Program PWSCF v.5.1.1 starts on 13Dec2015 at 7:42:18 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./AlPO4.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 43 25 7 2598 1131 171 Max 45 26 8 2605 1158 179 Sum 2077 1201 349 124879 55125 8461 bravais-lattice index = 14 lattice parameter (alat) = 9.6331 a.u. unit-cell volume = 1267.1795 (a.u.)^3 number of atoms/cell = 12 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.633067 celldm(2)= 1.000000 celldm(3)= 1.636868 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 1.636868 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.610923 ) PseudoPot. # 1 for O read from file: /home/autes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Al read from file: /home/autes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for P read from file: /home/autes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) Al 3.00 26.98150 Al( 1.00) P 5.00 30.97380 P( 1.00) 12 Sym. Ops. (no inversion) found ( 6 have fractional translation) 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 = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 3 60 deg rotation - cryst. axis [0,0,1] cryst. s( 3) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 3) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 4 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 4) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 4) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 5 120 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 5) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 6 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 6) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 7) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s( 8) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 9) = ( -0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 10 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(10) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.8184342 ) isym = 11 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(12) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_6v (6mm) there are 9 classes and 3 irreducible representations the character table: E -E C2 2C3 -2C3 2C6 -2C6 3s_v 3s_d -C2 -3s_v -3s_d G_7 2.00 -2.00 0.00 1.00 -1.00 1.73 -1.73 0.00 0.00 G_8 2.00 -2.00 0.00 1.00 -1.00 -1.73 1.73 0.00 0.00 G_9 2.00 -2.00 0.00 -2.00 2.00 0.00 0.00 0.00 0.00 the symmetry operations in each class: E 1 C2 -C2 2 -2 2C6 3 4 2C3 5 6 3s_v-3s_v 7 -7 9 10 -10 -9 3s_d-3s_d 8 -8 12 -11 11 -12 -E -1 -2C6 -3 -4 -2C3 -5 -6 Cartesian axes number of k points= 264 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 2) = ( 0.0138889 0.0080188 -0.0000000), wk = 0.0037879 k( 3) = ( 0.0277778 0.0160375 -0.0000000), wk = 0.0037879 k( 4) = ( 0.0416667 0.0240563 -0.0000000), wk = 0.0037879 k( 5) = ( 0.0555556 0.0320750 -0.0000000), wk = 0.0037879 k( 6) = ( 0.0694444 0.0400938 -0.0000000), wk = 0.0037879 k( 7) = ( 0.0833333 0.0481125 -0.0000000), wk = 0.0037879 k( 8) = ( 0.0972222 0.0561313 -0.0000000), wk = 0.0037879 k( 9) = ( 0.1111111 0.0641500 -0.0000000), wk = 0.0037879 k( 10) = ( 0.1250000 0.0721688 -0.0000000), wk = 0.0037879 k( 11) = ( 0.1388889 0.0801875 -0.0000000), wk = 0.0037879 k( 12) = ( 0.1527778 0.0882063 -0.0000000), wk = 0.0037879 k( 13) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0037879 k( 14) = ( 0.1805556 0.1042438 -0.0000000), wk = 0.0037879 k( 15) = ( 0.1944444 0.1122625 -0.0000000), wk = 0.0037879 k( 16) = ( 0.2083333 0.1202813 -0.0000000), wk = 0.0037879 k( 17) = ( 0.2222222 0.1283001 -0.0000000), wk = 0.0037879 k( 18) = ( 0.2361111 0.1363188 -0.0000000), wk = 0.0037879 k( 19) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0037879 k( 20) = ( 0.2638889 0.1523563 -0.0000000), wk = 0.0037879 k( 21) = ( 0.2777778 0.1603751 -0.0000000), wk = 0.0037879 k( 22) = ( 0.2916667 0.1683938 -0.0000000), wk = 0.0037879 k( 23) = ( 0.3055556 0.1764126 -0.0000000), wk = 0.0037879 k( 24) = ( 0.3194444 0.1844313 -0.0000000), wk = 0.0037879 k( 25) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0037879 k( 26) = ( 0.3472222 0.2004688 -0.0000000), wk = 0.0037879 k( 27) = ( 0.3611111 0.2084876 -0.0000000), wk = 0.0037879 k( 28) = ( 0.3750000 0.2165064 -0.0000000), wk = 0.0037879 k( 29) = ( 0.3888889 0.2245251 -0.0000000), wk = 0.0037879 k( 30) = ( 0.4027778 0.2325439 -0.0000000), wk = 0.0037879 k( 31) = ( 0.4166667 0.2405626 -0.0000000), wk = 0.0037879 k( 32) = ( 0.4305556 0.2485814 -0.0000000), wk = 0.0037879 k( 33) = ( 0.4444444 0.2566001 -0.0000000), wk = 0.0037879 k( 34) = ( 0.4583333 0.2646189 -0.0000000), wk = 0.0037879 k( 35) = ( 0.4722222 0.2726376 -0.0000000), wk = 0.0037879 k( 36) = ( 0.4861111 0.2806564 -0.0000000), wk = 0.0037879 k( 37) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037879 k( 38) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037879 k( 39) = ( 0.4920635 0.3024216 -0.0000000), wk = 0.0037879 k( 40) = ( 0.4841270 0.3161680 -0.0000000), wk = 0.0037879 k( 41) = ( 0.4761905 0.3299144 -0.0000000), wk = 0.0037879 k( 42) = ( 0.4682540 0.3436609 -0.0000000), wk = 0.0037879 k( 43) = ( 0.4603175 0.3574073 -0.0000000), wk = 0.0037879 k( 44) = ( 0.4523810 0.3711537 -0.0000000), wk = 0.0037879 k( 45) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0037879 k( 46) = ( 0.4365079 0.3986466 -0.0000000), wk = 0.0037879 k( 47) = ( 0.4285714 0.4123930 -0.0000000), wk = 0.0037879 k( 48) = ( 0.4206349 0.4261395 -0.0000000), wk = 0.0037879 k( 49) = ( 0.4126984 0.4398859 -0.0000000), wk = 0.0037879 k( 50) = ( 0.4047619 0.4536324 -0.0000000), wk = 0.0037879 k( 51) = ( 0.3968254 0.4673788 -0.0000000), wk = 0.0037879 k( 52) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0037879 k( 53) = ( 0.3809524 0.4948717 -0.0000000), wk = 0.0037879 k( 54) = ( 0.3730159 0.5086181 -0.0000000), wk = 0.0037879 k( 55) = ( 0.3650794 0.5223645 -0.0000000), wk = 0.0037879 k( 56) = ( 0.3571429 0.5361110 -0.0000000), wk = 0.0037879 k( 57) = ( 0.3492063 0.5498574 -0.0000000), wk = 0.0037879 k( 58) = ( 0.3412698 0.5636038 -0.0000000), wk = 0.0037879 k( 59) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037879 k( 60) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037879 k( 61) = ( 0.3253968 0.5636038 -0.0000000), wk = 0.0037879 k( 62) = ( 0.3174603 0.5498574 -0.0000000), wk = 0.0037879 k( 63) = ( 0.3095238 0.5361110 -0.0000000), wk = 0.0037879 k( 64) = ( 0.3015873 0.5223645 -0.0000000), wk = 0.0037879 k( 65) = ( 0.2936508 0.5086181 -0.0000000), wk = 0.0037879 k( 66) = ( 0.2857143 0.4948717 -0.0000000), wk = 0.0037879 k( 67) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0037879 k( 68) = ( 0.2698413 0.4673788 -0.0000000), wk = 0.0037879 k( 69) = ( 0.2619048 0.4536324 -0.0000000), wk = 0.0037879 k( 70) = ( 0.2539683 0.4398859 -0.0000000), wk = 0.0037879 k( 71) = ( 0.2460317 0.4261395 -0.0000000), wk = 0.0037879 k( 72) = ( 0.2380952 0.4123931 -0.0000000), wk = 0.0037879 k( 73) = ( 0.2301587 0.3986466 -0.0000000), wk = 0.0037879 k( 74) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0037879 k( 75) = ( 0.2142857 0.3711537 -0.0000000), wk = 0.0037879 k( 76) = ( 0.2063492 0.3574073 -0.0000000), wk = 0.0037879 k( 77) = ( 0.1984127 0.3436609 -0.0000000), wk = 0.0037879 k( 78) = ( 0.1904762 0.3299144 -0.0000000), wk = 0.0037879 k( 79) = ( 0.1825397 0.3161680 -0.0000000), wk = 0.0037879 k( 80) = ( 0.1746032 0.3024216 -0.0000000), wk = 0.0037879 k( 81) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0037879 k( 82) = ( 0.1587302 0.2749287 -0.0000000), wk = 0.0037879 k( 83) = ( 0.1507937 0.2611823 -0.0000000), wk = 0.0037879 k( 84) = ( 0.1428571 0.2474358 -0.0000000), wk = 0.0037879 k( 85) = ( 0.1349206 0.2336894 -0.0000000), wk = 0.0037879 k( 86) = ( 0.1269841 0.2199430 -0.0000000), wk = 0.0037879 k( 87) = ( 0.1190476 0.2061965 -0.0000000), wk = 0.0037879 k( 88) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0037879 k( 89) = ( 0.1031746 0.1787036 -0.0000000), wk = 0.0037879 k( 90) = ( 0.0952381 0.1649572 -0.0000000), wk = 0.0037879 k( 91) = ( 0.0873016 0.1512108 -0.0000000), wk = 0.0037879 k( 92) = ( 0.0793651 0.1374644 -0.0000000), wk = 0.0037879 k( 93) = ( 0.0714286 0.1237179 -0.0000000), wk = 0.0037879 k( 94) = ( 0.0634921 0.1099715 -0.0000000), wk = 0.0037879 k( 95) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0037879 k( 96) = ( 0.0476191 0.0824786 -0.0000000), wk = 0.0037879 k( 97) = ( 0.0396825 0.0687322 -0.0000000), wk = 0.0037879 k( 98) = ( 0.0317460 0.0549857 -0.0000000), wk = 0.0037879 k( 99) = ( 0.0238095 0.0412393 -0.0000000), wk = 0.0037879 k( 100) = ( 0.0158730 0.0274929 -0.0000000), wk = 0.0037879 k( 101) = ( 0.0079365 0.0137464 -0.0000000), wk = 0.0037879 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 104) = ( 0.0000000 0.0000000 0.0160769), wk = 0.0037879 k( 105) = ( 0.0000000 0.0000000 0.0321538), wk = 0.0037879 k( 106) = ( 0.0000000 0.0000000 0.0482307), wk = 0.0037879 k( 107) = ( 0.0000000 0.0000000 0.0643077), wk = 0.0037879 k( 108) = ( 0.0000000 0.0000000 0.0803846), wk = 0.0037879 k( 109) = ( 0.0000000 0.0000000 0.0964615), wk = 0.0037879 k( 110) = ( 0.0000000 0.0000000 0.1125384), wk = 0.0037879 k( 111) = ( 0.0000000 0.0000000 0.1286153), wk = 0.0037879 k( 112) = ( 0.0000000 0.0000000 0.1446922), wk = 0.0037879 k( 113) = ( 0.0000000 0.0000000 0.1607691), wk = 0.0037879 k( 114) = ( 0.0000000 0.0000000 0.1768460), wk = 0.0037879 k( 115) = ( 0.0000000 0.0000000 0.1929230), wk = 0.0037879 k( 116) = ( 0.0000000 0.0000000 0.2089999), wk = 0.0037879 k( 117) = ( 0.0000000 0.0000000 0.2250768), wk = 0.0037879 k( 118) = ( 0.0000000 0.0000000 0.2411537), wk = 0.0037879 k( 119) = ( 0.0000000 0.0000000 0.2572306), wk = 0.0037879 k( 120) = ( 0.0000000 0.0000000 0.2733075), wk = 0.0037879 k( 121) = ( 0.0000000 0.0000000 0.2893844), wk = 0.0037879 k( 122) = ( 0.0000000 0.0000000 0.3054613), wk = 0.0037879 k( 123) = ( 0.0000000 0.0000000 0.3054613), wk = 0.0037879 k( 124) = ( 0.0138889 0.0080188 0.3054613), wk = 0.0037879 k( 125) = ( 0.0277778 0.0160375 0.3054613), wk = 0.0037879 k( 126) = ( 0.0416667 0.0240563 0.3054613), wk = 0.0037879 k( 127) = ( 0.0555556 0.0320750 0.3054613), wk = 0.0037879 k( 128) = ( 0.0694444 0.0400938 0.3054613), wk = 0.0037879 k( 129) = ( 0.0833333 0.0481125 0.3054613), wk = 0.0037879 k( 130) = ( 0.0972222 0.0561313 0.3054613), wk = 0.0037879 k( 131) = ( 0.1111111 0.0641500 0.3054613), wk = 0.0037879 k( 132) = ( 0.1250000 0.0721688 0.3054613), wk = 0.0037879 k( 133) = ( 0.1388889 0.0801875 0.3054613), wk = 0.0037879 k( 134) = ( 0.1527778 0.0882063 0.3054613), wk = 0.0037879 k( 135) = ( 0.1666667 0.0962250 0.3054613), wk = 0.0037879 k( 136) = ( 0.1805556 0.1042438 0.3054613), wk = 0.0037879 k( 137) = ( 0.1944444 0.1122625 0.3054613), wk = 0.0037879 k( 138) = ( 0.2083333 0.1202813 0.3054613), wk = 0.0037879 k( 139) = ( 0.2222222 0.1283001 0.3054613), wk = 0.0037879 k( 140) = ( 0.2361111 0.1363188 0.3054613), wk = 0.0037879 k( 141) = ( 0.2500000 0.1443376 0.3054613), wk = 0.0037879 k( 142) = ( 0.2638889 0.1523563 0.3054613), wk = 0.0037879 k( 143) = ( 0.2777778 0.1603751 0.3054613), wk = 0.0037879 k( 144) = ( 0.2916667 0.1683938 0.3054613), wk = 0.0037879 k( 145) = ( 0.3055556 0.1764126 0.3054613), wk = 0.0037879 k( 146) = ( 0.3194444 0.1844313 0.3054613), wk = 0.0037879 k( 147) = ( 0.3333333 0.1924501 0.3054613), wk = 0.0037879 k( 148) = ( 0.3472222 0.2004688 0.3054613), wk = 0.0037879 k( 149) = ( 0.3611111 0.2084876 0.3054613), wk = 0.0037879 k( 150) = ( 0.3750000 0.2165064 0.3054613), wk = 0.0037879 k( 151) = ( 0.3888889 0.2245251 0.3054613), wk = 0.0037879 k( 152) = ( 0.4027778 0.2325439 0.3054613), wk = 0.0037879 k( 153) = ( 0.4166667 0.2405626 0.3054613), wk = 0.0037879 k( 154) = ( 0.4305556 0.2485814 0.3054613), wk = 0.0037879 k( 155) = ( 0.4444444 0.2566001 0.3054613), wk = 0.0037879 k( 156) = ( 0.4583333 0.2646189 0.3054613), wk = 0.0037879 k( 157) = ( 0.4722222 0.2726376 0.3054613), wk = 0.0037879 k( 158) = ( 0.4861111 0.2806564 0.3054613), wk = 0.0037879 k( 159) = ( 0.5000000 0.2886751 0.3054613), wk = 0.0037879 k( 160) = ( 0.5000000 0.2886751 0.3054613), wk = 0.0037879 k( 161) = ( 0.4920635 0.3024216 0.3054613), wk = 0.0037879 k( 162) = ( 0.4841270 0.3161680 0.3054613), wk = 0.0037879 k( 163) = ( 0.4761905 0.3299144 0.3054613), wk = 0.0037879 k( 164) = ( 0.4682540 0.3436609 0.3054613), wk = 0.0037879 k( 165) = ( 0.4603175 0.3574073 0.3054613), wk = 0.0037879 k( 166) = ( 0.4523810 0.3711537 0.3054613), wk = 0.0037879 k( 167) = ( 0.4444444 0.3849002 0.3054613), wk = 0.0037879 k( 168) = ( 0.4365079 0.3986466 0.3054613), wk = 0.0037879 k( 169) = ( 0.4285714 0.4123930 0.3054613), wk = 0.0037879 k( 170) = ( 0.4206349 0.4261395 0.3054613), wk = 0.0037879 k( 171) = ( 0.4126984 0.4398859 0.3054613), wk = 0.0037879 k( 172) = ( 0.4047619 0.4536324 0.3054613), wk = 0.0037879 k( 173) = ( 0.3968254 0.4673788 0.3054613), wk = 0.0037879 k( 174) = ( 0.3888889 0.4811252 0.3054613), wk = 0.0037879 k( 175) = ( 0.3809524 0.4948717 0.3054613), wk = 0.0037879 k( 176) = ( 0.3730159 0.5086181 0.3054613), wk = 0.0037879 k( 177) = ( 0.3650794 0.5223645 0.3054613), wk = 0.0037879 k( 178) = ( 0.3571429 0.5361110 0.3054613), wk = 0.0037879 k( 179) = ( 0.3492063 0.5498574 0.3054613), wk = 0.0037879 k( 180) = ( 0.3412698 0.5636038 0.3054613), wk = 0.0037879 k( 181) = ( 0.3333333 0.5773503 0.3054613), wk = 0.0037879 k( 182) = ( 0.3333333 0.5773503 0.3054613), wk = 0.0037879 k( 183) = ( 0.3253968 0.5636038 0.3054613), wk = 0.0037879 k( 184) = ( 0.3174603 0.5498574 0.3054613), wk = 0.0037879 k( 185) = ( 0.3095238 0.5361110 0.3054613), wk = 0.0037879 k( 186) = ( 0.3015873 0.5223645 0.3054613), wk = 0.0037879 k( 187) = ( 0.2936508 0.5086181 0.3054613), wk = 0.0037879 k( 188) = ( 0.2857143 0.4948717 0.3054613), wk = 0.0037879 k( 189) = ( 0.2777778 0.4811252 0.3054613), wk = 0.0037879 k( 190) = ( 0.2698413 0.4673788 0.3054613), wk = 0.0037879 k( 191) = ( 0.2619048 0.4536324 0.3054613), wk = 0.0037879 k( 192) = ( 0.2539683 0.4398859 0.3054613), wk = 0.0037879 k( 193) = ( 0.2460317 0.4261395 0.3054613), wk = 0.0037879 k( 194) = ( 0.2380952 0.4123931 0.3054613), wk = 0.0037879 k( 195) = ( 0.2301587 0.3986466 0.3054613), wk = 0.0037879 k( 196) = ( 0.2222222 0.3849002 0.3054613), wk = 0.0037879 k( 197) = ( 0.2142857 0.3711537 0.3054613), wk = 0.0037879 k( 198) = ( 0.2063492 0.3574073 0.3054613), wk = 0.0037879 k( 199) = ( 0.1984127 0.3436609 0.3054613), wk = 0.0037879 k( 200) = ( 0.1904762 0.3299144 0.3054613), wk = 0.0037879 k( 201) = ( 0.1825397 0.3161680 0.3054613), wk = 0.0037879 k( 202) = ( 0.1746032 0.3024216 0.3054613), wk = 0.0037879 k( 203) = ( 0.1666667 0.2886751 0.3054613), wk = 0.0037879 k( 204) = ( 0.1587302 0.2749287 0.3054613), wk = 0.0037879 k( 205) = ( 0.1507937 0.2611823 0.3054613), wk = 0.0037879 k( 206) = ( 0.1428571 0.2474358 0.3054613), wk = 0.0037879 k( 207) = ( 0.1349206 0.2336894 0.3054613), wk = 0.0037879 k( 208) = ( 0.1269841 0.2199430 0.3054613), wk = 0.0037879 k( 209) = ( 0.1190476 0.2061965 0.3054613), wk = 0.0037879 k( 210) = ( 0.1111111 0.1924501 0.3054613), wk = 0.0037879 k( 211) = ( 0.1031746 0.1787036 0.3054613), wk = 0.0037879 k( 212) = ( 0.0952381 0.1649572 0.3054613), wk = 0.0037879 k( 213) = ( 0.0873016 0.1512108 0.3054613), wk = 0.0037879 k( 214) = ( 0.0793651 0.1374644 0.3054613), wk = 0.0037879 k( 215) = ( 0.0714286 0.1237179 0.3054613), wk = 0.0037879 k( 216) = ( 0.0634921 0.1099715 0.3054613), wk = 0.0037879 k( 217) = ( 0.0555556 0.0962251 0.3054613), wk = 0.0037879 k( 218) = ( 0.0476191 0.0824786 0.3054613), wk = 0.0037879 k( 219) = ( 0.0396825 0.0687322 0.3054613), wk = 0.0037879 k( 220) = ( 0.0317460 0.0549857 0.3054613), wk = 0.0037879 k( 221) = ( 0.0238095 0.0412393 0.3054613), wk = 0.0037879 k( 222) = ( 0.0158730 0.0274929 0.3054613), wk = 0.0037879 k( 223) = ( 0.0079365 0.0137464 0.3054613), wk = 0.0037879 k( 224) = ( 0.0000000 0.0000000 0.3054613), wk = 0.0037879 k( 225) = ( 0.5000000 0.2886751 0.3054613), wk = 0.0037879 k( 226) = ( 0.5000000 0.2886751 0.2893844), wk = 0.0037879 k( 227) = ( 0.5000000 0.2886751 0.2733075), wk = 0.0037879 k( 228) = ( 0.5000000 0.2886751 0.2572306), wk = 0.0037879 k( 229) = ( 0.5000000 0.2886751 0.2411537), wk = 0.0037879 k( 230) = ( 0.5000000 0.2886751 0.2250768), wk = 0.0037879 k( 231) = ( 0.5000000 0.2886751 0.2089999), wk = 0.0037879 k( 232) = ( 0.5000000 0.2886751 0.1929230), wk = 0.0037879 k( 233) = ( 0.5000000 0.2886751 0.1768460), wk = 0.0037879 k( 234) = ( 0.5000000 0.2886751 0.1607691), wk = 0.0037879 k( 235) = ( 0.5000000 0.2886751 0.1446922), wk = 0.0037879 k( 236) = ( 0.5000000 0.2886751 0.1286153), wk = 0.0037879 k( 237) = ( 0.5000000 0.2886751 0.1125384), wk = 0.0037879 k( 238) = ( 0.5000000 0.2886751 0.0964615), wk = 0.0037879 k( 239) = ( 0.5000000 0.2886751 0.0803846), wk = 0.0037879 k( 240) = ( 0.5000000 0.2886751 0.0643077), wk = 0.0037879 k( 241) = ( 0.5000000 0.2886751 0.0482307), wk = 0.0037879 k( 242) = ( 0.5000000 0.2886751 0.0321538), wk = 0.0037879 k( 243) = ( 0.5000000 0.2886751 0.0160769), wk = 0.0037879 k( 244) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037879 k( 245) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037879 k( 246) = ( 0.3333333 0.5773503 0.0160769), wk = 0.0037879 k( 247) = ( 0.3333333 0.5773503 0.0321538), wk = 0.0037879 k( 248) = ( 0.3333333 0.5773503 0.0482307), wk = 0.0037879 k( 249) = ( 0.3333333 0.5773503 0.0643077), wk = 0.0037879 k( 250) = ( 0.3333333 0.5773503 0.0803846), wk = 0.0037879 k( 251) = ( 0.3333333 0.5773503 0.0964615), wk = 0.0037879 k( 252) = ( 0.3333333 0.5773503 0.1125384), wk = 0.0037879 k( 253) = ( 0.3333333 0.5773503 0.1286153), wk = 0.0037879 k( 254) = ( 0.3333333 0.5773503 0.1446922), wk = 0.0037879 k( 255) = ( 0.3333333 0.5773503 0.1607691), wk = 0.0037879 k( 256) = ( 0.3333333 0.5773503 0.1768460), wk = 0.0037879 k( 257) = ( 0.3333333 0.5773503 0.1929230), wk = 0.0037879 k( 258) = ( 0.3333333 0.5773503 0.2089999), wk = 0.0037879 k( 259) = ( 0.3333333 0.5773503 0.2250768), wk = 0.0037879 k( 260) = ( 0.3333333 0.5773503 0.2411537), wk = 0.0037879 k( 261) = ( 0.3333333 0.5773503 0.2572306), wk = 0.0037879 k( 262) = ( 0.3333333 0.5773503 0.2733075), wk = 0.0037879 k( 263) = ( 0.3333333 0.5773503 0.2893844), wk = 0.0037879 k( 264) = ( 0.3333333 0.5773503 0.3054613), wk = 0.0037879 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 2) = ( 0.0138889 0.0000000 0.0000000), wk = 0.0037879 k( 3) = ( 0.0277778 0.0000000 0.0000000), wk = 0.0037879 k( 4) = ( 0.0416667 0.0000000 -0.0000000), wk = 0.0037879 k( 5) = ( 0.0555556 0.0000000 0.0000000), wk = 0.0037879 k( 6) = ( 0.0694444 0.0000000 0.0000000), wk = 0.0037879 k( 7) = ( 0.0833333 0.0000000 0.0000000), wk = 0.0037879 k( 8) = ( 0.0972222 0.0000000 -0.0000000), wk = 0.0037879 k( 9) = ( 0.1111111 0.0000000 -0.0000000), wk = 0.0037879 k( 10) = ( 0.1250000 0.0000000 -0.0000000), wk = 0.0037879 k( 11) = ( 0.1388889 0.0000000 -0.0000000), wk = 0.0037879 k( 12) = ( 0.1527778 0.0000000 0.0000000), wk = 0.0037879 k( 13) = ( 0.1666667 0.0000000 -0.0000000), wk = 0.0037879 k( 14) = ( 0.1805556 0.0000000 0.0000000), wk = 0.0037879 k( 15) = ( 0.1944444 0.0000000 -0.0000000), wk = 0.0037879 k( 16) = ( 0.2083333 0.0000000 -0.0000000), wk = 0.0037879 k( 17) = ( 0.2222222 0.0000000 -0.0000000), wk = 0.0037879 k( 18) = ( 0.2361111 0.0000000 -0.0000000), wk = 0.0037879 k( 19) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0037879 k( 20) = ( 0.2638889 0.0000000 0.0000000), wk = 0.0037879 k( 21) = ( 0.2777778 0.0000000 -0.0000000), wk = 0.0037879 k( 22) = ( 0.2916667 0.0000000 -0.0000000), wk = 0.0037879 k( 23) = ( 0.3055556 0.0000000 0.0000000), wk = 0.0037879 k( 24) = ( 0.3194444 0.0000000 -0.0000000), wk = 0.0037879 k( 25) = ( 0.3333333 0.0000000 0.0000000), wk = 0.0037879 k( 26) = ( 0.3472222 0.0000000 0.0000000), wk = 0.0037879 k( 27) = ( 0.3611111 0.0000000 -0.0000000), wk = 0.0037879 k( 28) = ( 0.3750000 0.0000000 -0.0000000), wk = 0.0037879 k( 29) = ( 0.3888889 0.0000000 -0.0000000), wk = 0.0037879 k( 30) = ( 0.4027778 0.0000000 0.0000000), wk = 0.0037879 k( 31) = ( 0.4166667 0.0000000 0.0000000), wk = 0.0037879 k( 32) = ( 0.4305556 0.0000000 -0.0000000), wk = 0.0037879 k( 33) = ( 0.4444444 0.0000000 -0.0000000), wk = 0.0037879 k( 34) = ( 0.4583333 0.0000000 0.0000000), wk = 0.0037879 k( 35) = ( 0.4722222 0.0000000 -0.0000000), wk = 0.0037879 k( 36) = ( 0.4861111 0.0000000 -0.0000000), wk = 0.0037879 k( 37) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037879 k( 38) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037879 k( 39) = ( 0.4920635 0.0158730 -0.0000000), wk = 0.0037879 k( 40) = ( 0.4841270 0.0317460 -0.0000000), wk = 0.0037879 k( 41) = ( 0.4761905 0.0476191 -0.0000000), wk = 0.0037879 k( 42) = ( 0.4682540 0.0634921 -0.0000000), wk = 0.0037879 k( 43) = ( 0.4603175 0.0793651 0.0000000), wk = 0.0037879 k( 44) = ( 0.4523810 0.0952381 -0.0000000), wk = 0.0037879 k( 45) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0037879 k( 46) = ( 0.4365079 0.1269841 0.0000000), wk = 0.0037879 k( 47) = ( 0.4285714 0.1428571 0.0000000), wk = 0.0037879 k( 48) = ( 0.4206349 0.1587302 0.0000000), wk = 0.0037879 k( 49) = ( 0.4126984 0.1746032 -0.0000000), wk = 0.0037879 k( 50) = ( 0.4047619 0.1904762 0.0000000), wk = 0.0037879 k( 51) = ( 0.3968254 0.2063492 0.0000000), wk = 0.0037879 k( 52) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0037879 k( 53) = ( 0.3809524 0.2380952 0.0000000), wk = 0.0037879 k( 54) = ( 0.3730159 0.2539683 0.0000000), wk = 0.0037879 k( 55) = ( 0.3650794 0.2698413 0.0000000), wk = 0.0037879 k( 56) = ( 0.3571429 0.2857143 -0.0000000), wk = 0.0037879 k( 57) = ( 0.3492063 0.3015873 -0.0000000), wk = 0.0037879 k( 58) = ( 0.3412698 0.3174603 -0.0000000), wk = 0.0037879 k( 59) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037879 k( 60) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037879 k( 61) = ( 0.3253968 0.3253968 -0.0000000), wk = 0.0037879 k( 62) = ( 0.3174603 0.3174603 0.0000000), wk = 0.0037879 k( 63) = ( 0.3095238 0.3095238 0.0000000), wk = 0.0037879 k( 64) = ( 0.3015873 0.3015873 0.0000000), wk = 0.0037879 k( 65) = ( 0.2936508 0.2936508 -0.0000000), wk = 0.0037879 k( 66) = ( 0.2857143 0.2857143 0.0000000), wk = 0.0037879 k( 67) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0037879 k( 68) = ( 0.2698413 0.2698413 0.0000000), wk = 0.0037879 k( 69) = ( 0.2619048 0.2619048 0.0000000), wk = 0.0037879 k( 70) = ( 0.2539683 0.2539683 0.0000000), wk = 0.0037879 k( 71) = ( 0.2460317 0.2460318 -0.0000000), wk = 0.0037879 k( 72) = ( 0.2380952 0.2380952 0.0000000), wk = 0.0037879 k( 73) = ( 0.2301587 0.2301587 -0.0000000), wk = 0.0037879 k( 74) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0037879 k( 75) = ( 0.2142857 0.2142857 0.0000000), wk = 0.0037879 k( 76) = ( 0.2063492 0.2063492 0.0000000), wk = 0.0037879 k( 77) = ( 0.1984127 0.1984127 0.0000000), wk = 0.0037879 k( 78) = ( 0.1904762 0.1904762 0.0000000), wk = 0.0037879 k( 79) = ( 0.1825397 0.1825397 0.0000000), wk = 0.0037879 k( 80) = ( 0.1746032 0.1746032 -0.0000000), wk = 0.0037879 k( 81) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0037879 k( 82) = ( 0.1587302 0.1587302 0.0000000), wk = 0.0037879 k( 83) = ( 0.1507937 0.1507937 0.0000000), wk = 0.0037879 k( 84) = ( 0.1428571 0.1428571 0.0000000), wk = 0.0037879 k( 85) = ( 0.1349206 0.1349206 0.0000000), wk = 0.0037879 k( 86) = ( 0.1269841 0.1269841 0.0000000), wk = 0.0037879 k( 87) = ( 0.1190476 0.1190476 0.0000000), wk = 0.0037879 k( 88) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0037879 k( 89) = ( 0.1031746 0.1031746 0.0000000), wk = 0.0037879 k( 90) = ( 0.0952381 0.0952381 -0.0000000), wk = 0.0037879 k( 91) = ( 0.0873016 0.0873016 0.0000000), wk = 0.0037879 k( 92) = ( 0.0793651 0.0793651 0.0000000), wk = 0.0037879 k( 93) = ( 0.0714286 0.0714286 0.0000000), wk = 0.0037879 k( 94) = ( 0.0634921 0.0634921 0.0000000), wk = 0.0037879 k( 95) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0037879 k( 96) = ( 0.0476191 0.0476191 -0.0000000), wk = 0.0037879 k( 97) = ( 0.0396825 0.0396825 0.0000000), wk = 0.0037879 k( 98) = ( 0.0317460 0.0317460 0.0000000), wk = 0.0037879 k( 99) = ( 0.0238095 0.0238095 0.0000000), wk = 0.0037879 k( 100) = ( 0.0158730 0.0158730 0.0000000), wk = 0.0037879 k( 101) = ( 0.0079365 0.0079365 0.0000000), wk = 0.0037879 k( 102) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 103) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037879 k( 104) = ( 0.0000000 0.0000000 0.0263158), wk = 0.0037879 k( 105) = ( 0.0000000 0.0000000 0.0526316), wk = 0.0037879 k( 106) = ( 0.0000000 0.0000000 0.0789474), wk = 0.0037879 k( 107) = ( 0.0000000 0.0000000 0.1052632), wk = 0.0037879 k( 108) = ( 0.0000000 0.0000000 0.1315790), wk = 0.0037879 k( 109) = ( 0.0000000 0.0000000 0.1578947), wk = 0.0037879 k( 110) = ( 0.0000000 0.0000000 0.1842105), wk = 0.0037879 k( 111) = ( 0.0000000 0.0000000 0.2105263), wk = 0.0037879 k( 112) = ( 0.0000000 0.0000000 0.2368421), wk = 0.0037879 k( 113) = ( 0.0000000 0.0000000 0.2631579), wk = 0.0037879 k( 114) = ( 0.0000000 0.0000000 0.2894737), wk = 0.0037879 k( 115) = ( 0.0000000 0.0000000 0.3157895), wk = 0.0037879 k( 116) = ( 0.0000000 0.0000000 0.3421053), wk = 0.0037879 k( 117) = ( 0.0000000 0.0000000 0.3684211), wk = 0.0037879 k( 118) = ( 0.0000000 0.0000000 0.3947368), wk = 0.0037879 k( 119) = ( 0.0000000 0.0000000 0.4210526), wk = 0.0037879 k( 120) = ( 0.0000000 0.0000000 0.4473684), wk = 0.0037879 k( 121) = ( 0.0000000 0.0000000 0.4736842), wk = 0.0037879 k( 122) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 123) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 124) = ( 0.0138889 0.0000000 0.5000000), wk = 0.0037879 k( 125) = ( 0.0277778 0.0000000 0.5000000), wk = 0.0037879 k( 126) = ( 0.0416667 0.0000000 0.5000000), wk = 0.0037879 k( 127) = ( 0.0555556 0.0000000 0.5000000), wk = 0.0037879 k( 128) = ( 0.0694444 0.0000000 0.5000000), wk = 0.0037879 k( 129) = ( 0.0833333 0.0000000 0.5000000), wk = 0.0037879 k( 130) = ( 0.0972222 0.0000000 0.5000000), wk = 0.0037879 k( 131) = ( 0.1111111 0.0000000 0.5000000), wk = 0.0037879 k( 132) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0037879 k( 133) = ( 0.1388889 0.0000000 0.5000000), wk = 0.0037879 k( 134) = ( 0.1527778 0.0000000 0.5000000), wk = 0.0037879 k( 135) = ( 0.1666667 0.0000000 0.5000000), wk = 0.0037879 k( 136) = ( 0.1805556 0.0000000 0.5000000), wk = 0.0037879 k( 137) = ( 0.1944444 0.0000000 0.5000000), wk = 0.0037879 k( 138) = ( 0.2083333 0.0000000 0.5000000), wk = 0.0037879 k( 139) = ( 0.2222222 0.0000000 0.5000000), wk = 0.0037879 k( 140) = ( 0.2361111 0.0000000 0.5000000), wk = 0.0037879 k( 141) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0037879 k( 142) = ( 0.2638889 0.0000000 0.5000000), wk = 0.0037879 k( 143) = ( 0.2777778 0.0000000 0.5000000), wk = 0.0037879 k( 144) = ( 0.2916667 0.0000000 0.5000000), wk = 0.0037879 k( 145) = ( 0.3055556 0.0000000 0.5000000), wk = 0.0037879 k( 146) = ( 0.3194444 0.0000000 0.5000000), wk = 0.0037879 k( 147) = ( 0.3333333 0.0000000 0.5000000), wk = 0.0037879 k( 148) = ( 0.3472222 0.0000000 0.5000000), wk = 0.0037879 k( 149) = ( 0.3611111 0.0000000 0.5000000), wk = 0.0037879 k( 150) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0037879 k( 151) = ( 0.3888889 0.0000000 0.5000000), wk = 0.0037879 k( 152) = ( 0.4027778 0.0000000 0.5000000), wk = 0.0037879 k( 153) = ( 0.4166667 0.0000000 0.5000000), wk = 0.0037879 k( 154) = ( 0.4305556 0.0000000 0.5000000), wk = 0.0037879 k( 155) = ( 0.4444444 0.0000000 0.5000000), wk = 0.0037879 k( 156) = ( 0.4583333 0.0000000 0.5000000), wk = 0.0037879 k( 157) = ( 0.4722222 0.0000000 0.5000000), wk = 0.0037879 k( 158) = ( 0.4861111 0.0000000 0.5000000), wk = 0.0037879 k( 159) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037879 k( 160) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037879 k( 161) = ( 0.4920635 0.0158730 0.5000000), wk = 0.0037879 k( 162) = ( 0.4841270 0.0317460 0.5000000), wk = 0.0037879 k( 163) = ( 0.4761905 0.0476191 0.5000000), wk = 0.0037879 k( 164) = ( 0.4682540 0.0634921 0.5000000), wk = 0.0037879 k( 165) = ( 0.4603175 0.0793651 0.5000000), wk = 0.0037879 k( 166) = ( 0.4523810 0.0952381 0.5000000), wk = 0.0037879 k( 167) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0037879 k( 168) = ( 0.4365079 0.1269841 0.5000000), wk = 0.0037879 k( 169) = ( 0.4285714 0.1428571 0.5000000), wk = 0.0037879 k( 170) = ( 0.4206349 0.1587302 0.5000000), wk = 0.0037879 k( 171) = ( 0.4126984 0.1746032 0.5000000), wk = 0.0037879 k( 172) = ( 0.4047619 0.1904762 0.5000000), wk = 0.0037879 k( 173) = ( 0.3968254 0.2063492 0.5000000), wk = 0.0037879 k( 174) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0037879 k( 175) = ( 0.3809524 0.2380952 0.5000000), wk = 0.0037879 k( 176) = ( 0.3730159 0.2539683 0.5000000), wk = 0.0037879 k( 177) = ( 0.3650794 0.2698413 0.5000000), wk = 0.0037879 k( 178) = ( 0.3571429 0.2857143 0.5000000), wk = 0.0037879 k( 179) = ( 0.3492063 0.3015873 0.5000000), wk = 0.0037879 k( 180) = ( 0.3412698 0.3174603 0.5000000), wk = 0.0037879 k( 181) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037879 k( 182) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037879 k( 183) = ( 0.3253968 0.3253968 0.5000000), wk = 0.0037879 k( 184) = ( 0.3174603 0.3174603 0.5000000), wk = 0.0037879 k( 185) = ( 0.3095238 0.3095238 0.5000000), wk = 0.0037879 k( 186) = ( 0.3015873 0.3015873 0.5000000), wk = 0.0037879 k( 187) = ( 0.2936508 0.2936508 0.5000000), wk = 0.0037879 k( 188) = ( 0.2857143 0.2857143 0.5000000), wk = 0.0037879 k( 189) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0037879 k( 190) = ( 0.2698413 0.2698413 0.5000000), wk = 0.0037879 k( 191) = ( 0.2619048 0.2619048 0.5000000), wk = 0.0037879 k( 192) = ( 0.2539683 0.2539683 0.5000000), wk = 0.0037879 k( 193) = ( 0.2460317 0.2460318 0.5000000), wk = 0.0037879 k( 194) = ( 0.2380952 0.2380952 0.5000000), wk = 0.0037879 k( 195) = ( 0.2301587 0.2301587 0.5000000), wk = 0.0037879 k( 196) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0037879 k( 197) = ( 0.2142857 0.2142857 0.5000000), wk = 0.0037879 k( 198) = ( 0.2063492 0.2063492 0.5000000), wk = 0.0037879 k( 199) = ( 0.1984127 0.1984127 0.5000000), wk = 0.0037879 k( 200) = ( 0.1904762 0.1904762 0.5000000), wk = 0.0037879 k( 201) = ( 0.1825397 0.1825397 0.5000000), wk = 0.0037879 k( 202) = ( 0.1746032 0.1746032 0.5000000), wk = 0.0037879 k( 203) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0037879 k( 204) = ( 0.1587302 0.1587302 0.5000000), wk = 0.0037879 k( 205) = ( 0.1507937 0.1507937 0.5000000), wk = 0.0037879 k( 206) = ( 0.1428571 0.1428571 0.5000000), wk = 0.0037879 k( 207) = ( 0.1349206 0.1349206 0.5000000), wk = 0.0037879 k( 208) = ( 0.1269841 0.1269841 0.5000000), wk = 0.0037879 k( 209) = ( 0.1190476 0.1190476 0.5000000), wk = 0.0037879 k( 210) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0037879 k( 211) = ( 0.1031746 0.1031746 0.5000000), wk = 0.0037879 k( 212) = ( 0.0952381 0.0952381 0.5000000), wk = 0.0037879 k( 213) = ( 0.0873016 0.0873016 0.5000000), wk = 0.0037879 k( 214) = ( 0.0793651 0.0793651 0.5000000), wk = 0.0037879 k( 215) = ( 0.0714286 0.0714286 0.5000000), wk = 0.0037879 k( 216) = ( 0.0634921 0.0634921 0.5000000), wk = 0.0037879 k( 217) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0037879 k( 218) = ( 0.0476191 0.0476191 0.5000000), wk = 0.0037879 k( 219) = ( 0.0396825 0.0396825 0.5000000), wk = 0.0037879 k( 220) = ( 0.0317460 0.0317460 0.5000000), wk = 0.0037879 k( 221) = ( 0.0238095 0.0238095 0.5000000), wk = 0.0037879 k( 222) = ( 0.0158730 0.0158730 0.5000000), wk = 0.0037879 k( 223) = ( 0.0079365 0.0079365 0.5000000), wk = 0.0037879 k( 224) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037879 k( 225) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037879 k( 226) = ( 0.5000000 0.0000000 0.4736842), wk = 0.0037879 k( 227) = ( 0.5000000 0.0000000 0.4473684), wk = 0.0037879 k( 228) = ( 0.5000000 0.0000000 0.4210526), wk = 0.0037879 k( 229) = ( 0.5000000 0.0000000 0.3947368), wk = 0.0037879 k( 230) = ( 0.5000000 0.0000000 0.3684211), wk = 0.0037879 k( 231) = ( 0.5000000 0.0000000 0.3421053), wk = 0.0037879 k( 232) = ( 0.5000000 0.0000000 0.3157895), wk = 0.0037879 k( 233) = ( 0.5000000 0.0000000 0.2894737), wk = 0.0037879 k( 234) = ( 0.5000000 0.0000000 0.2631579), wk = 0.0037879 k( 235) = ( 0.5000000 0.0000000 0.2368421), wk = 0.0037879 k( 236) = ( 0.5000000 0.0000000 0.2105263), wk = 0.0037879 k( 237) = ( 0.5000000 0.0000000 0.1842105), wk = 0.0037879 k( 238) = ( 0.5000000 0.0000000 0.1578947), wk = 0.0037879 k( 239) = ( 0.5000000 0.0000000 0.1315790), wk = 0.0037879 k( 240) = ( 0.5000000 0.0000000 0.1052632), wk = 0.0037879 k( 241) = ( 0.5000000 0.0000000 0.0789474), wk = 0.0037879 k( 242) = ( 0.5000000 0.0000000 0.0526316), wk = 0.0037879 k( 243) = ( 0.5000000 0.0000000 0.0263158), wk = 0.0037879 k( 244) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0037879 k( 245) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037879 k( 246) = ( 0.3333333 0.3333333 0.0263158), wk = 0.0037879 k( 247) = ( 0.3333333 0.3333333 0.0526316), wk = 0.0037879 k( 248) = ( 0.3333333 0.3333333 0.0789474), wk = 0.0037879 k( 249) = ( 0.3333333 0.3333333 0.1052632), wk = 0.0037879 k( 250) = ( 0.3333333 0.3333333 0.1315790), wk = 0.0037879 k( 251) = ( 0.3333333 0.3333333 0.1578947), wk = 0.0037879 k( 252) = ( 0.3333333 0.3333333 0.1842105), wk = 0.0037879 k( 253) = ( 0.3333333 0.3333333 0.2105263), wk = 0.0037879 k( 254) = ( 0.3333333 0.3333333 0.2368421), wk = 0.0037879 k( 255) = ( 0.3333333 0.3333333 0.2631579), wk = 0.0037879 k( 256) = ( 0.3333333 0.3333333 0.2894737), wk = 0.0037879 k( 257) = ( 0.3333333 0.3333333 0.3157895), wk = 0.0037879 k( 258) = ( 0.3333333 0.3333333 0.3421053), wk = 0.0037879 k( 259) = ( 0.3333333 0.3333333 0.3684211), wk = 0.0037879 k( 260) = ( 0.3333333 0.3333333 0.3947368), wk = 0.0037879 k( 261) = ( 0.3333333 0.3333333 0.4210526), wk = 0.0037879 k( 262) = ( 0.3333333 0.3333333 0.4473684), wk = 0.0037879 k( 263) = ( 0.3333333 0.3333333 0.4736842), wk = 0.0037879 k( 264) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037879 Dense grid: 124879 G-vectors FFT dimensions: ( 60, 60, 96) Smooth grid: 55125 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.34 Mb ( 296, 76) NL pseudopotentials 0.56 Mb ( 148, 248) Each V/rho on FFT grid 0.11 Mb ( 7200) Each G-vector array 0.02 Mb ( 2603) G-vector shells 0.01 Mb ( 1323) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.37 Mb ( 296, 304) Each subspace H/S matrix 1.41 Mb ( 304, 304) Each matrix 0.58 Mb ( 248, 2, 76) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./AlPO4.save/charge-density.dat Starting wfc are 96 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 48.8 secs Computing kpt #: 2 total cpu time spent up to now is 54.4 secs Computing kpt #: 3 total cpu time spent up to now is 60.0 secs Computing kpt #: 4 total cpu time spent up to now is 65.3 secs Computing kpt #: 5 total cpu time spent up to now is 71.4 secs Computing kpt #: 6 total cpu time spent up to now is 76.8 secs Computing kpt #: 7 total cpu time spent up to now is 82.0 secs Computing kpt #: 8 total cpu time spent up to now is 87.8 secs Computing kpt #: 9 total cpu time spent up to now is 93.6 secs Computing kpt #: 10 total cpu time spent up to now is 99.9 secs Computing kpt #: 11 total cpu time spent up to now is 106.2 secs Computing kpt #: 12 total cpu time spent up to now is 112.8 secs Computing kpt #: 13 total cpu time spent up to now is 119.6 secs Computing kpt #: 14 total cpu time spent up to now is 128.0 secs Computing kpt #: 15 total cpu time spent up to now is 140.1 secs Computing kpt #: 16 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 151.1 secs Computing kpt #: 17 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 161.9 secs Computing kpt #: 18 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 172.8 secs Computing kpt #: 19 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 183.7 secs Computing kpt #: 20 total cpu time spent up to now is 194.4 secs Computing kpt #: 21 total cpu time spent up to now is 203.3 secs Computing kpt #: 22 total cpu time spent up to now is 211.9 secs Computing kpt #: 23 total cpu time spent up to now is 221.0 secs Computing kpt #: 24 total cpu time spent up to now is 230.2 secs Computing kpt #: 25 total cpu time spent up to now is 238.5 secs Computing kpt #: 26 total cpu time spent up to now is 246.9 secs Computing kpt #: 27 total cpu time spent up to now is 255.2 secs Computing kpt #: 28 total cpu time spent up to now is 263.1 secs Computing kpt #: 29 total cpu time spent up to now is 270.2 secs Computing kpt #: 30 total cpu time spent up to now is 277.6 secs Computing kpt #: 31 total cpu time spent up to now is 285.4 secs Computing kpt #: 32 total cpu time spent up to now is 292.4 secs Computing kpt #: 33 total cpu time spent up to now is 299.6 secs Computing kpt #: 34 total cpu time spent up to now is 306.6 secs Computing kpt #: 35 total cpu time spent up to now is 313.4 secs Computing kpt #: 36 total cpu time spent up to now is 320.0 secs Computing kpt #: 37 total cpu time spent up to now is 326.8 secs Computing kpt #: 38 total cpu time spent up to now is 333.3 secs Computing kpt #: 39 total cpu time spent up to now is 339.8 secs Computing kpt #: 40 total cpu time spent up to now is 346.4 secs Computing kpt #: 41 total cpu time spent up to now is 353.0 secs Computing kpt #: 42 total cpu time spent up to now is 359.6 secs Computing kpt #: 43 total cpu time spent up to now is 366.2 secs Computing kpt #: 44 total cpu time spent up to now is 372.8 secs Computing kpt #: 45 total cpu time spent up to now is 379.5 secs Computing kpt #: 46 total cpu time spent up to now is 386.6 secs Computing kpt #: 47 total cpu time spent up to now is 393.9 secs Computing kpt #: 48 total cpu time spent up to now is 401.1 secs Computing kpt #: 49 total cpu time spent up to now is 408.5 secs Computing kpt #: 50 total cpu time spent up to now is 416.0 secs Computing kpt #: 51 total cpu time spent up to now is 423.3 secs Computing kpt #: 52 total cpu time spent up to now is 432.3 secs Computing kpt #: 53 total cpu time spent up to now is 442.5 secs Computing kpt #: 54 total cpu time spent up to now is 450.5 secs Computing kpt #: 55 total cpu time spent up to now is 460.8 secs Computing kpt #: 56 total cpu time spent up to now is 471.1 secs Computing kpt #: 57 total cpu time spent up to now is 479.9 secs Computing kpt #: 58 total cpu time spent up to now is 489.0 secs Computing kpt #: 59 total cpu time spent up to now is 498.6 secs Computing kpt #: 60 total cpu time spent up to now is 508.4 secs Computing kpt #: 61 total cpu time spent up to now is 519.7 secs Computing kpt #: 62 total cpu time spent up to now is 528.4 secs Computing kpt #: 63 total cpu time spent up to now is 537.4 secs Computing kpt #: 64 total cpu time spent up to now is 546.3 secs Computing kpt #: 65 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 557.7 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 568.6 secs Computing kpt #: 67 total cpu time spent up to now is 577.8 secs Computing kpt #: 68 total cpu time spent up to now is 585.9 secs Computing kpt #: 69 total cpu time spent up to now is 593.4 secs Computing kpt #: 70 total cpu time spent up to now is 600.8 secs Computing kpt #: 71 total cpu time spent up to now is 608.2 secs Computing kpt #: 72 total cpu time spent up to now is 615.1 secs Computing kpt #: 73 total cpu time spent up to now is 621.9 secs Computing kpt #: 74 total cpu time spent up to now is 628.9 secs Computing kpt #: 75 total cpu time spent up to now is 635.7 secs Computing kpt #: 76 total cpu time spent up to now is 642.3 secs Computing kpt #: 77 total cpu time spent up to now is 649.0 secs Computing kpt #: 78 total cpu time spent up to now is 655.7 secs Computing kpt #: 79 total cpu time spent up to now is 662.9 secs Computing kpt #: 80 total cpu time spent up to now is 670.3 secs Computing kpt #: 81 total cpu time spent up to now is 677.7 secs Computing kpt #: 82 total cpu time spent up to now is 686.6 secs Computing kpt #: 83 total cpu time spent up to now is 695.7 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 706.7 secs Computing kpt #: 85 total cpu time spent up to now is 717.4 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 728.3 secs Computing kpt #: 87 total cpu time spent up to now is 739.4 secs Computing kpt #: 88 total cpu time spent up to now is 748.9 secs Computing kpt #: 89 total cpu time spent up to now is 758.1 secs Computing kpt #: 90 total cpu time spent up to now is 766.4 secs Computing kpt #: 91 total cpu time spent up to now is 774.0 secs Computing kpt #: 92 total cpu time spent up to now is 780.3 secs Computing kpt #: 93 total cpu time spent up to now is 786.7 secs Computing kpt #: 94 total cpu time spent up to now is 793.1 secs Computing kpt #: 95 total cpu time spent up to now is 799.0 secs Computing kpt #: 96 total cpu time spent up to now is 804.6 secs Computing kpt #: 97 total cpu time spent up to now is 810.4 secs Computing kpt #: 98 total cpu time spent up to now is 816.2 secs Computing kpt #: 99 total cpu time spent up to now is 821.9 secs Computing kpt #: 100 total cpu time spent up to now is 827.5 secs Computing kpt #: 101 total cpu time spent up to now is 833.1 secs Computing kpt #: 102 total cpu time spent up to now is 838.7 secs Computing kpt #: 103 total cpu time spent up to now is 844.1 secs Computing kpt #: 104 total cpu time spent up to now is 849.7 secs Computing kpt #: 105 total cpu time spent up to now is 855.9 secs Computing kpt #: 106 total cpu time spent up to now is 861.6 secs Computing kpt #: 107 total cpu time spent up to now is 867.8 secs Computing kpt #: 108 total cpu time spent up to now is 873.7 secs Computing kpt #: 109 total cpu time spent up to now is 879.9 secs Computing kpt #: 110 total cpu time spent up to now is 886.2 secs Computing kpt #: 111 total cpu time spent up to now is 892.5 secs Computing kpt #: 112 total cpu time spent up to now is 898.9 secs Computing kpt #: 113 total cpu time spent up to now is 905.4 secs Computing kpt #: 114 total cpu time spent up to now is 911.8 secs Computing kpt #: 115 total cpu time spent up to now is 918.3 secs Computing kpt #: 116 total cpu time spent up to now is 924.9 secs Computing kpt #: 117 total cpu time spent up to now is 931.4 secs Computing kpt #: 118 total cpu time spent up to now is 938.0 secs Computing kpt #: 119 total cpu time spent up to now is 945.5 secs Computing kpt #: 120 total cpu time spent up to now is 953.5 secs Computing kpt #: 121 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 964.5 secs Computing kpt #: 122 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 975.8 secs Computing kpt #: 123 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 986.8 secs Computing kpt #: 124 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 998.6 secs Computing kpt #: 125 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1010.3 secs Computing kpt #: 126 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1022.0 secs Computing kpt #: 127 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1033.8 secs Computing kpt #: 128 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1047.8 secs Computing kpt #: 129 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1059.6 secs Computing kpt #: 130 total cpu time spent up to now is 1069.7 secs Computing kpt #: 131 total cpu time spent up to now is 1079.0 secs Computing kpt #: 132 total cpu time spent up to now is 1087.1 secs Computing kpt #: 133 total cpu time spent up to now is 1094.2 secs Computing kpt #: 134 total cpu time spent up to now is 1101.4 secs Computing kpt #: 135 total cpu time spent up to now is 1108.3 secs Computing kpt #: 136 total cpu time spent up to now is 1115.0 secs Computing kpt #: 137 total cpu time spent up to now is 1121.7 secs Computing kpt #: 138 total cpu time spent up to now is 1128.6 secs Computing kpt #: 139 total cpu time spent up to now is 1135.2 secs Computing kpt #: 140 total cpu time spent up to now is 1141.7 secs Computing kpt #: 141 total cpu time spent up to now is 1148.3 secs Computing kpt #: 142 total cpu time spent up to now is 1154.9 secs Computing kpt #: 143 total cpu time spent up to now is 1161.0 secs Computing kpt #: 144 total cpu time spent up to now is 1167.3 secs Computing kpt #: 145 total cpu time spent up to now is 1173.5 secs Computing kpt #: 146 total cpu time spent up to now is 1180.0 secs Computing kpt #: 147 total cpu time spent up to now is 1186.4 secs Computing kpt #: 148 total cpu time spent up to now is 1192.7 secs Computing kpt #: 149 total cpu time spent up to now is 1199.2 secs Computing kpt #: 150 total cpu time spent up to now is 1205.9 secs Computing kpt #: 151 total cpu time spent up to now is 1212.0 secs Computing kpt #: 152 total cpu time spent up to now is 1218.2 secs Computing kpt #: 153 total cpu time spent up to now is 1224.6 secs Computing kpt #: 154 total cpu time spent up to now is 1230.8 secs Computing kpt #: 155 total cpu time spent up to now is 1237.2 secs Computing kpt #: 156 total cpu time spent up to now is 1243.2 secs Computing kpt #: 157 total cpu time spent up to now is 1249.5 secs Computing kpt #: 158 total cpu time spent up to now is 1255.9 secs Computing kpt #: 159 total cpu time spent up to now is 1262.0 secs Computing kpt #: 160 total cpu time spent up to now is 1268.3 secs Computing kpt #: 161 total cpu time spent up to now is 1275.0 secs Computing kpt #: 162 total cpu time spent up to now is 1281.3 secs Computing kpt #: 163 total cpu time spent up to now is 1288.1 secs Computing kpt #: 164 total cpu time spent up to now is 1294.5 secs Computing kpt #: 165 total cpu time spent up to now is 1301.0 secs Computing kpt #: 166 total cpu time spent up to now is 1307.5 secs Computing kpt #: 167 total cpu time spent up to now is 1313.9 secs Computing kpt #: 168 total cpu time spent up to now is 1320.5 secs Computing kpt #: 169 total cpu time spent up to now is 1326.9 secs Computing kpt #: 170 total cpu time spent up to now is 1333.5 secs Computing kpt #: 171 total cpu time spent up to now is 1341.1 secs Computing kpt #: 172 total cpu time spent up to now is 1347.7 secs Computing kpt #: 173 total cpu time spent up to now is 1353.9 secs Computing kpt #: 174 total cpu time spent up to now is 1360.0 secs Computing kpt #: 175 total cpu time spent up to now is 1366.1 secs Computing kpt #: 176 total cpu time spent up to now is 1372.0 secs Computing kpt #: 177 total cpu time spent up to now is 1377.8 secs Computing kpt #: 178 total cpu time spent up to now is 1383.5 secs Computing kpt #: 179 total cpu time spent up to now is 1388.9 secs Computing kpt #: 180 total cpu time spent up to now is 1394.3 secs Computing kpt #: 181 total cpu time spent up to now is 1399.5 secs Computing kpt #: 182 total cpu time spent up to now is 1404.7 secs Computing kpt #: 183 total cpu time spent up to now is 1409.9 secs Computing kpt #: 184 total cpu time spent up to now is 1415.4 secs Computing kpt #: 185 total cpu time spent up to now is 1421.2 secs Computing kpt #: 186 total cpu time spent up to now is 1426.8 secs Computing kpt #: 187 total cpu time spent up to now is 1432.8 secs Computing kpt #: 188 total cpu time spent up to now is 1438.5 secs Computing kpt #: 189 total cpu time spent up to now is 1444.4 secs Computing kpt #: 190 total cpu time spent up to now is 1450.3 secs Computing kpt #: 191 total cpu time spent up to now is 1456.0 secs Computing kpt #: 192 total cpu time spent up to now is 1462.0 secs Computing kpt #: 193 total cpu time spent up to now is 1468.0 secs Computing kpt #: 194 total cpu time spent up to now is 1473.9 secs Computing kpt #: 195 total cpu time spent up to now is 1479.9 secs Computing kpt #: 196 total cpu time spent up to now is 1485.9 secs Computing kpt #: 197 total cpu time spent up to now is 1492.1 secs Computing kpt #: 198 total cpu time spent up to now is 1498.3 secs Computing kpt #: 199 total cpu time spent up to now is 1505.0 secs Computing kpt #: 200 total cpu time spent up to now is 1511.5 secs Computing kpt #: 201 total cpu time spent up to now is 1518.0 secs Computing kpt #: 202 total cpu time spent up to now is 1524.5 secs Computing kpt #: 203 total cpu time spent up to now is 1531.1 secs Computing kpt #: 204 total cpu time spent up to now is 1537.6 secs Computing kpt #: 205 total cpu time spent up to now is 1544.1 secs Computing kpt #: 206 total cpu time spent up to now is 1551.0 secs Computing kpt #: 207 total cpu time spent up to now is 1557.8 secs Computing kpt #: 208 total cpu time spent up to now is 1564.4 secs Computing kpt #: 209 total cpu time spent up to now is 1571.6 secs Computing kpt #: 210 total cpu time spent up to now is 1579.0 secs Computing kpt #: 211 total cpu time spent up to now is 1586.3 secs Computing kpt #: 212 total cpu time spent up to now is 1593.7 secs Computing kpt #: 213 total cpu time spent up to now is 1601.7 secs Computing kpt #: 214 total cpu time spent up to now is 1609.5 secs Computing kpt #: 215 total cpu time spent up to now is 1618.0 secs Computing kpt #: 216 total cpu time spent up to now is 1627.3 secs Computing kpt #: 217 total cpu time spent up to now is 1638.5 secs Computing kpt #: 218 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1650.9 secs Computing kpt #: 219 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1662.7 secs Computing kpt #: 220 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1674.3 secs Computing kpt #: 221 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1686.0 secs Computing kpt #: 222 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1698.1 secs Computing kpt #: 223 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1709.8 secs Computing kpt #: 224 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1720.9 secs Computing kpt #: 225 total cpu time spent up to now is 1727.3 secs Computing kpt #: 226 total cpu time spent up to now is 1733.6 secs Computing kpt #: 227 total cpu time spent up to now is 1740.0 secs Computing kpt #: 228 total cpu time spent up to now is 1746.3 secs Computing kpt #: 229 total cpu time spent up to now is 1752.7 secs Computing kpt #: 230 total cpu time spent up to now is 1759.2 secs Computing kpt #: 231 total cpu time spent up to now is 1765.7 secs Computing kpt #: 232 total cpu time spent up to now is 1772.0 secs Computing kpt #: 233 total cpu time spent up to now is 1778.7 secs Computing kpt #: 234 total cpu time spent up to now is 1785.3 secs Computing kpt #: 235 total cpu time spent up to now is 1792.3 secs Computing kpt #: 236 total cpu time spent up to now is 1799.5 secs Computing kpt #: 237 total cpu time spent up to now is 1806.7 secs Computing kpt #: 238 total cpu time spent up to now is 1813.5 secs Computing kpt #: 239 total cpu time spent up to now is 1820.5 secs Computing kpt #: 240 total cpu time spent up to now is 1827.2 secs Computing kpt #: 241 total cpu time spent up to now is 1833.8 secs Computing kpt #: 242 total cpu time spent up to now is 1840.5 secs Computing kpt #: 243 total cpu time spent up to now is 1847.1 secs Computing kpt #: 244 total cpu time spent up to now is 1853.6 secs Computing kpt #: 245 total cpu time spent up to now is 1863.7 secs Computing kpt #: 246 total cpu time spent up to now is 1871.7 secs Computing kpt #: 247 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1882.4 secs Computing kpt #: 248 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1893.1 secs Computing kpt #: 249 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1904.5 secs Computing kpt #: 250 total cpu time spent up to now is 1914.1 secs Computing kpt #: 251 total cpu time spent up to now is 1920.9 secs Computing kpt #: 252 total cpu time spent up to now is 1927.5 secs Computing kpt #: 253 total cpu time spent up to now is 1933.5 secs Computing kpt #: 254 total cpu time spent up to now is 1941.8 secs Computing kpt #: 255 total cpu time spent up to now is 1947.1 secs Computing kpt #: 256 total cpu time spent up to now is 1952.5 secs Computing kpt #: 257 total cpu time spent up to now is 1957.9 secs Computing kpt #: 258 total cpu time spent up to now is 1963.3 secs Computing kpt #: 259 total cpu time spent up to now is 1968.5 secs Computing kpt #: 260 total cpu time spent up to now is 1973.9 secs Computing kpt #: 261 total cpu time spent up to now is 1979.3 secs Computing kpt #: 262 total cpu time spent up to now is 1984.3 secs Computing kpt #: 263 total cpu time spent up to now is 1989.6 secs Computing kpt #: 264 total cpu time spent up to now is 1994.8 secs ethr = 1.56E-11, avg # of iterations = 57.2 total cpu time spent up to now is 1995.0 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6827 PWs) bands (ev): -20.4320 -20.4320 -20.2671 -20.2671 -17.7510 -17.7510 -17.3847 -17.3847 -17.3465 -17.3465 -17.3385 -17.3385 -17.3304 -17.3304 -17.3230 -17.3230 -9.2541 -9.2541 -8.2520 -8.2520 -6.0268 -6.0268 -5.6119 -5.6119 -5.5900 -5.5900 -5.5821 -5.5821 -5.3320 -5.3320 -5.3225 -5.3225 -2.7249 -2.7249 -2.3509 -2.3509 -2.3509 -2.3509 -2.0573 -2.0573 -2.0519 -2.0519 -1.7258 -1.7258 -1.7055 -1.7055 -1.6672 -1.6672 -1.6384 -1.6384 -1.6314 -1.6314 -0.1445 -0.1445 -0.1341 -0.1341 0.7109 0.7109 0.7249 0.7249 0.7701 0.7701 0.7778 0.7778 6.4055 6.4055 8.6994 8.6994 9.1135 9.1135 9.6138 9.6138 10.3426 10.3426 10.3659 10.3659 k = 0.0139 0.0080-0.0000 ( 6869 PWs) bands (ev): -20.4317 -20.4317 -20.2669 -20.2669 -17.7514 -17.7510 -17.3847 -17.3847 -17.3468 -17.3464 -17.3386 -17.3386 -17.3307 -17.3307 -17.3233 -17.3233 -9.2527 -9.2527 -8.2507 -8.2507 -6.0290 -6.0283 -5.6117 -5.6116 -5.5901 -5.5900 -5.5821 -5.5821 -5.3316 -5.3309 -5.3218 -5.3218 -2.7250 -2.7249 -2.3514 -2.3513 -2.3509 -2.3508 -2.0573 -2.0570 -2.0518 -2.0517 -1.7268 -1.7263 -1.7071 -1.7071 -1.6664 -1.6663 -1.6384 -1.6384 -1.6315 -1.6313 -0.1452 -0.1449 -0.1347 -0.1347 0.7101 0.7102 0.7242 0.7242 0.7687 0.7688 0.7763 0.7764 6.4078 6.4078 8.7006 8.7007 9.1155 9.1155 9.6153 9.6155 10.3435 10.3439 10.3671 10.3671 k = 0.0278 0.0160-0.0000 ( 6873 PWs) bands (ev): -20.4310 -20.4310 -20.2665 -20.2664 -17.7522 -17.7514 -17.3848 -17.3848 -17.3473 -17.3464 -17.3388 -17.3388 -17.3319 -17.3318 -17.3241 -17.3241 -9.2484 -9.2484 -8.2467 -8.2467 -6.0349 -6.0336 -5.6107 -5.6106 -5.5903 -5.5902 -5.5818 -5.5818 -5.3296 -5.3285 -5.3195 -5.3193 -2.7251 -2.7250 -2.3526 -2.3526 -2.3506 -2.3506 -2.0570 -2.0564 -2.0511 -2.0511 -1.7294 -1.7284 -1.7118 -1.7118 -1.6645 -1.6642 -1.6385 -1.6383 -1.6312 -1.6310 -0.1474 -0.1468 -0.1361 -0.1361 0.7078 0.7080 0.7224 0.7224 0.7646 0.7648 0.7717 0.7720 6.4145 6.4145 8.7042 8.7045 9.1214 9.1215 9.6200 9.6206 10.3462 10.3472 10.3709 10.3710 k = 0.0417 0.0241-0.0000 ( 6887 PWs) bands (ev): -20.4298 -20.4298 -20.2658 -20.2657 -17.7533 -17.7520 -17.3849 -17.3849 -17.3479 -17.3466 -17.3393 -17.3392 -17.3341 -17.3340 -17.3250 -17.3250 -9.2414 -9.2414 -8.2401 -8.2400 -6.0444 -6.0425 -5.6093 -5.6092 -5.5913 -5.5912 -5.5806 -5.5806 -5.3265 -5.3251 -5.3155 -5.3150 -2.7254 -2.7253 -2.3547 -2.3547 -2.3503 -2.3502 -2.0567 -2.0557 -2.0499 -2.0497 -1.7337 -1.7322 -1.7188 -1.7188 -1.6625 -1.6619 -1.6388 -1.6382 -1.6300 -1.6299 -0.1515 -0.1507 -0.1379 -0.1379 0.7033 0.7035 0.7196 0.7197 0.7580 0.7584 0.7643 0.7648 6.4257 6.4257 8.7102 8.7106 9.1313 9.1315 9.6280 9.6288 10.3497 10.3513 10.3784 10.3786 k = 0.0556 0.0321-0.0000 ( 6891 PWs) bands (ev): -20.4280 -20.4280 -20.2648 -20.2647 -17.7547 -17.7531 -17.3851 -17.3850 -17.3488 -17.3470 -17.3399 -17.3397 -17.3376 -17.3375 -17.3258 -17.3258 -9.2315 -9.2315 -8.2308 -8.2308 -6.0572 -6.0548 -5.6079 -5.6078 -5.5929 -5.5928 -5.5781 -5.5781 -5.3223 -5.3209 -5.3098 -5.3087 -2.7258 -2.7256 -2.3575 -2.3575 -2.3497 -2.3496 -2.0567 -2.0553 -2.0477 -2.0474 -1.7399 -1.7379 -1.7275 -1.7273 -1.6611 -1.6602 -1.6392 -1.6381 -1.6275 -1.6275 -0.1579 -0.1568 -0.1398 -0.1396 0.6962 0.6965 0.7158 0.7161 0.7495 0.7502 0.7541 0.7551 6.4414 6.4414 8.7184 8.7190 9.1452 9.1454 9.6390 9.6401 10.3532 10.3553 10.3903 10.3907 k = 0.0694 0.0401-0.0000 ( 6899 PWs) bands (ev): -20.4258 -20.4258 -20.2635 -20.2634 -17.7565 -17.7545 -17.3854 -17.3851 -17.3498 -17.3476 -17.3428 -17.3425 -17.3404 -17.3401 -17.3264 -17.3264 -9.2190 -9.2190 -8.2190 -8.2189 -6.0733 -6.0703 -5.6080 -5.6076 -5.5938 -5.5934 -5.5744 -5.5744 -5.3173 -5.3161 -5.3023 -5.3005 -2.7263 -2.7261 -2.3611 -2.3611 -2.3490 -2.3489 -2.0571 -2.0553 -2.0447 -2.0442 -1.7492 -1.7468 -1.7366 -1.7363 -1.6605 -1.6595 -1.6397 -1.6382 -1.6236 -1.6236 -0.1663 -0.1651 -0.1415 -0.1412 0.6866 0.6869 0.7095 0.7100 0.7387 0.7400 0.7431 0.7448 6.4615 6.4615 8.7289 8.7295 9.1630 9.1632 9.6531 9.6544 10.3565 10.3592 10.4068 10.4073 k = 0.0833 0.0481-0.0000 ( 6903 PWs) bands (ev): -20.4232 -20.4232 -20.2620 -20.2618 -17.7586 -17.7562 -17.3858 -17.3853 -17.3512 -17.3490 -17.3485 -17.3483 -17.3412 -17.3408 -17.3269 -17.3269 -9.2037 -9.2037 -8.2046 -8.2045 -6.0922 -6.0888 -5.6110 -5.6103 -5.5922 -5.5915 -5.5697 -5.5697 -5.3116 -5.3105 -5.2932 -5.2909 -2.7269 -2.7266 -2.3653 -2.3653 -2.3480 -2.3479 -2.0579 -2.0559 -2.0407 -2.0402 -1.7624 -1.7600 -1.7448 -1.7447 -1.6604 -1.6594 -1.6402 -1.6384 -1.6184 -1.6184 -0.1766 -0.1753 -0.1434 -0.1429 0.6745 0.6749 0.6988 0.6994 0.7240 0.7247 0.7364 0.7375 6.4859 6.4859 8.7414 8.7421 9.1847 9.1850 9.6699 9.6715 10.3598 10.3629 10.4277 10.4281 k = 0.0972 0.0561-0.0000 ( 6907 PWs) bands (ev): -20.4200 -20.4200 -20.2602 -20.2600 -17.7610 -17.7582 -17.3864 -17.3855 -17.3565 -17.3556 -17.3527 -17.3494 -17.3419 -17.3414 -17.3274 -17.3273 -9.1858 -9.1858 -8.1878 -8.1877 -6.1139 -6.1100 -5.6166 -5.6158 -5.5883 -5.5874 -5.5642 -5.5641 -5.3052 -5.3042 -5.2829 -5.2801 -2.7275 -2.7271 -2.3701 -2.3701 -2.3468 -2.3467 -2.0593 -2.0570 -2.0358 -2.0354 -1.7792 -1.7770 -1.7527 -1.7526 -1.6604 -1.6597 -1.6405 -1.6386 -1.6124 -1.6124 -0.1885 -0.1870 -0.1454 -0.1447 0.6602 0.6606 0.6831 0.6837 0.7061 0.7065 0.7326 0.7335 6.5145 6.5145 8.7558 8.7566 9.2104 9.2107 9.6892 9.6912 10.3632 10.3668 10.4525 10.4529 k = 0.1111 0.0642-0.0000 ( 6894 PWs) bands (ev): -20.4164 -20.4164 -20.2582 -20.2580 -17.7637 -17.7606 -17.3874 -17.3858 -17.3650 -17.3633 -17.3544 -17.3507 -17.3426 -17.3420 -17.3278 -17.3277 -9.1653 -9.1653 -8.1686 -8.1685 -6.1379 -6.1337 -5.6239 -5.6230 -5.5830 -5.5820 -5.5578 -5.5577 -5.2980 -5.2972 -5.2717 -5.2683 -2.7282 -2.7278 -2.3754 -2.3754 -2.3454 -2.3452 -2.0614 -2.0588 -2.0302 -2.0297 -1.7992 -1.7970 -1.7608 -1.7606 -1.6603 -1.6599 -1.6409 -1.6387 -1.6059 -1.6058 -0.2017 -0.2001 -0.1477 -0.1468 0.6437 0.6442 0.6633 0.6638 0.6857 0.6859 0.7307 0.7314 6.5473 6.5473 8.7719 8.7728 9.2399 9.2402 9.7109 9.7132 10.3668 10.3710 10.4810 10.4814 k = 0.1250 0.0722-0.0000 ( 6890 PWs) bands (ev): -20.4125 -20.4124 -20.2559 -20.2557 -17.7667 -17.7632 -17.3895 -17.3860 -17.3746 -17.3711 -17.3564 -17.3522 -17.3433 -17.3426 -17.3282 -17.3282 -9.1424 -9.1424 -8.1471 -8.1469 -6.1640 -6.1595 -5.6326 -5.6316 -5.5767 -5.5757 -5.5506 -5.5505 -5.2901 -5.2893 -5.2596 -5.2559 -2.7290 -2.7284 -2.3812 -2.3812 -2.3437 -2.3435 -2.0643 -2.0613 -2.0238 -2.0233 -1.8218 -1.8197 -1.7691 -1.7689 -1.6600 -1.6600 -1.6411 -1.6389 -1.5989 -1.5989 -0.2159 -0.2142 -0.1503 -0.1493 0.6251 0.6258 0.6403 0.6406 0.6630 0.6632 0.7297 0.7302 6.5842 6.5842 8.7897 8.7906 9.2731 9.2734 9.7346 9.7372 10.3705 10.3753 10.5131 10.5135 k = 0.1389 0.0802-0.0000 ( 6902 PWs) bands (ev): -20.4081 -20.4080 -20.2535 -20.2533 -17.7699 -17.7661 -17.3941 -17.3864 -17.3851 -17.3773 -17.3585 -17.3540 -17.3439 -17.3432 -17.3286 -17.3286 -9.1170 -9.1170 -8.1234 -8.1233 -6.1921 -6.1873 -5.6425 -5.6414 -5.5696 -5.5685 -5.5428 -5.5427 -5.2815 -5.2808 -5.2471 -5.2431 -2.7297 -2.7291 -2.3874 -2.3873 -2.3416 -2.3414 -2.0680 -2.0648 -2.0167 -2.0161 -1.8469 -1.8448 -1.7777 -1.7775 -1.6598 -1.6595 -1.6414 -1.6390 -1.5918 -1.5918 -0.2310 -0.2291 -0.1532 -0.1520 0.6042 0.6054 0.6149 0.6150 0.6384 0.6385 0.7292 0.7296 6.6250 6.6251 8.8088 8.8098 9.3100 9.3102 9.7598 9.7627 10.3745 10.3799 10.5485 10.5489 k = 0.1528 0.0882-0.0000 ( 6912 PWs) bands (ev): -20.4033 -20.4033 -20.2509 -20.2507 -17.7734 -17.7693 -17.4024 -17.3966 -17.3867 -17.3807 -17.3607 -17.3559 -17.3445 -17.3438 -17.3291 -17.3291 -9.0894 -9.0894 -8.0977 -8.0975 -6.2219 -6.2169 -5.6535 -5.6524 -5.5618 -5.5606 -5.5343 -5.5341 -5.2723 -5.2716 -5.2342 -5.2300 -2.7305 -2.7298 -2.3940 -2.3937 -2.3392 -2.3390 -2.0727 -2.0693 -2.0088 -2.0082 -1.8742 -1.8721 -1.7867 -1.7864 -1.6593 -1.6587 -1.6417 -1.6391 -1.5845 -1.5845 -0.2465 -0.2445 -0.1565 -0.1552 0.5802 0.5823 0.5878 0.5886 0.6122 0.6122 0.7290 0.7294 6.6698 6.6698 8.8292 8.8302 9.3503 9.3505 9.7863 9.7895 10.3786 10.3847 10.5870 10.5874 k = 0.1667 0.0962-0.0000 ( 6904 PWs) bands (ev): -20.3981 -20.3981 -20.2482 -20.2479 -17.7770 -17.7727 -17.4132 -17.4088 -17.3870 -17.3824 -17.3630 -17.3579 -17.3451 -17.3444 -17.3296 -17.3295 -9.0596 -9.0595 -8.0701 -8.0698 -6.2531 -6.2479 -5.6657 -5.6645 -5.5534 -5.5521 -5.5252 -5.5250 -5.2625 -5.2618 -5.2212 -5.2167 -2.7313 -2.7305 -2.4007 -2.4004 -2.3364 -2.3362 -2.0786 -2.0749 -2.0001 -1.9995 -1.9034 -1.9013 -1.7959 -1.7957 -1.6584 -1.6577 -1.6419 -1.6390 -1.5772 -1.5771 -0.2623 -0.2601 -0.1602 -0.1587 0.5520 0.5541 0.5621 0.5628 0.5845 0.5846 0.7290 0.7293 6.7182 6.7183 8.8507 8.8517 9.3938 9.3940 9.8133 9.8169 10.3829 10.3897 10.6285 10.6289 k = 0.1806 0.1042-0.0000 ( 6896 PWs) bands (ev): -20.3926 -20.3926 -20.2454 -20.2451 -17.7808 -17.7763 -17.4255 -17.4218 -17.3874 -17.3834 -17.3654 -17.3601 -17.3457 -17.3450 -17.3301 -17.3300 -9.0277 -9.0276 -8.0407 -8.0403 -6.2857 -6.2803 -5.6790 -5.6777 -5.5444 -5.5430 -5.5155 -5.5154 -5.2521 -5.2515 -5.2081 -5.2035 -2.7321 -2.7312 -2.4077 -2.4073 -2.3332 -2.3329 -2.0856 -2.0817 -1.9908 -1.9901 -1.9342 -1.9322 -1.8055 -1.8053 -1.6573 -1.6565 -1.6420 -1.6389 -1.5698 -1.5698 -0.2780 -0.2756 -0.1643 -0.1627 0.5204 0.5222 0.5367 0.5370 0.5559 0.5559 0.7291 0.7294 6.7703 6.7704 8.8731 8.8742 9.4403 9.4404 9.8404 9.8443 10.3872 10.3947 10.6728 10.6732 k = 0.1944 0.1123-0.0000 ( 6912 PWs) bands (ev): -20.3869 -20.3868 -20.2424 -20.2421 -17.7848 -17.7800 -17.4388 -17.4353 -17.3877 -17.3841 -17.3678 -17.3622 -17.3463 -17.3456 -17.3306 -17.3305 -8.9938 -8.9938 -8.0096 -8.0093 -6.3193 -6.3138 -5.6933 -5.6920 -5.5348 -5.5334 -5.5055 -5.5053 -5.2413 -5.2407 -5.1951 -5.1904 -2.7328 -2.7318 -2.4148 -2.4143 -2.3296 -2.3293 -2.0937 -2.0898 -1.9812 -1.9801 -1.9661 -1.9646 -1.8153 -1.8152 -1.6560 -1.6552 -1.6420 -1.6385 -1.5626 -1.5625 -0.2933 -0.2908 -0.1690 -0.1672 0.4867 0.4883 0.5102 0.5103 0.5264 0.5265 0.7293 0.7295 6.8258 6.8259 8.8964 8.8975 9.4895 9.4896 9.8667 9.8710 10.3915 10.3999 10.7197 10.7200 k = 0.2083 0.1203-0.0000 ( 6908 PWs) bands (ev): -20.3808 -20.3808 -20.2395 -20.2391 -17.7888 -17.7838 -17.4527 -17.4495 -17.3881 -17.3846 -17.3702 -17.3645 -17.3469 -17.3462 -17.3311 -17.3310 -8.9582 -8.9581 -7.9772 -7.9768 -6.3539 -6.3482 -5.7087 -5.7073 -5.5248 -5.5233 -5.4950 -5.4949 -5.2300 -5.2295 -5.1823 -5.1775 -2.7335 -2.7323 -2.4219 -2.4214 -2.3255 -2.3251 -2.1032 -2.0991 -2.0005 -1.9982 -1.9695 -1.9691 -1.8255 -1.8254 -1.6546 -1.6540 -1.6420 -1.6380 -1.5554 -1.5554 -0.3080 -0.3054 -0.1742 -0.1722 0.4515 0.4530 0.4823 0.4827 0.4964 0.4966 0.7295 0.7298 6.8848 6.8849 8.9205 8.9215 9.5409 9.5409 9.8915 9.8961 10.3957 10.4050 10.7689 10.7693 k = 0.2222 0.1283-0.0000 ( 6904 PWs) bands (ev): -20.3745 -20.3745 -20.2365 -20.2361 -17.7929 -17.7877 -17.4672 -17.4641 -17.3886 -17.3851 -17.3726 -17.3667 -17.3474 -17.3468 -17.3316 -17.3315 -8.9208 -8.9208 -7.9436 -7.9430 -6.3892 -6.3834 -5.7251 -5.7236 -5.5144 -5.5129 -5.4843 -5.4841 -5.2185 -5.2179 -5.1698 -5.1649 -2.7340 -2.7327 -2.4291 -2.4284 -2.3209 -2.3205 -2.1139 -2.1099 -2.0346 -2.0325 -1.9582 -1.9577 -1.8359 -1.8359 -1.6531 -1.6528 -1.6417 -1.6371 -1.5485 -1.5485 -0.3218 -0.3191 -0.1799 -0.1778 0.4150 0.4165 0.4534 0.4541 0.4663 0.4667 0.7298 0.7301 6.9469 6.9470 8.9451 8.9461 9.5940 9.5940 9.9139 9.9187 10.3999 10.4100 10.8203 10.8207 k = 0.2361 0.1363-0.0000 ( 6910 PWs) bands (ev): -20.3680 -20.3680 -20.2335 -20.2331 -17.7969 -17.7916 -17.4822 -17.4791 -17.3890 -17.3855 -17.3749 -17.3688 -17.3480 -17.3474 -17.3321 -17.3321 -8.8820 -8.8820 -7.9089 -7.9083 -6.4250 -6.4190 -5.7425 -5.7410 -5.5037 -5.5021 -5.4733 -5.4731 -5.2067 -5.2061 -5.1576 -5.1528 -2.7345 -2.7331 -2.4363 -2.4354 -2.3157 -2.3153 -2.1260 -2.1222 -2.0691 -2.0673 -1.9461 -1.9456 -1.8466 -1.8466 -1.6518 -1.6517 -1.6412 -1.6361 -1.5418 -1.5418 -0.3344 -0.3316 -0.1863 -0.1840 0.3775 0.3790 0.4237 0.4248 0.4361 0.4366 0.7302 0.7304 7.0121 7.0123 8.9701 8.9711 9.6482 9.6482 9.9328 9.9378 10.4040 10.4150 10.8691 10.8722 k = 0.2500 0.1443-0.0000 ( 6928 PWs) bands (ev): -20.3613 -20.3613 -20.2305 -20.2301 -17.8009 -17.7955 -17.4975 -17.4944 -17.3894 -17.3859 -17.3771 -17.3709 -17.3486 -17.3480 -17.3326 -17.3326 -8.8419 -8.8419 -7.8736 -7.8729 -6.4611 -6.4551 -5.7610 -5.7593 -5.4927 -5.4911 -5.4621 -5.4620 -5.1948 -5.1942 -5.1459 -5.1410 -2.7349 -2.7333 -2.4434 -2.4424 -2.3100 -2.3096 -2.1399 -2.1368 -2.1029 -2.1018 -1.9336 -1.9330 -1.8576 -1.8575 -1.6510 -1.6506 -1.6404 -1.6348 -1.5355 -1.5355 -0.3457 -0.3427 -0.1933 -0.1908 0.3393 0.3408 0.3938 0.3951 0.4060 0.4066 0.7305 0.7307 7.0803 7.0805 8.9954 8.9964 9.7020 9.7020 9.9478 9.9527 10.4080 10.4198 10.8555 10.8602 k = 0.2639 0.1524-0.0000 ( 6928 PWs) bands (ev): -20.3546 -20.3545 -20.2276 -20.2272 -17.8048 -17.7993 -17.5129 -17.5098 -17.3899 -17.3863 -17.3793 -17.3730 -17.3491 -17.3486 -17.3332 -17.3331 -8.8007 -8.8006 -7.8378 -7.8370 -6.4973 -6.4912 -5.7803 -5.7785 -5.4815 -5.4798 -5.4509 -5.4508 -5.1828 -5.1822 -5.1346 -5.1298 -2.7351 -2.7333 -2.4503 -2.4492 -2.3037 -2.3033 -2.1574 -2.1567 -2.1339 -2.1326 -1.9207 -1.9201 -1.8684 -1.8682 -1.6504 -1.6497 -1.6392 -1.6333 -1.5296 -1.5296 -0.3553 -0.3523 -0.2009 -0.1982 0.3007 0.3022 0.3638 0.3654 0.3761 0.3767 0.7309 0.7311 7.1513 7.1515 9.0209 9.0218 9.7531 9.7533 9.9592 9.9637 10.4122 10.4245 10.8381 10.8419 k = 0.2778 0.1604-0.0000 ( 6920 PWs) bands (ev): -20.3477 -20.3476 -20.2248 -20.2244 -17.8085 -17.8030 -17.5285 -17.5254 -17.3904 -17.3867 -17.3813 -17.3749 -17.3497 -17.3492 -17.3337 -17.3336 -8.7585 -8.7584 -7.8019 -7.8009 -6.5334 -6.5272 -5.8004 -5.7986 -5.4702 -5.4685 -5.4398 -5.4396 -5.1708 -5.1703 -5.1238 -5.1191 -2.7351 -2.7332 -2.4571 -2.4558 -2.2969 -2.2964 -2.1855 -2.1834 -2.1581 -2.1540 -1.9088 -1.9080 -1.8781 -1.8777 -1.6500 -1.6491 -1.6378 -1.6317 -1.5242 -1.5241 -0.3632 -0.3601 -0.2091 -0.2063 0.2618 0.2633 0.3340 0.3356 0.3467 0.3473 0.7313 0.7314 7.2249 7.2251 9.0465 9.0473 9.7960 9.7967 9.9705 9.9741 10.4164 10.4289 10.8195 10.8224 k = 0.2917 0.1684-0.0000 ( 6910 PWs) bands (ev): -20.3407 -20.3407 -20.2222 -20.2218 -17.8120 -17.8065 -17.5440 -17.5409 -17.3908 -17.3871 -17.3832 -17.3768 -17.3502 -17.3498 -17.3342 -17.3341 -8.7155 -8.7155 -7.7662 -7.7651 -6.5690 -6.5627 -5.8214 -5.8195 -5.4589 -5.4572 -5.4287 -5.4285 -5.1590 -5.1585 -5.1136 -5.1090 -2.7349 -2.7329 -2.4637 -2.4622 -2.2894 -2.2889 -2.2188 -2.2160 -2.1760 -2.1713 -1.9038 -1.9032 -1.8803 -1.8800 -1.6497 -1.6487 -1.6362 -1.6301 -1.5194 -1.5193 -0.3692 -0.3661 -0.2179 -0.2150 0.2229 0.2245 0.3041 0.3057 0.3186 0.3190 0.7317 0.7318 7.3010 7.3013 9.0718 9.0727 9.8207 9.8222 9.9903 9.9924 10.4205 10.4329 10.8014 10.8034 k = 0.3056 0.1764-0.0000 ( 6910 PWs) bands (ev): -20.3338 -20.3337 -20.2197 -20.2193 -17.8153 -17.8098 -17.5595 -17.5564 -17.3913 -17.3874 -17.3850 -17.3785 -17.3508 -17.3503 -17.3347 -17.3346 -8.6722 -8.6721 -7.7312 -7.7299 -6.6039 -6.5976 -5.8430 -5.8411 -5.4477 -5.4460 -5.4178 -5.4177 -5.1474 -5.1468 -5.1039 -5.0994 -2.7345 -2.7323 -2.4700 -2.4684 -2.2814 -2.2809 -2.2529 -2.2499 -2.1926 -2.1878 -1.9111 -1.9109 -1.8698 -1.8697 -1.6495 -1.6484 -1.6346 -1.6286 -1.5152 -1.5151 -0.3732 -0.3701 -0.2272 -0.2241 0.1843 0.1859 0.2739 0.2753 0.2921 0.2922 0.7321 0.7322 7.3795 7.3798 9.0969 9.0977 9.8185 9.8205 10.0260 10.0267 10.4242 10.4360 10.7852 10.7864 k = 0.3194 0.1844-0.0000 ( 6912 PWs) bands (ev): -20.3269 -20.3269 -20.2174 -20.2170 -17.8182 -17.8128 -17.5747 -17.5716 -17.3918 -17.3878 -17.3867 -17.3801 -17.3513 -17.3509 -17.3352 -17.3351 -8.6285 -8.6285 -7.6972 -7.6958 -6.6377 -6.6313 -5.8651 -5.8632 -5.4366 -5.4349 -5.4073 -5.4071 -5.1361 -5.1355 -5.0948 -5.0905 -2.7339 -2.7316 -2.4761 -2.4743 -2.2866 -2.2835 -2.2726 -2.2721 -2.2088 -2.2041 -1.9226 -1.9226 -1.8552 -1.8550 -1.6493 -1.6483 -1.6331 -1.6272 -1.5118 -1.5117 -0.3752 -0.3721 -0.2368 -0.2337 0.1462 0.1479 0.2434 0.2447 0.2675 0.2676 0.7325 0.7326 7.4602 7.4605 9.1216 9.1223 9.7923 9.7942 10.0745 10.0745 10.4269 10.4380 10.7717 10.7723 k = 0.3333 0.1925-0.0000 ( 6912 PWs) bands (ev): -20.3202 -20.3201 -20.2153 -20.2149 -17.8208 -17.8154 -17.5896 -17.5865 -17.3924 -17.3885 -17.3878 -17.3816 -17.3517 -17.3514 -17.3356 -17.3356 -8.5850 -8.5850 -7.6648 -7.6632 -6.6700 -6.6636 -5.8877 -5.8857 -5.4258 -5.4241 -5.3970 -5.3969 -5.1252 -5.1246 -5.0864 -5.0823 -2.7330 -2.7305 -2.4818 -2.4799 -2.3193 -2.3162 -2.2634 -2.2630 -2.2249 -2.2204 -1.9353 -1.9352 -1.8393 -1.8390 -1.6492 -1.6482 -1.6316 -1.6260 -1.5093 -1.5091 -0.3751 -0.3720 -0.2467 -0.2435 0.1089 0.1106 0.2128 0.2139 0.2449 0.2453 0.7328 0.7329 7.5428 7.5432 9.1455 9.1462 9.7489 9.7504 10.1289 10.1293 10.4282 10.4382 10.7613 10.7613 k = 0.3472 0.2005-0.0000 ( 6906 PWs) bands (ev): -20.3136 -20.3135 -20.2135 -20.2131 -17.8230 -17.8177 -17.6041 -17.6010 -17.3929 -17.3898 -17.3883 -17.3829 -17.3522 -17.3519 -17.3361 -17.3360 -8.5419 -8.5418 -7.6344 -7.6326 -6.7004 -6.6941 -5.9104 -5.9084 -5.4154 -5.4137 -5.3873 -5.3871 -5.1147 -5.1142 -5.0785 -5.0747 -2.7319 -2.7292 -2.4873 -2.4853 -2.3507 -2.3476 -2.2536 -2.2535 -2.2405 -2.2365 -1.9486 -1.9484 -1.8228 -1.8225 -1.6491 -1.6481 -1.6303 -1.6250 -1.5077 -1.5075 -0.3730 -0.3699 -0.2565 -0.2533 0.0726 0.0743 0.1823 0.1833 0.2245 0.2251 0.7332 0.7333 7.6272 7.6276 9.1687 9.1693 9.6930 9.6940 10.1859 10.1865 10.4275 10.4364 10.7533 10.7537 k = 0.3611 0.2085-0.0000 ( 6894 PWs) bands (ev): -20.3072 -20.3071 -20.2119 -20.2115 -17.8248 -17.8197 -17.6180 -17.6149 -17.3934 -17.3910 -17.3886 -17.3841 -17.3526 -17.3523 -17.3365 -17.3364 -8.4995 -8.4995 -7.6065 -7.6046 -6.7284 -6.7221 -5.9331 -5.9312 -5.4054 -5.4037 -5.3781 -5.3779 -5.1049 -5.1043 -5.0714 -5.0678 -2.7304 -2.7276 -2.4925 -2.4904 -2.3806 -2.3774 -2.2572 -2.2525 -2.2428 -2.2418 -1.9622 -1.9620 -1.8059 -1.8056 -1.6489 -1.6480 -1.6291 -1.6242 -1.5072 -1.5070 -0.3689 -0.3659 -0.2661 -0.2629 0.0375 0.0393 0.1520 0.1530 0.2063 0.2070 0.7335 0.7336 7.7133 7.7137 9.1907 9.1913 9.6276 9.6282 10.2434 10.2442 10.4249 10.4326 10.7477 10.7485 k = 0.3750 0.2165-0.0000 ( 6898 PWs) bands (ev): -20.3010 -20.3009 -20.2106 -20.2102 -17.8261 -17.8212 -17.6313 -17.6282 -17.3939 -17.3921 -17.3889 -17.3852 -17.3530 -17.3527 -17.3369 -17.3368 -8.4583 -8.4583 -7.5817 -7.5797 -6.7535 -6.7475 -5.9555 -5.9536 -5.3959 -5.3944 -5.3694 -5.3693 -5.0957 -5.0952 -5.0648 -5.0616 -2.7286 -2.7258 -2.4975 -2.4953 -2.4084 -2.4052 -2.2719 -2.2676 -2.2319 -2.2311 -1.9762 -1.9759 -1.7888 -1.7885 -1.6488 -1.6479 -1.6281 -1.6235 -1.5077 -1.5075 -0.3630 -0.3601 -0.2752 -0.2720 0.0040 0.0058 0.1223 0.1232 0.1903 0.1909 0.7338 0.7339 7.8006 7.8011 9.2115 9.2120 9.5550 9.5552 10.3000 10.3009 10.4203 10.4271 10.7438 10.7448 k = 0.3889 0.2245-0.0000 ( 6894 PWs) bands (ev): -20.2953 -20.2951 -20.2095 -20.2092 -17.8270 -17.8224 -17.6437 -17.6408 -17.3944 -17.3931 -17.3891 -17.3861 -17.3534 -17.3531 -17.3372 -17.3372 -8.4188 -8.4188 -7.5604 -7.5584 -6.7755 -6.7696 -5.9773 -5.9755 -5.3871 -5.3857 -5.3615 -5.3614 -5.0872 -5.0867 -5.0590 -5.0560 -2.7265 -2.7236 -2.5024 -2.5002 -2.4339 -2.4308 -2.2859 -2.2819 -2.2204 -2.2196 -1.9904 -1.9901 -1.7717 -1.7714 -1.6487 -1.6478 -1.6273 -1.6231 -1.5094 -1.5092 -0.3554 -0.3526 -0.2834 -0.2803 -0.0277 -0.0258 0.0933 0.0943 0.1763 0.1769 0.7341 0.7342 7.8890 7.8895 9.2307 9.2312 9.4770 9.4771 10.3548 10.3556 10.4144 10.4203 10.7408 10.7421 k = 0.4028 0.2325-0.0000 ( 6892 PWs) bands (ev): -20.2899 -20.2898 -20.2087 -20.2084 -17.8275 -17.8233 -17.6552 -17.6524 -17.3948 -17.3940 -17.3893 -17.3869 -17.3537 -17.3535 -17.3375 -17.3375 -8.3815 -8.3815 -7.5429 -7.5409 -6.7939 -6.7883 -5.9981 -5.9964 -5.3791 -5.3777 -5.3543 -5.3542 -5.0796 -5.0791 -5.0538 -5.0511 -2.7241 -2.7212 -2.5078 -2.5056 -2.4563 -2.4533 -2.2990 -2.2953 -2.2083 -2.2076 -2.0048 -2.0044 -1.7549 -1.7546 -1.6485 -1.6477 -1.6265 -1.6228 -1.5122 -1.5119 -0.3463 -0.3437 -0.2906 -0.2875 -0.0572 -0.0554 0.0655 0.0664 0.1642 0.1649 0.7344 0.7344 7.9780 7.9785 9.2479 9.2483 9.3955 9.3957 10.4026 10.4031 10.4121 10.4175 10.7380 10.7395 k = 0.4167 0.2406-0.0000 ( 6894 PWs) bands (ev): -20.2850 -20.2848 -20.2081 -20.2078 -17.8277 -17.8238 -17.6656 -17.6630 -17.3953 -17.3947 -17.3895 -17.3876 -17.3540 -17.3538 -17.3378 -17.3378 -8.3469 -8.3469 -7.5293 -7.5273 -6.8086 -6.8035 -6.0175 -6.0159 -5.3719 -5.3707 -5.3480 -5.3479 -5.0728 -5.0723 -5.0492 -5.0470 -2.7214 -2.7185 -2.5144 -2.5122 -2.4746 -2.4718 -2.3109 -2.3075 -2.1958 -2.1951 -2.0193 -2.0189 -1.7385 -1.7383 -1.6483 -1.6476 -1.6259 -1.6227 -1.5159 -1.5157 -0.3362 -0.3338 -0.2966 -0.2936 -0.0843 -0.0825 0.0390 0.0399 0.1541 0.1547 0.7346 0.7346 8.0671 8.0677 9.2602 9.2609 9.3145 9.3146 10.3991 10.4025 10.4575 10.4595 10.7345 10.7363 k = 0.4306 0.2486-0.0000 ( 6888 PWs) bands (ev): -20.2806 -20.2805 -20.2077 -20.2074 -17.8275 -17.8240 -17.6748 -17.6725 -17.3957 -17.3953 -17.3897 -17.3882 -17.3542 -17.3541 -17.3380 -17.3380 -8.3159 -8.3159 -7.5194 -7.5176 -6.8197 -6.8152 -6.0351 -6.0336 -5.3656 -5.3646 -5.3425 -5.3424 -5.0670 -5.0665 -5.0453 -5.0435 -2.7185 -2.7158 -2.5233 -2.5211 -2.4875 -2.4850 -2.3212 -2.3183 -2.1829 -2.1822 -2.0339 -2.0335 -1.7230 -1.7228 -1.6480 -1.6474 -1.6254 -1.6227 -1.5205 -1.5203 -0.3253 -0.3233 -0.3011 -0.2982 -0.1085 -0.1067 0.0144 0.0153 0.1458 0.1463 0.7348 0.7348 8.1555 8.1561 9.2190 9.2199 9.2841 9.2842 10.3921 10.3949 10.5033 10.5051 10.7299 10.7318 k = 0.4444 0.2566-0.0000 ( 6894 PWs) bands (ev): -20.2769 -20.2768 -20.2074 -20.2072 -17.8270 -17.8241 -17.6826 -17.6805 -17.3960 -17.3958 -17.3898 -17.3886 -17.3544 -17.3543 -17.3382 -17.3382 -8.2890 -8.2890 -7.5127 -7.5111 -6.8275 -6.8238 -6.0503 -6.0490 -5.3603 -5.3595 -5.3380 -5.3379 -5.0621 -5.0617 -5.0421 -5.0406 -2.7155 -2.7131 -2.5340 -2.5319 -2.4951 -2.4931 -2.3300 -2.3275 -2.1697 -2.1690 -2.0485 -2.0480 -1.7089 -1.7087 -1.6477 -1.6472 -1.6250 -1.6228 -1.5257 -1.5255 -0.3143 -0.3130 -0.3042 -0.3012 -0.1295 -0.1278 -0.0078 -0.0069 0.1391 0.1395 0.7350 0.7350 8.2418 8.2424 9.1371 9.1378 9.2932 9.2933 10.3855 10.3878 10.5450 10.5469 10.7234 10.7255 k = 0.4583 0.2646-0.0000 ( 6896 PWs) bands (ev): -20.2739 -20.2738 -20.2073 -20.2071 -17.8264 -17.8241 -17.6888 -17.6871 -17.3963 -17.3962 -17.3898 -17.3890 -17.3545 -17.3545 -17.3384 -17.3384 -8.2671 -8.2671 -7.5086 -7.5074 -6.8326 -6.8297 -6.0627 -6.0617 -5.3561 -5.3555 -5.3344 -5.3343 -5.0583 -5.0579 -5.0396 -5.0385 -2.7126 -2.7106 -2.5445 -2.5427 -2.4992 -2.4977 -2.3369 -2.3350 -2.1564 -2.1558 -2.0629 -2.0624 -1.6967 -1.6965 -1.6473 -1.6470 -1.6246 -1.6230 -1.5308 -1.5307 -0.3064 -0.3064 -0.3036 -0.3000 -0.1466 -0.1452 -0.0267 -0.0260 0.1340 0.1343 0.7351 0.7351 8.3237 8.3243 9.0568 9.0575 9.3019 9.3020 10.3801 10.3817 10.5825 10.5844 10.7145 10.7166 k = 0.4722 0.2726-0.0000 ( 6906 PWs) bands (ev): -20.2716 -20.2716 -20.2073 -20.2072 -17.8257 -17.8241 -17.6932 -17.6921 -17.3965 -17.3964 -17.3898 -17.3893 -17.3547 -17.3546 -17.3385 -17.3385 -8.2508 -8.2508 -7.5064 -7.5056 -6.8355 -6.8335 -6.0718 -6.0712 -5.3531 -5.3526 -5.3318 -5.3317 -5.0555 -5.0552 -5.0378 -5.0370 -2.7101 -2.7087 -2.5529 -2.5515 -2.5015 -2.5005 -2.3418 -2.3405 -2.1433 -2.1427 -2.0768 -2.0762 -1.6871 -1.6870 -1.6468 -1.6466 -1.6243 -1.6232 -1.5354 -1.5353 -0.3071 -0.3063 -0.2950 -0.2932 -0.1594 -0.1583 -0.0414 -0.0408 0.1304 0.1307 0.7352 0.7352 8.3965 8.3970 8.9849 8.9855 9.3085 9.3085 10.3760 10.3771 10.6154 10.6174 10.7026 10.7047 k = 0.4861 0.2807-0.0000 ( 6906 PWs) bands (ev): -20.2703 -20.2702 -20.2072 -20.2072 -17.8251 -17.8243 -17.6958 -17.6953 -17.3966 -17.3966 -17.3898 -17.3896 -17.3547 -17.3547 -17.3386 -17.3386 -8.2408 -8.2408 -7.5054 -7.5049 -6.8368 -6.8358 -6.0774 -6.0771 -5.3512 -5.3510 -5.3302 -5.3302 -5.0538 -5.0536 -5.0366 -5.0362 -2.7083 -2.7076 -2.5581 -2.5574 -2.5025 -2.5020 -2.3447 -2.3440 -2.1315 -2.1311 -2.0889 -2.0885 -1.6810 -1.6810 -1.6464 -1.6463 -1.6240 -1.6235 -1.5386 -1.5385 -0.3072 -0.3067 -0.2889 -0.2880 -0.1672 -0.1666 -0.0508 -0.0505 0.1284 0.1285 0.7353 0.7353 8.4510 8.4513 8.9310 8.9314 9.3125 9.3125 10.3735 10.3741 10.6437 10.6457 10.6872 10.6893 k = 0.5000 0.2887-0.0000 ( 6908 PWs) bands (ev): -20.2698 -20.2698 -20.2072 -20.2072 -17.8246 -17.8246 -17.6965 -17.6965 -17.3966 -17.3966 -17.3897 -17.3897 -17.3547 -17.3547 -17.3386 -17.3386 -8.2374 -8.2374 -7.5049 -7.5049 -6.8368 -6.8368 -6.0792 -6.0792 -5.3505 -5.3505 -5.3297 -5.3297 -5.0531 -5.0531 -5.0361 -5.0361 -2.7074 -2.7074 -2.5596 -2.5596 -2.5027 -2.5027 -2.3454 -2.3454 -2.1254 -2.1254 -2.0947 -2.0947 -1.6789 -1.6789 -1.6462 -1.6462 -1.6237 -1.6237 -1.5398 -1.5398 -0.3071 -0.3071 -0.2865 -0.2865 -0.1697 -0.1697 -0.0539 -0.0539 0.1277 0.1277 0.7353 0.7353 8.4723 8.4723 8.9101 8.9101 9.3138 9.3138 10.3729 10.3729 10.6658 10.6658 10.6715 10.6715 k = 0.5000 0.2887-0.0000 ( 6908 PWs) bands (ev): -20.2698 -20.2698 -20.2072 -20.2072 -17.8246 -17.8246 -17.6965 -17.6965 -17.3966 -17.3966 -17.3897 -17.3897 -17.3547 -17.3547 -17.3386 -17.3386 -8.2374 -8.2374 -7.5049 -7.5049 -6.8368 -6.8368 -6.0792 -6.0792 -5.3505 -5.3505 -5.3297 -5.3297 -5.0531 -5.0531 -5.0361 -5.0361 -2.7074 -2.7074 -2.5596 -2.5596 -2.5027 -2.5027 -2.3454 -2.3454 -2.1254 -2.1254 -2.0947 -2.0947 -1.6789 -1.6789 -1.6462 -1.6462 -1.6237 -1.6237 -1.5398 -1.5398 -0.3071 -0.3071 -0.2865 -0.2865 -0.1697 -0.1697 -0.0539 -0.0539 0.1277 0.1277 0.7353 0.7353 8.4723 8.4723 8.9101 8.9101 9.3138 9.3138 10.3729 10.3729 10.6658 10.6658 10.6715 10.6715 k = 0.4921 0.3024-0.0000 ( 6902 PWs) bands (ev): -20.2697 -20.2696 -20.2072 -20.2072 -17.8247 -17.8244 -17.6969 -17.6967 -17.3967 -17.3965 -17.3898 -17.3897 -17.3548 -17.3547 -17.3386 -17.3386 -8.2361 -8.2361 -7.5049 -7.5047 -6.8371 -6.8367 -6.0807 -6.0806 -5.3505 -5.3496 -5.3296 -5.3286 -5.0550 -5.0527 -5.0365 -5.0343 -2.7073 -2.7073 -2.5599 -2.5596 -2.5047 -2.5038 -2.3465 -2.3463 -2.1250 -2.1250 -2.0929 -2.0918 -1.6797 -1.6773 -1.6470 -1.6451 -1.6238 -1.6236 -1.5399 -1.5398 -0.3089 -0.3069 -0.2858 -0.2841 -0.1744 -0.1717 -0.0524 -0.0498 0.1259 0.1259 0.7340 0.7341 8.4736 8.4736 8.9122 8.9122 9.3141 9.3141 10.3733 10.3734 10.6674 10.6675 10.6723 10.6724 k = 0.4841 0.3162-0.0000 ( 6902 PWs) bands (ev): -20.2692 -20.2692 -20.2072 -20.2072 -17.8247 -17.8242 -17.6978 -17.6974 -17.3968 -17.3964 -17.3898 -17.3897 -17.3550 -17.3548 -17.3388 -17.3387 -8.2323 -8.2322 -7.5045 -7.5042 -6.8375 -6.8367 -6.0852 -6.0849 -5.3496 -5.3480 -5.3286 -5.3266 -5.0578 -5.0539 -5.0353 -5.0319 -2.7070 -2.7070 -2.5604 -2.5598 -2.5099 -2.5082 -2.3494 -2.3490 -2.1238 -2.1236 -2.0867 -2.0843 -1.6798 -1.6749 -1.6475 -1.6436 -1.6237 -1.6234 -1.5403 -1.5401 -0.3116 -0.3084 -0.2823 -0.2797 -0.1847 -0.1798 -0.0457 -0.0411 0.1204 0.1205 0.7304 0.7306 8.4773 8.4774 8.9184 8.9184 9.3149 9.3149 10.3746 10.3747 10.6722 10.6724 10.6748 10.6750 k = 0.4762 0.3299-0.0000 ( 6902 PWs) bands (ev): -20.2685 -20.2685 -20.2073 -20.2072 -17.8247 -17.8239 -17.6992 -17.6987 -17.3969 -17.3963 -17.3899 -17.3897 -17.3553 -17.3550 -17.3390 -17.3390 -8.2259 -8.2259 -7.5041 -7.5036 -6.8379 -6.8368 -6.0926 -6.0921 -5.3479 -5.3456 -5.3265 -5.3237 -5.0611 -5.0564 -5.0330 -5.0290 -2.7065 -2.7064 -2.5611 -2.5603 -2.5179 -2.5153 -2.3540 -2.3534 -2.1217 -2.1215 -2.0762 -2.0728 -1.6794 -1.6718 -1.6477 -1.6416 -1.6235 -1.6231 -1.5410 -1.5405 -0.3144 -0.3106 -0.2768 -0.2739 -0.1986 -0.1925 -0.0357 -0.0299 0.1114 0.1116 0.7245 0.7247 8.4836 8.4837 8.9287 8.9287 9.3161 9.3161 10.3764 10.3765 10.6780 10.6781 10.6815 10.6815 k = 0.4683 0.3437-0.0000 ( 6894 PWs) bands (ev): -20.2675 -20.2674 -20.2073 -20.2072 -17.8246 -17.8235 -17.7012 -17.7005 -17.3970 -17.3961 -17.3900 -17.3897 -17.3557 -17.3552 -17.3393 -17.3392 -8.2170 -8.2170 -7.5036 -7.5030 -6.8382 -6.8367 -6.1028 -6.1021 -5.3452 -5.3424 -5.3235 -5.3200 -5.0648 -5.0597 -5.0299 -5.0258 -2.7058 -2.7057 -2.5621 -2.5610 -2.5280 -2.5248 -2.3601 -2.3594 -2.1190 -2.1188 -2.0620 -2.0577 -1.6786 -1.6683 -1.6473 -1.6390 -1.6232 -1.6227 -1.5418 -1.5413 -0.3169 -0.3128 -0.2701 -0.2671 -0.2147 -0.2078 -0.0239 -0.0174 0.0990 0.0993 0.7164 0.7167 8.4924 8.4925 8.9430 8.9431 9.3179 9.3179 10.3782 10.3784 10.6836 10.6838 10.6930 10.6931 k = 0.4603 0.3574-0.0000 ( 6894 PWs) bands (ev): -20.2662 -20.2662 -20.2074 -20.2073 -17.8244 -17.8231 -17.7036 -17.7029 -17.3971 -17.3960 -17.3901 -17.3897 -17.3561 -17.3556 -17.3396 -17.3396 -8.2057 -8.2057 -7.5034 -7.5026 -6.8382 -6.8362 -6.1156 -6.1148 -5.3417 -5.3384 -5.3196 -5.3155 -5.0688 -5.0636 -5.0265 -5.0224 -2.7050 -2.7048 -2.5634 -2.5620 -2.5397 -2.5360 -2.3675 -2.3666 -2.1159 -2.1156 -2.0448 -2.0396 -1.6777 -1.6650 -1.6459 -1.6356 -1.6228 -1.6221 -1.5429 -1.5422 -0.3192 -0.3148 -0.2624 -0.2598 -0.2318 -0.2247 -0.0116 -0.0046 0.0834 0.0838 0.7063 0.7067 8.5036 8.5037 8.9613 8.9613 9.3201 9.3201 10.3794 10.3798 10.6904 10.6907 10.7080 10.7081 k = 0.4524 0.3712-0.0000 ( 6890 PWs) bands (ev): -20.2647 -20.2646 -20.2075 -20.2074 -17.8241 -17.8225 -17.7066 -17.7057 -17.3971 -17.3958 -17.3902 -17.3897 -17.3566 -17.3560 -17.3400 -17.3400 -8.1919 -8.1919 -7.5037 -7.5028 -6.8374 -6.8351 -6.1311 -6.1301 -5.3373 -5.3336 -5.3151 -5.3105 -5.0733 -5.0681 -5.0228 -5.0189 -2.7040 -2.7038 -2.5649 -2.5633 -2.5524 -2.5483 -2.3759 -2.3749 -2.1125 -2.1121 -2.0251 -2.0191 -1.6770 -1.6626 -1.6430 -1.6315 -1.6222 -1.6214 -1.5442 -1.5433 -0.3210 -0.3164 -0.2552 -0.2538 -0.2459 -0.2423 0.0006 0.0079 0.0648 0.0652 0.6943 0.6948 8.5171 8.5173 8.9834 8.9835 9.3228 9.3228 10.3791 10.3796 10.6986 10.6990 10.7260 10.7261 k = 0.4444 0.3849-0.0000 ( 6880 PWs) bands (ev): -20.2629 -20.2628 -20.2076 -20.2075 -17.8236 -17.8218 -17.7101 -17.7090 -17.3972 -17.3956 -17.3903 -17.3898 -17.3571 -17.3565 -17.3405 -17.3404 -8.1758 -8.1758 -7.5049 -7.5039 -6.8357 -6.8330 -6.1489 -6.1478 -5.3320 -5.3281 -5.3101 -5.3051 -5.0781 -5.0729 -5.0188 -5.0152 -2.7029 -2.7026 -2.5678 -2.5655 -2.5646 -2.5605 -2.3851 -2.3840 -2.1088 -2.1084 -2.0035 -1.9968 -1.6765 -1.6614 -1.6384 -1.6267 -1.6215 -1.6204 -1.5456 -1.5446 -0.3224 -0.3176 -0.2695 -0.2602 -0.2443 -0.2404 0.0120 0.0197 0.0435 0.0439 0.6808 0.6814 8.5329 8.5331 9.0093 9.0093 9.3258 9.3258 10.3762 10.3769 10.7080 10.7085 10.7468 10.7470 k = 0.4365 0.3986-0.0000 ( 6878 PWs) bands (ev): -20.2608 -20.2607 -20.2078 -20.2076 -17.8230 -17.8210 -17.7140 -17.7127 -17.3972 -17.3954 -17.3905 -17.3899 -17.3577 -17.3570 -17.3410 -17.3409 -8.1574 -8.1574 -7.5074 -7.5062 -6.8325 -6.8296 -6.1690 -6.1677 -5.3260 -5.3218 -5.3047 -5.2993 -5.0833 -5.0783 -5.0148 -5.0114 -2.7019 -2.7014 -2.5796 -2.5751 -2.5682 -2.5657 -2.3948 -2.3936 -2.1051 -2.1047 -1.9806 -1.9732 -1.6765 -1.6613 -1.6325 -1.6214 -1.6207 -1.6190 -1.5472 -1.5461 -0.3234 -0.3185 -0.2871 -0.2780 -0.2342 -0.2308 0.0169 0.0202 0.0253 0.0304 0.6660 0.6667 8.5508 8.5510 9.0387 9.0388 9.3292 9.3292 10.3694 10.3703 10.7185 10.7191 10.7698 10.7704 k = 0.4286 0.4124-0.0000 ( 6882 PWs) bands (ev): -20.2586 -20.2585 -20.2081 -20.2079 -17.8223 -17.8200 -17.7183 -17.7169 -17.3973 -17.3952 -17.3906 -17.3899 -17.3583 -17.3576 -17.3415 -17.3414 -8.1368 -8.1368 -7.5115 -7.5102 -6.8277 -6.8244 -6.1913 -6.1898 -5.3192 -5.3148 -5.2991 -5.2932 -5.0889 -5.0840 -5.0106 -5.0076 -2.7009 -2.7003 -2.5926 -2.5877 -2.5706 -2.5679 -2.4048 -2.4035 -2.1015 -2.1010 -1.9567 -1.9486 -1.6769 -1.6619 -1.6259 -1.6196 -1.6185 -1.6145 -1.5490 -1.5477 -0.3241 -0.3190 -0.3043 -0.2951 -0.2233 -0.2204 -0.0073 -0.0055 0.0329 0.0398 0.6503 0.6511 8.5708 8.5710 9.0716 9.0717 9.3328 9.3329 10.3570 10.3581 10.7301 10.7307 10.7945 10.7955 k = 0.4206 0.4261-0.0000 ( 6880 PWs) bands (ev): -20.2561 -20.2560 -20.2084 -20.2082 -17.8213 -17.8188 -17.7230 -17.7215 -17.3974 -17.3950 -17.3908 -17.3900 -17.3589 -17.3582 -17.3420 -17.3420 -8.1141 -8.1140 -7.5176 -7.5163 -6.8207 -6.8172 -6.2155 -6.2138 -5.3119 -5.3071 -5.2934 -5.2870 -5.0950 -5.0902 -5.0064 -5.0037 -2.7001 -2.6994 -2.6048 -2.5998 -2.5731 -2.5702 -2.4150 -2.4135 -2.0979 -2.0973 -1.9323 -1.9236 -1.6778 -1.6631 -1.6194 -1.6177 -1.6168 -1.6083 -1.5510 -1.5495 -0.3244 -0.3207 -0.3192 -0.3113 -0.2118 -0.2093 -0.0349 -0.0328 0.0406 0.0477 0.6341 0.6349 8.5926 8.5929 9.1077 9.1078 9.3367 9.3368 10.3375 10.3388 10.7424 10.7431 10.8201 10.8216 k = 0.4127 0.4399-0.0000 ( 6884 PWs) bands (ev): -20.2535 -20.2534 -20.2089 -20.2087 -17.8201 -17.8174 -17.7281 -17.7264 -17.3974 -17.3948 -17.3910 -17.3901 -17.3596 -17.3588 -17.3425 -17.3425 -8.0894 -8.0893 -7.5260 -7.5247 -6.8112 -6.8075 -6.2415 -6.2397 -5.3040 -5.2988 -5.2876 -5.2806 -5.1015 -5.0969 -5.0023 -4.9999 -2.6998 -2.6989 -2.6159 -2.6106 -2.5758 -2.5728 -2.4251 -2.4235 -2.0944 -2.0938 -1.9078 -1.8984 -1.6791 -1.6648 -1.6169 -1.6149 -1.6117 -1.6020 -1.5531 -1.5514 -0.3359 -0.3269 -0.3244 -0.3186 -0.1997 -0.1979 -0.0638 -0.0609 0.0466 0.0537 0.6177 0.6186 8.6161 8.6164 9.1469 9.1470 9.3408 9.3408 10.3093 10.3107 10.7554 10.7562 10.8456 10.8476 k = 0.4048 0.4536-0.0000 ( 6880 PWs) bands (ev): -20.2508 -20.2506 -20.2095 -20.2093 -17.8187 -17.8158 -17.7335 -17.7316 -17.3975 -17.3946 -17.3912 -17.3902 -17.3601 -17.3594 -17.3430 -17.3430 -8.0628 -8.0627 -7.5371 -7.5357 -6.7991 -6.7952 -6.2691 -6.2672 -5.2960 -5.2902 -5.2817 -5.2740 -5.1085 -5.1041 -4.9982 -4.9961 -2.7001 -2.6991 -2.6253 -2.6199 -2.5789 -2.5756 -2.4349 -2.4333 -2.0911 -2.0905 -1.8837 -1.8736 -1.6810 -1.6670 -1.6150 -1.6127 -1.6050 -1.5958 -1.5552 -1.5534 -0.3496 -0.3405 -0.3243 -0.3183 -0.1875 -0.1869 -0.0930 -0.0888 0.0505 0.0576 0.6016 0.6025 8.6410 8.6414 9.1889 9.1891 9.3450 9.3450 10.2713 10.2728 10.7689 10.7696 10.8697 10.8724 k = 0.3968 0.4674-0.0000 ( 6880 PWs) bands (ev): -20.2479 -20.2477 -20.2102 -20.2100 -17.8169 -17.8139 -17.7391 -17.7371 -17.3976 -17.3944 -17.3914 -17.3903 -17.3607 -17.3599 -17.3435 -17.3435 -8.0344 -8.0343 -7.5510 -7.5496 -6.7841 -6.7801 -6.2983 -6.2962 -5.2881 -5.2820 -5.2752 -5.2670 -5.1160 -5.1116 -4.9943 -4.9925 -2.7013 -2.7003 -2.6326 -2.6271 -2.5821 -2.5786 -2.4443 -2.4427 -2.0880 -2.0874 -1.8601 -1.8493 -1.6834 -1.6696 -1.6127 -1.6101 -1.5989 -1.5900 -1.5575 -1.5555 -0.3615 -0.3523 -0.3240 -0.3177 -0.1785 -0.1764 -0.1207 -0.1136 0.0522 0.0591 0.5862 0.5872 8.6672 8.6675 9.2336 9.2338 9.3492 9.3492 10.2231 10.2247 10.7825 10.7833 10.8914 10.8947 k = 0.3889 0.4811-0.0000 ( 6878 PWs) bands (ev): -20.2449 -20.2447 -20.2111 -20.2109 -17.8149 -17.8116 -17.7450 -17.7428 -17.3976 -17.3943 -17.3916 -17.3904 -17.3612 -17.3605 -17.3440 -17.3439 -8.0044 -8.0042 -7.5678 -7.5664 -6.7661 -6.7620 -6.3289 -6.3265 -5.2806 -5.2753 -5.2670 -5.2594 -5.1238 -5.1197 -4.9906 -4.9891 -2.7036 -2.7026 -2.6374 -2.6320 -2.5856 -2.5820 -2.4531 -2.4516 -2.0850 -2.0845 -1.8376 -1.8261 -1.6864 -1.6728 -1.6100 -1.6072 -1.5934 -1.5848 -1.5598 -1.5576 -0.3713 -0.3621 -0.3238 -0.3171 -0.1800 -0.1744 -0.1383 -0.1275 0.0514 0.0581 0.5720 0.5729 8.6941 8.6944 9.2805 9.2808 9.3536 9.3536 10.1653 10.1668 10.7960 10.7968 10.9101 10.9139 k = 0.3810 0.4949-0.0000 ( 6874 PWs) bands (ev): -20.2418 -20.2417 -20.2122 -20.2120 -17.8125 -17.8090 -17.7510 -17.7487 -17.3977 -17.3941 -17.3918 -17.3905 -17.3617 -17.3610 -17.3444 -17.3443 -7.9729 -7.9727 -7.5876 -7.5863 -6.7453 -6.7411 -6.3606 -6.3581 -5.2741 -5.2702 -5.2572 -5.2509 -5.1322 -5.1281 -4.9872 -4.9860 -2.7068 -2.7060 -2.6397 -2.6346 -2.5894 -2.5858 -2.4612 -2.4597 -2.0823 -2.0818 -1.8165 -1.8043 -1.6899 -1.6765 -1.6068 -1.6038 -1.5886 -1.5803 -1.5621 -1.5596 -0.3787 -0.3696 -0.3239 -0.3167 -0.1969 -0.1934 -0.1333 -0.1241 0.0478 0.0544 0.5593 0.5602 8.7214 8.7217 9.3285 9.3288 9.3590 9.3590 10.0992 10.1007 10.8090 10.8098 10.9256 10.9298 k = 0.3730 0.5086-0.0000 ( 6876 PWs) bands (ev): -20.2388 -20.2386 -20.2135 -20.2133 -17.8097 -17.8061 -17.7571 -17.7547 -17.3978 -17.3939 -17.3920 -17.3905 -17.3620 -17.3615 -17.3447 -17.3447 -7.9401 -7.9398 -7.6103 -7.6091 -6.7216 -6.7174 -6.3935 -6.3908 -5.2687 -5.2662 -5.2466 -5.2415 -5.1409 -5.1370 -4.9841 -4.9831 -2.7106 -2.7101 -2.6398 -2.6350 -2.5935 -2.5898 -2.4685 -2.4671 -2.0798 -2.0794 -1.7971 -1.7842 -1.6941 -1.6810 -1.6033 -1.6002 -1.5847 -1.5765 -1.5644 -1.5616 -0.3836 -0.3746 -0.3248 -0.3169 -0.2197 -0.2184 -0.1196 -0.1121 0.0415 0.0477 0.5484 0.5492 8.7484 8.7487 9.3571 9.3571 9.3855 9.3858 10.0270 10.0284 10.8214 10.8221 10.9384 10.9428 k = 0.3651 0.5224-0.0000 ( 6868 PWs) bands (ev): -20.2357 -20.2355 -20.2151 -20.2148 -17.8065 -17.8027 -17.7633 -17.7607 -17.3978 -17.3937 -17.3922 -17.3906 -17.3623 -17.3619 -17.3450 -17.3450 -7.9061 -7.9058 -7.6358 -7.6347 -6.6953 -6.6911 -6.4272 -6.4243 -5.2644 -5.2628 -5.2357 -5.2313 -5.1501 -5.1464 -4.9815 -4.9807 -2.7146 -2.7142 -2.6382 -2.6336 -2.5978 -2.5942 -2.4746 -2.4734 -2.0777 -2.0772 -1.7797 -1.7661 -1.6989 -1.6862 -1.5995 -1.5966 -1.5818 -1.5736 -1.5665 -1.5633 -0.3858 -0.3768 -0.3273 -0.3187 -0.2417 -0.2413 -0.1037 -0.0970 0.0323 0.0383 0.5396 0.5403 8.7743 8.7746 9.3621 9.3621 9.4370 9.4374 9.9509 9.9521 10.8325 10.8333 10.9489 10.9536 k = 0.3571 0.5361-0.0000 ( 6874 PWs) bands (ev): -20.2326 -20.2324 -20.2168 -20.2166 -17.8029 -17.7988 -17.7693 -17.7667 -17.3979 -17.3935 -17.3925 -17.3907 -17.3626 -17.3622 -17.3452 -17.3452 -7.8712 -7.8708 -7.6641 -7.6631 -6.6666 -6.6623 -6.4616 -6.4586 -5.2612 -5.2602 -5.2245 -5.2207 -5.1597 -5.1561 -4.9793 -4.9787 -2.7182 -2.7180 -2.6352 -2.6308 -2.6024 -2.5991 -2.4796 -2.4786 -2.0758 -2.0755 -1.7645 -1.7503 -1.7043 -1.6923 -1.5956 -1.5931 -1.5797 -1.5717 -1.5682 -1.5646 -0.3851 -0.3762 -0.3324 -0.3234 -0.2601 -0.2586 -0.0867 -0.0804 0.0205 0.0260 0.5329 0.5334 8.7980 8.7983 9.3651 9.3651 9.4915 9.4919 9.8734 9.8746 10.8421 10.8428 10.9575 10.9625 k = 0.3492 0.5499-0.0000 ( 6868 PWs) bands (ev): -20.2296 -20.2294 -20.2189 -20.2186 -17.7989 -17.7945 -17.7752 -17.7727 -17.3979 -17.3934 -17.3927 -17.3907 -17.3627 -17.3625 -17.3454 -17.3454 -7.8356 -7.8351 -7.6948 -7.6939 -6.6356 -6.6313 -6.4966 -6.4934 -5.2589 -5.2584 -5.2133 -5.2097 -5.1696 -5.1662 -4.9776 -4.9773 -2.7211 -2.7210 -2.6313 -2.6268 -2.6072 -2.6043 -2.4832 -2.4825 -2.0744 -2.0741 -1.7518 -1.7366 -1.7101 -1.6991 -1.5921 -1.5904 -1.5787 -1.5705 -1.5694 -1.5653 -0.3817 -0.3727 -0.3409 -0.3324 -0.2715 -0.2699 -0.0689 -0.0628 0.0063 0.0112 0.5283 0.5286 8.8179 8.8181 9.3673 9.3673 9.5476 9.5480 9.7975 9.7985 10.8497 10.8502 10.9639 10.9697 k = 0.3413 0.5636-0.0000 ( 6882 PWs) bands (ev): -20.2267 -20.2264 -20.2212 -20.2210 -17.7947 -17.7897 -17.7806 -17.7785 -17.3979 -17.3932 -17.3929 -17.3907 -17.3628 -17.3627 -17.3455 -17.3455 -7.7995 -7.7989 -7.7279 -7.7271 -6.6029 -6.5984 -6.5318 -6.5285 -5.2574 -5.2572 -5.2022 -5.1986 -5.1799 -5.1767 -4.9766 -4.9764 -2.7230 -2.7230 -2.6270 -2.6220 -2.6120 -2.6099 -2.4854 -2.4850 -2.0734 -2.0733 -1.7424 -1.7253 -1.7154 -1.7068 -1.5895 -1.5887 -1.5784 -1.5700 -1.5699 -1.5654 -0.3759 -0.3662 -0.3512 -0.3445 -0.2764 -0.2756 -0.0508 -0.0444 -0.0098 -0.0058 0.5257 0.5259 8.8319 8.8320 9.3687 9.3687 9.6047 9.6052 9.7261 9.7269 10.8547 10.8550 10.9675 10.9748 k = 0.3333 0.5774-0.0000 ( 6882 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7921 -17.7848 -17.7837 -17.7837 -17.3980 -17.3930 -17.3930 -17.3907 -17.3628 -17.3628 -17.3455 -17.3455 -7.7651 -7.7637 -7.7614 -7.7614 -6.5736 -6.5656 -6.5621 -6.5621 -5.2569 -5.2569 -5.1934 -5.1884 -5.1884 -5.1868 -4.9762 -4.9762 -2.7237 -2.7237 -2.6244 -2.6176 -2.6147 -2.6147 -2.4860 -2.4860 -2.0730 -2.0730 -1.7384 -1.7178 -1.7178 -1.7134 -1.5884 -1.5884 -1.5784 -1.5699 -1.5699 -1.5653 -0.3713 -0.3574 -0.3574 -0.3561 -0.2773 -0.2773 -0.0377 -0.0278 -0.0222 -0.0222 0.5249 0.5249 8.8373 8.8373 9.3692 9.3692 9.6609 9.6619 9.6645 9.6645 10.8566 10.8566 10.9683 10.9772 k = 0.3333 0.5774-0.0000 ( 6882 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7921 -17.7848 -17.7837 -17.7837 -17.3980 -17.3930 -17.3930 -17.3907 -17.3628 -17.3628 -17.3455 -17.3455 -7.7651 -7.7637 -7.7614 -7.7614 -6.5736 -6.5656 -6.5621 -6.5621 -5.2569 -5.2569 -5.1934 -5.1884 -5.1884 -5.1868 -4.9762 -4.9762 -2.7237 -2.7237 -2.6244 -2.6176 -2.6147 -2.6147 -2.4860 -2.4860 -2.0730 -2.0730 -1.7384 -1.7178 -1.7178 -1.7134 -1.5884 -1.5884 -1.5784 -1.5699 -1.5699 -1.5653 -0.3713 -0.3574 -0.3574 -0.3561 -0.2773 -0.2773 -0.0377 -0.0278 -0.0222 -0.0222 0.5249 0.5249 8.8373 8.8373 9.3692 9.3692 9.6609 9.6619 9.6645 9.6645 10.8566 10.8566 10.9683 10.9772 k = 0.3254 0.5636-0.0000 ( 6878 PWs) bands (ev): -20.2268 -20.2265 -20.2211 -20.2209 -17.7949 -17.7897 -17.7807 -17.7782 -17.3979 -17.3932 -17.3929 -17.3907 -17.3628 -17.3627 -17.3455 -17.3455 -7.8005 -7.7999 -7.7270 -7.7262 -6.6036 -6.5989 -6.5313 -6.5278 -5.2574 -5.2573 -5.2022 -5.1988 -5.1798 -5.1767 -4.9766 -4.9764 -2.7230 -2.7229 -2.6274 -2.6227 -2.6113 -2.6096 -2.4853 -2.4850 -2.0735 -2.0733 -1.7419 -1.7252 -1.7150 -1.7075 -1.5891 -1.5888 -1.5785 -1.5703 -1.5699 -1.5654 -0.3758 -0.3668 -0.3497 -0.3445 -0.2768 -0.2761 -0.0516 -0.0457 -0.0083 -0.0049 0.5256 0.5258 8.8308 8.8310 9.3687 9.3687 9.6109 9.6112 9.7212 9.7218 10.8545 10.8548 10.9679 10.9765 k = 0.3175 0.5499-0.0000 ( 6874 PWs) bands (ev): -20.2300 -20.2297 -20.2186 -20.2184 -17.7996 -17.7949 -17.7748 -17.7717 -17.3979 -17.3933 -17.3927 -17.3907 -17.3627 -17.3625 -17.3454 -17.3454 -7.8395 -7.8390 -7.6914 -7.6904 -6.6382 -6.6335 -6.4944 -6.4907 -5.2588 -5.2585 -5.2135 -5.2103 -5.1694 -5.1662 -4.9777 -4.9775 -2.7208 -2.7206 -2.6330 -2.6293 -2.6049 -2.6025 -2.4831 -2.4823 -2.0747 -2.0744 -1.7492 -1.7348 -1.7103 -1.7014 -1.5907 -1.5904 -1.5794 -1.5718 -1.5700 -1.5657 -0.3808 -0.3734 -0.3355 -0.3296 -0.2748 -0.2737 -0.0721 -0.0672 0.0116 0.0154 0.5277 0.5281 8.8100 8.8103 9.3670 9.3670 9.5739 9.5739 9.7799 9.7806 10.8480 10.8487 10.9659 10.9741 k = 0.3095 0.5361-0.0000 ( 6870 PWs) bands (ev): -20.2335 -20.2333 -20.2163 -20.2160 -17.8043 -17.7997 -17.7678 -17.7645 -17.3978 -17.3934 -17.3925 -17.3906 -17.3626 -17.3623 -17.3452 -17.3452 -7.8801 -7.8797 -7.6568 -7.6556 -6.6721 -6.6670 -6.4564 -6.4527 -5.2609 -5.2607 -5.2251 -5.2220 -5.1595 -5.1560 -4.9797 -4.9793 -2.7170 -2.7168 -2.6394 -2.6361 -2.5974 -2.5948 -2.4791 -2.4780 -2.0769 -2.0763 -1.7577 -1.7449 -1.7057 -1.6965 -1.5928 -1.5925 -1.5820 -1.5751 -1.5699 -1.5658 -0.3824 -0.3758 -0.3183 -0.3123 -0.2719 -0.2705 -0.0938 -0.0893 0.0325 0.0364 0.5310 0.5315 8.7734 8.7738 9.3641 9.3641 9.5531 9.5532 9.8387 9.8393 10.8366 10.8377 10.9597 10.9672 k = 0.3016 0.5224-0.0000 ( 6878 PWs) bands (ev): -20.2374 -20.2371 -20.2142 -20.2139 -17.8088 -17.8042 -17.7602 -17.7567 -17.3977 -17.3935 -17.3923 -17.3905 -17.3624 -17.3619 -17.3450 -17.3450 -7.9222 -7.9218 -7.6237 -7.6222 -6.7046 -6.6992 -6.4177 -6.4141 -5.2640 -5.2637 -5.2370 -5.2340 -5.1501 -5.1465 -4.9824 -4.9819 -2.7116 -2.7112 -2.6461 -2.6432 -2.5891 -2.5863 -2.4735 -2.4720 -2.0801 -2.0793 -1.7666 -1.7550 -1.7019 -1.6926 -1.5954 -1.5951 -1.5868 -1.5805 -1.5695 -1.5656 -0.3799 -0.3736 -0.2989 -0.2930 -0.2685 -0.2668 -0.1157 -0.1115 0.0541 0.0580 0.5353 0.5359 8.7218 8.7223 9.3598 9.3599 9.5480 9.5483 9.8971 9.8978 10.8199 10.8213 10.9489 10.9565 k = 0.2937 0.5086-0.0000 ( 6886 PWs) bands (ev): -20.2416 -20.2413 -20.2124 -20.2121 -17.8129 -17.8082 -17.7518 -17.7482 -17.3976 -17.3935 -17.3920 -17.3904 -17.3621 -17.3616 -17.3447 -17.3447 -7.9656 -7.9653 -7.5927 -7.5910 -6.7351 -6.7293 -6.3786 -6.3751 -5.2681 -5.2677 -5.2490 -5.2462 -5.1413 -5.1375 -4.9860 -4.9854 -2.7046 -2.7040 -2.6529 -2.6502 -2.5800 -2.5771 -2.4662 -2.4644 -2.0845 -2.0834 -1.7754 -1.7649 -1.6988 -1.6897 -1.5989 -1.5986 -1.5932 -1.5873 -1.5687 -1.5652 -0.3729 -0.3669 -0.2782 -0.2725 -0.2645 -0.2625 -0.1369 -0.1329 0.0762 0.0800 0.5403 0.5411 8.6575 8.6582 9.3541 9.3542 9.5565 9.5570 9.9550 9.9558 10.7976 10.7992 10.9341 10.9422 k = 0.2857 0.4949-0.0000 ( 6882 PWs) bands (ev): -20.2461 -20.2459 -20.2108 -20.2105 -17.8166 -17.8118 -17.7427 -17.7391 -17.3974 -17.3935 -17.3917 -17.3903 -17.3617 -17.3611 -17.3444 -17.3443 -8.0101 -8.0098 -7.5647 -7.5627 -6.7628 -6.7566 -6.3394 -6.3358 -5.2732 -5.2726 -5.2611 -5.2585 -5.1332 -5.1293 -4.9904 -4.9898 -2.6959 -2.6952 -2.6597 -2.6573 -2.5702 -2.5671 -2.4573 -2.4552 -2.0900 -2.0887 -1.7839 -1.7743 -1.6966 -1.6876 -1.6058 -1.6048 -1.5981 -1.5939 -1.5676 -1.5646 -0.3615 -0.3557 -0.2604 -0.2591 -0.2572 -0.2511 -0.1557 -0.1519 0.0988 0.1025 0.5461 0.5469 8.5836 8.5843 9.3468 9.3469 9.5756 9.5761 10.0122 10.0131 10.7694 10.7713 10.9159 10.9245 k = 0.2778 0.4811-0.0000 ( 6876 PWs) bands (ev): -20.2509 -20.2507 -20.2095 -20.2092 -17.8198 -17.8149 -17.7329 -17.7293 -17.3971 -17.3934 -17.3915 -17.3900 -17.3613 -17.3606 -17.3440 -17.3439 -8.0555 -8.0553 -7.5405 -7.5381 -6.7869 -6.7802 -6.3001 -6.2967 -5.2799 -5.2789 -5.2725 -5.2705 -5.1260 -5.1218 -4.9957 -4.9950 -2.6857 -2.6850 -2.6663 -2.6642 -2.5594 -2.5562 -2.4468 -2.4445 -2.0968 -2.0952 -1.7916 -1.7829 -1.6953 -1.6866 -1.6165 -1.6144 -1.6012 -1.5985 -1.5662 -1.5637 -0.3459 -0.3402 -0.2558 -0.2542 -0.2407 -0.2355 -0.1675 -0.1644 0.1217 0.1254 0.5523 0.5533 8.5029 8.5036 9.3380 9.3381 9.6025 9.6030 10.0684 10.0693 10.7355 10.7374 10.8946 10.9038 k = 0.2698 0.4674-0.0000 ( 6878 PWs) bands (ev): -20.2560 -20.2558 -20.2085 -20.2081 -17.8225 -17.8175 -17.7225 -17.7189 -17.3968 -17.3933 -17.3912 -17.3897 -17.3608 -17.3601 -17.3435 -17.3435 -8.1018 -8.1017 -7.5211 -7.5184 -6.8063 -6.7993 -6.2611 -6.2577 -5.2898 -5.2878 -5.2818 -5.2809 -5.1196 -5.1153 -5.0019 -5.0012 -2.6754 -2.6743 -2.6708 -2.6707 -2.5477 -2.5443 -2.4348 -2.4323 -2.1048 -2.1030 -1.7986 -1.7907 -1.6952 -1.6870 -1.6286 -1.6264 -1.6039 -1.6017 -1.5646 -1.5626 -0.3267 -0.3206 -0.2511 -0.2494 -0.2366 -0.2342 -0.1624 -0.1616 0.1451 0.1486 0.5589 0.5600 8.4174 8.4181 9.3275 9.3277 9.6349 9.6353 10.1235 10.1244 10.6959 10.6979 10.8710 10.8805 k = 0.2619 0.4536-0.0000 ( 6890 PWs) bands (ev): -20.2615 -20.2613 -20.2078 -20.2074 -17.8247 -17.8196 -17.7115 -17.7078 -17.3965 -17.3931 -17.3909 -17.3893 -17.3602 -17.3595 -17.3430 -17.3430 -8.1488 -8.1487 -7.5074 -7.5046 -6.8201 -6.8127 -6.2225 -6.2192 -5.3019 -5.2994 -5.2899 -5.2895 -5.1142 -5.1097 -5.0089 -5.0082 -2.6800 -2.6776 -2.6611 -2.6594 -2.5348 -2.5313 -2.4214 -2.4188 -2.1139 -2.1118 -1.8046 -1.7975 -1.6971 -1.6898 -1.6403 -1.6388 -1.6065 -1.6045 -1.5628 -1.5614 -0.3044 -0.2975 -0.2499 -0.2464 -0.2443 -0.2419 -0.1426 -0.1414 0.1687 0.1722 0.5658 0.5669 8.3290 8.3296 9.3153 9.3155 9.6709 9.6712 10.1772 10.1783 10.6511 10.6531 10.8454 10.8554 k = 0.2540 0.4399-0.0000 ( 6891 PWs) bands (ev): -20.2672 -20.2670 -20.2074 -20.2070 -17.8264 -17.8211 -17.6998 -17.6962 -17.3961 -17.3929 -17.3906 -17.3889 -17.3596 -17.3589 -17.3425 -17.3424 -8.1963 -8.1963 -7.5004 -7.4973 -6.8275 -6.8198 -6.1845 -6.1812 -5.3147 -5.3122 -5.2981 -5.2979 -5.1098 -5.1051 -5.0168 -5.0161 -2.6861 -2.6839 -2.6472 -2.6454 -2.5204 -2.5168 -2.4068 -2.4039 -2.1240 -2.1217 -1.8097 -1.8032 -1.7021 -1.6963 -1.6498 -1.6497 -1.6091 -1.6071 -1.5608 -1.5599 -0.2820 -0.2718 -0.2625 -0.2612 -0.2387 -0.2369 -0.1156 -0.1136 0.1926 0.1960 0.5729 0.5741 8.2388 8.2394 9.3015 9.3018 9.7090 9.7092 10.2296 10.2307 10.6014 10.6035 10.8184 10.8287 k = 0.2460 0.4261-0.0000 ( 6895 PWs) bands (ev): -20.2731 -20.2729 -20.2074 -20.2070 -17.8275 -17.8221 -17.6875 -17.6839 -17.3956 -17.3925 -17.3903 -17.3883 -17.3590 -17.3582 -17.3419 -17.3419 -8.2443 -8.2443 -7.5004 -7.4972 -6.8280 -6.8201 -6.1471 -6.1440 -5.3277 -5.3253 -5.3068 -5.3067 -5.1064 -5.1015 -5.0255 -5.0249 -2.6919 -2.6899 -2.6325 -2.6306 -2.5045 -2.5008 -2.3911 -2.3880 -2.1348 -2.1324 -1.8138 -1.8078 -1.7113 -1.7076 -1.6575 -1.6558 -1.6116 -1.6095 -1.5588 -1.5584 -0.2833 -0.2801 -0.2534 -0.2456 -0.2297 -0.2253 -0.0849 -0.0826 0.2168 0.2200 0.5802 0.5814 8.1477 8.1483 9.2861 9.2864 9.7480 9.7480 10.2805 10.2816 10.5476 10.5496 10.7904 10.8011 k = 0.2381 0.4124-0.0000 ( 6891 PWs) bands (ev): -20.2793 -20.2792 -20.2076 -20.2072 -17.8280 -17.8226 -17.6747 -17.6711 -17.3951 -17.3921 -17.3900 -17.3875 -17.3583 -17.3575 -17.3413 -17.3413 -8.2926 -8.2926 -7.5074 -7.5043 -6.8214 -6.8135 -6.1107 -6.1076 -5.3409 -5.3385 -5.3162 -5.3161 -5.1041 -5.0990 -5.0351 -5.0344 -2.6974 -2.6955 -2.6174 -2.6153 -2.4866 -2.4828 -2.3744 -2.3712 -2.1463 -2.1437 -1.8170 -1.8115 -1.7248 -1.7227 -1.6620 -1.6587 -1.6140 -1.6119 -1.5568 -1.5567 -0.2984 -0.2964 -0.2401 -0.2332 -0.2048 -0.2022 -0.0521 -0.0498 0.2411 0.2443 0.5875 0.5887 8.0565 8.0570 9.2692 9.2696 9.7867 9.7870 10.3297 10.3308 10.4903 10.4924 10.7617 10.7728 k = 0.2302 0.3986-0.0000 ( 6889 PWs) bands (ev): -20.2857 -20.2856 -20.2082 -20.2078 -17.8280 -17.8225 -17.6613 -17.6578 -17.3946 -17.3916 -17.3897 -17.3867 -17.3577 -17.3568 -17.3407 -17.3406 -8.3410 -8.3410 -7.5211 -7.5181 -6.8083 -6.8003 -6.0751 -6.0722 -5.3541 -5.3518 -5.3262 -5.3261 -5.1028 -5.0976 -5.0453 -5.0447 -2.7026 -2.7007 -2.6021 -2.5999 -2.4666 -2.4628 -2.3570 -2.3536 -2.1580 -2.1554 -1.8194 -1.8142 -1.7410 -1.7401 -1.6641 -1.6599 -1.6164 -1.6142 -1.5552 -1.5547 -0.3133 -0.3115 -0.2322 -0.2271 -0.1712 -0.1706 -0.0180 -0.0156 0.2655 0.2686 0.5948 0.5961 7.9656 7.9661 9.2508 9.2513 9.8242 9.8248 10.3762 10.3766 10.4313 10.4340 10.7327 10.7441 k = 0.2222 0.3849-0.0000 ( 6899 PWs) bands (ev): -20.2923 -20.2922 -20.2090 -20.2086 -17.8275 -17.8220 -17.6474 -17.6439 -17.3940 -17.3909 -17.3894 -17.3858 -17.3569 -17.3561 -17.3400 -17.3400 -8.3895 -8.3894 -7.5407 -7.5379 -6.7893 -6.7815 -6.0407 -6.0378 -5.3674 -5.3651 -5.3367 -5.3367 -5.1027 -5.0973 -5.0563 -5.0558 -2.7074 -2.7056 -2.5870 -2.5848 -2.4443 -2.4405 -2.3391 -2.3356 -2.1697 -2.1671 -1.8211 -1.8161 -1.7588 -1.7585 -1.6650 -1.6602 -1.6188 -1.6165 -1.5537 -1.5527 -0.3267 -0.3249 -0.2261 -0.2218 -0.1350 -0.1348 0.0172 0.0195 0.2900 0.2930 0.6021 0.6034 7.8754 7.8759 9.2311 9.2316 9.8597 9.8607 10.3637 10.3642 10.4274 10.4299 10.7036 10.7153 k = 0.2143 0.3712-0.0000 ( 6913 PWs) bands (ev): -20.2991 -20.2990 -20.2102 -20.2098 -17.8265 -17.8209 -17.6331 -17.6297 -17.3935 -17.3901 -17.3891 -17.3847 -17.3562 -17.3554 -17.3394 -17.3393 -8.4378 -8.4378 -7.5652 -7.5626 -6.7656 -6.7579 -6.0074 -6.0046 -5.3807 -5.3784 -5.3478 -5.3478 -5.1037 -5.0981 -5.0678 -5.0675 -2.7117 -2.7100 -2.5722 -2.5701 -2.4196 -2.4160 -2.3213 -2.3176 -2.1811 -2.1785 -1.8222 -1.8173 -1.7774 -1.7772 -1.6651 -1.6600 -1.6211 -1.6186 -1.5523 -1.5510 -0.3383 -0.3365 -0.2205 -0.2167 -0.0971 -0.0966 0.0532 0.0554 0.3145 0.3174 0.6093 0.6106 7.7863 7.7867 9.2102 9.2107 9.8923 9.8938 10.3001 10.3011 10.4713 10.4734 10.6747 10.6868 k = 0.2063 0.3574-0.0000 ( 6911 PWs) bands (ev): -20.3060 -20.3059 -20.2117 -20.2112 -17.8250 -17.8193 -17.6184 -17.6150 -17.3930 -17.3892 -17.3888 -17.3836 -17.3555 -17.3546 -17.3387 -17.3386 -8.4859 -8.4859 -7.5936 -7.5913 -6.7379 -6.7305 -5.9753 -5.9726 -5.3939 -5.3917 -5.3593 -5.3592 -5.1059 -5.1000 -5.0799 -5.0797 -2.7156 -2.7139 -2.5580 -2.5559 -2.3926 -2.3891 -2.3039 -2.3002 -2.1914 -2.1890 -1.8230 -1.8179 -1.7962 -1.7955 -1.6648 -1.6596 -1.6233 -1.6207 -1.5511 -1.5494 -0.3479 -0.3460 -0.2152 -0.2118 -0.0576 -0.0569 0.0897 0.0918 0.3390 0.3417 0.6164 0.6178 7.6985 7.6990 9.1882 9.1888 9.9212 9.9231 10.2343 10.2353 10.5147 10.5168 10.6463 10.6586 k = 0.1984 0.3437-0.0000 ( 6913 PWs) bands (ev): -20.3130 -20.3129 -20.2134 -20.2129 -17.8231 -17.8174 -17.6034 -17.6001 -17.3925 -17.3884 -17.3880 -17.3823 -17.3547 -17.3539 -17.3380 -17.3379 -8.5337 -8.5336 -7.6250 -7.6230 -6.7073 -6.7000 -5.9445 -5.9419 -5.4070 -5.4049 -5.3711 -5.3711 -5.1094 -5.1030 -5.0924 -5.0922 -2.7191 -2.7175 -2.5442 -2.5423 -2.3634 -2.3601 -2.2880 -2.2845 -2.1997 -2.1977 -1.8246 -1.8183 -1.8145 -1.8124 -1.6644 -1.6591 -1.6255 -1.6228 -1.5502 -1.5482 -0.3554 -0.3533 -0.2101 -0.2069 -0.0168 -0.0160 0.1267 0.1287 0.3633 0.3660 0.6235 0.6248 7.6124 7.6128 9.1653 9.1659 9.9455 9.9480 10.1674 10.1684 10.5567 10.5589 10.6185 10.6310 k = 0.1905 0.3299-0.0000 ( 6911 PWs) bands (ev): -20.3201 -20.3200 -20.2153 -20.2149 -17.8207 -17.8150 -17.5881 -17.5848 -17.3920 -17.3881 -17.3868 -17.3809 -17.3539 -17.3531 -17.3373 -17.3372 -8.5810 -8.5809 -7.6587 -7.6569 -6.6744 -6.6673 -5.9150 -5.9125 -5.4200 -5.4179 -5.3833 -5.3832 -5.1145 -5.1071 -5.1055 -5.1042 -2.7221 -2.7205 -2.5311 -2.5292 -2.3322 -2.3291 -2.2755 -2.2726 -2.2040 -2.2028 -1.8349 -1.8333 -1.8196 -1.8173 -1.6639 -1.6584 -1.6276 -1.6248 -1.5497 -1.5475 -0.3605 -0.3583 -0.2052 -0.2022 0.0249 0.0257 0.1639 0.1659 0.3875 0.3901 0.6303 0.6317 7.5280 7.5284 9.1416 9.1423 9.9646 9.9677 10.1002 10.1011 10.5903 10.5971 10.6008 10.6043 k = 0.1825 0.3162-0.0000 ( 6911 PWs) bands (ev): -20.3273 -20.3272 -20.2175 -20.2171 -17.8180 -17.8122 -17.5726 -17.5694 -17.3915 -17.3877 -17.3853 -17.3794 -17.3532 -17.3523 -17.3366 -17.3365 -8.6276 -8.6275 -7.6940 -7.6924 -6.6398 -6.6329 -5.8869 -5.8845 -5.4328 -5.4308 -5.3957 -5.3956 -5.1229 -5.1191 -5.1143 -5.1120 -2.7247 -2.7232 -2.5184 -2.5167 -2.2994 -2.2965 -2.2689 -2.2672 -2.2018 -2.2016 -1.8515 -1.8509 -1.8198 -1.8165 -1.6633 -1.6578 -1.6297 -1.6266 -1.5496 -1.5472 -0.3633 -0.3610 -0.2003 -0.1975 0.0673 0.0681 0.2013 0.2032 0.4115 0.4139 0.6370 0.6384 7.4457 7.4460 9.1172 9.1180 9.9780 9.9817 10.0330 10.0338 10.5656 10.5786 10.6356 10.6384 k = 0.1746 0.3024-0.0000 ( 6915 PWs) bands (ev): -20.3344 -20.3343 -20.2199 -20.2195 -17.8149 -17.8092 -17.5570 -17.5538 -17.3911 -17.3874 -17.3837 -17.3777 -17.3524 -17.3516 -17.3359 -17.3358 -8.6735 -8.6734 -7.7303 -7.7289 -6.6041 -6.5974 -5.8601 -5.8578 -5.4455 -5.4436 -5.4082 -5.4081 -5.1349 -5.1327 -5.1220 -5.1180 -2.7269 -2.7254 -2.5062 -2.5047 -2.2692 -2.2690 -2.2652 -2.2621 -2.1940 -2.1923 -1.8682 -1.8678 -1.8188 -1.8152 -1.6627 -1.6571 -1.6316 -1.6284 -1.5500 -1.5474 -0.3636 -0.3613 -0.1956 -0.1929 0.1102 0.1109 0.2387 0.2405 0.4351 0.4375 0.6435 0.6449 7.3654 7.3657 9.0924 9.0932 9.9663 9.9670 9.9854 9.9897 10.5414 10.5543 10.6716 10.6746 k = 0.1667 0.2887-0.0000 ( 6899 PWs) bands (ev): -20.3415 -20.3414 -20.2225 -20.2220 -17.8116 -17.8059 -17.5413 -17.5381 -17.3906 -17.3870 -17.3820 -17.3760 -17.3516 -17.3508 -17.3352 -17.3351 -8.7185 -8.7185 -7.7672 -7.7660 -6.5677 -6.5611 -5.8346 -5.8325 -5.4580 -5.4561 -5.4209 -5.4207 -5.1481 -5.1465 -5.1296 -5.1250 -2.7286 -2.7272 -2.4944 -2.4930 -2.2743 -2.2740 -2.2299 -2.2273 -2.1816 -2.1790 -1.8842 -1.8840 -1.8173 -1.8135 -1.6621 -1.6565 -1.6335 -1.6301 -1.5510 -1.5482 -0.3616 -0.3592 -0.1910 -0.1885 0.1532 0.1539 0.2760 0.2777 0.4585 0.4607 0.6498 0.6512 7.2875 7.2877 9.0672 9.0681 9.9004 9.9009 9.9868 9.9914 10.5189 10.5316 10.7045 10.7076 k = 0.1587 0.2749-0.0000 ( 6895 PWs) bands (ev): -20.3485 -20.3485 -20.2252 -20.2248 -17.8080 -17.8024 -17.5256 -17.5225 -17.3902 -17.3867 -17.3802 -17.3742 -17.3509 -17.3500 -17.3345 -17.3344 -8.7625 -8.7625 -7.8042 -7.8032 -6.5309 -6.5245 -5.8106 -5.8085 -5.4702 -5.4683 -5.4334 -5.4333 -5.1616 -5.1603 -5.1377 -5.1328 -2.7300 -2.7286 -2.4830 -2.4817 -2.2815 -2.2809 -2.1941 -2.1916 -2.1673 -2.1642 -1.8995 -1.8993 -1.8154 -1.8114 -1.6615 -1.6559 -1.6352 -1.6317 -1.5525 -1.5497 -0.3573 -0.3548 -0.1866 -0.1842 0.1962 0.1969 0.3130 0.3146 0.4813 0.4835 0.6559 0.6573 7.2120 7.2122 9.0419 9.0427 9.8356 9.8360 9.9822 9.9871 10.4983 10.5105 10.7329 10.7362 k = 0.1508 0.2612-0.0000 ( 6883 PWs) bands (ev): -20.3555 -20.3554 -20.2280 -20.2276 -17.8042 -17.7987 -17.5100 -17.5069 -17.3897 -17.3863 -17.3782 -17.3722 -17.3501 -17.3493 -17.3338 -17.3337 -8.8054 -8.8053 -7.8410 -7.8402 -6.4940 -6.4877 -5.7879 -5.7859 -5.4821 -5.4803 -5.4460 -5.4458 -5.1752 -5.1740 -5.1465 -5.1415 -2.7310 -2.7297 -2.4719 -2.4708 -2.2892 -2.2885 -2.1586 -2.1555 -2.1519 -2.1493 -1.9139 -1.9138 -1.8131 -1.8090 -1.6611 -1.6554 -1.6368 -1.6331 -1.5546 -1.5518 -0.3507 -0.3482 -0.1823 -0.1800 0.2390 0.2397 0.3496 0.3511 0.5037 0.5058 0.6618 0.6631 7.1391 7.1393 9.0164 9.0174 9.7722 9.7726 9.9722 9.9773 10.4795 10.4913 10.7548 10.7580 k = 0.1429 0.2474-0.0000 ( 6883 PWs) bands (ev): -20.3623 -20.3622 -20.2309 -20.2305 -17.8003 -17.7949 -17.4946 -17.4915 -17.3893 -17.3859 -17.3762 -17.3702 -17.3494 -17.3486 -17.3332 -17.3331 -8.8470 -8.8469 -7.8774 -7.8767 -6.4572 -6.4510 -5.7665 -5.7647 -5.4937 -5.4919 -5.4583 -5.4582 -5.1886 -5.1876 -5.1561 -5.1510 -2.7317 -2.7305 -2.4612 -2.4602 -2.2969 -2.2962 -2.1393 -2.1350 -2.1209 -2.1193 -1.9273 -1.9272 -1.8103 -1.8061 -1.6607 -1.6551 -1.6383 -1.6344 -1.5573 -1.5545 -0.3421 -0.3397 -0.1782 -0.1760 0.2814 0.2820 0.3856 0.3871 0.5256 0.5276 0.6674 0.6687 7.0689 7.0691 8.9911 8.9921 9.7105 9.7108 9.9574 9.9624 10.4627 10.4738 10.7666 10.7695 k = 0.1349 0.2337-0.0000 ( 6895 PWs) bands (ev): -20.3690 -20.3689 -20.2339 -20.2335 -17.7963 -17.7910 -17.4795 -17.4764 -17.3889 -17.3855 -17.3740 -17.3682 -17.3487 -17.3478 -17.3325 -17.3324 -8.8872 -8.8872 -7.9131 -7.9125 -6.4208 -6.4147 -5.7465 -5.7448 -5.5049 -5.5032 -5.4704 -5.4703 -5.2019 -5.2009 -5.1663 -5.1612 -2.7321 -2.7309 -2.4509 -2.4500 -2.3042 -2.3035 -2.1258 -2.1217 -2.0853 -2.0838 -1.9394 -1.9394 -1.8072 -1.8029 -1.6604 -1.6549 -1.6395 -1.6355 -1.5606 -1.5579 -0.3317 -0.3293 -0.1742 -0.1722 0.3231 0.3236 0.4210 0.4225 0.5468 0.5487 0.6727 0.6741 7.0016 7.0017 8.9660 8.9670 9.6508 9.6510 9.9384 9.9434 10.4476 10.4580 10.7640 10.7660 k = 0.1270 0.2199-0.0000 ( 6903 PWs) bands (ev): -20.3754 -20.3754 -20.2369 -20.2365 -17.7923 -17.7871 -17.4647 -17.4616 -17.3884 -17.3850 -17.3718 -17.3661 -17.3480 -17.3471 -17.3319 -17.3318 -8.9259 -8.9259 -7.9478 -7.9473 -6.3848 -6.3789 -5.7278 -5.7262 -5.5157 -5.5142 -5.4822 -5.4821 -5.2148 -5.2139 -5.1771 -5.1721 -2.7322 -2.7311 -2.4409 -2.4401 -2.3110 -2.3104 -2.1136 -2.1094 -2.0511 -2.0497 -1.9498 -1.9497 -1.8035 -1.7992 -1.6602 -1.6549 -1.6404 -1.6365 -1.5645 -1.5619 -0.3197 -0.3173 -0.1704 -0.1685 0.3639 0.3644 0.4556 0.4571 0.5674 0.5692 0.6778 0.6792 6.9373 6.9374 8.9412 8.9422 9.5933 9.5934 9.9163 9.9210 10.4342 10.4438 10.7458 10.7470 k = 0.1190 0.2062-0.0000 ( 6897 PWs) bands (ev): -20.3817 -20.3816 -20.2399 -20.2395 -17.7882 -17.7832 -17.4504 -17.4472 -17.3880 -17.3846 -17.3695 -17.3639 -17.3473 -17.3464 -17.3313 -17.3312 -8.9630 -8.9629 -7.9814 -7.9809 -6.3496 -6.3438 -5.7104 -5.7089 -5.5262 -5.5246 -5.4937 -5.4935 -5.2273 -5.2265 -5.1884 -5.1835 -2.7321 -2.7311 -2.4312 -2.4306 -2.3173 -2.3167 -2.1027 -2.0985 -2.0205 -2.0196 -1.9563 -1.9560 -1.7994 -1.7950 -1.6601 -1.6550 -1.6411 -1.6373 -1.5689 -1.5664 -0.3063 -0.3040 -0.1668 -0.1650 0.4037 0.4041 0.4893 0.4907 0.5872 0.5889 0.6827 0.6841 6.8760 6.8761 8.9169 8.9179 9.5382 9.5382 9.8917 9.8961 10.4223 10.4311 10.7165 10.7173 k = 0.1111 0.1925-0.0000 ( 6911 PWs) bands (ev): -20.3876 -20.3876 -20.2428 -20.2425 -17.7842 -17.7795 -17.4367 -17.4332 -17.3877 -17.3840 -17.3672 -17.3618 -17.3466 -17.3458 -17.3307 -17.3307 -8.9983 -8.9982 -8.0136 -8.0132 -6.3152 -6.3096 -5.6943 -5.6929 -5.5361 -5.5347 -5.5046 -5.5045 -5.2394 -5.2386 -5.2002 -5.1954 -2.7318 -2.7309 -2.4220 -2.4214 -2.3229 -2.3224 -2.0930 -2.0890 -2.0013 -2.0010 -1.9517 -1.9509 -1.7947 -1.7904 -1.6602 -1.6554 -1.6416 -1.6379 -1.5737 -1.5714 -0.2919 -0.2896 -0.1633 -0.1617 0.4420 0.4425 0.5218 0.5232 0.6062 0.6078 0.6872 0.6887 6.8180 6.8181 8.8932 8.8942 9.4858 9.4858 9.8654 9.8696 10.4116 10.4197 10.6817 10.6823 k = 0.1032 0.1787-0.0000 ( 6907 PWs) bands (ev): -20.3934 -20.3933 -20.2457 -20.2454 -17.7803 -17.7758 -17.4237 -17.4199 -17.3873 -17.3833 -17.3649 -17.3596 -17.3460 -17.3451 -17.3302 -17.3301 -9.0317 -9.0317 -8.0443 -8.0440 -6.2818 -6.2763 -5.6794 -5.6781 -5.5455 -5.5442 -5.5151 -5.5150 -5.2509 -5.2501 -5.2123 -5.2076 -2.7314 -2.7306 -2.4132 -2.4127 -2.3279 -2.3275 -2.0847 -2.0808 -1.9995 -1.9993 -1.9304 -1.9293 -1.7896 -1.7854 -1.6602 -1.6559 -1.6418 -1.6384 -1.5789 -1.5768 -0.2767 -0.2746 -0.1601 -0.1586 0.4789 0.4793 0.5531 0.5545 0.6244 0.6260 0.6915 0.6930 6.7634 6.7635 8.8702 8.8712 9.4362 9.4363 9.8383 9.8421 10.4022 10.4095 10.6450 10.6455 k = 0.0952 0.1650-0.0000 ( 6895 PWs) bands (ev): -20.3987 -20.3987 -20.2485 -20.2482 -17.7766 -17.7723 -17.4117 -17.4072 -17.3869 -17.3823 -17.3626 -17.3576 -17.3453 -17.3445 -17.3296 -17.3296 -9.0631 -9.0631 -8.0733 -8.0731 -6.2495 -6.2443 -5.6658 -5.6645 -5.5544 -5.5531 -5.5250 -5.5249 -5.2617 -5.2610 -5.2246 -5.2201 -2.7308 -2.7301 -2.4047 -2.4043 -2.3323 -2.3320 -2.0777 -2.0740 -2.0049 -2.0046 -1.9025 -1.9015 -1.7841 -1.7799 -1.6604 -1.6564 -1.6418 -1.6387 -1.5845 -1.5826 -0.2611 -0.2591 -0.1571 -0.1557 0.5139 0.5143 0.5829 0.5844 0.6418 0.6432 0.6956 0.6971 6.7122 6.7123 8.8480 8.8491 9.3897 9.3898 9.8108 9.8143 10.3938 10.4004 10.6081 10.6086 k = 0.0873 0.1512-0.0000 ( 6899 PWs) bands (ev): -20.4038 -20.4038 -20.2512 -20.2510 -17.7730 -17.7689 -17.4012 -17.3952 -17.3866 -17.3805 -17.3603 -17.3556 -17.3447 -17.3438 -17.3291 -17.3291 -9.0925 -9.0925 -8.1006 -8.1004 -6.2186 -6.2136 -5.6534 -5.6522 -5.5627 -5.5615 -5.5343 -5.5342 -5.2720 -5.2712 -5.2370 -5.2327 -2.7302 -2.7295 -2.3968 -2.3965 -2.3361 -2.3359 -2.0719 -2.0684 -2.0117 -2.0114 -1.8742 -1.8732 -1.7781 -1.7741 -1.6605 -1.6570 -1.6416 -1.6389 -1.5903 -1.5886 -0.2454 -0.2435 -0.1542 -0.1530 0.5469 0.5472 0.6111 0.6127 0.6582 0.6596 0.6993 0.7010 6.6646 6.6647 8.8269 8.8279 9.3464 9.3466 9.7837 9.7869 10.3864 10.3923 10.5721 10.5725 k = 0.0794 0.1375-0.0000 ( 6899 PWs) bands (ev): -20.4085 -20.4085 -20.2538 -20.2535 -17.7696 -17.7658 -17.3935 -17.3863 -17.3840 -17.3767 -17.3582 -17.3537 -17.3440 -17.3432 -17.3287 -17.3286 -9.1197 -9.1197 -8.1259 -8.1257 -6.1893 -6.1845 -5.6422 -5.6411 -5.5704 -5.5693 -5.5430 -5.5429 -5.2815 -5.2807 -5.2493 -5.2453 -2.7295 -2.7289 -2.3894 -2.3891 -2.3394 -2.3392 -2.0673 -2.0641 -2.0187 -2.0183 -1.8470 -1.8462 -1.7718 -1.7680 -1.6606 -1.6575 -1.6414 -1.6389 -1.5963 -1.5948 -0.2300 -0.2282 -0.1516 -0.1506 0.5774 0.5778 0.6374 0.6392 0.6738 0.6751 0.7028 0.7047 6.6207 6.6208 8.8068 8.8078 9.3065 9.3068 9.7575 9.7603 10.3798 10.3850 10.5377 10.5382 k = 0.0714 0.1237-0.0000 ( 6893 PWs) bands (ev): -20.4128 -20.4128 -20.2562 -20.2559 -17.7664 -17.7630 -17.3892 -17.3860 -17.3737 -17.3704 -17.3561 -17.3520 -17.3433 -17.3426 -17.3282 -17.3282 -9.1446 -9.1446 -8.1491 -8.1490 -6.1616 -6.1571 -5.6323 -5.6312 -5.5774 -5.5763 -5.5509 -5.5508 -5.2902 -5.2894 -5.2614 -5.2577 -2.7288 -2.7283 -2.3825 -2.3822 -2.3421 -2.3420 -2.0637 -2.0607 -2.0252 -2.0248 -1.8218 -1.8211 -1.7652 -1.7617 -1.6606 -1.6579 -1.6411 -1.6389 -1.6023 -1.6011 -0.2150 -0.2133 -0.1492 -0.1483 0.6054 0.6057 0.6616 0.6638 0.6885 0.6898 0.7062 0.7084 6.5807 6.5807 8.7880 8.7889 9.2702 9.2704 9.7325 9.7350 10.3739 10.3786 10.5055 10.5059 k = 0.0635 0.1100-0.0000 ( 6885 PWs) bands (ev): -20.4168 -20.4167 -20.2583 -20.2581 -17.7635 -17.7604 -17.3873 -17.3858 -17.3643 -17.3627 -17.3542 -17.3506 -17.3426 -17.3419 -17.3278 -17.3277 -9.1671 -9.1671 -8.1702 -8.1701 -6.1358 -6.1317 -5.6236 -5.6226 -5.5835 -5.5825 -5.5581 -5.5580 -5.2982 -5.2973 -5.2730 -5.2697 -2.7281 -2.7277 -2.3762 -2.3760 -2.3444 -2.3443 -2.0610 -2.0583 -2.0311 -2.0307 -1.7988 -1.7983 -1.7584 -1.7552 -1.6605 -1.6582 -1.6407 -1.6388 -1.6083 -1.6074 -0.2008 -0.1993 -0.1470 -0.1462 0.6304 0.6307 0.6830 0.6862 0.7022 0.7037 0.7096 0.7124 6.5445 6.5445 8.7706 8.7714 9.2375 9.2378 9.7091 9.7114 10.3688 10.3730 10.4758 10.4762 k = 0.0556 0.0962-0.0000 ( 6897 PWs) bands (ev): -20.4203 -20.4203 -20.2603 -20.2601 -17.7608 -17.7581 -17.3863 -17.3855 -17.3559 -17.3550 -17.3525 -17.3493 -17.3419 -17.3413 -17.3273 -17.3273 -9.1872 -9.1872 -8.1890 -8.1890 -6.1122 -6.1084 -5.6163 -5.6155 -5.5887 -5.5878 -5.5644 -5.5644 -5.3055 -5.3045 -5.2840 -5.2811 -2.7275 -2.7271 -2.3705 -2.3703 -2.3462 -2.3462 -2.0591 -2.0567 -2.0364 -2.0360 -1.7786 -1.7783 -1.7514 -1.7487 -1.6604 -1.6584 -1.6403 -1.6387 -1.6142 -1.6134 -0.1878 -0.1864 -0.1450 -0.1443 0.6521 0.6524 0.7000 0.7050 0.7124 0.7168 0.7170 0.7183 6.5123 6.5123 8.7547 8.7555 9.2085 9.2088 9.6878 9.6897 10.3643 10.3680 10.4490 10.4494 k = 0.0476 0.0825-0.0000 ( 6889 PWs) bands (ev): -20.4233 -20.4233 -20.2621 -20.2619 -17.7584 -17.7561 -17.3857 -17.3853 -17.3511 -17.3485 -17.3485 -17.3479 -17.3412 -17.3407 -17.3269 -17.3269 -9.2047 -9.2047 -8.2055 -8.2055 -6.0910 -6.0876 -5.6109 -5.6101 -5.5924 -5.5917 -5.5700 -5.5699 -5.3119 -5.3108 -5.2939 -5.2916 -2.7268 -2.7265 -2.3654 -2.3653 -2.3477 -2.3476 -2.0578 -2.0557 -2.0411 -2.0406 -1.7614 -1.7613 -1.7442 -1.7420 -1.6603 -1.6586 -1.6399 -1.6385 -1.6195 -1.6190 -0.1760 -0.1747 -0.1431 -0.1426 0.6703 0.6706 0.7095 0.7125 0.7256 0.7285 0.7291 0.7301 6.4842 6.4842 8.7406 8.7413 9.1833 9.1836 9.6688 9.6704 10.3603 10.3635 10.4254 10.4259 k = 0.0397 0.0687-0.0000 ( 6895 PWs) bands (ev): -20.4259 -20.4259 -20.2636 -20.2634 -17.7564 -17.7544 -17.3853 -17.3851 -17.3498 -17.3475 -17.3424 -17.3422 -17.3404 -17.3401 -17.3264 -17.3264 -9.2197 -9.2197 -8.2196 -8.2196 -6.0724 -6.0695 -5.6080 -5.6075 -5.5938 -5.5934 -5.5746 -5.5745 -5.3176 -5.3163 -5.3027 -5.3010 -2.7263 -2.7260 -2.3611 -2.3610 -2.3488 -2.3487 -2.0570 -2.0553 -2.0449 -2.0445 -1.7483 -1.7476 -1.7361 -1.7348 -1.6604 -1.6591 -1.6395 -1.6384 -1.6242 -1.6239 -0.1659 -0.1647 -0.1414 -0.1410 0.6848 0.6851 0.7140 0.7153 0.7390 0.7399 0.7421 0.7433 6.4603 6.4603 8.7283 8.7289 9.1620 9.1622 9.6523 9.6536 10.3567 10.3593 10.4055 10.4060 k = 0.0317 0.0550-0.0000 ( 6897 PWs) bands (ev): -20.4281 -20.4281 -20.2648 -20.2647 -17.7546 -17.7530 -17.3851 -17.3850 -17.3487 -17.3470 -17.3398 -17.3397 -17.3375 -17.3374 -17.3258 -17.3258 -9.2320 -9.2320 -8.2312 -8.2312 -6.0567 -6.0542 -5.6079 -5.6078 -5.5928 -5.5927 -5.5782 -5.5782 -5.3225 -5.3211 -5.3100 -5.3090 -2.7258 -2.7256 -2.3575 -2.3574 -2.3496 -2.3496 -2.0567 -2.0553 -2.0479 -2.0476 -1.7394 -1.7381 -1.7271 -1.7267 -1.6611 -1.6601 -1.6391 -1.6383 -1.6278 -1.6277 -0.1576 -0.1566 -0.1397 -0.1395 0.6957 0.6960 0.7172 0.7177 0.7496 0.7501 0.7545 0.7553 6.4407 6.4407 8.7180 8.7186 9.1445 9.1447 9.6385 9.6396 10.3532 10.3553 10.3896 10.3900 k = 0.0238 0.0412-0.0000 ( 6883 PWs) bands (ev): -20.4298 -20.4298 -20.2658 -20.2657 -17.7532 -17.7520 -17.3849 -17.3849 -17.3479 -17.3466 -17.3392 -17.3392 -17.3340 -17.3339 -17.3250 -17.3250 -9.2416 -9.2416 -8.2403 -8.2403 -6.0440 -6.0421 -5.6093 -5.6093 -5.5912 -5.5912 -5.5806 -5.5806 -5.3266 -5.3252 -5.3157 -5.3152 -2.7254 -2.7253 -2.3546 -2.3546 -2.3502 -2.3502 -2.0567 -2.0557 -2.0499 -2.0497 -1.7335 -1.7321 -1.7186 -1.7185 -1.6626 -1.6619 -1.6387 -1.6383 -1.6301 -1.6300 -0.1514 -0.1505 -0.1379 -0.1378 0.7033 0.7035 0.7199 0.7202 0.7582 0.7585 0.7646 0.7650 6.4253 6.4253 8.7099 8.7103 9.1309 9.1311 9.6277 9.6285 10.3496 10.3512 10.3780 10.3783 k = 0.0159 0.0275-0.0000 ( 6875 PWs) bands (ev): -20.4310 -20.4310 -20.2665 -20.2665 -17.7522 -17.7513 -17.3848 -17.3848 -17.3472 -17.3464 -17.3388 -17.3388 -17.3318 -17.3318 -17.3241 -17.3241 -9.2485 -9.2485 -8.2468 -8.2468 -6.0347 -6.0334 -5.6107 -5.6106 -5.5903 -5.5902 -5.5818 -5.5818 -5.3297 -5.3286 -5.3196 -5.3194 -2.7251 -2.7250 -2.3526 -2.3526 -2.3506 -2.3506 -2.0570 -2.0564 -2.0512 -2.0511 -1.7294 -1.7284 -1.7117 -1.7117 -1.6646 -1.6642 -1.6385 -1.6384 -1.6312 -1.6310 -0.1473 -0.1468 -0.1361 -0.1361 0.7078 0.7080 0.7224 0.7225 0.7647 0.7649 0.7719 0.7721 6.4143 6.4143 8.7041 8.7044 9.1212 9.1214 9.6199 9.6204 10.3461 10.3471 10.3708 10.3709 k = 0.0079 0.0137-0.0000 ( 6863 PWs) bands (ev): -20.4317 -20.4317 -20.2669 -20.2669 -17.7514 -17.7510 -17.3847 -17.3847 -17.3468 -17.3464 -17.3386 -17.3386 -17.3307 -17.3307 -17.3233 -17.3233 -9.2527 -9.2527 -8.2507 -8.2507 -6.0289 -6.0283 -5.6117 -5.6116 -5.5901 -5.5900 -5.5821 -5.5821 -5.3316 -5.3309 -5.3218 -5.3218 -2.7250 -2.7249 -2.3513 -2.3513 -2.3509 -2.3508 -2.0573 -2.0570 -2.0518 -2.0518 -1.7268 -1.7263 -1.7071 -1.7071 -1.6664 -1.6663 -1.6384 -1.6384 -1.6315 -1.6313 -0.1452 -0.1449 -0.1346 -0.1346 0.7102 0.7103 0.7242 0.7242 0.7687 0.7688 0.7763 0.7764 6.4077 6.4077 8.7006 8.7007 9.1154 9.1155 9.6152 9.6155 10.3435 10.3439 10.3671 10.3671 k = 0.0000 0.0000 0.0000 ( 6827 PWs) bands (ev): -20.4320 -20.4320 -20.2671 -20.2671 -17.7510 -17.7510 -17.3847 -17.3847 -17.3465 -17.3465 -17.3385 -17.3385 -17.3304 -17.3304 -17.3230 -17.3230 -9.2541 -9.2541 -8.2520 -8.2520 -6.0268 -6.0268 -5.6119 -5.6119 -5.5900 -5.5900 -5.5821 -5.5821 -5.3320 -5.3320 -5.3225 -5.3225 -2.7249 -2.7249 -2.3509 -2.3509 -2.3509 -2.3509 -2.0573 -2.0573 -2.0519 -2.0519 -1.7258 -1.7258 -1.7055 -1.7055 -1.6672 -1.6672 -1.6384 -1.6384 -1.6314 -1.6314 -0.1445 -0.1445 -0.1341 -0.1341 0.7109 0.7109 0.7249 0.7249 0.7701 0.7701 0.7778 0.7778 6.4055 6.4055 8.6994 8.6994 9.1135 9.1135 9.6138 9.6138 10.3426 10.3426 10.3659 10.3659 k = 0.0000 0.0000 0.0000 ( 6827 PWs) bands (ev): -20.4320 -20.4320 -20.2671 -20.2671 -17.7510 -17.7510 -17.3847 -17.3847 -17.3465 -17.3465 -17.3385 -17.3385 -17.3304 -17.3304 -17.3230 -17.3230 -9.2541 -9.2541 -8.2520 -8.2520 -6.0268 -6.0268 -5.6119 -5.6119 -5.5900 -5.5900 -5.5821 -5.5821 -5.3320 -5.3320 -5.3225 -5.3225 -2.7249 -2.7249 -2.3509 -2.3509 -2.3509 -2.3509 -2.0573 -2.0573 -2.0519 -2.0519 -1.7258 -1.7258 -1.7055 -1.7055 -1.6672 -1.6672 -1.6384 -1.6384 -1.6314 -1.6314 -0.1445 -0.1445 -0.1341 -0.1341 0.7109 0.7109 0.7249 0.7249 0.7701 0.7701 0.7778 0.7778 6.4055 6.4055 8.6994 8.6994 9.1135 9.1135 9.6138 9.6138 10.3426 10.3426 10.3659 10.3659 k = 0.0000 0.0000 0.0161 ( 6857 PWs) bands (ev): -20.4317 -20.4317 -20.2674 -20.2674 -17.7504 -17.7504 -17.3853 -17.3853 -17.3465 -17.3465 -17.3384 -17.3384 -17.3305 -17.3305 -17.3230 -17.3230 -9.2526 -9.2526 -8.2542 -8.2542 -6.0256 -6.0256 -5.6123 -5.6123 -5.5898 -5.5898 -5.5817 -5.5817 -5.3325 -5.3325 -5.3230 -5.3230 -2.7231 -2.7231 -2.3506 -2.3506 -2.3506 -2.3506 -2.0582 -2.0582 -2.0528 -2.0528 -1.7254 -1.7254 -1.7051 -1.7051 -1.6676 -1.6676 -1.6385 -1.6385 -1.6329 -1.6329 -0.1429 -0.1429 -0.1325 -0.1325 0.7095 0.7095 0.7234 0.7234 0.7701 0.7701 0.7778 0.7778 6.4078 6.4078 8.6751 8.6751 9.1379 9.1379 9.6149 9.6149 10.3446 10.3446 10.3679 10.3679 k = 0.0000 0.0000 0.0322 ( 6869 PWs) bands (ev): -20.4310 -20.4310 -20.2683 -20.2683 -17.7485 -17.7485 -17.3871 -17.3871 -17.3464 -17.3464 -17.3384 -17.3384 -17.3306 -17.3306 -17.3231 -17.3231 -9.2483 -9.2483 -8.2607 -8.2607 -6.0223 -6.0223 -5.6134 -5.6134 -5.5889 -5.5889 -5.5804 -5.5804 -5.3339 -5.3339 -5.3244 -5.3244 -2.7176 -2.7176 -2.3496 -2.3496 -2.3495 -2.3495 -2.0607 -2.0607 -2.0554 -2.0554 -1.7244 -1.7244 -1.7041 -1.7041 -1.6692 -1.6692 -1.6386 -1.6386 -1.6371 -1.6371 -0.1383 -0.1383 -0.1279 -0.1279 0.7052 0.7052 0.7191 0.7191 0.7702 0.7702 0.7777 0.7777 6.4145 6.4145 8.6142 8.6142 9.1989 9.1989 9.6184 9.6184 10.3506 10.3506 10.3739 10.3739 k = 0.0000 0.0000 0.0482 ( 6899 PWs) bands (ev): -20.4297 -20.4297 -20.2699 -20.2699 -17.7453 -17.7453 -17.3902 -17.3902 -17.3463 -17.3463 -17.3382 -17.3382 -17.3307 -17.3307 -17.3232 -17.3232 -9.2412 -9.2412 -8.2715 -8.2715 -6.0168 -6.0168 -5.6153 -5.6153 -5.5874 -5.5874 -5.5783 -5.5783 -5.3363 -5.3363 -5.3268 -5.3268 -2.7086 -2.7086 -2.3479 -2.3479 -2.3478 -2.3478 -2.0649 -2.0649 -2.0596 -2.0596 -1.7227 -1.7227 -1.7024 -1.7024 -1.6728 -1.6728 -1.6432 -1.6432 -1.6387 -1.6387 -0.1307 -0.1307 -0.1203 -0.1203 0.6982 0.6982 0.7119 0.7119 0.7702 0.7702 0.7775 0.7775 6.4257 6.4257 8.5348 8.5348 9.2782 9.2782 9.6242 9.6242 10.3605 10.3605 10.3838 10.3838 k = 0.0000 0.0000 0.0643 ( 6887 PWs) bands (ev): -20.4279 -20.4279 -20.2720 -20.2720 -17.7409 -17.7409 -17.3944 -17.3944 -17.3461 -17.3461 -17.3381 -17.3381 -17.3309 -17.3309 -17.3234 -17.3234 -9.2312 -9.2312 -8.2863 -8.2863 -6.0092 -6.0092 -5.6182 -5.6182 -5.5850 -5.5850 -5.5754 -5.5754 -5.3395 -5.3395 -5.3300 -5.3300 -2.6960 -2.6960 -2.3455 -2.3455 -2.3454 -2.3454 -2.0706 -2.0706 -2.0654 -2.0654 -1.7204 -1.7204 -1.7001 -1.7001 -1.6802 -1.6802 -1.6492 -1.6492 -1.6389 -1.6389 -0.1202 -0.1202 -0.1097 -0.1097 0.6884 0.6884 0.7020 0.7020 0.7703 0.7703 0.7773 0.7773 6.4414 6.4414 8.4469 8.4469 9.3654 9.3654 9.6322 9.6322 10.3742 10.3742 10.3975 10.3975 k = 0.0000 0.0000 0.0804 ( 6887 PWs) bands (ev): -20.4257 -20.4257 -20.2748 -20.2748 -17.7353 -17.7353 -17.3999 -17.3999 -17.3459 -17.3459 -17.3378 -17.3378 -17.3312 -17.3312 -17.3236 -17.3236 -9.2185 -9.2185 -8.3050 -8.3050 -5.9998 -5.9998 -5.6222 -5.6222 -5.5817 -5.5817 -5.5718 -5.5718 -5.3437 -5.3437 -5.3341 -5.3341 -2.6800 -2.6800 -2.3424 -2.3424 -2.3423 -2.3423 -2.0776 -2.0776 -2.0725 -2.0725 -1.7177 -1.7177 -1.6974 -1.6974 -1.6929 -1.6929 -1.6535 -1.6535 -1.6392 -1.6392 -0.1068 -0.1068 -0.0962 -0.0962 0.6759 0.6759 0.6893 0.6893 0.7704 0.7704 0.7771 0.7771 6.4615 6.4615 8.3551 8.3551 9.4554 9.4554 9.6424 9.6424 10.3917 10.3917 10.4150 10.4150 k = 0.0000 0.0000 0.0965 ( 6899 PWs) bands (ev): -20.4229 -20.4229 -20.2780 -20.2780 -17.7285 -17.7285 -17.4064 -17.4064 -17.3456 -17.3456 -17.3376 -17.3376 -17.3315 -17.3315 -17.3239 -17.3239 -9.2030 -9.2030 -8.3273 -8.3273 -5.9886 -5.9886 -5.6272 -5.6272 -5.5776 -5.5776 -5.5673 -5.5673 -5.3487 -5.3487 -5.3391 -5.3391 -2.6606 -2.6606 -2.3387 -2.3387 -2.3386 -2.3386 -2.0858 -2.0858 -2.0809 -2.0809 -1.7146 -1.7146 -1.7108 -1.7108 -1.6943 -1.6943 -1.6562 -1.6562 -1.6396 -1.6396 -0.0906 -0.0906 -0.0800 -0.0800 0.6607 0.6607 0.6740 0.6740 0.7705 0.7705 0.7769 0.7769 6.4858 6.4858 8.2618 8.2618 9.5451 9.5451 9.6548 9.6548 10.4129 10.4129 10.4361 10.4361 k = 0.0000 0.0000 0.1125 ( 6905 PWs) bands (ev): -20.4197 -20.4197 -20.2819 -20.2819 -17.7206 -17.7206 -17.4140 -17.4140 -17.3452 -17.3452 -17.3372 -17.3372 -17.3319 -17.3319 -17.3243 -17.3243 -9.1849 -9.1849 -8.3529 -8.3529 -5.9759 -5.9759 -5.6332 -5.6332 -5.5726 -5.5726 -5.5621 -5.5621 -5.3546 -5.3546 -5.3449 -5.3449 -2.6381 -2.6381 -2.3344 -2.3344 -2.3341 -2.3341 -2.0951 -2.0951 -2.0903 -2.0903 -1.7330 -1.7330 -1.7113 -1.7113 -1.6909 -1.6909 -1.6580 -1.6580 -1.6400 -1.6400 -0.0718 -0.0718 -0.0611 -0.0611 0.6429 0.6429 0.6562 0.6562 0.7706 0.7706 0.7766 0.7766 6.5144 6.5144 8.1681 8.1681 9.6321 9.6321 9.6691 9.6691 10.4374 10.4374 10.4606 10.4606 k = 0.0000 0.0000 0.1286 ( 6922 PWs) bands (ev): -20.4161 -20.4161 -20.2862 -20.2862 -17.7117 -17.7117 -17.4227 -17.4227 -17.3449 -17.3449 -17.3369 -17.3369 -17.3323 -17.3323 -17.3246 -17.3246 -9.1643 -9.1643 -8.3816 -8.3816 -5.9619 -5.9619 -5.6403 -5.6403 -5.5668 -5.5668 -5.5561 -5.5561 -5.3612 -5.3612 -5.3514 -5.3514 -2.6124 -2.6124 -2.3294 -2.3294 -2.3290 -2.3290 -2.1053 -2.1053 -2.1006 -2.1006 -1.7589 -1.7589 -1.7077 -1.7077 -1.6874 -1.6874 -1.6593 -1.6593 -1.6406 -1.6406 -0.0505 -0.0505 -0.0398 -0.0398 0.6228 0.6228 0.6359 0.6359 0.7708 0.7708 0.7764 0.7764 6.5472 6.5472 8.0746 8.0746 9.6854 9.6854 9.7141 9.7141 10.4652 10.4652 10.4883 10.4883 k = 0.0000 0.0000 0.1447 ( 6928 PWs) bands (ev): -20.4120 -20.4120 -20.2909 -20.2909 -17.7018 -17.7018 -17.4324 -17.4324 -17.3445 -17.3445 -17.3364 -17.3364 -17.3328 -17.3328 -17.3251 -17.3251 -9.1411 -9.1411 -8.4130 -8.4130 -5.9467 -5.9467 -5.6483 -5.6483 -5.5603 -5.5603 -5.5495 -5.5495 -5.3685 -5.3685 -5.3587 -5.3587 -2.5839 -2.5839 -2.3237 -2.3237 -2.3232 -2.3232 -2.1161 -2.1161 -2.1117 -2.1117 -1.7880 -1.7880 -1.7042 -1.7042 -1.6838 -1.6838 -1.6604 -1.6604 -1.6412 -1.6412 -0.0270 -0.0270 -0.0161 -0.0161 0.6004 0.6004 0.6134 0.6134 0.7710 0.7710 0.7761 0.7761 6.5840 6.5840 7.9820 7.9820 9.7034 9.7034 9.7889 9.7889 10.4961 10.4961 10.5191 10.5191 k = 0.0000 0.0000 0.1608 ( 6922 PWs) bands (ev): -20.4075 -20.4075 -20.2961 -20.2961 -17.6909 -17.6909 -17.4430 -17.4430 -17.3440 -17.3440 -17.3360 -17.3360 -17.3333 -17.3333 -17.3255 -17.3255 -9.1156 -9.1156 -8.4468 -8.4468 -5.9307 -5.9307 -5.6573 -5.6573 -5.5531 -5.5531 -5.5422 -5.5422 -5.3764 -5.3764 -5.3666 -5.3666 -2.5527 -2.5527 -2.3174 -2.3174 -2.3168 -2.3168 -2.1275 -2.1275 -2.1233 -2.1233 -1.8199 -1.8199 -1.7006 -1.7006 -1.6802 -1.6802 -1.6614 -1.6614 -1.6419 -1.6419 -0.0013 -0.0013 0.0097 0.0097 0.5759 0.5759 0.5888 0.5888 0.7712 0.7712 0.7759 0.7759 6.6247 6.6247 7.8905 7.8905 9.7230 9.7230 9.8538 9.8538 10.5297 10.5297 10.5527 10.5527 k = 0.0000 0.0000 0.1768 ( 6934 PWs) bands (ev): -20.4027 -20.4027 -20.3017 -20.3017 -17.6793 -17.6793 -17.4544 -17.4544 -17.3435 -17.3435 -17.3355 -17.3355 -17.3338 -17.3338 -17.3260 -17.3260 -9.0879 -9.0879 -8.4826 -8.4826 -5.9140 -5.9140 -5.6672 -5.6672 -5.5452 -5.5452 -5.5343 -5.5343 -5.3850 -5.3850 -5.3751 -5.3751 -2.5189 -2.5189 -2.3106 -2.3106 -2.3098 -2.3098 -2.1393 -2.1393 -2.1353 -2.1353 -1.8544 -1.8544 -1.6970 -1.6970 -1.6767 -1.6767 -1.6625 -1.6625 -1.6427 -1.6427 0.0263 0.0263 0.0374 0.0374 0.5494 0.5494 0.5622 0.5622 0.7714 0.7714 0.7756 0.7756 6.6693 6.6693 7.8003 7.8003 9.7441 9.7441 9.9065 9.9065 10.5658 10.5658 10.5887 10.5887 k = 0.0000 0.0000 0.1929 ( 6928 PWs) bands (ev): -20.3974 -20.3974 -20.3075 -20.3075 -17.6668 -17.6668 -17.4667 -17.4667 -17.3430 -17.3430 -17.3350 -17.3350 -17.3343 -17.3343 -17.3265 -17.3265 -9.0580 -9.0580 -8.5201 -8.5201 -5.8967 -5.8967 -5.6780 -5.6780 -5.5368 -5.5368 -5.5259 -5.5259 -5.3941 -5.3941 -5.3841 -5.3841 -2.4829 -2.4829 -2.3031 -2.3031 -2.3022 -2.3022 -2.1514 -2.1514 -2.1476 -2.1476 -1.8912 -1.8912 -1.6936 -1.6936 -1.6732 -1.6732 -1.6636 -1.6636 -1.6436 -1.6436 0.0556 0.0556 0.0668 0.0668 0.5211 0.5211 0.5338 0.5338 0.7716 0.7716 0.7754 0.7754 6.7175 6.7175 7.7117 7.7117 9.7664 9.7664 9.9457 9.9457 10.6042 10.6042 10.6269 10.6269 k = 0.0000 0.0000 0.2090 ( 6928 PWs) bands (ev): -20.3919 -20.3919 -20.3137 -20.3137 -17.6537 -17.6537 -17.4796 -17.4796 -17.3424 -17.3424 -17.3349 -17.3349 -17.3344 -17.3344 -17.3271 -17.3271 -9.0262 -9.0262 -8.5589 -8.5589 -5.8792 -5.8792 -5.6896 -5.6896 -5.5279 -5.5279 -5.5170 -5.5170 -5.4037 -5.4037 -5.3936 -5.3936 -2.4449 -2.4449 -2.2950 -2.2950 -2.2939 -2.2939 -2.1637 -2.1637 -2.1601 -2.1601 -1.9300 -1.9300 -1.6903 -1.6903 -1.6699 -1.6699 -1.6647 -1.6647 -1.6446 -1.6446 0.0864 0.0864 0.0977 0.0977 0.4913 0.4913 0.5039 0.5039 0.7718 0.7718 0.7751 0.7751 6.7694 6.7694 7.6249 7.6249 9.7897 9.7897 9.9712 9.9712 10.6444 10.6444 10.6671 10.6671 k = 0.0000 0.0000 0.2251 ( 6928 PWs) bands (ev): -20.3861 -20.3861 -20.3201 -20.3201 -17.6400 -17.6400 -17.4931 -17.4931 -17.3419 -17.3419 -17.3355 -17.3355 -17.3339 -17.3339 -17.3276 -17.3276 -8.9925 -8.9925 -8.5988 -8.5988 -5.8615 -5.8615 -5.7021 -5.7021 -5.5185 -5.5185 -5.5076 -5.5076 -5.4137 -5.4137 -5.4035 -5.4035 -2.4050 -2.4050 -2.2863 -2.2863 -2.2851 -2.2851 -2.1760 -2.1760 -2.1727 -2.1727 -1.9706 -1.9706 -1.6872 -1.6872 -1.6668 -1.6668 -1.6660 -1.6660 -1.6458 -1.6458 0.1185 0.1185 0.1299 0.1299 0.4600 0.4600 0.4725 0.4725 0.7721 0.7721 0.7748 0.7748 6.8247 6.8247 7.5400 7.5400 9.8137 9.8137 9.9841 9.9841 10.6862 10.6862 10.7087 10.7087 k = 0.0000 0.0000 0.2412 ( 6946 PWs) bands (ev): -20.3800 -20.3800 -20.3266 -20.3266 -17.6258 -17.6258 -17.5071 -17.5071 -17.3413 -17.3413 -17.3361 -17.3361 -17.3333 -17.3333 -17.3282 -17.3282 -8.9572 -8.9572 -8.6394 -8.6394 -5.8438 -5.8438 -5.7154 -5.7154 -5.5087 -5.5087 -5.4978 -5.4978 -5.4239 -5.4239 -5.4137 -5.4137 -2.3637 -2.3637 -2.2772 -2.2772 -2.2758 -2.2758 -2.1883 -2.1883 -2.1852 -2.1852 -2.0125 -2.0125 -1.6842 -1.6842 -1.6674 -1.6674 -1.6638 -1.6638 -1.6471 -1.6471 0.1516 0.1516 0.1632 0.1632 0.4276 0.4276 0.4400 0.4400 0.7723 0.7723 0.7746 0.7746 6.8834 6.8834 7.4571 7.4571 9.8382 9.8382 9.9866 9.9866 10.7291 10.7291 10.7515 10.7515 k = 0.0000 0.0000 0.2572 ( 6946 PWs) bands (ev): -20.3736 -20.3736 -20.3333 -20.3333 -17.6113 -17.6113 -17.5215 -17.5215 -17.3406 -17.3406 -17.3368 -17.3368 -17.3327 -17.3327 -17.3289 -17.3289 -8.9205 -8.9205 -8.6804 -8.6804 -5.8263 -5.8263 -5.7294 -5.7294 -5.4985 -5.4985 -5.4877 -5.4877 -5.4345 -5.4345 -5.4241 -5.4241 -2.3211 -2.3211 -2.2675 -2.2675 -2.2659 -2.2659 -2.2005 -2.2005 -2.1976 -2.1976 -2.0556 -2.0556 -1.6815 -1.6815 -1.6689 -1.6689 -1.6610 -1.6610 -1.6486 -1.6486 0.1856 0.1856 0.1973 0.1973 0.3942 0.3942 0.4065 0.4065 0.7726 0.7726 0.7743 0.7743 6.9452 6.9452 7.3764 7.3764 9.8629 9.8629 9.9809 9.9809 10.7728 10.7728 10.7950 10.7950 k = 0.0000 0.0000 0.2733 ( 6940 PWs) bands (ev): -20.3671 -20.3671 -20.3401 -20.3401 -17.5964 -17.5964 -17.5362 -17.5362 -17.3400 -17.3400 -17.3374 -17.3374 -17.3320 -17.3320 -17.3295 -17.3295 -8.8824 -8.8824 -8.7216 -8.7216 -5.8090 -5.8090 -5.7441 -5.7441 -5.4881 -5.4881 -5.4774 -5.4774 -5.4452 -5.4452 -5.4347 -5.4347 -2.2776 -2.2776 -2.2573 -2.2573 -2.2555 -2.2555 -2.2124 -2.2124 -2.2098 -2.2098 -2.0995 -2.0995 -1.6789 -1.6789 -1.6706 -1.6706 -1.6585 -1.6585 -1.6502 -1.6502 0.2202 0.2202 0.2320 0.2320 0.3600 0.3600 0.3722 0.3722 0.7729 0.7729 0.7740 0.7740 7.0101 7.0101 7.2980 7.2980 9.8872 9.8872 9.9689 9.9689 10.8169 10.8169 10.8389 10.8389 k = 0.0000 0.0000 0.2894 ( 6934 PWs) bands (ev): -20.3605 -20.3605 -20.3469 -20.3469 -17.5814 -17.5814 -17.5512 -17.5512 -17.3394 -17.3394 -17.3381 -17.3381 -17.3314 -17.3314 -17.3301 -17.3301 -8.8432 -8.8432 -8.7626 -8.7626 -5.7920 -5.7920 -5.7595 -5.7595 -5.4775 -5.4775 -5.4668 -5.4668 -5.4559 -5.4559 -5.4454 -5.4454 -2.2467 -2.2467 -2.2447 -2.2447 -2.2339 -2.2339 -2.2235 -2.2235 -2.2218 -2.2218 -2.1440 -2.1440 -1.6765 -1.6765 -1.6724 -1.6724 -1.6561 -1.6561 -1.6520 -1.6520 0.2552 0.2552 0.2671 0.2671 0.3253 0.3253 0.3374 0.3374 0.7732 0.7732 0.7737 0.7737 7.0780 7.0780 7.2221 7.2221 9.9106 9.9106 9.9524 9.9524 10.8610 10.8610 10.8828 10.8828 k = 0.0000 0.0000 0.3055 ( 6934 PWs) bands (ev): -20.3537 -20.3537 -20.3537 -20.3537 -17.5663 -17.5663 -17.5663 -17.5663 -17.3387 -17.3387 -17.3387 -17.3387 -17.3308 -17.3308 -17.3308 -17.3308 -8.8032 -8.8032 -8.8032 -8.8032 -5.7755 -5.7755 -5.7755 -5.7755 -5.4667 -5.4667 -5.4667 -5.4667 -5.4562 -5.4562 -5.4562 -5.4562 -2.2357 -2.2357 -2.2357 -2.2357 -2.2334 -2.2334 -2.2334 -2.2334 -2.1886 -2.1886 -2.1886 -2.1886 -1.6744 -1.6744 -1.6744 -1.6744 -1.6540 -1.6540 -1.6540 -1.6540 0.2903 0.2903 0.2903 0.2903 0.3023 0.3023 0.3023 0.3023 0.7734 0.7734 0.7734 0.7734 7.1487 7.1487 7.1487 7.1487 9.9327 9.9327 9.9327 9.9327 10.9046 10.9046 10.9046 10.9047 k = 0.0000 0.0000 0.3055 ( 6934 PWs) bands (ev): -20.3537 -20.3537 -20.3537 -20.3537 -17.5663 -17.5663 -17.5663 -17.5663 -17.3387 -17.3387 -17.3387 -17.3387 -17.3308 -17.3308 -17.3308 -17.3308 -8.8032 -8.8032 -8.8032 -8.8032 -5.7755 -5.7755 -5.7755 -5.7755 -5.4667 -5.4667 -5.4667 -5.4667 -5.4562 -5.4562 -5.4562 -5.4562 -2.2357 -2.2357 -2.2357 -2.2357 -2.2334 -2.2334 -2.2334 -2.2334 -2.1886 -2.1886 -2.1886 -2.1886 -1.6744 -1.6744 -1.6744 -1.6744 -1.6540 -1.6540 -1.6540 -1.6540 0.2903 0.2903 0.2903 0.2903 0.3023 0.3023 0.3023 0.3023 0.7734 0.7734 0.7734 0.7734 7.1487 7.1487 7.1487 7.1487 9.9327 9.9327 9.9327 9.9327 10.9046 10.9046 10.9046 10.9046 k = 0.0139 0.0080 0.3055 ( 6924 PWs) bands (ev): -20.3535 -20.3535 -20.3535 -20.3535 -17.5668 -17.5668 -17.5664 -17.5664 -17.3390 -17.3390 -17.3386 -17.3386 -17.3309 -17.3309 -17.3309 -17.3309 -8.8019 -8.8019 -8.8019 -8.8019 -5.7770 -5.7770 -5.7765 -5.7765 -5.4663 -5.4663 -5.4658 -5.4658 -5.4555 -5.4555 -5.4555 -5.4555 -2.2363 -2.2363 -2.2361 -2.2361 -2.2337 -2.2337 -2.2336 -2.2336 -2.1886 -2.1886 -2.1882 -2.1882 -1.6747 -1.6747 -1.6745 -1.6745 -1.6542 -1.6542 -1.6542 -1.6542 0.2897 0.2897 0.2898 0.2898 0.3018 0.3018 0.3018 0.3018 0.7720 0.7720 0.7721 0.7721 7.1506 7.1506 7.1507 7.1507 9.9340 9.9340 9.9343 9.9343 10.9044 10.9044 10.9050 10.9050 k = 0.0278 0.0160 0.3055 ( 6920 PWs) bands (ev): -20.3529 -20.3529 -20.3529 -20.3529 -17.5678 -17.5678 -17.5671 -17.5671 -17.3395 -17.3395 -17.3388 -17.3388 -17.3312 -17.3312 -17.3312 -17.3312 -8.7981 -8.7981 -8.7981 -8.7981 -5.7809 -5.7809 -5.7799 -5.7799 -5.4646 -5.4646 -5.4636 -5.4636 -5.4535 -5.4535 -5.4534 -5.4534 -2.2385 -2.2385 -2.2380 -2.2380 -2.2337 -2.2337 -2.2336 -2.2336 -2.1884 -2.1884 -2.1876 -2.1876 -1.6755 -1.6755 -1.6750 -1.6750 -1.6548 -1.6548 -1.6548 -1.6548 0.2878 0.2878 0.2882 0.2882 0.3003 0.3003 0.3003 0.3003 0.7679 0.7679 0.7680 0.7680 7.1565 7.1565 7.1566 7.1566 9.9383 9.9383 9.9390 9.9390 10.9027 10.9027 10.9041 10.9041 k = 0.0417 0.0241 0.3055 ( 6916 PWs) bands (ev): -20.3519 -20.3519 -20.3519 -20.3519 -17.5694 -17.5694 -17.5683 -17.5683 -17.3403 -17.3403 -17.3391 -17.3391 -17.3317 -17.3317 -17.3316 -17.3316 -8.7917 -8.7917 -8.7916 -8.7916 -5.7871 -5.7871 -5.7856 -5.7856 -5.4616 -5.4616 -5.4604 -5.4604 -5.4501 -5.4501 -5.4498 -5.4498 -2.2424 -2.2424 -2.2418 -2.2418 -2.2330 -2.2330 -2.2330 -2.2330 -2.1880 -2.1880 -2.1869 -2.1869 -1.6770 -1.6770 -1.6762 -1.6762 -1.6558 -1.6558 -1.6557 -1.6557 0.2845 0.2845 0.2850 0.2850 0.2982 0.2982 0.2983 0.2983 0.7610 0.7610 0.7612 0.7612 7.1663 7.1663 7.1664 7.1664 9.9456 9.9456 9.9467 9.9467 10.8976 10.8976 10.8996 10.8996 k = 0.0556 0.0321 0.3055 ( 6918 PWs) bands (ev): -20.3505 -20.3505 -20.3505 -20.3505 -17.5715 -17.5715 -17.5701 -17.5701 -17.3413 -17.3413 -17.3398 -17.3398 -17.3323 -17.3323 -17.3322 -17.3322 -8.7827 -8.7827 -8.7827 -8.7827 -5.7954 -5.7954 -5.7935 -5.7935 -5.4577 -5.4577 -5.4563 -5.4563 -5.4453 -5.4453 -5.4447 -5.4447 -2.2477 -2.2477 -2.2470 -2.2470 -2.2321 -2.2321 -2.2320 -2.2320 -2.1876 -2.1876 -2.1863 -2.1863 -1.6792 -1.6792 -1.6781 -1.6781 -1.6569 -1.6569 -1.6567 -1.6567 0.2794 0.2794 0.2799 0.2799 0.2959 0.2959 0.2960 0.2960 0.7516 0.7516 0.7519 0.7519 7.1800 7.1800 7.1801 7.1801 9.9558 9.9558 9.9572 9.9572 10.8888 10.8888 10.8913 10.8913 k = 0.0694 0.0401 0.3055 ( 6916 PWs) bands (ev): -20.3487 -20.3487 -20.3487 -20.3487 -17.5743 -17.5743 -17.5726 -17.5726 -17.3427 -17.3427 -17.3407 -17.3407 -17.3331 -17.3331 -17.3328 -17.3328 -8.7713 -8.7713 -8.7712 -8.7712 -5.8057 -5.8057 -5.8034 -5.8034 -5.4528 -5.4528 -5.4515 -5.4515 -5.4391 -5.4391 -5.4382 -5.4382 -2.2541 -2.2541 -2.2535 -2.2535 -2.2308 -2.2308 -2.2307 -2.2307 -2.1875 -2.1875 -2.1860 -2.1860 -1.6823 -1.6823 -1.6809 -1.6809 -1.6578 -1.6578 -1.6576 -1.6576 0.2724 0.2724 0.2730 0.2730 0.2933 0.2933 0.2935 0.2935 0.7396 0.7396 0.7400 0.7400 7.1975 7.1975 7.1976 7.1976 9.9686 9.9686 9.9704 9.9704 10.8773 10.8773 10.8802 10.8802 k = 0.0833 0.0481 0.3055 ( 6908 PWs) bands (ev): -20.3466 -20.3466 -20.3465 -20.3465 -17.5776 -17.5776 -17.5755 -17.5755 -17.3444 -17.3444 -17.3419 -17.3419 -17.3338 -17.3338 -17.3334 -17.3334 -8.7574 -8.7574 -8.7574 -8.7574 -5.8176 -5.8176 -5.8151 -5.8151 -5.4473 -5.4473 -5.4460 -5.4460 -5.4318 -5.4318 -5.4305 -5.4305 -2.2616 -2.2616 -2.2610 -2.2610 -2.2291 -2.2291 -2.2290 -2.2290 -2.1877 -2.1877 -2.1860 -2.1860 -1.6865 -1.6865 -1.6848 -1.6848 -1.6585 -1.6585 -1.6582 -1.6582 0.2638 0.2638 0.2644 0.2644 0.2904 0.2904 0.2908 0.2908 0.7254 0.7254 0.7258 0.7258 7.2187 7.2187 7.2189 7.2189 9.9839 9.9839 9.9860 9.9860 10.8636 10.8636 10.8669 10.8669 k = 0.0972 0.0561 0.3055 ( 6912 PWs) bands (ev): -20.3441 -20.3441 -20.3440 -20.3440 -17.5814 -17.5814 -17.5791 -17.5791 -17.3463 -17.3463 -17.3435 -17.3435 -17.3344 -17.3344 -17.3340 -17.3340 -8.7412 -8.7412 -8.7411 -8.7411 -5.8312 -5.8312 -5.8284 -5.8284 -5.4410 -5.4410 -5.4398 -5.4398 -5.4235 -5.4235 -5.4218 -5.4218 -2.2700 -2.2700 -2.2695 -2.2695 -2.2271 -2.2271 -2.2270 -2.2270 -2.1883 -2.1883 -2.1865 -2.1865 -1.6917 -1.6917 -1.6897 -1.6897 -1.6588 -1.6588 -1.6585 -1.6585 0.2536 0.2536 0.2543 0.2543 0.2871 0.2871 0.2876 0.2876 0.7090 0.7090 0.7096 0.7096 7.2436 7.2436 7.2438 7.2438 10.0015 10.0015 10.0040 10.0040 10.8482 10.8482 10.8518 10.8518 k = 0.1111 0.0642 0.3055 ( 6924 PWs) bands (ev): -20.3412 -20.3412 -20.3411 -20.3411 -17.5859 -17.5859 -17.5833 -17.5833 -17.3485 -17.3485 -17.3454 -17.3454 -17.3351 -17.3351 -17.3345 -17.3345 -8.7227 -8.7227 -8.7226 -8.7226 -5.8461 -5.8461 -5.8431 -5.8431 -5.4339 -5.4339 -5.4329 -5.4329 -5.4143 -5.4143 -5.4124 -5.4124 -2.2794 -2.2794 -2.2789 -2.2789 -2.2249 -2.2249 -2.2247 -2.2247 -2.1893 -2.1893 -2.1874 -2.1874 -1.6978 -1.6978 -1.6956 -1.6956 -1.6589 -1.6589 -1.6585 -1.6585 0.2420 0.2420 0.2428 0.2428 0.2832 0.2832 0.2838 0.2838 0.6907 0.6907 0.6914 0.6914 7.2721 7.2721 7.2724 7.2724 10.0210 10.0210 10.0238 10.0238 10.8311 10.8311 10.8350 10.8350 k = 0.1250 0.0722 0.3055 ( 6916 PWs) bands (ev): -20.3380 -20.3380 -20.3379 -20.3379 -17.5909 -17.5909 -17.5881 -17.5881 -17.3509 -17.3509 -17.3475 -17.3475 -17.3357 -17.3357 -17.3351 -17.3351 -8.7019 -8.7019 -8.7019 -8.7019 -5.8622 -5.8622 -5.8591 -5.8591 -5.4262 -5.4262 -5.4253 -5.4253 -5.4045 -5.4045 -5.4023 -5.4023 -2.2896 -2.2896 -2.2892 -2.2892 -2.2223 -2.2223 -2.2221 -2.2221 -2.1908 -2.1908 -2.1889 -2.1889 -1.7047 -1.7047 -1.7023 -1.7023 -1.6587 -1.6587 -1.6583 -1.6583 0.2294 0.2294 0.2302 0.2302 0.2786 0.2786 0.2793 0.2793 0.6709 0.6709 0.6716 0.6716 7.3041 7.3041 7.3044 7.3044 10.0421 10.0421 10.0453 10.0453 10.8125 10.8125 10.8167 10.8167 k = 0.1389 0.0802 0.3055 ( 6912 PWs) bands (ev): -20.3345 -20.3345 -20.3344 -20.3344 -17.5964 -17.5964 -17.5934 -17.5934 -17.3534 -17.3534 -17.3499 -17.3499 -17.3362 -17.3362 -17.3357 -17.3357 -8.6791 -8.6791 -8.6790 -8.6790 -5.8794 -5.8794 -5.8762 -5.8762 -5.4179 -5.4179 -5.4170 -5.4170 -5.3943 -5.3943 -5.3919 -5.3919 -2.3006 -2.3006 -2.3003 -2.3003 -2.2194 -2.2194 -2.2191 -2.2191 -2.1928 -2.1928 -2.1909 -2.1909 -1.7124 -1.7124 -1.7098 -1.7098 -1.6583 -1.6583 -1.6579 -1.6579 0.2158 0.2158 0.2166 0.2166 0.2730 0.2730 0.2738 0.2738 0.6497 0.6497 0.6506 0.6506 7.3395 7.3395 7.3398 7.3398 10.0645 10.0645 10.0680 10.0680 10.7925 10.7925 10.7970 10.7970 k = 0.1528 0.0882 0.3055 ( 6916 PWs) bands (ev): -20.3307 -20.3307 -20.3306 -20.3306 -17.6025 -17.6025 -17.5994 -17.5994 -17.3560 -17.3560 -17.3523 -17.3523 -17.3368 -17.3368 -17.3362 -17.3362 -8.6543 -8.6543 -8.6542 -8.6542 -5.8976 -5.8976 -5.8943 -5.8943 -5.4089 -5.4089 -5.4081 -5.4081 -5.3836 -5.3836 -5.3811 -5.3811 -2.3124 -2.3124 -2.3122 -2.3122 -2.2161 -2.2161 -2.2159 -2.2159 -2.1953 -2.1953 -2.1934 -2.1934 -1.7206 -1.7206 -1.7179 -1.7179 -1.6577 -1.6577 -1.6574 -1.6574 0.2014 0.2014 0.2023 0.2023 0.2662 0.2662 0.2672 0.2672 0.6277 0.6277 0.6287 0.6287 7.3782 7.3782 7.3785 7.3785 10.0875 10.0875 10.0914 10.0914 10.7712 10.7712 10.7760 10.7760 k = 0.1667 0.0962 0.3055 ( 6916 PWs) bands (ev): -20.3266 -20.3266 -20.3265 -20.3265 -17.6091 -17.6091 -17.6058 -17.6058 -17.3586 -17.3586 -17.3548 -17.3548 -17.3373 -17.3373 -17.3368 -17.3368 -8.6276 -8.6276 -8.6275 -8.6275 -5.9167 -5.9167 -5.9134 -5.9134 -5.3994 -5.3994 -5.3986 -5.3986 -5.3728 -5.3728 -5.3702 -5.3702 -2.3250 -2.3250 -2.3249 -2.3249 -2.2126 -2.2126 -2.2124 -2.2124 -2.1982 -2.1982 -2.1963 -2.1963 -1.7293 -1.7293 -1.7265 -1.7265 -1.6570 -1.6570 -1.6567 -1.6567 0.1864 0.1864 0.1873 0.1873 0.2580 0.2580 0.2592 0.2592 0.6052 0.6052 0.6063 0.6063 7.4200 7.4200 7.4203 7.4203 10.1107 10.1107 10.1150 10.1150 10.7488 10.7488 10.7538 10.7538 k = 0.1806 0.1042 0.3055 ( 6924 PWs) bands (ev): -20.3224 -20.3224 -20.3222 -20.3222 -17.6162 -17.6162 -17.6128 -17.6128 -17.3612 -17.3612 -17.3573 -17.3573 -17.3379 -17.3379 -17.3374 -17.3374 -8.5991 -8.5991 -8.5991 -8.5991 -5.9365 -5.9365 -5.9332 -5.9332 -5.3893 -5.3893 -5.3886 -5.3886 -5.3617 -5.3617 -5.3591 -5.3591 -2.3384 -2.3384 -2.3383 -2.3383 -2.2090 -2.2090 -2.2089 -2.2089 -2.2014 -2.2014 -2.1996 -2.1996 -1.7383 -1.7383 -1.7354 -1.7354 -1.6562 -1.6562 -1.6559 -1.6559 0.1710 0.1710 0.1719 0.1719 0.2482 0.2482 0.2495 0.2495 0.5828 0.5828 0.5839 0.5839 7.4648 7.4648 7.4652 7.4652 10.1334 10.1334 10.1380 10.1380 10.7254 10.7254 10.7306 10.7306 k = 0.1944 0.1123 0.3055 ( 6910 PWs) bands (ev): -20.3179 -20.3179 -20.3177 -20.3177 -17.6237 -17.6237 -17.6203 -17.6203 -17.3637 -17.3637 -17.3599 -17.3599 -17.3384 -17.3384 -17.3379 -17.3379 -8.5691 -8.5691 -8.5691 -8.5691 -5.9571 -5.9571 -5.9538 -5.9538 -5.3788 -5.3788 -5.3781 -5.3781 -5.3506 -5.3506 -5.3480 -5.3480 -2.3525 -2.3525 -2.3524 -2.3524 -2.2073 -2.2073 -2.2061 -2.2061 -2.2026 -2.2026 -2.2022 -2.2022 -1.7476 -1.7476 -1.7446 -1.7446 -1.6553 -1.6553 -1.6550 -1.6550 0.1553 0.1553 0.1563 0.1563 0.2365 0.2365 0.2378 0.2378 0.5609 0.5609 0.5621 0.5621 7.5125 7.5125 7.5129 7.5129 10.1548 10.1548 10.1596 10.1596 10.7014 10.7014 10.7068 10.7068 k = 0.2083 0.1203 0.3055 ( 6910 PWs) bands (ev): -20.3132 -20.3132 -20.3131 -20.3131 -17.6316 -17.6316 -17.6282 -17.6282 -17.3662 -17.3662 -17.3623 -17.3623 -17.3389 -17.3389 -17.3385 -17.3385 -8.5377 -8.5377 -8.5376 -8.5376 -5.9783 -5.9783 -5.9750 -5.9750 -5.3680 -5.3680 -5.3673 -5.3673 -5.3395 -5.3395 -5.3369 -5.3369 -2.3674 -2.3674 -2.3672 -2.3672 -2.2106 -2.2106 -2.2087 -2.2087 -2.1995 -2.1995 -2.1991 -2.1991 -1.7570 -1.7570 -1.7540 -1.7540 -1.6543 -1.6543 -1.6540 -1.6540 0.1395 0.1395 0.1405 0.1405 0.2225 0.2225 0.2240 0.2240 0.5399 0.5399 0.5413 0.5413 7.5630 7.5630 7.5633 7.5633 10.1739 10.1739 10.1789 10.1789 10.6773 10.6773 10.6828 10.6828 k = 0.2222 0.1283 0.3055 ( 6902 PWs) bands (ev): -20.3084 -20.3084 -20.3083 -20.3083 -17.6399 -17.6399 -17.6364 -17.6364 -17.3686 -17.3686 -17.3647 -17.3647 -17.3395 -17.3395 -17.3391 -17.3391 -8.5050 -8.5050 -8.5049 -8.5049 -6.0001 -6.0001 -5.9969 -5.9969 -5.3568 -5.3568 -5.3561 -5.3561 -5.3284 -5.3284 -5.3258 -5.3258 -2.3830 -2.3830 -2.3826 -2.3826 -2.2150 -2.2150 -2.2132 -2.2132 -2.1949 -2.1949 -2.1945 -2.1945 -1.7664 -1.7664 -1.7634 -1.7634 -1.6532 -1.6532 -1.6530 -1.6530 0.1237 0.1237 0.1247 0.1247 0.2062 0.2062 0.2077 0.2077 0.5205 0.5205 0.5219 0.5219 7.6160 7.6160 7.6164 7.6164 10.1894 10.1894 10.1946 10.1946 10.6539 10.6539 10.6595 10.6595 k = 0.2361 0.1363 0.3055 ( 6900 PWs) bands (ev): -20.3035 -20.3035 -20.3034 -20.3034 -17.6484 -17.6484 -17.6450 -17.6450 -17.3708 -17.3708 -17.3670 -17.3670 -17.3400 -17.3400 -17.3397 -17.3397 -8.4712 -8.4712 -8.4712 -8.4712 -6.0224 -6.0224 -6.0192 -6.0192 -5.3454 -5.3454 -5.3448 -5.3448 -5.3175 -5.3175 -5.3149 -5.3149 -2.3991 -2.3991 -2.3987 -2.3987 -2.2199 -2.2199 -2.2180 -2.2180 -2.1899 -2.1899 -2.1895 -2.1895 -1.7758 -1.7758 -1.7727 -1.7727 -1.6521 -1.6521 -1.6519 -1.6519 0.1081 0.1081 0.1091 0.1091 0.1874 0.1874 0.1890 0.1890 0.5028 0.5028 0.5043 0.5043 7.6715 7.6715 7.6719 7.6719 10.1999 10.1999 10.2051 10.2051 10.6322 10.6322 10.6376 10.6376 k = 0.2500 0.1443 0.3055 ( 6896 PWs) bands (ev): -20.2985 -20.2985 -20.2984 -20.2984 -17.6571 -17.6571 -17.6538 -17.6538 -17.3729 -17.3729 -17.3692 -17.3692 -17.3406 -17.3406 -17.3402 -17.3402 -8.4366 -8.4366 -8.4366 -8.4366 -6.0451 -6.0451 -6.0419 -6.0419 -5.3339 -5.3339 -5.3333 -5.3333 -5.3067 -5.3067 -5.3042 -5.3042 -2.4157 -2.4157 -2.4152 -2.4152 -2.2249 -2.2249 -2.2232 -2.2232 -2.1847 -2.1847 -2.1842 -2.1842 -1.7850 -1.7850 -1.7819 -1.7819 -1.6509 -1.6509 -1.6507 -1.6507 0.0927 0.0927 0.0938 0.0938 0.1663 0.1663 0.1678 0.1678 0.4872 0.4872 0.4886 0.4886 7.7293 7.7293 7.7296 7.7296 10.2039 10.2039 10.2090 10.2090 10.6134 10.6134 10.6186 10.6186 k = 0.2639 0.1524 0.3055 ( 6898 PWs) bands (ev): -20.2935 -20.2935 -20.2934 -20.2934 -17.6660 -17.6660 -17.6627 -17.6627 -17.3749 -17.3749 -17.3713 -17.3713 -17.3411 -17.3411 -17.3408 -17.3408 -8.4013 -8.4013 -8.4013 -8.4013 -6.0680 -6.0680 -6.0650 -6.0650 -5.3224 -5.3224 -5.3217 -5.3217 -5.2961 -5.2961 -5.2937 -5.2937 -2.4328 -2.4328 -2.4322 -2.4322 -2.2302 -2.2302 -2.2285 -2.2285 -2.1792 -2.1792 -2.1787 -2.1787 -1.7940 -1.7940 -1.7909 -1.7909 -1.6497 -1.6497 -1.6495 -1.6495 0.0778 0.0778 0.0789 0.0789 0.1429 0.1429 0.1443 0.1443 0.4736 0.4736 0.4750 0.4750 7.7891 7.7891 7.7895 7.7895 10.1999 10.1999 10.2045 10.2045 10.5988 10.5988 10.6034 10.6034 k = 0.2778 0.1604 0.3055 ( 6902 PWs) bands (ev): -20.2885 -20.2885 -20.2884 -20.2884 -17.6749 -17.6749 -17.6718 -17.6718 -17.3767 -17.3767 -17.3733 -17.3733 -17.3417 -17.3417 -17.3414 -17.3414 -8.3656 -8.3656 -8.3656 -8.3656 -6.0912 -6.0912 -6.0883 -6.0883 -5.3108 -5.3108 -5.3102 -5.3102 -5.2857 -5.2857 -5.2834 -5.2834 -2.4502 -2.4502 -2.4495 -2.4495 -2.2355 -2.2355 -2.2340 -2.2340 -2.1735 -2.1735 -2.1730 -2.1730 -1.8026 -1.8026 -1.7997 -1.7997 -1.6484 -1.6484 -1.6482 -1.6482 0.0633 0.0633 0.0645 0.0645 0.1177 0.1177 0.1190 0.1190 0.4620 0.4620 0.4634 0.4634 7.8510 7.8510 7.8513 7.8513 10.1869 10.1869 10.1909 10.1909 10.5890 10.5890 10.5930 10.5930 k = 0.2917 0.1684 0.3055 ( 6898 PWs) bands (ev): -20.2836 -20.2836 -20.2834 -20.2834 -17.6838 -17.6838 -17.6808 -17.6808 -17.3784 -17.3784 -17.3751 -17.3751 -17.3422 -17.3422 -17.3419 -17.3419 -8.3297 -8.3297 -8.3297 -8.3297 -6.1145 -6.1145 -6.1116 -6.1116 -5.2994 -5.2994 -5.2988 -5.2988 -5.2757 -5.2757 -5.2735 -5.2735 -2.4677 -2.4677 -2.4670 -2.4670 -2.2409 -2.2409 -2.2394 -2.2394 -2.1676 -2.1676 -2.1672 -2.1672 -1.8109 -1.8109 -1.8080 -1.8080 -1.6472 -1.6472 -1.6470 -1.6470 0.0493 0.0493 0.0506 0.0506 0.0911 0.0911 0.0923 0.0923 0.4523 0.4523 0.4535 0.4535 7.9145 7.9145 7.9149 7.9149 10.1645 10.1645 10.1679 10.1679 10.5841 10.5841 10.5873 10.5873 k = 0.3056 0.1764 0.3055 ( 6906 PWs) bands (ev): -20.2787 -20.2787 -20.2786 -20.2786 -17.6927 -17.6927 -17.6898 -17.6898 -17.3799 -17.3799 -17.3768 -17.3768 -17.3427 -17.3427 -17.3424 -17.3424 -8.2939 -8.2939 -8.2938 -8.2938 -6.1377 -6.1377 -6.1350 -6.1350 -5.2883 -5.2883 -5.2876 -5.2876 -5.2660 -5.2660 -5.2640 -5.2640 -2.4853 -2.4853 -2.4846 -2.4846 -2.2462 -2.2462 -2.2449 -2.2449 -2.1617 -2.1617 -2.1613 -2.1613 -1.8187 -1.8187 -1.8160 -1.8160 -1.6459 -1.6459 -1.6457 -1.6457 0.0358 0.0358 0.0372 0.0372 0.0638 0.0638 0.0648 0.0648 0.4441 0.4441 0.4453 0.4453 7.9796 7.9796 7.9799 7.9799 10.1336 10.1336 10.1362 10.1362 10.5834 10.5834 10.5857 10.5857 k = 0.3194 0.1844 0.3055 ( 6914 PWs) bands (ev): -20.2740 -20.2740 -20.2738 -20.2738 -17.7013 -17.7013 -17.6986 -17.6986 -17.3813 -17.3813 -17.3784 -17.3784 -17.3432 -17.3432 -17.3430 -17.3430 -8.2584 -8.2584 -8.2584 -8.2584 -6.1608 -6.1608 -6.1582 -6.1582 -5.2774 -5.2774 -5.2767 -5.2767 -5.2567 -5.2567 -5.2548 -5.2548 -2.5027 -2.5027 -2.5021 -2.5021 -2.2514 -2.2514 -2.2502 -2.2502 -2.1557 -2.1557 -2.1553 -2.1553 -1.8261 -1.8261 -1.8235 -1.8235 -1.6445 -1.6445 -1.6444 -1.6444 0.0219 0.0219 0.0238 0.0238 0.0372 0.0372 0.0375 0.0375 0.4373 0.4373 0.4384 0.4384 8.0460 8.0460 8.0463 8.0463 10.0951 10.0951 10.0971 10.0971 10.5855 10.5855 10.5871 10.5871 k = 0.3333 0.1925 0.3055 ( 6906 PWs) bands (ev): -20.2694 -20.2694 -20.2692 -20.2692 -17.7097 -17.7097 -17.7071 -17.7071 -17.3825 -17.3825 -17.3798 -17.3798 -17.3437 -17.3437 -17.3434 -17.3434 -8.2236 -8.2236 -8.2235 -8.2235 -6.1835 -6.1835 -6.1810 -6.1810 -5.2669 -5.2669 -5.2662 -5.2662 -5.2478 -5.2478 -5.2461 -5.2461 -2.5199 -2.5199 -2.5192 -2.5192 -2.2565 -2.2565 -2.2554 -2.2554 -2.1497 -2.1497 -2.1493 -2.1493 -1.8329 -1.8329 -1.8305 -1.8305 -1.6432 -1.6432 -1.6431 -1.6431 0.0027 0.0027 0.0049 0.0049 0.0165 0.0165 0.0166 0.0166 0.4316 0.4316 0.4326 0.4326 8.1134 8.1134 8.1137 8.1137 10.0505 10.0505 10.0519 10.0519 10.5894 10.5894 10.5905 10.5905 k = 0.3472 0.2005 0.3055 ( 6906 PWs) bands (ev): -20.2650 -20.2650 -20.2649 -20.2649 -17.7177 -17.7177 -17.7153 -17.7153 -17.3836 -17.3836 -17.3811 -17.3811 -17.3441 -17.3441 -17.3439 -17.3439 -8.1897 -8.1897 -8.1896 -8.1896 -6.2056 -6.2056 -6.2033 -6.2033 -5.2569 -5.2569 -5.2562 -5.2562 -5.2394 -5.2394 -5.2378 -5.2378 -2.5365 -2.5365 -2.5359 -2.5359 -2.2614 -2.2614 -2.2604 -2.2604 -2.1438 -2.1438 -2.1434 -2.1434 -1.8393 -1.8393 -1.8370 -1.8370 -1.6420 -1.6420 -1.6418 -1.6418 -0.0230 -0.0230 -0.0213 -0.0213 0.0039 0.0039 0.0042 0.0042 0.4270 0.4270 0.4279 0.4279 8.1816 8.1816 8.1819 8.1819 10.0010 10.0010 10.0020 10.0020 10.5942 10.5942 10.5948 10.5948 k = 0.3611 0.2085 0.3055 ( 6900 PWs) bands (ev): -20.2608 -20.2608 -20.2607 -20.2607 -17.7253 -17.7253 -17.7231 -17.7231 -17.3846 -17.3846 -17.3823 -17.3823 -17.3445 -17.3445 -17.3444 -17.3444 -8.1571 -8.1571 -8.1570 -8.1570 -6.2271 -6.2271 -6.2249 -6.2249 -5.2475 -5.2475 -5.2468 -5.2468 -5.2315 -5.2315 -5.2301 -5.2301 -2.5526 -2.5526 -2.5519 -2.5519 -2.2660 -2.2660 -2.2651 -2.2651 -2.1381 -2.1381 -2.1377 -2.1377 -1.8451 -1.8451 -1.8430 -1.8430 -1.6407 -1.6407 -1.6406 -1.6406 -0.0492 -0.0492 -0.0479 -0.0479 -0.0064 -0.0064 -0.0060 -0.0060 0.4231 0.4231 0.4239 0.4239 8.2502 8.2503 8.2505 8.2505 9.9478 9.9478 9.9484 9.9484 10.5991 10.5991 10.5993 10.5993 k = 0.3750 0.2165 0.3055 ( 6896 PWs) bands (ev): -20.2569 -20.2569 -20.2568 -20.2568 -17.7324 -17.7324 -17.7304 -17.7304 -17.3854 -17.3854 -17.3833 -17.3833 -17.3449 -17.3449 -17.3448 -17.3448 -8.1261 -8.1261 -8.1260 -8.1260 -6.2476 -6.2476 -6.2456 -6.2456 -5.2387 -5.2387 -5.2380 -5.2380 -5.2241 -5.2241 -5.2230 -5.2230 -2.5677 -2.5677 -2.5672 -2.5672 -2.2703 -2.2703 -2.2695 -2.2695 -2.1325 -2.1325 -2.1322 -2.1321 -1.8504 -1.8504 -1.8485 -1.8485 -1.6395 -1.6395 -1.6394 -1.6394 -0.0745 -0.0745 -0.0734 -0.0734 -0.0156 -0.0156 -0.0152 -0.0152 0.4199 0.4199 0.4206 0.4206 8.3189 8.3189 8.3191 8.3191 9.8918 9.8918 9.8922 9.8922 10.6037 10.6037 10.6037 10.6037 k = 0.3889 0.2245 0.3055 ( 6894 PWs) bands (ev): -20.2534 -20.2534 -20.2533 -20.2533 -17.7390 -17.7390 -17.7372 -17.7372 -17.3862 -17.3862 -17.3843 -17.3843 -17.3453 -17.3453 -17.3451 -17.3451 -8.0971 -8.0971 -8.0970 -8.0970 -6.2669 -6.2669 -6.2651 -6.2651 -5.2307 -5.2307 -5.2299 -5.2299 -5.2174 -5.2174 -5.2164 -5.2164 -2.5819 -2.5819 -2.5814 -2.5814 -2.2743 -2.2743 -2.2736 -2.2736 -2.1273 -2.1273 -2.1269 -2.1269 -1.8551 -1.8551 -1.8534 -1.8534 -1.6383 -1.6383 -1.6382 -1.6382 -0.0982 -0.0982 -0.0972 -0.0972 -0.0238 -0.0238 -0.0233 -0.0233 0.4173 0.4173 0.4179 0.4179 8.3869 8.3869 8.3871 8.3871 9.8341 9.8341 9.8343 9.8343 10.6076 10.6076 10.6077 10.6077 k = 0.4028 0.2325 0.3055 ( 6890 PWs) bands (ev): -20.2501 -20.2501 -20.2500 -20.2500 -17.7449 -17.7449 -17.7433 -17.7433 -17.3868 -17.3868 -17.3851 -17.3851 -17.3456 -17.3456 -17.3455 -17.3455 -8.0704 -8.0704 -8.0703 -8.0703 -6.2847 -6.2847 -6.2832 -6.2832 -5.2234 -5.2234 -5.2227 -5.2227 -5.2113 -5.2113 -5.2105 -5.2105 -2.5948 -2.5948 -2.5944 -2.5944 -2.2779 -2.2779 -2.2773 -2.2773 -2.1224 -2.1224 -2.1221 -2.1221 -1.8592 -1.8592 -1.8577 -1.8577 -1.6373 -1.6372 -1.6372 -1.6372 -0.1200 -0.1200 -0.1191 -0.1191 -0.0309 -0.0309 -0.0305 -0.0305 0.4151 0.4151 0.4156 0.4156 8.4538 8.4538 8.4540 8.4540 9.7758 9.7758 9.7759 9.7759 10.6109 10.6109 10.6111 10.6111 k = 0.4167 0.2406 0.3055 ( 6888 PWs) bands (ev): -20.2473 -20.2473 -20.2472 -20.2472 -17.7501 -17.7501 -17.7488 -17.7488 -17.3873 -17.3873 -17.3859 -17.3859 -17.3459 -17.3459 -17.3458 -17.3458 -8.0463 -8.0463 -8.0462 -8.0462 -6.3009 -6.3009 -6.2995 -6.2995 -5.2170 -5.2170 -5.2163 -5.2163 -5.2059 -5.2059 -5.2053 -5.2053 -2.6064 -2.6064 -2.6060 -2.6060 -2.2811 -2.2811 -2.2806 -2.2806 -2.1180 -2.1180 -2.1177 -2.1177 -1.8628 -1.8628 -1.8615 -1.8615 -1.6363 -1.6363 -1.6362 -1.6362 -0.1395 -0.1395 -0.1388 -0.1388 -0.0371 -0.0371 -0.0368 -0.0368 0.4134 0.4134 0.4138 0.4138 8.5186 8.5186 8.5187 8.5187 9.7179 9.7179 9.7180 9.7180 10.6136 10.6136 10.6139 10.6139 k = 0.4306 0.2486 0.3055 ( 6888 PWs) bands (ev): -20.2448 -20.2448 -20.2447 -20.2447 -17.7546 -17.7546 -17.7535 -17.7535 -17.3877 -17.3877 -17.3865 -17.3865 -17.3461 -17.3461 -17.3460 -17.3460 -8.0252 -8.0252 -8.0252 -8.0252 -6.3151 -6.3151 -6.3140 -6.3140 -5.2115 -5.2115 -5.2109 -5.2109 -5.2012 -5.2012 -5.2008 -5.2008 -2.6165 -2.6165 -2.6161 -2.6161 -2.2838 -2.2838 -2.2834 -2.2834 -2.1141 -2.1141 -2.1139 -2.1139 -1.8658 -1.8658 -1.8647 -1.8647 -1.6354 -1.6354 -1.6353 -1.6353 -0.1564 -0.1564 -0.1559 -0.1559 -0.0424 -0.0424 -0.0421 -0.0421 0.4120 0.4120 0.4123 0.4123 8.5801 8.5801 8.5802 8.5802 9.6620 9.6620 9.6621 9.6621 10.6157 10.6157 10.6160 10.6160 k = 0.4444 0.2566 0.3055 ( 6888 PWs) bands (ev): -20.2427 -20.2427 -20.2427 -20.2427 -17.7584 -17.7584 -17.7575 -17.7575 -17.3880 -17.3880 -17.3870 -17.3870 -17.3463 -17.3463 -17.3462 -17.3462 -8.0075 -8.0075 -8.0074 -8.0074 -6.3272 -6.3272 -6.3262 -6.3262 -5.2070 -5.2070 -5.2064 -5.2064 -5.1973 -5.1973 -5.1970 -5.1970 -2.6249 -2.6249 -2.6246 -2.6246 -2.2860 -2.2860 -2.2857 -2.2857 -2.1109 -2.1109 -2.1106 -2.1106 -1.8682 -1.8682 -1.8673 -1.8673 -1.6347 -1.6347 -1.6346 -1.6346 -0.1707 -0.1707 -0.1702 -0.1702 -0.0467 -0.0467 -0.0464 -0.0464 0.4109 0.4109 0.4112 0.4112 8.6366 8.6366 8.6367 8.6367 9.6099 9.6099 9.6099 9.6099 10.6173 10.6173 10.6176 10.6176 k = 0.4583 0.2646 0.3055 ( 6888 PWs) bands (ev): -20.2411 -20.2411 -20.2411 -20.2411 -17.7613 -17.7613 -17.7606 -17.7606 -17.3882 -17.3882 -17.3875 -17.3875 -17.3465 -17.3465 -17.3464 -17.3464 -7.9934 -7.9934 -7.9933 -7.9933 -6.3367 -6.3367 -6.3360 -6.3360 -5.2034 -5.2034 -5.2029 -5.2029 -5.1942 -5.1942 -5.1940 -5.1940 -2.6315 -2.6315 -2.6313 -2.6313 -2.2878 -2.2878 -2.2876 -2.2876 -2.1082 -2.1082 -2.1081 -2.1081 -1.8701 -1.8701 -1.8694 -1.8694 -1.6341 -1.6341 -1.6340 -1.6340 -0.1819 -0.1819 -0.1816 -0.1816 -0.0500 -0.0500 -0.0498 -0.0498 0.4101 0.4101 0.4103 0.4103 8.6858 8.6858 8.6858 8.6858 9.5639 9.5639 9.5640 9.5640 10.6185 10.6185 10.6187 10.6187 k = 0.4722 0.2726 0.3055 ( 6872 PWs) bands (ev): -20.2399 -20.2399 -20.2399 -20.2399 -17.7634 -17.7634 -17.7629 -17.7629 -17.3883 -17.3883 -17.3878 -17.3878 -17.3466 -17.3466 -17.3465 -17.3465 -7.9831 -7.9831 -7.9830 -7.9830 -6.3437 -6.3437 -6.3432 -6.3432 -5.2008 -5.2008 -5.2004 -5.2004 -5.1920 -5.1920 -5.1919 -5.1919 -2.6364 -2.6364 -2.6362 -2.6362 -2.2891 -2.2891 -2.2889 -2.2889 -2.1063 -2.1063 -2.1062 -2.1062 -1.8714 -1.8714 -1.8709 -1.8709 -1.6336 -1.6336 -1.6336 -1.6336 -0.1900 -0.1900 -0.1898 -0.1898 -0.0524 -0.0524 -0.0522 -0.0522 0.4096 0.4096 0.4097 0.4097 8.7248 8.7248 8.7248 8.7248 9.5272 9.5272 9.5273 9.5273 10.6192 10.6192 10.6194 10.6194 k = 0.4861 0.2807 0.3055 ( 6872 PWs) bands (ev): -20.2392 -20.2392 -20.2392 -20.2392 -17.7646 -17.7646 -17.7643 -17.7643 -17.3883 -17.3883 -17.3881 -17.3881 -17.3466 -17.3466 -17.3466 -17.3466 -7.9768 -7.9768 -7.9768 -7.9768 -6.3479 -6.3479 -6.3477 -6.3477 -5.1992 -5.1992 -5.1990 -5.1990 -5.1906 -5.1906 -5.1906 -5.1906 -2.6393 -2.6393 -2.6392 -2.6392 -2.2898 -2.2898 -2.2897 -2.2897 -2.1051 -2.1051 -2.1051 -2.1051 -1.8721 -1.8721 -1.8719 -1.8719 -1.6334 -1.6334 -1.6333 -1.6333 -0.1949 -0.1949 -0.1948 -0.1948 -0.0538 -0.0538 -0.0537 -0.0537 0.4093 0.4093 0.4093 0.4093 8.7502 8.7502 8.7502 8.7502 9.5032 9.5032 9.5032 9.5032 10.6197 10.6197 10.6198 10.6198 k = 0.5000 0.2887 0.3055 ( 6880 PWs) bands (ev): -20.2390 -20.2390 -20.2390 -20.2390 -17.7649 -17.7649 -17.7649 -17.7649 -17.3882 -17.3882 -17.3882 -17.3882 -17.3466 -17.3466 -17.3466 -17.3466 -7.9747 -7.9747 -7.9747 -7.9747 -6.3492 -6.3492 -6.3492 -6.3492 -5.1986 -5.1986 -5.1986 -5.1986 -5.1901 -5.1901 -5.1901 -5.1901 -2.6402 -2.6402 -2.6402 -2.6402 -2.2900 -2.2900 -2.2900 -2.2900 -2.1047 -2.1047 -2.1047 -2.1047 -1.8723 -1.8723 -1.8723 -1.8723 -1.6333 -1.6333 -1.6333 -1.6333 -0.1965 -0.1965 -0.1965 -0.1965 -0.0542 -0.0542 -0.0542 -0.0542 0.4092 0.4092 0.4092 0.4092 8.7590 8.7590 8.7590 8.7590 9.4948 9.4948 9.4948 9.4948 10.6199 10.6199 10.6199 10.6199 k = 0.5000 0.2887 0.3055 ( 6880 PWs) bands (ev): -20.2390 -20.2390 -20.2390 -20.2390 -17.7649 -17.7649 -17.7649 -17.7649 -17.3882 -17.3882 -17.3882 -17.3882 -17.3466 -17.3466 -17.3466 -17.3466 -7.9747 -7.9747 -7.9747 -7.9747 -6.3492 -6.3492 -6.3492 -6.3492 -5.1986 -5.1986 -5.1986 -5.1986 -5.1901 -5.1901 -5.1901 -5.1901 -2.6402 -2.6402 -2.6402 -2.6402 -2.2900 -2.2900 -2.2900 -2.2900 -2.1047 -2.1047 -2.1047 -2.1047 -1.8723 -1.8723 -1.8723 -1.8723 -1.6333 -1.6333 -1.6333 -1.6333 -0.1965 -0.1965 -0.1965 -0.1965 -0.0542 -0.0542 -0.0542 -0.0542 0.4092 0.4092 0.4092 0.4092 8.7590 8.7590 8.7590 8.7590 9.4948 9.4948 9.4948 9.4948 10.6199 10.6199 10.6199 10.6199 k = 0.4921 0.3024 0.3055 ( 6884 PWs) bands (ev): -20.2389 -20.2389 -20.2389 -20.2389 -17.7652 -17.7652 -17.7648 -17.7648 -17.3883 -17.3883 -17.3882 -17.3882 -17.3469 -17.3469 -17.3465 -17.3465 -7.9740 -7.9740 -7.9738 -7.9738 -6.3502 -6.3502 -6.3497 -6.3497 -5.2013 -5.2013 -5.1973 -5.1973 -5.1912 -5.1912 -5.1871 -5.1871 -2.6402 -2.6402 -2.6400 -2.6400 -2.2929 -2.2929 -2.2923 -2.2923 -2.1028 -2.1028 -2.1020 -2.1020 -1.8725 -1.8725 -1.8719 -1.8719 -1.6332 -1.6332 -1.6326 -1.6326 -0.1977 -0.1977 -0.1969 -0.1969 -0.0538 -0.0538 -0.0532 -0.0532 0.4078 0.4078 0.4079 0.4079 8.7601 8.7601 8.7603 8.7603 9.4962 9.4962 9.4963 9.4963 10.6197 10.6197 10.6200 10.6200 k = 0.4841 0.3162 0.3055 ( 6882 PWs) bands (ev): -20.2387 -20.2387 -20.2386 -20.2386 -17.7658 -17.7658 -17.7650 -17.7650 -17.3883 -17.3883 -17.3881 -17.3881 -17.3472 -17.3472 -17.3464 -17.3464 -7.9716 -7.9716 -7.9712 -7.9712 -6.3527 -6.3527 -6.3517 -6.3517 -5.2040 -5.2040 -5.1987 -5.1987 -5.1889 -5.1889 -5.1835 -5.1835 -2.6399 -2.6399 -2.6396 -2.6396 -2.3005 -2.3005 -2.2994 -2.2994 -2.0966 -2.0966 -2.0951 -2.0951 -1.8727 -1.8727 -1.8715 -1.8715 -1.6325 -1.6325 -1.6311 -1.6311 -0.2003 -0.2003 -0.1988 -0.1988 -0.0521 -0.0521 -0.0509 -0.0509 0.4038 0.4038 0.4041 0.4041 8.7635 8.7635 8.7638 8.7638 9.5005 9.5005 9.5006 9.5006 10.6194 10.6194 10.6199 10.6199 k = 0.4762 0.3299 0.3055 ( 6882 PWs) bands (ev): -20.2383 -20.2383 -20.2383 -20.2383 -17.7666 -17.7666 -17.7654 -17.7654 -17.3884 -17.3884 -17.3881 -17.3881 -17.3477 -17.3477 -17.3464 -17.3464 -7.9676 -7.9676 -7.9670 -7.9670 -6.3566 -6.3566 -6.3551 -6.3551 -5.2064 -5.2064 -5.2010 -5.2010 -5.1852 -5.1852 -5.1795 -5.1795 -2.6393 -2.6393 -2.6389 -2.6389 -2.3117 -2.3117 -2.3103 -2.3103 -2.0871 -2.0871 -2.0851 -2.0851 -1.8727 -1.8727 -1.8709 -1.8709 -1.6309 -1.6309 -1.6289 -1.6289 -0.2042 -0.2042 -0.2021 -0.2021 -0.0490 -0.0490 -0.0474 -0.0474 0.3973 0.3973 0.3977 0.3977 8.7691 8.7691 8.7696 8.7696 9.5075 9.5075 9.5077 9.5077 10.6189 10.6189 10.6196 10.6196 k = 0.4683 0.3437 0.3055 ( 6886 PWs) bands (ev): -20.2378 -20.2378 -20.2377 -20.2377 -17.7676 -17.7676 -17.7661 -17.7661 -17.3884 -17.3884 -17.3880 -17.3880 -17.3482 -17.3482 -17.3465 -17.3465 -7.9620 -7.9620 -7.9613 -7.9613 -6.3619 -6.3619 -6.3599 -6.3599 -5.2086 -5.2086 -5.2031 -5.2031 -5.1811 -5.1811 -5.1753 -5.1753 -2.6386 -2.6386 -2.6380 -2.6380 -2.3256 -2.3256 -2.3239 -2.3239 -2.0755 -2.0755 -2.0730 -2.0730 -1.8727 -1.8727 -1.8703 -1.8703 -1.6286 -1.6286 -1.6260 -1.6260 -0.2093 -0.2093 -0.2067 -0.2067 -0.0449 -0.0449 -0.0429 -0.0429 0.3884 0.3884 0.3890 0.3890 8.7769 8.7769 8.7776 8.7776 9.5173 9.5173 9.5175 9.5175 10.6178 10.6178 10.6189 10.6189 k = 0.4603 0.3574 0.3055 ( 6890 PWs) bands (ev): -20.2372 -20.2372 -20.2371 -20.2371 -17.7688 -17.7688 -17.7670 -17.7670 -17.3885 -17.3885 -17.3880 -17.3880 -17.3487 -17.3487 -17.3467 -17.3467 -7.9550 -7.9550 -7.9540 -7.9540 -6.3685 -6.3685 -6.3661 -6.3661 -5.2104 -5.2104 -5.2050 -5.2050 -5.1767 -5.1767 -5.1709 -5.1709 -2.6377 -2.6377 -2.6369 -2.6369 -2.3412 -2.3412 -2.3392 -2.3392 -2.0628 -2.0628 -2.0599 -2.0599 -1.8724 -1.8724 -1.8695 -1.8695 -1.6256 -1.6256 -1.6223 -1.6223 -0.2155 -0.2155 -0.2124 -0.2124 -0.0398 -0.0398 -0.0376 -0.0376 0.3773 0.3773 0.3780 0.3780 8.7869 8.7869 8.7877 8.7877 9.5297 9.5297 9.5299 9.5299 10.6161 10.6161 10.6174 10.6174 k = 0.4524 0.3712 0.3055 ( 6890 PWs) bands (ev): -20.2364 -20.2364 -20.2363 -20.2363 -17.7703 -17.7703 -17.7681 -17.7681 -17.3885 -17.3885 -17.3880 -17.3880 -17.3494 -17.3494 -17.3469 -17.3469 -7.9466 -7.9466 -7.9454 -7.9454 -6.3764 -6.3764 -6.3734 -6.3734 -5.2118 -5.2118 -5.2066 -5.2066 -5.1722 -5.1722 -5.1663 -5.1663 -2.6366 -2.6366 -2.6356 -2.6356 -2.3578 -2.3578 -2.3556 -2.3556 -2.0497 -2.0497 -2.0465 -2.0465 -1.8720 -1.8720 -1.8686 -1.8686 -1.6217 -1.6217 -1.6179 -1.6179 -0.2224 -0.2224 -0.2190 -0.2190 -0.0340 -0.0340 -0.0316 -0.0316 0.3642 0.3642 0.3651 0.3651 8.7989 8.7989 8.7998 8.7998 9.5446 9.5446 9.5449 9.5449 10.6132 10.6132 10.6148 10.6148 k = 0.4444 0.3849 0.3055 ( 6886 PWs) bands (ev): -20.2356 -20.2356 -20.2354 -20.2354 -17.7719 -17.7719 -17.7693 -17.7693 -17.3886 -17.3886 -17.3879 -17.3879 -17.3500 -17.3500 -17.3472 -17.3472 -7.9369 -7.9369 -7.9355 -7.9355 -6.3853 -6.3853 -6.3819 -6.3819 -5.2129 -5.2129 -5.2079 -5.2079 -5.1675 -5.1675 -5.1617 -5.1617 -2.6353 -2.6353 -2.6340 -2.6340 -2.3749 -2.3749 -2.3724 -2.3724 -2.0367 -2.0367 -2.0333 -2.0333 -1.8714 -1.8714 -1.8676 -1.8676 -1.6171 -1.6171 -1.6127 -1.6127 -0.2301 -0.2301 -0.2264 -0.2264 -0.0276 -0.0276 -0.0251 -0.0251 0.3493 0.3493 0.3504 0.3504 8.8127 8.8127 8.8138 8.8138 9.5618 9.5618 9.5621 9.5621 10.6088 10.6088 10.6107 10.6107 k = 0.4365 0.3986 0.3055 ( 6890 PWs) bands (ev): -20.2346 -20.2346 -20.2344 -20.2344 -17.7736 -17.7736 -17.7708 -17.7708 -17.3886 -17.3886 -17.3879 -17.3879 -17.3507 -17.3507 -17.3475 -17.3475 -7.9261 -7.9261 -7.9245 -7.9245 -6.3951 -6.3951 -6.3913 -6.3913 -5.2137 -5.2137 -5.2089 -5.2089 -5.1629 -5.1629 -5.1571 -5.1571 -2.6339 -2.6339 -2.6323 -2.6323 -2.3922 -2.3922 -2.3893 -2.3893 -2.0244 -2.0244 -2.0207 -2.0207 -1.8706 -1.8706 -1.8664 -1.8664 -1.6117 -1.6117 -1.6068 -1.6068 -0.2383 -0.2383 -0.2345 -0.2345 -0.0208 -0.0208 -0.0182 -0.0182 0.3330 0.3330 0.3344 0.3344 8.8283 8.8283 8.8296 8.8296 9.5811 9.5811 9.5815 9.5815 10.6024 10.6024 10.6046 10.6046 k = 0.4286 0.4124 0.3055 ( 6880 PWs) bands (ev): -20.2336 -20.2336 -20.2334 -20.2334 -17.7755 -17.7755 -17.7723 -17.7723 -17.3887 -17.3887 -17.3879 -17.3879 -17.3514 -17.3514 -17.3479 -17.3479 -7.9144 -7.9144 -7.9126 -7.9126 -6.4057 -6.4057 -6.4015 -6.4015 -5.2142 -5.2142 -5.2096 -5.2096 -5.1583 -5.1583 -5.1524 -5.1524 -2.6324 -2.6324 -2.6305 -2.6305 -2.4092 -2.4092 -2.4059 -2.4059 -2.0129 -2.0129 -2.0091 -2.0091 -1.8695 -1.8695 -1.8650 -1.8650 -1.6056 -1.6056 -1.6002 -1.6002 -0.2470 -0.2470 -0.2430 -0.2430 -0.0138 -0.0138 -0.0111 -0.0111 0.3156 0.3156 0.3173 0.3173 8.8455 8.8455 8.8469 8.8469 9.6022 9.6022 9.6027 9.6027 10.5935 10.5935 10.5961 10.5961 k = 0.4206 0.4261 0.3055 ( 6880 PWs) bands (ev): -20.2325 -20.2325 -20.2323 -20.2323 -17.7774 -17.7774 -17.7740 -17.7740 -17.3887 -17.3887 -17.3879 -17.3879 -17.3521 -17.3521 -17.3483 -17.3483 -7.9020 -7.9020 -7.9000 -7.9000 -6.4169 -6.4169 -6.4123 -6.4123 -5.2144 -5.2144 -5.2100 -5.2100 -5.1537 -5.1537 -5.1479 -5.1479 -2.6309 -2.6309 -2.6285 -2.6285 -2.4258 -2.4258 -2.4221 -2.4221 -2.0026 -2.0026 -1.9987 -1.9987 -1.8682 -1.8682 -1.8635 -1.8635 -1.5989 -1.5989 -1.5930 -1.5930 -0.2560 -0.2560 -0.2519 -0.2519 -0.0065 -0.0065 -0.0037 -0.0037 0.2974 0.2974 0.2994 0.2994 8.8640 8.8640 8.8656 8.8656 9.6249 9.6249 9.6254 9.6254 10.5817 10.5817 10.5846 10.5846 k = 0.4127 0.4399 0.3055 ( 6880 PWs) bands (ev): -20.2314 -20.2314 -20.2311 -20.2311 -17.7795 -17.7795 -17.7758 -17.7758 -17.3888 -17.3888 -17.3878 -17.3878 -17.3528 -17.3528 -17.3488 -17.3488 -7.8890 -7.8890 -7.8869 -7.8869 -6.4285 -6.4285 -6.4235 -6.4235 -5.2143 -5.2143 -5.2103 -5.2103 -5.1493 -5.1493 -5.1435 -5.1435 -2.6293 -2.6293 -2.6265 -2.6265 -2.4417 -2.4417 -2.4375 -2.4375 -1.9934 -1.9934 -1.9896 -1.9896 -1.8667 -1.8667 -1.8619 -1.8619 -1.5918 -1.5918 -1.5854 -1.5854 -0.2653 -0.2653 -0.2610 -0.2610 0.0007 0.0007 0.0037 0.0037 0.2789 0.2789 0.2813 0.2813 8.8837 8.8837 8.8854 8.8854 9.6487 9.6487 9.6493 9.6493 10.5666 10.5666 10.5699 10.5699 k = 0.4048 0.4536 0.3055 ( 6884 PWs) bands (ev): -20.2303 -20.2303 -20.2300 -20.2300 -17.7815 -17.7815 -17.7776 -17.7776 -17.3888 -17.3888 -17.3878 -17.3878 -17.3535 -17.3535 -17.3492 -17.3492 -7.8759 -7.8759 -7.8735 -7.8735 -6.4402 -6.4402 -6.4349 -6.4349 -5.2140 -5.2140 -5.2103 -5.2103 -5.1451 -5.1451 -5.1393 -5.1393 -2.6279 -2.6279 -2.6244 -2.6244 -2.4569 -2.4569 -2.4520 -2.4520 -1.9855 -1.9855 -1.9817 -1.9817 -1.8650 -1.8650 -1.8602 -1.8602 -1.5842 -1.5842 -1.5774 -1.5774 -0.2747 -0.2747 -0.2703 -0.2703 0.0078 0.0078 0.0111 0.0111 0.2603 0.2603 0.2632 0.2632 8.9042 8.9042 8.9060 8.9060 9.6732 9.6732 9.6739 9.6739 10.5482 10.5482 10.5519 10.5519 k = 0.3968 0.4674 0.3055 ( 6888 PWs) bands (ev): -20.2291 -20.2291 -20.2289 -20.2289 -17.7835 -17.7835 -17.7794 -17.7794 -17.3889 -17.3889 -17.3878 -17.3878 -17.3542 -17.3542 -17.3496 -17.3496 -7.8627 -7.8627 -7.8602 -7.8602 -6.4519 -6.4519 -6.4463 -6.4463 -5.2136 -5.2136 -5.2101 -5.2101 -5.1412 -5.1412 -5.1354 -5.1354 -2.6265 -2.6265 -2.6224 -2.6224 -2.4710 -2.4710 -2.4654 -2.4654 -1.9788 -1.9788 -1.9752 -1.9752 -1.8632 -1.8632 -1.8585 -1.8585 -1.5766 -1.5766 -1.5694 -1.5694 -0.2841 -0.2841 -0.2795 -0.2795 0.0147 0.0147 0.0185 0.0185 0.2422 0.2422 0.2457 0.2457 8.9254 8.9254 8.9273 8.9273 9.6977 9.6977 9.6987 9.6987 10.5266 10.5266 10.5306 10.5306 k = 0.3889 0.4811 0.3055 ( 6882 PWs) bands (ev): -20.2281 -20.2281 -20.2278 -20.2278 -17.7854 -17.7854 -17.7812 -17.7812 -17.3890 -17.3890 -17.3879 -17.3879 -17.3547 -17.3547 -17.3500 -17.3500 -7.8499 -7.8499 -7.8472 -7.8472 -6.4632 -6.4632 -6.4573 -6.4573 -5.2130 -5.2130 -5.2098 -5.2098 -5.1375 -5.1375 -5.1317 -5.1317 -2.6254 -2.6254 -2.6206 -2.6206 -2.4838 -2.4838 -2.4775 -2.4775 -1.9732 -1.9732 -1.9698 -1.9698 -1.8614 -1.8614 -1.8568 -1.8568 -1.5690 -1.5690 -1.5614 -1.5614 -0.2933 -0.2933 -0.2886 -0.2886 0.0212 0.0212 0.0257 0.0257 0.2249 0.2249 0.2291 0.2291 8.9467 8.9467 8.9487 8.9487 9.7218 9.7218 9.7229 9.7229 10.5024 10.5024 10.5068 10.5068 k = 0.3810 0.4949 0.3055 ( 6884 PWs) bands (ev): -20.2270 -20.2270 -20.2267 -20.2267 -17.7872 -17.7872 -17.7829 -17.7829 -17.3890 -17.3890 -17.3879 -17.3879 -17.3553 -17.3553 -17.3503 -17.3503 -7.8377 -7.8377 -7.8349 -7.8349 -6.4739 -6.4739 -6.4677 -6.4677 -5.2123 -5.2123 -5.2094 -5.2094 -5.1342 -5.1342 -5.1284 -5.1284 -2.6245 -2.6245 -2.6189 -2.6189 -2.4953 -2.4953 -2.4881 -2.4881 -1.9687 -1.9687 -1.9656 -1.9656 -1.8596 -1.8596 -1.8553 -1.8553 -1.5617 -1.5617 -1.5539 -1.5539 -0.3020 -0.3020 -0.2972 -0.2972 0.0271 0.0271 0.0325 0.0325 0.2087 0.2087 0.2138 0.2138 8.9677 8.9677 8.9698 8.9698 9.7444 9.7444 9.7458 9.7458 10.4765 10.4765 10.4814 10.4814 k = 0.3730 0.5086 0.3055 ( 6892 PWs) bands (ev): -20.2261 -20.2261 -20.2258 -20.2258 -17.7889 -17.7889 -17.7844 -17.7844 -17.3891 -17.3891 -17.3879 -17.3879 -17.3557 -17.3557 -17.3507 -17.3507 -7.8265 -7.8265 -7.8235 -7.8235 -6.4837 -6.4837 -6.4773 -6.4773 -5.2115 -5.2115 -5.2090 -5.2090 -5.1313 -5.1313 -5.1254 -5.1254 -2.6240 -2.6240 -2.6175 -2.6175 -2.5052 -2.5052 -2.4972 -2.4972 -1.9651 -1.9651 -1.9623 -1.9623 -1.8580 -1.8580 -1.8538 -1.8538 -1.5550 -1.5550 -1.5469 -1.5469 -0.3102 -0.3102 -0.3052 -0.3052 0.0323 0.0323 0.0388 0.0388 0.1942 0.1942 0.2003 0.2003 8.9880 8.9880 8.9902 8.9902 9.7648 9.7648 9.7665 9.7665 10.4505 10.4505 10.4558 10.4558 k = 0.3651 0.5224 0.3055 ( 6896 PWs) bands (ev): -20.2253 -20.2253 -20.2250 -20.2250 -17.7904 -17.7904 -17.7858 -17.7858 -17.3891 -17.3891 -17.3879 -17.3879 -17.3561 -17.3561 -17.3509 -17.3509 -7.8166 -7.8166 -7.8135 -7.8135 -6.4923 -6.4923 -6.4857 -6.4857 -5.2108 -5.2108 -5.2086 -5.2086 -5.1288 -5.1288 -5.1229 -5.1229 -2.6238 -2.6238 -2.6165 -2.6165 -2.5134 -2.5134 -2.5045 -2.5045 -1.9623 -1.9623 -1.9598 -1.9598 -1.8566 -1.8566 -1.8526 -1.8526 -1.5491 -1.5491 -1.5408 -1.5408 -0.3174 -0.3174 -0.3123 -0.3123 0.0367 0.0367 0.0442 0.0442 0.1817 0.1817 0.1889 0.1889 9.0068 9.0069 9.0091 9.0091 9.7820 9.7820 9.7840 9.7840 10.4259 10.4259 10.4316 10.4316 k = 0.3571 0.5361 0.3055 ( 6884 PWs) bands (ev): -20.2246 -20.2246 -20.2243 -20.2243 -17.7916 -17.7916 -17.7869 -17.7869 -17.3892 -17.3892 -17.3880 -17.3880 -17.3564 -17.3564 -17.3511 -17.3511 -7.8084 -7.8084 -7.8052 -7.8052 -6.4995 -6.4995 -6.4927 -6.4927 -5.2101 -5.2101 -5.2082 -5.2082 -5.1268 -5.1268 -5.1209 -5.1209 -2.6238 -2.6238 -2.6160 -2.6160 -2.5197 -2.5197 -2.5101 -2.5101 -1.9603 -1.9603 -1.9580 -1.9580 -1.8555 -1.8555 -1.8517 -1.8517 -1.5443 -1.5443 -1.5358 -1.5358 -0.3234 -0.3234 -0.3182 -0.3182 0.0400 0.0400 0.0487 0.0487 0.1717 0.1717 0.1799 0.1799 9.0234 9.0234 9.0258 9.0258 9.7951 9.7951 9.7975 9.7975 10.4048 10.4048 10.4108 10.4108 k = 0.3492 0.5499 0.3055 ( 6888 PWs) bands (ev): -20.2241 -20.2241 -20.2238 -20.2238 -17.7925 -17.7925 -17.7878 -17.7878 -17.3892 -17.3892 -17.3880 -17.3880 -17.3566 -17.3566 -17.3513 -17.3513 -7.8021 -7.8021 -7.7988 -7.7988 -6.5049 -6.5049 -6.4980 -6.4980 -5.2095 -5.2095 -5.2079 -5.2079 -5.1253 -5.1253 -5.1194 -5.1194 -2.6241 -2.6241 -2.6157 -2.6157 -2.5240 -2.5240 -2.5139 -2.5139 -1.9589 -1.9589 -1.9568 -1.9568 -1.8548 -1.8548 -1.8510 -1.8510 -1.5407 -1.5407 -1.5321 -1.5321 -0.3281 -0.3281 -0.3228 -0.3228 0.0422 0.0422 0.0519 0.0519 0.1645 0.1645 0.1736 0.1736 9.0368 9.0368 9.0391 9.0391 9.8037 9.8037 9.8064 9.8064 10.3887 10.3887 10.3951 10.3951 k = 0.3413 0.5636 0.3055 ( 6892 PWs) bands (ev): -20.2238 -20.2238 -20.2234 -20.2234 -17.7931 -17.7931 -17.7883 -17.7883 -17.3892 -17.3892 -17.3880 -17.3880 -17.3568 -17.3568 -17.3514 -17.3514 -7.7982 -7.7982 -7.7948 -7.7948 -6.5082 -6.5082 -6.5013 -6.5013 -5.2091 -5.2091 -5.2076 -5.2076 -5.1244 -5.1244 -5.1185 -5.1185 -2.6245 -2.6245 -2.6158 -2.6158 -2.5266 -2.5266 -2.5161 -2.5161 -1.9581 -1.9581 -1.9561 -1.9561 -1.8543 -1.8543 -1.8506 -1.8506 -1.5385 -1.5385 -1.5298 -1.5298 -0.3310 -0.3310 -0.3257 -0.3256 0.0434 0.0434 0.0537 0.0537 0.1602 0.1602 0.1699 0.1699 9.0457 9.0457 9.0481 9.0481 9.8081 9.8081 9.8109 9.8109 10.3789 10.3789 10.3855 10.3855 k = 0.3333 0.5774 0.3055 ( 6888 PWs) bands (ev): -20.2237 -20.2237 -20.2233 -20.2233 -17.7933 -17.7933 -17.7885 -17.7885 -17.3892 -17.3892 -17.3880 -17.3880 -17.3568 -17.3568 -17.3514 -17.3514 -7.7968 -7.7968 -7.7935 -7.7935 -6.5094 -6.5094 -6.5025 -6.5025 -5.2090 -5.2090 -5.2076 -5.2076 -5.1241 -5.1241 -5.1182 -5.1182 -2.6246 -2.6246 -2.6158 -2.6158 -2.5273 -2.5273 -2.5168 -2.5168 -1.9578 -1.9578 -1.9559 -1.9559 -1.8541 -1.8541 -1.8504 -1.8504 -1.5377 -1.5377 -1.5290 -1.5290 -0.3320 -0.3320 -0.3267 -0.3267 0.0437 0.0437 0.0542 0.0542 0.1588 0.1588 0.1688 0.1688 9.0490 9.0490 9.0514 9.0514 9.8091 9.8091 9.8120 9.8120 10.3757 10.3757 10.3823 10.3823 k = 0.3333 0.5774 0.3055 ( 6888 PWs) bands (ev): -20.2237 -20.2237 -20.2233 -20.2233 -17.7933 -17.7933 -17.7885 -17.7885 -17.3892 -17.3892 -17.3880 -17.3880 -17.3568 -17.3568 -17.3514 -17.3514 -7.7968 -7.7968 -7.7935 -7.7935 -6.5094 -6.5094 -6.5025 -6.5025 -5.2090 -5.2090 -5.2076 -5.2076 -5.1241 -5.1241 -5.1182 -5.1182 -2.6246 -2.6246 -2.6158 -2.6158 -2.5273 -2.5273 -2.5168 -2.5168 -1.9578 -1.9578 -1.9559 -1.9559 -1.8541 -1.8541 -1.8504 -1.8504 -1.5377 -1.5377 -1.5290 -1.5290 -0.3320 -0.3320 -0.3267 -0.3267 0.0437 0.0437 0.0542 0.0542 0.1588 0.1588 0.1688 0.1688 9.0490 9.0490 9.0514 9.0514 9.8091 9.8091 9.8120 9.8120 10.3757 10.3757 10.3823 10.3823 k = 0.3254 0.5636 0.3055 ( 6892 PWs) bands (ev): -20.2238 -20.2238 -20.2234 -20.2234 -17.7931 -17.7931 -17.7883 -17.7883 -17.3892 -17.3892 -17.3880 -17.3880 -17.3568 -17.3568 -17.3514 -17.3514 -7.7982 -7.7982 -7.7949 -7.7949 -6.5082 -6.5082 -6.5013 -6.5013 -5.2091 -5.2091 -5.2077 -5.2077 -5.1245 -5.1245 -5.1185 -5.1185 -2.6244 -2.6244 -2.6157 -2.6157 -2.5266 -2.5266 -2.5162 -2.5162 -1.9581 -1.9581 -1.9561 -1.9561 -1.8543 -1.8543 -1.8506 -1.8506 -1.5384 -1.5384 -1.5298 -1.5298 -0.3310 -0.3310 -0.3256 -0.3256 0.0435 0.0435 0.0538 0.0538 0.1601 0.1601 0.1698 0.1698 9.0453 9.0453 9.0477 9.0477 9.8088 9.8088 9.8116 9.8116 10.3786 10.3786 10.3852 10.3852 k = 0.3175 0.5499 0.3055 ( 6896 PWs) bands (ev): -20.2242 -20.2242 -20.2238 -20.2238 -17.7924 -17.7924 -17.7877 -17.7877 -17.3892 -17.3892 -17.3880 -17.3880 -17.3566 -17.3566 -17.3513 -17.3513 -7.8027 -7.8027 -7.7994 -7.7994 -6.5045 -6.5045 -6.4976 -6.4976 -5.2096 -5.2096 -5.2080 -5.2080 -5.1254 -5.1254 -5.1195 -5.1195 -2.6235 -2.6235 -2.6150 -2.6150 -2.5246 -2.5246 -2.5144 -2.5144 -1.9588 -1.9588 -1.9568 -1.9568 -1.8547 -1.8547 -1.8509 -1.8509 -1.5407 -1.5407 -1.5321 -1.5321 -0.3277 -0.3277 -0.3224 -0.3224 0.0432 0.0432 0.0530 0.0530 0.1634 0.1634 0.1726 0.1726 9.0335 9.0335 9.0359 9.0359 9.8092 9.8092 9.8119 9.8119 10.3865 10.3865 10.3929 10.3929 k = 0.3095 0.5361 0.3055 ( 6896 PWs) bands (ev): -20.2248 -20.2248 -20.2245 -20.2245 -17.7912 -17.7912 -17.7866 -17.7866 -17.3891 -17.3891 -17.3879 -17.3879 -17.3564 -17.3564 -17.3511 -17.3511 -7.8102 -7.8102 -7.8070 -7.8070 -6.4982 -6.4982 -6.4915 -6.4915 -5.2105 -5.2105 -5.2086 -5.2086 -5.1271 -5.1271 -5.1212 -5.1212 -2.6218 -2.6218 -2.6136 -2.6136 -2.5215 -2.5215 -2.5116 -2.5116 -1.9601 -1.9601 -1.9580 -1.9580 -1.8552 -1.8552 -1.8515 -1.8515 -1.5442 -1.5442 -1.5358 -1.5358 -0.3221 -0.3221 -0.3169 -0.3169 0.0432 0.0432 0.0523 0.0523 0.1683 0.1683 0.1769 0.1769 9.0129 9.0129 9.0152 9.0152 9.8124 9.8124 9.8149 9.8149 10.3979 10.3979 10.4041 10.4041 k = 0.3016 0.5224 0.3055 ( 6892 PWs) bands (ev): -20.2257 -20.2257 -20.2254 -20.2254 -17.7896 -17.7896 -17.7849 -17.7849 -17.3891 -17.3891 -17.3878 -17.3878 -17.3561 -17.3561 -17.3509 -17.3509 -7.8208 -7.8208 -7.8178 -7.8178 -6.4894 -6.4894 -6.4828 -6.4828 -5.2118 -5.2118 -5.2096 -5.2096 -5.1295 -5.1295 -5.1237 -5.1237 -2.6190 -2.6190 -2.6112 -2.6112 -2.5175 -2.5175 -2.5079 -2.5079 -1.9620 -1.9620 -1.9597 -1.9597 -1.8559 -1.8559 -1.8522 -1.8522 -1.5490 -1.5490 -1.5407 -1.5407 -0.3142 -0.3142 -0.3091 -0.3091 0.0438 0.0438 0.0520 0.0520 0.1744 0.1744 0.1823 0.1823 8.9833 8.9833 8.9855 8.9855 9.8200 9.8200 9.8223 9.8223 10.4115 10.4115 10.4173 10.4173 k = 0.2937 0.5086 0.3055 ( 6892 PWs) bands (ev): -20.2269 -20.2269 -20.2266 -20.2266 -17.7873 -17.7873 -17.7828 -17.7828 -17.3889 -17.3889 -17.3876 -17.3876 -17.3558 -17.3558 -17.3506 -17.3506 -7.8346 -7.8346 -7.8317 -7.8317 -6.4781 -6.4781 -6.4717 -6.4717 -5.2134 -5.2134 -5.2109 -5.2109 -5.1326 -5.1326 -5.1268 -5.1268 -2.6151 -2.6151 -2.6076 -2.6076 -2.5127 -2.5127 -2.5035 -2.5035 -1.9645 -1.9645 -1.9621 -1.9621 -1.8566 -1.8566 -1.8529 -1.8529 -1.5548 -1.5548 -1.5467 -1.5467 -0.3042 -0.3042 -0.2992 -0.2992 0.0452 0.0452 0.0525 0.0525 0.1815 0.1815 0.1886 0.1886 8.9452 8.9452 8.9473 8.9473 9.8326 9.8326 9.8348 9.8348 10.4259 10.4259 10.4314 10.4314 k = 0.2857 0.4949 0.3055 ( 6892 PWs) bands (ev): -20.2285 -20.2285 -20.2282 -20.2282 -17.7845 -17.7845 -17.7801 -17.7801 -17.3888 -17.3888 -17.3874 -17.3874 -17.3554 -17.3554 -17.3503 -17.3503 -7.8515 -7.8515 -7.8487 -7.8487 -6.4645 -6.4645 -6.4583 -6.4583 -5.2155 -5.2155 -5.2127 -5.2127 -5.1364 -5.1364 -5.1308 -5.1308 -2.6100 -2.6100 -2.6028 -2.6028 -2.5072 -2.5072 -2.4984 -2.4984 -1.9676 -1.9676 -1.9653 -1.9653 -1.8573 -1.8573 -1.8536 -1.8536 -1.5614 -1.5614 -1.5535 -1.5535 -0.2921 -0.2921 -0.2872 -0.2872 0.0476 0.0476 0.0541 0.0541 0.1892 0.1892 0.1955 0.1955 8.8994 8.8994 8.9013 8.9013 9.8502 9.8502 9.8523 9.8523 10.4402 10.4402 10.4452 10.4452 k = 0.2778 0.4811 0.3055 ( 6894 PWs) bands (ev): -20.2303 -20.2303 -20.2300 -20.2300 -17.7812 -17.7812 -17.7768 -17.7768 -17.3886 -17.3886 -17.3872 -17.3872 -17.3549 -17.3549 -17.3499 -17.3499 -7.8713 -7.8713 -7.8686 -7.8686 -6.4487 -6.4487 -6.4427 -6.4427 -5.2181 -5.2181 -5.2150 -5.2150 -5.1410 -5.1410 -5.1355 -5.1355 -2.6035 -2.6035 -2.5967 -2.5967 -2.5011 -2.5011 -2.4927 -2.4927 -1.9716 -1.9716 -1.9692 -1.9692 -1.8577 -1.8577 -1.8541 -1.8541 -1.5685 -1.5685 -1.5609 -1.5609 -0.2780 -0.2780 -0.2733 -0.2733 0.0511 0.0511 0.0568 0.0568 0.1974 0.1974 0.2031 0.2031 8.8470 8.8470 8.8488 8.8488 9.8726 9.8726 9.8746 9.8746 10.4535 10.4535 10.4582 10.4582 k = 0.2698 0.4674 0.3055 ( 6884 PWs) bands (ev): -20.2325 -20.2325 -20.2322 -20.2322 -17.7773 -17.7773 -17.7729 -17.7729 -17.3884 -17.3884 -17.3868 -17.3868 -17.3544 -17.3544 -17.3495 -17.3495 -7.8938 -7.8938 -7.8913 -7.8913 -6.4310 -6.4310 -6.4252 -6.4252 -5.2212 -5.2212 -5.2178 -5.2178 -5.1464 -5.1464 -5.1410 -5.1410 -2.5957 -2.5957 -2.5893 -2.5893 -2.4944 -2.4944 -2.4864 -2.4864 -1.9764 -1.9764 -1.9740 -1.9740 -1.8578 -1.8578 -1.8543 -1.8543 -1.5759 -1.5759 -1.5686 -1.5686 -0.2623 -0.2623 -0.2576 -0.2576 0.0559 0.0559 0.0607 0.0607 0.2061 0.2061 0.2110 0.2110 8.7893 8.7893 8.7909 8.7909 9.8990 9.8990 9.9010 9.9010 10.4656 10.4656 10.4699 10.4699 k = 0.2619 0.4536 0.3055 ( 6892 PWs) bands (ev): -20.2349 -20.2349 -20.2346 -20.2346 -17.7727 -17.7727 -17.7685 -17.7685 -17.3881 -17.3881 -17.3864 -17.3864 -17.3538 -17.3538 -17.3490 -17.3490 -7.9188 -7.9188 -7.9165 -7.9165 -6.4115 -6.4115 -6.4059 -6.4059 -5.2248 -5.2248 -5.2210 -5.2210 -5.1525 -5.1525 -5.1472 -5.1472 -2.5866 -2.5866 -2.5805 -2.5805 -2.4873 -2.4873 -2.4796 -2.4796 -1.9822 -1.9822 -1.9798 -1.9798 -1.8575 -1.8575 -1.8541 -1.8541 -1.5834 -1.5834 -1.5764 -1.5764 -0.2450 -0.2450 -0.2404 -0.2404 0.0619 0.0619 0.0660 0.0660 0.2152 0.2152 0.2195 0.2195 8.7273 8.7273 8.7288 8.7288 9.9288 9.9288 9.9307 9.9307 10.4760 10.4760 10.4799 10.4799 k = 0.2540 0.4399 0.3055 ( 6894 PWs) bands (ev): -20.2377 -20.2377 -20.2374 -20.2374 -17.7677 -17.7677 -17.7635 -17.7635 -17.3877 -17.3877 -17.3859 -17.3859 -17.3532 -17.3532 -17.3485 -17.3485 -7.9462 -7.9462 -7.9441 -7.9441 -6.3904 -6.3904 -6.3851 -6.3851 -5.2289 -5.2289 -5.2248 -5.2248 -5.1594 -5.1594 -5.1542 -5.1542 -2.5762 -2.5762 -2.5704 -2.5704 -2.4796 -2.4796 -2.4722 -2.4722 -1.9888 -1.9888 -1.9866 -1.9866 -1.8567 -1.8567 -1.8534 -1.8534 -1.5908 -1.5908 -1.5841 -1.5841 -0.2266 -0.2266 -0.2220 -0.2220 0.0691 0.0691 0.0728 0.0728 0.2247 0.2247 0.2284 0.2284 8.6621 8.6621 8.6635 8.6635 9.9612 9.9612 9.9630 9.9630 10.4846 10.4846 10.4883 10.4883 k = 0.2460 0.4261 0.3055 ( 6884 PWs) bands (ev): -20.2408 -20.2408 -20.2405 -20.2405 -17.7620 -17.7620 -17.7579 -17.7579 -17.3873 -17.3873 -17.3853 -17.3853 -17.3525 -17.3525 -17.3480 -17.3480 -7.9756 -7.9756 -7.9737 -7.9737 -6.3681 -6.3681 -6.3630 -6.3630 -5.2335 -5.2335 -5.2292 -5.2292 -5.1669 -5.1669 -5.1620 -5.1620 -2.5646 -2.5646 -2.5591 -2.5591 -2.4714 -2.4714 -2.4642 -2.4642 -1.9964 -1.9964 -1.9942 -1.9942 -1.8554 -1.8554 -1.8521 -1.8521 -1.5979 -1.5979 -1.5916 -1.5916 -0.2071 -0.2071 -0.2025 -0.2025 0.0774 0.0774 0.0810 0.0810 0.2346 0.2346 0.2377 0.2377 8.5946 8.5946 8.5959 8.5959 9.9955 9.9955 9.9972 9.9972 10.4916 10.4916 10.4949 10.4949 k = 0.2381 0.4124 0.3055 ( 6876 PWs) bands (ev): -20.2441 -20.2441 -20.2439 -20.2439 -17.7558 -17.7558 -17.7518 -17.7518 -17.3868 -17.3868 -17.3847 -17.3847 -17.3518 -17.3518 -17.3474 -17.3474 -8.0069 -8.0069 -8.0052 -8.0052 -6.3448 -6.3448 -6.3398 -6.3398 -5.2387 -5.2387 -5.2340 -5.2340 -5.1752 -5.1752 -5.1704 -5.1704 -2.5519 -2.5519 -2.5468 -2.5468 -2.4627 -2.4627 -2.4557 -2.4557 -2.0049 -2.0049 -2.0028 -2.0028 -1.8534 -1.8534 -1.8502 -1.8502 -1.6047 -1.6047 -1.5987 -1.5987 -0.1869 -0.1869 -0.1821 -0.1821 0.0868 0.0868 0.0906 0.0906 0.2450 0.2450 0.2477 0.2477 8.5254 8.5254 8.5266 8.5266 10.0309 10.0309 10.0326 10.0326 10.4971 10.4971 10.5001 10.5001 k = 0.2302 0.3986 0.3055 ( 6874 PWs) bands (ev): -20.2478 -20.2478 -20.2475 -20.2475 -17.7492 -17.7492 -17.7452 -17.7452 -17.3862 -17.3862 -17.3839 -17.3839 -17.3511 -17.3511 -17.3468 -17.3468 -8.0398 -8.0398 -8.0382 -8.0382 -6.3206 -6.3206 -6.3158 -6.3158 -5.2445 -5.2445 -5.2395 -5.2395 -5.1841 -5.1841 -5.1794 -5.1794 -2.5383 -2.5383 -2.5334 -2.5334 -2.4535 -2.4535 -2.4466 -2.4466 -2.0141 -2.0141 -2.0122 -2.0122 -1.8509 -1.8509 -1.8475 -1.8475 -1.6110 -1.6110 -1.6053 -1.6053 -0.1661 -0.1661 -0.1612 -0.1612 0.0972 0.0972 0.1016 0.1016 0.2558 0.2558 0.2582 0.2582 8.4552 8.4552 8.4563 8.4563 10.0668 10.0668 10.0684 10.0684 10.5013 10.5013 10.5041 10.5041 k = 0.2222 0.3849 0.3055 ( 6870 PWs) bands (ev): -20.2517 -20.2517 -20.2514 -20.2514 -17.7420 -17.7420 -17.7382 -17.7382 -17.3855 -17.3855 -17.3831 -17.3831 -17.3503 -17.3503 -17.3462 -17.3462 -8.0740 -8.0740 -8.0726 -8.0726 -6.2957 -6.2957 -6.2911 -6.2911 -5.2508 -5.2508 -5.2455 -5.2455 -5.1936 -5.1936 -5.1890 -5.1890 -2.5240 -2.5240 -2.5193 -2.5193 -2.4437 -2.4437 -2.4369 -2.4369 -2.0240 -2.0240 -2.0222 -2.0222 -1.8477 -1.8477 -1.8442 -1.8442 -1.6168 -1.6168 -1.6114 -1.6114 -0.1450 -0.1450 -0.1399 -0.1399 0.1086 0.1086 0.1137 0.1137 0.2672 0.2672 0.2696 0.2696 8.3845 8.3845 8.3854 8.3854 10.1025 10.1025 10.1040 10.1040 10.5045 10.5045 10.5072 10.5072 k = 0.2143 0.3712 0.3055 ( 6878 PWs) bands (ev): -20.2558 -20.2558 -20.2556 -20.2556 -17.7344 -17.7344 -17.7306 -17.7306 -17.3848 -17.3848 -17.3821 -17.3821 -17.3496 -17.3496 -17.3455 -17.3455 -8.1093 -8.1093 -8.1080 -8.1080 -6.2704 -6.2704 -6.2660 -6.2660 -5.2576 -5.2576 -5.2520 -5.2520 -5.2037 -5.2037 -5.1991 -5.1991 -2.5091 -2.5091 -2.5047 -2.5047 -2.4334 -2.4334 -2.4264 -2.4264 -2.0344 -2.0344 -2.0327 -2.0327 -1.8438 -1.8438 -1.8402 -1.8402 -1.6221 -1.6221 -1.6170 -1.6170 -0.1237 -0.1237 -0.1184 -0.1184 0.1208 0.1208 0.1266 0.1266 0.2794 0.2794 0.2820 0.2820 8.3137 8.3137 8.3145 8.3145 10.1371 10.1371 10.1385 10.1385 10.5073 10.5073 10.5099 10.5099 k = 0.2063 0.3574 0.3055 ( 6878 PWs) bands (ev): -20.2601 -20.2601 -20.2599 -20.2599 -17.7265 -17.7265 -17.7227 -17.7227 -17.3839 -17.3839 -17.3811 -17.3811 -17.3488 -17.3488 -17.3449 -17.3449 -8.1455 -8.1455 -8.1444 -8.1444 -6.2448 -6.2448 -6.2405 -6.2405 -5.2650 -5.2650 -5.2591 -5.2591 -5.2143 -5.2143 -5.2097 -5.2097 -2.4940 -2.4940 -2.4896 -2.4896 -2.4224 -2.4224 -2.4153 -2.4153 -2.0452 -2.0452 -2.0436 -2.0436 -1.8393 -1.8393 -1.8355 -1.8355 -1.6269 -1.6269 -1.6220 -1.6220 -0.1023 -0.1023 -0.0968 -0.0968 0.1335 0.1335 0.1402 0.1402 0.2926 0.2926 0.2954 0.2954 8.2431 8.2431 8.2439 8.2439 10.1695 10.1695 10.1710 10.1710 10.5102 10.5102 10.5129 10.5129 k = 0.1984 0.3437 0.3055 ( 6884 PWs) bands (ev): -20.2647 -20.2647 -20.2645 -20.2645 -17.7182 -17.7182 -17.7144 -17.7144 -17.3829 -17.3829 -17.3799 -17.3799 -17.3480 -17.3480 -17.3442 -17.3442 -8.1823 -8.1823 -8.1813 -8.1813 -6.2191 -6.2191 -6.2149 -6.2149 -5.2730 -5.2730 -5.2668 -5.2668 -5.2253 -5.2253 -5.2206 -5.2206 -2.4789 -2.4789 -2.4745 -2.4745 -2.4107 -2.4107 -2.4034 -2.4034 -2.0563 -2.0563 -2.0548 -2.0548 -1.8342 -1.8342 -1.8302 -1.8302 -1.6311 -1.6311 -1.6265 -1.6265 -0.0808 -0.0808 -0.0752 -0.0752 0.1466 0.1466 0.1540 0.1540 0.3070 0.3070 0.3101 0.3101 8.1732 8.1732 8.1739 8.1739 10.1986 10.1986 10.2004 10.2004 10.5141 10.5141 10.5170 10.5170 k = 0.1905 0.3299 0.3055 ( 6888 PWs) bands (ev): -20.2694 -20.2694 -20.2692 -20.2692 -17.7096 -17.7096 -17.7059 -17.7059 -17.3818 -17.3818 -17.3787 -17.3787 -17.3472 -17.3472 -17.3436 -17.3436 -8.2196 -8.2196 -8.2187 -8.2187 -6.1934 -6.1934 -6.1893 -6.1893 -5.2814 -5.2814 -5.2749 -5.2749 -5.2367 -5.2367 -5.2318 -5.2318 -2.4640 -2.4640 -2.4595 -2.4595 -2.3984 -2.3984 -2.3907 -2.3907 -2.0674 -2.0674 -2.0660 -2.0660 -1.8285 -1.8285 -1.8243 -1.8243 -1.6350 -1.6350 -1.6306 -1.6306 -0.0595 -0.0595 -0.0537 -0.0537 0.1597 0.1597 0.1677 0.1677 0.3227 0.3227 0.3261 0.3261 8.1041 8.1041 8.1048 8.1048 10.2231 10.2231 10.2254 10.2254 10.5198 10.5198 10.5232 10.5232 k = 0.1825 0.3162 0.3055 ( 6892 PWs) bands (ev): -20.2742 -20.2742 -20.2740 -20.2740 -17.7008 -17.7008 -17.6971 -17.6971 -17.3806 -17.3806 -17.3773 -17.3773 -17.3464 -17.3464 -17.3429 -17.3429 -8.2571 -8.2571 -8.2563 -8.2563 -6.1677 -6.1677 -6.1638 -6.1638 -5.2904 -5.2904 -5.2836 -5.2836 -5.2482 -5.2482 -5.2433 -5.2433 -2.4493 -2.4493 -2.4448 -2.4448 -2.3853 -2.3853 -2.3774 -2.3774 -2.0786 -2.0786 -2.0772 -2.0772 -1.8222 -1.8222 -1.8178 -1.8178 -1.6384 -1.6384 -1.6342 -1.6342 -0.0383 -0.0383 -0.0323 -0.0323 0.1726 0.1726 0.1810 0.1810 0.3401 0.3401 0.3436 0.3436 8.0361 8.0361 8.0368 8.0368 10.2417 10.2417 10.2448 10.2448 10.5285 10.5285 10.5325 10.5325 k = 0.1746 0.3024 0.3055 ( 6896 PWs) bands (ev): -20.2791 -20.2791 -20.2789 -20.2789 -17.6918 -17.6918 -17.6881 -17.6881 -17.3792 -17.3792 -17.3757 -17.3757 -17.3456 -17.3456 -17.3422 -17.3422 -8.2946 -8.2946 -8.2939 -8.2939 -6.1423 -6.1423 -6.1385 -6.1385 -5.2998 -5.2998 -5.2928 -5.2928 -5.2600 -5.2600 -5.2548 -5.2548 -2.4352 -2.4352 -2.4305 -2.4305 -2.3716 -2.3716 -2.3636 -2.3636 -2.0895 -2.0895 -2.0882 -2.0882 -1.8153 -1.8153 -1.8108 -1.8108 -1.6414 -1.6414 -1.6375 -1.6375 -0.0171 -0.0171 -0.0111 -0.0111 0.1851 0.1851 0.1936 0.1936 0.3591 0.3591 0.3627 0.3627 7.9695 7.9695 7.9701 7.9701 10.2536 10.2536 10.2574 10.2574 10.5408 10.5408 10.5456 10.5456 k = 0.1667 0.2887 0.3055 ( 6910 PWs) bands (ev): -20.2841 -20.2841 -20.2840 -20.2840 -17.6828 -17.6828 -17.6791 -17.6791 -17.3777 -17.3777 -17.3741 -17.3741 -17.3448 -17.3448 -17.3416 -17.3416 -8.3319 -8.3319 -8.3313 -8.3313 -6.1172 -6.1172 -6.1134 -6.1134 -5.3096 -5.3096 -5.3025 -5.3025 -5.2718 -5.2718 -5.2665 -5.2665 -2.4215 -2.4215 -2.4169 -2.4169 -2.3574 -2.3574 -2.3494 -2.3494 -2.1003 -2.1003 -2.0990 -2.0990 -1.8080 -1.8080 -1.8033 -1.8033 -1.6441 -1.6441 -1.6403 -1.6403 0.0039 0.0039 0.0099 0.0099 0.1968 0.1968 0.2053 0.2053 0.3798 0.3798 0.3833 0.3833 7.9044 7.9044 7.9050 7.9050 10.2584 10.2584 10.2629 10.2629 10.5570 10.5570 10.5624 10.5624 k = 0.1587 0.2749 0.3055 ( 6908 PWs) bands (ev): -20.2892 -20.2892 -20.2890 -20.2890 -17.6737 -17.6737 -17.6701 -17.6701 -17.3761 -17.3761 -17.3723 -17.3723 -17.3440 -17.3440 -17.3409 -17.3409 -8.3688 -8.3688 -8.3683 -8.3683 -6.0925 -6.0925 -6.0887 -6.0887 -5.3197 -5.3197 -5.3126 -5.3126 -5.2837 -5.2837 -5.2782 -5.2782 -2.4083 -2.4083 -2.4038 -2.4038 -2.3429 -2.3429 -2.3351 -2.3351 -2.1107 -2.1107 -2.1095 -2.1095 -1.8001 -1.8001 -1.7954 -1.7954 -1.6465 -1.6465 -1.6429 -1.6429 0.0247 0.0247 0.0306 0.0306 0.2077 0.2077 0.2160 0.2160 0.4020 0.4020 0.4053 0.4053 7.8410 7.8410 7.8416 7.8416 10.2566 10.2566 10.2615 10.2615 10.5767 10.5767 10.5826 10.5826 k = 0.1508 0.2612 0.3055 ( 6904 PWs) bands (ev): -20.2942 -20.2942 -20.2941 -20.2941 -17.6647 -17.6647 -17.6610 -17.6610 -17.3743 -17.3743 -17.3704 -17.3704 -17.3432 -17.3432 -17.3403 -17.3403 -8.4052 -8.4052 -8.4048 -8.4048 -6.0682 -6.0682 -6.0645 -6.0645 -5.3301 -5.3301 -5.3230 -5.3230 -5.2955 -5.2955 -5.2899 -5.2899 -2.3955 -2.3955 -2.3912 -2.3912 -2.3285 -2.3285 -2.3209 -2.3209 -2.1207 -2.1207 -2.1196 -2.1196 -1.7918 -1.7918 -1.7871 -1.7871 -1.6486 -1.6486 -1.6452 -1.6452 0.0454 0.0454 0.0512 0.0512 0.2178 0.2178 0.2258 0.2258 0.4255 0.4255 0.4285 0.4285 7.7796 7.7796 7.7800 7.7801 10.2490 10.2490 10.2542 10.2542 10.5989 10.5989 10.6051 10.6051 k = 0.1429 0.2474 0.3055 ( 6914 PWs) bands (ev): -20.2993 -20.2993 -20.2991 -20.2991 -17.6558 -17.6558 -17.6522 -17.6522 -17.3723 -17.3723 -17.3684 -17.3684 -17.3424 -17.3424 -17.3397 -17.3397 -8.4409 -8.4409 -8.4405 -8.4405 -6.0444 -6.0444 -6.0407 -6.0407 -5.3407 -5.3407 -5.3338 -5.3338 -5.3072 -5.3072 -5.3016 -5.3016 -2.3830 -2.3830 -2.3790 -2.3790 -2.3143 -2.3143 -2.3071 -2.3071 -2.1303 -2.1303 -2.1292 -2.1292 -1.7832 -1.7832 -1.7785 -1.7785 -1.6505 -1.6505 -1.6472 -1.6472 0.0658 0.0658 0.0715 0.0715 0.2271 0.2271 0.2346 0.2346 0.4501 0.4501 0.4528 0.4528 7.7201 7.7201 7.7206 7.7206 10.2366 10.2366 10.2419 10.2419 10.6225 10.6225 10.6290 10.6290 k = 0.1349 0.2337 0.3055 ( 6914 PWs) bands (ev): -20.3042 -20.3042 -20.3041 -20.3041 -17.6471 -17.6471 -17.6435 -17.6435 -17.3703 -17.3703 -17.3662 -17.3662 -17.3416 -17.3416 -17.3391 -17.3391 -8.4757 -8.4757 -8.4754 -8.4754 -6.0211 -6.0211 -6.0175 -6.0175 -5.3513 -5.3513 -5.3447 -5.3447 -5.3188 -5.3188 -5.3132 -5.3132 -2.3710 -2.3710 -2.3672 -2.3672 -2.3007 -2.3007 -2.2939 -2.2939 -2.1393 -2.1393 -2.1383 -2.1383 -1.7743 -1.7743 -1.7696 -1.7696 -1.6521 -1.6521 -1.6490 -1.6490 0.0860 0.0860 0.0915 0.0915 0.2355 0.2355 0.2426 0.2426 0.4754 0.4754 0.4778 0.4778 7.6629 7.6629 7.6634 7.6634 10.2205 10.2205 10.2257 10.2257 10.6469 10.6469 10.6534 10.6534 k = 0.1270 0.2199 0.3055 ( 6916 PWs) bands (ev): -20.3091 -20.3091 -20.3090 -20.3090 -17.6387 -17.6387 -17.6350 -17.6350 -17.3681 -17.3681 -17.3639 -17.3639 -17.3409 -17.3409 -17.3385 -17.3385 -8.5094 -8.5094 -8.5091 -8.5091 -5.9984 -5.9984 -5.9948 -5.9948 -5.3620 -5.3620 -5.3557 -5.3557 -5.3303 -5.3303 -5.3249 -5.3249 -2.3592 -2.3592 -2.3558 -2.3558 -2.2878 -2.2878 -2.2815 -2.2815 -2.1477 -2.1477 -2.1467 -2.1467 -1.7652 -1.7652 -1.7605 -1.7605 -1.6536 -1.6536 -1.6506 -1.6506 0.1058 0.1058 0.1111 0.1111 0.2432 0.2432 0.2498 0.2498 0.5012 0.5012 0.5033 0.5033 7.6081 7.6081 7.6085 7.6085 10.2015 10.2015 10.2066 10.2066 10.6712 10.6712 10.6777 10.6777 k = 0.1190 0.2062 0.3055 ( 6920 PWs) bands (ev): -20.3139 -20.3139 -20.3137 -20.3137 -17.6305 -17.6305 -17.6269 -17.6269 -17.3657 -17.3657 -17.3616 -17.3616 -17.3402 -17.3402 -17.3379 -17.3379 -8.5419 -8.5419 -8.5417 -8.5417 -5.9764 -5.9764 -5.9729 -5.9728 -5.3725 -5.3725 -5.3666 -5.3666 -5.3417 -5.3417 -5.3364 -5.3364 -2.3477 -2.3477 -2.3446 -2.3446 -2.2759 -2.2759 -2.2701 -2.2701 -2.1554 -2.1554 -2.1545 -2.1545 -1.7559 -1.7559 -1.7514 -1.7514 -1.6549 -1.6549 -1.6521 -1.6521 0.1253 0.1253 0.1303 0.1303 0.2502 0.2502 0.2563 0.2563 0.5272 0.5272 0.5290 0.5290 7.5557 7.5557 7.5561 7.5561 10.1802 10.1802 10.1852 10.1852 10.6950 10.6950 10.7014 10.7014 k = 0.1111 0.1925 0.3055 ( 6924 PWs) bands (ev): -20.3185 -20.3185 -20.3184 -20.3184 -17.6227 -17.6227 -17.6192 -17.6192 -17.3633 -17.3633 -17.3592 -17.3592 -17.3394 -17.3394 -17.3373 -17.3373 -8.5731 -8.5731 -8.5729 -8.5729 -5.9551 -5.9551 -5.9516 -5.9516 -5.3828 -5.3828 -5.3773 -5.3773 -5.3529 -5.3529 -5.3479 -5.3479 -2.3365 -2.3365 -2.3338 -2.3338 -2.2652 -2.2652 -2.2600 -2.2600 -2.1625 -2.1625 -2.1616 -2.1616 -1.7467 -1.7467 -1.7424 -1.7424 -1.6561 -1.6561 -1.6534 -1.6534 0.1442 0.1442 0.1490 0.1490 0.2566 0.2566 0.2622 0.2622 0.5531 0.5531 0.5547 0.5547 7.5059 7.5059 7.5063 7.5063 10.1575 10.1575 10.1622 10.1622 10.7180 10.7180 10.7243 10.7243 k = 0.1032 0.1787 0.3055 ( 6932 PWs) bands (ev): -20.3229 -20.3229 -20.3228 -20.3228 -17.6153 -17.6153 -17.6118 -17.6118 -17.3608 -17.3608 -17.3567 -17.3567 -17.3388 -17.3388 -17.3368 -17.3368 -8.6027 -8.6027 -8.6026 -8.6026 -5.9345 -5.9345 -5.9310 -5.9310 -5.3928 -5.3928 -5.3877 -5.3877 -5.3640 -5.3640 -5.3593 -5.3593 -2.3256 -2.3256 -2.3232 -2.3232 -2.2557 -2.2557 -2.2511 -2.2511 -2.1687 -2.1687 -2.1678 -2.1678 -1.7376 -1.7376 -1.7334 -1.7334 -1.6571 -1.6571 -1.6545 -1.6545 0.1625 0.1625 0.1670 0.1670 0.2624 0.2624 0.2675 0.2675 0.5786 0.5786 0.5800 0.5800 7.4590 7.4590 7.4593 7.4593 10.1339 10.1339 10.1383 10.1383 10.7401 10.7401 10.7463 10.7463 k = 0.0952 0.1650 0.3055 ( 6940 PWs) bands (ev): -20.3271 -20.3271 -20.3270 -20.3270 -17.6083 -17.6083 -17.6050 -17.6050 -17.3582 -17.3582 -17.3543 -17.3543 -17.3381 -17.3381 -17.3363 -17.3363 -8.6308 -8.6308 -8.6307 -8.6307 -5.9147 -5.9147 -5.9113 -5.9113 -5.4024 -5.4024 -5.3977 -5.3977 -5.3750 -5.3750 -5.3705 -5.3705 -2.3150 -2.3150 -2.3129 -2.3129 -2.2477 -2.2477 -2.2437 -2.2437 -2.1741 -2.1741 -2.1732 -2.1732 -1.7287 -1.7287 -1.7247 -1.7247 -1.6579 -1.6579 -1.6555 -1.6555 0.1801 0.1801 0.1843 0.1843 0.2676 0.2676 0.2723 0.2723 0.6035 0.6035 0.6047 0.6047 7.4149 7.4149 7.4152 7.4152 10.1099 10.1099 10.1140 10.1140 10.7612 10.7612 10.7672 10.7672 k = 0.0873 0.1512 0.3055 ( 6930 PWs) bands (ev): -20.3311 -20.3311 -20.3310 -20.3310 -17.6018 -17.6018 -17.5987 -17.5987 -17.3557 -17.3557 -17.3518 -17.3518 -17.3374 -17.3374 -17.3357 -17.3357 -8.6571 -8.6571 -8.6570 -8.6570 -5.8958 -5.8958 -5.8924 -5.8924 -5.4115 -5.4115 -5.4073 -5.4073 -5.3857 -5.3857 -5.3815 -5.3815 -2.3048 -2.3048 -2.3029 -2.3029 -2.2413 -2.2413 -2.2379 -2.2379 -2.1786 -2.1786 -2.1775 -2.1775 -1.7201 -1.7201 -1.7164 -1.7164 -1.6586 -1.6586 -1.6564 -1.6564 0.1968 0.1968 0.2007 0.2007 0.2724 0.2724 0.2766 0.2766 0.6275 0.6275 0.6285 0.6285 7.3738 7.3738 7.3741 7.3741 10.0860 10.0860 10.0899 10.0899 10.7813 10.7813 10.7870 10.7870 k = 0.0794 0.1375 0.3055 ( 6926 PWs) bands (ev): -20.3349 -20.3349 -20.3347 -20.3347 -17.5959 -17.5959 -17.5929 -17.5929 -17.3531 -17.3531 -17.3495 -17.3495 -17.3367 -17.3367 -17.3352 -17.3352 -8.6815 -8.6815 -8.6814 -8.6814 -5.8778 -5.8777 -5.8745 -5.8745 -5.4201 -5.4201 -5.4163 -5.4163 -5.3961 -5.3961 -5.3923 -5.3923 -2.2949 -2.2949 -2.2933 -2.2933 -2.2365 -2.2365 -2.2337 -2.2337 -2.1820 -2.1820 -2.1807 -2.1807 -1.7120 -1.7120 -1.7085 -1.7085 -1.6591 -1.6591 -1.6571 -1.6571 0.2126 0.2126 0.2161 0.2161 0.2767 0.2767 0.2805 0.2805 0.6504 0.6504 0.6513 0.6513 7.3358 7.3358 7.3361 7.3361 10.0627 10.0627 10.0662 10.0662 10.8003 10.8003 10.8058 10.8058 k = 0.0714 0.1237 0.3055 ( 6920 PWs) bands (ev): -20.3383 -20.3383 -20.3382 -20.3382 -17.5904 -17.5904 -17.5876 -17.5876 -17.3507 -17.3507 -17.3472 -17.3472 -17.3360 -17.3360 -17.3347 -17.3347 -8.7039 -8.7039 -8.7038 -8.7038 -5.8607 -5.8607 -5.8576 -5.8576 -5.4280 -5.4280 -5.4247 -5.4247 -5.4062 -5.4062 -5.4027 -5.4027 -2.2855 -2.2855 -2.2840 -2.2840 -2.2333 -2.2333 -2.2311 -2.2311 -2.1843 -2.1843 -2.1829 -2.1829 -1.7044 -1.7044 -1.7013 -1.7013 -1.6594 -1.6594 -1.6576 -1.6576 0.2272 0.2272 0.2304 0.2304 0.2806 0.2806 0.2839 0.2839 0.6719 0.6719 0.6727 0.6727 7.3011 7.3011 7.3013 7.3013 10.0404 10.0404 10.0436 10.0436 10.8183 10.8183 10.8234 10.8234 k = 0.0635 0.1100 0.3055 ( 6928 PWs) bands (ev): -20.3414 -20.3414 -20.3414 -20.3414 -17.5855 -17.5855 -17.5829 -17.5829 -17.3483 -17.3483 -17.3452 -17.3452 -17.3354 -17.3354 -17.3342 -17.3342 -8.7243 -8.7243 -8.7242 -8.7242 -5.8448 -5.8448 -5.8419 -5.8419 -5.4354 -5.4354 -5.4325 -5.4325 -5.4157 -5.4157 -5.4127 -5.4127 -2.2766 -2.2766 -2.2753 -2.2753 -2.2316 -2.2316 -2.2298 -2.2298 -2.1858 -2.1858 -2.1842 -2.1842 -1.6975 -1.6975 -1.6948 -1.6948 -1.6595 -1.6595 -1.6579 -1.6579 0.2406 0.2406 0.2434 0.2434 0.2841 0.2841 0.2870 0.2870 0.6919 0.6919 0.6925 0.6925 7.2697 7.2697 7.2699 7.2699 10.0195 10.0195 10.0223 10.0223 10.8351 10.8351 10.8399 10.8399 k = 0.0556 0.0962 0.3055 ( 6916 PWs) bands (ev): -20.3443 -20.3443 -20.3442 -20.3442 -17.5811 -17.5811 -17.5789 -17.5789 -17.3462 -17.3462 -17.3433 -17.3433 -17.3346 -17.3346 -17.3337 -17.3337 -8.7424 -8.7424 -8.7424 -8.7424 -5.8302 -5.8302 -5.8274 -5.8274 -5.4420 -5.4420 -5.4395 -5.4395 -5.4246 -5.4246 -5.4221 -5.4221 -2.2682 -2.2682 -2.2670 -2.2670 -2.2311 -2.2311 -2.2297 -2.2297 -2.1865 -2.1865 -2.1849 -2.1849 -1.6915 -1.6915 -1.6891 -1.6891 -1.6593 -1.6593 -1.6580 -1.6580 0.2527 0.2527 0.2551 0.2551 0.2873 0.2873 0.2898 0.2898 0.7101 0.7101 0.7106 0.7106 7.2417 7.2417 7.2419 7.2419 10.0002 10.0002 10.0027 10.0027 10.8509 10.8509 10.8553 10.8553 k = 0.0476 0.0825 0.3055 ( 6916 PWs) bands (ev): -20.3467 -20.3467 -20.3467 -20.3467 -17.5774 -17.5774 -17.5753 -17.5753 -17.3443 -17.3443 -17.3418 -17.3418 -17.3339 -17.3339 -17.3332 -17.3332 -8.7583 -8.7583 -8.7583 -8.7583 -5.8169 -5.8169 -5.8143 -5.8143 -5.4480 -5.4480 -5.4459 -5.4459 -5.4327 -5.4327 -5.4307 -5.4307 -2.2604 -2.2604 -2.2594 -2.2594 -2.2313 -2.2313 -2.2302 -2.2302 -2.1869 -2.1869 -2.1853 -2.1853 -1.6863 -1.6863 -1.6843 -1.6843 -1.6588 -1.6588 -1.6578 -1.6578 0.2633 0.2633 0.2653 0.2653 0.2903 0.2903 0.2922 0.2922 0.7263 0.7263 0.7267 0.7267 7.2173 7.2173 7.2175 7.2175 9.9829 9.9829 9.9850 9.9850 10.8653 10.8653 10.8693 10.8693 k = 0.0397 0.0687 0.3055 ( 6916 PWs) bands (ev): -20.3488 -20.3488 -20.3488 -20.3488 -17.5741 -17.5741 -17.5724 -17.5724 -17.3426 -17.3426 -17.3406 -17.3406 -17.3331 -17.3331 -17.3326 -17.3326 -8.7719 -8.7719 -8.7719 -8.7719 -5.8051 -5.8051 -5.8029 -5.8029 -5.4533 -5.4533 -5.4515 -5.4515 -5.4398 -5.4398 -5.4383 -5.4383 -2.2534 -2.2534 -2.2525 -2.2525 -2.2319 -2.2319 -2.2311 -2.2311 -2.1872 -2.1872 -2.1858 -2.1858 -1.6822 -1.6822 -1.6806 -1.6806 -1.6580 -1.6580 -1.6573 -1.6573 0.2722 0.2722 0.2737 0.2737 0.2930 0.2930 0.2945 0.2945 0.7403 0.7403 0.7407 0.7407 7.1965 7.1965 7.1966 7.1966 9.9679 9.9679 9.9696 9.9696 10.8782 10.8782 10.8818 10.8818 k = 0.0317 0.0550 0.3055 ( 6912 PWs) bands (ev): -20.3506 -20.3506 -20.3505 -20.3505 -17.5714 -17.5714 -17.5701 -17.5701 -17.3413 -17.3413 -17.3397 -17.3397 -17.3324 -17.3324 -17.3321 -17.3321 -8.7831 -8.7831 -8.7831 -8.7831 -5.7950 -5.7950 -5.7932 -5.7931 -5.4579 -5.4579 -5.4564 -5.4564 -5.4457 -5.4457 -5.4448 -5.4448 -2.2473 -2.2473 -2.2465 -2.2465 -2.2327 -2.2327 -2.2321 -2.2321 -2.1876 -2.1876 -2.1863 -2.1863 -1.6791 -1.6791 -1.6779 -1.6779 -1.6569 -1.6569 -1.6565 -1.6565 0.2793 0.2793 0.2804 0.2804 0.2956 0.2956 0.2966 0.2966 0.7520 0.7520 0.7523 0.7523 7.1793 7.1793 7.1795 7.1795 9.9553 9.9553 9.9567 9.9567 10.8892 10.8892 10.8922 10.8922 k = 0.0238 0.0412 0.3055 ( 6920 PWs) bands (ev): -20.3520 -20.3520 -20.3519 -20.3519 -17.5693 -17.5693 -17.5683 -17.5683 -17.3403 -17.3403 -17.3391 -17.3391 -17.3317 -17.3317 -17.3316 -17.3316 -8.7919 -8.7919 -8.7919 -8.7919 -5.7869 -5.7869 -5.7854 -5.7854 -5.4617 -5.4617 -5.4605 -5.4605 -5.4503 -5.4503 -5.4499 -5.4498 -2.2422 -2.2422 -2.2415 -2.2415 -2.2334 -2.2334 -2.2329 -2.2329 -2.1880 -2.1880 -2.1869 -2.1869 -1.6769 -1.6769 -1.6761 -1.6761 -1.6558 -1.6558 -1.6556 -1.6556 0.2845 0.2845 0.2852 0.2852 0.2981 0.2981 0.2986 0.2986 0.7613 0.7613 0.7615 0.7615 7.1660 7.1660 7.1660 7.1660 9.9454 9.9454 9.9464 9.9464 10.8977 10.8977 10.9000 10.9000 k = 0.0159 0.0275 0.3055 ( 6926 PWs) bands (ev): -20.3530 -20.3530 -20.3529 -20.3529 -17.5678 -17.5678 -17.5671 -17.5671 -17.3395 -17.3395 -17.3388 -17.3388 -17.3312 -17.3312 -17.3312 -17.3312 -8.7982 -8.7982 -8.7982 -8.7982 -5.7808 -5.7808 -5.7798 -5.7798 -5.4646 -5.4646 -5.4637 -5.4637 -5.4535 -5.4535 -5.4534 -5.4534 -2.2384 -2.2384 -2.2379 -2.2379 -2.2338 -2.2338 -2.2335 -2.2335 -2.1884 -2.1884 -2.1876 -2.1876 -1.6755 -1.6755 -1.6750 -1.6750 -1.6549 -1.6549 -1.6548 -1.6548 0.2879 0.2879 0.2882 0.2882 0.3003 0.3003 0.3004 0.3004 0.7680 0.7680 0.7681 0.7681 7.1564 7.1564 7.1564 7.1564 9.9382 9.9382 9.9389 9.9389 10.9028 10.9028 10.9042 10.9042 k = 0.0079 0.0137 0.3055 ( 6930 PWs) bands (ev): -20.3535 -20.3535 -20.3535 -20.3535 -17.5668 -17.5668 -17.5664 -17.5664 -17.3390 -17.3390 -17.3386 -17.3386 -17.3309 -17.3309 -17.3309 -17.3309 -8.8020 -8.8020 -8.8020 -8.8020 -5.7770 -5.7770 -5.7764 -5.7764 -5.4663 -5.4663 -5.4658 -5.4658 -5.4555 -5.4555 -5.4555 -5.4555 -2.2363 -2.2363 -2.2360 -2.2360 -2.2337 -2.2337 -2.2336 -2.2336 -2.1886 -2.1886 -2.1882 -2.1882 -1.6747 -1.6747 -1.6745 -1.6745 -1.6542 -1.6542 -1.6542 -1.6542 0.2897 0.2897 0.2898 0.2898 0.3018 0.3018 0.3018 0.3018 0.7720 0.7720 0.7721 0.7721 7.1506 7.1506 7.1506 7.1506 9.9340 9.9340 9.9343 9.9343 10.9044 10.9044 10.9050 10.9050 k = 0.0000 0.0000 0.3055 ( 6934 PWs) bands (ev): -20.3537 -20.3537 -20.3537 -20.3537 -17.5663 -17.5663 -17.5663 -17.5663 -17.3387 -17.3387 -17.3387 -17.3387 -17.3308 -17.3308 -17.3308 -17.3308 -8.8032 -8.8032 -8.8032 -8.8032 -5.7755 -5.7755 -5.7755 -5.7755 -5.4667 -5.4667 -5.4667 -5.4667 -5.4562 -5.4562 -5.4562 -5.4562 -2.2357 -2.2357 -2.2357 -2.2357 -2.2334 -2.2334 -2.2334 -2.2334 -2.1886 -2.1886 -2.1886 -2.1886 -1.6744 -1.6744 -1.6744 -1.6744 -1.6540 -1.6540 -1.6540 -1.6540 0.2903 0.2903 0.2903 0.2903 0.3023 0.3023 0.3023 0.3023 0.7734 0.7734 0.7734 0.7734 7.1487 7.1487 7.1487 7.1487 9.9327 9.9327 9.9327 9.9327 10.9046 10.9046 10.9046 10.9047 k = 0.5000 0.2887 0.3055 ( 6880 PWs) bands (ev): -20.2390 -20.2390 -20.2390 -20.2390 -17.7649 -17.7649 -17.7649 -17.7649 -17.3882 -17.3882 -17.3882 -17.3882 -17.3466 -17.3466 -17.3466 -17.3466 -7.9747 -7.9747 -7.9747 -7.9747 -6.3492 -6.3492 -6.3492 -6.3492 -5.1986 -5.1986 -5.1986 -5.1986 -5.1901 -5.1901 -5.1901 -5.1901 -2.6402 -2.6402 -2.6402 -2.6402 -2.2900 -2.2900 -2.2900 -2.2900 -2.1047 -2.1047 -2.1047 -2.1047 -1.8723 -1.8723 -1.8723 -1.8723 -1.6333 -1.6333 -1.6333 -1.6333 -0.1965 -0.1965 -0.1965 -0.1965 -0.0542 -0.0542 -0.0542 -0.0542 0.4092 0.4092 0.4092 0.4092 8.7590 8.7590 8.7590 8.7590 9.4948 9.4948 9.4948 9.4948 10.6199 10.6199 10.6199 10.6199 k = 0.5000 0.2887 0.2894 ( 6886 PWs) bands (ev): -20.2416 -20.2416 -20.2364 -20.2364 -17.7701 -17.7701 -17.7597 -17.7597 -17.3886 -17.3886 -17.3879 -17.3879 -17.3473 -17.3473 -17.3460 -17.3460 -8.0005 -8.0005 -7.9479 -7.9479 -6.3772 -6.3772 -6.3224 -6.3224 -5.2103 -5.2103 -5.2032 -5.2032 -5.1861 -5.1861 -5.1778 -5.1778 -2.6457 -2.6457 -2.6347 -2.6347 -2.3017 -2.3017 -2.2808 -2.2808 -2.1060 -2.1060 -2.1034 -2.1034 -1.8743 -1.8743 -1.8665 -1.8665 -1.6383 -1.6383 -1.6279 -1.6279 -0.2008 -0.2008 -0.1927 -0.1927 -0.0641 -0.0641 -0.0458 -0.0458 0.3830 0.3830 0.4355 0.4355 8.7319 8.7319 8.7868 8.7868 9.4480 9.4480 9.5438 9.5438 10.6153 10.6153 10.6258 10.6258 k = 0.5000 0.2887 0.2733 ( 6884 PWs) bands (ev): -20.2441 -20.2441 -20.2338 -20.2338 -17.7752 -17.7752 -17.7544 -17.7544 -17.3890 -17.3890 -17.3877 -17.3877 -17.3480 -17.3480 -17.3453 -17.3453 -8.0251 -8.0251 -7.9201 -7.9201 -6.4061 -6.4061 -6.2968 -6.2968 -5.2223 -5.2223 -5.2153 -5.2153 -5.1745 -5.1745 -5.1652 -5.1652 -2.6511 -2.6511 -2.6291 -2.6291 -2.3154 -2.3154 -2.2744 -2.2744 -2.1074 -2.1074 -2.1023 -2.1023 -1.8722 -1.8722 -1.8574 -1.8574 -1.6430 -1.6430 -1.6222 -1.6222 -0.2056 -0.2056 -0.1894 -0.1894 -0.0754 -0.0754 -0.0388 -0.0388 0.3573 0.3573 0.4619 0.4619 8.7055 8.7055 8.8150 8.8150 9.4036 9.4036 9.5945 9.5945 10.6121 10.6121 10.6330 10.6330 k = 0.5000 0.2887 0.2572 ( 6880 PWs) bands (ev): -20.2466 -20.2466 -20.2313 -20.2313 -17.7802 -17.7802 -17.7491 -17.7491 -17.3895 -17.3895 -17.3876 -17.3876 -17.3486 -17.3486 -17.3447 -17.3447 -8.0486 -8.0486 -7.8915 -7.8915 -6.4360 -6.4360 -6.2724 -6.2724 -5.2343 -5.2343 -5.2271 -5.2271 -5.1629 -5.1629 -5.1527 -5.1527 -2.6563 -2.6563 -2.6235 -2.6235 -2.3306 -2.3306 -2.2709 -2.2709 -2.1089 -2.1089 -2.1012 -2.1012 -1.8662 -1.8662 -1.8455 -1.8455 -1.6474 -1.6474 -1.6163 -1.6163 -0.2108 -0.2108 -0.1864 -0.1864 -0.0879 -0.0879 -0.0334 -0.0334 0.3323 0.3323 0.4881 0.4881 8.6802 8.6802 8.8431 8.8431 9.3620 9.3620 9.6469 9.6469 10.6105 10.6105 10.6413 10.6413 k = 0.5000 0.2887 0.2412 ( 6876 PWs) bands (ev): -20.2491 -20.2491 -20.2288 -20.2288 -17.7850 -17.7850 -17.7439 -17.7439 -17.3900 -17.3900 -17.3875 -17.3875 -17.3493 -17.3493 -17.3440 -17.3440 -8.0709 -8.0709 -7.8621 -7.8621 -6.4666 -6.4666 -6.2493 -6.2493 -5.2463 -5.2463 -5.2384 -5.2384 -5.1516 -5.1516 -5.1404 -5.1404 -2.6615 -2.6615 -2.6179 -2.6179 -2.3467 -2.3467 -2.2702 -2.2702 -2.1104 -2.1104 -2.1002 -2.1002 -1.8565 -1.8565 -1.8311 -1.8311 -1.6514 -1.6514 -1.6101 -1.6101 -0.2167 -0.2167 -0.1838 -0.1838 -0.1016 -0.1016 -0.0294 -0.0294 0.3081 0.3081 0.5138 0.5138 8.6561 8.6561 8.8708 8.8708 9.3237 9.3237 9.7006 9.7006 10.6104 10.6104 10.6502 10.6502 k = 0.5000 0.2887 0.2251 ( 6880 PWs) bands (ev): -20.2515 -20.2515 -20.2263 -20.2263 -17.7897 -17.7897 -17.7388 -17.7388 -17.3905 -17.3905 -17.3875 -17.3875 -17.3499 -17.3499 -17.3434 -17.3434 -8.0919 -8.0919 -7.8321 -7.8321 -6.4979 -6.4979 -6.2276 -6.2276 -5.2580 -5.2580 -5.2492 -5.2492 -5.1406 -5.1406 -5.1285 -5.1285 -2.6665 -2.6665 -2.6123 -2.6123 -2.3633 -2.3633 -2.2720 -2.2720 -2.1119 -2.1119 -2.0993 -2.0993 -1.8435 -1.8435 -1.8150 -1.8150 -1.6550 -1.6550 -1.6038 -1.6038 -0.2230 -0.2230 -0.1815 -0.1815 -0.1164 -0.1164 -0.0268 -0.0268 0.2850 0.2850 0.5389 0.5389 8.6332 8.6332 8.8972 8.8972 9.2894 9.2894 9.7554 9.7554 10.6117 10.6117 10.6596 10.6596 k = 0.5000 0.2887 0.2090 ( 6872 PWs) bands (ev): -20.2538 -20.2538 -20.2240 -20.2240 -17.7941 -17.7941 -17.7338 -17.7338 -17.3911 -17.3911 -17.3875 -17.3875 -17.3505 -17.3505 -17.3428 -17.3428 -8.1116 -8.1116 -7.8016 -7.8016 -6.5297 -6.5297 -6.2073 -6.2073 -5.2694 -5.2694 -5.2595 -5.2595 -5.1299 -5.1299 -5.1170 -5.1170 -2.6714 -2.6714 -2.6068 -2.6068 -2.3799 -2.3799 -2.2758 -2.2758 -2.1134 -2.1134 -2.0984 -2.0984 -1.8278 -1.8278 -1.7975 -1.7975 -1.6583 -1.6583 -1.5973 -1.5973 -0.2299 -0.2299 -0.1795 -0.1795 -0.1319 -0.1319 -0.0256 -0.0256 0.2632 0.2632 0.5631 0.5631 8.6116 8.6116 8.9213 8.9213 9.2598 9.2598 9.8109 9.8109 10.6144 10.6144 10.6692 10.6692 k = 0.5000 0.2887 0.1929 ( 6860 PWs) bands (ev): -20.2559 -20.2559 -20.2217 -20.2217 -17.7983 -17.7983 -17.7289 -17.7289 -17.3917 -17.3917 -17.3876 -17.3876 -17.3510 -17.3510 -17.3422 -17.3422 -8.1299 -8.1299 -7.7708 -7.7708 -6.5618 -6.5618 -6.1884 -6.1884 -5.2804 -5.2804 -5.2692 -5.2692 -5.1196 -5.1196 -5.1059 -5.1059 -2.6760 -2.6760 -2.6013 -2.6013 -2.3962 -2.3962 -2.2813 -2.2813 -2.1149 -2.1149 -2.0977 -2.0977 -1.8102 -1.8102 -1.7791 -1.7791 -1.6613 -1.6613 -1.5907 -1.5907 -0.2372 -0.2372 -0.1779 -0.1779 -0.1480 -0.1480 -0.0255 -0.0255 0.2428 0.2428 0.5864 0.5864 8.5915 8.5915 8.9420 8.9420 9.2363 9.2363 9.8669 9.8669 10.6182 10.6182 10.6784 10.6784 k = 0.5000 0.2887 0.1768 ( 6858 PWs) bands (ev): -20.2580 -20.2580 -20.2196 -20.2196 -17.8023 -17.8023 -17.7243 -17.7243 -17.3923 -17.3923 -17.3877 -17.3877 -17.3516 -17.3516 -17.3417 -17.3417 -8.1469 -8.1469 -7.7398 -7.7398 -6.5940 -6.5940 -6.1710 -6.1710 -5.2908 -5.2908 -5.2783 -5.2783 -5.1099 -5.1099 -5.0955 -5.0955 -2.6805 -2.6805 -2.5959 -2.5959 -2.4119 -2.4119 -2.2878 -2.2878 -2.1163 -2.1163 -2.0971 -2.0971 -1.7914 -1.7914 -1.7602 -1.7602 -1.6639 -1.6639 -1.5842 -1.5842 -0.2448 -0.2448 -0.1766 -0.1766 -0.1643 -0.1643 -0.0265 -0.0265 0.2239 0.2239 0.6084 0.6084 8.5728 8.5728 8.9573 8.9573 9.2203 9.2203 9.9231 9.9231 10.6231 10.6231 10.6868 10.6868 k = 0.5000 0.2887 0.1608 ( 6870 PWs) bands (ev): -20.2599 -20.2599 -20.2176 -20.2176 -17.8060 -17.8060 -17.7199 -17.7199 -17.3929 -17.3929 -17.3879 -17.3879 -17.3521 -17.3521 -17.3412 -17.3412 -8.1624 -8.1624 -7.7090 -7.7090 -6.6260 -6.6260 -6.1550 -6.1550 -5.3006 -5.3006 -5.2869 -5.2869 -5.1007 -5.1007 -5.0857 -5.0857 -2.6847 -2.6847 -2.5907 -2.5907 -2.4267 -2.4267 -2.2950 -2.2950 -2.1178 -2.1178 -2.0966 -2.0966 -1.7720 -1.7720 -1.7413 -1.7413 -1.6662 -1.6662 -1.5778 -1.5778 -0.2528 -0.2528 -0.1821 -0.1821 -0.1742 -0.1742 -0.0284 -0.0284 0.2067 0.2067 0.6291 0.6291 8.5556 8.5556 8.9661 8.9661 9.2130 9.2130 9.9791 9.9791 10.6288 10.6288 10.6941 10.6941 k = 0.5000 0.2887 0.1447 ( 6868 PWs) bands (ev): -20.2617 -20.2617 -20.2157 -20.2157 -17.8094 -17.8094 -17.7158 -17.7158 -17.3935 -17.3935 -17.3882 -17.3882 -17.3526 -17.3526 -17.3407 -17.3407 -8.1765 -8.1765 -7.6786 -7.6786 -6.6576 -6.6576 -6.1406 -6.1406 -5.3097 -5.3097 -5.2947 -5.2947 -5.0921 -5.0921 -5.0767 -5.0767 -2.6887 -2.6887 -2.5857 -2.5857 -2.4405 -2.4405 -2.3026 -2.3026 -2.1191 -2.1191 -2.0961 -2.0961 -1.7526 -1.7526 -1.7226 -1.7226 -1.6682 -1.6682 -1.5716 -1.5716 -0.2608 -0.2608 -0.1981 -0.1981 -0.1736 -0.1736 -0.0310 -0.0310 0.1913 0.1913 0.6483 0.6483 8.5399 8.5399 8.9679 8.9679 9.2144 9.2144 10.0345 10.0345 10.6349 10.6349 10.6996 10.6996 k = 0.5000 0.2887 0.1286 ( 6888 PWs) bands (ev): -20.2634 -20.2634 -20.2140 -20.2140 -17.8125 -17.8125 -17.7120 -17.7120 -17.3941 -17.3941 -17.3884 -17.3884 -17.3530 -17.3530 -17.3403 -17.3403 -8.1892 -8.1892 -7.6490 -7.6490 -6.6883 -6.6883 -6.1277 -6.1277 -5.3179 -5.3179 -5.3018 -5.3018 -5.0843 -5.0843 -5.0685 -5.0685 -2.6923 -2.6923 -2.5810 -2.5810 -2.4532 -2.4532 -2.3101 -2.3101 -2.1203 -2.1203 -2.0958 -2.0958 -1.7338 -1.7338 -1.7046 -1.7046 -1.6698 -1.6698 -1.5657 -1.5657 -0.2688 -0.2688 -0.2140 -0.2140 -0.1727 -0.1727 -0.0342 -0.0342 0.1775 0.1775 0.6659 0.6659 8.5258 8.5258 8.9639 8.9639 9.2230 9.2230 10.0888 10.0888 10.6413 10.6413 10.7031 10.7031 k = 0.5000 0.2887 0.1125 ( 6888 PWs) bands (ev): -20.2648 -20.2648 -20.2125 -20.2125 -17.8153 -17.8153 -17.7085 -17.7085 -17.3947 -17.3947 -17.3886 -17.3886 -17.3534 -17.3534 -17.3399 -17.3399 -8.2005 -8.2005 -7.6205 -7.6205 -6.7177 -6.7177 -6.1163 -6.1163 -5.3254 -5.3254 -5.3082 -5.3082 -5.0773 -5.0773 -5.0611 -5.0611 -2.6957 -2.6957 -2.5765 -2.5765 -2.4645 -2.4645 -2.3174 -2.3174 -2.1215 -2.1215 -2.0955 -2.0955 -1.7161 -1.7161 -1.6877 -1.6877 -1.6709 -1.6709 -1.5601 -1.5601 -0.2765 -0.2765 -0.2290 -0.2290 -0.1720 -0.1720 -0.0376 -0.0376 0.1655 0.1655 0.6817 0.6817 8.5134 8.5134 8.9560 8.9560 9.2364 9.2364 10.1414 10.1414 10.6476 10.6476 10.7040 10.7040 k = 0.5000 0.2887 0.0965 ( 6880 PWs) bands (ev): -20.2661 -20.2661 -20.2111 -20.2111 -17.8177 -17.8177 -17.7054 -17.7054 -17.3951 -17.3951 -17.3889 -17.3889 -17.3537 -17.3537 -17.3396 -17.3396 -8.2102 -8.2102 -7.5937 -7.5937 -6.7454 -6.7454 -6.1065 -6.1065 -5.3319 -5.3319 -5.3138 -5.3138 -5.0710 -5.0710 -5.0545 -5.0545 -2.6987 -2.6987 -2.5724 -2.5724 -2.4745 -2.4745 -2.3242 -2.3242 -2.1225 -2.1225 -2.0952 -2.0952 -1.7004 -1.7004 -1.6737 -1.6737 -1.6699 -1.6699 -1.5551 -1.5551 -0.2838 -0.2838 -0.2430 -0.2430 -0.1713 -0.1713 -0.0411 -0.0411 0.1553 0.1553 0.6956 0.6956 8.5025 8.5025 8.9465 8.9465 9.2522 9.2522 10.1917 10.1917 10.6536 10.6536 10.7023 10.7023 k = 0.5000 0.2887 0.0804 ( 6876 PWs) bands (ev): -20.2672 -20.2672 -20.2099 -20.2099 -17.8198 -17.8198 -17.7028 -17.7028 -17.3956 -17.3956 -17.3891 -17.3891 -17.3540 -17.3540 -17.3393 -17.3393 -8.2185 -8.2185 -7.5692 -7.5692 -6.7707 -6.7707 -6.0981 -6.0981 -5.3375 -5.3375 -5.3186 -5.3186 -5.0656 -5.0656 -5.0490 -5.0490 -2.7013 -2.7013 -2.5687 -2.5687 -2.4830 -2.4830 -2.3303 -2.3303 -2.1234 -2.1234 -2.0951 -2.0951 -1.6877 -1.6877 -1.6710 -1.6710 -1.6577 -1.6577 -1.5506 -1.5506 -0.2904 -0.2904 -0.2555 -0.2555 -0.1708 -0.1708 -0.0445 -0.0445 0.1467 0.1467 0.7076 0.7076 8.4933 8.4933 8.9367 8.9367 9.2683 9.2683 10.2387 10.2387 10.6588 10.6588 10.6979 10.6979 k = 0.5000 0.2887 0.0643 ( 6882 PWs) bands (ev): -20.2682 -20.2682 -20.2090 -20.2090 -17.8215 -17.8215 -17.7005 -17.7005 -17.3959 -17.3959 -17.3893 -17.3893 -17.3543 -17.3543 -17.3390 -17.3390 -8.2253 -8.2253 -7.5476 -7.5476 -6.7929 -6.7929 -6.0913 -6.0913 -5.3421 -5.3421 -5.3225 -5.3225 -5.0612 -5.0612 -5.0443 -5.0443 -2.7034 -2.7034 -2.5656 -2.5656 -2.4900 -2.4900 -2.3355 -2.3355 -2.1241 -2.1241 -2.0949 -2.0949 -1.6810 -1.6810 -1.6660 -1.6660 -1.6459 -1.6459 -1.5468 -1.5468 -0.2961 -0.2961 -0.2662 -0.2662 -0.1704 -0.1704 -0.0476 -0.0476 0.1398 0.1398 0.7175 0.7175 8.4858 8.4858 8.9278 8.9278 9.2833 9.2833 10.2814 10.2814 10.6633 10.6633 10.6912 10.6912 k = 0.5000 0.2887 0.0482 ( 6886 PWs) bands (ev): -20.2689 -20.2689 -20.2082 -20.2082 -17.8229 -17.8229 -17.6988 -17.6988 -17.3962 -17.3962 -17.3895 -17.3895 -17.3545 -17.3545 -17.3388 -17.3388 -8.2306 -8.2306 -7.5297 -7.5297 -6.8114 -6.8114 -6.0860 -6.0860 -5.3458 -5.3458 -5.3256 -5.3256 -5.0577 -5.0577 -5.0407 -5.0407 -2.7052 -2.7052 -2.5631 -2.5631 -2.4955 -2.4955 -2.3398 -2.3398 -2.1247 -2.1247 -2.0948 -2.0948 -1.6793 -1.6793 -1.6583 -1.6583 -1.6364 -1.6364 -1.5438 -1.5438 -0.3008 -0.3008 -0.2749 -0.2749 -0.1701 -0.1701 -0.0503 -0.0503 0.1345 0.1345 0.7252 0.7252 8.4799 8.4799 8.9203 8.9203 9.2961 9.2961 10.3183 10.3183 10.6667 10.6667 10.6831 10.6831 k = 0.5000 0.2887 0.0322 ( 6890 PWs) bands (ev): -20.2694 -20.2694 -20.2077 -20.2077 -17.8238 -17.8238 -17.6975 -17.6975 -17.3965 -17.3965 -17.3896 -17.3896 -17.3546 -17.3546 -17.3387 -17.3387 -8.2343 -8.2343 -7.5162 -7.5162 -6.8252 -6.8252 -6.0822 -6.0822 -5.3484 -5.3484 -5.3279 -5.3279 -5.0552 -5.0552 -5.0381 -5.0381 -2.7064 -2.7064 -2.5612 -2.5612 -2.4995 -2.4995 -2.3429 -2.3429 -2.1251 -2.1251 -2.0947 -2.0947 -1.6789 -1.6789 -1.6518 -1.6518 -1.6294 -1.6294 -1.5416 -1.5416 -0.3042 -0.3042 -0.2812 -0.2812 -0.1699 -0.1699 -0.0523 -0.0523 0.1307 0.1307 0.7308 0.7308 8.4757 8.4757 8.9147 8.9147 9.3057 9.3057 10.3473 10.3473 10.6689 10.6689 10.6751 10.6751 k = 0.5000 0.2887 0.0161 ( 6900 PWs) bands (ev): -20.2697 -20.2697 -20.2073 -20.2073 -17.8244 -17.8244 -17.6968 -17.6968 -17.3966 -17.3966 -17.3897 -17.3897 -17.3547 -17.3547 -17.3386 -17.3386 -8.2366 -8.2366 -7.5078 -7.5078 -6.8339 -6.8339 -6.0799 -6.0799 -5.3499 -5.3499 -5.3292 -5.3292 -5.0537 -5.0537 -5.0366 -5.0366 -2.7072 -2.7072 -2.5600 -2.5600 -2.5019 -2.5019 -2.3448 -2.3448 -2.1254 -2.1254 -2.0947 -2.0947 -1.6789 -1.6789 -1.6476 -1.6476 -1.6252 -1.6252 -1.5402 -1.5402 -0.3063 -0.3063 -0.2851 -0.2851 -0.1697 -0.1697 -0.0535 -0.0535 0.1285 0.1285 0.7342 0.7342 8.4731 8.4731 8.9113 8.9113 9.3118 9.3118 10.3663 10.3663 10.6678 10.6678 10.6714 10.6714 k = 0.5000 0.2887-0.0000 ( 6908 PWs) bands (ev): -20.2698 -20.2698 -20.2072 -20.2072 -17.8246 -17.8246 -17.6965 -17.6965 -17.3966 -17.3966 -17.3897 -17.3897 -17.3547 -17.3547 -17.3386 -17.3386 -8.2374 -8.2374 -7.5049 -7.5049 -6.8368 -6.8368 -6.0792 -6.0792 -5.3505 -5.3505 -5.3297 -5.3297 -5.0531 -5.0531 -5.0361 -5.0361 -2.7074 -2.7074 -2.5596 -2.5596 -2.5027 -2.5027 -2.3454 -2.3454 -2.1254 -2.1254 -2.0947 -2.0947 -1.6789 -1.6789 -1.6462 -1.6462 -1.6237 -1.6237 -1.5398 -1.5398 -0.3071 -0.3071 -0.2865 -0.2865 -0.1697 -0.1697 -0.0539 -0.0539 0.1277 0.1277 0.7353 0.7353 8.4723 8.4723 8.9101 8.9101 9.3138 9.3138 10.3729 10.3729 10.6658 10.6658 10.6715 10.6715 k = 0.3333 0.5774-0.0000 ( 6882 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7921 -17.7848 -17.7837 -17.7837 -17.3980 -17.3930 -17.3930 -17.3907 -17.3628 -17.3628 -17.3455 -17.3455 -7.7651 -7.7637 -7.7614 -7.7614 -6.5736 -6.5656 -6.5621 -6.5621 -5.2569 -5.2569 -5.1934 -5.1884 -5.1884 -5.1868 -4.9762 -4.9762 -2.7237 -2.7237 -2.6244 -2.6176 -2.6147 -2.6147 -2.4860 -2.4860 -2.0730 -2.0730 -1.7384 -1.7178 -1.7178 -1.7134 -1.5884 -1.5884 -1.5784 -1.5699 -1.5699 -1.5653 -0.3713 -0.3574 -0.3574 -0.3561 -0.2773 -0.2773 -0.0377 -0.0278 -0.0222 -0.0222 0.5249 0.5249 8.8373 8.8373 9.3692 9.3692 9.6609 9.6619 9.6645 9.6645 10.8566 10.8566 10.9683 10.9772 k = 0.3333 0.5774 0.0161 ( 6876 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7922 -17.7848 -17.7837 -17.7837 -17.3979 -17.3930 -17.3930 -17.3907 -17.3627 -17.3627 -17.3455 -17.3455 -7.7653 -7.7639 -7.7616 -7.7616 -6.5731 -6.5652 -6.5616 -6.5616 -5.2565 -5.2565 -5.1935 -5.1885 -5.1885 -5.1869 -4.9767 -4.9767 -2.7233 -2.7233 -2.6239 -2.6171 -2.6141 -2.6141 -2.4866 -2.4866 -2.0722 -2.0722 -1.7401 -1.7197 -1.7197 -1.7154 -1.5895 -1.5895 -1.5777 -1.5692 -1.5692 -1.5649 -0.3709 -0.3571 -0.3571 -0.3559 -0.2756 -0.2756 -0.0371 -0.0274 -0.0217 -0.0217 0.5238 0.5238 8.8379 8.8379 9.3677 9.3677 9.6616 9.6627 9.6652 9.6652 10.8581 10.8581 10.9618 10.9707 k = 0.3333 0.5774 0.0322 ( 6888 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7922 -17.7850 -17.7838 -17.7838 -17.3978 -17.3929 -17.3929 -17.3907 -17.3627 -17.3627 -17.3456 -17.3456 -7.7660 -7.7646 -7.7623 -7.7623 -6.5719 -6.5640 -6.5604 -6.5604 -5.2551 -5.2551 -5.1938 -5.1889 -5.1889 -5.1873 -4.9782 -4.9782 -2.7223 -2.7223 -2.6223 -2.6156 -2.6126 -2.6126 -2.4883 -2.4883 -2.0698 -2.0698 -1.7450 -1.7255 -1.7255 -1.7212 -1.5929 -1.5929 -1.5756 -1.5672 -1.5672 -1.5637 -0.3700 -0.3563 -0.3563 -0.3551 -0.2703 -0.2703 -0.0356 -0.0260 -0.0202 -0.0202 0.5203 0.5203 8.8398 8.8398 9.3634 9.3634 9.6638 9.6648 9.6674 9.6674 10.8625 10.8625 10.9431 10.9519 k = 0.3333 0.5774 0.0482 ( 6897 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7923 -17.7852 -17.7840 -17.7840 -17.3975 -17.3927 -17.3927 -17.3905 -17.3625 -17.3625 -17.3458 -17.3458 -7.7671 -7.7657 -7.7634 -7.7634 -6.5698 -6.5621 -6.5584 -6.5584 -5.2529 -5.2529 -5.1944 -5.1895 -5.1895 -5.1880 -4.9808 -4.9808 -2.7207 -2.7207 -2.6198 -2.6131 -2.6100 -2.6100 -2.4912 -2.4912 -2.0657 -2.0657 -1.7530 -1.7346 -1.7346 -1.7304 -1.5985 -1.5985 -1.5727 -1.5643 -1.5643 -1.5618 -0.3684 -0.3550 -0.3550 -0.3539 -0.2616 -0.2616 -0.0330 -0.0236 -0.0177 -0.0177 0.5145 0.5145 8.8429 8.8429 9.3564 9.3564 9.6674 9.6684 9.6710 9.6710 10.8695 10.8695 10.9143 10.9223 k = 0.3333 0.5774 0.0643 ( 6894 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7925 -17.7855 -17.7842 -17.7842 -17.3972 -17.3925 -17.3925 -17.3904 -17.3624 -17.3624 -17.3459 -17.3459 -7.7686 -7.7673 -7.7649 -7.7649 -6.5670 -6.5594 -6.5557 -6.5557 -5.2498 -5.2498 -5.1952 -5.1903 -5.1903 -5.1889 -4.9843 -4.9843 -2.7184 -2.7184 -2.6163 -2.6097 -2.6064 -2.6064 -2.4951 -2.4951 -2.0602 -2.0602 -1.7635 -1.7466 -1.7466 -1.7425 -1.6061 -1.6061 -1.5691 -1.5607 -1.5607 -1.5595 -0.3664 -0.3532 -0.3532 -0.3524 -0.2495 -0.2495 -0.0295 -0.0204 -0.0143 -0.0143 0.5065 0.5065 8.8473 8.8473 9.3467 9.3467 9.6724 9.6734 9.6760 9.6760 10.8778 10.8778 10.8779 10.8849 k = 0.3333 0.5774 0.0804 ( 6894 PWs) bands (ev): -20.2241 -20.2236 -20.2235 -20.2235 -17.7926 -17.7859 -17.7845 -17.7845 -17.3968 -17.3922 -17.3922 -17.3902 -17.3621 -17.3621 -17.3462 -17.3462 -7.7704 -7.7691 -7.7667 -7.7667 -6.5634 -6.5561 -6.5524 -6.5524 -5.2459 -5.2459 -5.1961 -5.1913 -5.1913 -5.1900 -4.9888 -4.9888 -2.7154 -2.7154 -2.6118 -2.6053 -2.6019 -2.6019 -2.5000 -2.5000 -2.0532 -2.0532 -1.7764 -1.7609 -1.7609 -1.7568 -1.6157 -1.6157 -1.5653 -1.5569 -1.5569 -1.5569 -0.3639 -0.3511 -0.3511 -0.3505 -0.2344 -0.2344 -0.0251 -0.0165 -0.0101 -0.0101 0.4962 0.4962 8.8529 8.8529 9.3346 9.3346 9.6788 9.6798 9.6823 9.6823 10.8362 10.8424 10.8440 10.8440 k = 0.3333 0.5774 0.0965 ( 6888 PWs) bands (ev): -20.2240 -20.2236 -20.2235 -20.2235 -17.7928 -17.7864 -17.7848 -17.7848 -17.3963 -17.3919 -17.3919 -17.3900 -17.3618 -17.3618 -17.3465 -17.3465 -7.7725 -7.7713 -7.7689 -7.7689 -6.5594 -6.5523 -6.5485 -6.5485 -5.2411 -5.2411 -5.1972 -5.1924 -5.1924 -5.1913 -4.9942 -4.9942 -2.7118 -2.7118 -2.6066 -2.6001 -2.5966 -2.5966 -2.5058 -2.5058 -2.0448 -2.0448 -1.7910 -1.7771 -1.7771 -1.7729 -1.6270 -1.6270 -1.5615 -1.5543 -1.5531 -1.5531 -0.3611 -0.3487 -0.3487 -0.3485 -0.2164 -0.2164 -0.0199 -0.0118 -0.0052 -0.0052 0.4838 0.4838 8.8598 8.8598 9.3204 9.3204 9.6864 9.6874 9.6900 9.6900 10.7914 10.7968 10.7993 10.7993 k = 0.3333 0.5774 0.1125 ( 6882 PWs) bands (ev): -20.2240 -20.2236 -20.2235 -20.2235 -17.7930 -17.7869 -17.7852 -17.7852 -17.3958 -17.3915 -17.3915 -17.3898 -17.3615 -17.3615 -17.3468 -17.3468 -7.7749 -7.7738 -7.7712 -7.7712 -6.5548 -6.5481 -6.5441 -6.5441 -5.2356 -5.2356 -5.1984 -5.1937 -5.1937 -5.1928 -5.0005 -5.0005 -2.7076 -2.7076 -2.6005 -2.5942 -2.5904 -2.5904 -2.5123 -2.5123 -2.0352 -2.0352 -1.8070 -1.7945 -1.7945 -1.7904 -1.6399 -1.6399 -1.5579 -1.5517 -1.5494 -1.5494 -0.3580 -0.3463 -0.3462 -0.3462 -0.1957 -0.1957 -0.0142 -0.0066 0.0003 0.0003 0.4692 0.4692 8.8678 8.8678 9.3042 9.3042 9.6952 9.6961 9.6988 9.6988 10.7451 10.7497 10.7528 10.7528 k = 0.3333 0.5774 0.1286 ( 6870 PWs) bands (ev): -20.2240 -20.2236 -20.2234 -20.2234 -17.7932 -17.7874 -17.7855 -17.7855 -17.3952 -17.3911 -17.3911 -17.3896 -17.3611 -17.3611 -17.3471 -17.3471 -7.7774 -7.7764 -7.7738 -7.7738 -6.5499 -6.5436 -6.5394 -6.5394 -5.2293 -5.2293 -5.1997 -5.1951 -5.1951 -5.1944 -5.0076 -5.0076 -2.7029 -2.7029 -2.5937 -2.5877 -2.5836 -2.5836 -2.5195 -2.5195 -2.0244 -2.0244 -1.8240 -1.8129 -1.8129 -1.8088 -1.6542 -1.6542 -1.5546 -1.5493 -1.5460 -1.5460 -0.3549 -0.3440 -0.3436 -0.3436 -0.1726 -0.1726 -0.0079 -0.0010 0.0063 0.0063 0.4526 0.4526 8.8771 8.8771 9.2864 9.2864 9.7051 9.7060 9.7086 9.7086 10.6983 10.7024 10.7060 10.7060 k = 0.3333 0.5774 0.1447 ( 6876 PWs) bands (ev): -20.2240 -20.2236 -20.2234 -20.2234 -17.7934 -17.7880 -17.7859 -17.7859 -17.3946 -17.3907 -17.3907 -17.3894 -17.3607 -17.3607 -17.3475 -17.3475 -7.7800 -7.7791 -7.7764 -7.7764 -6.5448 -6.5389 -6.5346 -6.5346 -5.2223 -5.2223 -5.2011 -5.1965 -5.1965 -5.1961 -5.0155 -5.0155 -2.6976 -2.6976 -2.5865 -2.5806 -2.5763 -2.5763 -2.5272 -2.5272 -2.0126 -2.0126 -1.8415 -1.8318 -1.8318 -1.8277 -1.6697 -1.6697 -1.5516 -1.5471 -1.5428 -1.5428 -0.3518 -0.3418 -0.3410 -0.3410 -0.1474 -0.1474 -0.0014 0.0049 0.0125 0.0125 0.4340 0.4340 8.8875 8.8875 9.2672 9.2672 9.7159 9.7168 9.7194 9.7194 10.6522 10.6557 10.6598 10.6598 k = 0.3333 0.5774 0.1608 ( 6888 PWs) bands (ev): -20.2239 -20.2236 -20.2234 -20.2234 -17.7936 -17.7886 -17.7863 -17.7863 -17.3940 -17.3903 -17.3903 -17.3892 -17.3603 -17.3603 -17.3480 -17.3480 -7.7827 -7.7818 -7.7790 -7.7790 -6.5396 -6.5341 -6.5297 -6.5297 -5.2148 -5.2148 -5.2024 -5.1978 -5.1977 -5.1977 -5.0241 -5.0241 -2.6917 -2.6917 -2.5788 -2.5732 -2.5687 -2.5687 -2.5353 -2.5353 -1.9998 -1.9998 -1.8592 -1.8507 -1.8507 -1.8466 -1.6861 -1.6861 -1.5489 -1.5451 -1.5401 -1.5401 -0.3487 -0.3398 -0.3385 -0.3385 -0.1204 -0.1204 0.0053 0.0109 0.0188 0.0188 0.4135 0.4135 8.8992 8.8992 9.2468 9.2468 9.7275 9.7283 9.7310 9.7310 10.6075 10.6106 10.6150 10.6150 k = 0.3333 0.5774 0.1768 ( 6909 PWs) bands (ev): -20.2239 -20.2236 -20.2234 -20.2234 -17.7937 -17.7893 -17.7867 -17.7867 -17.3933 -17.3899 -17.3899 -17.3890 -17.3598 -17.3598 -17.3484 -17.3484 -7.7852 -7.7845 -7.7816 -7.7816 -6.5345 -6.5295 -6.5248 -6.5248 -5.2074 -5.2074 -5.2038 -5.1996 -5.1983 -5.1983 -5.0334 -5.0334 -2.6854 -2.6854 -2.5709 -2.5656 -2.5614 -2.5614 -2.5432 -2.5432 -1.9861 -1.9861 -1.8766 -1.8693 -1.8693 -1.8653 -1.7033 -1.7033 -1.5465 -1.5434 -1.5376 -1.5376 -0.3458 -0.3379 -0.3362 -0.3362 -0.0918 -0.0918 0.0119 0.0169 0.0251 0.0251 0.3912 0.3912 8.9119 8.9119 9.2256 9.2256 9.7396 9.7403 9.7430 9.7430 10.5650 10.5676 10.5724 10.5724 k = 0.3333 0.5774 0.1929 ( 6924 PWs) bands (ev): -20.2239 -20.2236 -20.2234 -20.2234 -17.7938 -17.7899 -17.7871 -17.7871 -17.3927 -17.3895 -17.3895 -17.3888 -17.3594 -17.3594 -17.3489 -17.3489 -7.7877 -7.7870 -7.7841 -7.7841 -6.5295 -6.5251 -6.5202 -6.5202 -5.2051 -5.2035 -5.2035 -5.2013 -5.1946 -5.1946 -5.0432 -5.0432 -2.6785 -2.6785 -2.5629 -2.5580 -2.5580 -2.5580 -2.5476 -2.5476 -1.9717 -1.9717 -1.8932 -1.8871 -1.8871 -1.8832 -1.7212 -1.7212 -1.5445 -1.5419 -1.5355 -1.5355 -0.3431 -0.3362 -0.3340 -0.3340 -0.0619 -0.0619 0.0182 0.0226 0.0312 0.0312 0.3673 0.3673 8.9257 8.9257 9.2039 9.2039 9.7519 9.7526 9.7553 9.7553 10.5252 10.5274 10.5325 10.5325 k = 0.3333 0.5774 0.2090 ( 6912 PWs) bands (ev): -20.2238 -20.2236 -20.2234 -20.2234 -17.7939 -17.7905 -17.7875 -17.7875 -17.3921 -17.3892 -17.3892 -17.3887 -17.3589 -17.3589 -17.3494 -17.3494 -7.7900 -7.7894 -7.7864 -7.7864 -6.5249 -6.5210 -6.5159 -6.5159 -5.2062 -5.2038 -5.2038 -5.2029 -5.1861 -5.1861 -5.0535 -5.0535 -2.6713 -2.6713 -2.5643 -2.5643 -2.5552 -2.5508 -2.5427 -2.5427 -1.9566 -1.9566 -1.9088 -1.9037 -1.9037 -1.9001 -1.7395 -1.7395 -1.5428 -1.5406 -1.5337 -1.5337 -0.3406 -0.3347 -0.3321 -0.3321 -0.0310 -0.0310 0.0242 0.0279 0.0369 0.0369 0.3418 0.3418 8.9407 8.9407 9.1817 9.1817 9.7642 9.7648 9.7675 9.7675 10.4887 10.4906 10.4960 10.4960 k = 0.3333 0.5774 0.2251 ( 6903 PWs) bands (ev): -20.2238 -20.2236 -20.2233 -20.2233 -17.7940 -17.7911 -17.7878 -17.7878 -17.3915 -17.3888 -17.3888 -17.3886 -17.3584 -17.3584 -17.3499 -17.3499 -7.7920 -7.7915 -7.7884 -7.7884 -6.5207 -6.5174 -6.5120 -6.5120 -5.2072 -5.2047 -5.2047 -5.2045 -5.1764 -5.1764 -5.0642 -5.0642 -2.6636 -2.6636 -2.5731 -2.5731 -2.5479 -2.5440 -2.5359 -2.5359 -1.9413 -1.9413 -1.9227 -1.9181 -1.9181 -1.9153 -1.7582 -1.7582 -1.5413 -1.5396 -1.5323 -1.5323 -0.3384 -0.3335 -0.3305 -0.3305 0.0006 0.0006 0.0296 0.0326 0.0420 0.0420 0.3149 0.3149 8.9567 8.9567 9.1593 9.1593 9.7759 9.7765 9.7792 9.7792 10.4563 10.4578 10.4634 10.4634 k = 0.3333 0.5774 0.2412 ( 6903 PWs) bands (ev): -20.2238 -20.2236 -20.2233 -20.2233 -17.7940 -17.7916 -17.7880 -17.7880 -17.3909 -17.3886 -17.3886 -17.3886 -17.3579 -17.3579 -17.3503 -17.3503 -7.7937 -7.7933 -7.7902 -7.7902 -6.5170 -6.5144 -6.5087 -6.5087 -5.2081 -5.2058 -5.2057 -5.2057 -5.1660 -5.1660 -5.0752 -5.0752 -2.6556 -2.6556 -2.5824 -2.5824 -2.5413 -2.5381 -2.5296 -2.5296 -1.9347 -1.9347 -1.9347 -1.9287 -1.9213 -1.9213 -1.7770 -1.7770 -1.5401 -1.5388 -1.5311 -1.5311 -0.3365 -0.3326 -0.3291 -0.3291 0.0324 0.0324 0.0342 0.0367 0.0469 0.0469 0.2867 0.2867 8.9736 8.9736 9.1369 9.1369 9.7867 9.7871 9.7899 9.7899 10.4284 10.4296 10.4355 10.4355 k = 0.3333 0.5774 0.2572 ( 6894 PWs) bands (ev): -20.2237 -20.2236 -20.2233 -20.2233 -17.7939 -17.7921 -17.7883 -17.7883 -17.3904 -17.3887 -17.3883 -17.3883 -17.3575 -17.3575 -17.3508 -17.3508 -7.7951 -7.7948 -7.7916 -7.7916 -6.5140 -6.5120 -6.5060 -6.5060 -5.2087 -5.2070 -5.2065 -5.2065 -5.1552 -5.1552 -5.0864 -5.0864 -2.6473 -2.6473 -2.5917 -2.5917 -2.5358 -2.5333 -2.5243 -2.5243 -1.9443 -1.9437 -1.9437 -1.9397 -1.9058 -1.9058 -1.7960 -1.7960 -1.5392 -1.5382 -1.5302 -1.5302 -0.3349 -0.3320 -0.3280 -0.3280 0.0381 0.0399 0.0490 0.0490 0.0664 0.0664 0.2573 0.2573 8.9915 8.9915 9.1146 9.1146 9.7959 9.7962 9.7990 9.7990 10.4059 10.4068 10.4129 10.4129 k = 0.3333 0.5774 0.2733 ( 6876 PWs) bands (ev): -20.2237 -20.2236 -20.2233 -20.2233 -17.7938 -17.7926 -17.7884 -17.7884 -17.3900 -17.3888 -17.3882 -17.3882 -17.3571 -17.3571 -17.3511 -17.3511 -7.7960 -7.7958 -7.7926 -7.7926 -6.5117 -6.5104 -6.5041 -6.5041 -5.2090 -5.2079 -5.2071 -5.2071 -5.1442 -5.1442 -5.0978 -5.0978 -2.6388 -2.6388 -2.6010 -2.6010 -2.5315 -2.5298 -2.5202 -2.5202 -1.9514 -1.9514 -1.9512 -1.9481 -1.8885 -1.8885 -1.8149 -1.8149 -1.5384 -1.5378 -1.5295 -1.5295 -0.3336 -0.3317 -0.3273 -0.3273 0.0410 0.0422 0.0520 0.0520 0.0987 0.0987 0.2271 0.2271 9.0103 9.0103 9.0927 9.0927 9.8030 9.8033 9.8060 9.8060 10.3892 10.3898 10.3961 10.3961 k = 0.3333 0.5774 0.2894 ( 6882 PWs) bands (ev): -20.2237 -20.2236 -20.2233 -20.2233 -17.7936 -17.7930 -17.7885 -17.7885 -17.3896 -17.3890 -17.3881 -17.3881 -17.3569 -17.3569 -17.3513 -17.3513 -7.7966 -7.7965 -7.7932 -7.7932 -6.5101 -6.5095 -6.5029 -6.5029 -5.2091 -5.2086 -5.2074 -5.2074 -5.1330 -5.1330 -5.1092 -5.1092 -2.6304 -2.6304 -2.6099 -2.6099 -2.5286 -2.5277 -2.5177 -2.5177 -1.9562 -1.9562 -1.9551 -1.9535 -1.8707 -1.8707 -1.8336 -1.8336 -1.5380 -1.5376 -1.5291 -1.5291 -0.3327 -0.3317 -0.3268 -0.3268 0.0428 0.0434 0.0536 0.0536 0.1311 0.1311 0.1960 0.1960 9.0298 9.0298 9.0712 9.0712 9.8075 9.8077 9.8105 9.8105 10.3790 10.3793 10.3858 10.3858 k = 0.3333 0.5774 0.3055 ( 6888 PWs) bands (ev): -20.2237 -20.2237 -20.2233 -20.2233 -17.7933 -17.7933 -17.7885 -17.7885 -17.3892 -17.3892 -17.3880 -17.3880 -17.3568 -17.3568 -17.3514 -17.3514 -7.7968 -7.7968 -7.7935 -7.7935 -6.5094 -6.5094 -6.5025 -6.5025 -5.2090 -5.2090 -5.2076 -5.2076 -5.1241 -5.1241 -5.1182 -5.1182 -2.6246 -2.6246 -2.6158 -2.6158 -2.5273 -2.5273 -2.5168 -2.5168 -1.9578 -1.9578 -1.9559 -1.9559 -1.8541 -1.8541 -1.8504 -1.8504 -1.5377 -1.5377 -1.5290 -1.5290 -0.3320 -0.3320 -0.3267 -0.3267 0.0437 0.0437 0.0542 0.0542 0.1588 0.1588 0.1688 0.1688 9.0490 9.0490 9.0514 9.0514 9.8091 9.8091 9.8120 9.8120 10.3757 10.3757 10.3823 10.3823 Writing output data file AlPO4.save init_run : 3.84s CPU 14.23s WALL ( 1 calls) electrons : 1936.54s CPU 1954.66s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.37s CPU 1.57s WALL ( 1 calls) Called by electrons: c_bands : 1936.52s CPU 1954.43s WALL ( 1 calls) v_of_rho : 0.15s CPU 0.87s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.14s CPU 0.51s WALL ( 1 calls) newd : 0.67s CPU 0.89s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.03s CPU 0.12s WALL ( 264 calls) cegterg : 1852.62s CPU 1867.45s WALL ( 880 calls) Called by sum_band: Called by *egterg: h_psi : 689.50s CPU 701.91s WALL ( 16236 calls) s_psi : 91.39s CPU 91.57s WALL ( 16236 calls) g_psi : 1.60s CPU 1.68s WALL ( 15092 calls) cdiaghg : 810.23s CPU 807.44s WALL ( 15356 calls) cegterg:over : 150.00s CPU 146.15s WALL ( 15092 calls) cegterg:upda : 51.03s CPU 54.98s WALL ( 15092 calls) cegterg:last : 31.45s CPU 32.03s WALL ( 1939 calls) Called by h_psi: h_psi:vloc : 502.19s CPU 511.22s WALL ( 16236 calls) h_psi:vnl : 186.53s CPU 189.11s WALL ( 16236 calls) add_vuspsi : 71.74s CPU 77.21s WALL ( 16236 calls) General routines calbec : 114.71s CPU 111.71s WALL ( 16236 calls) fft : 0.48s CPU 1.48s WALL ( 19 calls) ffts : 0.01s CPU 0.06s WALL ( 4 calls) fftw : 477.37s CPU 484.02s WALL ( 1880080 calls) interpolate : 0.04s CPU 0.10s WALL ( 4 calls) davcio : 0.02s CPU 2.29s WALL ( 528 calls) Parallel routines fft_scatter : 283.63s CPU 284.08s WALL ( 1880103 calls) PWSCF : 33m41.40s CPU 36m37.41s WALL This run was terminated on: 8:18:55 13Dec2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=