Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 18:27:22 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./BaAl2xSiO4x2.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 62 35 10 3494 1527 234 Max 63 36 11 3501 1556 241 Sum 2233 1285 367 125929 55553 8513 bravais-lattice index = 14 lattice parameter (alat) = 10.0174 a.u. unit-cell volume = 1278.9945 (a.u.)^3 number of atoms/cell = 13 number of atomic types = 4 number of electrons = 72.00 number of Kohn-Sham states= 86 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 10.017437 celldm(2)= 1.000000 celldm(3)= 1.469157 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 1.469157 ) 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 0.680663 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Al read from file: /users/gautes/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. # 4 for Si read from file: /users/gautes/Pseudo/Si.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: b835890840a210e39275f4497a2439d5 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1141 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ba 10.00 137.32700 Ba( 1.00) O 6.00 15.99940 O( 1.00) Al 3.00 26.98150 Al( 1.00) Si 4.00 28.08550 Si( 1.00) 6 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 120 deg rotation - cryst. axis [0,0,1] cryst. s( 2) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 3) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 3) = ( -0.5000000 0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 4 inversion cryst. s( 4) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 inv. 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 inv. 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 ) double point group S_6 (-3) there are 12 classes and 6 irreducible representations the character table: E -E C3 -C3 C3^2 -C3^2 i -i S6^5 -S6^5 S6 -S6 G_4+ 1.00 -1.00 0.50 -0.50 0.50 -0.50 1.00 -1.00 0.50 -0.50 0.50 -0.50 G_5+ 1.00 -1.00 0.50 -0.50 0.50 -0.50 1.00 -1.00 0.50 -0.50 0.50 -0.50 G_6+ 1.00 -1.00 -1.00 1.00 -1.00 1.00 1.00 -1.00 -1.00 1.00 -1.00 1.00 G_4- 1.00 -1.00 0.50 -0.50 0.50 -0.50 -1.00 1.00 -0.50 0.50 -0.50 0.50 G_5- 1.00 -1.00 0.50 -0.50 0.50 -0.50 -1.00 1.00 -0.50 0.50 -0.50 0.50 G_6- 1.00 -1.00 -1.00 1.00 -1.00 1.00 -1.00 1.00 1.00 -1.00 1.00 -1.00 imaginary part E -E C3 -C3 C3^2 -C3^2 i -i S6^5 -S6^5 S6 -S6 G_4+ 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 0.87 -0.87 -0.87 0.87 G_5+ 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 -0.87 0.87 0.87 -0.87 G_6+ 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 G_4- 0.00 0.00 0.87 -0.87 -0.87 0.87 0.00 0.00 -0.87 0.87 0.87 -0.87 G_5- 0.00 0.00 -0.87 0.87 0.87 -0.87 0.00 0.00 0.87 -0.87 -0.87 0.87 G_6- 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C3 2 120 deg rotation - cryst. axis [0,0,1] -C3 -2 120 deg rotation - cryst. axis [0,0,1] E C3^2 3 120 deg rotation - cryst. axis [0,0,-1] -C3^2 -3 120 deg rotation - cryst. axis [0,0,-1] E i 4 inversion -i -4 inversion E S6^5 5 inv. 120 deg rotation - cryst. axis [0,0,1] -S6^5 -5 inv. 120 deg rotation - cryst. axis [0,0,1] E S6 6 inv. 120 deg rotation - cryst. axis [0,0,-1] -S6 -6 inv. 120 deg rotation - cryst. axis [0,0,-1] E Cartesian axes number of k points= 262 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 2) = ( 0.0142857 0.0082479 -0.0000000), wk = 0.0038168 k( 3) = ( 0.0285714 0.0164957 -0.0000000), wk = 0.0038168 k( 4) = ( 0.0428571 0.0247436 -0.0000000), wk = 0.0038168 k( 5) = ( 0.0571429 0.0329914 -0.0000000), wk = 0.0038168 k( 6) = ( 0.0714286 0.0412393 -0.0000000), wk = 0.0038168 k( 7) = ( 0.0857143 0.0494872 -0.0000000), wk = 0.0038168 k( 8) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0038168 k( 9) = ( 0.1142857 0.0659829 -0.0000000), wk = 0.0038168 k( 10) = ( 0.1285714 0.0742307 -0.0000000), wk = 0.0038168 k( 11) = ( 0.1428571 0.0824786 -0.0000000), wk = 0.0038168 k( 12) = ( 0.1571429 0.0907265 -0.0000000), wk = 0.0038168 k( 13) = ( 0.1714286 0.0989743 -0.0000000), wk = 0.0038168 k( 14) = ( 0.1857143 0.1072222 -0.0000000), wk = 0.0038168 k( 15) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0038168 k( 16) = ( 0.2142857 0.1237179 -0.0000000), wk = 0.0038168 k( 17) = ( 0.2285714 0.1319658 -0.0000000), wk = 0.0038168 k( 18) = ( 0.2428571 0.1402136 -0.0000000), wk = 0.0038168 k( 19) = ( 0.2571429 0.1484615 -0.0000000), wk = 0.0038168 k( 20) = ( 0.2714286 0.1567094 -0.0000000), wk = 0.0038168 k( 21) = ( 0.2857143 0.1649572 -0.0000000), wk = 0.0038168 k( 22) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0038168 k( 23) = ( 0.3142857 0.1814529 -0.0000000), wk = 0.0038168 k( 24) = ( 0.3285714 0.1897008 -0.0000000), wk = 0.0038168 k( 25) = ( 0.3428571 0.1979487 -0.0000000), wk = 0.0038168 k( 26) = ( 0.3571429 0.2061965 -0.0000000), wk = 0.0038168 k( 27) = ( 0.3714286 0.2144444 -0.0000000), wk = 0.0038168 k( 28) = ( 0.3857143 0.2226922 -0.0000000), wk = 0.0038168 k( 29) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0038168 k( 30) = ( 0.4142857 0.2391880 -0.0000000), wk = 0.0038168 k( 31) = ( 0.4285714 0.2474358 -0.0000000), wk = 0.0038168 k( 32) = ( 0.4428571 0.2556837 -0.0000000), wk = 0.0038168 k( 33) = ( 0.4571429 0.2639316 -0.0000000), wk = 0.0038168 k( 34) = ( 0.4714286 0.2721794 -0.0000000), wk = 0.0038168 k( 35) = ( 0.4857143 0.2804273 -0.0000000), wk = 0.0038168 k( 36) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038168 k( 37) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038168 k( 38) = ( 0.4916667 0.3031089 -0.0000000), wk = 0.0038168 k( 39) = ( 0.4833333 0.3175426 -0.0000000), wk = 0.0038168 k( 40) = ( 0.4750000 0.3319764 -0.0000000), wk = 0.0038168 k( 41) = ( 0.4666667 0.3464102 -0.0000000), wk = 0.0038168 k( 42) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0038168 k( 43) = ( 0.4500000 0.3752777 -0.0000000), wk = 0.0038168 k( 44) = ( 0.4416667 0.3897114 -0.0000000), wk = 0.0038168 k( 45) = ( 0.4333333 0.4041452 -0.0000000), wk = 0.0038168 k( 46) = ( 0.4250000 0.4185789 -0.0000000), wk = 0.0038168 k( 47) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0038168 k( 48) = ( 0.4083333 0.4474465 -0.0000000), wk = 0.0038168 k( 49) = ( 0.4000000 0.4618802 -0.0000000), wk = 0.0038168 k( 50) = ( 0.3916667 0.4763140 -0.0000000), wk = 0.0038168 k( 51) = ( 0.3833333 0.4907477 -0.0000000), wk = 0.0038168 k( 52) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0038168 k( 53) = ( 0.3666667 0.5196152 -0.0000000), wk = 0.0038168 k( 54) = ( 0.3583333 0.5340490 -0.0000000), wk = 0.0038168 k( 55) = ( 0.3500000 0.5484828 -0.0000000), wk = 0.0038168 k( 56) = ( 0.3416667 0.5629165 -0.0000000), wk = 0.0038168 k( 57) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038168 k( 58) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038168 k( 59) = ( 0.3250000 0.5629165 -0.0000000), wk = 0.0038168 k( 60) = ( 0.3166667 0.5484828 -0.0000000), wk = 0.0038168 k( 61) = ( 0.3083333 0.5340490 -0.0000000), wk = 0.0038168 k( 62) = ( 0.3000000 0.5196152 -0.0000000), wk = 0.0038168 k( 63) = ( 0.2916667 0.5051815 -0.0000000), wk = 0.0038168 k( 64) = ( 0.2833333 0.4907477 -0.0000000), wk = 0.0038168 k( 65) = ( 0.2750000 0.4763140 -0.0000000), wk = 0.0038168 k( 66) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0038168 k( 67) = ( 0.2583333 0.4474465 -0.0000000), wk = 0.0038168 k( 68) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0038168 k( 69) = ( 0.2416667 0.4185790 -0.0000000), wk = 0.0038168 k( 70) = ( 0.2333333 0.4041452 -0.0000000), wk = 0.0038168 k( 71) = ( 0.2250000 0.3897114 -0.0000000), wk = 0.0038168 k( 72) = ( 0.2166667 0.3752777 -0.0000000), wk = 0.0038168 k( 73) = ( 0.2083333 0.3608439 -0.0000000), wk = 0.0038168 k( 74) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0038168 k( 75) = ( 0.1916667 0.3319764 -0.0000000), wk = 0.0038168 k( 76) = ( 0.1833333 0.3175426 -0.0000000), wk = 0.0038168 k( 77) = ( 0.1750000 0.3031089 -0.0000000), wk = 0.0038168 k( 78) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0038168 k( 79) = ( 0.1583333 0.2742414 -0.0000000), wk = 0.0038168 k( 80) = ( 0.1500000 0.2598076 -0.0000000), wk = 0.0038168 k( 81) = ( 0.1416667 0.2453739 -0.0000000), wk = 0.0038168 k( 82) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0038168 k( 83) = ( 0.1250000 0.2165064 -0.0000000), wk = 0.0038168 k( 84) = ( 0.1166667 0.2020726 -0.0000000), wk = 0.0038168 k( 85) = ( 0.1083333 0.1876388 -0.0000000), wk = 0.0038168 k( 86) = ( 0.1000000 0.1732051 -0.0000000), wk = 0.0038168 k( 87) = ( 0.0916667 0.1587713 -0.0000000), wk = 0.0038168 k( 88) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0038168 k( 89) = ( 0.0750000 0.1299038 -0.0000000), wk = 0.0038168 k( 90) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0038168 k( 91) = ( 0.0583333 0.1010363 -0.0000000), wk = 0.0038168 k( 92) = ( 0.0500000 0.0866025 -0.0000000), wk = 0.0038168 k( 93) = ( 0.0416667 0.0721688 -0.0000000), wk = 0.0038168 k( 94) = ( 0.0333333 0.0577350 -0.0000000), wk = 0.0038168 k( 95) = ( 0.0250000 0.0433013 -0.0000000), wk = 0.0038168 k( 96) = ( 0.0166667 0.0288675 -0.0000000), wk = 0.0038168 k( 97) = ( 0.0083333 0.0144338 -0.0000000), wk = 0.0038168 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 100) = ( 0.0000000 0.0000000 0.0162062), wk = 0.0038168 k( 101) = ( 0.0000000 0.0000000 0.0324125), wk = 0.0038168 k( 102) = ( 0.0000000 0.0000000 0.0486188), wk = 0.0038168 k( 103) = ( 0.0000000 0.0000000 0.0648250), wk = 0.0038168 k( 104) = ( 0.0000000 0.0000000 0.0810313), wk = 0.0038168 k( 105) = ( 0.0000000 0.0000000 0.0972375), wk = 0.0038168 k( 106) = ( 0.0000000 0.0000000 0.1134438), wk = 0.0038168 k( 107) = ( 0.0000000 0.0000000 0.1296500), wk = 0.0038168 k( 108) = ( 0.0000000 0.0000000 0.1458563), wk = 0.0038168 k( 109) = ( 0.0000000 0.0000000 0.1620625), wk = 0.0038168 k( 110) = ( 0.0000000 0.0000000 0.1782688), wk = 0.0038168 k( 111) = ( 0.0000000 0.0000000 0.1944750), wk = 0.0038168 k( 112) = ( 0.0000000 0.0000000 0.2106813), wk = 0.0038168 k( 113) = ( 0.0000000 0.0000000 0.2268875), wk = 0.0038168 k( 114) = ( 0.0000000 0.0000000 0.2430938), wk = 0.0038168 k( 115) = ( 0.0000000 0.0000000 0.2593000), wk = 0.0038168 k( 116) = ( 0.0000000 0.0000000 0.2755063), wk = 0.0038168 k( 117) = ( 0.0000000 0.0000000 0.2917125), wk = 0.0038168 k( 118) = ( 0.0000000 0.0000000 0.3079188), wk = 0.0038168 k( 119) = ( 0.0000000 0.0000000 0.3241250), wk = 0.0038168 k( 120) = ( 0.0000000 0.0000000 0.3403313), wk = 0.0038168 k( 121) = ( 0.0000000 0.0000000 0.3403313), wk = 0.0038168 k( 122) = ( 0.0142857 0.0082479 0.3403313), wk = 0.0038168 k( 123) = ( 0.0285714 0.0164957 0.3403313), wk = 0.0038168 k( 124) = ( 0.0428571 0.0247436 0.3403313), wk = 0.0038168 k( 125) = ( 0.0571429 0.0329914 0.3403313), wk = 0.0038168 k( 126) = ( 0.0714286 0.0412393 0.3403313), wk = 0.0038168 k( 127) = ( 0.0857143 0.0494872 0.3403313), wk = 0.0038168 k( 128) = ( 0.1000000 0.0577350 0.3403313), wk = 0.0038168 k( 129) = ( 0.1142857 0.0659829 0.3403313), wk = 0.0038168 k( 130) = ( 0.1285714 0.0742307 0.3403313), wk = 0.0038168 k( 131) = ( 0.1428571 0.0824786 0.3403313), wk = 0.0038168 k( 132) = ( 0.1571429 0.0907265 0.3403313), wk = 0.0038168 k( 133) = ( 0.1714286 0.0989743 0.3403313), wk = 0.0038168 k( 134) = ( 0.1857143 0.1072222 0.3403313), wk = 0.0038168 k( 135) = ( 0.2000000 0.1154701 0.3403313), wk = 0.0038168 k( 136) = ( 0.2142857 0.1237179 0.3403313), wk = 0.0038168 k( 137) = ( 0.2285714 0.1319658 0.3403313), wk = 0.0038168 k( 138) = ( 0.2428571 0.1402136 0.3403313), wk = 0.0038168 k( 139) = ( 0.2571429 0.1484615 0.3403313), wk = 0.0038168 k( 140) = ( 0.2714286 0.1567094 0.3403313), wk = 0.0038168 k( 141) = ( 0.2857143 0.1649572 0.3403313), wk = 0.0038168 k( 142) = ( 0.3000000 0.1732051 0.3403313), wk = 0.0038168 k( 143) = ( 0.3142857 0.1814529 0.3403313), wk = 0.0038168 k( 144) = ( 0.3285714 0.1897008 0.3403313), wk = 0.0038168 k( 145) = ( 0.3428571 0.1979487 0.3403313), wk = 0.0038168 k( 146) = ( 0.3571429 0.2061965 0.3403313), wk = 0.0038168 k( 147) = ( 0.3714286 0.2144444 0.3403313), wk = 0.0038168 k( 148) = ( 0.3857143 0.2226922 0.3403313), wk = 0.0038168 k( 149) = ( 0.4000000 0.2309401 0.3403313), wk = 0.0038168 k( 150) = ( 0.4142857 0.2391880 0.3403313), wk = 0.0038168 k( 151) = ( 0.4285714 0.2474358 0.3403313), wk = 0.0038168 k( 152) = ( 0.4428571 0.2556837 0.3403313), wk = 0.0038168 k( 153) = ( 0.4571429 0.2639316 0.3403313), wk = 0.0038168 k( 154) = ( 0.4714286 0.2721794 0.3403313), wk = 0.0038168 k( 155) = ( 0.4857143 0.2804273 0.3403313), wk = 0.0038168 k( 156) = ( 0.5000000 0.2886751 0.3403313), wk = 0.0038168 k( 157) = ( 0.5000000 0.2886751 0.3403313), wk = 0.0038168 k( 158) = ( 0.4916667 0.3031089 0.3403313), wk = 0.0038168 k( 159) = ( 0.4833333 0.3175426 0.3403313), wk = 0.0038168 k( 160) = ( 0.4750000 0.3319764 0.3403313), wk = 0.0038168 k( 161) = ( 0.4666667 0.3464102 0.3403313), wk = 0.0038168 k( 162) = ( 0.4583333 0.3608439 0.3403313), wk = 0.0038168 k( 163) = ( 0.4500000 0.3752777 0.3403313), wk = 0.0038168 k( 164) = ( 0.4416667 0.3897114 0.3403313), wk = 0.0038168 k( 165) = ( 0.4333333 0.4041452 0.3403313), wk = 0.0038168 k( 166) = ( 0.4250000 0.4185789 0.3403313), wk = 0.0038168 k( 167) = ( 0.4166667 0.4330127 0.3403313), wk = 0.0038168 k( 168) = ( 0.4083333 0.4474465 0.3403313), wk = 0.0038168 k( 169) = ( 0.4000000 0.4618802 0.3403313), wk = 0.0038168 k( 170) = ( 0.3916667 0.4763140 0.3403313), wk = 0.0038168 k( 171) = ( 0.3833333 0.4907477 0.3403313), wk = 0.0038168 k( 172) = ( 0.3750000 0.5051815 0.3403313), wk = 0.0038168 k( 173) = ( 0.3666667 0.5196152 0.3403313), wk = 0.0038168 k( 174) = ( 0.3583333 0.5340490 0.3403313), wk = 0.0038168 k( 175) = ( 0.3500000 0.5484828 0.3403313), wk = 0.0038168 k( 176) = ( 0.3416667 0.5629165 0.3403313), wk = 0.0038168 k( 177) = ( 0.3333333 0.5773503 0.3403313), wk = 0.0038168 k( 178) = ( 0.3333333 0.5773503 0.3403313), wk = 0.0038168 k( 179) = ( 0.3250000 0.5629165 0.3403313), wk = 0.0038168 k( 180) = ( 0.3166667 0.5484828 0.3403313), wk = 0.0038168 k( 181) = ( 0.3083333 0.5340490 0.3403313), wk = 0.0038168 k( 182) = ( 0.3000000 0.5196152 0.3403313), wk = 0.0038168 k( 183) = ( 0.2916667 0.5051815 0.3403313), wk = 0.0038168 k( 184) = ( 0.2833333 0.4907477 0.3403313), wk = 0.0038168 k( 185) = ( 0.2750000 0.4763140 0.3403313), wk = 0.0038168 k( 186) = ( 0.2666667 0.4618802 0.3403313), wk = 0.0038168 k( 187) = ( 0.2583333 0.4474465 0.3403313), wk = 0.0038168 k( 188) = ( 0.2500000 0.4330127 0.3403313), wk = 0.0038168 k( 189) = ( 0.2416667 0.4185790 0.3403313), wk = 0.0038168 k( 190) = ( 0.2333333 0.4041452 0.3403313), wk = 0.0038168 k( 191) = ( 0.2250000 0.3897114 0.3403313), wk = 0.0038168 k( 192) = ( 0.2166667 0.3752777 0.3403313), wk = 0.0038168 k( 193) = ( 0.2083333 0.3608439 0.3403313), wk = 0.0038168 k( 194) = ( 0.2000000 0.3464102 0.3403313), wk = 0.0038168 k( 195) = ( 0.1916667 0.3319764 0.3403313), wk = 0.0038168 k( 196) = ( 0.1833333 0.3175426 0.3403313), wk = 0.0038168 k( 197) = ( 0.1750000 0.3031089 0.3403313), wk = 0.0038168 k( 198) = ( 0.1666667 0.2886751 0.3403313), wk = 0.0038168 k( 199) = ( 0.1583333 0.2742414 0.3403313), wk = 0.0038168 k( 200) = ( 0.1500000 0.2598076 0.3403313), wk = 0.0038168 k( 201) = ( 0.1416667 0.2453739 0.3403313), wk = 0.0038168 k( 202) = ( 0.1333333 0.2309401 0.3403313), wk = 0.0038168 k( 203) = ( 0.1250000 0.2165064 0.3403313), wk = 0.0038168 k( 204) = ( 0.1166667 0.2020726 0.3403313), wk = 0.0038168 k( 205) = ( 0.1083333 0.1876388 0.3403313), wk = 0.0038168 k( 206) = ( 0.1000000 0.1732051 0.3403313), wk = 0.0038168 k( 207) = ( 0.0916667 0.1587713 0.3403313), wk = 0.0038168 k( 208) = ( 0.0833333 0.1443376 0.3403313), wk = 0.0038168 k( 209) = ( 0.0750000 0.1299038 0.3403313), wk = 0.0038168 k( 210) = ( 0.0666667 0.1154701 0.3403313), wk = 0.0038168 k( 211) = ( 0.0583333 0.1010363 0.3403313), wk = 0.0038168 k( 212) = ( 0.0500000 0.0866025 0.3403313), wk = 0.0038168 k( 213) = ( 0.0416667 0.0721688 0.3403313), wk = 0.0038168 k( 214) = ( 0.0333333 0.0577350 0.3403313), wk = 0.0038168 k( 215) = ( 0.0250000 0.0433013 0.3403313), wk = 0.0038168 k( 216) = ( 0.0166667 0.0288675 0.3403313), wk = 0.0038168 k( 217) = ( 0.0083333 0.0144338 0.3403313), wk = 0.0038168 k( 218) = ( 0.0000000 0.0000000 0.3403313), wk = 0.0038168 k( 219) = ( 0.5000000 0.2886751 0.3403313), wk = 0.0038168 k( 220) = ( 0.5000000 0.2886751 0.3241250), wk = 0.0038168 k( 221) = ( 0.5000000 0.2886751 0.3079188), wk = 0.0038168 k( 222) = ( 0.5000000 0.2886751 0.2917125), wk = 0.0038168 k( 223) = ( 0.5000000 0.2886751 0.2755063), wk = 0.0038168 k( 224) = ( 0.5000000 0.2886751 0.2593000), wk = 0.0038168 k( 225) = ( 0.5000000 0.2886751 0.2430938), wk = 0.0038168 k( 226) = ( 0.5000000 0.2886751 0.2268875), wk = 0.0038168 k( 227) = ( 0.5000000 0.2886751 0.2106813), wk = 0.0038168 k( 228) = ( 0.5000000 0.2886751 0.1944750), wk = 0.0038168 k( 229) = ( 0.5000000 0.2886751 0.1782688), wk = 0.0038168 k( 230) = ( 0.5000000 0.2886751 0.1620625), wk = 0.0038168 k( 231) = ( 0.5000000 0.2886751 0.1458563), wk = 0.0038168 k( 232) = ( 0.5000000 0.2886751 0.1296500), wk = 0.0038168 k( 233) = ( 0.5000000 0.2886751 0.1134438), wk = 0.0038168 k( 234) = ( 0.5000000 0.2886751 0.0972375), wk = 0.0038168 k( 235) = ( 0.5000000 0.2886751 0.0810313), wk = 0.0038168 k( 236) = ( 0.5000000 0.2886751 0.0648250), wk = 0.0038168 k( 237) = ( 0.5000000 0.2886751 0.0486188), wk = 0.0038168 k( 238) = ( 0.5000000 0.2886751 0.0324125), wk = 0.0038168 k( 239) = ( 0.5000000 0.2886751 0.0162062), wk = 0.0038168 k( 240) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0038168 k( 241) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0038168 k( 242) = ( 0.3333333 0.5773503 0.0162062), wk = 0.0038168 k( 243) = ( 0.3333333 0.5773503 0.0324125), wk = 0.0038168 k( 244) = ( 0.3333333 0.5773503 0.0486188), wk = 0.0038168 k( 245) = ( 0.3333333 0.5773503 0.0648250), wk = 0.0038168 k( 246) = ( 0.3333333 0.5773503 0.0810313), wk = 0.0038168 k( 247) = ( 0.3333333 0.5773503 0.0972375), wk = 0.0038168 k( 248) = ( 0.3333333 0.5773503 0.1134438), wk = 0.0038168 k( 249) = ( 0.3333333 0.5773503 0.1296500), wk = 0.0038168 k( 250) = ( 0.3333333 0.5773503 0.1458563), wk = 0.0038168 k( 251) = ( 0.3333333 0.5773503 0.1620625), wk = 0.0038168 k( 252) = ( 0.3333333 0.5773503 0.1782688), wk = 0.0038168 k( 253) = ( 0.3333333 0.5773503 0.1944750), wk = 0.0038168 k( 254) = ( 0.3333333 0.5773503 0.2106813), wk = 0.0038168 k( 255) = ( 0.3333333 0.5773503 0.2268875), wk = 0.0038168 k( 256) = ( 0.3333333 0.5773503 0.2430938), wk = 0.0038168 k( 257) = ( 0.3333333 0.5773503 0.2593000), wk = 0.0038168 k( 258) = ( 0.3333333 0.5773503 0.2755063), wk = 0.0038168 k( 259) = ( 0.3333333 0.5773503 0.2917125), wk = 0.0038168 k( 260) = ( 0.3333333 0.5773503 0.3079188), wk = 0.0038168 k( 261) = ( 0.3333333 0.5773503 0.3241250), wk = 0.0038168 k( 262) = ( 0.3333333 0.5773503 0.3403313), wk = 0.0038168 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 2) = ( 0.0142857 -0.0000000 -0.0000000), wk = 0.0038168 k( 3) = ( 0.0285714 -0.0000000 -0.0000000), wk = 0.0038168 k( 4) = ( 0.0428571 -0.0000000 -0.0000000), wk = 0.0038168 k( 5) = ( 0.0571429 -0.0000000 -0.0000000), wk = 0.0038168 k( 6) = ( 0.0714286 -0.0000000 -0.0000000), wk = 0.0038168 k( 7) = ( 0.0857143 -0.0000000 -0.0000000), wk = 0.0038168 k( 8) = ( 0.1000000 0.0000000 -0.0000000), wk = 0.0038168 k( 9) = ( 0.1142857 -0.0000000 0.0000000), wk = 0.0038168 k( 10) = ( 0.1285714 -0.0000000 -0.0000000), wk = 0.0038168 k( 11) = ( 0.1428571 -0.0000000 -0.0000000), wk = 0.0038168 k( 12) = ( 0.1571429 -0.0000000 -0.0000000), wk = 0.0038168 k( 13) = ( 0.1714286 -0.0000000 -0.0000000), wk = 0.0038168 k( 14) = ( 0.1857143 -0.0000000 0.0000000), wk = 0.0038168 k( 15) = ( 0.2000000 0.0000000 -0.0000000), wk = 0.0038168 k( 16) = ( 0.2142857 -0.0000000 0.0000000), wk = 0.0038168 k( 17) = ( 0.2285714 -0.0000000 -0.0000000), wk = 0.0038168 k( 18) = ( 0.2428571 -0.0000000 -0.0000000), wk = 0.0038168 k( 19) = ( 0.2571429 -0.0000000 -0.0000000), wk = 0.0038168 k( 20) = ( 0.2714286 -0.0000000 -0.0000000), wk = 0.0038168 k( 21) = ( 0.2857143 -0.0000000 -0.0000000), wk = 0.0038168 k( 22) = ( 0.3000000 -0.0000000 -0.0000000), wk = 0.0038168 k( 23) = ( 0.3142857 0.0000000 0.0000000), wk = 0.0038168 k( 24) = ( 0.3285714 -0.0000000 -0.0000000), wk = 0.0038168 k( 25) = ( 0.3428571 -0.0000000 -0.0000000), wk = 0.0038168 k( 26) = ( 0.3571429 -0.0000000 -0.0000000), wk = 0.0038168 k( 27) = ( 0.3714286 -0.0000000 0.0000000), wk = 0.0038168 k( 28) = ( 0.3857143 -0.0000000 -0.0000000), wk = 0.0038168 k( 29) = ( 0.4000000 0.0000000 -0.0000000), wk = 0.0038168 k( 30) = ( 0.4142857 0.0000000 0.0000000), wk = 0.0038168 k( 31) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0038168 k( 32) = ( 0.4428571 0.0000000 0.0000000), wk = 0.0038168 k( 33) = ( 0.4571429 -0.0000000 -0.0000000), wk = 0.0038168 k( 34) = ( 0.4714286 -0.0000000 0.0000000), wk = 0.0038168 k( 35) = ( 0.4857143 -0.0000000 -0.0000000), wk = 0.0038168 k( 36) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038168 k( 37) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038168 k( 38) = ( 0.4916667 0.0166667 -0.0000000), wk = 0.0038168 k( 39) = ( 0.4833333 0.0333333 -0.0000000), wk = 0.0038168 k( 40) = ( 0.4750000 0.0500000 0.0000000), wk = 0.0038168 k( 41) = ( 0.4666667 0.0666667 -0.0000000), wk = 0.0038168 k( 42) = ( 0.4583333 0.0833333 -0.0000000), wk = 0.0038168 k( 43) = ( 0.4500000 0.1000000 -0.0000000), wk = 0.0038168 k( 44) = ( 0.4416667 0.1166667 0.0000000), wk = 0.0038168 k( 45) = ( 0.4333333 0.1333333 -0.0000000), wk = 0.0038168 k( 46) = ( 0.4250000 0.1500000 -0.0000000), wk = 0.0038168 k( 47) = ( 0.4166667 0.1666667 0.0000000), wk = 0.0038168 k( 48) = ( 0.4083333 0.1833333 -0.0000000), wk = 0.0038168 k( 49) = ( 0.4000000 0.2000000 -0.0000000), wk = 0.0038168 k( 50) = ( 0.3916667 0.2166667 0.0000000), wk = 0.0038168 k( 51) = ( 0.3833333 0.2333333 -0.0000000), wk = 0.0038168 k( 52) = ( 0.3750000 0.2500000 -0.0000000), wk = 0.0038168 k( 53) = ( 0.3666667 0.2666667 -0.0000000), wk = 0.0038168 k( 54) = ( 0.3583333 0.2833333 0.0000000), wk = 0.0038168 k( 55) = ( 0.3500000 0.3000000 -0.0000000), wk = 0.0038168 k( 56) = ( 0.3416667 0.3166667 -0.0000000), wk = 0.0038168 k( 57) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038168 k( 58) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038168 k( 59) = ( 0.3250000 0.3250000 0.0000000), wk = 0.0038168 k( 60) = ( 0.3166667 0.3166667 0.0000000), wk = 0.0038168 k( 61) = ( 0.3083333 0.3083333 -0.0000000), wk = 0.0038168 k( 62) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0038168 k( 63) = ( 0.2916667 0.2916667 0.0000000), wk = 0.0038168 k( 64) = ( 0.2833333 0.2833333 0.0000000), wk = 0.0038168 k( 65) = ( 0.2750000 0.2750000 0.0000000), wk = 0.0038168 k( 66) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0038168 k( 67) = ( 0.2583333 0.2583333 -0.0000000), wk = 0.0038168 k( 68) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0038168 k( 69) = ( 0.2416667 0.2416667 0.0000000), wk = 0.0038168 k( 70) = ( 0.2333333 0.2333333 -0.0000000), wk = 0.0038168 k( 71) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0038168 k( 72) = ( 0.2166667 0.2166667 0.0000000), wk = 0.0038168 k( 73) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0038168 k( 74) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0038168 k( 75) = ( 0.1916667 0.1916667 -0.0000000), wk = 0.0038168 k( 76) = ( 0.1833333 0.1833333 -0.0000000), wk = 0.0038168 k( 77) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0038168 k( 78) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0038168 k( 79) = ( 0.1583333 0.1583333 -0.0000000), wk = 0.0038168 k( 80) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0038168 k( 81) = ( 0.1416667 0.1416667 0.0000000), wk = 0.0038168 k( 82) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0038168 k( 83) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0038168 k( 84) = ( 0.1166667 0.1166667 -0.0000000), wk = 0.0038168 k( 85) = ( 0.1083333 0.1083333 -0.0000000), wk = 0.0038168 k( 86) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0038168 k( 87) = ( 0.0916667 0.0916667 0.0000000), wk = 0.0038168 k( 88) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0038168 k( 89) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0038168 k( 90) = ( 0.0666667 0.0666667 0.0000000), wk = 0.0038168 k( 91) = ( 0.0583333 0.0583333 0.0000000), wk = 0.0038168 k( 92) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0038168 k( 93) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0038168 k( 94) = ( 0.0333333 0.0333333 -0.0000000), wk = 0.0038168 k( 95) = ( 0.0250000 0.0250000 0.0000000), wk = 0.0038168 k( 96) = ( 0.0166667 0.0166667 -0.0000000), wk = 0.0038168 k( 97) = ( 0.0083333 0.0083333 0.0000000), wk = 0.0038168 k( 98) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 99) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0038168 k( 100) = ( 0.0000000 0.0000000 0.0238095), wk = 0.0038168 k( 101) = ( 0.0000000 0.0000000 0.0476190), wk = 0.0038168 k( 102) = ( 0.0000000 0.0000000 0.0714286), wk = 0.0038168 k( 103) = ( 0.0000000 0.0000000 0.0952381), wk = 0.0038168 k( 104) = ( 0.0000000 0.0000000 0.1190476), wk = 0.0038168 k( 105) = ( 0.0000000 0.0000000 0.1428571), wk = 0.0038168 k( 106) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0038168 k( 107) = ( 0.0000000 0.0000000 0.1904762), wk = 0.0038168 k( 108) = ( 0.0000000 0.0000000 0.2142857), wk = 0.0038168 k( 109) = ( 0.0000000 0.0000000 0.2380952), wk = 0.0038168 k( 110) = ( 0.0000000 0.0000000 0.2619048), wk = 0.0038168 k( 111) = ( 0.0000000 0.0000000 0.2857143), wk = 0.0038168 k( 112) = ( 0.0000000 0.0000000 0.3095238), wk = 0.0038168 k( 113) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0038168 k( 114) = ( 0.0000000 0.0000000 0.3571429), wk = 0.0038168 k( 115) = ( 0.0000000 0.0000000 0.3809524), wk = 0.0038168 k( 116) = ( 0.0000000 0.0000000 0.4047619), wk = 0.0038168 k( 117) = ( 0.0000000 0.0000000 0.4285714), wk = 0.0038168 k( 118) = ( 0.0000000 0.0000000 0.4523809), wk = 0.0038168 k( 119) = ( 0.0000000 0.0000000 0.4761905), wk = 0.0038168 k( 120) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038168 k( 121) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038168 k( 122) = ( 0.0142857 -0.0000000 0.5000000), wk = 0.0038168 k( 123) = ( 0.0285714 -0.0000000 0.5000000), wk = 0.0038168 k( 124) = ( 0.0428571 -0.0000000 0.5000000), wk = 0.0038168 k( 125) = ( 0.0571429 -0.0000000 0.5000000), wk = 0.0038168 k( 126) = ( 0.0714286 -0.0000000 0.5000000), wk = 0.0038168 k( 127) = ( 0.0857143 -0.0000000 0.5000000), wk = 0.0038168 k( 128) = ( 0.1000000 0.0000000 0.5000000), wk = 0.0038168 k( 129) = ( 0.1142857 -0.0000000 0.5000000), wk = 0.0038168 k( 130) = ( 0.1285714 -0.0000000 0.5000000), wk = 0.0038168 k( 131) = ( 0.1428571 -0.0000000 0.5000000), wk = 0.0038168 k( 132) = ( 0.1571429 -0.0000000 0.5000000), wk = 0.0038168 k( 133) = ( 0.1714286 -0.0000000 0.5000000), wk = 0.0038168 k( 134) = ( 0.1857143 -0.0000000 0.5000000), wk = 0.0038168 k( 135) = ( 0.2000000 0.0000000 0.5000000), wk = 0.0038168 k( 136) = ( 0.2142857 -0.0000000 0.5000000), wk = 0.0038168 k( 137) = ( 0.2285714 -0.0000000 0.5000000), wk = 0.0038168 k( 138) = ( 0.2428571 -0.0000000 0.5000000), wk = 0.0038168 k( 139) = ( 0.2571429 -0.0000000 0.5000000), wk = 0.0038168 k( 140) = ( 0.2714286 -0.0000000 0.5000000), wk = 0.0038168 k( 141) = ( 0.2857143 -0.0000000 0.5000000), wk = 0.0038168 k( 142) = ( 0.3000000 -0.0000000 0.5000000), wk = 0.0038168 k( 143) = ( 0.3142857 0.0000000 0.5000000), wk = 0.0038168 k( 144) = ( 0.3285714 -0.0000000 0.5000000), wk = 0.0038168 k( 145) = ( 0.3428571 -0.0000000 0.5000000), wk = 0.0038168 k( 146) = ( 0.3571429 -0.0000000 0.5000000), wk = 0.0038168 k( 147) = ( 0.3714286 -0.0000000 0.5000000), wk = 0.0038168 k( 148) = ( 0.3857143 -0.0000000 0.5000000), wk = 0.0038168 k( 149) = ( 0.4000000 0.0000000 0.5000000), wk = 0.0038168 k( 150) = ( 0.4142857 0.0000000 0.5000000), wk = 0.0038168 k( 151) = ( 0.4285714 -0.0000000 0.5000000), wk = 0.0038168 k( 152) = ( 0.4428571 0.0000000 0.5000000), wk = 0.0038168 k( 153) = ( 0.4571429 -0.0000000 0.5000000), wk = 0.0038168 k( 154) = ( 0.4714286 -0.0000000 0.5000000), wk = 0.0038168 k( 155) = ( 0.4857143 -0.0000000 0.5000000), wk = 0.0038168 k( 156) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0038168 k( 157) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0038168 k( 158) = ( 0.4916667 0.0166667 0.5000000), wk = 0.0038168 k( 159) = ( 0.4833333 0.0333333 0.5000000), wk = 0.0038168 k( 160) = ( 0.4750000 0.0500000 0.5000000), wk = 0.0038168 k( 161) = ( 0.4666667 0.0666667 0.5000000), wk = 0.0038168 k( 162) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0038168 k( 163) = ( 0.4500000 0.1000000 0.5000000), wk = 0.0038168 k( 164) = ( 0.4416667 0.1166667 0.5000000), wk = 0.0038168 k( 165) = ( 0.4333333 0.1333333 0.5000000), wk = 0.0038168 k( 166) = ( 0.4250000 0.1500000 0.5000000), wk = 0.0038168 k( 167) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0038168 k( 168) = ( 0.4083333 0.1833333 0.5000000), wk = 0.0038168 k( 169) = ( 0.4000000 0.2000000 0.5000000), wk = 0.0038168 k( 170) = ( 0.3916667 0.2166667 0.5000000), wk = 0.0038168 k( 171) = ( 0.3833333 0.2333333 0.5000000), wk = 0.0038168 k( 172) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0038168 k( 173) = ( 0.3666667 0.2666667 0.5000000), wk = 0.0038168 k( 174) = ( 0.3583333 0.2833333 0.5000000), wk = 0.0038168 k( 175) = ( 0.3500000 0.3000000 0.5000000), wk = 0.0038168 k( 176) = ( 0.3416667 0.3166667 0.5000000), wk = 0.0038168 k( 177) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038168 k( 178) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038168 k( 179) = ( 0.3250000 0.3250000 0.5000000), wk = 0.0038168 k( 180) = ( 0.3166667 0.3166667 0.5000000), wk = 0.0038168 k( 181) = ( 0.3083333 0.3083333 0.5000000), wk = 0.0038168 k( 182) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0038168 k( 183) = ( 0.2916667 0.2916667 0.5000000), wk = 0.0038168 k( 184) = ( 0.2833333 0.2833333 0.5000000), wk = 0.0038168 k( 185) = ( 0.2750000 0.2750000 0.5000000), wk = 0.0038168 k( 186) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0038168 k( 187) = ( 0.2583333 0.2583333 0.5000000), wk = 0.0038168 k( 188) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0038168 k( 189) = ( 0.2416667 0.2416667 0.5000000), wk = 0.0038168 k( 190) = ( 0.2333333 0.2333333 0.5000000), wk = 0.0038168 k( 191) = ( 0.2250000 0.2250000 0.5000000), wk = 0.0038168 k( 192) = ( 0.2166667 0.2166667 0.5000000), wk = 0.0038168 k( 193) = ( 0.2083333 0.2083333 0.5000000), wk = 0.0038168 k( 194) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0038168 k( 195) = ( 0.1916667 0.1916667 0.5000000), wk = 0.0038168 k( 196) = ( 0.1833333 0.1833333 0.5000000), wk = 0.0038168 k( 197) = ( 0.1750000 0.1750000 0.5000000), wk = 0.0038168 k( 198) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0038168 k( 199) = ( 0.1583333 0.1583333 0.5000000), wk = 0.0038168 k( 200) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0038168 k( 201) = ( 0.1416667 0.1416667 0.5000000), wk = 0.0038168 k( 202) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0038168 k( 203) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0038168 k( 204) = ( 0.1166667 0.1166667 0.5000000), wk = 0.0038168 k( 205) = ( 0.1083333 0.1083333 0.5000000), wk = 0.0038168 k( 206) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0038168 k( 207) = ( 0.0916667 0.0916667 0.5000000), wk = 0.0038168 k( 208) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0038168 k( 209) = ( 0.0750000 0.0750000 0.5000000), wk = 0.0038168 k( 210) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0038168 k( 211) = ( 0.0583333 0.0583333 0.5000000), wk = 0.0038168 k( 212) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0038168 k( 213) = ( 0.0416667 0.0416667 0.5000000), wk = 0.0038168 k( 214) = ( 0.0333333 0.0333333 0.5000000), wk = 0.0038168 k( 215) = ( 0.0250000 0.0250000 0.5000000), wk = 0.0038168 k( 216) = ( 0.0166667 0.0166667 0.5000000), wk = 0.0038168 k( 217) = ( 0.0083333 0.0083333 0.5000000), wk = 0.0038168 k( 218) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0038168 k( 219) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0038168 k( 220) = ( 0.5000000 -0.0000000 0.4761905), wk = 0.0038168 k( 221) = ( 0.5000000 -0.0000000 0.4523810), wk = 0.0038168 k( 222) = ( 0.5000000 -0.0000000 0.4285714), wk = 0.0038168 k( 223) = ( 0.5000000 -0.0000000 0.4047619), wk = 0.0038168 k( 224) = ( 0.5000000 -0.0000000 0.3809524), wk = 0.0038168 k( 225) = ( 0.5000000 -0.0000000 0.3571429), wk = 0.0038168 k( 226) = ( 0.5000000 -0.0000000 0.3333333), wk = 0.0038168 k( 227) = ( 0.5000000 -0.0000000 0.3095238), wk = 0.0038168 k( 228) = ( 0.5000000 -0.0000000 0.2857143), wk = 0.0038168 k( 229) = ( 0.5000000 -0.0000000 0.2619048), wk = 0.0038168 k( 230) = ( 0.5000000 -0.0000000 0.2380952), wk = 0.0038168 k( 231) = ( 0.5000000 -0.0000000 0.2142857), wk = 0.0038168 k( 232) = ( 0.5000000 -0.0000000 0.1904762), wk = 0.0038168 k( 233) = ( 0.5000000 -0.0000000 0.1666667), wk = 0.0038168 k( 234) = ( 0.5000000 -0.0000000 0.1428571), wk = 0.0038168 k( 235) = ( 0.5000000 -0.0000000 0.1190476), wk = 0.0038168 k( 236) = ( 0.5000000 -0.0000000 0.0952381), wk = 0.0038168 k( 237) = ( 0.5000000 -0.0000000 0.0714286), wk = 0.0038168 k( 238) = ( 0.5000000 -0.0000000 0.0476191), wk = 0.0038168 k( 239) = ( 0.5000000 -0.0000000 0.0238095), wk = 0.0038168 k( 240) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0038168 k( 241) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0038168 k( 242) = ( 0.3333333 0.3333333 0.0238095), wk = 0.0038168 k( 243) = ( 0.3333333 0.3333333 0.0476191), wk = 0.0038168 k( 244) = ( 0.3333333 0.3333333 0.0714286), wk = 0.0038168 k( 245) = ( 0.3333333 0.3333333 0.0952381), wk = 0.0038168 k( 246) = ( 0.3333333 0.3333333 0.1190476), wk = 0.0038168 k( 247) = ( 0.3333333 0.3333333 0.1428571), wk = 0.0038168 k( 248) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0038168 k( 249) = ( 0.3333333 0.3333333 0.1904762), wk = 0.0038168 k( 250) = ( 0.3333333 0.3333333 0.2142857), wk = 0.0038168 k( 251) = ( 0.3333333 0.3333333 0.2380952), wk = 0.0038168 k( 252) = ( 0.3333333 0.3333333 0.2619048), wk = 0.0038168 k( 253) = ( 0.3333333 0.3333333 0.2857143), wk = 0.0038168 k( 254) = ( 0.3333333 0.3333333 0.3095238), wk = 0.0038168 k( 255) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0038168 k( 256) = ( 0.3333333 0.3333333 0.3571429), wk = 0.0038168 k( 257) = ( 0.3333333 0.3333333 0.3809524), wk = 0.0038168 k( 258) = ( 0.3333333 0.3333333 0.4047619), wk = 0.0038168 k( 259) = ( 0.3333333 0.3333333 0.4285714), wk = 0.0038168 k( 260) = ( 0.3333333 0.3333333 0.4523810), wk = 0.0038168 k( 261) = ( 0.3333333 0.3333333 0.4761905), wk = 0.0038168 k( 262) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0038168 Dense grid: 125929 G-vectors FFT dimensions: ( 60, 60, 90) Smooth grid: 55553 G-vectors FFT dimensions: ( 45, 45, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.52 Mb ( 394, 86) NL pseudopotentials 0.85 Mb ( 197, 283) Each V/rho on FFT grid 0.16 Mb ( 10800) Each G-vector array 0.03 Mb ( 3496) G-vector shells 0.01 Mb ( 1656) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.07 Mb ( 394, 344) Each subspace H/S matrix 0.11 Mb ( 86, 86) Each matrix 0.74 Mb ( 283, 2, 86) Check: negative/imaginary core charge= -0.000003 0.000000 The potential is recalculated from file : ./BaAl2xSiO4x2.save/charge-density.dat Starting wfc are 106 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.1 secs Computing kpt #: 2 total cpu time spent up to now is 9.1 secs Computing kpt #: 3 total cpu time spent up to now is 12.0 secs Computing kpt #: 4 total cpu time spent up to now is 15.1 secs Computing kpt #: 5 total cpu time spent up to now is 17.9 secs Computing kpt #: 6 total cpu time spent up to now is 21.2 secs Computing kpt #: 7 total cpu time spent up to now is 24.2 secs Computing kpt #: 8 total cpu time spent up to now is 27.0 secs Computing kpt #: 9 total cpu time spent up to now is 29.1 secs Computing kpt #: 10 total cpu time spent up to now is 31.2 secs Computing kpt #: 11 total cpu time spent up to now is 33.5 secs Computing kpt #: 12 total cpu time spent up to now is 35.5 secs Computing kpt #: 13 total cpu time spent up to now is 37.6 secs Computing kpt #: 14 total cpu time spent up to now is 39.5 secs Computing kpt #: 15 total cpu time spent up to now is 41.4 secs Computing kpt #: 16 total cpu time spent up to now is 43.3 secs Computing kpt #: 17 total cpu time spent up to now is 45.2 secs Computing kpt #: 18 total cpu time spent up to now is 47.1 secs Computing kpt #: 19 total cpu time spent up to now is 49.1 secs Computing kpt #: 20 total cpu time spent up to now is 51.0 secs Computing kpt #: 21 total cpu time spent up to now is 53.0 secs Computing kpt #: 22 total cpu time spent up to now is 55.0 secs Computing kpt #: 23 total cpu time spent up to now is 57.0 secs Computing kpt #: 24 total cpu time spent up to now is 59.0 secs Computing kpt #: 25 total cpu time spent up to now is 60.9 secs Computing kpt #: 26 total cpu time spent up to now is 62.8 secs Computing kpt #: 27 total cpu time spent up to now is 64.8 secs Computing kpt #: 28 total cpu time spent up to now is 66.7 secs Computing kpt #: 29 total cpu time spent up to now is 68.7 secs Computing kpt #: 30 total cpu time spent up to now is 70.6 secs Computing kpt #: 31 total cpu time spent up to now is 72.6 secs Computing kpt #: 32 total cpu time spent up to now is 74.6 secs Computing kpt #: 33 total cpu time spent up to now is 76.5 secs Computing kpt #: 34 total cpu time spent up to now is 78.4 secs Computing kpt #: 35 total cpu time spent up to now is 80.3 secs Computing kpt #: 36 total cpu time spent up to now is 82.2 secs Computing kpt #: 37 total cpu time spent up to now is 84.1 secs Computing kpt #: 38 total cpu time spent up to now is 86.1 secs Computing kpt #: 39 total cpu time spent up to now is 88.1 secs Computing kpt #: 40 total cpu time spent up to now is 90.1 secs Computing kpt #: 41 total cpu time spent up to now is 92.1 secs Computing kpt #: 42 total cpu time spent up to now is 94.4 secs Computing kpt #: 43 total cpu time spent up to now is 96.8 secs Computing kpt #: 44 total cpu time spent up to now is 99.3 secs Computing kpt #: 45 total cpu time spent up to now is 102.1 secs Computing kpt #: 46 total cpu time spent up to now is 105.0 secs Computing kpt #: 47 total cpu time spent up to now is 108.2 secs Computing kpt #: 48 total cpu time spent up to now is 111.6 secs Computing kpt #: 49 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 115.1 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 118.5 secs Computing kpt #: 51 total cpu time spent up to now is 121.8 secs Computing kpt #: 52 total cpu time spent up to now is 125.0 secs Computing kpt #: 53 total cpu time spent up to now is 128.2 secs Computing kpt #: 54 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 131.6 secs Computing kpt #: 55 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 135.1 secs Computing kpt #: 56 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 138.4 secs Computing kpt #: 57 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 141.9 secs Computing kpt #: 58 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 145.3 secs Computing kpt #: 59 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 148.7 secs Computing kpt #: 60 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 152.2 secs Computing kpt #: 61 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 155.6 secs Computing kpt #: 62 total cpu time spent up to now is 158.8 secs Computing kpt #: 63 total cpu time spent up to now is 162.0 secs Computing kpt #: 64 total cpu time spent up to now is 165.1 secs Computing kpt #: 65 total cpu time spent up to now is 168.3 secs Computing kpt #: 66 total cpu time spent up to now is 171.5 secs Computing kpt #: 67 total cpu time spent up to now is 174.7 secs Computing kpt #: 68 total cpu time spent up to now is 177.9 secs Computing kpt #: 69 total cpu time spent up to now is 181.1 secs Computing kpt #: 70 total cpu time spent up to now is 184.4 secs Computing kpt #: 71 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 187.8 secs Computing kpt #: 72 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 191.3 secs Computing kpt #: 73 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 194.8 secs Computing kpt #: 74 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 198.3 secs Computing kpt #: 75 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 201.7 secs Computing kpt #: 76 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 205.2 secs Computing kpt #: 77 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 208.8 secs Computing kpt #: 78 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 212.3 secs Computing kpt #: 79 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 215.8 secs Computing kpt #: 80 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 219.3 secs Computing kpt #: 81 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 222.8 secs Computing kpt #: 82 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 226.4 secs Computing kpt #: 83 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 229.9 secs Computing kpt #: 84 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 233.5 secs Computing kpt #: 85 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 237.1 secs Computing kpt #: 86 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 240.6 secs Computing kpt #: 87 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 244.2 secs Computing kpt #: 88 total cpu time spent up to now is 247.5 secs Computing kpt #: 89 total cpu time spent up to now is 250.7 secs Computing kpt #: 90 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 254.3 secs Computing kpt #: 91 total cpu time spent up to now is 256.5 secs Computing kpt #: 92 total cpu time spent up to now is 259.5 secs Computing kpt #: 93 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 263.1 secs Computing kpt #: 94 total cpu time spent up to now is 265.9 secs Computing kpt #: 95 total cpu time spent up to now is 269.0 secs Computing kpt #: 96 total cpu time spent up to now is 272.0 secs Computing kpt #: 97 total cpu time spent up to now is 275.0 secs Computing kpt #: 98 total cpu time spent up to now is 278.0 secs Computing kpt #: 99 total cpu time spent up to now is 281.0 secs Computing kpt #: 100 total cpu time spent up to now is 283.9 secs Computing kpt #: 101 total cpu time spent up to now is 287.1 secs Computing kpt #: 102 total cpu time spent up to now is 289.9 secs Computing kpt #: 103 total cpu time spent up to now is 292.7 secs Computing kpt #: 104 total cpu time spent up to now is 295.6 secs Computing kpt #: 105 total cpu time spent up to now is 298.4 secs Computing kpt #: 106 total cpu time spent up to now is 300.8 secs Computing kpt #: 107 total cpu time spent up to now is 303.7 secs Computing kpt #: 108 total cpu time spent up to now is 306.3 secs Computing kpt #: 109 total cpu time spent up to now is 308.7 secs Computing kpt #: 110 total cpu time spent up to now is 311.3 secs Computing kpt #: 111 total cpu time spent up to now is 313.7 secs Computing kpt #: 112 total cpu time spent up to now is 316.2 secs Computing kpt #: 113 total cpu time spent up to now is 318.8 secs Computing kpt #: 114 total cpu time spent up to now is 321.7 secs Computing kpt #: 115 total cpu time spent up to now is 324.8 secs Computing kpt #: 116 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 328.5 secs Computing kpt #: 117 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 332.2 secs Computing kpt #: 118 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 335.9 secs Computing kpt #: 119 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 339.7 secs Computing kpt #: 120 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 343.4 secs Computing kpt #: 121 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 347.3 secs Computing kpt #: 122 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 351.2 secs Computing kpt #: 123 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 355.0 secs Computing kpt #: 124 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 358.9 secs Computing kpt #: 125 total cpu time spent up to now is 362.0 secs Computing kpt #: 126 total cpu time spent up to now is 365.0 secs Computing kpt #: 127 total cpu time spent up to now is 367.9 secs Computing kpt #: 128 total cpu time spent up to now is 370.3 secs Computing kpt #: 129 total cpu time spent up to now is 372.4 secs Computing kpt #: 130 total cpu time spent up to now is 374.3 secs Computing kpt #: 131 total cpu time spent up to now is 375.9 secs Computing kpt #: 132 total cpu time spent up to now is 377.6 secs Computing kpt #: 133 total cpu time spent up to now is 379.2 secs Computing kpt #: 134 total cpu time spent up to now is 381.1 secs Computing kpt #: 135 total cpu time spent up to now is 382.8 secs Computing kpt #: 136 total cpu time spent up to now is 384.5 secs Computing kpt #: 137 total cpu time spent up to now is 386.2 secs Computing kpt #: 138 total cpu time spent up to now is 388.1 secs Computing kpt #: 139 total cpu time spent up to now is 389.8 secs Computing kpt #: 140 total cpu time spent up to now is 391.4 secs Computing kpt #: 141 total cpu time spent up to now is 393.0 secs Computing kpt #: 142 total cpu time spent up to now is 394.7 secs Computing kpt #: 143 total cpu time spent up to now is 396.4 secs Computing kpt #: 144 total cpu time spent up to now is 398.1 secs Computing kpt #: 145 total cpu time spent up to now is 399.9 secs Computing kpt #: 146 total cpu time spent up to now is 401.5 secs Computing kpt #: 147 total cpu time spent up to now is 403.3 secs Computing kpt #: 148 total cpu time spent up to now is 405.1 secs Computing kpt #: 149 total cpu time spent up to now is 406.9 secs Computing kpt #: 150 total cpu time spent up to now is 408.7 secs Computing kpt #: 151 total cpu time spent up to now is 410.5 secs Computing kpt #: 152 total cpu time spent up to now is 412.3 secs Computing kpt #: 153 total cpu time spent up to now is 413.9 secs Computing kpt #: 154 total cpu time spent up to now is 415.5 secs Computing kpt #: 155 total cpu time spent up to now is 417.1 secs Computing kpt #: 156 total cpu time spent up to now is 418.7 secs Computing kpt #: 157 total cpu time spent up to now is 420.3 secs Computing kpt #: 158 total cpu time spent up to now is 422.2 secs Computing kpt #: 159 total cpu time spent up to now is 423.8 secs Computing kpt #: 160 total cpu time spent up to now is 425.7 secs Computing kpt #: 161 total cpu time spent up to now is 427.5 secs Computing kpt #: 162 total cpu time spent up to now is 429.1 secs Computing kpt #: 163 total cpu time spent up to now is 430.7 secs Computing kpt #: 164 total cpu time spent up to now is 432.1 secs Computing kpt #: 165 total cpu time spent up to now is 433.8 secs Computing kpt #: 166 total cpu time spent up to now is 435.7 secs Computing kpt #: 167 total cpu time spent up to now is 437.6 secs Computing kpt #: 168 total cpu time spent up to now is 439.6 secs Computing kpt #: 169 total cpu time spent up to now is 441.6 secs Computing kpt #: 170 total cpu time spent up to now is 443.9 secs Computing kpt #: 171 total cpu time spent up to now is 446.2 secs Computing kpt #: 172 total cpu time spent up to now is 448.2 secs Computing kpt #: 173 total cpu time spent up to now is 450.7 secs Computing kpt #: 174 total cpu time spent up to now is 453.2 secs Computing kpt #: 175 total cpu time spent up to now is 456.0 secs Computing kpt #: 176 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 459.4 secs Computing kpt #: 177 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 462.8 secs Computing kpt #: 178 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 466.2 secs Computing kpt #: 179 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 469.6 secs Computing kpt #: 180 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 473.1 secs Computing kpt #: 181 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 476.5 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 479.9 secs Computing kpt #: 183 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 483.4 secs Computing kpt #: 184 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 486.8 secs Computing kpt #: 185 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 490.2 secs Computing kpt #: 186 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 493.7 secs Computing kpt #: 187 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 497.1 secs Computing kpt #: 188 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 500.6 secs Computing kpt #: 189 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 504.0 secs Computing kpt #: 190 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 507.5 secs Computing kpt #: 191 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 510.9 secs Computing kpt #: 192 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 514.4 secs Computing kpt #: 193 total cpu time spent up to now is 517.9 secs Computing kpt #: 194 total cpu time spent up to now is 521.3 secs Computing kpt #: 195 total cpu time spent up to now is 524.7 secs Computing kpt #: 196 total cpu time spent up to now is 527.8 secs Computing kpt #: 197 total cpu time spent up to now is 530.8 secs Computing kpt #: 198 total cpu time spent up to now is 533.7 secs Computing kpt #: 199 total cpu time spent up to now is 536.5 secs Computing kpt #: 200 total cpu time spent up to now is 539.3 secs Computing kpt #: 201 total cpu time spent up to now is 542.0 secs Computing kpt #: 202 total cpu time spent up to now is 544.6 secs Computing kpt #: 203 total cpu time spent up to now is 547.2 secs Computing kpt #: 204 total cpu time spent up to now is 549.6 secs Computing kpt #: 205 total cpu time spent up to now is 552.0 secs Computing kpt #: 206 total cpu time spent up to now is 554.3 secs Computing kpt #: 207 total cpu time spent up to now is 556.4 secs Computing kpt #: 208 total cpu time spent up to now is 558.7 secs Computing kpt #: 209 total cpu time spent up to now is 561.1 secs Computing kpt #: 210 total cpu time spent up to now is 563.4 secs Computing kpt #: 211 total cpu time spent up to now is 566.0 secs Computing kpt #: 212 total cpu time spent up to now is 568.8 secs Computing kpt #: 213 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 572.4 secs Computing kpt #: 214 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 576.0 secs Computing kpt #: 215 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 579.8 secs Computing kpt #: 216 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 583.7 secs Computing kpt #: 217 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 587.5 secs Computing kpt #: 218 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 591.9 secs Computing kpt #: 219 total cpu time spent up to now is 593.5 secs Computing kpt #: 220 total cpu time spent up to now is 595.3 secs Computing kpt #: 221 total cpu time spent up to now is 597.1 secs Computing kpt #: 222 total cpu time spent up to now is 599.0 secs Computing kpt #: 223 total cpu time spent up to now is 600.8 secs Computing kpt #: 224 total cpu time spent up to now is 602.7 secs Computing kpt #: 225 total cpu time spent up to now is 604.5 secs Computing kpt #: 226 total cpu time spent up to now is 606.4 secs Computing kpt #: 227 total cpu time spent up to now is 608.3 secs Computing kpt #: 228 total cpu time spent up to now is 610.2 secs Computing kpt #: 229 total cpu time spent up to now is 612.1 secs Computing kpt #: 230 total cpu time spent up to now is 614.0 secs Computing kpt #: 231 total cpu time spent up to now is 615.9 secs Computing kpt #: 232 total cpu time spent up to now is 617.9 secs Computing kpt #: 233 total cpu time spent up to now is 619.8 secs Computing kpt #: 234 total cpu time spent up to now is 621.8 secs Computing kpt #: 235 total cpu time spent up to now is 623.7 secs Computing kpt #: 236 total cpu time spent up to now is 625.6 secs Computing kpt #: 237 total cpu time spent up to now is 627.6 secs Computing kpt #: 238 total cpu time spent up to now is 629.5 secs Computing kpt #: 239 total cpu time spent up to now is 631.4 secs Computing kpt #: 240 total cpu time spent up to now is 633.3 secs Computing kpt #: 241 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 636.8 secs Computing kpt #: 242 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 640.1 secs Computing kpt #: 243 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 643.5 secs Computing kpt #: 244 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 647.0 secs Computing kpt #: 245 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 650.9 secs Computing kpt #: 246 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 654.3 secs Computing kpt #: 247 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 657.8 secs Computing kpt #: 248 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 661.2 secs Computing kpt #: 249 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 664.6 secs Computing kpt #: 250 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 667.9 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 671.3 secs Computing kpt #: 252 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 674.7 secs Computing kpt #: 253 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 678.1 secs Computing kpt #: 254 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 681.5 secs Computing kpt #: 255 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 685.0 secs Computing kpt #: 256 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 688.4 secs Computing kpt #: 257 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 691.8 secs Computing kpt #: 258 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 695.2 secs Computing kpt #: 259 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 698.7 secs Computing kpt #: 260 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 702.8 secs Computing kpt #: 261 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 706.3 secs Computing kpt #: 262 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 709.6 secs ethr = 1.39E-08, avg # of iterations = 81.6 total cpu time spent up to now is 709.6 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6921 PWs) bands (ev): -18.4890 -18.4890 -15.2173 -15.2173 -14.8628 -14.8628 -12.6021 -12.6021 -11.7439 -11.7439 -11.7436 -11.7436 -11.6540 -11.6540 -10.7510 -10.7510 -10.7141 -10.7141 -5.2005 -5.2005 -3.8907 -3.8907 -3.6876 -3.6876 -3.4646 -3.4646 -3.3311 -3.3311 -0.8311 -0.8311 -0.5216 -0.5216 -0.3525 -0.3525 -0.3352 -0.3352 0.8024 0.8024 0.8758 0.8758 0.9080 0.9080 1.4928 1.4928 1.4931 1.4931 2.4909 2.4909 2.4947 2.4947 2.5142 2.5142 2.8292 2.8292 3.0721 3.0721 4.3782 4.3782 4.4628 4.4628 4.4786 4.4786 4.6132 4.6132 4.6309 4.6309 5.3592 5.3592 5.4410 5.4410 5.4663 5.4663 5.9128 5.9128 8.8733 8.8733 9.1456 9.1456 9.2831 9.2831 9.3087 9.3087 10.2174 10.2174 10.2221 10.2221 k = 0.0143 0.0082-0.0000 ( 6919 PWs) bands (ev): -18.4889 -18.4889 -15.2171 -15.2171 -14.8630 -14.8630 -12.6024 -12.6024 -11.7448 -11.7448 -11.7440 -11.7440 -11.6533 -11.6533 -10.7508 -10.7508 -10.7139 -10.7139 -5.2002 -5.2002 -3.8904 -3.8904 -3.6874 -3.6874 -3.4643 -3.4643 -3.3310 -3.3310 -0.8299 -0.8299 -0.5211 -0.5211 -0.3527 -0.3527 -0.3354 -0.3354 0.8026 0.8026 0.8765 0.8765 0.9084 0.9084 1.4928 1.4928 1.4935 1.4935 2.4908 2.4908 2.4948 2.4948 2.5135 2.5135 2.8279 2.8279 3.0699 3.0699 4.3754 4.3754 4.4609 4.4609 4.4812 4.4812 4.6135 4.6135 4.6307 4.6307 5.3587 5.3587 5.4403 5.4403 5.4647 5.4647 5.9166 5.9166 8.8718 8.8718 9.1451 9.1451 9.2811 9.2811 9.3066 9.3066 10.2184 10.2184 10.2235 10.2235 k = 0.0286 0.0165-0.0000 ( 6923 PWs) bands (ev): -18.4886 -18.4886 -15.2167 -15.2167 -14.8635 -14.8635 -12.6034 -12.6034 -11.7479 -11.7479 -11.7449 -11.7449 -11.6513 -11.6513 -10.7500 -10.7500 -10.7133 -10.7133 -5.1993 -5.1993 -3.8898 -3.8898 -3.6868 -3.6868 -3.4632 -3.4632 -3.3306 -3.3306 -0.8263 -0.8263 -0.5195 -0.5195 -0.3532 -0.3532 -0.3359 -0.3359 0.8034 0.8034 0.8785 0.8785 0.9097 0.9097 1.4927 1.4927 1.4949 1.4949 2.4900 2.4900 2.4953 2.4953 2.5116 2.5116 2.8240 2.8240 3.0637 3.0637 4.3676 4.3676 4.4545 4.4545 4.4884 4.4884 4.6142 4.6142 4.6305 4.6305 5.3570 5.3570 5.4379 5.4379 5.4606 5.4606 5.9277 5.9277 8.8672 8.8672 9.1433 9.1433 9.2746 9.2746 9.3009 9.3009 10.2197 10.2197 10.2287 10.2287 k = 0.0429 0.0247-0.0000 ( 6923 PWs) bands (ev): -18.4881 -18.4881 -15.2159 -15.2159 -14.8643 -14.8643 -12.6049 -12.6049 -11.7529 -11.7529 -11.7464 -11.7464 -11.6481 -11.6481 -10.7491 -10.7491 -10.7119 -10.7119 -5.1978 -5.1978 -3.8887 -3.8887 -3.6859 -3.6859 -3.4614 -3.4614 -3.3300 -3.3300 -0.8204 -0.8204 -0.5169 -0.5169 -0.3542 -0.3542 -0.3366 -0.3366 0.8046 0.8046 0.8818 0.8818 0.9120 0.9120 1.4923 1.4923 1.4973 1.4973 2.4872 2.4872 2.4960 2.4960 2.5100 2.5100 2.8172 2.8172 3.0541 3.0541 4.3556 4.3556 4.4438 4.4438 4.4983 4.4983 4.6151 4.6151 4.6314 4.6314 5.3537 5.3537 5.4324 5.4324 5.4565 5.4565 5.9455 5.9455 8.8596 8.8596 9.1405 9.1405 9.2629 9.2629 9.2928 9.2928 10.2206 10.2206 10.2373 10.2373 k = 0.0571 0.0330-0.0000 ( 6915 PWs) bands (ev): -18.4873 -18.4873 -15.2149 -15.2149 -14.8654 -14.8654 -12.6070 -12.6070 -11.7597 -11.7597 -11.7484 -11.7484 -11.6439 -11.6439 -10.7484 -10.7484 -10.7095 -10.7095 -5.1957 -5.1957 -3.8871 -3.8871 -3.6847 -3.6847 -3.4589 -3.4589 -3.3291 -3.3291 -0.8121 -0.8121 -0.5133 -0.5133 -0.3559 -0.3559 -0.3374 -0.3374 0.8061 0.8061 0.8861 0.8861 0.9156 0.9156 1.4917 1.4917 1.5006 1.5006 2.4807 2.4807 2.4960 2.4960 2.5112 2.5112 2.8073 2.8073 3.0424 3.0424 4.3396 4.3396 4.4297 4.4297 4.5079 4.5079 4.6147 4.6147 4.6364 4.6364 5.3481 5.3481 5.4235 5.4235 5.4542 5.4542 5.9689 5.9689 8.8491 8.8491 9.1364 9.1364 9.2453 9.2453 9.2836 9.2836 10.2213 10.2213 10.2466 10.2466 k = 0.0714 0.0412-0.0000 ( 6911 PWs) bands (ev): -18.4864 -18.4864 -15.2135 -15.2135 -14.8668 -14.8668 -12.6097 -12.6097 -11.7681 -11.7681 -11.7510 -11.7510 -11.6386 -11.6386 -10.7483 -10.7483 -10.7057 -10.7057 -5.1930 -5.1930 -3.8852 -3.8852 -3.6833 -3.6833 -3.4556 -3.4556 -3.3279 -3.3279 -0.8016 -0.8016 -0.5087 -0.5087 -0.3583 -0.3583 -0.3379 -0.3379 0.8076 0.8076 0.8911 0.8911 0.9211 0.9211 1.4908 1.4908 1.5047 1.5047 2.4698 2.4698 2.4950 2.4950 2.5155 2.5155 2.7941 2.7941 3.0301 3.0301 4.3191 4.3191 4.4133 4.4133 4.5145 4.5145 4.6122 4.6122 4.6480 4.6480 5.3394 5.3394 5.4130 5.4130 5.4535 5.4535 5.9970 5.9970 8.8357 8.8357 9.1311 9.1311 9.2223 9.2223 9.2737 9.2737 10.2216 10.2216 10.2538 10.2538 k = 0.0857 0.0495-0.0000 ( 6903 PWs) bands (ev): -18.4852 -18.4852 -15.2119 -15.2119 -14.8686 -14.8686 -12.6129 -12.6129 -11.7779 -11.7779 -11.7540 -11.7540 -11.6324 -11.6324 -10.7491 -10.7491 -10.7003 -10.7003 -5.1898 -5.1898 -3.8828 -3.8828 -3.6816 -3.6816 -3.4516 -3.4516 -3.3263 -3.3263 -0.7887 -0.7887 -0.5031 -0.5031 -0.3615 -0.3615 -0.3382 -0.3382 0.8089 0.8089 0.8964 0.8964 0.9290 0.9290 1.4895 1.4895 1.5094 1.5094 2.4548 2.4548 2.4931 2.4931 2.5224 2.5224 2.7775 2.7775 3.0188 3.0188 4.2934 4.2934 4.3956 4.3956 4.5164 4.5164 4.6080 4.6080 4.6665 4.6665 5.3275 5.3275 5.4026 5.4026 5.4539 5.4539 6.0288 6.0288 8.8197 8.8197 9.1244 9.1244 9.1946 9.1946 9.2633 9.2633 10.2216 10.2216 10.2566 10.2566 k = 0.1000 0.0577-0.0000 ( 6913 PWs) bands (ev): -18.4839 -18.4839 -15.2099 -15.2099 -14.8706 -14.8706 -12.6167 -12.6167 -11.7888 -11.7888 -11.7576 -11.7576 -11.6253 -11.6253 -10.7510 -10.7510 -10.6935 -10.6935 -5.1861 -5.1861 -3.8801 -3.8801 -3.6799 -3.6799 -3.4468 -3.4468 -3.3243 -3.3243 -0.7737 -0.7737 -0.4966 -0.4966 -0.3656 -0.3656 -0.3380 -0.3380 0.8100 0.8100 0.9016 0.9016 0.9394 0.9394 1.4876 1.4876 1.5147 1.5147 2.4361 2.4361 2.4897 2.4897 2.5312 2.5312 2.7582 2.7582 3.0097 3.0097 4.2619 4.2619 4.3777 4.3777 4.5136 4.5136 4.6029 4.6029 4.6910 4.6910 5.3124 5.3124 5.3928 5.3928 5.4547 5.4547 6.0637 6.0637 8.8011 8.8011 9.1161 9.1161 9.1631 9.1631 9.2528 9.2528 10.2209 10.2209 10.2542 10.2542 k = 0.1143 0.0660-0.0000 ( 6931 PWs) bands (ev): -18.4824 -18.4824 -15.2077 -15.2077 -14.8730 -14.8730 -12.6210 -12.6210 -11.8009 -11.8009 -11.7616 -11.7616 -11.6174 -11.6174 -10.7539 -10.7539 -10.6852 -10.6852 -5.1820 -5.1820 -3.8770 -3.8770 -3.6781 -3.6781 -3.4412 -3.4412 -3.3218 -3.3218 -0.7565 -0.7565 -0.4893 -0.4893 -0.3705 -0.3705 -0.3373 -0.3373 0.8107 0.8107 0.9067 0.9067 0.9524 0.9524 1.4851 1.4851 1.5205 1.5205 2.4139 2.4139 2.4838 2.4838 2.5420 2.5420 2.7374 2.7374 3.0036 3.0036 4.2242 4.2242 4.3599 4.3599 4.5066 4.5066 4.5970 4.5970 4.7199 4.7199 5.2952 5.2952 5.3834 5.3834 5.4557 5.4557 6.1012 6.1012 8.7801 8.7801 9.1054 9.1054 9.1292 9.1292 9.2423 9.2423 10.2194 10.2194 10.2473 10.2473 k = 0.1286 0.0742-0.0000 ( 6931 PWs) bands (ev): -18.4807 -18.4807 -15.2052 -15.2052 -14.8756 -14.8756 -12.6258 -12.6258 -11.8138 -11.8138 -11.7659 -11.7659 -11.6086 -11.6086 -10.7578 -10.7578 -10.6759 -10.6759 -5.1775 -5.1775 -3.8736 -3.8736 -3.6764 -3.6764 -3.4347 -3.4347 -3.3188 -3.3188 -0.7373 -0.7373 -0.4812 -0.4812 -0.3760 -0.3760 -0.3362 -0.3362 0.8110 0.8110 0.9118 0.9118 0.9678 0.9678 1.4817 1.4817 1.5266 1.5266 2.3884 2.3884 2.4736 2.4736 2.5547 2.5547 2.7177 2.7177 3.0008 3.0008 4.1808 4.1808 4.3422 4.3422 4.4963 4.4963 4.5907 4.5907 4.7519 4.7519 5.2769 5.2769 5.3739 5.3739 5.4566 5.4566 6.1409 6.1409 8.7567 8.7567 9.0849 9.0849 9.1011 9.1011 9.2322 9.2322 10.2169 10.2169 10.2371 10.2371 k = 0.1429 0.0825-0.0000 ( 6933 PWs) bands (ev): -18.4788 -18.4788 -15.2024 -15.2024 -14.8785 -14.8785 -12.6310 -12.6310 -11.8275 -11.8275 -11.7707 -11.7707 -11.5991 -11.5991 -10.7626 -10.7626 -10.6656 -10.6656 -5.1726 -5.1726 -3.8698 -3.8698 -3.6749 -3.6749 -3.4275 -3.4275 -3.3152 -3.3152 -0.7162 -0.7162 -0.4723 -0.4723 -0.3821 -0.3821 -0.3344 -0.3344 0.8109 0.8109 0.9170 0.9170 0.9854 0.9854 1.4776 1.4776 1.5328 1.5328 2.3599 2.3599 2.4575 2.4575 2.5692 2.5692 2.7018 2.7018 3.0011 3.0011 4.1319 4.1319 4.3245 4.3245 4.4832 4.4832 4.5840 4.5840 4.7858 4.7858 5.2582 5.2582 5.3638 5.3638 5.4573 5.4573 6.1825 6.1825 8.7312 8.7312 9.0481 9.0481 9.0856 9.0856 9.2228 9.2228 10.2128 10.2128 10.2249 10.2249 k = 0.1571 0.0907-0.0000 ( 6937 PWs) bands (ev): -18.4769 -18.4769 -15.1994 -15.1994 -14.8818 -14.8818 -12.6367 -12.6367 -11.8418 -11.8418 -11.7757 -11.7757 -11.5888 -11.5888 -10.7681 -10.7681 -10.6546 -10.6546 -5.1674 -5.1674 -3.8658 -3.8658 -3.6736 -3.6736 -3.4195 -3.4195 -3.3108 -3.3108 -0.6933 -0.6933 -0.4629 -0.4629 -0.3886 -0.3886 -0.3321 -0.3321 0.8104 0.8104 0.9222 0.9222 1.0048 1.0048 1.4724 1.4724 1.5391 1.5391 2.3288 2.3288 2.4340 2.4340 2.5854 2.5854 2.6923 2.6923 3.0042 3.0042 4.0782 4.0782 4.3066 4.3066 4.4676 4.4676 4.5771 4.5771 4.8208 4.8208 5.2395 5.2395 5.3527 5.3527 5.4574 5.4574 6.2257 6.2257 8.7036 8.7036 9.0077 9.0077 9.0708 9.0708 9.2144 9.2144 10.2041 10.2041 10.2144 10.2144 k = 0.1714 0.0990-0.0000 ( 6949 PWs) bands (ev): -18.4748 -18.4748 -15.1961 -15.1961 -14.8852 -14.8852 -12.6427 -12.6427 -11.8565 -11.8565 -11.7810 -11.7810 -11.5777 -11.5777 -10.7745 -10.7745 -10.6431 -10.6431 -5.1620 -5.1620 -3.8615 -3.8615 -3.6727 -3.6727 -3.4108 -3.4108 -3.3056 -3.3056 -0.6690 -0.6690 -0.4528 -0.4528 -0.3955 -0.3955 -0.3289 -0.3289 0.8095 0.8095 0.9274 0.9274 1.0259 1.0259 1.4662 1.4662 1.5453 1.5453 2.2953 2.2953 2.4032 2.4032 2.6032 2.6032 2.6904 2.6904 3.0095 3.0095 4.0203 4.0203 4.2883 4.2883 4.4499 4.4499 4.5701 4.5701 4.8563 4.8563 5.2214 5.2214 5.3405 5.3405 5.4569 5.4569 6.2703 6.2703 8.6739 8.6739 8.9662 8.9662 9.0548 9.0548 9.2070 9.2070 10.1889 10.1889 10.2080 10.2080 k = 0.1857 0.1072-0.0000 ( 6955 PWs) bands (ev): -18.4725 -18.4725 -15.1925 -15.1925 -14.8890 -14.8890 -12.6490 -12.6490 -11.8715 -11.8715 -11.7865 -11.7865 -11.5659 -11.5659 -10.7817 -10.7817 -10.6311 -10.6311 -5.1564 -5.1564 -3.8569 -3.8569 -3.6722 -3.6722 -3.4016 -3.4016 -3.2995 -3.2995 -0.6436 -0.6436 -0.4422 -0.4422 -0.4027 -0.4027 -0.3248 -0.3248 0.8084 0.8084 0.9325 0.9325 1.0484 1.0484 1.4589 1.4589 1.5513 1.5513 2.2599 2.2599 2.3663 2.3663 2.6222 2.6222 2.6962 2.6962 3.0167 3.0167 3.9589 3.9589 4.2695 4.2695 4.4301 4.4301 4.5630 4.5630 4.8916 4.8916 5.2041 5.2041 5.3270 5.3270 5.4557 5.4557 6.3162 6.3162 8.6421 8.6421 8.9243 8.9243 9.0377 9.0377 9.2007 9.2007 10.1712 10.1712 10.2022 10.2022 k = 0.2000 0.1155-0.0000 ( 6959 PWs) bands (ev): -18.4703 -18.4703 -15.1888 -15.1888 -14.8929 -14.8929 -12.6556 -12.6556 -11.8867 -11.8867 -11.7922 -11.7922 -11.5533 -11.5533 -10.7896 -10.7896 -10.6189 -10.6189 -5.1507 -5.1507 -3.8521 -3.8521 -3.6721 -3.6721 -3.3922 -3.3922 -3.2923 -3.2923 -0.6175 -0.6175 -0.4311 -0.4311 -0.4099 -0.4099 -0.3196 -0.3196 0.8072 0.8072 0.9374 0.9374 1.0721 1.0721 1.4506 1.4506 1.5570 1.5570 2.2230 2.2230 2.3251 2.3251 2.6422 2.6422 2.7089 2.7089 3.0250 3.0250 3.8948 3.8948 4.2502 4.2502 4.4083 4.4083 4.5558 4.5558 4.9264 4.9264 5.1876 5.1876 5.3123 5.3123 5.4537 5.4537 6.3632 6.3632 8.6084 8.6084 8.8825 8.8825 9.0196 9.0196 9.1956 9.1956 10.1526 10.1526 10.1960 10.1960 k = 0.2143 0.1237-0.0000 ( 6957 PWs) bands (ev): -18.4679 -18.4679 -15.1847 -15.1847 -14.8971 -14.8971 -12.6624 -12.6624 -11.9020 -11.9020 -11.7980 -11.7980 -11.5401 -11.5401 -10.7983 -10.7983 -10.6066 -10.6066 -5.1449 -5.1449 -3.8471 -3.8471 -3.6725 -3.6725 -3.3827 -3.3827 -3.2837 -3.2837 -0.5914 -0.5914 -0.4204 -0.4204 -0.4159 -0.4159 -0.3130 -0.3130 0.8059 0.8059 0.9419 0.9419 1.0967 1.0967 1.4413 1.4413 1.5625 1.5625 2.1850 2.1850 2.2811 2.2811 2.6631 2.6631 2.7277 2.7277 3.0339 3.0339 3.8288 3.8288 4.2302 4.2302 4.3848 4.3848 4.5486 4.5486 4.9600 4.9600 5.1723 5.1723 5.2964 5.2964 5.4510 5.4510 6.4113 6.4113 8.5727 8.5727 8.8415 8.8415 9.0006 9.0006 9.1914 9.1914 10.1334 10.1334 10.1893 10.1893 k = 0.2286 0.1320-0.0000 ( 6963 PWs) bands (ev): -18.4655 -18.4655 -15.1805 -15.1805 -14.9016 -14.9016 -12.6694 -12.6694 -11.9171 -11.9171 -11.8039 -11.8039 -11.5262 -11.5262 -10.8077 -10.8077 -10.5943 -10.5943 -5.1391 -5.1391 -3.8419 -3.8419 -3.6733 -3.6733 -3.3734 -3.3734 -3.2738 -3.2738 -0.5661 -0.5661 -0.4253 -0.4253 -0.4050 -0.4050 -0.3050 -0.3050 0.8046 0.8046 0.9459 0.9459 1.1219 1.1219 1.4312 1.4312 1.5675 1.5675 2.1463 2.1463 2.2358 2.2358 2.6848 2.6848 2.7514 2.7514 3.0427 3.0427 3.7619 3.7619 4.2095 4.2095 4.3596 4.3596 4.5412 4.5412 4.9918 4.9918 5.1583 5.1583 5.2794 5.2794 5.4475 5.4475 6.4602 6.4602 8.5350 8.5350 8.8016 8.8016 8.9812 8.9812 9.1882 9.1882 10.1142 10.1142 10.1823 10.1823 k = 0.2429 0.1402-0.0000 ( 6965 PWs) bands (ev): -18.4630 -18.4630 -15.1761 -15.1761 -14.9062 -14.9062 -12.6766 -12.6766 -11.9321 -11.9321 -11.8098 -11.8098 -11.5116 -11.5116 -10.8178 -10.8178 -10.5821 -10.5821 -5.1332 -5.1332 -3.8366 -3.8366 -3.6745 -3.6745 -3.3646 -3.3646 -3.2624 -3.2624 -0.5428 -0.5428 -0.4325 -0.4325 -0.3896 -0.3896 -0.2954 -0.2954 0.8034 0.8034 0.9492 0.9492 1.1476 1.1476 1.4203 1.4203 1.5721 1.5721 2.1073 2.1073 2.1904 2.1904 2.7077 2.7077 2.7790 2.7790 3.0505 3.0505 3.6956 3.6956 4.1882 4.1882 4.3327 4.3327 4.5337 4.5337 5.0210 5.0210 5.1463 5.1463 5.2616 5.2616 5.4434 5.4434 6.5099 6.5099 8.4953 8.4953 8.7630 8.7630 8.9615 8.9615 9.1859 9.1859 10.0950 10.0950 10.1749 10.1749 k = 0.2571 0.1485-0.0000 ( 6973 PWs) bands (ev): -18.4605 -18.4605 -15.1715 -15.1715 -14.9110 -14.9110 -12.6838 -12.6838 -11.9468 -11.9468 -11.8157 -11.8157 -11.4965 -11.4965 -10.8286 -10.8286 -10.5701 -10.5701 -5.1275 -5.1275 -3.8310 -3.8310 -3.6761 -3.6761 -3.3565 -3.3565 -3.2494 -3.2494 -0.5228 -0.5228 -0.4395 -0.4395 -0.3713 -0.3713 -0.2843 -0.2843 0.8025 0.8025 0.9516 0.9516 1.1735 1.1735 1.4089 1.4089 1.5763 1.5763 2.0683 2.0683 2.1458 2.1458 2.7318 2.7318 2.8093 2.8093 3.0562 3.0562 3.6316 3.6316 4.1662 4.1662 4.3042 4.3042 4.5258 4.5258 5.0456 5.0456 5.1374 5.1374 5.2435 5.2435 5.4388 5.4388 6.5602 6.5602 8.4539 8.4539 8.7261 8.7261 8.9417 8.9417 9.1843 9.1843 10.0761 10.0761 10.1672 10.1672 k = 0.2714 0.1567-0.0000 ( 6993 PWs) bands (ev): -18.4580 -18.4580 -15.1668 -15.1668 -14.9159 -14.9159 -12.6910 -12.6910 -11.9610 -11.9610 -11.8215 -11.8215 -11.4808 -11.4808 -10.8402 -10.8402 -10.5584 -10.5584 -5.1218 -5.1218 -3.8254 -3.8254 -3.6780 -3.6780 -3.3491 -3.3491 -3.2351 -3.2351 -0.5068 -0.5068 -0.4462 -0.4462 -0.3496 -0.3496 -0.2716 -0.2716 0.8019 0.8019 0.9531 0.9531 1.1992 1.1992 1.3973 1.3973 1.5801 1.5801 2.0295 2.0295 2.1027 2.1027 2.7571 2.7571 2.8410 2.8410 3.0587 3.0587 3.5722 3.5722 4.1436 4.1436 4.2743 4.2743 4.5174 4.5174 5.0622 5.0622 5.1342 5.1342 5.2262 5.2262 5.4337 5.4337 6.6111 6.6111 8.4109 8.4109 8.6910 8.6910 8.9221 8.9221 9.1835 9.1835 10.0578 10.0578 10.1593 10.1593 k = 0.2857 0.1650-0.0000 ( 6981 PWs) bands (ev): -18.4556 -18.4556 -15.1619 -15.1619 -14.9210 -14.9210 -12.6982 -12.6982 -11.9748 -11.9748 -11.8272 -11.8272 -11.4646 -11.4646 -10.8523 -10.8523 -10.5470 -10.5470 -5.1163 -5.1163 -3.8196 -3.8196 -3.6802 -3.6802 -3.3426 -3.3426 -3.2196 -3.2196 -0.4954 -0.4954 -0.4522 -0.4522 -0.3246 -0.3246 -0.2576 -0.2576 0.8018 0.8018 0.9536 0.9536 1.2244 1.2244 1.3859 1.3859 1.5835 1.5835 1.9912 1.9912 2.0620 2.0620 2.7833 2.7833 2.8719 2.8719 3.0574 3.0574 3.5204 3.5204 4.1202 4.1202 4.2431 4.2431 4.5084 4.5084 5.0675 5.0675 5.1374 5.1374 5.2122 5.2122 5.4283 5.4283 6.6624 6.6624 8.3664 8.3664 8.6578 8.6578 8.9029 8.9029 9.1833 9.1833 10.0401 10.0401 10.1514 10.1514 k = 0.3000 0.1732-0.0000 ( 6969 PWs) bands (ev): -18.4532 -18.4532 -15.1569 -15.1569 -14.9263 -14.9263 -12.7052 -12.7052 -11.9880 -11.9880 -11.8327 -11.8327 -11.4480 -11.4480 -10.8651 -10.8651 -10.5360 -10.5360 -5.1109 -5.1109 -3.8138 -3.8138 -3.6826 -3.6826 -3.3368 -3.3368 -3.2033 -3.2033 -0.4883 -0.4883 -0.4572 -0.4572 -0.2972 -0.2972 -0.2422 -0.2422 0.8023 0.8023 0.9529 0.9529 1.2487 1.2487 1.3750 1.3750 1.5865 1.5865 1.9536 1.9536 2.0242 2.0242 2.8098 2.8098 2.8979 2.8979 3.0539 3.0539 3.4791 3.4791 4.0962 4.0962 4.2107 4.2107 4.4986 4.4986 5.0640 5.0640 5.1396 5.1396 5.2067 5.2067 5.4227 5.4227 6.7140 6.7140 8.3208 8.3208 8.6265 8.6265 8.8843 8.8843 9.1837 9.1837 10.0233 10.0233 10.1435 10.1435 k = 0.3143 0.1815-0.0000 ( 6959 PWs) bands (ev): -18.4509 -18.4509 -15.1518 -15.1518 -14.9316 -14.9316 -12.7121 -12.7121 -12.0006 -12.0006 -11.8380 -11.8380 -11.4310 -11.4310 -10.8785 -10.8785 -10.5256 -10.5256 -5.1058 -5.1058 -3.8080 -3.8080 -3.6853 -3.6853 -3.3316 -3.3316 -3.1863 -3.1863 -0.4855 -0.4855 -0.4606 -0.4606 -0.2686 -0.2686 -0.2255 -0.2255 0.8036 0.8036 0.9510 0.9510 1.2713 1.2713 1.3655 1.3655 1.5891 1.5891 1.9169 1.9169 1.9900 1.9900 2.8341 2.8341 2.9112 2.9112 3.0561 3.0561 3.4505 3.4505 4.0715 4.0715 4.1772 4.1772 4.4879 4.4879 5.0560 5.0560 5.1329 5.1329 5.2133 5.2133 5.4172 5.4172 6.7658 6.7658 8.2742 8.2742 8.5971 8.5971 8.8664 8.8664 9.1844 9.1844 10.0073 10.0073 10.1356 10.1356 k = 0.3286 0.1897-0.0000 ( 6963 PWs) bands (ev): -18.4486 -18.4486 -15.1466 -15.1466 -14.9369 -14.9369 -12.7188 -12.7188 -12.0124 -12.0124 -11.8431 -11.8431 -11.4137 -11.4137 -10.8924 -10.8924 -10.5157 -10.5157 -5.1010 -5.1010 -3.8021 -3.8021 -3.6881 -3.6881 -3.3271 -3.3271 -3.1691 -3.1691 -0.4862 -0.4862 -0.4623 -0.4623 -0.2405 -0.2405 -0.2072 -0.2072 0.8057 0.8057 0.9479 0.9479 1.2907 1.2907 1.3588 1.3588 1.5914 1.5914 1.8814 1.8814 1.9596 1.9596 2.8464 2.8464 2.9118 2.9118 3.0734 3.0734 3.4347 3.4347 4.0461 4.0461 4.1429 4.1429 4.4761 4.4761 5.0461 5.0461 5.1198 5.1198 5.2272 5.2272 5.4120 5.4120 6.8176 6.8176 8.2270 8.2270 8.5697 8.5697 8.8494 8.8494 9.1856 9.1856 9.9922 9.9922 10.1280 10.1280 k = 0.3429 0.1979-0.0000 ( 6951 PWs) bands (ev): -18.4465 -18.4465 -15.1415 -15.1415 -14.9422 -14.9422 -12.7252 -12.7252 -12.0235 -12.0235 -11.8479 -11.8479 -11.3962 -11.3962 -10.9067 -10.9067 -10.5064 -10.5064 -5.0964 -5.0964 -3.7962 -3.7962 -3.6910 -3.6910 -3.3231 -3.3231 -3.1519 -3.1519 -0.4891 -0.4891 -0.4630 -0.4630 -0.2145 -0.2145 -0.1867 -0.1867 0.8089 0.8089 0.9438 0.9438 1.3038 1.3038 1.3581 1.3581 1.5934 1.5934 1.8473 1.8473 1.9335 1.9335 2.8251 2.8251 2.9240 2.9240 3.1047 3.1047 3.4301 3.4301 4.0198 4.0198 4.1080 4.1080 4.4630 4.4630 5.0351 5.0351 5.1052 5.1052 5.2429 5.2429 5.4072 5.4072 6.8693 6.8693 8.1794 8.1794 8.5442 8.5442 8.8334 8.8334 9.1871 9.1871 9.9782 9.9782 10.1206 10.1206 k = 0.3571 0.2062-0.0000 ( 6947 PWs) bands (ev): -18.4444 -18.4444 -15.1363 -15.1363 -14.9476 -14.9476 -12.7312 -12.7312 -12.0338 -12.0338 -11.8525 -11.8525 -11.3786 -11.3786 -10.9213 -10.9213 -10.4978 -10.4978 -5.0921 -5.0921 -3.7904 -3.7904 -3.6940 -3.6940 -3.3196 -3.3196 -3.1352 -3.1352 -0.4930 -0.4930 -0.4634 -0.4634 -0.1920 -0.1920 -0.1639 -0.1639 0.8132 0.8132 0.9388 0.9388 1.3076 1.3076 1.3662 1.3662 1.5949 1.5949 1.8151 1.8151 1.9117 1.9117 2.7776 2.7776 2.9490 2.9490 3.1438 3.1438 3.4340 3.4340 3.9923 3.9923 4.0732 4.0732 4.4487 4.4487 5.0234 5.0234 5.0913 5.0913 5.2580 5.2580 5.4033 5.4033 6.9207 6.9207 8.1316 8.1316 8.5208 8.5208 8.8184 8.8184 9.1888 9.1888 9.9653 9.9653 10.1135 10.1135 k = 0.3714 0.2144-0.0000 ( 6957 PWs) bands (ev): -18.4425 -18.4425 -15.1312 -15.1312 -14.9528 -14.9528 -12.7369 -12.7369 -12.0432 -12.0432 -11.8567 -11.8567 -11.3611 -11.3611 -10.9362 -10.9362 -10.4898 -10.4898 -5.0882 -5.0882 -3.7847 -3.7847 -3.6971 -3.6971 -3.3165 -3.3165 -3.1190 -3.1190 -0.4971 -0.4971 -0.4640 -0.4640 -0.1722 -0.1722 -0.1402 -0.1402 0.8186 0.8186 0.9330 0.9330 1.3049 1.3049 1.3805 1.3805 1.5958 1.5958 1.7852 1.7852 1.8945 1.8945 2.7192 2.7192 2.9774 2.9774 3.1867 3.1867 3.4441 3.4441 3.9635 3.9635 4.0389 4.0389 4.4333 4.4333 5.0112 5.0112 5.0791 5.0791 5.2712 5.2712 5.4004 5.4004 6.9715 6.9715 8.0841 8.0841 8.4993 8.4993 8.8047 8.8047 9.1906 9.1906 9.9535 9.9535 10.1068 10.1068 k = 0.3857 0.2227-0.0000 ( 6955 PWs) bands (ev): -18.4408 -18.4408 -15.1263 -15.1263 -14.9579 -14.9579 -12.7421 -12.7421 -12.0517 -12.0517 -11.8605 -11.8605 -11.3437 -11.3437 -10.9512 -10.9512 -10.4826 -10.4826 -5.0846 -5.0846 -3.7791 -3.7791 -3.7002 -3.7002 -3.3139 -3.3139 -3.1038 -3.1038 -0.5011 -0.5011 -0.4648 -0.4648 -0.1543 -0.1543 -0.1175 -0.1175 0.8251 0.8251 0.9268 0.9268 1.2998 1.2998 1.3967 1.3967 1.5958 1.5958 1.7579 1.7579 1.8819 1.8819 2.6565 2.6565 3.0064 3.0064 3.2317 3.2317 3.4584 3.4584 3.9326 3.9326 4.0059 4.0059 4.4169 4.4169 4.9990 4.9990 5.0688 5.0688 5.2820 5.2820 5.3989 5.3989 7.0214 7.0214 8.0370 8.0370 8.4799 8.4799 8.7922 8.7922 9.1925 9.1925 9.9429 9.9429 10.1006 10.1006 k = 0.4000 0.2309-0.0000 ( 6955 PWs) bands (ev): -18.4392 -18.4392 -15.1216 -15.1216 -14.9627 -14.9627 -12.7468 -12.7468 -12.0593 -12.0593 -11.8639 -11.8639 -11.3267 -11.3267 -10.9660 -10.9660 -10.4762 -10.4762 -5.0815 -5.0815 -3.7737 -3.7737 -3.7034 -3.7034 -3.3116 -3.3116 -3.0897 -3.0897 -0.5047 -0.5047 -0.4657 -0.4657 -0.1375 -0.1375 -0.0972 -0.0972 0.8326 0.8326 0.9204 0.9204 1.2942 1.2942 1.4130 1.4130 1.5945 1.5945 1.7338 1.7338 1.8738 1.8738 2.5930 2.5930 3.0346 3.0346 3.2777 3.2777 3.4754 3.4754 3.8995 3.8995 3.9750 3.9750 4.3999 4.3999 4.9874 4.9874 5.0605 5.0605 5.2900 5.2900 5.3989 5.3989 7.0701 7.0701 7.9908 7.9908 8.4626 8.4626 8.7811 8.7811 9.1944 9.1944 9.9334 9.9334 10.0950 10.0950 k = 0.4143 0.2392-0.0000 ( 6945 PWs) bands (ev): -18.4379 -18.4379 -15.1172 -15.1172 -14.9673 -14.9673 -12.7510 -12.7510 -12.0659 -12.0659 -11.8669 -11.8669 -11.3103 -11.3103 -10.9805 -10.9805 -10.4706 -10.4706 -5.0787 -5.0787 -3.7685 -3.7685 -3.7066 -3.7066 -3.3097 -3.3097 -3.0770 -3.0770 -0.5080 -0.5080 -0.4668 -0.4668 -0.1218 -0.1218 -0.0800 -0.0800 0.8406 0.8406 0.9141 0.9141 1.2889 1.2889 1.4289 1.4289 1.5914 1.5914 1.7135 1.7135 1.8701 1.8701 2.5310 2.5310 3.0612 3.0612 3.3242 3.3242 3.4938 3.4938 3.8638 3.8638 3.9469 3.9469 4.3829 4.3829 4.9767 4.9767 5.0538 5.0538 5.2954 5.2954 5.4003 5.4003 7.1170 7.1170 7.9462 7.9462 8.4475 8.4475 8.7714 8.7714 9.1962 9.1962 9.9252 9.9252 10.0900 10.0900 k = 0.4286 0.2474-0.0000 ( 6953 PWs) bands (ev): -18.4367 -18.4367 -15.1131 -15.1131 -14.9714 -14.9714 -12.7546 -12.7546 -12.0716 -12.0716 -11.8695 -11.8695 -11.2948 -11.2948 -10.9943 -10.9943 -10.4658 -10.4658 -5.0763 -5.0763 -3.7637 -3.7637 -3.7097 -3.7097 -3.3081 -3.3081 -3.0659 -3.0659 -0.5108 -0.5108 -0.4678 -0.4678 -0.1073 -0.1073 -0.0661 -0.0661 0.8490 0.8490 0.9082 0.9082 1.2841 1.2841 1.4442 1.4442 1.5857 1.5857 1.6974 1.6974 1.8704 1.8704 2.4726 2.4726 3.0854 3.0854 3.3706 3.3706 3.5129 3.5129 3.8258 3.8258 3.9217 3.9217 4.3664 4.3664 4.9673 4.9673 5.0486 5.0486 5.2986 5.2986 5.4027 5.4027 7.1613 7.1613 7.9038 7.9038 8.4346 8.4346 8.7631 8.7631 9.1978 9.1978 9.9182 9.9182 10.0856 10.0856 k = 0.4429 0.2557-0.0000 ( 6937 PWs) bands (ev): -18.4357 -18.4357 -15.1096 -15.1096 -14.9750 -14.9750 -12.7576 -12.7576 -12.0762 -12.0762 -11.8717 -11.8717 -11.2808 -11.2808 -11.0070 -11.0070 -10.4618 -10.4618 -5.0743 -5.0743 -3.7591 -3.7591 -3.7127 -3.7127 -3.3068 -3.3068 -3.0566 -3.0566 -0.5132 -0.5132 -0.4687 -0.4687 -0.0941 -0.0941 -0.0558 -0.0558 0.8570 0.8570 0.9029 0.9029 1.2800 1.2800 1.4590 1.4590 1.5774 1.5774 1.6857 1.6857 1.8739 1.8739 2.4198 2.4198 3.1066 3.1066 3.4163 3.4163 3.5315 3.5315 3.7861 3.7861 3.8997 3.8997 4.3513 4.3513 4.9595 4.9595 5.0445 5.0445 5.3003 5.3003 5.4055 5.4055 7.2019 7.2019 7.8647 7.8647 8.4239 8.4239 8.7563 8.7563 9.1992 9.1992 9.9125 9.9125 10.0820 10.0820 k = 0.4571 0.2639-0.0000 ( 6943 PWs) bands (ev): -18.4349 -18.4349 -15.1067 -15.1067 -14.9780 -14.9780 -12.7599 -12.7599 -12.0798 -12.0798 -11.8733 -11.8733 -11.2688 -11.2688 -11.0181 -11.0181 -10.4587 -10.4587 -5.0728 -5.0728 -3.7551 -3.7551 -3.7155 -3.7155 -3.3058 -3.3058 -3.0492 -3.0492 -0.5150 -0.5150 -0.4696 -0.4696 -0.0827 -0.0827 -0.0488 -0.0488 0.8641 0.8641 0.8985 0.8985 1.2766 1.2766 1.4733 1.4733 1.5668 1.5668 1.6780 1.6780 1.8796 1.8796 2.3747 2.3747 3.1239 3.1239 3.4606 3.4606 3.5492 3.5492 3.7453 3.7453 3.8814 3.8814 4.3384 4.3384 4.9533 4.9533 5.0415 5.0415 5.3008 5.3008 5.4083 5.4083 7.2373 7.2373 7.8305 7.8305 8.4156 8.4156 8.7510 8.7510 9.2004 9.2004 9.9080 9.9080 10.0791 10.0791 k = 0.4714 0.2722-0.0000 ( 6946 PWs) bands (ev): -18.4343 -18.4343 -15.1045 -15.1045 -14.9803 -14.9803 -12.7616 -12.7616 -12.0824 -12.0824 -11.8746 -11.8746 -11.2594 -11.2594 -11.0267 -11.0267 -10.4565 -10.4565 -5.0716 -5.0716 -3.7519 -3.7519 -3.7180 -3.7180 -3.3051 -3.3051 -3.0438 -3.0438 -0.5163 -0.5163 -0.4702 -0.4702 -0.0735 -0.0735 -0.0447 -0.0447 0.8698 0.8698 0.8951 0.8951 1.2742 1.2742 1.4868 1.4868 1.5550 1.5550 1.6733 1.6733 1.8859 1.8859 2.3398 2.3398 3.1368 3.1368 3.5012 3.5012 3.5661 3.5661 3.7041 3.7041 3.8672 3.8672 4.3285 4.3285 4.9489 4.9489 5.0395 5.0395 5.3009 5.3009 5.4106 5.4106 7.2654 7.2654 7.8033 7.8033 8.4096 8.4096 8.7472 8.7472 9.2012 9.2012 9.9048 9.9048 10.0770 10.0770 k = 0.4857 0.2804-0.0000 ( 6944 PWs) bands (ev): -18.4340 -18.4340 -15.1031 -15.1031 -14.9817 -14.9817 -12.7627 -12.7627 -12.0840 -12.0840 -11.8753 -11.8753 -11.2534 -11.2534 -11.0323 -11.0323 -10.4552 -10.4552 -5.0710 -5.0710 -3.7497 -3.7497 -3.7196 -3.7196 -3.3047 -3.3047 -3.0405 -3.0405 -0.5171 -0.5171 -0.4705 -0.4705 -0.0673 -0.0673 -0.0430 -0.0430 0.8736 0.8736 0.8929 0.8929 1.2727 1.2727 1.4985 1.4985 1.5441 1.5441 1.6709 1.6709 1.8908 1.8908 2.3174 2.3174 3.1448 3.1448 3.5318 3.5318 3.5861 3.5861 3.6641 3.6641 3.8582 3.8582 4.3222 4.3222 4.9462 4.9462 5.0383 5.0383 5.3008 5.3008 5.4121 5.4121 7.2837 7.2837 7.7855 7.7855 8.4060 8.4060 8.7449 8.7449 9.2018 9.2018 9.9029 9.9029 10.0757 10.0757 k = 0.5000 0.2887-0.0000 ( 6944 PWs) bands (ev): -18.4339 -18.4339 -15.1026 -15.1026 -14.9821 -14.9821 -12.7630 -12.7630 -12.0845 -12.0845 -11.8755 -11.8755 -11.2513 -11.2513 -11.0343 -11.0343 -10.4547 -10.4547 -5.0708 -5.0708 -3.7489 -3.7489 -3.7203 -3.7203 -3.3045 -3.3045 -3.0395 -3.0395 -0.5174 -0.5174 -0.4707 -0.4707 -0.0650 -0.0650 -0.0427 -0.0427 0.8749 0.8749 0.8922 0.8922 1.2722 1.2722 1.5040 1.5040 1.5387 1.5387 1.6701 1.6701 1.8927 1.8927 2.3097 2.3097 3.1475 3.1475 3.5426 3.5426 3.6060 3.6060 3.6370 3.6370 3.8551 3.8551 4.3201 4.3201 4.9453 4.9453 5.0379 5.0379 5.3008 5.3008 5.4126 5.4126 7.2902 7.2902 7.7792 7.7792 8.4048 8.4048 8.7441 8.7441 9.2019 9.2019 9.9023 9.9023 10.0753 10.0753 k = 0.5000 0.2887-0.0000 ( 6944 PWs) bands (ev): -18.4339 -18.4339 -15.1026 -15.1026 -14.9821 -14.9821 -12.7630 -12.7630 -12.0845 -12.0845 -11.8755 -11.8755 -11.2513 -11.2513 -11.0343 -11.0343 -10.4547 -10.4547 -5.0708 -5.0708 -3.7489 -3.7489 -3.7203 -3.7203 -3.3045 -3.3045 -3.0395 -3.0395 -0.5174 -0.5174 -0.4707 -0.4707 -0.0650 -0.0650 -0.0427 -0.0427 0.8749 0.8749 0.8922 0.8922 1.2722 1.2722 1.5040 1.5040 1.5387 1.5387 1.6701 1.6701 1.8927 1.8927 2.3097 2.3097 3.1475 3.1475 3.5426 3.5426 3.6060 3.6060 3.6370 3.6370 3.8551 3.8551 4.3201 4.3201 4.9453 4.9453 5.0379 5.0379 5.3008 5.3008 5.4126 5.4126 7.2902 7.2902 7.7792 7.7792 8.4048 8.4048 8.7441 8.7441 9.2019 9.2019 9.9023 9.9023 10.0753 10.0753 k = 0.4917 0.3031-0.0000 ( 6944 PWs) bands (ev): -18.4338 -18.4338 -15.1025 -15.1025 -14.9823 -14.9823 -12.7625 -12.7625 -12.0885 -12.0885 -11.8724 -11.8724 -11.2509 -11.2509 -11.0343 -11.0343 -10.4549 -10.4549 -5.0706 -5.0706 -3.7490 -3.7490 -3.7200 -3.7200 -3.3044 -3.3044 -3.0396 -3.0396 -0.5213 -0.5213 -0.4665 -0.4665 -0.0637 -0.0637 -0.0425 -0.0425 0.8649 0.8649 0.9018 0.9018 1.2720 1.2720 1.4996 1.4996 1.5419 1.5419 1.6704 1.6704 1.8923 1.8923 2.3105 2.3105 3.1466 3.1466 3.5387 3.5387 3.6028 3.6028 3.6469 3.6469 3.8542 3.8542 4.3191 4.3191 4.9443 4.9443 5.0360 5.0360 5.3018 5.3018 5.4129 5.4129 7.2910 7.2910 7.7793 7.7793 8.4008 8.4008 8.7480 8.7480 9.2018 9.2018 9.8811 9.8811 10.0985 10.0985 k = 0.4833 0.3175-0.0000 ( 6956 PWs) bands (ev): -18.4337 -18.4337 -15.1020 -15.1020 -14.9828 -14.9828 -12.7608 -12.7608 -12.0999 -12.0999 -11.8637 -11.8637 -11.2498 -11.2498 -11.0343 -11.0343 -10.4555 -10.4555 -5.0702 -5.0702 -3.7493 -3.7493 -3.7192 -3.7192 -3.3040 -3.3040 -3.0401 -3.0401 -0.5304 -0.5304 -0.4565 -0.4565 -0.0606 -0.0606 -0.0413 -0.0413 0.8491 0.8491 0.9165 0.9165 1.2713 1.2713 1.4891 1.4891 1.5487 1.5487 1.6712 1.6712 1.8911 1.8911 2.3128 2.3128 3.1441 3.1441 3.5276 3.5276 3.6017 3.6017 3.6673 3.6673 3.8514 3.8514 4.3160 4.3160 4.9410 4.9410 5.0303 5.0303 5.3047 5.3047 5.4139 5.4139 7.2936 7.2936 7.7793 7.7793 8.3892 8.3892 8.7591 8.7591 9.2013 9.2013 9.8355 9.8355 10.1504 10.1504 k = 0.4750 0.3320-0.0000 ( 6952 PWs) bands (ev): -18.4335 -18.4335 -15.1012 -15.1012 -14.9836 -14.9836 -12.7580 -12.7580 -12.1169 -12.1169 -11.8510 -11.8510 -11.2480 -11.2480 -11.0344 -11.0344 -10.4564 -10.4564 -5.0695 -5.0695 -3.7498 -3.7498 -3.7180 -3.7180 -3.3033 -3.3033 -3.0408 -3.0408 -0.5415 -0.5415 -0.4438 -0.4438 -0.0582 -0.0582 -0.0365 -0.0365 0.8323 0.8323 0.9313 0.9313 1.2702 1.2702 1.4759 1.4759 1.5561 1.5561 1.6723 1.6723 1.8893 1.8893 2.3162 2.3162 3.1405 3.1405 3.5121 3.5121 3.6067 3.6067 3.6913 3.6913 3.8469 3.8469 4.3111 4.3111 4.9350 4.9350 5.0218 5.0218 5.3092 5.3092 5.4154 5.4154 7.2979 7.2979 7.7793 7.7793 8.3716 8.3716 8.7759 8.7759 9.2005 9.2005 9.7830 9.7830 10.2134 10.2134 k = 0.4667 0.3464-0.0000 ( 6952 PWs) bands (ev): -18.4333 -18.4333 -15.1000 -15.1000 -14.9848 -14.9848 -12.7541 -12.7541 -12.1379 -12.1379 -11.8360 -11.8360 -11.2455 -11.2455 -11.0346 -11.0346 -10.4577 -10.4577 -5.0686 -5.0686 -3.7504 -3.7504 -3.7164 -3.7164 -3.3023 -3.3023 -3.0419 -3.0419 -0.5532 -0.5532 -0.4298 -0.4298 -0.0587 -0.0587 -0.0259 -0.0259 0.8150 0.8150 0.9459 0.9459 1.2687 1.2687 1.4612 1.4612 1.5631 1.5631 1.6736 1.6736 1.8870 1.8870 2.3201 2.3201 3.1368 3.1368 3.4949 3.4949 3.6161 3.6161 3.7170 3.7170 3.8407 3.8407 4.3044 4.3044 4.9254 4.9254 5.0115 5.0115 5.3149 5.3149 5.4176 5.4176 7.3040 7.3040 7.7793 7.7793 8.3495 8.3495 8.7969 8.7969 9.1993 9.1993 9.7293 9.7293 10.2816 10.2816 k = 0.4583 0.3608-0.0000 ( 6955 PWs) bands (ev): -18.4330 -18.4330 -15.0986 -15.0986 -14.9863 -14.9863 -12.7490 -12.7490 -12.1618 -12.1618 -11.8199 -11.8199 -11.2423 -11.2423 -11.0349 -11.0349 -10.4593 -10.4593 -5.0675 -5.0675 -3.7509 -3.7509 -3.7145 -3.7145 -3.3011 -3.3011 -3.0432 -3.0432 -0.5649 -0.5649 -0.4152 -0.4152 -0.0616 -0.0616 -0.0104 -0.0104 0.7975 0.7975 0.9599 0.9599 1.2667 1.2667 1.4458 1.4458 1.5694 1.5694 1.6748 1.6748 1.8845 1.8845 2.3235 2.3235 3.1338 3.1338 3.4780 3.4780 3.6285 3.6285 3.7432 3.7432 3.8332 3.8332 4.2962 4.2962 4.9112 4.9112 5.0011 5.0011 5.3213 5.3213 5.4204 5.4204 7.3117 7.3117 7.7792 7.7792 8.3243 8.3243 8.8205 8.8205 9.1978 9.1978 9.6764 9.6764 10.3529 10.3529 k = 0.4500 0.3753-0.0000 ( 6953 PWs) bands (ev): -18.4326 -18.4326 -15.0968 -15.0968 -14.9881 -14.9881 -12.7429 -12.7429 -12.1874 -12.1874 -11.8035 -11.8035 -11.2384 -11.2384 -11.0355 -11.0355 -10.4611 -10.4611 -5.0661 -5.0661 -3.7514 -3.7514 -3.7125 -3.7125 -3.2996 -3.2996 -3.0447 -3.0447 -0.5763 -0.5763 -0.4001 -0.4001 -0.0660 -0.0660 0.0091 0.0091 0.7797 0.7797 0.9734 0.9734 1.2642 1.2642 1.4299 1.4299 1.5753 1.5753 1.6757 1.6757 1.8817 1.8817 2.3257 2.3257 3.1327 3.1327 3.4623 3.4623 3.6426 3.6426 3.7688 3.7688 3.8254 3.8254 4.2870 4.2870 4.8915 4.8915 4.9917 4.9917 5.3281 5.3281 5.4237 5.4237 7.3213 7.3213 7.7789 7.7789 8.2971 8.2971 8.8456 8.8456 9.1959 9.1959 9.6253 9.6253 10.4265 10.4265 k = 0.4417 0.3897-0.0000 ( 6953 PWs) bands (ev): -18.4321 -18.4321 -15.0947 -15.0947 -14.9902 -14.9902 -12.7357 -12.7357 -12.2143 -12.2143 -11.7875 -11.7875 -11.2337 -11.2337 -11.0363 -11.0363 -10.4630 -10.4630 -5.0646 -5.0646 -3.7518 -3.7518 -3.7104 -3.7104 -3.2979 -3.2979 -3.0464 -3.0464 -0.5874 -0.5874 -0.3846 -0.3846 -0.0715 -0.0715 0.0320 0.0320 0.7616 0.7616 0.9864 0.9864 1.2613 1.2613 1.4137 1.4137 1.5810 1.5810 1.6762 1.6762 1.8787 1.8787 2.3257 2.3257 3.1343 3.1343 3.4483 3.4483 3.6574 3.6574 3.7888 3.7888 3.8223 3.8223 4.2770 4.2770 4.8661 4.8661 4.9839 4.9839 5.3349 5.3349 5.4276 5.4276 7.3325 7.3325 7.7785 7.7785 8.2687 8.2687 8.8714 8.8714 9.1937 9.1937 9.5763 9.5763 10.5016 10.5016 k = 0.4333 0.4041-0.0000 ( 6951 PWs) bands (ev): -18.4317 -18.4317 -15.0923 -15.0923 -14.9927 -14.9927 -12.7274 -12.7274 -12.2418 -12.2418 -11.7723 -11.7723 -11.2284 -11.2284 -11.0375 -11.0375 -10.4651 -10.4651 -5.0629 -5.0629 -3.7521 -3.7521 -3.7083 -3.7083 -3.2959 -3.2959 -3.0482 -3.0482 -0.5979 -0.5979 -0.3689 -0.3689 -0.0778 -0.0778 0.0580 0.0580 0.7432 0.7432 0.9987 0.9987 1.2579 1.2579 1.3975 1.3975 1.5867 1.5867 1.6762 1.6762 1.8754 1.8754 2.3228 2.3228 3.1395 3.1395 3.4364 3.4364 3.6716 3.6716 3.7905 3.7905 3.8371 3.8371 4.2666 4.2666 4.8354 4.8354 4.9777 4.9777 5.3414 5.3414 5.4319 5.4319 7.3455 7.3455 7.7776 7.7776 8.2398 8.2398 8.8972 8.8972 9.1911 9.1911 9.5297 9.5297 10.5777 10.5777 k = 0.4250 0.4186-0.0000 ( 6951 PWs) bands (ev): -18.4312 -18.4312 -15.0896 -15.0896 -14.9954 -14.9954 -12.7181 -12.7181 -12.2698 -12.2698 -11.7580 -11.7580 -11.2223 -11.2223 -11.0392 -11.0392 -10.4673 -10.4673 -5.0612 -5.0612 -3.7522 -3.7522 -3.7063 -3.7063 -3.2938 -3.2938 -3.0501 -3.0501 -0.6078 -0.6078 -0.3531 -0.3531 -0.0850 -0.0850 0.0866 0.0866 0.7246 0.7246 1.0104 1.0104 1.2541 1.2541 1.3815 1.3815 1.5927 1.5927 1.6757 1.6757 1.8717 1.8717 2.3167 2.3167 3.1488 3.1488 3.4269 3.4269 3.6836 3.6836 3.7825 3.7825 3.8622 3.8622 4.2564 4.2564 4.8001 4.8001 4.9726 4.9726 5.3476 5.3476 5.4364 5.4364 7.3602 7.3602 7.7762 7.7762 8.2106 8.2106 8.9226 8.9226 9.1881 9.1881 9.4858 9.4858 10.6540 10.6540 k = 0.4167 0.4330-0.0000 ( 6963 PWs) bands (ev): -18.4306 -18.4306 -15.0866 -15.0866 -14.9984 -14.9984 -12.7077 -12.7077 -12.2979 -12.2979 -11.7449 -11.7449 -11.2156 -11.2156 -11.0415 -11.0415 -10.4694 -10.4694 -5.0593 -5.0593 -3.7521 -3.7521 -3.7044 -3.7044 -3.2916 -3.2916 -3.0520 -3.0520 -0.6170 -0.6170 -0.3372 -0.3372 -0.0928 -0.0928 0.1176 0.1176 0.7055 0.7055 1.0213 1.0213 1.2500 1.2500 1.3658 1.3658 1.5991 1.5991 1.6749 1.6749 1.8675 1.8675 2.3070 2.3070 3.1624 3.1624 3.4200 3.4200 3.6904 3.6904 3.7754 3.7754 3.8893 3.8893 4.2469 4.2469 4.7607 4.7607 4.9684 4.9684 5.3534 5.3534 5.4411 5.4411 7.3767 7.3767 7.7742 7.7742 8.1818 8.1818 8.9474 8.9474 9.1847 9.1847 9.4445 9.4445 10.7295 10.7295 k = 0.4083 0.4474-0.0000 ( 6959 PWs) bands (ev): -18.4301 -18.4301 -15.0833 -15.0833 -15.0018 -15.0018 -12.6962 -12.6962 -12.3259 -12.3259 -11.7331 -11.7331 -11.2082 -11.2082 -11.0444 -11.0444 -10.4714 -10.4714 -5.0575 -5.0575 -3.7518 -3.7518 -3.7026 -3.7026 -3.2892 -3.2892 -3.0539 -3.0539 -0.6254 -0.6254 -0.3214 -0.3214 -0.1013 -0.1013 0.1507 0.1507 0.6861 0.6861 1.0316 1.0316 1.2457 1.2457 1.3506 1.3506 1.6062 1.6062 1.6740 1.6740 1.8624 1.8624 2.2939 2.2939 3.1804 3.1804 3.4156 3.4156 3.6888 3.6888 3.7737 3.7737 3.9170 3.9170 4.2385 4.2385 4.7179 4.7179 4.9648 4.9648 5.3587 5.3587 5.4457 5.4457 7.3948 7.3948 7.7712 7.7712 8.1535 8.1535 8.9714 8.9714 9.1810 9.1810 9.4062 9.4062 10.8032 10.8032 k = 0.4000 0.4619-0.0000 ( 6947 PWs) bands (ev): -18.4296 -18.4296 -15.0797 -15.0797 -15.0054 -15.0054 -12.6838 -12.6838 -12.3536 -12.3536 -11.7226 -11.7226 -11.2001 -11.2001 -11.0482 -11.0482 -10.4732 -10.4732 -5.0557 -5.0557 -3.7514 -3.7514 -3.7010 -3.7010 -3.2869 -3.2869 -3.0556 -3.0556 -0.6331 -0.6331 -0.3057 -0.3057 -0.1104 -0.1104 0.1855 0.1855 0.6661 0.6661 1.0412 1.0412 1.2414 1.2414 1.3358 1.3358 1.6139 1.6139 1.6731 1.6731 1.8563 1.8563 2.2780 2.2780 3.2023 3.2023 3.4137 3.4137 3.6778 3.6778 3.7783 3.7783 3.9448 3.9448 4.2318 4.2318 4.6719 4.6719 4.9618 4.9618 5.3635 5.3635 5.4501 5.4501 7.4147 7.4147 7.7670 7.7670 8.1262 8.1262 8.9944 8.9944 9.1769 9.1769 9.3707 9.3707 10.8738 10.8738 k = 0.3917 0.4763-0.0000 ( 6963 PWs) bands (ev): -18.4291 -18.4291 -15.0759 -15.0759 -15.0092 -15.0092 -12.6703 -12.6703 -12.3808 -12.3808 -11.7135 -11.7135 -11.1914 -11.1914 -11.0528 -11.0528 -10.4748 -10.4748 -5.0539 -5.0539 -3.7509 -3.7509 -3.6996 -3.6996 -3.2845 -3.2845 -3.0573 -3.0573 -0.6400 -0.6400 -0.2902 -0.2902 -0.1199 -0.1199 0.2215 0.2215 0.6455 0.6455 1.0500 1.0500 1.2373 1.2373 1.3216 1.3216 1.6221 1.6221 1.6728 1.6728 1.8490 1.8490 2.2600 2.2600 3.2277 3.2277 3.4142 3.4142 3.6602 3.6602 3.7862 3.7862 3.9729 3.9729 4.2272 4.2272 4.6235 4.6235 4.9592 4.9592 5.3679 5.3679 5.4541 5.4541 7.4362 7.4362 7.7611 7.7611 8.1003 8.1003 9.0164 9.0164 9.1725 9.1725 9.3382 9.3382 10.9398 10.9398 k = 0.3833 0.4907-0.0000 ( 6955 PWs) bands (ev): -18.4286 -18.4286 -15.0718 -15.0718 -15.0133 -15.0133 -12.6559 -12.6559 -12.4074 -12.4074 -11.7058 -11.7058 -11.1821 -11.1821 -11.0585 -11.0585 -10.4762 -10.4762 -5.0523 -5.0523 -3.7502 -3.7502 -3.6984 -3.6984 -3.2823 -3.2823 -3.0587 -3.0587 -0.6460 -0.6460 -0.2750 -0.2750 -0.1298 -0.1298 0.2583 0.2583 0.6241 0.6241 1.0579 1.0579 1.2337 1.2337 1.3080 1.3080 1.6305 1.6305 1.6736 1.6736 1.8404 1.8404 2.2407 2.2407 3.2559 3.2559 3.4167 3.4167 3.6384 3.6384 3.7949 3.7949 4.0013 4.0013 4.2251 4.2251 4.5730 4.5730 4.9570 4.9570 5.3719 5.3719 5.4576 5.4576 7.4593 7.4593 7.7530 7.7530 8.0764 8.0764 9.0375 9.0375 9.1678 9.1678 9.3087 9.3087 11.0004 11.0004 k = 0.3750 0.5052-0.0000 ( 6959 PWs) bands (ev): -18.4281 -18.4281 -15.0675 -15.0675 -15.0177 -15.0177 -12.6406 -12.6406 -12.4332 -12.4332 -11.6994 -11.6994 -11.1722 -11.1722 -11.0651 -11.0651 -10.4773 -10.4773 -5.0508 -5.0508 -3.7496 -3.7496 -3.6974 -3.6974 -3.2802 -3.2802 -3.0598 -3.0598 -0.6511 -0.6511 -0.2602 -0.2602 -0.1401 -0.1401 0.2954 0.2954 0.6018 0.6018 1.0649 1.0649 1.2309 1.2309 1.2951 1.2951 1.6381 1.6381 1.6766 1.6766 1.8302 1.8302 2.2214 2.2214 3.2861 3.2861 3.4208 3.4208 3.6139 3.6139 3.8029 3.8029 4.0301 4.0301 4.2255 4.2255 4.5211 4.5211 4.9551 4.9551 5.3755 5.3755 5.4605 5.4605 7.4840 7.4840 7.7421 7.7421 8.0550 8.0550 9.0576 9.0576 9.1628 9.1628 9.2823 9.2823 11.0556 11.0556 k = 0.3667 0.5196-0.0000 ( 6963 PWs) bands (ev): -18.4277 -18.4277 -15.0629 -15.0629 -15.0223 -15.0223 -12.6244 -12.6244 -12.4581 -12.4581 -11.6943 -11.6943 -11.1617 -11.1617 -11.0728 -11.0728 -10.4782 -10.4782 -5.0495 -5.0495 -3.7489 -3.7489 -3.6967 -3.6967 -3.2784 -3.2784 -3.0607 -3.0607 -0.6553 -0.6553 -0.2458 -0.2458 -0.1506 -0.1506 0.3323 0.3323 0.5785 0.5785 1.0709 1.0709 1.2294 1.2294 1.2830 1.2830 1.6438 1.6438 1.6830 1.6830 1.8183 1.8183 2.2031 2.2031 3.3174 3.3174 3.4260 3.4260 3.5877 3.5877 3.8095 3.8095 4.0596 4.0596 4.2279 4.2279 4.4689 4.4689 4.9536 4.9536 5.3786 5.3786 5.4628 5.4628 7.5101 7.5101 7.7278 7.7278 8.0369 8.0369 9.0768 9.0768 9.1576 9.1576 9.2589 9.2589 11.1054 11.1054 k = 0.3583 0.5340-0.0000 ( 6973 PWs) bands (ev): -18.4274 -18.4274 -15.0582 -15.0582 -15.0271 -15.0271 -12.6074 -12.6074 -12.4820 -12.4820 -11.6905 -11.6905 -11.1507 -11.1507 -11.0816 -11.0816 -10.4788 -10.4788 -5.0485 -5.0485 -3.7482 -3.7482 -3.6962 -3.6962 -3.2769 -3.2769 -3.0612 -3.0612 -0.6586 -0.6586 -0.2321 -0.2321 -0.1614 -0.1614 0.3683 0.3683 0.5541 0.5541 1.0756 1.0756 1.2296 1.2296 1.2716 1.2716 1.6471 1.6471 1.6935 1.6935 1.8046 1.8046 2.1871 2.1871 3.3489 3.3489 3.4316 3.4316 3.5605 3.5605 3.8146 3.8146 4.0900 4.0900 4.2311 4.2311 4.4182 4.4182 4.9523 4.9523 5.3811 5.3811 5.4644 5.4644 7.5377 7.5377 7.7097 7.7097 8.0226 8.0226 9.0949 9.0949 9.1521 9.1521 9.2387 9.2387 11.1504 11.1504 k = 0.3500 0.5485-0.0000 ( 6981 PWs) bands (ev): -18.4271 -18.4271 -15.0532 -15.0532 -15.0321 -15.0321 -12.5899 -12.5899 -12.5045 -12.5045 -11.6878 -11.6878 -11.1392 -11.1392 -11.0915 -11.0915 -10.4792 -10.4792 -5.0477 -5.0477 -3.7477 -3.7477 -3.6959 -3.6959 -3.2758 -3.2758 -3.0615 -3.0615 -0.6609 -0.6609 -0.2190 -0.2190 -0.1722 -0.1722 0.4026 0.4026 0.5287 0.5287 1.0790 1.0790 1.2317 1.2317 1.2611 1.2611 1.6486 1.6486 1.7071 1.7071 1.7893 1.7893 2.1746 2.1746 3.3791 3.3791 3.4367 3.4367 3.5336 3.5336 3.8181 3.8181 4.1213 4.1213 4.2318 4.2318 4.3730 4.3730 4.9515 4.9515 5.3831 5.3831 5.4655 5.4655 7.5667 7.5667 7.6875 7.6875 8.0124 8.0124 9.1115 9.1115 9.1465 9.1465 9.2223 9.2223 11.1908 11.1908 k = 0.3417 0.5629-0.0000 ( 6983 PWs) bands (ev): -18.4270 -18.4270 -15.0480 -15.0480 -15.0373 -15.0373 -12.5725 -12.5725 -12.5249 -12.5249 -11.6863 -11.6863 -11.1273 -11.1273 -11.1025 -11.1025 -10.4793 -10.4793 -5.0472 -5.0472 -3.7473 -3.7473 -3.6957 -3.6957 -3.2752 -3.2752 -3.0617 -3.0617 -0.6623 -0.6623 -0.2070 -0.2070 -0.1829 -0.1829 0.4339 0.4339 0.5033 0.5033 1.0811 1.0811 1.2359 1.2359 1.2518 1.2518 1.6493 1.6493 1.7222 1.7222 1.7733 1.7733 2.1665 2.1665 3.4045 3.4045 3.4407 3.4407 3.5100 3.5100 3.8204 3.8204 4.1530 4.1530 4.2230 4.2230 4.3415 4.3415 4.9509 4.9509 5.3844 5.3844 5.4661 5.4661 7.5965 7.5965 7.6615 7.6615 8.0064 8.0064 9.1255 9.1255 9.1409 9.1409 9.2106 9.2106 11.2265 11.2267 k = 0.3333 0.5774-0.0000 ( 6987 PWs) bands (ev): -18.4269 -18.4269 -15.0427 -15.0427 -15.0426 -15.0426 -12.5615 -12.5615 -12.5369 -12.5369 -11.6858 -11.6858 -11.1166 -11.1166 -11.1128 -11.1128 -10.4794 -10.4794 -5.0470 -5.0470 -3.7472 -3.7472 -3.6957 -3.6957 -3.2749 -3.2749 -3.0617 -3.0617 -0.6628 -0.6628 -0.1988 -0.1988 -0.1905 -0.1905 0.4524 0.4524 0.4867 0.4867 1.0817 1.0817 1.2406 1.2406 1.2454 1.2454 1.6494 1.6494 1.7318 1.7318 1.7635 1.7635 2.1637 2.1637 3.4160 3.4160 3.4424 3.4424 3.4990 3.4990 3.8212 3.8212 4.1752 4.1752 4.2076 4.2076 4.3315 4.3315 4.9507 4.9507 5.3849 5.3849 5.4662 5.4662 7.6203 7.6203 7.6389 7.6389 8.0044 8.0044 9.1334 9.1334 9.1363 9.1363 9.2062 9.2062 11.2552 11.2580 k = 0.3333 0.5774-0.0000 ( 6987 PWs) bands (ev): -18.4269 -18.4269 -15.0427 -15.0427 -15.0426 -15.0426 -12.5615 -12.5615 -12.5369 -12.5369 -11.6858 -11.6858 -11.1166 -11.1166 -11.1128 -11.1128 -10.4794 -10.4794 -5.0470 -5.0470 -3.7472 -3.7472 -3.6957 -3.6957 -3.2749 -3.2749 -3.0617 -3.0617 -0.6628 -0.6628 -0.1988 -0.1988 -0.1905 -0.1905 0.4524 0.4524 0.4867 0.4867 1.0817 1.0817 1.2406 1.2406 1.2454 1.2454 1.6494 1.6494 1.7318 1.7318 1.7635 1.7635 2.1637 2.1637 3.4160 3.4160 3.4424 3.4424 3.4990 3.4990 3.8212 3.8212 4.1752 4.1752 4.2076 4.2076 4.3315 4.3315 4.9507 4.9507 5.3849 5.3849 5.4662 5.4662 7.6203 7.6203 7.6389 7.6389 8.0044 8.0044 9.1334 9.1334 9.1363 9.1363 9.2062 9.2062 11.2546 11.2576 k = 0.3250 0.5629-0.0000 ( 6983 PWs) bands (ev): -18.4270 -18.4270 -15.0482 -15.0482 -15.0371 -15.0371 -12.5723 -12.5723 -12.5251 -12.5251 -11.6863 -11.6863 -11.1279 -11.1279 -11.1018 -11.1018 -10.4793 -10.4793 -5.0472 -5.0472 -3.7474 -3.7474 -3.6957 -3.6957 -3.2752 -3.2752 -3.0617 -3.0617 -0.6623 -0.6623 -0.2065 -0.2065 -0.1834 -0.1834 0.4342 0.4342 0.5028 0.5028 1.0811 1.0811 1.2355 1.2355 1.2522 1.2522 1.6493 1.6493 1.7208 1.7208 1.7749 1.7749 2.1667 2.1667 3.4044 3.4044 3.4408 3.4408 3.5097 3.5097 3.8201 3.8201 4.1494 4.1494 4.2304 4.2304 4.3383 4.3383 4.9509 4.9509 5.3844 5.3844 5.4661 5.4661 7.5943 7.5943 7.6639 7.6639 8.0063 8.0063 9.1286 9.1286 9.1375 9.1375 9.2109 9.2109 11.2297 11.2313 k = 0.3167 0.5485-0.0000 ( 6971 PWs) bands (ev): -18.4271 -18.4271 -15.0538 -15.0538 -15.0315 -15.0315 -12.5889 -12.5889 -12.5054 -12.5054 -11.6876 -11.6876 -11.1419 -11.1419 -11.0887 -11.0887 -10.4793 -10.4793 -5.0477 -5.0477 -3.7479 -3.7479 -3.6957 -3.6957 -3.2758 -3.2758 -3.0619 -3.0619 -0.6609 -0.6609 -0.2171 -0.2171 -0.1743 -0.1743 0.4041 0.4041 0.5264 0.5264 1.0793 1.0793 1.2300 1.2300 1.2627 1.2627 1.6486 1.6486 1.7007 1.7007 1.7967 1.7967 2.1758 2.1758 3.3790 3.3790 3.4360 3.4360 3.5319 3.5319 3.8159 3.8159 4.1116 4.1116 4.2647 4.2647 4.3543 4.3543 4.9515 4.9515 5.3828 5.3828 5.4658 5.4658 7.5578 7.5578 7.6973 7.6973 8.0116 8.0116 9.1225 9.1225 9.1344 9.1344 9.2235 9.2235 11.2012 11.2012 k = 0.3083 0.5340-0.0000 ( 6959 PWs) bands (ev): -18.4275 -18.4275 -15.0596 -15.0596 -15.0256 -15.0256 -12.6053 -12.6053 -12.4839 -12.4839 -11.6897 -11.6897 -11.1568 -11.1568 -11.0753 -11.0753 -10.4794 -10.4794 -5.0486 -5.0486 -3.7488 -3.7488 -3.6958 -3.6958 -3.2769 -3.2769 -3.0625 -3.0625 -0.6586 -0.6586 -0.2279 -0.2279 -0.1663 -0.1663 0.3710 0.3710 0.5486 0.5486 1.0766 1.0766 1.2260 1.2260 1.2750 1.2750 1.6464 1.6464 1.6801 1.6801 1.8220 1.8220 2.1911 2.1911 3.3488 3.3488 3.4279 3.4279 3.5555 3.5555 3.8070 3.8070 4.0785 4.0785 4.2992 4.2992 4.3766 4.3766 4.9526 4.9526 5.3800 5.3800 5.4655 5.4655 7.5182 7.5182 7.7322 7.7322 8.0201 8.0201 9.1161 9.1161 9.1292 9.1292 9.2408 9.2408 11.1737 11.1737 k = 0.3000 0.5196-0.0000 ( 6955 PWs) bands (ev): -18.4279 -18.4279 -15.0655 -15.0655 -15.0197 -15.0197 -12.6205 -12.6205 -12.4616 -12.4616 -11.6925 -11.6925 -11.1726 -11.1726 -11.0617 -11.0617 -10.4797 -10.4797 -5.0499 -5.0499 -3.7501 -3.7501 -3.6958 -3.6958 -3.2784 -3.2784 -3.0635 -3.0635 -0.6554 -0.6554 -0.2386 -0.2386 -0.1597 -0.1597 0.3361 0.3361 0.5684 0.5684 1.0731 1.0731 1.2237 1.2237 1.2884 1.2884 1.6379 1.6379 1.6651 1.6651 1.8495 1.8495 2.2128 2.2128 3.3169 3.3169 3.4161 3.4161 3.5759 3.5759 3.7934 3.7934 4.0549 4.0549 4.3313 4.3313 4.4053 4.4053 4.9541 4.9541 5.3759 5.3759 5.4652 5.4652 7.4762 7.4762 7.7682 7.7682 8.0315 8.0315 9.1096 9.1096 9.1238 9.1238 9.2608 9.2608 11.1468 11.1468 k = 0.2917 0.5052-0.0000 ( 6953 PWs) bands (ev): -18.4285 -18.4285 -15.0714 -15.0714 -15.0137 -15.0137 -12.6345 -12.6345 -12.4384 -12.4384 -11.6960 -11.6960 -11.1890 -11.1890 -11.0478 -11.0478 -10.4802 -10.4802 -5.0515 -5.0515 -3.7519 -3.7519 -3.6956 -3.6956 -3.2801 -3.2801 -3.0653 -3.0653 -0.6513 -0.6513 -0.2492 -0.2492 -0.1548 -0.1548 0.2996 0.2996 0.5858 0.5858 1.0689 1.0689 1.2232 1.2232 1.3027 1.3027 1.6193 1.6193 1.6602 1.6602 1.8786 1.8786 2.2408 2.2408 3.2843 3.2843 3.4009 3.4009 3.5881 3.5881 3.7785 3.7785 4.0423 4.0423 4.3596 4.3596 4.4404 4.4404 4.9561 4.9561 5.3706 5.3706 5.4648 5.4648 7.4323 7.4323 7.8050 7.8050 8.0456 8.0456 9.1031 9.1031 9.1187 9.1187 9.2828 9.2828 11.1202 11.1202 k = 0.2833 0.4907-0.0000 ( 6957 PWs) bands (ev): -18.4293 -18.4293 -15.0775 -15.0775 -15.0076 -15.0076 -12.6471 -12.6471 -12.4147 -12.4147 -11.6999 -11.6999 -11.2060 -11.2060 -11.0337 -11.0337 -10.4810 -10.4810 -5.0535 -5.0535 -3.7542 -3.7542 -3.6954 -3.6954 -3.2822 -3.2822 -3.0680 -3.0680 -0.6463 -0.6463 -0.2596 -0.2596 -0.1516 -0.1516 0.2619 0.2619 0.6012 0.6012 1.0643 1.0643 1.2245 1.2245 1.3176 1.3176 1.5968 1.5968 1.6598 1.6598 1.9089 1.9089 2.2749 2.2749 3.2516 3.2516 3.3826 3.3826 3.5857 3.5857 3.7701 3.7701 4.0394 4.0394 4.3845 4.3845 4.4808 4.4808 4.9586 4.9586 5.3640 5.3640 5.4645 5.4645 7.3867 7.3867 7.8426 7.8426 8.0624 8.0624 9.0968 9.0968 9.1141 9.1141 9.3064 9.3064 11.0939 11.0939 k = 0.2750 0.4763-0.0000 ( 6955 PWs) bands (ev): -18.4302 -18.4302 -15.0836 -15.0836 -15.0014 -15.0014 -12.6583 -12.6583 -12.3904 -12.3904 -11.7043 -11.7043 -11.2236 -11.2236 -11.0196 -11.0196 -10.4822 -10.4822 -5.0559 -5.0559 -3.7569 -3.7569 -3.6950 -3.6950 -3.2846 -3.2846 -3.0717 -3.0717 -0.6406 -0.6406 -0.2698 -0.2698 -0.1504 -0.1504 0.2230 0.2230 0.6149 0.6149 1.0594 1.0594 1.2275 1.2275 1.3327 1.3327 1.5737 1.5737 1.6609 1.6609 1.9400 1.9400 2.3148 2.3148 3.2190 3.2190 3.3615 3.3615 3.5655 3.5655 3.7744 3.7744 4.0435 4.0435 4.4069 4.4069 4.5247 4.5247 4.9617 4.9617 5.3563 5.3563 5.4642 5.4642 7.3396 7.3396 7.8809 7.8809 8.0817 8.0817 9.0909 9.0909 9.1101 9.1101 9.3313 9.3313 11.0677 11.0677 k = 0.2667 0.4619-0.0000 ( 6951 PWs) bands (ev): -18.4313 -18.4313 -15.0897 -15.0897 -14.9952 -14.9952 -12.6680 -12.6680 -12.3656 -12.3656 -11.7090 -11.7090 -11.2416 -11.2416 -11.0054 -11.0054 -10.4839 -10.4839 -5.0586 -5.0586 -3.7601 -3.7601 -3.6945 -3.6945 -3.2872 -3.2872 -3.0766 -3.0766 -0.6340 -0.6340 -0.2799 -0.2799 -0.1512 -0.1512 0.1831 0.1831 0.6274 0.6274 1.0543 1.0543 1.2321 1.2321 1.3479 1.3479 1.5510 1.5510 1.6628 1.6628 1.9715 1.9715 2.3600 2.3600 3.1868 3.1868 3.3380 3.3380 3.5317 3.5317 3.7897 3.7897 4.0524 4.0524 4.4278 4.4278 4.5707 4.5707 4.9654 4.9654 5.3474 5.3474 5.4638 5.4638 7.2914 7.2914 7.9198 7.9198 8.1034 8.1034 9.0855 9.0855 9.1067 9.1067 9.3576 9.3576 11.0415 11.0415 k = 0.2583 0.4474-0.0000 ( 6957 PWs) bands (ev): -18.4325 -18.4325 -15.0959 -15.0959 -14.9889 -14.9889 -12.6764 -12.6764 -12.3404 -12.3404 -11.7140 -11.7140 -11.2600 -11.2600 -10.9911 -10.9911 -10.4861 -10.4861 -5.0617 -5.0617 -3.7637 -3.7637 -3.6938 -3.6938 -3.2899 -3.2899 -3.0828 -3.0828 -0.6267 -0.6267 -0.2899 -0.2899 -0.1543 -0.1543 0.1425 0.1425 0.6392 0.6392 1.0491 1.0491 1.2384 1.2384 1.3627 1.3627 1.5294 1.5294 1.6654 1.6654 2.0032 2.0032 2.4098 2.4098 3.1549 3.1549 3.3122 3.3122 3.4912 3.4912 3.8116 3.8116 4.0645 4.0645 4.4476 4.4476 4.6178 4.6178 4.9697 4.9697 5.3377 5.3377 5.4633 5.4633 7.2421 7.2421 7.9591 7.9591 8.1275 8.1275 9.0807 9.0807 9.1037 9.1037 9.3851 9.3851 11.0152 11.0152 k = 0.2500 0.4330-0.0000 ( 6961 PWs) bands (ev): -18.4339 -18.4339 -15.1021 -15.1021 -14.9827 -14.9827 -12.6834 -12.6834 -12.3148 -12.3148 -11.7192 -11.7192 -11.2786 -11.2786 -10.9769 -10.9769 -10.4889 -10.4889 -5.0651 -5.0651 -3.7677 -3.7677 -3.6930 -3.6930 -3.2929 -3.2929 -3.0903 -3.0903 -0.6186 -0.6186 -0.2997 -0.2997 -0.1596 -0.1596 0.1014 0.1014 0.6506 0.6506 1.0439 1.0439 1.2460 1.2460 1.3766 1.3766 1.5095 1.5095 1.6687 1.6687 2.0347 2.0347 2.4634 2.4634 3.1234 3.1234 3.2846 3.2846 3.4489 3.4489 3.8368 3.8368 4.0785 4.0785 4.4664 4.4664 4.6652 4.6652 4.9747 4.9747 5.3271 5.3271 5.4626 5.4626 7.1920 7.1920 7.9988 7.9988 8.1540 8.1540 9.0766 9.0766 9.1012 9.1012 9.4139 9.4139 10.9886 10.9886 k = 0.2417 0.4186-0.0000 ( 6965 PWs) bands (ev): -18.4355 -18.4355 -15.1082 -15.1082 -14.9764 -14.9764 -12.6891 -12.6891 -12.2889 -12.2889 -11.7245 -11.7245 -11.2974 -11.2974 -10.9628 -10.9628 -10.4923 -10.4923 -5.0688 -5.0688 -3.7720 -3.7720 -3.6920 -3.6920 -3.2961 -3.2961 -3.0992 -3.0992 -0.6099 -0.6099 -0.3095 -0.3095 -0.1670 -0.1670 0.0600 0.0600 0.6619 0.6619 1.0386 1.0386 1.2549 1.2549 1.3878 1.3878 1.4931 1.4931 1.6729 1.6729 2.0660 2.0660 2.5193 2.5193 3.0924 3.0924 3.2551 3.2551 3.4083 3.4083 3.8636 3.8636 4.0939 4.0939 4.4845 4.4845 4.7122 4.7122 4.9802 4.9802 5.3160 5.3160 5.4617 5.4617 7.1412 7.1412 8.0388 8.0388 8.1828 8.1828 9.0732 9.0732 9.0993 9.0993 9.4437 9.4437 10.9616 10.9616 k = 0.2333 0.4041-0.0000 ( 6949 PWs) bands (ev): -18.4372 -18.4372 -15.1143 -15.1143 -14.9701 -14.9701 -12.6934 -12.6934 -12.2628 -12.2628 -11.7298 -11.7298 -11.3163 -11.3163 -10.9488 -10.9488 -10.4964 -10.4964 -5.0729 -5.0729 -3.7766 -3.7766 -3.6908 -3.6908 -3.2995 -3.2995 -3.1095 -3.1095 -0.6006 -0.6006 -0.3193 -0.3193 -0.1764 -0.1764 0.0186 0.0186 0.6733 0.6733 1.0334 1.0334 1.2649 1.2649 1.3932 1.3932 1.4832 1.4832 1.6782 1.6782 2.0970 2.0970 2.5761 2.5761 3.0618 3.0618 3.2240 3.2240 3.3723 3.3723 3.8913 3.8913 4.1102 4.1102 4.5017 4.5017 4.7584 4.7584 4.9863 4.9863 5.3044 5.3044 5.4605 5.4605 7.0897 7.0897 8.0788 8.0788 8.2139 8.2139 9.0706 9.0706 9.0978 9.0978 9.4747 9.4747 10.9342 10.9342 k = 0.2250 0.3897-0.0000 ( 6961 PWs) bands (ev): -18.4390 -18.4390 -15.1204 -15.1204 -14.9639 -14.9639 -12.6964 -12.6964 -12.2365 -12.2365 -11.7350 -11.7350 -11.3352 -11.3352 -10.9350 -10.9350 -10.5011 -10.5011 -5.0772 -5.0772 -3.7815 -3.7815 -3.6896 -3.6896 -3.3031 -3.3031 -3.1210 -3.1210 -0.5908 -0.5908 -0.3293 -0.3293 -0.1878 -0.1878 -0.0225 -0.0225 0.6848 0.6848 1.0281 1.0281 1.2758 1.2758 1.3892 1.3892 1.4834 1.4834 1.6851 1.6851 2.1276 2.1276 2.6314 2.6314 3.0320 3.0320 3.1913 3.1913 3.3432 3.3432 3.9193 3.9193 4.1271 4.1271 4.5181 4.5181 4.8031 4.8031 4.9929 4.9929 5.2927 5.2927 5.4592 5.4592 7.0378 7.0378 8.1189 8.1189 8.2473 8.2473 9.0687 9.0687 9.0969 9.0969 9.5067 9.5067 10.9063 10.9063 k = 0.2167 0.3753-0.0000 ( 6957 PWs) bands (ev): -18.4410 -18.4410 -15.1264 -15.1264 -14.9577 -14.9577 -12.6982 -12.6982 -12.2101 -12.2101 -11.7402 -11.7402 -11.3540 -11.3540 -10.9213 -10.9213 -10.5065 -10.5065 -5.0817 -5.0817 -3.7866 -3.7866 -3.6881 -3.6881 -3.3069 -3.3069 -3.1337 -3.1337 -0.5805 -0.5805 -0.3397 -0.3397 -0.2007 -0.2007 -0.0629 -0.0629 0.6964 0.6964 1.0228 1.0228 1.2870 1.2870 1.3768 1.3768 1.4925 1.4925 1.6941 1.6941 2.1578 2.1578 2.6823 2.6823 3.0035 3.0035 3.1575 3.1575 3.3235 3.3235 3.9473 3.9473 4.1444 4.1444 4.5336 4.5336 4.8458 4.8458 4.9999 4.9999 5.2813 5.2813 5.4576 5.4576 6.9856 6.9856 8.1590 8.1590 8.2828 8.2828 9.0675 9.0675 9.0965 9.0965 9.5397 9.5397 10.8778 10.8778 k = 0.2083 0.3608-0.0000 ( 6953 PWs) bands (ev): -18.4431 -18.4431 -15.1323 -15.1323 -14.9516 -14.9516 -12.6989 -12.6989 -12.1836 -12.1836 -11.7451 -11.7451 -11.3726 -11.3726 -10.9079 -10.9079 -10.5127 -10.5127 -5.0866 -5.0866 -3.7918 -3.7918 -3.6866 -3.6866 -3.3111 -3.3111 -3.1474 -3.1474 -0.5697 -0.5697 -0.3507 -0.3507 -0.2151 -0.2151 -0.1022 -0.1022 0.7079 0.7079 1.0173 1.0173 1.2975 1.2975 1.3606 1.3606 1.5062 1.5062 1.7060 1.7060 2.1875 2.1875 2.7249 2.7249 2.9776 2.9776 3.1232 3.1232 3.3154 3.3154 3.9751 3.9751 4.1622 4.1622 4.5482 4.5482 4.8857 4.8857 5.0070 5.0070 5.2708 5.2708 5.4559 5.4559 6.9331 6.9331 8.1990 8.1990 8.3205 8.3205 9.0672 9.0672 9.0968 9.0968 9.5736 9.5736 10.8489 10.8489 k = 0.2000 0.3464-0.0000 ( 6963 PWs) bands (ev): -18.4452 -18.4452 -15.1382 -15.1382 -14.9456 -14.9456 -12.6984 -12.6984 -12.1572 -12.1572 -11.7498 -11.7498 -11.3911 -11.3911 -10.8949 -10.8949 -10.5195 -10.5195 -5.0916 -5.0916 -3.7972 -3.7972 -3.6850 -3.6850 -3.3155 -3.3155 -3.1620 -3.1620 -0.5587 -0.5587 -0.3629 -0.3629 -0.2306 -0.2306 -0.1396 -0.1396 0.7194 0.7194 1.0117 1.0117 1.3035 1.3035 1.3466 1.3466 1.5211 1.5211 1.7220 1.7220 2.2167 2.2167 2.7541 2.7541 2.9564 2.9564 3.0892 3.0892 3.3208 3.3208 4.0025 4.0025 4.1802 4.1802 4.5618 4.5618 4.9220 4.9220 5.0140 5.0140 5.2620 5.2620 5.4541 5.4541 6.8805 6.8805 8.2388 8.2388 8.3601 8.3601 9.0676 9.0676 9.0978 9.0978 9.6083 9.6083 10.8196 10.8196 k = 0.1917 0.3320-0.0000 ( 6965 PWs) bands (ev): -18.4475 -18.4475 -15.1439 -15.1439 -14.9397 -14.9397 -12.6970 -12.6970 -12.1310 -12.1310 -11.7542 -11.7542 -11.4093 -11.4093 -10.8821 -10.8821 -10.5270 -10.5270 -5.0969 -5.0969 -3.8027 -3.8027 -3.6833 -3.6833 -3.3203 -3.3203 -3.1771 -3.1771 -0.5475 -0.5475 -0.3766 -0.3766 -0.2469 -0.2469 -0.1746 -0.1746 0.7304 0.7304 1.0059 1.0059 1.2960 1.2960 1.3447 1.3447 1.5349 1.5349 1.7430 1.7430 2.2453 2.2453 2.7659 2.7659 2.9418 2.9418 3.0567 3.0567 3.3412 3.3412 4.0296 4.0296 4.1986 4.1986 4.5745 4.5745 4.9536 4.9536 5.0208 5.0208 5.2558 5.2558 5.4522 5.4522 6.8279 6.8279 8.2783 8.2783 8.4015 8.4015 9.0688 9.0688 9.0994 9.0994 9.6438 9.6438 10.7899 10.7899 k = 0.1833 0.3175-0.0000 ( 6959 PWs) bands (ev): -18.4499 -18.4499 -15.1495 -15.1495 -14.9339 -14.9339 -12.6946 -12.6946 -12.1049 -12.1049 -11.7581 -11.7581 -11.4271 -11.4271 -10.8698 -10.8698 -10.5353 -10.5353 -5.1024 -5.1024 -3.8083 -3.8083 -3.6815 -3.6815 -3.3255 -3.3255 -3.1925 -3.1925 -0.5362 -0.5362 -0.3927 -0.3927 -0.2638 -0.2638 -0.2062 -0.2062 0.7410 0.7410 0.9998 0.9998 1.2769 1.2769 1.3536 1.3536 1.5465 1.5465 1.7697 1.7697 2.2732 2.2732 2.7606 2.7606 2.9319 2.9319 3.0272 3.0272 3.3760 3.3760 4.0561 4.0561 4.2174 4.2174 4.5861 4.5861 4.9783 4.9783 5.0282 5.0282 5.2534 5.2534 5.4502 5.4502 6.7754 6.7754 8.3175 8.3175 8.4447 8.4447 9.0706 9.0706 9.1020 9.1020 9.6799 9.6799 10.7600 10.7600 k = 0.1750 0.3031-0.0000 ( 6955 PWs) bands (ev): -18.4524 -18.4524 -15.1549 -15.1549 -14.9282 -14.9282 -12.6914 -12.6914 -12.0790 -12.0790 -11.7616 -11.7616 -11.4446 -11.4446 -10.8578 -10.8578 -10.5441 -10.5441 -5.1080 -5.1080 -3.8139 -3.8139 -3.6797 -3.6797 -3.3313 -3.3313 -3.2080 -3.2080 -0.5250 -0.5250 -0.4115 -0.4115 -0.2811 -0.2811 -0.2337 -0.2337 0.7510 0.7510 0.9935 0.9935 1.2537 1.2537 1.3660 1.3660 1.5552 1.5552 1.8024 1.8024 2.3004 2.3004 2.7436 2.7436 2.9212 2.9212 3.0032 3.0032 3.4233 3.4233 4.0821 4.0821 4.2365 4.2365 4.5966 4.5966 4.9920 4.9920 5.0393 5.0393 5.2557 5.2557 5.4484 5.4484 6.7230 6.7230 8.3564 8.3564 8.4894 8.4894 9.0730 9.0730 9.1054 9.1054 9.7166 9.7166 10.7298 10.7298 k = 0.1667 0.2887-0.0000 ( 6947 PWs) bands (ev): -18.4549 -18.4549 -15.1603 -15.1603 -14.9227 -14.9227 -12.6875 -12.6875 -12.0535 -12.0535 -11.7647 -11.7647 -11.4616 -11.4616 -10.8463 -10.8463 -10.5536 -10.5536 -5.1138 -5.1138 -3.8196 -3.8196 -3.6780 -3.6780 -3.3377 -3.3377 -3.2231 -3.2231 -0.5142 -0.5142 -0.4334 -0.4334 -0.2983 -0.2983 -0.2565 -0.2565 0.7603 0.7603 0.9870 0.9870 1.2288 1.2288 1.3792 1.3792 1.5611 1.5611 1.8406 1.8406 2.3268 2.3268 2.7205 2.7205 2.9045 2.9045 2.9869 2.9869 3.4801 3.4801 4.1075 4.1075 4.2559 4.2559 4.6060 4.6060 4.9930 4.9930 5.0553 5.0553 5.2627 5.2627 5.4467 5.4467 6.6709 6.6709 8.3948 8.3948 8.5354 8.5354 9.0760 9.0760 9.1098 9.1098 9.7537 9.7537 10.6996 10.6996 k = 0.1583 0.2742-0.0000 ( 6957 PWs) bands (ev): -18.4574 -18.4574 -15.1654 -15.1654 -14.9174 -14.9174 -12.6830 -12.6830 -12.0285 -12.0285 -11.7672 -11.7672 -11.4781 -11.4781 -10.8353 -10.8353 -10.5636 -10.5636 -5.1197 -5.1197 -3.8251 -3.8251 -3.6764 -3.6764 -3.3448 -3.3448 -3.2376 -3.2376 -0.5048 -0.5048 -0.4573 -0.4573 -0.3152 -0.3152 -0.2748 -0.2748 0.7688 0.7688 0.9802 0.9802 1.2032 1.2032 1.3924 1.3924 1.5644 1.5644 1.8837 1.8837 2.3523 2.3523 2.6950 2.6950 2.8818 2.8818 2.9775 2.9775 3.5433 3.5433 4.1322 4.1322 4.2757 4.2757 4.6143 4.6143 4.9847 4.9847 5.0733 5.0733 5.2738 5.2738 5.4452 5.4452 6.6192 6.6192 8.4326 8.4326 8.5826 8.5826 9.0794 9.0794 9.1154 9.1154 9.7911 9.7911 10.6692 10.6692 k = 0.1500 0.2598-0.0000 ( 6961 PWs) bands (ev): -18.4599 -18.4599 -15.1703 -15.1703 -14.9122 -14.9122 -12.6779 -12.6779 -12.0039 -12.0039 -11.7691 -11.7691 -11.4941 -11.4941 -10.8248 -10.8248 -10.5742 -10.5742 -5.1256 -5.1256 -3.8307 -3.8307 -3.6750 -3.6750 -3.3526 -3.3526 -3.2511 -3.2511 -0.5026 -0.5026 -0.4767 -0.4767 -0.3315 -0.3315 -0.2891 -0.2891 0.7765 0.7765 0.9732 0.9732 1.1772 1.1772 1.4054 1.4054 1.5656 1.5656 1.9308 1.9308 2.3768 2.3768 2.6695 2.6695 2.8560 2.8560 2.9723 2.9723 3.6106 3.6106 4.1562 4.1562 4.2958 4.2958 4.6214 4.6214 4.9702 4.9702 5.0916 5.0916 5.2876 5.2876 5.4440 5.4440 6.5679 6.5679 8.4698 8.4698 8.6307 8.6307 9.0832 9.0832 9.1220 9.1220 9.8287 9.8287 10.6388 10.6389 k = 0.1417 0.2454-0.0000 ( 6961 PWs) bands (ev): -18.4625 -18.4625 -15.1751 -15.1751 -14.9072 -14.9072 -12.6725 -12.6725 -11.9800 -11.9800 -11.7704 -11.7704 -11.5095 -11.5095 -10.8149 -10.8149 -10.5851 -10.5851 -5.1317 -5.1317 -3.8361 -3.8361 -3.6737 -3.6737 -3.3612 -3.3612 -3.2634 -3.2634 -0.5226 -0.5226 -0.4761 -0.4761 -0.3468 -0.3468 -0.3003 -0.3003 0.7833 0.7833 0.9661 0.9661 1.1512 1.1512 1.4177 1.4177 1.5649 1.5649 1.9809 1.9809 2.4002 2.4002 2.6450 2.6450 2.8297 2.8297 2.9693 2.9693 3.6798 3.6798 4.1795 4.1795 4.3162 4.3162 4.6274 4.6274 4.9512 4.9512 5.1100 5.1100 5.3026 5.3026 5.4432 5.4432 6.5171 6.5171 8.5063 8.5063 8.6795 8.6795 9.0873 9.0873 9.1298 9.1298 9.8662 9.8662 10.6085 10.6085 k = 0.1333 0.2309-0.0000 ( 6961 PWs) bands (ev): -18.4650 -18.4650 -15.1797 -15.1797 -14.9025 -14.9025 -12.6667 -12.6667 -11.9567 -11.9567 -11.7712 -11.7712 -11.5243 -11.5243 -10.8055 -10.8055 -10.5964 -10.5964 -5.1377 -5.1377 -3.8414 -3.8414 -3.6728 -3.6728 -3.3704 -3.3704 -3.2744 -3.2744 -0.5508 -0.5508 -0.4690 -0.4690 -0.3607 -0.3607 -0.3091 -0.3091 0.7894 0.7894 0.9589 0.9589 1.1254 1.1254 1.4293 1.4293 1.5629 1.5629 2.0331 2.0331 2.4222 2.4222 2.6224 2.6224 2.8042 2.8042 2.9677 2.9677 3.7496 3.7496 4.2021 4.2021 4.3369 4.3369 4.6322 4.6322 4.9286 4.9286 5.1285 5.1285 5.3178 5.3178 5.4429 5.4429 6.4671 6.4671 8.5418 8.5418 8.7288 8.7288 9.0918 9.0918 9.1387 9.1387 9.9036 9.9036 10.5781 10.5781 k = 0.1250 0.2165-0.0000 ( 6957 PWs) bands (ev): -18.4675 -18.4675 -15.1840 -15.1840 -14.8979 -14.8979 -12.6607 -12.6607 -11.9342 -11.9342 -11.7713 -11.7713 -11.5384 -11.5384 -10.7967 -10.7967 -10.6080 -10.6080 -5.1437 -5.1437 -3.8466 -3.8466 -3.6721 -3.6721 -3.3801 -3.3801 -3.2840 -3.2840 -0.5802 -0.5802 -0.4624 -0.4624 -0.3726 -0.3726 -0.3161 -0.3161 0.7947 0.7947 0.9517 0.9517 1.0999 1.0999 1.4400 1.4400 1.5597 1.5597 2.0864 2.0864 2.4425 2.4425 2.6021 2.6021 2.7808 2.7808 2.9673 2.9673 3.8189 3.8189 4.2239 4.2239 4.3577 4.3577 4.6360 4.6360 4.9034 4.9034 5.1473 5.1473 5.3321 5.3321 5.4429 5.4429 6.4178 6.4178 8.5764 8.5764 8.7783 8.7783 9.0966 9.0966 9.1487 9.1487 9.9405 9.9405 10.5478 10.5478 k = 0.1167 0.2021-0.0000 ( 6961 PWs) bands (ev): -18.4699 -18.4699 -15.1881 -15.1881 -14.8936 -14.8936 -12.6546 -12.6546 -11.9126 -11.9126 -11.7709 -11.7709 -11.5519 -11.5519 -10.7885 -10.7885 -10.6197 -10.6197 -5.1497 -5.1497 -3.8516 -3.8516 -3.6719 -3.6719 -3.3900 -3.3900 -3.2922 -3.2922 -0.6093 -0.6093 -0.4581 -0.4581 -0.3815 -0.3815 -0.3216 -0.3216 0.7991 0.7991 0.9447 0.9447 1.0752 1.0752 1.4496 1.4496 1.5555 1.5555 2.1398 2.1398 2.4608 2.4608 2.5846 2.5846 2.7601 2.7601 2.9678 2.9678 3.8866 3.8866 4.2449 4.2449 4.3785 4.3785 4.6387 4.6387 4.8760 4.8760 5.1665 5.1665 5.3452 5.3452 5.4435 5.4435 6.3693 6.3693 8.6098 8.6098 8.8276 8.8276 9.1018 9.1018 9.1596 9.1596 9.9768 9.9768 10.5175 10.5175 k = 0.1083 0.1876-0.0000 ( 6957 PWs) bands (ev): -18.4722 -18.4722 -15.1920 -15.1920 -14.8895 -14.8895 -12.6486 -12.6486 -11.8918 -11.8918 -11.7699 -11.7699 -11.5646 -11.5646 -10.7810 -10.7810 -10.6314 -10.6314 -5.1556 -5.1556 -3.8564 -3.8564 -3.6720 -3.6720 -3.3998 -3.3998 -3.2993 -3.2993 -0.6375 -0.6375 -0.4573 -0.4573 -0.3865 -0.3865 -0.3260 -0.3260 0.8029 0.8029 0.9377 0.9377 1.0513 1.0513 1.4582 1.4582 1.5506 1.5506 2.1923 2.1923 2.4764 2.4764 2.5700 2.5700 2.7434 2.7434 2.9693 2.9693 3.9520 3.9520 4.2652 4.2652 4.3992 4.3992 4.6405 4.6405 4.8470 4.8470 5.1862 5.1862 5.3565 5.3565 5.4444 5.4444 6.3218 6.3218 8.6420 8.6420 8.8763 8.8763 9.1074 9.1074 9.1713 9.1713 10.0121 10.0121 10.4873 10.4874 k = 0.1000 0.1732-0.0000 ( 6939 PWs) bands (ev): -18.4745 -18.4745 -15.1956 -15.1956 -14.8857 -14.8857 -12.6426 -12.6426 -11.8721 -11.8721 -11.7684 -11.7684 -11.5766 -11.5766 -10.7741 -10.7741 -10.6430 -10.6430 -5.1613 -5.1613 -3.8610 -3.8610 -3.6726 -3.6726 -3.4093 -3.4093 -3.3054 -3.3054 -0.6644 -0.6644 -0.4602 -0.4602 -0.3873 -0.3873 -0.3295 -0.3295 0.8058 0.8058 0.9310 0.9310 1.0286 1.0286 1.4656 1.4656 1.5451 1.5451 2.2426 2.2426 2.4884 2.4884 2.5585 2.5585 2.7315 2.7315 2.9719 2.9719 4.0144 4.0144 4.2848 4.2848 4.4196 4.4196 4.6413 4.6413 4.8169 4.8169 5.2065 5.2065 5.3662 5.3662 5.4456 5.4456 6.2755 6.2755 8.6727 8.6727 8.9239 8.9239 9.1134 9.1134 9.1837 9.1837 10.0461 10.0461 10.4574 10.4574 k = 0.0917 0.1588-0.0000 ( 6921 PWs) bands (ev): -18.4766 -18.4766 -15.1990 -15.1990 -14.8822 -14.8822 -12.6368 -12.6368 -11.8535 -11.8535 -11.7664 -11.7664 -11.5878 -11.5878 -10.7680 -10.7680 -10.6543 -10.6543 -5.1668 -5.1668 -3.8654 -3.8654 -3.6735 -3.6735 -3.4183 -3.4183 -3.3106 -3.3106 -0.6898 -0.6898 -0.4661 -0.4661 -0.3849 -0.3849 -0.3323 -0.3323 0.8080 0.8080 0.9246 0.9246 1.0072 1.0072 1.4720 1.4720 1.5392 1.5392 2.2898 2.2898 2.4959 2.4959 2.5501 2.5501 2.7258 2.7258 2.9755 2.9755 4.0731 4.0731 4.3038 4.3038 4.4394 4.4394 4.6414 4.6414 4.7862 4.7862 5.2272 5.2272 5.3744 5.3744 5.4470 5.4470 6.2304 6.2304 8.7019 8.7019 8.9699 8.9699 9.1200 9.1200 9.1966 9.1966 10.0784 10.0784 10.4277 10.4277 k = 0.0833 0.1443-0.0000 ( 6921 PWs) bands (ev): -18.4786 -18.4786 -15.2021 -15.2021 -14.8789 -14.8789 -12.6313 -12.6313 -11.8361 -11.8361 -11.7641 -11.7641 -11.5983 -11.5983 -10.7625 -10.7625 -10.6651 -10.6651 -5.1721 -5.1721 -3.8694 -3.8694 -3.6747 -3.6747 -3.4265 -3.4265 -3.3149 -3.3149 -0.7134 -0.7134 -0.4734 -0.4734 -0.3806 -0.3806 -0.3344 -0.3344 0.8095 0.8095 0.9185 0.9185 0.9874 0.9874 1.4772 1.4772 1.5331 1.5331 2.3327 2.3327 2.4991 2.4991 2.5439 2.5439 2.7269 2.7269 2.9805 2.9805 4.1275 4.1275 4.3223 4.3223 4.4582 4.4582 4.6407 4.6407 4.7554 4.7554 5.2482 5.2482 5.3812 5.3812 5.4483 5.4483 6.1867 6.1867 8.7294 8.7294 9.0134 9.0134 9.1277 9.1277 9.2097 9.2097 10.1085 10.1085 10.3986 10.3986 k = 0.0750 0.1299-0.0000 ( 6921 PWs) bands (ev): -18.4805 -18.4805 -15.2049 -15.2049 -14.8759 -14.8759 -12.6261 -12.6261 -11.8199 -11.8199 -11.7615 -11.7615 -11.6079 -11.6079 -10.7578 -10.7578 -10.6754 -10.6754 -5.1770 -5.1770 -3.8732 -3.8732 -3.6762 -3.6762 -3.4340 -3.4340 -3.3186 -3.3186 -0.7351 -0.7351 -0.4813 -0.4813 -0.3756 -0.3756 -0.3361 -0.3361 0.8103 0.8103 0.9128 0.9128 0.9695 0.9695 1.4815 1.4815 1.5269 1.5269 2.3707 2.3707 2.4994 2.4994 2.5384 2.5384 2.7345 2.7345 2.9868 2.9868 4.1771 4.1771 4.3404 4.3404 4.4755 4.4755 4.6394 4.6394 4.7251 4.7251 5.2691 5.2691 5.3873 5.3873 5.4494 5.4494 6.1446 6.1446 8.7549 8.7549 9.0527 9.0527 9.1373 9.1373 9.2230 9.2230 10.1359 10.1359 10.3703 10.3703 k = 0.0667 0.1155-0.0000 ( 6919 PWs) bands (ev): -18.4822 -18.4822 -15.2075 -15.2075 -14.8732 -14.8732 -12.6213 -12.6213 -11.8050 -11.8050 -11.7588 -11.7588 -11.6168 -11.6168 -10.7540 -10.7540 -10.6847 -10.6847 -5.1816 -5.1816 -3.8767 -3.8767 -3.6779 -3.6779 -3.4406 -3.4406 -3.3217 -3.3217 -0.7549 -0.7549 -0.4890 -0.4890 -0.3705 -0.3705 -0.3372 -0.3372 0.8104 0.8104 0.9073 0.9073 0.9537 0.9537 1.4849 1.4849 1.5209 1.5209 2.4032 2.4032 2.4984 2.4984 2.5327 2.5327 2.7473 2.7473 2.9949 2.9949 4.2213 4.2213 4.3584 4.3584 4.4907 4.4907 4.6377 4.6377 4.6962 4.6962 5.2894 5.2894 5.3929 5.3929 5.4503 5.4503 6.1044 6.1044 8.7785 8.7785 9.0853 9.0853 9.1511 9.1511 9.2361 9.2361 10.1601 10.1601 10.3431 10.3431 k = 0.0583 0.1010-0.0000 ( 6915 PWs) bands (ev): -18.4838 -18.4838 -15.2098 -15.2098 -14.8708 -14.8708 -12.6170 -12.6170 -11.7916 -11.7916 -11.7560 -11.7560 -11.6248 -11.6248 -10.7511 -10.7511 -10.6930 -10.6930 -5.1858 -5.1858 -3.8799 -3.8799 -3.6797 -3.6797 -3.4464 -3.4464 -3.3242 -3.3242 -0.7724 -0.7724 -0.4963 -0.4963 -0.3658 -0.3658 -0.3379 -0.3379 0.8099 0.8099 0.9020 0.9020 0.9403 0.9403 1.4875 1.4875 1.5151 1.5151 2.4302 2.4302 2.4972 2.4972 2.5265 2.5265 2.7629 2.7629 3.0047 3.0047 4.2596 4.2596 4.3765 4.3765 4.5028 4.5028 4.6357 4.6357 4.6699 4.6699 5.3084 5.3084 5.3989 5.3989 5.4510 5.4510 6.0663 6.0663 8.7998 8.7998 9.1079 9.1079 9.1715 9.1715 9.2489 9.2489 10.1806 10.1806 10.3174 10.3174 k = 0.0500 0.0866-0.0000 ( 6905 PWs) bands (ev): -18.4851 -18.4851 -15.2117 -15.2117 -14.8687 -14.8687 -12.6131 -12.6131 -11.7796 -11.7796 -11.7532 -11.7532 -11.6320 -11.6320 -10.7491 -10.7491 -10.7000 -10.7000 -5.1896 -5.1896 -3.8826 -3.8826 -3.6815 -3.6815 -3.4513 -3.4513 -3.3262 -3.3262 -0.7878 -0.7878 -0.5028 -0.5028 -0.3617 -0.3617 -0.3381 -0.3381 0.8089 0.8089 0.8967 0.8967 0.9296 0.9296 1.4894 1.4894 1.5097 1.5097 2.4518 2.4518 2.4963 2.4963 2.5204 2.5204 2.7792 2.7792 3.0161 3.0161 4.2918 4.2918 4.3946 4.3946 4.5104 4.5104 4.6334 4.6334 4.6480 4.6480 5.3250 5.3250 5.4059 5.4059 5.4516 5.4516 6.0309 6.0309 8.8187 8.8187 9.1215 9.1215 9.1969 9.1969 9.2610 9.2610 10.1967 10.1967 10.2938 10.2938 k = 0.0417 0.0722-0.0000 ( 6895 PWs) bands (ev): -18.4863 -18.4863 -15.2134 -15.2134 -14.8669 -14.8669 -12.6098 -12.6098 -11.7691 -11.7691 -11.7506 -11.7506 -11.6383 -11.6383 -10.7483 -10.7483 -10.7054 -10.7054 -5.1928 -5.1928 -3.8850 -3.8850 -3.6832 -3.6832 -3.4554 -3.4554 -3.3278 -3.3278 -0.8009 -0.8009 -0.5084 -0.5084 -0.3584 -0.3584 -0.3379 -0.3379 0.8076 0.8076 0.8914 0.8914 0.9215 0.9215 1.4908 1.4908 1.5049 1.5049 2.4685 2.4685 2.4959 2.4959 2.5150 2.5150 2.7943 2.7943 3.0287 3.0287 4.3180 4.3180 4.4124 4.4124 4.5121 4.5121 4.6290 4.6290 4.6342 4.6342 5.3382 5.3382 5.4144 5.4144 5.4524 5.4524 5.9985 5.9985 8.8350 8.8350 9.1301 9.1301 9.2224 9.2224 9.2724 9.2724 10.2083 10.2083 10.2726 10.2726 k = 0.0333 0.0577-0.0000 ( 6907 PWs) bands (ev): -18.4873 -18.4873 -15.2148 -15.2148 -14.8655 -14.8655 -12.6071 -12.6071 -11.7603 -11.7603 -11.7483 -11.7483 -11.6437 -11.6437 -10.7483 -10.7483 -10.7093 -10.7093 -5.1956 -5.1956 -3.8870 -3.8870 -3.6847 -3.6847 -3.4588 -3.4588 -3.3291 -3.3291 -0.8117 -0.8117 -0.5131 -0.5131 -0.3559 -0.3559 -0.3374 -0.3374 0.8061 0.8061 0.8863 0.8863 0.9158 0.9158 1.4917 1.4917 1.5007 1.5007 2.4803 2.4803 2.4959 2.4959 2.5112 2.5112 2.8071 2.8071 3.0417 3.0417 4.3388 4.3388 4.4291 4.4291 4.5074 4.5074 4.6208 4.6208 4.6313 4.6313 5.3476 5.3476 5.4238 5.4238 5.4536 5.4536 5.9700 5.9700 8.8486 8.8486 9.1361 9.1361 9.2449 9.2449 9.2829 9.2829 10.2154 10.2154 10.2545 10.2545 k = 0.0250 0.0433-0.0000 ( 6919 PWs) bands (ev): -18.4880 -18.4880 -15.2159 -15.2159 -14.8643 -14.8643 -12.6049 -12.6049 -11.7532 -11.7532 -11.7464 -11.7464 -11.6480 -11.6480 -10.7490 -10.7490 -10.7118 -10.7118 -5.1977 -5.1977 -3.8886 -3.8886 -3.6859 -3.6859 -3.4613 -3.4613 -3.3300 -3.3300 -0.8202 -0.8202 -0.5168 -0.5168 -0.3543 -0.3543 -0.3367 -0.3367 0.8047 0.8047 0.8820 0.8820 0.9121 0.9121 1.4923 1.4923 1.4974 1.4974 2.4872 2.4872 2.4959 2.4959 2.5100 2.5100 2.8170 2.8170 3.0537 3.0537 4.3552 4.3552 4.4434 4.4434 4.4984 4.4984 4.6163 4.6163 4.6304 4.6304 5.3535 5.3535 5.4323 5.4323 5.4563 5.4563 5.9462 5.9462 8.8593 8.8593 9.1403 9.1403 9.2625 9.2625 9.2925 9.2925 10.2187 10.2187 10.2398 10.2398 k = 0.0167 0.0289-0.0000 ( 6921 PWs) bands (ev): -18.4886 -18.4886 -15.2167 -15.2167 -14.8635 -14.8635 -12.6034 -12.6034 -11.7480 -11.7480 -11.7449 -11.7449 -11.6513 -11.6513 -10.7500 -10.7500 -10.7132 -10.7132 -5.1993 -5.1993 -3.8897 -3.8897 -3.6868 -3.6868 -3.4632 -3.4632 -3.3306 -3.3306 -0.8262 -0.8262 -0.5195 -0.5195 -0.3532 -0.3532 -0.3359 -0.3359 0.8034 0.8034 0.8786 0.8786 0.9097 0.9097 1.4927 1.4927 1.4950 1.4950 2.4900 2.4900 2.4953 2.4953 2.5115 2.5115 2.8239 2.8239 3.0635 3.0635 4.3674 4.3674 4.4543 4.4543 4.4886 4.4886 4.6143 4.6143 4.6304 4.6304 5.3569 5.3569 5.4378 5.4378 5.4605 5.4605 5.9281 5.9281 8.8671 8.8671 9.1433 9.1433 9.2744 9.2744 9.3008 9.3008 10.2194 10.2194 10.2293 10.2293 k = 0.0083 0.0144-0.0000 ( 6921 PWs) bands (ev): -18.4889 -18.4889 -15.2171 -15.2171 -14.8630 -14.8630 -12.6025 -12.6025 -11.7448 -11.7448 -11.7440 -11.7440 -11.6533 -11.6533 -10.7507 -10.7507 -10.7139 -10.7139 -5.2002 -5.2002 -3.8904 -3.8904 -3.6874 -3.6874 -3.4643 -3.4643 -3.3310 -3.3310 -0.8299 -0.8299 -0.5211 -0.5211 -0.3527 -0.3527 -0.3354 -0.3354 0.8026 0.8026 0.8765 0.8765 0.9084 0.9084 1.4928 1.4928 1.4935 1.4935 2.4908 2.4908 2.4948 2.4948 2.5135 2.5135 2.8279 2.8279 3.0699 3.0699 4.3754 4.3754 4.4608 4.4608 4.4812 4.4812 4.6135 4.6135 4.6307 4.6307 5.3587 5.3587 5.4403 5.4403 5.4646 5.4646 5.9166 5.9166 8.8718 8.8718 9.1450 9.1450 9.2810 9.2810 9.3066 9.3066 10.2184 10.2184 10.2235 10.2235 k = 0.0000 0.0000 0.0000 ( 6921 PWs) bands (ev): -18.4890 -18.4890 -15.2173 -15.2173 -14.8628 -14.8628 -12.6021 -12.6021 -11.7439 -11.7439 -11.7436 -11.7436 -11.6540 -11.6540 -10.7510 -10.7510 -10.7141 -10.7141 -5.2005 -5.2005 -3.8907 -3.8907 -3.6876 -3.6876 -3.4646 -3.4646 -3.3311 -3.3311 -0.8311 -0.8311 -0.5216 -0.5216 -0.3525 -0.3525 -0.3352 -0.3352 0.8024 0.8024 0.8758 0.8758 0.9080 0.9080 1.4928 1.4928 1.4931 1.4931 2.4909 2.4909 2.4947 2.4947 2.5142 2.5142 2.8292 2.8292 3.0721 3.0721 4.3782 4.3782 4.4628 4.4628 4.4786 4.4786 4.6132 4.6132 4.6309 4.6309 5.3592 5.3592 5.4410 5.4410 5.4663 5.4663 5.9128 5.9128 8.8733 8.8733 9.1456 9.1456 9.2831 9.2831 9.3087 9.3087 10.2174 10.2174 10.2221 10.2221 k = 0.0000 0.0000 0.0000 ( 6921 PWs) bands (ev): -18.4890 -18.4890 -15.2173 -15.2173 -14.8628 -14.8628 -12.6021 -12.6021 -11.7439 -11.7439 -11.7436 -11.7436 -11.6540 -11.6540 -10.7510 -10.7510 -10.7141 -10.7141 -5.2005 -5.2005 -3.8907 -3.8907 -3.6876 -3.6876 -3.4646 -3.4646 -3.3311 -3.3311 -0.8311 -0.8311 -0.5216 -0.5216 -0.3525 -0.3525 -0.3352 -0.3352 0.8024 0.8024 0.8758 0.8758 0.9080 0.9080 1.4928 1.4928 1.4931 1.4931 2.4909 2.4909 2.4947 2.4947 2.5142 2.5142 2.8292 2.8292 3.0721 3.0721 4.3782 4.3782 4.4628 4.4628 4.4786 4.4786 4.6132 4.6132 4.6309 4.6309 5.3592 5.3592 5.4410 5.4410 5.4663 5.4663 5.9128 5.9128 8.8733 8.8733 9.1456 9.1456 9.2831 9.2831 9.3087 9.3087 10.2174 10.2174 10.2221 10.2221 k = 0.0000 0.0000 0.0162 ( 6921 PWs) bands (ev): -18.4890 -18.4890 -15.2173 -15.2173 -14.8628 -14.8628 -12.6023 -12.6023 -11.7439 -11.7439 -11.7436 -11.7436 -11.6537 -11.6537 -10.7510 -10.7510 -10.7142 -10.7142 -5.2005 -5.2005 -3.8916 -3.8916 -3.6876 -3.6876 -3.4649 -3.4649 -3.3308 -3.3308 -0.8299 -0.8299 -0.5191 -0.5191 -0.3517 -0.3517 -0.3344 -0.3344 0.8014 0.8014 0.8745 0.8745 0.9066 0.9066 1.4932 1.4932 1.4937 1.4937 2.4900 2.4900 2.4937 2.4937 2.5100 2.5100 2.8295 2.8295 3.0723 3.0723 4.3789 4.3789 4.4635 4.4635 4.4796 4.4796 4.6132 4.6132 4.6309 4.6309 5.3563 5.3563 5.4375 5.4375 5.4667 5.4667 5.9238 5.9238 8.8759 8.8759 9.1409 9.1409 9.2826 9.2826 9.3081 9.3081 10.2168 10.2168 10.2215 10.2215 k = 0.0000 0.0000 0.0324 ( 6933 PWs) bands (ev): -18.4890 -18.4890 -15.2172 -15.2172 -14.8629 -14.8629 -12.6029 -12.6029 -11.7438 -11.7438 -11.7436 -11.7436 -11.6530 -11.6530 -10.7511 -10.7511 -10.7142 -10.7142 -5.2005 -5.2005 -3.8945 -3.8945 -3.6877 -3.6877 -3.4659 -3.4659 -3.3300 -3.3300 -0.8263 -0.8263 -0.5114 -0.5114 -0.3495 -0.3495 -0.3320 -0.3320 0.7985 0.7985 0.8708 0.8708 0.9025 0.9025 1.4946 1.4946 1.4954 1.4954 2.4873 2.4873 2.4907 2.4907 2.4975 2.4975 2.8305 2.8305 3.0729 3.0729 4.3809 4.3809 4.4654 4.4654 4.4824 4.4824 4.6133 4.6133 4.6310 4.6310 5.3467 5.3467 5.4298 5.4298 5.4676 5.4676 5.9551 5.9551 8.8836 8.8836 9.1269 9.1269 9.2811 9.2811 9.3064 9.3064 10.2149 10.2149 10.2198 10.2198 k = 0.0000 0.0000 0.0486 ( 6908 PWs) bands (ev): -18.4890 -18.4890 -15.2172 -15.2172 -14.8629 -14.8629 -12.6038 -12.6038 -11.7438 -11.7438 -11.7435 -11.7435 -11.6517 -11.6517 -10.7511 -10.7511 -10.7142 -10.7142 -5.2005 -5.2005 -3.8992 -3.8992 -3.6878 -3.6878 -3.4675 -3.4675 -3.3288 -3.3288 -0.8205 -0.8205 -0.4988 -0.4988 -0.3458 -0.3458 -0.3280 -0.3280 0.7939 0.7939 0.8646 0.8646 0.8957 0.8957 1.4967 1.4967 1.4980 1.4980 2.4764 2.4764 2.4830 2.4830 2.4865 2.4865 2.8319 2.8319 3.0739 3.0739 4.3843 4.3843 4.4685 4.4685 4.4871 4.4871 4.6134 4.6134 4.6312 4.6312 5.3289 5.3289 5.4229 5.4229 5.4691 5.4691 6.0029 6.0029 8.8963 8.8963 9.1040 9.1040 9.2787 9.2787 9.3037 9.3037 10.2116 10.2117 10.2169 10.2169 k = 0.0000 0.0000 0.0648 ( 6908 PWs) bands (ev): -18.4890 -18.4890 -15.2171 -15.2171 -14.8629 -14.8629 -12.6051 -12.6051 -11.7438 -11.7438 -11.7435 -11.7435 -11.6500 -11.6500 -10.7511 -10.7511 -10.7142 -10.7142 -5.2005 -5.2005 -3.9055 -3.9055 -3.6880 -3.6880 -3.4695 -3.4695 -3.3272 -3.3272 -0.8124 -0.8124 -0.4815 -0.4815 -0.3408 -0.3408 -0.3226 -0.3226 0.7875 0.7875 0.8561 0.8561 0.8865 0.8865 1.4996 1.4996 1.5015 1.5015 2.4479 2.4479 2.4772 2.4772 2.4804 2.4804 2.8338 2.8338 3.0751 3.0751 4.3888 4.3888 4.4726 4.4726 4.4934 4.4934 4.6136 4.6136 4.6315 4.6315 5.3039 5.3039 5.4196 5.4196 5.4712 5.4712 6.0631 6.0631 8.9136 8.9136 9.0726 9.0726 9.2755 9.2755 9.3000 9.3000 10.2071 10.2071 10.2128 10.2128 k = 0.0000 0.0000 0.0810 ( 6908 PWs) bands (ev): -18.4890 -18.4890 -15.2170 -15.2170 -14.8630 -14.8630 -12.6066 -12.6066 -11.7438 -11.7438 -11.7435 -11.7435 -11.6479 -11.6479 -10.7511 -10.7511 -10.7143 -10.7143 -5.2004 -5.2004 -3.9134 -3.9134 -3.6883 -3.6883 -3.4720 -3.4720 -3.3254 -3.3254 -0.8022 -0.8022 -0.4597 -0.4597 -0.3344 -0.3344 -0.3156 -0.3156 0.7798 0.7798 0.8456 0.8456 0.8752 0.8752 1.5029 1.5029 1.5055 1.5055 2.4120 2.4120 2.4704 2.4704 2.4734 2.4734 2.8359 2.8359 3.0764 3.0764 4.3945 4.3945 4.4777 4.4777 4.5012 4.5012 4.6138 4.6138 4.6319 4.6319 5.2747 5.2747 5.4196 5.4196 5.4739 5.4739 6.1328 6.1328 8.9346 8.9346 9.0342 9.0342 9.2715 9.2715 9.2954 9.2954 10.2013 10.2013 10.2076 10.2076 k = 0.0000 0.0000 0.0972 ( 6908 PWs) bands (ev): -18.4890 -18.4890 -15.2169 -15.2169 -14.8630 -14.8630 -12.6085 -12.6085 -11.7437 -11.7437 -11.7435 -11.7435 -11.6454 -11.6454 -10.7512 -10.7512 -10.7143 -10.7143 -5.2004 -5.2004 -3.9226 -3.9226 -3.6886 -3.6886 -3.4747 -3.4747 -3.3234 -3.3234 -0.7900 -0.7900 -0.4340 -0.4340 -0.3267 -0.3267 -0.3074 -0.3074 0.7708 0.7708 0.8333 0.8333 0.8619 0.8619 1.5065 1.5065 1.5099 1.5099 2.3695 2.3695 2.4629 2.4629 2.4656 2.4656 2.8380 2.8380 3.0777 3.0777 4.4010 4.4010 4.4835 4.4835 4.5103 4.5103 4.6140 4.6140 4.6323 4.6323 5.2440 5.2440 5.4219 5.4219 5.4771 5.4771 6.2097 6.2097 8.9513 8.9513 8.9970 8.9970 9.2670 9.2670 9.2902 9.2902 10.1942 10.1942 10.2012 10.2012 k = 0.0000 0.0000 0.1134 ( 6920 PWs) bands (ev): -18.4890 -18.4890 -15.2168 -15.2168 -14.8631 -14.8631 -12.6105 -12.6105 -11.7437 -11.7437 -11.7434 -11.7434 -11.6427 -11.6427 -10.7513 -10.7513 -10.7144 -10.7144 -5.2003 -5.2003 -3.9328 -3.9328 -3.6890 -3.6890 -3.4776 -3.4776 -3.3213 -3.3213 -0.7760 -0.7760 -0.4048 -0.4048 -0.3179 -0.3179 -0.2978 -0.2978 0.7611 0.7611 0.8195 0.8195 0.8470 0.8470 1.5102 1.5102 1.5144 1.5144 2.3209 2.3209 2.4549 2.4549 2.4576 2.4576 2.8400 2.8400 3.0788 3.0788 4.4084 4.4084 4.4899 4.4899 4.5205 4.5205 4.6142 4.6142 4.6327 4.6327 5.2135 5.2135 5.4257 5.4257 5.4808 5.4808 6.2923 6.2923 8.9196 8.9196 9.0055 9.0055 9.2621 9.2621 9.2844 9.2844 10.1858 10.1858 10.1937 10.1937 k = 0.0000 0.0000 0.1297 ( 6920 PWs) bands (ev): -18.4890 -18.4890 -15.2167 -15.2167 -14.8632 -14.8632 -12.6127 -12.6127 -11.7437 -11.7437 -11.7434 -11.7434 -11.6397 -11.6397 -10.7513 -10.7513 -10.7144 -10.7144 -5.2002 -5.2002 -3.9439 -3.9439 -3.6893 -3.6893 -3.4806 -3.4806 -3.3193 -3.3193 -0.7604 -0.7604 -0.3727 -0.3727 -0.3081 -0.3081 -0.2872 -0.2872 0.7511 0.7511 0.8044 0.8044 0.8308 0.8308 1.5139 1.5139 1.5188 1.5188 2.2672 2.2672 2.4468 2.4468 2.4495 2.4495 2.8418 2.8418 3.0798 3.0798 4.4162 4.4162 4.4968 4.4968 4.5314 4.5314 4.6144 4.6144 4.6332 4.6332 5.1843 5.1843 5.4306 5.4306 5.4849 5.4849 6.3796 6.3796 8.8610 8.8610 9.0387 9.0387 9.2569 9.2569 9.2782 9.2782 10.1763 10.1763 10.1851 10.1851 k = 0.0000 0.0000 0.1459 ( 6944 PWs) bands (ev): -18.4890 -18.4890 -15.2165 -15.2165 -14.8632 -14.8632 -12.6151 -12.6151 -11.7436 -11.7436 -11.7434 -11.7434 -11.6365 -11.6365 -10.7514 -10.7514 -10.7145 -10.7145 -5.2002 -5.2002 -3.9555 -3.9555 -3.6897 -3.6897 -3.4836 -3.4836 -3.3174 -3.3174 -0.7435 -0.7435 -0.3383 -0.3383 -0.2975 -0.2975 -0.2757 -0.2757 0.7411 0.7411 0.7884 0.7884 0.8137 0.8137 1.5173 1.5173 1.5228 1.5228 2.2093 2.2093 2.4390 2.4390 2.4417 2.4417 2.8433 2.8433 3.0804 3.0804 4.4245 4.4245 4.5039 4.5039 4.5428 4.5428 4.6147 4.6147 4.6337 4.6337 5.1568 5.1568 5.4362 5.4362 5.4893 5.4893 6.4707 6.4707 8.7942 8.7942 9.0781 9.0781 9.2517 9.2517 9.2718 9.2718 10.1658 10.1658 10.1757 10.1757 k = 0.0000 0.0000 0.1621 ( 6938 PWs) bands (ev): -18.4889 -18.4889 -15.2164 -15.2164 -14.8633 -14.8633 -12.6175 -12.6175 -11.7436 -11.7436 -11.7433 -11.7433 -11.6332 -11.6332 -10.7514 -10.7514 -10.7146 -10.7146 -5.2001 -5.2001 -3.9674 -3.9674 -3.6901 -3.6901 -3.4865 -3.4865 -3.3156 -3.3156 -0.7255 -0.7255 -0.3027 -0.3027 -0.2861 -0.2861 -0.2635 -0.2635 0.7319 0.7319 0.7718 0.7718 0.7959 0.7959 1.5204 1.5204 1.5265 1.5265 2.1480 2.1480 2.4316 2.4316 2.4345 2.4345 2.8444 2.8444 3.0807 3.0807 4.4329 4.4329 4.5110 4.5110 4.5545 4.5545 4.6149 4.6149 4.6343 4.6343 5.1315 5.1315 5.4424 5.4424 5.4940 5.4940 6.5650 6.5650 8.7216 8.7216 9.1215 9.1215 9.2465 9.2465 9.2654 9.2654 10.1544 10.1544 10.1656 10.1656 k = 0.0000 0.0000 0.1783 ( 6926 PWs) bands (ev): -18.4889 -18.4889 -15.2162 -15.2162 -14.8634 -14.8634 -12.6199 -12.6199 -11.7435 -11.7435 -11.7433 -11.7433 -11.6299 -11.6299 -10.7515 -10.7515 -10.7147 -10.7147 -5.2000 -5.2000 -3.9792 -3.9792 -3.6905 -3.6905 -3.4893 -3.4893 -3.3140 -3.3140 -0.7068 -0.7068 -0.2751 -0.2751 -0.2657 -0.2657 -0.2508 -0.2508 0.7240 0.7240 0.7549 0.7549 0.7779 0.7779 1.5231 1.5231 1.5296 1.5296 2.0843 2.0843 2.4248 2.4248 2.4280 2.4280 2.8451 2.8451 3.0807 3.0807 4.4414 4.4414 4.5180 4.5180 4.5661 4.5661 4.6150 4.6150 4.6348 4.6348 5.1083 5.1083 5.4489 5.4489 5.4989 5.4989 6.6619 6.6619 8.6440 8.6440 9.1682 9.1682 9.2416 9.2416 9.2591 9.2591 10.1423 10.1424 10.1549 10.1549 k = 0.0000 0.0000 0.1945 ( 6926 PWs) bands (ev): -18.4889 -18.4889 -15.2161 -15.2161 -14.8635 -14.8635 -12.6223 -12.6223 -11.7435 -11.7435 -11.7432 -11.7432 -11.6266 -11.6266 -10.7516 -10.7516 -10.7147 -10.7147 -5.1999 -5.1999 -3.9908 -3.9908 -3.6910 -3.6910 -3.4920 -3.4920 -3.3125 -3.3125 -0.6877 -0.6877 -0.2629 -0.2629 -0.2378 -0.2378 -0.2302 -0.2302 0.7180 0.7180 0.7381 0.7381 0.7599 0.7599 1.5253 1.5253 1.5321 1.5321 2.0192 2.0192 2.4189 2.4189 2.4222 2.4222 2.8454 2.8454 3.0803 3.0803 4.4496 4.4496 4.5248 4.5248 4.5774 4.5774 4.6152 4.6152 4.6354 4.6354 5.0874 5.0874 5.4555 5.4555 5.5038 5.5038 6.7610 6.7610 8.5620 8.5620 9.2172 9.2172 9.2376 9.2376 9.2531 9.2531 10.1300 10.1300 10.1439 10.1439 k = 0.0000 0.0000 0.2107 ( 6920 PWs) bands (ev): -18.4889 -18.4889 -15.2160 -15.2160 -14.8635 -14.8635 -12.6246 -12.6246 -11.7435 -11.7435 -11.7432 -11.7432 -11.6235 -11.6235 -10.7516 -10.7516 -10.7148 -10.7148 -5.1998 -5.1998 -4.0019 -4.0019 -3.6913 -3.6913 -3.4944 -3.4944 -3.3113 -3.3113 -0.6686 -0.6686 -0.2510 -0.2510 -0.2249 -0.2249 -0.1959 -0.1959 0.7145 0.7145 0.7218 0.7218 0.7423 0.7423 1.5270 1.5270 1.5340 1.5340 1.9540 1.9540 2.4138 2.4138 2.4174 2.4174 2.8453 2.8453 3.0797 3.0797 4.4575 4.4575 4.5313 4.5313 4.5882 4.5882 4.6153 4.6153 4.6359 4.6359 5.0688 5.0688 5.4620 5.4620 5.5087 5.5087 6.8618 6.8618 8.4761 8.4761 9.2318 9.2318 9.2474 9.2474 9.2704 9.2704 10.1176 10.1176 10.1329 10.1329 k = 0.0000 0.0000 0.2269 ( 6920 PWs) bands (ev): -18.4889 -18.4889 -15.2158 -15.2158 -14.8636 -14.8636 -12.6268 -12.6268 -11.7434 -11.7434 -11.7431 -11.7431 -11.6206 -11.6206 -10.7517 -10.7517 -10.7148 -10.7148 -5.1998 -5.1998 -4.0122 -4.0122 -3.6917 -3.6917 -3.4967 -3.4967 -3.3102 -3.3102 -0.6500 -0.6500 -0.2395 -0.2395 -0.2123 -0.2123 -0.1639 -0.1639 0.7057 0.7057 0.7146 0.7146 0.7255 0.7255 1.5283 1.5283 1.5354 1.5354 1.8898 1.8898 2.4096 2.4096 2.4134 2.4134 2.8449 2.8449 3.0789 3.0789 4.4649 4.4649 4.5372 4.5372 4.5982 4.5982 4.6153 4.6153 4.6365 4.6365 5.0524 5.0524 5.4682 5.4682 5.5133 5.5133 6.9641 6.9641 8.3868 8.3868 9.2282 9.2282 9.2422 9.2422 9.3232 9.3232 10.1055 10.1055 10.1222 10.1222 k = 0.0000 0.0000 0.2431 ( 6920 PWs) bands (ev): -18.4889 -18.4889 -15.2157 -15.2157 -14.8637 -14.8637 -12.6287 -12.6287 -11.7434 -11.7434 -11.7431 -11.7431 -11.6179 -11.6179 -10.7518 -10.7518 -10.7149 -10.7149 -5.1997 -5.1997 -4.0216 -4.0216 -3.6921 -3.6921 -3.4987 -3.4987 -3.3093 -3.3093 -0.6323 -0.6323 -0.2287 -0.2287 -0.2005 -0.2005 -0.1353 -0.1353 0.6912 0.6912 0.7099 0.7099 0.7174 0.7174 1.5292 1.5292 1.5364 1.5364 1.8280 1.8280 2.4062 2.4062 2.4102 2.4102 2.8444 2.8444 3.0780 3.0780 4.4716 4.4716 4.5426 4.5426 4.6072 4.6072 4.6153 4.6153 4.6370 4.6370 5.0383 5.0383 5.4740 5.4740 5.5177 5.5177 7.0673 7.0673 8.2946 8.2946 9.2249 9.2249 9.2376 9.2376 9.3769 9.3769 10.0940 10.0941 10.1121 10.1121 k = 0.0000 0.0000 0.2593 ( 6926 PWs) bands (ev): -18.4889 -18.4889 -15.2156 -15.2156 -14.8637 -14.8637 -12.6304 -12.6304 -11.7434 -11.7434 -11.7431 -11.7431 -11.6155 -11.6155 -10.7518 -10.7518 -10.7150 -10.7150 -5.1996 -5.1996 -4.0298 -4.0298 -3.6924 -3.6924 -3.5004 -3.5004 -3.3086 -3.3086 -0.6162 -0.6162 -0.2188 -0.2188 -0.1896 -0.1896 -0.1108 -0.1108 0.6781 0.6781 0.6959 0.6959 0.7234 0.7234 1.5298 1.5298 1.5369 1.5369 1.7703 1.7703 2.4035 2.4035 2.4077 2.4077 2.8437 2.8437 3.0770 3.0770 4.4775 4.4775 4.5473 4.5473 4.6150 4.6150 4.6153 4.6153 4.6375 4.6375 5.0265 5.0265 5.4793 5.4793 5.5217 5.5217 7.1713 7.1713 8.1999 8.1999 9.2222 9.2222 9.2337 9.2337 9.4300 9.4300 10.0836 10.0836 10.1029 10.1030 k = 0.0000 0.0000 0.2755 ( 6914 PWs) bands (ev): -18.4889 -18.4889 -15.2155 -15.2155 -14.8638 -14.8638 -12.6319 -12.6319 -11.7433 -11.7433 -11.7430 -11.7430 -11.6135 -11.6135 -10.7518 -10.7518 -10.7150 -10.7150 -5.1996 -5.1996 -4.0368 -4.0368 -3.6926 -3.6926 -3.5018 -3.5018 -3.3080 -3.3080 -0.6020 -0.6020 -0.2102 -0.2102 -0.1801 -0.1801 -0.0908 -0.0908 0.6667 0.6667 0.6837 0.6837 0.7317 0.7317 1.5301 1.5301 1.5372 1.5372 1.7186 1.7186 2.4016 2.4016 2.4059 2.4059 2.8430 2.8430 3.0760 3.0760 4.4825 4.4825 4.5512 4.5512 4.6153 4.6153 4.6215 4.6215 4.6380 4.6380 5.0168 5.0168 5.4838 5.4838 5.5251 5.5251 7.2757 7.2757 8.1030 8.1030 9.2199 9.2199 9.2304 9.2304 9.4808 9.4808 10.0746 10.0746 10.0950 10.0950 k = 0.0000 0.0000 0.2917 ( 6908 PWs) bands (ev): -18.4889 -18.4889 -15.2154 -15.2154 -14.8638 -14.8638 -12.6331 -12.6331 -11.7433 -11.7433 -11.7430 -11.7430 -11.6119 -11.6119 -10.7519 -10.7519 -10.7150 -10.7150 -5.1995 -5.1995 -4.0424 -4.0424 -3.6928 -3.6928 -3.5030 -3.5030 -3.3075 -3.3075 -0.5903 -0.5903 -0.2031 -0.2031 -0.1723 -0.1723 -0.0755 -0.0755 0.6575 0.6575 0.6738 0.6738 0.7410 0.7410 1.5303 1.5303 1.5372 1.5372 1.6749 1.6749 2.4001 2.4001 2.4046 2.4046 2.8423 2.8423 3.0751 3.0751 4.4866 4.4866 4.5543 4.5543 4.6152 4.6152 4.6266 4.6266 4.6385 4.6385 5.0092 5.0092 5.4874 5.4874 5.5279 5.5279 7.3800 7.3800 8.0045 8.0045 9.2181 9.2181 9.2278 9.2278 9.5272 9.5272 10.0671 10.0671 10.0885 10.0887 k = 0.0000 0.0000 0.3079 ( 6914 PWs) bands (ev): -18.4888 -18.4888 -15.2154 -15.2154 -14.8638 -14.8638 -12.6339 -12.6339 -11.7433 -11.7433 -11.7430 -11.7430 -11.6107 -11.6107 -10.7519 -10.7519 -10.7151 -10.7151 -5.1995 -5.1995 -4.0464 -4.0464 -3.6930 -3.6930 -3.5038 -3.5038 -3.3072 -3.3072 -0.5816 -0.5816 -0.1979 -0.1979 -0.1665 -0.1665 -0.0647 -0.0647 0.6507 0.6507 0.6665 0.6665 0.7497 0.7497 1.5304 1.5304 1.5372 1.5372 1.6415 1.6415 2.3992 2.3992 2.4037 2.4037 2.8418 2.8418 3.0745 3.0745 4.4895 4.4895 4.5566 4.5566 4.6152 4.6152 4.6301 4.6301 4.6391 4.6391 5.0039 5.0039 5.4901 5.4901 5.5299 5.5299 7.4837 7.4837 7.9048 7.9048 9.2169 9.2169 9.2260 9.2260 9.5658 9.5658 10.0610 10.0612 10.0769 10.0833 k = 0.0000 0.0000 0.3241 ( 6914 PWs) bands (ev): -18.4888 -18.4888 -15.2153 -15.2153 -14.8638 -14.8638 -12.6345 -12.6345 -11.7433 -11.7433 -11.7430 -11.7430 -11.6100 -11.6100 -10.7519 -10.7519 -10.7151 -10.7151 -5.1994 -5.1994 -4.0489 -4.0489 -3.6931 -3.6931 -3.5043 -3.5043 -3.3071 -3.3071 -0.5762 -0.5762 -0.1946 -0.1946 -0.1629 -0.1629 -0.0584 -0.0584 0.6466 0.6466 0.6621 0.6621 0.7559 0.7559 1.5304 1.5304 1.5372 1.5372 1.6204 1.6204 2.3987 2.3987 2.4033 2.4033 2.8414 2.8414 3.0741 3.0741 4.4913 4.4913 4.5579 4.5579 4.6152 4.6152 4.6320 4.6320 4.6396 4.6396 5.0007 5.0007 5.4917 5.4917 5.5312 5.5312 7.5849 7.5849 7.8061 7.8061 9.2162 9.2162 9.2248 9.2248 9.5920 9.5920 10.0494 10.0498 10.0595 10.0597 k = 0.0000 0.0000 0.3403 ( 6920 PWs) bands (ev): -18.4888 -18.4888 -15.2153 -15.2153 -14.8639 -14.8639 -12.6346 -12.6346 -11.7433 -11.7433 -11.7430 -11.7430 -11.6097 -11.6097 -10.7519 -10.7519 -10.7151 -10.7151 -5.1994 -5.1994 -4.0497 -4.0497 -3.6931 -3.6931 -3.5044 -3.5044 -3.3070 -3.3070 -0.5744 -0.5744 -0.1935 -0.1935 -0.1617 -0.1617 -0.0563 -0.0563 0.6452 0.6452 0.6606 0.6606 0.7581 0.7581 1.5304 1.5304 1.5372 1.5372 1.6131 1.6131 2.3985 2.3985 2.4031 2.4031 2.8413 2.8413 3.0739 3.0739 4.4919 4.4919 4.5584 4.5584 4.6152 4.6152 4.6326 4.6326 4.6398 4.6398 4.9996 4.9996 5.4923 5.4923 5.5316 5.5316 7.6574 7.6574 7.7344 7.7344 9.2159 9.2159 9.2245 9.2245 9.6015 9.6015 10.0419 10.0423 10.0580 10.0582 k = 0.0000 0.0000 0.3403 ( 6920 PWs) bands (ev): -18.4888 -18.4888 -15.2153 -15.2153 -14.8639 -14.8639 -12.6346 -12.6346 -11.7433 -11.7433 -11.7430 -11.7430 -11.6097 -11.6097 -10.7519 -10.7519 -10.7151 -10.7151 -5.1994 -5.1994 -4.0497 -4.0497 -3.6931 -3.6931 -3.5044 -3.5044 -3.3070 -3.3070 -0.5744 -0.5744 -0.1935 -0.1935 -0.1617 -0.1617 -0.0563 -0.0563 0.6452 0.6452 0.6606 0.6606 0.7581 0.7581 1.5304 1.5304 1.5372 1.5372 1.6131 1.6131 2.3985 2.3985 2.4031 2.4031 2.8413 2.8413 3.0739 3.0739 4.4919 4.4919 4.5584 4.5584 4.6152 4.6152 4.6326 4.6326 4.6398 4.6398 4.9996 4.9996 5.4923 5.4923 5.5316 5.5316 7.6574 7.6574 7.7344 7.7344 9.2159 9.2159 9.2245 9.2245 9.6015 9.6015 10.0440 10.0481 10.0588 10.0646 k = 0.0143 0.0082 0.3403 ( 6916 PWs) bands (ev): -18.4887 -18.4887 -15.2152 -15.2152 -14.8640 -14.8640 -12.6349 -12.6349 -11.7442 -11.7442 -11.7434 -11.7434 -11.6091 -11.6091 -10.7516 -10.7516 -10.7149 -10.7149 -5.1991 -5.1991 -4.0496 -4.0496 -3.6920 -3.6920 -3.5045 -3.5045 -3.3072 -3.3072 -0.5734 -0.5734 -0.1938 -0.1938 -0.1620 -0.1620 -0.0554 -0.0554 0.6453 0.6453 0.6607 0.6607 0.7591 0.7591 1.5273 1.5273 1.5354 1.5354 1.6176 1.6176 2.3993 2.3993 2.4040 2.4040 2.8399 2.8399 3.0718 3.0718 4.4891 4.4891 4.5594 4.5594 4.6093 4.6093 4.6315 4.6315 4.6437 4.6437 5.0021 5.0021 5.4914 5.4914 5.5306 5.5306 7.6593 7.6593 7.7350 7.7350 9.2142 9.2142 9.2227 9.2227 9.5950 9.5950 10.0430 10.0434 10.0602 10.0605 k = 0.0286 0.0165 0.3403 ( 6912 PWs) bands (ev): -18.4884 -18.4884 -15.2147 -15.2147 -14.8645 -14.8645 -12.6358 -12.6358 -11.7472 -11.7472 -11.7443 -11.7443 -11.6074 -11.6074 -10.7509 -10.7509 -10.7142 -10.7142 -5.1982 -5.1982 -4.0494 -4.0494 -3.6886 -3.6886 -3.5047 -3.5047 -3.3078 -3.3078 -0.5703 -0.5703 -0.1947 -0.1947 -0.1629 -0.1629 -0.0526 -0.0526 0.6454 0.6454 0.6611 0.6611 0.7619 0.7619 1.5164 1.5164 1.5342 1.5342 1.6286 1.6286 2.4014 2.4014 2.4067 2.4067 2.8355 2.8355 3.0656 3.0656 4.4811 4.4811 4.5607 4.5607 4.5961 4.5961 4.6284 4.6284 4.6519 4.6519 5.0094 5.0094 5.4886 5.4886 5.5278 5.5278 7.6649 7.6649 7.7366 7.7366 9.2089 9.2089 9.2176 9.2176 9.5768 9.5768 10.0443 10.0444 10.0612 10.0613 k = 0.0429 0.0247 0.3403 ( 6910 PWs) bands (ev): -18.4879 -18.4879 -15.2139 -15.2139 -14.8653 -14.8653 -12.6372 -12.6372 -11.7522 -11.7522 -11.7458 -11.7458 -11.6044 -11.6044 -10.7499 -10.7499 -10.7128 -10.7128 -5.1967 -5.1967 -4.0489 -4.0489 -3.6831 -3.6831 -3.5051 -3.5051 -3.3089 -3.3089 -0.5651 -0.5651 -0.1963 -0.1963 -0.1643 -0.1643 -0.0479 -0.0479 0.6450 0.6450 0.6624 0.6624 0.7665 0.7665 1.5007 1.5007 1.5338 1.5338 1.6428 1.6428 2.4046 2.4046 2.4117 2.4117 2.8277 2.8277 3.0560 3.0560 4.4687 4.4687 4.5575 4.5575 4.5815 4.5815 4.6234 4.6234 4.6634 4.6634 5.0204 5.0204 5.4835 5.4835 5.5236 5.5236 7.6740 7.6740 7.7393 7.7393 9.1996 9.1996 9.2095 9.2095 9.5505 9.5505 10.0419 10.0419 10.0617 10.0618 k = 0.0571 0.0330 0.3403 ( 6910 PWs) bands (ev): -18.4871 -18.4871 -15.2128 -15.2128 -14.8664 -14.8664 -12.6393 -12.6393 -11.7589 -11.7589 -11.7478 -11.7478 -11.6005 -11.6005 -10.7490 -10.7490 -10.7103 -10.7103 -5.1947 -5.1947 -4.0483 -4.0483 -3.6755 -3.6755 -3.5055 -3.5055 -3.3102 -3.3102 -0.5579 -0.5579 -0.1987 -0.1987 -0.1660 -0.1660 -0.0415 -0.0415 0.6437 0.6437 0.6649 0.6649 0.7730 0.7730 1.4829 1.4829 1.5336 1.5336 1.6582 1.6582 2.4087 2.4087 2.4189 2.4189 2.8163 2.8163 3.0443 3.0443 4.4523 4.4523 4.5431 4.5431 4.5715 4.5715 4.6166 4.6166 4.6792 4.6792 5.0337 5.0337 5.4759 5.4759 5.5188 5.5188 7.6866 7.6866 7.7430 7.7430 9.1863 9.1863 9.1981 9.1981 9.5194 9.5194 10.0327 10.0327 10.0662 10.0662 k = 0.0714 0.0412 0.3403 ( 6914 PWs) bands (ev): -18.4862 -18.4862 -15.2114 -15.2114 -14.8678 -14.8678 -12.6418 -12.6418 -11.7673 -11.7673 -11.7504 -11.7504 -11.5955 -11.5955 -10.7488 -10.7488 -10.7065 -10.7065 -5.1921 -5.1921 -4.0474 -4.0474 -3.6660 -3.6660 -3.5060 -3.5060 -3.3119 -3.3119 -0.5486 -0.5486 -0.2021 -0.2021 -0.1677 -0.1677 -0.0333 -0.0333 0.6412 0.6412 0.6688 0.6688 0.7814 0.7814 1.4638 1.4638 1.5334 1.5334 1.6737 1.6737 2.4134 2.4134 2.4284 2.4284 2.8006 2.8006 3.0315 3.0315 4.4315 4.4315 4.5207 4.5207 4.5634 4.5634 4.6085 4.6085 4.6997 4.6997 5.0479 5.0479 5.4656 5.4656 5.5141 5.5141 7.7022 7.7022 7.7478 7.7478 9.1695 9.1695 9.1832 9.1832 9.4869 9.4869 10.0192 10.0192 10.0727 10.0727 k = 0.0857 0.0495 0.3403 ( 6918 PWs) bands (ev): -18.4850 -18.4850 -15.2097 -15.2097 -14.8696 -14.8696 -12.6449 -12.6449 -11.7772 -11.7772 -11.7534 -11.7534 -11.5896 -11.5896 -10.7494 -10.7494 -10.7012 -10.7012 -5.1889 -5.1889 -4.0463 -4.0463 -3.6547 -3.6547 -3.5065 -3.5065 -3.3138 -3.3138 -0.5374 -0.5374 -0.2065 -0.2065 -0.1694 -0.1694 -0.0234 -0.0234 0.6376 0.6376 0.6738 0.6738 0.7915 0.7915 1.4440 1.4440 1.5333 1.5333 1.6888 1.6888 2.4186 2.4186 2.4401 2.4401 2.7806 2.7806 3.0192 3.0192 4.4057 4.4057 4.4956 4.4956 4.5532 4.5532 4.5990 4.5990 4.7245 4.7245 5.0618 5.0618 5.4527 5.4527 5.5097 5.5097 7.7205 7.7205 7.7536 7.7536 9.1494 9.1494 9.1641 9.1641 9.4550 9.4550 10.0030 10.0030 10.0792 10.0792 k = 0.1000 0.0577 0.3403 ( 6920 PWs) bands (ev): -18.4837 -18.4837 -15.2077 -15.2077 -14.8716 -14.8716 -12.6485 -12.6485 -11.7883 -11.7883 -11.7570 -11.7570 -11.5828 -11.5828 -10.7510 -10.7510 -10.6944 -10.6944 -5.1853 -5.1853 -4.0448 -4.0448 -3.6420 -3.6420 -3.5070 -3.5070 -3.3158 -3.3158 -0.5242 -0.5242 -0.2120 -0.2120 -0.1708 -0.1708 -0.0119 -0.0119 0.6330 0.6330 0.6799 0.6799 0.8035 0.8035 1.4236 1.4236 1.5332 1.5332 1.7031 1.7031 2.4238 2.4238 2.4540 2.4540 2.7565 2.7565 3.0082 3.0082 4.3744 4.3744 4.4701 4.4701 4.5405 4.5405 4.5882 4.5882 4.7526 4.7526 5.0745 5.0745 5.4379 5.4379 5.5056 5.5056 7.7411 7.7411 7.7605 7.7605 9.1266 9.1266 9.1406 9.1406 9.4252 9.4252 9.9852 9.9852 10.0841 10.0841 k = 0.1143 0.0660 0.3403 ( 6914 PWs) bands (ev): -18.4822 -18.4822 -15.2055 -15.2055 -14.8740 -14.8740 -12.6526 -12.6526 -11.8006 -11.8006 -11.7610 -11.7610 -11.5751 -11.5751 -10.7536 -10.7536 -10.6862 -10.6862 -5.1813 -5.1813 -4.0429 -4.0429 -3.6280 -3.6280 -3.5072 -3.5072 -3.3177 -3.3177 -0.5092 -0.5092 -0.2185 -0.2185 -0.1720 -0.1720 0.0011 0.0011 0.6276 0.6276 0.6868 0.6868 0.8171 0.8171 1.4026 1.4026 1.5331 1.5331 1.7164 1.7164 2.4281 2.4281 2.4700 2.4700 2.7296 2.7296 2.9992 2.9992 4.3371 4.3371 4.4454 4.4454 4.5259 4.5259 4.5762 4.5762 4.7832 4.7832 5.0851 5.0851 5.4218 5.4218 5.5018 5.5018 7.7632 7.7632 7.7688 7.7688 9.1013 9.1013 9.1129 9.1129 9.3984 9.3984 9.9663 9.9663 10.0857 10.0857 k = 0.1286 0.0742 0.3403 ( 6916 PWs) bands (ev): -18.4805 -18.4805 -15.2029 -15.2029 -14.8766 -14.8766 -12.6571 -12.6571 -11.8139 -11.8139 -11.7653 -11.7653 -11.5666 -11.5666 -10.7571 -10.7571 -10.6769 -10.6769 -5.1769 -5.1769 -4.0407 -4.0407 -3.6134 -3.6134 -3.5070 -3.5070 -3.3195 -3.3195 -0.4924 -0.4924 -0.2259 -0.2259 -0.1730 -0.1730 0.0155 0.0155 0.6215 0.6215 0.6944 0.6944 0.8324 0.8324 1.3812 1.3812 1.5330 1.5330 1.7284 1.7284 2.4303 2.4303 2.4879 2.4879 2.7019 2.7019 2.9924 2.9924 4.2938 4.2938 4.4221 4.4221 4.5095 4.5095 4.5628 4.5628 4.8155 4.8155 5.0930 5.0930 5.4048 5.4048 5.4982 5.4982 7.7765 7.7765 7.7885 7.7885 9.0734 9.0734 9.0819 9.0819 9.3747 9.3747 9.9469 9.9469 10.0828 10.0828 k = 0.1429 0.0825 0.3403 ( 6920 PWs) bands (ev): -18.4787 -18.4787 -15.2000 -15.2000 -14.8795 -14.8795 -12.6621 -12.6621 -11.8280 -11.8280 -11.7701 -11.7701 -11.5574 -11.5574 -10.7614 -10.7614 -10.6667 -10.6667 -5.1721 -5.1721 -4.0380 -4.0380 -3.5986 -3.5986 -3.5060 -3.5060 -3.3208 -3.3208 -0.4739 -0.4739 -0.2340 -0.2340 -0.1738 -0.1738 0.0312 0.0312 0.6146 0.6146 0.7025 0.7025 0.8493 0.8493 1.3593 1.3593 1.5330 1.5330 1.7388 1.7388 2.4280 2.4280 2.5076 2.5076 2.6768 2.6768 2.9879 2.9879 4.2447 4.2447 4.4005 4.4005 4.4920 4.4920 4.5482 4.5482 4.8488 4.8488 5.0978 5.0978 5.3875 5.3875 5.4948 5.4948 7.7864 7.7864 7.8138 7.8138 9.0415 9.0415 9.0503 9.0503 9.3535 9.3535 9.9274 9.9274 10.0741 10.0741 k = 0.1571 0.0907 0.3403 ( 6924 PWs) bands (ev): -18.4767 -18.4767 -15.1969 -15.1969 -14.8827 -14.8827 -12.6674 -12.6674 -11.8427 -11.8427 -11.7751 -11.7751 -11.5474 -11.5474 -10.7665 -10.7665 -10.6558 -10.6558 -5.1670 -5.1670 -4.0349 -4.0349 -3.5846 -3.5846 -3.5038 -3.5038 -3.3215 -3.3215 -0.4540 -0.4540 -0.2426 -0.2426 -0.1745 -0.1745 0.0482 0.0482 0.6073 0.6073 0.7110 0.7110 0.8676 0.8676 1.3370 1.3370 1.5331 1.5331 1.7475 1.7475 2.4183 2.4183 2.5288 2.5288 2.6583 2.6583 2.9856 2.9856 4.1903 4.1903 4.3804 4.3804 4.4734 4.4734 4.5322 4.5322 4.8823 4.8823 5.0994 5.0994 5.3703 5.3703 5.4914 5.4914 7.7970 7.7970 7.8400 7.8400 9.0051 9.0051 9.0197 9.0197 9.3344 9.3344 9.9080 9.9080 10.0594 10.0594 k = 0.1714 0.0990 0.3403 ( 6922 PWs) bands (ev): -18.4746 -18.4746 -15.1935 -15.1935 -14.8861 -14.8861 -12.6731 -12.6731 -11.8579 -11.8579 -11.7804 -11.7804 -11.5366 -11.5366 -10.7724 -10.7724 -10.6443 -10.6443 -5.1617 -5.1617 -4.0314 -4.0314 -3.5725 -3.5725 -3.4996 -3.4996 -3.3211 -3.3211 -0.4330 -0.4330 -0.2513 -0.2513 -0.1751 -0.1751 0.0664 0.0664 0.5994 0.5994 0.7199 0.7199 0.8871 0.8871 1.3142 1.3142 1.5332 1.5332 1.7543 1.7543 2.3988 2.3988 2.5511 2.5511 2.6501 2.6501 2.9853 2.9853 4.1313 4.1313 4.3618 4.3618 4.4540 4.4540 4.5151 4.5151 4.9155 4.9155 5.0977 5.0977 5.3534 5.3534 5.4881 5.4881 7.8084 7.8084 7.8667 7.8667 8.9662 8.9662 8.9893 8.9893 9.3166 9.3166 9.8889 9.8889 10.0389 10.0389 k = 0.1857 0.1072 0.3403 ( 6938 PWs) bands (ev): -18.4724 -18.4724 -15.1899 -15.1899 -14.8899 -14.8899 -12.6791 -12.6791 -11.8734 -11.8734 -11.7859 -11.7859 -11.5251 -11.5251 -10.7791 -10.7791 -10.6324 -10.6324 -5.1562 -5.1562 -4.0274 -4.0274 -3.5634 -3.5634 -3.4929 -3.4929 -3.3190 -3.3190 -0.4112 -0.4112 -0.2596 -0.2596 -0.1756 -0.1756 0.0857 0.0857 0.5911 0.5911 0.7289 0.7289 0.9078 0.9078 1.2911 1.2911 1.5335 1.5335 1.7589 1.7589 2.3693 2.3693 2.5741 2.5741 2.6533 2.6533 2.9871 2.9871 4.0681 4.0681 4.3442 4.3442 4.4341 4.4341 4.4971 4.4971 4.9473 4.9473 5.0933 5.0933 5.3372 5.3372 5.4846 5.4846 7.8206 7.8206 7.8935 7.8935 8.9264 8.9264 8.9588 8.9588 9.2996 9.2996 9.8704 9.8704 10.0136 10.0136 k = 0.2000 0.1155 0.3403 ( 6938 PWs) bands (ev): -18.4701 -18.4701 -15.1860 -15.1860 -14.8938 -14.8938 -12.6853 -12.6853 -11.8892 -11.8892 -11.7916 -11.7916 -11.5129 -11.5129 -10.7865 -10.7865 -10.6202 -10.6202 -5.1506 -5.1506 -4.0230 -4.0230 -3.5577 -3.5577 -3.4841 -3.4841 -3.3149 -3.3149 -0.3897 -0.3897 -0.2669 -0.2669 -0.1761 -0.1761 0.1059 0.1059 0.5826 0.5826 0.7382 0.7382 0.9295 0.9295 1.2675 1.2675 1.5339 1.5339 1.7613 1.7613 2.3321 2.3321 2.5974 2.5974 2.6669 2.6669 2.9908 2.9908 4.0015 4.0015 4.3271 4.3271 4.4140 4.4140 4.4785 4.4785 4.9762 4.9762 5.0873 5.0873 5.3218 5.3218 5.4808 5.4808 7.8337 7.8337 7.9203 7.9203 8.8862 8.8862 8.9283 8.9283 9.2828 9.2828 9.8526 9.8526 9.9849 9.9849 k = 0.2143 0.1237 0.3403 ( 6934 PWs) bands (ev): -18.4677 -18.4677 -15.1819 -15.1819 -14.8980 -14.8980 -12.6918 -12.6918 -11.9050 -11.9050 -11.7974 -11.7974 -11.5001 -11.5001 -10.7945 -10.7945 -10.6079 -10.6079 -5.1449 -5.1449 -4.0181 -4.0181 -3.5549 -3.5549 -3.4742 -3.4742 -3.3080 -3.3080 -0.3701 -0.3701 -0.2713 -0.2713 -0.1766 -0.1766 0.1271 0.1271 0.5739 0.5739 0.7474 0.7474 0.9519 0.9519 1.2436 1.2436 1.5344 1.5344 1.7615 1.7615 2.2897 2.2897 2.6211 2.6211 2.6882 2.6882 2.9965 2.9965 3.9322 3.9322 4.3096 4.3096 4.3938 4.3938 4.4598 4.4598 4.9986 4.9986 5.0832 5.0832 5.3075 5.3075 5.4767 5.4767 7.8474 7.8474 7.9467 7.9467 8.8461 8.8461 8.8981 8.8981 9.2660 9.2660 9.8355 9.8355 9.9540 9.9540 k = 0.2286 0.1320 0.3403 ( 6942 PWs) bands (ev): -18.4653 -18.4653 -15.1776 -15.1776 -14.9024 -14.9024 -12.6984 -12.6984 -11.9207 -11.9207 -11.8033 -11.8033 -11.4866 -11.4866 -10.8033 -10.8033 -10.5957 -10.5957 -5.1392 -5.1392 -4.0129 -4.0129 -3.5542 -3.5542 -3.4648 -3.4648 -3.2978 -3.2978 -0.3556 -0.3556 -0.2699 -0.2699 -0.1771 -0.1771 0.1492 0.1492 0.5652 0.5652 0.7567 0.7567 0.9749 0.9749 1.2196 1.2196 1.5351 1.5351 1.7594 1.7594 2.2446 2.2446 2.6457 2.6457 2.7149 2.7149 3.0041 3.0041 3.8610 3.8610 4.2908 4.2908 4.3737 4.3737 4.4419 4.4419 5.0077 5.0077 5.0874 5.0874 5.2944 5.2944 5.4721 5.4721 7.8618 7.8618 7.9724 7.9724 8.8066 8.8066 8.8684 8.8684 9.2489 9.2489 9.8192 9.8192 9.9220 9.9220 k = 0.2429 0.1402 0.3403 ( 6956 PWs) bands (ev): -18.4629 -18.4629 -15.1731 -15.1731 -14.9070 -14.9070 -12.7051 -12.7051 -11.9363 -11.9363 -11.8091 -11.8091 -11.4725 -11.4725 -10.8128 -10.8128 -10.5835 -10.5835 -5.1335 -5.1335 -4.0073 -4.0073 -3.5549 -3.5549 -3.4569 -3.4569 -3.2841 -3.2841 -0.3497 -0.3497 -0.2595 -0.2595 -0.1775 -0.1775 0.1721 0.1721 0.5566 0.5566 0.7659 0.7659 0.9981 0.9981 1.1955 1.1955 1.5359 1.5359 1.7550 1.7550 2.1984 2.1984 2.6714 2.6714 2.7451 2.7451 3.0133 3.0133 3.7890 3.7890 4.2698 4.2698 4.3530 4.3530 4.4259 4.4259 5.0010 5.0010 5.1026 5.1026 5.2830 5.2830 5.4669 5.4669 7.8769 7.8769 7.9973 7.9973 8.7679 8.7679 8.8395 8.8395 9.2313 9.2313 9.8037 9.8037 9.8899 9.8899 k = 0.2571 0.1485 0.3403 ( 6956 PWs) bands (ev): -18.4604 -18.4604 -15.1684 -15.1684 -14.9117 -14.9117 -12.7119 -12.7119 -11.9516 -11.9516 -11.8150 -11.8150 -11.4579 -11.4579 -10.8230 -10.8230 -10.5715 -10.5715 -5.1278 -5.1278 -4.0014 -4.0014 -3.5566 -3.5566 -3.4508 -3.4508 -3.2671 -3.2671 -0.3516 -0.3516 -0.2410 -0.2410 -0.1779 -0.1779 0.1958 0.1958 0.5483 0.5483 0.7750 0.7750 1.0210 1.0210 1.1718 1.1718 1.5370 1.5370 1.7486 1.7486 2.1523 2.1523 2.6983 2.6983 2.7774 2.7774 3.0242 3.0242 3.7173 3.7173 4.2463 4.2463 4.3310 4.3310 4.4129 4.4129 4.9842 4.9842 5.1224 5.1224 5.2737 5.2737 5.4610 5.4610 7.8926 7.8926 8.0211 8.0211 8.7301 8.7301 8.8117 8.8117 9.2130 9.2130 9.7889 9.7889 9.8585 9.8585 k = 0.2714 0.1567 0.3403 ( 6928 PWs) bands (ev): -18.4579 -18.4579 -15.1636 -15.1636 -14.9166 -14.9166 -12.7187 -12.7187 -11.9665 -11.9665 -11.8208 -11.8208 -11.4427 -11.4427 -10.8338 -10.8338 -10.5597 -10.5597 -5.1223 -5.1223 -3.9952 -3.9952 -3.5591 -3.5591 -3.4464 -3.4464 -3.2473 -3.2473 -0.3581 -0.3581 -0.2183 -0.2183 -0.1778 -0.1778 0.2202 0.2202 0.5404 0.5404 0.7839 0.7839 1.0429 1.0429 1.1491 1.1491 1.5383 1.5383 1.7402 1.7402 2.1071 2.1071 2.7263 2.7263 2.8101 2.8101 3.0363 3.0363 3.6475 3.6475 4.2202 4.2202 4.3070 4.3070 4.4035 4.4035 4.9622 4.9622 5.1415 5.1415 5.2674 5.2674 5.4546 5.4546 7.9089 7.9089 8.0437 8.0437 8.6934 8.6934 8.7851 8.7851 9.1943 9.1943 9.7748 9.7748 9.8284 9.8284 k = 0.2857 0.1650 0.3403 ( 6936 PWs) bands (ev): -18.4555 -18.4555 -15.1586 -15.1586 -14.9217 -14.9217 -12.7254 -12.7254 -11.9809 -11.9809 -11.8265 -11.8265 -11.4270 -11.4270 -10.8453 -10.8453 -10.5484 -10.5484 -5.1169 -5.1169 -3.9887 -3.9887 -3.5622 -3.5622 -3.4435 -3.4435 -3.2255 -3.2255 -0.3668 -0.3668 -0.1955 -0.1955 -0.1758 -0.1758 0.2453 0.2453 0.5331 0.5331 0.7925 0.7925 1.0614 1.0614 1.1298 1.1298 1.5398 1.5398 1.7300 1.7300 2.0639 2.0639 2.7550 2.7550 2.8417 2.8417 3.0497 3.0497 3.5817 3.5817 4.1917 4.1917 4.2806 4.2806 4.3972 4.3972 4.9372 4.9372 5.1570 5.1570 5.2651 5.2651 5.4475 5.4475 7.9256 7.9256 8.0650 8.0650 8.6579 8.6579 8.7600 8.7600 9.1749 9.1749 9.7612 9.7612 9.8003 9.8003 k = 0.3000 0.1732 0.3403 ( 6936 PWs) bands (ev): -18.4531 -18.4531 -15.1535 -15.1535 -14.9269 -14.9269 -12.7320 -12.7320 -11.9948 -11.9948 -11.8320 -11.8320 -11.4110 -11.4110 -10.8574 -10.8574 -10.5374 -10.5374 -5.1117 -5.1117 -3.9821 -3.9821 -3.5658 -3.5658 -3.4415 -3.4415 -3.2022 -3.2022 -0.3765 -0.3765 -0.1846 -0.1846 -0.1616 -0.1616 0.2710 0.2710 0.5266 0.5266 0.8008 0.8008 1.0685 1.0685 1.1218 1.1218 1.5417 1.5417 1.7181 1.7181 2.0233 2.0233 2.7834 2.7834 2.8697 2.8697 3.0648 3.0648 3.5226 3.5226 4.1612 4.1612 4.2521 4.2521 4.3932 4.3932 4.9104 4.9104 5.1669 5.1669 5.2678 5.2678 5.4400 5.4400 7.9428 7.9428 8.0847 8.0847 8.6236 8.6236 8.7365 8.7365 9.1552 9.1552 9.7477 9.7477 9.7749 9.7749 k = 0.3143 0.1815 0.3403 ( 6936 PWs) bands (ev): -18.4508 -18.4508 -15.1483 -15.1483 -14.9321 -14.9321 -12.7385 -12.7385 -12.0079 -12.0079 -11.8373 -11.8373 -11.3945 -11.3945 -10.8700 -10.8700 -10.5270 -10.5270 -5.1067 -5.1067 -3.9753 -3.9753 -3.5698 -3.5698 -3.4402 -3.4402 -3.1783 -3.1783 -0.3867 -0.3867 -0.1834 -0.1834 -0.1380 -0.1380 0.2971 0.2971 0.5210 0.5210 0.8087 0.8087 1.0575 1.0575 1.1318 1.1318 1.5438 1.5438 1.7047 1.7047 1.9860 1.9860 2.8097 2.8097 2.8913 2.8913 3.0827 3.0827 3.4736 3.4736 4.1289 4.1289 4.2219 4.2219 4.3905 4.3905 4.8828 4.8828 5.1711 5.1711 5.2753 5.2753 5.4324 5.4324 7.9604 7.9604 8.1028 8.1028 8.5905 8.5905 8.7147 8.7147 9.1352 9.1352 9.7329 9.7329 9.7535 9.7535 k = 0.3286 0.1897 0.3403 ( 6956 PWs) bands (ev): -18.4485 -18.4485 -15.1431 -15.1431 -14.9374 -14.9374 -12.7447 -12.7447 -12.0204 -12.0204 -11.8424 -11.8424 -11.3778 -11.3778 -10.8831 -10.8831 -10.5171 -10.5171 -5.1019 -5.1019 -3.9685 -3.9685 -3.5742 -3.5742 -3.4392 -3.4392 -3.1541 -3.1541 -0.3969 -0.3969 -0.1836 -0.1836 -0.1141 -0.1141 0.3236 0.3236 0.5165 0.5165 0.8162 0.8162 1.0386 1.0386 1.1497 1.1497 1.5460 1.5460 1.6898 1.6898 1.9529 1.9529 2.8282 2.8282 2.9065 2.9065 3.1057 3.1057 3.4380 3.4380 4.0951 4.0951 4.1901 4.1901 4.3882 4.3882 4.8551 4.8551 5.1710 5.1710 5.2856 5.2856 5.4249 5.4249 7.9784 7.9784 8.1193 8.1193 8.5587 8.5587 8.6949 8.6949 9.1153 9.1153 9.7157 9.7157 9.7375 9.7375 k = 0.3429 0.1979 0.3403 ( 6968 PWs) bands (ev): -18.4464 -18.4464 -15.1379 -15.1379 -14.9427 -14.9427 -12.7507 -12.7507 -12.0321 -12.0321 -11.8472 -11.8472 -11.3609 -11.3609 -10.8967 -10.8967 -10.5078 -10.5078 -5.0975 -5.0975 -3.9617 -3.9617 -3.5788 -3.5788 -3.4385 -3.4385 -3.1301 -3.1301 -0.4070 -0.4070 -0.1841 -0.1841 -0.0915 -0.0915 0.3500 0.3500 0.5132 0.5132 0.8232 0.8232 1.0180 1.0180 1.1692 1.1692 1.5482 1.5482 1.6738 1.6738 1.9246 1.9246 2.8278 2.8278 2.9229 2.9229 3.1351 3.1351 3.4179 3.4179 4.0598 4.0598 4.1572 4.1572 4.3852 4.3852 4.8284 4.8284 5.1685 5.1685 5.2962 5.2962 5.4181 5.4181 7.9966 7.9966 8.1340 8.1340 8.5281 8.5281 8.6770 8.6770 9.0956 9.0956 9.6974 9.6974 9.7256 9.7256 k = 0.3571 0.2062 0.3403 ( 6964 PWs) bands (ev): -18.4444 -18.4444 -15.1327 -15.1327 -14.9480 -14.9480 -12.7564 -12.7564 -12.0429 -12.0429 -11.8518 -11.8518 -11.3439 -11.3439 -10.9106 -10.9106 -10.4991 -10.4991 -5.0933 -5.0933 -3.9550 -3.9550 -3.5836 -3.5836 -3.4378 -3.4378 -3.1069 -3.1069 -0.4167 -0.4167 -0.1847 -0.1847 -0.0708 -0.0708 0.3762 0.3762 0.5114 0.5114 0.8296 0.8296 0.9978 0.9978 1.1887 1.1887 1.5498 1.5498 1.6570 1.6570 1.9018 1.9018 2.8032 2.8032 2.9467 2.9467 3.1702 3.1702 3.4127 3.4127 4.0233 4.0233 4.1233 4.1233 4.3808 4.3808 4.8034 4.8034 5.1650 5.1650 5.3053 5.3053 5.4129 5.4129 8.0151 8.0151 8.1469 8.1469 8.4988 8.4988 8.6611 8.6611 9.0764 9.0764 9.6799 9.6799 9.7158 9.7158 k = 0.3714 0.2144 0.3403 ( 6968 PWs) bands (ev): -18.4425 -18.4425 -15.1275 -15.1275 -14.9532 -14.9532 -12.7617 -12.7617 -12.0529 -12.0529 -11.8559 -11.8559 -11.3269 -11.3269 -10.9248 -10.9248 -10.4912 -10.4912 -5.0895 -5.0895 -3.9484 -3.9484 -3.5884 -3.5884 -3.4371 -3.4371 -3.0847 -3.0847 -0.4260 -0.4260 -0.1853 -0.1853 -0.0522 -0.0522 0.4015 0.4015 0.5111 0.5111 0.8353 0.8353 0.9785 0.9785 1.2077 1.2077 1.5497 1.5497 1.6409 1.6409 1.8847 1.8847 2.7607 2.7607 2.9750 2.9750 3.2095 3.2095 3.4201 3.4201 3.9857 3.9857 4.0887 4.0887 4.3741 4.3741 4.7811 4.7811 5.1611 5.1611 5.3113 5.3113 5.4099 5.4099 8.0337 8.0337 8.1582 8.1582 8.4706 8.4706 8.6472 8.6472 9.0580 9.0580 9.6639 9.6639 9.7074 9.7074 k = 0.3857 0.2227 0.3403 ( 6972 PWs) bands (ev): -18.4408 -18.4408 -15.1225 -15.1225 -14.9582 -14.9582 -12.7665 -12.7665 -12.0619 -12.0619 -11.8597 -11.8597 -11.3101 -11.3101 -10.9391 -10.9391 -10.4840 -10.4840 -5.0860 -5.0860 -3.9422 -3.9422 -3.5933 -3.5933 -3.4363 -3.4363 -3.0639 -3.0639 -0.4347 -0.4347 -0.1859 -0.1859 -0.0360 -0.0360 0.4253 0.4253 0.5126 0.5126 0.8403 0.8403 0.9606 0.9606 1.2261 1.2261 1.5460 1.5460 1.6273 1.6273 1.8737 1.8737 2.7080 2.7080 3.0047 3.0047 3.2515 3.2515 3.4373 3.4373 3.9470 3.9470 4.0534 4.0534 4.3649 4.3649 4.7621 4.7621 5.1573 5.1573 5.3135 5.3135 5.4098 5.4098 8.0523 8.0523 8.1679 8.1679 8.4436 8.4436 8.6353 8.6353 9.0407 9.0407 9.6496 9.6496 9.7001 9.7001 k = 0.4000 0.2309 0.3403 ( 6974 PWs) bands (ev): -18.4392 -18.4392 -15.1177 -15.1177 -14.9631 -14.9631 -12.7709 -12.7709 -12.0699 -12.0699 -11.8632 -11.8632 -11.2936 -11.2936 -10.9533 -10.9533 -10.4775 -10.4775 -5.0829 -5.0829 -3.9363 -3.9363 -3.5980 -3.5980 -3.4356 -3.4356 -3.0448 -3.0448 -0.4426 -0.4426 -0.1865 -0.1865 -0.0222 -0.0222 0.4466 0.4466 0.5160 0.5160 0.8445 0.8445 0.9444 0.9444 1.2440 1.2440 1.5366 1.5366 1.6186 1.6186 1.8684 1.8684 2.6502 2.6502 3.0339 3.0339 3.2950 3.2950 3.4615 3.4615 3.9074 3.9074 4.0177 4.0177 4.3530 4.3530 4.7468 4.7468 5.1539 5.1539 5.3122 5.3122 5.4122 5.4122 8.0709 8.0709 8.1762 8.1762 8.4178 8.4178 8.6253 8.6253 9.0248 9.0248 9.6372 9.6372 9.6937 9.6937 k = 0.4143 0.2392 0.3403 ( 6978 PWs) bands (ev): -18.4378 -18.4378 -15.1132 -15.1132 -14.9676 -14.9676 -12.7748 -12.7748 -12.0769 -12.0769 -11.8662 -11.8662 -11.2777 -11.2777 -10.9672 -10.9672 -10.4719 -10.4719 -5.0802 -5.0802 -3.9308 -3.9308 -3.6024 -3.6024 -3.4348 -3.4348 -3.0277 -3.0277 -0.4498 -0.4498 -0.1871 -0.1871 -0.0108 -0.0108 0.4645 0.4645 0.5217 0.5217 0.8478 0.8478 0.9304 0.9304 1.2615 1.2615 1.5214 1.5214 1.6152 1.6152 1.8686 1.8686 2.5911 2.5911 3.0617 3.0617 3.3391 3.3391 3.4908 3.4908 3.8672 3.8672 3.9817 3.9817 4.3389 4.3389 4.7351 4.7351 5.1510 5.1510 5.3083 5.3083 5.4164 5.4164 8.0891 8.0891 8.1832 8.1832 8.3931 8.3931 8.6170 8.6170 9.0105 9.0105 9.6265 9.6265 9.6882 9.6882 k = 0.4286 0.2474 0.3403 ( 6984 PWs) bands (ev): -18.4366 -18.4366 -15.1092 -15.1092 -14.9717 -14.9717 -12.7782 -12.7782 -12.0829 -12.0829 -11.8688 -11.8688 -11.2627 -11.2627 -10.9805 -10.9805 -10.4671 -10.4671 -5.0779 -5.0779 -3.9260 -3.9260 -3.6065 -3.6065 -3.4341 -3.4341 -3.0128 -3.0128 -0.4560 -0.4560 -0.1876 -0.1876 -0.0015 -0.0015 0.4783 0.4783 0.5297 0.5297 0.8501 0.8501 0.9189 0.9189 1.2787 1.2787 1.5024 1.5024 1.6154 1.6154 1.8735 1.8735 2.5336 2.5336 3.0870 3.0870 3.3834 3.3834 3.5235 3.5235 3.8263 3.8263 3.9456 3.9456 4.3237 4.3237 4.7269 4.7269 5.1486 5.1486 5.3029 5.3029 5.4212 5.4212 8.1068 8.1068 8.1893 8.1893 8.3697 8.3697 8.6104 8.6104 8.9979 8.9979 9.6176 9.6176 9.6835 9.6835 k = 0.4429 0.2557 0.3403 ( 6992 PWs) bands (ev): -18.4356 -18.4356 -15.1056 -15.1056 -14.9754 -14.9754 -12.7810 -12.7810 -12.0878 -12.0878 -11.8709 -11.8709 -11.2491 -11.2491 -10.9928 -10.9928 -10.4631 -10.4631 -5.0760 -5.0760 -3.9218 -3.9218 -3.6100 -3.6100 -3.4335 -3.4335 -3.0002 -3.0002 -0.4612 -0.4612 -0.1880 -0.1880 0.0056 0.0056 0.4880 0.4880 0.5389 0.5389 0.8513 0.8513 0.9100 0.9100 1.2957 1.2957 1.4817 1.4817 1.6172 1.6172 1.8821 1.8821 2.4803 2.4803 3.1092 3.1092 3.4276 3.4276 3.5580 3.5580 3.7853 3.7853 3.9096 3.9096 4.3084 4.3084 4.7214 4.7214 5.1468 5.1468 5.2973 5.2973 5.4258 5.4258 8.1233 8.1233 8.1948 8.1948 8.3477 8.3477 8.6052 8.6052 8.9874 8.9874 9.6104 9.6104 9.6797 9.6797 k = 0.4571 0.2639 0.3403 ( 6992 PWs) bands (ev): -18.4349 -18.4349 -15.1026 -15.1026 -14.9784 -14.9784 -12.7832 -12.7832 -12.0917 -12.0917 -11.8726 -11.8726 -11.2373 -11.2373 -11.0035 -11.0035 -10.4600 -10.4600 -5.0745 -5.0745 -3.9185 -3.9185 -3.6129 -3.6129 -3.4329 -3.4329 -2.9903 -2.9903 -0.4653 -0.4653 -0.1883 -0.1883 0.0110 0.0110 0.4945 0.4945 0.5478 0.5478 0.8515 0.8515 0.9037 0.9037 1.3124 1.3124 1.4610 1.4610 1.6194 1.6194 1.8928 1.8928 2.4339 2.4339 3.1274 3.1274 3.4714 3.4714 3.5921 3.5921 3.7450 3.7450 3.8744 3.8744 4.2946 4.2946 4.7179 4.7179 5.1455 5.1455 5.2921 5.2921 5.4299 5.4299 8.1379 8.1379 8.2002 8.2002 8.3277 8.3277 8.6014 8.6014 8.9791 8.9791 9.6048 9.6048 9.6768 9.6768 k = 0.4714 0.2722 0.3403 ( 6982 PWs) bands (ev): -18.4343 -18.4343 -15.1003 -15.1003 -14.9806 -14.9806 -12.7848 -12.7848 -12.0944 -12.0944 -11.8738 -11.8738 -11.2281 -11.2281 -11.0119 -11.0119 -10.4578 -10.4578 -5.0734 -5.0734 -3.9160 -3.9160 -3.6150 -3.6150 -3.4325 -3.4325 -2.9831 -2.9831 -0.4683 -0.4683 -0.1885 -0.1885 0.0146 0.0146 0.4988 0.4988 0.5550 0.5550 0.8510 0.8510 0.8998 0.8998 1.3280 1.3280 1.4421 1.4421 1.6212 1.6212 1.9034 1.9034 2.3972 2.3972 3.1409 3.1409 3.5146 3.5146 3.6212 3.6212 3.7080 3.7080 3.8413 3.8413 4.2835 4.2835 4.7160 4.7160 5.1447 5.1447 5.2880 5.2880 5.4330 5.4330 8.1493 8.1493 8.2059 8.2059 8.3106 8.3106 8.5988 8.5988 8.9730 8.9730 9.6008 9.6008 9.6747 9.6747 k = 0.4857 0.2804 0.3403 ( 6968 PWs) bands (ev): -18.4340 -18.4340 -15.0990 -15.0990 -14.9820 -14.9820 -12.7858 -12.7858 -12.0961 -12.0961 -11.8745 -11.8745 -11.2222 -11.2222 -11.0174 -11.0174 -10.4564 -10.4564 -5.0728 -5.0728 -3.9145 -3.9145 -3.6163 -3.6163 -3.4322 -3.4322 -2.9788 -2.9788 -0.4702 -0.4702 -0.1887 -0.1887 0.0168 0.0168 0.5012 0.5012 0.5596 0.5596 0.8505 0.8505 0.8978 0.8978 1.3406 1.3406 1.4273 1.4273 1.6224 1.6224 1.9114 1.9114 2.3735 2.3735 3.1493 3.1493 3.5564 3.5564 3.6280 3.6280 3.6881 3.6881 3.8142 3.8142 4.2764 4.2764 4.7151 4.7151 5.1442 5.1442 5.2854 5.2854 5.4349 5.4349 8.1566 8.1566 8.2110 8.2110 8.2981 8.2981 8.5973 8.5973 8.9694 8.9694 9.5985 9.5985 9.6734 9.6734 k = 0.5000 0.2887 0.3403 ( 6960 PWs) bands (ev): -18.4338 -18.4338 -15.0985 -15.0985 -14.9825 -14.9825 -12.7861 -12.7861 -12.0966 -12.0966 -11.8747 -11.8747 -11.2201 -11.2201 -11.0193 -11.0193 -10.4560 -10.4560 -5.0725 -5.0725 -3.9140 -3.9140 -3.6167 -3.6167 -3.4321 -3.4321 -2.9773 -2.9773 -0.4708 -0.4708 -0.1887 -0.1887 0.0175 0.0175 0.5020 0.5020 0.5612 0.5612 0.8502 0.8502 0.8972 0.8972 1.3458 1.3458 1.4212 1.4212 1.6228 1.6228 1.9144 1.9144 2.3652 2.3652 3.1521 3.1521 3.5875 3.5875 3.6080 3.6080 3.6893 3.6893 3.8025 3.8025 4.2739 4.2739 4.7148 4.7148 5.1440 5.1440 5.2845 5.2845 5.4355 5.4355 8.1590 8.1590 8.2133 8.2133 8.2934 8.2934 8.5968 8.5968 8.9681 8.9681 9.5977 9.5977 9.6730 9.6730 k = 0.5000 0.2887 0.3403 ( 6960 PWs) bands (ev): -18.4338 -18.4338 -15.0985 -15.0985 -14.9825 -14.9825 -12.7861 -12.7861 -12.0966 -12.0966 -11.8747 -11.8747 -11.2201 -11.2201 -11.0193 -11.0193 -10.4560 -10.4560 -5.0725 -5.0725 -3.9140 -3.9140 -3.6167 -3.6167 -3.4321 -3.4321 -2.9773 -2.9773 -0.4708 -0.4708 -0.1887 -0.1887 0.0175 0.0175 0.5020 0.5020 0.5612 0.5612 0.8502 0.8502 0.8972 0.8972 1.3458 1.3458 1.4212 1.4212 1.6228 1.6228 1.9144 1.9144 2.3652 2.3652 3.1521 3.1521 3.5875 3.5875 3.6080 3.6080 3.6893 3.6893 3.8025 3.8025 4.2739 4.2739 4.7148 4.7148 5.1440 5.1440 5.2845 5.2845 5.4355 5.4355 8.1590 8.1590 8.2133 8.2133 8.2934 8.2934 8.5968 8.5968 8.9681 8.9681 9.5977 9.5977 9.6730 9.6730 k = 0.4917 0.3031 0.3403 ( 6960 PWs) bands (ev): -18.4338 -18.4338 -15.0983 -15.0983 -14.9826 -14.9826 -12.7855 -12.7855 -12.1006 -12.1006 -11.8717 -11.8717 -11.2198 -11.2198 -11.0193 -11.0193 -10.4562 -10.4562 -5.0724 -5.0724 -3.9137 -3.9137 -3.6178 -3.6178 -3.4309 -3.4309 -2.9776 -2.9776 -0.4715 -0.4715 -0.1876 -0.1876 0.0183 0.0183 0.5008 0.5008 0.5621 0.5621 0.8485 0.8485 0.8990 0.8990 1.3449 1.3449 1.4220 1.4220 1.6228 1.6228 1.9133 1.9133 2.3660 2.3660 3.1517 3.1517 3.5803 3.5803 3.6140 3.6140 3.6917 3.6917 3.8028 3.8028 4.2727 4.2727 4.7138 4.7138 5.1436 5.1436 5.2851 5.2851 5.4349 5.4349 8.1591 8.1591 8.2133 8.2133 8.2931 8.2931 8.5973 8.5973 8.9675 8.9675 9.5593 9.5593 9.7137 9.7137 k = 0.4833 0.3175 0.3403 ( 6972 PWs) bands (ev): -18.4337 -18.4337 -15.0978 -15.0978 -14.9831 -14.9831 -12.7838 -12.7838 -12.1117 -12.1117 -11.8632 -11.8632 -11.2188 -11.2188 -11.0193 -11.0193 -10.4568 -10.4568 -5.0721 -5.0721 -3.9128 -3.9128 -3.6208 -3.6208 -3.4271 -3.4271 -2.9786 -2.9786 -0.4736 -0.4736 -0.1842 -0.1842 0.0207 0.0207 0.4976 0.4976 0.5646 0.5646 0.8439 0.8439 0.9037 0.9037 1.3423 1.3423 1.4242 1.4242 1.6226 1.6226 1.9099 1.9099 2.3683 2.3683 3.1507 3.1507 3.5669 3.5669 3.6243 3.6243 3.6982 3.6982 3.8039 3.8039 4.2690 4.2690 4.7109 4.7109 5.1425 5.1425 5.2870 5.2870 5.4329 5.4329 8.1594 8.1594 8.2133 8.2133 8.2924 8.2924 8.5987 8.5987 8.9656 8.9656 9.5000 9.5000 9.7798 9.7798 k = 0.4750 0.3320 0.3403 ( 6976 PWs) bands (ev): -18.4335 -18.4335 -15.0971 -15.0971 -14.9839 -14.9839 -12.7809 -12.7809 -12.1285 -12.1285 -11.8508 -11.8508 -11.2171 -11.2171 -11.0192 -11.0192 -10.4577 -10.4577 -5.0716 -5.0716 -3.9112 -3.9112 -3.6256 -3.6256 -3.4212 -3.4212 -2.9802 -2.9802 -0.4769 -0.4769 -0.1786 -0.1786 0.0247 0.0247 0.4929 0.4929 0.5680 0.5680 0.8382 0.8382 0.9099 0.9099 1.3381 1.3381 1.4277 1.4277 1.6223 1.6223 1.9043 1.9043 2.3717 2.3717 3.1493 3.1493 3.5520 3.5520 3.6354 3.6354 3.7070 3.7070 3.8061 3.8061 4.2630 4.2630 4.7060 4.7060 5.1408 5.1408 5.2898 5.2898 5.4299 5.4299 8.1599 8.1599 8.2133 8.2133 8.2913 8.2913 8.6011 8.6011 8.9626 8.9626 9.4403 9.4403 9.8510 9.8510 k = 0.4667 0.3464 0.3403 ( 6980 PWs) bands (ev): -18.4333 -18.4333 -15.0960 -15.0960 -14.9850 -14.9850 -12.7769 -12.7769 -12.1495 -12.1495 -11.8360 -11.8360 -11.2147 -11.2147 -11.0193 -11.0193 -10.4590 -10.4590 -5.0709 -5.0709 -3.9091 -3.9091 -3.6318 -3.6318 -3.4133 -3.4133 -2.9824 -2.9824 -0.4814 -0.4814 -0.1711 -0.1711 0.0299 0.0299 0.4876 0.4876 0.5716 0.5716 0.8324 0.8324 0.9166 0.9166 1.3326 1.3326 1.4321 1.4321 1.6220 1.6220 1.8968 1.8968 2.3757 2.3757 3.1483 3.1483 3.5369 3.5369 3.6470 3.6470 3.7163 3.7163 3.8101 3.8101 4.2549 4.2549 4.6989 4.6989 5.1387 5.1387 5.2932 5.2932 5.4260 5.4260 8.1605 8.1605 8.2133 8.2133 8.2897 8.2897 8.6044 8.6044 8.9583 8.9583 9.3822 9.3822 9.9250 9.9250 k = 0.4583 0.3608 0.3403 ( 6982 PWs) bands (ev): -18.4329 -18.4329 -15.0945 -15.0945 -14.9864 -14.9864 -12.7717 -12.7717 -12.1734 -12.1734 -11.8200 -11.8200 -11.2117 -11.2117 -11.0194 -11.0194 -10.4605 -10.4605 -5.0700 -5.0700 -3.9064 -3.9064 -3.6392 -3.6392 -3.4040 -3.4040 -2.9851 -2.9851 -0.4868 -0.4868 -0.1617 -0.1617 0.0362 0.0362 0.4821 0.4821 0.5749 0.5749 0.8273 0.8273 0.9232 0.9232 1.3260 1.3260 1.4373 1.4373 1.6216 1.6216 1.8876 1.8876 2.3795 2.3795 3.1482 3.1482 3.5222 3.5222 3.6594 3.6594 3.7240 3.7240 3.8166 3.8166 4.2450 4.2450 4.6894 4.6894 5.1365 5.1365 5.2968 5.2968 5.4215 5.4215 8.1613 8.1613 8.2135 8.2135 8.2879 8.2879 8.6087 8.6087 8.9530 8.9530 9.3263 9.3263 10.0013 10.0013 k = 0.4500 0.3753 0.3403 ( 6970 PWs) bands (ev): -18.4326 -18.4326 -15.0928 -15.0928 -14.9882 -14.9882 -12.7655 -12.7655 -12.1992 -12.1992 -11.8037 -11.8037 -11.2079 -11.2079 -11.0197 -11.0197 -10.4623 -10.4623 -5.0689 -5.0689 -3.9031 -3.9031 -3.6474 -3.6474 -3.3934 -3.3934 -2.9885 -2.9885 -0.4928 -0.4928 -0.1508 -0.1508 0.0431 0.0431 0.4769 0.4769 0.5776 0.5776 0.8234 0.8234 0.9296 0.9296 1.3185 1.3185 1.4433 1.4433 1.6212 1.6212 1.8767 1.8767 2.3823 2.3823 3.1500 3.1500 3.5086 3.5086 3.6720 3.6720 3.7293 3.7293 3.8262 3.8262 4.2337 4.2337 4.6773 4.6773 5.1343 5.1343 5.3000 5.3000 5.4169 5.4169 8.1622 8.1622 8.2137 8.2137 8.2857 8.2857 8.6139 8.6139 8.9468 8.9468 9.2728 9.2728 10.0796 10.0796 k = 0.4417 0.3897 0.3403 ( 6970 PWs) bands (ev): -18.4321 -18.4321 -15.0908 -15.0908 -14.9902 -14.9902 -12.7581 -12.7581 -12.2262 -12.2262 -11.7877 -11.7877 -11.2036 -11.2036 -11.0202 -11.0202 -10.4643 -10.4643 -5.0677 -5.0677 -3.8992 -3.8992 -3.6562 -3.6562 -3.3820 -3.3820 -2.9923 -2.9923 -0.4994 -0.4994 -0.1384 -0.1384 0.0503 0.0503 0.4725 0.4725 0.5792 0.5792 0.8212 0.8212 0.9354 0.9354 1.3099 1.3099 1.4499 1.4499 1.6208 1.6208 1.8645 1.8645 2.3835 2.3835 3.1544 3.1544 3.4963 3.4963 3.6841 3.6841 3.7320 3.7320 3.8388 3.8388 4.2213 4.2213 4.6624 4.6624 5.1324 5.1324 5.3026 5.3026 5.4125 5.4125 8.1631 8.1631 8.2139 8.2139 8.2834 8.2834 8.6200 8.6200 8.9397 8.9397 9.2218 9.2218 10.1596 10.1596 k = 0.4333 0.4041 0.3403 ( 6972 PWs) bands (ev): -18.4317 -18.4317 -15.0885 -15.0885 -14.9925 -14.9925 -12.7496 -12.7496 -12.2541 -12.2541 -11.7724 -11.7724 -11.1985 -11.1985 -11.0211 -11.0211 -10.4664 -10.4664 -5.0664 -5.0664 -3.8948 -3.8948 -3.6654 -3.6654 -3.3700 -3.3700 -2.9965 -2.9965 -0.5062 -0.5062 -0.1249 -0.1249 0.0574 0.0574 0.4691 0.4691 0.5797 0.5797 0.8209 0.8209 0.9408 0.9408 1.3003 1.3003 1.4571 1.4571 1.6205 1.6205 1.8510 1.8510 2.3822 2.3822 3.1620 3.1620 3.4858 3.4858 3.6938 3.6938 3.7338 3.7338 3.8539 3.8539 4.2084 4.2084 4.6446 4.6446 5.1307 5.1307 5.3041 5.3041 5.4088 5.4088 8.1640 8.1640 8.2143 8.2143 8.2810 8.2810 8.6271 8.6271 8.9319 8.9319 9.1735 9.1735 10.2412 10.2412 k = 0.4250 0.4186 0.3403 ( 6988 PWs) bands (ev): -18.4312 -18.4312 -15.0859 -15.0859 -14.9951 -14.9951 -12.7400 -12.7400 -12.2824 -12.2824 -11.7580 -11.7580 -11.1928 -11.1928 -11.0224 -11.0224 -10.4685 -10.4685 -5.0651 -5.0651 -3.8899 -3.8899 -3.6749 -3.6749 -3.3576 -3.3576 -3.0011 -3.0011 -0.5131 -0.5131 -0.1106 -0.1106 0.0640 0.0640 0.4670 0.4670 0.5791 0.5791 0.8225 0.8225 0.9459 0.9459 1.2896 1.2896 1.4652 1.4652 1.6203 1.6203 1.8365 1.8365 2.3779 2.3779 3.1734 3.1734 3.4774 3.4774 3.6980 3.6980 3.7381 3.7381 3.8706 3.8706 4.1954 4.1954 4.6237 4.6237 5.1295 5.1295 5.3045 5.3045 5.4058 5.4058 8.1650 8.1650 8.2146 8.2146 8.2787 8.2787 8.6350 8.6350 8.9235 8.9235 9.1278 9.1278 10.3242 10.3242 k = 0.4167 0.4330 0.3403 ( 6992 PWs) bands (ev): -18.4306 -18.4306 -15.0830 -15.0830 -14.9980 -14.9980 -12.7293 -12.7293 -12.3109 -12.3109 -11.7449 -11.7449 -11.1864 -11.1864 -11.0242 -11.0242 -10.4706 -10.4706 -5.0636 -5.0636 -3.8844 -3.8844 -3.6845 -3.6845 -3.3451 -3.3451 -3.0059 -3.0059 -0.5200 -0.5200 -0.0957 -0.0957 0.0696 0.0696 0.4664 0.4664 0.5773 0.5773 0.8261 0.8261 0.9508 0.9508 1.2776 1.2776 1.4741 1.4741 1.6202 1.6202 1.8212 1.8212 2.3705 2.3705 3.1889 3.1889 3.4713 3.4713 3.6949 3.6949 3.7465 3.7465 3.8884 3.8884 4.1827 4.1827 4.5997 4.5997 5.1287 5.1287 5.3039 5.3039 5.4036 5.4036 8.1660 8.1660 8.2149 8.2149 8.2765 8.2765 8.6438 8.6438 8.9146 8.9146 9.0849 9.0849 10.4085 10.4085 k = 0.4083 0.4474 0.3403 ( 6988 PWs) bands (ev): -18.4301 -18.4301 -15.0798 -15.0798 -15.0012 -15.0012 -12.7176 -12.7176 -12.3392 -12.3392 -11.7330 -11.7330 -11.1794 -11.1794 -11.0267 -11.0267 -10.4726 -10.4726 -5.0622 -5.0622 -3.8785 -3.8785 -3.6941 -3.6941 -3.3326 -3.3326 -3.0109 -3.0109 -0.5266 -0.5266 -0.0804 -0.0804 0.0739 0.0739 0.4676 0.4676 0.5747 0.5747 0.8313 0.8313 0.9559 0.9559 1.2644 1.2644 1.4839 1.4839 1.6202 1.6202 1.8050 1.8050 2.3599 2.3599 3.2084 3.2084 3.4675 3.4675 3.6862 3.6862 3.7573 3.7573 3.9066 3.9066 4.1709 4.1709 4.5726 4.5726 5.1284 5.1284 5.3025 5.3025 5.4022 5.4022 8.1670 8.1670 8.2150 8.2150 8.2748 8.2748 8.6534 8.6534 8.9053 8.9053 9.0449 9.0449 10.4938 10.4938 k = 0.4000 0.4619 0.3403 ( 6990 PWs) bands (ev): -18.4296 -18.4296 -15.0764 -15.0764 -15.0046 -15.0046 -12.7048 -12.7048 -12.3673 -12.3673 -11.7224 -11.7224 -11.1718 -11.1718 -11.0299 -11.0299 -10.4744 -10.4744 -5.0607 -5.0607 -3.8722 -3.8722 -3.7038 -3.7038 -3.3206 -3.3206 -3.0159 -3.0159 -0.5329 -0.5329 -0.0651 -0.0651 0.0766 0.0766 0.4704 0.4704 0.5714 0.5714 0.8378 0.8378 0.9617 0.9617 1.2497 1.2497 1.4947 1.4947 1.6204 1.6204 1.7883 1.7883 2.3464 2.3464 3.2318 3.2318 3.4662 3.4662 3.6738 3.6738 3.7684 3.7684 3.9250 3.9250 4.1605 4.1605 4.5427 4.5427 5.1284 5.1284 5.3007 5.3007 5.4012 5.4012 8.1682 8.1682 8.2147 8.2147 8.2734 8.2734 8.6638 8.6638 8.8955 8.8955 9.0080 9.0080 10.5800 10.5800 k = 0.3917 0.4763 0.3403 ( 6992 PWs) bands (ev): -18.4290 -18.4290 -15.0727 -15.0727 -15.0083 -15.0083 -12.6910 -12.6910 -12.3950 -12.3950 -11.7132 -11.7132 -11.1636 -11.1636 -11.0340 -11.0340 -10.4761 -10.4761 -5.0593 -5.0593 -3.8656 -3.8656 -3.7133 -3.7133 -3.3090 -3.3090 -3.0208 -3.0208 -0.5387 -0.5387 -0.0498 -0.0498 0.0776 0.0776 0.4748 0.4748 0.5675 0.5675 0.8450 0.8450 0.9686 0.9686 1.2335 1.2335 1.5067 1.5067 1.6207 1.6207 1.7710 1.7710 2.3308 2.3308 3.2586 3.2586 3.4671 3.4671 3.6584 3.6584 3.7788 3.7788 3.9432 3.9432 4.1519 4.1519 4.5104 4.5104 5.1288 5.1288 5.2989 5.2989 5.4004 5.4004 8.1695 8.1695 8.2140 8.2140 8.2727 8.2727 8.6750 8.6750 8.8852 8.8852 8.9746 8.9746 10.6668 10.6668 k = 0.3833 0.4907 0.3403 ( 6972 PWs) bands (ev): -18.4285 -18.4285 -15.0688 -15.0688 -15.0123 -15.0123 -12.6762 -12.6762 -12.4221 -12.4221 -11.7054 -11.7054 -11.1548 -11.1548 -11.0390 -11.0390 -10.4775 -10.4775 -5.0580 -5.0580 -3.8587 -3.8587 -3.7226 -3.7226 -3.2983 -3.2983 -3.0254 -3.0254 -0.5440 -0.5440 -0.0350 -0.0350 0.0767 0.0767 0.4804 0.4804 0.5635 0.5635 0.8523 0.8523 0.9773 0.9773 1.2158 1.2158 1.5197 1.5197 1.6211 1.6211 1.7533 1.7533 2.3137 2.3137 3.2882 3.2882 3.4701 3.4701 3.6406 3.6406 3.7878 3.7878 3.9612 3.9612 4.1452 4.1452 4.4763 4.4763 5.1295 5.1295 5.2974 5.2974 5.3996 5.3996 8.1711 8.1711 8.2128 8.2128 8.2724 8.2724 8.6869 8.6869 8.8737 8.8737 8.9454 8.9454 10.7539 10.7539 k = 0.3750 0.5052 0.3403 ( 6980 PWs) bands (ev): -18.4281 -18.4281 -15.0646 -15.0646 -15.0165 -15.0165 -12.6605 -12.6605 -12.4484 -12.4484 -11.6989 -11.6989 -11.1454 -11.1454 -11.0450 -11.0450 -10.4786 -10.4786 -5.0568 -5.0568 -3.8517 -3.8517 -3.7316 -3.7316 -3.2887 -3.2887 -3.0295 -3.0295 -0.5486 -0.5486 -0.0206 -0.0206 0.0741 0.0741 0.4870 0.4870 0.5594 0.5594 0.8591 0.8591 0.9883 0.9883 1.1966 1.1966 1.5340 1.5340 1.6217 1.6217 1.7352 1.7352 2.2961 2.2961 3.3199 3.3199 3.4748 3.4748 3.6205 3.6205 3.7953 3.7953 3.9789 3.9789 4.1402 4.1402 4.4415 4.4415 5.1302 5.1302 5.2964 5.2964 5.3986 5.3986 8.1731 8.1731 8.2109 8.2109 8.2727 8.2727 8.6994 8.6994 8.8603 8.8603 8.9214 8.9214 10.8410 10.8410 k = 0.3667 0.5196 0.3403 ( 6988 PWs) bands (ev): -18.4277 -18.4277 -15.0602 -15.0602 -15.0209 -15.0209 -12.6439 -12.6439 -12.4738 -12.4738 -11.6938 -11.6938 -11.1355 -11.1355 -11.0521 -11.0521 -10.4795 -10.4795 -5.0558 -5.0558 -3.8448 -3.8448 -3.7401 -3.7401 -3.2805 -3.2805 -3.0330 -3.0330 -0.5525 -0.5525 -0.0069 -0.0069 0.0697 0.0697 0.4939 0.4939 0.5554 0.5554 0.8647 0.8647 1.0022 1.0022 1.1760 1.1760 1.5494 1.5494 1.6224 1.6224 1.7166 1.7166 2.2792 2.2792 3.3527 3.3527 3.4805 3.4805 3.5984 3.5984 3.8010 3.8010 3.9967 3.9967 4.1359 4.1359 4.4076 4.4076 5.1311 5.1311 5.2959 5.2959 5.3975 5.3975 8.1755 8.1755 8.2083 8.2083 8.2733 8.2733 8.7126 8.7126 8.8443 8.8443 8.9035 8.9035 10.9274 10.9274 k = 0.3583 0.5340 0.3403 ( 6974 PWs) bands (ev): -18.4274 -18.4274 -15.0556 -15.0556 -15.0255 -15.0255 -12.6264 -12.6264 -12.4982 -12.4982 -11.6899 -11.6899 -11.1251 -11.1251 -11.0602 -11.0602 -10.4801 -10.4801 -5.0549 -5.0549 -3.8383 -3.8383 -3.7478 -3.7478 -3.2739 -3.2739 -3.0357 -3.0357 -0.5556 -0.5556 0.0059 0.0059 0.0639 0.0639 0.5005 0.5005 0.5519 0.5519 0.8688 0.8688 1.0189 1.0189 1.1541 1.1541 1.5660 1.5660 1.6232 1.6232 1.6976 1.6976 2.2641 2.2641 3.3860 3.3860 3.4864 3.4864 3.5747 3.5747 3.8052 3.8052 4.0151 4.0151 4.1304 4.1304 4.3769 4.3769 5.1319 5.1319 5.2958 5.2958 5.3963 5.3963 8.1784 8.1784 8.2051 8.2051 8.2740 8.2740 8.7263 8.7263 8.8262 8.8262 8.8915 8.8915 11.0123 11.0123 k = 0.3500 0.5485 0.3403 ( 6970 PWs) bands (ev): -18.4271 -18.4271 -15.0507 -15.0507 -15.0303 -15.0303 -12.6084 -12.6084 -12.5212 -12.5212 -11.6873 -11.6873 -11.1143 -11.1143 -11.0694 -11.0694 -10.4805 -10.4805 -5.0543 -5.0543 -3.8327 -3.8327 -3.7542 -3.7542 -3.2690 -3.2690 -3.0376 -3.0376 -0.5578 -0.5578 0.0180 0.0180 0.0567 0.0567 0.5062 0.5062 0.5490 0.5490 0.8716 0.8716 1.0383 1.0383 1.1312 1.1312 1.5830 1.5830 1.6246 1.6246 1.6782 1.6782 2.2520 2.2520 3.4187 3.4187 3.4914 3.4914 3.5500 3.5500 3.8082 3.8082 4.0345 4.0345 4.1211 4.1211 4.3525 4.3525 5.1326 5.1326 5.2961 5.2961 5.3952 5.3952 8.1820 8.1820 8.2013 8.2013 8.2748 8.2748 8.7403 8.7403 8.8079 8.8079 8.8840 8.8840 11.0939 11.0939 k = 0.3417 0.5629 0.3403 ( 6972 PWs) bands (ev): -18.4270 -18.4270 -15.0457 -15.0457 -15.0353 -15.0353 -12.5905 -12.5905 -12.5422 -12.5422 -11.6857 -11.6857 -11.1031 -11.1031 -11.0797 -11.0797 -10.4806 -10.4806 -5.0539 -5.0539 -3.8287 -3.8287 -3.7586 -3.7586 -3.2661 -3.2661 -3.0387 -3.0387 -0.5592 -0.5592 0.0290 0.0290 0.0484 0.0484 0.5101 0.5101 0.5472 0.5472 0.8731 0.8731 1.0599 1.0599 1.1076 1.1076 1.5987 1.5987 1.6275 1.6275 1.6592 1.6592 2.2440 2.2440 3.4489 3.4489 3.4935 3.4935 3.5265 3.5265 3.8101 3.8101 4.0553 4.0553 4.1057 4.1057 4.3374 4.3374 5.1330 5.1330 5.2965 5.2965 5.3943 5.3943 8.1862 8.1862 8.1969 8.1969 8.2753 8.2753 8.7540 8.7540 8.7910 8.7910 8.8799 8.8799 11.1683 11.1684 k = 0.3333 0.5774 0.3403 ( 6978 PWs) bands (ev): -18.4269 -18.4269 -15.0405 -15.0405 -15.0405 -15.0405 -12.5791 -12.5791 -12.5546 -12.5546 -11.6852 -11.6852 -11.0932 -11.0932 -11.0893 -11.0893 -10.4807 -10.4807 -5.0537 -5.0537 -3.8273 -3.8273 -3.7602 -3.7602 -3.2652 -3.2652 -3.0390 -3.0390 -0.5597 -0.5597 0.0391 0.0391 0.0392 0.0392 0.5115 0.5115 0.5466 0.5466 0.8735 0.8735 1.0808 1.0808 1.0861 1.0861 1.6060 1.6060 1.6324 1.6324 1.6469 1.6469 2.2411 2.2411 3.4664 3.4664 3.4912 3.4912 3.5144 3.5144 3.8108 3.8108 4.0719 4.0719 4.0904 4.0904 4.3325 4.3325 5.1332 5.1332 5.2967 5.2967 5.3940 5.3940 8.1901 8.1901 8.1929 8.1929 8.2755 8.2755 8.7625 8.7625 8.7814 8.7814 8.8785 8.8785 11.2204 11.2268 k = 0.3333 0.5774 0.3403 ( 6978 PWs) bands (ev): -18.4269 -18.4269 -15.0405 -15.0405 -15.0405 -15.0405 -12.5791 -12.5791 -12.5546 -12.5546 -11.6852 -11.6852 -11.0932 -11.0932 -11.0893 -11.0893 -10.4807 -10.4807 -5.0537 -5.0537 -3.8273 -3.8273 -3.7602 -3.7602 -3.2652 -3.2652 -3.0390 -3.0390 -0.5597 -0.5597 0.0391 0.0391 0.0392 0.0392 0.5115 0.5115 0.5466 0.5466 0.8735 0.8735 1.0808 1.0808 1.0861 1.0861 1.6060 1.6060 1.6324 1.6324 1.6469 1.6469 2.2411 2.2411 3.4664 3.4664 3.4912 3.4912 3.5144 3.5144 3.8108 3.8108 4.0719 4.0719 4.0904 4.0904 4.3325 4.3325 5.1332 5.1332 5.2967 5.2967 5.3940 5.3940 8.1901 8.1901 8.1929 8.1929 8.2755 8.2755 8.7625 8.7625 8.7814 8.7814 8.8785 8.8785 11.2217 11.2258 k = 0.3250 0.5629 0.3403 ( 6970 PWs) bands (ev): -18.4270 -18.4270 -15.0459 -15.0459 -15.0352 -15.0352 -12.5903 -12.5903 -12.5423 -12.5423 -11.6857 -11.6857 -11.1037 -11.1037 -11.0790 -11.0790 -10.4807 -10.4807 -5.0539 -5.0539 -3.8288 -3.8288 -3.7585 -3.7585 -3.2661 -3.2661 -3.0388 -3.0388 -0.5592 -0.5592 0.0292 0.0292 0.0483 0.0483 0.5102 0.5102 0.5469 0.5469 0.8732 0.8732 1.0594 1.0594 1.1081 1.1081 1.5976 1.5976 1.6278 1.6278 1.6600 1.6600 2.2442 2.2442 3.4497 3.4497 3.4915 3.4915 3.5273 3.5273 3.8097 3.8097 4.0527 4.0527 4.1098 4.1098 4.3366 4.3366 5.1330 5.1330 5.2964 5.2964 5.3944 5.3944 8.1854 8.1854 8.1977 8.1977 8.2753 8.2753 8.7547 8.7547 8.7904 8.7904 8.8798 8.8798 11.1840 11.1841 k = 0.3167 0.5485 0.3403 ( 6970 PWs) bands (ev): -18.4271 -18.4271 -15.0514 -15.0514 -15.0297 -15.0297 -12.6075 -12.6075 -12.5221 -12.5221 -11.6870 -11.6870 -11.1170 -11.1170 -11.0667 -11.0667 -10.4806 -10.4806 -5.0543 -5.0543 -3.8330 -3.8330 -3.7539 -3.7539 -3.2687 -3.2687 -3.0383 -3.0383 -0.5578 -0.5578 0.0186 0.0186 0.0565 0.0565 0.5065 0.5065 0.5475 0.5475 0.8722 0.8722 1.0362 1.0362 1.1332 1.1332 1.5778 1.5778 1.6259 1.6259 1.6819 1.6819 2.2540 2.2540 3.4210 3.4210 3.4849 3.4849 3.5512 3.5512 3.8053 3.8053 4.0268 4.0268 4.1395 4.1395 4.3474 4.3474 5.1324 5.1324 5.2955 5.2955 5.3957 5.3957 8.1786 8.1786 8.2047 8.2047 8.2745 8.2745 8.7434 8.7434 8.8053 8.8053 8.8837 8.8837 11.1430 11.1431 k = 0.3083 0.5340 0.3403 ( 6966 PWs) bands (ev): -18.4275 -18.4275 -15.0570 -15.0570 -15.0240 -15.0240 -12.6244 -12.6244 -12.5000 -12.5000 -11.6892 -11.6892 -11.1311 -11.1311 -11.0541 -11.0541 -10.4807 -10.4807 -5.0551 -5.0551 -3.8392 -3.8392 -3.7472 -3.7472 -3.2728 -3.2728 -3.0380 -3.0380 -0.5553 -0.5553 0.0075 0.0075 0.0635 0.0635 0.5010 0.5010 0.5474 0.5474 0.8707 0.8707 1.0141 1.0141 1.1586 1.1586 1.5541 1.5541 1.6255 1.6255 1.7060 1.7060 2.2707 2.2707 3.3896 3.3896 3.4731 3.4731 3.5739 3.5739 3.7967 3.7967 4.0053 4.0053 4.1730 4.1730 4.3628 4.3628 5.1315 5.1315 5.2939 5.2939 5.3980 5.3980 8.1709 8.1709 8.2127 8.2127 8.2732 8.2732 8.7336 8.7336 8.8213 8.8213 8.8902 8.8902 11.1018 11.1018 k = 0.3000 0.5196 0.3403 ( 6978 PWs) bands (ev): -18.4279 -18.4279 -15.0628 -15.0628 -15.0183 -15.0183 -12.6401 -12.6401 -12.4771 -12.4771 -11.6920 -11.6920 -11.1461 -11.1461 -11.0412 -11.0412 -10.4810 -10.4810 -5.0562 -5.0562 -3.8467 -3.8467 -3.7389 -3.7389 -3.2782 -3.2782 -3.0381 -3.0381 -0.5518 -0.5518 -0.0039 -0.0039 0.0695 0.0695 0.4939 0.4939 0.5462 0.5462 0.8689 0.8689 0.9937 0.9937 1.1839 1.1839 1.5290 1.5290 1.6256 1.6256 1.7313 1.7313 2.2945 2.2945 3.3570 3.3570 3.4569 3.4569 3.5906 3.5906 3.7853 3.7853 3.9911 3.9911 4.2097 4.2097 4.3813 4.3813 5.1300 5.1300 5.2916 5.2916 5.4012 5.4012 8.1621 8.1621 8.2216 8.2216 8.2715 8.2715 8.7259 8.7259 8.8377 8.8377 8.8993 8.8993 11.0604 11.0604 k = 0.2917 0.5052 0.3403 ( 6978 PWs) bands (ev): -18.4285 -18.4285 -15.0686 -15.0686 -15.0124 -15.0124 -12.6546 -12.6546 -12.4534 -12.4534 -11.6955 -11.6955 -11.1618 -11.1618 -11.0282 -11.0282 -10.4815 -10.4815 -5.0576 -5.0576 -3.8549 -3.8549 -3.7298 -3.7298 -3.2845 -3.2845 -3.0391 -3.0391 -0.5473 -0.5473 -0.0156 -0.0156 0.0742 0.0742 0.4852 0.4852 0.5435 0.5435 0.8667 0.8667 0.9758 0.9758 1.2088 1.2088 1.5033 1.5033 1.6258 1.6258 1.7572 1.7572 2.3253 2.3253 3.3235 3.3235 3.4369 3.4369 3.5956 3.5956 3.7772 3.7772 3.9844 3.9844 4.2491 4.2491 4.4022 4.4022 5.1282 5.1282 5.2887 5.2887 5.4051 5.4051 8.1523 8.1523 8.2312 8.2312 8.2696 8.2696 8.7204 8.7204 8.8544 8.8544 8.9111 8.9111 11.0189 11.0189 k = 0.2833 0.4907 0.3403 ( 6982 PWs) bands (ev): -18.4293 -18.4293 -15.0745 -15.0745 -15.0065 -15.0065 -12.6677 -12.6677 -12.4290 -12.4290 -11.6995 -11.6995 -11.1781 -11.1781 -11.0150 -11.0150 -10.4823 -10.4823 -5.0593 -5.0593 -3.8636 -3.8636 -3.7200 -3.7200 -3.2916 -3.2916 -3.0413 -3.0413 -0.5417 -0.5417 -0.0275 -0.0275 0.0774 0.0774 0.4751 0.4751 0.5393 0.5393 0.8643 0.8643 0.9606 0.9606 1.2332 1.2332 1.4777 1.4777 1.6260 1.6260 1.7832 1.7832 2.3628 2.3628 3.2896 3.2896 3.4138 3.4138 3.5842 3.5842 3.7795 3.7795 3.9835 3.9835 4.2902 4.2902 4.4250 4.4250 5.1260 5.1260 5.2854 5.2854 5.4095 5.4095 8.1414 8.1414 8.2403 8.2403 8.2688 8.2688 8.7170 8.7170 8.8714 8.8714 8.9256 8.9256 10.9772 10.9772 k = 0.2750 0.4763 0.3403 ( 6970 PWs) bands (ev): -18.4302 -18.4302 -15.0805 -15.0805 -15.0005 -15.0005 -12.6794 -12.6794 -12.4041 -12.4041 -11.7039 -11.7039 -11.1949 -11.1949 -11.0017 -11.0017 -10.4835 -10.4835 -5.0614 -5.0614 -3.8726 -3.8726 -3.7099 -3.7099 -3.2992 -3.2992 -3.0450 -3.0450 -0.5351 -0.5351 -0.0395 -0.0395 0.0788 0.0788 0.4636 0.4636 0.5336 0.5336 0.8616 0.8616 0.9487 0.9487 1.2566 1.2566 1.4526 1.4526 1.6264 1.6264 1.8091 1.8091 2.4064 2.4064 3.2553 3.2553 3.3878 3.3878 3.5579 3.5579 3.7935 3.7935 3.9865 3.9865 4.3319 4.3319 4.4497 4.4497 5.1234 5.1234 5.2819 5.2819 5.4143 5.4143 8.1296 8.1296 8.2454 8.2454 8.2725 8.2725 8.7159 8.7159 8.8887 8.8887 8.9427 8.9427 10.9356 10.9356 k = 0.2667 0.4619 0.3403 ( 6982 PWs) bands (ev): -18.4313 -18.4313 -15.0866 -15.0866 -14.9944 -14.9944 -12.6897 -12.6897 -12.3787 -12.3787 -11.7086 -11.7086 -11.2122 -11.2122 -10.9883 -10.9883 -10.4852 -10.4852 -5.0638 -5.0638 -3.8818 -3.8818 -3.6996 -3.6996 -3.3071 -3.3071 -3.0504 -3.0504 -0.5275 -0.5275 -0.0515 -0.0515 0.0781 0.0781 0.4511 0.4511 0.5267 0.5267 0.8586 0.8586 0.9404 0.9404 1.2788 1.2788 1.4289 1.4289 1.6270 1.6270 1.8348 1.8348 2.4553 2.4553 3.2207 3.2207 3.3596 3.3596 3.5226 3.5226 3.8154 3.8154 3.9917 3.9917 4.3729 4.3729 4.4769 4.4769 5.1206 5.1206 5.2782 5.2782 5.4191 5.4191 8.1168 8.1168 8.2441 8.2441 8.2831 8.2831 8.7168 8.7168 8.9063 8.9063 8.9625 8.9625 10.8942 10.8942 k = 0.2583 0.4474 0.3403 ( 6974 PWs) bands (ev): -18.4325 -18.4325 -15.0926 -15.0926 -14.9883 -14.9883 -12.6985 -12.6985 -12.3529 -12.3529 -11.7137 -11.7137 -11.2298 -11.2298 -10.9749 -10.9749 -10.4874 -10.4874 -5.0665 -5.0665 -3.8910 -3.8910 -3.6892 -3.6892 -3.3152 -3.3152 -3.0576 -3.0576 -0.5189 -0.5189 -0.0635 -0.0635 0.0748 0.0748 0.4377 0.4377 0.5189 0.5189 0.8553 0.8553 0.9357 0.9357 1.2984 1.2984 1.4079 1.4079 1.6278 1.6278 1.8601 1.8601 2.5085 2.5085 3.1860 3.1860 3.3296 3.3296 3.4838 3.4838 3.8418 3.8418 3.9984 3.9984 4.4114 4.4114 4.5074 4.5074 5.1174 5.1174 5.2747 5.2747 5.4240 5.4240 8.1032 8.1032 8.2388 8.2388 8.2982 8.2982 8.7198 8.7198 8.9243 8.9243 8.9847 8.9847 10.8531 10.8531 k = 0.2500 0.4330 0.3403 ( 6978 PWs) bands (ev): -18.4339 -18.4339 -15.0987 -15.0987 -14.9822 -14.9822 -12.7060 -12.7060 -12.3267 -12.3267 -11.7189 -11.7189 -11.2477 -11.2477 -10.9616 -10.9616 -10.4902 -10.4902 -5.0695 -5.0695 -3.9003 -3.9003 -3.6787 -3.6787 -3.3234 -3.3234 -3.0668 -3.0668 -0.5094 -0.5094 -0.0754 -0.0754 0.0686 0.0686 0.4237 0.4237 0.5107 0.5107 0.8517 0.8517 0.9346 0.9346 1.3119 1.3119 1.3932 1.3932 1.6290 1.6290 1.8849 1.8849 2.5647 2.5647 3.1510 3.1510 3.2979 3.2979 3.4452 3.4452 3.8706 3.8706 4.0061 4.0061 4.4459 4.4459 4.5418 4.5418 5.1141 5.1141 5.2713 5.2713 5.4286 5.4286 8.0887 8.0887 8.2312 8.2312 8.3160 8.3160 8.7248 8.7248 8.9425 8.9425 9.0095 9.0095 10.8125 10.8125 k = 0.2417 0.4186 0.3403 ( 6980 PWs) bands (ev): -18.4354 -18.4354 -15.1048 -15.1048 -14.9760 -14.9760 -12.7122 -12.7122 -12.3002 -12.3002 -11.7242 -11.7242 -11.2657 -11.2657 -10.9483 -10.9483 -10.4936 -10.4936 -5.0729 -5.0729 -3.9095 -3.9095 -3.6684 -3.6684 -3.3314 -3.3314 -3.0780 -3.0780 -0.4989 -0.4989 -0.0874 -0.0874 0.0592 0.0592 0.4092 0.4092 0.5030 0.5030 0.8476 0.8476 0.9370 0.9370 1.3129 1.3129 1.3911 1.3911 1.6309 1.6309 1.9093 1.9093 2.6225 2.6225 3.1159 3.1159 3.2649 3.2649 3.4094 3.4094 3.9007 3.9007 4.0146 4.0146 4.4760 4.4760 4.5799 4.5799 5.1106 5.1106 5.2682 5.2682 5.4330 5.4330 8.0736 8.0736 8.2220 8.2220 8.3360 8.3360 8.7317 8.7317 8.9609 8.9609 9.0369 9.0369 10.7725 10.7725 k = 0.2333 0.4041 0.3403 ( 6980 PWs) bands (ev): -18.4371 -18.4371 -15.1109 -15.1109 -14.9699 -14.9699 -12.7169 -12.7169 -12.2734 -12.2734 -11.7296 -11.7296 -11.2839 -11.2839 -10.9352 -10.9352 -10.4977 -10.4977 -5.0765 -5.0765 -3.9187 -3.9187 -3.6581 -3.6581 -3.3393 -3.3393 -3.0913 -3.0913 -0.4876 -0.4876 -0.0993 -0.0993 0.0463 0.0463 0.3942 0.3942 0.4963 0.4963 0.8432 0.8432 0.9426 0.9426 1.3010 1.3010 1.4021 1.4021 1.6335 1.6335 1.9333 1.9333 2.6796 2.6796 3.0810 3.0810 3.2307 3.2307 3.3792 3.3792 3.9314 3.9314 4.0240 4.0240 4.5021 4.5021 4.6205 4.6205 5.1069 5.1069 5.2655 5.2655 5.4371 5.4371 8.0580 8.0580 8.2114 8.2114 8.3578 8.3578 8.7404 8.7404 8.9795 8.9795 9.0667 9.0667 10.7331 10.7331 k = 0.2250 0.3897 0.3403 ( 6976 PWs) bands (ev): -18.4390 -18.4390 -15.1170 -15.1170 -14.9638 -14.9638 -12.7205 -12.7205 -12.2465 -12.2465 -11.7349 -11.7349 -11.3021 -11.3021 -10.9222 -10.9222 -10.5024 -10.5024 -5.0805 -5.0805 -3.9277 -3.9277 -3.6481 -3.6481 -3.3470 -3.3470 -3.1065 -3.1065 -0.4754 -0.4754 -0.1112 -0.1112 0.0302 0.0302 0.3784 0.3784 0.4915 0.4915 0.8383 0.8383 0.9510 0.9510 1.2828 1.2828 1.4190 1.4190 1.6372 1.6372 1.9571 1.9571 2.7332 2.7332 3.0468 3.0468 3.1953 3.1953 3.3571 3.3571 3.9622 3.9622 4.0343 4.0343 4.5251 4.5251 4.6623 4.6623 5.1030 5.1030 5.2632 5.2632 5.4408 5.4408 8.0419 8.0419 8.1993 8.1993 8.3815 8.3815 8.7507 8.7507 8.9983 8.9983 9.0991 9.0991 10.6946 10.6946 k = 0.2167 0.3753 0.3403 ( 6988 PWs) bands (ev): -18.4409 -18.4409 -15.1230 -15.1230 -14.9577 -14.9577 -12.7227 -12.7227 -12.2195 -12.2195 -11.7401 -11.7401 -11.3202 -11.3202 -10.9094 -10.9094 -10.5078 -10.5078 -5.0847 -5.0847 -3.9366 -3.9366 -3.6383 -3.6383 -3.3543 -3.3543 -3.1234 -3.1234 -0.4626 -0.4626 -0.1234 -0.1234 0.0112 0.0112 0.3615 0.3615 0.4890 0.4890 0.8330 0.8330 0.9619 0.9619 1.2625 1.2625 1.4375 1.4375 1.6424 1.6424 1.9807 1.9807 2.7791 2.7791 3.0150 3.0150 3.1591 3.1591 3.3458 3.3458 3.9924 3.9924 4.0461 4.0461 4.5458 4.5458 4.7037 4.7037 5.0989 5.0989 5.2617 5.2617 5.4442 5.4442 8.0254 8.0254 8.1858 8.1858 8.4070 8.4070 8.7627 8.7627 9.0171 9.0171 9.1339 9.1339 10.6568 10.6568 k = 0.2083 0.3608 0.3403 ( 6988 PWs) bands (ev): -18.4430 -18.4430 -15.1289 -15.1289 -14.9518 -14.9518 -12.7239 -12.7239 -12.1924 -12.1924 -11.7450 -11.7450 -11.3382 -11.3382 -10.8968 -10.8968 -10.5140 -10.5140 -5.0892 -5.0892 -3.9453 -3.9453 -3.6288 -3.6288 -3.3613 -3.3613 -3.1419 -3.1419 -0.4491 -0.4491 -0.1360 -0.1360 -0.0099 -0.0099 0.3435 0.3435 0.4892 0.4892 0.8272 0.8272 0.9747 0.9747 1.2417 1.2417 1.4555 1.4555 1.6493 1.6493 2.0044 2.0044 2.8111 2.8111 2.9884 2.9884 3.1226 3.1226 3.3481 3.3481 4.0213 4.0213 4.0600 4.0600 4.5646 4.5646 4.7439 4.7439 5.0945 5.0945 5.2609 5.2609 5.4473 5.4473 8.0087 8.0087 8.1709 8.1709 8.4343 8.4343 8.7763 8.7763 9.0360 9.0360 9.1711 9.1711 10.6198 10.6198 k = 0.2000 0.3464 0.3403 ( 6980 PWs) bands (ev): -18.4452 -18.4452 -15.1348 -15.1348 -14.9458 -14.9458 -12.7239 -12.7239 -12.1654 -12.1654 -11.7497 -11.7497 -11.3560 -11.3560 -10.8846 -10.8846 -10.5208 -10.5208 -5.0939 -5.0939 -3.9538 -3.9538 -3.6198 -3.6198 -3.3681 -3.3681 -3.1618 -3.1618 -0.4351 -0.4351 -0.1493 -0.1493 -0.0322 -0.0322 0.3242 0.3242 0.4918 0.4918 0.8209 0.8209 0.9887 0.9887 1.2213 1.2213 1.4720 1.4720 1.6582 1.6582 2.0285 2.0285 2.8227 2.8227 2.9707 2.9707 3.0866 3.0866 3.3660 3.3660 4.0470 4.0470 4.0779 4.0779 4.5817 4.5817 4.7821 4.7821 5.0899 5.0899 5.2611 5.2611 5.4501 5.4501 7.9919 7.9919 8.1546 8.1546 8.4633 8.4633 8.7913 8.7913 9.0549 9.0549 9.2105 9.2105 10.5837 10.5837 k = 0.1917 0.3320 0.3403 ( 6976 PWs) bands (ev): -18.4475 -18.4475 -15.1405 -15.1405 -14.9400 -14.9400 -12.7229 -12.7229 -12.1385 -12.1385 -11.7541 -11.7541 -11.3735 -11.3735 -10.8726 -10.8726 -10.5284 -10.5284 -5.0989 -5.0989 -3.9621 -3.9621 -3.6111 -3.6111 -3.3747 -3.3747 -3.1826 -3.1826 -0.4206 -0.4206 -0.1639 -0.1639 -0.0547 -0.0547 0.3038 0.3038 0.4965 0.4965 0.8142 0.8142 1.0029 1.0029 1.2022 1.2022 1.4863 1.4863 1.6691 1.6691 2.0533 2.0533 2.8129 2.8129 2.9608 2.9608 3.0529 3.0529 3.3998 3.3998 4.0682 4.0682 4.1011 4.1011 4.5971 4.5971 4.8174 4.8174 5.0850 5.0850 5.2624 5.2624 5.4527 5.4527 7.9751 7.9751 8.1369 8.1369 8.4941 8.4941 8.8076 8.8076 9.0739 9.0739 9.2519 9.2519 10.5484 10.5484 k = 0.1833 0.3175 0.3403 ( 6970 PWs) bands (ev): -18.4498 -18.4498 -15.1462 -15.1462 -14.9343 -14.9343 -12.7210 -12.7210 -12.1118 -12.1118 -11.7580 -11.7580 -11.3907 -11.3907 -10.8611 -10.8611 -10.5366 -10.5366 -5.1040 -5.1040 -3.9701 -3.9701 -3.6029 -3.6029 -3.3812 -3.3812 -3.2039 -3.2039 -0.4058 -0.4058 -0.1805 -0.1805 -0.0760 -0.0760 0.2827 0.2827 0.5030 0.5030 0.8071 0.8071 1.0157 1.0157 1.1858 1.1858 1.4982 1.4982 1.6819 1.6819 2.0791 2.0791 2.7892 2.7892 2.9498 2.9498 3.0251 3.0251 3.4474 3.4474 4.0867 4.0867 4.1279 4.1279 4.6111 4.6111 4.8492 4.8492 5.0802 5.0802 5.2649 5.2649 5.4552 5.4552 7.9582 7.9582 8.1179 8.1179 8.5265 8.5265 8.8253 8.8253 9.0929 9.0929 9.2954 9.2954 10.5139 10.5139 k = 0.1750 0.3031 0.3403 ( 6970 PWs) bands (ev): -18.4523 -18.4523 -15.1517 -15.1517 -14.9287 -14.9287 -12.7183 -12.7183 -12.0853 -12.0853 -11.7615 -11.7615 -11.4076 -11.4076 -10.8499 -10.8499 -10.5455 -10.5455 -5.1094 -5.1094 -3.9779 -3.9779 -3.5952 -3.5952 -3.3879 -3.3879 -3.2253 -3.2253 -0.3908 -0.3908 -0.1996 -0.1996 -0.0951 -0.0951 0.2609 0.2609 0.5109 0.5109 0.7995 0.7995 1.0248 1.0248 1.1740 1.1740 1.5075 1.5075 1.6959 1.6959 2.1065 2.1065 2.7592 2.7592 2.9292 2.9292 3.0068 3.0068 3.5056 3.5056 4.1048 4.1048 4.1560 4.1560 4.6235 4.6235 4.8764 4.8764 5.0759 5.0759 5.2687 5.2687 5.4576 5.4576 7.9415 7.9415 8.0976 8.0976 8.5605 8.5605 8.8442 8.8442 9.1119 9.1119 9.3405 9.3405 10.4803 10.4803 k = 0.1667 0.2887 0.3403 ( 6956 PWs) bands (ev): -18.4548 -18.4548 -15.1570 -15.1570 -14.9233 -14.9233 -12.7148 -12.7148 -12.0592 -12.0592 -11.7645 -11.7645 -11.4240 -11.4240 -10.8392 -10.8392 -10.5549 -10.5549 -5.1149 -5.1149 -3.9853 -3.9853 -3.5882 -3.5882 -3.3952 -3.3952 -3.2460 -3.2460 -0.3756 -0.3756 -0.2215 -0.2215 -0.1112 -0.1112 0.2387 0.2387 0.5198 0.5198 0.7915 0.7915 1.0275 1.0275 1.1696 1.1696 1.5147 1.5147 1.7101 1.7101 2.1358 2.1358 2.7271 2.7271 2.9000 2.9000 2.9966 2.9966 3.5710 3.5710 4.1237 4.1237 4.1842 4.1842 4.6343 4.6343 4.8978 4.8978 5.0731 5.0731 5.2738 5.2738 5.4600 5.4600 7.9251 7.9251 8.0761 8.0761 8.5961 8.5961 8.8642 8.8642 9.1310 9.1310 9.3871 9.3871 10.4475 10.4475 k = 0.1583 0.2742 0.3403 ( 6952 PWs) bands (ev): -18.4573 -18.4573 -15.1622 -15.1622 -14.9180 -14.9180 -12.7107 -12.7107 -12.0336 -12.0336 -11.7670 -11.7670 -11.4400 -11.4400 -10.8289 -10.8289 -10.5650 -10.5650 -5.1206 -5.1206 -3.9924 -3.9924 -3.5819 -3.5819 -3.4034 -3.4034 -3.2653 -3.2653 -0.3605 -0.3605 -0.2458 -0.2458 -0.1243 -0.1243 0.2163 0.2163 0.5293 0.5293 0.7832 0.7832 1.0220 1.0220 1.1740 1.1740 1.5200 1.5200 1.7238 1.7238 2.1673 2.1673 2.6947 2.6947 2.8669 2.8669 2.9902 2.9902 3.6408 3.6408 4.1440 4.1440 4.2120 4.2120 4.6436 4.6436 4.9123 4.9123 5.0726 5.0726 5.2802 5.2802 5.4625 5.4625 7.9089 7.9089 8.0533 8.0533 8.6331 8.6331 8.8853 8.8853 9.1501 9.1501 9.4350 9.4350 10.4156 10.4156 k = 0.1500 0.2598 0.3403 ( 6964 PWs) bands (ev): -18.4598 -18.4598 -15.1673 -15.1673 -14.9129 -14.9129 -12.7061 -12.7061 -12.0084 -12.0084 -11.7689 -11.7689 -11.4555 -11.4555 -10.8191 -10.8191 -10.5755 -10.5755 -5.1263 -5.1263 -3.9992 -3.9992 -3.5763 -3.5763 -3.4133 -3.4133 -3.2824 -3.2824 -0.3455 -0.3455 -0.2717 -0.2717 -0.1349 -0.1349 0.1939 0.1939 0.5393 0.5393 0.7746 0.7746 1.0094 1.0094 1.1859 1.1859 1.5239 1.5239 1.7360 1.7360 2.2012 2.2012 2.6631 2.6631 2.8328 2.8328 2.9855 2.9855 3.7129 3.7129 4.1657 4.1657 4.2393 4.2393 4.6514 4.6514 4.9188 4.9188 5.0754 5.0754 5.2879 5.2879 5.4651 5.4651 7.8930 7.8930 8.0294 8.0294 8.6714 8.6714 8.9073 8.9073 9.1694 9.1694 9.4837 9.4837 10.3845 10.3845 k = 0.1417 0.2454 0.3403 ( 6960 PWs) bands (ev): -18.4623 -18.4623 -15.1721 -15.1721 -14.9080 -14.9080 -12.7010 -12.7010 -11.9839 -11.9839 -11.7702 -11.7702 -11.4704 -11.4704 -10.8098 -10.8098 -10.5864 -10.5864 -5.1322 -5.1322 -4.0055 -4.0055 -3.5716 -3.5716 -3.4251 -3.4251 -3.2965 -3.2965 -0.3312 -0.3312 -0.2979 -0.2979 -0.1434 -0.1434 0.1717 0.1717 0.5494 0.5494 0.7657 0.7657 0.9923 0.9923 1.2029 1.2029 1.5267 1.5267 1.7459 1.7459 2.2373 2.2373 2.6329 2.6329 2.7993 2.7993 2.9820 2.9820 3.7858 3.7858 4.1891 4.1891 4.2660 4.2660 4.6577 4.6577 4.9174 4.9174 5.0811 5.0811 5.2967 5.2967 5.4679 5.4679 7.8776 7.8776 8.0045 8.0045 8.7110 8.7110 8.9301 8.9301 9.1888 9.1888 9.5331 9.5331 10.3543 10.3543 k = 0.1333 0.2309 0.3403 ( 6960 PWs) bands (ev): -18.4649 -18.4649 -15.1768 -15.1768 -14.9032 -14.9032 -12.6956 -12.6956 -11.9601 -11.9601 -11.7709 -11.7709 -11.4847 -11.4847 -10.8011 -10.8011 -10.5977 -10.5977 -5.1380 -5.1380 -4.0114 -4.0114 -3.5681 -3.5681 -3.4387 -3.4387 -3.3072 -3.3072 -0.3290 -0.3290 -0.3126 -0.3126 -0.1503 -0.1503 0.1498 0.1498 0.5595 0.5595 0.7567 0.7567 0.9727 0.9727 1.2229 1.2229 1.5287 1.5287 1.7533 1.7533 2.2753 2.2753 2.6045 2.6045 2.7674 2.7674 2.9793 2.9793 3.8583 3.8583 4.2141 4.2141 4.2919 4.2919 4.6624 4.6624 4.9095 4.9095 5.0886 5.0886 5.3067 5.3067 5.4709 5.4709 7.8627 7.8627 7.9788 7.9788 8.7516 8.7516 8.9535 8.9535 9.2084 9.2084 9.5826 9.5826 10.3251 10.3251 k = 0.1250 0.2165 0.3403 ( 6956 PWs) bands (ev): -18.4673 -18.4673 -15.1812 -15.1812 -14.8987 -14.8987 -12.6901 -12.6901 -11.9370 -11.9370 -11.7710 -11.7710 -11.4984 -11.4984 -10.7929 -10.7929 -10.6092 -10.6092 -5.1439 -5.1439 -4.0170 -4.0170 -3.5661 -3.5661 -3.4537 -3.4537 -3.3147 -3.3147 -0.3538 -0.3538 -0.3003 -0.3003 -0.1558 -0.1558 0.1284 0.1284 0.5695 0.5695 0.7475 0.7475 0.9518 0.9518 1.2444 1.2444 1.5301 1.5301 1.7578 1.7578 2.3143 2.3143 2.5781 2.5781 2.7379 2.7379 2.9776 2.9776 3.9293 3.9293 4.2406 4.2406 4.3172 4.3172 4.6658 4.6658 4.8965 4.8965 5.0963 5.0963 5.3178 5.3178 5.4741 5.4741 7.8483 7.8483 7.9524 7.9524 8.7931 8.7931 8.9774 8.9774 9.2283 9.2283 9.6319 9.6319 10.2968 10.2968 k = 0.1167 0.2021 0.3403 ( 6944 PWs) bands (ev): -18.4697 -18.4697 -15.1854 -15.1854 -14.8945 -14.8945 -12.6844 -12.6844 -11.9148 -11.9148 -11.7705 -11.7705 -11.5114 -11.5114 -10.7853 -10.7853 -10.6209 -10.6209 -5.1497 -5.1497 -4.0220 -4.0220 -3.5661 -3.5661 -3.4687 -3.4687 -3.3194 -3.3194 -0.3795 -0.3795 -0.2868 -0.2868 -0.1603 -0.1603 0.1075 0.1075 0.5793 0.5793 0.7383 0.7383 0.9306 0.9306 1.2668 1.2668 1.5311 1.5311 1.7594 1.7594 2.3528 2.3528 2.5539 2.5539 2.7120 2.7120 2.9769 2.9769 3.9980 3.9980 4.2685 4.2685 4.3417 4.3417 4.6677 4.6677 4.8797 4.8797 5.1030 5.1030 5.3300 5.3300 5.4775 5.4775 7.8346 7.8346 7.9254 7.9254 8.8352 8.8352 9.0015 9.0015 9.2486 9.2486 9.6805 9.6805 10.2695 10.2695 k = 0.1083 0.1876 0.3403 ( 6944 PWs) bands (ev): -18.4721 -18.4721 -15.1893 -15.1893 -14.8904 -14.8904 -12.6787 -12.6787 -11.8936 -11.8936 -11.7695 -11.7695 -11.5238 -11.5238 -10.7784 -10.7784 -10.6326 -10.6326 -5.1554 -5.1554 -4.0266 -4.0266 -3.5689 -3.5689 -3.4823 -3.4823 -3.3219 -3.3219 -0.4045 -0.4045 -0.2738 -0.2738 -0.1638 -0.1638 0.0874 0.0874 0.5887 0.5887 0.7292 0.7292 0.9095 0.9095 1.2895 1.2895 1.5317 1.5317 1.7582 1.7582 2.3888 2.3888 2.5321 2.5321 2.6914 2.6914 2.9771 2.9771 4.0639 4.0639 4.2976 4.2976 4.3657 4.3657 4.6683 4.6683 4.8602 4.8602 5.1076 5.1076 5.3433 5.3433 5.4810 5.4810 7.8216 7.8216 7.8981 7.8981 8.8776 8.8776 9.0256 9.0256 9.2695 9.2695 9.7280 9.7280 10.2432 10.2432 k = 0.1000 0.1732 0.3403 ( 6936 PWs) bands (ev): -18.4743 -18.4743 -15.1931 -15.1931 -14.8866 -14.8866 -12.6730 -12.6730 -11.8734 -11.8734 -11.7679 -11.7679 -11.5354 -11.5354 -10.7720 -10.7720 -10.6441 -10.6441 -5.1610 -5.1610 -4.0308 -4.0308 -3.5753 -3.5753 -3.4930 -3.4930 -3.3228 -3.3228 -0.4283 -0.4283 -0.2613 -0.2613 -0.1665 -0.1665 0.0682 0.0682 0.5976 0.5976 0.7201 0.7201 0.8891 0.8891 1.3123 1.3123 1.5322 1.5322 1.7544 1.7544 2.4189 2.4189 2.5128 2.5128 2.6784 2.6784 2.9785 2.9785 4.1262 4.1262 4.3275 4.3275 4.3893 4.3893 4.6676 4.6676 4.8387 4.8387 5.1097 5.1097 5.3576 5.3576 5.4847 5.4847 7.8093 7.8093 7.8707 7.8707 8.9200 8.9200 9.0494 9.0494 9.2910 9.2910 9.7737 9.7737 10.2181 10.2181 k = 0.0917 0.1588 0.3403 ( 6928 PWs) bands (ev): -18.4765 -18.4765 -15.1965 -15.1965 -14.8831 -14.8831 -12.6676 -12.6676 -11.8544 -11.8544 -11.7659 -11.7659 -11.5463 -11.5463 -10.7663 -10.7663 -10.6554 -10.6554 -5.1664 -5.1664 -4.0345 -4.0345 -3.5853 -3.5853 -3.5002 -3.5002 -3.3226 -3.3226 -0.4506 -0.4506 -0.2497 -0.2497 -0.1685 -0.1685 0.0499 0.0499 0.6060 0.6060 0.7113 0.7113 0.8695 0.8695 1.3349 1.3349 1.5325 1.5325 1.7481 1.7481 2.4393 2.4393 2.4964 2.4964 2.6760 2.6760 2.9810 2.9810 4.1845 4.1845 4.3577 4.3577 4.4126 4.4126 4.6658 4.6658 4.8160 4.8160 5.1089 5.1089 5.3728 5.3728 5.4886 5.4886 7.7977 7.7977 7.8435 7.8435 8.9619 8.9619 9.0728 9.0728 9.3136 9.3136 9.8173 9.8173 10.1941 10.1941 k = 0.0833 0.1443 0.3403 ( 6928 PWs) bands (ev): -18.4785 -18.4785 -15.1997 -15.1997 -14.8798 -14.8798 -12.6623 -12.6623 -11.8365 -11.8365 -11.7636 -11.7636 -11.5565 -11.5565 -10.7613 -10.7613 -10.6662 -10.6662 -5.1716 -5.1716 -4.0377 -4.0377 -3.5982 -3.5982 -3.5043 -3.5043 -3.3215 -3.3215 -0.4714 -0.4714 -0.2389 -0.2389 -0.1698 -0.1698 0.0328 0.0328 0.6137 0.6137 0.7028 0.7028 0.8511 0.8511 1.3573 1.3573 1.5327 1.5327 1.7397 1.7397 2.4472 2.4472 2.4831 2.4831 2.6855 2.6855 2.9850 2.9850 4.2384 4.2384 4.3876 4.3876 4.4359 4.4359 4.6629 4.6629 4.7925 4.7925 5.1050 5.1050 5.3888 5.3888 5.4925 5.4925 7.7870 7.7870 7.8169 7.8169 9.0027 9.0027 9.0953 9.0953 9.3374 9.3374 9.8582 9.8582 10.1714 10.1714 k = 0.0750 0.1299 0.3403 ( 6924 PWs) bands (ev): -18.4803 -18.4803 -15.2026 -15.2026 -14.8769 -14.8769 -12.6574 -12.6574 -11.8200 -11.8200 -11.7610 -11.7610 -11.5659 -11.5659 -10.7571 -10.7571 -10.6764 -10.6764 -5.1764 -5.1764 -4.0404 -4.0404 -3.6125 -3.6125 -3.5062 -3.5062 -3.3199 -3.3199 -0.4905 -0.4905 -0.2292 -0.2292 -0.1705 -0.1705 0.0168 0.0168 0.6208 0.6208 0.6947 0.6947 0.8340 0.8340 1.3793 1.3793 1.5329 1.5329 1.7294 1.7294 2.4448 2.4448 2.4719 2.4719 2.7051 2.7051 2.9905 2.9905 4.2876 4.2876 4.4166 4.4166 4.4594 4.4594 4.6589 4.6589 4.7689 4.7689 5.0982 5.0982 5.4052 5.4052 5.4965 5.4965 7.7769 7.7769 7.7913 7.7913 9.0416 9.0416 9.1168 9.1168 9.3628 9.3628 9.8960 9.8960 10.1501 10.1501 k = 0.0667 0.1155 0.3403 ( 6920 PWs) bands (ev): -18.4820 -18.4820 -15.2052 -15.2052 -14.8742 -14.8742 -12.6529 -12.6529 -11.8048 -11.8048 -11.7582 -11.7582 -11.5745 -11.5745 -10.7536 -10.7536 -10.6858 -10.6858 -5.1809 -5.1809 -4.0427 -4.0427 -3.6271 -3.6271 -3.5069 -3.5069 -3.3180 -3.3180 -0.5078 -0.5078 -0.2206 -0.2206 -0.1706 -0.1706 0.0022 0.0022 0.6272 0.6272 0.6871 0.6871 0.8184 0.8184 1.4009 1.4009 1.5330 1.5330 1.7174 1.7174 2.4375 2.4375 2.4609 2.4609 2.7299 2.7299 2.9979 2.9979 4.3316 4.3316 4.4443 4.4443 4.4831 4.4831 4.6540 4.6540 4.7458 4.7458 5.0888 5.0888 5.4216 5.4216 5.5006 5.5006 7.7643 7.7643 7.7704 7.7704 9.0780 9.0780 9.1369 9.1369 9.3903 9.3903 9.9304 9.9304 10.1304 10.1304 k = 0.0583 0.1010 0.3403 ( 6912 PWs) bands (ev): -18.4836 -18.4836 -15.2076 -15.2076 -14.8718 -14.8718 -12.6488 -12.6488 -11.7911 -11.7911 -11.7554 -11.7554 -11.5823 -11.5823 -10.7510 -10.7510 -10.6940 -10.6940 -5.1850 -5.1850 -4.0447 -4.0447 -3.6411 -3.6411 -3.5069 -3.5069 -3.3160 -3.3160 -0.5232 -0.5232 -0.2132 -0.2132 -0.1701 -0.1701 -0.0110 -0.0110 0.6327 0.6327 0.6802 0.6802 0.8044 0.8044 1.4221 1.4221 1.5331 1.5331 1.7041 1.7041 2.4292 2.4292 2.4494 2.4494 2.7557 2.7557 3.0072 3.0072 4.3702 4.3702 4.4709 4.4709 4.5064 4.5064 4.6483 4.6483 4.7240 4.7240 5.0770 5.0770 5.4375 5.4375 5.5048 5.5048 7.7426 7.7426 7.7611 7.7611 9.1111 9.1111 9.1554 9.1554 9.4198 9.4198 9.9610 9.9610 10.1124 10.1124 k = 0.0500 0.0866 0.3403 ( 6924 PWs) bands (ev): -18.4850 -18.4850 -15.2096 -15.2096 -14.8697 -14.8697 -12.6451 -12.6451 -11.7789 -11.7789 -11.7526 -11.7526 -11.5892 -11.5892 -10.7494 -10.7494 -10.7009 -10.7009 -5.1887 -5.1887 -4.0462 -4.0462 -3.6540 -3.6540 -3.5065 -3.5065 -3.3139 -3.3139 -0.5366 -0.5366 -0.2072 -0.2072 -0.1691 -0.1691 -0.0227 -0.0227 0.6374 0.6374 0.6741 0.6741 0.7922 0.7922 1.4427 1.4427 1.5333 1.5333 1.6897 1.6897 2.4215 2.4215 2.4381 2.4381 2.7796 2.7796 3.0183 3.0183 4.4029 4.4029 4.4968 4.4968 4.5281 4.5281 4.6419 4.6419 4.7042 4.7042 5.0635 5.0635 5.4522 5.4522 5.5092 5.5092 7.7217 7.7217 7.7540 7.7540 9.1401 9.1401 9.1721 9.1721 9.4514 9.4514 9.9877 9.9877 10.0963 10.0963 k = 0.0417 0.0722 0.3403 ( 6920 PWs) bands (ev): -18.4861 -18.4861 -15.2114 -15.2114 -14.8679 -14.8679 -12.6420 -12.6420 -11.7683 -11.7683 -11.7500 -11.7500 -11.5952 -11.5952 -10.7487 -10.7487 -10.7063 -10.7063 -5.1919 -5.1919 -4.0474 -4.0474 -3.6655 -3.6655 -3.5060 -3.5060 -3.3120 -3.3120 -0.5481 -0.5481 -0.2024 -0.2024 -0.1677 -0.1677 -0.0328 -0.0328 0.6410 0.6410 0.6689 0.6689 0.7819 0.7819 1.4628 1.4628 1.5334 1.5334 1.6744 1.6744 2.4148 2.4148 2.4277 2.4277 2.7998 2.7998 3.0308 3.0308 4.4298 4.4298 4.5218 4.5218 4.5471 4.5471 4.6354 4.6354 4.6870 4.6870 5.0490 5.0490 5.4651 5.4651 5.5138 5.5138 7.7031 7.7031 7.7481 7.7481 9.1645 9.1645 9.1867 9.1867 9.4846 9.4846 10.0101 10.0101 10.0825 10.0825 k = 0.0333 0.0577 0.3403 ( 6910 PWs) bands (ev): -18.4871 -18.4871 -15.2128 -15.2128 -14.8665 -14.8665 -12.6393 -12.6393 -11.7594 -11.7594 -11.7477 -11.7477 -11.6003 -11.6003 -10.7490 -10.7490 -10.7102 -10.7102 -5.1946 -5.1946 -4.0483 -4.0483 -3.6752 -3.6752 -3.5055 -3.5055 -3.3103 -3.3103 -0.5575 -0.5575 -0.1989 -0.1989 -0.1660 -0.1660 -0.0412 -0.0412 0.6436 0.6436 0.6650 0.6650 0.7733 0.7733 1.4821 1.4821 1.5336 1.5336 1.6588 1.6588 2.4093 2.4093 2.4188 2.4188 2.8157 2.8157 3.0437 3.0437 4.4514 4.4514 4.5440 4.5440 4.5629 4.5629 4.6302 4.6302 4.6727 4.6727 5.0344 5.0344 5.4756 5.4756 5.5186 5.5186 7.6872 7.6872 7.7432 7.7432 9.1842 9.1842 9.1992 9.1992 9.5179 9.5179 10.0279 10.0279 10.0713 10.0713 k = 0.0250 0.0433 0.3403 ( 6910 PWs) bands (ev): -18.4879 -18.4879 -15.2139 -15.2139 -14.8653 -14.8653 -12.6373 -12.6373 -11.7524 -11.7524 -11.7458 -11.7458 -11.6043 -11.6043 -10.7498 -10.7498 -10.7127 -10.7127 -5.1967 -5.1967 -4.0489 -4.0489 -3.6829 -3.6829 -3.5051 -3.5051 -3.3089 -3.3089 -0.5649 -0.5649 -0.1964 -0.1964 -0.1644 -0.1644 -0.0477 -0.0477 0.6450 0.6450 0.6624 0.6624 0.7667 0.7667 1.5002 1.5002 1.5338 1.5338 1.6433 1.6433 2.4049 2.4049 2.4118 2.4118 2.8274 2.8274 3.0557 3.0557 4.4683 4.4683 4.5576 4.5576 4.5786 4.5786 4.6280 4.6280 4.6611 4.6611 5.0208 5.0208 5.4833 5.4833 5.5234 5.5234 7.6744 7.6744 7.7394 7.7394 9.1988 9.1988 9.2096 9.2096 9.5495 9.5495 10.0399 10.0399 10.0638 10.0638 k = 0.0167 0.0289 0.3403 ( 6914 PWs) bands (ev): -18.4884 -18.4884 -15.2147 -15.2147 -14.8645 -14.8645 -12.6358 -12.6358 -11.7473 -11.7473 -11.7443 -11.7443 -11.6073 -11.6073 -10.7508 -10.7508 -10.7141 -10.7141 -5.1982 -5.1982 -4.0494 -4.0494 -3.6885 -3.6885 -3.5047 -3.5047 -3.3079 -3.3079 -0.5702 -0.5702 -0.1948 -0.1948 -0.1630 -0.1630 -0.0525 -0.0525 0.6454 0.6454 0.6611 0.6611 0.7619 0.7619 1.5161 1.5161 1.5342 1.5342 1.6289 1.6289 2.4015 2.4015 2.4068 2.4068 2.8353 2.8353 3.0654 3.0654 4.4809 4.4809 4.5606 4.5606 4.5955 4.5955 4.6292 4.6292 4.6516 4.6516 5.0096 5.0096 5.4885 5.4885 5.5277 5.5277 7.6650 7.6650 7.7366 7.7366 9.2087 9.2087 9.2175 9.2175 9.5764 9.5764 10.0440 10.0443 10.0615 10.0618 k = 0.0083 0.0144 0.3403 ( 6918 PWs) bands (ev): -18.4887 -18.4887 -15.2152 -15.2152 -14.8640 -14.8640 -12.6349 -12.6349 -11.7442 -11.7442 -11.7434 -11.7434 -11.6091 -11.6091 -10.7516 -10.7516 -10.7149 -10.7149 -5.1991 -5.1991 -4.0496 -4.0496 -3.6919 -3.6919 -3.5045 -3.5045 -3.3072 -3.3072 -0.5734 -0.5734 -0.1938 -0.1938 -0.1621 -0.1621 -0.0554 -0.0554 0.6453 0.6453 0.6607 0.6607 0.7591 0.7591 1.5273 1.5273 1.5354 1.5354 1.6177 1.6177 2.3993 2.3993 2.4040 2.4040 2.8399 2.8399 3.0717 3.0717 4.4890 4.4890 4.5594 4.5594 4.6091 4.6091 4.6315 4.6315 4.6437 4.6437 5.0022 5.0022 5.4913 5.4913 5.5306 5.5306 7.6593 7.6593 7.7350 7.7350 9.2142 9.2142 9.2227 9.2227 9.5948 9.5948 10.0429 10.0432 10.0602 10.0604 k = 0.0000 0.0000 0.3403 ( 6920 PWs) bands (ev): -18.4888 -18.4888 -15.2153 -15.2153 -14.8639 -14.8639 -12.6346 -12.6346 -11.7433 -11.7433 -11.7430 -11.7430 -11.6097 -11.6097 -10.7519 -10.7519 -10.7151 -10.7151 -5.1994 -5.1994 -4.0497 -4.0497 -3.6931 -3.6931 -3.5044 -3.5044 -3.3070 -3.3070 -0.5744 -0.5744 -0.1935 -0.1935 -0.1617 -0.1617 -0.0563 -0.0563 0.6452 0.6452 0.6606 0.6606 0.7581 0.7581 1.5304 1.5304 1.5372 1.5372 1.6131 1.6131 2.3985 2.3985 2.4031 2.4031 2.8413 2.8413 3.0739 3.0739 4.4919 4.4919 4.5584 4.5584 4.6152 4.6152 4.6326 4.6326 4.6398 4.6398 4.9996 4.9996 5.4923 5.4923 5.5316 5.5316 7.6574 7.6574 7.7344 7.7344 9.2159 9.2159 9.2245 9.2245 9.6015 9.6015 10.0420 10.0433 10.0581 10.0591 k = 0.5000 0.2887 0.3403 ( 6960 PWs) bands (ev): -18.4338 -18.4338 -15.0985 -15.0985 -14.9825 -14.9825 -12.7861 -12.7861 -12.0966 -12.0966 -11.8747 -11.8747 -11.2201 -11.2201 -11.0193 -11.0193 -10.4560 -10.4560 -5.0725 -5.0725 -3.9140 -3.9140 -3.6167 -3.6167 -3.4321 -3.4321 -2.9773 -2.9773 -0.4708 -0.4708 -0.1887 -0.1887 0.0175 0.0175 0.5020 0.5020 0.5612 0.5612 0.8502 0.8502 0.8972 0.8972 1.3458 1.3458 1.4212 1.4212 1.6228 1.6228 1.9144 1.9144 2.3652 2.3652 3.1521 3.1521 3.5875 3.5875 3.6080 3.6080 3.6893 3.6893 3.8025 3.8025 4.2739 4.2739 4.7148 4.7148 5.1440 5.1440 5.2845 5.2845 5.4355 5.4355 8.1590 8.1590 8.2133 8.2133 8.2934 8.2934 8.5968 8.5968 8.9681 8.9681 9.5977 9.5977 9.6730 9.6730 k = 0.5000 0.2887 0.3241 ( 6970 PWs) bands (ev): -18.4338 -18.4338 -15.0985 -15.0985 -14.9825 -14.9825 -12.7860 -12.7860 -12.0966 -12.0966 -11.8748 -11.8748 -11.2203 -11.2203 -11.0194 -11.0194 -10.4560 -10.4560 -5.0725 -5.0725 -3.9133 -3.9133 -3.6175 -3.6175 -3.4310 -3.4310 -2.9777 -2.9777 -0.4712 -0.4712 -0.1902 -0.1902 0.0167 0.0167 0.4894 0.4894 0.5710 0.5710 0.8481 0.8481 0.9036 0.9036 1.3462 1.3462 1.4223 1.4223 1.6231 1.6231 1.9143 1.9143 2.3650 2.3650 3.1522 3.1522 3.5868 3.5868 3.6084 3.6084 3.6889 3.6889 3.8027 3.8027 4.2741 4.2741 4.7158 4.7158 5.1430 5.1430 5.2851 5.2851 5.4355 5.4355 8.1514 8.1514 8.2058 8.2058 8.2948 8.2948 8.6062 8.6062 8.9681 8.9681 9.5906 9.5906 9.6839 9.6839 k = 0.5000 0.2887 0.3079 ( 6978 PWs) bands (ev): -18.4338 -18.4338 -15.0986 -15.0986 -14.9825 -14.9825 -12.7856 -12.7856 -12.0964 -12.0964 -11.8748 -11.8748 -11.2208 -11.2208 -11.0196 -11.0196 -10.4560 -10.4560 -5.0725 -5.0725 -3.9113 -3.9113 -3.6197 -3.6197 -3.4277 -3.4277 -2.9787 -2.9787 -0.4726 -0.4726 -0.1947 -0.1947 0.0144 0.0144 0.4631 0.4631 0.5894 0.5894 0.8447 0.8447 0.9196 0.9196 1.3471 1.3471 1.4253 1.4253 1.6240 1.6240 1.9141 1.9141 2.3644 2.3644 3.1524 3.1524 3.5848 3.5848 3.6093 3.6093 3.6880 3.6880 3.8034 3.8034 4.2747 4.2747 4.7190 4.7190 5.1401 5.1401 5.2867 5.2867 5.4353 5.4353 8.1278 8.1278 8.1881 8.1881 8.2979 8.2979 8.6318 8.6318 8.9679 8.9679 9.5773 9.5773 9.7090 9.7090 k = 0.5000 0.2887 0.2917 ( 6972 PWs) bands (ev): -18.4338 -18.4338 -15.0987 -15.0987 -14.9825 -14.9825 -12.7850 -12.7850 -12.0960 -12.0960 -11.8748 -11.8748 -11.2216 -11.2216 -11.0200 -11.0200 -10.4559 -10.4559 -5.0724 -5.0724 -3.9080 -3.9080 -3.6232 -3.6232 -3.4224 -3.4224 -2.9805 -2.9805 -0.4749 -0.4749 -0.2020 -0.2020 0.0107 0.0107 0.4319 0.4319 0.6079 0.6079 0.8436 0.8436 0.9410 0.9410 1.3487 1.3487 1.4303 1.4303 1.6255 1.6255 1.9137 1.9137 2.3634 2.3634 3.1528 3.1528 3.5818 3.5818 3.6105 3.6105 3.6864 3.6864 3.8045 3.8045 4.2757 4.2757 4.7241 4.7241 5.1356 5.1356 5.2892 5.2892 5.4351 5.4351 8.0888 8.0888 8.1666 8.1666 8.3017 8.3017 8.6683 8.6683 8.9665 8.9665 9.5662 9.5662 9.7397 9.7397 k = 0.5000 0.2887 0.2755 ( 6972 PWs) bands (ev): -18.4338 -18.4338 -15.0988 -15.0988 -14.9825 -14.9825 -12.7841 -12.7841 -12.0956 -12.0956 -11.8748 -11.8748 -11.2228 -11.2228 -11.0206 -11.0206 -10.4559 -10.4559 -5.0723 -5.0723 -3.9034 -3.9034 -3.6276 -3.6276 -3.4155 -3.4155 -2.9830 -2.9830 -0.4778 -0.4778 -0.2120 -0.2120 0.0056 0.0056 0.3984 0.3984 0.6249 0.6249 0.8456 0.8456 0.9658 0.9658 1.3512 1.3512 1.4370 1.4370 1.6275 1.6275 1.9132 1.9132 2.3620 2.3620 3.1531 3.1531 3.5780 3.5780 3.6119 3.6119 3.6845 3.6845 3.8060 3.8060 4.2772 4.2772 4.7314 4.7314 5.1296 5.1296 5.2922 5.2922 5.4347 5.4347 8.0391 8.0391 8.1429 8.1429 8.3058 8.3058 8.7107 8.7107 8.9632 8.9632 9.5609 9.5609 9.7727 9.7727 k = 0.5000 0.2887 0.2593 ( 6968 PWs) bands (ev): -18.4338 -18.4338 -15.0990 -15.0990 -14.9824 -14.9824 -12.7830 -12.7830 -12.0950 -12.0950 -11.8748 -11.8748 -11.2242 -11.2242 -11.0213 -11.0213 -10.4558 -10.4558 -5.0722 -5.0722 -3.8976 -3.8976 -3.6328 -3.6328 -3.4073 -3.4073 -2.9860 -2.9860 -0.4815 -0.4815 -0.2246 -0.2246 -0.0007 -0.0007 0.3637 0.3637 0.6404 0.6404 0.8506 0.8506 0.9926 0.9926 1.3545 1.3545 1.4452 1.4452 1.6299 1.6299 1.9125 1.9125 2.3601 2.3601 3.1534 3.1534 3.5736 3.5736 3.6133 3.6133 3.6823 3.6823 3.8078 3.8078 4.2789 4.2789 4.7406 4.7406 5.1225 5.1225 5.2955 5.2955 5.4343 5.4343 7.9830 7.9830 8.1170 8.1170 8.3102 8.3102 8.7557 8.7557 8.9571 8.9571 9.5626 9.5626 9.8064 9.8064 k = 0.5000 0.2887 0.2431 ( 6960 PWs) bands (ev): -18.4338 -18.4338 -15.0993 -15.0993 -14.9824 -14.9824 -12.7818 -12.7818 -12.0944 -12.0944 -11.8749 -11.8749 -11.2259 -11.2259 -11.0221 -11.0221 -10.4557 -10.4557 -5.0721 -5.0721 -3.8907 -3.8907 -3.6386 -3.6386 -3.3981 -3.3981 -2.9896 -2.9896 -0.4856 -0.4856 -0.2394 -0.2394 -0.0080 -0.0080 0.3284 0.3284 0.6551 0.6551 0.8579 0.8579 1.0206 1.0206 1.3587 1.3587 1.4548 1.4548 1.6327 1.6327 1.9116 1.9116 2.3578 2.3578 3.1537 3.1537 3.5689 3.5689 3.6146 3.6146 3.6799 3.6799 3.8099 3.8099 4.2811 4.2811 4.7517 4.7517 5.1146 5.1146 5.2987 5.2987 5.4337 5.4337 7.9234 7.9234 8.0890 8.0890 8.3150 8.3150 8.8011 8.8011 8.9479 8.9479 9.5717 9.5717 9.8398 9.8398 k = 0.5000 0.2887 0.2269 ( 6964 PWs) bands (ev): -18.4338 -18.4338 -15.0995 -15.0995 -14.9824 -14.9824 -12.7804 -12.7804 -12.0936 -12.0936 -11.8749 -11.8749 -11.2278 -11.2278 -11.0230 -11.0230 -10.4557 -10.4557 -5.0720 -5.0720 -3.8827 -3.8827 -3.6446 -3.6446 -3.3883 -3.3883 -2.9937 -2.9937 -0.4900 -0.4900 -0.2561 -0.2561 -0.0160 -0.0160 0.2931 0.2931 0.6695 0.6695 0.8663 0.8663 1.0489 1.0489 1.3640 1.3640 1.4653 1.4653 1.6357 1.6357 1.9107 1.9107 2.3551 2.3551 3.1537 3.1537 3.5640 3.5640 3.6157 3.6157 3.6774 3.6774 3.8123 3.8123 4.2836 4.2836 4.7646 4.7646 5.1061 5.1061 5.3016 5.3016 5.4329 5.4329 7.8620 7.8620 8.0597 8.0597 8.3203 8.3203 8.8451 8.8451 8.9365 8.9365 9.5875 9.5875 9.8721 9.8721 k = 0.5000 0.2887 0.2107 ( 6976 PWs) bands (ev): -18.4339 -18.4339 -15.0998 -15.0998 -14.9824 -14.9824 -12.7788 -12.7788 -12.0928 -12.0928 -11.8750 -11.8750 -11.2299 -11.2299 -11.0240 -11.0240 -10.4556 -10.4556 -5.0718 -5.0718 -3.8737 -3.8737 -3.6508 -3.6508 -3.3782 -3.3782 -2.9982 -2.9982 -0.4946 -0.4946 -0.2743 -0.2743 -0.0245 -0.0245 0.2582 0.2582 0.6842 0.6842 0.8753 0.8753 1.0768 1.0768 1.3705 1.3705 1.4765 1.4765 1.6388 1.6388 1.9096 1.9096 2.3519 2.3519 3.1536 3.1536 3.5591 3.5591 3.6166 3.6166 3.6748 3.6748 3.8151 3.8151 4.2863 4.2863 4.7791 4.7791 5.0972 5.0972 5.3041 5.3041 5.4320 5.4320 7.8000 7.8000 8.0295 8.0295 8.3262 8.3262 8.8827 8.8827 8.9273 8.9273 9.6090 9.6090 9.9028 9.9028 k = 0.5000 0.2887 0.1945 ( 6980 PWs) bands (ev): -18.4339 -18.4339 -15.1001 -15.1001 -14.9823 -14.9823 -12.7772 -12.7772 -12.0920 -12.0920 -11.8750 -11.8750 -11.2322 -11.2322 -11.0251 -11.0251 -10.4555 -10.4555 -5.0717 -5.0717 -3.8640 -3.8640 -3.6570 -3.6570 -3.3681 -3.3681 -3.0029 -3.0029 -0.4992 -0.4992 -0.2937 -0.2937 -0.0332 -0.0332 0.2239 0.2239 0.6996 0.6996 0.8839 0.8839 1.1039 1.1039 1.3783 1.3783 1.4882 1.4882 1.6420 1.6420 1.9083 1.9083 2.3484 2.3484 3.1532 3.1532 3.5545 3.5545 3.6171 3.6171 3.6722 3.6722 3.8181 3.8181 4.2894 4.2894 4.7952 4.7952 5.0882 5.0882 5.3060 5.3060 5.4309 5.4309 7.7385 7.7385 7.9992 7.9992 8.3326 8.3326 8.8905 8.8905 8.9439 8.9439 9.6351 9.6351 9.9315 9.9315 k = 0.5000 0.2887 0.1783 ( 6970 PWs) bands (ev): -18.4339 -18.4339 -15.1004 -15.1004 -14.9823 -14.9823 -12.7755 -12.7755 -12.0911 -12.0911 -11.8751 -11.8751 -11.2345 -11.2345 -11.0262 -11.0262 -10.4554 -10.4554 -5.0716 -5.0716 -3.8535 -3.8535 -3.6631 -3.6631 -3.3583 -3.3583 -3.0077 -3.0077 -0.5037 -0.5037 -0.3138 -0.3138 -0.0418 -0.0418 0.1908 0.1908 0.7156 0.7156 0.8919 0.8919 1.1296 1.1296 1.3873 1.3873 1.4998 1.4998 1.6450 1.6450 1.9069 1.9069 2.3445 2.3445 3.1527 3.1527 3.5502 3.5502 3.6173 3.6173 3.6693 3.6693 3.8215 3.8215 4.2926 4.2926 4.8124 4.8124 5.0792 5.0792 5.3074 5.3074 5.4296 5.4296 7.6782 7.6782 7.9693 7.9693 8.3396 8.3396 8.8759 8.8759 8.9796 8.9796 9.6642 9.6642 9.9577 9.9577 k = 0.5000 0.2887 0.1621 ( 6966 PWs) bands (ev): -18.4339 -18.4339 -15.1007 -15.1007 -14.9823 -14.9823 -12.7738 -12.7738 -12.0902 -12.0902 -11.8752 -11.8752 -11.2368 -11.2368 -11.0273 -11.0273 -10.4553 -10.4553 -5.0714 -5.0714 -3.8425 -3.8425 -3.6692 -3.6692 -3.3489 -3.3489 -3.0126 -3.0126 -0.5078 -0.5078 -0.3342 -0.3342 -0.0500 -0.0500 0.1589 0.1589 0.7324 0.7324 0.8987 0.8987 1.1535 1.1535 1.3976 1.3976 1.5110 1.5110 1.6479 1.6479 1.9054 1.9054 2.3403 2.3403 3.1521 3.1521 3.5465 3.5465 3.6171 3.6171 3.6663 3.6663 3.8252 3.8252 4.2960 4.2960 4.8306 4.8306 5.0703 5.0703 5.3082 5.3082 5.4281 5.4281 7.6198 7.6198 7.9403 7.9403 8.3471 8.3471 8.8578 8.8578 9.0156 9.0156 9.6952 9.6952 9.9813 9.9813 k = 0.5000 0.2887 0.1459 ( 6970 PWs) bands (ev): -18.4339 -18.4339 -15.1010 -15.1010 -14.9823 -14.9823 -12.7721 -12.7721 -12.0893 -12.0893 -11.8752 -11.8752 -11.2391 -11.2391 -11.0284 -11.0284 -10.4552 -10.4552 -5.0713 -5.0713 -3.8311 -3.8311 -3.6751 -3.6751 -3.3402 -3.3402 -3.0173 -3.0173 -0.5116 -0.5116 -0.3544 -0.3544 -0.0575 -0.0575 0.1285 0.1285 0.7496 0.7496 0.9043 0.9043 1.1754 1.1754 1.4091 1.4091 1.5213 1.5213 1.6507 1.6507 1.9038 1.9038 2.3360 2.3360 3.1513 3.1513 3.5435 3.5435 3.6165 3.6165 3.6630 3.6630 3.8292 3.8292 4.2995 4.2995 4.8492 4.8492 5.0618 5.0618 5.3085 5.3085 5.4264 5.4264 7.5641 7.5641 7.9126 7.9126 8.3550 8.3550 8.8393 8.8393 9.0495 9.0495 9.7267 9.7267 10.0020 10.0020 k = 0.5000 0.2887 0.1297 ( 6976 PWs) bands (ev): -18.4339 -18.4339 -15.1013 -15.1013 -14.9822 -14.9822 -12.7704 -12.7704 -12.0884 -12.0884 -11.8753 -11.8753 -11.2413 -11.2413 -11.0295 -11.0295 -10.4551 -10.4551 -5.0712 -5.0712 -3.8196 -3.8196 -3.6809 -3.6809 -3.3323 -3.3323 -3.0218 -3.0218 -0.5148 -0.5148 -0.3742 -0.3742 -0.0640 -0.0640 0.0998 0.0998 0.7671 0.7671 0.9084 0.9084 1.1951 1.1951 1.4215 1.4215 1.5303 1.5303 1.6533 1.6533 1.9022 1.9022 2.3315 2.3315 3.1506 3.1506 3.5412 3.5412 3.6156 3.6156 3.6594 3.6594 3.8334 3.8334 4.3030 4.3030 4.8677 4.8677 5.0540 5.0540 5.3082 5.3082 5.4245 5.4245 7.5118 7.5118 7.8867 7.8867 8.3630 8.3630 8.8214 8.8214 9.0804 9.0804 9.7579 9.7579 10.0199 10.0199 k = 0.5000 0.2887 0.1134 ( 6980 PWs) bands (ev): -18.4339 -18.4339 -15.1016 -15.1016 -14.9822 -14.9822 -12.7689 -12.7689 -12.0876 -12.0876 -11.8753 -11.8753 -11.2434 -11.2434 -11.0305 -11.0305 -10.4551 -10.4551 -5.0711 -5.0711 -3.8080 -3.8080 -3.6866 -3.6866 -3.3253 -3.3253 -3.0259 -3.0259 -0.5173 -0.5173 -0.3931 -0.3931 -0.0693 -0.0693 0.0731 0.0731 0.7844 0.7844 0.9110 0.9110 1.2126 1.2126 1.4346 1.4346 1.5376 1.5376 1.6559 1.6559 1.9004 1.9004 2.3272 2.3272 3.1499 3.1499 3.5398 3.5398 3.6145 3.6145 3.6556 3.6556 3.8375 3.8375 4.3064 4.3064 4.8856 4.8856 5.0471 5.0471 5.3076 5.3076 5.4225 5.4225 7.4636 7.4636 7.8630 7.8630 8.3710 8.3710 8.8046 8.8046 9.1083 9.1083 9.7877 9.7877 10.0349 10.0349 k = 0.5000 0.2887 0.0972 ( 6966 PWs) bands (ev): -18.4339 -18.4339 -15.1019 -15.1019 -14.9822 -14.9822 -12.7674 -12.7674 -12.0868 -12.0868 -11.8754 -11.8754 -11.2454 -11.2454 -11.0314 -11.0314 -10.4550 -10.4550 -5.0710 -5.0710 -3.7967 -3.7967 -3.6922 -3.6922 -3.3195 -3.3195 -3.0295 -3.0295 -0.5191 -0.5191 -0.4107 -0.4107 -0.0732 -0.0732 0.0484 0.0484 0.8015 0.8015 0.9120 0.9120 1.2279 1.2279 1.4479 1.4479 1.5428 1.5428 1.6585 1.6585 1.8987 1.8987 2.3231 2.3231 3.1492 3.1492 3.5391 3.5391 3.6131 3.6131 3.6517 3.6517 3.8416 3.8416 4.3096 4.3096 4.9021 4.9021 5.0416 5.0416 5.3066 5.3066 5.4205 5.4205 7.4201 7.4201 7.8417 7.8417 8.3788 8.3788 8.7894 8.7894 9.1327 9.1327 9.8154 9.8154 10.0472 10.0472 k = 0.5000 0.2887 0.0810 ( 6956 PWs) bands (ev): -18.4339 -18.4339 -15.1021 -15.1021 -14.9822 -14.9822 -12.7661 -12.7661 -12.0862 -12.0862 -11.8754 -11.8754 -11.2471 -11.2471 -11.0323 -11.0323 -10.4549 -10.4549 -5.0709 -5.0709 -3.7857 -3.7857 -3.6978 -3.6978 -3.3146 -3.3146 -3.0326 -3.0326 -0.5201 -0.5201 -0.4268 -0.4268 -0.0755 -0.0755 0.0260 0.0260 0.8178 0.8178 0.9115 0.9115 1.2410 1.2410 1.4610 1.4610 1.5457 1.5457 1.6612 1.6612 1.8971 1.8971 2.3193 2.3193 3.1487 3.1487 3.5392 3.5392 3.6116 3.6116 3.6479 3.6479 3.8453 3.8453 4.3126 4.3126 4.9164 4.9164 5.0377 5.0377 5.3054 5.3054 5.4185 5.4185 7.3819 7.3819 7.8232 7.8232 8.3860 8.3860 8.7760 8.7760 9.1536 9.1536 9.8402 9.8402 10.0568 10.0568 k = 0.5000 0.2887 0.0648 ( 6946 PWs) bands (ev): -18.4339 -18.4339 -15.1023 -15.1023 -14.9822 -14.9822 -12.7651 -12.7651 -12.0856 -12.0856 -11.8755 -11.8755 -11.2485 -11.2485 -11.0330 -11.0330 -10.4548 -10.4548 -5.0709 -5.0709 -3.7753 -3.7753 -3.7034 -3.7034 -3.3108 -3.3108 -3.0351 -3.0351 -0.5203 -0.5203 -0.4411 -0.4411 -0.0760 -0.0760 0.0058 0.0058 0.8331 0.8331 0.9095 0.9095 1.2519 1.2519 1.4735 1.4735 1.5464 1.5464 1.6639 1.6639 1.8956 1.8956 2.3160 2.3160 3.1482 3.1482 3.5397 3.5397 3.6101 3.6101 3.6443 3.6443 3.8487 3.8487 4.3151 4.3151 4.9279 4.9279 5.0357 5.0357 5.3041 5.3041 5.4166 5.4166 7.3497 7.3497 7.8077 7.8077 8.3923 8.3923 8.7648 8.7648 9.1709 9.1709 9.8616 9.8616 10.0641 10.0641 k = 0.5000 0.2887 0.0486 ( 6944 PWs) bands (ev): -18.4339 -18.4339 -15.1024 -15.1024 -14.9822 -14.9822 -12.7642 -12.7642 -12.0851 -12.0851 -11.8755 -11.8755 -11.2497 -11.2497 -11.0335 -11.0335 -10.4548 -10.4548 -5.0708 -5.0708 -3.7658 -3.7658 -3.7089 -3.7089 -3.3080 -3.3080 -3.0370 -3.0370 -0.5198 -0.5198 -0.4531 -0.4531 -0.0747 -0.0747 -0.0118 -0.0118 0.8472 0.8472 0.9059 0.9059 1.2606 1.2606 1.4848 1.4848 1.5452 1.5452 1.6664 1.6664 1.8944 1.8944 2.3133 2.3133 3.1479 3.1479 3.5406 3.5406 3.6085 3.6085 3.6413 3.6413 3.8514 3.8514 4.3172 4.3172 4.9363 4.9363 5.0355 5.0355 5.3028 5.3028 5.4150 5.4150 7.3240 7.3240 7.7954 7.7954 8.3976 8.3976 8.7558 8.7558 9.1845 9.1845 9.8790 9.8790 10.0693 10.0693 k = 0.5000 0.2887 0.0324 ( 6948 PWs) bands (ev): -18.4339 -18.4339 -15.1025 -15.1025 -14.9822 -14.9822 -12.7635 -12.7635 -12.0848 -12.0848 -11.8755 -11.8755 -11.2506 -11.2506 -11.0339 -11.0339 -10.4548 -10.4548 -5.0708 -5.0708 -3.7575 -3.7575 -3.7141 -3.7141 -3.3060 -3.3060 -3.0384 -3.0384 -0.5188 -0.5188 -0.4625 -0.4625 -0.0716 -0.0716 -0.0266 -0.0266 0.8598 0.8598 0.9011 0.9011 1.2670 1.2670 1.4945 1.4945 1.5427 1.5427 1.6684 1.6684 1.8935 1.8935 2.3113 2.3113 3.1476 3.1476 3.5416 3.5416 3.6072 3.6072 3.6389 3.6389 3.8534 3.8534 4.3188 4.3188 4.9416 4.9416 5.0364 5.0364 5.3017 5.3017 5.4137 5.4137 7.3053 7.3053 7.7864 7.7864 8.4015 8.4015 8.7493 8.7493 9.1942 9.1942 9.8918 9.8918 10.0728 10.0728 k = 0.5000 0.2887 0.0162 ( 6942 PWs) bands (ev): -18.4339 -18.4339 -15.1026 -15.1026 -14.9821 -14.9821 -12.7631 -12.7631 -12.0846 -12.0846 -11.8755 -11.8755 -11.2511 -11.2511 -11.0342 -11.0342 -10.4547 -10.4547 -5.0708 -5.0708 -3.7513 -3.7513 -3.7184 -3.7184 -3.3049 -3.3049 -3.0392 -3.0392 -0.5178 -0.5178 -0.4685 -0.4685 -0.0675 -0.0675 -0.0378 -0.0378 0.8700 0.8700 0.8955 0.8955 1.2709 1.2709 1.5014 1.5014 1.5399 1.5399 1.6697 1.6697 1.8929 1.8929 2.3101 2.3101 3.1475 3.1475 3.5423 3.5423 3.6063 3.6063 3.6375 3.6375 3.8547 3.8547 4.3198 4.3198 4.9445 4.9445 5.0375 5.0375 5.3010 5.3010 5.4129 5.4129 7.2940 7.2940 7.7811 7.7811 8.4040 8.4040 8.7454 8.7454 9.2000 9.2000 9.8996 9.8996 10.0747 10.0747 k = 0.5000 0.2887-0.0000 ( 6944 PWs) bands (ev): -18.4339 -18.4339 -15.1026 -15.1026 -14.9821 -14.9821 -12.7630 -12.7630 -12.0845 -12.0845 -11.8755 -11.8755 -11.2513 -11.2513 -11.0343 -11.0343 -10.4547 -10.4547 -5.0708 -5.0708 -3.7489 -3.7489 -3.7203 -3.7203 -3.3045 -3.3045 -3.0395 -3.0395 -0.5174 -0.5174 -0.4707 -0.4707 -0.0650 -0.0650 -0.0427 -0.0427 0.8749 0.8749 0.8922 0.8922 1.2722 1.2722 1.5040 1.5040 1.5387 1.5387 1.6701 1.6701 1.8927 1.8927 2.3097 2.3097 3.1475 3.1475 3.5426 3.5426 3.6060 3.6060 3.6370 3.6370 3.8551 3.8551 4.3201 4.3201 4.9453 4.9453 5.0379 5.0379 5.3008 5.3008 5.4126 5.4126 7.2902 7.2902 7.7792 7.7792 8.4048 8.4048 8.7441 8.7441 9.2019 9.2019 9.9023 9.9023 10.0753 10.0753 k = 0.3333 0.5774-0.0000 ( 6987 PWs) bands (ev): -18.4269 -18.4269 -15.0427 -15.0427 -15.0426 -15.0426 -12.5615 -12.5615 -12.5369 -12.5369 -11.6858 -11.6858 -11.1166 -11.1166 -11.1128 -11.1128 -10.4794 -10.4794 -5.0470 -5.0470 -3.7472 -3.7472 -3.6957 -3.6957 -3.2749 -3.2749 -3.0617 -3.0617 -0.6628 -0.6628 -0.1988 -0.1988 -0.1905 -0.1905 0.4524 0.4524 0.4867 0.4867 1.0817 1.0817 1.2406 1.2406 1.2454 1.2454 1.6494 1.6494 1.7318 1.7318 1.7635 1.7635 2.1637 2.1637 3.4160 3.4160 3.4424 3.4424 3.4990 3.4990 3.8212 3.8212 4.1752 4.1752 4.2076 4.2076 4.3315 4.3315 4.9507 4.9507 5.3849 5.3849 5.4662 5.4662 7.6203 7.6203 7.6389 7.6389 8.0044 8.0044 9.1334 9.1334 9.1363 9.1363 9.2062 9.2062 11.2545 11.2561 k = 0.3333 0.5774 0.0162 ( 6984 PWs) bands (ev): -18.4269 -18.4269 -15.0427 -15.0427 -15.0426 -15.0426 -12.5615 -12.5615 -12.5368 -12.5368 -11.6858 -11.6858 -11.1167 -11.1167 -11.1129 -11.1129 -10.4793 -10.4793 -5.0456 -5.0456 -3.7385 -3.7385 -3.6915 -3.6915 -3.2831 -3.2831 -3.0744 -3.0744 -0.6684 -0.6684 -0.1858 -0.1858 -0.1752 -0.1752 0.4468 0.4468 0.4809 0.4809 1.0965 1.0965 1.2296 1.2296 1.2340 1.2340 1.6514 1.6514 1.7335 1.7335 1.7642 1.7642 2.1611 2.1611 3.4215 3.4215 3.4475 3.4475 3.4995 3.4995 3.8131 3.8131 4.1739 4.1739 4.2065 4.2065 4.3271 4.3271 4.9407 4.9407 5.3909 5.3909 5.4729 5.4729 7.6314 7.6314 7.6501 7.6501 8.0315 8.0315 9.0996 9.0996 9.1035 9.1035 9.2002 9.2002 11.2601 11.2647 k = 0.3333 0.5774 0.0324 ( 6981 PWs) bands (ev): -18.4269 -18.4269 -15.0426 -15.0426 -15.0426 -15.0426 -12.5616 -12.5616 -12.5370 -12.5370 -11.6859 -11.6859 -11.1166 -11.1166 -11.1127 -11.1127 -10.4793 -10.4793 -5.0443 -5.0443 -3.7306 -3.7306 -3.6882 -3.6882 -3.2911 -3.2911 -3.0868 -3.0868 -0.6729 -0.6729 -0.1702 -0.1702 -0.1573 -0.1573 0.4416 0.4416 0.4754 0.4754 1.1087 1.1087 1.2168 1.2168 1.2209 1.2209 1.6528 1.6528 1.7344 1.7344 1.7641 1.7641 2.1596 2.1596 3.4276 3.4276 3.4532 3.4532 3.4997 3.4997 3.8049 3.8049 4.1716 4.1716 4.2042 4.2042 4.3228 4.3228 4.9331 4.9331 5.3956 5.3956 5.4784 5.4784 7.6484 7.6484 7.6671 7.6671 8.0607 8.0607 9.0632 9.0632 9.0680 9.0680 9.1906 9.1906 11.2605 11.2632 k = 0.3333 0.5774 0.0486 ( 6948 PWs) bands (ev): -18.4269 -18.4269 -15.0426 -15.0426 -15.0425 -15.0425 -12.5620 -12.5620 -12.5374 -12.5374 -11.6859 -11.6859 -11.1162 -11.1162 -11.1123 -11.1123 -10.4793 -10.4793 -5.0431 -5.0431 -3.7239 -3.7239 -3.6856 -3.6856 -3.2986 -3.2986 -3.0985 -3.0985 -0.6760 -0.6760 -0.1523 -0.1523 -0.1373 -0.1373 0.4369 0.4369 0.4703 0.4703 1.1181 1.1181 1.2027 1.2027 1.2063 1.2063 1.6536 1.6536 1.7344 1.7344 1.7631 1.7631 2.1592 2.1592 3.4341 3.4341 3.4593 3.4593 3.4995 3.4995 3.7968 3.7968 4.1682 4.1682 4.2007 4.2007 4.3187 4.3187 4.9282 4.9282 5.3986 5.3986 5.4825 5.4825 7.6712 7.6712 7.6898 7.6898 8.0919 8.0919 9.0246 9.0246 9.0303 9.0303 9.1772 9.1772 11.2625 11.2630 k = 0.3333 0.5774 0.0648 ( 6957 PWs) bands (ev): -18.4269 -18.4269 -15.0425 -15.0425 -15.0425 -15.0425 -12.5625 -12.5625 -12.5379 -12.5379 -11.6859 -11.6859 -11.1155 -11.1155 -11.1116 -11.1116 -10.4793 -10.4793 -5.0420 -5.0420 -3.7186 -3.7186 -3.6841 -3.6841 -3.3055 -3.3055 -3.1091 -3.1091 -0.6779 -0.6779 -0.1323 -0.1323 -0.1153 -0.1153 0.4325 0.4325 0.4655 0.4655 1.1245 1.1245 1.1876 1.1876 1.1907 1.1907 1.6538 1.6538 1.7335 1.7335 1.7611 1.7611 2.1602 2.1602 3.4409 3.4409 3.4657 3.4657 3.4989 3.4989 3.7889 3.7889 4.1640 4.1640 4.1960 4.1960 4.3150 4.3150 4.9259 4.9259 5.4001 5.4001 5.4851 5.4851 7.6997 7.6997 7.7181 7.7181 8.1247 8.1247 8.9841 8.9841 8.9905 8.9905 9.1600 9.1600 11.2643 11.2668 k = 0.3333 0.5774 0.0810 ( 6945 PWs) bands (ev): -18.4269 -18.4269 -15.0424 -15.0424 -15.0424 -15.0424 -12.5632 -12.5632 -12.5386 -12.5386 -11.6859 -11.6859 -11.1146 -11.1146 -11.1107 -11.1107 -10.4793 -10.4793 -5.0412 -5.0412 -3.7148 -3.7148 -3.6836 -3.6836 -3.3114 -3.3114 -3.1184 -3.1184 -0.6784 -0.6784 -0.1105 -0.1105 -0.0916 -0.0916 0.4286 0.4286 0.4610 0.4610 1.1276 1.1276 1.1719 1.1719 1.1743 1.1743 1.6532 1.6532 1.7314 1.7314 1.7581 1.7581 2.1624 2.1624 3.4478 3.4478 3.4723 3.4723 3.4980 3.4980 3.7816 3.7816 4.1589 4.1589 4.1905 4.1905 4.3119 4.3119 4.9261 4.9261 5.4000 5.4000 5.4862 5.4862 7.7338 7.7338 7.7520 7.7520 8.1589 8.1589 8.9422 8.9422 8.9491 8.9491 9.1391 9.1391 11.2679 11.2706 k = 0.3333 0.5774 0.0972 ( 6957 PWs) bands (ev): -18.4269 -18.4269 -15.0423 -15.0423 -15.0423 -15.0423 -12.5641 -12.5641 -12.5395 -12.5395 -11.6859 -11.6859 -11.1135 -11.1135 -11.1095 -11.1095 -10.4793 -10.4793 -5.0405 -5.0405 -3.7128 -3.7128 -3.6843 -3.6843 -3.3163 -3.3163 -3.1259 -3.1259 -0.6775 -0.6775 -0.0873 -0.0873 -0.0668 -0.0668 0.4250 0.4250 0.4568 0.4568 1.1275 1.1275 1.1559 1.1559 1.1575 1.1575 1.6520 1.6520 1.7284 1.7284 1.7541 1.7541 2.1658 2.1658 3.4547 3.4547 3.4790 3.4790 3.4967 3.4967 3.7751 3.7751 4.1531 4.1531 4.1841 4.1841 4.3093 4.3093 4.9287 4.9287 5.3983 5.3983 5.4859 5.4859 7.7732 7.7732 7.7912 7.7912 8.1941 8.1941 8.8992 8.8992 8.9065 8.9065 9.1144 9.1144 11.2681 11.2719 k = 0.3333 0.5774 0.1134 ( 6957 PWs) bands (ev): -18.4269 -18.4269 -15.0422 -15.0422 -15.0422 -15.0422 -12.5651 -12.5651 -12.5406 -12.5406 -11.6859 -11.6859 -11.1122 -11.1122 -11.1082 -11.1082 -10.4793 -10.4793 -5.0401 -5.0401 -3.7127 -3.7127 -3.6861 -3.6861 -3.3200 -3.3200 -3.1315 -3.1315 -0.6753 -0.6753 -0.0630 -0.0630 -0.0411 -0.0411 0.4219 0.4219 0.4529 0.4529 1.1241 1.1241 1.1400 1.1400 1.1408 1.1408 1.6500 1.6500 1.7242 1.7242 1.7491 1.7491 2.1704 2.1704 3.4615 3.4615 3.4855 3.4855 3.4951 3.4951 3.7695 3.7695 4.1468 4.1468 4.1770 4.1770 4.3075 4.3075 4.9337 4.9337 5.3953 5.3953 5.4841 5.4841 7.8175 7.8175 7.8352 7.8352 8.2299 8.2299 8.8554 8.8554 8.8630 8.8630 9.0862 9.0862 11.2666 11.2682 k = 0.3333 0.5774 0.1297 ( 6939 PWs) bands (ev): -18.4269 -18.4269 -15.0421 -15.0421 -15.0420 -15.0420 -12.5662 -12.5662 -12.5417 -12.5417 -11.6858 -11.6858 -11.1107 -11.1107 -11.1067 -11.1067 -10.4794 -10.4794 -5.0399 -5.0399 -3.7145 -3.7145 -3.6891 -3.6891 -3.3223 -3.3223 -3.1350 -3.1350 -0.6718 -0.6718 -0.0381 -0.0381 -0.0152 -0.0152 0.4192 0.4192 0.4494 0.4494 1.1174 1.1174 1.1246 1.1246 1.1247 1.1247 1.6476 1.6476 1.7190 1.7190 1.7431 1.7431 2.1759 2.1759 3.4680 3.4680 3.4918 3.4918 3.4933 3.4933 3.7650 3.7650 4.1400 4.1400 4.1694 4.1694 4.3063 4.3063 4.9408 4.9408 5.3909 5.3909 5.4811 5.4811 7.8663 7.8663 7.8837 7.8837 8.2661 8.2661 8.8111 8.8111 8.8189 8.8189 9.0549 9.0549 11.2661 11.2666 k = 0.3333 0.5774 0.1459 ( 6939 PWs) bands (ev): -18.4269 -18.4269 -15.0419 -15.0419 -15.0419 -15.0419 -12.5675 -12.5675 -12.5429 -12.5429 -11.6858 -11.6858 -11.1091 -11.1091 -11.1051 -11.1051 -10.4795 -10.4795 -5.0399 -5.0399 -3.7182 -3.7182 -3.6930 -3.6930 -3.3233 -3.3233 -3.1363 -3.1363 -0.6671 -0.6671 -0.0133 -0.0133 0.0103 0.0103 0.4170 0.4170 0.4465 0.4465 1.1073 1.1073 1.1094 1.1094 1.1102 1.1102 1.6448 1.6448 1.7128 1.7128 1.7362 1.7362 2.1821 2.1821 3.4740 3.4740 3.4913 3.4913 3.4978 3.4978 3.7618 3.7618 4.1328 4.1328 4.1615 4.1615 4.3058 4.3058 4.9499 4.9499 5.3854 5.3854 5.4769 5.4769 7.9191 7.9191 7.9362 7.9362 8.3020 8.3020 8.7668 8.7668 8.7745 8.7745 9.0209 9.0209 11.2660 11.2705 k = 0.3333 0.5774 0.1621 ( 6954 PWs) bands (ev): -18.4269 -18.4269 -15.0418 -15.0418 -15.0417 -15.0417 -12.5687 -12.5687 -12.5442 -12.5442 -11.6858 -11.6858 -11.1074 -11.1074 -11.1033 -11.1033 -10.4796 -10.4796 -5.0401 -5.0401 -3.7237 -3.7237 -3.6979 -3.6979 -3.3229 -3.3229 -3.1354 -3.1354 -0.6611 -0.6611 0.0108 0.0108 0.0347 0.0347 0.4157 0.4157 0.4444 0.4444 1.0941 1.0941 1.0957 1.0957 1.0970 1.0970 1.6417 1.6417 1.7056 1.7056 1.7284 1.7284 2.1888 2.1888 3.4793 3.4793 3.4894 3.4894 3.5033 3.5033 3.7599 3.7599 4.1255 4.1255 4.1533 4.1533 4.3060 4.3060 4.9608 4.9608 5.3790 5.3790 5.4716 5.4716 7.9753 7.9753 7.9919 7.9919 8.3369 8.3369 8.7228 8.7228 8.7303 8.7303 8.9847 8.9847 11.2633 11.2638 k = 0.3333 0.5774 0.1783 ( 6954 PWs) bands (ev): -18.4269 -18.4269 -15.0416 -15.0416 -15.0416 -15.0416 -12.5701 -12.5701 -12.5456 -12.5456 -11.6857 -11.6857 -11.1056 -11.1056 -11.1016 -11.1016 -10.4797 -10.4797 -5.0406 -5.0406 -3.7308 -3.7308 -3.7035 -3.7035 -3.3213 -3.3213 -3.1325 -3.1325 -0.6541 -0.6541 0.0333 0.0333 0.0570 0.0570 0.4154 0.4154 0.4436 0.4436 1.0796 1.0796 1.0822 1.0822 1.0854 1.0854 1.6385 1.6385 1.6977 1.6977 1.7199 1.7199 2.1957 2.1957 3.4827 3.4827 3.4887 3.4887 3.5083 3.5083 3.7593 3.7593 4.1182 4.1182 4.1451 4.1451 4.3068 4.3068 4.9734 4.9734 5.3718 5.3718 5.4656 5.4656 8.0342 8.0342 8.0502 8.0502 8.3701 8.3701 8.6796 8.6796 8.6865 8.6865 8.9475 8.9475 11.2602 11.2632 k = 0.3333 0.5774 0.1945 ( 6957 PWs) bands (ev): -18.4269 -18.4269 -15.0414 -15.0414 -15.0414 -15.0414 -12.5714 -12.5714 -12.5469 -12.5469 -11.6857 -11.6857 -11.1039 -11.1039 -11.0998 -11.0998 -10.4798 -10.4798 -5.0413 -5.0413 -3.7392 -3.7392 -3.7097 -3.7097 -3.3186 -3.3186 -3.1277 -3.1277 -0.6461 -0.6461 0.0534 0.0534 0.0762 0.0762 0.4167 0.4167 0.4445 0.4445 1.0621 1.0621 1.0712 1.0712 1.0756 1.0756 1.6352 1.6352 1.6892 1.6892 1.7109 1.7109 2.2026 2.2026 3.4823 3.4823 3.4911 3.4911 3.5126 3.5126 3.7602 3.7602 4.1110 4.1110 4.1370 4.1370 4.3081 4.3081 4.9874 4.9874 5.3641 5.3641 5.4589 5.4589 8.0947 8.0947 8.1101 8.1101 8.4004 8.4004 8.6378 8.6378 8.6440 8.6440 8.9103 8.9103 11.2572 11.2582 k = 0.3333 0.5774 0.2107 ( 6960 PWs) bands (ev): -18.4269 -18.4269 -15.0413 -15.0413 -15.0413 -15.0413 -12.5727 -12.5727 -12.5482 -12.5482 -11.6856 -11.6856 -11.1021 -11.1021 -11.0981 -11.0981 -10.4799 -10.4799 -5.0422 -5.0422 -3.7486 -3.7486 -3.7162 -3.7162 -3.3148 -3.3148 -3.1213 -3.1213 -0.6373 -0.6373 0.0701 0.0701 0.0915 0.0915 0.4198 0.4198 0.4478 0.4478 1.0425 1.0425 1.0625 1.0625 1.0679 1.0679 1.6321 1.6321 1.6803 1.6803 1.7016 1.7016 2.2093 2.2093 3.4803 3.4803 3.4943 3.4943 3.5163 3.5163 3.7623 3.7623 4.1040 4.1040 4.1291 4.1291 4.3099 4.3099 5.0026 5.0026 5.3560 5.3560 5.4517 5.4517 8.1556 8.1556 8.1699 8.1699 8.4258 8.4258 8.5986 8.5986 8.6035 8.6035 8.8751 8.8751 11.2534 11.2552 k = 0.3333 0.5774 0.2269 ( 6960 PWs) bands (ev): -18.4269 -18.4269 -15.0411 -15.0411 -15.0411 -15.0411 -12.5739 -12.5739 -12.5494 -12.5494 -11.6856 -11.6856 -11.1005 -11.1005 -11.0964 -11.0964 -10.4800 -10.4800 -5.0433 -5.0433 -3.7587 -3.7587 -3.7228 -3.7228 -3.3102 -3.3102 -3.1134 -3.1134 -0.6278 -0.6278 0.0825 0.0825 0.1019 0.1019 0.4254 0.4254 0.4538 0.4538 1.0214 1.0214 1.0561 1.0561 1.0624 1.0624 1.6290 1.6290 1.6712 1.6712 1.6921 1.6921 2.2157 2.2157 3.4780 3.4780 3.4971 3.4971 3.5192 3.5192 3.7656 3.7656 4.0974 4.0974 4.1216 4.1216 4.3121 4.3121 5.0188 5.0188 5.3478 5.3478 5.4442 5.4442 8.2146 8.2146 8.2269 8.2269 8.4440 8.4440 8.5643 8.5643 8.5671 8.5671 8.8444 8.8444 11.2503 11.2510 k = 0.3333 0.5774 0.2431 ( 6957 PWs) bands (ev): -18.4269 -18.4269 -15.0410 -15.0410 -15.0410 -15.0410 -12.5751 -12.5751 -12.5506 -12.5506 -11.6855 -11.6855 -11.0989 -11.0989 -11.0948 -11.0948 -10.4801 -10.4801 -5.0446 -5.0446 -3.7693 -3.7693 -3.7294 -3.7294 -3.3048 -3.3048 -3.1043 -3.1043 -0.6178 -0.6178 0.0900 0.0900 0.1068 0.1068 0.4335 0.4335 0.4627 0.4627 0.9994 0.9994 1.0523 1.0523 1.0592 1.0592 1.6259 1.6259 1.6624 1.6624 1.6829 1.6829 2.2215 2.2215 3.4758 3.4758 3.4991 3.4991 3.5213 3.5213 3.7700 3.7700 4.0913 4.0913 4.1146 4.1146 4.3146 4.3146 5.0356 5.0356 5.3395 5.3395 5.4365 5.4365 8.2671 8.2671 8.2758 8.2758 8.4518 8.4518 8.5391 8.5391 8.5399 8.5399 8.8216 8.8216 11.2452 11.2465 k = 0.3333 0.5774 0.2593 ( 6981 PWs) bands (ev): -18.4269 -18.4269 -15.0409 -15.0409 -15.0409 -15.0409 -12.5761 -12.5761 -12.5516 -12.5516 -11.6854 -11.6854 -11.0974 -11.0974 -11.0934 -11.0934 -10.4802 -10.4802 -5.0460 -5.0460 -3.7800 -3.7800 -3.7358 -3.7358 -3.2989 -3.2989 -3.0943 -3.0943 -0.6075 -0.6075 0.0923 0.0923 0.1062 0.1062 0.4440 0.4440 0.4744 0.4744 0.9767 0.9767 1.0510 1.0510 1.0583 1.0583 1.6228 1.6228 1.6542 1.6542 1.6741 1.6741 2.2266 2.2266 3.4736 3.4736 3.5002 3.5002 3.5225 3.5225 3.7754 3.7754 4.0858 4.0858 4.1082 4.1082 4.3174 4.3174 5.0528 5.0528 5.3313 5.3313 5.4287 5.4287 8.3036 8.3036 8.3065 8.3065 8.4468 8.4468 8.5282 8.5282 8.5350 8.5350 8.8094 8.8094 11.2411 11.2425 k = 0.3333 0.5774 0.2755 ( 6987 PWs) bands (ev): -18.4269 -18.4269 -15.0408 -15.0408 -15.0408 -15.0408 -12.5771 -12.5771 -12.5526 -12.5526 -11.6854 -11.6854 -11.0961 -11.0961 -11.0921 -11.0921 -10.4803 -10.4803 -5.0475 -5.0475 -3.7906 -3.7906 -3.7419 -3.7419 -3.2925 -3.2925 -3.0837 -3.0837 -0.5972 -0.5972 0.0896 0.0896 0.1005 0.1005 0.4566 0.4566 0.4881 0.4881 0.9541 0.9541 1.0522 1.0522 1.0597 1.0597 1.6195 1.6195 1.6470 1.6470 1.6660 1.6660 2.2311 2.2311 3.4716 3.4716 3.5004 3.5004 3.5228 3.5228 3.7816 3.7816 4.0811 4.0811 4.1026 4.1026 4.3203 4.3203 5.0701 5.0701 5.3234 5.3234 5.4211 5.4211 8.3102 8.3102 8.3128 8.3128 8.4291 8.4291 8.5445 8.5445 8.5578 8.5578 8.8088 8.8088 11.2361 11.2368 k = 0.3333 0.5774 0.2917 ( 6984 PWs) bands (ev): -18.4269 -18.4269 -15.0407 -15.0407 -15.0407 -15.0407 -12.5778 -12.5778 -12.5533 -12.5533 -11.6853 -11.6853 -11.0951 -11.0951 -11.0911 -11.0911 -10.4804 -10.4804 -5.0490 -5.0490 -3.8008 -3.8008 -3.7474 -3.7474 -3.2858 -3.2858 -3.0726 -3.0726 -0.5870 -0.5870 0.0822 0.0822 0.0901 0.0901 0.4704 0.4704 0.5030 0.5030 0.9320 0.9320 1.0560 1.0560 1.0633 1.0633 1.6159 1.6159 1.6412 1.6412 1.6590 1.6590 2.2348 2.2348 3.4699 3.4699 3.4996 3.4996 3.5222 3.5222 3.7884 3.7884 4.0773 4.0773 4.0979 4.0979 4.3233 4.3233 5.0871 5.0871 5.3159 5.3159 5.4137 5.4137 8.2919 8.2919 8.2967 8.2967 8.4001 8.4001 8.5861 8.5861 8.6029 8.6029 8.8182 8.8182 11.2329 11.2358 k = 0.3333 0.5774 0.3079 ( 6978 PWs) bands (ev): -18.4269 -18.4269 -15.0406 -15.0406 -15.0406 -15.0406 -12.5784 -12.5784 -12.5539 -12.5539 -11.6853 -11.6853 -11.0942 -11.0942 -11.0902 -11.0902 -10.4805 -10.4805 -5.0506 -5.0506 -3.8104 -3.8104 -3.7524 -3.7524 -3.2789 -3.2789 -3.0613 -3.0613 -0.5771 -0.5771 0.0709 0.0709 0.0759 0.0759 0.4847 0.4847 0.5183 0.5183 0.9109 0.9109 1.0621 1.0621 1.0691 1.0691 1.6122 1.6122 1.6370 1.6370 1.6534 1.6534 2.2377 2.2377 3.4685 3.4685 3.4978 3.4978 3.5205 3.5205 3.7956 3.7956 4.0744 4.0744 4.0943 4.0943 4.3264 4.3264 5.1036 5.1036 5.3088 5.3088 5.4067 5.4067 8.2622 8.2622 8.2670 8.2670 8.3629 8.3629 8.6410 8.6410 8.6591 8.6591 8.8346 8.8346 11.2272 11.2283 k = 0.3333 0.5774 0.3241 ( 6984 PWs) bands (ev): -18.4269 -18.4269 -15.0406 -15.0406 -15.0406 -15.0406 -12.5789 -12.5789 -12.5544 -12.5544 -11.6853 -11.6853 -11.0936 -11.0936 -11.0896 -11.0896 -10.4806 -10.4806 -5.0522 -5.0522 -3.8193 -3.8193 -3.7566 -3.7566 -3.2720 -3.2720 -3.0500 -3.0500 -0.5680 -0.5680 0.0563 0.0563 0.0587 0.0587 0.4986 0.4986 0.5331 0.5331 0.8912 0.8912 1.0705 1.0705 1.0767 1.0767 1.6088 1.6088 1.6341 1.6341 1.6492 1.6492 2.2398 2.2398 3.4673 3.4673 3.4950 3.4950 3.5180 3.5180 3.8032 3.8032 4.0726 4.0726 4.0917 4.0917 4.3295 4.3295 5.1190 5.1190 5.3024 5.3024 5.4000 5.4000 8.2274 8.2274 8.2314 8.2314 8.3205 8.3205 8.7011 8.7011 8.7197 8.7197 8.8553 8.8553 11.2242 11.2299 k = 0.3333 0.5774 0.3403 ( 6978 PWs) bands (ev): -18.4269 -18.4269 -15.0405 -15.0405 -15.0405 -15.0405 -12.5791 -12.5791 -12.5546 -12.5546 -11.6852 -11.6852 -11.0932 -11.0932 -11.0893 -11.0893 -10.4807 -10.4807 -5.0537 -5.0537 -3.8273 -3.8273 -3.7602 -3.7602 -3.2652 -3.2652 -3.0390 -3.0390 -0.5597 -0.5597 0.0391 0.0391 0.0392 0.0392 0.5115 0.5115 0.5466 0.5466 0.8735 0.8735 1.0808 1.0808 1.0861 1.0861 1.6060 1.6060 1.6324 1.6324 1.6469 1.6469 2.2411 2.2411 3.4664 3.4664 3.4912 3.4912 3.5144 3.5144 3.8108 3.8108 4.0719 4.0719 4.0904 4.0904 4.3325 4.3325 5.1332 5.1332 5.2967 5.2967 5.3940 5.3940 8.1901 8.1901 8.1929 8.1929 8.2755 8.2755 8.7625 8.7625 8.7814 8.7814 8.8785 8.8785 11.2204 11.2249 Writing output data file BaAl2xSiO4x2.save init_run : 0.56s CPU 0.74s WALL ( 1 calls) electrons : 698.98s CPU 706.46s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 698.97s CPU 706.44s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.14s CPU 0.24s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.10s CPU 0.16s WALL ( 262 calls) cegterg : 672.33s CPU 679.05s WALL ( 1167 calls) Called by sum_band: Called by *egterg: h_psi : 288.81s CPU 292.25s WALL ( 22803 calls) s_psi : 32.66s CPU 32.83s WALL ( 22803 calls) g_psi : 0.86s CPU 0.87s WALL ( 21374 calls) cdiaghg : 279.44s CPU 282.53s WALL ( 21636 calls) cegterg:over : 32.06s CPU 32.02s WALL ( 21374 calls) cegterg:upda : 33.07s CPU 33.41s WALL ( 21374 calls) cegterg:last : 12.20s CPU 12.15s WALL ( 1953 calls) cdiaghg:chol : 15.93s CPU 16.29s WALL ( 21636 calls) cdiaghg:inve : 11.80s CPU 11.88s WALL ( 21636 calls) cdiaghg:para : 20.08s CPU 20.09s WALL ( 43272 calls) Called by h_psi: h_psi:vloc : 217.95s CPU 221.03s WALL ( 22803 calls) h_psi:vnl : 69.67s CPU 70.03s WALL ( 22803 calls) add_vuspsi : 36.24s CPU 36.23s WALL ( 22803 calls) General routines calbec : 33.31s CPU 33.74s WALL ( 22803 calls) fft : 0.04s CPU 0.03s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 200.51s CPU 203.47s WALL ( 1872540 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.25s CPU 0.41s WALL ( 524 calls) Parallel routines fft_scatter : 66.98s CPU 67.81s WALL ( 1872563 calls) PWSCF : 12m 7.76s CPU 12m27.09s WALL This run was terminated on: 18:39:49 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=