2327 0.4229 0.4229 0.8598 0.8598 1.0691 1.0691 1.2563 1.2563 1.5883 1.5883 5.6963 5.6963 5.9072 5.9072 6.1682 6.1682 7.2723 7.2723 8.0320 8.0320 8.6541 8.6541 k = 0.1744-0.0850-0.0231 ( 8629 PWs) bands (ev): -19.7710 -19.7710 -19.6637 -19.6637 -17.4358 -17.4358 -17.3474 -17.3474 -10.1025 -10.1025 -9.8357 -9.8357 -9.4918 -9.4918 -9.2399 -9.2399 -8.4677 -8.4677 -8.3323 -8.3323 -6.2843 -6.2843 -6.0448 -6.0448 -5.7027 -5.7027 -5.6264 -5.6264 -5.1764 -5.1764 -5.0331 -5.0331 -4.8911 -4.8911 -4.1604 -4.1604 -3.7716 -3.7716 -3.7047 -3.7047 -3.5519 -3.5519 -0.9812 -0.9812 -0.4496 -0.4496 -0.3275 -0.3275 0.1422 0.1422 0.2544 0.2544 0.4303 0.4303 0.8857 0.8857 1.0863 1.0863 1.2575 1.2575 1.6099 1.6099 5.6507 5.6507 5.9145 5.9145 6.1611 6.1611 7.3091 7.3091 8.0255 8.0255 8.6119 8.6119 k = 0.1628-0.0793-0.0215 ( 8629 PWs) bands (ev): -19.7718 -19.7718 -19.6639 -19.6639 -17.4359 -17.4359 -17.3478 -17.3478 -10.1030 -10.1030 -9.8354 -9.8354 -9.5047 -9.5047 -9.2418 -9.2418 -8.4641 -8.4641 -8.3330 -8.3330 -6.2827 -6.2827 -6.0443 -6.0443 -5.7061 -5.7061 -5.6292 -5.6292 -5.1759 -5.1759 -5.0386 -5.0386 -4.8910 -4.8910 -4.1614 -4.1614 -3.7633 -3.7633 -3.6953 -3.6953 -3.5484 -3.5484 -0.9936 -0.9936 -0.4409 -0.4409 -0.3251 -0.3251 0.1582 0.1582 0.2771 0.2771 0.4379 0.4379 0.9065 0.9065 1.1072 1.1072 1.2588 1.2588 1.6373 1.6373 5.5989 5.5989 5.9211 5.9211 6.1548 6.1548 7.3488 7.3488 8.0197 8.0197 8.5322 8.5322 k = 0.1512-0.0737-0.0200 ( 8636 PWs) bands (ev): -19.7725 -19.7725 -19.6640 -19.6640 -17.4360 -17.4360 -17.3481 -17.3481 -10.1035 -10.1035 -9.8351 -9.8351 -9.5171 -9.5171 -9.2437 -9.2437 -8.4605 -8.4605 -8.3339 -8.3339 -6.2811 -6.2811 -6.0438 -6.0438 -5.7095 -5.7095 -5.6318 -5.6318 -5.1755 -5.1755 -5.0438 -5.0438 -4.8909 -4.8909 -4.1622 -4.1622 -3.7561 -3.7561 -3.6853 -3.6853 -3.5454 -3.5454 -1.0060 -1.0060 -0.4323 -0.4323 -0.3231 -0.3231 0.1706 0.1706 0.2995 0.2995 0.4459 0.4459 0.9218 0.9218 1.1319 1.1319 1.2601 1.2601 1.6700 1.6700 5.5426 5.5426 5.9271 5.9271 6.1491 6.1491 7.3891 7.3891 8.0145 8.0145 8.4365 8.4365 k = 0.1395-0.0680-0.0185 ( 8646 PWs) bands (ev): -19.7733 -19.7733 -19.6642 -19.6642 -17.4361 -17.4361 -17.3485 -17.3485 -10.1039 -10.1039 -9.8347 -9.8347 -9.5288 -9.5288 -9.2455 -9.2455 -8.4569 -8.4569 -8.3347 -8.3347 -6.2795 -6.2795 -6.0433 -6.0433 -5.7129 -5.7129 -5.6342 -5.6342 -5.1751 -5.1751 -5.0488 -5.0488 -4.8909 -4.8909 -4.1629 -4.1629 -3.7500 -3.7500 -3.6750 -3.6750 -3.5429 -3.5429 -1.0182 -1.0182 -0.4240 -0.4240 -0.3216 -0.3216 0.1804 0.1804 0.3206 0.3206 0.4542 0.4542 0.9322 0.9322 1.1597 1.1597 1.2616 1.2616 1.7072 1.7072 5.4834 5.4834 5.9323 5.9323 6.1441 6.1441 7.4281 7.4281 8.0092 8.0092 8.3370 8.3370 k = 0.1279-0.0623-0.0169 ( 8643 PWs) bands (ev): -19.7740 -19.7740 -19.6644 -19.6644 -17.4362 -17.4362 -17.3488 -17.3488 -10.1043 -10.1043 -9.8344 -9.8344 -9.5398 -9.5398 -9.2472 -9.2472 -8.4534 -8.4534 -8.3356 -8.3356 -6.2779 -6.2779 -6.0428 -6.0428 -5.7162 -5.7162 -5.6362 -5.6362 -5.1747 -5.1747 -5.0533 -5.0533 -4.8907 -4.8907 -4.1635 -4.1635 -3.7449 -3.7449 -3.6644 -3.6644 -3.5409 -3.5409 -1.0299 -1.0299 -0.4160 -0.4160 -0.3206 -0.3206 0.1881 0.1881 0.3399 0.3399 0.4628 0.4628 0.9384 0.9384 1.1883 1.1883 1.2650 1.2650 1.7476 1.7476 5.4228 5.4228 5.9368 5.9368 6.1398 6.1398 7.4639 7.4639 8.0028 8.0028 8.2400 8.2400 k = 0.1163-0.0567-0.0154 ( 8648 PWs) bands (ev): -19.7746 -19.7746 -19.6645 -19.6645 -17.4363 -17.4363 -17.3491 -17.3491 -10.1047 -10.1047 -9.8341 -9.8341 -9.5500 -9.5500 -9.2487 -9.2487 -8.4501 -8.4501 -8.3364 -8.3364 -6.2764 -6.2764 -6.0424 -6.0424 -5.7195 -5.7195 -5.6381 -5.6381 -5.1744 -5.1744 -5.0575 -5.0575 -4.8906 -4.8906 -4.1641 -4.1641 -3.7407 -3.7407 -3.6536 -3.6536 -3.5395 -3.5395 -1.0410 -1.0410 -0.4083 -0.4083 -0.3201 -0.3201 0.1942 0.1942 0.3568 0.3568 0.4714 0.4714 0.9414 0.9414 1.2121 1.2121 1.2750 1.2750 1.7900 1.7900 5.3622 5.3622 5.9405 5.9405 6.1359 6.1359 7.4949 7.4949 7.9914 7.9914 8.1523 8.1523 k = 0.1047-0.0510-0.0138 ( 8650 PWs) bands (ev): -19.7752 -19.7752 -19.6647 -19.6647 -17.4364 -17.4364 -17.3494 -17.3494 -10.1050 -10.1050 -9.8338 -9.8338 -9.5594 -9.5594 -9.2502 -9.2502 -8.4470 -8.4470 -8.3373 -8.3373 -6.2750 -6.2750 -6.0421 -6.0421 -5.7226 -5.7226 -5.6398 -5.6398 -5.1742 -5.1742 -5.0614 -5.0614 -4.8905 -4.8905 -4.1645 -4.1645 -3.7372 -3.7372 -3.6429 -3.6429 -3.5387 -3.5387 -1.0514 -1.0514 -0.4009 -0.4009 -0.3199 -0.3199 0.1991 0.1991 0.3713 0.3713 0.4798 0.4798 0.9423 0.9423 1.2246 1.2246 1.2970 1.2970 1.8329 1.8329 5.3028 5.3028 5.9436 5.9436 6.1326 6.1326 7.5201 7.5201 7.9647 7.9647 8.0865 8.0865 k = 0.0930-0.0453-0.0123 ( 8648 PWs) bands (ev): -19.7757 -19.7757 -19.6648 -19.6648 -17.4365 -17.4365 -17.3497 -17.3497 -10.1053 -10.1053 -9.8335 -9.8335 -9.5680 -9.5680 -9.2516 -9.2516 -8.4440 -8.4440 -8.3380 -8.3380 -6.2736 -6.2736 -6.0417 -6.0417 -5.7255 -5.7255 -5.6412 -5.6412 -5.1739 -5.1739 -5.0649 -5.0649 -4.8903 -4.8903 -4.1648 -4.1648 -3.7343 -3.7343 -3.6323 -3.6323 -3.5386 -3.5386 -1.0610 -1.0610 -0.3939 -0.3939 -0.3201 -0.3201 0.2031 0.2031 0.3837 0.3837 0.4879 0.4879 0.9417 0.9417 1.2279 1.2279 1.3281 1.3281 1.8751 1.8751 5.2458 5.2458 5.9461 5.9461 6.1297 6.1297 7.5385 7.5385 7.9129 7.9129 8.0543 8.0543 k = 0.0814-0.0397-0.0108 ( 8648 PWs) bands (ev): -19.7762 -19.7762 -19.6649 -19.6649 -17.4365 -17.4365 -17.3499 -17.3499 -10.1056 -10.1056 -9.8332 -9.8332 -9.5757 -9.5757 -9.2528 -9.2528 -8.4414 -8.4414 -8.3387 -8.3387 -6.2724 -6.2724 -6.0414 -6.0414 -5.7282 -5.7282 -5.6425 -5.6425 -5.1737 -5.1737 -5.0679 -5.0679 -4.8902 -4.8902 -4.1651 -4.1651 -3.7320 -3.7320 -3.6221 -3.6221 -3.5391 -3.5391 -1.0696 -1.0696 -0.3873 -0.3873 -0.3207 -0.3207 0.2062 0.2062 0.3940 0.3940 0.4954 0.4954 0.9403 0.9403 1.2272 1.2272 1.3620 1.3620 1.9153 1.9153 5.1923 5.1923 5.9480 5.9480 6.1272 6.1272 7.5493 7.5493 7.8506 7.8506 8.0429 8.0429 k = 0.0698-0.0340-0.0092 ( 8646 PWs) bands (ev): -19.7766 -19.7766 -19.6650 -19.6650 -17.4366 -17.4366 -17.3501 -17.3501 -10.1058 -10.1058 -9.8330 -9.8330 -9.5824 -9.5824 -9.2539 -9.2539 -8.4390 -8.4390 -8.3394 -8.3394 -6.2713 -6.2713 -6.0412 -6.0412 -5.7305 -5.7305 -5.6435 -5.6435 -5.1736 -5.1736 -5.0706 -5.0706 -4.8900 -4.8900 -4.1653 -4.1653 -3.7302 -3.7302 -3.6121 -3.6121 -3.5403 -3.5403 -1.0772 -1.0772 -0.3811 -0.3811 -0.3216 -0.3216 0.2087 0.2087 0.4026 0.4026 0.5021 0.5021 0.9384 0.9384 1.2252 1.2252 1.3954 1.3954 1.9524 1.9524 5.1435 5.1435 5.9494 5.9494 6.1252 6.1252 7.5518 7.5518 7.7934 7.7934 8.0388 8.0388 k = 0.0581-0.0283-0.0077 ( 8642 PWs) bands (ev): -19.7770 -19.7770 -19.6651 -19.6651 -17.4366 -17.4366 -17.3503 -17.3503 -10.1060 -10.1060 -9.8328 -9.8328 -9.5881 -9.5881 -9.2548 -9.2548 -8.4370 -8.4370 -8.3399 -8.3399 -6.2703 -6.2703 -6.0410 -6.0410 -5.7326 -5.7326 -5.6444 -5.6444 -5.1735 -5.1735 -5.0729 -5.0729 -4.8899 -4.8899 -4.1654 -4.1654 -3.7287 -3.7287 -3.6027 -3.6027 -3.5422 -3.5422 -1.0838 -1.0838 -0.3754 -0.3754 -0.3228 -0.3228 0.2107 0.2107 0.4095 0.4095 0.5079 0.5079 0.9364 0.9364 1.2227 1.2227 1.4263 1.4263 1.9855 1.9855 5.1003 5.1003 5.9504 5.9504 6.1235 6.1235 7.5454 7.5454 7.7481 7.7481 8.0375 8.0375 k = 0.0465-0.0227-0.0062 ( 8643 PWs) bands (ev): -19.7773 -19.7773 -19.6651 -19.6651 -17.4366 -17.4366 -17.3504 -17.3504 -10.1062 -10.1062 -9.8326 -9.8326 -9.5929 -9.5929 -9.2556 -9.2556 -8.4353 -8.4353 -8.3404 -8.3404 -6.2695 -6.2695 -6.0408 -6.0408 -5.7344 -5.7344 -5.6452 -5.6452 -5.1734 -5.1734 -5.0748 -5.0748 -4.8898 -4.8898 -4.1655 -4.1655 -3.7276 -3.7276 -3.5938 -3.5938 -3.5448 -3.5448 -1.0893 -1.0893 -0.3704 -0.3704 -0.3241 -0.3241 0.2121 0.2121 0.4151 0.4151 0.5127 0.5127 0.9345 0.9345 1.2202 1.2202 1.4534 1.4534 2.0137 2.0137 5.0635 5.0635 5.9511 5.9511 6.1222 6.1222 7.5312 7.5312 7.7167 7.7167 8.0372 8.0372 k = 0.0349-0.0170-0.0046 ( 8643 PWs) bands (ev): -19.7775 -19.7775 -19.6652 -19.6652 -17.4366 -17.4366 -17.3505 -17.3505 -10.1063 -10.1063 -9.8324 -9.8324 -9.5966 -9.5966 -9.2562 -9.2562 -8.4340 -8.4340 -8.3407 -8.3407 -6.2689 -6.2689 -6.0407 -6.0407 -5.7357 -5.7357 -5.6457 -5.6457 -5.1733 -5.1733 -5.0762 -5.0762 -4.8897 -4.8897 -4.1656 -4.1656 -3.7268 -3.7268 -3.5856 -3.5856 -3.5481 -3.5481 -1.0935 -1.0935 -0.3660 -0.3660 -0.3256 -0.3256 0.2132 0.2132 0.4193 0.4193 0.5165 0.5165 0.9328 0.9328 1.2181 1.2181 1.4756 1.4756 2.0363 2.0363 5.0340 5.0340 5.9515 5.9515 6.1212 6.1212 7.5131 7.5131 7.6974 7.6974 8.0373 8.0373 k = 0.0233-0.0113-0.0031 ( 8640 PWs) bands (ev): -19.7777 -19.7777 -19.6652 -19.6652 -17.4366 -17.4366 -17.3506 -17.3506 -10.1064 -10.1064 -9.8323 -9.8323 -9.5993 -9.5993 -9.2566 -9.2566 -8.4331 -8.4331 -8.3409 -8.3409 -6.2684 -6.2684 -6.0406 -6.0406 -5.7368 -5.7368 -5.6461 -5.6461 -5.1733 -5.1733 -5.0772 -5.0772 -4.8896 -4.8896 -4.1657 -4.1657 -3.7262 -3.7262 -3.5782 -3.5782 -3.5520 -3.5520 -1.0966 -1.0966 -0.3626 -0.3626 -0.3269 -0.3269 0.2140 0.2140 0.4222 0.4222 0.5191 0.5191 0.9316 0.9316 1.2164 1.2164 1.4921 1.4921 2.0529 2.0529 5.0124 5.0124 5.9517 5.9517 6.1205 6.1205 7.4962 7.4962 7.6865 7.6865 8.0375 8.0375 k = 0.0116-0.0057-0.0015 ( 8642 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6009 -9.6009 -9.2569 -9.2569 -8.4325 -8.4325 -8.3411 -8.3411 -6.2681 -6.2681 -6.0405 -6.0405 -5.7374 -5.7374 -5.6463 -5.6463 -5.1732 -5.1732 -5.0779 -5.0779 -4.8896 -4.8896 -4.1657 -4.1657 -3.7259 -3.7259 -3.5719 -3.5719 -3.5561 -3.5561 -1.0985 -1.0985 -0.3604 -0.3604 -0.3279 -0.3279 0.2144 0.2144 0.4240 0.4240 0.5207 0.5207 0.9308 0.9308 1.2154 1.2154 1.5023 1.5023 2.0630 2.0630 4.9993 4.9993 5.9519 5.9519 6.1201 6.1201 7.4846 7.4846 7.6811 7.6811 8.0377 8.0377 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k =-0.0119-0.0007 0.0052 ( 8642 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8323 -9.8323 -9.6008 -9.6008 -9.2568 -9.2568 -8.4324 -8.4324 -8.3411 -8.3411 -6.2685 -6.2685 -6.0401 -6.0401 -5.7374 -5.7374 -5.6464 -5.6464 -5.1732 -5.1732 -5.0779 -5.0779 -4.8896 -4.8896 -4.1659 -4.1659 -3.7258 -3.7258 -3.5704 -3.5704 -3.5576 -3.5576 -1.0985 -1.0985 -0.3618 -0.3618 -0.3266 -0.3266 0.2138 0.2138 0.4234 0.4234 0.5220 0.5220 0.9308 0.9308 1.2155 1.2155 1.5023 1.5023 2.0628 2.0628 4.9992 4.9992 5.9521 5.9521 6.1201 6.1201 7.4859 7.4859 7.6803 7.6803 8.0382 8.0382 k =-0.0238-0.0014 0.0103 ( 8641 PWs) bands (ev): -19.7776 -19.7776 -19.6653 -19.6653 -17.4367 -17.4367 -17.3506 -17.3506 -10.1063 -10.1063 -9.8326 -9.8326 -9.5992 -9.5992 -9.2564 -9.2564 -8.4326 -8.4326 -8.3411 -8.3411 -6.2698 -6.2698 -6.0388 -6.0388 -5.7367 -5.7367 -5.6463 -5.6463 -5.1733 -5.1733 -5.0772 -5.0772 -4.8896 -4.8896 -4.1666 -4.1666 -3.7257 -3.7257 -3.5744 -3.5744 -3.5558 -3.5558 -1.0968 -1.0968 -0.3673 -0.3673 -0.3227 -0.3227 0.2117 0.2117 0.4200 0.4200 0.5240 0.5240 0.9317 0.9317 1.2166 1.2166 1.4922 1.4922 2.0519 2.0519 5.0119 5.0119 5.9528 5.9528 6.1204 6.1204 7.5019 7.5019 7.6834 7.6834 8.0393 8.0393 k =-0.0357-0.0022 0.0155 ( 8639 PWs) bands (ev): -19.7774 -19.7774 -19.6653 -19.6653 -17.4367 -17.4367 -17.3505 -17.3505 -10.1062 -10.1062 -9.8331 -9.8331 -9.5964 -9.5964 -9.2558 -9.2558 -8.4330 -8.4330 -8.3410 -8.3410 -6.2720 -6.2720 -6.0368 -6.0368 -5.7356 -5.7356 -5.6462 -5.6462 -5.1734 -5.1734 -5.0761 -5.0761 -4.8897 -4.8897 -4.1676 -4.1676 -3.7257 -3.7257 -3.5796 -3.5796 -3.5543 -3.5543 -1.0941 -1.0941 -0.3748 -0.3748 -0.3178 -0.3178 0.2082 0.2082 0.4148 0.4148 0.5268 0.5268 0.9331 0.9331 1.2186 1.2186 1.4759 1.4759 2.0340 2.0340 5.0327 5.0327 5.9540 5.9540 6.1210 6.1210 7.5265 7.5265 7.6897 7.6897 8.0412 8.0412 k =-0.0476-0.0029 0.0206 ( 8643 PWs) bands (ev): -19.7771 -19.7771 -19.6653 -19.6653 -17.4367 -17.4367 -17.3503 -17.3503 -10.1060 -10.1060 -9.8338 -9.8338 -9.5925 -9.5925 -9.2549 -9.2549 -8.4336 -8.4336 -8.3410 -8.3410 -6.2750 -6.2750 -6.0340 -6.0340 -5.7341 -5.7341 -5.6460 -5.6460 -5.1735 -5.1735 -5.0746 -5.0746 -4.8898 -4.8898 -4.1691 -4.1691 -3.7257 -3.7257 -3.5857 -3.5857 -3.5533 -3.5533 -1.0902 -1.0902 -0.3835 -0.3835 -0.3127 -0.3127 0.2031 0.2031 0.4081 0.4081 0.5301 0.5301 0.9350 0.9350 1.2211 1.2211 1.4539 1.4539 2.0097 2.0097 5.0611 5.0611 5.9555 5.9555 6.1217 6.1217 7.5553 7.5553 7.7026 7.7026 8.0438 8.0438 k =-0.0595-0.0036 0.0258 ( 8648 PWs) bands (ev): -19.7767 -19.7767 -19.6653 -19.6653 -17.4367 -17.4367 -17.3501 -17.3501 -10.1058 -10.1058 -9.8346 -9.8346 -9.5876 -9.5876 -9.2537 -9.2537 -8.4343 -8.4343 -8.3409 -8.3409 -6.2787 -6.2787 -6.0306 -6.0306 -5.7323 -5.7323 -5.6457 -5.6457 -5.1736 -5.1736 -5.0727 -5.0727 -4.8899 -4.8899 -4.1709 -4.1709 -3.7256 -3.7256 -3.5926 -3.5926 -3.5530 -3.5530 -1.0853 -1.0853 -0.3932 -0.3932 -0.3078 -0.3078 0.1966 0.1966 0.4003 0.4003 0.5333 0.5333 0.9374 0.9374 1.2242 1.2242 1.4269 1.4269 1.9795 1.9795 5.0964 5.0964 5.9574 5.9574 6.1227 6.1227 7.5801 7.5801 7.7286 7.7286 8.0473 8.0473 k =-0.0714-0.0043 0.0309 ( 8653 PWs) bands (ev): -19.7763 -19.7763 -19.6653 -19.6653 -17.4367 -17.4367 -17.3499 -17.3499 -10.1056 -10.1056 -9.8356 -9.8356 -9.5816 -9.5816 -9.2523 -9.2523 -8.4352 -8.4352 -8.3408 -8.3408 -6.2831 -6.2831 -6.0266 -6.0266 -5.7301 -5.7301 -5.6454 -5.6454 -5.1738 -5.1738 -5.0703 -5.0703 -4.8900 -4.8900 -4.1732 -4.1732 -3.7256 -3.7256 -3.6000 -3.6000 -3.5533 -3.5533 -1.0793 -1.0793 -0.4035 -0.4035 -0.3031 -0.3031 0.1885 0.1885 0.3916 0.3916 0.5361 0.5361 0.9402 0.9402 1.2276 1.2276 1.3960 1.3960 1.9441 1.9441 5.1378 5.1378 5.9595 5.9595 6.1238 6.1238 7.5929 7.5929 7.7739 7.7739 8.0517 8.0517 k =-0.0833-0.0051 0.0361 ( 8648 PWs) bands (ev): -19.7757 -19.7757 -19.6653 -19.6653 -17.4367 -17.4367 -17.3496 -17.3496 -10.1053 -10.1053 -9.8367 -9.8367 -9.5747 -9.5747 -9.2507 -9.2507 -8.4361 -8.4361 -8.3408 -8.3408 -6.2879 -6.2879 -6.0221 -6.0221 -5.7275 -5.7275 -5.6449 -5.6449 -5.1740 -5.1740 -5.0675 -5.0675 -4.8901 -4.8901 -4.1758 -4.1758 -3.7257 -3.7257 -3.6081 -3.6081 -3.5543 -3.5543 -1.0725 -1.0725 -0.4146 -0.4146 -0.2988 -0.2988 0.1788 0.1788 0.3821 0.3821 0.5381 0.5381 0.9433 0.9433 1.2309 1.2309 1.3623 1.3623 1.9045 1.9045 5.1844 5.1844 5.9618 5.9618 6.1250 6.1250 7.5924 7.5924 7.8374 7.8374 8.0576 8.0576 k =-0.0952-0.0058 0.0413 ( 8645 PWs) bands (ev): -19.7751 -19.7751 -19.6653 -19.6653 -17.4367 -17.4367 -17.3492 -17.3492 -10.1049 -10.1049 -9.8379 -9.8379 -9.5668 -9.5668 -9.2489 -9.2489 -8.4372 -8.4372 -8.3407 -8.3407 -6.2932 -6.2932 -6.0172 -6.0172 -5.7247 -5.7247 -5.6444 -5.6444 -5.1742 -5.1742 -5.0643 -5.0643 -4.8902 -4.8902 -4.1788 -4.1788 -3.7259 -3.7259 -3.6166 -3.6166 -3.5561 -3.5561 -1.0647 -1.0647 -0.4262 -0.4262 -0.2949 -0.2949 0.1675 0.1675 0.3718 0.3718 0.5390 0.5390 0.9464 0.9464 1.2335 1.2335 1.3273 1.3273 1.8618 1.8618 5.2352 5.2352 5.9642 5.9642 6.1264 6.1264 7.5811 7.5811 7.9130 7.9130 8.0665 8.0665 k =-0.1071-0.0065 0.0464 ( 8644 PWs) bands (ev): -19.7744 -19.7744 -19.6653 -19.6653 -17.4367 -17.4367 -17.3489 -17.3489 -10.1046 -10.1046 -9.8391 -9.8391 -9.5580 -9.5580 -9.2468 -9.2468 -8.4384 -8.4384 -8.3407 -8.3407 -6.2988 -6.2988 -6.0120 -6.0120 -5.7216 -5.7216 -5.6438 -5.6438 -5.1744 -5.1744 -5.0607 -5.0607 -4.8903 -4.8903 -4.1821 -4.1821 -3.7263 -3.7263 -3.6255 -3.6255 -3.5584 -3.5584 -1.0561 -1.0561 -0.4385 -0.4385 -0.2914 -0.2914 0.1547 0.1547 0.3605 0.3605 0.5387 0.5387 0.9495 0.9495 1.2332 1.2332 1.2941 1.2941 1.8170 1.8170 5.2890 5.2890 5.9667 5.9667 6.1279 6.1279 7.5612 7.5612 7.9910 7.9910 8.0844 8.0844 k =-0.1190-0.0072 0.0516 ( 8641 PWs) bands (ev): -19.7737 -19.7737 -19.6653 -19.6653 -17.4367 -17.4367 -17.3485 -17.3485 -10.1042 -10.1042 -9.8404 -9.8404 -9.5484 -9.5484 -9.2445 -9.2445 -8.4397 -8.4397 -8.3407 -8.3407 -6.3046 -6.3046 -6.0065 -6.0065 -5.7184 -5.7184 -5.6430 -5.6430 -5.1747 -5.1747 -5.0567 -5.0567 -4.8904 -4.8904 -4.1857 -4.1857 -3.7270 -3.7270 -3.6346 -3.6346 -3.5614 -3.5614 -1.0468 -1.0468 -0.4514 -0.4514 -0.2883 -0.2883 0.1405 0.1405 0.3481 0.3481 0.5368 0.5368 0.9523 0.9523 1.2233 1.2233 1.2699 1.2699 1.7716 1.7716 5.3449 5.3449 5.9690 5.9690 6.1295 6.1295 7.5337 7.5337 8.0435 8.0435 8.1365 8.1365 k =-0.1310-0.0079 0.0567 ( 8643 PWs) bands (ev): -19.7728 -19.7728 -19.6654 -19.6654 -17.4367 -17.4367 -17.3480 -17.3480 -10.1038 -10.1038 -9.8418 -9.8418 -9.5379 -9.5379 -9.2421 -9.2421 -8.4411 -8.4411 -8.3408 -8.3408 -6.3107 -6.3107 -6.0007 -6.0007 -5.7151 -5.7151 -5.6421 -5.6421 -5.1751 -5.1751 -5.0523 -5.0523 -4.8905 -4.8905 -4.1896 -4.1896 -3.7279 -3.7279 -3.6440 -3.6440 -3.5650 -3.5650 -1.0369 -1.0369 -0.4648 -0.4648 -0.2855 -0.2855 0.1247 0.1247 0.3344 0.3344 0.5332 0.5332 0.9543 0.9543 1.1984 1.1984 1.2611 1.2611 1.7270 1.7270 5.4015 5.4015 5.9712 5.9712 6.1313 6.1313 7.5000 7.5000 8.0645 8.0645 8.2269 8.2269 k =-0.1429-0.0087 0.0619 ( 8645 PWs) bands (ev): -19.7719 -19.7719 -19.6654 -19.6654 -17.4367 -17.4367 -17.3476 -17.3476 -10.1034 -10.1034 -9.8431 -9.8431 -9.5268 -9.5268 -9.2395 -9.2395 -8.4426 -8.4426 -8.3409 -8.3409 -6.3169 -6.3169 -5.9948 -5.9948 -5.7117 -5.7117 -5.6409 -5.6409 -5.1754 -5.1754 -5.0476 -5.0476 -4.8906 -4.8906 -4.1937 -4.1937 -3.7294 -3.7294 -3.6534 -3.6534 -3.5691 -3.5691 -1.0265 -1.0265 -0.4789 -0.4789 -0.2832 -0.2832 0.1076 0.1076 0.3190 0.3190 0.5278 0.5278 0.9551 0.9551 1.1677 1.1677 1.2589 1.2589 1.6847 1.6847 5.4577 5.4577 5.9731 5.9731 6.1333 6.1333 7.4616 7.4616 8.0777 8.0777 8.3292 8.3292 k =-0.1548-0.0094 0.0670 ( 8643 PWs) bands (ev): -19.7710 -19.7710 -19.6654 -19.6654 -17.4367 -17.4367 -17.3471 -17.3471 -10.1029 -10.1029 -9.8444 -9.8444 -9.5149 -9.5149 -9.2367 -9.2367 -8.4441 -8.4441 -8.3411 -8.3411 -6.3231 -6.3231 -5.9888 -5.9888 -5.7085 -5.7085 -5.6396 -5.6396 -5.1758 -5.1758 -5.0425 -5.0425 -4.8907 -4.8907 -4.1980 -4.1980 -3.7314 -3.7314 -3.6626 -3.6626 -3.5738 -3.5738 -1.0157 -1.0157 -0.4936 -0.4936 -0.2812 -0.2812 0.0891 0.0891 0.3018 0.3018 0.5205 0.5205 0.9540 0.9540 1.1380 1.1380 1.2571 1.2571 1.6463 1.6463 5.5122 5.5122 5.9745 5.9745 6.1354 6.1354 7.4202 7.4202 8.0896 8.0896 8.4343 8.4343 k =-0.1667-0.0101 0.0722 ( 8642 PWs) bands (ev): -19.7700 -19.7700 -19.6655 -19.6655 -17.4367 -17.4367 -17.3466 -17.3466 -10.1025 -10.1025 -9.8457 -9.8457 -9.5023 -9.5023 -9.2338 -9.2338 -8.4456 -8.4456 -8.3414 -8.3414 -6.3293 -6.3293 -5.9827 -5.9827 -5.7054 -5.7054 -5.6379 -5.6379 -5.1762 -5.1762 -5.0371 -5.0371 -4.8907 -4.8907 -4.2025 -4.2025 -3.7342 -3.7342 -3.6714 -3.6714 -3.5789 -3.5789 -1.0046 -1.0046 -0.5088 -0.5088 -0.2796 -0.2796 0.0693 0.0693 0.2826 0.2826 0.5113 0.5113 0.9502 0.9502 1.1116 1.1116 1.2541 1.2541 1.6134 1.6134 5.5636 5.5636 5.9755 5.9755 6.1379 6.1379 7.3779 7.3779 8.1014 8.1014 8.5378 8.5378 k =-0.1786-0.0108 0.0774 ( 8641 PWs) bands (ev): -19.7689 -19.7689 -19.6655 -19.6655 -17.4367 -17.4367 -17.3460 -17.3460 -10.1021 -10.1021 -9.8470 -9.8470 -9.4892 -9.4892 -9.2308 -9.2308 -8.4471 -8.4471 -8.3418 -8.3418 -6.3355 -6.3355 -5.9765 -5.9765 -5.7026 -5.7026 -5.6358 -5.6358 -5.1766 -5.1766 -5.0313 -5.0313 -4.8907 -4.8907 -4.2072 -4.2072 -3.7381 -3.7381 -3.6796 -3.6796 -3.5845 -3.5845 -0.9935 -0.9935 -0.5247 -0.5247 -0.2783 -0.2783 0.0482 0.0482 0.2614 0.2614 0.5002 0.5002 0.9428 0.9428 1.0896 1.0896 1.2494 1.2494 1.5871 1.5871 5.6107 5.6107 5.9758 5.9758 6.1408 6.1408 7.3367 7.3367 8.1132 8.1132 8.6356 8.6356 k =-0.1905-0.0115 0.0825 ( 8636 PWs) bands (ev): -19.7678 -19.7678 -19.6656 -19.6656 -17.4367 -17.4367 -17.3455 -17.3455 -10.1016 -10.1016 -9.8483 -9.8483 -9.4755 -9.4755 -9.2277 -9.2277 -8.4487 -8.4487 -8.3423 -8.3423 -6.3417 -6.3417 -5.9702 -5.9702 -5.7002 -5.7002 -5.6334 -5.6334 -5.1771 -5.1771 -5.0253 -5.0253 -4.8907 -4.8907 -4.2120 -4.2120 -3.7431 -3.7431 -3.6868 -3.6868 -3.5904 -3.5904 -0.9824 -0.9824 -0.5411 -0.5411 -0.2774 -0.2774 0.0258 0.0258 0.2385 0.2385 0.4872 0.4872 0.9313 0.9313 1.0725 1.0725 1.2434 1.2434 1.5679 1.5679 5.6520 5.6520 5.9754 5.9754 6.1440 6.1440 7.2988 7.2988 8.1249 8.1249 8.7224 8.7224 k =-0.2024-0.0123 0.0877 ( 8634 PWs) bands (ev): -19.7667 -19.7667 -19.6656 -19.6656 -17.4367 -17.4367 -17.3449 -17.3449 -10.1012 -10.1012 -9.8495 -9.8495 -9.4614 -9.4614 -9.2245 -9.2245 -8.4502 -8.4502 -8.3430 -8.3430 -6.3477 -6.3477 -5.9639 -5.9639 -5.6983 -5.6983 -5.6305 -5.6305 -5.1776 -5.1776 -5.0190 -5.0190 -4.8907 -4.8907 -4.2169 -4.2169 -3.7494 -3.7494 -3.6931 -3.6931 -3.5966 -3.5966 -0.9716 -0.9716 -0.5582 -0.5582 -0.2769 -0.2769 0.0020 0.0020 0.2143 0.2143 0.4724 0.4724 0.9159 0.9159 1.0601 1.0601 1.2369 1.2369 1.5555 1.5555 5.6863 5.6863 5.9743 5.9743 6.1476 6.1476 7.2662 7.2662 8.1360 8.1360 8.7855 8.7855 k =-0.2143-0.0130 0.0928 ( 8632 PWs) bands (ev): -19.7655 -19.7655 -19.6657 -19.6657 -17.4367 -17.4367 -17.3443 -17.3443 -10.1008 -10.1008 -9.8507 -9.8507 -9.4468 -9.4468 -9.2212 -9.2212 -8.4517 -8.4517 -8.3438 -8.3438 -6.3536 -6.3536 -5.9575 -5.9575 -5.6969 -5.6969 -5.6272 -5.6272 -5.1780 -5.1780 -5.0125 -5.0125 -4.8907 -4.8907 -4.2219 -4.2219 -3.7570 -3.7570 -3.6984 -3.6984 -3.6032 -3.6032 -0.9613 -0.9613 -0.5758 -0.5758 -0.2767 -0.2767 -0.0233 -0.0233 0.1892 0.1892 0.4560 0.4560 0.8973 0.8973 1.0514 1.0514 1.2312 1.2312 1.5492 1.5492 5.7124 5.7124 5.9725 5.9725 6.1513 6.1513 7.2407 7.2407 8.1461 8.1461 8.8032 8.8032 k =-0.2262-0.0137 0.0980 ( 8627 PWs) bands (ev): -19.7643 -19.7643 -19.6658 -19.6658 -17.4367 -17.4367 -17.3437 -17.3437 -10.1004 -10.1004 -9.8519 -9.8519 -9.4318 -9.4318 -9.2179 -9.2179 -8.4532 -8.4532 -8.3447 -8.3447 -6.3594 -6.3594 -5.9510 -5.9510 -5.6961 -5.6961 -5.6235 -5.6235 -5.1785 -5.1785 -5.0058 -5.0058 -4.8906 -4.8906 -4.2269 -4.2269 -3.7656 -3.7656 -3.7028 -3.7028 -3.6099 -3.6099 -0.9516 -0.9516 -0.5940 -0.5940 -0.2769 -0.2769 -0.0501 -0.0501 0.1641 0.1641 0.4381 0.4381 0.8766 0.8766 1.0454 1.0454 1.2270 1.2270 1.5479 1.5479 5.7294 5.7294 5.9701 5.9701 6.1551 6.1551 7.2236 7.2236 8.1548 8.1548 8.7933 8.7933 k =-0.2381-0.0144 0.1031 ( 8626 PWs) bands (ev): -19.7631 -19.7631 -19.6659 -19.6659 -17.4367 -17.4367 -17.3431 -17.3431 -10.1000 -10.1000 -9.8529 -9.8529 -9.4166 -9.4166 -9.2146 -9.2146 -8.4545 -8.4545 -8.3458 -8.3458 -6.3649 -6.3649 -5.9445 -5.9445 -5.6959 -5.6959 -5.6194 -5.6194 -5.1791 -5.1791 -4.9989 -4.9989 -4.8904 -4.8904 -4.2319 -4.2319 -3.7749 -3.7749 -3.7067 -3.7067 -3.6169 -3.6169 -0.9428 -0.9428 -0.6128 -0.6128 -0.2776 -0.2776 -0.0784 -0.0784 0.1396 0.1396 0.4188 0.4188 0.8550 0.8550 1.0415 1.0415 1.2250 1.2250 1.5505 1.5505 5.7369 5.7369 5.9674 5.9674 6.1585 6.1585 7.2160 7.2160 8.1611 8.1611 8.7747 8.7747 k =-0.2500-0.0152 0.1083 ( 8633 PWs) bands (ev): -19.7619 -19.7619 -19.6660 -19.6660 -17.4367 -17.4367 -17.3425 -17.3425 -10.0996 -10.0996 -9.8540 -9.8540 -9.4012 -9.4012 -9.2112 -9.2112 -8.4558 -8.4558 -8.3471 -8.3471 -6.3704 -6.3704 -5.9380 -5.9380 -5.6962 -5.6962 -5.6150 -5.6150 -5.1796 -5.1796 -4.9919 -4.9919 -4.8903 -4.8903 -4.2369 -4.2369 -3.7847 -3.7847 -3.7101 -3.7101 -3.6240 -3.6240 -0.9350 -0.9350 -0.6320 -0.6320 -0.2789 -0.2789 -0.1081 -0.1081 0.1165 0.1165 0.3986 0.3986 0.8332 0.8332 1.0393 1.0393 1.2252 1.2252 1.5560 1.5560 5.7348 5.7348 5.9645 5.9645 6.1612 6.1612 7.2181 7.2181 8.1646 8.1646 8.7516 8.7516 k =-0.2619-0.0159 0.1135 ( 8630 PWs) bands (ev): -19.7606 -19.7606 -19.6661 -19.6661 -17.4367 -17.4367 -17.3419 -17.3419 -10.0992 -10.0992 -9.8550 -9.8550 -9.3856 -9.3856 -9.2079 -9.2079 -8.4570 -8.4570 -8.3485 -8.3485 -6.3755 -6.3755 -5.9314 -5.9314 -5.6970 -5.6970 -5.6104 -5.6104 -5.1801 -5.1801 -4.9847 -4.9847 -4.8901 -4.8901 -4.2418 -4.2418 -3.7947 -3.7947 -3.7133 -3.7133 -3.6311 -3.6311 -0.9285 -0.9285 -0.6516 -0.6516 -0.2810 -0.2810 -0.1390 -0.1390 0.0954 0.0954 0.3779 0.3779 0.8118 0.8118 1.0387 1.0387 1.2274 1.2274 1.5636 1.5636 5.7238 5.7238 5.9616 5.9616 6.1632 6.1632 7.2297 7.2297 8.1643 8.1643 8.7261 8.7261 k =-0.2738-0.0166 0.1186 ( 8626 PWs) bands (ev): -19.7594 -19.7594 -19.6662 -19.6662 -17.4367 -17.4367 -17.3413 -17.3413 -10.0989 -10.0989 -9.8559 -9.8559 -9.3700 -9.3700 -9.2046 -9.2046 -8.4581 -8.4581 -8.3502 -8.3502 -6.3805 -6.3805 -5.9248 -5.9248 -5.6983 -5.6983 -5.6056 -5.6056 -5.1807 -5.1807 -4.9775 -4.9775 -4.8899 -4.8899 -4.2466 -4.2466 -3.8049 -3.8049 -3.7163 -3.7163 -3.6383 -3.6383 -0.9235 -0.9235 -0.6715 -0.6715 -0.2843 -0.2843 -0.1705 -0.1705 0.0767 0.0767 0.3570 0.3570 0.7912 0.7912 1.0393 1.0393 1.2313 1.2313 1.5727 1.5727 5.7047 5.7047 5.9589 5.9589 6.1643 6.1643 7.2499 7.2499 8.1597 8.1597 8.6993 8.6993 k =-0.2857-0.0173 0.1238 ( 8621 PWs) bands (ev): -19.7582 -19.7582 -19.6663 -19.6663 -17.4367 -17.4367 -17.3407 -17.3407 -10.0985 -10.0985 -9.8568 -9.8568 -9.3544 -9.3544 -9.2013 -9.2013 -8.4591 -8.4591 -8.3520 -8.3520 -6.3853 -6.3853 -5.9181 -5.9181 -5.7000 -5.7000 -5.6007 -5.6007 -5.1812 -5.1812 -4.9703 -4.9703 -4.8896 -4.8896 -4.2513 -4.2513 -3.8150 -3.8150 -3.7193 -3.7193 -3.6455 -3.6455 -0.9201 -0.9201 -0.6916 -0.6916 -0.2898 -0.2898 -0.2011 -0.2011 0.0607 0.0607 0.3366 0.3366 0.7714 0.7714 1.0411 1.0411 1.2364 1.2364 1.5830 1.5830 5.6790 5.6790 5.9561 5.9561 6.1646 6.1646 7.2775 7.2775 8.1503 8.1503 8.6724 8.6724 k =-0.2976-0.0180 0.1289 ( 8622 PWs) bands (ev): -19.7569 -19.7569 -19.6664 -19.6664 -17.4367 -17.4367 -17.3401 -17.3401 -10.0982 -10.0982 -9.8577 -9.8577 -9.3389 -9.3389 -9.1982 -9.1982 -8.4599 -8.4599 -8.3540 -8.3540 -6.3899 -6.3899 -5.9114 -5.9114 -5.7022 -5.7022 -5.5959 -5.5959 -5.1817 -5.1817 -4.9631 -4.9631 -4.8894 -4.8894 -4.2559 -4.2559 -3.8249 -3.8249 -3.7223 -3.7223 -3.6526 -3.6526 -0.9185 -0.9185 -0.7117 -0.7117 -0.2995 -0.2995 -0.2285 -0.2285 0.0476 0.0476 0.3172 0.3172 0.7525 0.7525 1.0440 1.0440 1.2426 1.2426 1.5939 1.5939 5.6481 5.6481 5.9534 5.9534 6.1643 6.1643 7.3109 7.3109 8.1363 8.1363 8.6461 8.6461 k =-0.3095-0.0188 0.1341 ( 8615 PWs) bands (ev): -19.7557 -19.7557 -19.6665 -19.6665 -17.4367 -17.4367 -17.3395 -17.3395 -10.0979 -10.0979 -9.8585 -9.8585 -9.3236 -9.3236 -9.1950 -9.1950 -8.4605 -8.4605 -8.3562 -8.3562 -6.3942 -6.3942 -5.9046 -5.9046 -5.7048 -5.7048 -5.5910 -5.5910 -5.1822 -5.1822 -4.9560 -4.9560 -4.8891 -4.8891 -4.2602 -4.2602 -3.8346 -3.8346 -3.7253 -3.7253 -3.6597 -3.6597 -0.9186 -0.9186 -0.7317 -0.7317 -0.3167 -0.3167 -0.2489 -0.2489 0.0371 0.0371 0.2993 0.2993 0.7344 0.7344 1.0478 1.0478 1.2494 1.2494 1.6052 1.6052 5.6132 5.6132 5.9506 5.9506 6.1634 6.1634 7.3484 7.3484 8.1181 8.1181 8.6210 8.6210 k =-0.3214-0.0195 0.1392 ( 8613 PWs) bands (ev): -19.7545 -19.7545 -19.6667 -19.6667 -17.4366 -17.4366 -17.3390 -17.3390 -10.0976 -10.0976 -9.8592 -9.8592 -9.3085 -9.3085 -9.1920 -9.1920 -8.4610 -8.4610 -8.3585 -8.3585 -6.3982 -6.3982 -5.8978 -5.8978 -5.7078 -5.7078 -5.5862 -5.5862 -5.1827 -5.1827 -4.9489 -4.9489 -4.8888 -4.8888 -4.2644 -4.2644 -3.8439 -3.8439 -3.7283 -3.7283 -3.6665 -3.6665 -0.9207 -0.9207 -0.7513 -0.7513 -0.3419 -0.3419 -0.2613 -0.2613 0.0290 0.0290 0.2834 0.2834 0.7170 0.7170 1.0522 1.0522 1.2566 1.2566 1.6168 1.6168 5.5758 5.5758 5.9477 5.9477 6.1621 6.1621 7.3884 7.3884 8.0970 8.0970 8.5971 8.5971 k =-0.3333-0.0202 0.1444 ( 8616 PWs) bands (ev): -19.7534 -19.7534 -19.6668 -19.6668 -17.4366 -17.4366 -17.3385 -17.3385 -10.0974 -10.0974 -9.8599 -9.8599 -9.2939 -9.2939 -9.1891 -9.1891 -8.4612 -8.4612 -8.3611 -8.3611 -6.4021 -6.4021 -5.8909 -5.8909 -5.7111 -5.7111 -5.5816 -5.5816 -5.1832 -5.1832 -4.9421 -4.9421 -4.8884 -4.8884 -4.2684 -4.2684 -3.8529 -3.8529 -3.7313 -3.7313 -3.6732 -3.6732 -0.9246 -0.9246 -0.7705 -0.7705 -0.3713 -0.3713 -0.2686 -0.2686 0.0231 0.0231 0.2699 0.2699 0.6999 0.6999 1.0573 1.0573 1.2639 1.2639 1.6283 1.6283 5.5369 5.5369 5.9448 5.9448 6.1605 6.1605 7.4290 7.4290 8.0744 8.0744 8.5744 8.5744 k =-0.3452-0.0209 0.1496 ( 8612 PWs) bands (ev): -19.7523 -19.7523 -19.6670 -19.6670 -17.4366 -17.4366 -17.3380 -17.3380 -10.0971 -10.0971 -9.8606 -9.8606 -9.2798 -9.2798 -9.1863 -9.1863 -8.4613 -8.4613 -8.3638 -8.3638 -6.4057 -6.4057 -5.8840 -5.8840 -5.7148 -5.7148 -5.5772 -5.5772 -5.1837 -5.1837 -4.9355 -4.9355 -4.8881 -4.8881 -4.2722 -4.2722 -3.8615 -3.8615 -3.7343 -3.7343 -3.6797 -3.6797 -0.9302 -0.9302 -0.7889 -0.7889 -0.4020 -0.4020 -0.2736 -0.2736 0.0188 0.0188 0.2591 0.2591 0.6831 0.6831 1.0627 1.0627 1.2714 1.2714 1.6396 1.6396 5.4975 5.4975 5.9419 5.9419 6.1587 6.1587 7.4684 7.4684 8.0525 8.0525 8.5525 8.5525 k =-0.3571-0.0217 0.1547 ( 8608 PWs) bands (ev): -19.7512 -19.7512 -19.6671 -19.6671 -17.4366 -17.4366 -17.3375 -17.3375 -10.0969 -10.0969 -9.8611 -9.8611 -9.2662 -9.2662 -9.1836 -9.1836 -8.4612 -8.4612 -8.3666 -8.3666 -6.4090 -6.4090 -5.8770 -5.8770 -5.7188 -5.7188 -5.5729 -5.5729 -5.1842 -5.1842 -4.9291 -4.9291 -4.8877 -4.8877 -4.2757 -4.2757 -3.8695 -3.8695 -3.7373 -3.7373 -3.6858 -3.6858 -0.9374 -0.9374 -0.8066 -0.8066 -0.4321 -0.4321 -0.2774 -0.2774 0.0156 0.0156 0.2514 0.2514 0.6665 0.6665 1.0684 1.0684 1.2786 1.2786 1.6506 1.6506 5.4585 5.4585 5.9390 5.9390 6.1567 6.1567 7.5044 7.5044 8.0333 8.0333 8.5315 8.5315 k =-0.3690-0.0224 0.1599 ( 8602 PWs) bands (ev): -19.7502 -19.7502 -19.6672 -19.6672 -17.4366 -17.4366 -17.3370 -17.3370 -10.0967 -10.0967 -9.8617 -9.8617 -9.2533 -9.2533 -9.1810 -9.1810 -8.4609 -8.4609 -8.3695 -8.3695 -6.4121 -6.4121 -5.8700 -5.8700 -5.7231 -5.7231 -5.5690 -5.5690 -5.1846 -5.1846 -4.9231 -4.9231 -4.8872 -4.8872 -4.2790 -4.2790 -3.8771 -3.8771 -3.7401 -3.7401 -3.6917 -3.6917 -0.9460 -0.9460 -0.8233 -0.8233 -0.4608 -0.4608 -0.2805 -0.2805 0.0132 0.0132 0.2469 0.2469 0.6498 0.6498 1.0742 1.0742 1.2856 1.2856 1.6612 1.6612 5.4206 5.4206 5.9363 5.9363 6.1546 6.1546 7.5349 7.5349 8.0190 8.0190 8.5113 8.5113 k =-0.3810-0.0231 0.1650 ( 8612 PWs) bands (ev): -19.7493 -19.7493 -19.6674 -19.6674 -17.4366 -17.4366 -17.3366 -17.3366 -10.0965 -10.0965 -9.8622 -9.8622 -9.2412 -9.2412 -9.1786 -9.1786 -8.4604 -8.4604 -8.3726 -8.3726 -6.4150 -6.4150 -5.8630 -5.8630 -5.7276 -5.7276 -5.5653 -5.5653 -5.1850 -5.1850 -4.9175 -4.9175 -4.8867 -4.8867 -4.2820 -4.2820 -3.8841 -3.8841 -3.7429 -3.7429 -3.6972 -3.6972 -0.9557 -0.9557 -0.8388 -0.8388 -0.4875 -0.4875 -0.2832 -0.2832 0.0111 0.0111 0.2458 0.2458 0.6331 0.6331 1.0800 1.0800 1.2923 1.2923 1.6712 1.6712 5.3843 5.3843 5.9336 5.9336 6.1525 6.1525 7.5583 7.5583 8.0115 8.0115 8.4919 8.4919 k =-0.3929-0.0238 0.1702 ( 8612 PWs) bands (ev): -19.7484 -19.7484 -19.6675 -19.6675 -17.4366 -17.4366 -17.3362 -17.3362 -10.0964 -10.0964 -9.8626 -9.8626 -9.2300 -9.2300 -9.1763 -9.1763 -8.4597 -8.4597 -8.3756 -8.3756 -6.4176 -6.4176 -5.8560 -5.8560 -5.7325 -5.7325 -5.5619 -5.5619 -5.1854 -5.1854 -4.9123 -4.9123 -4.8862 -4.8862 -4.2847 -4.2847 -3.8905 -3.8905 -3.7456 -3.7456 -3.7023 -3.7023 -0.9661 -0.9661 -0.8532 -0.8532 -0.5119 -0.5119 -0.2855 -0.2855 0.0090 0.0090 0.2479 0.2479 0.6163 0.6163 1.0856 1.0856 1.2985 1.2985 1.6806 1.6806 5.3503 5.3503 5.9311 5.9311 6.1504 6.1504 7.5734 7.5734 8.0114 8.0114 8.4734 8.4734 k =-0.4048-0.0245 0.1754 ( 8611 PWs) bands (ev): -19.7476 -19.7476 -19.6676 -19.6676 -17.4366 -17.4366 -17.3359 -17.3359 -10.0962 -10.0962 -9.8630 -9.8630 -9.2198 -9.2198 -9.1741 -9.1741 -8.4589 -8.4589 -8.3787 -8.3787 -6.4199 -6.4199 -5.8489 -5.8489 -5.7375 -5.7375 -5.5588 -5.5588 -5.1857 -5.1857 -4.9077 -4.9077 -4.8855 -4.8855 -4.2871 -4.2871 -3.8962 -3.8962 -3.7481 -3.7481 -3.7070 -3.7070 -0.9768 -0.9768 -0.8663 -0.8663 -0.5338 -0.5338 -0.2875 -0.2875 0.0068 0.0068 0.2530 0.2530 0.5995 0.5995 1.0910 1.0910 1.3043 1.3043 1.6892 1.6892 5.3189 5.3189 5.9288 5.9288 6.1484 6.1484 7.5804 7.5804 8.0185 8.0185 8.4561 8.4561 k =-0.4167-0.0253 0.1805 ( 8613 PWs) bands (ev): -19.7469 -19.7469 -19.6678 -19.6678 -17.4365 -17.4365 -17.3356 -17.3356 -10.0961 -10.0961 -9.8634 -9.8634 -9.2107 -9.2107 -9.1720 -9.1720 -8.4579 -8.4579 -8.3817 -8.3817 -6.4220 -6.4220 -5.8420 -5.8420 -5.7428 -5.7428 -5.5561 -5.5561 -5.1860 -5.1860 -4.9037 -4.9037 -4.8847 -4.8847 -4.2893 -4.2893 -3.9014 -3.9014 -3.7504 -3.7504 -3.7112 -3.7112 -0.9875 -0.9875 -0.8781 -0.8781 -0.5530 -0.5530 -0.2893 -0.2893 0.0045 0.0045 0.2606 0.2606 0.5827 0.5827 1.0961 1.0961 1.3094 1.3094 1.6969 1.6969 5.2904 5.2904 5.9267 5.9267 6.1464 6.1464 7.5808 7.5808 8.0308 8.0308 8.4402 8.4402 k =-0.4286-0.0260 0.1857 ( 8607 PWs) bands (ev): -19.7462 -19.7462 -19.6679 -19.6679 -17.4365 -17.4365 -17.3353 -17.3353 -10.0960 -10.0960 -9.8637 -9.8637 -9.2028 -9.2028 -9.1701 -9.1701 -8.4569 -8.4569 -8.3846 -8.3846 -6.4238 -6.4238 -5.8351 -5.8351 -5.7481 -5.7481 -5.5537 -5.5537 -5.1863 -5.1863 -4.9004 -4.9004 -4.8838 -4.8838 -4.2912 -4.2912 -3.9059 -3.9059 -3.7525 -3.7525 -3.7149 -3.7149 -0.9977 -0.9977 -0.8884 -0.8884 -0.5696 -0.5696 -0.2908 -0.2908 0.0022 0.0022 0.2702 0.2702 0.5662 0.5662 1.1007 1.1007 1.3140 1.3140 1.7038 1.7038 5.2652 5.2652 5.9249 5.9249 6.1446 6.1446 7.5767 7.5767 8.0458 8.0458 8.4259 8.4259 k =-0.4405-0.0267 0.1908 ( 8604 PWs) bands (ev): -19.7457 -19.7457 -19.6680 -19.6680 -17.4365 -17.4365 -17.3351 -17.3351 -10.0959 -10.0959 -9.8640 -9.8640 -9.1962 -9.1962 -9.1682 -9.1682 -8.4558 -8.4558 -8.3873 -8.3873 -6.4253 -6.4253 -5.8283 -5.8283 -5.7536 -5.7536 -5.5516 -5.5516 -5.1865 -5.1865 -4.8978 -4.8978 -4.8827 -4.8827 -4.2928 -4.2928 -3.9097 -3.9097 -3.7543 -3.7543 -3.7181 -3.7181 -1.0070 -1.0070 -0.8972 -0.8972 -0.5835 -0.5835 -0.2921 -0.2921 -0.0001 -0.0001 0.2810 0.2810 0.5502 0.5502 1.1047 1.1047 1.3179 1.3179 1.7097 1.7097 5.2435 5.2435 5.9233 5.9233 6.1430 6.1430 7.5700 7.5700 8.0613 8.0613 8.4133 8.4133 k =-0.4524-0.0274 0.1960 ( 8602 PWs) bands (ev): -19.7452 -19.7452 -19.6680 -19.6680 -17.4365 -17.4365 -17.3349 -17.3349 -10.0958 -10.0958 -9.8642 -9.8642 -9.1909 -9.1909 -9.1664 -9.1664 -8.4548 -8.4548 -8.3897 -8.3897 -6.4266 -6.4266 -5.8218 -5.8218 -5.7591 -5.7591 -5.5499 -5.5499 -5.1867 -5.1867 -4.8959 -4.8959 -4.8815 -4.8815 -4.2941 -4.2941 -3.9129 -3.9129 -3.7558 -3.7558 -3.7208 -3.7208 -1.0151 -1.0151 -0.9045 -0.9045 -0.5948 -0.5948 -0.2931 -0.2931 -0.0022 -0.0022 0.2923 0.2923 0.5352 0.5352 1.1081 1.1081 1.3211 1.3211 1.7146 1.7146 5.2256 5.2256 5.9220 5.9220 6.1416 6.1416 7.5626 7.5626 8.0754 8.0754 8.4028 8.4028 k =-0.4643-0.0282 0.2011 ( 8605 PWs) bands (ev): -19.7448 -19.7448 -19.6681 -19.6681 -17.4365 -17.4365 -17.3347 -17.3347 -10.0957 -10.0957 -9.8643 -9.8643 -9.1870 -9.1870 -9.1649 -9.1649 -8.4538 -8.4538 -8.3917 -8.3917 -6.4276 -6.4276 -5.8157 -5.8157 -5.7644 -5.7644 -5.5486 -5.5486 -5.1869 -5.1869 -4.8947 -4.8947 -4.8804 -4.8804 -4.2951 -4.2951 -3.9153 -3.9153 -3.7570 -3.7570 -3.7229 -3.7229 -1.0218 -1.0218 -0.9102 -0.9102 -0.6035 -0.6035 -0.2939 -0.2939 -0.0039 -0.0039 0.3031 0.3031 0.5218 0.5218 1.1108 1.1108 1.3237 1.3237 1.7185 1.7185 5.2114 5.2114 5.9210 5.9210 6.1405 6.1405 7.5557 7.5557 8.0869 8.0869 8.3945 8.3945 k =-0.4762-0.0289 0.2063 ( 8598 PWs) bands (ev): -19.7446 -19.7446 -19.6681 -19.6681 -17.4365 -17.4365 -17.3346 -17.3346 -10.0957 -10.0957 -9.8645 -9.8645 -9.1843 -9.1843 -9.1636 -9.1636 -8.4531 -8.4531 -8.3932 -8.3932 -6.4283 -6.4283 -5.8103 -5.8103 -5.7692 -5.7692 -5.5477 -5.5477 -5.1870 -5.1870 -4.8938 -4.8938 -4.8795 -4.8795 -4.2958 -4.2958 -3.9171 -3.9171 -3.7578 -3.7578 -3.7244 -3.7244 -1.0267 -1.0267 -0.9143 -0.9143 -0.6097 -0.6097 -0.2945 -0.2945 -0.0053 -0.0053 0.3122 0.3122 0.5110 0.5110 1.1128 1.1128 1.3255 1.3255 1.7213 1.7213 5.2012 5.2012 5.9203 5.9203 6.1397 6.1397 7.5503 7.5503 8.0953 8.0953 8.3884 8.3884 k =-0.4881-0.0296 0.2115 ( 8597 PWs) bands (ev): -19.7444 -19.7444 -19.6682 -19.6682 -17.4365 -17.4365 -17.3345 -17.3345 -10.0957 -10.0957 -9.8645 -9.8645 -9.1827 -9.1827 -9.1627 -9.1627 -8.4526 -8.4526 -8.3942 -8.3942 -6.4287 -6.4287 -5.8063 -5.8063 -5.7729 -5.7729 -5.5471 -5.5471 -5.1870 -5.1870 -4.8933 -4.8933 -4.8789 -4.8789 -4.2962 -4.2962 -3.9182 -3.9182 -3.7583 -3.7583 -3.7253 -3.7253 -1.0297 -1.0297 -0.9168 -0.9168 -0.6134 -0.6134 -0.2948 -0.2948 -0.0061 -0.0061 0.3185 0.3185 0.5039 0.5039 1.1140 1.1140 1.3266 1.3266 1.7230 1.7230 5.1951 5.1951 5.9198 5.9198 6.1392 6.1392 7.5468 7.5468 8.1003 8.1003 8.3847 8.3847 k =-0.5000-0.0303 0.2166 ( 8600 PWs) bands (ev): -19.7444 -19.7444 -19.6682 -19.6682 -17.4365 -17.4365 -17.3345 -17.3345 -10.0957 -10.0957 -9.8646 -9.8646 -9.1822 -9.1822 -9.1624 -9.1624 -8.4524 -8.4524 -8.3945 -8.3945 -6.4288 -6.4288 -5.8048 -5.8048 -5.7743 -5.7743 -5.5469 -5.5469 -5.1871 -5.1871 -4.8932 -4.8932 -4.8788 -4.8788 -4.2964 -4.2964 -3.9185 -3.9185 -3.7585 -3.7585 -3.7256 -3.7256 -1.0308 -1.0308 -0.9176 -0.9176 -0.6146 -0.6146 -0.2949 -0.2949 -0.0064 -0.0064 0.3207 0.3207 0.5014 0.5014 1.1144 1.1144 1.3270 1.3270 1.7235 1.7235 5.1930 5.1930 5.9197 5.9197 6.1390 6.1390 7.5456 7.5456 8.1020 8.1020 8.3835 8.3835 k =-0.5000-0.3043 0.0834 ( 8650 PWs) bands (ev): -19.7448 -19.7448 -19.6676 -19.6676 -17.4370 -17.4370 -17.3343 -17.3343 -10.1008 -10.1008 -9.8576 -9.8576 -9.1855 -9.1855 -9.1661 -9.1661 -8.4434 -8.4434 -8.3938 -8.3938 -6.4144 -6.4144 -5.7989 -5.7989 -5.7920 -5.7920 -5.5446 -5.5446 -5.1882 -5.1882 -4.8990 -4.8990 -4.8718 -4.8718 -4.3144 -4.3144 -3.9354 -3.9354 -3.7615 -3.7615 -3.7556 -3.7556 -0.9393 -0.9393 -0.7278 -0.7278 -0.5450 -0.5450 -0.3470 -0.3470 -0.1490 -0.1490 0.0485 0.0485 0.6230 0.6230 1.1351 1.1351 1.3764 1.3764 1.7914 1.7914 5.0020 5.0020 5.8018 5.8018 6.0469 6.0469 7.6906 7.6906 7.8773 7.8773 8.6719 8.6719 k =-0.4889-0.2975 0.0816 ( 8647 PWs) bands (ev): -19.7449 -19.7449 -19.6676 -19.6676 -17.4370 -17.4370 -17.3343 -17.3343 -10.1008 -10.1008 -9.8576 -9.8576 -9.1861 -9.1861 -9.1661 -9.1661 -8.4434 -8.4434 -8.3938 -8.3938 -6.4143 -6.4143 -5.8027 -5.8027 -5.7883 -5.7883 -5.5448 -5.5448 -5.1881 -5.1881 -4.8991 -4.8991 -4.8720 -4.8720 -4.3143 -4.3143 -3.9349 -3.9349 -3.7636 -3.7636 -3.7529 -3.7529 -0.9391 -0.9391 -0.7273 -0.7273 -0.5440 -0.5440 -0.3475 -0.3475 -0.1484 -0.1484 0.0498 0.0498 0.6233 0.6233 1.1349 1.1349 1.3759 1.3759 1.7908 1.7908 5.0039 5.0039 5.8025 5.8025 6.0474 6.0474 7.6900 7.6900 7.8788 7.8788 8.6709 8.6709 k =-0.4778-0.2908 0.0797 ( 8647 PWs) bands (ev): -19.7450 -19.7450 -19.6676 -19.6676 -17.4370 -17.4370 -17.3344 -17.3344 -10.1009 -10.1009 -9.8575 -9.8575 -9.1879 -9.1879 -9.1664 -9.1664 -8.4433 -8.4433 -8.3935 -8.3935 -6.4139 -6.4139 -5.8088 -5.8088 -5.7825 -5.7825 -5.5453 -5.5453 -5.1881 -5.1881 -4.8994 -4.8994 -4.8726 -4.8726 -4.3140 -4.3140 -3.9335 -3.9335 -3.7668 -3.7668 -3.7481 -3.7481 -0.9387 -0.9387 -0.7261 -0.7261 -0.5413 -0.5413 -0.3490 -0.3490 -0.1468 -0.1468 0.0537 0.0537 0.6243 0.6243 1.1341 1.1341 1.3743 1.3743 1.7888 1.7888 5.0096 5.0096 5.8045 5.8045 6.0490 6.0490 7.6884 7.6884 7.8833 7.8833 8.6681 8.6681 k =-0.4667-0.2840 0.0779 ( 8644 PWs) bands (ev): -19.7452 -19.7452 -19.6676 -19.6676 -17.4370 -17.4370 -17.3345 -17.3345 -10.1011 -10.1011 -9.8573 -9.8573 -9.1907 -9.1907 -9.1668 -9.1668 -8.4432 -8.4432 -8.3931 -8.3931 -6.4133 -6.4133 -5.8153 -5.8153 -5.7767 -5.7767 -5.5461 -5.5461 -5.1880 -5.1880 -4.8999 -4.8999 -4.8735 -4.8735 -4.3134 -4.3134 -3.9312 -3.9312 -3.7695 -3.7695 -3.7425 -3.7425 -0.9379 -0.9379 -0.7244 -0.7244 -0.5365 -0.5365 -0.3512 -0.3512 -0.1443 -0.1443 0.0601 0.0601 0.6258 0.6258 1.1329 1.1329 1.3717 1.3717 1.7855 1.7855 5.0190 5.0190 5.8077 5.8077 6.0517 6.0517 7.6854 7.6854 7.8908 7.8908 8.6643 8.6643 k =-0.4556-0.2772 0.0760 ( 8647 PWs) bands (ev): -19.7455 -19.7455 -19.6675 -19.6675 -17.4370 -17.4370 -17.3346 -17.3346 -10.1013 -10.1013 -9.8570 -9.8570 -9.1947 -9.1947 -9.1674 -9.1674 -8.4431 -8.4431 -8.3926 -8.3926 -6.4125 -6.4125 -5.8219 -5.8219 -5.7709 -5.7709 -5.5473 -5.5473 -5.1879 -5.1879 -4.9008 -4.9008 -4.8748 -4.8748 -4.3126 -4.3126 -3.9280 -3.9280 -3.7718 -3.7718 -3.7364 -3.7364 -0.9368 -0.9368 -0.7226 -0.7226 -0.5295 -0.5295 -0.3536 -0.3536 -0.1409 -0.1409 0.0688 0.0688 0.6279 0.6279 1.1312 1.1312 1.3681 1.3681 1.7809 1.7809 5.0321 5.0321 5.8122 5.8122 6.0553 6.0553 7.6809 7.6809 7.9015 7.9015 8.6604 8.6604 k =-0.4444-0.2705 0.0742 ( 8633 PWs) bands (ev): -19.7459 -19.7459 -19.6674 -19.6674 -17.4370 -17.4370 -17.3348 -17.3348 -10.1016 -10.1016 -9.8567 -9.8567 -9.1998 -9.1998 -9.1682 -9.1682 -8.4429 -8.4429 -8.3920 -8.3920 -6.4114 -6.4114 -5.8286 -5.8286 -5.7653 -5.7653 -5.5488 -5.5488 -5.1877 -5.1877 -4.9019 -4.9019 -4.8762 -4.8762 -4.3115 -4.3115 -3.9239 -3.9239 -3.7733 -3.7733 -3.7299 -3.7299 -0.9353 -0.9353 -0.7211 -0.7211 -0.5201 -0.5201 -0.3558 -0.3558 -0.1368 -0.1368 0.0797 0.0797 0.6305 0.6305 1.1290 1.1290 1.3635 1.3635 1.7752 1.7752 5.0489 5.0489 5.8179 5.8179 6.0598 6.0598 7.6744 7.6744 7.9155 7.9155 8.6574 8.6574 k =-0.4333-0.2637 0.0723 ( 8631 PWs) bands (ev): -19.7464 -19.7464 -19.6674 -19.6674 -17.4370 -17.4370 -17.3350 -17.3350 -10.1019 -10.1019 -9.8563 -9.8563 -9.2059 -9.2059 -9.1692 -9.1692 -8.4427 -8.4427 -8.3912 -8.3912 -6.4101 -6.4101 -5.8353 -5.8353 -5.7598 -5.7598 -5.5506 -5.5506 -5.1874 -5.1874 -4.9035 -4.9035 -4.8778 -4.8778 -4.3102 -4.3102 -3.9190 -3.9190 -3.7743 -3.7743 -3.7230 -3.7230 -0.9334 -0.9334 -0.7203 -0.7203 -0.5081 -0.5081 -0.3571 -0.3571 -0.1321 -0.1321 0.0925 0.0925 0.6336 0.6336 1.1264 1.1264 1.3580 1.3580 1.7682 1.7682 5.0692 5.0692 5.8246 5.8246 6.0651 6.0651 7.6656 7.6656 7.9328 7.9328 8.6562 8.6562 k =-0.4222-0.2569 0.0705 ( 8631 PWs) bands (ev): -19.7470 -19.7470 -19.6673 -19.6673 -17.4370 -17.4370 -17.3352 -17.3352 -10.1022 -10.1022 -9.8558 -9.8558 -9.2130 -9.2130 -9.1704 -9.1704 -8.4425 -8.4425 -8.3903 -8.3903 -6.4085 -6.4085 -5.8421 -5.8421 -5.7546 -5.7546 -5.5528 -5.5528 -5.1872 -5.1872 -4.9056 -4.9056 -4.8795 -4.8795 -4.3086 -4.3086 -3.9134 -3.9134 -3.7746 -3.7746 -3.7159 -3.7159 -0.9312 -0.9312 -0.7207 -0.7207 -0.4934 -0.4934 -0.3572 -0.3572 -0.1267 -0.1267 0.1070 0.1070 0.6373 0.6373 1.1234 1.1234 1.3517 1.3517 1.7600 1.7600 5.0928 5.0928 5.8323 5.8323 6.0711 6.0711 7.6543 7.6543 7.9534 7.9534 8.6574 8.6574 k =-0.4111-0.2502 0.0686 ( 8621 PWs) bands (ev): -19.7476 -19.7476 -19.6672 -19.6672 -17.4370 -17.4370 -17.3355 -17.3355 -10.1026 -10.1026 -9.8553 -9.8553 -9.2210 -9.2210 -9.1718 -9.1718 -8.4422 -8.4422 -8.3892 -8.3892 -6.4068 -6.4068 -5.8489 -5.8489 -5.7495 -5.7495 -5.5552 -5.5552 -5.1869 -5.1869 -4.9082 -4.9082 -4.8810 -4.8810 -4.3068 -4.3068 -3.9070 -3.9070 -3.7742 -3.7742 -3.7086 -3.7086 -0.9286 -0.9286 -0.7224 -0.7224 -0.4764 -0.4764 -0.3553 -0.3553 -0.1208 -0.1208 0.1231 0.1231 0.6414 0.6414 1.1201 1.1201 1.3446 1.3446 1.7508 1.7508 5.1198 5.1198 5.8408 5.8408 6.0776 6.0776 7.6403 7.6403 7.9773 7.9773 8.6615 8.6615 k =-0.4000-0.2434 0.0668 ( 8619 PWs) bands (ev): -19.7483 -19.7483 -19.6671 -19.6671 -17.4370 -17.4370 -17.3358 -17.3358 -10.1031 -10.1031 -9.8547 -9.8547 -9.2299 -9.2299 -9.1734 -9.1734 -8.4418 -8.4418 -8.3881 -8.3881 -6.4048 -6.4048 -5.8557 -5.8557 -5.7447 -5.7447 -5.5580 -5.5580 -5.1866 -5.1866 -4.9115 -4.9115 -4.8824 -4.8824 -4.3047 -4.3047 -3.9000 -3.9000 -3.7731 -3.7731 -3.7011 -3.7011 -0.9258 -0.9258 -0.7252 -0.7252 -0.4575 -0.4575 -0.3509 -0.3509 -0.1142 -0.1142 0.1406 0.1406 0.6459 0.6459 1.1166 1.1166 1.3367 1.3367 1.7406 1.7406 5.1499 5.1499 5.8500 5.8500 6.0845 6.0845 7.6235 7.6235 8.0044 8.0044 8.6687 8.6687 k =-0.3889-0.2367 0.0649 ( 8611 PWs) bands (ev): -19.7491 -19.7491 -19.6670 -19.6670 -17.4370 -17.4370 -17.3362 -17.3362 -10.1035 -10.1035 -9.8540 -9.8540 -9.2396 -9.2396 -9.1752 -9.1752 -8.4415 -8.4415 -8.3868 -8.3868 -6.4025 -6.4025 -5.8625 -5.8625 -5.7401 -5.7401 -5.5610 -5.5610 -5.1862 -5.1862 -4.9153 -4.9153 -4.8836 -4.8836 -4.3023 -4.3023 -3.8924 -3.8924 -3.7715 -3.7715 -3.6936 -3.6936 -0.9230 -0.9230 -0.7290 -0.7290 -0.4377 -0.4377 -0.3431 -0.3431 -0.1070 -0.1070 0.1593 0.1593 0.6508 0.6508 1.1128 1.1128 1.3282 1.3282 1.7296 1.7296 5.1828 5.1828 5.8597 5.8597 6.0917 6.0917 7.6039 7.6039 8.0345 8.0345 8.6786 8.6786 k =-0.3778-0.2299 0.0630 ( 8609 PWs) bands (ev): -19.7499 -19.7499 -19.6669 -19.6669 -17.4370 -17.4370 -17.3365 -17.3365 -10.1040 -10.1040 -9.8533 -9.8533 -9.2501 -9.2501 -9.1771 -9.1771 -8.4411 -8.4411 -8.3855 -8.3855 -6.4001 -6.4001 -5.8693 -5.8693 -5.7357 -5.7357 -5.5643 -5.5643 -5.1859 -5.1859 -4.9197 -4.9197 -4.8847 -4.8847 -4.2997 -4.2997 -3.8842 -3.8842 -3.7692 -3.7692 -3.6860 -3.6860 -0.9202 -0.9202 -0.7334 -0.7334 -0.4184 -0.4184 -0.3308 -0.3308 -0.0992 -0.0992 0.1792 0.1792 0.6562 0.6562 1.1089 1.1089 1.3192 1.3192 1.7176 1.7176 5.2184 5.2184 5.8699 5.8699 6.0991 6.0991 7.5816 7.5816 8.0672 8.0672 8.6901 8.6901 k =-0.3667-0.2231 0.0612 ( 8613 PWs) bands (ev): -19.7508 -19.7508 -19.6667 -19.6667 -17.4370 -17.4370 -17.3369 -17.3369 -10.1045 -10.1045 -9.8526 -9.8526 -9.2614 -9.2614 -9.1792 -9.1792 -8.4407 -8.4407 -8.3841 -8.3841 -6.3975 -6.3975 -5.8760 -5.8760 -5.7316 -5.7316 -5.5679 -5.5679 -5.1855 -5.1855 -4.9247 -4.9247 -4.8856 -4.8856 -4.2968 -4.2968 -3.8756 -3.8756 -3.7664 -3.7664 -3.6785 -3.6785 -0.9179 -0.9179 -0.7377 -0.7377 -0.4010 -0.4010 -0.3131 -0.3131 -0.0906 -0.0906 0.2002 0.2002 0.6621 0.6621 1.1049 1.1049 1.3097 1.3097 1.7050 1.7050 5.2563 5.2563 5.8802 5.8802 6.1065 6.1065 7.5570 7.5570 8.1023 8.1023 8.7011 8.7011 k =-0.3556-0.2164 0.0593 ( 8604 PWs) bands (ev): -19.7517 -19.7517 -19.6666 -19.6666 -17.4370 -17.4370 -17.3374 -17.3374 -10.1050 -10.1050 -9.8519 -9.8519 -9.2732 -9.2732 -9.1815 -9.1815 -8.4402 -8.4402 -8.3826 -8.3826 -6.3946 -6.3946 -5.8827 -5.8827 -5.7277 -5.7277 -5.5717 -5.5717 -5.1851 -5.1851 -4.9300 -4.9300 -4.8863 -4.8863 -4.2936 -4.2936 -3.8665 -3.8665 -3.7630 -3.7630 -3.6711 -3.6711 -0.9164 -0.9164 -0.7414 -0.7414 -0.3863 -0.3863 -0.2898 -0.2898 -0.0811 -0.0811 0.2222 0.2222 0.6685 0.6685 1.1009 1.1009 1.2999 1.2999 1.6918 1.6918 5.2962 5.2962 5.8905 5.8905 6.1137 6.1137 7.5303 7.5303 8.1392 8.1392 8.7077 8.7077 k =-0.3444-0.2096 0.0575 ( 8608 PWs) bands (ev): -19.7527 -19.7527 -19.6665 -19.6665 -17.4370 -17.4370 -17.3378 -17.3378 -10.1055 -10.1055 -9.8511 -9.8511 -9.2857 -9.2857 -9.1839 -9.1839 -8.4397 -8.4397 -8.3810 -8.3810 -6.3916 -6.3916 -5.8894 -5.8894 -5.7241 -5.7241 -5.5758 -5.5758 -5.1846 -5.1846 -4.9357 -4.9357 -4.8870 -4.8870 -4.2901 -4.2901 -3.8572 -3.8572 -3.7591 -3.7591 -3.6639 -3.6639 -0.9160 -0.9160 -0.7437 -0.7437 -0.3737 -0.3737 -0.2620 -0.2620 -0.0707 -0.0707 0.2450 0.2450 0.6757 0.6757 1.0971 1.0971 1.2898 1.2898 1.6781 1.6781 5.3377 5.3377 5.9006 5.9006 6.1208 6.1208 7.5020 7.5020 8.1775 8.1775 8.7058 8.7058 k =-0.3333-0.2029 0.0556 ( 8609 PWs) bands (ev): -19.7537 -19.7537 -19.6664 -19.6664 -17.4370 -17.4370 -17.3383 -17.3383 -10.1060 -10.1060 -9.8503 -9.8503 -9.2986 -9.2986 -9.1864 -9.1864 -8.4393 -8.4393 -8.3794 -8.3794 -6.3883 -6.3883 -5.8960 -5.8960 -5.7207 -5.7207 -5.5800 -5.5800 -5.1842 -5.1842 -4.9417 -4.9417 -4.8875 -4.8875 -4.2864 -4.2864 -3.8475 -3.8475 -3.7548 -3.7548 -3.6569 -3.6569 -0.9172 -0.9172 -0.7440 -0.7440 -0.3626 -0.3626 -0.2312 -0.2312 -0.0591 -0.0591 0.2686 0.2686 0.6837 0.6837 1.0934 1.0934 1.2796 1.2796 1.6640 1.6640 5.3802 5.3802 5.9103 5.9103 6.1275 6.1275 7.4726 7.4726 8.2162 8.2162 8.6952 8.6952 k =-0.3222-0.1961 0.0538 ( 8617 PWs) bands (ev): -19.7548 -19.7548 -19.6663 -19.6663 -17.4370 -17.4370 -17.3388 -17.3388 -10.1064 -10.1064 -9.8495 -9.8495 -9.3120 -9.3120 -9.1891 -9.1891 -8.4388 -8.4388 -8.3777 -8.3777 -6.3849 -6.3849 -5.9026 -5.9026 -5.7177 -5.7177 -5.5844 -5.5844 -5.1837 -5.1837 -4.9480 -4.9480 -4.8880 -4.8880 -4.2825 -4.2825 -3.8376 -3.8376 -3.7501 -3.7501 -3.6501 -3.6501 -0.9201 -0.9201 -0.7420 -0.7420 -0.3524 -0.3524 -0.1987 -0.1987 -0.0461 -0.0461 0.2927 0.2927 0.6928 0.6928 1.0901 1.0901 1.2695 1.2695 1.6497 1.6497 5.4232 5.4232 5.9194 5.9194 6.1338 6.1338 7.4427 7.4427 8.2545 8.2545 8.6803 8.6803 k =-0.3111-0.1893 0.0519 ( 8619 PWs) bands (ev): -19.7558 -19.7558 -19.6662 -19.6662 -17.4370 -17.4370 -17.3393 -17.3393 -10.1069 -10.1069 -9.8486 -9.8486 -9.3258 -9.3258 -9.1919 -9.1919 -8.4383 -8.4383 -8.3760 -8.3760 -6.3813 -6.3813 -5.9090 -5.9090 -5.7149 -5.7149 -5.5889 -5.5889 -5.1833 -5.1833 -4.9545 -4.9545 -4.8884 -4.8884 -4.2783 -4.2783 -3.8274 -3.8274 -3.7450 -3.7450 -3.6435 -3.6435 -0.9249 -0.9249 -0.7375 -0.7375 -0.3429 -0.3429 -0.1657 -0.1657 -0.0313 -0.0313 0.3171 0.3171 0.7032 0.7032 1.0872 1.0872 1.2596 1.2596 1.6354 1.6354 5.4661 5.4661 5.9277 5.9277 6.1395 6.1395 7.4131 7.4131 8.2912 8.2912 8.6653 8.6653 k =-0.3000-0.1826 0.0501 ( 8627 PWs) bands (ev): -19.7570 -19.7570 -19.6661 -19.6661 -17.4370 -17.4370 -17.3399 -17.3399 -10.1073 -10.1073 -9.8478 -9.8478 -9.3398 -9.3398 -9.1948 -9.1948 -8.4378 -8.4378 -8.3743 -8.3743 -6.3775 -6.3775 -5.9155 -5.9155 -5.7124 -5.7124 -5.5935 -5.5935 -5.1828 -5.1828 -4.9611 -4.9611 -4.8888 -4.8888 -4.2739 -4.2739 -3.8172 -3.8172 -3.7398 -3.7398 -3.6373 -3.6373 -0.9312 -0.9312 -0.7304 -0.7304 -0.3339 -0.3339 -0.1332 -0.1332 -0.0145 -0.0145 0.3414 0.3414 0.7154 0.7154 1.0848 1.0848 1.2502 1.2502 1.6211 1.6211 5.5081 5.5081 5.9351 5.9351 6.1447 6.1447 7.3844 7.3844 8.3248 8.3248 8.6533 8.6533 k =-0.2889-0.1758 0.0482 ( 8633 PWs) bands (ev): -19.7581 -19.7581 -19.6660 -19.6660 -17.4370 -17.4370 -17.3404 -17.3404 -10.1076 -10.1076 -9.8469 -9.8469 -9.3541 -9.3541 -9.1977 -9.1977 -8.4373 -8.4373 -8.3725 -8.3725 -6.3735 -6.3735 -5.9218 -5.9218 -5.7102 -5.7102 -5.5982 -5.5982 -5.1823 -5.1823 -4.9678 -4.9678 -4.8891 -4.8891 -4.2694 -4.2694 -3.8069 -3.8069 -3.7344 -3.7344 -3.6313 -3.6313 -0.9390 -0.9390 -0.7211 -0.7211 -0.3254 -0.3254 -0.1024 -0.1024 0.0050 0.0050 0.3652 0.3652 0.7295 0.7295 1.0830 1.0830 1.2414 1.2414 1.6071 1.6071 5.5482 5.5482 5.9413 5.9413 6.1493 6.1493 7.3577 7.3577 8.3539 8.3539 8.6460 8.6460 k =-0.2778-0.1690 0.0464 ( 8638 PWs) bands (ev): -19.7592 -19.7592 -19.6659 -19.6659 -17.4370 -17.4370 -17.3410 -17.3410 -10.1079 -10.1079 -9.8461 -9.8461 -9.3684 -9.3684 -9.2008 -9.2008 -8.4368 -8.4368 -8.3707 -8.3707 -6.3694 -6.3694 -5.9281 -5.9281 -5.7084 -5.7084 -5.6028 -5.6028 -5.1818 -5.1818 -4.9745 -4.9745 -4.8894 -4.8894 -4.2646 -4.2646 -3.7965 -3.7965 -3.7290 -3.7290 -3.6255 -3.6255 -0.9477 -0.9477 -0.7097 -0.7097 -0.3175 -0.3175 -0.0741 -0.0741 0.0275 0.0275 0.3880 0.3880 0.7459 0.7459 1.0820 1.0820 1.2336 1.2336 1.5936 1.5936 5.5855 5.5855 5.9462 5.9462 6.1531 6.1531 7.3339 7.3339 8.3772 8.3772 8.6439 8.6439 k =-0.2667-0.1623 0.0445 ( 8634 PWs) bands (ev): -19.7604 -19.7604 -19.6658 -19.6658 -17.4370 -17.4370 -17.3415 -17.3415 -10.1082 -10.1082 -9.8452 -9.8452 -9.3829 -9.3829 -9.2039 -9.2039 -8.4363 -8.4363 -8.3689 -8.3689 -6.3651 -6.3651 -5.9343 -5.9343 -5.7069 -5.7069 -5.6074 -5.6074 -5.1812 -5.1812 -4.9812 -4.9812 -4.8897 -4.8897 -4.2597 -4.2597 -3.7861 -3.7861 -3.7236 -3.7236 -3.6200 -3.6200 -0.9571 -0.9571 -0.6967 -0.6967 -0.3101 -0.3101 -0.0487 -0.0487 0.0530 0.0530 0.4093 0.4093 0.7648 0.7648 1.0820 1.0820 1.2271 1.2271 1.5809 1.5809 5.6187 5.6187 5.9498 5.9498 6.1563 6.1563 7.3142 7.3142 8.3944 8.3944 8.6457 8.6457 k =-0.2556-0.1555 0.0427 ( 8632 PWs) bands (ev): -19.7615 -19.7615 -19.6657 -19.6657 -17.4370 -17.4370 -17.3421 -17.3421 -10.1085 -10.1085 -9.8444 -9.8444 -9.3973 -9.3973 -9.2070 -9.2070 -8.4358 -8.4358 -8.3671 -8.3671 -6.3606 -6.3606 -5.9405 -5.9405 -5.7057 -5.7057 -5.6119 -5.6119 -5.1807 -5.1807 -4.9879 -4.9879 -4.8899 -4.8899 -4.2546 -4.2546 -3.7759 -3.7759 -3.7182 -3.7182 -3.6147 -3.6147 -0.9670 -0.9670 -0.6824 -0.6824 -0.3035 -0.3035 -0.0260 -0.0260 0.0809 0.0809 0.4288 0.4288 0.7859 0.7859 1.0830 1.0830 1.2223 1.2223 1.5692 1.5692 5.6467 5.6467 5.9522 5.9522 6.1587 6.1587 7.2997 7.2997 8.4061 8.4061 8.6483 8.6483 k =-0.2444-0.1488 0.0408 ( 8635 PWs) bands (ev): -19.7627 -19.7627 -19.6657 -19.6657 -17.4370 -17.4370 -17.3427 -17.3427 -10.1086 -10.1086 -9.8436 -9.8436 -9.4117 -9.4117 -9.2102 -9.2102 -8.4354 -8.4354 -8.3653 -8.3653 -6.3560 -6.3560 -5.9465 -5.9465 -5.7050 -5.7050 -5.6161 -5.6161 -5.1802 -5.1802 -4.9945 -4.9945 -4.8901 -4.8901 -4.2495 -4.2495 -3.7657 -3.7657 -3.7131 -3.7131 -3.6096 -3.6096 -0.9770 -0.9770 -0.6669 -0.6669 -0.2977 -0.2977 -0.0054 -0.0054 0.1103 0.1103 0.4461 0.4461 0.8088 0.8088 1.0851 1.0851 1.2197 1.2197 1.5591 1.5591 5.6680 5.6680 5.9536 5.9536 6.1603 6.1603 7.2913 7.2913 8.4135 8.4135 8.6455 8.6455 k =-0.2333-0.1420 0.0389 ( 8632 PWs) bands (ev): -19.7638 -19.7638 -19.6656 -19.6656 -17.4370 -17.4370 -17.3433 -17.3433 -10.1088 -10.1088 -9.8428 -9.8428 -9.4260 -9.4260 -9.2134 -9.2134 -8.4350 -8.4350 -8.3635 -8.3635 -6.3513 -6.3513 -5.9526 -5.9526 -5.7046 -5.7046 -5.6202 -5.6202 -5.1797 -5.1797 -5.0010 -5.0010 -4.8902 -4.8902 -4.2442 -4.2442 -3.7559 -3.7559 -3.7080 -3.7080 -3.6046 -3.6046 -0.9870 -0.9870 -0.6507 -0.6507 -0.2926 -0.2926 0.0136 0.0136 0.1401 0.1401 0.4612 0.4612 0.8326 0.8326 1.0885 1.0885 1.2198 1.2198 1.5509 1.5509 5.6813 5.6813 5.9543 5.9543 6.1613 6.1613 7.2898 7.2898 8.4176 8.4176 8.6291 8.6291 k =-0.2222-0.1352 0.0371 ( 8628 PWs) bands (ev): -19.7649 -19.7649 -19.6655 -19.6655 -17.4369 -17.4369 -17.3438 -17.3438 -10.1089 -10.1089 -9.8419 -9.8419 -9.4400 -9.4400 -9.2166 -9.2166 -8.4346 -8.4346 -8.3618 -8.3618 -6.3464 -6.3464 -5.9585 -5.9585 -5.7047 -5.7047 -5.6240 -5.6240 -5.1792 -5.1792 -5.0074 -5.0074 -4.8903 -4.8903 -4.2389 -4.2389 -3.7465 -3.7465 -3.7030 -3.7030 -3.5997 -3.5997 -0.9968 -0.9968 -0.6338 -0.6338 -0.2883 -0.2883 0.0315 0.0315 0.1696 0.1696 0.4743 0.4743 0.8562 0.8562 1.0935 1.0935 1.2229 1.2229 1.5454 1.5454 5.6855 5.6855 5.9549 5.9549 6.1615 6.1615 7.2959 7.2959 8.4189 8.4189 8.5992 8.5992 k =-0.2111-0.1285 0.0352 ( 8630 PWs) bands (ev): -19.7660 -19.7660 -19.6655 -19.6655 -17.4369 -17.4369 -17.3444 -17.3444 -10.1089 -10.1089 -9.8412 -9.8412 -9.4538 -9.4538 -9.2198 -9.2198 -8.4342 -8.4342 -8.3600 -8.3600 -6.3415 -6.3415 -5.9644 -5.9644 -5.7052 -5.7052 -5.6275 -5.6275 -5.1787 -5.1787 -5.0136 -5.0136 -4.8904 -4.8904 -4.2336 -4.2336 -3.7379 -3.7379 -3.6979 -3.6979 -3.5949 -3.5949 -1.0064 -1.0064 -0.6164 -0.6164 -0.2848 -0.2848 0.0485 0.0485 0.1981 0.1981 0.4856 0.4856 0.8782 0.8782 1.1001 1.1001 1.2291 1.2291 1.5436 1.5436 5.6798 5.6798 5.9558 5.9558 6.1610 6.1610 7.3096 7.3096 8.4162 8.4162 8.5661 8.5661 k =-0.2000-0.1217 0.0334 ( 8629 PWs) bands (ev): -19.7671 -19.7671 -19.6654 -19.6654 -17.4369 -17.4369 -17.3449 -17.3449 -10.1089 -10.1089 -9.8404 -9.8404 -9.4672 -9.4672 -9.2230 -9.2230 -8.4339 -8.4339 -8.3584 -8.3584 -6.3364 -6.3364 -5.9702 -5.9702 -5.7061 -5.7061 -5.6306 -5.6306 -5.1782 -5.1782 -5.0196 -5.0196 -4.8905 -4.8905 -4.2282 -4.2282 -3.7302 -3.7302 -3.6925 -3.6925 -3.5902 -3.5902 -1.0157 -1.0157 -0.5988 -0.5988 -0.2821 -0.2821 0.0649 0.0649 0.2250 0.2250 0.4953 0.4953 0.8976 0.8976 1.1089 1.1089 1.2377 1.2377 1.5464 1.5464 5.6643 5.6643 5.9572 5.9572 6.1599 6.1599 7.3305 7.3305 8.4062 8.4062 8.5380 8.5380 k =-0.1889-0.1150 0.0315 ( 8622 PWs) bands (ev): -19.7681 -19.7681 -19.6654 -19.6654 -17.4369 -17.4369 -17.3455 -17.3455 -10.1089 -10.1089 -9.8396 -9.8396 -9.4803 -9.4803 -9.2261 -9.2261 -8.4336 -8.4336 -8.3567 -8.3567 -6.3313 -6.3313 -5.9759 -5.9759 -5.7074 -5.7074 -5.6333 -5.6333 -5.1777 -5.1777 -5.0255 -5.0255 -4.8905 -4.8905 -4.2229 -4.2229 -3.7239 -3.7239 -3.6864 -3.6864 -3.5856 -3.5856 -1.0246 -1.0246 -0.5811 -0.5811 -0.2801 -0.2801 0.0806 0.0806 0.2501 0.2501 0.5036 0.5036 0.9133 0.9133 1.1201 1.1201 1.2476 1.2476 1.5552 1.5552 5.6395 5.6395 5.9589 5.9589 6.1582 6.1582 7.3577 7.3577 8.3848 8.3848 8.5199 8.5199 k =-0.1778-0.1082 0.0297 ( 8622 PWs) bands (ev): -19.7691 -19.7691 -19.6654 -19.6654 -17.4369 -17.4369 -17.3460 -17.3460 -10.1088 -10.1088 -9.8389 -9.8389 -9.4929 -9.4929 -9.2291 -9.2291 -8.4334 -8.4334 -8.3551 -8.3551 -6.3262 -6.3262 -5.9815 -5.9815 -5.7091 -5.7091 -5.6357 -5.6357 -5.1772 -5.1772 -5.0311 -5.0311 -4.8905 -4.8905 -4.2176 -4.2176 -3.7192 -3.7192 -3.6794 -3.6794 -3.5811 -3.5811 -1.0330 -1.0330 -0.5635 -0.5635 -0.2789 -0.2789 0.0957 0.0957 0.2730 0.2730 0.5109 0.5109 0.9253 0.9253 1.1342 1.1342 1.2573 1.2573 1.5711 1.5711 5.6067 5.6067 5.9607 5.9607 6.1561 6.1561 7.3901 7.3901 8.3508 8.3508 8.5072 8.5072 k =-0.1667-0.1014 0.0278 ( 8623 PWs) bands (ev): -19.7701 -19.7701 -19.6653 -19.6653 -17.4369 -17.4369 -17.3465 -17.3465 -10.1087 -10.1087 -9.8382 -9.8382 -9.5050 -9.5050 -9.2321 -9.2321 -8.4332 -8.4332 -8.3536 -8.3536 -6.3210 -6.3210 -5.9871 -5.9871 -5.7111 -5.7111 -5.6378 -5.6378 -5.1768 -5.1768 -5.0365 -5.0365 -4.8905 -4.8905 -4.2124 -4.2124 -3.7161 -3.7161 -3.6717 -3.6717 -3.5768 -3.5768 -1.0410 -1.0410 -0.5459 -0.5459 -0.2784 -0.2784 0.1100 0.1100 0.2936 0.2936 0.5172 0.5172 0.9335 0.9335 1.1511 1.1511 1.2656 1.2656 1.5943 1.5943 5.5671 5.5671 5.9622 5.9622 6.1535 6.1535 7.4260 7.4260 8.3061 8.3061 8.4711 8.4711 k =-0.1556-0.0947 0.0260 ( 8625 PWs) bands (ev): -19.7710 -19.7710 -19.6653 -19.6653 -17.4368 -17.4368 -17.3470 -17.3470 -10.1085 -10.1085 -9.8375 -9.8375 -9.5166 -9.5166 -9.2349 -9.2349 -8.4330 -8.4330 -8.3521 -8.3521 -6.3158 -6.3158 -5.9926 -5.9926 -5.7133 -5.7133 -5.6395 -5.6395 -5.1763 -5.1763 -5.0416 -5.0416 -4.8905 -4.8905 -4.2073 -4.2073 -3.7142 -3.7142 -3.6633 -3.6633 -3.5726 -3.5726 -1.0485 -1.0485 -0.5287 -0.5287 -0.2787 -0.2787 0.1236 0.1236 0.3120 0.3120 0.5225 0.5225 0.9387 0.9387 1.1704 1.1704 1.2721 1.2721 1.6247 1.6247 5.5221 5.5221 5.9634 5.9634 6.1506 6.1506 7.4635 7.4635 8.2515 8.2515 8.4167 8.4167 k =-0.1444-0.0879 0.0241 ( 8626 PWs) bands (ev): -19.7719 -19.7719 -19.6653 -19.6653 -17.4368 -17.4368 -17.3475 -17.3475 -10.1084 -10.1084 -9.8369 -9.8369 -9.5276 -9.5276 -9.2377 -9.2377 -8.4328 -8.4328 -8.3507 -8.3507 -6.3107 -6.3107 -5.9979 -5.9979 -5.7157 -5.7157 -5.6409 -5.6409 -5.1759 -5.1759 -5.0464 -5.0464 -4.8905 -4.8905 -4.2023 -4.2023 -3.7134 -3.7134 -3.6546 -3.6546 -3.5688 -3.5688 -1.0555 -1.0555 -0.5117 -0.5117 -0.2795 -0.2795 0.1364 0.1364 0.3282 0.3282 0.5269 0.5269 0.9414 0.9414 1.1911 1.1911 1.2775 1.2775 1.6610 1.6610 5.4733 5.4733 5.9641 5.9641 6.1475 6.1475 7.5009 7.5009 8.1871 8.1871 8.3631 8.3631 k =-0.1333-0.0811 0.0223 ( 8626 PWs) bands (ev): -19.7727 -19.7727 -19.6653 -19.6653 -17.4368 -17.4368 -17.3479 -17.3479 -10.1082 -10.1082 -9.8363 -9.8363 -9.5380 -9.5380 -9.2403 -9.2403 -8.4327 -8.4327 -8.3494 -8.3494 -6.3056 -6.3056 -6.0031 -6.0031 -5.7182 -5.7182 -5.6421 -5.6421 -5.1755 -5.1755 -5.0510 -5.0510 -4.8904 -4.8904 -4.1976 -4.1976 -3.7134 -3.7134 -3.6458 -3.6458 -3.5652 -3.5652 -1.0620 -1.0620 -0.4953 -0.4953 -0.2810 -0.2810 0.1483 0.1483 0.3425 0.3425 0.5303 0.5303 0.9424 0.9424 1.2109 1.2109 1.2839 1.2839 1.7017 1.7017 5.4219 5.4219 5.9643 5.9643 6.1443 6.1443 7.5362 7.5362 8.1146 8.1146 8.3144 8.3144 k =-0.1222-0.0744 0.0204 ( 8631 PWs) bands (ev): -19.7735 -19.7735 -19.6653 -19.6653 -17.4368 -17.4368 -17.3483 -17.3483 -10.1080 -10.1080 -9.8357 -9.8357 -9.5477 -9.5477 -9.2428 -9.2428 -8.4326 -8.4326 -8.3481 -8.3481 -6.3006 -6.3006 -6.0082 -6.0082 -5.7207 -5.7207 -5.6431 -5.6431 -5.1752 -5.1752 -5.0552 -5.0552 -4.8903 -4.8903 -4.1930 -4.1930 -3.7140 -3.7140 -3.6370 -3.6370 -3.5620 -3.5620 -1.0679 -1.0679 -0.4793 -0.4793 -0.2831 -0.2831 0.1593 0.1593 0.3551 0.3551 0.5327 0.5327 0.9422 0.9422 1.2261 1.2261 1.2950 1.2950 1.7452 1.7452 5.3691 5.3691 5.9641 5.9641 6.1410 6.1410 7.5678 7.5678 8.0375 8.0375 8.2710 8.2710 k =-0.1111-0.0676 0.0185 ( 8638 PWs) bands (ev): -19.7742 -19.7742 -19.6653 -19.6653 -17.4368 -17.4368 -17.3487 -17.3487 -10.1078 -10.1078 -9.8351 -9.8351 -9.5567 -9.5567 -9.2451 -9.2451 -8.4325 -8.4325 -8.3470 -8.3470 -6.2958 -6.2958 -6.0130 -6.0130 -5.7233 -5.7233 -5.6438 -5.6438 -5.1749 -5.1749 -5.0591 -5.0591 -4.8903 -4.8903 -4.1887 -4.1887 -3.7150 -3.7150 -3.6283 -3.6283 -3.5592 -3.5592 -1.0734 -1.0734 -0.4639 -0.4639 -0.2857 -0.2857 0.1693 0.1693 0.3662 0.3662 0.5342 0.5342 0.9412 0.9412 1.2339 1.2339 1.3137 1.3137 1.7898 1.7898 5.3162 5.3162 5.9633 5.9633 6.1377 6.1377 7.5945 7.5945 7.9594 7.9594 8.2318 8.2318 k =-0.1000-0.0609 0.0167 ( 8642 PWs) bands (ev): -19.7749 -19.7749 -19.6653 -19.6653 -17.4367 -17.4367 -17.3491 -17.3491 -10.1076 -10.1076 -9.8346 -9.8346 -9.5650 -9.5650 -9.2473 -9.2473 -8.4324 -8.4324 -8.3459 -8.3459 -6.2912 -6.2912 -6.0176 -6.0176 -5.7257 -5.7257 -5.6445 -5.6445 -5.1745 -5.1745 -5.0627 -5.0627 -4.8902 -4.8902 -4.1846 -4.1846 -3.7163 -3.7163 -3.6199 -3.6199 -3.5569 -3.5569 -1.0783 -1.0783 -0.4492 -0.4492 -0.2888 -0.2888 0.1783 0.1783 0.3761 0.3761 0.5347 0.5347 0.9398 0.9398 1.2356 1.2356 1.3383 1.3383 1.8341 1.8341 5.2643 5.2643 5.9623 5.9623 6.1346 6.1346 7.6152 7.6152 7.8836 7.8836 8.1963 8.1963 k =-0.0889-0.0541 0.0148 ( 8648 PWs) bands (ev): -19.7755 -19.7755 -19.6653 -19.6653 -17.4367 -17.4367 -17.3494 -17.3494 -10.1074 -10.1074 -9.8341 -9.8341 -9.5724 -9.5724 -9.2492 -9.2492 -8.4324 -8.4324 -8.3449 -8.3449 -6.2869 -6.2869 -6.0220 -6.0220 -5.7280 -5.7280 -5.6450 -5.6450 -5.1743 -5.1743 -5.0659 -5.0659 -4.8901 -4.8901 -4.1809 -4.1809 -3.7178 -3.7178 -3.6118 -3.6118 -3.5551 -3.5551 -1.0827 -1.0827 -0.4351 -0.4351 -0.2924 -0.2924 0.1862 0.1862 0.3851 0.3851 0.5343 0.5343 0.9382 0.9382 1.2342 1.2342 1.3655 1.3655 1.8770 1.8770 5.2145 5.2145 5.9609 5.9609 6.1317 6.1317 7.6291 7.6291 7.8130 7.8130 8.1642 8.1642 k =-0.0778-0.0473 0.0130 ( 8645 PWs) bands (ev): -19.7760 -19.7760 -19.6653 -19.6653 -17.4367 -17.4367 -17.3497 -17.3497 -10.1072 -10.1072 -9.8337 -9.8337 -9.5791 -9.5791 -9.2510 -9.2510 -8.4324 -8.4324 -8.3440 -8.3440 -6.2828 -6.2828 -6.0260 -6.0260 -5.7301 -5.7301 -5.6454 -5.6454 -5.1740 -5.1740 -5.0687 -5.0687 -4.8900 -4.8900 -4.1775 -4.1775 -3.7193 -3.7193 -3.6041 -3.6041 -3.5539 -3.5539 -1.0865 -1.0865 -0.4217 -0.4217 -0.2965 -0.2965 0.1931 0.1931 0.3932 0.3932 0.5331 0.5331 0.9366 0.9366 1.2313 1.2313 1.3931 1.3931 1.9174 1.9174 5.1677 5.1677 5.9594 5.9594 6.1291 6.1291 7.6342 7.6342 7.7519 7.7519 8.1354 8.1354 k =-0.0667-0.0406 0.0111 ( 8649 PWs) bands (ev): -19.7765 -19.7765 -19.6653 -19.6653 -17.4367 -17.4367 -17.3500 -17.3500 -10.1070 -10.1070 -9.8333 -9.8333 -9.5850 -9.5850 -9.2525 -9.2525 -8.4323 -8.4323 -8.3433 -8.3433 -6.2791 -6.2791 -6.0296 -6.0296 -5.7320 -5.7320 -5.6457 -5.6457 -5.1738 -5.1738 -5.0712 -5.0712 -4.8899 -4.8899 -4.1745 -4.1745 -3.7208 -3.7208 -3.5969 -3.5969 -3.5532 -3.5532 -1.0899 -1.0899 -0.4092 -0.4092 -0.3011 -0.3011 0.1990 0.1990 0.4006 0.4006 0.5314 0.5314 0.9351 0.9351 1.2279 1.2279 1.4196 1.4196 1.9544 1.9544 5.1249 5.1249 5.9578 5.9578 6.1267 6.1267 7.6239 7.6239 7.7087 7.7087 8.1100 8.1100 k =-0.0556-0.0338 0.0093 ( 8639 PWs) bands (ev): -19.7769 -19.7769 -19.6653 -19.6653 -17.4367 -17.4367 -17.3502 -17.3502 -10.1068 -10.1068 -9.8330 -9.8330 -9.5899 -9.5899 -9.2539 -9.2539 -8.4323 -8.4323 -8.3426 -8.3426 -6.2759 -6.2759 -6.0328 -6.0328 -5.7336 -5.7336 -5.6459 -5.6459 -5.1736 -5.1736 -5.0733 -5.0733 -4.8898 -4.8898 -4.1719 -4.1719 -3.7222 -3.7222 -3.5901 -3.5901 -3.5531 -3.5531 -1.0927 -1.0927 -0.3974 -0.3974 -0.3060 -0.3060 0.2039 0.2039 0.4072 0.4072 0.5293 0.5293 0.9338 0.9338 1.2244 1.2244 1.4439 1.4439 1.9871 1.9871 5.0871 5.0871 5.9563 5.9563 6.1247 6.1247 7.5938 7.5938 7.6900 7.6900 8.0883 8.0883 k =-0.0444-0.0270 0.0074 ( 8640 PWs) bands (ev): -19.7772 -19.7772 -19.6653 -19.6653 -17.4367 -17.4367 -17.3504 -17.3504 -10.1067 -10.1067 -9.8327 -9.8327 -9.5940 -9.5940 -9.2550 -9.2550 -8.4323 -8.4323 -8.3421 -8.3421 -6.2731 -6.2731 -6.0355 -6.0355 -5.7350 -5.7350 -5.6461 -5.6461 -5.1735 -5.1735 -5.0750 -5.0750 -4.8897 -4.8897 -4.1697 -4.1697 -3.7234 -3.7234 -3.5840 -3.5840 -3.5536 -3.5536 -1.0950 -1.0950 -0.3866 -0.3866 -0.3113 -0.3113 0.2078 0.2078 0.4130 0.4130 0.5270 0.5270 0.9326 0.9326 1.2213 1.2213 1.4651 1.4651 2.0148 2.0148 5.0549 5.0549 5.9548 5.9548 6.1230 6.1230 7.5571 7.5571 7.6841 7.6841 8.0702 8.0702 k =-0.0333-0.0203 0.0056 ( 8638 PWs) bands (ev): -19.7775 -19.7775 -19.6653 -19.6653 -17.4367 -17.4367 -17.3505 -17.3505 -10.1066 -10.1066 -9.8325 -9.8325 -9.5973 -9.5973 -9.2558 -9.2558 -8.4323 -8.4323 -8.3417 -8.3417 -6.2709 -6.2709 -6.0376 -6.0376 -5.7361 -5.7361 -5.6463 -5.6463 -5.1734 -5.1734 -5.0763 -5.0763 -4.8896 -4.8896 -4.1679 -4.1679 -3.7244 -3.7244 -3.5785 -3.5785 -3.5546 -3.5546 -1.0968 -1.0968 -0.3768 -0.3768 -0.3167 -0.3167 0.2108 0.2108 0.4178 0.4178 0.5248 0.5248 0.9317 0.9317 1.2187 1.2187 1.4824 1.4824 2.0370 2.0370 5.0291 5.0291 5.9536 5.9536 6.1216 6.1216 7.5248 7.5248 7.6817 7.6817 8.0561 8.0561 k =-0.0222-0.0135 0.0037 ( 8635 PWs) bands (ev): -19.7777 -19.7777 -19.6653 -19.6653 -17.4367 -17.4367 -17.3506 -17.3506 -10.1065 -10.1065 -9.8323 -9.8323 -9.5996 -9.5996 -9.2565 -9.2565 -8.4323 -8.4323 -8.3414 -8.3414 -6.2693 -6.2693 -6.0392 -6.0392 -5.7369 -5.7369 -5.6463 -5.6463 -5.1733 -5.1733 -5.0773 -5.0773 -4.8896 -4.8896 -4.1667 -4.1667 -3.7252 -3.7252 -3.5737 -3.5737 -3.5561 -3.5561 -1.0981 -1.0981 -0.3684 -0.3684 -0.3220 -0.3220 0.2129 0.2129 0.4215 0.4215 0.5230 0.5230 0.9310 0.9310 1.2167 1.2167 1.4952 1.4952 2.0533 2.0533 5.0102 5.0102 5.9527 5.9527 6.1207 6.1207 7.5005 7.5005 7.6804 7.6804 8.0459 8.0460 k =-0.0111-0.0068 0.0019 ( 8640 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6009 -9.6009 -9.2568 -9.2568 -8.4323 -8.4323 -8.3412 -8.3412 -6.2683 -6.2683 -6.0402 -6.0402 -5.7374 -5.7374 -5.6464 -5.6464 -5.1732 -5.1732 -5.0779 -5.0779 -4.8896 -4.8896 -4.1660 -4.1660 -3.7256 -3.7256 -3.5702 -3.5702 -3.5577 -3.5577 -1.0988 -1.0988 -0.3621 -0.3621 -0.3264 -0.3264 0.2141 0.2141 0.4238 0.4238 0.5217 0.5217 0.9306 0.9306 1.2155 1.2155 1.5030 1.5030 2.0631 2.0631 4.9987 4.9987 5.9521 5.9521 6.1201 6.1201 7.4855 7.4855 7.6797 7.6797 8.0398 8.0398 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 k = 0.0000 0.0000 0.0129 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8326 -9.8326 -9.6009 -9.6009 -9.2570 -9.2570 -8.4323 -8.4323 -8.3412 -8.3412 -6.2695 -6.2695 -6.0388 -6.0388 -5.7376 -5.7376 -5.6466 -5.6466 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1669 -4.1669 -3.7249 -3.7249 -3.5701 -3.5701 -3.5571 -3.5571 -1.0979 -1.0979 -0.3605 -0.3605 -0.3274 -0.3274 0.2129 0.2129 0.4217 0.4217 0.5243 0.5243 0.9311 0.9311 1.2146 1.2146 1.5054 1.5054 2.0666 2.0666 4.9968 4.9968 5.9511 5.9511 6.1208 6.1208 7.4782 7.4782 7.6809 7.6809 8.0369 8.0369 k = 0.0000 0.0000 0.0258 ( 8637 PWs) bands (ev): -19.7776 -19.7776 -19.6654 -19.6654 -17.4368 -17.4368 -17.3506 -17.3506 -10.1062 -10.1062 -9.8337 -9.8337 -9.5994 -9.5994 -9.2572 -9.2572 -8.4323 -8.4323 -8.3414 -8.3414 -6.2739 -6.2739 -6.0339 -6.0339 -5.7375 -5.7375 -5.6469 -5.6469 -5.1730 -5.1730 -5.0781 -5.0781 -4.8895 -4.8895 -4.1703 -4.1703 -3.7221 -3.7221 -3.5731 -3.5731 -3.5539 -3.5539 -1.0945 -1.0945 -0.3627 -0.3627 -0.3253 -0.3253 0.2081 0.2081 0.4139 0.4139 0.5323 0.5323 0.9329 0.9329 1.2131 1.2131 1.5045 1.5045 2.0670 2.0670 5.0026 5.0026 5.9489 5.9489 6.1234 6.1234 7.4719 7.4719 7.6849 7.6849 8.0344 8.0344 k = 0.0000 0.0000 0.0387 ( 8636 PWs) bands (ev): -19.7774 -19.7774 -19.6656 -19.6656 -17.4369 -17.4369 -17.3504 -17.3504 -10.1060 -10.1060 -9.8355 -9.8355 -9.5971 -9.5971 -9.2574 -9.2574 -8.4322 -8.4322 -8.3417 -8.3417 -6.2808 -6.2808 -6.0263 -6.0263 -5.7375 -5.7375 -5.6476 -5.6476 -5.1728 -5.1728 -5.0781 -5.0781 -4.8895 -4.8895 -4.1758 -4.1758 -3.7177 -3.7177 -3.5765 -3.5765 -3.5502 -3.5502 -1.0889 -1.0889 -0.3658 -0.3658 -0.3222 -0.3222 0.2002 0.2002 0.4030 0.4030 0.5434 0.5434 0.9359 0.9359 1.2108 1.2108 1.5030 1.5030 2.0676 2.0676 5.0121 5.0121 5.9455 5.9455 6.1274 6.1274 7.4620 7.4620 7.6905 7.6905 8.0306 8.0306 k = 0.0000 0.0000 0.0516 ( 8640 PWs) bands (ev): -19.7772 -19.7772 -19.6659 -19.6659 -17.4371 -17.4371 -17.3502 -17.3502 -10.1056 -10.1056 -9.8380 -9.8380 -9.5938 -9.5938 -9.2578 -9.2578 -8.4322 -8.4322 -8.3422 -8.3422 -6.2897 -6.2897 -6.0163 -6.0163 -5.7374 -5.7374 -5.6485 -5.6485 -5.1724 -5.1724 -5.0781 -5.0781 -4.8894 -4.8894 -4.1832 -4.1832 -3.7119 -3.7119 -3.5800 -3.5800 -3.5462 -3.5462 -1.0811 -1.0811 -0.3695 -0.3695 -0.3186 -0.3186 0.1894 0.1894 0.3905 0.3905 0.5562 0.5562 0.9400 0.9400 1.2075 1.2075 1.5011 1.5011 2.0684 2.0684 5.0251 5.0251 5.9412 5.9412 6.1326 6.1326 7.4493 7.4493 7.6967 7.6967 8.0262 8.0262 k = 0.0000 0.0000 0.0645 ( 8644 PWs) bands (ev): -19.7768 -19.7768 -19.6663 -19.6663 -17.4374 -17.4374 -17.3500 -17.3500 -10.1052 -10.1052 -9.8410 -9.8410 -9.5898 -9.5898 -9.2583 -9.2583 -8.4321 -8.4321 -8.3427 -8.3427 -6.3000 -6.3000 -6.0046 -6.0046 -5.7373 -5.7373 -5.6497 -5.6497 -5.1720 -5.1720 -5.0781 -5.0781 -4.8893 -4.8893 -4.1923 -4.1923 -3.7048 -3.7048 -3.5835 -3.5835 -3.5422 -3.5422 -1.0711 -1.0711 -0.3736 -0.3736 -0.3147 -0.3147 0.1758 0.1758 0.3772 0.3772 0.5698 0.5698 0.9450 0.9450 1.2033 1.2033 1.4988 1.4988 2.0695 2.0695 5.0415 5.0415 5.9365 5.9365 6.1386 6.1386 7.4345 7.4345 7.7020 7.7020 8.0220 8.0220 k = 0.0000 0.0000 0.0773 ( 8638 PWs) bands (ev): -19.7764 -19.7764 -19.6667 -19.6667 -17.4376 -17.4376 -17.3497 -17.3497 -10.1047 -10.1047 -9.8445 -9.8445 -9.5852 -9.5852 -9.2589 -9.2589 -8.4320 -8.4320 -8.3434 -8.3434 -6.3112 -6.3112 -5.9915 -5.9915 -5.7373 -5.7373 -5.6512 -5.6512 -5.1715 -5.1715 -5.0781 -5.0781 -4.8892 -4.8892 -4.2027 -4.2027 -3.6968 -3.6968 -3.5869 -3.5869 -3.5380 -3.5380 -1.0592 -1.0592 -0.3778 -0.3778 -0.3107 -0.3107 0.1599 0.1599 0.3637 0.3637 0.5835 0.5835 0.9510 0.9510 1.1984 1.1984 1.4962 1.4962 2.0707 2.0707 5.0608 5.0608 5.9316 5.9316 6.1452 6.1452 7.4181 7.4181 7.7054 7.7054 8.0190 8.0190 k = 0.0000 0.0000 0.0902 ( 8637 PWs) bands (ev): -19.7759 -19.7759 -19.6672 -19.6672 -17.4380 -17.4380 -17.3493 -17.3493 -10.1041 -10.1041 -9.8483 -9.8483 -9.5800 -9.5800 -9.2596 -9.2596 -8.4320 -8.4320 -8.3441 -8.3441 -6.3231 -6.3231 -5.9774 -5.9774 -5.7372 -5.7372 -5.6530 -5.6530 -5.1709 -5.1709 -5.0782 -5.0782 -4.8890 -4.8890 -4.2141 -4.2141 -3.6881 -3.6881 -3.5902 -3.5902 -3.5339 -3.5339 -1.0454 -1.0454 -0.3821 -0.3821 -0.3066 -0.3066 0.1419 0.1419 0.3500 0.3500 0.5971 0.5971 0.9576 0.9576 1.1927 1.1927 1.4934 1.4934 2.0719 2.0719 5.0828 5.0828 5.9269 5.9269 6.1520 6.1520 7.4005 7.4005 7.7059 7.7059 8.0182 8.0182 k = 0.0000 0.0000 0.1031 ( 8636 PWs) bands (ev): -19.7754 -19.7754 -19.6678 -19.6678 -17.4383 -17.4383 -17.3490 -17.3490 -10.1035 -10.1035 -9.8524 -9.8524 -9.5743 -9.5743 -9.2604 -9.2604 -8.4319 -8.4319 -8.3449 -8.3449 -6.3352 -6.3352 -5.9627 -5.9627 -5.7371 -5.7371 -5.6552 -5.6552 -5.1702 -5.1702 -5.0782 -5.0782 -4.8888 -4.8888 -4.2263 -4.2263 -3.6790 -3.6790 -3.5934 -3.5934 -3.5298 -3.5298 -1.0300 -1.0300 -0.3863 -0.3863 -0.3025 -0.3025 0.1221 0.1221 0.3364 0.3364 0.6103 0.6103 0.9648 0.9648 1.1865 1.1865 1.4905 1.4905 2.0733 2.0733 5.1071 5.1071 5.9229 5.9229 6.1589 6.1589 7.3817 7.3817 7.7028 7.7028 8.0201 8.0201 k = 0.0000 0.0000 0.1160 ( 8634 PWs) bands (ev): -19.7748 -19.7748 -19.6684 -19.6684 -17.4387 -17.4387 -17.3486 -17.3486 -10.1027 -10.1027 -9.8566 -9.8566 -9.5684 -9.5684 -9.2613 -9.2613 -8.4318 -8.4318 -8.3457 -8.3457 -6.3473 -6.3473 -5.9476 -5.9476 -5.7371 -5.7371 -5.6577 -5.6577 -5.1694 -5.1694 -5.0782 -5.0782 -4.8886 -4.8886 -4.2389 -4.2389 -3.6698 -3.6698 -3.5964 -3.5964 -3.5257 -3.5257 -1.0130 -1.0130 -0.3906 -0.3906 -0.2985 -0.2985 0.1009 0.1009 0.3230 0.3230 0.6230 0.6230 0.9724 0.9724 1.1797 1.1797 1.4876 1.4876 2.0747 2.0747 5.1330 5.1330 5.9197 5.9197 6.1656 6.1656 7.3621 7.3621 7.6960 7.6960 8.0250 8.0250 k = 0.0000 0.0000 0.1289 ( 8630 PWs) bands (ev): -19.7742 -19.7742 -19.6690 -19.6690 -17.4391 -17.4391 -17.3482 -17.3482 -10.1020 -10.1020 -9.8610 -9.8610 -9.5623 -9.5623 -9.2623 -9.2623 -8.4317 -8.4317 -8.3466 -8.3466 -6.3591 -6.3591 -5.9324 -5.9324 -5.7371 -5.7371 -5.6605 -5.6605 -5.1686 -5.1686 -5.0783 -5.0783 -4.8883 -4.8883 -4.2516 -4.2516 -3.6606 -3.6606 -3.5992 -3.5992 -3.5217 -3.5217 -0.9946 -0.9946 -0.3947 -0.3947 -0.2946 -0.2946 0.0786 0.0786 0.3098 0.3098 0.6351 0.6351 0.9803 0.9803 1.1726 1.1726 1.4847 1.4847 2.0761 2.0761 5.1601 5.1601 5.9176 5.9176 6.1720 6.1720 7.3417 7.3417 7.6860 7.6860 8.0328 8.0328 k = 0.0000 0.0000 0.1418 ( 8636 PWs) bands (ev): -19.7736 -19.7736 -19.6697 -19.6697 -17.4394 -17.4394 -17.3478 -17.3478 -10.1011 -10.1011 -9.8653 -9.8653 -9.5561 -9.5561 -9.2635 -9.2635 -8.4316 -8.4316 -8.3474 -8.3474 -6.3706 -6.3706 -5.9171 -5.9171 -5.7372 -5.7372 -5.6637 -5.6637 -5.1679 -5.1679 -5.0783 -5.0783 -4.8881 -4.8881 -4.2643 -4.2643 -3.6517 -3.6517 -3.6018 -3.6018 -3.5178 -3.5178 -0.9753 -0.9753 -0.3987 -0.3987 -0.2908 -0.2908 0.0555 0.0555 0.2971 0.2971 0.6464 0.6464 0.9882 0.9882 1.1653 1.1653 1.4820 1.4820 2.0774 2.0774 5.1878 5.1878 5.9170 5.9170 6.1779 6.1779 7.3205 7.3205 7.6733 7.6733 8.0429 8.0429 k = 0.0000 0.0000 0.1547 ( 8631 PWs) bands (ev): -19.7730 -19.7730 -19.6703 -19.6703 -17.4398 -17.4398 -17.3474 -17.3474 -10.1003 -10.1003 -9.8695 -9.8695 -9.5499 -9.5499 -9.2646 -9.2646 -8.4316 -8.4316 -8.3483 -8.3483 -6.3815 -6.3815 -5.9020 -5.9020 -5.7373 -5.7373 -5.6672 -5.6672 -5.1670 -5.1670 -5.0783 -5.0783 -4.8878 -4.8878 -4.2767 -4.2767 -3.6433 -3.6433 -3.6042 -3.6042 -3.5140 -3.5140 -0.9552 -0.9552 -0.4026 -0.4026 -0.2871 -0.2871 0.0320 0.0320 0.2848 0.2848 0.6571 0.6571 0.9961 0.9961 1.1578 1.1578 1.4794 1.4794 2.0787 2.0787 5.2154 5.2154 5.9180 5.9180 6.1832 6.1832 7.2987 7.2987 7.6590 7.6590 8.0546 8.0546 k = 0.0000 0.0000 0.1676 ( 8633 PWs) bands (ev): -19.7724 -19.7724 -19.6710 -19.6710 -17.4402 -17.4402 -17.3470 -17.3470 -10.0995 -10.0995 -9.8736 -9.8736 -9.5439 -9.5439 -9.2659 -9.2659 -8.4315 -8.4315 -8.3491 -8.3491 -6.3917 -6.3917 -5.8871 -5.8871 -5.7376 -5.7376 -5.6711 -5.6711 -5.1662 -5.1662 -5.0784 -5.0784 -4.8876 -4.8876 -4.2886 -4.2886 -3.6354 -3.6354 -3.6063 -3.6063 -3.5103 -3.5103 -0.9346 -0.9346 -0.4063 -0.4063 -0.2835 -0.2835 0.0085 0.0085 0.2731 0.2731 0.6669 0.6669 1.0038 1.0038 1.1505 1.1505 1.4771 1.4771 2.0799 2.0799 5.2423 5.2423 5.9207 5.9207 6.1878 6.1878 7.2764 7.2764 7.6439 7.6439 8.0669 8.0669 k = 0.0000 0.0000 0.1805 ( 8634 PWs) bands (ev): -19.7718 -19.7718 -19.6716 -19.6716 -17.4405 -17.4405 -17.3466 -17.3466 -10.0987 -10.0987 -9.8774 -9.8774 -9.5382 -9.5382 -9.2671 -9.2671 -8.4315 -8.4315 -8.3499 -8.3499 -6.4011 -6.4011 -5.8726 -5.8726 -5.7380 -5.7380 -5.6752 -5.6752 -5.1654 -5.1654 -5.0784 -5.0784 -4.8873 -4.8873 -4.2998 -4.2998 -3.6284 -3.6284 -3.6081 -3.6081 -3.5068 -3.5068 -0.9140 -0.9140 -0.4098 -0.4098 -0.2801 -0.2801 -0.0148 -0.0148 0.2622 0.2622 0.6759 0.6759 1.0111 1.0111 1.1433 1.1433 1.4750 1.4750 2.0810 2.0810 5.2679 5.2679 5.9251 5.9251 6.1916 6.1916 7.2540 7.2540 7.6290 7.6290 8.0790 8.0790 k = 0.0000 0.0000 0.1934 ( 8639 PWs) bands (ev): -19.7712 -19.7712 -19.6722 -19.6722 -17.4409 -17.4409 -17.3463 -17.3463 -10.0979 -10.0979 -9.8810 -9.8810 -9.5328 -9.5328 -9.2684 -9.2684 -8.4314 -8.4314 -8.3507 -8.3507 -6.4096 -6.4096 -5.8586 -5.8586 -5.7386 -5.7386 -5.6796 -5.6796 -5.1647 -5.1647 -5.0784 -5.0784 -4.8870 -4.8870 -4.3101 -4.3101 -3.6223 -3.6223 -3.6094 -3.6094 -3.5036 -3.5036 -0.8938 -0.8938 -0.4131 -0.4131 -0.2769 -0.2769 -0.0373 -0.0373 0.2522 0.2522 0.6840 0.6840 1.0179 1.0179 1.1365 1.1365 1.4731 1.4731 2.0819 2.0819 5.2915 5.2915 5.9312 5.9312 6.1946 6.1946 7.2317 7.2317 7.6149 7.6149 8.0900 8.0900 k = 0.0000 0.0000 0.2063 ( 8638 PWs) bands (ev): -19.7707 -19.7707 -19.6727 -19.6727 -17.4412 -17.4412 -17.3460 -17.3460 -10.0971 -10.0971 -9.8842 -9.8842 -9.5279 -9.5279 -9.2696 -9.2696 -8.4314 -8.4314 -8.3513 -8.3513 -6.4171 -6.4171 -5.8453 -5.8453 -5.7394 -5.7394 -5.6841 -5.6841 -5.1640 -5.1640 -5.0784 -5.0784 -4.8867 -4.8867 -4.3194 -4.3194 -3.6179 -3.6179 -3.6096 -3.6096 -3.5007 -3.5007 -0.8745 -0.8745 -0.4162 -0.4162 -0.2737 -0.2737 -0.0586 -0.0586 0.2432 0.2432 0.6911 0.6911 1.0242 1.0242 1.1302 1.1302 1.4715 1.4715 2.0828 2.0828 5.3127 5.3127 5.9386 5.9386 6.1968 6.1968 7.2102 7.2102 7.6020 7.6020 8.0991 8.0991 k = 0.0000 0.0000 0.2191 ( 8643 PWs) bands (ev): -19.7702 -19.7702 -19.6732 -19.6732 -17.4414 -17.4414 -17.3457 -17.3457 -10.0965 -10.0965 -9.8870 -9.8870 -9.5236 -9.5236 -9.2707 -9.2707 -8.4314 -8.4314 -8.3519 -8.3519 -6.4236 -6.4236 -5.8327 -5.8327 -5.7406 -5.7406 -5.6886 -5.6886 -5.1634 -5.1634 -5.0785 -5.0785 -4.8865 -4.8865 -4.3275 -4.3275 -3.6162 -3.6162 -3.6078 -3.6078 -3.4981 -3.4981 -0.8566 -0.8566 -0.4189 -0.4189 -0.2708 -0.2708 -0.0783 -0.0783 0.2353 0.2353 0.6973 0.6973 1.0297 1.0297 1.1245 1.1245 1.4702 1.4702 2.0835 2.0835 5.3311 5.3311 5.9469 5.9469 6.1982 6.1982 7.1901 7.1901 7.5909 7.5909 8.1059 8.1059 k = 0.0000 0.0000 0.2320 ( 8637 PWs) bands (ev): -19.7698 -19.7698 -19.6737 -19.6737 -17.4416 -17.4416 -17.3455 -17.3455 -10.0959 -10.0959 -9.8893 -9.8893 -9.5199 -9.5199 -9.2717 -9.2717 -8.4313 -8.4313 -8.3524 -8.3524 -6.4290 -6.4290 -5.8212 -5.8212 -5.7422 -5.7422 -5.6927 -5.6927 -5.1628 -5.1628 -5.0785 -5.0785 -4.8862 -4.8862 -4.3343 -4.3343 -3.6163 -3.6163 -3.6047 -3.6047 -3.4958 -3.4958 -0.8408 -0.8408 -0.4214 -0.4214 -0.2681 -0.2681 -0.0957 -0.0957 0.2287 0.2287 0.7024 0.7024 1.0344 1.0344 1.1196 1.1196 1.4691 1.4691 2.0841 2.0841 5.3464 5.3464 5.9554 5.9554 6.1989 6.1989 7.1722 7.1722 7.5816 7.5816 8.1103 8.1103 k = 0.0000 0.0000 0.2449 ( 8641 PWs) bands (ev): -19.7695 -19.7695 -19.6740 -19.6740 -17.4418 -17.4418 -17.3453 -17.3453 -10.0954 -10.0954 -9.8912 -9.8912 -9.5169 -9.5169 -9.2725 -9.2725 -8.4313 -8.4313 -8.3528 -8.3528 -6.4333 -6.4333 -5.8110 -5.8110 -5.7442 -5.7442 -5.6964 -5.6964 -5.1624 -5.1624 -5.0785 -5.0785 -4.8861 -4.8861 -4.3397 -4.3397 -3.6168 -3.6168 -3.6019 -3.6019 -3.4940 -3.4940 -0.8276 -0.8276 -0.4234 -0.4234 -0.2657 -0.2657 -0.1102 -0.1102 0.2234 0.2234 0.7064 0.7064 1.0383 1.0383 1.1156 1.1156 1.4682 1.4682 2.0846 2.0846 5.3584 5.3584 5.9634 5.9634 6.1991 6.1991 7.1572 7.1572 7.5743 7.5743 8.1126 8.1126 k = 0.0000 0.0000 0.2578 ( 8644 PWs) bands (ev): -19.7693 -19.7693 -19.6742 -19.6742 -17.4419 -17.4419 -17.3451 -17.3451 -10.0951 -10.0951 -9.8926 -9.8926 -9.5147 -9.5147 -9.2731 -9.2731 -8.4313 -8.4313 -8.3531 -8.3531 -6.4363 -6.4363 -5.8027 -5.8027 -5.7464 -5.7464 -5.6993 -5.6993 -5.1621 -5.1621 -5.0785 -5.0785 -4.8859 -4.8859 -4.3436 -4.3436 -3.6173 -3.6173 -3.5999 -3.5999 -3.4927 -3.4927 -0.8177 -0.8177 -0.4250 -0.4250 -0.2638 -0.2638 -0.1212 -0.1212 0.2196 0.2196 0.7093 0.7093 1.0411 1.0411 1.1126 1.1126 1.4676 1.4676 2.0850 2.0850 5.3669 5.3669 5.9699 5.9699 6.1990 6.1990 7.1458 7.1458 7.5691 7.5691 8.1136 8.1136 k = 0.0000 0.0000 0.2707 ( 8641 PWs) bands (ev): -19.7691 -19.7691 -19.6744 -19.6744 -17.4420 -17.4420 -17.3451 -17.3451 -10.0949 -10.0949 -9.8934 -9.8934 -9.5134 -9.5134 -9.2735 -9.2735 -8.4313 -8.4313 -8.3532 -8.3532 -6.4382 -6.4382 -5.7970 -5.7970 -5.7483 -5.7483 -5.7011 -5.7011 -5.1619 -5.1619 -5.0785 -5.0785 -4.8858 -4.8858 -4.3459 -4.3459 -3.6176 -3.6176 -3.5986 -3.5986 -3.4919 -3.4919 -0.8115 -0.8115 -0.4259 -0.4259 -0.2625 -0.2625 -0.1281 -0.1281 0.2173 0.2173 0.7111 0.7111 1.0428 1.0428 1.1108 1.1108 1.4672 1.4672 2.0852 2.0852 5.3721 5.3721 5.9742 5.9742 6.1988 6.1988 7.1388 7.1388 7.5660 7.5660 8.1138 8.1138 k = 0.0000 0.0000 0.2836 ( 8636 PWs) bands (ev): -19.7691 -19.7691 -19.6744 -19.6744 -17.4420 -17.4420 -17.3450 -17.3450 -10.0948 -10.0948 -9.8937 -9.8937 -9.5130 -9.5130 -9.2736 -9.2736 -8.4313 -8.4313 -8.3533 -8.3533 -6.4388 -6.4388 -5.7949 -5.7949 -5.7491 -5.7491 -5.7017 -5.7017 -5.1618 -5.1618 -5.0785 -5.0785 -4.8858 -4.8858 -4.3467 -4.3467 -3.6177 -3.6177 -3.5981 -3.5981 -3.4916 -3.4916 -0.8094 -0.8094 -0.4262 -0.4262 -0.2621 -0.2621 -0.1305 -0.1305 0.2166 0.2166 0.7117 0.7117 1.0434 1.0434 1.1102 1.1102 1.4671 1.4671 2.0852 2.0852 5.3738 5.3738 5.9757 5.9757 6.1987 6.1987 7.1364 7.1364 7.5650 7.5650 8.1138 8.1138 k = 0.0000-0.2740 0.1504 ( 8650 PWs) bands (ev): -19.7695 -19.7695 -19.6738 -19.6738 -17.4443 -17.4443 -17.3433 -17.3433 -10.1292 -10.1292 -9.8579 -9.8579 -9.5261 -9.5261 -9.2247 -9.2247 -8.4378 -8.4378 -8.3880 -8.3880 -6.4170 -6.4170 -5.8024 -5.8024 -5.7835 -5.7835 -5.7004 -5.7004 -5.1614 -5.1614 -5.0777 -5.0777 -4.8858 -4.8858 -4.3654 -4.3654 -3.6107 -3.6107 -3.5419 -3.5419 -3.4942 -3.4942 -0.8315 -0.8315 -0.4577 -0.4577 -0.2604 -0.2604 -0.2384 -0.2384 0.3858 0.3858 0.6170 0.6170 1.0676 1.0676 1.1517 1.1517 1.5182 1.5182 2.0784 2.0784 5.3430 5.3430 6.0151 6.0151 6.1326 6.1326 7.1596 7.1596 7.7188 7.7188 8.3809 8.3809 k = 0.0000-0.2625 0.1442 ( 8646 PWs) bands (ev): -19.7695 -19.7695 -19.6737 -19.6737 -17.4443 -17.4443 -17.3433 -17.3433 -10.1291 -10.1291 -9.8578 -9.8578 -9.5265 -9.5265 -9.2248 -9.2248 -8.4379 -8.4379 -8.3878 -8.3878 -6.4166 -6.4166 -5.8059 -5.8059 -5.7807 -5.7807 -5.7001 -5.7001 -5.1615 -5.1615 -5.0776 -5.0776 -4.8858 -4.8858 -4.3648 -4.3648 -3.6107 -3.6107 -3.5423 -3.5423 -3.4945 -3.4945 -0.8336 -0.8336 -0.4574 -0.4574 -0.2611 -0.2611 -0.2349 -0.2349 0.3854 0.3854 0.6169 0.6169 1.0666 1.0666 1.1523 1.1523 1.5182 1.5182 2.0784 2.0784 5.3415 5.3415 6.0143 6.0143 6.1329 6.1329 7.1610 7.1610 7.7203 7.7203 8.3733 8.3733 k = 0.0000-0.2511 0.1379 ( 8648 PWs) bands (ev): -19.7696 -19.7696 -19.6736 -19.6736 -17.4442 -17.4442 -17.3434 -17.3434 -10.1288 -10.1288 -9.8575 -9.8575 -9.5275 -9.5275 -9.2252 -9.2252 -8.4380 -8.4380 -8.3869 -8.3869 -6.4152 -6.4152 -5.8134 -5.8134 -5.7752 -5.7752 -5.6992 -5.6992 -5.1616 -5.1616 -5.0777 -5.0777 -4.8859 -4.8859 -4.3629 -4.3629 -3.6107 -3.6107 -3.5434 -3.5434 -3.4953 -3.4953 -0.8397 -0.8397 -0.4565 -0.4565 -0.2623 -0.2623 -0.2250 -0.2250 0.3843 0.3843 0.6168 0.6168 1.0636 1.0636 1.1542 1.1542 1.5180 1.5180 2.0782 2.0782 5.3372 5.3372 6.0119 6.0119 6.1336 6.1336 7.1652 7.1652 7.7245 7.7245 8.3545 8.3545 k = 0.0000-0.2397 0.1316 ( 8647 PWs) bands (ev): -19.7698 -19.7698 -19.6734 -19.6734 -17.4440 -17.4440 -17.3436 -17.3436 -10.1283 -10.1283 -9.8570 -9.8570 -9.5292 -9.5292 -9.2258 -9.2258 -8.4383 -8.4383 -8.3855 -8.3855 -6.4130 -6.4130 -5.8225 -5.8225 -5.7694 -5.7694 -5.6977 -5.6977 -5.1618 -5.1618 -5.0777 -5.0777 -4.8861 -4.8861 -4.3598 -4.3598 -3.6107 -3.6107 -3.5454 -3.5454 -3.4967 -3.4967 -0.8495 -0.8495 -0.4552 -0.4552 -0.2636 -0.2636 -0.2099 -0.2099 0.3825 0.3825 0.6166 0.6166 1.0588 1.0588 1.1570 1.1570 1.5176 1.5176 2.0780 2.0780 5.3301 5.3301 6.0083 6.0083 6.1347 6.1347 7.1720 7.1720 7.7312 7.7312 8.3304 8.3304 k = 0.0000-0.2283 0.1254 ( 8643 PWs) bands (ev): -19.7701 -19.7701 -19.6732 -19.6732 -17.4438 -17.4438 -17.3438 -17.3438 -10.1276 -10.1276 -9.8563 -9.8563 -9.5315 -9.5315 -9.2266 -9.2266 -8.4385 -8.4385 -8.3837 -8.3837 -6.4099 -6.4099 -5.8325 -5.8325 -5.7641 -5.7641 -5.6957 -5.6957 -5.1621 -5.1621 -5.0778 -5.0778 -4.8863 -4.8863 -4.3555 -4.3555 -3.6108 -3.6108 -3.5481 -3.5481 -3.4984 -3.4984 -0.8622 -0.8622 -0.4533 -0.4533 -0.2649 -0.2649 -0.1903 -0.1903 0.3801 0.3801 0.6163 0.6163 1.0527 1.0527 1.1606 1.1606 1.5171 1.5171 2.0776 2.0776 5.3203 5.3203 6.0037 6.0037 6.1360 6.1360 7.1813 7.1813 7.7401 7.7401 8.3049 8.3049 k = 0.0000-0.2169 0.1191 ( 8640 PWs) bands (ev): -19.7704 -19.7704 -19.6728 -19.6728 -17.4435 -17.4435 -17.3440 -17.3440 -10.1268 -10.1268 -9.8554 -9.8554 -9.5343 -9.5343 -9.2277 -9.2277 -8.4387 -8.4387 -8.3815 -8.3815 -6.4059 -6.4059 -5.8431 -5.8431 -5.7594 -5.7594 -5.6931 -5.6931 -5.1625 -5.1625 -5.0778 -5.0778 -4.8865 -4.8865 -4.3499 -4.3499 -3.6108 -3.6108 -3.5518 -3.5518 -3.5005 -3.5005 -0.8771 -0.8771 -0.4510 -0.4510 -0.2661 -0.2661 -0.1669 -0.1669 0.3773 0.3773 0.6157 0.6157 1.0453 1.0453 1.1647 1.1647 1.5166 1.5166 2.0772 2.0772 5.3080 5.3080 5.9983 5.9983 6.1373 6.1373 7.1930 7.1930 7.7506 7.7506 8.2804 8.2804 k = 0.0000-0.2055 0.1128 ( 8652 PWs) bands (ev): -19.7708 -19.7708 -19.6725 -19.6725 -17.4432 -17.4432 -17.3443 -17.3443 -10.1258 -10.1258 -9.8543 -9.8543 -9.5377 -9.5377 -9.2290 -9.2290 -8.4389 -8.4389 -8.3790 -8.3790 -6.4011 -6.4011 -5.8543 -5.8543 -5.7554 -5.7554 -5.6901 -5.6901 -5.1630 -5.1630 -5.0779 -5.0779 -4.8868 -4.8868 -4.3432 -4.3432 -3.6109 -3.6109 -3.5564 -3.5564 -3.5029 -3.5029 -0.8937 -0.8937 -0.4484 -0.4484 -0.2675 -0.2675 -0.1404 -0.1404 0.3741 0.3741 0.6148 0.6148 1.0371 1.0371 1.1691 1.1691 1.5159 1.5159 2.0767 2.0767 5.2932 5.2932 5.9925 5.9925 6.1384 6.1384 7.2068 7.2068 7.7617 7.7617 8.2584 8.2584 k = 0.0000-0.1941 0.1066 ( 8658 PWs) bands (ev): -19.7712 -19.7712 -19.6720 -19.6720 -17.4429 -17.4429 -17.3447 -17.3447 -10.1247 -10.1247 -9.8531 -9.8531 -9.5416 -9.5416 -9.2305 -9.2305 -8.4390 -8.4390 -8.3762 -8.3762 -6.3956 -6.3956 -5.8658 -5.8658 -5.7521 -5.7521 -5.6868 -5.6868 -5.1636 -5.1636 -5.0779 -5.0779 -4.8871 -4.8871 -4.3355 -4.3355 -3.6112 -3.6112 -3.5618 -3.5618 -3.5055 -3.5055 -0.9112 -0.9112 -0.4453 -0.4453 -0.2690 -0.2690 -0.1116 -0.1116 0.3707 0.3707 0.6135 0.6135 1.0282 1.0282 1.1737 1.1737 1.5151 1.5151 2.0761 2.0761 5.2763 5.2763 5.9867 5.9867 6.1392 6.1392 7.2224 7.2224 7.7725 7.7725 8.2399 8.2399 k = 0.0000-0.1826 0.1003 ( 8656 PWs) bands (ev): -19.7717 -19.7717 -19.6715 -19.6715 -17.4424 -17.4424 -17.3451 -17.3451 -10.1235 -10.1235 -9.8518 -9.8518 -9.5458 -9.5458 -9.2322 -9.2322 -8.4391 -8.4391 -8.3732 -8.3732 -6.3892 -6.3892 -5.8778 -5.8778 -5.7493 -5.7493 -5.6832 -5.6832 -5.1642 -5.1642 -5.0780 -5.0780 -4.8874 -4.8874 -4.3266 -4.3266 -3.6117 -3.6117 -3.5679 -3.5679 -3.5081 -3.5081 -0.9292 -0.9292 -0.4418 -0.4418 -0.2707 -0.2707 -0.0811 -0.0811 0.3672 0.3672 0.6117 0.6117 1.0189 1.0189 1.1784 1.1784 1.5143 1.5143 2.0754 2.0754 5.2576 5.2576 5.9809 5.9809 6.1396 6.1396 7.2396 7.2396 7.7819 7.7819 8.2258 8.2258 k = 0.0000-0.1712 0.0940 ( 8649 PWs) bands (ev): -19.7722 -19.7722 -19.6710 -19.6710 -17.4420 -17.4420 -17.3455 -17.3455 -10.1222 -10.1222 -9.8503 -9.8503 -9.5503 -9.5503 -9.2340 -9.2340 -8.4389 -8.4389 -8.3702 -8.3702 -6.3822 -6.3822 -5.8901 -5.8901 -5.7470 -5.7470 -5.6794 -5.6794 -5.1649 -5.1649 -5.0780 -5.0780 -4.8877 -4.8877 -4.3168 -4.3168 -3.6127 -3.6127 -3.5744 -3.5744 -3.5109 -3.5109 -0.9472 -0.9472 -0.4379 -0.4379 -0.2727 -0.2727 -0.0497 -0.0497 0.3639 0.3639 0.6094 0.6094 1.0093 1.0093 1.1830 1.1830 1.5135 1.5135 2.0748 2.0748 5.2372 5.2372 5.9755 5.9755 6.1397 6.1397 7.2581 7.2581 7.7886 7.7886 8.2160 8.2160 k = 0.0000-0.1598 0.0878 ( 8649 PWs) bands (ev): -19.7727 -19.7727 -19.6705 -19.6705 -17.4415 -17.4415 -17.3460 -17.3460 -10.1208 -10.1208 -9.8488 -9.8488 -9.5550 -9.5550 -9.2359 -9.2359 -8.4388 -8.4388 -8.3671 -8.3671 -6.3745 -6.3745 -5.9026 -5.9026 -5.7451 -5.7451 -5.6756 -5.6756 -5.1656 -5.1656 -5.0781 -5.0781 -4.8880 -4.8880 -4.3061 -4.3061 -3.6147 -3.6147 -3.5807 -3.5807 -3.5137 -3.5137 -0.9649 -0.9649 -0.4337 -0.4337 -0.2750 -0.2750 -0.0178 -0.0178 0.3610 0.3610 0.6064 0.6064 0.9997 0.9997 1.1875 1.1875 1.5126 1.5126 2.0741 2.0741 5.2157 5.2157 5.9706 5.9706 6.1394 6.1394 7.2775 7.2775 7.7917 7.7917 8.2097 8.2097 k = 0.0000-0.1484 0.0815 ( 8641 PWs) bands (ev): -19.7733 -19.7733 -19.6699 -19.6699 -17.4410 -17.4410 -17.3465 -17.3465 -10.1193 -10.1193 -9.8471 -9.8471 -9.5599 -9.5599 -9.2380 -9.2380 -8.4384 -8.4384 -8.3640 -8.3640 -6.3662 -6.3662 -5.9153 -5.9153 -5.7436 -5.7436 -5.6719 -5.6719 -5.1664 -5.1664 -5.0781 -5.0781 -4.8883 -4.8883 -4.2946 -4.2946 -3.6186 -3.6186 -3.5859 -3.5859 -3.5166 -3.5166 -0.9821 -0.9821 -0.4291 -0.4291 -0.2775 -0.2775 0.0137 0.0137 0.3586 0.3586 0.6028 0.6028 0.9903 0.9903 1.1917 1.1917 1.5117 1.5117 2.0733 2.0733 5.1933 5.1933 5.9662 5.9662 6.1387 6.1387 7.2975 7.2975 7.7910 7.7910 8.2049 8.2049 k = 0.0000-0.1370 0.0752 ( 8644 PWs) bands (ev): -19.7738 -19.7738 -19.6694 -19.6694 -17.4405 -17.4405 -17.3469 -17.3469 -10.1178 -10.1178 -9.8455 -9.8455 -9.5648 -9.5648 -9.2401 -9.2401 -8.4380 -8.4380 -8.3610 -8.3610 -6.3575 -6.3575 -5.9282 -5.9282 -5.7423 -5.7423 -5.6683 -5.6683 -5.1671 -5.1671 -5.0781 -5.0781 -4.8885 -4.8885 -4.2824 -4.2824 -3.6248 -3.6248 -3.5892 -3.5892 -3.5196 -3.5196 -0.9985 -0.9985 -0.4241 -0.4241 -0.2804 -0.2804 0.0445 0.0445 0.3570 0.3570 0.5986 0.5986 0.9812 0.9812 1.1957 1.1957 1.5108 1.5108 2.0726 2.0726 5.1704 5.1704 5.9624 5.9624 6.1376 6.1376 7.3178 7.3178 7.7865 7.7865 8.1986 8.1986 k = 0.0000-0.1256 0.0690 ( 8644 PWs) bands (ev): -19.7743 -19.7743 -19.6688 -19.6688 -17.4400 -17.4400 -17.3474 -17.3474 -10.1163 -10.1163 -9.8438 -9.8438 -9.5696 -9.5696 -9.2422 -9.2422 -8.4375 -8.4375 -8.3581 -8.3581 -6.3483 -6.3483 -5.9411 -5.9411 -5.7413 -5.7413 -5.6649 -5.6649 -5.1679 -5.1679 -5.0781 -5.0781 -4.8887 -4.8887 -4.2698 -4.2698 -3.6334 -3.6334 -3.5906 -3.5906 -3.5228 -3.5228 -1.0139 -1.0139 -0.4188 -0.4188 -0.2836 -0.2836 0.0739 0.0739 0.3564 0.3564 0.5936 0.5936 0.9727 0.9727 1.1993 1.1993 1.5100 1.5100 2.0718 2.0718 5.1475 5.1475 5.9592 5.9592 6.1362 6.1362 7.3381 7.3381 7.7789 7.7789 8.1886 8.1886 k = 0.0000-0.1142 0.0627 ( 8644 PWs) bands (ev): -19.7749 -19.7749 -19.6683 -19.6683 -17.4395 -17.4395 -17.3479 -17.3479 -10.1149 -10.1149 -9.8422 -9.8422 -9.5744 -9.5744 -9.2443 -9.2443 -8.4369 -8.4369 -8.3554 -8.3554 -6.3388 -6.3388 -5.9540 -5.9540 -5.7405 -5.7405 -5.6618 -5.6618 -5.1687 -5.1687 -5.0782 -5.0782 -4.8889 -4.8889 -4.2568 -4.2568 -3.6435 -3.6435 -3.5907 -3.5907 -3.5260 -3.5260 -1.0283 -1.0283 -0.4132 -0.4132 -0.2871 -0.2871 0.1013 0.1013 0.3572 0.3572 0.5878 0.5878 0.9648 0.9648 1.2026 1.2026 1.5093 1.5093 2.0711 2.0711 5.1250 5.1250 5.9567 5.9567 6.1346 6.1346 7.3581 7.3581 7.7688 7.7688 8.1742 8.1742 k = 0.0000-0.1027 0.0564 ( 8642 PWs) bands (ev): -19.7754 -19.7754 -19.6678 -19.6678 -17.4391 -17.4391 -17.3484 -17.3484 -10.1134 -10.1134 -9.8405 -9.8405 -9.5789 -9.5789 -9.2464 -9.2464 -8.4363 -8.4363 -8.3528 -8.3528 -6.3291 -6.3291 -5.9667 -5.9667 -5.7398 -5.7398 -5.6589 -5.6589 -5.1695 -5.1695 -5.0782 -5.0782 -4.8891 -4.8891 -4.2436 -4.2436 -3.6545 -3.6545 -3.5898 -3.5898 -3.5293 -3.5293 -1.0414 -1.0414 -0.4074 -0.4074 -0.2909 -0.2909 0.1262 0.1262 0.3596 0.3596 0.5814 0.5814 0.9576 0.9576 1.2054 1.2054 1.5085 1.5085 2.0703 2.0703 5.1032 5.1032 5.9547 5.9547 6.1327 6.1327 7.3775 7.3775 7.7573 7.7573 8.1563 8.1563 k = 0.0000-0.0913 0.0501 ( 8641 PWs) bands (ev): -19.7758 -19.7758 -19.6673 -19.6673 -17.4386 -17.4386 -17.3488 -17.3488 -10.1121 -10.1121 -9.8390 -9.8390 -9.5832 -9.5832 -9.2484 -9.2484 -8.4356 -8.4356 -8.3505 -8.3505 -6.3193 -6.3193 -5.9792 -5.9792 -5.7392 -5.7392 -5.6562 -5.6562 -5.1702 -5.1702 -5.0782 -5.0782 -4.8892 -4.8892 -4.2305 -4.2305 -3.6660 -3.6660 -3.5883 -3.5883 -3.5328 -3.5328 -1.0533 -1.0533 -0.4013 -0.4013 -0.2951 -0.2951 0.1480 0.1480 0.3638 0.3638 0.5744 0.5744 0.9514 0.9514 1.2079 1.2079 1.5079 1.5079 2.0696 2.0696 5.0826 5.0826 5.9533 5.9533 6.1308 6.1308 7.3960 7.3960 7.7450 7.7450 8.1366 8.1366 k = 0.0000-0.0799 0.0439 ( 8636 PWs) bands (ev): -19.7763 -19.7763 -19.6668 -19.6668 -17.4382 -17.4382 -17.3492 -17.3492 -10.1109 -10.1109 -9.8375 -9.8375 -9.5872 -9.5872 -9.2502 -9.2502 -8.4350 -8.4350 -8.3483 -8.3483 -6.3097 -6.3097 -5.9912 -5.9912 -5.7388 -5.7388 -5.6539 -5.6539 -5.1708 -5.1708 -5.0781 -5.0781 -4.8893 -4.8893 -4.2178 -4.2178 -3.6774 -3.6774 -3.5863 -3.5863 -3.5363 -3.5363 -1.0640 -1.0640 -0.3950 -0.3950 -0.2995 -0.2995 0.1665 0.1665 0.3700 0.3700 0.5668 0.5668 0.9460 0.9460 1.2099 1.2099 1.5074 1.5074 2.0690 2.0690 5.0635 5.0635 5.9524 5.9524 6.1288 6.1288 7.4134 7.4134 7.7325 7.7325 8.1167 8.1167 k = 0.0000-0.0685 0.0376 ( 8638 PWs) bands (ev): -19.7767 -19.7767 -19.6664 -19.6664 -17.4378 -17.4378 -17.3496 -17.3496 -10.1098 -10.1098 -9.8362 -9.8362 -9.5908 -9.5908 -9.2519 -9.2519 -8.4343 -8.4343 -8.3464 -8.3464 -6.3004 -6.3004 -6.0025 -6.0025 -5.7384 -5.7384 -5.6519 -5.6519 -5.1714 -5.1714 -5.0781 -5.0781 -4.8894 -4.8894 -4.2057 -4.2057 -3.6884 -3.6884 -3.5839 -3.5839 -3.5400 -3.5400 -1.0732 -1.0732 -0.3887 -0.3887 -0.3042 -0.3042 0.1814 0.1814 0.3781 0.3781 0.5588 0.5588 0.9415 0.9415 1.2115 1.2115 1.5069 1.5069 2.0684 2.0684 5.0463 5.0463 5.9518 5.9518 6.1268 6.1268 7.4295 7.4295 7.7205 7.7205 8.0977 8.0977 k = 0.0000-0.0571 0.0313 ( 8640 PWs) bands (ev): -19.7770 -19.7770 -19.6661 -19.6661 -17.4375 -17.4375 -17.3499 -17.3499 -10.1088 -10.1088 -9.8351 -9.8351 -9.5939 -9.5939 -9.2534 -9.2534 -8.4338 -8.4338 -8.3448 -8.3448 -6.2917 -6.2917 -6.0129 -6.0129 -5.7381 -5.7381 -5.6502 -5.6502 -5.1720 -5.1720 -5.0781 -5.0781 -4.8895 -4.8895 -4.1946 -4.1946 -3.6987 -3.6987 -3.5813 -3.5813 -3.5437 -3.5437 -1.0811 -1.0811 -0.3823 -0.3823 -0.3091 -0.3091 0.1930 0.1930 0.3876 0.3876 0.5505 0.5505 0.9379 0.9379 1.2128 1.2128 1.5065 1.5065 2.0678 2.0678 5.0311 5.0311 5.9516 5.9516 6.1249 6.1249 7.4438 7.4438 7.7092 7.7092 8.0804 8.0804 k = 0.0000-0.0457 0.0251 ( 8638 PWs) bands (ev): -19.7773 -19.7773 -19.6658 -19.6658 -17.4372 -17.4372 -17.3502 -17.3502 -10.1080 -10.1080 -9.8341 -9.8341 -9.5966 -9.5966 -9.2546 -9.2546 -8.4333 -8.4333 -8.3435 -8.3435 -6.2839 -6.2839 -6.0221 -6.0221 -5.7379 -5.7379 -5.6489 -5.6489 -5.1724 -5.1724 -5.0781 -5.0781 -4.8895 -4.8895 -4.1849 -4.1849 -3.7078 -3.7078 -3.5784 -3.5784 -3.5474 -3.5474 -1.0875 -1.0875 -0.3761 -0.3761 -0.3141 -0.3141 0.2016 0.2016 0.3978 0.3978 0.5423 0.5423 0.9351 0.9351 1.2137 1.2137 1.5062 1.5062 2.0673 2.0673 5.0184 5.0184 5.9516 5.9516 6.1233 6.1233 7.4563 7.4563 7.6993 7.6993 8.0656 8.0656 k = 0.0000-0.0342 0.0188 ( 8639 PWs) bands (ev): -19.7775 -19.7775 -19.6656 -19.6656 -17.4370 -17.4370 -17.3504 -17.3504 -10.1073 -10.1073 -9.8333 -9.8333 -9.5987 -9.5987 -9.2556 -9.2556 -8.4329 -8.4329 -8.3425 -8.3425 -6.2773 -6.2773 -6.0298 -6.0298 -5.7378 -5.7378 -5.6478 -5.6478 -5.1728 -5.1728 -5.0781 -5.0781 -4.8895 -4.8895 -4.1768 -4.1768 -3.7153 -3.7153 -3.5755 -3.5755 -3.5510 -3.5510 -1.0926 -1.0926 -0.3702 -0.3702 -0.3190 -0.3190 0.2076 0.2076 0.4077 0.4077 0.5344 0.5344 0.9330 0.9330 1.2143 1.2143 1.5060 1.5060 2.0669 2.0669 5.0082 5.0082 5.9516 5.9516 6.1219 6.1219 7.4665 7.4665 7.6910 7.6910 8.0537 8.0537 k = 0.0000-0.0228 0.0125 ( 8640 PWs) bands (ev): -19.7777 -19.7777 -19.6654 -19.6654 -17.4368 -17.4368 -17.3506 -17.3506 -10.1068 -10.1068 -9.8327 -9.8327 -9.6002 -9.6002 -9.2564 -9.2564 -8.4326 -8.4326 -8.3417 -8.3417 -6.2723 -6.2723 -6.0356 -6.0356 -5.7376 -5.7376 -5.6470 -5.6470 -5.1730 -5.1730 -5.0781 -5.0781 -4.8896 -4.8896 -4.1707 -4.1707 -3.7210 -3.7210 -3.5725 -3.5725 -3.5544 -3.5544 -1.0962 -1.0962 -0.3650 -0.3650 -0.3235 -0.3235 0.2116 0.2116 0.4164 0.4164 0.5277 0.5277 0.9316 0.9316 1.2148 1.2148 1.5058 1.5058 2.0667 2.0667 5.0009 5.0009 5.9518 5.9518 6.1208 6.1208 7.4741 7.4741 7.6847 7.6847 8.0449 8.0449 k = 0.0000-0.0114 0.0063 ( 8639 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1065 -10.1065 -9.8323 -9.8323 -9.6011 -9.6011 -9.2568 -9.2568 -8.4324 -8.4324 -8.3413 -8.3413 -6.2691 -6.2691 -6.0392 -6.0392 -5.7376 -5.7376 -5.6466 -5.6466 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1670 -4.1670 -3.7246 -3.7246 -3.5699 -3.5699 -3.5573 -3.5573 -1.0984 -1.0984 -0.3611 -0.3611 -0.3269 -0.3269 0.2138 0.2138 0.4224 0.4224 0.5230 0.5230 0.9308 0.9308 1.2150 1.2150 1.5057 1.5057 2.0665 2.0665 4.9964 4.9964 5.9519 5.9519 6.1202 6.1202 7.4788 7.4788 7.6808 7.6808 8.0396 8.0396 k = 0.0000 0.0000 0.0000 ( 8641 PWs) bands (ev): -19.7778 -19.7778 -19.6653 -19.6653 -17.4367 -17.4367 -17.3507 -17.3507 -10.1064 -10.1064 -9.8322 -9.8322 -9.6014 -9.6014 -9.2569 -9.2569 -8.4323 -8.4323 -8.3411 -8.3411 -6.2680 -6.2680 -6.0405 -6.0405 -5.7376 -5.7376 -5.6464 -5.6464 -5.1732 -5.1732 -5.0781 -5.0781 -4.8896 -4.8896 -4.1657 -4.1657 -3.7258 -3.7258 -3.5687 -3.5687 -3.5586 -3.5586 -1.0991 -1.0991 -0.3597 -0.3597 -0.3282 -0.3282 0.2145 0.2145 0.4246 0.4246 0.5213 0.5213 0.9305 0.9305 1.2151 1.2151 1.5057 1.5057 2.0664 2.0664 4.9949 4.9949 5.9519 5.9519 6.1199 6.1199 7.4805 7.4805 7.6794 7.6794 8.0378 8.0378 Writing output data file CdH6C2I2xNOx2.save init_run : 1.02s CPU 1.35s WALL ( 1 calls) electrons : 274.55s CPU 278.18s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.03s WALL ( 1 calls) potinit : 0.08s CPU 0.13s WALL ( 1 calls) Called by electrons: c_bands : 274.54s CPU 278.16s WALL ( 1 calls) v_of_rho : 0.02s CPU 0.02s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.02s CPU 0.02s WALL ( 1 calls) newd : 0.16s CPU 0.33s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.07s CPU 0.08s WALL ( 244 calls) cegterg : 254.05s CPU 256.81s WALL ( 384 calls) Called by sum_band: Called by *egterg: h_psi : 134.56s CPU 137.41s WALL ( 5777 calls) s_psi : 7.05s CPU 6.94s WALL ( 5777 calls) g_psi : 0.24s CPU 0.26s WALL ( 5149 calls) cdiaghg : 100.56s CPU 100.77s WALL ( 5393 calls) cegterg:over : 12.32s CPU 12.49s WALL ( 5149 calls) cegterg:upda : 8.15s CPU 8.26s WALL ( 5149 calls) cegterg:last : 4.71s CPU 4.67s WALL ( 872 calls) cdiaghg:chol : 4.36s CPU 4.43s WALL ( 5393 calls) cdiaghg:inve : 3.24s CPU 3.19s WALL ( 5393 calls) cdiaghg:para : 6.23s CPU 6.11s WALL ( 10786 calls) Called by h_psi: h_psi:vloc : 117.92s CPU 120.39s WALL ( 5777 calls) h_psi:vnl : 16.37s CPU 16.75s WALL ( 5777 calls) add_vuspsi : 8.01s CPU 8.07s WALL ( 5777 calls) General routines calbec : 8.34s CPU 8.66s WALL ( 5777 calls) fft : 0.02s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 108.92s CPU 111.20s WALL ( 865476 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.17s CPU 0.30s WALL ( 488 calls) Parallel routines fft_scatter : 75.90s CPU 77.26s WALL ( 865499 calls) PWSCF : 5m12.62s CPU 5m34.42s WALL This run was terminated on: 4:31:56 31Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=