Program PWSCF v.5.4.0 starts on 3Aug2017 at 20:29:31 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 & OpenMP), running on 72 processor cores Number of MPI processes: 36 Threads/MPI process: 2 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: ./NaB3H8.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per band group 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 70 58 16 4047 3022 452 Max 71 59 17 4055 3049 457 Sum 2549 2095 591 145845 109269 16327 bravais-lattice index = 14 lattice parameter (alat) = 8.9775 a.u. unit-cell volume = 1474.6631 (a.u.)^3 number of atoms/cell = 24 number of atomic types = 3 number of electrons = 52.00 number of Kohn-Sham states= 62 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 325.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.977521 celldm(2)= 1.221841 celldm(3)= 1.668049 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.221841 0.000000 ) a(3) = ( 0.000000 0.000000 1.668049 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.818437 -0.000000 ) b(3) = ( 0.000000 0.000000 0.599503 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 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 B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c 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 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) Na 9.00 22.98980 Na( 1.00) B 3.00 10.81100 B( 1.00) 8 Sym. Ops., with inversion, found ( 6 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8340245 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8340245 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 inversion cryst. s( 5) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 6) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 6) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8340245 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8340245 ) isym = 8 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) double point group D_2h (mmm) there are 10 classes and 2 irreducible representations the character table: E -E C2 C2' C2'' i -i s_v s_v' s_v'' -C2 -C2' -C2'' -s_v -s_v' -s_v' G_5+ 2.00 -2.00 0.00 0.00 0.00 2.00 -2.00 0.00 0.00 0.00 G_5- 2.00 -2.00 0.00 0.00 0.00 -2.00 2.00 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 C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] C2' -C2' 3 -3 180 deg rotation - cart. axis [0,1,0] C2'' -C2'' 4 -4 180 deg rotation - cart. axis [1,0,0] i 5 inversion -i -5 inversion E s_v -s_v 6 -6 inv. 180 deg rotation - cart. axis [0,0,1] s_v'-s_v' 7 -7 inv. 180 deg rotation - cart. axis [0,1,0] s_v''-s_v' 8 -8 inv. 180 deg rotation - cart. axis [1,0,0] Cartesian axes number of k points= 340 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 2) = ( 0.0147059 -0.0000000 -0.0000000), wk = 0.0029412 k( 3) = ( 0.0294118 -0.0000000 -0.0000000), wk = 0.0029412 k( 4) = ( 0.0441177 -0.0000000 -0.0000000), wk = 0.0029412 k( 5) = ( 0.0588235 -0.0000000 -0.0000000), wk = 0.0029412 k( 6) = ( 0.0735294 -0.0000000 -0.0000000), wk = 0.0029412 k( 7) = ( 0.0882353 -0.0000000 -0.0000000), wk = 0.0029412 k( 8) = ( 0.1029412 -0.0000000 -0.0000000), wk = 0.0029412 k( 9) = ( 0.1176471 -0.0000000 -0.0000000), wk = 0.0029412 k( 10) = ( 0.1323529 -0.0000000 -0.0000000), wk = 0.0029412 k( 11) = ( 0.1470588 -0.0000000 -0.0000000), wk = 0.0029412 k( 12) = ( 0.1617647 -0.0000000 -0.0000000), wk = 0.0029412 k( 13) = ( 0.1764706 -0.0000000 -0.0000000), wk = 0.0029412 k( 14) = ( 0.1911765 -0.0000000 -0.0000000), wk = 0.0029412 k( 15) = ( 0.2058823 -0.0000000 -0.0000000), wk = 0.0029412 k( 16) = ( 0.2205882 -0.0000000 -0.0000000), wk = 0.0029412 k( 17) = ( 0.2352941 -0.0000000 -0.0000000), wk = 0.0029412 k( 18) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0029412 k( 19) = ( 0.2647059 -0.0000000 -0.0000000), wk = 0.0029412 k( 20) = ( 0.2794118 -0.0000000 -0.0000000), wk = 0.0029412 k( 21) = ( 0.2941177 -0.0000000 -0.0000000), wk = 0.0029412 k( 22) = ( 0.3088235 -0.0000000 -0.0000000), wk = 0.0029412 k( 23) = ( 0.3235294 -0.0000000 -0.0000000), wk = 0.0029412 k( 24) = ( 0.3382353 -0.0000000 -0.0000000), wk = 0.0029412 k( 25) = ( 0.3529412 -0.0000000 -0.0000000), wk = 0.0029412 k( 26) = ( 0.3676471 -0.0000000 -0.0000000), wk = 0.0029412 k( 27) = ( 0.3823529 -0.0000000 -0.0000000), wk = 0.0029412 k( 28) = ( 0.3970588 -0.0000000 -0.0000000), wk = 0.0029412 k( 29) = ( 0.4117647 -0.0000000 -0.0000000), wk = 0.0029412 k( 30) = ( 0.4264706 -0.0000000 -0.0000000), wk = 0.0029412 k( 31) = ( 0.4411765 -0.0000000 -0.0000000), wk = 0.0029412 k( 32) = ( 0.4558823 -0.0000000 -0.0000000), wk = 0.0029412 k( 33) = ( 0.4705882 -0.0000000 -0.0000000), wk = 0.0029412 k( 34) = ( 0.4852941 -0.0000000 -0.0000000), wk = 0.0029412 k( 35) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0029412 k( 36) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0029412 k( 37) = ( 0.5000000 0.0146149 -0.0000000), wk = 0.0029412 k( 38) = ( 0.5000000 0.0292299 -0.0000000), wk = 0.0029412 k( 39) = ( 0.5000000 0.0438448 -0.0000000), wk = 0.0029412 k( 40) = ( 0.5000000 0.0584598 -0.0000000), wk = 0.0029412 k( 41) = ( 0.5000000 0.0730747 -0.0000000), wk = 0.0029412 k( 42) = ( 0.5000000 0.0876897 -0.0000000), wk = 0.0029412 k( 43) = ( 0.5000000 0.1023046 -0.0000000), wk = 0.0029412 k( 44) = ( 0.5000000 0.1169196 -0.0000000), wk = 0.0029412 k( 45) = ( 0.5000000 0.1315345 -0.0000000), wk = 0.0029412 k( 46) = ( 0.5000000 0.1461495 -0.0000000), wk = 0.0029412 k( 47) = ( 0.5000000 0.1607644 -0.0000000), wk = 0.0029412 k( 48) = ( 0.5000000 0.1753794 -0.0000000), wk = 0.0029412 k( 49) = ( 0.5000000 0.1899943 -0.0000000), wk = 0.0029412 k( 50) = ( 0.5000000 0.2046093 -0.0000000), wk = 0.0029412 k( 51) = ( 0.5000000 0.2192242 -0.0000000), wk = 0.0029412 k( 52) = ( 0.5000000 0.2338392 -0.0000000), wk = 0.0029412 k( 53) = ( 0.5000000 0.2484541 -0.0000000), wk = 0.0029412 k( 54) = ( 0.5000000 0.2630691 -0.0000000), wk = 0.0029412 k( 55) = ( 0.5000000 0.2776840 -0.0000000), wk = 0.0029412 k( 56) = ( 0.5000000 0.2922990 -0.0000000), wk = 0.0029412 k( 57) = ( 0.5000000 0.3069139 -0.0000000), wk = 0.0029412 k( 58) = ( 0.5000000 0.3215289 -0.0000000), wk = 0.0029412 k( 59) = ( 0.5000000 0.3361438 -0.0000000), wk = 0.0029412 k( 60) = ( 0.5000000 0.3507588 -0.0000000), wk = 0.0029412 k( 61) = ( 0.5000000 0.3653737 -0.0000000), wk = 0.0029412 k( 62) = ( 0.5000000 0.3799887 -0.0000000), wk = 0.0029412 k( 63) = ( 0.5000000 0.3946036 -0.0000000), wk = 0.0029412 k( 64) = ( 0.5000000 0.4092186 -0.0000000), wk = 0.0029412 k( 65) = ( 0.5000000 0.4092186 -0.0000000), wk = 0.0029412 k( 66) = ( 0.4852941 0.4092186 -0.0000000), wk = 0.0029412 k( 67) = ( 0.4705882 0.4092186 -0.0000000), wk = 0.0029412 k( 68) = ( 0.4558823 0.4092186 -0.0000000), wk = 0.0029412 k( 69) = ( 0.4411765 0.4092186 -0.0000000), wk = 0.0029412 k( 70) = ( 0.4264706 0.4092186 -0.0000000), wk = 0.0029412 k( 71) = ( 0.4117647 0.4092186 -0.0000000), wk = 0.0029412 k( 72) = ( 0.3970588 0.4092186 -0.0000000), wk = 0.0029412 k( 73) = ( 0.3823529 0.4092186 -0.0000000), wk = 0.0029412 k( 74) = ( 0.3676471 0.4092186 -0.0000000), wk = 0.0029412 k( 75) = ( 0.3529412 0.4092186 -0.0000000), wk = 0.0029412 k( 76) = ( 0.3382353 0.4092186 -0.0000000), wk = 0.0029412 k( 77) = ( 0.3235294 0.4092186 -0.0000000), wk = 0.0029412 k( 78) = ( 0.3088235 0.4092186 -0.0000000), wk = 0.0029412 k( 79) = ( 0.2941177 0.4092186 -0.0000000), wk = 0.0029412 k( 80) = ( 0.2794118 0.4092186 -0.0000000), wk = 0.0029412 k( 81) = ( 0.2647059 0.4092186 -0.0000000), wk = 0.0029412 k( 82) = ( 0.2500000 0.4092186 -0.0000000), wk = 0.0029412 k( 83) = ( 0.2352941 0.4092186 -0.0000000), wk = 0.0029412 k( 84) = ( 0.2205882 0.4092186 -0.0000000), wk = 0.0029412 k( 85) = ( 0.2058823 0.4092186 -0.0000000), wk = 0.0029412 k( 86) = ( 0.1911765 0.4092186 -0.0000000), wk = 0.0029412 k( 87) = ( 0.1764706 0.4092186 -0.0000000), wk = 0.0029412 k( 88) = ( 0.1617647 0.4092186 -0.0000000), wk = 0.0029412 k( 89) = ( 0.1470588 0.4092186 -0.0000000), wk = 0.0029412 k( 90) = ( 0.1323529 0.4092186 -0.0000000), wk = 0.0029412 k( 91) = ( 0.1176471 0.4092186 -0.0000000), wk = 0.0029412 k( 92) = ( 0.1029412 0.4092186 -0.0000000), wk = 0.0029412 k( 93) = ( 0.0882353 0.4092186 -0.0000000), wk = 0.0029412 k( 94) = ( 0.0735294 0.4092186 -0.0000000), wk = 0.0029412 k( 95) = ( 0.0588235 0.4092186 -0.0000000), wk = 0.0029412 k( 96) = ( 0.0441177 0.4092186 -0.0000000), wk = 0.0029412 k( 97) = ( 0.0294118 0.4092186 -0.0000000), wk = 0.0029412 k( 98) = ( 0.0147059 0.4092186 -0.0000000), wk = 0.0029412 k( 99) = ( 0.0000000 0.4092186 -0.0000000), wk = 0.0029412 k( 100) = ( 0.0000000 0.4092186 -0.0000000), wk = 0.0029412 k( 101) = ( 0.0000000 0.3946036 -0.0000000), wk = 0.0029412 k( 102) = ( 0.0000000 0.3799887 -0.0000000), wk = 0.0029412 k( 103) = ( 0.0000000 0.3653737 -0.0000000), wk = 0.0029412 k( 104) = ( 0.0000000 0.3507588 -0.0000000), wk = 0.0029412 k( 105) = ( 0.0000000 0.3361438 -0.0000000), wk = 0.0029412 k( 106) = ( 0.0000000 0.3215289 -0.0000000), wk = 0.0029412 k( 107) = ( 0.0000000 0.3069139 -0.0000000), wk = 0.0029412 k( 108) = ( 0.0000000 0.2922990 -0.0000000), wk = 0.0029412 k( 109) = ( 0.0000000 0.2776840 -0.0000000), wk = 0.0029412 k( 110) = ( 0.0000000 0.2630691 -0.0000000), wk = 0.0029412 k( 111) = ( 0.0000000 0.2484541 -0.0000000), wk = 0.0029412 k( 112) = ( 0.0000000 0.2338392 -0.0000000), wk = 0.0029412 k( 113) = ( 0.0000000 0.2192242 -0.0000000), wk = 0.0029412 k( 114) = ( 0.0000000 0.2046093 -0.0000000), wk = 0.0029412 k( 115) = ( 0.0000000 0.1899943 -0.0000000), wk = 0.0029412 k( 116) = ( 0.0000000 0.1753794 -0.0000000), wk = 0.0029412 k( 117) = ( 0.0000000 0.1607644 -0.0000000), wk = 0.0029412 k( 118) = ( 0.0000000 0.1461495 -0.0000000), wk = 0.0029412 k( 119) = ( 0.0000000 0.1315345 -0.0000000), wk = 0.0029412 k( 120) = ( 0.0000000 0.1169196 -0.0000000), wk = 0.0029412 k( 121) = ( 0.0000000 0.1023046 -0.0000000), wk = 0.0029412 k( 122) = ( 0.0000000 0.0876897 -0.0000000), wk = 0.0029412 k( 123) = ( 0.0000000 0.0730747 -0.0000000), wk = 0.0029412 k( 124) = ( 0.0000000 0.0584598 -0.0000000), wk = 0.0029412 k( 125) = ( 0.0000000 0.0438448 -0.0000000), wk = 0.0029412 k( 126) = ( 0.0000000 0.0292299 -0.0000000), wk = 0.0029412 k( 127) = ( 0.0000000 0.0146149 -0.0000000), wk = 0.0029412 k( 128) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 130) = ( 0.0000000 0.0000000 0.0149876), wk = 0.0029412 k( 131) = ( 0.0000000 0.0000000 0.0299751), wk = 0.0029412 k( 132) = ( 0.0000000 0.0000000 0.0449627), wk = 0.0029412 k( 133) = ( 0.0000000 0.0000000 0.0599503), wk = 0.0029412 k( 134) = ( 0.0000000 0.0000000 0.0749379), wk = 0.0029412 k( 135) = ( 0.0000000 0.0000000 0.0899254), wk = 0.0029412 k( 136) = ( 0.0000000 0.0000000 0.1049130), wk = 0.0029412 k( 137) = ( 0.0000000 0.0000000 0.1199006), wk = 0.0029412 k( 138) = ( 0.0000000 0.0000000 0.1348881), wk = 0.0029412 k( 139) = ( 0.0000000 0.0000000 0.1498757), wk = 0.0029412 k( 140) = ( 0.0000000 0.0000000 0.1648633), wk = 0.0029412 k( 141) = ( 0.0000000 0.0000000 0.1798508), wk = 0.0029412 k( 142) = ( 0.0000000 0.0000000 0.1948384), wk = 0.0029412 k( 143) = ( 0.0000000 0.0000000 0.2098260), wk = 0.0029412 k( 144) = ( 0.0000000 0.0000000 0.2248136), wk = 0.0029412 k( 145) = ( 0.0000000 0.0000000 0.2398011), wk = 0.0029412 k( 146) = ( 0.0000000 0.0000000 0.2547887), wk = 0.0029412 k( 147) = ( 0.0000000 0.0000000 0.2697763), wk = 0.0029412 k( 148) = ( 0.0000000 0.0000000 0.2847638), wk = 0.0029412 k( 149) = ( 0.0000000 0.0000000 0.2997514), wk = 0.0029412 k( 150) = ( 0.0000000 0.0000000 0.2997514), wk = 0.0029412 k( 151) = ( 0.0147059 -0.0000000 0.2997514), wk = 0.0029412 k( 152) = ( 0.0294118 -0.0000000 0.2997514), wk = 0.0029412 k( 153) = ( 0.0441177 -0.0000000 0.2997514), wk = 0.0029412 k( 154) = ( 0.0588235 -0.0000000 0.2997514), wk = 0.0029412 k( 155) = ( 0.0735294 -0.0000000 0.2997514), wk = 0.0029412 k( 156) = ( 0.0882353 -0.0000000 0.2997514), wk = 0.0029412 k( 157) = ( 0.1029412 -0.0000000 0.2997514), wk = 0.0029412 k( 158) = ( 0.1176471 -0.0000000 0.2997514), wk = 0.0029412 k( 159) = ( 0.1323529 -0.0000000 0.2997514), wk = 0.0029412 k( 160) = ( 0.1470588 -0.0000000 0.2997514), wk = 0.0029412 k( 161) = ( 0.1617647 -0.0000000 0.2997514), wk = 0.0029412 k( 162) = ( 0.1764706 -0.0000000 0.2997514), wk = 0.0029412 k( 163) = ( 0.1911765 -0.0000000 0.2997514), wk = 0.0029412 k( 164) = ( 0.2058823 -0.0000000 0.2997514), wk = 0.0029412 k( 165) = ( 0.2205882 -0.0000000 0.2997514), wk = 0.0029412 k( 166) = ( 0.2352941 -0.0000000 0.2997514), wk = 0.0029412 k( 167) = ( 0.2500000 -0.0000000 0.2997514), wk = 0.0029412 k( 168) = ( 0.2647059 -0.0000000 0.2997514), wk = 0.0029412 k( 169) = ( 0.2794118 -0.0000000 0.2997514), wk = 0.0029412 k( 170) = ( 0.2941177 -0.0000000 0.2997514), wk = 0.0029412 k( 171) = ( 0.3088235 -0.0000000 0.2997514), wk = 0.0029412 k( 172) = ( 0.3235294 -0.0000000 0.2997514), wk = 0.0029412 k( 173) = ( 0.3382353 -0.0000000 0.2997514), wk = 0.0029412 k( 174) = ( 0.3529412 -0.0000000 0.2997514), wk = 0.0029412 k( 175) = ( 0.3676471 -0.0000000 0.2997514), wk = 0.0029412 k( 176) = ( 0.3823529 -0.0000000 0.2997514), wk = 0.0029412 k( 177) = ( 0.3970588 -0.0000000 0.2997514), wk = 0.0029412 k( 178) = ( 0.4117647 -0.0000000 0.2997514), wk = 0.0029412 k( 179) = ( 0.4264706 -0.0000000 0.2997514), wk = 0.0029412 k( 180) = ( 0.4411765 -0.0000000 0.2997514), wk = 0.0029412 k( 181) = ( 0.4558823 -0.0000000 0.2997514), wk = 0.0029412 k( 182) = ( 0.4705882 -0.0000000 0.2997514), wk = 0.0029412 k( 183) = ( 0.4852941 -0.0000000 0.2997514), wk = 0.0029412 k( 184) = ( 0.5000000 -0.0000000 0.2997514), wk = 0.0029412 k( 185) = ( 0.5000000 -0.0000000 0.2997514), wk = 0.0029412 k( 186) = ( 0.5000000 0.0146149 0.2997514), wk = 0.0029412 k( 187) = ( 0.5000000 0.0292299 0.2997514), wk = 0.0029412 k( 188) = ( 0.5000000 0.0438448 0.2997514), wk = 0.0029412 k( 189) = ( 0.5000000 0.0584598 0.2997514), wk = 0.0029412 k( 190) = ( 0.5000000 0.0730747 0.2997514), wk = 0.0029412 k( 191) = ( 0.5000000 0.0876897 0.2997514), wk = 0.0029412 k( 192) = ( 0.5000000 0.1023046 0.2997514), wk = 0.0029412 k( 193) = ( 0.5000000 0.1169196 0.2997514), wk = 0.0029412 k( 194) = ( 0.5000000 0.1315345 0.2997514), wk = 0.0029412 k( 195) = ( 0.5000000 0.1461495 0.2997514), wk = 0.0029412 k( 196) = ( 0.5000000 0.1607644 0.2997514), wk = 0.0029412 k( 197) = ( 0.5000000 0.1753794 0.2997514), wk = 0.0029412 k( 198) = ( 0.5000000 0.1899943 0.2997514), wk = 0.0029412 k( 199) = ( 0.5000000 0.2046093 0.2997514), wk = 0.0029412 k( 200) = ( 0.5000000 0.2192242 0.2997514), wk = 0.0029412 k( 201) = ( 0.5000000 0.2338392 0.2997514), wk = 0.0029412 k( 202) = ( 0.5000000 0.2484541 0.2997514), wk = 0.0029412 k( 203) = ( 0.5000000 0.2630691 0.2997514), wk = 0.0029412 k( 204) = ( 0.5000000 0.2776840 0.2997514), wk = 0.0029412 k( 205) = ( 0.5000000 0.2922990 0.2997514), wk = 0.0029412 k( 206) = ( 0.5000000 0.3069139 0.2997514), wk = 0.0029412 k( 207) = ( 0.5000000 0.3215289 0.2997514), wk = 0.0029412 k( 208) = ( 0.5000000 0.3361438 0.2997514), wk = 0.0029412 k( 209) = ( 0.5000000 0.3507588 0.2997514), wk = 0.0029412 k( 210) = ( 0.5000000 0.3653737 0.2997514), wk = 0.0029412 k( 211) = ( 0.5000000 0.3799887 0.2997514), wk = 0.0029412 k( 212) = ( 0.5000000 0.3946036 0.2997514), wk = 0.0029412 k( 213) = ( 0.5000000 0.4092186 0.2997514), wk = 0.0029412 k( 214) = ( 0.5000000 0.4092186 0.2997514), wk = 0.0029412 k( 215) = ( 0.4852941 0.4092186 0.2997514), wk = 0.0029412 k( 216) = ( 0.4705882 0.4092186 0.2997514), wk = 0.0029412 k( 217) = ( 0.4558823 0.4092186 0.2997514), wk = 0.0029412 k( 218) = ( 0.4411765 0.4092186 0.2997514), wk = 0.0029412 k( 219) = ( 0.4264706 0.4092186 0.2997514), wk = 0.0029412 k( 220) = ( 0.4117647 0.4092186 0.2997514), wk = 0.0029412 k( 221) = ( 0.3970588 0.4092186 0.2997514), wk = 0.0029412 k( 222) = ( 0.3823529 0.4092186 0.2997514), wk = 0.0029412 k( 223) = ( 0.3676471 0.4092186 0.2997514), wk = 0.0029412 k( 224) = ( 0.3529412 0.4092186 0.2997514), wk = 0.0029412 k( 225) = ( 0.3382353 0.4092186 0.2997514), wk = 0.0029412 k( 226) = ( 0.3235294 0.4092186 0.2997514), wk = 0.0029412 k( 227) = ( 0.3088235 0.4092186 0.2997514), wk = 0.0029412 k( 228) = ( 0.2941177 0.4092186 0.2997514), wk = 0.0029412 k( 229) = ( 0.2794118 0.4092186 0.2997514), wk = 0.0029412 k( 230) = ( 0.2647059 0.4092186 0.2997514), wk = 0.0029412 k( 231) = ( 0.2500000 0.4092186 0.2997514), wk = 0.0029412 k( 232) = ( 0.2352941 0.4092186 0.2997514), wk = 0.0029412 k( 233) = ( 0.2205882 0.4092186 0.2997514), wk = 0.0029412 k( 234) = ( 0.2058823 0.4092186 0.2997514), wk = 0.0029412 k( 235) = ( 0.1911765 0.4092186 0.2997514), wk = 0.0029412 k( 236) = ( 0.1764706 0.4092186 0.2997514), wk = 0.0029412 k( 237) = ( 0.1617647 0.4092186 0.2997514), wk = 0.0029412 k( 238) = ( 0.1470588 0.4092186 0.2997514), wk = 0.0029412 k( 239) = ( 0.1323529 0.4092186 0.2997514), wk = 0.0029412 k( 240) = ( 0.1176471 0.4092186 0.2997514), wk = 0.0029412 k( 241) = ( 0.1029412 0.4092186 0.2997514), wk = 0.0029412 k( 242) = ( 0.0882353 0.4092186 0.2997514), wk = 0.0029412 k( 243) = ( 0.0735294 0.4092186 0.2997514), wk = 0.0029412 k( 244) = ( 0.0588235 0.4092186 0.2997514), wk = 0.0029412 k( 245) = ( 0.0441177 0.4092186 0.2997514), wk = 0.0029412 k( 246) = ( 0.0294118 0.4092186 0.2997514), wk = 0.0029412 k( 247) = ( 0.0147059 0.4092186 0.2997514), wk = 0.0029412 k( 248) = ( 0.0000000 0.4092186 0.2997514), wk = 0.0029412 k( 249) = ( 0.0000000 0.4092186 0.2997514), wk = 0.0029412 k( 250) = ( 0.0000000 0.3946036 0.2997514), wk = 0.0029412 k( 251) = ( 0.0000000 0.3799887 0.2997514), wk = 0.0029412 k( 252) = ( 0.0000000 0.3653737 0.2997514), wk = 0.0029412 k( 253) = ( 0.0000000 0.3507588 0.2997514), wk = 0.0029412 k( 254) = ( 0.0000000 0.3361438 0.2997514), wk = 0.0029412 k( 255) = ( 0.0000000 0.3215289 0.2997514), wk = 0.0029412 k( 256) = ( 0.0000000 0.3069139 0.2997514), wk = 0.0029412 k( 257) = ( 0.0000000 0.2922990 0.2997514), wk = 0.0029412 k( 258) = ( 0.0000000 0.2776840 0.2997514), wk = 0.0029412 k( 259) = ( 0.0000000 0.2630691 0.2997514), wk = 0.0029412 k( 260) = ( 0.0000000 0.2484541 0.2997514), wk = 0.0029412 k( 261) = ( 0.0000000 0.2338392 0.2997514), wk = 0.0029412 k( 262) = ( 0.0000000 0.2192242 0.2997514), wk = 0.0029412 k( 263) = ( 0.0000000 0.2046093 0.2997514), wk = 0.0029412 k( 264) = ( 0.0000000 0.1899943 0.2997514), wk = 0.0029412 k( 265) = ( 0.0000000 0.1753794 0.2997514), wk = 0.0029412 k( 266) = ( 0.0000000 0.1607644 0.2997514), wk = 0.0029412 k( 267) = ( 0.0000000 0.1461495 0.2997514), wk = 0.0029412 k( 268) = ( 0.0000000 0.1315345 0.2997514), wk = 0.0029412 k( 269) = ( 0.0000000 0.1169196 0.2997514), wk = 0.0029412 k( 270) = ( 0.0000000 0.1023046 0.2997514), wk = 0.0029412 k( 271) = ( 0.0000000 0.0876897 0.2997514), wk = 0.0029412 k( 272) = ( 0.0000000 0.0730747 0.2997514), wk = 0.0029412 k( 273) = ( 0.0000000 0.0584598 0.2997514), wk = 0.0029412 k( 274) = ( 0.0000000 0.0438448 0.2997514), wk = 0.0029412 k( 275) = ( 0.0000000 0.0292299 0.2997514), wk = 0.0029412 k( 276) = ( 0.0000000 0.0146149 0.2997514), wk = 0.0029412 k( 277) = ( 0.0000000 0.0000000 0.2997514), wk = 0.0029412 k( 278) = ( 0.0000000 0.4092186 -0.0000000), wk = 0.0029412 k( 279) = ( 0.0000000 0.4092186 0.0149876), wk = 0.0029412 k( 280) = ( 0.0000000 0.4092186 0.0299751), wk = 0.0029412 k( 281) = ( 0.0000000 0.4092186 0.0449627), wk = 0.0029412 k( 282) = ( 0.0000000 0.4092186 0.0599503), wk = 0.0029412 k( 283) = ( 0.0000000 0.4092186 0.0749379), wk = 0.0029412 k( 284) = ( 0.0000000 0.4092186 0.0899254), wk = 0.0029412 k( 285) = ( 0.0000000 0.4092186 0.1049130), wk = 0.0029412 k( 286) = ( 0.0000000 0.4092186 0.1199006), wk = 0.0029412 k( 287) = ( 0.0000000 0.4092186 0.1348881), wk = 0.0029412 k( 288) = ( 0.0000000 0.4092186 0.1498757), wk = 0.0029412 k( 289) = ( 0.0000000 0.4092186 0.1648633), wk = 0.0029412 k( 290) = ( 0.0000000 0.4092186 0.1798508), wk = 0.0029412 k( 291) = ( 0.0000000 0.4092186 0.1948384), wk = 0.0029412 k( 292) = ( 0.0000000 0.4092186 0.2098260), wk = 0.0029412 k( 293) = ( 0.0000000 0.4092186 0.2248136), wk = 0.0029412 k( 294) = ( 0.0000000 0.4092186 0.2398011), wk = 0.0029412 k( 295) = ( 0.0000000 0.4092186 0.2547887), wk = 0.0029412 k( 296) = ( 0.0000000 0.4092186 0.2697763), wk = 0.0029412 k( 297) = ( 0.0000000 0.4092186 0.2847638), wk = 0.0029412 k( 298) = ( 0.0000000 0.4092186 0.2997514), wk = 0.0029412 k( 299) = ( 0.5000000 -0.0000000 0.2997514), wk = 0.0029412 k( 300) = ( 0.5000000 -0.0000000 0.2847638), wk = 0.0029412 k( 301) = ( 0.5000000 -0.0000000 0.2697763), wk = 0.0029412 k( 302) = ( 0.5000000 -0.0000000 0.2547887), wk = 0.0029412 k( 303) = ( 0.5000000 -0.0000000 0.2398011), wk = 0.0029412 k( 304) = ( 0.5000000 -0.0000000 0.2248136), wk = 0.0029412 k( 305) = ( 0.5000000 -0.0000000 0.2098260), wk = 0.0029412 k( 306) = ( 0.5000000 -0.0000000 0.1948384), wk = 0.0029412 k( 307) = ( 0.5000000 -0.0000000 0.1798508), wk = 0.0029412 k( 308) = ( 0.5000000 -0.0000000 0.1648633), wk = 0.0029412 k( 309) = ( 0.5000000 -0.0000000 0.1498757), wk = 0.0029412 k( 310) = ( 0.5000000 -0.0000000 0.1348881), wk = 0.0029412 k( 311) = ( 0.5000000 -0.0000000 0.1199006), wk = 0.0029412 k( 312) = ( 0.5000000 -0.0000000 0.1049130), wk = 0.0029412 k( 313) = ( 0.5000000 -0.0000000 0.0899254), wk = 0.0029412 k( 314) = ( 0.5000000 -0.0000000 0.0749379), wk = 0.0029412 k( 315) = ( 0.5000000 -0.0000000 0.0599503), wk = 0.0029412 k( 316) = ( 0.5000000 -0.0000000 0.0449627), wk = 0.0029412 k( 317) = ( 0.5000000 -0.0000000 0.0299751), wk = 0.0029412 k( 318) = ( 0.5000000 -0.0000000 0.0149876), wk = 0.0029412 k( 319) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0029412 k( 320) = ( 0.5000000 0.4092186 -0.0000000), wk = 0.0029412 k( 321) = ( 0.5000000 0.4092186 0.0149876), wk = 0.0029412 k( 322) = ( 0.5000000 0.4092186 0.0299751), wk = 0.0029412 k( 323) = ( 0.5000000 0.4092186 0.0449627), wk = 0.0029412 k( 324) = ( 0.5000000 0.4092186 0.0599503), wk = 0.0029412 k( 325) = ( 0.5000000 0.4092186 0.0749379), wk = 0.0029412 k( 326) = ( 0.5000000 0.4092186 0.0899254), wk = 0.0029412 k( 327) = ( 0.5000000 0.4092186 0.1049130), wk = 0.0029412 k( 328) = ( 0.5000000 0.4092186 0.1199006), wk = 0.0029412 k( 329) = ( 0.5000000 0.4092186 0.1348881), wk = 0.0029412 k( 330) = ( 0.5000000 0.4092186 0.1498757), wk = 0.0029412 k( 331) = ( 0.5000000 0.4092186 0.1648633), wk = 0.0029412 k( 332) = ( 0.5000000 0.4092186 0.1798508), wk = 0.0029412 k( 333) = ( 0.5000000 0.4092186 0.1948384), wk = 0.0029412 k( 334) = ( 0.5000000 0.4092186 0.2098260), wk = 0.0029412 k( 335) = ( 0.5000000 0.4092186 0.2248136), wk = 0.0029412 k( 336) = ( 0.5000000 0.4092186 0.2398011), wk = 0.0029412 k( 337) = ( 0.5000000 0.4092186 0.2547887), wk = 0.0029412 k( 338) = ( 0.5000000 0.4092186 0.2697763), wk = 0.0029412 k( 339) = ( 0.5000000 0.4092186 0.2847638), wk = 0.0029412 k( 340) = ( 0.5000000 0.4092186 0.2997514), wk = 0.0029412 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 2) = ( 0.0147059 -0.0000000 0.0000000), wk = 0.0029412 k( 3) = ( 0.0294118 -0.0000000 0.0000000), wk = 0.0029412 k( 4) = ( 0.0441177 0.0000000 0.0000000), wk = 0.0029412 k( 5) = ( 0.0588235 0.0000000 0.0000000), wk = 0.0029412 k( 6) = ( 0.0735294 -0.0000000 0.0000000), wk = 0.0029412 k( 7) = ( 0.0882353 -0.0000000 0.0000000), wk = 0.0029412 k( 8) = ( 0.1029412 0.0000000 0.0000000), wk = 0.0029412 k( 9) = ( 0.1176471 0.0000000 0.0000000), wk = 0.0029412 k( 10) = ( 0.1323529 -0.0000000 0.0000000), wk = 0.0029412 k( 11) = ( 0.1470588 -0.0000000 0.0000000), wk = 0.0029412 k( 12) = ( 0.1617647 0.0000000 0.0000000), wk = 0.0029412 k( 13) = ( 0.1764706 0.0000000 0.0000000), wk = 0.0029412 k( 14) = ( 0.1911765 -0.0000000 0.0000000), wk = 0.0029412 k( 15) = ( 0.2058823 0.0000000 -0.0000000), wk = 0.0029412 k( 16) = ( 0.2205882 -0.0000000 0.0000000), wk = 0.0029412 k( 17) = ( 0.2352941 0.0000000 0.0000000), wk = 0.0029412 k( 18) = ( 0.2500000 0.0000000 -0.0000000), wk = 0.0029412 k( 19) = ( 0.2647059 -0.0000000 0.0000000), wk = 0.0029412 k( 20) = ( 0.2794118 -0.0000000 0.0000000), wk = 0.0029412 k( 21) = ( 0.2941177 -0.0000000 0.0000000), wk = 0.0029412 k( 22) = ( 0.3088235 0.0000000 0.0000000), wk = 0.0029412 k( 23) = ( 0.3235294 0.0000000 -0.0000000), wk = 0.0029412 k( 24) = ( 0.3382353 -0.0000000 0.0000000), wk = 0.0029412 k( 25) = ( 0.3529412 0.0000000 0.0000000), wk = 0.0029412 k( 26) = ( 0.3676471 0.0000000 0.0000000), wk = 0.0029412 k( 27) = ( 0.3823529 -0.0000000 0.0000000), wk = 0.0029412 k( 28) = ( 0.3970588 -0.0000000 -0.0000000), wk = 0.0029412 k( 29) = ( 0.4117647 0.0000000 -0.0000000), wk = 0.0029412 k( 30) = ( 0.4264706 -0.0000000 0.0000000), wk = 0.0029412 k( 31) = ( 0.4411765 -0.0000000 0.0000000), wk = 0.0029412 k( 32) = ( 0.4558823 -0.0000000 0.0000000), wk = 0.0029412 k( 33) = ( 0.4705882 0.0000000 0.0000000), wk = 0.0029412 k( 34) = ( 0.4852941 -0.0000000 -0.0000000), wk = 0.0029412 k( 35) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0029412 k( 36) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0029412 k( 37) = ( 0.5000000 0.0178571 0.0000000), wk = 0.0029412 k( 38) = ( 0.5000000 0.0357143 0.0000000), wk = 0.0029412 k( 39) = ( 0.5000000 0.0535714 -0.0000000), wk = 0.0029412 k( 40) = ( 0.5000000 0.0714286 -0.0000000), wk = 0.0029412 k( 41) = ( 0.5000000 0.0892857 0.0000000), wk = 0.0029412 k( 42) = ( 0.5000000 0.1071429 0.0000000), wk = 0.0029412 k( 43) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0029412 k( 44) = ( 0.5000000 0.1428571 -0.0000000), wk = 0.0029412 k( 45) = ( 0.5000000 0.1607143 0.0000000), wk = 0.0029412 k( 46) = ( 0.5000000 0.1785714 -0.0000000), wk = 0.0029412 k( 47) = ( 0.5000000 0.1964286 0.0000000), wk = 0.0029412 k( 48) = ( 0.5000000 0.2142857 -0.0000000), wk = 0.0029412 k( 49) = ( 0.5000000 0.2321429 0.0000000), wk = 0.0029412 k( 50) = ( 0.5000000 0.2500000 -0.0000000), wk = 0.0029412 k( 51) = ( 0.5000000 0.2678571 0.0000000), wk = 0.0029412 k( 52) = ( 0.5000000 0.2857143 0.0000000), wk = 0.0029412 k( 53) = ( 0.5000000 0.3035714 0.0000000), wk = 0.0029412 k( 54) = ( 0.5000000 0.3214286 0.0000000), wk = 0.0029412 k( 55) = ( 0.5000000 0.3392857 0.0000000), wk = 0.0029412 k( 56) = ( 0.5000000 0.3571429 -0.0000000), wk = 0.0029412 k( 57) = ( 0.5000000 0.3750000 -0.0000000), wk = 0.0029412 k( 58) = ( 0.5000000 0.3928571 -0.0000000), wk = 0.0029412 k( 59) = ( 0.5000000 0.4107143 -0.0000000), wk = 0.0029412 k( 60) = ( 0.5000000 0.4285714 0.0000000), wk = 0.0029412 k( 61) = ( 0.5000000 0.4464286 -0.0000000), wk = 0.0029412 k( 62) = ( 0.5000000 0.4642857 0.0000000), wk = 0.0029412 k( 63) = ( 0.5000000 0.4821429 0.0000000), wk = 0.0029412 k( 64) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029412 k( 65) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029412 k( 66) = ( 0.4852941 0.5000000 0.0000000), wk = 0.0029412 k( 67) = ( 0.4705882 0.5000000 -0.0000000), wk = 0.0029412 k( 68) = ( 0.4558823 0.5000000 -0.0000000), wk = 0.0029412 k( 69) = ( 0.4411765 0.5000000 -0.0000000), wk = 0.0029412 k( 70) = ( 0.4264706 0.5000000 0.0000000), wk = 0.0029412 k( 71) = ( 0.4117647 0.5000000 -0.0000000), wk = 0.0029412 k( 72) = ( 0.3970588 0.5000000 0.0000000), wk = 0.0029412 k( 73) = ( 0.3823529 0.5000000 -0.0000000), wk = 0.0029412 k( 74) = ( 0.3676471 0.5000000 -0.0000000), wk = 0.0029412 k( 75) = ( 0.3529412 0.5000000 0.0000000), wk = 0.0029412 k( 76) = ( 0.3382353 0.5000000 0.0000000), wk = 0.0029412 k( 77) = ( 0.3235294 0.5000000 0.0000000), wk = 0.0029412 k( 78) = ( 0.3088235 0.5000000 0.0000000), wk = 0.0029412 k( 79) = ( 0.2941177 0.5000000 0.0000000), wk = 0.0029412 k( 80) = ( 0.2794118 0.5000000 -0.0000000), wk = 0.0029412 k( 81) = ( 0.2647059 0.5000000 0.0000000), wk = 0.0029412 k( 82) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0029412 k( 83) = ( 0.2352941 0.5000000 -0.0000000), wk = 0.0029412 k( 84) = ( 0.2205882 0.5000000 0.0000000), wk = 0.0029412 k( 85) = ( 0.2058823 0.5000000 -0.0000000), wk = 0.0029412 k( 86) = ( 0.1911765 0.5000000 0.0000000), wk = 0.0029412 k( 87) = ( 0.1764706 0.5000000 -0.0000000), wk = 0.0029412 k( 88) = ( 0.1617647 0.5000000 0.0000000), wk = 0.0029412 k( 89) = ( 0.1470588 0.5000000 0.0000000), wk = 0.0029412 k( 90) = ( 0.1323529 0.5000000 0.0000000), wk = 0.0029412 k( 91) = ( 0.1176471 0.5000000 -0.0000000), wk = 0.0029412 k( 92) = ( 0.1029412 0.5000000 -0.0000000), wk = 0.0029412 k( 93) = ( 0.0882353 0.5000000 -0.0000000), wk = 0.0029412 k( 94) = ( 0.0735294 0.5000000 -0.0000000), wk = 0.0029412 k( 95) = ( 0.0588235 0.5000000 -0.0000000), wk = 0.0029412 k( 96) = ( 0.0441177 0.5000000 0.0000000), wk = 0.0029412 k( 97) = ( 0.0294118 0.5000000 -0.0000000), wk = 0.0029412 k( 98) = ( 0.0147059 0.5000000 -0.0000000), wk = 0.0029412 k( 99) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029412 k( 100) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029412 k( 101) = ( 0.0000000 0.4821429 -0.0000000), wk = 0.0029412 k( 102) = ( 0.0000000 0.4642857 0.0000000), wk = 0.0029412 k( 103) = ( 0.0000000 0.4464286 -0.0000000), wk = 0.0029412 k( 104) = ( 0.0000000 0.4285714 -0.0000000), wk = 0.0029412 k( 105) = ( 0.0000000 0.4107143 -0.0000000), wk = 0.0029412 k( 106) = ( 0.0000000 0.3928571 -0.0000000), wk = 0.0029412 k( 107) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0029412 k( 108) = ( 0.0000000 0.3571429 -0.0000000), wk = 0.0029412 k( 109) = ( 0.0000000 0.3392857 -0.0000000), wk = 0.0029412 k( 110) = ( 0.0000000 0.3214286 0.0000000), wk = 0.0029412 k( 111) = ( 0.0000000 0.3035714 -0.0000000), wk = 0.0029412 k( 112) = ( 0.0000000 0.2857143 0.0000000), wk = 0.0029412 k( 113) = ( 0.0000000 0.2678571 0.0000000), wk = 0.0029412 k( 114) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0029412 k( 115) = ( 0.0000000 0.2321429 0.0000000), wk = 0.0029412 k( 116) = ( 0.0000000 0.2142857 0.0000000), wk = 0.0029412 k( 117) = ( 0.0000000 0.1964286 -0.0000000), wk = 0.0029412 k( 118) = ( 0.0000000 0.1785714 -0.0000000), wk = 0.0029412 k( 119) = ( 0.0000000 0.1607143 -0.0000000), wk = 0.0029412 k( 120) = ( 0.0000000 0.1428571 -0.0000000), wk = 0.0029412 k( 121) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0029412 k( 122) = ( 0.0000000 0.1071429 0.0000000), wk = 0.0029412 k( 123) = ( 0.0000000 0.0892857 -0.0000000), wk = 0.0029412 k( 124) = ( 0.0000000 0.0714286 -0.0000000), wk = 0.0029412 k( 125) = ( 0.0000000 0.0535714 0.0000000), wk = 0.0029412 k( 126) = ( 0.0000000 0.0357143 0.0000000), wk = 0.0029412 k( 127) = ( 0.0000000 0.0178571 -0.0000000), wk = 0.0029412 k( 128) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 129) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0029412 k( 130) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0029412 k( 131) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0029412 k( 132) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0029412 k( 133) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0029412 k( 134) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0029412 k( 135) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0029412 k( 136) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0029412 k( 137) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0029412 k( 138) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0029412 k( 139) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0029412 k( 140) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0029412 k( 141) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0029412 k( 142) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0029412 k( 143) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0029412 k( 144) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0029412 k( 145) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0029412 k( 146) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0029412 k( 147) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0029412 k( 148) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0029412 k( 149) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029412 k( 150) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029412 k( 151) = ( 0.0147059 -0.0000000 0.5000000), wk = 0.0029412 k( 152) = ( 0.0294118 -0.0000000 0.5000000), wk = 0.0029412 k( 153) = ( 0.0441177 0.0000000 0.5000000), wk = 0.0029412 k( 154) = ( 0.0588235 0.0000000 0.5000000), wk = 0.0029412 k( 155) = ( 0.0735294 -0.0000000 0.5000000), wk = 0.0029412 k( 156) = ( 0.0882353 -0.0000000 0.5000000), wk = 0.0029412 k( 157) = ( 0.1029412 0.0000000 0.5000000), wk = 0.0029412 k( 158) = ( 0.1176471 0.0000000 0.5000000), wk = 0.0029412 k( 159) = ( 0.1323529 -0.0000000 0.5000000), wk = 0.0029412 k( 160) = ( 0.1470588 -0.0000000 0.5000000), wk = 0.0029412 k( 161) = ( 0.1617647 0.0000000 0.5000000), wk = 0.0029412 k( 162) = ( 0.1764706 0.0000000 0.5000000), wk = 0.0029412 k( 163) = ( 0.1911765 -0.0000000 0.5000000), wk = 0.0029412 k( 164) = ( 0.2058823 0.0000000 0.5000000), wk = 0.0029412 k( 165) = ( 0.2205882 -0.0000000 0.5000000), wk = 0.0029412 k( 166) = ( 0.2352941 0.0000000 0.5000000), wk = 0.0029412 k( 167) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0029412 k( 168) = ( 0.2647059 -0.0000000 0.5000000), wk = 0.0029412 k( 169) = ( 0.2794118 -0.0000000 0.5000000), wk = 0.0029412 k( 170) = ( 0.2941177 -0.0000000 0.5000000), wk = 0.0029412 k( 171) = ( 0.3088235 0.0000000 0.5000000), wk = 0.0029412 k( 172) = ( 0.3235294 0.0000000 0.5000000), wk = 0.0029412 k( 173) = ( 0.3382353 -0.0000000 0.5000000), wk = 0.0029412 k( 174) = ( 0.3529412 0.0000000 0.5000000), wk = 0.0029412 k( 175) = ( 0.3676471 0.0000000 0.5000000), wk = 0.0029412 k( 176) = ( 0.3823529 -0.0000000 0.5000000), wk = 0.0029412 k( 177) = ( 0.3970588 -0.0000000 0.5000000), wk = 0.0029412 k( 178) = ( 0.4117647 0.0000000 0.5000000), wk = 0.0029412 k( 179) = ( 0.4264706 -0.0000000 0.5000000), wk = 0.0029412 k( 180) = ( 0.4411765 -0.0000000 0.5000000), wk = 0.0029412 k( 181) = ( 0.4558823 -0.0000000 0.5000000), wk = 0.0029412 k( 182) = ( 0.4705882 0.0000000 0.5000000), wk = 0.0029412 k( 183) = ( 0.4852941 -0.0000000 0.5000000), wk = 0.0029412 k( 184) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029412 k( 185) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029412 k( 186) = ( 0.5000000 0.0178571 0.5000000), wk = 0.0029412 k( 187) = ( 0.5000000 0.0357143 0.5000000), wk = 0.0029412 k( 188) = ( 0.5000000 0.0535714 0.5000000), wk = 0.0029412 k( 189) = ( 0.5000000 0.0714286 0.5000000), wk = 0.0029412 k( 190) = ( 0.5000000 0.0892857 0.5000000), wk = 0.0029412 k( 191) = ( 0.5000000 0.1071429 0.5000000), wk = 0.0029412 k( 192) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0029412 k( 193) = ( 0.5000000 0.1428571 0.5000000), wk = 0.0029412 k( 194) = ( 0.5000000 0.1607143 0.5000000), wk = 0.0029412 k( 195) = ( 0.5000000 0.1785714 0.5000000), wk = 0.0029412 k( 196) = ( 0.5000000 0.1964286 0.5000000), wk = 0.0029412 k( 197) = ( 0.5000000 0.2142857 0.5000000), wk = 0.0029412 k( 198) = ( 0.5000000 0.2321429 0.5000000), wk = 0.0029412 k( 199) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0029412 k( 200) = ( 0.5000000 0.2678571 0.5000000), wk = 0.0029412 k( 201) = ( 0.5000000 0.2857143 0.5000000), wk = 0.0029412 k( 202) = ( 0.5000000 0.3035714 0.5000000), wk = 0.0029412 k( 203) = ( 0.5000000 0.3214286 0.5000000), wk = 0.0029412 k( 204) = ( 0.5000000 0.3392857 0.5000000), wk = 0.0029412 k( 205) = ( 0.5000000 0.3571429 0.5000000), wk = 0.0029412 k( 206) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0029412 k( 207) = ( 0.5000000 0.3928571 0.5000000), wk = 0.0029412 k( 208) = ( 0.5000000 0.4107143 0.5000000), wk = 0.0029412 k( 209) = ( 0.5000000 0.4285714 0.5000000), wk = 0.0029412 k( 210) = ( 0.5000000 0.4464286 0.5000000), wk = 0.0029412 k( 211) = ( 0.5000000 0.4642857 0.5000000), wk = 0.0029412 k( 212) = ( 0.5000000 0.4821429 0.5000000), wk = 0.0029412 k( 213) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029412 k( 214) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029412 k( 215) = ( 0.4852941 0.5000000 0.5000000), wk = 0.0029412 k( 216) = ( 0.4705882 0.5000000 0.5000000), wk = 0.0029412 k( 217) = ( 0.4558823 0.5000000 0.5000000), wk = 0.0029412 k( 218) = ( 0.4411765 0.5000000 0.5000000), wk = 0.0029412 k( 219) = ( 0.4264706 0.5000000 0.5000000), wk = 0.0029412 k( 220) = ( 0.4117647 0.5000000 0.5000000), wk = 0.0029412 k( 221) = ( 0.3970588 0.5000000 0.5000000), wk = 0.0029412 k( 222) = ( 0.3823529 0.5000000 0.5000000), wk = 0.0029412 k( 223) = ( 0.3676471 0.5000000 0.5000000), wk = 0.0029412 k( 224) = ( 0.3529412 0.5000000 0.5000000), wk = 0.0029412 k( 225) = ( 0.3382353 0.5000000 0.5000000), wk = 0.0029412 k( 226) = ( 0.3235294 0.5000000 0.5000000), wk = 0.0029412 k( 227) = ( 0.3088235 0.5000000 0.5000000), wk = 0.0029412 k( 228) = ( 0.2941177 0.5000000 0.5000000), wk = 0.0029412 k( 229) = ( 0.2794118 0.5000000 0.5000000), wk = 0.0029412 k( 230) = ( 0.2647059 0.5000000 0.5000000), wk = 0.0029412 k( 231) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0029412 k( 232) = ( 0.2352941 0.5000000 0.5000000), wk = 0.0029412 k( 233) = ( 0.2205882 0.5000000 0.5000000), wk = 0.0029412 k( 234) = ( 0.2058823 0.5000000 0.5000000), wk = 0.0029412 k( 235) = ( 0.1911765 0.5000000 0.5000000), wk = 0.0029412 k( 236) = ( 0.1764706 0.5000000 0.5000000), wk = 0.0029412 k( 237) = ( 0.1617647 0.5000000 0.5000000), wk = 0.0029412 k( 238) = ( 0.1470588 0.5000000 0.5000000), wk = 0.0029412 k( 239) = ( 0.1323529 0.5000000 0.5000000), wk = 0.0029412 k( 240) = ( 0.1176471 0.5000000 0.5000000), wk = 0.0029412 k( 241) = ( 0.1029412 0.5000000 0.5000000), wk = 0.0029412 k( 242) = ( 0.0882353 0.5000000 0.5000000), wk = 0.0029412 k( 243) = ( 0.0735294 0.5000000 0.5000000), wk = 0.0029412 k( 244) = ( 0.0588235 0.5000000 0.5000000), wk = 0.0029412 k( 245) = ( 0.0441177 0.5000000 0.5000000), wk = 0.0029412 k( 246) = ( 0.0294118 0.5000000 0.5000000), wk = 0.0029412 k( 247) = ( 0.0147059 0.5000000 0.5000000), wk = 0.0029412 k( 248) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029412 k( 249) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029412 k( 250) = ( 0.0000000 0.4821429 0.5000000), wk = 0.0029412 k( 251) = ( 0.0000000 0.4642857 0.5000000), wk = 0.0029412 k( 252) = ( 0.0000000 0.4464286 0.5000000), wk = 0.0029412 k( 253) = ( 0.0000000 0.4285714 0.5000000), wk = 0.0029412 k( 254) = ( 0.0000000 0.4107143 0.5000000), wk = 0.0029412 k( 255) = ( 0.0000000 0.3928571 0.5000000), wk = 0.0029412 k( 256) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0029412 k( 257) = ( 0.0000000 0.3571429 0.5000000), wk = 0.0029412 k( 258) = ( 0.0000000 0.3392857 0.5000000), wk = 0.0029412 k( 259) = ( 0.0000000 0.3214286 0.5000000), wk = 0.0029412 k( 260) = ( 0.0000000 0.3035714 0.5000000), wk = 0.0029412 k( 261) = ( 0.0000000 0.2857143 0.5000000), wk = 0.0029412 k( 262) = ( 0.0000000 0.2678571 0.5000000), wk = 0.0029412 k( 263) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0029412 k( 264) = ( 0.0000000 0.2321429 0.5000000), wk = 0.0029412 k( 265) = ( 0.0000000 0.2142857 0.5000000), wk = 0.0029412 k( 266) = ( 0.0000000 0.1964286 0.5000000), wk = 0.0029412 k( 267) = ( 0.0000000 0.1785714 0.5000000), wk = 0.0029412 k( 268) = ( 0.0000000 0.1607143 0.5000000), wk = 0.0029412 k( 269) = ( 0.0000000 0.1428571 0.5000000), wk = 0.0029412 k( 270) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0029412 k( 271) = ( 0.0000000 0.1071429 0.5000000), wk = 0.0029412 k( 272) = ( 0.0000000 0.0892857 0.5000000), wk = 0.0029412 k( 273) = ( 0.0000000 0.0714286 0.5000000), wk = 0.0029412 k( 274) = ( 0.0000000 0.0535714 0.5000000), wk = 0.0029412 k( 275) = ( 0.0000000 0.0357143 0.5000000), wk = 0.0029412 k( 276) = ( 0.0000000 0.0178571 0.5000000), wk = 0.0029412 k( 277) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0029412 k( 278) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0029412 k( 279) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0029412 k( 280) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0029412 k( 281) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0029412 k( 282) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0029412 k( 283) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0029412 k( 284) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0029412 k( 285) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0029412 k( 286) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0029412 k( 287) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0029412 k( 288) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0029412 k( 289) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0029412 k( 290) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0029412 k( 291) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0029412 k( 292) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0029412 k( 293) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0029412 k( 294) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0029412 k( 295) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0029412 k( 296) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0029412 k( 297) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0029412 k( 298) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0029412 k( 299) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0029412 k( 300) = ( 0.5000000 0.0000000 0.4750000), wk = 0.0029412 k( 301) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0029412 k( 302) = ( 0.5000000 0.0000000 0.4250000), wk = 0.0029412 k( 303) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0029412 k( 304) = ( 0.5000000 0.0000000 0.3750000), wk = 0.0029412 k( 305) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0029412 k( 306) = ( 0.5000000 0.0000000 0.3250000), wk = 0.0029412 k( 307) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0029412 k( 308) = ( 0.5000000 0.0000000 0.2750000), wk = 0.0029412 k( 309) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0029412 k( 310) = ( 0.5000000 0.0000000 0.2250000), wk = 0.0029412 k( 311) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0029412 k( 312) = ( 0.5000000 0.0000000 0.1750000), wk = 0.0029412 k( 313) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0029412 k( 314) = ( 0.5000000 0.0000000 0.1250000), wk = 0.0029412 k( 315) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0029412 k( 316) = ( 0.5000000 0.0000000 0.0750000), wk = 0.0029412 k( 317) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0029412 k( 318) = ( 0.5000000 0.0000000 0.0250000), wk = 0.0029412 k( 319) = ( 0.5000000 0.0000000 -0.0000000), wk = 0.0029412 k( 320) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0029412 k( 321) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0029412 k( 322) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0029412 k( 323) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0029412 k( 324) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0029412 k( 325) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0029412 k( 326) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0029412 k( 327) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0029412 k( 328) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0029412 k( 329) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0029412 k( 330) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0029412 k( 331) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0029412 k( 332) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0029412 k( 333) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0029412 k( 334) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0029412 k( 335) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0029412 k( 336) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0029412 k( 337) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0029412 k( 338) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0029412 k( 339) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0029412 k( 340) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0029412 Dense grid: 145845 G-vectors FFT dimensions: ( 54, 64, 90) Smooth grid: 109269 G-vectors FFT dimensions: ( 48, 60, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.75 Mb ( 790, 62) NL pseudopotentials 0.87 Mb ( 395, 144) Each V/rho on FFT grid 0.16 Mb ( 10368) Each G-vector array 0.03 Mb ( 4048) G-vector shells 0.02 Mb ( 1977) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 2.99 Mb ( 790, 248) Each subspace H/S matrix 0.06 Mb ( 62, 62) Each <psi_i|beta_j> matrix 0.27 Mb ( 144, 2, 62) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./NaB3H8.save/charge-density.dat Starting wfc are 100 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.8 secs Computing kpt #: 2 total cpu time spent up to now is 3.9 secs Computing kpt #: 3 total cpu time spent up to now is 4.9 secs Computing kpt #: 4 total cpu time spent up to now is 6.0 secs Computing kpt #: 5 total cpu time spent up to now is 7.1 secs Computing kpt #: 6 total cpu time spent up to now is 8.1 secs Computing kpt #: 7 total cpu time spent up to now is 9.2 secs Computing kpt #: 8 total cpu time spent up to now is 10.3 secs Computing kpt #: 9 total cpu time spent up to now is 11.4 secs Computing kpt #: 10 total cpu time spent up to now is 12.5 secs Computing kpt #: 11 total cpu time spent up to now is 13.6 secs Computing kpt #: 12 total cpu time spent up to now is 14.7 secs Computing kpt #: 13 total cpu time spent up to now is 15.8 secs Computing kpt #: 14 total cpu time spent up to now is 16.9 secs Computing kpt #: 15 total cpu time spent up to now is 18.1 secs Computing kpt #: 16 total cpu time spent up to now is 19.2 secs Computing kpt #: 17 total cpu time spent up to now is 20.3 secs Computing kpt #: 18 total cpu time spent up to now is 21.5 secs Computing kpt #: 19 total cpu time spent up to now is 22.6 secs Computing kpt #: 20 total cpu time spent up to now is 23.7 secs Computing kpt #: 21 total cpu time spent up to now is 24.9 secs Computing kpt #: 22 total cpu time spent up to now is 26.0 secs Computing kpt #: 23 total cpu time spent up to now is 27.1 secs Computing kpt #: 24 total cpu time spent up to now is 28.1 secs Computing kpt #: 25 total cpu time spent up to now is 29.3 secs Computing kpt #: 26 total cpu time spent up to now is 30.4 secs Computing kpt #: 27 total cpu time spent up to now is 31.5 secs Computing kpt #: 28 total cpu time spent up to now is 32.5 secs Computing kpt #: 29 total cpu time spent up to now is 33.6 secs Computing kpt #: 30 total cpu time spent up to now is 34.7 secs Computing kpt #: 31 total cpu time spent up to now is 35.8 secs Computing kpt #: 32 total cpu time spent up to now is 37.5 secs Computing kpt #: 33 total cpu time spent up to now is 38.6 secs Computing kpt #: 34 total cpu time spent up to now is 39.7 secs Computing kpt #: 35 total cpu time spent up to now is 41.0 secs Computing kpt #: 36 total cpu time spent up to now is 42.3 secs Computing kpt #: 37 total cpu time spent up to now is 43.5 secs Computing kpt #: 38 total cpu time spent up to now is 44.8 secs Computing kpt #: 39 total cpu time spent up to now is 46.1 secs Computing kpt #: 40 total cpu time spent up to now is 47.3 secs Computing kpt #: 41 total cpu time spent up to now is 48.6 secs Computing kpt #: 42 total cpu time spent up to now is 49.9 secs Computing kpt #: 43 total cpu time spent up to now is 51.1 secs Computing kpt #: 44 total cpu time spent up to now is 52.4 secs Computing kpt #: 45 total cpu time spent up to now is 53.7 secs Computing kpt #: 46 total cpu time spent up to now is 55.0 secs Computing kpt #: 47 total cpu time spent up to now is 56.1 secs Computing kpt #: 48 total cpu time spent up to now is 57.4 secs Computing kpt #: 49 total cpu time spent up to now is 58.7 secs Computing kpt #: 50 total cpu time spent up to now is 60.1 secs Computing kpt #: 51 total cpu time spent up to now is 61.3 secs Computing kpt #: 52 total cpu time spent up to now is 62.7 secs Computing kpt #: 53 total cpu time spent up to now is 64.0 secs Computing kpt #: 54 total cpu time spent up to now is 65.3 secs Computing kpt #: 55 total cpu time spent up to now is 66.7 secs Computing kpt #: 56 total cpu time spent up to now is 68.6 secs Computing kpt #: 57 total cpu time spent up to now is 70.1 secs Computing kpt #: 58 total cpu time spent up to now is 72.0 secs Computing kpt #: 59 total cpu time spent up to now is 73.4 secs Computing kpt #: 60 total cpu time spent up to now is 74.7 secs Computing kpt #: 61 total cpu time spent up to now is 76.1 secs Computing kpt #: 62 total cpu time spent up to now is 77.5 secs Computing kpt #: 63 total cpu time spent up to now is 78.8 secs Computing kpt #: 64 total cpu time spent up to now is 80.2 secs Computing kpt #: 65 total cpu time spent up to now is 81.6 secs Computing kpt #: 66 total cpu time spent up to now is 82.9 secs Computing kpt #: 67 total cpu time spent up to now is 84.3 secs Computing kpt #: 68 total cpu time spent up to now is 85.7 secs Computing kpt #: 69 total cpu time spent up to now is 87.0 secs Computing kpt #: 70 total cpu time spent up to now is 88.4 secs Computing kpt #: 71 total cpu time spent up to now is 89.8 secs Computing kpt #: 72 total cpu time spent up to now is 91.2 secs Computing kpt #: 73 total cpu time spent up to now is 92.5 secs Computing kpt #: 74 total cpu time spent up to now is 93.9 secs Computing kpt #: 75 total cpu time spent up to now is 95.2 secs Computing kpt #: 76 total cpu time spent up to now is 96.5 secs Computing kpt #: 77 total cpu time spent up to now is 97.9 secs Computing kpt #: 78 total cpu time spent up to now is 99.2 secs Computing kpt #: 79 total cpu time spent up to now is 100.5 secs Computing kpt #: 80 total cpu time spent up to now is 101.8 secs Computing kpt #: 81 total cpu time spent up to now is 103.1 secs Computing kpt #: 82 total cpu time spent up to now is 104.5 secs Computing kpt #: 83 total cpu time spent up to now is 105.7 secs Computing kpt #: 84 total cpu time spent up to now is 107.1 secs Computing kpt #: 85 total cpu time spent up to now is 108.4 secs Computing kpt #: 86 total cpu time spent up to now is 109.7 secs Computing kpt #: 87 total cpu time spent up to now is 110.8 secs Computing kpt #: 88 total cpu time spent up to now is 112.0 secs Computing kpt #: 89 total cpu time spent up to now is 113.1 secs Computing kpt #: 90 total cpu time spent up to now is 114.2 secs Computing kpt #: 91 total cpu time spent up to now is 115.4 secs Computing kpt #: 92 total cpu time spent up to now is 116.5 secs Computing kpt #: 93 total cpu time spent up to now is 117.7 secs Computing kpt #: 94 total cpu time spent up to now is 118.7 secs Computing kpt #: 95 total cpu time spent up to now is 119.8 secs Computing kpt #: 96 total cpu time spent up to now is 120.9 secs Computing kpt #: 97 total cpu time spent up to now is 121.9 secs Computing kpt #: 98 total cpu time spent up to now is 123.0 secs Computing kpt #: 99 total cpu time spent up to now is 124.1 secs Computing kpt #: 100 total cpu time spent up to now is 125.2 secs Computing kpt #: 101 total cpu time spent up to now is 126.3 secs Computing kpt #: 102 total cpu time spent up to now is 127.3 secs Computing kpt #: 103 total cpu time spent up to now is 128.4 secs Computing kpt #: 104 total cpu time spent up to now is 129.5 secs Computing kpt #: 105 total cpu time spent up to now is 130.6 secs Computing kpt #: 106 total cpu time spent up to now is 131.7 secs Computing kpt #: 107 total cpu time spent up to now is 132.8 secs Computing kpt #: 108 total cpu time spent up to now is 133.9 secs Computing kpt #: 109 total cpu time spent up to now is 135.1 secs Computing kpt #: 110 total cpu time spent up to now is 136.2 secs Computing kpt #: 111 total cpu time spent up to now is 137.4 secs Computing kpt #: 112 total cpu time spent up to now is 138.7 secs Computing kpt #: 113 total cpu time spent up to now is 140.0 secs Computing kpt #: 114 total cpu time spent up to now is 141.1 secs Computing kpt #: 115 total cpu time spent up to now is 142.4 secs Computing kpt #: 116 total cpu time spent up to now is 143.5 secs Computing kpt #: 117 total cpu time spent up to now is 144.7 secs Computing kpt #: 118 total cpu time spent up to now is 145.8 secs Computing kpt #: 119 total cpu time spent up to now is 146.9 secs Computing kpt #: 120 total cpu time spent up to now is 147.9 secs Computing kpt #: 121 total cpu time spent up to now is 148.9 secs Computing kpt #: 122 total cpu time spent up to now is 150.0 secs Computing kpt #: 123 total cpu time spent up to now is 151.1 secs Computing kpt #: 124 total cpu time spent up to now is 152.1 secs Computing kpt #: 125 total cpu time spent up to now is 153.2 secs Computing kpt #: 126 total cpu time spent up to now is 154.3 secs Computing kpt #: 127 total cpu time spent up to now is 155.3 secs Computing kpt #: 128 total cpu time spent up to now is 156.4 secs Computing kpt #: 129 total cpu time spent up to now is 157.4 secs Computing kpt #: 130 total cpu time spent up to now is 158.5 secs Computing kpt #: 131 total cpu time spent up to now is 159.5 secs Computing kpt #: 132 total cpu time spent up to now is 160.6 secs Computing kpt #: 133 total cpu time spent up to now is 161.7 secs Computing kpt #: 134 total cpu time spent up to now is 162.7 secs Computing kpt #: 135 total cpu time spent up to now is 163.8 secs Computing kpt #: 136 total cpu time spent up to now is 164.9 secs Computing kpt #: 137 total cpu time spent up to now is 165.9 secs Computing kpt #: 138 total cpu time spent up to now is 167.0 secs Computing kpt #: 139 total cpu time spent up to now is 168.1 secs Computing kpt #: 140 total cpu time spent up to now is 169.2 secs Computing kpt #: 141 total cpu time spent up to now is 170.3 secs Computing kpt #: 142 total cpu time spent up to now is 171.6 secs Computing kpt #: 143 total cpu time spent up to now is 172.7 secs Computing kpt #: 144 total cpu time spent up to now is 173.7 secs Computing kpt #: 145 total cpu time spent up to now is 174.9 secs Computing kpt #: 146 total cpu time spent up to now is 176.0 secs Computing kpt #: 147 total cpu time spent up to now is 177.2 secs Computing kpt #: 148 total cpu time spent up to now is 178.4 secs Computing kpt #: 149 total cpu time spent up to now is 179.5 secs Computing kpt #: 150 total cpu time spent up to now is 180.6 secs Computing kpt #: 151 total cpu time spent up to now is 181.7 secs Computing kpt #: 152 total cpu time spent up to now is 182.9 secs Computing kpt #: 153 total cpu time spent up to now is 184.0 secs Computing kpt #: 154 total cpu time spent up to now is 185.3 secs Computing kpt #: 155 total cpu time spent up to now is 186.6 secs Computing kpt #: 156 total cpu time spent up to now is 187.9 secs Computing kpt #: 157 total cpu time spent up to now is 189.0 secs Computing kpt #: 158 total cpu time spent up to now is 190.3 secs Computing kpt #: 159 total cpu time spent up to now is 191.6 secs Computing kpt #: 160 total cpu time spent up to now is 192.9 secs Computing kpt #: 161 total cpu time spent up to now is 194.2 secs Computing kpt #: 162 total cpu time spent up to now is 195.6 secs Computing kpt #: 163 total cpu time spent up to now is 196.9 secs Computing kpt #: 164 total cpu time spent up to now is 198.2 secs Computing kpt #: 165 total cpu time spent up to now is 199.6 secs Computing kpt #: 166 total cpu time spent up to now is 201.0 secs Computing kpt #: 167 total cpu time spent up to now is 202.3 secs Computing kpt #: 168 total cpu time spent up to now is 203.7 secs Computing kpt #: 169 total cpu time spent up to now is 205.0 secs Computing kpt #: 170 total cpu time spent up to now is 206.5 secs Computing kpt #: 171 total cpu time spent up to now is 207.8 secs Computing kpt #: 172 total cpu time spent up to now is 209.2 secs Computing kpt #: 173 total cpu time spent up to now is 210.6 secs Computing kpt #: 174 total cpu time spent up to now is 212.3 secs Computing kpt #: 175 total cpu time spent up to now is 213.7 secs Computing kpt #: 176 total cpu time spent up to now is 215.0 secs Computing kpt #: 177 total cpu time spent up to now is 216.4 secs Computing kpt #: 178 total cpu time spent up to now is 217.7 secs Computing kpt #: 179 total cpu time spent up to now is 219.0 secs Computing kpt #: 180 total cpu time spent up to now is 220.4 secs Computing kpt #: 181 total cpu time spent up to now is 221.6 secs Computing kpt #: 182 total cpu time spent up to now is 222.7 secs Computing kpt #: 183 total cpu time spent up to now is 223.8 secs Computing kpt #: 184 total cpu time spent up to now is 224.9 secs Computing kpt #: 185 total cpu time spent up to now is 225.9 secs Computing kpt #: 186 total cpu time spent up to now is 227.0 secs Computing kpt #: 187 total cpu time spent up to now is 228.0 secs Computing kpt #: 188 total cpu time spent up to now is 229.1 secs Computing kpt #: 189 total cpu time spent up to now is 230.2 secs Computing kpt #: 190 total cpu time spent up to now is 231.2 secs Computing kpt #: 191 total cpu time spent up to now is 232.3 secs Computing kpt #: 192 total cpu time spent up to now is 233.4 secs Computing kpt #: 193 total cpu time spent up to now is 234.4 secs Computing kpt #: 194 total cpu time spent up to now is 235.5 secs Computing kpt #: 195 total cpu time spent up to now is 236.6 secs Computing kpt #: 196 total cpu time spent up to now is 237.7 secs Computing kpt #: 197 total cpu time spent up to now is 238.8 secs Computing kpt #: 198 total cpu time spent up to now is 239.8 secs Computing kpt #: 199 total cpu time spent up to now is 241.1 secs Computing kpt #: 200 total cpu time spent up to now is 242.5 secs Computing kpt #: 201 total cpu time spent up to now is 243.8 secs Computing kpt #: 202 total cpu time spent up to now is 245.1 secs Computing kpt #: 203 total cpu time spent up to now is 247.4 secs Computing kpt #: 204 total cpu time spent up to now is 248.8 secs Computing kpt #: 205 total cpu time spent up to now is 250.1 secs Computing kpt #: 206 total cpu time spent up to now is 251.4 secs Computing kpt #: 207 total cpu time spent up to now is 252.8 secs Computing kpt #: 208 total cpu time spent up to now is 254.1 secs Computing kpt #: 209 total cpu time spent up to now is 255.4 secs Computing kpt #: 210 total cpu time spent up to now is 256.8 secs Computing kpt #: 211 total cpu time spent up to now is 258.2 secs Computing kpt #: 212 total cpu time spent up to now is 259.5 secs Computing kpt #: 213 total cpu time spent up to now is 260.8 secs Computing kpt #: 214 total cpu time spent up to now is 262.1 secs Computing kpt #: 215 total cpu time spent up to now is 263.4 secs Computing kpt #: 216 total cpu time spent up to now is 264.8 secs Computing kpt #: 217 total cpu time spent up to now is 266.1 secs Computing kpt #: 218 total cpu time spent up to now is 267.5 secs Computing kpt #: 219 total cpu time spent up to now is 268.9 secs Computing kpt #: 220 total cpu time spent up to now is 270.3 secs Computing kpt #: 221 total cpu time spent up to now is 271.6 secs Computing kpt #: 222 total cpu time spent up to now is 273.0 secs Computing kpt #: 223 total cpu time spent up to now is 274.4 secs Computing kpt #: 224 total cpu time spent up to now is 275.7 secs Computing kpt #: 225 total cpu time spent up to now is 277.1 secs Computing kpt #: 226 total cpu time spent up to now is 278.5 secs Computing kpt #: 227 total cpu time spent up to now is 279.9 secs Computing kpt #: 228 total cpu time spent up to now is 282.2 secs Computing kpt #: 229 total cpu time spent up to now is 283.6 secs Computing kpt #: 230 total cpu time spent up to now is 285.1 secs Computing kpt #: 231 total cpu time spent up to now is 286.5 secs Computing kpt #: 232 total cpu time spent up to now is 287.9 secs Computing kpt #: 233 total cpu time spent up to now is 289.2 secs Computing kpt #: 234 total cpu time spent up to now is 290.6 secs Computing kpt #: 235 total cpu time spent up to now is 292.0 secs Computing kpt #: 236 total cpu time spent up to now is 293.4 secs Computing kpt #: 237 total cpu time spent up to now is 294.7 secs Computing kpt #: 238 total cpu time spent up to now is 296.0 secs Computing kpt #: 239 total cpu time spent up to now is 297.4 secs Computing kpt #: 240 total cpu time spent up to now is 298.8 secs Computing kpt #: 241 total cpu time spent up to now is 300.1 secs Computing kpt #: 242 total cpu time spent up to now is 301.4 secs Computing kpt #: 243 total cpu time spent up to now is 302.8 secs Computing kpt #: 244 total cpu time spent up to now is 304.2 secs Computing kpt #: 245 total cpu time spent up to now is 305.5 secs Computing kpt #: 246 total cpu time spent up to now is 306.6 secs Computing kpt #: 247 total cpu time spent up to now is 307.7 secs Computing kpt #: 248 total cpu time spent up to now is 308.8 secs Computing kpt #: 249 total cpu time spent up to now is 309.9 secs Computing kpt #: 250 total cpu time spent up to now is 311.0 secs Computing kpt #: 251 total cpu time spent up to now is 312.1 secs Computing kpt #: 252 total cpu time spent up to now is 313.2 secs Computing kpt #: 253 total cpu time spent up to now is 314.3 secs Computing kpt #: 254 total cpu time spent up to now is 315.4 secs Computing kpt #: 255 total cpu time spent up to now is 317.6 secs Computing kpt #: 256 total cpu time spent up to now is 318.7 secs Computing kpt #: 257 total cpu time spent up to now is 319.8 secs Computing kpt #: 258 total cpu time spent up to now is 321.0 secs Computing kpt #: 259 total cpu time spent up to now is 322.0 secs Computing kpt #: 260 total cpu time spent up to now is 323.1 secs Computing kpt #: 261 total cpu time spent up to now is 324.2 secs Computing kpt #: 262 total cpu time spent up to now is 325.3 secs Computing kpt #: 263 total cpu time spent up to now is 326.4 secs Computing kpt #: 264 total cpu time spent up to now is 327.4 secs Computing kpt #: 265 total cpu time spent up to now is 328.5 secs Computing kpt #: 266 total cpu time spent up to now is 329.6 secs Computing kpt #: 267 total cpu time spent up to now is 330.7 secs Computing kpt #: 268 total cpu time spent up to now is 331.8 secs Computing kpt #: 269 total cpu time spent up to now is 332.9 secs Computing kpt #: 270 total cpu time spent up to now is 334.0 secs Computing kpt #: 271 total cpu time spent up to now is 335.0 secs Computing kpt #: 272 total cpu time spent up to now is 336.1 secs Computing kpt #: 273 total cpu time spent up to now is 337.2 secs Computing kpt #: 274 total cpu time spent up to now is 338.3 secs Computing kpt #: 275 total cpu time spent up to now is 339.4 secs Computing kpt #: 276 total cpu time spent up to now is 340.4 secs Computing kpt #: 277 total cpu time spent up to now is 341.6 secs Computing kpt #: 278 total cpu time spent up to now is 342.6 secs Computing kpt #: 279 total cpu time spent up to now is 343.7 secs Computing kpt #: 280 total cpu time spent up to now is 344.8 secs Computing kpt #: 281 total cpu time spent up to now is 345.9 secs Computing kpt #: 282 total cpu time spent up to now is 346.9 secs Computing kpt #: 283 total cpu time spent up to now is 348.0 secs Computing kpt #: 284 total cpu time spent up to now is 349.2 secs Computing kpt #: 285 total cpu time spent up to now is 350.3 secs Computing kpt #: 286 total cpu time spent up to now is 352.4 secs Computing kpt #: 287 total cpu time spent up to now is 353.5 secs Computing kpt #: 288 total cpu time spent up to now is 354.6 secs Computing kpt #: 289 total cpu time spent up to now is 355.8 secs Computing kpt #: 290 total cpu time spent up to now is 356.9 secs Computing kpt #: 291 total cpu time spent up to now is 358.0 secs Computing kpt #: 292 total cpu time spent up to now is 359.2 secs Computing kpt #: 293 total cpu time spent up to now is 360.3 secs Computing kpt #: 294 total cpu time spent up to now is 361.4 secs Computing kpt #: 295 total cpu time spent up to now is 362.6 secs Computing kpt #: 296 total cpu time spent up to now is 363.8 secs Computing kpt #: 297 total cpu time spent up to now is 365.1 secs Computing kpt #: 298 total cpu time spent up to now is 366.2 secs Computing kpt #: 299 total cpu time spent up to now is 367.4 secs Computing kpt #: 300 total cpu time spent up to now is 368.8 secs Computing kpt #: 301 total cpu time spent up to now is 370.1 secs Computing kpt #: 302 total cpu time spent up to now is 371.4 secs Computing kpt #: 303 total cpu time spent up to now is 372.8 secs Computing kpt #: 304 total cpu time spent up to now is 374.1 secs Computing kpt #: 305 total cpu time spent up to now is 375.4 secs Computing kpt #: 306 total cpu time spent up to now is 376.8 secs Computing kpt #: 307 total cpu time spent up to now is 378.1 secs Computing kpt #: 308 total cpu time spent up to now is 379.4 secs Computing kpt #: 309 total cpu time spent up to now is 380.8 secs Computing kpt #: 310 total cpu time spent up to now is 382.1 secs Computing kpt #: 311 total cpu time spent up to now is 383.4 secs Computing kpt #: 312 total cpu time spent up to now is 384.8 secs Computing kpt #: 313 total cpu time spent up to now is 386.1 secs Computing kpt #: 314 total cpu time spent up to now is 387.4 secs Computing kpt #: 315 total cpu time spent up to now is 388.8 secs Computing kpt #: 316 total cpu time spent up to now is 390.1 secs Computing kpt #: 317 total cpu time spent up to now is 391.5 secs Computing kpt #: 318 total cpu time spent up to now is 392.8 secs Computing kpt #: 319 total cpu time spent up to now is 394.0 secs Computing kpt #: 320 total cpu time spent up to now is 395.4 secs Computing kpt #: 321 total cpu time spent up to now is 396.8 secs Computing kpt #: 322 total cpu time spent up to now is 398.2 secs Computing kpt #: 323 total cpu time spent up to now is 399.6 secs Computing kpt #: 324 total cpu time spent up to now is 401.0 secs Computing kpt #: 325 total cpu time spent up to now is 402.4 secs Computing kpt #: 326 total cpu time spent up to now is 403.8 secs Computing kpt #: 327 total cpu time spent up to now is 405.2 secs Computing kpt #: 328 total cpu time spent up to now is 406.5 secs Computing kpt #: 329 total cpu time spent up to now is 407.9 secs Computing kpt #: 330 total cpu time spent up to now is 409.3 secs Computing kpt #: 331 total cpu time spent up to now is 410.7 secs Computing kpt #: 332 total cpu time spent up to now is 412.1 secs Computing kpt #: 333 total cpu time spent up to now is 413.5 secs Computing kpt #: 334 total cpu time spent up to now is 414.9 secs Computing kpt #: 335 total cpu time spent up to now is 416.9 secs Computing kpt #: 336 total cpu time spent up to now is 418.3 secs Computing kpt #: 337 total cpu time spent up to now is 419.6 secs Computing kpt #: 338 total cpu time spent up to now is 421.0 secs Computing kpt #: 339 total cpu time spent up to now is 422.4 secs Computing kpt #: 340 total cpu time spent up to now is 423.7 secs ethr = 1.92E-08, avg # of iterations = 20.2 total cpu time spent up to now is 423.7 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 13725 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7127 -11.7127 -11.4249 -11.4249 -8.4778 -8.4778 -7.9132 -7.9132 -6.3637 -6.3637 -6.2586 -6.2586 -5.3257 -5.3257 -4.9783 -4.9783 -3.7062 -3.7062 -3.3779 -3.3779 -3.1154 -3.1154 -3.0069 -3.0069 -2.9318 -2.9318 -2.9290 -2.9290 -2.6352 -2.6352 -2.0887 -2.0887 -1.3845 -1.3845 -0.9702 -0.9702 3.7252 3.7252 4.9998 4.9998 5.1512 5.1512 5.5013 5.5013 5.6036 5.6036 k = 0.0147-0.0000-0.0000 ( 13713 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7124 -11.7124 -11.4249 -11.4249 -8.4774 -8.4774 -7.9134 -7.9134 -6.3633 -6.3633 -6.2582 -6.2582 -5.3269 -5.3269 -4.9802 -4.9802 -3.7058 -3.7058 -3.3764 -3.3764 -3.1154 -3.1154 -3.0089 -3.0089 -2.9327 -2.9327 -2.9271 -2.9271 -2.6359 -2.6359 -2.0897 -2.0897 -1.3843 -1.3843 -0.9705 -0.9705 3.7280 3.7280 5.0023 5.0023 5.1519 5.1519 5.5025 5.5025 5.6027 5.6027 k = 0.0294-0.0000-0.0000 ( 13713 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7115 -11.7115 -11.4249 -11.4249 -8.4763 -8.4763 -7.9140 -7.9140 -6.3621 -6.3621 -6.2573 -6.2573 -5.3304 -5.3304 -4.9857 -4.9857 -3.7046 -3.7046 -3.3719 -3.3719 -3.1153 -3.1153 -3.0144 -3.0144 -2.9352 -2.9352 -2.9217 -2.9217 -2.6380 -2.6380 -2.0926 -2.0926 -1.3837 -1.3837 -0.9713 -0.9713 3.7363 3.7363 5.0099 5.0099 5.1542 5.1542 5.5061 5.5061 5.5998 5.5998 k = 0.0441-0.0000-0.0000 ( 13709 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2653 -23.2653 -11.7100 -11.7100 -11.4248 -11.4248 -8.4744 -8.4744 -7.9149 -7.9149 -6.3601 -6.3601 -6.2557 -6.2557 -5.3363 -5.3363 -4.9948 -4.9948 -3.7026 -3.7026 -3.3646 -3.3646 -3.1151 -3.1151 -3.0226 -3.0226 -2.9395 -2.9395 -2.9138 -2.9138 -2.6414 -2.6414 -2.0975 -2.0975 -1.3827 -1.3827 -0.9726 -0.9726 3.7502 3.7502 5.0224 5.0224 5.1580 5.1580 5.5121 5.5121 5.5951 5.5951 k = 0.0588-0.0000-0.0000 ( 13701 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2653 -23.2653 -11.7080 -11.7080 -11.4248 -11.4248 -8.4717 -8.4717 -7.9162 -7.9162 -6.3574 -6.3574 -6.2534 -6.2534 -5.3444 -5.3444 -5.0074 -5.0074 -3.6999 -3.6999 -3.3547 -3.3547 -3.1149 -3.1149 -3.0329 -3.0329 -2.9453 -2.9453 -2.9039 -2.9039 -2.6462 -2.6462 -2.1043 -2.1043 -1.3813 -1.3813 -0.9745 -0.9745 3.7695 3.7695 5.0397 5.0397 5.1633 5.1633 5.5205 5.5205 5.5885 5.5885 k = 0.0735-0.0000-0.0000 ( 13693 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2653 -23.2653 -11.7054 -11.7054 -11.4247 -11.4247 -8.4683 -8.4683 -7.9179 -7.9179 -6.3538 -6.3538 -6.2506 -6.2506 -5.3546 -5.3546 -5.0231 -5.0231 -3.6963 -3.6963 -3.3424 -3.3424 -3.1146 -3.1146 -3.0449 -3.0449 -2.9525 -2.9525 -2.8925 -2.8925 -2.6522 -2.6522 -2.1129 -2.1129 -1.3796 -1.3796 -0.9769 -0.9769 3.7941 3.7941 5.0616 5.0616 5.1701 5.1701 5.5311 5.5311 5.5801 5.5801 k = 0.0882-0.0000-0.0000 ( 13669 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2723 -23.2723 -23.2716 -23.2716 -23.2664 -23.2664 -23.2653 -23.2653 -11.7022 -11.7022 -11.4246 -11.4246 -8.4642 -8.4642 -7.9199 -7.9199 -6.3495 -6.3495 -6.2471 -6.2471 -5.3668 -5.3668 -5.0418 -5.0418 -3.6920 -3.6920 -3.3281 -3.3281 -3.1143 -3.1143 -3.0584 -3.0584 -2.9609 -2.9609 -2.8799 -2.8799 -2.6594 -2.6594 -2.1233 -2.1233 -1.3775 -1.3775 -0.9799 -0.9799 3.8241 3.8241 5.0878 5.0878 5.1783 5.1783 5.5439 5.5439 5.5699 5.5699 k = 0.1029-0.0000-0.0000 ( 13661 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2723 -23.2723 -23.2716 -23.2716 -23.2664 -23.2664 -23.2653 -23.2653 -11.6985 -11.6985 -11.4245 -11.4245 -8.4594 -8.4594 -7.9224 -7.9224 -6.3445 -6.3445 -6.2431 -6.2431 -5.3808 -5.3808 -5.0631 -5.0631 -3.6869 -3.6869 -3.3123 -3.3123 -3.1140 -3.1140 -3.0731 -3.0731 -2.9702 -2.9702 -2.8663 -2.8663 -2.6678 -2.6678 -2.1355 -2.1355 -1.3750 -1.3750 -0.9833 -0.9833 3.8592 3.8592 5.1181 5.1181 5.1880 5.1880 5.5581 5.5581 5.5588 5.5588 k = 0.1176-0.0000-0.0000 ( 13673 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2723 -23.2723 -23.2716 -23.2716 -23.2664 -23.2664 -23.2654 -23.2654 -11.6943 -11.6943 -11.4245 -11.4245 -8.4538 -8.4538 -7.9252 -7.9252 -6.3388 -6.3388 -6.2386 -6.2386 -5.3963 -5.3963 -5.0867 -5.0867 -3.6811 -3.6811 -3.2955 -3.2955 -3.1136 -3.1136 -3.0890 -3.0890 -2.9801 -2.9801 -2.8518 -2.8518 -2.6772 -2.6772 -2.1493 -2.1493 -1.3721 -1.3721 -0.9873 -0.9873 3.8993 3.8993 5.1520 5.1520 5.1992 5.1992 5.5447 5.5447 5.5756 5.5756 k = 0.1324-0.0000-0.0000 ( 13663 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4475 -23.4475 -23.2723 -23.2723 -23.2716 -23.2716 -23.2664 -23.2664 -23.2654 -23.2654 -11.6896 -11.6896 -11.4245 -11.4245 -8.4476 -8.4476 -7.9284 -7.9284 -6.3325 -6.3325 -6.2336 -6.2336 -5.4133 -5.4133 -5.1123 -5.1123 -3.6745 -3.6745 -3.2784 -3.2784 -3.1132 -3.1132 -3.1061 -3.1061 -2.9900 -2.9900 -2.8366 -2.8366 -2.6875 -2.6875 -2.1646 -2.1646 -1.3689 -1.3689 -0.9918 -0.9918 3.9443 3.9443 5.1888 5.1888 5.2117 5.2117 5.5298 5.5298 5.5943 5.5943 k = 0.1471-0.0000-0.0000 ( 13663 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2723 -23.2723 -23.2716 -23.2716 -23.2664 -23.2664 -23.2654 -23.2654 -11.6844 -11.6844 -11.4245 -11.4245 -8.4407 -8.4407 -7.9321 -7.9321 -6.3255 -6.3255 -6.2282 -6.2282 -5.4314 -5.4314 -5.1397 -5.1397 -3.6672 -3.6672 -3.2620 -3.2620 -3.1242 -3.1242 -3.1129 -3.1129 -2.9991 -2.9991 -2.8209 -2.8209 -2.6986 -2.6986 -2.1815 -2.1815 -1.3654 -1.3654 -0.9968 -0.9968 3.9939 3.9939 5.2256 5.2256 5.2279 5.2279 5.5136 5.5136 5.6147 5.6147 k = 0.1618-0.0000-0.0000 ( 13667 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2723 -23.2723 -23.2717 -23.2717 -23.2664 -23.2664 -23.2655 -23.2655 -11.6787 -11.6787 -11.4247 -11.4247 -8.4331 -8.4331 -7.9361 -7.9361 -6.3180 -6.3180 -6.2223 -6.2223 -5.4504 -5.4504 -5.1684 -5.1684 -3.6591 -3.6591 -3.2473 -3.2473 -3.1432 -3.1432 -3.1126 -3.1126 -3.0065 -3.0065 -2.8047 -2.8047 -2.7104 -2.7104 -2.1997 -2.1997 -1.3615 -1.3615 -1.0022 -1.0022 4.0480 4.0480 5.2410 5.2410 5.2684 5.2684 5.4963 5.4963 5.6366 5.6366 k = 0.1765-0.0000-0.0000 ( 13663 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2723 -23.2723 -23.2716 -23.2716 -23.2665 -23.2665 -23.2655 -23.2655 -11.6725 -11.6725 -11.4249 -11.4249 -8.4249 -8.4249 -7.9406 -7.9406 -6.3099 -6.3099 -6.2162 -6.2162 -5.4701 -5.4701 -5.1982 -5.1982 -3.6503 -3.6503 -3.2359 -3.2359 -3.1629 -3.1629 -3.1125 -3.1125 -3.0107 -3.0107 -2.7882 -2.7882 -2.7227 -2.7227 -2.2192 -2.2192 -1.3573 -1.3573 -1.0082 -1.0082 4.1063 4.1063 5.2576 5.2576 5.3092 5.3092 5.4781 5.4781 5.6598 5.6598 k = 0.1912-0.0000-0.0000 ( 13655 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2723 -23.2723 -23.2717 -23.2717 -23.2664 -23.2664 -23.2655 -23.2655 -11.6660 -11.6660 -11.4252 -11.4252 -8.4161 -8.4161 -7.9456 -7.9456 -6.3013 -6.3013 -6.2097 -6.2097 -5.4904 -5.4904 -5.2289 -5.2289 -3.6409 -3.6409 -3.2290 -3.2290 -3.1834 -3.1834 -3.1125 -3.1125 -3.0106 -3.0106 -2.7717 -2.7717 -2.7354 -2.7354 -2.2399 -2.2399 -1.3528 -1.3528 -1.0146 -1.0146 4.1685 4.1685 5.2755 5.2755 5.3490 5.3490 5.4592 5.4592 5.6841 5.6841 k = 0.2059-0.0000-0.0000 ( 13665 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2722 -23.2722 -23.2717 -23.2717 -23.2665 -23.2665 -23.2656 -23.2656 -11.6591 -11.6591 -11.4257 -11.4257 -8.4067 -8.4067 -7.9509 -7.9509 -6.2924 -6.2924 -6.2030 -6.2030 -5.5108 -5.5108 -5.2600 -5.2600 -3.6307 -3.6307 -3.2276 -3.2276 -3.2044 -3.2044 -3.1128 -3.1128 -3.0051 -3.0051 -2.7551 -2.7551 -2.7482 -2.7482 -2.2615 -2.2615 -1.3481 -1.3481 -1.0214 -1.0214 4.2344 4.2344 5.2947 5.2947 5.3862 5.3862 5.4398 5.4398 5.7092 5.7092 k = 0.2206-0.0000-0.0000 ( 13665 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2722 -23.2722 -23.2717 -23.2717 -23.2665 -23.2665 -23.2657 -23.2657 -11.6518 -11.6518 -11.4264 -11.4264 -8.3968 -8.3968 -7.9567 -7.9567 -6.2830 -6.2830 -6.1962 -6.1962 -5.5313 -5.5313 -5.2914 -5.2914 -3.6199 -3.6199 -3.2320 -3.2320 -3.2257 -3.2257 -3.1134 -3.1134 -2.9942 -2.9942 -2.7609 -2.7609 -2.7388 -2.7388 -2.2841 -2.2841 -1.3430 -1.3430 -1.0287 -1.0287 4.3037 4.3037 5.3151 5.3151 5.4191 5.4191 5.4202 5.4202 5.7349 5.7349 k = 0.2353-0.0000-0.0000 ( 13653 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4476 -23.4476 -23.2722 -23.2722 -23.2717 -23.2717 -23.2665 -23.2665 -23.2657 -23.2657 -11.6442 -11.6442 -11.4272 -11.4272 -8.3863 -8.3863 -7.9630 -7.9630 -6.2734 -6.2734 -6.1893 -6.1893 -5.5516 -5.5516 -5.3229 -5.3229 -3.6084 -3.6084 -3.2472 -3.2472 -3.2412 -3.2412 -3.1145 -3.1145 -2.9787 -2.9787 -2.7734 -2.7734 -2.7228 -2.7228 -2.3075 -2.3075 -1.3377 -1.3377 -1.0363 -1.0363 4.3760 4.3760 5.3366 5.3366 5.4007 5.4007 5.4462 5.4462 5.7609 5.7609 k = 0.2500-0.0000-0.0000 ( 13645 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4476 -23.4476 -23.2722 -23.2722 -23.2717 -23.2717 -23.2665 -23.2665 -23.2657 -23.2657 -11.6364 -11.6364 -11.4283 -11.4283 -8.3753 -8.3753 -7.9697 -7.9697 -6.2635 -6.2635 -6.1824 -6.1824 -5.5715 -5.5715 -5.3542 -5.3542 -3.5963 -3.5963 -3.2688 -3.2688 -3.2542 -3.2542 -3.1163 -3.1163 -2.9597 -2.9597 -2.7852 -2.7852 -2.7074 -2.7074 -2.3315 -2.3315 -1.3321 -1.3321 -1.0443 -1.0443 4.4510 4.4510 5.3593 5.3593 5.3815 5.3815 5.4661 5.4661 5.7868 5.7868 k = 0.2647-0.0000-0.0000 ( 13651 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4477 -23.4477 -23.2721 -23.2721 -23.2717 -23.2717 -23.2666 -23.2666 -23.2658 -23.2658 -11.6282 -11.6282 -11.4296 -11.4296 -8.3639 -8.3639 -7.9769 -7.9769 -6.2535 -6.2535 -6.1756 -6.1756 -5.5907 -5.5907 -5.3850 -5.3850 -3.5836 -3.5836 -3.2903 -3.2903 -3.2698 -3.2698 -3.1188 -3.1188 -2.9384 -2.9384 -2.7963 -2.7963 -2.6925 -2.6925 -2.3561 -2.3561 -1.3263 -1.3263 -1.0527 -1.0527 4.5282 4.5282 5.3629 5.3629 5.3830 5.3830 5.4781 5.4781 5.8123 5.8123 k = 0.2794-0.0000-0.0000 ( 13651 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4477 -23.4477 -23.2721 -23.2721 -23.2717 -23.2717 -23.2666 -23.2666 -23.2658 -23.2658 -11.6199 -11.6199 -11.4311 -11.4311 -8.3521 -8.3521 -7.9845 -7.9845 -6.2434 -6.2434 -6.1689 -6.1689 -5.6092 -5.6092 -5.4153 -5.4153 -3.5703 -3.5703 -3.3114 -3.3114 -3.2871 -3.2871 -3.1223 -3.1223 -2.9156 -2.9156 -2.8062 -2.8062 -2.6785 -2.6785 -2.3811 -2.3811 -1.3203 -1.3203 -1.0613 -1.0613 4.6072 4.6072 5.3453 5.3453 5.4078 5.4078 5.4824 5.4824 5.8369 5.8369 k = 0.2941-0.0000-0.0000 ( 13649 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4477 -23.4477 -23.2721 -23.2721 -23.2717 -23.2717 -23.2666 -23.2666 -23.2659 -23.2659 -11.6114 -11.6114 -11.4330 -11.4330 -8.3399 -8.3399 -7.9926 -7.9926 -6.2333 -6.2333 -6.1625 -6.1625 -5.6267 -5.6267 -5.4448 -5.4448 -3.5564 -3.5564 -3.3321 -3.3321 -3.3055 -3.3055 -3.1269 -3.1269 -2.8920 -2.8920 -2.8146 -2.8146 -2.6654 -2.6654 -2.4064 -2.4064 -1.3140 -1.3140 -1.0703 -1.0703 4.6875 4.6875 5.3289 5.3289 5.4335 5.4335 5.4795 5.4795 5.8601 5.8601 k = 0.3088-0.0000-0.0000 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4477 -23.4477 -23.2721 -23.2721 -23.2717 -23.2717 -23.2666 -23.2666 -23.2659 -23.2659 -11.6027 -11.6027 -11.4351 -11.4351 -8.3273 -8.3273 -8.0012 -8.0012 -6.2233 -6.2233 -6.1564 -6.1564 -5.6431 -5.6431 -5.4733 -5.4733 -3.5420 -3.5420 -3.3521 -3.3521 -3.3244 -3.3244 -3.1329 -3.1329 -2.8680 -2.8680 -2.8214 -2.8214 -2.6533 -2.6533 -2.4319 -2.4319 -1.3075 -1.3075 -1.0794 -1.0794 4.7685 4.7685 5.3143 5.3143 5.4602 5.4602 5.4706 5.4706 5.8815 5.8815 k = 0.3235-0.0000-0.0000 ( 13650 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4478 -23.4478 -23.2721 -23.2721 -23.2717 -23.2717 -23.2666 -23.2666 -23.2660 -23.2660 -11.5940 -11.5940 -11.4375 -11.4375 -8.3144 -8.3144 -8.0102 -8.0102 -6.2134 -6.2134 -6.1507 -6.1507 -5.6582 -5.6582 -5.5008 -5.5008 -3.5270 -3.5270 -3.3713 -3.3713 -3.3433 -3.3433 -3.1402 -3.1402 -2.8441 -2.8441 -2.8263 -2.8263 -2.6424 -2.6424 -2.4575 -2.4575 -1.3008 -1.3008 -1.0888 -1.0888 4.8494 4.8494 5.3021 5.3021 5.4569 5.4569 5.4876 5.4876 5.9005 5.9005 k = 0.3382-0.0000-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4478 -23.4478 -23.2721 -23.2721 -23.2717 -23.2717 -23.2667 -23.2667 -23.2661 -23.2661 -11.5852 -11.5852 -11.4403 -11.4403 -8.3012 -8.3012 -8.0196 -8.0196 -6.2038 -6.2038 -6.1455 -6.1455 -5.6718 -5.6718 -5.5270 -5.5270 -3.5115 -3.5115 -3.3895 -3.3895 -3.3619 -3.3619 -3.1491 -3.1491 -2.8292 -2.8292 -2.8206 -2.8206 -2.6328 -2.6328 -2.4830 -2.4830 -1.2939 -1.2939 -1.0984 -1.0984 4.9290 4.9290 5.2931 5.2931 5.4397 5.4397 5.5158 5.5158 5.9167 5.9167 k = 0.3529-0.0000-0.0000 ( 13638 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4478 -23.4478 -23.2720 -23.2720 -23.2717 -23.2717 -23.2666 -23.2666 -23.2661 -23.2661 -11.5764 -11.5764 -11.4434 -11.4434 -8.2878 -8.2878 -8.0296 -8.0296 -6.1944 -6.1944 -6.1408 -6.1408 -5.6840 -5.6840 -5.5519 -5.5519 -3.4956 -3.4956 -3.4065 -3.4065 -3.3799 -3.3799 -3.1595 -3.1595 -2.8298 -2.8298 -2.7976 -2.7976 -2.6246 -2.6246 -2.5083 -2.5083 -1.2868 -1.2868 -1.1081 -1.1081 5.0053 5.0053 5.2891 5.2891 5.4201 5.4201 5.5446 5.5446 5.9294 5.9294 k = 0.3676-0.0000-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4479 -23.4479 -23.2720 -23.2720 -23.2717 -23.2717 -23.2667 -23.2667 -23.2662 -23.2662 -11.5675 -11.5675 -11.4468 -11.4468 -8.2742 -8.2742 -8.0399 -8.0399 -6.1855 -6.1855 -6.1367 -6.1367 -5.6945 -5.6945 -5.5753 -5.5753 -3.4793 -3.4793 -3.4223 -3.4223 -3.3971 -3.3971 -3.1713 -3.1713 -2.8283 -2.8283 -2.7753 -2.7753 -2.6177 -2.6177 -2.5334 -2.5334 -1.2795 -1.2795 -1.1178 -1.1178 5.0746 5.0746 5.2937 5.2937 5.3989 5.3989 5.5740 5.5740 5.9382 5.9382 k = 0.3824-0.0000-0.0000 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4479 -23.4479 -23.2720 -23.2720 -23.2717 -23.2717 -23.2667 -23.2667 -23.2662 -23.2662 -11.5588 -11.5588 -11.4506 -11.4506 -8.2604 -8.2604 -8.0507 -8.0507 -6.1770 -6.1770 -6.1333 -6.1333 -5.7034 -5.7034 -5.5972 -5.5972 -3.4625 -3.4625 -3.4366 -3.4366 -3.4133 -3.4133 -3.1844 -3.1844 -2.8246 -2.8246 -2.7540 -2.7540 -2.6125 -2.6125 -2.5580 -2.5580 -1.2720 -1.2720 -1.1277 -1.1277 5.1297 5.1297 5.3137 5.3137 5.3771 5.3771 5.6038 5.6038 5.9429 5.9429 k = 0.3971-0.0000-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4479 -23.4479 -23.2720 -23.2720 -23.2717 -23.2717 -23.2667 -23.2667 -23.2663 -23.2663 -11.5501 -11.5501 -11.4549 -11.4549 -8.2465 -8.2465 -8.0618 -8.0618 -6.1691 -6.1691 -6.1306 -6.1306 -5.7105 -5.7105 -5.6174 -5.6174 -3.4494 -3.4494 -3.4454 -3.4454 -3.4283 -3.4283 -3.1987 -3.1987 -2.8189 -2.8189 -2.7338 -2.7338 -2.6088 -2.6088 -2.5822 -2.5822 -1.2643 -1.2643 -1.1376 -1.1376 5.1642 5.1642 5.3550 5.3550 5.3553 5.3553 5.6339 5.6339 5.9431 5.9431 k = 0.4118-0.0000-0.0000 ( 13662 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2720 -23.2720 -23.2718 -23.2718 -23.2667 -23.2667 -23.2664 -23.2664 -11.5416 -11.5416 -11.4594 -11.4594 -8.2326 -8.2326 -8.0734 -8.0734 -6.1617 -6.1617 -6.1285 -6.1285 -5.7158 -5.7158 -5.6359 -5.6359 -3.4604 -3.4604 -3.4418 -3.4418 -3.4280 -3.4280 -3.2141 -3.2141 -2.8112 -2.8112 -2.7148 -2.7148 -2.6067 -2.6067 -2.6058 -2.6058 -1.2564 -1.2564 -1.1474 -1.1474 5.1819 5.1819 5.3338 5.3338 5.4142 5.4142 5.6641 5.6641 5.9389 5.9389 k = 0.4265-0.0000-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2719 -23.2719 -23.2718 -23.2718 -23.2667 -23.2667 -23.2664 -23.2664 -11.5332 -11.5332 -11.4644 -11.4644 -8.2186 -8.2186 -8.0853 -8.0853 -6.1550 -6.1550 -6.1272 -6.1272 -5.7193 -5.7193 -5.6527 -5.6527 -3.4697 -3.4697 -3.4538 -3.4538 -3.4102 -3.4102 -3.2303 -3.2303 -2.8016 -2.8016 -2.6970 -2.6970 -2.6288 -2.6288 -2.6064 -2.6064 -1.2483 -1.2483 -1.1572 -1.1572 5.1914 5.1914 5.3132 5.3132 5.4818 5.4818 5.6943 5.6943 5.9304 5.9304 k = 0.4412-0.0000-0.0000 ( 13650 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2719 -23.2719 -23.2718 -23.2718 -23.2666 -23.2666 -23.2664 -23.2664 -11.5250 -11.5250 -11.4698 -11.4698 -8.2046 -8.2046 -8.0976 -8.0976 -6.1489 -6.1489 -6.1266 -6.1266 -5.7210 -5.7210 -5.6677 -5.6677 -3.4770 -3.4770 -3.4641 -3.4641 -3.3922 -3.3922 -3.2472 -3.2472 -2.7904 -2.7904 -2.6807 -2.6807 -2.6510 -2.6510 -2.6078 -2.6078 -1.2399 -1.2399 -1.1670 -1.1670 5.1982 5.1982 5.2938 5.2938 5.5521 5.5521 5.7242 5.7242 5.9179 5.9179 k = 0.4559-0.0000-0.0000 ( 13650 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2719 -23.2719 -23.2718 -23.2718 -23.2666 -23.2666 -23.2665 -23.2665 -11.5171 -11.5171 -11.4755 -11.4755 -8.1907 -8.1907 -8.1102 -8.1102 -6.1435 -6.1435 -6.1268 -6.1268 -5.7208 -5.7208 -5.6808 -5.6808 -3.4825 -3.4825 -3.4727 -3.4727 -3.3741 -3.3741 -3.2647 -3.2647 -2.7775 -2.7775 -2.6723 -2.6723 -2.6658 -2.6658 -2.6109 -2.6109 -1.2314 -1.2314 -1.1766 -1.1766 5.2048 5.2048 5.2758 5.2758 5.6225 5.6225 5.7536 5.7536 5.9018 5.9018 k = 0.4706-0.0000-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2666 -23.2666 -23.2665 -23.2665 -11.5094 -11.5094 -11.4816 -11.4816 -8.1768 -8.1768 -8.1231 -8.1231 -6.1389 -6.1389 -6.1277 -6.1277 -5.7188 -5.7188 -5.6921 -5.6921 -3.4859 -3.4859 -3.4793 -3.4793 -3.3557 -3.3557 -3.2825 -3.2825 -2.7631 -2.7631 -2.6927 -2.6927 -2.6525 -2.6525 -2.6157 -2.6157 -1.2227 -1.2227 -1.1862 -1.1862 5.2124 5.2124 5.2595 5.2595 5.6915 5.6915 5.7823 5.7823 5.8824 5.8824 k = 0.4853-0.0000-0.0000 ( 13670 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2666 -23.2666 -23.2666 -23.2666 -11.5019 -11.5019 -11.4880 -11.4880 -8.1631 -8.1631 -8.1362 -8.1362 -6.1350 -6.1350 -6.1294 -6.1294 -5.7149 -5.7149 -5.7016 -5.7016 -3.4873 -3.4873 -3.4840 -3.4840 -3.3373 -3.3373 -3.3007 -3.3007 -2.7474 -2.7474 -2.7121 -2.7121 -2.6407 -2.6407 -2.6224 -2.6224 -1.2139 -1.2139 -1.1955 -1.1955 5.2215 5.2215 5.2450 5.2450 5.7582 5.7582 5.8099 5.8099 5.8604 5.8604 k = 0.5000-0.0000-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1496 -8.1496 -8.1496 -8.1496 -6.1318 -6.1318 -6.1318 -6.1318 -5.7091 -5.7091 -5.7091 -5.7091 -3.4867 -3.4867 -3.4867 -3.4867 -3.3190 -3.3190 -3.3190 -3.3190 -2.7303 -2.7303 -2.7303 -2.7303 -2.6307 -2.6307 -2.6307 -2.6307 -1.2048 -1.2048 -1.2048 -1.2048 5.2323 5.2323 5.2323 5.2323 5.8223 5.8223 5.8223 5.8223 5.8360 5.8360 k = 0.5000-0.0000-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1496 -8.1496 -8.1496 -8.1496 -6.1318 -6.1318 -6.1318 -6.1318 -5.7091 -5.7091 -5.7091 -5.7091 -3.4867 -3.4867 -3.4867 -3.4867 -3.3190 -3.3190 -3.3190 -3.3190 -2.7303 -2.7303 -2.7303 -2.7303 -2.6307 -2.6307 -2.6307 -2.6307 -1.2048 -1.2048 -1.2048 -1.2048 5.2323 5.2323 5.2323 5.2323 5.8223 5.8223 5.8223 5.8223 5.8360 5.8360 k = 0.5000 0.0146-0.0000 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1495 -8.1495 -8.1495 -8.1495 -6.1325 -6.1325 -6.1325 -6.1325 -5.7088 -5.7088 -5.7088 -5.7088 -3.4867 -3.4867 -3.4867 -3.4867 -3.3201 -3.3201 -3.3201 -3.3201 -2.7293 -2.7293 -2.7293 -2.7293 -2.6301 -2.6301 -2.6301 -2.6301 -1.2047 -1.2047 -1.2047 -1.2047 5.2343 5.2343 5.2343 5.2343 5.8225 5.8225 5.8225 5.8225 5.8378 5.8378 k = 0.5000 0.0292-0.0000 ( 13694 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4946 -11.4946 -11.4946 -11.4946 -8.1493 -8.1493 -8.1493 -8.1493 -6.1347 -6.1347 -6.1347 -6.1347 -5.7079 -5.7079 -5.7079 -5.7079 -3.4869 -3.4869 -3.4869 -3.4869 -3.3234 -3.3234 -3.3234 -3.3234 -2.7263 -2.7263 -2.7263 -2.7263 -2.6284 -2.6284 -2.6284 -2.6284 -1.2044 -1.2044 -1.2044 -1.2044 5.2401 5.2401 5.2401 5.2401 5.8231 5.8231 5.8231 5.8231 5.8430 5.8430 k = 0.5000 0.0438-0.0000 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4944 -11.4944 -11.4944 -11.4944 -8.1490 -8.1490 -8.1490 -8.1490 -6.1382 -6.1382 -6.1382 -6.1382 -5.7063 -5.7063 -5.7063 -5.7063 -3.4872 -3.4872 -3.4872 -3.4872 -3.3288 -3.3288 -3.3288 -3.3288 -2.7215 -2.7215 -2.7215 -2.7215 -2.6255 -2.6255 -2.6255 -2.6255 -1.2040 -1.2040 -1.2040 -1.2040 5.2498 5.2498 5.2498 5.2498 5.8242 5.8242 5.8242 5.8242 5.8517 5.8517 k = 0.5000 0.0585-0.0000 ( 13696 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4940 -11.4940 -11.4940 -11.4940 -8.1486 -8.1486 -8.1486 -8.1486 -6.1430 -6.1430 -6.1430 -6.1430 -5.7041 -5.7041 -5.7041 -5.7041 -3.4877 -3.4877 -3.4877 -3.4877 -3.3362 -3.3362 -3.3362 -3.3362 -2.7149 -2.7149 -2.7149 -2.7149 -2.6214 -2.6214 -2.6214 -2.6214 -1.2033 -1.2033 -1.2033 -1.2033 5.2633 5.2633 5.2633 5.2633 5.8257 5.8257 5.8257 5.8257 5.8639 5.8639 k = 0.5000 0.0731-0.0000 ( 13688 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4936 -11.4936 -11.4936 -11.4936 -8.1481 -8.1481 -8.1481 -8.1481 -6.1491 -6.1491 -6.1491 -6.1491 -5.7014 -5.7014 -5.7014 -5.7014 -3.4884 -3.4884 -3.4884 -3.4884 -3.3453 -3.3453 -3.3453 -3.3453 -2.7068 -2.7068 -2.7068 -2.7068 -2.6162 -2.6162 -2.6162 -2.6162 -1.2025 -1.2025 -1.2025 -1.2025 5.2803 5.2803 5.2803 5.2803 5.8279 5.8279 5.8279 5.8279 5.8793 5.8793 k = 0.5000 0.0877-0.0000 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4930 -11.4930 -11.4930 -11.4930 -8.1475 -8.1475 -8.1475 -8.1475 -6.1563 -6.1563 -6.1563 -6.1563 -5.6981 -5.6981 -5.6981 -5.6981 -3.4895 -3.4895 -3.4895 -3.4895 -3.3558 -3.3558 -3.3558 -3.3558 -2.6974 -2.6974 -2.6974 -2.6974 -2.6097 -2.6097 -2.6097 -2.6097 -1.2016 -1.2016 -1.2016 -1.2016 5.3008 5.3008 5.3008 5.3008 5.8307 5.8307 5.8307 5.8307 5.8978 5.8978 k = 0.5000 0.1023-0.0000 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4924 -11.4924 -11.4924 -11.4924 -8.1468 -8.1468 -8.1468 -8.1468 -6.1646 -6.1646 -6.1646 -6.1646 -5.6943 -5.6943 -5.6943 -5.6943 -3.4911 -3.4911 -3.4911 -3.4911 -3.3676 -3.3676 -3.3676 -3.3676 -2.6870 -2.6870 -2.6870 -2.6870 -2.6019 -2.6019 -2.6019 -2.6019 -1.2006 -1.2006 -1.2006 -1.2006 5.3245 5.3245 5.3245 5.3245 5.8343 5.8343 5.8343 5.8343 5.9194 5.9194 k = 0.5000 0.1169-0.0000 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4917 -11.4917 -11.4917 -11.4917 -8.1460 -8.1460 -8.1460 -8.1460 -6.1737 -6.1737 -6.1737 -6.1737 -5.6901 -5.6901 -5.6901 -5.6901 -3.4931 -3.4931 -3.4931 -3.4931 -3.3804 -3.3804 -3.3804 -3.3804 -2.6757 -2.6757 -2.6757 -2.6757 -2.5930 -2.5930 -2.5930 -2.5930 -1.1995 -1.1995 -1.1995 -1.1995 5.3511 5.3511 5.3511 5.3511 5.8389 5.8389 5.8389 5.8389 5.9439 5.9439 k = 0.5000 0.1315-0.0000 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4910 -11.4910 -11.4910 -11.4910 -8.1452 -8.1452 -8.1452 -8.1452 -6.1836 -6.1836 -6.1836 -6.1836 -5.6855 -5.6855 -5.6855 -5.6855 -3.4956 -3.4956 -3.4956 -3.4956 -3.3939 -3.3939 -3.3939 -3.3939 -2.6638 -2.6638 -2.6638 -2.6638 -2.5829 -2.5829 -2.5829 -2.5829 -1.1983 -1.1983 -1.1983 -1.1983 5.3802 5.3802 5.3802 5.3802 5.8446 5.8446 5.8446 5.8446 5.9709 5.9709 k = 0.5000 0.1461-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4901 -11.4901 -11.4901 -11.4901 -8.1442 -8.1442 -8.1442 -8.1442 -6.1941 -6.1941 -6.1941 -6.1941 -5.6805 -5.6805 -5.6805 -5.6805 -3.4988 -3.4988 -3.4988 -3.4988 -3.4080 -3.4080 -3.4080 -3.4080 -2.6516 -2.6516 -2.6516 -2.6516 -2.5717 -2.5717 -2.5717 -2.5717 -1.1970 -1.1970 -1.1970 -1.1970 5.4114 5.4114 5.4114 5.4114 5.8516 5.8516 5.8516 5.8516 6.0003 6.0003 k = 0.5000 0.1608-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4893 -11.4893 -11.4893 -11.4893 -8.1433 -8.1433 -8.1433 -8.1433 -6.2051 -6.2051 -6.2051 -6.2051 -5.6752 -5.6752 -5.6752 -5.6752 -3.5026 -3.5026 -3.5026 -3.5026 -3.4223 -3.4223 -3.4223 -3.4223 -2.6391 -2.6391 -2.6391 -2.6391 -2.5595 -2.5595 -2.5595 -2.5595 -1.1958 -1.1958 -1.1958 -1.1958 5.4443 5.4443 5.4443 5.4443 5.8603 5.8603 5.8603 5.8603 6.0316 6.0316 k = 0.5000 0.1754-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4884 -11.4884 -11.4884 -11.4884 -8.1423 -8.1423 -8.1423 -8.1423 -6.2164 -6.2164 -6.2164 -6.2164 -5.6697 -5.6697 -5.6697 -5.6697 -3.5069 -3.5069 -3.5069 -3.5069 -3.4368 -3.4368 -3.4368 -3.4368 -2.6266 -2.6266 -2.6266 -2.6266 -2.5463 -2.5463 -2.5463 -2.5463 -1.1945 -1.1945 -1.1945 -1.1945 5.4783 5.4783 5.4783 5.4783 5.8709 5.8709 5.8709 5.8709 6.0646 6.0646 k = 0.5000 0.1900-0.0000 ( 13672 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4875 -11.4875 -11.4875 -11.4875 -8.1412 -8.1412 -8.1412 -8.1412 -6.2279 -6.2279 -6.2279 -6.2279 -5.6641 -5.6641 -5.6641 -5.6641 -3.5119 -3.5119 -3.5119 -3.5119 -3.4511 -3.4511 -3.4511 -3.4511 -2.6142 -2.6142 -2.6142 -2.6142 -2.5324 -2.5324 -2.5324 -2.5324 -1.1933 -1.1933 -1.1933 -1.1933 5.5126 5.5126 5.5126 5.5126 5.8839 5.8839 5.8839 5.8839 6.0987 6.0987 k = 0.5000 0.2046-0.0000 ( 13684 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4865 -11.4865 -11.4865 -11.4865 -8.1402 -8.1402 -8.1402 -8.1402 -6.2393 -6.2393 -6.2393 -6.2393 -5.6583 -5.6583 -5.6583 -5.6583 -3.5173 -3.5173 -3.5173 -3.5173 -3.4652 -3.4652 -3.4652 -3.4652 -2.6022 -2.6022 -2.6022 -2.6022 -2.5179 -2.5179 -2.5179 -2.5179 -1.1921 -1.1921 -1.1921 -1.1921 5.5465 5.5465 5.5465 5.5465 5.8995 5.8995 5.8995 5.8995 6.1334 6.1334 k = 0.5000 0.2192-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4856 -11.4856 -11.4856 -11.4856 -8.1391 -8.1391 -8.1391 -8.1391 -6.2507 -6.2507 -6.2507 -6.2507 -5.6526 -5.6526 -5.6526 -5.6526 -3.5231 -3.5231 -3.5231 -3.5231 -3.4790 -3.4790 -3.4790 -3.4790 -2.5904 -2.5904 -2.5904 -2.5904 -2.5030 -2.5030 -2.5030 -2.5030 -1.1910 -1.1910 -1.1910 -1.1910 5.5794 5.5794 5.5794 5.5794 5.9180 5.9180 5.9180 5.9180 6.1681 6.1681 k = 0.5000 0.2338-0.0000 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4847 -11.4847 -11.4847 -11.4847 -8.1380 -8.1380 -8.1380 -8.1380 -6.2618 -6.2618 -6.2618 -6.2618 -5.6469 -5.6469 -5.6469 -5.6469 -3.5293 -3.5293 -3.5293 -3.5293 -3.4922 -3.4922 -3.4922 -3.4922 -2.5792 -2.5792 -2.5792 -2.5792 -2.4879 -2.4879 -2.4879 -2.4879 -1.1900 -1.1900 -1.1900 -1.1900 5.6103 5.6103 5.6103 5.6103 5.9398 5.9398 5.9398 5.9398 6.2023 6.2023 k = 0.5000 0.2485-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4838 -11.4838 -11.4838 -11.4838 -8.1370 -8.1370 -8.1370 -8.1370 -6.2725 -6.2725 -6.2725 -6.2725 -5.6412 -5.6412 -5.6412 -5.6412 -3.5356 -3.5356 -3.5356 -3.5356 -3.5048 -3.5048 -3.5048 -3.5048 -2.5686 -2.5686 -2.5686 -2.5686 -2.4729 -2.4729 -2.4729 -2.4729 -1.1890 -1.1890 -1.1890 -1.1890 5.6389 5.6389 5.6389 5.6389 5.9647 5.9647 5.9647 5.9647 6.2351 6.2351 k = 0.5000 0.2631-0.0000 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4829 -11.4829 -11.4829 -11.4829 -8.1360 -8.1360 -8.1360 -8.1360 -6.2827 -6.2827 -6.2827 -6.2827 -5.6358 -5.6358 -5.6358 -5.6358 -3.5420 -3.5420 -3.5420 -3.5420 -3.5166 -3.5166 -3.5166 -3.5166 -2.5587 -2.5587 -2.5587 -2.5587 -2.4581 -2.4581 -2.4581 -2.4581 -1.1882 -1.1882 -1.1882 -1.1882 5.6646 5.6646 5.6646 5.6646 5.9924 5.9924 5.9924 5.9924 6.2659 6.2659 k = 0.5000 0.2777-0.0000 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4821 -11.4821 -11.4821 -11.4821 -8.1351 -8.1351 -8.1351 -8.1351 -6.2923 -6.2923 -6.2923 -6.2923 -5.6307 -5.6307 -5.6307 -5.6307 -3.5483 -3.5483 -3.5483 -3.5483 -3.5276 -3.5276 -3.5276 -3.5276 -2.5495 -2.5495 -2.5495 -2.5495 -2.4439 -2.4439 -2.4439 -2.4439 -1.1874 -1.1874 -1.1874 -1.1874 5.6875 5.6875 5.6875 5.6875 6.0223 6.0223 6.0223 6.0223 6.2941 6.2941 k = 0.5000 0.2923-0.0000 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4813 -11.4813 -11.4813 -11.4813 -8.1342 -8.1342 -8.1342 -8.1342 -6.3012 -6.3012 -6.3012 -6.3012 -5.6258 -5.6258 -5.6258 -5.6258 -3.5544 -3.5544 -3.5544 -3.5544 -3.5376 -3.5376 -3.5376 -3.5376 -2.5411 -2.5411 -2.5411 -2.5411 -2.4304 -2.4304 -2.4304 -2.4304 -1.1868 -1.1868 -1.1868 -1.1868 5.7076 5.7076 5.7076 5.7076 6.0534 6.0534 6.0534 6.0534 6.3191 6.3191 k = 0.5000 0.3069-0.0000 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4806 -11.4806 -11.4806 -11.4806 -8.1334 -8.1334 -8.1334 -8.1334 -6.3092 -6.3092 -6.3092 -6.3092 -5.6214 -5.6214 -5.6214 -5.6214 -3.5601 -3.5601 -3.5601 -3.5601 -3.5466 -3.5466 -3.5466 -3.5466 -2.5336 -2.5336 -2.5336 -2.5336 -2.4180 -2.4180 -2.4180 -2.4180 -1.1862 -1.1862 -1.1862 -1.1862 5.7250 5.7250 5.7250 5.7250 6.0845 6.0845 6.0845 6.0845 6.3407 6.3407 k = 0.5000 0.3215-0.0000 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4800 -11.4800 -11.4800 -11.4800 -8.1327 -8.1327 -8.1327 -8.1327 -6.3164 -6.3164 -6.3164 -6.3164 -5.6174 -5.6174 -5.6174 -5.6174 -3.5654 -3.5654 -3.5654 -3.5654 -3.5546 -3.5546 -3.5546 -3.5546 -2.5270 -2.5270 -2.5270 -2.5270 -2.4067 -2.4067 -2.4067 -2.4067 -1.1858 -1.1858 -1.1858 -1.1858 5.7400 5.7400 5.7400 5.7400 6.1145 6.1145 6.1145 6.1145 6.3587 6.3587 k = 0.5000 0.3361-0.0000 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4794 -11.4794 -11.4794 -11.4794 -8.1321 -8.1321 -8.1321 -8.1321 -6.3225 -6.3225 -6.3225 -6.3225 -5.6139 -5.6139 -5.6139 -5.6139 -3.5700 -3.5700 -3.5700 -3.5700 -3.5614 -3.5614 -3.5614 -3.5614 -2.5214 -2.5214 -2.5214 -2.5214 -2.3968 -2.3968 -2.3968 -2.3968 -1.1854 -1.1854 -1.1854 -1.1854 5.7526 5.7526 5.7526 5.7526 6.1422 6.1422 6.1422 6.1422 6.3731 6.3731 k = 0.5000 0.3508-0.0000 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4790 -11.4790 -11.4790 -11.4790 -8.1316 -8.1316 -8.1316 -8.1316 -6.3277 -6.3277 -6.3277 -6.3277 -5.6110 -5.6110 -5.6110 -5.6110 -3.5740 -3.5740 -3.5740 -3.5740 -3.5671 -3.5671 -3.5671 -3.5671 -2.5167 -2.5167 -2.5167 -2.5167 -2.3884 -2.3884 -2.3884 -2.3884 -1.1851 -1.1851 -1.1851 -1.1851 5.7630 5.7630 5.7630 5.7630 6.1665 6.1665 6.1665 6.1665 6.3843 6.3843 k = 0.5000 0.3654-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4786 -11.4786 -11.4786 -11.4786 -8.1312 -8.1312 -8.1312 -8.1312 -6.3317 -6.3317 -6.3317 -6.3317 -5.6087 -5.6087 -5.6087 -5.6087 -3.5772 -3.5772 -3.5772 -3.5772 -3.5715 -3.5715 -3.5715 -3.5715 -2.5130 -2.5130 -2.5130 -2.5130 -2.3818 -2.3818 -2.3818 -2.3818 -1.1849 -1.1849 -1.1849 -1.1849 5.7711 5.7711 5.7711 5.7711 6.1863 6.1863 6.1863 6.1863 6.3925 6.3925 k = 0.5000 0.3800-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4784 -11.4784 -11.4784 -11.4784 -8.1309 -8.1309 -8.1309 -8.1309 -6.3346 -6.3346 -6.3346 -6.3346 -5.6070 -5.6070 -5.6070 -5.6070 -3.5795 -3.5795 -3.5795 -3.5795 -3.5747 -3.5747 -3.5747 -3.5747 -2.5104 -2.5104 -2.5104 -2.5104 -2.3770 -2.3770 -2.3770 -2.3770 -1.1848 -1.1848 -1.1848 -1.1848 5.7770 5.7770 5.7770 5.7770 6.2011 6.2011 6.2011 6.2011 6.3981 6.3981 k = 0.5000 0.3946-0.0000 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4782 -11.4782 -11.4782 -11.4782 -8.1307 -8.1307 -8.1307 -8.1307 -6.3364 -6.3364 -6.3364 -6.3364 -5.6060 -5.6060 -5.6060 -5.6060 -3.5809 -3.5809 -3.5809 -3.5809 -3.5766 -3.5766 -3.5766 -3.5766 -2.5088 -2.5088 -2.5088 -2.5088 -2.3740 -2.3740 -2.3740 -2.3740 -1.1847 -1.1847 -1.1847 -1.1847 5.7806 5.7806 5.7806 5.7806 6.2101 6.2101 6.2101 6.2101 6.4013 6.4013 k = 0.5000 0.4092-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4782 -11.4782 -11.4782 -11.4782 -8.1306 -8.1306 -8.1306 -8.1306 -6.3370 -6.3370 -6.3370 -6.3370 -5.6056 -5.6056 -5.6056 -5.6056 -3.5814 -3.5814 -3.5814 -3.5814 -3.5773 -3.5773 -3.5773 -3.5773 -2.5083 -2.5083 -2.5083 -2.5083 -2.3730 -2.3730 -2.3730 -2.3730 -1.1847 -1.1847 -1.1847 -1.1847 5.7818 5.7818 5.7818 5.7818 6.2132 6.2132 6.2132 6.2132 6.4024 6.4024 k = 0.5000 0.4092-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4782 -11.4782 -11.4782 -11.4782 -8.1306 -8.1306 -8.1306 -8.1306 -6.3370 -6.3370 -6.3370 -6.3370 -5.6056 -5.6056 -5.6056 -5.6056 -3.5814 -3.5814 -3.5814 -3.5814 -3.5773 -3.5773 -3.5773 -3.5773 -2.5083 -2.5083 -2.5083 -2.5083 -2.3730 -2.3730 -2.3730 -2.3730 -1.1847 -1.1847 -1.1847 -1.1847 5.7818 5.7818 5.7818 5.7818 6.2132 6.2132 6.2132 6.2132 6.4024 6.4024 k = 0.4853 0.4092-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.4835 -11.4835 -11.4731 -11.4731 -8.1380 -8.1380 -8.1236 -8.1236 -6.3555 -6.3555 -6.3193 -6.3193 -5.6096 -5.6096 -5.5999 -5.5999 -3.5999 -3.5999 -3.5951 -3.5951 -3.5653 -3.5653 -3.5538 -3.5538 -2.5186 -2.5186 -2.4977 -2.4977 -2.3777 -2.3777 -2.3696 -2.3696 -1.1916 -1.1916 -1.1780 -1.1780 5.7424 5.7424 5.8185 5.8185 6.1769 6.1769 6.2473 6.2473 6.3821 6.3821 k = 0.4706 0.4092-0.0000 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.4890 -11.4890 -11.4684 -11.4684 -8.1456 -8.1456 -8.1168 -8.1168 -6.3747 -6.3747 -6.3024 -6.3024 -5.6118 -5.6118 -5.5925 -5.5925 -3.6217 -3.6217 -3.6064 -3.6064 -3.5470 -3.5470 -3.5296 -3.5296 -2.5285 -2.5285 -2.4868 -2.4868 -2.3837 -2.3837 -2.3675 -2.3675 -1.1988 -1.1988 -1.1717 -1.1717 5.7009 5.7009 5.8515 5.8515 6.1402 6.1402 6.2771 6.2771 6.3607 6.3607 k = 0.4559 0.4092-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.4949 -11.4949 -11.4641 -11.4641 -8.1535 -8.1535 -8.1103 -8.1103 -6.3946 -6.3946 -6.2866 -6.2866 -5.6121 -5.6121 -5.5835 -5.5835 -3.6426 -3.6426 -3.6152 -3.6152 -3.5265 -3.5265 -3.5047 -3.5047 -2.5381 -2.5381 -2.4756 -2.4756 -2.3909 -2.3909 -2.3666 -2.3666 -1.2062 -1.2062 -1.1657 -1.1657 5.6577 5.6577 5.8789 5.8789 6.1056 6.1056 6.3004 6.3004 6.3384 6.3384 k = 0.4412 0.4092-0.0000 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.5010 -11.5010 -11.4600 -11.4600 -8.1616 -8.1616 -8.1042 -8.1042 -6.4150 -6.4150 -6.2717 -6.2717 -5.6107 -5.6107 -5.5729 -5.5729 -3.6625 -3.6625 -3.6215 -3.6215 -3.5041 -3.5041 -3.4792 -3.4792 -2.5472 -2.5472 -2.4641 -2.4641 -2.3993 -2.3993 -2.3671 -2.3671 -1.2138 -1.2138 -1.1600 -1.1600 5.6130 5.6130 5.8969 5.8969 6.0773 6.0773 6.3142 6.3142 6.3152 6.3152 k = 0.4265 0.4092-0.0000 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2720 -23.2720 -23.2718 -23.2718 -23.2666 -23.2666 -23.2664 -23.2664 -11.5073 -11.5073 -11.4563 -11.4563 -8.1699 -8.1699 -8.0984 -8.0984 -6.4360 -6.4360 -6.2578 -6.2578 -5.6074 -5.6074 -5.5607 -5.5607 -3.6815 -3.6815 -3.6252 -3.6252 -3.4797 -3.4797 -3.4531 -3.4531 -2.5559 -2.5559 -2.4525 -2.4525 -2.4089 -2.4089 -2.3688 -2.3688 -1.2216 -1.2216 -1.1548 -1.1548 5.5670 5.5670 5.8993 5.8993 6.0611 6.0611 6.2913 6.2913 6.3160 6.3160 k = 0.4118 0.4092-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2720 -23.2720 -23.2718 -23.2718 -23.2666 -23.2666 -23.2664 -23.2664 -11.5138 -11.5138 -11.4529 -11.4529 -8.1783 -8.1783 -8.0930 -8.0930 -6.4573 -6.4573 -6.2451 -6.2451 -5.6024 -5.6024 -5.5471 -5.5471 -3.6995 -3.6995 -3.6263 -3.6263 -3.4537 -3.4537 -3.4266 -3.4266 -2.5641 -2.5641 -2.4406 -2.4406 -2.4196 -2.4196 -2.3717 -2.3717 -1.2295 -1.2295 -1.1499 -1.1499 5.5197 5.5197 5.8832 5.8832 6.0600 6.0600 6.2669 6.2669 6.3034 6.3034 k = 0.3971 0.4092-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2720 -23.2720 -23.2718 -23.2718 -23.2666 -23.2666 -23.2663 -23.2663 -11.5205 -11.5205 -11.4498 -11.4498 -8.1868 -8.1868 -8.0880 -8.0880 -6.4788 -6.4788 -6.2334 -6.2334 -5.5955 -5.5955 -5.5321 -5.5321 -3.7166 -3.7166 -3.6249 -3.6249 -3.4262 -3.4262 -3.3997 -3.3997 -2.5718 -2.5718 -2.4315 -2.4315 -2.4286 -2.4286 -2.3759 -2.3759 -1.2375 -1.2375 -1.1454 -1.1454 5.4713 5.4713 5.8535 5.8535 6.0686 6.0686 6.2420 6.2420 6.2762 6.2762 k = 0.3824 0.4092-0.0000 ( 13654 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4480 -23.4480 -23.2720 -23.2720 -23.2718 -23.2718 -23.2666 -23.2666 -23.2662 -23.2662 -11.5273 -11.5273 -11.4470 -11.4470 -8.1955 -8.1955 -8.0833 -8.0833 -6.5006 -6.5006 -6.2229 -6.2229 -5.5869 -5.5869 -5.5157 -5.5157 -3.7327 -3.7327 -3.6210 -3.6210 -3.3972 -3.3972 -3.3726 -3.3726 -2.5790 -2.5790 -2.4445 -2.4445 -2.4165 -2.4165 -2.3813 -2.3813 -1.2455 -1.2455 -1.1413 -1.1413 5.4218 5.4218 5.8166 5.8166 6.0797 6.0797 6.2168 6.2168 6.2361 6.2361 k = 0.3676 0.4092-0.0000 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4479 -23.4479 -23.2721 -23.2721 -23.2719 -23.2719 -23.2667 -23.2667 -23.2662 -23.2662 -11.5342 -11.5342 -11.4446 -11.4446 -8.2041 -8.2041 -8.0789 -8.0789 -6.5225 -6.5225 -6.2135 -6.2135 -5.5767 -5.5767 -5.4981 -5.4981 -3.7478 -3.7478 -3.6147 -3.6147 -3.3671 -3.3671 -3.3454 -3.3454 -2.5855 -2.5855 -2.4584 -2.4584 -2.4042 -2.4042 -2.3879 -2.3879 -1.2536 -1.2536 -1.1377 -1.1377 5.3713 5.3713 5.7763 5.7763 6.0886 6.0886 6.1860 6.1860 6.1915 6.1915 k = 0.3529 0.4092-0.0000 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4479 -23.4479 -23.2721 -23.2721 -23.2718 -23.2718 -23.2667 -23.2667 -23.2661 -23.2661 -11.5412 -11.5412 -11.4425 -11.4425 -8.2129 -8.2129 -8.0750 -8.0750 -6.5443 -6.5443 -6.2053 -6.2053 -5.5648 -5.5648 -5.4793 -5.4793 -3.7620 -3.7620 -3.6061 -3.6061 -3.3359 -3.3359 -3.3183 -3.3183 -2.5914 -2.5914 -2.4734 -2.4734 -2.3956 -2.3956 -2.3919 -2.3919 -1.2617 -1.2617 -1.1344 -1.1344 5.3198 5.3198 5.7344 5.7344 6.0921 6.0921 6.1291 6.1291 6.1662 6.1662 k = 0.3382 0.4092-0.0000 ( 13694 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4479 -23.4479 -23.2722 -23.2722 -23.2718 -23.2718 -23.2667 -23.2667 -23.2661 -23.2661 -11.5483 -11.5483 -11.4407 -11.4407 -8.2215 -8.2215 -8.0713 -8.0713 -6.5660 -6.5660 -6.1982 -6.1982 -5.5514 -5.5514 -5.4595 -5.4595 -3.7753 -3.7753 -3.5954 -3.5954 -3.3039 -3.3039 -3.2914 -3.2914 -2.5965 -2.5965 -2.4892 -2.4892 -2.4044 -2.4044 -2.3796 -2.3796 -1.2698 -1.2698 -1.1316 -1.1316 5.2674 5.2674 5.6916 5.6916 6.0678 6.0678 6.0875 6.0875 6.1409 6.1409 k = 0.3235 0.4092-0.0000 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4479 -23.4479 -23.2722 -23.2722 -23.2718 -23.2718 -23.2666 -23.2666 -23.2660 -23.2660 -11.5553 -11.5553 -11.4391 -11.4391 -8.2302 -8.2302 -8.0680 -8.0680 -6.5875 -6.5875 -6.1922 -6.1922 -5.5365 -5.5365 -5.4386 -5.4386 -3.7876 -3.7876 -3.5826 -3.5826 -3.2713 -3.2713 -3.2648 -3.2648 -2.6010 -2.6010 -2.5058 -2.5058 -2.4142 -2.4142 -2.3673 -2.3673 -1.2778 -1.2778 -1.1293 -1.1293 5.2142 5.2142 5.6487 5.6487 6.0044 6.0044 6.0723 6.0723 6.1158 6.1158 k = 0.3088 0.4092-0.0000 ( 13670 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4478 -23.4478 -23.2722 -23.2722 -23.2718 -23.2718 -23.2666 -23.2666 -23.2660 -23.2660 -11.5623 -11.5623 -11.4379 -11.4379 -8.2388 -8.2388 -8.0651 -8.0651 -6.6087 -6.6087 -6.1872 -6.1872 -5.5204 -5.5204 -5.4169 -5.4169 -3.7991 -3.7991 -3.5680 -3.5680 -3.2388 -3.2388 -3.2380 -3.2380 -2.6046 -2.6046 -2.5232 -2.5232 -2.4250 -2.4250 -2.3550 -2.3550 -1.2857 -1.2857 -1.1273 -1.1273 5.1603 5.1603 5.6057 5.6057 5.9404 5.9404 6.0445 6.0445 6.0910 6.0910 k = 0.2941 0.4092-0.0000 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4478 -23.4478 -23.2722 -23.2722 -23.2718 -23.2718 -23.2666 -23.2666 -23.2659 -23.2659 -11.5693 -11.5693 -11.4369 -11.4369 -8.2472 -8.2472 -8.0624 -8.0624 -6.6295 -6.6295 -6.1833 -6.1833 -5.5031 -5.5031 -5.3944 -5.3944 -3.8097 -3.8097 -3.5517 -3.5517 -3.2133 -3.2133 -3.2048 -3.2048 -2.6073 -2.6073 -2.5412 -2.5412 -2.4367 -2.4367 -2.3428 -2.3428 -1.2934 -1.2934 -1.1257 -1.1257 5.1059 5.1059 5.5630 5.5630 5.8770 5.8770 6.0034 6.0034 6.0666 6.0666 k = 0.2794 0.4092-0.0000 ( 13662 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4477 -23.4477 -23.2722 -23.2722 -23.2718 -23.2718 -23.2666 -23.2666 -23.2658 -23.2658 -11.5762 -11.5762 -11.4361 -11.4361 -8.2555 -8.2555 -8.0601 -8.0601 -6.6498 -6.6498 -6.1803 -6.1803 -5.4848 -5.4848 -5.3712 -5.3712 -3.8195 -3.8195 -3.5339 -3.5339 -3.1888 -3.1888 -3.1713 -3.1713 -2.6091 -2.6091 -2.5598 -2.5598 -2.4492 -2.4492 -2.3308 -2.3308 -1.3011 -1.3011 -1.1246 -1.1246 5.0512 5.0512 5.5206 5.5206 5.8150 5.8150 5.9501 5.9501 6.0427 6.0427 k = 0.2647 0.4092-0.0000 ( 13650 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4477 -23.4477 -23.2722 -23.2722 -23.2718 -23.2718 -23.2665 -23.2665 -23.2658 -23.2658 -11.5830 -11.5830 -11.4355 -11.4355 -8.2636 -8.2636 -8.0580 -8.0580 -6.6696 -6.6696 -6.1781 -6.1781 -5.4655 -5.4655 -5.3476 -5.3476 -3.8285 -3.8285 -3.5149 -3.5149 -3.1652 -3.1652 -3.1379 -3.1379 -2.6100 -2.6100 -2.5788 -2.5788 -2.4624 -2.4624 -2.3189 -2.3189 -1.3085 -1.3085 -1.1238 -1.1238 4.9964 4.9964 5.4787 5.4787 5.7552 5.7552 5.8875 5.8875 6.0195 6.0195 k = 0.2500 0.4092-0.0000 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4477 -23.4477 -23.2722 -23.2722 -23.2718 -23.2718 -23.2665 -23.2665 -23.2658 -23.2658 -11.5896 -11.5896 -11.4351 -11.4351 -8.2714 -8.2714 -8.0563 -8.0563 -6.6887 -6.6887 -6.1768 -6.1768 -5.4456 -5.4456 -5.3236 -5.3236 -3.8367 -3.8367 -3.4949 -3.4949 -3.1429 -3.1429 -3.1048 -3.1048 -2.6099 -2.6099 -2.5981 -2.5981 -2.4763 -2.4763 -2.3072 -2.3072 -1.3157 -1.3157 -1.1234 -1.1234 4.9418 4.9418 5.4372 5.4372 5.6980 5.6980 5.8190 5.8190 5.9969 5.9969 k = 0.2353 0.4092-0.0000 ( 13684 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4477 -23.4477 -23.2723 -23.2723 -23.2718 -23.2718 -23.2665 -23.2665 -23.2657 -23.2657 -11.5960 -11.5960 -11.4349 -11.4349 -8.2790 -8.2790 -8.0547 -8.0547 -6.7071 -6.7071 -6.1761 -6.1761 -5.4251 -5.4251 -5.2994 -5.2994 -3.8443 -3.8443 -3.4741 -3.4741 -3.1218 -3.1218 -3.0723 -3.0723 -2.6176 -2.6176 -2.6088 -2.6088 -2.4907 -2.4907 -2.2959 -2.2959 -1.3226 -1.3226 -1.1233 -1.1233 4.8878 4.8878 5.3963 5.3963 5.6437 5.6437 5.7478 5.7478 5.9751 5.9751 k = 0.2206 0.4092-0.0000 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2723 -23.2723 -23.2718 -23.2718 -23.2665 -23.2665 -23.2656 -23.2656 -11.6023 -11.6023 -11.4348 -11.4348 -8.2863 -8.2863 -8.0534 -8.0534 -6.7247 -6.7247 -6.1761 -6.1761 -5.4043 -5.4043 -5.2753 -5.2753 -3.8511 -3.8511 -3.4528 -3.4528 -3.1023 -3.1023 -3.0404 -3.0404 -2.6372 -2.6372 -2.6066 -2.6066 -2.5054 -2.5054 -2.2848 -2.2848 -1.3293 -1.3293 -1.1235 -1.1235 4.8348 4.8348 5.3560 5.3560 5.5925 5.5925 5.6763 5.6763 5.9541 5.9541 k = 0.2059 0.4092-0.0000 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2723 -23.2723 -23.2718 -23.2718 -23.2665 -23.2665 -23.2656 -23.2656 -11.6082 -11.6082 -11.4349 -11.4349 -8.2933 -8.2933 -8.0523 -8.0523 -6.7414 -6.7414 -6.1766 -6.1766 -5.3834 -5.3834 -5.2513 -5.2513 -3.8573 -3.8573 -3.4312 -3.4312 -3.0842 -3.0842 -3.0094 -3.0094 -2.6567 -2.6567 -2.6036 -2.6036 -2.5204 -2.5204 -2.2742 -2.2742 -1.3356 -1.3356 -1.1239 -1.1239 4.7830 4.7830 5.3161 5.3161 5.5446 5.5446 5.6065 5.6065 5.9342 5.9342 k = 0.1912 0.4092-0.0000 ( 13690 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2723 -23.2723 -23.2718 -23.2718 -23.2665 -23.2665 -23.2655 -23.2655 -11.6139 -11.6139 -11.4351 -11.4351 -8.3000 -8.3000 -8.0514 -8.0514 -6.7573 -6.7573 -6.1775 -6.1775 -5.3625 -5.3625 -5.2277 -5.2277 -3.8630 -3.8630 -3.4095 -3.4095 -3.0678 -3.0678 -2.9795 -2.9795 -2.6759 -2.6759 -2.5996 -2.5996 -2.5356 -2.5356 -2.2639 -2.2639 -1.3417 -1.3417 -1.1246 -1.1246 4.7329 4.7329 5.2768 5.2768 5.5000 5.5000 5.5398 5.5398 5.9152 5.9152 k = 0.1765 0.4092-0.0000 ( 13682 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2723 -23.2723 -23.2717 -23.2717 -23.2665 -23.2665 -23.2655 -23.2655 -11.6193 -11.6193 -11.4353 -11.4353 -8.3063 -8.3063 -8.0506 -8.0506 -6.7721 -6.7721 -6.1787 -6.1787 -5.3420 -5.3420 -5.2048 -5.2048 -3.8680 -3.8680 -3.3881 -3.3881 -3.0531 -3.0531 -2.9510 -2.9510 -2.6947 -2.6947 -2.5948 -2.5948 -2.5507 -2.5507 -2.2542 -2.2542 -1.3474 -1.3474 -1.1256 -1.1256 4.6850 4.6850 5.2380 5.2380 5.4588 5.4588 5.4774 5.4774 5.8973 5.8973 k = 0.1618 0.4092-0.0000 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4476 -23.4476 -23.2723 -23.2723 -23.2717 -23.2717 -23.2665 -23.2665 -23.2655 -23.2655 -11.6243 -11.6243 -11.4357 -11.4357 -8.3121 -8.3121 -8.0500 -8.0500 -6.7860 -6.7860 -6.1802 -6.1802 -5.3219 -5.3219 -5.1826 -5.1826 -3.8725 -3.8725 -3.3671 -3.3671 -3.0400 -3.0400 -2.9238 -2.9238 -2.7128 -2.7128 -2.5894 -2.5894 -2.5657 -2.5657 -2.2450 -2.2450 -1.3527 -1.3527 -1.1266 -1.1266 4.6394 4.6394 5.1997 5.1997 5.4202 5.4202 5.4210 5.4210 5.8806 5.8806 k = 0.1471 0.4092-0.0000 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2654 -23.2654 -11.6290 -11.6290 -11.4360 -11.4360 -8.3176 -8.3176 -8.0495 -8.0495 -6.7988 -6.7988 -6.1819 -6.1819 -5.3026 -5.3026 -5.1614 -5.1614 -3.8765 -3.8765 -3.3468 -3.3468 -3.0285 -3.0285 -2.8984 -2.8984 -2.7302 -2.7302 -2.5835 -2.5835 -2.5803 -2.5803 -2.2364 -2.2364 -1.3577 -1.3577 -1.1278 -1.1278 4.5966 4.5966 5.1620 5.1620 5.3687 5.3687 5.3864 5.3864 5.8651 5.8651 k = 0.1324 0.4092-0.0000 ( 13692 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2724 -23.2724 -23.2718 -23.2718 -23.2664 -23.2664 -23.2654 -23.2654 -11.6334 -11.6334 -11.4364 -11.4364 -8.3225 -8.3225 -8.0492 -8.0492 -6.8105 -6.8105 -6.1836 -6.1836 -5.2842 -5.2842 -5.1415 -5.1415 -3.8800 -3.8800 -3.3274 -3.3274 -3.0185 -3.0185 -2.8749 -2.8749 -2.7466 -2.7466 -2.5944 -2.5944 -2.5773 -2.5773 -2.2284 -2.2284 -1.3622 -1.3622 -1.1290 -1.1290 4.5570 4.5570 5.1253 5.1253 5.3231 5.3231 5.3552 5.3552 5.8509 5.8509 k = 0.1176 0.4092-0.0000 ( 13692 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2654 -23.2654 -11.6373 -11.6373 -11.4368 -11.4368 -8.3271 -8.3271 -8.0489 -8.0489 -6.8211 -6.8211 -6.1854 -6.1854 -5.2670 -5.2670 -5.1230 -5.1230 -3.8830 -3.8830 -3.3093 -3.3093 -3.0100 -3.0100 -2.8535 -2.8535 -2.7617 -2.7617 -2.6077 -2.6077 -2.5710 -2.5710 -2.2212 -2.2212 -1.3663 -1.3663 -1.1303 -1.1303 4.5207 4.5207 5.0901 5.0901 5.2834 5.2834 5.3273 5.3273 5.8381 5.8381 k = 0.1029 0.4092-0.0000 ( 13684 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2653 -23.2653 -11.6408 -11.6408 -11.4372 -11.4372 -8.3311 -8.3311 -8.0487 -8.0487 -6.8305 -6.8305 -6.1871 -6.1871 -5.2513 -5.2513 -5.1061 -5.1061 -3.8857 -3.8857 -3.2925 -3.2925 -3.0028 -3.0028 -2.8345 -2.8345 -2.7752 -2.7752 -2.6201 -2.6201 -2.5648 -2.5648 -2.2146 -2.2146 -1.3700 -1.3700 -1.1316 -1.1316 4.4881 4.4881 5.0570 5.0570 5.2495 5.2495 5.3027 5.3027 5.8266 5.8266 k = 0.0882 0.4092-0.0000 ( 13662 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.6439 -11.6439 -11.4376 -11.4376 -8.3346 -8.3346 -8.0485 -8.0485 -6.8387 -6.8387 -6.1887 -6.1887 -5.2371 -5.2371 -5.0910 -5.0910 -3.8879 -3.8879 -3.2774 -3.2774 -2.9969 -2.9969 -2.8188 -2.8188 -2.7862 -2.7862 -2.6314 -2.6314 -2.5589 -2.5589 -2.2089 -2.2089 -1.3732 -1.3732 -1.1327 -1.1327 4.4594 4.4594 5.0267 5.0267 5.2210 5.2210 5.2815 5.2815 5.8165 5.8165 k = 0.0735 0.4092-0.0000 ( 13670 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.6465 -11.6465 -11.4379 -11.4379 -8.3376 -8.3376 -8.0484 -8.0484 -6.8457 -6.8457 -6.1902 -6.1902 -5.2248 -5.2248 -5.0780 -5.0780 -3.8898 -3.8898 -3.2642 -3.2642 -2.9920 -2.9920 -2.8105 -2.8105 -2.7907 -2.7907 -2.6414 -2.6414 -2.5536 -2.5536 -2.2040 -2.2040 -1.3759 -1.3759 -1.1338 -1.1338 4.4348 4.4348 4.9999 4.9999 5.1974 5.1974 5.2635 5.2635 5.8080 5.8080 k = 0.0588 0.4092-0.0000 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6487 -11.6487 -11.4382 -11.4382 -8.3401 -8.3401 -8.0484 -8.0484 -6.8514 -6.8514 -6.1914 -6.1914 -5.2145 -5.2145 -5.0670 -5.0670 -3.8913 -3.8913 -3.2531 -3.2531 -2.9882 -2.9882 -2.8137 -2.8137 -2.7844 -2.7844 -2.6500 -2.6500 -2.5490 -2.5490 -2.1999 -2.1999 -1.3781 -1.3781 -1.1348 -1.1348 4.4145 4.4145 4.9773 4.9773 5.1786 5.1786 5.2487 5.2487 5.8009 5.8009 k = 0.0441 0.4092-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6504 -11.6504 -11.4384 -11.4384 -8.3421 -8.3421 -8.0483 -8.0483 -6.8559 -6.8559 -6.1924 -6.1924 -5.2062 -5.2062 -5.0584 -5.0584 -3.8924 -3.8924 -3.2442 -3.2442 -2.9854 -2.9854 -2.8196 -2.8196 -2.7761 -2.7761 -2.6568 -2.6568 -2.5453 -2.5453 -2.1967 -2.1967 -1.3799 -1.3799 -1.1355 -1.1355 4.3985 4.3985 4.9592 4.9592 5.1641 5.1641 5.2373 5.2373 5.7954 5.7954 k = 0.0294 0.4092-0.0000 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6516 -11.6516 -11.4386 -11.4386 -8.3435 -8.3435 -8.0483 -8.0483 -6.8591 -6.8591 -6.1932 -6.1932 -5.2003 -5.2003 -5.0521 -5.0521 -3.8933 -3.8933 -3.2377 -3.2377 -2.9834 -2.9834 -2.8243 -2.8243 -2.7697 -2.7697 -2.6618 -2.6618 -2.5425 -2.5425 -2.1944 -2.1944 -1.3812 -1.3812 -1.1361 -1.1361 4.3870 4.3870 4.9461 4.9461 5.1539 5.1539 5.2291 5.2291 5.7914 5.7914 k = 0.0147 0.4092-0.0000 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6523 -11.6523 -11.4387 -11.4387 -8.3443 -8.3443 -8.0483 -8.0483 -6.8611 -6.8611 -6.1936 -6.1936 -5.1967 -5.1967 -5.0483 -5.0483 -3.8937 -3.8937 -3.2338 -3.2338 -2.9822 -2.9822 -2.8273 -2.8273 -2.7657 -2.7657 -2.6648 -2.6648 -2.5408 -2.5408 -2.1930 -2.1930 -1.3819 -1.3819 -1.1365 -1.1365 4.3801 4.3801 4.9381 4.9381 5.1478 5.1478 5.2242 5.2242 5.7891 5.7891 k = 0.0000 0.4092-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6526 -11.6526 -11.4387 -11.4387 -8.3446 -8.3446 -8.0483 -8.0483 -6.8617 -6.8617 -6.1938 -6.1938 -5.1955 -5.1955 -5.0471 -5.0471 -3.8939 -3.8939 -3.2325 -3.2325 -2.9818 -2.9818 -2.8284 -2.8284 -2.7643 -2.7643 -2.6658 -2.6658 -2.5403 -2.5403 -2.1925 -2.1925 -1.3822 -1.3822 -1.1366 -1.1366 4.3778 4.3778 4.9354 4.9354 5.1458 5.1458 5.2225 5.2225 5.7883 5.7883 k = 0.0000 0.4092-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6526 -11.6526 -11.4387 -11.4387 -8.3446 -8.3446 -8.0483 -8.0483 -6.8617 -6.8617 -6.1938 -6.1938 -5.1955 -5.1955 -5.0471 -5.0471 -3.8939 -3.8939 -3.2325 -3.2325 -2.9818 -2.9818 -2.8284 -2.8284 -2.7643 -2.7643 -2.6658 -2.6658 -2.5403 -2.5403 -2.1925 -2.1925 -1.3822 -1.3822 -1.1366 -1.1366 4.3778 4.3778 4.9354 4.9354 5.1458 5.1458 5.2225 5.2225 5.7883 5.7883 k = 0.0000 0.3946-0.0000 ( 13638 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6528 -11.6528 -11.4387 -11.4387 -8.3452 -8.3452 -8.0477 -8.0477 -6.8607 -6.8607 -6.1935 -6.1935 -5.1961 -5.1961 -5.0466 -5.0466 -3.8934 -3.8934 -3.2319 -3.2319 -2.9821 -2.9821 -2.8317 -2.8317 -2.7645 -2.7645 -2.6654 -2.6654 -2.5407 -2.5407 -2.1921 -2.1921 -1.3820 -1.3820 -1.1361 -1.1361 4.3742 4.3742 4.9356 4.9356 5.1473 5.1473 5.2253 5.2253 5.7818 5.7818 k = 0.0000 0.3800-0.0000 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6534 -11.6534 -11.4385 -11.4385 -8.3470 -8.3470 -8.0458 -8.0458 -6.8576 -6.8576 -6.1927 -6.1927 -5.1980 -5.1980 -5.0453 -5.0453 -3.8920 -3.8920 -3.2302 -3.2302 -2.9830 -2.9830 -2.8412 -2.8412 -2.7649 -2.7649 -2.6643 -2.6643 -2.5418 -2.5418 -2.1909 -2.1909 -1.3816 -1.3816 -1.1348 -1.1348 4.3637 4.3637 4.9364 4.9364 5.1517 5.1517 5.2335 5.2335 5.7636 5.7636 k = 0.0000 0.3654-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6545 -11.6545 -11.4382 -11.4382 -8.3500 -8.3500 -8.0428 -8.0428 -6.8526 -6.8526 -6.1913 -6.1913 -5.2012 -5.2012 -5.0431 -5.0431 -3.8896 -3.8896 -3.2273 -3.2273 -2.9845 -2.9845 -2.8562 -2.8562 -2.7657 -2.7657 -2.6634 -2.6634 -2.5437 -2.5437 -2.1888 -2.1888 -1.3809 -1.3809 -1.1327 -1.1327 4.3466 4.3466 4.9380 4.9380 5.1580 5.1580 5.2473 5.2473 5.7361 5.7361 k = 0.0000 0.3508-0.0000 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6559 -11.6559 -11.4377 -11.4377 -8.3539 -8.3539 -8.0388 -8.0388 -6.8455 -6.8455 -6.1895 -6.1895 -5.2053 -5.2053 -5.0403 -5.0403 -3.8863 -3.8863 -3.2233 -3.2233 -2.9867 -2.9867 -2.8756 -2.8756 -2.7667 -2.7667 -2.6634 -2.6634 -2.5463 -2.5463 -2.1861 -2.1861 -1.3800 -1.3800 -1.1296 -1.1296 4.3239 4.3239 4.9411 4.9411 5.1651 5.1651 5.2669 5.2669 5.7022 5.7022 k = 0.0000 0.3361-0.0000 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6577 -11.6577 -11.4372 -11.4372 -8.3589 -8.3589 -8.0338 -8.0338 -6.8365 -6.8365 -6.1872 -6.1872 -5.2104 -5.2104 -5.0369 -5.0369 -3.8821 -3.8821 -3.2182 -3.2182 -2.9894 -2.9894 -2.8985 -2.8985 -2.7681 -2.7681 -2.6651 -2.6651 -2.5495 -2.5495 -2.1827 -2.1827 -1.3789 -1.3789 -1.1257 -1.1257 4.2963 4.2963 4.9463 4.9463 5.1713 5.1713 5.2927 5.2927 5.6641 5.6641 k = 0.0000 0.3215-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6599 -11.6599 -11.4365 -11.4365 -8.3645 -8.3645 -8.0281 -8.0281 -6.8256 -6.8256 -6.1846 -6.1846 -5.2161 -5.2161 -5.0332 -5.0332 -3.8770 -3.8770 -3.2121 -3.2121 -2.9927 -2.9927 -2.9242 -2.9242 -2.7698 -2.7698 -2.6688 -2.6688 -2.5532 -2.5532 -2.1786 -2.1786 -1.3778 -1.3778 -1.1208 -1.1208 4.2649 4.2649 4.9540 4.9540 5.1756 5.1756 5.3248 5.3248 5.6237 5.6237 k = 0.0000 0.3069-0.0000 ( 13652 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6623 -11.6623 -11.4358 -11.4358 -8.3708 -8.3708 -8.0217 -8.0217 -6.8128 -6.8128 -6.1818 -6.1818 -5.2225 -5.2225 -5.0292 -5.0292 -3.8710 -3.8710 -3.2049 -3.2049 -2.9966 -2.9966 -2.9519 -2.9519 -2.7719 -2.7719 -2.6748 -2.6748 -2.5574 -2.5574 -2.1741 -2.1741 -1.3767 -1.3767 -1.1152 -1.1152 4.2307 4.2307 4.9646 4.9646 5.1774 5.1774 5.3627 5.3627 5.5822 5.5822 k = 0.0000 0.2923-0.0000 ( 13660 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6651 -11.6651 -11.4351 -11.4351 -8.3776 -8.3776 -8.0148 -8.0148 -6.7982 -6.7982 -6.1788 -6.1788 -5.2292 -5.2292 -5.0251 -5.0251 -3.8643 -3.8643 -3.1968 -3.1968 -3.0011 -3.0011 -2.9811 -2.9811 -2.7744 -2.7744 -2.6834 -2.6834 -2.5620 -2.5620 -2.1691 -2.1691 -1.3757 -1.3757 -1.1087 -1.1087 4.1945 4.1945 4.9783 4.9783 5.1768 5.1768 5.4059 5.4059 5.5407 5.5407 k = 0.0000 0.2777-0.0000 ( 13670 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6680 -11.6680 -11.4343 -11.4343 -8.3847 -8.3847 -8.0076 -8.0076 -6.7819 -6.7819 -6.1758 -6.1758 -5.2362 -5.2362 -5.0209 -5.0209 -3.8568 -3.8568 -3.1877 -3.1877 -3.0113 -3.0113 -3.0060 -3.0060 -2.7772 -2.7772 -2.6943 -2.6943 -2.5669 -2.5669 -2.1638 -2.1638 -1.3748 -1.3748 -1.1014 -1.1014 4.1571 4.1571 4.9952 4.9952 5.1740 5.1740 5.4537 5.4537 5.4998 5.4998 k = 0.0000 0.2631-0.0000 ( 13674 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6711 -11.6711 -11.4334 -11.4334 -8.3921 -8.3921 -8.0002 -8.0002 -6.7640 -6.7640 -6.1729 -6.1729 -5.2434 -5.2434 -5.0167 -5.0167 -3.8487 -3.8487 -3.1777 -3.1777 -3.0421 -3.0421 -3.0115 -3.0115 -2.7805 -2.7805 -2.7077 -2.7077 -2.5720 -2.5720 -2.1582 -2.1582 -1.3742 -1.3742 -1.0934 -1.0934 4.1193 4.1193 5.0149 5.0149 5.1696 5.1696 5.4601 5.4601 5.5053 5.5053 k = 0.0000 0.2485-0.0000 ( 13686 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4475 -23.4475 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6743 -11.6743 -11.4326 -11.4326 -8.3995 -8.3995 -7.9926 -7.9926 -6.7446 -6.7446 -6.1702 -6.1702 -5.2506 -5.2506 -5.0127 -5.0127 -3.8399 -3.8399 -3.1670 -3.1670 -3.0731 -3.0731 -3.0175 -3.0175 -2.7842 -2.7842 -2.7232 -2.7232 -2.5773 -2.5773 -2.1525 -2.1525 -1.3738 -1.3738 -1.0848 -1.0848 4.0817 4.0817 5.0368 5.0368 5.1644 5.1644 5.4221 5.4221 5.5603 5.5603 k = 0.0000 0.2338-0.0000 ( 13675 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6776 -11.6776 -11.4318 -11.4318 -8.4070 -8.4070 -7.9850 -7.9850 -6.7238 -6.7238 -6.1680 -6.1680 -5.2578 -5.2578 -5.0088 -5.0088 -3.8305 -3.8305 -3.1555 -3.1555 -3.1038 -3.1038 -3.0239 -3.0239 -2.7884 -2.7884 -2.7407 -2.7407 -2.5826 -2.5826 -2.1467 -2.1467 -1.3736 -1.3736 -1.0758 -1.0758 4.0447 4.0447 5.0596 5.0596 5.1601 5.1601 5.3860 5.3860 5.6177 5.6177 k = 0.0000 0.2192-0.0000 ( 13667 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2723 -23.2723 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6810 -11.6810 -11.4310 -11.4310 -8.4144 -8.4144 -7.9775 -7.9775 -6.7017 -6.7017 -6.1663 -6.1663 -5.2650 -5.2650 -5.0051 -5.0051 -3.8208 -3.8208 -3.1433 -3.1433 -3.1340 -3.1340 -3.0306 -3.0306 -2.7930 -2.7930 -2.7600 -2.7600 -2.5879 -2.5879 -2.1409 -2.1409 -1.3737 -1.3737 -1.0664 -1.0664 4.0087 4.0087 5.0795 5.0795 5.1606 5.1606 5.3523 5.3523 5.6771 5.6771 k = 0.0000 0.2046-0.0000 ( 13671 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2723 -23.2723 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6844 -11.6844 -11.4302 -11.4302 -8.4216 -8.4216 -7.9702 -7.9702 -6.6785 -6.6785 -6.1653 -6.1653 -5.2719 -5.2719 -5.0016 -5.0016 -3.8106 -3.8106 -3.1634 -3.1634 -3.1305 -3.1305 -3.0377 -3.0377 -2.7982 -2.7982 -2.7805 -2.7805 -2.5932 -2.5932 -2.1352 -2.1352 -1.3741 -1.3741 -1.0568 -1.0568 3.9742 3.9742 5.0901 5.0901 5.1723 5.1723 5.3210 5.3210 5.7377 5.7377 k = 0.0000 0.1900-0.0000 ( 13691 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.6877 -11.6877 -11.4295 -11.4295 -8.4286 -8.4286 -7.9631 -7.9631 -6.6542 -6.6542 -6.1652 -6.1652 -5.2786 -5.2786 -4.9983 -4.9983 -3.8002 -3.8002 -3.1916 -3.1916 -3.1172 -3.1172 -3.0451 -3.0451 -2.8041 -2.8041 -2.8020 -2.8020 -2.5983 -2.5983 -2.1296 -2.1296 -1.3746 -1.3746 -1.0471 -1.0471 3.9413 3.9413 5.0896 5.0896 5.1970 5.1970 5.2924 5.2924 5.7987 5.7987 k = 0.0000 0.1754-0.0000 ( 13693 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.6909 -11.6909 -11.4288 -11.4288 -8.4353 -8.4353 -7.9563 -7.9563 -6.6291 -6.6291 -6.1662 -6.1662 -5.2850 -5.2850 -4.9953 -4.9953 -3.7897 -3.7897 -3.2184 -3.2184 -3.1034 -3.1034 -3.0526 -3.0526 -2.8245 -2.8245 -2.8101 -2.8101 -2.6033 -2.6033 -2.1241 -2.1241 -1.3754 -1.3754 -1.0375 -1.0375 3.9104 3.9104 5.0829 5.0829 5.2301 5.2301 5.2666 5.2666 5.8236 5.8236 k = 0.0000 0.1608-0.0000 ( 13679 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.6940 -11.6940 -11.4282 -11.4282 -8.4417 -8.4417 -7.9499 -7.9499 -6.6033 -6.6033 -6.1683 -6.1683 -5.2911 -5.2911 -4.9925 -4.9925 -3.7792 -3.7792 -3.2435 -3.2435 -3.0893 -3.0893 -3.0603 -3.0603 -2.8471 -2.8471 -2.8170 -2.8170 -2.6080 -2.6080 -2.1189 -2.1189 -1.3762 -1.3762 -1.0281 -1.0281 3.8815 3.8815 5.0735 5.0735 5.2436 5.2436 5.2675 5.2675 5.7813 5.7813 k = 0.0000 0.1461-0.0000 ( 13675 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.6970 -11.6970 -11.4276 -11.4276 -8.4476 -8.4476 -7.9438 -7.9438 -6.5771 -6.5771 -6.1717 -6.1717 -5.2968 -5.2968 -4.9900 -4.9900 -3.7688 -3.7688 -3.2667 -3.2667 -3.0748 -3.0748 -3.0679 -3.0679 -2.8697 -2.8697 -2.8244 -2.8244 -2.6124 -2.6124 -2.1141 -2.1141 -1.3772 -1.3772 -1.0191 -1.0191 3.8549 3.8549 5.0633 5.0633 5.2235 5.2235 5.3073 5.3073 5.7402 5.7402 k = 0.0000 0.1315-0.0000 ( 13669 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.6998 -11.6998 -11.4271 -11.4271 -8.4531 -8.4531 -7.9383 -7.9383 -6.5505 -6.5505 -6.1765 -6.1765 -5.3020 -5.3020 -4.9877 -4.9877 -3.7587 -3.7587 -3.2880 -3.2880 -3.0753 -3.0753 -3.0602 -3.0602 -2.8917 -2.8917 -2.8324 -2.8324 -2.6165 -2.6165 -2.1095 -2.1095 -1.3783 -1.3783 -1.0106 -1.0106 3.8305 3.8305 5.0529 5.0529 5.2062 5.2062 5.3484 5.3484 5.7008 5.7008 k = 0.0000 0.1169-0.0000 ( 13663 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2723 -23.2723 -23.2716 -23.2716 -23.2663 -23.2663 -23.2652 -23.2652 -11.7023 -11.7023 -11.4266 -11.4266 -8.4581 -8.4581 -7.9332 -7.9332 -6.5239 -6.5239 -6.1828 -6.1828 -5.3068 -5.3068 -4.9857 -4.9857 -3.7490 -3.7490 -3.3070 -3.3070 -3.0826 -3.0826 -3.0454 -3.0454 -2.9129 -2.9129 -2.8409 -2.8409 -2.6203 -2.6203 -2.1053 -2.1053 -1.3793 -1.3793 -1.0026 -1.0026 3.8086 3.8086 5.0428 5.0428 5.1918 5.1918 5.3898 5.3898 5.6636 5.6636 k = 0.0000 0.1023-0.0000 ( 13671 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2663 -23.2663 -23.2652 -23.2652 -11.7047 -11.7047 -11.4262 -11.4262 -8.4626 -8.4626 -7.9286 -7.9286 -6.4974 -6.4974 -6.1906 -6.1906 -5.3111 -5.3111 -4.9840 -4.9840 -3.7399 -3.7399 -3.3239 -3.3239 -3.0894 -3.0894 -3.0305 -3.0305 -2.9328 -2.9328 -2.8501 -2.8501 -2.6237 -2.6237 -2.1015 -2.1015 -1.3804 -1.3804 -0.9954 -0.9954 3.7892 3.7892 5.0335 5.0335 5.1799 5.1799 5.4306 5.4306 5.6290 5.6290 k = 0.0000 0.0877-0.0000 ( 13685 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.7067 -11.7067 -11.4259 -11.4259 -8.4666 -8.4666 -7.9246 -7.9246 -6.4714 -6.4714 -6.1999 -6.1999 -5.3149 -5.3149 -4.9824 -4.9824 -3.7316 -3.7316 -3.3384 -3.3384 -3.0957 -3.0957 -3.0157 -3.0157 -2.9511 -2.9511 -2.8599 -2.8599 -2.6267 -2.6267 -2.0982 -2.0982 -1.3814 -1.3814 -0.9889 -0.9889 3.7723 3.7723 5.0250 5.0250 5.1706 5.1706 5.4698 5.4698 5.5976 5.5976 k = 0.0000 0.0731-0.0000 ( 13689 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.7085 -11.7085 -11.4256 -11.4256 -8.4700 -8.4700 -7.9212 -7.9212 -6.4463 -6.4463 -6.2105 -6.2105 -5.3182 -5.3182 -4.9812 -4.9812 -3.7243 -3.7243 -3.3506 -3.3506 -3.1014 -3.1014 -3.0009 -3.0009 -2.9673 -2.9673 -2.8703 -2.8703 -2.6293 -2.6293 -2.0954 -2.0954 -1.3823 -1.3823 -0.9833 -0.9833 3.7580 3.7580 5.0175 5.0175 5.1635 5.1635 5.5062 5.5062 5.5697 5.5697 k = 0.0000 0.0585-0.0000 ( 13705 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2716 -23.2716 -23.2664 -23.2664 -23.2652 -23.2652 -11.7100 -11.7100 -11.4254 -11.4254 -8.4728 -8.4728 -7.9183 -7.9183 -6.4224 -6.4224 -6.2221 -6.2221 -5.3209 -5.3209 -4.9801 -4.9801 -3.7180 -3.7180 -3.3605 -3.3605 -3.1062 -3.1062 -2.9863 -2.9863 -2.9810 -2.9810 -2.8813 -2.8813 -2.6314 -2.6314 -2.0930 -2.0930 -1.3830 -1.3830 -0.9787 -0.9787 3.7462 3.7462 5.0113 5.0113 5.1584 5.1584 5.5387 5.5387 5.5460 5.5460 k = 0.0000 0.0438-0.0000 ( 13721 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7112 -11.7112 -11.4252 -11.4252 -8.4749 -8.4749 -7.9161 -7.9161 -6.4006 -6.4006 -6.2343 -6.2343 -5.3230 -5.3230 -4.9793 -4.9793 -3.7129 -3.7129 -3.3682 -3.3682 -3.1101 -3.1101 -2.9922 -2.9922 -2.9718 -2.9718 -2.8928 -2.8928 -2.6331 -2.6331 -2.0911 -2.0911 -1.3836 -1.3836 -0.9750 -0.9750 3.7370 3.7370 5.0063 5.0063 5.1549 5.1549 5.5269 5.5269 5.5658 5.5658 k = 0.0000 0.0292-0.0000 ( 13719 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7120 -11.7120 -11.4251 -11.4251 -8.4765 -8.4765 -7.9145 -7.9145 -6.3820 -6.3820 -6.2459 -6.2459 -5.3245 -5.3245 -4.9788 -4.9788 -3.7092 -3.7092 -3.3736 -3.3736 -3.1130 -3.1130 -3.0003 -3.0003 -2.9577 -2.9577 -2.9048 -2.9048 -2.6343 -2.6343 -2.0898 -2.0898 -1.3841 -1.3841 -0.9723 -0.9723 3.7305 3.7305 5.0027 5.0027 5.1527 5.1527 5.5128 5.5128 5.5864 5.5864 k = 0.0000 0.0146-0.0000 ( 13717 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7125 -11.7125 -11.4250 -11.4250 -8.4775 -8.4775 -7.9136 -7.9136 -6.3687 -6.3687 -6.2550 -6.2550 -5.3254 -5.3254 -4.9784 -4.9784 -3.7069 -3.7069 -3.3768 -3.3768 -3.1148 -3.1148 -3.0053 -3.0053 -2.9439 -2.9439 -2.9173 -2.9173 -2.6350 -2.6350 -2.0890 -2.0890 -1.3844 -1.3844 -0.9707 -0.9707 3.7265 3.7265 5.0005 5.0005 5.1516 5.1516 5.5042 5.5042 5.5993 5.5993 k = 0.0000 0.0000 0.0000 ( 13725 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7127 -11.7127 -11.4249 -11.4249 -8.4778 -8.4778 -7.9132 -7.9132 -6.3637 -6.3637 -6.2586 -6.2586 -5.3257 -5.3257 -4.9783 -4.9783 -3.7062 -3.7062 -3.3779 -3.3779 -3.1154 -3.1154 -3.0069 -3.0069 -2.9318 -2.9318 -2.9290 -2.9290 -2.6352 -2.6352 -2.0887 -2.0887 -1.3845 -1.3845 -0.9702 -0.9702 3.7252 3.7252 4.9998 4.9998 5.1512 5.1512 5.5013 5.5013 5.6036 5.6036 k = 0.0000 0.0000 0.0000 ( 13725 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7127 -11.7127 -11.4249 -11.4249 -8.4778 -8.4778 -7.9132 -7.9132 -6.3637 -6.3637 -6.2586 -6.2586 -5.3257 -5.3257 -4.9783 -4.9783 -3.7062 -3.7062 -3.3779 -3.3779 -3.1154 -3.1154 -3.0069 -3.0069 -2.9318 -2.9318 -2.9290 -2.9290 -2.6352 -2.6352 -2.0887 -2.0887 -1.3845 -1.3845 -0.9702 -0.9702 3.7252 3.7252 4.9998 4.9998 5.1512 5.1512 5.5013 5.5013 5.6036 5.6036 k = 0.0000 0.0000 0.0150 ( 13719 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7123 -11.7123 -11.4255 -11.4255 -8.4769 -8.4769 -7.9141 -7.9141 -6.3635 -6.3635 -6.2587 -6.2587 -5.3252 -5.3252 -4.9790 -4.9790 -3.7062 -3.7062 -3.3795 -3.3795 -3.1136 -3.1136 -3.0061 -3.0061 -2.9319 -2.9319 -2.9290 -2.9290 -2.6342 -2.6342 -2.0895 -2.0895 -1.3845 -1.3845 -0.9715 -0.9715 3.7264 3.7264 4.9956 4.9956 5.1518 5.1518 5.4990 5.4990 5.6065 5.6065 k = 0.0000 0.0000 0.0300 ( 13711 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7111 -11.7111 -11.4270 -11.4270 -8.4744 -8.4744 -7.9169 -7.9169 -6.3628 -6.3628 -6.2589 -6.2589 -5.3238 -5.3238 -4.9809 -4.9809 -3.7064 -3.7064 -3.3843 -3.3843 -3.1083 -3.1083 -3.0038 -3.0038 -2.9323 -2.9323 -2.9292 -2.9292 -2.6310 -2.6310 -2.0916 -2.0916 -1.3846 -1.3846 -0.9753 -0.9753 3.7300 3.7300 4.9832 4.9832 5.1533 5.1533 5.4927 5.4927 5.6140 5.6140 k = 0.0000 0.0000 0.0450 ( 13707 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7091 -11.7091 -11.4295 -11.4295 -8.4701 -8.4701 -7.9214 -7.9214 -6.3617 -6.3617 -6.2594 -6.2594 -5.3216 -5.3216 -4.9840 -4.9840 -3.7066 -3.7066 -3.3919 -3.3919 -3.1000 -3.1000 -2.9999 -2.9999 -2.9329 -2.9329 -2.9294 -2.9294 -2.6257 -2.6257 -2.0953 -2.0953 -1.3847 -1.3847 -0.9816 -0.9816 3.7359 3.7359 4.9635 4.9635 5.1555 5.1555 5.4845 5.4845 5.6242 5.6242 k = 0.0000 0.0000 0.0600 ( 13699 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2664 -23.2664 -23.2652 -23.2652 -11.7064 -11.7064 -11.4329 -11.4329 -8.4642 -8.4642 -7.9277 -7.9277 -6.3602 -6.3602 -6.2600 -6.2600 -5.3184 -5.3184 -4.9884 -4.9884 -3.7068 -3.7068 -3.4019 -3.4019 -3.0891 -3.0891 -2.9946 -2.9946 -2.9336 -2.9336 -2.9297 -2.9297 -2.6185 -2.6185 -2.1004 -2.1004 -1.3848 -1.3848 -0.9902 -0.9902 3.7442 3.7442 4.9372 4.9372 5.1581 5.1581 5.4757 5.4757 5.6353 5.6353 k = 0.0000 0.0000 0.0749 ( 13693 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4483 -23.4483 -23.4474 -23.4474 -23.2723 -23.2723 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.7029 -11.7029 -11.4373 -11.4373 -8.4566 -8.4566 -7.9357 -7.9357 -6.3582 -6.3582 -6.2609 -6.2609 -5.3143 -5.3143 -4.9940 -4.9940 -3.7069 -3.7069 -3.4137 -3.4137 -3.0761 -3.0761 -2.9880 -2.9880 -2.9345 -2.9345 -2.9300 -2.9300 -2.6093 -2.6093 -2.1069 -2.1069 -1.3847 -1.3847 -1.0012 -1.0012 3.7548 3.7548 4.9052 4.9052 5.1610 5.1610 5.4674 5.4674 5.6461 5.6461 k = 0.0000 0.0000 0.0899 ( 13691 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2723 -23.2723 -23.2717 -23.2717 -23.2663 -23.2663 -23.2653 -23.2653 -11.6986 -11.6986 -11.4426 -11.4426 -8.4475 -8.4475 -7.9454 -7.9454 -6.3559 -6.3559 -6.2619 -6.2619 -5.3094 -5.3094 -5.0007 -5.0007 -3.7068 -3.7068 -3.4270 -3.4270 -3.0617 -3.0617 -2.9804 -2.9804 -2.9355 -2.9355 -2.9305 -2.9305 -2.5984 -2.5984 -2.1148 -2.1148 -1.3845 -1.3845 -1.0143 -1.0143 3.7679 3.7679 4.8684 4.8684 5.1643 5.1643 5.4602 5.4602 5.6554 5.6554 k = 0.0000 0.0000 0.1049 ( 13679 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4475 -23.4475 -23.2723 -23.2723 -23.2717 -23.2717 -23.2663 -23.2663 -23.2653 -23.2653 -11.6937 -11.6937 -11.4488 -11.4488 -8.4368 -8.4368 -7.9566 -7.9566 -6.3532 -6.3532 -6.2632 -6.2632 -5.3036 -5.3036 -5.0084 -5.0084 -3.7064 -3.7064 -3.4413 -3.4413 -3.0461 -3.0461 -2.9719 -2.9719 -2.9365 -2.9365 -2.9310 -2.9310 -2.5859 -2.5859 -2.1240 -2.1240 -1.3840 -1.3840 -1.0293 -1.0293 3.7833 3.7833 4.8275 4.8275 5.1681 5.1681 5.4543 5.4543 5.6629 5.6629 k = 0.0000 0.0000 0.1199 ( 13675 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4475 -23.4475 -23.2723 -23.2723 -23.2717 -23.2717 -23.2662 -23.2662 -23.2653 -23.2653 -11.6880 -11.6880 -11.4557 -11.4557 -8.4247 -8.4247 -7.9694 -7.9694 -6.3502 -6.3502 -6.2646 -6.2646 -5.2970 -5.2970 -5.0172 -5.0172 -3.7056 -3.7056 -3.4563 -3.4563 -3.0299 -3.0299 -2.9627 -2.9627 -2.9374 -2.9374 -2.9316 -2.9316 -2.5718 -2.5718 -2.1345 -2.1345 -1.3831 -1.3831 -1.0461 -1.0461 3.8010 3.8010 4.7833 4.7833 5.1728 5.1728 5.4498 5.4498 5.6682 5.6682 k = 0.0000 0.0000 0.1349 ( 13677 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4481 -23.4481 -23.4475 -23.4475 -23.2723 -23.2723 -23.2718 -23.2718 -23.2662 -23.2662 -23.2653 -23.2653 -11.6816 -11.6816 -11.4634 -11.4634 -8.4112 -8.4112 -7.9835 -7.9835 -6.3468 -6.3468 -6.2663 -6.2663 -5.2896 -5.2896 -5.0268 -5.0268 -3.7043 -3.7043 -3.4719 -3.4719 -3.0135 -3.0135 -2.9531 -2.9531 -2.9384 -2.9384 -2.9322 -2.9322 -2.5565 -2.5565 -2.1463 -2.1463 -1.3816 -1.3816 -1.0645 -1.0645 3.8211 3.8211 4.7365 4.7365 5.1785 5.1785 5.4465 5.4465 5.6714 5.6714 k = 0.0000 0.0000 0.1499 ( 13671 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4481 -23.4481 -23.4476 -23.4476 -23.2722 -23.2722 -23.2718 -23.2718 -23.2661 -23.2661 -23.2654 -23.2654 -11.6746 -11.6746 -11.4718 -11.4718 -8.3964 -8.3964 -7.9990 -7.9990 -6.3432 -6.3432 -6.2683 -6.2683 -5.2814 -5.2814 -5.0373 -5.0373 -3.7024 -3.7024 -3.4878 -3.4878 -2.9970 -2.9970 -2.9434 -2.9434 -2.9391 -2.9391 -2.9329 -2.9329 -2.5399 -2.5399 -2.1593 -2.1593 -1.3795 -1.3795 -1.0841 -1.0841 3.8436 3.8436 4.6876 4.6876 5.1855 5.1855 5.4439 5.4439 5.6729 5.6729 k = 0.0000 0.0000 0.1649 ( 13667 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4481 -23.4481 -23.4476 -23.4476 -23.2722 -23.2722 -23.2718 -23.2718 -23.2661 -23.2661 -23.2654 -23.2654 -11.6670 -11.6670 -11.4808 -11.4808 -8.3804 -8.3804 -8.0156 -8.0156 -6.3394 -6.3394 -6.2704 -6.2704 -5.2724 -5.2724 -5.0485 -5.0485 -3.6997 -3.6997 -3.5039 -3.5039 -2.9809 -2.9809 -2.9399 -2.9399 -2.9337 -2.9337 -2.9335 -2.9335 -2.5223 -2.5223 -2.1734 -2.1734 -1.3764 -1.3764 -1.1047 -1.1047 3.8684 3.8684 4.6374 4.6374 5.1939 5.1939 5.4415 5.4415 5.6736 5.6736 k = 0.0000 0.0000 0.1799 ( 13663 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2721 -23.2721 -23.2718 -23.2718 -23.2661 -23.2661 -23.2654 -23.2654 -11.6588 -11.6588 -11.4904 -11.4904 -8.3633 -8.3633 -8.0334 -8.0334 -6.3353 -6.3353 -6.2729 -6.2729 -5.2628 -5.2628 -5.0603 -5.0603 -3.6962 -3.6962 -3.5199 -3.5199 -2.9654 -2.9654 -2.9405 -2.9405 -2.9344 -2.9344 -2.9243 -2.9243 -2.5037 -2.5037 -2.1886 -2.1886 -1.3724 -1.3724 -1.1260 -1.1260 3.8955 3.8955 4.5863 4.5863 5.2038 5.2038 5.4384 5.4384 5.6745 5.6745 k = 0.0000 0.0000 0.1948 ( 13665 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2721 -23.2721 -23.2718 -23.2718 -23.2660 -23.2660 -23.2655 -23.2655 -11.6500 -11.6500 -11.5004 -11.5004 -8.3452 -8.3452 -8.0521 -8.0521 -6.3311 -6.3311 -6.2755 -6.2755 -5.2525 -5.2525 -5.0727 -5.0727 -3.6919 -3.6919 -3.5358 -3.5358 -2.9507 -2.9507 -2.9409 -2.9409 -2.9352 -2.9352 -2.9156 -2.9156 -2.4844 -2.4844 -2.2048 -2.2048 -1.3672 -1.3672 -1.1478 -1.1478 3.9249 3.9249 4.5347 4.5347 5.2152 5.2152 5.4338 5.4338 5.6770 5.6770 k = 0.0000 0.0000 0.2098 ( 13667 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2721 -23.2721 -23.2718 -23.2718 -23.2660 -23.2660 -23.2655 -23.2655 -11.6408 -11.6408 -11.5108 -11.5108 -8.3262 -8.3262 -8.0717 -8.0717 -6.3268 -6.3268 -6.2784 -6.2784 -5.2416 -5.2416 -5.0855 -5.0855 -3.6866 -3.6866 -3.5515 -3.5515 -2.9412 -2.9412 -2.9373 -2.9373 -2.9358 -2.9358 -2.9077 -2.9077 -2.4645 -2.4645 -2.2220 -2.2220 -1.3607 -1.3607 -1.1698 -1.1698 3.9566 3.9566 4.4831 4.4831 5.2283 5.2283 5.4268 5.4268 5.6822 5.6822 k = 0.0000 0.0000 0.2248 ( 13681 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2660 -23.2660 -23.2656 -23.2656 -11.6311 -11.6311 -11.5216 -11.5216 -8.3064 -8.3064 -8.0920 -8.0920 -6.3223 -6.3223 -6.2816 -6.2816 -5.2302 -5.2302 -5.0986 -5.0986 -3.6803 -3.6803 -3.5668 -3.5668 -2.9413 -2.9413 -2.9368 -2.9368 -2.9250 -2.9250 -2.9010 -2.9010 -2.4441 -2.4441 -2.2399 -2.2399 -1.3527 -1.3527 -1.1916 -1.1916 3.9905 3.9905 4.4319 4.4319 5.2429 5.2429 5.4169 5.4169 5.6911 5.6911 k = 0.0000 0.0000 0.2398 ( 13669 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2660 -23.2660 -23.2656 -23.2656 -11.6209 -11.6209 -11.5326 -11.5326 -8.2859 -8.2859 -8.1129 -8.1129 -6.3179 -6.3179 -6.2849 -6.2849 -5.2182 -5.2182 -5.1120 -5.1120 -3.6731 -3.6731 -3.5816 -3.5816 -2.9413 -2.9413 -2.9375 -2.9375 -2.9144 -2.9144 -2.8955 -2.8955 -2.4233 -2.4233 -2.2586 -2.2586 -1.3433 -1.3433 -1.2130 -1.2130 4.0265 4.0265 4.3814 4.3814 5.2590 5.2590 5.4042 5.4042 5.7042 5.7042 k = 0.0000 0.0000 0.2548 ( 13659 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2659 -23.2659 -23.2656 -23.2656 -11.6105 -11.6105 -11.5437 -11.5437 -8.2649 -8.2649 -8.1342 -8.1342 -6.3134 -6.3134 -6.2885 -6.2885 -5.2058 -5.2058 -5.1256 -5.1256 -3.6648 -3.6648 -3.5958 -3.5958 -2.9412 -2.9412 -2.9382 -2.9382 -2.9055 -2.9055 -2.8915 -2.8915 -2.4023 -2.4023 -2.2780 -2.2780 -1.3322 -1.3322 -1.2337 -1.2337 4.0646 4.0646 4.3317 4.3317 5.2764 5.2764 5.3888 5.3888 5.7215 5.7215 k = 0.0000 0.0000 0.2698 ( 13657 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2657 -23.2657 -11.5997 -11.5997 -11.5550 -11.5550 -8.2435 -8.2435 -8.1559 -8.1559 -6.3090 -6.3090 -6.2923 -6.2923 -5.1930 -5.1930 -5.1393 -5.1393 -3.6556 -3.6556 -3.6094 -3.6094 -2.9409 -2.9409 -2.9389 -2.9389 -2.8984 -2.8984 -2.8891 -2.8891 -2.3812 -2.3812 -2.2979 -2.2979 -1.3195 -1.3195 -1.2534 -1.2534 4.1047 4.1047 4.2833 4.2833 5.2948 5.2948 5.3715 5.3715 5.7427 5.7427 k = 0.0000 0.0000 0.2848 ( 13655 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2657 -23.2657 -11.5887 -11.5887 -11.5663 -11.5663 -8.2217 -8.2217 -8.1778 -8.1778 -6.3047 -6.3047 -6.2963 -6.2963 -5.1798 -5.1798 -5.1529 -5.1529 -3.6454 -3.6454 -3.6222 -3.6222 -2.9406 -2.9406 -2.9395 -2.9395 -2.8932 -2.8932 -2.8886 -2.8886 -2.3600 -2.3600 -2.3183 -2.3183 -1.3052 -1.3052 -1.2721 -1.2721 4.1468 4.1468 4.2362 4.2362 5.3139 5.3139 5.3528 5.3528 5.7674 5.7674 k = 0.0000 0.0000 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5776 -11.5776 -11.5776 -11.5776 -8.1998 -8.1998 -8.1998 -8.1998 -6.3004 -6.3004 -6.3004 -6.3004 -5.1665 -5.1665 -5.1665 -5.1665 -3.6342 -3.6342 -3.6342 -3.6342 -2.9401 -2.9401 -2.9401 -2.9401 -2.8899 -2.8899 -2.8899 -2.8899 -2.3391 -2.3391 -2.3391 -2.3391 -1.2894 -1.2894 -1.2894 -1.2894 4.1906 4.1906 4.1906 4.1906 5.3334 5.3334 5.3334 5.3334 5.7950 5.7950 k = 0.0000 0.0000 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5776 -11.5776 -11.5776 -11.5776 -8.1998 -8.1998 -8.1998 -8.1998 -6.3004 -6.3004 -6.3004 -6.3004 -5.1665 -5.1665 -5.1665 -5.1665 -3.6342 -3.6342 -3.6342 -3.6342 -2.9401 -2.9401 -2.9401 -2.9401 -2.8899 -2.8899 -2.8899 -2.8899 -2.3391 -2.3391 -2.3391 -2.3391 -1.2894 -1.2894 -1.2894 -1.2894 4.1906 4.1906 4.1906 4.1906 5.3334 5.3334 5.3334 5.3334 5.7950 5.7950 k = 0.0147-0.0000 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5774 -11.5774 -11.5774 -11.5774 -8.1997 -8.1997 -8.1997 -8.1997 -6.3000 -6.3000 -6.3000 -6.3000 -5.1678 -5.1678 -5.1678 -5.1678 -3.6336 -3.6336 -3.6336 -3.6336 -2.9421 -2.9421 -2.9419 -2.9419 -2.8887 -2.8887 -2.8885 -2.8885 -2.3399 -2.3399 -2.3399 -2.3399 -1.2891 -1.2891 -1.2891 -1.2891 4.1932 4.1932 4.1932 4.1932 5.3334 5.3334 5.3334 5.3334 5.7950 5.7950 k = 0.0294-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5769 -11.5769 -11.5769 -11.5769 -8.1996 -8.1996 -8.1996 -8.1996 -6.2989 -6.2989 -6.2989 -6.2989 -5.1717 -5.1717 -5.1717 -5.1717 -3.6318 -3.6318 -3.6318 -3.6318 -2.9474 -2.9474 -2.9470 -2.9470 -2.8853 -2.8853 -2.8849 -2.8849 -2.3422 -2.3422 -2.3422 -2.3422 -1.2881 -1.2881 -1.2881 -1.2881 4.2007 4.2007 4.2007 4.2007 5.3333 5.3333 5.3333 5.3333 5.7951 5.7951 k = 0.0441-0.0000 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5760 -11.5760 -11.5760 -11.5760 -8.1992 -8.1992 -8.1992 -8.1992 -6.2971 -6.2971 -6.2971 -6.2971 -5.1782 -5.1782 -5.1782 -5.1782 -3.6289 -3.6289 -3.6289 -3.6289 -2.9552 -2.9552 -2.9547 -2.9547 -2.8805 -2.8805 -2.8799 -2.8799 -2.3462 -2.3462 -2.3461 -2.3461 -1.2866 -1.2866 -1.2866 -1.2866 4.2131 4.2131 4.2131 4.2131 5.3330 5.3330 5.3331 5.3331 5.7953 5.7954 k = 0.0588-0.0000 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2658 -23.2658 -11.5748 -11.5748 -11.5748 -11.5748 -8.1988 -8.1988 -8.1988 -8.1988 -6.2945 -6.2945 -6.2945 -6.2945 -5.1872 -5.1872 -5.1872 -5.1872 -3.6248 -3.6248 -3.6248 -3.6248 -2.9650 -2.9650 -2.9645 -2.9645 -2.8749 -2.8749 -2.8743 -2.8743 -2.3515 -2.3515 -2.3515 -2.3515 -1.2844 -1.2844 -1.2844 -1.2844 4.2304 4.2304 4.2304 4.2304 5.3327 5.3327 5.3327 5.3327 5.7956 5.7956 k = 0.0735-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2658 -23.2658 -11.5733 -11.5733 -11.5733 -11.5733 -8.1983 -8.1983 -8.1983 -8.1983 -6.2912 -6.2912 -6.2912 -6.2912 -5.1985 -5.1985 -5.1985 -5.1985 -3.6197 -3.6197 -3.6196 -3.6196 -2.9764 -2.9764 -2.9759 -2.9759 -2.8690 -2.8690 -2.8682 -2.8682 -2.3582 -2.3582 -2.3582 -2.3582 -1.2817 -1.2817 -1.2817 -1.2817 4.2525 4.2525 4.2525 4.2525 5.3321 5.3321 5.3322 5.3322 5.7961 5.7961 k = 0.0882-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2658 -23.2658 -11.5714 -11.5714 -11.5714 -11.5714 -8.1976 -8.1976 -8.1976 -8.1976 -6.2873 -6.2873 -6.2872 -6.2872 -5.2120 -5.2120 -5.2120 -5.2120 -3.6136 -3.6136 -3.6135 -3.6135 -2.9892 -2.9892 -2.9887 -2.9887 -2.8628 -2.8628 -2.8621 -2.8621 -2.3660 -2.3660 -2.3660 -2.3660 -1.2785 -1.2785 -1.2785 -1.2785 4.2791 4.2791 4.2791 4.2791 5.3314 5.3314 5.3314 5.3314 5.7967 5.7967 k = 0.1029-0.0000 0.2998 ( 13662 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5693 -11.5693 -11.5693 -11.5693 -8.1969 -8.1969 -8.1969 -8.1969 -6.2827 -6.2827 -6.2826 -6.2826 -5.2275 -5.2275 -5.2275 -5.2275 -3.6065 -3.6065 -3.6064 -3.6064 -3.0034 -3.0034 -3.0029 -3.0029 -2.8568 -2.8568 -2.8561 -2.8561 -2.3748 -2.3748 -2.3748 -2.3748 -1.2748 -1.2748 -1.2748 -1.2748 4.3100 4.3100 4.3101 4.3101 5.3304 5.3304 5.3305 5.3305 5.7974 5.7975 k = 0.1176-0.0000 0.2998 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5668 -11.5668 -11.5668 -11.5668 -8.1961 -8.1961 -8.1961 -8.1961 -6.2774 -6.2774 -6.2773 -6.2773 -5.2447 -5.2447 -5.2447 -5.2447 -3.5986 -3.5986 -3.5985 -3.5985 -3.0188 -3.0188 -3.0183 -3.0183 -2.8510 -2.8510 -2.8503 -2.8503 -2.3843 -2.3843 -2.3843 -2.3843 -1.2707 -1.2707 -1.2707 -1.2707 4.3451 4.3451 4.3451 4.3451 5.3292 5.3292 5.3292 5.3292 5.7985 5.7986 k = 0.1324-0.0000 0.2998 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5641 -11.5641 -11.5641 -11.5641 -8.1951 -8.1951 -8.1951 -8.1951 -6.2715 -6.2715 -6.2714 -6.2714 -5.2635 -5.2635 -5.2635 -5.2635 -3.5900 -3.5900 -3.5899 -3.5899 -3.0354 -3.0354 -3.0349 -3.0349 -2.8457 -2.8457 -2.8450 -2.8450 -2.3943 -2.3943 -2.3943 -2.3943 -1.2663 -1.2663 -1.2663 -1.2663 4.3839 4.3839 4.3840 4.3840 5.3277 5.3277 5.3277 5.3277 5.7998 5.7999 k = 0.1471-0.0000 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5612 -11.5612 -11.5612 -11.5612 -8.1942 -8.1942 -8.1942 -8.1942 -6.2651 -6.2651 -6.2650 -6.2650 -5.2837 -5.2837 -5.2836 -5.2836 -3.5806 -3.5806 -3.5805 -3.5805 -3.0529 -3.0529 -3.0525 -3.0525 -2.8412 -2.8412 -2.8404 -2.8404 -2.4046 -2.4046 -2.4045 -2.4045 -1.2616 -1.2616 -1.2616 -1.2616 4.4262 4.4262 4.4262 4.4262 5.3260 5.3260 5.3260 5.3260 5.8016 5.8016 k = 0.1618-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2659 -23.2659 -11.5580 -11.5580 -11.5580 -11.5580 -8.1931 -8.1931 -8.1931 -8.1931 -6.2582 -6.2582 -6.2580 -6.2580 -5.3049 -5.3049 -5.3049 -5.3049 -3.5707 -3.5707 -3.5706 -3.5706 -3.0714 -3.0714 -3.0711 -3.0711 -2.8376 -2.8376 -2.8368 -2.8368 -2.4146 -2.4146 -2.4146 -2.4146 -1.2566 -1.2566 -1.2566 -1.2566 4.4713 4.4713 4.4714 4.4714 5.3242 5.3242 5.3242 5.3242 5.8037 5.8037 k = 0.1765-0.0000 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2660 -23.2660 -11.5547 -11.5547 -11.5547 -11.5547 -8.1920 -8.1920 -8.1920 -8.1920 -6.2507 -6.2507 -6.2506 -6.2506 -5.3270 -5.3270 -5.3270 -5.3270 -3.5603 -3.5603 -3.5602 -3.5602 -3.0907 -3.0907 -3.0904 -3.0904 -2.8353 -2.8353 -2.8345 -2.8345 -2.4243 -2.4243 -2.4243 -2.4243 -1.2515 -1.2515 -1.2514 -1.2514 4.5188 4.5188 4.5189 4.5189 5.3226 5.3226 5.3226 5.3226 5.8064 5.8064 k = 0.1912-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2660 -23.2660 -11.5511 -11.5511 -11.5511 -11.5511 -8.1909 -8.1909 -8.1909 -8.1909 -6.2429 -6.2429 -6.2428 -6.2428 -5.3498 -5.3498 -5.3498 -5.3498 -3.5494 -3.5494 -3.5493 -3.5493 -3.1106 -3.1106 -3.1103 -3.1103 -2.8346 -2.8346 -2.8338 -2.8338 -2.4332 -2.4332 -2.4331 -2.4331 -1.2462 -1.2462 -1.2462 -1.2462 4.5681 4.5681 4.5682 4.5682 5.3213 5.3213 5.3213 5.3213 5.8097 5.8097 k = 0.2059-0.0000 0.2998 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2660 -23.2660 -11.5475 -11.5475 -11.5475 -11.5475 -8.1897 -8.1897 -8.1897 -8.1897 -6.2347 -6.2347 -6.2346 -6.2346 -5.3730 -5.3730 -5.3730 -5.3730 -3.5382 -3.5382 -3.5381 -3.5381 -3.1309 -3.1309 -3.1306 -3.1306 -2.8357 -2.8357 -2.8349 -2.8349 -2.4409 -2.4409 -2.4409 -2.4409 -1.2408 -1.2408 -1.2408 -1.2408 4.6182 4.6182 4.6183 4.6183 5.3209 5.3209 5.3209 5.3209 5.8136 5.8136 k = 0.2206-0.0000 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2661 -23.2661 -11.5437 -11.5437 -11.5437 -11.5437 -8.1886 -8.1886 -8.1886 -8.1886 -6.2262 -6.2262 -6.2260 -6.2260 -5.3964 -5.3964 -5.3964 -5.3964 -3.5268 -3.5268 -3.5266 -3.5266 -3.1514 -3.1514 -3.1511 -3.1511 -2.8389 -2.8389 -2.8381 -2.8381 -2.4474 -2.4474 -2.4473 -2.4473 -1.2355 -1.2355 -1.2355 -1.2355 4.6682 4.6682 4.6684 4.6684 5.3219 5.3219 5.3219 5.3219 5.8183 5.8183 k = 0.2353-0.0000 0.2998 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2661 -23.2661 -11.5398 -11.5398 -11.5398 -11.5398 -8.1874 -8.1874 -8.1874 -8.1874 -6.2174 -6.2174 -6.2173 -6.2173 -5.4198 -5.4198 -5.4198 -5.4198 -3.5151 -3.5151 -3.5150 -3.5150 -3.1720 -3.1720 -3.1717 -3.1717 -2.8443 -2.8443 -2.8435 -2.8435 -2.4523 -2.4523 -2.4523 -2.4523 -1.2301 -1.2301 -1.2301 -1.2301 4.7170 4.7170 4.7172 4.7172 5.3251 5.3251 5.3252 5.3252 5.8236 5.8236 k = 0.2500-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2661 -23.2661 -11.5359 -11.5359 -11.5359 -11.5359 -8.1862 -8.1862 -8.1862 -8.1862 -6.2085 -6.2085 -6.2083 -6.2083 -5.4430 -5.4430 -5.4430 -5.4430 -3.5034 -3.5034 -3.5033 -3.5033 -3.1922 -3.1922 -3.1919 -3.1919 -2.8520 -2.8520 -2.8512 -2.8512 -2.4556 -2.4556 -2.4556 -2.4556 -1.2249 -1.2249 -1.2249 -1.2249 4.7631 4.7631 4.7633 4.7633 5.3314 5.3314 5.3315 5.3315 5.8297 5.8297 k = 0.2647-0.0000 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2662 -23.2662 -23.2662 -23.2662 -11.5320 -11.5320 -11.5320 -11.5320 -8.1851 -8.1851 -8.1851 -8.1851 -6.1994 -6.1994 -6.1993 -6.1993 -5.4658 -5.4658 -5.4658 -5.4658 -3.4919 -3.4919 -3.4917 -3.4917 -3.2119 -3.2119 -3.2116 -3.2116 -2.8619 -2.8619 -2.8611 -2.8611 -2.4574 -2.4574 -2.4573 -2.4573 -1.2197 -1.2197 -1.2197 -1.2197 4.8052 4.8052 4.8054 4.8054 5.3419 5.3419 5.3420 5.3420 5.8366 5.8366 k = 0.2794-0.0000 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2662 -23.2662 -23.2662 -23.2662 -11.5281 -11.5281 -11.5281 -11.5281 -8.1840 -8.1840 -8.1840 -8.1840 -6.1904 -6.1904 -6.1902 -6.1902 -5.4881 -5.4881 -5.4881 -5.4881 -3.4807 -3.4807 -3.4805 -3.4805 -3.2307 -3.2307 -3.2304 -3.2304 -2.8740 -2.8740 -2.8732 -2.8732 -2.4576 -2.4576 -2.4575 -2.4575 -1.2147 -1.2147 -1.2147 -1.2147 4.8418 4.8418 4.8420 4.8420 5.3574 5.3574 5.3576 5.3576 5.8442 5.8442 k = 0.2941-0.0000 0.2998 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2662 -23.2662 -23.2662 -23.2662 -11.5242 -11.5242 -11.5242 -11.5242 -8.1829 -8.1829 -8.1829 -8.1829 -6.1814 -6.1814 -6.1812 -6.1812 -5.5097 -5.5097 -5.5097 -5.5097 -3.4701 -3.4701 -3.4699 -3.4699 -3.2480 -3.2480 -3.2477 -3.2477 -2.8881 -2.8881 -2.8873 -2.8873 -2.4565 -2.4565 -2.4565 -2.4565 -1.2098 -1.2098 -1.2098 -1.2098 4.8718 4.8718 4.8721 4.8721 5.3786 5.3786 5.3788 5.3788 5.8526 5.8526 k = 0.3088-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.5205 -11.5205 -11.5205 -11.5205 -8.1819 -8.1819 -8.1819 -8.1819 -6.1725 -6.1725 -6.1724 -6.1724 -5.5304 -5.5304 -5.5304 -5.5304 -3.4605 -3.4605 -3.4604 -3.4604 -3.2633 -3.2633 -3.2630 -3.2630 -2.9038 -2.9038 -2.9030 -2.9030 -2.4543 -2.4543 -2.4543 -2.4543 -1.2052 -1.2052 -1.2052 -1.2052 4.8949 4.8949 4.8952 4.8952 5.4052 5.4052 5.4054 5.4054 5.8617 5.8617 k = 0.3235-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.5168 -11.5168 -11.5168 -11.5168 -8.1809 -8.1809 -8.1809 -8.1809 -6.1638 -6.1638 -6.1637 -6.1637 -5.5501 -5.5501 -5.5501 -5.5501 -3.4525 -3.4525 -3.4525 -3.4525 -3.2760 -3.2760 -3.2756 -3.2756 -2.9209 -2.9209 -2.9202 -2.9202 -2.4513 -2.4513 -2.4513 -2.4513 -1.2008 -1.2008 -1.2008 -1.2008 4.9112 4.9112 4.9116 4.9116 5.4365 5.4365 5.4368 5.4368 5.8715 5.8715 k = 0.3382-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.5133 -11.5133 -11.5133 -11.5133 -8.1800 -8.1800 -8.1800 -8.1800 -6.1555 -6.1555 -6.1553 -6.1553 -5.5687 -5.5687 -5.5687 -5.5687 -3.4468 -3.4468 -3.4468 -3.4468 -3.2851 -3.2851 -3.2847 -3.2847 -2.9393 -2.9393 -2.9385 -2.9385 -2.4477 -2.4477 -2.4477 -2.4477 -1.1966 -1.1966 -1.1966 -1.1966 4.9218 4.9218 4.9221 4.9221 5.4711 5.4711 5.4713 5.4713 5.8820 5.8820 k = 0.3529-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.5100 -11.5100 -11.5100 -11.5100 -8.1792 -8.1792 -8.1792 -8.1792 -6.1475 -6.1475 -6.1474 -6.1474 -5.5860 -5.5860 -5.5860 -5.5860 -3.4440 -3.4440 -3.4440 -3.4440 -3.2899 -3.2899 -3.2894 -3.2894 -2.9585 -2.9585 -2.9578 -2.9578 -2.4437 -2.4437 -2.4436 -2.4436 -1.1928 -1.1928 -1.1928 -1.1928 4.9276 4.9276 4.9279 4.9279 5.5072 5.5072 5.5074 5.5074 5.8931 5.8931 k = 0.3676-0.0000 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2719 -23.2719 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.5069 -11.5069 -11.5069 -11.5069 -8.1784 -8.1784 -8.1784 -8.1784 -6.1399 -6.1399 -6.1398 -6.1398 -5.6020 -5.6020 -5.6020 -5.6020 -3.4443 -3.4443 -3.4443 -3.4443 -3.2901 -3.2901 -3.2895 -3.2895 -2.9785 -2.9785 -2.9777 -2.9777 -2.4395 -2.4395 -2.4395 -2.4395 -1.1892 -1.1892 -1.1892 -1.1892 4.9299 4.9299 4.9301 4.9301 5.5432 5.5432 5.5434 5.5434 5.9046 5.9046 k = 0.3824-0.0000 0.2998 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2719 -23.2719 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.5041 -11.5041 -11.5041 -11.5041 -8.1777 -8.1777 -8.1777 -8.1777 -6.1330 -6.1330 -6.1329 -6.1329 -5.6166 -5.6166 -5.6166 -5.6166 -3.4474 -3.4474 -3.4473 -3.4473 -3.2858 -3.2858 -3.2852 -3.2852 -2.9989 -2.9989 -2.9982 -2.9982 -2.4353 -2.4353 -2.4353 -2.4353 -1.1860 -1.1860 -1.1860 -1.1860 4.9297 4.9297 4.9299 4.9299 5.5775 5.5775 5.5777 5.5777 5.9165 5.9165 k = 0.3971-0.0000 0.2998 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.5015 -11.5015 -11.5015 -11.5015 -8.1771 -8.1771 -8.1771 -8.1771 -6.1266 -6.1266 -6.1265 -6.1265 -5.6296 -5.6296 -5.6296 -5.6296 -3.4523 -3.4523 -3.4523 -3.4523 -3.2777 -3.2777 -3.2771 -3.2771 -3.0196 -3.0196 -3.0189 -3.0189 -2.4313 -2.4313 -2.4312 -2.4312 -1.1831 -1.1831 -1.1831 -1.1831 4.9279 4.9279 4.9281 4.9281 5.6090 5.6090 5.6092 5.6092 5.9284 5.9284 k = 0.4118-0.0000 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2719 -23.2719 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.4992 -11.4992 -11.4992 -11.4992 -8.1766 -8.1766 -8.1766 -8.1766 -6.1209 -6.1209 -6.1208 -6.1208 -5.6411 -5.6411 -5.6410 -5.6410 -3.4583 -3.4583 -3.4582 -3.4582 -3.2668 -3.2668 -3.2662 -3.2662 -3.0404 -3.0404 -3.0397 -3.0397 -2.4275 -2.4275 -2.4275 -2.4275 -1.1805 -1.1805 -1.1805 -1.1805 4.9252 4.9252 4.9254 4.9254 5.6369 5.6369 5.6370 5.6370 5.9401 5.9401 k = 0.4265-0.0000 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4973 -11.4973 -11.4972 -11.4972 -8.1761 -8.1761 -8.1761 -8.1761 -6.1160 -6.1160 -6.1159 -6.1159 -5.6508 -5.6508 -5.6508 -5.6508 -3.4644 -3.4644 -3.4643 -3.4643 -3.2537 -3.2537 -3.2531 -3.2531 -3.0612 -3.0612 -3.0605 -3.0605 -2.4242 -2.4242 -2.4242 -2.4242 -1.1784 -1.1784 -1.1784 -1.1784 4.9222 4.9222 4.9223 4.9223 5.6606 5.6606 5.6607 5.6607 5.9512 5.9512 k = 0.4412-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4956 -11.4956 -11.4956 -11.4956 -8.1757 -8.1757 -8.1757 -8.1757 -6.1119 -6.1119 -6.1118 -6.1118 -5.6589 -5.6589 -5.6589 -5.6589 -3.4700 -3.4700 -3.4700 -3.4700 -3.2391 -3.2391 -3.2384 -3.2384 -3.0817 -3.0817 -3.0810 -3.0810 -2.4213 -2.4213 -2.4213 -2.4213 -1.1766 -1.1766 -1.1766 -1.1766 4.9192 4.9192 4.9193 4.9193 5.6800 5.6800 5.6800 5.6800 5.9611 5.9611 k = 0.4559-0.0000 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4943 -11.4943 -11.4943 -11.4943 -8.1754 -8.1754 -8.1754 -8.1754 -6.1086 -6.1086 -6.1086 -6.1086 -5.6652 -5.6652 -5.6652 -5.6652 -3.4748 -3.4748 -3.4747 -3.4747 -3.2234 -3.2234 -3.2228 -3.2228 -3.1018 -3.1018 -3.1011 -3.1011 -2.4190 -2.4190 -2.4190 -2.4190 -1.1752 -1.1752 -1.1752 -1.1752 4.9166 4.9166 4.9167 4.9167 5.6949 5.6949 5.6949 5.6949 5.9694 5.9694 k = 0.4706-0.0000 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4934 -11.4934 -11.4934 -11.4934 -8.1752 -8.1752 -8.1752 -8.1752 -6.1063 -6.1063 -6.1062 -6.1062 -5.6698 -5.6698 -5.6698 -5.6698 -3.4784 -3.4784 -3.4783 -3.4783 -3.2074 -3.2074 -3.2068 -3.2068 -3.1208 -3.1208 -3.1202 -3.1202 -2.4174 -2.4174 -2.4174 -2.4174 -1.1742 -1.1742 -1.1742 -1.1742 4.9146 4.9146 4.9146 4.9146 5.7054 5.7054 5.7055 5.7055 5.9757 5.9757 k = 0.4853-0.0000 0.2998 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4928 -11.4928 -11.4928 -11.4928 -8.1751 -8.1751 -8.1751 -8.1751 -6.1048 -6.1048 -6.1048 -6.1048 -5.6725 -5.6725 -5.6725 -5.6725 -3.4806 -3.4806 -3.4806 -3.4806 -3.1925 -3.1925 -3.1921 -3.1921 -3.1373 -3.1373 -3.1368 -3.1368 -2.4164 -2.4164 -2.4164 -2.4164 -1.1736 -1.1736 -1.1736 -1.1736 4.9133 4.9133 4.9133 4.9133 5.7117 5.7117 5.7117 5.7117 5.9796 5.9796 k = 0.5000-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4926 -11.4926 -11.4926 -11.4926 -8.1751 -8.1751 -8.1751 -8.1751 -6.1044 -6.1044 -6.1044 -6.1044 -5.6734 -5.6734 -5.6734 -5.6734 -3.4813 -3.4813 -3.4813 -3.4813 -3.1847 -3.1847 -3.1847 -3.1847 -3.1452 -3.1452 -3.1452 -3.1452 -2.4160 -2.4160 -2.4160 -2.4160 -1.1734 -1.1734 -1.1734 -1.1734 4.9129 4.9129 4.9129 4.9129 5.7138 5.7138 5.7138 5.7138 5.9810 5.9810 k = 0.5000-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4926 -11.4926 -11.4926 -11.4926 -8.1751 -8.1751 -8.1751 -8.1751 -6.1044 -6.1044 -6.1044 -6.1044 -5.6734 -5.6734 -5.6734 -5.6734 -3.4813 -3.4813 -3.4813 -3.4813 -3.1847 -3.1847 -3.1847 -3.1847 -3.1452 -3.1452 -3.1452 -3.1452 -2.4160 -2.4160 -2.4160 -2.4160 -1.1734 -1.1734 -1.1734 -1.1734 4.9129 4.9129 4.9129 4.9129 5.7138 5.7138 5.7138 5.7138 5.9810 5.9810 k = 0.5000 0.0146 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4926 -11.4926 -11.4926 -11.4926 -8.1750 -8.1750 -8.1750 -8.1750 -6.1051 -6.1051 -6.1051 -6.1051 -5.6733 -5.6733 -5.6733 -5.6733 -3.4832 -3.4832 -3.4832 -3.4832 -3.1834 -3.1834 -3.1834 -3.1834 -3.1441 -3.1441 -3.1441 -3.1441 -2.4158 -2.4158 -2.4158 -2.4158 -1.1736 -1.1736 -1.1736 -1.1736 4.9143 4.9143 4.9143 4.9143 5.7159 5.7159 5.7159 5.7159 5.9814 5.9814 k = 0.5000 0.0292 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4924 -11.4924 -11.4924 -11.4924 -8.1747 -8.1747 -8.1747 -8.1747 -6.1071 -6.1071 -6.1071 -6.1071 -5.6729 -5.6729 -5.6729 -5.6729 -3.4888 -3.4888 -3.4888 -3.4888 -3.1795 -3.1795 -3.1795 -3.1795 -3.1407 -3.1407 -3.1407 -3.1407 -2.4152 -2.4152 -2.4152 -2.4152 -1.1745 -1.1745 -1.1745 -1.1745 4.9187 4.9187 4.9187 4.9187 5.7223 5.7223 5.7223 5.7223 5.9828 5.9828 k = 0.5000 0.0438 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4922 -11.4922 -11.4922 -11.4922 -8.1743 -8.1743 -8.1743 -8.1743 -6.1106 -6.1106 -6.1106 -6.1106 -5.6722 -5.6722 -5.6722 -5.6722 -3.4977 -3.4977 -3.4977 -3.4977 -3.1735 -3.1735 -3.1735 -3.1735 -3.1350 -3.1350 -3.1350 -3.1350 -2.4142 -2.4142 -2.4142 -2.4142 -1.1759 -1.1759 -1.1759 -1.1759 4.9259 4.9259 4.9259 4.9259 5.7328 5.7328 5.7328 5.7328 5.9850 5.9850 k = 0.5000 0.0585 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4918 -11.4918 -11.4918 -11.4918 -8.1737 -8.1737 -8.1737 -8.1737 -6.1153 -6.1153 -6.1153 -6.1153 -5.6712 -5.6712 -5.6712 -5.6712 -3.5094 -3.5094 -3.5094 -3.5094 -3.1657 -3.1657 -3.1657 -3.1657 -3.1271 -3.1271 -3.1271 -3.1271 -2.4127 -2.4127 -2.4127 -2.4127 -1.1778 -1.1778 -1.1778 -1.1778 4.9359 4.9359 4.9359 4.9359 5.7474 5.7474 5.7474 5.7474 5.9882 5.9882 k = 0.5000 0.0731 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4914 -11.4914 -11.4914 -11.4914 -8.1730 -8.1730 -8.1730 -8.1730 -6.1212 -6.1212 -6.1212 -6.1212 -5.6700 -5.6700 -5.6700 -5.6700 -3.5235 -3.5235 -3.5235 -3.5235 -3.1566 -3.1566 -3.1566 -3.1566 -3.1172 -3.1172 -3.1172 -3.1172 -2.4110 -2.4110 -2.4110 -2.4110 -1.1802 -1.1802 -1.1802 -1.1802 4.9489 4.9489 4.9489 4.9489 5.7660 5.7660 5.7660 5.7660 5.9923 5.9923 k = 0.5000 0.0877 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4909 -11.4909 -11.4909 -11.4909 -8.1721 -8.1721 -8.1721 -8.1721 -6.1283 -6.1283 -6.1283 -6.1283 -5.6685 -5.6685 -5.6685 -5.6685 -3.5395 -3.5395 -3.5395 -3.5395 -3.1467 -3.1467 -3.1467 -3.1467 -3.1054 -3.1054 -3.1054 -3.1054 -2.4089 -2.4089 -2.4089 -2.4089 -1.1831 -1.1831 -1.1831 -1.1831 4.9646 4.9646 4.9646 4.9646 5.7884 5.7884 5.7884 5.7884 5.9973 5.9973 k = 0.5000 0.1023 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4903 -11.4903 -11.4903 -11.4903 -8.1711 -8.1711 -8.1711 -8.1711 -6.1364 -6.1364 -6.1364 -6.1364 -5.6669 -5.6669 -5.6669 -5.6669 -3.5568 -3.5568 -3.5568 -3.5568 -3.1363 -3.1363 -3.1363 -3.1363 -3.0918 -3.0918 -3.0918 -3.0918 -2.4065 -2.4065 -2.4065 -2.4065 -1.1864 -1.1864 -1.1864 -1.1864 4.9832 4.9832 4.9832 4.9832 5.8145 5.8145 5.8145 5.8145 6.0031 6.0031 k = 0.5000 0.1169 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4896 -11.4896 -11.4896 -11.4896 -8.1699 -8.1699 -8.1699 -8.1699 -6.1454 -6.1454 -6.1454 -6.1454 -5.6650 -5.6650 -5.6650 -5.6650 -3.5751 -3.5751 -3.5751 -3.5751 -3.1257 -3.1257 -3.1257 -3.1257 -3.0766 -3.0766 -3.0766 -3.0766 -2.4038 -2.4038 -2.4038 -2.4038 -1.1901 -1.1901 -1.1901 -1.1901 5.0044 5.0044 5.0044 5.0044 5.8440 5.8440 5.8440 5.8440 6.0099 6.0099 k = 0.5000 0.1315 0.2998 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4889 -11.4889 -11.4889 -11.4889 -8.1687 -8.1687 -8.1687 -8.1687 -6.1551 -6.1551 -6.1551 -6.1551 -5.6629 -5.6629 -5.6629 -5.6629 -3.5941 -3.5941 -3.5941 -3.5941 -3.1152 -3.1152 -3.1152 -3.1152 -3.0601 -3.0601 -3.0601 -3.0601 -2.4009 -2.4009 -2.4009 -2.4009 -1.1941 -1.1941 -1.1941 -1.1941 5.0284 5.0284 5.0284 5.0284 5.8768 5.8768 5.8768 5.8768 6.0175 6.0175 k = 0.5000 0.1461 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4881 -11.4881 -11.4881 -11.4881 -8.1673 -8.1673 -8.1673 -8.1673 -6.1655 -6.1655 -6.1655 -6.1655 -5.6606 -5.6606 -5.6606 -5.6606 -3.6135 -3.6135 -3.6135 -3.6135 -3.1049 -3.1049 -3.1049 -3.1049 -3.0423 -3.0423 -3.0423 -3.0423 -2.3979 -2.3979 -2.3979 -2.3979 -1.1984 -1.1984 -1.1984 -1.1984 5.0549 5.0549 5.0549 5.0549 5.9125 5.9125 5.9125 5.9125 6.0260 6.0260 k = 0.5000 0.1608 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4872 -11.4872 -11.4872 -11.4872 -8.1659 -8.1659 -8.1659 -8.1659 -6.1763 -6.1763 -6.1763 -6.1763 -5.6582 -5.6582 -5.6582 -5.6582 -3.6331 -3.6331 -3.6331 -3.6331 -3.0950 -3.0950 -3.0950 -3.0950 -3.0236 -3.0236 -3.0236 -3.0236 -2.3948 -2.3948 -2.3948 -2.3948 -1.2028 -1.2028 -1.2028 -1.2028 5.0838 5.0838 5.0838 5.0838 5.9510 5.9510 5.9510 5.9510 6.0352 6.0352 k = 0.5000 0.1754 0.2998 ( 13628 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4864 -11.4864 -11.4864 -11.4864 -8.1644 -8.1644 -8.1644 -8.1644 -6.1875 -6.1875 -6.1875 -6.1875 -5.6558 -5.6558 -5.6558 -5.6558 -3.6525 -3.6525 -3.6525 -3.6525 -3.0855 -3.0855 -3.0855 -3.0855 -3.0041 -3.0041 -3.0041 -3.0041 -2.3917 -2.3917 -2.3917 -2.3917 -1.2074 -1.2074 -1.2074 -1.2074 5.1149 5.1149 5.1149 5.1149 5.9919 5.9919 5.9919 5.9919 6.0453 6.0453 k = 0.5000 0.1900 0.2998 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4855 -11.4855 -11.4855 -11.4855 -8.1629 -8.1629 -8.1629 -8.1629 -6.1988 -6.1988 -6.1988 -6.1988 -5.6532 -5.6532 -5.6532 -5.6532 -3.6717 -3.6717 -3.6717 -3.6717 -3.0767 -3.0767 -3.0767 -3.0767 -2.9841 -2.9841 -2.9841 -2.9841 -2.3886 -2.3886 -2.3886 -2.3886 -1.2121 -1.2121 -1.2121 -1.2121 5.1481 5.1481 5.1481 5.1481 6.0351 6.0351 6.0351 6.0351 6.0561 6.0561 k = 0.5000 0.2046 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4846 -11.4846 -11.4846 -11.4846 -8.1613 -8.1613 -8.1613 -8.1613 -6.2102 -6.2102 -6.2102 -6.2102 -5.6506 -5.6506 -5.6506 -5.6506 -3.6905 -3.6905 -3.6905 -3.6905 -3.0684 -3.0684 -3.0684 -3.0684 -2.9638 -2.9638 -2.9638 -2.9638 -2.3856 -2.3856 -2.3856 -2.3856 -1.2168 -1.2168 -1.2168 -1.2168 5.1831 5.1831 5.1831 5.1831 6.0675 6.0675 6.0675 6.0675 6.0802 6.0802 k = 0.5000 0.2192 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4837 -11.4837 -11.4837 -11.4837 -8.1598 -8.1598 -8.1598 -8.1598 -6.2215 -6.2215 -6.2215 -6.2215 -5.6479 -5.6479 -5.6479 -5.6479 -3.7087 -3.7087 -3.7087 -3.7087 -3.0607 -3.0607 -3.0607 -3.0607 -2.9436 -2.9436 -2.9436 -2.9436 -2.3827 -2.3827 -2.3827 -2.3827 -1.2215 -1.2215 -1.2215 -1.2215 5.2196 5.2196 5.2196 5.2196 6.0796 6.0796 6.0796 6.0796 6.1269 6.1269 k = 0.5000 0.2338 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4828 -11.4828 -11.4828 -11.4828 -8.1582 -8.1582 -8.1582 -8.1582 -6.2325 -6.2325 -6.2325 -6.2325 -5.6453 -5.6453 -5.6453 -5.6453 -3.7260 -3.7260 -3.7260 -3.7260 -3.0537 -3.0537 -3.0537 -3.0537 -2.9235 -2.9235 -2.9235 -2.9235 -2.3800 -2.3800 -2.3800 -2.3800 -1.2260 -1.2260 -1.2260 -1.2260 5.2572 5.2572 5.2572 5.2572 6.0921 6.0921 6.0921 6.0921 6.1750 6.1750 k = 0.5000 0.2485 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4819 -11.4819 -11.4819 -11.4819 -8.1567 -8.1567 -8.1567 -8.1567 -6.2431 -6.2431 -6.2431 -6.2431 -5.6427 -5.6427 -5.6427 -5.6427 -3.7426 -3.7426 -3.7426 -3.7426 -3.0473 -3.0473 -3.0473 -3.0473 -2.9039 -2.9039 -2.9039 -2.9039 -2.3775 -2.3775 -2.3775 -2.3775 -1.2303 -1.2303 -1.2303 -1.2303 5.2956 5.2956 5.2956 5.2956 6.1050 6.1050 6.1050 6.1050 6.2242 6.2242 k = 0.5000 0.2631 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4810 -11.4810 -11.4810 -11.4810 -8.1553 -8.1553 -8.1553 -8.1553 -6.2533 -6.2533 -6.2533 -6.2533 -5.6403 -5.6403 -5.6403 -5.6403 -3.7581 -3.7581 -3.7581 -3.7581 -3.0416 -3.0416 -3.0416 -3.0416 -2.8849 -2.8849 -2.8849 -2.8849 -2.3754 -2.3754 -2.3754 -2.3754 -1.2345 -1.2345 -1.2345 -1.2345 5.3341 5.3341 5.3341 5.3341 6.1181 6.1181 6.1181 6.1181 6.2742 6.2742 k = 0.5000 0.2777 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4802 -11.4802 -11.4802 -11.4802 -8.1539 -8.1539 -8.1539 -8.1539 -6.2628 -6.2628 -6.2628 -6.2628 -5.6379 -5.6379 -5.6379 -5.6379 -3.7724 -3.7724 -3.7724 -3.7724 -3.0364 -3.0364 -3.0364 -3.0364 -2.8669 -2.8669 -2.8669 -2.8669 -2.3735 -2.3735 -2.3735 -2.3735 -1.2383 -1.2383 -1.2383 -1.2383 5.3723 5.3723 5.3723 5.3723 6.1312 6.1312 6.1312 6.1312 6.3248 6.3248 k = 0.5000 0.2923 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4795 -11.4795 -11.4795 -11.4795 -8.1526 -8.1526 -8.1526 -8.1526 -6.2716 -6.2716 -6.2716 -6.2716 -5.6357 -5.6357 -5.6357 -5.6357 -3.7856 -3.7856 -3.7856 -3.7856 -3.0319 -3.0319 -3.0319 -3.0319 -2.8499 -2.8499 -2.8499 -2.8499 -2.3719 -2.3719 -2.3719 -2.3719 -1.2418 -1.2418 -1.2418 -1.2418 5.4096 5.4096 5.4096 5.4096 6.1441 6.1441 6.1441 6.1441 6.3758 6.3758 k = 0.5000 0.3069 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4788 -11.4788 -11.4788 -11.4788 -8.1515 -8.1515 -8.1515 -8.1515 -6.2797 -6.2797 -6.2797 -6.2797 -5.6336 -5.6336 -5.6336 -5.6336 -3.7974 -3.7974 -3.7974 -3.7974 -3.0280 -3.0280 -3.0280 -3.0280 -2.8344 -2.8344 -2.8344 -2.8344 -2.3706 -2.3706 -2.3706 -2.3706 -1.2450 -1.2450 -1.2450 -1.2450 5.4452 5.4452 5.4452 5.4452 6.1566 6.1566 6.1566 6.1566 6.4268 6.4268 k = 0.5000 0.3215 0.2998 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4782 -11.4782 -11.4782 -11.4782 -8.1504 -8.1504 -8.1504 -8.1504 -6.2868 -6.2868 -6.2868 -6.2868 -5.6318 -5.6318 -5.6318 -5.6318 -3.8078 -3.8078 -3.8078 -3.8078 -3.0247 -3.0247 -3.0247 -3.0247 -2.8204 -2.8204 -2.8204 -2.8204 -2.3696 -2.3696 -2.3696 -2.3696 -1.2478 -1.2478 -1.2478 -1.2478 5.4783 5.4783 5.4783 5.4783 6.1684 6.1684 6.1684 6.1684 6.4776 6.4776 k = 0.5000 0.3361 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4777 -11.4777 -11.4777 -11.4777 -8.1495 -8.1495 -8.1495 -8.1495 -6.2929 -6.2929 -6.2929 -6.2929 -5.6302 -5.6302 -5.6302 -5.6302 -3.8168 -3.8168 -3.8168 -3.8168 -3.0219 -3.0219 -3.0219 -3.0219 -2.8082 -2.8082 -2.8082 -2.8082 -2.3689 -2.3689 -2.3689 -2.3689 -1.2502 -1.2502 -1.2502 -1.2502 5.5083 5.5083 5.5083 5.5083 6.1792 6.1792 6.1792 6.1792 6.5279 6.5279 k = 0.5000 0.3508 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4772 -11.4772 -11.4772 -11.4772 -8.1487 -8.1487 -8.1487 -8.1487 -6.2980 -6.2980 -6.2980 -6.2980 -5.6289 -5.6289 -5.6289 -5.6289 -3.8242 -3.8242 -3.8242 -3.8242 -3.0196 -3.0196 -3.0196 -3.0196 -2.7979 -2.7979 -2.7979 -2.7979 -2.3684 -2.3684 -2.3684 -2.3684 -1.2522 -1.2522 -1.2522 -1.2522 5.5342 5.5342 5.5342 5.5342 6.1885 6.1885 6.1885 6.1885 6.5771 6.5771 k = 0.5000 0.3654 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4769 -11.4769 -11.4769 -11.4769 -8.1481 -8.1481 -8.1481 -8.1481 -6.3020 -6.3020 -6.3020 -6.3020 -5.6278 -5.6278 -5.6278 -5.6278 -3.8300 -3.8300 -3.8300 -3.8300 -3.0179 -3.0179 -3.0179 -3.0179 -2.7897 -2.7897 -2.7897 -2.7897 -2.3680 -2.3680 -2.3680 -2.3680 -1.2538 -1.2538 -1.2538 -1.2538 5.5554 5.5554 5.5554 5.5554 6.1963 6.1963 6.1963 6.1963 6.6241 6.6241 k = 0.5000 0.3800 0.2998 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4766 -11.4766 -11.4766 -11.4766 -8.1477 -8.1477 -8.1477 -8.1477 -6.3050 -6.3050 -6.3050 -6.3050 -5.6270 -5.6270 -5.6270 -5.6270 -3.8342 -3.8342 -3.8342 -3.8342 -3.0167 -3.0167 -3.0167 -3.0167 -2.7837 -2.7837 -2.7837 -2.7837 -2.3678 -2.3678 -2.3678 -2.3678 -1.2549 -1.2549 -1.2549 -1.2549 5.5710 5.5710 5.5710 5.5710 6.2020 6.2020 6.2020 6.2020 6.6665 6.6665 k = 0.5000 0.3946 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4765 -11.4765 -11.4765 -11.4765 -8.1474 -8.1474 -8.1474 -8.1474 -6.3067 -6.3067 -6.3067 -6.3067 -5.6266 -5.6266 -5.6266 -5.6266 -3.8367 -3.8367 -3.8367 -3.8367 -3.0159 -3.0159 -3.0159 -3.0159 -2.7801 -2.7801 -2.7801 -2.7801 -2.3677 -2.3677 -2.3677 -2.3677 -1.2556 -1.2556 -1.2556 -1.2556 5.5806 5.5806 5.5806 5.5806 6.2056 6.2056 6.2056 6.2056 6.6988 6.6988 k = 0.5000 0.4092 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4764 -11.4764 -11.4764 -11.4764 -8.1473 -8.1473 -8.1473 -8.1473 -6.3073 -6.3073 -6.3073 -6.3073 -5.6264 -5.6264 -5.6264 -5.6264 -3.8375 -3.8375 -3.8375 -3.8375 -3.0157 -3.0157 -3.0157 -3.0157 -2.7789 -2.7789 -2.7789 -2.7789 -2.3677 -2.3677 -2.3677 -2.3677 -1.2558 -1.2558 -1.2558 -1.2558 5.5839 5.5839 5.5839 5.5839 6.2068 6.2068 6.2068 6.2068 6.7116 6.7116 k = 0.5000 0.4092 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4764 -11.4764 -11.4764 -11.4764 -8.1473 -8.1473 -8.1473 -8.1473 -6.3073 -6.3073 -6.3073 -6.3073 -5.6264 -5.6264 -5.6264 -5.6264 -3.8375 -3.8375 -3.8375 -3.8375 -3.0157 -3.0157 -3.0157 -3.0157 -2.7789 -2.7789 -2.7789 -2.7789 -2.3677 -2.3677 -2.3677 -2.3677 -1.2558 -1.2558 -1.2558 -1.2558 5.5839 5.5839 5.5839 5.5839 6.2068 6.2068 6.2068 6.2068 6.7116 6.7116 k = 0.4853 0.4092 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4766 -11.4766 -11.4766 -11.4766 -8.1475 -8.1475 -8.1475 -8.1475 -6.3079 -6.3079 -6.3078 -6.3078 -5.6255 -5.6255 -5.6255 -5.6255 -3.8364 -3.8364 -3.8364 -3.8364 -3.0172 -3.0172 -3.0171 -3.0171 -2.7769 -2.7769 -2.7768 -2.7768 -2.3682 -2.3682 -2.3682 -2.3682 -1.2558 -1.2558 -1.2558 -1.2558 5.5810 5.5810 5.5811 5.5811 6.2060 6.2060 6.2062 6.2062 6.7129 6.7129 k = 0.4706 0.4092 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4771 -11.4771 -11.4770 -11.4770 -8.1479 -8.1479 -8.1479 -8.1479 -6.3095 -6.3095 -6.3095 -6.3095 -5.6227 -5.6227 -5.6226 -5.6226 -3.8329 -3.8329 -3.8329 -3.8329 -3.0216 -3.0216 -3.0214 -3.0214 -2.7711 -2.7711 -2.7709 -2.7709 -2.3699 -2.3699 -2.3699 -2.3699 -1.2558 -1.2558 -1.2558 -1.2558 5.5725 5.5725 5.5727 5.5727 6.2037 6.2037 6.2042 6.2042 6.7165 6.7165 k = 0.4559 0.4092 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4778 -11.4778 -11.4778 -11.4778 -8.1486 -8.1486 -8.1486 -8.1486 -6.3122 -6.3122 -6.3122 -6.3122 -5.6180 -5.6180 -5.6180 -5.6180 -3.8272 -3.8272 -3.8272 -3.8272 -3.0284 -3.0284 -3.0281 -3.0281 -2.7618 -2.7618 -2.7615 -2.7615 -2.3727 -2.3727 -2.3726 -2.3726 -1.2557 -1.2557 -1.2557 -1.2557 5.5588 5.5588 5.5591 5.5591 6.1994 6.1994 6.2001 6.2001 6.7220 6.7220 k = 0.4412 0.4092 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4790 -11.4790 -11.4789 -11.4789 -8.1496 -8.1496 -8.1496 -8.1496 -6.3160 -6.3160 -6.3160 -6.3160 -5.6115 -5.6115 -5.6115 -5.6115 -3.8192 -3.8192 -3.8192 -3.8192 -3.0371 -3.0371 -3.0367 -3.0367 -2.7495 -2.7495 -2.7492 -2.7492 -2.3765 -2.3765 -2.3765 -2.3765 -1.2557 -1.2557 -1.2557 -1.2557 5.5403 5.5403 5.5407 5.5407 6.1922 6.1922 6.1931 6.1931 6.7276 6.7276 k = 0.4265 0.4092 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4804 -11.4804 -11.4803 -11.4803 -8.1508 -8.1508 -8.1508 -8.1508 -6.3207 -6.3207 -6.3207 -6.3207 -5.6032 -5.6032 -5.6031 -5.6031 -3.8092 -3.8092 -3.8092 -3.8092 -3.0471 -3.0471 -3.0467 -3.0467 -2.7349 -2.7349 -2.7345 -2.7345 -2.3814 -2.3814 -2.3814 -2.3814 -1.2557 -1.2557 -1.2556 -1.2556 5.5178 5.5178 5.5182 5.5182 6.1813 6.1813 6.1824 6.1824 6.7267 6.7267 k = 0.4118 0.4092 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4820 -11.4820 -11.4820 -11.4820 -8.1523 -8.1523 -8.1523 -8.1523 -6.3264 -6.3264 -6.3263 -6.3263 -5.5931 -5.5931 -5.5931 -5.5931 -3.7972 -3.7972 -3.7972 -3.7972 -3.0580 -3.0580 -3.0576 -3.0576 -2.7183 -2.7183 -2.7179 -2.7179 -2.3874 -2.3874 -2.3873 -2.3873 -1.2556 -1.2556 -1.2556 -1.2556 5.4918 5.4918 5.4922 5.4922 6.1655 6.1655 6.1667 6.1667 6.7024 6.7024 k = 0.3971 0.4092 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.4840 -11.4840 -11.4840 -11.4840 -8.1540 -8.1540 -8.1540 -8.1540 -6.3329 -6.3329 -6.3328 -6.3328 -5.5814 -5.5814 -5.5814 -5.5814 -3.7833 -3.7833 -3.7833 -3.7833 -3.0695 -3.0695 -3.0690 -3.0690 -2.7002 -2.7002 -2.6998 -2.6998 -2.3944 -2.3944 -2.3943 -2.3943 -1.2556 -1.2556 -1.2555 -1.2555 5.4629 5.4629 5.4634 5.4634 6.1437 6.1437 6.1449 6.1449 6.6566 6.6566 k = 0.3824 0.4092 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.4862 -11.4862 -11.4862 -11.4862 -8.1560 -8.1560 -8.1560 -8.1560 -6.3401 -6.3401 -6.3401 -6.3401 -5.5681 -5.5681 -5.5681 -5.5681 -3.7678 -3.7678 -3.7677 -3.7677 -3.0811 -3.0811 -3.0806 -3.0806 -2.6810 -2.6810 -2.6805 -2.6805 -2.4023 -2.4023 -2.4023 -2.4023 -1.2555 -1.2555 -1.2555 -1.2555 5.4317 5.4317 5.4322 5.4322 6.1146 6.1146 6.1159 6.1159 6.6052 6.6052 k = 0.3676 0.4092 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.4886 -11.4886 -11.4886 -11.4886 -8.1582 -8.1582 -8.1582 -8.1582 -6.3481 -6.3481 -6.3480 -6.3480 -5.5533 -5.5533 -5.5532 -5.5532 -3.7507 -3.7507 -3.7507 -3.7507 -3.0928 -3.0928 -3.0923 -3.0923 -2.6608 -2.6608 -2.6603 -2.6603 -2.4112 -2.4112 -2.4112 -2.4112 -1.2555 -1.2555 -1.2554 -1.2554 5.3988 5.3988 5.3993 5.3993 6.0774 6.0774 6.0787 6.0787 6.5545 6.5545 k = 0.3529 0.4092 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2664 -23.2664 -23.2664 -23.2664 -11.4913 -11.4913 -11.4912 -11.4912 -8.1606 -8.1606 -8.1606 -8.1606 -6.3566 -6.3566 -6.3565 -6.3565 -5.5370 -5.5370 -5.5369 -5.5369 -3.7324 -3.7324 -3.7323 -3.7323 -3.1042 -3.1042 -3.1036 -3.1036 -2.6399 -2.6399 -2.6394 -2.6394 -2.4210 -2.4210 -2.4209 -2.4209 -1.2554 -1.2554 -1.2554 -1.2554 5.3646 5.3646 5.3651 5.3651 6.0317 6.0317 6.0330 6.0330 6.5068 6.5068 k = 0.3382 0.4092 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.4941 -11.4941 -11.4941 -11.4941 -8.1631 -8.1631 -8.1631 -8.1631 -6.3656 -6.3656 -6.3655 -6.3655 -5.5194 -5.5194 -5.5193 -5.5193 -3.7130 -3.7130 -3.7129 -3.7129 -3.1152 -3.1152 -3.1146 -3.1146 -2.6184 -2.6184 -2.6180 -2.6180 -2.4317 -2.4317 -2.4316 -2.4316 -1.2554 -1.2554 -1.2554 -1.2554 5.3295 5.3295 5.3300 5.3300 5.9780 5.9780 5.9792 5.9792 6.4630 6.4630 k = 0.3235 0.4092 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.4971 -11.4971 -11.4971 -11.4971 -8.1658 -8.1658 -8.1658 -8.1658 -6.3750 -6.3750 -6.3749 -6.3749 -5.5006 -5.5006 -5.5005 -5.5005 -3.6928 -3.6928 -3.6927 -3.6927 -3.1256 -3.1256 -3.1251 -3.1251 -2.5966 -2.5966 -2.5962 -2.5962 -2.4431 -2.4431 -2.4430 -2.4430 -1.2554 -1.2554 -1.2554 -1.2554 5.2937 5.2937 5.2942 5.2942 5.9171 5.9171 5.9182 5.9182 6.4232 6.4232 k = 0.3088 0.4092 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2663 -23.2663 -11.5002 -11.5002 -11.5002 -11.5002 -8.1686 -8.1686 -8.1686 -8.1686 -6.3847 -6.3847 -6.3846 -6.3846 -5.4807 -5.4807 -5.4806 -5.4806 -3.6721 -3.6721 -3.6720 -3.6720 -3.1354 -3.1354 -3.1348 -3.1348 -2.5746 -2.5746 -2.5741 -2.5741 -2.4552 -2.4552 -2.4551 -2.4551 -1.2554 -1.2554 -1.2554 -1.2554 5.2578 5.2578 5.2582 5.2582 5.8506 5.8506 5.8516 5.8516 6.3868 6.3868 k = 0.2941 0.4092 0.2998 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2663 -23.2663 -23.2662 -23.2662 -11.5034 -11.5034 -11.5034 -11.5034 -8.1716 -8.1716 -8.1716 -8.1716 -6.3945 -6.3945 -6.3945 -6.3945 -5.4598 -5.4598 -5.4597 -5.4597 -3.6511 -3.6511 -3.6510 -3.6510 -3.1443 -3.1443 -3.1437 -3.1437 -2.5526 -2.5526 -2.5521 -2.5521 -2.4679 -2.4679 -2.4678 -2.4678 -1.2555 -1.2555 -1.2554 -1.2554 5.2217 5.2217 5.2222 5.2222 5.7801 5.7801 5.7810 5.7810 6.3530 6.3530 k = 0.2794 0.4092 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4480 -23.4480 -23.2720 -23.2720 -23.2719 -23.2719 -23.2662 -23.2662 -23.2662 -23.2662 -11.5067 -11.5067 -11.5067 -11.5067 -8.1746 -8.1746 -8.1746 -8.1746 -6.4045 -6.4045 -6.4045 -6.4045 -5.4381 -5.4381 -5.4380 -5.4380 -3.6302 -3.6302 -3.6301 -3.6301 -3.1522 -3.1522 -3.1516 -3.1516 -2.5306 -2.5306 -2.5301 -2.5301 -2.4811 -2.4811 -2.4810 -2.4810 -1.2556 -1.2556 -1.2555 -1.2555 5.1859 5.1859 5.1864 5.1864 5.7072 5.7072 5.7080 5.7080 6.3210 6.3211 k = 0.2647 0.4092 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2662 -23.2662 -23.2662 -23.2662 -11.5100 -11.5100 -11.5100 -11.5100 -8.1777 -8.1777 -8.1777 -8.1777 -6.4145 -6.4145 -6.4145 -6.4145 -5.4158 -5.4158 -5.4157 -5.4157 -3.6097 -3.6097 -3.6096 -3.6096 -3.1589 -3.1589 -3.1583 -3.1583 -2.5097 -2.5097 -2.5090 -2.5090 -2.4940 -2.4940 -2.4940 -2.4940 -1.2557 -1.2557 -1.2556 -1.2556 5.1506 5.1506 5.1510 5.1510 5.6333 5.6333 5.6340 5.6340 6.2904 6.2904 k = 0.2500 0.4092 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2661 -23.2661 -11.5134 -11.5134 -11.5134 -11.5134 -8.1808 -8.1808 -8.1808 -8.1808 -6.4245 -6.4245 -6.4244 -6.4244 -5.3929 -5.3929 -5.3929 -5.3929 -3.5900 -3.5900 -3.5899 -3.5899 -3.1642 -3.1642 -3.1636 -3.1636 -2.5104 -2.5104 -2.5100 -2.5100 -2.4858 -2.4858 -2.4856 -2.4856 -1.2558 -1.2558 -1.2558 -1.2558 5.1158 5.1158 5.1161 5.1161 5.5596 5.5596 5.5602 5.5602 6.2606 6.2606 k = 0.2353 0.4092 0.2998 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2661 -23.2661 -11.5168 -11.5168 -11.5167 -11.5167 -8.1839 -8.1839 -8.1839 -8.1839 -6.4343 -6.4343 -6.4342 -6.4342 -5.3698 -5.3698 -5.3697 -5.3697 -3.5714 -3.5714 -3.5713 -3.5713 -3.1680 -3.1680 -3.1674 -3.1674 -2.5244 -2.5244 -2.5241 -2.5241 -2.4651 -2.4651 -2.4648 -2.4648 -1.2560 -1.2560 -1.2560 -1.2560 5.0817 5.0817 5.0821 5.0821 5.4869 5.4869 5.4874 5.4874 6.2314 6.2316 k = 0.2206 0.4092 0.2998 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2661 -23.2661 -23.2660 -23.2660 -11.5201 -11.5201 -11.5201 -11.5201 -8.1870 -8.1870 -8.1870 -8.1870 -6.4438 -6.4438 -6.4438 -6.4438 -5.3464 -5.3464 -5.3464 -5.3464 -3.5542 -3.5542 -3.5541 -3.5541 -3.1701 -3.1701 -3.1695 -3.1695 -2.5389 -2.5389 -2.5386 -2.5386 -2.4445 -2.4445 -2.4442 -2.4442 -1.2562 -1.2562 -1.2562 -1.2562 5.0486 5.0486 5.0489 5.0489 5.4162 5.4162 5.4166 5.4166 6.2028 6.2028 k = 0.2059 0.4092 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4479 -23.4479 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2660 -23.2660 -11.5233 -11.5233 -11.5233 -11.5233 -8.1901 -8.1901 -8.1901 -8.1901 -6.4531 -6.4531 -6.4531 -6.4531 -5.3232 -5.3232 -5.3231 -5.3231 -3.5388 -3.5388 -3.5387 -3.5387 -3.1704 -3.1704 -3.1698 -3.1698 -2.5536 -2.5536 -2.5533 -2.5533 -2.4245 -2.4245 -2.4242 -2.4242 -1.2564 -1.2564 -1.2564 -1.2564 5.0166 5.0166 5.0169 5.0169 5.3480 5.3480 5.3484 5.3484 6.1747 6.1747 k = 0.1912 0.4092 0.2998 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2660 -23.2660 -23.2659 -23.2659 -11.5265 -11.5265 -11.5265 -11.5265 -8.1931 -8.1931 -8.1930 -8.1930 -6.4620 -6.4620 -6.4620 -6.4620 -5.3002 -5.3002 -5.3002 -5.3002 -3.5254 -3.5254 -3.5253 -3.5253 -3.1689 -3.1689 -3.1683 -3.1683 -2.5682 -2.5682 -2.5679 -2.5679 -2.4052 -2.4052 -2.4049 -2.4049 -1.2567 -1.2567 -1.2567 -1.2567 4.9857 4.9857 4.9859 4.9859 5.2830 5.2830 5.2833 5.2833 6.1473 6.1473 k = 0.1765 0.4092 0.2998 ( 13612 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5295 -11.5295 -11.5295 -11.5295 -8.1959 -8.1959 -8.1959 -8.1959 -6.4705 -6.4705 -6.4705 -6.4705 -5.2777 -5.2777 -5.2776 -5.2776 -3.5141 -3.5141 -3.5140 -3.5140 -3.1654 -3.1654 -3.1649 -3.1649 -2.5826 -2.5826 -2.5824 -2.5824 -2.3868 -2.3868 -2.3865 -2.3865 -1.2570 -1.2570 -1.2569 -1.2569 4.9561 4.9561 4.9563 4.9563 5.2216 5.2216 5.2219 5.2219 6.1206 6.1206 k = 0.1618 0.4092 0.2998 ( 13616 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5324 -11.5324 -11.5324 -11.5324 -8.1987 -8.1987 -8.1987 -8.1987 -6.4785 -6.4785 -6.4785 -6.4785 -5.2559 -5.2559 -5.2558 -5.2558 -3.5050 -3.5050 -3.5048 -3.5048 -3.1603 -3.1603 -3.1597 -3.1597 -2.5968 -2.5968 -2.5965 -2.5965 -2.3694 -2.3694 -2.3691 -2.3691 -1.2573 -1.2573 -1.2572 -1.2572 4.9280 4.9280 4.9282 4.9282 5.1642 5.1642 5.1645 5.1645 6.0950 6.0950 k = 0.1471 0.4092 0.2998 ( 13616 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5351 -11.5351 -11.5351 -11.5351 -8.2013 -8.2013 -8.2013 -8.2013 -6.4860 -6.4860 -6.4860 -6.4860 -5.2350 -5.2350 -5.2349 -5.2349 -3.4979 -3.4979 -3.4977 -3.4977 -3.1537 -3.1537 -3.1532 -3.1532 -2.6104 -2.6104 -2.6101 -2.6101 -2.3530 -2.3530 -2.3528 -2.3528 -1.2576 -1.2576 -1.2576 -1.2576 4.9013 4.9013 4.9015 4.9015 5.1113 5.1113 5.1115 5.1115 6.0706 6.0706 k = 0.1324 0.4092 0.2998 ( 13628 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2659 -23.2659 -23.2659 -23.2659 -11.5377 -11.5377 -11.5376 -11.5376 -8.2037 -8.2037 -8.2037 -8.2037 -6.4929 -6.4929 -6.4929 -6.4929 -5.2152 -5.2152 -5.2151 -5.2151 -3.4926 -3.4926 -3.4925 -3.4925 -3.1460 -3.1460 -3.1454 -3.1454 -2.6235 -2.6235 -2.6232 -2.6232 -2.3379 -2.3379 -2.3377 -2.3377 -1.2579 -1.2579 -1.2579 -1.2579 4.8763 4.8763 4.8765 4.8765 5.0630 5.0630 5.0632 5.0632 6.0477 6.0477 k = 0.1176 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2658 -23.2658 -11.5400 -11.5400 -11.5400 -11.5400 -8.2059 -8.2059 -8.2059 -8.2059 -6.4992 -6.4992 -6.4992 -6.4992 -5.1967 -5.1967 -5.1967 -5.1967 -3.4890 -3.4890 -3.4889 -3.4889 -3.1375 -3.1375 -3.1370 -3.1370 -2.6357 -2.6357 -2.6355 -2.6355 -2.3241 -2.3241 -2.3239 -2.3239 -1.2582 -1.2582 -1.2582 -1.2582 4.8530 4.8530 4.8531 4.8531 5.0198 5.0198 5.0199 5.0199 6.0265 6.0265 k = 0.1029 0.4092 0.2998 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5421 -11.5421 -11.5421 -11.5421 -8.2079 -8.2079 -8.2079 -8.2079 -6.5049 -6.5049 -6.5048 -6.5048 -5.1798 -5.1798 -5.1798 -5.1798 -3.4866 -3.4866 -3.4866 -3.4866 -3.1287 -3.1287 -3.1283 -3.1283 -2.6471 -2.6471 -2.6468 -2.6468 -2.3116 -2.3116 -2.3114 -2.3114 -1.2585 -1.2585 -1.2585 -1.2585 4.8316 4.8316 4.8317 4.8317 4.9818 4.9818 4.9819 4.9819 6.0071 6.0071 k = 0.0882 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5439 -11.5439 -11.5439 -11.5439 -8.2097 -8.2097 -8.2097 -8.2097 -6.5098 -6.5098 -6.5098 -6.5098 -5.1647 -5.1647 -5.1647 -5.1647 -3.4853 -3.4853 -3.4852 -3.4852 -3.1201 -3.1201 -3.1197 -3.1197 -2.6574 -2.6574 -2.6571 -2.6571 -2.3006 -2.3006 -2.3005 -2.3005 -1.2588 -1.2588 -1.2588 -1.2588 4.8122 4.8122 4.8123 4.8123 4.9490 4.9490 4.9491 4.9491 5.9899 5.9899 k = 0.0735 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5455 -11.5455 -11.5455 -11.5455 -8.2112 -8.2112 -8.2112 -8.2112 -6.5140 -6.5140 -6.5140 -6.5140 -5.1516 -5.1516 -5.1516 -5.1516 -3.4847 -3.4847 -3.4846 -3.4846 -3.1120 -3.1120 -3.1116 -3.1116 -2.6664 -2.6664 -2.6662 -2.6662 -2.2912 -2.2912 -2.2911 -2.2911 -1.2591 -1.2591 -1.2590 -1.2590 4.7951 4.7951 4.7951 4.7951 4.9216 4.9216 4.9217 4.9217 5.9750 5.9750 k = 0.0588 0.4092 0.2998 ( 13628 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5468 -11.5468 -11.5468 -11.5468 -8.2125 -8.2125 -8.2125 -8.2125 -6.5175 -6.5175 -6.5175 -6.5175 -5.1406 -5.1406 -5.1405 -5.1405 -3.4845 -3.4845 -3.4845 -3.4845 -3.1048 -3.1048 -3.1045 -3.1045 -2.6741 -2.6741 -2.6739 -2.6739 -2.2834 -2.2834 -2.2833 -2.2833 -1.2593 -1.2593 -1.2593 -1.2593 4.7804 4.7804 4.7805 4.7805 4.8995 4.8995 4.8996 4.8996 5.9625 5.9625 k = 0.0441 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2657 -23.2657 -11.5479 -11.5479 -11.5479 -11.5479 -8.2135 -8.2135 -8.2135 -8.2135 -6.5203 -6.5203 -6.5203 -6.5203 -5.1318 -5.1318 -5.1318 -5.1318 -3.4846 -3.4846 -3.4846 -3.4846 -3.0988 -3.0988 -3.0986 -3.0986 -2.6802 -2.6802 -2.6801 -2.6801 -2.2773 -2.2773 -2.2772 -2.2772 -1.2595 -1.2595 -1.2594 -1.2594 4.7686 4.7686 4.7686 4.7686 4.8826 4.8826 4.8826 4.8826 5.9527 5.9528 k = 0.0294 0.4092 0.2998 ( 13616 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5486 -11.5486 -11.5486 -11.5486 -8.2142 -8.2142 -8.2142 -8.2142 -6.5222 -6.5222 -6.5222 -6.5222 -5.1255 -5.1255 -5.1255 -5.1255 -3.4848 -3.4848 -3.4848 -3.4848 -3.0943 -3.0943 -3.0942 -3.0942 -2.6847 -2.6847 -2.6846 -2.6846 -2.2729 -2.2729 -2.2728 -2.2728 -1.2596 -1.2596 -1.2596 -1.2596 4.7599 4.7599 4.7599 4.7599 4.8707 4.8707 4.8707 4.8707 5.9456 5.9457 k = 0.0147 0.4092 0.2998 ( 13616 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5491 -11.5491 -11.5491 -11.5491 -8.2147 -8.2147 -8.2147 -8.2147 -6.5234 -6.5234 -6.5234 -6.5234 -5.1217 -5.1217 -5.1217 -5.1217 -3.4850 -3.4850 -3.4850 -3.4850 -3.0916 -3.0916 -3.0915 -3.0915 -2.6874 -2.6874 -2.6874 -2.6874 -2.2702 -2.2702 -2.2702 -2.2702 -1.2597 -1.2597 -1.2597 -1.2597 4.7546 4.7546 4.7546 4.7546 4.8636 4.8636 4.8636 4.8636 5.9414 5.9414 k = 0.0000 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5492 -11.5492 -11.5492 -11.5492 -8.2148 -8.2148 -8.2148 -8.2148 -6.5238 -6.5238 -6.5238 -6.5238 -5.1204 -5.1204 -5.1204 -5.1204 -3.4850 -3.4850 -3.4850 -3.4850 -3.0906 -3.0906 -3.0906 -3.0906 -2.6883 -2.6883 -2.6883 -2.6883 -2.2693 -2.2693 -2.2693 -2.2693 -1.2597 -1.2597 -1.2597 -1.2597 4.7528 4.7528 4.7528 4.7528 4.8612 4.8612 4.8612 4.8612 5.9399 5.9399 k = 0.0000 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5492 -11.5492 -11.5492 -11.5492 -8.2148 -8.2148 -8.2148 -8.2148 -6.5238 -6.5238 -6.5238 -6.5238 -5.1204 -5.1204 -5.1204 -5.1204 -3.4850 -3.4850 -3.4850 -3.4850 -3.0906 -3.0906 -3.0906 -3.0906 -2.6883 -2.6883 -2.6883 -2.6883 -2.2693 -2.2693 -2.2693 -2.2693 -1.2597 -1.2597 -1.2597 -1.2597 4.7528 4.7528 4.7528 4.7528 4.8612 4.8612 4.8612 4.8612 5.9399 5.9399 k = 0.0000 0.3946 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5493 -11.5493 -11.5493 -11.5493 -8.2147 -8.2147 -8.2147 -8.2147 -6.5232 -6.5232 -6.5232 -6.5232 -5.1205 -5.1205 -5.1205 -5.1205 -3.4852 -3.4852 -3.4852 -3.4852 -3.0902 -3.0902 -3.0902 -3.0902 -2.6893 -2.6893 -2.6893 -2.6893 -2.2695 -2.2695 -2.2695 -2.2695 -1.2597 -1.2597 -1.2597 -1.2597 4.7521 4.7521 4.7521 4.7521 4.8608 4.8608 4.8608 4.8608 5.9414 5.9414 k = 0.0000 0.3800 0.2998 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5496 -11.5496 -11.5496 -11.5496 -8.2146 -8.2146 -8.2146 -8.2146 -6.5213 -6.5213 -6.5213 -6.5213 -5.1210 -5.1210 -5.1210 -5.1210 -3.4856 -3.4856 -3.4856 -3.4856 -3.0888 -3.0888 -3.0888 -3.0888 -2.6922 -2.6922 -2.6922 -2.6922 -2.2700 -2.2700 -2.2700 -2.2700 -1.2599 -1.2599 -1.2599 -1.2599 4.7494 4.7494 4.7494 4.7494 4.8601 4.8601 4.8601 4.8601 5.9454 5.9454 k = 0.0000 0.3654 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5500 -11.5500 -11.5500 -11.5500 -8.2143 -8.2143 -8.2143 -8.2143 -6.5182 -6.5182 -6.5182 -6.5182 -5.1217 -5.1217 -5.1217 -5.1217 -3.4863 -3.4863 -3.4863 -3.4863 -3.0867 -3.0867 -3.0867 -3.0867 -2.6970 -2.6970 -2.6970 -2.6970 -2.2709 -2.2709 -2.2709 -2.2709 -1.2601 -1.2601 -1.2601 -1.2601 4.7433 4.7433 4.7433 4.7433 4.8610 4.8610 4.8610 4.8610 5.9516 5.9516 k = 0.0000 0.3508 0.2998 ( 13630 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5506 -11.5506 -11.5506 -11.5506 -8.2139 -8.2139 -8.2139 -8.2139 -6.5140 -6.5140 -6.5140 -6.5140 -5.1227 -5.1227 -5.1227 -5.1227 -3.4874 -3.4874 -3.4874 -3.4874 -3.0836 -3.0836 -3.0836 -3.0836 -2.7035 -2.7035 -2.7035 -2.7035 -2.2722 -2.2722 -2.2722 -2.2722 -1.2604 -1.2604 -1.2604 -1.2604 4.7323 4.7323 4.7323 4.7323 4.8653 4.8653 4.8653 4.8653 5.9590 5.9590 k = 0.0000 0.3361 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5514 -11.5514 -11.5514 -11.5514 -8.2135 -8.2135 -8.2135 -8.2135 -6.5085 -6.5085 -6.5085 -6.5085 -5.1240 -5.1240 -5.1240 -5.1240 -3.4888 -3.4888 -3.4888 -3.4888 -3.0798 -3.0798 -3.0798 -3.0798 -2.7116 -2.7116 -2.7116 -2.7116 -2.2738 -2.2738 -2.2738 -2.2738 -1.2609 -1.2609 -1.2609 -1.2609 4.7156 4.7156 4.7156 4.7156 4.8743 4.8743 4.8743 4.8743 5.9666 5.9666 k = 0.0000 0.3215 0.2998 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5523 -11.5523 -11.5523 -11.5523 -8.2129 -8.2129 -8.2129 -8.2129 -6.5020 -6.5020 -6.5020 -6.5020 -5.1256 -5.1256 -5.1256 -5.1256 -3.4907 -3.4907 -3.4907 -3.4907 -3.0752 -3.0752 -3.0752 -3.0752 -2.7211 -2.7211 -2.7211 -2.7211 -2.2757 -2.2757 -2.2757 -2.2757 -1.2615 -1.2615 -1.2615 -1.2615 4.6937 4.6937 4.6937 4.6937 4.8881 4.8881 4.8881 4.8881 5.9731 5.9731 k = 0.0000 0.3069 0.2998 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5534 -11.5534 -11.5534 -11.5534 -8.2123 -8.2123 -8.2123 -8.2123 -6.4944 -6.4944 -6.4944 -6.4944 -5.1274 -5.1274 -5.1274 -5.1274 -3.4931 -3.4931 -3.4931 -3.4931 -3.0699 -3.0699 -3.0699 -3.0699 -2.7318 -2.7318 -2.7318 -2.7318 -2.2780 -2.2780 -2.2780 -2.2780 -1.2622 -1.2622 -1.2622 -1.2622 4.6676 4.6676 4.6676 4.6676 4.9062 4.9062 4.9062 4.9062 5.9773 5.9773 k = 0.0000 0.2923 0.2998 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5546 -11.5546 -11.5546 -11.5546 -8.2116 -8.2116 -8.2116 -8.2116 -6.4858 -6.4858 -6.4858 -6.4858 -5.1293 -5.1293 -5.1293 -5.1293 -3.4962 -3.4962 -3.4962 -3.4962 -3.0639 -3.0639 -3.0639 -3.0639 -2.7434 -2.7434 -2.7434 -2.7434 -2.2805 -2.2805 -2.2805 -2.2805 -1.2630 -1.2630 -1.2630 -1.2630 4.6384 4.6384 4.6384 4.6384 4.9280 4.9280 4.9280 4.9280 5.9783 5.9783 k = 0.0000 0.2777 0.2998 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5559 -11.5559 -11.5559 -11.5559 -8.2109 -8.2109 -8.2109 -8.2109 -6.4763 -6.4763 -6.4763 -6.4763 -5.1315 -5.1315 -5.1315 -5.1315 -3.4998 -3.4998 -3.4998 -3.4998 -3.0574 -3.0574 -3.0574 -3.0574 -2.7557 -2.7557 -2.7557 -2.7557 -2.2834 -2.2834 -2.2834 -2.2834 -1.2640 -1.2640 -1.2640 -1.2640 4.6071 4.6071 4.6071 4.6071 4.9527 4.9527 4.9527 4.9527 5.9751 5.9751 k = 0.0000 0.2631 0.2998 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5573 -11.5573 -11.5573 -11.5573 -8.2101 -8.2101 -8.2101 -8.2101 -6.4661 -6.4661 -6.4661 -6.4661 -5.1338 -5.1338 -5.1338 -5.1338 -3.5043 -3.5043 -3.5043 -3.5043 -3.0503 -3.0503 -3.0503 -3.0503 -2.7684 -2.7684 -2.7684 -2.7684 -2.2864 -2.2864 -2.2864 -2.2864 -1.2651 -1.2651 -1.2651 -1.2651 4.5744 4.5744 4.5744 4.5744 4.9800 4.9800 4.9800 4.9800 5.9675 5.9675 k = 0.0000 0.2485 0.2998 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2657 -23.2657 -23.2657 -23.2657 -11.5588 -11.5588 -11.5588 -11.5588 -8.2093 -8.2093 -8.2093 -8.2093 -6.4551 -6.4551 -6.4551 -6.4551 -5.1362 -5.1362 -5.1362 -5.1362 -3.5095 -3.5095 -3.5095 -3.5095 -3.0428 -3.0428 -3.0428 -3.0428 -2.7812 -2.7812 -2.7812 -2.7812 -2.2898 -2.2898 -2.2898 -2.2898 -1.2664 -1.2664 -1.2664 -1.2664 4.5411 4.5411 4.5411 4.5411 5.0092 5.0092 5.0092 5.0092 5.9558 5.9558 k = 0.0000 0.2338 0.2998 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5603 -11.5603 -11.5603 -11.5603 -8.2084 -8.2084 -8.2084 -8.2084 -6.4435 -6.4435 -6.4435 -6.4435 -5.1387 -5.1387 -5.1387 -5.1387 -3.5156 -3.5156 -3.5156 -3.5156 -3.0349 -3.0349 -3.0349 -3.0349 -2.7940 -2.7940 -2.7940 -2.7940 -2.2933 -2.2933 -2.2933 -2.2933 -1.2678 -1.2678 -1.2678 -1.2678 4.5076 4.5076 4.5076 4.5076 5.0398 5.0398 5.0398 5.0398 5.9405 5.9405 k = 0.0000 0.2192 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5619 -11.5619 -11.5619 -11.5619 -8.2076 -8.2076 -8.2076 -8.2076 -6.4315 -6.4315 -6.4315 -6.4315 -5.1413 -5.1413 -5.1413 -5.1413 -3.5225 -3.5225 -3.5225 -3.5225 -3.0267 -3.0267 -3.0267 -3.0267 -2.8063 -2.8063 -2.8063 -2.8063 -2.2970 -2.2970 -2.2970 -2.2970 -1.2694 -1.2694 -1.2694 -1.2694 4.4744 4.4744 4.4744 4.4744 5.0714 5.0714 5.0714 5.0714 5.9226 5.9226 k = 0.0000 0.2046 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5635 -11.5635 -11.5635 -11.5635 -8.2067 -8.2067 -8.2067 -8.2067 -6.4191 -6.4191 -6.4191 -6.4191 -5.1439 -5.1439 -5.1439 -5.1439 -3.5302 -3.5302 -3.5302 -3.5302 -3.0184 -3.0184 -3.0184 -3.0184 -2.8181 -2.8181 -2.8181 -2.8181 -2.3008 -2.3008 -2.3008 -2.3008 -1.2710 -1.2710 -1.2710 -1.2710 4.4419 4.4419 4.4419 4.4419 5.1032 5.1032 5.1032 5.1032 5.9030 5.9030 k = 0.0000 0.1900 0.2998 ( 13674 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5651 -11.5651 -11.5651 -11.5651 -8.2059 -8.2059 -8.2059 -8.2059 -6.4066 -6.4066 -6.4066 -6.4066 -5.1465 -5.1465 -5.1465 -5.1465 -3.5387 -3.5387 -3.5387 -3.5387 -3.0100 -3.0100 -3.0100 -3.0100 -2.8291 -2.8291 -2.8291 -2.8291 -2.3047 -2.3047 -2.3047 -2.3047 -1.2728 -1.2728 -1.2728 -1.2728 4.4105 4.4105 4.4105 4.4105 5.1349 5.1349 5.1349 5.1349 5.8830 5.8830 k = 0.0000 0.1754 0.2998 ( 13682 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5667 -11.5667 -11.5667 -11.5667 -8.2051 -8.2051 -8.2051 -8.2051 -6.3940 -6.3940 -6.3940 -6.3940 -5.1490 -5.1490 -5.1490 -5.1490 -3.5479 -3.5479 -3.5479 -3.5479 -3.0016 -3.0016 -3.0016 -3.0016 -2.8393 -2.8393 -2.8393 -2.8393 -2.3086 -2.3086 -2.3086 -2.3086 -1.2746 -1.2746 -1.2746 -1.2746 4.3805 4.3805 4.3805 4.3805 5.1657 5.1657 5.1657 5.1657 5.8634 5.8634 k = 0.0000 0.1608 0.2998 ( 13674 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5682 -11.5682 -11.5682 -11.5682 -8.2043 -8.2043 -8.2043 -8.2043 -6.3816 -6.3816 -6.3816 -6.3816 -5.1515 -5.1515 -5.1515 -5.1515 -3.5576 -3.5576 -3.5576 -3.5576 -2.9934 -2.9934 -2.9934 -2.9934 -2.8485 -2.8485 -2.8485 -2.8485 -2.3125 -2.3125 -2.3125 -2.3125 -1.2764 -1.2764 -1.2764 -1.2764 4.3521 4.3521 4.3521 4.3521 5.1950 5.1950 5.1950 5.1950 5.8453 5.8453 k = 0.0000 0.1461 0.2998 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5696 -11.5696 -11.5696 -11.5696 -8.2036 -8.2036 -8.2036 -8.2036 -6.3696 -6.3696 -6.3696 -6.3696 -5.1538 -5.1538 -5.1538 -5.1538 -3.5675 -3.5675 -3.5675 -3.5675 -2.9854 -2.9854 -2.9854 -2.9854 -2.8566 -2.8566 -2.8566 -2.8566 -2.3163 -2.3163 -2.3163 -2.3163 -1.2782 -1.2782 -1.2782 -1.2782 4.3254 4.3254 4.3254 4.3254 5.2223 5.2223 5.2223 5.2223 5.8292 5.8292 k = 0.0000 0.1315 0.2998 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5710 -11.5710 -11.5710 -11.5710 -8.2029 -8.2029 -8.2029 -8.2029 -6.3580 -6.3580 -6.3580 -6.3580 -5.1560 -5.1560 -5.1560 -5.1560 -3.5776 -3.5776 -3.5776 -3.5776 -2.9777 -2.9777 -2.9777 -2.9777 -2.8637 -2.8637 -2.8637 -2.8637 -2.3201 -2.3201 -2.3201 -2.3201 -1.2800 -1.2800 -1.2800 -1.2800 4.3008 4.3008 4.3008 4.3008 5.2468 5.2468 5.2468 5.2468 5.8158 5.8158 k = 0.0000 0.1169 0.2998 ( 13666 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5723 -11.5723 -11.5723 -11.5723 -8.2023 -8.2023 -8.2023 -8.2023 -6.3470 -6.3470 -6.3470 -6.3470 -5.1581 -5.1581 -5.1581 -5.1581 -3.5876 -3.5876 -3.5876 -3.5876 -2.9705 -2.9705 -2.9705 -2.9705 -2.8699 -2.8699 -2.8699 -2.8699 -2.3236 -2.3236 -2.3236 -2.3236 -1.2817 -1.2817 -1.2817 -1.2817 4.2784 4.2784 4.2784 4.2784 5.2683 5.2683 5.2683 5.2683 5.8055 5.8055 k = 0.0000 0.1023 0.2998 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5735 -11.5735 -11.5735 -11.5735 -8.2017 -8.2017 -8.2017 -8.2017 -6.3369 -6.3369 -6.3369 -6.3369 -5.1600 -5.1600 -5.1600 -5.1600 -3.5972 -3.5972 -3.5972 -3.5972 -2.9639 -2.9639 -2.9639 -2.9639 -2.8750 -2.8750 -2.8750 -2.8750 -2.3269 -2.3269 -2.3269 -2.3269 -1.2834 -1.2834 -1.2834 -1.2834 4.2583 4.2583 4.2583 4.2583 5.2864 5.2864 5.2864 5.2864 5.7982 5.7982 k = 0.0000 0.0877 0.2998 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5745 -11.5745 -11.5745 -11.5745 -8.2012 -8.2012 -8.2012 -8.2012 -6.3277 -6.3277 -6.3277 -6.3277 -5.1616 -5.1616 -5.1616 -5.1616 -3.6061 -3.6061 -3.6061 -3.6061 -2.9579 -2.9579 -2.9579 -2.9579 -2.8793 -2.8793 -2.8793 -2.8793 -2.3299 -2.3299 -2.3299 -2.3299 -1.2849 -1.2849 -1.2849 -1.2849 4.2407 4.2407 4.2407 4.2407 5.3011 5.3011 5.3011 5.3011 5.7938 5.7938 k = 0.0000 0.0731 0.2998 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5754 -11.5754 -11.5754 -11.5754 -8.2008 -8.2008 -8.2008 -8.2008 -6.3197 -6.3197 -6.3197 -6.3197 -5.1631 -5.1631 -5.1631 -5.1631 -3.6142 -3.6142 -3.6142 -3.6142 -2.9526 -2.9526 -2.9526 -2.9526 -2.8827 -2.8827 -2.8827 -2.8827 -2.3326 -2.3326 -2.3326 -2.3326 -1.2862 -1.2862 -1.2862 -1.2862 4.2256 4.2256 4.2256 4.2256 5.3125 5.3125 5.3125 5.3125 5.7918 5.7918 k = 0.0000 0.0585 0.2998 ( 13674 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5762 -11.5762 -11.5762 -11.5762 -8.2004 -8.2004 -8.2004 -8.2004 -6.3129 -6.3129 -6.3129 -6.3129 -5.1643 -5.1643 -5.1643 -5.1643 -3.6211 -3.6211 -3.6211 -3.6211 -2.9482 -2.9482 -2.9482 -2.9482 -2.8854 -2.8854 -2.8854 -2.8854 -2.3349 -2.3349 -2.3349 -2.3349 -1.2873 -1.2873 -1.2873 -1.2873 4.2131 4.2131 4.2131 4.2131 5.3209 5.3209 5.3209 5.3209 5.7916 5.7916 k = 0.0000 0.0438 0.2998 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5768 -11.5768 -11.5768 -11.5768 -8.2002 -8.2002 -8.2002 -8.2002 -6.3075 -6.3075 -6.3075 -6.3075 -5.1652 -5.1652 -5.1652 -5.1652 -3.6267 -3.6267 -3.6267 -3.6267 -2.9447 -2.9447 -2.9447 -2.9447 -2.8874 -2.8874 -2.8874 -2.8874 -2.3367 -2.3367 -2.3367 -2.3367 -1.2882 -1.2882 -1.2882 -1.2882 4.2033 4.2033 4.2033 4.2033 5.3268 5.3268 5.3268 5.3268 5.7924 5.7924 k = 0.0000 0.0292 0.2998 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5772 -11.5772 -11.5772 -11.5772 -8.2000 -8.2000 -8.2000 -8.2000 -6.3036 -6.3036 -6.3036 -6.3036 -5.1659 -5.1659 -5.1659 -5.1659 -3.6308 -3.6308 -3.6308 -3.6308 -2.9422 -2.9422 -2.9422 -2.9422 -2.8888 -2.8888 -2.8888 -2.8888 -2.3380 -2.3380 -2.3380 -2.3380 -1.2889 -1.2889 -1.2889 -1.2889 4.1963 4.1963 4.1963 4.1963 5.3306 5.3306 5.3306 5.3306 5.7936 5.7936 k = 0.0000 0.0146 0.2998 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2719 -23.2719 -23.2719 -23.2719 -23.2658 -23.2658 -23.2658 -23.2658 -11.5775 -11.5775 -11.5775 -11.5775 -8.1998 -8.1998 -8.1998 -8.1998 -6.3012 -6.3012 -6.3012 -6.3012 -5.1663 -5.1663 -5.1663 -5.1663 -3.6334 -3.6334 -3.6334 -3.6334 -2.9406 -2.9406 -2.9406 -2.9406 -2.8896 -2.8896 -2.8896 -2.8896 -2.3388 -2.3388 -2.3388 -2.3388 -1.2893 -1.2893 -1.2893 -1.2893 4.1921 4.1921 4.1921 4.1921 5.3327 5.3327 5.3327 5.3327 5.7946 5.7946 k = 0.0000 0.0000 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5776 -11.5776 -11.5776 -11.5776 -8.1998 -8.1998 -8.1998 -8.1998 -6.3004 -6.3004 -6.3004 -6.3004 -5.1665 -5.1665 -5.1665 -5.1665 -3.6342 -3.6342 -3.6342 -3.6342 -2.9401 -2.9401 -2.9401 -2.9401 -2.8899 -2.8899 -2.8899 -2.8899 -2.3391 -2.3391 -2.3391 -2.3391 -1.2894 -1.2894 -1.2894 -1.2894 4.1906 4.1906 4.1906 4.1906 5.3334 5.3334 5.3334 5.3334 5.7950 5.7950 k = 0.0000 0.4092-0.0000 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6526 -11.6526 -11.4387 -11.4387 -8.3446 -8.3446 -8.0483 -8.0483 -6.8617 -6.8617 -6.1938 -6.1938 -5.1955 -5.1955 -5.0471 -5.0471 -3.8939 -3.8939 -3.2325 -3.2325 -2.9818 -2.9818 -2.8284 -2.8284 -2.7643 -2.7643 -2.6658 -2.6658 -2.5403 -2.5403 -2.1925 -2.1925 -1.3822 -1.3822 -1.1366 -1.1366 4.3778 4.3778 4.9354 4.9354 5.1458 5.1458 5.2225 5.2225 5.7883 5.7883 k = 0.0000 0.4092 0.0150 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6523 -11.6523 -11.4391 -11.4391 -8.3442 -8.3442 -8.0489 -8.0489 -6.8606 -6.8606 -6.1948 -6.1948 -5.1952 -5.1952 -5.0473 -5.0473 -3.8927 -3.8927 -3.2321 -3.2321 -2.9841 -2.9841 -2.8272 -2.8272 -2.7669 -2.7669 -2.6657 -2.6657 -2.5379 -2.5379 -2.1926 -2.1926 -1.3819 -1.3819 -1.1368 -1.1368 4.3793 4.3793 4.9355 4.9355 5.1432 5.1432 5.2168 5.2168 5.7909 5.7909 k = 0.0000 0.4092 0.0300 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6513 -11.6513 -11.4402 -11.4402 -8.3432 -8.3432 -8.0506 -8.0506 -6.8575 -6.8575 -6.1978 -6.1978 -5.1945 -5.1945 -5.0480 -5.0480 -3.8891 -3.8891 -3.2312 -3.2312 -2.9909 -2.9909 -2.8239 -2.8239 -2.7742 -2.7742 -2.6653 -2.6653 -2.5310 -2.5310 -2.1930 -2.1930 -1.3811 -1.3811 -1.1376 -1.1376 4.3839 4.3839 4.9357 4.9357 5.1358 5.1358 5.2004 5.2004 5.7985 5.7985 k = 0.0000 0.4092 0.0450 ( 13646 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2663 -23.2663 -23.2652 -23.2652 -11.6498 -11.6498 -11.4419 -11.4419 -8.3415 -8.3415 -8.0534 -8.0534 -6.8522 -6.8522 -6.2028 -6.2028 -5.1934 -5.1934 -5.0491 -5.0491 -3.8832 -3.8832 -3.2296 -3.2296 -3.0017 -3.0017 -2.8190 -2.8190 -2.7854 -2.7854 -2.6648 -2.6648 -2.5206 -2.5206 -2.1935 -2.1935 -1.3798 -1.3798 -1.1389 -1.1389 4.3915 4.3915 4.9359 4.9359 5.1241 5.1241 5.1750 5.1750 5.8105 5.8105 k = 0.0000 0.4092 0.0600 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2724 -23.2724 -23.2717 -23.2717 -23.2662 -23.2662 -23.2652 -23.2652 -11.6477 -11.6477 -11.4443 -11.4443 -8.3391 -8.3391 -8.0574 -8.0574 -6.8449 -6.8449 -6.2097 -6.2097 -5.1918 -5.1918 -5.0506 -5.0506 -3.8750 -3.8750 -3.2273 -3.2273 -3.0161 -3.0161 -2.8127 -2.8127 -2.7997 -2.7997 -2.6640 -2.6640 -2.5074 -2.5074 -2.1943 -2.1943 -1.3778 -1.3778 -1.1408 -1.1408 4.4021 4.4021 4.9359 4.9359 5.1089 5.1089 5.1431 5.1431 5.8260 5.8260 k = 0.0000 0.4092 0.0749 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4474 -23.4474 -23.2723 -23.2723 -23.2717 -23.2717 -23.2662 -23.2662 -23.2652 -23.2652 -11.6449 -11.6449 -11.4474 -11.4474 -8.3360 -8.3360 -8.0624 -8.0624 -6.8356 -6.8356 -6.2186 -6.2186 -5.1897 -5.1897 -5.0525 -5.0525 -3.8644 -3.8644 -3.2243 -3.2243 -3.0335 -3.0335 -2.8161 -2.8161 -2.8056 -2.8056 -2.6631 -2.6631 -2.4924 -2.4924 -2.1954 -2.1954 -1.3753 -1.3753 -1.1433 -1.1433 4.4156 4.4156 4.9353 4.9353 5.0913 5.0913 5.1069 5.1069 5.8437 5.8437 k = 0.0000 0.4092 0.0899 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4475 -23.4475 -23.2723 -23.2723 -23.2717 -23.2717 -23.2662 -23.2662 -23.2653 -23.2653 -11.6416 -11.6416 -11.4512 -11.4512 -8.3322 -8.3322 -8.0684 -8.0684 -6.8243 -6.8243 -6.2294 -6.2294 -5.1872 -5.1872 -5.0549 -5.0549 -3.8516 -3.8516 -3.2207 -3.2207 -3.0535 -3.0535 -2.8340 -2.8340 -2.7980 -2.7980 -2.6622 -2.6622 -2.4762 -2.4762 -2.1967 -2.1967 -1.3722 -1.3722 -1.1464 -1.1464 4.4319 4.4319 4.9336 4.9336 5.0686 5.0686 5.0725 5.0725 5.8623 5.8623 k = 0.0000 0.4092 0.1049 ( 13676 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4475 -23.4475 -23.2723 -23.2723 -23.2718 -23.2718 -23.2662 -23.2662 -23.2653 -23.2653 -11.6377 -11.6377 -11.4555 -11.4555 -8.3277 -8.3277 -8.0753 -8.0753 -6.8112 -6.8112 -6.2419 -6.2419 -5.1844 -5.1844 -5.0577 -5.0577 -3.8366 -3.8366 -3.2164 -3.2164 -3.0758 -3.0758 -2.8528 -2.8528 -2.7900 -2.7900 -2.6614 -2.6614 -2.4593 -2.4593 -2.1984 -2.1984 -1.3684 -1.3684 -1.1502 -1.1502 4.4510 4.4510 4.9300 4.9300 5.0297 5.0297 5.0538 5.0538 5.8804 5.8804 k = 0.0000 0.4092 0.1199 ( 13680 PWs) bands (ev): -51.4174 -51.4174 -51.4173 -51.4173 -23.4482 -23.4482 -23.4476 -23.4476 -23.2723 -23.2723 -23.2718 -23.2718 -23.2662 -23.2662 -23.2653 -23.2653 -11.6333 -11.6333 -11.4604 -11.4604 -8.3226 -8.3226 -8.0831 -8.0831 -6.7963 -6.7963 -6.2562 -6.2562 -5.1811 -5.1811 -5.0608 -5.0608 -3.8194 -3.8194 -3.2114 -3.2114 -3.1003 -3.1003 -2.8723 -2.8723 -2.7818 -2.7818 -2.6607 -2.6607 -2.4421 -2.4421 -2.2005 -2.2005 -1.3639 -1.3639 -1.1547 -1.1547 4.4726 4.4726 4.9235 4.9235 4.9916 4.9916 5.0368 5.0368 5.8964 5.8964 k = 0.0000 0.4092 0.1349 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4475 -23.4475 -23.2723 -23.2723 -23.2718 -23.2718 -23.2662 -23.2662 -23.2653 -23.2653 -11.6284 -11.6284 -11.4659 -11.4659 -8.3168 -8.3168 -8.0918 -8.0918 -6.7797 -6.7797 -6.2722 -6.2722 -5.1774 -5.1774 -5.0644 -5.0644 -3.8002 -3.8002 -3.2056 -3.2056 -3.1266 -3.1266 -2.8920 -2.8920 -2.7734 -2.7734 -2.6602 -2.6602 -2.4249 -2.4249 -2.2030 -2.2030 -1.3587 -1.3587 -1.1599 -1.1599 4.4967 4.4967 4.9134 4.9134 4.9552 4.9552 5.0224 5.0224 5.9092 5.9092 k = 0.0000 0.4092 0.1499 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4475 -23.4475 -23.2722 -23.2722 -23.2718 -23.2718 -23.2661 -23.2661 -23.2653 -23.2653 -11.6230 -11.6230 -11.4719 -11.4719 -8.3103 -8.3103 -8.1011 -8.1011 -6.7616 -6.7616 -6.2897 -6.2897 -5.1734 -5.1734 -5.0682 -5.0682 -3.7790 -3.7790 -3.1991 -3.1991 -3.1546 -3.1546 -2.9119 -2.9119 -2.7650 -2.7650 -2.6600 -2.6600 -2.4078 -2.4078 -2.2059 -2.2059 -1.3528 -1.3528 -1.1659 -1.1659 4.5230 4.5230 4.8996 4.8996 4.9212 4.9212 5.0110 5.0110 5.9179 5.9179 k = 0.0000 0.4092 0.1649 ( 13628 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4475 -23.4475 -23.2722 -23.2722 -23.2718 -23.2718 -23.2661 -23.2661 -23.2654 -23.2654 -11.6171 -11.6171 -11.4783 -11.4783 -8.3032 -8.3032 -8.1111 -8.1111 -6.7420 -6.7420 -6.3087 -6.3087 -5.1690 -5.1690 -5.0724 -5.0724 -3.7559 -3.7559 -3.1918 -3.1918 -3.1841 -3.1841 -2.9317 -2.9317 -2.7565 -2.7565 -2.6602 -2.6602 -2.3911 -2.3911 -2.2093 -2.2093 -1.3461 -1.3461 -1.1726 -1.1726 4.5512 4.5512 4.8828 4.8828 4.8902 4.8902 5.0020 5.0020 5.9222 5.9222 k = 0.0000 0.4092 0.1799 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4475 -23.4475 -23.2722 -23.2722 -23.2718 -23.2718 -23.2661 -23.2661 -23.2654 -23.2654 -11.6108 -11.6108 -11.4852 -11.4852 -8.2954 -8.2954 -8.1216 -8.1216 -6.7211 -6.7211 -6.3290 -6.3290 -5.1644 -5.1644 -5.0769 -5.0769 -3.7311 -3.7311 -3.2149 -3.2149 -3.1838 -3.1838 -2.9513 -2.9513 -2.7481 -2.7481 -2.6609 -2.6609 -2.3749 -2.3749 -2.2133 -2.2133 -1.3388 -1.3388 -1.1801 -1.1801 4.5810 4.5810 4.8627 4.8627 4.8642 4.8642 4.9939 4.9939 5.9226 5.9226 k = 0.0000 0.4092 0.1948 ( 13626 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2722 -23.2722 -23.2718 -23.2718 -23.2660 -23.2660 -23.2654 -23.2654 -11.6040 -11.6040 -11.4924 -11.4924 -8.2871 -8.2871 -8.1326 -8.1326 -6.6990 -6.6990 -6.3505 -6.3505 -5.1595 -5.1595 -5.0817 -5.0817 -3.7046 -3.7046 -3.2468 -3.2468 -3.1749 -3.1749 -2.9705 -2.9705 -2.7397 -2.7397 -2.6621 -2.6621 -2.3591 -2.3591 -2.2179 -2.2179 -1.3307 -1.3307 -1.1882 -1.1882 4.6121 4.6121 4.8390 4.8390 4.8452 4.8452 4.9855 4.9855 5.9202 5.9202 k = 0.0000 0.4092 0.2098 ( 13626 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2722 -23.2722 -23.2718 -23.2718 -23.2660 -23.2660 -23.2655 -23.2655 -11.5969 -11.5969 -11.5000 -11.5000 -8.2782 -8.2782 -8.1440 -8.1440 -6.6759 -6.6759 -6.3731 -6.3731 -5.1544 -5.1544 -5.0868 -5.0868 -3.6766 -3.6766 -3.2796 -3.2796 -3.1653 -3.1653 -2.9894 -2.9894 -2.7315 -2.7315 -2.6639 -2.6639 -2.3441 -2.3441 -2.2230 -2.2230 -1.3220 -1.3220 -1.1970 -1.1970 4.6437 4.6437 4.8195 4.8195 4.8266 4.8266 4.9758 4.9758 5.9164 5.9164 k = 0.0000 0.4092 0.2248 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4480 -23.4480 -23.4476 -23.4476 -23.2721 -23.2721 -23.2719 -23.2719 -23.2659 -23.2659 -23.2655 -23.2655 -11.5895 -11.5895 -11.5078 -11.5078 -8.2687 -8.2687 -8.1556 -8.1556 -6.6519 -6.6519 -6.3967 -6.3967 -5.1490 -5.1490 -5.0920 -5.0920 -3.6472 -3.6472 -3.3131 -3.3131 -3.1548 -3.1548 -3.0078 -3.0078 -2.7235 -2.7235 -2.6664 -2.6664 -2.3297 -2.3297 -2.2289 -2.2289 -1.3126 -1.3126 -1.2065 -1.2065 4.6750 4.6750 4.8050 4.8050 4.8092 4.8092 4.9638 4.9638 5.9130 5.9130 k = 0.0000 0.4092 0.2398 ( 13632 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2659 -23.2659 -23.2656 -23.2656 -11.5819 -11.5819 -11.5159 -11.5159 -8.2587 -8.2587 -8.1674 -8.1674 -6.6272 -6.6272 -6.4211 -6.4211 -5.1435 -5.1435 -5.0974 -5.0974 -3.6166 -3.6166 -3.3472 -3.3472 -3.1436 -3.1436 -3.0257 -3.0257 -2.7157 -2.7157 -2.6695 -2.6695 -2.3160 -2.3160 -2.2354 -2.2354 -1.3027 -1.3027 -1.2165 -1.2165 4.7040 4.7040 4.7935 4.7935 4.7968 4.7968 4.9490 4.9490 5.9112 5.9112 k = 0.0000 0.4092 0.2548 ( 13648 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2659 -23.2659 -23.2656 -23.2656 -11.5739 -11.5739 -11.5241 -11.5241 -8.2483 -8.2483 -8.1793 -8.1793 -6.6018 -6.6018 -6.4462 -6.4462 -5.1378 -5.1378 -5.1030 -5.1030 -3.5849 -3.5849 -3.3816 -3.3816 -3.1315 -3.1315 -3.0429 -3.0429 -2.7083 -2.7083 -2.6733 -2.6733 -2.3031 -2.3031 -2.2427 -2.2427 -1.2924 -1.2924 -1.2269 -1.2269 4.7272 4.7272 4.7799 4.7799 4.7981 4.7981 4.9312 4.9312 5.9122 5.9122 k = 0.0000 0.4092 0.2698 ( 13630 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4479 -23.4479 -23.4477 -23.4477 -23.2721 -23.2721 -23.2719 -23.2719 -23.2658 -23.2658 -23.2657 -23.2657 -11.5658 -11.5658 -11.5324 -11.5324 -8.2375 -8.2375 -8.1913 -8.1913 -6.5760 -6.5760 -6.4717 -6.4717 -5.1321 -5.1321 -5.1087 -5.1087 -3.5523 -3.5523 -3.4162 -3.4162 -3.1187 -3.1187 -3.0595 -3.0595 -2.7012 -2.7012 -2.6777 -2.6777 -2.2910 -2.2910 -2.2508 -2.2508 -1.2817 -1.2817 -1.2376 -1.2376 4.7406 4.7406 4.7685 4.7685 4.8121 4.8121 4.9103 4.9103 5.9171 5.9171 k = 0.0000 0.4092 0.2848 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2719 -23.2719 -23.2658 -23.2658 -23.2657 -23.2657 -11.5576 -11.5576 -11.5408 -11.5408 -8.2263 -8.2263 -8.2031 -8.2031 -6.5500 -6.5500 -6.4977 -6.4977 -5.1262 -5.1262 -5.1145 -5.1145 -3.5190 -3.5190 -3.4507 -3.4507 -3.1050 -3.1050 -3.0754 -3.0754 -2.6945 -2.6945 -2.6827 -2.6827 -2.2798 -2.2798 -2.2596 -2.2596 -1.2708 -1.2708 -1.2486 -1.2486 4.7473 4.7473 4.7596 4.7596 4.8352 4.8352 4.8868 4.8868 5.9263 5.9263 k = 0.0000 0.4092 0.2998 ( 13624 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4478 -23.4478 -23.4478 -23.4478 -23.2720 -23.2720 -23.2720 -23.2720 -23.2658 -23.2658 -23.2658 -23.2658 -11.5492 -11.5492 -11.5492 -11.5492 -8.2148 -8.2148 -8.2148 -8.2148 -6.5238 -6.5238 -6.5238 -6.5238 -5.1204 -5.1204 -5.1204 -5.1204 -3.4850 -3.4850 -3.4850 -3.4850 -3.0906 -3.0906 -3.0906 -3.0906 -2.6883 -2.6883 -2.6883 -2.6883 -2.2693 -2.2693 -2.2693 -2.2693 -1.2597 -1.2597 -1.2597 -1.2597 4.7528 4.7528 4.7528 4.7528 4.8612 4.8612 4.8612 4.8612 5.9399 5.9399 k = 0.5000-0.0000 0.2998 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4926 -11.4926 -11.4926 -11.4926 -8.1751 -8.1751 -8.1751 -8.1751 -6.1044 -6.1044 -6.1044 -6.1044 -5.6734 -5.6734 -5.6734 -5.6734 -3.4813 -3.4813 -3.4813 -3.4813 -3.1847 -3.1847 -3.1847 -3.1847 -3.1452 -3.1452 -3.1452 -3.1452 -2.4160 -2.4160 -2.4160 -2.4160 -1.1734 -1.1734 -1.1734 -1.1734 4.9129 4.9129 4.9129 4.9129 5.7138 5.7138 5.7138 5.7138 5.9810 5.9810 k = 0.5000-0.0000 0.2848 ( 13662 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4927 -11.4927 -11.4927 -11.4927 -8.1749 -8.1749 -8.1749 -8.1749 -6.1045 -6.1045 -6.1045 -6.1045 -5.6737 -5.6737 -5.6737 -5.6737 -3.4814 -3.4814 -3.4814 -3.4814 -3.1903 -3.1903 -3.1903 -3.1903 -3.1387 -3.1387 -3.1386 -3.1386 -2.4166 -2.4166 -2.4166 -2.4166 -1.1736 -1.1736 -1.1736 -1.1736 4.9144 4.9144 4.9144 4.9144 5.7140 5.7140 5.7140 5.7140 5.9806 5.9806 k = 0.5000-0.0000 0.2698 ( 13650 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4927 -11.4927 -11.4927 -11.4927 -8.1745 -8.1745 -8.1745 -8.1745 -6.1050 -6.1050 -6.1050 -6.1050 -5.6744 -5.6744 -5.6744 -5.6744 -3.4814 -3.4814 -3.4814 -3.4814 -3.2017 -3.2017 -3.2017 -3.2017 -3.1243 -3.1243 -3.1242 -3.1242 -2.4184 -2.4184 -2.4184 -2.4184 -1.1742 -1.1742 -1.1742 -1.1742 4.9189 4.9189 4.9189 4.9189 5.7148 5.7148 5.7148 5.7148 5.9796 5.9796 k = 0.5000-0.0000 0.2548 ( 13628 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4928 -11.4928 -11.4928 -11.4928 -8.1737 -8.1737 -8.1737 -8.1737 -6.1058 -6.1058 -6.1058 -6.1058 -5.6755 -5.6755 -5.6755 -5.6755 -3.4815 -3.4815 -3.4815 -3.4815 -3.2142 -3.2142 -3.2142 -3.2142 -3.1068 -3.1068 -3.1068 -3.1068 -2.4213 -2.4213 -2.4213 -2.4213 -1.1753 -1.1753 -1.1753 -1.1753 4.9263 4.9263 4.9263 4.9263 5.7162 5.7162 5.7162 5.7162 5.9779 5.9779 k = 0.5000-0.0000 0.2398 ( 13630 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4928 -11.4928 -11.4928 -11.4928 -8.1727 -8.1727 -8.1727 -8.1727 -6.1068 -6.1068 -6.1068 -6.1068 -5.6770 -5.6770 -5.6770 -5.6770 -3.4816 -3.4816 -3.4816 -3.4816 -3.2265 -3.2265 -3.2265 -3.2265 -3.0876 -3.0876 -3.0875 -3.0875 -2.4255 -2.4255 -2.4255 -2.4255 -1.1767 -1.1767 -1.1767 -1.1767 4.9366 4.9366 4.9366 4.9366 5.7181 5.7181 5.7181 5.7181 5.9755 5.9755 k = 0.5000-0.0000 0.2248 ( 13620 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4930 -11.4930 -11.4930 -11.4930 -8.1714 -8.1714 -8.1714 -8.1714 -6.1082 -6.1082 -6.1082 -6.1082 -5.6789 -5.6789 -5.6789 -5.6789 -3.4818 -3.4818 -3.4818 -3.4818 -3.2382 -3.2382 -3.2382 -3.2382 -3.0670 -3.0670 -3.0670 -3.0670 -2.4309 -2.4309 -2.4309 -2.4309 -1.1784 -1.1784 -1.1784 -1.1784 4.9496 4.9496 4.9497 4.9497 5.7206 5.7206 5.7206 5.7206 5.9723 5.9723 k = 0.5000-0.0000 0.2098 ( 13616 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2665 -23.2665 -23.2665 -23.2665 -11.4931 -11.4931 -11.4931 -11.4931 -8.1699 -8.1699 -8.1699 -8.1699 -6.1097 -6.1097 -6.1097 -6.1097 -5.6812 -5.6812 -5.6811 -5.6811 -3.4820 -3.4820 -3.4820 -3.4820 -3.2491 -3.2491 -3.2491 -3.2491 -3.0454 -3.0454 -3.0454 -3.0454 -2.4376 -2.4376 -2.4375 -2.4375 -1.1804 -1.1804 -1.1804 -1.1804 4.9652 4.9652 4.9653 4.9653 5.7237 5.7237 5.7238 5.7238 5.9682 5.9682 k = 0.5000-0.0000 0.1948 ( 13622 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2665 -23.2665 -23.2665 -23.2665 -11.4932 -11.4932 -11.4932 -11.4932 -8.1682 -8.1682 -8.1682 -8.1682 -6.1115 -6.1115 -6.1115 -6.1115 -5.6836 -5.6836 -5.6836 -5.6836 -3.4822 -3.4822 -3.4822 -3.4822 -3.2593 -3.2593 -3.2593 -3.2593 -3.0229 -3.0229 -3.0228 -3.0228 -2.4455 -2.4455 -2.4455 -2.4455 -1.1827 -1.1827 -1.1826 -1.1826 4.9833 4.9833 4.9833 4.9833 5.7276 5.7276 5.7276 5.7276 5.9632 5.9632 k = 0.5000-0.0000 0.1799 ( 13634 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4934 -11.4934 -11.4934 -11.4934 -8.1664 -8.1664 -8.1663 -8.1663 -6.1135 -6.1135 -6.1134 -6.1134 -5.6863 -5.6863 -5.6863 -5.6863 -3.4825 -3.4825 -3.4825 -3.4825 -3.2685 -3.2685 -3.2685 -3.2685 -2.9995 -2.9995 -2.9994 -2.9994 -2.4549 -2.4549 -2.4548 -2.4548 -1.1850 -1.1850 -1.1850 -1.1850 5.0034 5.0034 5.0035 5.0035 5.7321 5.7321 5.7321 5.7321 5.9573 5.9573 k = 0.5000-0.0000 0.1649 ( 13634 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2665 -23.2665 -23.2665 -23.2665 -11.4936 -11.4936 -11.4936 -11.4936 -8.1644 -8.1644 -8.1644 -8.1644 -6.1155 -6.1155 -6.1155 -6.1155 -5.6890 -5.6890 -5.6890 -5.6890 -3.4829 -3.4829 -3.4829 -3.4829 -3.2770 -3.2770 -3.2770 -3.2770 -2.9753 -2.9753 -2.9753 -2.9753 -2.4655 -2.4655 -2.4655 -2.4655 -1.1875 -1.1875 -1.1875 -1.1875 5.0254 5.0254 5.0255 5.0255 5.7373 5.7373 5.7374 5.7374 5.9503 5.9503 k = 0.5000-0.0000 0.1499 ( 13642 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2665 -23.2665 -23.2665 -23.2665 -11.4937 -11.4937 -11.4937 -11.4937 -8.1624 -8.1624 -8.1624 -8.1624 -6.1176 -6.1176 -6.1176 -6.1176 -5.6918 -5.6918 -5.6918 -5.6918 -3.4833 -3.4833 -3.4833 -3.4833 -3.2846 -3.2846 -3.2846 -3.2846 -2.9505 -2.9505 -2.9505 -2.9505 -2.4776 -2.4776 -2.4775 -2.4775 -1.1900 -1.1900 -1.1900 -1.1900 5.0490 5.0490 5.0490 5.0490 5.7432 5.7432 5.7432 5.7432 5.9423 5.9423 k = 0.5000-0.0000 0.1349 ( 13638 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2665 -23.2665 -23.2665 -23.2665 -11.4939 -11.4939 -11.4939 -11.4939 -8.1604 -8.1604 -8.1604 -8.1604 -6.1198 -6.1198 -6.1198 -6.1198 -5.6946 -5.6946 -5.6946 -5.6946 -3.4837 -3.4837 -3.4837 -3.4837 -3.2914 -3.2914 -3.2914 -3.2914 -2.9252 -2.9252 -2.9252 -2.9252 -2.4909 -2.4909 -2.4909 -2.4909 -1.1924 -1.1924 -1.1924 -1.1924 5.0735 5.0735 5.0736 5.0736 5.7497 5.7497 5.7497 5.7497 5.9333 5.9333 k = 0.5000-0.0000 0.1199 ( 13638 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2666 -23.2666 -23.2665 -23.2665 -11.4941 -11.4941 -11.4941 -11.4941 -8.1585 -8.1585 -8.1585 -8.1585 -6.1219 -6.1219 -6.1219 -6.1219 -5.6973 -5.6973 -5.6973 -5.6973 -3.4842 -3.4842 -3.4842 -3.4842 -3.2974 -3.2974 -3.2974 -3.2974 -2.8996 -2.8996 -2.8995 -2.8995 -2.5056 -2.5056 -2.5055 -2.5055 -1.1948 -1.1948 -1.1947 -1.1947 5.0987 5.0987 5.0987 5.0987 5.7567 5.7567 5.7568 5.7568 5.9234 5.9234 k = 0.5000-0.0000 0.1049 ( 13638 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2666 -23.2666 -23.2665 -23.2665 -11.4942 -11.4942 -11.4942 -11.4942 -8.1566 -8.1566 -8.1566 -8.1566 -6.1240 -6.1240 -6.1240 -6.1240 -5.6998 -5.6998 -5.6998 -5.6998 -3.4846 -3.4846 -3.4846 -3.4846 -3.3026 -3.3026 -3.3026 -3.3026 -2.8737 -2.8737 -2.8736 -2.8736 -2.5215 -2.5215 -2.5215 -2.5215 -1.1969 -1.1969 -1.1969 -1.1969 5.1237 5.1237 5.1238 5.1238 5.7643 5.7643 5.7644 5.7644 5.9126 5.9126 k = 0.5000-0.0000 0.0899 ( 13658 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2718 -23.2718 -23.2666 -23.2666 -23.2666 -23.2666 -11.4944 -11.4944 -11.4944 -11.4944 -8.1549 -8.1549 -8.1549 -8.1549 -6.1259 -6.1259 -6.1259 -6.1259 -5.7021 -5.7021 -5.7021 -5.7021 -3.4851 -3.4851 -3.4851 -3.4851 -3.3070 -3.3070 -3.3070 -3.3070 -2.8478 -2.8478 -2.8478 -2.8478 -2.5386 -2.5386 -2.5385 -2.5385 -1.1989 -1.1989 -1.1989 -1.1989 5.1481 5.1481 5.1481 5.1481 5.7723 5.7723 5.7724 5.7724 5.9012 5.9012 k = 0.5000-0.0000 0.0749 ( 13674 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4945 -11.4945 -11.4945 -11.4945 -8.1534 -8.1534 -8.1533 -8.1533 -6.1276 -6.1276 -6.1276 -6.1276 -5.7042 -5.7042 -5.7042 -5.7042 -3.4855 -3.4855 -3.4855 -3.4855 -3.3107 -3.3107 -3.3107 -3.3107 -2.8223 -2.8223 -2.8222 -2.8222 -2.5566 -2.5566 -2.5565 -2.5565 -1.2007 -1.2007 -1.2006 -1.2006 5.1709 5.1709 5.1709 5.1709 5.7807 5.7807 5.7808 5.7808 5.8892 5.8892 k = 0.5000-0.0000 0.0600 ( 13690 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4946 -11.4946 -11.4946 -11.4946 -8.1520 -8.1520 -8.1520 -8.1520 -6.1290 -6.1290 -6.1290 -6.1290 -5.7059 -5.7059 -5.7059 -5.7059 -3.4859 -3.4859 -3.4859 -3.4859 -3.3137 -3.3137 -3.3137 -3.3137 -2.7973 -2.7973 -2.7973 -2.7973 -2.5752 -2.5752 -2.5751 -2.5751 -1.2021 -1.2021 -1.2021 -1.2021 5.1913 5.1913 5.1913 5.1913 5.7893 5.7893 5.7894 5.7894 5.8770 5.8770 k = 0.5000-0.0000 0.0450 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4947 -11.4947 -11.4947 -11.4947 -8.1510 -8.1510 -8.1510 -8.1510 -6.1302 -6.1302 -6.1302 -6.1302 -5.7073 -5.7073 -5.7073 -5.7073 -3.4862 -3.4862 -3.4862 -3.4862 -3.3160 -3.3160 -3.3160 -3.3160 -2.7738 -2.7738 -2.7737 -2.7737 -2.5938 -2.5938 -2.5937 -2.5937 -1.2033 -1.2033 -1.2033 -1.2033 5.2084 5.2084 5.2084 5.2084 5.7983 5.7983 5.7984 5.7984 5.8648 5.8648 k = 0.5000-0.0000 0.0300 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1502 -8.1502 -8.1502 -8.1502 -6.1311 -6.1311 -6.1311 -6.1311 -5.7083 -5.7083 -5.7083 -5.7083 -3.4865 -3.4865 -3.4865 -3.4865 -3.3177 -3.3177 -3.3177 -3.3177 -2.7527 -2.7527 -2.7526 -2.7526 -2.6113 -2.6113 -2.6112 -2.6112 -1.2041 -1.2041 -1.2041 -1.2041 5.2214 5.2214 5.2214 5.2214 5.8075 5.8075 5.8076 5.8076 5.8530 5.8530 k = 0.5000-0.0000 0.0150 ( 13678 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1497 -8.1497 -8.1497 -8.1497 -6.1316 -6.1316 -6.1316 -6.1316 -5.7089 -5.7089 -5.7089 -5.7089 -3.4866 -3.4866 -3.4866 -3.4866 -3.3186 -3.3186 -3.3186 -3.3186 -2.7367 -2.7367 -2.7367 -2.7367 -2.6251 -2.6251 -2.6251 -2.6251 -1.2046 -1.2046 -1.2046 -1.2046 5.2296 5.2296 5.2296 5.2296 5.8166 5.8166 5.8166 5.8166 5.8423 5.8423 k = 0.5000-0.0000-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2718 -23.2718 -23.2718 -23.2718 -23.2666 -23.2666 -23.2666 -23.2666 -11.4948 -11.4948 -11.4948 -11.4948 -8.1496 -8.1496 -8.1496 -8.1496 -6.1318 -6.1318 -6.1318 -6.1318 -5.7091 -5.7091 -5.7091 -5.7091 -3.4867 -3.4867 -3.4867 -3.4867 -3.3190 -3.3190 -3.3190 -3.3190 -2.7303 -2.7303 -2.7303 -2.7303 -2.6307 -2.6307 -2.6307 -2.6307 -1.2048 -1.2048 -1.2048 -1.2048 5.2323 5.2323 5.2323 5.2323 5.8223 5.8223 5.8223 5.8223 5.8360 5.8360 k = 0.5000 0.4092-0.0000 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4782 -11.4782 -11.4782 -11.4782 -8.1306 -8.1306 -8.1306 -8.1306 -6.3370 -6.3370 -6.3370 -6.3370 -5.6056 -5.6056 -5.6056 -5.6056 -3.5814 -3.5814 -3.5814 -3.5814 -3.5773 -3.5773 -3.5773 -3.5773 -2.5083 -2.5083 -2.5083 -2.5083 -2.3730 -2.3730 -2.3730 -2.3730 -1.1847 -1.1847 -1.1847 -1.1847 5.7818 5.7818 5.7818 5.7818 6.2132 6.2132 6.2132 6.2132 6.4024 6.4024 k = 0.5000 0.4092 0.0150 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4781 -11.4781 -11.4781 -11.4781 -8.1307 -8.1307 -8.1307 -8.1307 -6.3368 -6.3368 -6.3368 -6.3368 -5.6057 -5.6057 -5.6057 -5.6057 -3.6062 -3.6062 -3.6061 -3.6061 -3.5514 -3.5514 -3.5512 -3.5512 -2.5094 -2.5094 -2.5094 -2.5094 -2.3730 -2.3730 -2.3730 -2.3730 -1.1851 -1.1851 -1.1851 -1.1851 5.7835 5.7835 5.7836 5.7836 6.1943 6.1943 6.1946 6.1946 6.4207 6.4207 k = 0.5000 0.4092 0.0300 ( 13660 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4781 -11.4781 -11.4781 -11.4781 -8.1311 -8.1311 -8.1311 -8.1311 -6.3363 -6.3363 -6.3363 -6.3363 -5.6061 -5.6061 -5.6060 -5.6060 -3.6315 -3.6315 -3.6314 -3.6314 -3.5223 -3.5223 -3.5222 -3.5222 -2.5126 -2.5126 -2.5126 -2.5126 -2.3728 -2.3728 -2.3728 -2.3728 -1.1864 -1.1864 -1.1863 -1.1863 5.7889 5.7889 5.7889 5.7889 6.1516 6.1516 6.1520 6.1520 6.4621 6.4621 k = 0.5000 0.4092 0.0450 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.4781 -11.4781 -11.4781 -11.4781 -8.1316 -8.1316 -8.1316 -8.1316 -6.3354 -6.3354 -6.3354 -6.3354 -5.6066 -5.6066 -5.6066 -5.6066 -3.6554 -3.6554 -3.6553 -3.6553 -3.4922 -3.4922 -3.4921 -3.4921 -2.5180 -2.5180 -2.5180 -2.5180 -2.3725 -2.3725 -2.3725 -2.3725 -1.1885 -1.1885 -1.1884 -1.1884 5.7977 5.7977 5.7978 5.7978 6.1005 6.1005 6.1010 6.1010 6.5100 6.5100 k = 0.5000 0.4092 0.0600 ( 13652 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2665 -23.2665 -11.4780 -11.4780 -11.4780 -11.4780 -8.1323 -8.1323 -8.1322 -8.1322 -6.3343 -6.3343 -6.3343 -6.3343 -5.6073 -5.6073 -5.6073 -5.6073 -3.6779 -3.6779 -3.6778 -3.6778 -3.4612 -3.4612 -3.4611 -3.4611 -2.5254 -2.5254 -2.5254 -2.5254 -2.3722 -2.3722 -2.3721 -2.3721 -1.1913 -1.1913 -1.1913 -1.1913 5.8100 5.8100 5.8101 5.8101 6.0475 6.0475 6.0481 6.0481 6.5567 6.5567 k = 0.5000 0.4092 0.0749 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4779 -11.4779 -11.4779 -11.4779 -8.1331 -8.1331 -8.1331 -8.1331 -6.3328 -6.3328 -6.3328 -6.3328 -5.6083 -5.6083 -5.6082 -5.6082 -3.6988 -3.6988 -3.6988 -3.6988 -3.4294 -3.4294 -3.4292 -3.4292 -2.5348 -2.5348 -2.5348 -2.5348 -2.3717 -2.3717 -2.3717 -2.3717 -1.1949 -1.1949 -1.1948 -1.1948 5.8255 5.8255 5.8257 5.8257 5.9952 5.9952 5.9959 5.9959 6.5984 6.5984 k = 0.5000 0.4092 0.0899 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2666 -23.2666 -23.2666 -23.2666 -11.4778 -11.4778 -11.4778 -11.4778 -8.1341 -8.1341 -8.1341 -8.1341 -6.3311 -6.3311 -6.3311 -6.3311 -5.6094 -5.6094 -5.6093 -5.6093 -3.7182 -3.7182 -3.7181 -3.7181 -3.3969 -3.3969 -3.3968 -3.3968 -2.5461 -2.5461 -2.5460 -2.5460 -2.3713 -2.3713 -2.3712 -2.3712 -1.1990 -1.1990 -1.1990 -1.1990 5.8441 5.8441 5.8443 5.8443 5.9450 5.9450 5.9456 5.9456 6.6332 6.6332 k = 0.5000 0.4092 0.1049 ( 13692 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2666 -23.2666 -23.2666 -23.2666 -11.4777 -11.4777 -11.4777 -11.4777 -8.1352 -8.1352 -8.1352 -8.1352 -6.3292 -6.3292 -6.3292 -6.3292 -5.6106 -5.6106 -5.6106 -5.6106 -3.7360 -3.7360 -3.7360 -3.7360 -3.3640 -3.3640 -3.3638 -3.3638 -2.5591 -2.5591 -2.5591 -2.5591 -2.3708 -2.3708 -2.3708 -2.3708 -1.2037 -1.2037 -1.2037 -1.2037 5.8644 5.8644 5.8644 5.8644 5.8986 5.8986 5.8994 5.8994 6.6605 6.6605 k = 0.5000 0.4092 0.1199 ( 13684 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2666 -23.2666 -23.2666 -23.2666 -11.4776 -11.4776 -11.4775 -11.4775 -8.1365 -8.1365 -8.1364 -8.1364 -6.3271 -6.3271 -6.3271 -6.3271 -5.6120 -5.6120 -5.6120 -5.6120 -3.7523 -3.7523 -3.7522 -3.7522 -3.3307 -3.3307 -3.3305 -3.3305 -2.5739 -2.5739 -2.5738 -2.5738 -2.3704 -2.3704 -2.3703 -2.3703 -1.2088 -1.2088 -1.2087 -1.2087 5.8490 5.8490 5.8494 5.8494 5.8936 5.8936 5.8941 5.8941 6.6806 6.6806 k = 0.5000 0.4092 0.1349 ( 13672 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4774 -11.4774 -11.4774 -11.4774 -8.1377 -8.1377 -8.1377 -8.1377 -6.3248 -6.3248 -6.3248 -6.3248 -5.6136 -5.6136 -5.6135 -5.6135 -3.7669 -3.7669 -3.7668 -3.7668 -3.2972 -3.2972 -3.2970 -3.2970 -2.5901 -2.5901 -2.5901 -2.5901 -2.3700 -2.3700 -2.3699 -2.3699 -1.2142 -1.2142 -1.2141 -1.2141 5.8081 5.8081 5.8086 5.8086 5.9199 5.9199 5.9202 5.9202 6.6948 6.6948 k = 0.5000 0.4092 0.1499 ( 13672 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4773 -11.4773 -11.4773 -11.4773 -8.1390 -8.1390 -8.1390 -8.1390 -6.3225 -6.3225 -6.3225 -6.3225 -5.6152 -5.6152 -5.6151 -5.6151 -3.7800 -3.7800 -3.7800 -3.7800 -3.2637 -3.2637 -3.2635 -3.2635 -2.6078 -2.6078 -2.6077 -2.6077 -2.3696 -2.3696 -2.3695 -2.3695 -1.2198 -1.2198 -1.2197 -1.2197 5.7697 5.7697 5.7702 5.7702 5.9493 5.9493 5.9496 5.9496 6.7043 6.7043 k = 0.5000 0.4092 0.1649 ( 13688 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2666 -23.2666 -23.2665 -23.2665 -11.4771 -11.4771 -11.4771 -11.4771 -8.1403 -8.1403 -8.1403 -8.1403 -6.3202 -6.3202 -6.3202 -6.3202 -5.6168 -5.6168 -5.6167 -5.6167 -3.7916 -3.7916 -3.7916 -3.7916 -3.2304 -3.2304 -3.2302 -3.2302 -2.6267 -2.6267 -2.6266 -2.6266 -2.3692 -2.3692 -2.3692 -2.3692 -1.2253 -1.2253 -1.2253 -1.2253 5.7347 5.7347 5.7352 5.7352 5.9807 5.9807 5.9810 5.9810 6.7102 6.7102 k = 0.5000 0.4092 0.1799 ( 13688 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2666 -23.2666 -23.2665 -23.2665 -11.4770 -11.4770 -11.4770 -11.4770 -8.1416 -8.1416 -8.1416 -8.1416 -6.3179 -6.3179 -6.3179 -6.3179 -5.6184 -5.6184 -5.6184 -5.6184 -3.8018 -3.8018 -3.8017 -3.8017 -3.1975 -3.1975 -3.1974 -3.1974 -2.6466 -2.6466 -2.6465 -2.6465 -2.3689 -2.3689 -2.3688 -2.3688 -1.2308 -1.2308 -1.2307 -1.2307 5.7032 5.7032 5.7036 5.7036 6.0134 6.0134 6.0138 6.0138 6.7136 6.7136 k = 0.5000 0.4092 0.1948 ( 13680 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4769 -11.4769 -11.4769 -11.4769 -8.1428 -8.1428 -8.1428 -8.1428 -6.3157 -6.3157 -6.3157 -6.3157 -5.6200 -5.6200 -5.6200 -5.6200 -3.8105 -3.8105 -3.8105 -3.8105 -3.1653 -3.1653 -3.1652 -3.1652 -2.6673 -2.6673 -2.6672 -2.6672 -2.3686 -2.3686 -2.3686 -2.3686 -1.2360 -1.2360 -1.2359 -1.2359 5.6753 5.6753 5.6757 5.6757 6.0469 6.0469 6.0473 6.0473 6.7152 6.7152 k = 0.5000 0.4092 0.2098 ( 13668 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4768 -11.4768 -11.4768 -11.4768 -8.1439 -8.1439 -8.1439 -8.1439 -6.3137 -6.3137 -6.3137 -6.3137 -5.6216 -5.6216 -5.6215 -5.6215 -3.8179 -3.8179 -3.8179 -3.8179 -3.1342 -3.1342 -3.1341 -3.1341 -2.6884 -2.6884 -2.6884 -2.6884 -2.3683 -2.3683 -2.3683 -2.3683 -1.2408 -1.2408 -1.2408 -1.2408 5.6511 5.6511 5.6514 5.6514 6.0804 6.0804 6.0807 6.0807 6.7156 6.7156 k = 0.5000 0.4092 0.2248 ( 13640 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4767 -11.4767 -11.4767 -11.4767 -8.1449 -8.1449 -8.1449 -8.1449 -6.3119 -6.3119 -6.3118 -6.3118 -5.6229 -5.6229 -5.6229 -5.6229 -3.8241 -3.8241 -3.8240 -3.8240 -3.1045 -3.1045 -3.1045 -3.1045 -2.7095 -2.7095 -2.7095 -2.7095 -2.3681 -2.3681 -2.3681 -2.3681 -1.2452 -1.2452 -1.2451 -1.2451 5.6305 5.6305 5.6308 5.6308 6.1127 6.1127 6.1130 6.1130 6.7152 6.7152 k = 0.5000 0.4092 0.2398 ( 13636 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2719 -23.2719 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4766 -11.4766 -11.4766 -11.4766 -8.1458 -8.1458 -8.1458 -8.1458 -6.3103 -6.3103 -6.3103 -6.3103 -5.6241 -5.6241 -5.6241 -5.6241 -3.8290 -3.8290 -3.8290 -3.8290 -3.0771 -3.0771 -3.0771 -3.0771 -2.7299 -2.7299 -2.7299 -2.7299 -2.3680 -2.3680 -2.3679 -2.3679 -1.2489 -1.2489 -1.2488 -1.2488 5.6137 5.6137 5.6140 5.6140 6.1426 6.1426 6.1429 6.1429 6.7144 6.7144 k = 0.5000 0.4092 0.2548 ( 13644 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2719 -23.2719 -23.2665 -23.2665 -23.2665 -23.2665 -11.4765 -11.4765 -11.4765 -11.4765 -8.1464 -8.1464 -8.1464 -8.1464 -6.3090 -6.3090 -6.3090 -6.3090 -5.6251 -5.6251 -5.6251 -5.6251 -3.8328 -3.8328 -3.8327 -3.8327 -3.0529 -3.0529 -3.0529 -3.0529 -2.7487 -2.7487 -2.7487 -2.7487 -2.3678 -2.3678 -2.3678 -2.3678 -1.2518 -1.2518 -1.2518 -1.2518 5.6007 5.6007 5.6008 5.6008 6.1687 6.1687 6.1689 6.1689 6.7134 6.7134 k = 0.5000 0.4092 0.2698 ( 13664 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4765 -11.4765 -11.4765 -11.4765 -8.1469 -8.1469 -8.1469 -8.1469 -6.3081 -6.3081 -6.3081 -6.3081 -5.6258 -5.6258 -5.6258 -5.6258 -3.8354 -3.8354 -3.8354 -3.8354 -3.0334 -3.0334 -3.0333 -3.0333 -2.7644 -2.7644 -2.7644 -2.7644 -2.3677 -2.3677 -2.3677 -2.3677 -1.2540 -1.2540 -1.2540 -1.2540 5.5913 5.5913 5.5914 5.5914 6.1891 6.1891 6.1893 6.1893 6.7125 6.7125 k = 0.5000 0.4092 0.2848 ( 13676 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4482 -23.4482 -23.4482 -23.4482 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4764 -11.4764 -11.4764 -11.4764 -8.1472 -8.1472 -8.1472 -8.1472 -6.3075 -6.3075 -6.3075 -6.3075 -5.6263 -5.6263 -5.6263 -5.6263 -3.8370 -3.8370 -3.8370 -3.8370 -3.0203 -3.0203 -3.0203 -3.0203 -2.7750 -2.7750 -2.7750 -2.7750 -2.3677 -2.3677 -2.3677 -2.3677 -1.2554 -1.2554 -1.2553 -1.2553 5.5857 5.5857 5.5858 5.5858 6.2022 6.2022 6.2023 6.2023 6.7119 6.7119 k = 0.5000 0.4092 0.2998 ( 13656 PWs) bands (ev): -51.4173 -51.4173 -51.4173 -51.4173 -23.4481 -23.4481 -23.4481 -23.4481 -23.2720 -23.2720 -23.2720 -23.2720 -23.2665 -23.2665 -23.2665 -23.2665 -11.4764 -11.4764 -11.4764 -11.4764 -8.1473 -8.1473 -8.1473 -8.1473 -6.3073 -6.3073 -6.3073 -6.3073 -5.6264 -5.6264 -5.6264 -5.6264 -3.8375 -3.8375 -3.8375 -3.8375 -3.0157 -3.0157 -3.0157 -3.0157 -2.7789 -2.7789 -2.7789 -2.7789 -2.3677 -2.3677 -2.3677 -2.3677 -1.2558 -1.2558 -1.2558 -1.2558 5.5839 5.5839 5.5839 5.5839 6.2068 6.2068 6.2068 6.2068 6.7116 6.7116 Writing output data file NaB3H8.save init_run : 0.74s CPU 0.54s WALL ( 1 calls) electrons : 549.14s CPU 422.01s WALL ( 1 calls) Called by init_run: wfcinit : 0.04s CPU 0.04s WALL ( 1 calls) potinit : 0.20s CPU 0.17s WALL ( 1 calls) Called by electrons: c_bands : 549.12s CPU 422.00s 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 : 0.04s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.61s CPU 0.59s WALL ( 340 calls) cegterg : 432.66s CPU 351.15s WALL ( 508 calls) Called by sum_band: Called by *egterg: h_psi : 364.85s CPU 250.85s WALL ( 7714 calls) s_psi : 13.76s CPU 10.61s WALL ( 7714 calls) g_psi : 0.85s CPU 0.89s WALL ( 6866 calls) cdiaghg : 79.89s CPU 77.16s WALL ( 7206 calls) cegterg:over : 22.70s CPU 22.03s WALL ( 6866 calls) cegterg:upda : 22.54s CPU 22.24s WALL ( 6866 calls) cegterg:last : 10.94s CPU 10.96s WALL ( 1188 calls) cdiaghg:chol : 4.77s CPU 4.44s WALL ( 7206 calls) cdiaghg:inve : 2.98s CPU 3.08s WALL ( 7206 calls) cdiaghg:para : 4.79s CPU 4.87s WALL ( 14412 calls) Called by h_psi: h_psi:vloc : 331.69s CPU 224.54s WALL ( 7714 calls) h_psi:vnl : 32.07s CPU 25.35s WALL ( 7714 calls) add_vuspsi : 14.86s CPU 11.38s WALL ( 7714 calls) General routines calbec : 17.14s CPU 13.94s WALL ( 7714 calls) fft : 0.04s CPU 0.02s WALL ( 19 calls) ffts : 0.02s CPU 0.01s WALL ( 4 calls) fftw : 315.43s CPU 211.43s WALL ( 971420 calls) interpolate : 0.03s CPU 0.01s WALL ( 4 calls) davcio : 0.64s CPU 3.59s WALL ( 680 calls) Parallel routines fft_scatter : 103.42s CPU 81.49s WALL ( 971443 calls) PWSCF : 10m40.28s CPU 9m49.33s WALL This run was terminated on: 20:39:21 3Aug2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=