Program PWSCF v.5.3.0 (svn rev. 11974) starts on 24Dec2016 at 19:28:39 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./AlHO2.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 31 18 5 2157 942 155 Max 32 19 6 2170 971 166 Sum 1149 671 201 77989 34519 5771 bravais-lattice index = 14 lattice parameter (alat) = 5.3668 a.u. unit-cell volume = 791.8321 (a.u.)^3 number of atoms/cell = 16 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 47.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.366822 celldm(2)= 1.549296 celldm(3)= 3.306338 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 1.549296 0.000000 ) a(3) = ( 0.000000 0.000000 3.306338 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 0.645455 -0.000000 ) b(3) = ( 0.000000 0.000000 0.302449 ) PseudoPot. # 1 for O read from file: /users/gautes/Pseudo/O.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e551570ea340e0688630c94d366e26e3 Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1095 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 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. # 3 for Al read from file: /users/gautes/Pseudo/Al.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d344aa71f13a435d235890da883ec65e Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1135 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential O 6.00 15.99940 O( 1.00) H 1.00 1.00790 H( 1.00) Al 3.00 26.98150 Al( 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 =( 0.5000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6531690 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.6531690 ) 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 =( 0.5000000 ) ( 0 1 0 ) ( 0.5000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 6) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.6531690 ) isym = 7 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s( 7) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.5000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.7746479 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.6531690 ) 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= 448 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 2) = ( 0.0089286 -0.0000000 -0.0000000), wk = 0.0022321 k( 3) = ( 0.0178571 -0.0000000 -0.0000000), wk = 0.0022321 k( 4) = ( 0.0267857 -0.0000000 -0.0000000), wk = 0.0022321 k( 5) = ( 0.0357143 -0.0000000 -0.0000000), wk = 0.0022321 k( 6) = ( 0.0446429 -0.0000000 -0.0000000), wk = 0.0022321 k( 7) = ( 0.0535714 -0.0000000 -0.0000000), wk = 0.0022321 k( 8) = ( 0.0625000 -0.0000000 -0.0000000), wk = 0.0022321 k( 9) = ( 0.0714286 -0.0000000 -0.0000000), wk = 0.0022321 k( 10) = ( 0.0803571 -0.0000000 -0.0000000), wk = 0.0022321 k( 11) = ( 0.0892857 -0.0000000 -0.0000000), wk = 0.0022321 k( 12) = ( 0.0982143 -0.0000000 -0.0000000), wk = 0.0022321 k( 13) = ( 0.1071429 -0.0000000 -0.0000000), wk = 0.0022321 k( 14) = ( 0.1160714 -0.0000000 -0.0000000), wk = 0.0022321 k( 15) = ( 0.1250000 -0.0000000 -0.0000000), wk = 0.0022321 k( 16) = ( 0.1339286 -0.0000000 -0.0000000), wk = 0.0022321 k( 17) = ( 0.1428571 -0.0000000 -0.0000000), wk = 0.0022321 k( 18) = ( 0.1517857 -0.0000000 -0.0000000), wk = 0.0022321 k( 19) = ( 0.1607143 -0.0000000 -0.0000000), wk = 0.0022321 k( 20) = ( 0.1696429 -0.0000000 -0.0000000), wk = 0.0022321 k( 21) = ( 0.1785714 -0.0000000 -0.0000000), wk = 0.0022321 k( 22) = ( 0.1875000 -0.0000000 -0.0000000), wk = 0.0022321 k( 23) = ( 0.1964286 -0.0000000 -0.0000000), wk = 0.0022321 k( 24) = ( 0.2053571 -0.0000000 -0.0000000), wk = 0.0022321 k( 25) = ( 0.2142857 -0.0000000 -0.0000000), wk = 0.0022321 k( 26) = ( 0.2232143 -0.0000000 -0.0000000), wk = 0.0022321 k( 27) = ( 0.2321429 -0.0000000 -0.0000000), wk = 0.0022321 k( 28) = ( 0.2410714 -0.0000000 -0.0000000), wk = 0.0022321 k( 29) = ( 0.2500000 -0.0000000 -0.0000000), wk = 0.0022321 k( 30) = ( 0.2589286 -0.0000000 -0.0000000), wk = 0.0022321 k( 31) = ( 0.2678571 -0.0000000 -0.0000000), wk = 0.0022321 k( 32) = ( 0.2767857 -0.0000000 -0.0000000), wk = 0.0022321 k( 33) = ( 0.2857143 -0.0000000 -0.0000000), wk = 0.0022321 k( 34) = ( 0.2946429 -0.0000000 -0.0000000), wk = 0.0022321 k( 35) = ( 0.3035714 -0.0000000 -0.0000000), wk = 0.0022321 k( 36) = ( 0.3125000 -0.0000000 -0.0000000), wk = 0.0022321 k( 37) = ( 0.3214286 -0.0000000 -0.0000000), wk = 0.0022321 k( 38) = ( 0.3303571 -0.0000000 -0.0000000), wk = 0.0022321 k( 39) = ( 0.3392857 -0.0000000 -0.0000000), wk = 0.0022321 k( 40) = ( 0.3482143 -0.0000000 -0.0000000), wk = 0.0022321 k( 41) = ( 0.3571429 -0.0000000 -0.0000000), wk = 0.0022321 k( 42) = ( 0.3660714 -0.0000000 -0.0000000), wk = 0.0022321 k( 43) = ( 0.3750000 -0.0000000 -0.0000000), wk = 0.0022321 k( 44) = ( 0.3839286 -0.0000000 -0.0000000), wk = 0.0022321 k( 45) = ( 0.3928571 -0.0000000 -0.0000000), wk = 0.0022321 k( 46) = ( 0.4017857 -0.0000000 -0.0000000), wk = 0.0022321 k( 47) = ( 0.4107143 -0.0000000 -0.0000000), wk = 0.0022321 k( 48) = ( 0.4196429 -0.0000000 -0.0000000), wk = 0.0022321 k( 49) = ( 0.4285714 -0.0000000 -0.0000000), wk = 0.0022321 k( 50) = ( 0.4375000 -0.0000000 -0.0000000), wk = 0.0022321 k( 51) = ( 0.4464286 -0.0000000 -0.0000000), wk = 0.0022321 k( 52) = ( 0.4553571 -0.0000000 -0.0000000), wk = 0.0022321 k( 53) = ( 0.4642857 -0.0000000 -0.0000000), wk = 0.0022321 k( 54) = ( 0.4732143 -0.0000000 -0.0000000), wk = 0.0022321 k( 55) = ( 0.4821429 -0.0000000 -0.0000000), wk = 0.0022321 k( 56) = ( 0.4910714 -0.0000000 -0.0000000), wk = 0.0022321 k( 57) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 58) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 59) = ( 0.5000000 0.0089646 -0.0000000), wk = 0.0022321 k( 60) = ( 0.5000000 0.0179293 -0.0000000), wk = 0.0022321 k( 61) = ( 0.5000000 0.0268939 -0.0000000), wk = 0.0022321 k( 62) = ( 0.5000000 0.0358586 -0.0000000), wk = 0.0022321 k( 63) = ( 0.5000000 0.0448232 -0.0000000), wk = 0.0022321 k( 64) = ( 0.5000000 0.0537879 -0.0000000), wk = 0.0022321 k( 65) = ( 0.5000000 0.0627525 -0.0000000), wk = 0.0022321 k( 66) = ( 0.5000000 0.0717172 -0.0000000), wk = 0.0022321 k( 67) = ( 0.5000000 0.0806818 -0.0000000), wk = 0.0022321 k( 68) = ( 0.5000000 0.0896465 -0.0000000), wk = 0.0022321 k( 69) = ( 0.5000000 0.0986111 -0.0000000), wk = 0.0022321 k( 70) = ( 0.5000000 0.1075758 -0.0000000), wk = 0.0022321 k( 71) = ( 0.5000000 0.1165404 -0.0000000), wk = 0.0022321 k( 72) = ( 0.5000000 0.1255050 -0.0000000), wk = 0.0022321 k( 73) = ( 0.5000000 0.1344697 -0.0000000), wk = 0.0022321 k( 74) = ( 0.5000000 0.1434343 -0.0000000), wk = 0.0022321 k( 75) = ( 0.5000000 0.1523990 -0.0000000), wk = 0.0022321 k( 76) = ( 0.5000000 0.1613636 -0.0000000), wk = 0.0022321 k( 77) = ( 0.5000000 0.1703283 -0.0000000), wk = 0.0022321 k( 78) = ( 0.5000000 0.1792929 -0.0000000), wk = 0.0022321 k( 79) = ( 0.5000000 0.1882576 -0.0000000), wk = 0.0022321 k( 80) = ( 0.5000000 0.1972222 -0.0000000), wk = 0.0022321 k( 81) = ( 0.5000000 0.2061869 -0.0000000), wk = 0.0022321 k( 82) = ( 0.5000000 0.2151515 -0.0000000), wk = 0.0022321 k( 83) = ( 0.5000000 0.2241162 -0.0000000), wk = 0.0022321 k( 84) = ( 0.5000000 0.2330808 -0.0000000), wk = 0.0022321 k( 85) = ( 0.5000000 0.2420455 -0.0000000), wk = 0.0022321 k( 86) = ( 0.5000000 0.2510101 -0.0000000), wk = 0.0022321 k( 87) = ( 0.5000000 0.2599747 -0.0000000), wk = 0.0022321 k( 88) = ( 0.5000000 0.2689394 -0.0000000), wk = 0.0022321 k( 89) = ( 0.5000000 0.2779040 -0.0000000), wk = 0.0022321 k( 90) = ( 0.5000000 0.2868687 -0.0000000), wk = 0.0022321 k( 91) = ( 0.5000000 0.2958333 -0.0000000), wk = 0.0022321 k( 92) = ( 0.5000000 0.3047980 -0.0000000), wk = 0.0022321 k( 93) = ( 0.5000000 0.3137626 -0.0000000), wk = 0.0022321 k( 94) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 95) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 96) = ( 0.4910714 0.3227273 -0.0000000), wk = 0.0022321 k( 97) = ( 0.4821429 0.3227273 -0.0000000), wk = 0.0022321 k( 98) = ( 0.4732143 0.3227273 -0.0000000), wk = 0.0022321 k( 99) = ( 0.4642857 0.3227273 -0.0000000), wk = 0.0022321 k( 100) = ( 0.4553571 0.3227273 -0.0000000), wk = 0.0022321 k( 101) = ( 0.4464286 0.3227273 -0.0000000), wk = 0.0022321 k( 102) = ( 0.4375000 0.3227273 -0.0000000), wk = 0.0022321 k( 103) = ( 0.4285714 0.3227273 -0.0000000), wk = 0.0022321 k( 104) = ( 0.4196429 0.3227273 -0.0000000), wk = 0.0022321 k( 105) = ( 0.4107143 0.3227273 -0.0000000), wk = 0.0022321 k( 106) = ( 0.4017857 0.3227273 -0.0000000), wk = 0.0022321 k( 107) = ( 0.3928571 0.3227273 -0.0000000), wk = 0.0022321 k( 108) = ( 0.3839286 0.3227273 -0.0000000), wk = 0.0022321 k( 109) = ( 0.3750000 0.3227273 -0.0000000), wk = 0.0022321 k( 110) = ( 0.3660714 0.3227273 -0.0000000), wk = 0.0022321 k( 111) = ( 0.3571429 0.3227273 -0.0000000), wk = 0.0022321 k( 112) = ( 0.3482143 0.3227273 -0.0000000), wk = 0.0022321 k( 113) = ( 0.3392857 0.3227273 -0.0000000), wk = 0.0022321 k( 114) = ( 0.3303571 0.3227273 -0.0000000), wk = 0.0022321 k( 115) = ( 0.3214286 0.3227273 -0.0000000), wk = 0.0022321 k( 116) = ( 0.3125000 0.3227273 -0.0000000), wk = 0.0022321 k( 117) = ( 0.3035714 0.3227273 -0.0000000), wk = 0.0022321 k( 118) = ( 0.2946429 0.3227273 -0.0000000), wk = 0.0022321 k( 119) = ( 0.2857143 0.3227273 -0.0000000), wk = 0.0022321 k( 120) = ( 0.2767857 0.3227273 -0.0000000), wk = 0.0022321 k( 121) = ( 0.2678571 0.3227273 -0.0000000), wk = 0.0022321 k( 122) = ( 0.2589286 0.3227273 -0.0000000), wk = 0.0022321 k( 123) = ( 0.2500000 0.3227273 -0.0000000), wk = 0.0022321 k( 124) = ( 0.2410714 0.3227273 -0.0000000), wk = 0.0022321 k( 125) = ( 0.2321429 0.3227273 -0.0000000), wk = 0.0022321 k( 126) = ( 0.2232143 0.3227273 -0.0000000), wk = 0.0022321 k( 127) = ( 0.2142857 0.3227273 -0.0000000), wk = 0.0022321 k( 128) = ( 0.2053571 0.3227273 -0.0000000), wk = 0.0022321 k( 129) = ( 0.1964286 0.3227273 -0.0000000), wk = 0.0022321 k( 130) = ( 0.1875000 0.3227273 -0.0000000), wk = 0.0022321 k( 131) = ( 0.1785714 0.3227273 -0.0000000), wk = 0.0022321 k( 132) = ( 0.1696429 0.3227273 -0.0000000), wk = 0.0022321 k( 133) = ( 0.1607143 0.3227273 -0.0000000), wk = 0.0022321 k( 134) = ( 0.1517857 0.3227273 -0.0000000), wk = 0.0022321 k( 135) = ( 0.1428571 0.3227273 -0.0000000), wk = 0.0022321 k( 136) = ( 0.1339286 0.3227273 -0.0000000), wk = 0.0022321 k( 137) = ( 0.1250000 0.3227273 -0.0000000), wk = 0.0022321 k( 138) = ( 0.1160714 0.3227273 -0.0000000), wk = 0.0022321 k( 139) = ( 0.1071429 0.3227273 -0.0000000), wk = 0.0022321 k( 140) = ( 0.0982143 0.3227273 -0.0000000), wk = 0.0022321 k( 141) = ( 0.0892857 0.3227273 -0.0000000), wk = 0.0022321 k( 142) = ( 0.0803571 0.3227273 -0.0000000), wk = 0.0022321 k( 143) = ( 0.0714286 0.3227273 -0.0000000), wk = 0.0022321 k( 144) = ( 0.0625000 0.3227273 -0.0000000), wk = 0.0022321 k( 145) = ( 0.0535714 0.3227273 -0.0000000), wk = 0.0022321 k( 146) = ( 0.0446429 0.3227273 -0.0000000), wk = 0.0022321 k( 147) = ( 0.0357143 0.3227273 -0.0000000), wk = 0.0022321 k( 148) = ( 0.0267857 0.3227273 -0.0000000), wk = 0.0022321 k( 149) = ( 0.0178571 0.3227273 -0.0000000), wk = 0.0022321 k( 150) = ( 0.0089286 0.3227273 -0.0000000), wk = 0.0022321 k( 151) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 152) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 153) = ( 0.0000000 0.3137626 -0.0000000), wk = 0.0022321 k( 154) = ( 0.0000000 0.3047980 -0.0000000), wk = 0.0022321 k( 155) = ( 0.0000000 0.2958333 -0.0000000), wk = 0.0022321 k( 156) = ( 0.0000000 0.2868687 -0.0000000), wk = 0.0022321 k( 157) = ( 0.0000000 0.2779040 -0.0000000), wk = 0.0022321 k( 158) = ( 0.0000000 0.2689394 -0.0000000), wk = 0.0022321 k( 159) = ( 0.0000000 0.2599747 -0.0000000), wk = 0.0022321 k( 160) = ( 0.0000000 0.2510101 -0.0000000), wk = 0.0022321 k( 161) = ( 0.0000000 0.2420455 -0.0000000), wk = 0.0022321 k( 162) = ( 0.0000000 0.2330808 -0.0000000), wk = 0.0022321 k( 163) = ( 0.0000000 0.2241162 -0.0000000), wk = 0.0022321 k( 164) = ( 0.0000000 0.2151515 -0.0000000), wk = 0.0022321 k( 165) = ( 0.0000000 0.2061869 -0.0000000), wk = 0.0022321 k( 166) = ( 0.0000000 0.1972222 -0.0000000), wk = 0.0022321 k( 167) = ( 0.0000000 0.1882576 -0.0000000), wk = 0.0022321 k( 168) = ( 0.0000000 0.1792929 -0.0000000), wk = 0.0022321 k( 169) = ( 0.0000000 0.1703283 -0.0000000), wk = 0.0022321 k( 170) = ( 0.0000000 0.1613636 -0.0000000), wk = 0.0022321 k( 171) = ( 0.0000000 0.1523990 -0.0000000), wk = 0.0022321 k( 172) = ( 0.0000000 0.1434343 -0.0000000), wk = 0.0022321 k( 173) = ( 0.0000000 0.1344697 -0.0000000), wk = 0.0022321 k( 174) = ( 0.0000000 0.1255050 -0.0000000), wk = 0.0022321 k( 175) = ( 0.0000000 0.1165404 -0.0000000), wk = 0.0022321 k( 176) = ( 0.0000000 0.1075758 -0.0000000), wk = 0.0022321 k( 177) = ( 0.0000000 0.0986111 -0.0000000), wk = 0.0022321 k( 178) = ( 0.0000000 0.0896465 -0.0000000), wk = 0.0022321 k( 179) = ( 0.0000000 0.0806818 -0.0000000), wk = 0.0022321 k( 180) = ( 0.0000000 0.0717172 -0.0000000), wk = 0.0022321 k( 181) = ( 0.0000000 0.0627525 -0.0000000), wk = 0.0022321 k( 182) = ( 0.0000000 0.0537879 -0.0000000), wk = 0.0022321 k( 183) = ( 0.0000000 0.0448232 -0.0000000), wk = 0.0022321 k( 184) = ( 0.0000000 0.0358586 -0.0000000), wk = 0.0022321 k( 185) = ( 0.0000000 0.0268939 -0.0000000), wk = 0.0022321 k( 186) = ( 0.0000000 0.0179293 -0.0000000), wk = 0.0022321 k( 187) = ( 0.0000000 0.0089646 -0.0000000), wk = 0.0022321 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 190) = ( 0.0000000 0.0000000 0.0088956), wk = 0.0022321 k( 191) = ( 0.0000000 0.0000000 0.0177911), wk = 0.0022321 k( 192) = ( 0.0000000 0.0000000 0.0266867), wk = 0.0022321 k( 193) = ( 0.0000000 0.0000000 0.0355823), wk = 0.0022321 k( 194) = ( 0.0000000 0.0000000 0.0444779), wk = 0.0022321 k( 195) = ( 0.0000000 0.0000000 0.0533734), wk = 0.0022321 k( 196) = ( 0.0000000 0.0000000 0.0622690), wk = 0.0022321 k( 197) = ( 0.0000000 0.0000000 0.0711646), wk = 0.0022321 k( 198) = ( 0.0000000 0.0000000 0.0800601), wk = 0.0022321 k( 199) = ( 0.0000000 0.0000000 0.0889557), wk = 0.0022321 k( 200) = ( 0.0000000 0.0000000 0.0978513), wk = 0.0022321 k( 201) = ( 0.0000000 0.0000000 0.1067469), wk = 0.0022321 k( 202) = ( 0.0000000 0.0000000 0.1156424), wk = 0.0022321 k( 203) = ( 0.0000000 0.0000000 0.1245380), wk = 0.0022321 k( 204) = ( 0.0000000 0.0000000 0.1334336), wk = 0.0022321 k( 205) = ( 0.0000000 0.0000000 0.1423291), wk = 0.0022321 k( 206) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 207) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 208) = ( 0.0089286 -0.0000000 0.1512247), wk = 0.0022321 k( 209) = ( 0.0178571 -0.0000000 0.1512247), wk = 0.0022321 k( 210) = ( 0.0267857 -0.0000000 0.1512247), wk = 0.0022321 k( 211) = ( 0.0357143 -0.0000000 0.1512247), wk = 0.0022321 k( 212) = ( 0.0446429 -0.0000000 0.1512247), wk = 0.0022321 k( 213) = ( 0.0535714 -0.0000000 0.1512247), wk = 0.0022321 k( 214) = ( 0.0625000 -0.0000000 0.1512247), wk = 0.0022321 k( 215) = ( 0.0714286 -0.0000000 0.1512247), wk = 0.0022321 k( 216) = ( 0.0803571 -0.0000000 0.1512247), wk = 0.0022321 k( 217) = ( 0.0892857 -0.0000000 0.1512247), wk = 0.0022321 k( 218) = ( 0.0982143 -0.0000000 0.1512247), wk = 0.0022321 k( 219) = ( 0.1071429 -0.0000000 0.1512247), wk = 0.0022321 k( 220) = ( 0.1160714 -0.0000000 0.1512247), wk = 0.0022321 k( 221) = ( 0.1250000 -0.0000000 0.1512247), wk = 0.0022321 k( 222) = ( 0.1339286 -0.0000000 0.1512247), wk = 0.0022321 k( 223) = ( 0.1428571 -0.0000000 0.1512247), wk = 0.0022321 k( 224) = ( 0.1517857 -0.0000000 0.1512247), wk = 0.0022321 k( 225) = ( 0.1607143 -0.0000000 0.1512247), wk = 0.0022321 k( 226) = ( 0.1696429 -0.0000000 0.1512247), wk = 0.0022321 k( 227) = ( 0.1785714 -0.0000000 0.1512247), wk = 0.0022321 k( 228) = ( 0.1875000 -0.0000000 0.1512247), wk = 0.0022321 k( 229) = ( 0.1964286 -0.0000000 0.1512247), wk = 0.0022321 k( 230) = ( 0.2053571 -0.0000000 0.1512247), wk = 0.0022321 k( 231) = ( 0.2142857 -0.0000000 0.1512247), wk = 0.0022321 k( 232) = ( 0.2232143 -0.0000000 0.1512247), wk = 0.0022321 k( 233) = ( 0.2321429 -0.0000000 0.1512247), wk = 0.0022321 k( 234) = ( 0.2410714 -0.0000000 0.1512247), wk = 0.0022321 k( 235) = ( 0.2500000 -0.0000000 0.1512247), wk = 0.0022321 k( 236) = ( 0.2589286 -0.0000000 0.1512247), wk = 0.0022321 k( 237) = ( 0.2678571 -0.0000000 0.1512247), wk = 0.0022321 k( 238) = ( 0.2767857 -0.0000000 0.1512247), wk = 0.0022321 k( 239) = ( 0.2857143 -0.0000000 0.1512247), wk = 0.0022321 k( 240) = ( 0.2946429 -0.0000000 0.1512247), wk = 0.0022321 k( 241) = ( 0.3035714 -0.0000000 0.1512247), wk = 0.0022321 k( 242) = ( 0.3125000 -0.0000000 0.1512247), wk = 0.0022321 k( 243) = ( 0.3214286 -0.0000000 0.1512247), wk = 0.0022321 k( 244) = ( 0.3303571 -0.0000000 0.1512247), wk = 0.0022321 k( 245) = ( 0.3392857 -0.0000000 0.1512247), wk = 0.0022321 k( 246) = ( 0.3482143 -0.0000000 0.1512247), wk = 0.0022321 k( 247) = ( 0.3571429 -0.0000000 0.1512247), wk = 0.0022321 k( 248) = ( 0.3660714 -0.0000000 0.1512247), wk = 0.0022321 k( 249) = ( 0.3750000 -0.0000000 0.1512247), wk = 0.0022321 k( 250) = ( 0.3839286 -0.0000000 0.1512247), wk = 0.0022321 k( 251) = ( 0.3928571 -0.0000000 0.1512247), wk = 0.0022321 k( 252) = ( 0.4017857 -0.0000000 0.1512247), wk = 0.0022321 k( 253) = ( 0.4107143 -0.0000000 0.1512247), wk = 0.0022321 k( 254) = ( 0.4196429 -0.0000000 0.1512247), wk = 0.0022321 k( 255) = ( 0.4285714 -0.0000000 0.1512247), wk = 0.0022321 k( 256) = ( 0.4375000 -0.0000000 0.1512247), wk = 0.0022321 k( 257) = ( 0.4464286 -0.0000000 0.1512247), wk = 0.0022321 k( 258) = ( 0.4553571 -0.0000000 0.1512247), wk = 0.0022321 k( 259) = ( 0.4642857 -0.0000000 0.1512247), wk = 0.0022321 k( 260) = ( 0.4732143 -0.0000000 0.1512247), wk = 0.0022321 k( 261) = ( 0.4821429 -0.0000000 0.1512247), wk = 0.0022321 k( 262) = ( 0.4910714 -0.0000000 0.1512247), wk = 0.0022321 k( 263) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 264) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 265) = ( 0.5000000 0.0089646 0.1512247), wk = 0.0022321 k( 266) = ( 0.5000000 0.0179293 0.1512247), wk = 0.0022321 k( 267) = ( 0.5000000 0.0268939 0.1512247), wk = 0.0022321 k( 268) = ( 0.5000000 0.0358586 0.1512247), wk = 0.0022321 k( 269) = ( 0.5000000 0.0448232 0.1512247), wk = 0.0022321 k( 270) = ( 0.5000000 0.0537879 0.1512247), wk = 0.0022321 k( 271) = ( 0.5000000 0.0627525 0.1512247), wk = 0.0022321 k( 272) = ( 0.5000000 0.0717172 0.1512247), wk = 0.0022321 k( 273) = ( 0.5000000 0.0806818 0.1512247), wk = 0.0022321 k( 274) = ( 0.5000000 0.0896465 0.1512247), wk = 0.0022321 k( 275) = ( 0.5000000 0.0986111 0.1512247), wk = 0.0022321 k( 276) = ( 0.5000000 0.1075758 0.1512247), wk = 0.0022321 k( 277) = ( 0.5000000 0.1165404 0.1512247), wk = 0.0022321 k( 278) = ( 0.5000000 0.1255050 0.1512247), wk = 0.0022321 k( 279) = ( 0.5000000 0.1344697 0.1512247), wk = 0.0022321 k( 280) = ( 0.5000000 0.1434343 0.1512247), wk = 0.0022321 k( 281) = ( 0.5000000 0.1523990 0.1512247), wk = 0.0022321 k( 282) = ( 0.5000000 0.1613636 0.1512247), wk = 0.0022321 k( 283) = ( 0.5000000 0.1703283 0.1512247), wk = 0.0022321 k( 284) = ( 0.5000000 0.1792929 0.1512247), wk = 0.0022321 k( 285) = ( 0.5000000 0.1882576 0.1512247), wk = 0.0022321 k( 286) = ( 0.5000000 0.1972222 0.1512247), wk = 0.0022321 k( 287) = ( 0.5000000 0.2061869 0.1512247), wk = 0.0022321 k( 288) = ( 0.5000000 0.2151515 0.1512247), wk = 0.0022321 k( 289) = ( 0.5000000 0.2241162 0.1512247), wk = 0.0022321 k( 290) = ( 0.5000000 0.2330808 0.1512247), wk = 0.0022321 k( 291) = ( 0.5000000 0.2420455 0.1512247), wk = 0.0022321 k( 292) = ( 0.5000000 0.2510101 0.1512247), wk = 0.0022321 k( 293) = ( 0.5000000 0.2599747 0.1512247), wk = 0.0022321 k( 294) = ( 0.5000000 0.2689394 0.1512247), wk = 0.0022321 k( 295) = ( 0.5000000 0.2779040 0.1512247), wk = 0.0022321 k( 296) = ( 0.5000000 0.2868687 0.1512247), wk = 0.0022321 k( 297) = ( 0.5000000 0.2958333 0.1512247), wk = 0.0022321 k( 298) = ( 0.5000000 0.3047980 0.1512247), wk = 0.0022321 k( 299) = ( 0.5000000 0.3137626 0.1512247), wk = 0.0022321 k( 300) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 k( 301) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 k( 302) = ( 0.4910714 0.3227273 0.1512247), wk = 0.0022321 k( 303) = ( 0.4821429 0.3227273 0.1512247), wk = 0.0022321 k( 304) = ( 0.4732143 0.3227273 0.1512247), wk = 0.0022321 k( 305) = ( 0.4642857 0.3227273 0.1512247), wk = 0.0022321 k( 306) = ( 0.4553571 0.3227273 0.1512247), wk = 0.0022321 k( 307) = ( 0.4464286 0.3227273 0.1512247), wk = 0.0022321 k( 308) = ( 0.4375000 0.3227273 0.1512247), wk = 0.0022321 k( 309) = ( 0.4285714 0.3227273 0.1512247), wk = 0.0022321 k( 310) = ( 0.4196429 0.3227273 0.1512247), wk = 0.0022321 k( 311) = ( 0.4107143 0.3227273 0.1512247), wk = 0.0022321 k( 312) = ( 0.4017857 0.3227273 0.1512247), wk = 0.0022321 k( 313) = ( 0.3928571 0.3227273 0.1512247), wk = 0.0022321 k( 314) = ( 0.3839286 0.3227273 0.1512247), wk = 0.0022321 k( 315) = ( 0.3750000 0.3227273 0.1512247), wk = 0.0022321 k( 316) = ( 0.3660714 0.3227273 0.1512247), wk = 0.0022321 k( 317) = ( 0.3571429 0.3227273 0.1512247), wk = 0.0022321 k( 318) = ( 0.3482143 0.3227273 0.1512247), wk = 0.0022321 k( 319) = ( 0.3392857 0.3227273 0.1512247), wk = 0.0022321 k( 320) = ( 0.3303571 0.3227273 0.1512247), wk = 0.0022321 k( 321) = ( 0.3214286 0.3227273 0.1512247), wk = 0.0022321 k( 322) = ( 0.3125000 0.3227273 0.1512247), wk = 0.0022321 k( 323) = ( 0.3035714 0.3227273 0.1512247), wk = 0.0022321 k( 324) = ( 0.2946429 0.3227273 0.1512247), wk = 0.0022321 k( 325) = ( 0.2857143 0.3227273 0.1512247), wk = 0.0022321 k( 326) = ( 0.2767857 0.3227273 0.1512247), wk = 0.0022321 k( 327) = ( 0.2678571 0.3227273 0.1512247), wk = 0.0022321 k( 328) = ( 0.2589286 0.3227273 0.1512247), wk = 0.0022321 k( 329) = ( 0.2500000 0.3227273 0.1512247), wk = 0.0022321 k( 330) = ( 0.2410714 0.3227273 0.1512247), wk = 0.0022321 k( 331) = ( 0.2321429 0.3227273 0.1512247), wk = 0.0022321 k( 332) = ( 0.2232143 0.3227273 0.1512247), wk = 0.0022321 k( 333) = ( 0.2142857 0.3227273 0.1512247), wk = 0.0022321 k( 334) = ( 0.2053571 0.3227273 0.1512247), wk = 0.0022321 k( 335) = ( 0.1964286 0.3227273 0.1512247), wk = 0.0022321 k( 336) = ( 0.1875000 0.3227273 0.1512247), wk = 0.0022321 k( 337) = ( 0.1785714 0.3227273 0.1512247), wk = 0.0022321 k( 338) = ( 0.1696429 0.3227273 0.1512247), wk = 0.0022321 k( 339) = ( 0.1607143 0.3227273 0.1512247), wk = 0.0022321 k( 340) = ( 0.1517857 0.3227273 0.1512247), wk = 0.0022321 k( 341) = ( 0.1428571 0.3227273 0.1512247), wk = 0.0022321 k( 342) = ( 0.1339286 0.3227273 0.1512247), wk = 0.0022321 k( 343) = ( 0.1250000 0.3227273 0.1512247), wk = 0.0022321 k( 344) = ( 0.1160714 0.3227273 0.1512247), wk = 0.0022321 k( 345) = ( 0.1071429 0.3227273 0.1512247), wk = 0.0022321 k( 346) = ( 0.0982143 0.3227273 0.1512247), wk = 0.0022321 k( 347) = ( 0.0892857 0.3227273 0.1512247), wk = 0.0022321 k( 348) = ( 0.0803571 0.3227273 0.1512247), wk = 0.0022321 k( 349) = ( 0.0714286 0.3227273 0.1512247), wk = 0.0022321 k( 350) = ( 0.0625000 0.3227273 0.1512247), wk = 0.0022321 k( 351) = ( 0.0535714 0.3227273 0.1512247), wk = 0.0022321 k( 352) = ( 0.0446429 0.3227273 0.1512247), wk = 0.0022321 k( 353) = ( 0.0357143 0.3227273 0.1512247), wk = 0.0022321 k( 354) = ( 0.0267857 0.3227273 0.1512247), wk = 0.0022321 k( 355) = ( 0.0178571 0.3227273 0.1512247), wk = 0.0022321 k( 356) = ( 0.0089286 0.3227273 0.1512247), wk = 0.0022321 k( 357) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 358) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 359) = ( 0.0000000 0.3137626 0.1512247), wk = 0.0022321 k( 360) = ( 0.0000000 0.3047980 0.1512247), wk = 0.0022321 k( 361) = ( 0.0000000 0.2958333 0.1512247), wk = 0.0022321 k( 362) = ( 0.0000000 0.2868687 0.1512247), wk = 0.0022321 k( 363) = ( 0.0000000 0.2779040 0.1512247), wk = 0.0022321 k( 364) = ( 0.0000000 0.2689394 0.1512247), wk = 0.0022321 k( 365) = ( 0.0000000 0.2599747 0.1512247), wk = 0.0022321 k( 366) = ( 0.0000000 0.2510101 0.1512247), wk = 0.0022321 k( 367) = ( 0.0000000 0.2420455 0.1512247), wk = 0.0022321 k( 368) = ( 0.0000000 0.2330808 0.1512247), wk = 0.0022321 k( 369) = ( 0.0000000 0.2241162 0.1512247), wk = 0.0022321 k( 370) = ( 0.0000000 0.2151515 0.1512247), wk = 0.0022321 k( 371) = ( 0.0000000 0.2061869 0.1512247), wk = 0.0022321 k( 372) = ( 0.0000000 0.1972222 0.1512247), wk = 0.0022321 k( 373) = ( 0.0000000 0.1882576 0.1512247), wk = 0.0022321 k( 374) = ( 0.0000000 0.1792929 0.1512247), wk = 0.0022321 k( 375) = ( 0.0000000 0.1703283 0.1512247), wk = 0.0022321 k( 376) = ( 0.0000000 0.1613636 0.1512247), wk = 0.0022321 k( 377) = ( 0.0000000 0.1523990 0.1512247), wk = 0.0022321 k( 378) = ( 0.0000000 0.1434343 0.1512247), wk = 0.0022321 k( 379) = ( 0.0000000 0.1344697 0.1512247), wk = 0.0022321 k( 380) = ( 0.0000000 0.1255050 0.1512247), wk = 0.0022321 k( 381) = ( 0.0000000 0.1165404 0.1512247), wk = 0.0022321 k( 382) = ( 0.0000000 0.1075758 0.1512247), wk = 0.0022321 k( 383) = ( 0.0000000 0.0986111 0.1512247), wk = 0.0022321 k( 384) = ( 0.0000000 0.0896465 0.1512247), wk = 0.0022321 k( 385) = ( 0.0000000 0.0806818 0.1512247), wk = 0.0022321 k( 386) = ( 0.0000000 0.0717172 0.1512247), wk = 0.0022321 k( 387) = ( 0.0000000 0.0627525 0.1512247), wk = 0.0022321 k( 388) = ( 0.0000000 0.0537879 0.1512247), wk = 0.0022321 k( 389) = ( 0.0000000 0.0448232 0.1512247), wk = 0.0022321 k( 390) = ( 0.0000000 0.0358586 0.1512247), wk = 0.0022321 k( 391) = ( 0.0000000 0.0268939 0.1512247), wk = 0.0022321 k( 392) = ( 0.0000000 0.0179293 0.1512247), wk = 0.0022321 k( 393) = ( 0.0000000 0.0089646 0.1512247), wk = 0.0022321 k( 394) = ( 0.0000000 0.0000000 0.1512247), wk = 0.0022321 k( 395) = ( 0.0000000 0.3227273 -0.0000000), wk = 0.0022321 k( 396) = ( 0.0000000 0.3227273 0.0088956), wk = 0.0022321 k( 397) = ( 0.0000000 0.3227273 0.0177911), wk = 0.0022321 k( 398) = ( 0.0000000 0.3227273 0.0266867), wk = 0.0022321 k( 399) = ( 0.0000000 0.3227273 0.0355823), wk = 0.0022321 k( 400) = ( 0.0000000 0.3227273 0.0444779), wk = 0.0022321 k( 401) = ( 0.0000000 0.3227273 0.0533734), wk = 0.0022321 k( 402) = ( 0.0000000 0.3227273 0.0622690), wk = 0.0022321 k( 403) = ( 0.0000000 0.3227273 0.0711646), wk = 0.0022321 k( 404) = ( 0.0000000 0.3227273 0.0800601), wk = 0.0022321 k( 405) = ( 0.0000000 0.3227273 0.0889557), wk = 0.0022321 k( 406) = ( 0.0000000 0.3227273 0.0978513), wk = 0.0022321 k( 407) = ( 0.0000000 0.3227273 0.1067469), wk = 0.0022321 k( 408) = ( 0.0000000 0.3227273 0.1156424), wk = 0.0022321 k( 409) = ( 0.0000000 0.3227273 0.1245380), wk = 0.0022321 k( 410) = ( 0.0000000 0.3227273 0.1334336), wk = 0.0022321 k( 411) = ( 0.0000000 0.3227273 0.1423291), wk = 0.0022321 k( 412) = ( 0.0000000 0.3227273 0.1512247), wk = 0.0022321 k( 413) = ( 0.5000000 -0.0000000 0.1512247), wk = 0.0022321 k( 414) = ( 0.5000000 -0.0000000 0.1423291), wk = 0.0022321 k( 415) = ( 0.5000000 -0.0000000 0.1334336), wk = 0.0022321 k( 416) = ( 0.5000000 -0.0000000 0.1245380), wk = 0.0022321 k( 417) = ( 0.5000000 -0.0000000 0.1156424), wk = 0.0022321 k( 418) = ( 0.5000000 -0.0000000 0.1067469), wk = 0.0022321 k( 419) = ( 0.5000000 -0.0000000 0.0978513), wk = 0.0022321 k( 420) = ( 0.5000000 -0.0000000 0.0889557), wk = 0.0022321 k( 421) = ( 0.5000000 -0.0000000 0.0800601), wk = 0.0022321 k( 422) = ( 0.5000000 -0.0000000 0.0711646), wk = 0.0022321 k( 423) = ( 0.5000000 -0.0000000 0.0622690), wk = 0.0022321 k( 424) = ( 0.5000000 -0.0000000 0.0533734), wk = 0.0022321 k( 425) = ( 0.5000000 -0.0000000 0.0444779), wk = 0.0022321 k( 426) = ( 0.5000000 -0.0000000 0.0355823), wk = 0.0022321 k( 427) = ( 0.5000000 -0.0000000 0.0266867), wk = 0.0022321 k( 428) = ( 0.5000000 -0.0000000 0.0177911), wk = 0.0022321 k( 429) = ( 0.5000000 -0.0000000 0.0088956), wk = 0.0022321 k( 430) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0022321 k( 431) = ( 0.5000000 0.3227273 -0.0000000), wk = 0.0022321 k( 432) = ( 0.5000000 0.3227273 0.0088956), wk = 0.0022321 k( 433) = ( 0.5000000 0.3227273 0.0177911), wk = 0.0022321 k( 434) = ( 0.5000000 0.3227273 0.0266867), wk = 0.0022321 k( 435) = ( 0.5000000 0.3227273 0.0355823), wk = 0.0022321 k( 436) = ( 0.5000000 0.3227273 0.0444779), wk = 0.0022321 k( 437) = ( 0.5000000 0.3227273 0.0533734), wk = 0.0022321 k( 438) = ( 0.5000000 0.3227273 0.0622690), wk = 0.0022321 k( 439) = ( 0.5000000 0.3227273 0.0711646), wk = 0.0022321 k( 440) = ( 0.5000000 0.3227273 0.0800601), wk = 0.0022321 k( 441) = ( 0.5000000 0.3227273 0.0889557), wk = 0.0022321 k( 442) = ( 0.5000000 0.3227273 0.0978513), wk = 0.0022321 k( 443) = ( 0.5000000 0.3227273 0.1067469), wk = 0.0022321 k( 444) = ( 0.5000000 0.3227273 0.1156424), wk = 0.0022321 k( 445) = ( 0.5000000 0.3227273 0.1245380), wk = 0.0022321 k( 446) = ( 0.5000000 0.3227273 0.1334336), wk = 0.0022321 k( 447) = ( 0.5000000 0.3227273 0.1423291), wk = 0.0022321 k( 448) = ( 0.5000000 0.3227273 0.1512247), wk = 0.0022321 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 2) = ( 0.0089286 0.0000000 0.0000000), wk = 0.0022321 k( 3) = ( 0.0178571 0.0000000 0.0000000), wk = 0.0022321 k( 4) = ( 0.0267857 0.0000000 0.0000000), wk = 0.0022321 k( 5) = ( 0.0357143 0.0000000 0.0000000), wk = 0.0022321 k( 6) = ( 0.0446429 0.0000000 0.0000000), wk = 0.0022321 k( 7) = ( 0.0535714 0.0000000 0.0000000), wk = 0.0022321 k( 8) = ( 0.0625000 0.0000000 0.0000000), wk = 0.0022321 k( 9) = ( 0.0714286 0.0000000 0.0000000), wk = 0.0022321 k( 10) = ( 0.0803571 -0.0000000 -0.0000000), wk = 0.0022321 k( 11) = ( 0.0892857 0.0000000 -0.0000000), wk = 0.0022321 k( 12) = ( 0.0982143 -0.0000000 0.0000000), wk = 0.0022321 k( 13) = ( 0.1071429 0.0000000 0.0000000), wk = 0.0022321 k( 14) = ( 0.1160714 0.0000000 0.0000000), wk = 0.0022321 k( 15) = ( 0.1250000 0.0000000 0.0000000), wk = 0.0022321 k( 16) = ( 0.1339286 -0.0000000 -0.0000000), wk = 0.0022321 k( 17) = ( 0.1428571 0.0000000 0.0000000), wk = 0.0022321 k( 18) = ( 0.1517857 0.0000000 0.0000000), wk = 0.0022321 k( 19) = ( 0.1607143 0.0000000 0.0000000), wk = 0.0022321 k( 20) = ( 0.1696429 0.0000000 0.0000000), wk = 0.0022321 k( 21) = ( 0.1785714 0.0000000 0.0000000), wk = 0.0022321 k( 22) = ( 0.1875000 0.0000000 0.0000000), wk = 0.0022321 k( 23) = ( 0.1964286 -0.0000000 0.0000000), wk = 0.0022321 k( 24) = ( 0.2053571 -0.0000000 0.0000000), wk = 0.0022321 k( 25) = ( 0.2142857 -0.0000000 0.0000000), wk = 0.0022321 k( 26) = ( 0.2232143 0.0000000 -0.0000000), wk = 0.0022321 k( 27) = ( 0.2321429 0.0000000 0.0000000), wk = 0.0022321 k( 28) = ( 0.2410714 0.0000000 0.0000000), wk = 0.0022321 k( 29) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0022321 k( 30) = ( 0.2589286 0.0000000 0.0000000), wk = 0.0022321 k( 31) = ( 0.2678571 -0.0000000 -0.0000000), wk = 0.0022321 k( 32) = ( 0.2767857 0.0000000 0.0000000), wk = 0.0022321 k( 33) = ( 0.2857143 0.0000000 0.0000000), wk = 0.0022321 k( 34) = ( 0.2946429 0.0000000 0.0000000), wk = 0.0022321 k( 35) = ( 0.3035714 -0.0000000 0.0000000), wk = 0.0022321 k( 36) = ( 0.3125000 0.0000000 0.0000000), wk = 0.0022321 k( 37) = ( 0.3214286 0.0000000 0.0000000), wk = 0.0022321 k( 38) = ( 0.3303571 -0.0000000 0.0000000), wk = 0.0022321 k( 39) = ( 0.3392857 0.0000000 0.0000000), wk = 0.0022321 k( 40) = ( 0.3482143 0.0000000 0.0000000), wk = 0.0022321 k( 41) = ( 0.3571429 0.0000000 0.0000000), wk = 0.0022321 k( 42) = ( 0.3660714 0.0000000 0.0000000), wk = 0.0022321 k( 43) = ( 0.3750000 0.0000000 0.0000000), wk = 0.0022321 k( 44) = ( 0.3839286 -0.0000000 0.0000000), wk = 0.0022321 k( 45) = ( 0.3928571 -0.0000000 0.0000000), wk = 0.0022321 k( 46) = ( 0.4017857 0.0000000 0.0000000), wk = 0.0022321 k( 47) = ( 0.4107143 -0.0000000 -0.0000000), wk = 0.0022321 k( 48) = ( 0.4196429 0.0000000 0.0000000), wk = 0.0022321 k( 49) = ( 0.4285714 0.0000000 0.0000000), wk = 0.0022321 k( 50) = ( 0.4375000 0.0000000 0.0000000), wk = 0.0022321 k( 51) = ( 0.4464286 0.0000000 0.0000000), wk = 0.0022321 k( 52) = ( 0.4553571 0.0000000 0.0000000), wk = 0.0022321 k( 53) = ( 0.4642857 0.0000000 0.0000000), wk = 0.0022321 k( 54) = ( 0.4732143 0.0000000 0.0000000), wk = 0.0022321 k( 55) = ( 0.4821429 0.0000000 0.0000000), wk = 0.0022321 k( 56) = ( 0.4910714 0.0000000 -0.0000000), wk = 0.0022321 k( 57) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 58) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 59) = ( 0.5000000 0.0138889 0.0000000), wk = 0.0022321 k( 60) = ( 0.5000000 0.0277778 -0.0000000), wk = 0.0022321 k( 61) = ( 0.5000000 0.0416667 0.0000000), wk = 0.0022321 k( 62) = ( 0.5000000 0.0555556 0.0000000), wk = 0.0022321 k( 63) = ( 0.5000000 0.0694444 0.0000000), wk = 0.0022321 k( 64) = ( 0.5000000 0.0833333 0.0000000), wk = 0.0022321 k( 65) = ( 0.5000000 0.0972222 0.0000000), wk = 0.0022321 k( 66) = ( 0.5000000 0.1111111 0.0000000), wk = 0.0022321 k( 67) = ( 0.5000000 0.1250000 0.0000000), wk = 0.0022321 k( 68) = ( 0.5000000 0.1388889 -0.0000000), wk = 0.0022321 k( 69) = ( 0.5000000 0.1527778 0.0000000), wk = 0.0022321 k( 70) = ( 0.5000000 0.1666667 0.0000000), wk = 0.0022321 k( 71) = ( 0.5000000 0.1805556 0.0000000), wk = 0.0022321 k( 72) = ( 0.5000000 0.1944444 0.0000000), wk = 0.0022321 k( 73) = ( 0.5000000 0.2083333 -0.0000000), wk = 0.0022321 k( 74) = ( 0.5000000 0.2222222 0.0000000), wk = 0.0022321 k( 75) = ( 0.5000000 0.2361111 0.0000000), wk = 0.0022321 k( 76) = ( 0.5000000 0.2500000 0.0000000), wk = 0.0022321 k( 77) = ( 0.5000000 0.2638889 0.0000000), wk = 0.0022321 k( 78) = ( 0.5000000 0.2777778 -0.0000000), wk = 0.0022321 k( 79) = ( 0.5000000 0.2916667 0.0000000), wk = 0.0022321 k( 80) = ( 0.5000000 0.3055556 0.0000000), wk = 0.0022321 k( 81) = ( 0.5000000 0.3194444 0.0000000), wk = 0.0022321 k( 82) = ( 0.5000000 0.3333333 0.0000000), wk = 0.0022321 k( 83) = ( 0.5000000 0.3472222 0.0000000), wk = 0.0022321 k( 84) = ( 0.5000000 0.3611111 -0.0000000), wk = 0.0022321 k( 85) = ( 0.5000000 0.3750000 0.0000000), wk = 0.0022321 k( 86) = ( 0.5000000 0.3888889 0.0000000), wk = 0.0022321 k( 87) = ( 0.5000000 0.4027778 0.0000000), wk = 0.0022321 k( 88) = ( 0.5000000 0.4166667 -0.0000000), wk = 0.0022321 k( 89) = ( 0.5000000 0.4305556 0.0000000), wk = 0.0022321 k( 90) = ( 0.5000000 0.4444444 0.0000000), wk = 0.0022321 k( 91) = ( 0.5000000 0.4583333 -0.0000000), wk = 0.0022321 k( 92) = ( 0.5000000 0.4722222 0.0000000), wk = 0.0022321 k( 93) = ( 0.5000000 0.4861111 -0.0000000), wk = 0.0022321 k( 94) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 95) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 96) = ( 0.4910714 0.5000000 0.0000000), wk = 0.0022321 k( 97) = ( 0.4821429 0.5000000 0.0000000), wk = 0.0022321 k( 98) = ( 0.4732143 0.5000000 0.0000000), wk = 0.0022321 k( 99) = ( 0.4642857 0.5000000 0.0000000), wk = 0.0022321 k( 100) = ( 0.4553571 0.5000000 0.0000000), wk = 0.0022321 k( 101) = ( 0.4464286 0.5000000 0.0000000), wk = 0.0022321 k( 102) = ( 0.4375000 0.5000000 0.0000000), wk = 0.0022321 k( 103) = ( 0.4285714 0.5000000 -0.0000000), wk = 0.0022321 k( 104) = ( 0.4196429 0.5000000 0.0000000), wk = 0.0022321 k( 105) = ( 0.4107143 0.5000000 0.0000000), wk = 0.0022321 k( 106) = ( 0.4017857 0.5000000 -0.0000000), wk = 0.0022321 k( 107) = ( 0.3928571 0.5000000 -0.0000000), wk = 0.0022321 k( 108) = ( 0.3839286 0.5000000 0.0000000), wk = 0.0022321 k( 109) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0022321 k( 110) = ( 0.3660714 0.5000000 0.0000000), wk = 0.0022321 k( 111) = ( 0.3571429 0.5000000 -0.0000000), wk = 0.0022321 k( 112) = ( 0.3482143 0.5000000 0.0000000), wk = 0.0022321 k( 113) = ( 0.3392857 0.5000000 0.0000000), wk = 0.0022321 k( 114) = ( 0.3303571 0.5000000 0.0000000), wk = 0.0022321 k( 115) = ( 0.3214286 0.5000000 -0.0000000), wk = 0.0022321 k( 116) = ( 0.3125000 0.5000000 0.0000000), wk = 0.0022321 k( 117) = ( 0.3035714 0.5000000 0.0000000), wk = 0.0022321 k( 118) = ( 0.2946429 0.5000000 0.0000000), wk = 0.0022321 k( 119) = ( 0.2857143 0.5000000 0.0000000), wk = 0.0022321 k( 120) = ( 0.2767857 0.5000000 0.0000000), wk = 0.0022321 k( 121) = ( 0.2678571 0.5000000 0.0000000), wk = 0.0022321 k( 122) = ( 0.2589286 0.5000000 0.0000000), wk = 0.0022321 k( 123) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0022321 k( 124) = ( 0.2410714 0.5000000 0.0000000), wk = 0.0022321 k( 125) = ( 0.2321429 0.5000000 0.0000000), wk = 0.0022321 k( 126) = ( 0.2232143 0.5000000 0.0000000), wk = 0.0022321 k( 127) = ( 0.2142857 0.5000000 0.0000000), wk = 0.0022321 k( 128) = ( 0.2053571 0.5000000 0.0000000), wk = 0.0022321 k( 129) = ( 0.1964286 0.5000000 0.0000000), wk = 0.0022321 k( 130) = ( 0.1875000 0.5000000 0.0000000), wk = 0.0022321 k( 131) = ( 0.1785714 0.5000000 0.0000000), wk = 0.0022321 k( 132) = ( 0.1696429 0.5000000 0.0000000), wk = 0.0022321 k( 133) = ( 0.1607143 0.5000000 0.0000000), wk = 0.0022321 k( 134) = ( 0.1517857 0.5000000 0.0000000), wk = 0.0022321 k( 135) = ( 0.1428571 0.5000000 0.0000000), wk = 0.0022321 k( 136) = ( 0.1339286 0.5000000 0.0000000), wk = 0.0022321 k( 137) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0022321 k( 138) = ( 0.1160714 0.5000000 0.0000000), wk = 0.0022321 k( 139) = ( 0.1071429 0.5000000 0.0000000), wk = 0.0022321 k( 140) = ( 0.0982143 0.5000000 0.0000000), wk = 0.0022321 k( 141) = ( 0.0892857 0.5000000 0.0000000), wk = 0.0022321 k( 142) = ( 0.0803571 0.5000000 0.0000000), wk = 0.0022321 k( 143) = ( 0.0714286 0.5000000 0.0000000), wk = 0.0022321 k( 144) = ( 0.0625000 0.5000000 0.0000000), wk = 0.0022321 k( 145) = ( 0.0535714 0.5000000 0.0000000), wk = 0.0022321 k( 146) = ( 0.0446429 0.5000000 0.0000000), wk = 0.0022321 k( 147) = ( 0.0357143 0.5000000 0.0000000), wk = 0.0022321 k( 148) = ( 0.0267857 0.5000000 0.0000000), wk = 0.0022321 k( 149) = ( 0.0178571 0.5000000 0.0000000), wk = 0.0022321 k( 150) = ( 0.0089286 0.5000000 0.0000000), wk = 0.0022321 k( 151) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 152) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 153) = ( 0.0000000 0.4861111 0.0000000), wk = 0.0022321 k( 154) = ( 0.0000000 0.4722222 0.0000000), wk = 0.0022321 k( 155) = ( 0.0000000 0.4583333 -0.0000000), wk = 0.0022321 k( 156) = ( 0.0000000 0.4444444 0.0000000), wk = 0.0022321 k( 157) = ( 0.0000000 0.4305556 -0.0000000), wk = 0.0022321 k( 158) = ( 0.0000000 0.4166667 0.0000000), wk = 0.0022321 k( 159) = ( 0.0000000 0.4027778 -0.0000000), wk = 0.0022321 k( 160) = ( 0.0000000 0.3888889 -0.0000000), wk = 0.0022321 k( 161) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0022321 k( 162) = ( 0.0000000 0.3611111 0.0000000), wk = 0.0022321 k( 163) = ( 0.0000000 0.3472222 -0.0000000), wk = 0.0022321 k( 164) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0022321 k( 165) = ( 0.0000000 0.3194444 0.0000000), wk = 0.0022321 k( 166) = ( 0.0000000 0.3055556 0.0000000), wk = 0.0022321 k( 167) = ( 0.0000000 0.2916667 0.0000000), wk = 0.0022321 k( 168) = ( 0.0000000 0.2777778 0.0000000), wk = 0.0022321 k( 169) = ( 0.0000000 0.2638889 -0.0000000), wk = 0.0022321 k( 170) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0022321 k( 171) = ( 0.0000000 0.2361111 0.0000000), wk = 0.0022321 k( 172) = ( 0.0000000 0.2222222 0.0000000), wk = 0.0022321 k( 173) = ( 0.0000000 0.2083333 -0.0000000), wk = 0.0022321 k( 174) = ( 0.0000000 0.1944444 -0.0000000), wk = 0.0022321 k( 175) = ( 0.0000000 0.1805556 0.0000000), wk = 0.0022321 k( 176) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0022321 k( 177) = ( 0.0000000 0.1527778 0.0000000), wk = 0.0022321 k( 178) = ( 0.0000000 0.1388889 0.0000000), wk = 0.0022321 k( 179) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0022321 k( 180) = ( 0.0000000 0.1111111 0.0000000), wk = 0.0022321 k( 181) = ( 0.0000000 0.0972222 -0.0000000), wk = 0.0022321 k( 182) = ( 0.0000000 0.0833333 0.0000000), wk = 0.0022321 k( 183) = ( 0.0000000 0.0694444 0.0000000), wk = 0.0022321 k( 184) = ( 0.0000000 0.0555556 -0.0000000), wk = 0.0022321 k( 185) = ( 0.0000000 0.0416667 0.0000000), wk = 0.0022321 k( 186) = ( 0.0000000 0.0277778 -0.0000000), wk = 0.0022321 k( 187) = ( 0.0000000 0.0138889 -0.0000000), wk = 0.0022321 k( 188) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 189) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022321 k( 190) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0022321 k( 191) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0022321 k( 192) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0022321 k( 193) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0022321 k( 194) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0022321 k( 195) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0022321 k( 196) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0022321 k( 197) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0022321 k( 198) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0022321 k( 199) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0022321 k( 200) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0022321 k( 201) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0022321 k( 202) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0022321 k( 203) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0022321 k( 204) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0022321 k( 205) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0022321 k( 206) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 207) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 208) = ( 0.0089286 0.0000000 0.5000000), wk = 0.0022321 k( 209) = ( 0.0178571 0.0000000 0.5000000), wk = 0.0022321 k( 210) = ( 0.0267857 0.0000000 0.5000000), wk = 0.0022321 k( 211) = ( 0.0357143 0.0000000 0.5000000), wk = 0.0022321 k( 212) = ( 0.0446429 0.0000000 0.5000000), wk = 0.0022321 k( 213) = ( 0.0535714 0.0000000 0.5000000), wk = 0.0022321 k( 214) = ( 0.0625000 0.0000000 0.5000000), wk = 0.0022321 k( 215) = ( 0.0714286 0.0000000 0.5000000), wk = 0.0022321 k( 216) = ( 0.0803571 -0.0000000 0.5000000), wk = 0.0022321 k( 217) = ( 0.0892857 0.0000000 0.5000000), wk = 0.0022321 k( 218) = ( 0.0982143 -0.0000000 0.5000000), wk = 0.0022321 k( 219) = ( 0.1071429 0.0000000 0.5000000), wk = 0.0022321 k( 220) = ( 0.1160714 0.0000000 0.5000000), wk = 0.0022321 k( 221) = ( 0.1250000 0.0000000 0.5000000), wk = 0.0022321 k( 222) = ( 0.1339286 -0.0000000 0.5000000), wk = 0.0022321 k( 223) = ( 0.1428571 0.0000000 0.5000000), wk = 0.0022321 k( 224) = ( 0.1517857 0.0000000 0.5000000), wk = 0.0022321 k( 225) = ( 0.1607143 0.0000000 0.5000000), wk = 0.0022321 k( 226) = ( 0.1696429 0.0000000 0.5000000), wk = 0.0022321 k( 227) = ( 0.1785714 0.0000000 0.5000000), wk = 0.0022321 k( 228) = ( 0.1875000 0.0000000 0.5000000), wk = 0.0022321 k( 229) = ( 0.1964286 -0.0000000 0.5000000), wk = 0.0022321 k( 230) = ( 0.2053571 -0.0000000 0.5000000), wk = 0.0022321 k( 231) = ( 0.2142857 -0.0000000 0.5000000), wk = 0.0022321 k( 232) = ( 0.2232143 0.0000000 0.5000000), wk = 0.0022321 k( 233) = ( 0.2321429 0.0000000 0.5000000), wk = 0.0022321 k( 234) = ( 0.2410714 0.0000000 0.5000000), wk = 0.0022321 k( 235) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0022321 k( 236) = ( 0.2589286 0.0000000 0.5000000), wk = 0.0022321 k( 237) = ( 0.2678571 -0.0000000 0.5000000), wk = 0.0022321 k( 238) = ( 0.2767857 0.0000000 0.5000000), wk = 0.0022321 k( 239) = ( 0.2857143 0.0000000 0.5000000), wk = 0.0022321 k( 240) = ( 0.2946429 0.0000000 0.5000000), wk = 0.0022321 k( 241) = ( 0.3035714 -0.0000000 0.5000000), wk = 0.0022321 k( 242) = ( 0.3125000 0.0000000 0.5000000), wk = 0.0022321 k( 243) = ( 0.3214286 0.0000000 0.5000000), wk = 0.0022321 k( 244) = ( 0.3303571 -0.0000000 0.5000000), wk = 0.0022321 k( 245) = ( 0.3392857 0.0000000 0.5000000), wk = 0.0022321 k( 246) = ( 0.3482143 0.0000000 0.5000000), wk = 0.0022321 k( 247) = ( 0.3571429 0.0000000 0.5000000), wk = 0.0022321 k( 248) = ( 0.3660714 0.0000000 0.5000000), wk = 0.0022321 k( 249) = ( 0.3750000 0.0000000 0.5000000), wk = 0.0022321 k( 250) = ( 0.3839286 -0.0000000 0.5000000), wk = 0.0022321 k( 251) = ( 0.3928571 -0.0000000 0.5000000), wk = 0.0022321 k( 252) = ( 0.4017857 0.0000000 0.5000000), wk = 0.0022321 k( 253) = ( 0.4107143 -0.0000000 0.5000000), wk = 0.0022321 k( 254) = ( 0.4196429 0.0000000 0.5000000), wk = 0.0022321 k( 255) = ( 0.4285714 0.0000000 0.5000000), wk = 0.0022321 k( 256) = ( 0.4375000 0.0000000 0.5000000), wk = 0.0022321 k( 257) = ( 0.4464286 0.0000000 0.5000000), wk = 0.0022321 k( 258) = ( 0.4553571 0.0000000 0.5000000), wk = 0.0022321 k( 259) = ( 0.4642857 0.0000000 0.5000000), wk = 0.0022321 k( 260) = ( 0.4732143 0.0000000 0.5000000), wk = 0.0022321 k( 261) = ( 0.4821429 0.0000000 0.5000000), wk = 0.0022321 k( 262) = ( 0.4910714 0.0000000 0.5000000), wk = 0.0022321 k( 263) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 264) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 265) = ( 0.5000000 0.0138889 0.5000000), wk = 0.0022321 k( 266) = ( 0.5000000 0.0277778 0.5000000), wk = 0.0022321 k( 267) = ( 0.5000000 0.0416667 0.5000000), wk = 0.0022321 k( 268) = ( 0.5000000 0.0555556 0.5000000), wk = 0.0022321 k( 269) = ( 0.5000000 0.0694444 0.5000000), wk = 0.0022321 k( 270) = ( 0.5000000 0.0833333 0.5000000), wk = 0.0022321 k( 271) = ( 0.5000000 0.0972222 0.5000000), wk = 0.0022321 k( 272) = ( 0.5000000 0.1111111 0.5000000), wk = 0.0022321 k( 273) = ( 0.5000000 0.1250000 0.5000000), wk = 0.0022321 k( 274) = ( 0.5000000 0.1388889 0.5000000), wk = 0.0022321 k( 275) = ( 0.5000000 0.1527778 0.5000000), wk = 0.0022321 k( 276) = ( 0.5000000 0.1666667 0.5000000), wk = 0.0022321 k( 277) = ( 0.5000000 0.1805556 0.5000000), wk = 0.0022321 k( 278) = ( 0.5000000 0.1944444 0.5000000), wk = 0.0022321 k( 279) = ( 0.5000000 0.2083333 0.5000000), wk = 0.0022321 k( 280) = ( 0.5000000 0.2222222 0.5000000), wk = 0.0022321 k( 281) = ( 0.5000000 0.2361111 0.5000000), wk = 0.0022321 k( 282) = ( 0.5000000 0.2500000 0.5000000), wk = 0.0022321 k( 283) = ( 0.5000000 0.2638889 0.5000000), wk = 0.0022321 k( 284) = ( 0.5000000 0.2777778 0.5000000), wk = 0.0022321 k( 285) = ( 0.5000000 0.2916667 0.5000000), wk = 0.0022321 k( 286) = ( 0.5000000 0.3055556 0.5000000), wk = 0.0022321 k( 287) = ( 0.5000000 0.3194444 0.5000000), wk = 0.0022321 k( 288) = ( 0.5000000 0.3333333 0.5000000), wk = 0.0022321 k( 289) = ( 0.5000000 0.3472222 0.5000000), wk = 0.0022321 k( 290) = ( 0.5000000 0.3611111 0.5000000), wk = 0.0022321 k( 291) = ( 0.5000000 0.3750000 0.5000000), wk = 0.0022321 k( 292) = ( 0.5000000 0.3888889 0.5000000), wk = 0.0022321 k( 293) = ( 0.5000000 0.4027778 0.5000000), wk = 0.0022321 k( 294) = ( 0.5000000 0.4166667 0.5000000), wk = 0.0022321 k( 295) = ( 0.5000000 0.4305556 0.5000000), wk = 0.0022321 k( 296) = ( 0.5000000 0.4444444 0.5000000), wk = 0.0022321 k( 297) = ( 0.5000000 0.4583333 0.5000000), wk = 0.0022321 k( 298) = ( 0.5000000 0.4722222 0.5000000), wk = 0.0022321 k( 299) = ( 0.5000000 0.4861111 0.5000000), wk = 0.0022321 k( 300) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 k( 301) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 k( 302) = ( 0.4910714 0.5000000 0.5000000), wk = 0.0022321 k( 303) = ( 0.4821429 0.5000000 0.5000000), wk = 0.0022321 k( 304) = ( 0.4732143 0.5000000 0.5000000), wk = 0.0022321 k( 305) = ( 0.4642857 0.5000000 0.5000000), wk = 0.0022321 k( 306) = ( 0.4553571 0.5000000 0.5000000), wk = 0.0022321 k( 307) = ( 0.4464286 0.5000000 0.5000000), wk = 0.0022321 k( 308) = ( 0.4375000 0.5000000 0.5000000), wk = 0.0022321 k( 309) = ( 0.4285714 0.5000000 0.5000000), wk = 0.0022321 k( 310) = ( 0.4196429 0.5000000 0.5000000), wk = 0.0022321 k( 311) = ( 0.4107143 0.5000000 0.5000000), wk = 0.0022321 k( 312) = ( 0.4017857 0.5000000 0.5000000), wk = 0.0022321 k( 313) = ( 0.3928571 0.5000000 0.5000000), wk = 0.0022321 k( 314) = ( 0.3839286 0.5000000 0.5000000), wk = 0.0022321 k( 315) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0022321 k( 316) = ( 0.3660714 0.5000000 0.5000000), wk = 0.0022321 k( 317) = ( 0.3571429 0.5000000 0.5000000), wk = 0.0022321 k( 318) = ( 0.3482143 0.5000000 0.5000000), wk = 0.0022321 k( 319) = ( 0.3392857 0.5000000 0.5000000), wk = 0.0022321 k( 320) = ( 0.3303571 0.5000000 0.5000000), wk = 0.0022321 k( 321) = ( 0.3214286 0.5000000 0.5000000), wk = 0.0022321 k( 322) = ( 0.3125000 0.5000000 0.5000000), wk = 0.0022321 k( 323) = ( 0.3035714 0.5000000 0.5000000), wk = 0.0022321 k( 324) = ( 0.2946429 0.5000000 0.5000000), wk = 0.0022321 k( 325) = ( 0.2857143 0.5000000 0.5000000), wk = 0.0022321 k( 326) = ( 0.2767857 0.5000000 0.5000000), wk = 0.0022321 k( 327) = ( 0.2678571 0.5000000 0.5000000), wk = 0.0022321 k( 328) = ( 0.2589286 0.5000000 0.5000000), wk = 0.0022321 k( 329) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0022321 k( 330) = ( 0.2410714 0.5000000 0.5000000), wk = 0.0022321 k( 331) = ( 0.2321429 0.5000000 0.5000000), wk = 0.0022321 k( 332) = ( 0.2232143 0.5000000 0.5000000), wk = 0.0022321 k( 333) = ( 0.2142857 0.5000000 0.5000000), wk = 0.0022321 k( 334) = ( 0.2053571 0.5000000 0.5000000), wk = 0.0022321 k( 335) = ( 0.1964286 0.5000000 0.5000000), wk = 0.0022321 k( 336) = ( 0.1875000 0.5000000 0.5000000), wk = 0.0022321 k( 337) = ( 0.1785714 0.5000000 0.5000000), wk = 0.0022321 k( 338) = ( 0.1696429 0.5000000 0.5000000), wk = 0.0022321 k( 339) = ( 0.1607143 0.5000000 0.5000000), wk = 0.0022321 k( 340) = ( 0.1517857 0.5000000 0.5000000), wk = 0.0022321 k( 341) = ( 0.1428571 0.5000000 0.5000000), wk = 0.0022321 k( 342) = ( 0.1339286 0.5000000 0.5000000), wk = 0.0022321 k( 343) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0022321 k( 344) = ( 0.1160714 0.5000000 0.5000000), wk = 0.0022321 k( 345) = ( 0.1071429 0.5000000 0.5000000), wk = 0.0022321 k( 346) = ( 0.0982143 0.5000000 0.5000000), wk = 0.0022321 k( 347) = ( 0.0892857 0.5000000 0.5000000), wk = 0.0022321 k( 348) = ( 0.0803571 0.5000000 0.5000000), wk = 0.0022321 k( 349) = ( 0.0714286 0.5000000 0.5000000), wk = 0.0022321 k( 350) = ( 0.0625000 0.5000000 0.5000000), wk = 0.0022321 k( 351) = ( 0.0535714 0.5000000 0.5000000), wk = 0.0022321 k( 352) = ( 0.0446429 0.5000000 0.5000000), wk = 0.0022321 k( 353) = ( 0.0357143 0.5000000 0.5000000), wk = 0.0022321 k( 354) = ( 0.0267857 0.5000000 0.5000000), wk = 0.0022321 k( 355) = ( 0.0178571 0.5000000 0.5000000), wk = 0.0022321 k( 356) = ( 0.0089286 0.5000000 0.5000000), wk = 0.0022321 k( 357) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 358) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 359) = ( 0.0000000 0.4861111 0.5000000), wk = 0.0022321 k( 360) = ( 0.0000000 0.4722222 0.5000000), wk = 0.0022321 k( 361) = ( 0.0000000 0.4583333 0.5000000), wk = 0.0022321 k( 362) = ( 0.0000000 0.4444444 0.5000000), wk = 0.0022321 k( 363) = ( 0.0000000 0.4305556 0.5000000), wk = 0.0022321 k( 364) = ( 0.0000000 0.4166667 0.5000000), wk = 0.0022321 k( 365) = ( 0.0000000 0.4027778 0.5000000), wk = 0.0022321 k( 366) = ( 0.0000000 0.3888889 0.5000000), wk = 0.0022321 k( 367) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0022321 k( 368) = ( 0.0000000 0.3611111 0.5000000), wk = 0.0022321 k( 369) = ( 0.0000000 0.3472222 0.5000000), wk = 0.0022321 k( 370) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0022321 k( 371) = ( 0.0000000 0.3194444 0.5000000), wk = 0.0022321 k( 372) = ( 0.0000000 0.3055556 0.5000000), wk = 0.0022321 k( 373) = ( 0.0000000 0.2916667 0.5000000), wk = 0.0022321 k( 374) = ( 0.0000000 0.2777778 0.5000000), wk = 0.0022321 k( 375) = ( 0.0000000 0.2638889 0.5000000), wk = 0.0022321 k( 376) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0022321 k( 377) = ( 0.0000000 0.2361111 0.5000000), wk = 0.0022321 k( 378) = ( 0.0000000 0.2222222 0.5000000), wk = 0.0022321 k( 379) = ( 0.0000000 0.2083333 0.5000000), wk = 0.0022321 k( 380) = ( 0.0000000 0.1944444 0.5000000), wk = 0.0022321 k( 381) = ( 0.0000000 0.1805556 0.5000000), wk = 0.0022321 k( 382) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0022321 k( 383) = ( 0.0000000 0.1527778 0.5000000), wk = 0.0022321 k( 384) = ( 0.0000000 0.1388889 0.5000000), wk = 0.0022321 k( 385) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0022321 k( 386) = ( 0.0000000 0.1111111 0.5000000), wk = 0.0022321 k( 387) = ( 0.0000000 0.0972222 0.5000000), wk = 0.0022321 k( 388) = ( 0.0000000 0.0833333 0.5000000), wk = 0.0022321 k( 389) = ( 0.0000000 0.0694444 0.5000000), wk = 0.0022321 k( 390) = ( 0.0000000 0.0555556 0.5000000), wk = 0.0022321 k( 391) = ( 0.0000000 0.0416667 0.5000000), wk = 0.0022321 k( 392) = ( 0.0000000 0.0277778 0.5000000), wk = 0.0022321 k( 393) = ( 0.0000000 0.0138889 0.5000000), wk = 0.0022321 k( 394) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022321 k( 395) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022321 k( 396) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0022321 k( 397) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0022321 k( 398) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0022321 k( 399) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0022321 k( 400) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0022321 k( 401) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0022321 k( 402) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0022321 k( 403) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0022321 k( 404) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0022321 k( 405) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0022321 k( 406) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0022321 k( 407) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0022321 k( 408) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0022321 k( 409) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0022321 k( 410) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0022321 k( 411) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0022321 k( 412) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022321 k( 413) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0022321 k( 414) = ( 0.5000000 0.0000000 0.4705882), wk = 0.0022321 k( 415) = ( 0.5000000 0.0000000 0.4411765), wk = 0.0022321 k( 416) = ( 0.5000000 0.0000000 0.4117647), wk = 0.0022321 k( 417) = ( 0.5000000 0.0000000 0.3823529), wk = 0.0022321 k( 418) = ( 0.5000000 0.0000000 0.3529412), wk = 0.0022321 k( 419) = ( 0.5000000 0.0000000 0.3235294), wk = 0.0022321 k( 420) = ( 0.5000000 0.0000000 0.2941177), wk = 0.0022321 k( 421) = ( 0.5000000 0.0000000 0.2647059), wk = 0.0022321 k( 422) = ( 0.5000000 0.0000000 0.2352941), wk = 0.0022321 k( 423) = ( 0.5000000 0.0000000 0.2058823), wk = 0.0022321 k( 424) = ( 0.5000000 0.0000000 0.1764706), wk = 0.0022321 k( 425) = ( 0.5000000 0.0000000 0.1470588), wk = 0.0022321 k( 426) = ( 0.5000000 0.0000000 0.1176471), wk = 0.0022321 k( 427) = ( 0.5000000 0.0000000 0.0882353), wk = 0.0022321 k( 428) = ( 0.5000000 0.0000000 0.0588235), wk = 0.0022321 k( 429) = ( 0.5000000 0.0000000 0.0294118), wk = 0.0022321 k( 430) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0022321 k( 431) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022321 k( 432) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0022321 k( 433) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0022321 k( 434) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0022321 k( 435) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0022321 k( 436) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0022321 k( 437) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0022321 k( 438) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0022321 k( 439) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0022321 k( 440) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0022321 k( 441) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0022321 k( 442) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0022321 k( 443) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0022321 k( 444) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0022321 k( 445) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0022321 k( 446) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0022321 k( 447) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0022321 k( 448) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022321 Dense grid: 77989 G-vectors FFT dimensions: ( 32, 48, 108) Smooth grid: 34519 G-vectors FFT dimensions: ( 24, 40, 80) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.31 Mb ( 264, 76) NL pseudopotentials 0.52 Mb ( 132, 256) Each V/rho on FFT grid 0.07 Mb ( 4608) Each G-vector array 0.02 Mb ( 2170) G-vector shells 0.01 Mb ( 1101) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.22 Mb ( 264, 304) Each subspace H/S matrix 0.09 Mb ( 76, 76) Each matrix 0.59 Mb ( 256, 2, 76) Check: negative/imaginary core charge= -0.000002 0.000000 The potential is recalculated from file : ./AlHO2.save/charge-density.dat Starting wfc are 104 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.6 secs Computing kpt #: 3 total cpu time spent up to now is 4.5 secs Computing kpt #: 4 total cpu time spent up to now is 5.4 secs Computing kpt #: 5 total cpu time spent up to now is 6.4 secs Computing kpt #: 6 total cpu time spent up to now is 7.4 secs Computing kpt #: 7 total cpu time spent up to now is 8.4 secs Computing kpt #: 8 total cpu time spent up to now is 9.3 secs Computing kpt #: 9 total cpu time spent up to now is 10.3 secs Computing kpt #: 10 total cpu time spent up to now is 11.3 secs Computing kpt #: 11 total cpu time spent up to now is 12.3 secs Computing kpt #: 12 total cpu time spent up to now is 13.2 secs Computing kpt #: 13 total cpu time spent up to now is 14.3 secs Computing kpt #: 14 total cpu time spent up to now is 15.4 secs Computing kpt #: 15 total cpu time spent up to now is 16.6 secs Computing kpt #: 16 total cpu time spent up to now is 17.7 secs Computing kpt #: 17 total cpu time spent up to now is 18.8 secs Computing kpt #: 18 total cpu time spent up to now is 19.9 secs Computing kpt #: 19 total cpu time spent up to now is 21.0 secs Computing kpt #: 20 total cpu time spent up to now is 22.1 secs Computing kpt #: 21 total cpu time spent up to now is 23.2 secs Computing kpt #: 22 total cpu time spent up to now is 24.3 secs Computing kpt #: 23 total cpu time spent up to now is 25.5 secs Computing kpt #: 24 total cpu time spent up to now is 26.6 secs Computing kpt #: 25 total cpu time spent up to now is 27.8 secs Computing kpt #: 26 total cpu time spent up to now is 28.9 secs Computing kpt #: 27 total cpu time spent up to now is 30.0 secs Computing kpt #: 28 total cpu time spent up to now is 31.2 secs Computing kpt #: 29 total cpu time spent up to now is 32.4 secs Computing kpt #: 30 total cpu time spent up to now is 33.7 secs Computing kpt #: 31 total cpu time spent up to now is 35.3 secs Computing kpt #: 32 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 38.0 secs Computing kpt #: 33 total cpu time spent up to now is 39.7 secs Computing kpt #: 34 total cpu time spent up to now is 40.9 secs Computing kpt #: 35 total cpu time spent up to now is 42.1 secs Computing kpt #: 36 total cpu time spent up to now is 43.3 secs Computing kpt #: 37 total cpu time spent up to now is 44.4 secs Computing kpt #: 38 total cpu time spent up to now is 45.5 secs Computing kpt #: 39 total cpu time spent up to now is 46.6 secs Computing kpt #: 40 total cpu time spent up to now is 47.7 secs Computing kpt #: 41 total cpu time spent up to now is 48.8 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 52.2 secs Computing kpt #: 45 total cpu time spent up to now is 53.3 secs Computing kpt #: 46 total cpu time spent up to now is 54.4 secs Computing kpt #: 47 total cpu time spent up to now is 55.3 secs Computing kpt #: 48 total cpu time spent up to now is 56.2 secs Computing kpt #: 49 total cpu time spent up to now is 57.2 secs Computing kpt #: 50 total cpu time spent up to now is 58.1 secs Computing kpt #: 51 total cpu time spent up to now is 59.1 secs Computing kpt #: 52 total cpu time spent up to now is 60.0 secs Computing kpt #: 53 total cpu time spent up to now is 60.9 secs Computing kpt #: 54 total cpu time spent up to now is 61.8 secs Computing kpt #: 55 total cpu time spent up to now is 62.7 secs Computing kpt #: 56 total cpu time spent up to now is 63.6 secs Computing kpt #: 57 total cpu time spent up to now is 64.5 secs Computing kpt #: 58 total cpu time spent up to now is 65.5 secs Computing kpt #: 59 total cpu time spent up to now is 66.4 secs Computing kpt #: 60 total cpu time spent up to now is 67.3 secs Computing kpt #: 61 total cpu time spent up to now is 68.3 secs Computing kpt #: 62 total cpu time spent up to now is 69.2 secs Computing kpt #: 63 total cpu time spent up to now is 70.1 secs Computing kpt #: 64 total cpu time spent up to now is 71.1 secs Computing kpt #: 65 total cpu time spent up to now is 72.0 secs Computing kpt #: 66 total cpu time spent up to now is 73.0 secs Computing kpt #: 67 total cpu time spent up to now is 73.9 secs Computing kpt #: 68 total cpu time spent up to now is 74.8 secs Computing kpt #: 69 total cpu time spent up to now is 75.8 secs Computing kpt #: 70 total cpu time spent up to now is 76.7 secs Computing kpt #: 71 total cpu time spent up to now is 77.7 secs Computing kpt #: 72 total cpu time spent up to now is 78.6 secs Computing kpt #: 73 total cpu time spent up to now is 79.6 secs Computing kpt #: 74 total cpu time spent up to now is 80.5 secs Computing kpt #: 75 total cpu time spent up to now is 81.5 secs Computing kpt #: 76 total cpu time spent up to now is 82.5 secs Computing kpt #: 77 total cpu time spent up to now is 83.4 secs Computing kpt #: 78 total cpu time spent up to now is 84.4 secs Computing kpt #: 79 total cpu time spent up to now is 85.3 secs Computing kpt #: 80 total cpu time spent up to now is 86.3 secs Computing kpt #: 81 total cpu time spent up to now is 87.2 secs Computing kpt #: 82 total cpu time spent up to now is 88.1 secs Computing kpt #: 83 total cpu time spent up to now is 89.1 secs Computing kpt #: 84 total cpu time spent up to now is 90.0 secs Computing kpt #: 85 total cpu time spent up to now is 90.9 secs Computing kpt #: 86 total cpu time spent up to now is 91.9 secs Computing kpt #: 87 total cpu time spent up to now is 92.8 secs Computing kpt #: 88 total cpu time spent up to now is 93.7 secs Computing kpt #: 89 total cpu time spent up to now is 94.6 secs Computing kpt #: 90 total cpu time spent up to now is 95.5 secs Computing kpt #: 91 total cpu time spent up to now is 96.4 secs Computing kpt #: 92 total cpu time spent up to now is 97.3 secs Computing kpt #: 93 total cpu time spent up to now is 98.2 secs Computing kpt #: 94 total cpu time spent up to now is 99.1 secs Computing kpt #: 95 total cpu time spent up to now is 99.9 secs Computing kpt #: 96 total cpu time spent up to now is 100.8 secs Computing kpt #: 97 total cpu time spent up to now is 101.6 secs Computing kpt #: 98 total cpu time spent up to now is 102.5 secs Computing kpt #: 99 total cpu time spent up to now is 103.4 secs Computing kpt #: 100 total cpu time spent up to now is 104.2 secs Computing kpt #: 101 total cpu time spent up to now is 105.1 secs Computing kpt #: 102 total cpu time spent up to now is 106.0 secs Computing kpt #: 103 total cpu time spent up to now is 106.8 secs Computing kpt #: 104 total cpu time spent up to now is 107.7 secs Computing kpt #: 105 total cpu time spent up to now is 108.6 secs Computing kpt #: 106 total cpu time spent up to now is 109.5 secs Computing kpt #: 107 total cpu time spent up to now is 110.4 secs Computing kpt #: 108 total cpu time spent up to now is 111.3 secs Computing kpt #: 109 total cpu time spent up to now is 112.2 secs Computing kpt #: 110 total cpu time spent up to now is 113.1 secs Computing kpt #: 111 total cpu time spent up to now is 114.1 secs Computing kpt #: 112 total cpu time spent up to now is 115.0 secs Computing kpt #: 113 total cpu time spent up to now is 115.9 secs Computing kpt #: 114 total cpu time spent up to now is 116.8 secs Computing kpt #: 115 total cpu time spent up to now is 117.7 secs Computing kpt #: 116 total cpu time spent up to now is 118.6 secs Computing kpt #: 117 total cpu time spent up to now is 119.5 secs Computing kpt #: 118 total cpu time spent up to now is 120.5 secs Computing kpt #: 119 total cpu time spent up to now is 121.4 secs Computing kpt #: 120 total cpu time spent up to now is 122.3 secs Computing kpt #: 121 total cpu time spent up to now is 123.2 secs Computing kpt #: 122 total cpu time spent up to now is 124.1 secs Computing kpt #: 123 total cpu time spent up to now is 125.0 secs Computing kpt #: 124 total cpu time spent up to now is 125.9 secs Computing kpt #: 125 total cpu time spent up to now is 126.8 secs Computing kpt #: 126 total cpu time spent up to now is 127.7 secs Computing kpt #: 127 total cpu time spent up to now is 128.6 secs Computing kpt #: 128 total cpu time spent up to now is 129.5 secs Computing kpt #: 129 total cpu time spent up to now is 130.4 secs Computing kpt #: 130 total cpu time spent up to now is 131.3 secs Computing kpt #: 131 total cpu time spent up to now is 132.2 secs Computing kpt #: 132 total cpu time spent up to now is 133.1 secs Computing kpt #: 133 total cpu time spent up to now is 134.1 secs Computing kpt #: 134 total cpu time spent up to now is 135.0 secs Computing kpt #: 135 total cpu time spent up to now is 135.9 secs Computing kpt #: 136 total cpu time spent up to now is 136.8 secs Computing kpt #: 137 total cpu time spent up to now is 137.7 secs Computing kpt #: 138 total cpu time spent up to now is 138.6 secs Computing kpt #: 139 total cpu time spent up to now is 139.5 secs Computing kpt #: 140 total cpu time spent up to now is 140.5 secs Computing kpt #: 141 total cpu time spent up to now is 141.4 secs Computing kpt #: 142 total cpu time spent up to now is 142.3 secs Computing kpt #: 143 total cpu time spent up to now is 143.2 secs Computing kpt #: 144 total cpu time spent up to now is 144.1 secs Computing kpt #: 145 total cpu time spent up to now is 145.1 secs Computing kpt #: 146 total cpu time spent up to now is 146.0 secs Computing kpt #: 147 total cpu time spent up to now is 146.9 secs Computing kpt #: 148 total cpu time spent up to now is 147.8 secs Computing kpt #: 149 total cpu time spent up to now is 148.8 secs Computing kpt #: 150 total cpu time spent up to now is 149.7 secs Computing kpt #: 151 total cpu time spent up to now is 150.6 secs Computing kpt #: 152 total cpu time spent up to now is 151.5 secs Computing kpt #: 153 total cpu time spent up to now is 152.4 secs Computing kpt #: 154 total cpu time spent up to now is 153.3 secs Computing kpt #: 155 total cpu time spent up to now is 154.3 secs Computing kpt #: 156 total cpu time spent up to now is 155.2 secs Computing kpt #: 157 total cpu time spent up to now is 156.1 secs Computing kpt #: 158 total cpu time spent up to now is 157.0 secs Computing kpt #: 159 total cpu time spent up to now is 158.0 secs Computing kpt #: 160 total cpu time spent up to now is 158.9 secs Computing kpt #: 161 total cpu time spent up to now is 159.9 secs Computing kpt #: 162 total cpu time spent up to now is 160.8 secs Computing kpt #: 163 total cpu time spent up to now is 161.8 secs Computing kpt #: 164 total cpu time spent up to now is 162.7 secs Computing kpt #: 165 total cpu time spent up to now is 163.7 secs Computing kpt #: 166 total cpu time spent up to now is 164.6 secs Computing kpt #: 167 total cpu time spent up to now is 165.5 secs Computing kpt #: 168 total cpu time spent up to now is 166.5 secs Computing kpt #: 169 total cpu time spent up to now is 167.5 secs Computing kpt #: 170 total cpu time spent up to now is 168.6 secs Computing kpt #: 171 total cpu time spent up to now is 169.6 secs Computing kpt #: 172 total cpu time spent up to now is 170.5 secs Computing kpt #: 173 total cpu time spent up to now is 171.5 secs Computing kpt #: 174 total cpu time spent up to now is 172.4 secs Computing kpt #: 175 total cpu time spent up to now is 173.3 secs Computing kpt #: 176 total cpu time spent up to now is 174.3 secs Computing kpt #: 177 total cpu time spent up to now is 175.2 secs Computing kpt #: 178 total cpu time spent up to now is 176.1 secs Computing kpt #: 179 total cpu time spent up to now is 177.0 secs Computing kpt #: 180 total cpu time spent up to now is 178.0 secs Computing kpt #: 181 total cpu time spent up to now is 178.9 secs Computing kpt #: 182 total cpu time spent up to now is 179.9 secs Computing kpt #: 183 total cpu time spent up to now is 180.9 secs Computing kpt #: 184 total cpu time spent up to now is 181.8 secs Computing kpt #: 185 total cpu time spent up to now is 182.8 secs Computing kpt #: 186 total cpu time spent up to now is 183.7 secs Computing kpt #: 187 total cpu time spent up to now is 184.7 secs Computing kpt #: 188 total cpu time spent up to now is 185.7 secs Computing kpt #: 189 total cpu time spent up to now is 186.7 secs Computing kpt #: 190 total cpu time spent up to now is 187.6 secs Computing kpt #: 191 total cpu time spent up to now is 188.6 secs Computing kpt #: 192 total cpu time spent up to now is 189.5 secs Computing kpt #: 193 total cpu time spent up to now is 190.4 secs Computing kpt #: 194 total cpu time spent up to now is 191.3 secs Computing kpt #: 195 total cpu time spent up to now is 192.3 secs Computing kpt #: 196 total cpu time spent up to now is 193.2 secs Computing kpt #: 197 total cpu time spent up to now is 194.1 secs Computing kpt #: 198 total cpu time spent up to now is 195.1 secs Computing kpt #: 199 total cpu time spent up to now is 196.0 secs Computing kpt #: 200 total cpu time spent up to now is 197.0 secs Computing kpt #: 201 total cpu time spent up to now is 197.9 secs Computing kpt #: 202 total cpu time spent up to now is 198.9 secs Computing kpt #: 203 total cpu time spent up to now is 199.8 secs Computing kpt #: 204 total cpu time spent up to now is 200.8 secs Computing kpt #: 205 total cpu time spent up to now is 201.7 secs Computing kpt #: 206 total cpu time spent up to now is 202.7 secs Computing kpt #: 207 total cpu time spent up to now is 203.6 secs Computing kpt #: 208 total cpu time spent up to now is 204.5 secs Computing kpt #: 209 total cpu time spent up to now is 205.5 secs Computing kpt #: 210 total cpu time spent up to now is 206.4 secs Computing kpt #: 211 total cpu time spent up to now is 207.3 secs Computing kpt #: 212 total cpu time spent up to now is 208.3 secs Computing kpt #: 213 total cpu time spent up to now is 209.2 secs Computing kpt #: 214 total cpu time spent up to now is 210.1 secs Computing kpt #: 215 total cpu time spent up to now is 211.0 secs Computing kpt #: 216 total cpu time spent up to now is 212.0 secs Computing kpt #: 217 total cpu time spent up to now is 212.9 secs Computing kpt #: 218 total cpu time spent up to now is 213.8 secs Computing kpt #: 219 total cpu time spent up to now is 214.7 secs Computing kpt #: 220 total cpu time spent up to now is 215.7 secs Computing kpt #: 221 total cpu time spent up to now is 216.6 secs Computing kpt #: 222 total cpu time spent up to now is 217.6 secs Computing kpt #: 223 total cpu time spent up to now is 218.5 secs Computing kpt #: 224 total cpu time spent up to now is 219.4 secs Computing kpt #: 225 total cpu time spent up to now is 220.4 secs Computing kpt #: 226 total cpu time spent up to now is 221.3 secs Computing kpt #: 227 total cpu time spent up to now is 222.3 secs Computing kpt #: 228 total cpu time spent up to now is 223.5 secs Computing kpt #: 229 total cpu time spent up to now is 224.6 secs Computing kpt #: 230 total cpu time spent up to now is 225.6 secs Computing kpt #: 231 total cpu time spent up to now is 226.5 secs Computing kpt #: 232 total cpu time spent up to now is 227.5 secs Computing kpt #: 233 total cpu time spent up to now is 228.4 secs Computing kpt #: 234 total cpu time spent up to now is 229.4 secs Computing kpt #: 235 total cpu time spent up to now is 230.3 secs Computing kpt #: 236 total cpu time spent up to now is 231.3 secs Computing kpt #: 237 total cpu time spent up to now is 232.3 secs Computing kpt #: 238 total cpu time spent up to now is 233.3 secs Computing kpt #: 239 total cpu time spent up to now is 234.2 secs Computing kpt #: 240 total cpu time spent up to now is 235.2 secs Computing kpt #: 241 total cpu time spent up to now is 236.2 secs Computing kpt #: 242 total cpu time spent up to now is 237.2 secs Computing kpt #: 243 total cpu time spent up to now is 238.2 secs Computing kpt #: 244 total cpu time spent up to now is 239.1 secs Computing kpt #: 245 total cpu time spent up to now is 240.2 secs Computing kpt #: 246 total cpu time spent up to now is 241.2 secs Computing kpt #: 247 total cpu time spent up to now is 242.2 secs Computing kpt #: 248 total cpu time spent up to now is 243.1 secs Computing kpt #: 249 total cpu time spent up to now is 244.1 secs Computing kpt #: 250 total cpu time spent up to now is 245.1 secs Computing kpt #: 251 total cpu time spent up to now is 246.2 secs Computing kpt #: 252 total cpu time spent up to now is 247.2 secs Computing kpt #: 253 total cpu time spent up to now is 248.2 secs Computing kpt #: 254 total cpu time spent up to now is 249.1 secs Computing kpt #: 255 total cpu time spent up to now is 250.1 secs Computing kpt #: 256 total cpu time spent up to now is 251.1 secs Computing kpt #: 257 total cpu time spent up to now is 252.1 secs Computing kpt #: 258 total cpu time spent up to now is 253.1 secs Computing kpt #: 259 total cpu time spent up to now is 254.1 secs Computing kpt #: 260 total cpu time spent up to now is 255.1 secs Computing kpt #: 261 total cpu time spent up to now is 256.1 secs Computing kpt #: 262 total cpu time spent up to now is 257.1 secs Computing kpt #: 263 total cpu time spent up to now is 258.3 secs Computing kpt #: 264 total cpu time spent up to now is 259.5 secs Computing kpt #: 265 total cpu time spent up to now is 260.8 secs Computing kpt #: 266 total cpu time spent up to now is 262.0 secs Computing kpt #: 267 total cpu time spent up to now is 263.1 secs Computing kpt #: 268 total cpu time spent up to now is 264.3 secs Computing kpt #: 269 total cpu time spent up to now is 265.5 secs Computing kpt #: 270 total cpu time spent up to now is 266.7 secs Computing kpt #: 271 total cpu time spent up to now is 267.9 secs Computing kpt #: 272 total cpu time spent up to now is 269.1 secs Computing kpt #: 273 total cpu time spent up to now is 270.3 secs Computing kpt #: 274 total cpu time spent up to now is 271.5 secs Computing kpt #: 275 total cpu time spent up to now is 272.7 secs Computing kpt #: 276 total cpu time spent up to now is 273.8 secs Computing kpt #: 277 total cpu time spent up to now is 275.0 secs Computing kpt #: 278 total cpu time spent up to now is 276.2 secs Computing kpt #: 279 total cpu time spent up to now is 277.3 secs Computing kpt #: 280 total cpu time spent up to now is 278.5 secs Computing kpt #: 281 total cpu time spent up to now is 279.7 secs Computing kpt #: 282 total cpu time spent up to now is 280.9 secs Computing kpt #: 283 total cpu time spent up to now is 282.1 secs Computing kpt #: 284 total cpu time spent up to now is 283.3 secs Computing kpt #: 285 total cpu time spent up to now is 284.5 secs Computing kpt #: 286 total cpu time spent up to now is 285.7 secs Computing kpt #: 287 total cpu time spent up to now is 286.9 secs Computing kpt #: 288 total cpu time spent up to now is 288.1 secs Computing kpt #: 289 total cpu time spent up to now is 289.3 secs Computing kpt #: 290 total cpu time spent up to now is 290.5 secs Computing kpt #: 291 total cpu time spent up to now is 291.6 secs Computing kpt #: 292 total cpu time spent up to now is 292.8 secs Computing kpt #: 293 total cpu time spent up to now is 294.0 secs Computing kpt #: 294 total cpu time spent up to now is 295.2 secs Computing kpt #: 295 total cpu time spent up to now is 296.3 secs Computing kpt #: 296 total cpu time spent up to now is 297.5 secs Computing kpt #: 297 total cpu time spent up to now is 298.6 secs Computing kpt #: 298 total cpu time spent up to now is 299.8 secs Computing kpt #: 299 total cpu time spent up to now is 301.0 secs Computing kpt #: 300 total cpu time spent up to now is 302.1 secs Computing kpt #: 301 total cpu time spent up to now is 303.3 secs Computing kpt #: 302 total cpu time spent up to now is 304.4 secs Computing kpt #: 303 total cpu time spent up to now is 305.5 secs Computing kpt #: 304 total cpu time spent up to now is 306.5 secs Computing kpt #: 305 total cpu time spent up to now is 307.6 secs Computing kpt #: 306 total cpu time spent up to now is 308.6 secs Computing kpt #: 307 total cpu time spent up to now is 309.5 secs Computing kpt #: 308 total cpu time spent up to now is 310.5 secs Computing kpt #: 309 total cpu time spent up to now is 311.5 secs Computing kpt #: 310 total cpu time spent up to now is 312.4 secs Computing kpt #: 311 total cpu time spent up to now is 313.4 secs Computing kpt #: 312 total cpu time spent up to now is 314.3 secs Computing kpt #: 313 total cpu time spent up to now is 315.2 secs Computing kpt #: 314 total cpu time spent up to now is 316.2 secs Computing kpt #: 315 total cpu time spent up to now is 317.1 secs Computing kpt #: 316 total cpu time spent up to now is 318.0 secs Computing kpt #: 317 total cpu time spent up to now is 318.9 secs Computing kpt #: 318 total cpu time spent up to now is 319.8 secs Computing kpt #: 319 total cpu time spent up to now is 320.8 secs Computing kpt #: 320 total cpu time spent up to now is 321.7 secs Computing kpt #: 321 total cpu time spent up to now is 322.6 secs Computing kpt #: 322 total cpu time spent up to now is 323.5 secs Computing kpt #: 323 total cpu time spent up to now is 324.4 secs Computing kpt #: 324 total cpu time spent up to now is 325.4 secs Computing kpt #: 325 total cpu time spent up to now is 326.3 secs Computing kpt #: 326 total cpu time spent up to now is 327.2 secs Computing kpt #: 327 total cpu time spent up to now is 328.1 secs Computing kpt #: 328 total cpu time spent up to now is 328.9 secs Computing kpt #: 329 total cpu time spent up to now is 329.8 secs Computing kpt #: 330 total cpu time spent up to now is 330.7 secs Computing kpt #: 331 total cpu time spent up to now is 331.6 secs Computing kpt #: 332 total cpu time spent up to now is 332.5 secs Computing kpt #: 333 total cpu time spent up to now is 333.4 secs Computing kpt #: 334 total cpu time spent up to now is 334.3 secs Computing kpt #: 335 total cpu time spent up to now is 335.2 secs Computing kpt #: 336 total cpu time spent up to now is 336.1 secs Computing kpt #: 337 total cpu time spent up to now is 337.0 secs Computing kpt #: 338 total cpu time spent up to now is 337.9 secs Computing kpt #: 339 total cpu time spent up to now is 338.8 secs Computing kpt #: 340 total cpu time spent up to now is 339.7 secs Computing kpt #: 341 total cpu time spent up to now is 340.6 secs Computing kpt #: 342 total cpu time spent up to now is 341.5 secs Computing kpt #: 343 total cpu time spent up to now is 342.5 secs Computing kpt #: 344 total cpu time spent up to now is 343.4 secs Computing kpt #: 345 total cpu time spent up to now is 344.3 secs Computing kpt #: 346 total cpu time spent up to now is 345.2 secs Computing kpt #: 347 total cpu time spent up to now is 346.1 secs Computing kpt #: 348 total cpu time spent up to now is 347.0 secs Computing kpt #: 349 total cpu time spent up to now is 347.9 secs Computing kpt #: 350 total cpu time spent up to now is 348.9 secs Computing kpt #: 351 total cpu time spent up to now is 349.8 secs Computing kpt #: 352 total cpu time spent up to now is 350.7 secs Computing kpt #: 353 total cpu time spent up to now is 351.6 secs Computing kpt #: 354 total cpu time spent up to now is 352.5 secs Computing kpt #: 355 total cpu time spent up to now is 353.4 secs Computing kpt #: 356 total cpu time spent up to now is 354.3 secs Computing kpt #: 357 total cpu time spent up to now is 355.2 secs Computing kpt #: 358 total cpu time spent up to now is 356.1 secs Computing kpt #: 359 total cpu time spent up to now is 357.1 secs Computing kpt #: 360 total cpu time spent up to now is 358.0 secs Computing kpt #: 361 total cpu time spent up to now is 358.9 secs Computing kpt #: 362 total cpu time spent up to now is 359.8 secs Computing kpt #: 363 total cpu time spent up to now is 360.7 secs Computing kpt #: 364 total cpu time spent up to now is 361.6 secs Computing kpt #: 365 total cpu time spent up to now is 362.5 secs Computing kpt #: 366 total cpu time spent up to now is 363.5 secs Computing kpt #: 367 total cpu time spent up to now is 364.4 secs Computing kpt #: 368 total cpu time spent up to now is 365.3 secs Computing kpt #: 369 total cpu time spent up to now is 366.2 secs Computing kpt #: 370 total cpu time spent up to now is 367.2 secs Computing kpt #: 371 total cpu time spent up to now is 368.1 secs Computing kpt #: 372 total cpu time spent up to now is 369.0 secs Computing kpt #: 373 total cpu time spent up to now is 369.9 secs Computing kpt #: 374 total cpu time spent up to now is 370.9 secs Computing kpt #: 375 total cpu time spent up to now is 371.8 secs Computing kpt #: 376 total cpu time spent up to now is 372.7 secs Computing kpt #: 377 total cpu time spent up to now is 373.7 secs Computing kpt #: 378 total cpu time spent up to now is 374.6 secs Computing kpt #: 379 total cpu time spent up to now is 375.5 secs Computing kpt #: 380 total cpu time spent up to now is 376.5 secs Computing kpt #: 381 total cpu time spent up to now is 377.4 secs Computing kpt #: 382 total cpu time spent up to now is 378.4 secs Computing kpt #: 383 total cpu time spent up to now is 379.3 secs Computing kpt #: 384 total cpu time spent up to now is 380.3 secs Computing kpt #: 385 total cpu time spent up to now is 381.3 secs Computing kpt #: 386 total cpu time spent up to now is 382.2 secs Computing kpt #: 387 total cpu time spent up to now is 383.1 secs Computing kpt #: 388 total cpu time spent up to now is 384.1 secs Computing kpt #: 389 total cpu time spent up to now is 385.0 secs Computing kpt #: 390 total cpu time spent up to now is 386.0 secs Computing kpt #: 391 total cpu time spent up to now is 386.9 secs Computing kpt #: 392 total cpu time spent up to now is 387.9 secs Computing kpt #: 393 total cpu time spent up to now is 388.8 secs Computing kpt #: 394 total cpu time spent up to now is 389.8 secs Computing kpt #: 395 total cpu time spent up to now is 390.7 secs Computing kpt #: 396 total cpu time spent up to now is 391.6 secs Computing kpt #: 397 total cpu time spent up to now is 392.5 secs Computing kpt #: 398 total cpu time spent up to now is 393.4 secs Computing kpt #: 399 total cpu time spent up to now is 394.3 secs Computing kpt #: 400 total cpu time spent up to now is 395.2 secs Computing kpt #: 401 total cpu time spent up to now is 396.2 secs Computing kpt #: 402 total cpu time spent up to now is 397.1 secs Computing kpt #: 403 total cpu time spent up to now is 398.0 secs Computing kpt #: 404 total cpu time spent up to now is 398.9 secs Computing kpt #: 405 total cpu time spent up to now is 399.8 secs Computing kpt #: 406 total cpu time spent up to now is 400.7 secs Computing kpt #: 407 total cpu time spent up to now is 401.6 secs Computing kpt #: 408 total cpu time spent up to now is 402.5 secs Computing kpt #: 409 total cpu time spent up to now is 403.5 secs Computing kpt #: 410 total cpu time spent up to now is 404.3 secs Computing kpt #: 411 total cpu time spent up to now is 405.3 secs Computing kpt #: 412 total cpu time spent up to now is 406.2 secs Computing kpt #: 413 total cpu time spent up to now is 407.3 secs Computing kpt #: 414 total cpu time spent up to now is 408.4 secs Computing kpt #: 415 total cpu time spent up to now is 409.4 secs Computing kpt #: 416 total cpu time spent up to now is 410.4 secs Computing kpt #: 417 total cpu time spent up to now is 411.4 secs Computing kpt #: 418 total cpu time spent up to now is 412.3 secs Computing kpt #: 419 total cpu time spent up to now is 413.3 secs Computing kpt #: 420 total cpu time spent up to now is 414.2 secs Computing kpt #: 421 total cpu time spent up to now is 415.2 secs Computing kpt #: 422 total cpu time spent up to now is 416.1 secs Computing kpt #: 423 total cpu time spent up to now is 417.0 secs Computing kpt #: 424 total cpu time spent up to now is 418.0 secs Computing kpt #: 425 total cpu time spent up to now is 418.9 secs Computing kpt #: 426 total cpu time spent up to now is 419.9 secs Computing kpt #: 427 total cpu time spent up to now is 420.8 secs Computing kpt #: 428 total cpu time spent up to now is 421.7 secs Computing kpt #: 429 total cpu time spent up to now is 422.7 secs Computing kpt #: 430 total cpu time spent up to now is 423.6 secs Computing kpt #: 431 total cpu time spent up to now is 424.5 secs Computing kpt #: 432 total cpu time spent up to now is 425.3 secs Computing kpt #: 433 total cpu time spent up to now is 426.2 secs Computing kpt #: 434 total cpu time spent up to now is 427.1 secs Computing kpt #: 435 total cpu time spent up to now is 427.9 secs Computing kpt #: 436 total cpu time spent up to now is 428.8 secs Computing kpt #: 437 total cpu time spent up to now is 429.7 secs Computing kpt #: 438 total cpu time spent up to now is 430.6 secs Computing kpt #: 439 total cpu time spent up to now is 431.4 secs Computing kpt #: 440 total cpu time spent up to now is 432.3 secs Computing kpt #: 441 total cpu time spent up to now is 433.2 secs Computing kpt #: 442 total cpu time spent up to now is 434.2 secs Computing kpt #: 443 total cpu time spent up to now is 435.1 secs Computing kpt #: 444 total cpu time spent up to now is 436.0 secs Computing kpt #: 445 total cpu time spent up to now is 437.0 secs Computing kpt #: 446 total cpu time spent up to now is 438.0 secs Computing kpt #: 447 total cpu time spent up to now is 439.1 secs Computing kpt #: 448 total cpu time spent up to now is 440.3 secs ethr = 1.56E-08, avg # of iterations = 19.6 total cpu time spent up to now is 440.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -16.5062 -16.5062 -16.4305 -16.4305 -12.6868 -12.6868 -12.5367 -12.5367 -10.8940 -10.8940 -10.7407 -10.7407 -9.7813 -9.7813 -9.6813 -9.6813 -2.3417 -2.3417 -2.3032 -2.3032 -0.7924 -0.7924 -0.6217 -0.6217 -0.5888 -0.5888 0.8714 0.8714 0.9783 0.9783 1.8263 1.8263 2.2673 2.2673 2.5630 2.5630 3.3089 3.3089 3.3239 3.3239 3.3407 3.3407 4.1643 4.1643 4.2013 4.2013 4.5380 4.5380 4.6090 4.6090 4.9127 4.9127 5.0073 5.0073 5.8068 5.8068 5.8172 5.8172 5.8996 5.8996 6.5539 6.5539 6.9640 6.9640 10.8174 10.8174 11.9961 11.9961 13.3801 13.3801 13.6848 13.6848 14.5331 14.5331 14.6624 14.6624 k = 0.0089-0.0000-0.0000 ( 4303 PWs) bands (ev): -16.5052 -16.5052 -16.4296 -16.4296 -12.6869 -12.6869 -12.5369 -12.5369 -10.8936 -10.8936 -10.7402 -10.7402 -9.7811 -9.7811 -9.6811 -9.6811 -2.3416 -2.3416 -2.3031 -2.3031 -0.7967 -0.7967 -0.6203 -0.6203 -0.5936 -0.5936 0.8719 0.8719 0.9788 0.9788 1.8268 1.8268 2.2687 2.2687 2.5656 2.5656 3.2883 3.2883 3.3379 3.3379 3.3401 3.3401 4.1642 4.1642 4.2016 4.2016 4.5376 4.5376 4.6116 4.6116 4.9110 4.9110 5.0044 5.0044 5.8047 5.8047 5.8139 5.8139 5.8995 5.8995 6.5537 6.5537 6.9636 6.9636 10.8208 10.8208 11.9980 11.9980 13.3840 13.3840 13.6878 13.6878 14.5316 14.5316 14.6589 14.6589 k = 0.0179-0.0000-0.0000 ( 4301 PWs) bands (ev): -16.5025 -16.5025 -16.4269 -16.4269 -12.6872 -12.6872 -12.5376 -12.5376 -10.8922 -10.8922 -10.7386 -10.7386 -9.7805 -9.7805 -9.6805 -9.6805 -2.3412 -2.3412 -2.3027 -2.3027 -0.8093 -0.8093 -0.6164 -0.6164 -0.6078 -0.6078 0.8733 0.8733 0.9804 0.9804 1.8283 1.8283 2.2729 2.2729 2.5733 2.5733 3.2572 3.2572 3.3297 3.3297 3.3578 3.3578 4.1637 4.1637 4.2026 4.2026 4.5364 4.5364 4.6194 4.6194 4.9061 4.9061 4.9959 4.9959 5.7984 5.7984 5.8043 5.8043 5.8993 5.8993 6.5534 6.5534 6.9625 6.9625 10.8311 10.8311 12.0034 12.0034 13.3959 13.3959 13.6967 13.6967 14.5272 14.5272 14.6484 14.6484 k = 0.0268-0.0000-0.0000 ( 4293 PWs) bands (ev): -16.4979 -16.4979 -16.4224 -16.4224 -12.6877 -12.6877 -12.5388 -12.5388 -10.8899 -10.8899 -10.7360 -10.7360 -9.7795 -9.7795 -9.6795 -9.6795 -2.3406 -2.3406 -2.3021 -2.3021 -0.8297 -0.8297 -0.6313 -0.6313 -0.6102 -0.6102 0.8756 0.8756 0.9831 0.9831 1.8307 1.8307 2.2798 2.2798 2.5859 2.5859 3.2211 3.2211 3.3161 3.3161 3.3721 3.3721 4.1629 4.1629 4.2042 4.2042 4.5344 4.5344 4.6320 4.6320 4.8980 4.8980 4.9817 4.9817 5.7874 5.7874 5.7889 5.7889 5.8989 5.8989 6.5528 6.5528 6.9608 6.9608 10.8480 10.8480 12.0125 12.0125 13.4154 13.4154 13.7114 13.7114 14.5201 14.5201 14.6316 14.6316 k = 0.0357-0.0000-0.0000 ( 4293 PWs) bands (ev): -16.4914 -16.4914 -16.4160 -16.4160 -12.6884 -12.6884 -12.5404 -12.5404 -10.8866 -10.8866 -10.7323 -10.7323 -9.7780 -9.7780 -9.6781 -9.6781 -2.3397 -2.3397 -2.3013 -2.3013 -0.8573 -0.8573 -0.6636 -0.6636 -0.6022 -0.6022 0.8788 0.8788 0.9868 0.9868 1.8341 1.8341 2.2893 2.2893 2.6031 2.6031 3.1804 3.1804 3.2973 3.2973 3.3830 3.3830 4.1617 4.1617 4.2063 4.2063 4.5315 4.5315 4.6491 4.6491 4.8869 4.8869 4.9622 4.9622 5.7656 5.7656 5.7739 5.7739 5.8983 5.8983 6.5519 6.5519 6.9582 6.9582 10.8714 10.8714 12.0251 12.0251 13.4426 13.4426 13.7316 13.7316 14.5106 14.5106 14.6094 14.6094 k = 0.0446-0.0000-0.0000 ( 4297 PWs) bands (ev): -16.4831 -16.4831 -16.4078 -16.4078 -12.6893 -12.6893 -12.5426 -12.5426 -10.8824 -10.8824 -10.7277 -10.7277 -9.7762 -9.7762 -9.6764 -9.6764 -2.3386 -2.3386 -2.3003 -2.3003 -0.8914 -0.8914 -0.7042 -0.7042 -0.5927 -0.5927 0.8828 0.8828 0.9915 0.9915 1.8385 1.8385 2.3012 2.3012 2.6244 2.6244 3.1353 3.1353 3.2735 3.2735 3.3907 3.3907 4.1599 4.1599 4.2088 4.2088 4.5277 4.5277 4.6699 4.6699 4.8729 4.8729 4.9376 4.9376 5.7372 5.7372 5.7557 5.7557 5.8974 5.8974 6.5508 6.5508 6.9550 6.9550 10.9011 10.9011 12.0411 12.0411 13.4769 13.4769 13.7570 13.7570 14.4991 14.4991 14.5828 14.5828 k = 0.0536-0.0000-0.0000 ( 4295 PWs) bands (ev): -16.4730 -16.4730 -16.3979 -16.3979 -12.6905 -12.6905 -12.5452 -12.5452 -10.8773 -10.8773 -10.7219 -10.7219 -9.7740 -9.7740 -9.6742 -9.6742 -2.3373 -2.3373 -2.2991 -2.2991 -0.9317 -0.9317 -0.7525 -0.7525 -0.5818 -0.5818 0.8875 0.8875 0.9972 0.9972 1.8438 1.8438 2.3153 2.3153 2.6493 2.6493 3.0862 3.0862 3.2450 3.2450 3.3956 3.3956 4.1576 4.1576 4.2114 4.2114 4.5230 4.5230 4.6938 4.6938 4.8566 4.8566 4.9083 4.9083 5.7030 5.7030 5.7338 5.7338 5.8962 5.8962 6.5494 6.5494 6.9510 6.9510 10.9369 10.9369 12.0604 12.0604 13.5181 13.5181 13.7871 13.7871 14.4864 14.4864 14.5530 14.5530 k = 0.0625-0.0000-0.0000 ( 4287 PWs) bands (ev): -16.4610 -16.4610 -16.3861 -16.3861 -12.6920 -12.6920 -12.5484 -12.5484 -10.8713 -10.8713 -10.7152 -10.7152 -9.7714 -9.7714 -9.6718 -9.6718 -2.3358 -2.3358 -2.2978 -2.2978 -0.9777 -0.9777 -0.8077 -0.8077 -0.5696 -0.5696 0.8928 0.8928 1.0040 1.0040 1.8500 1.8500 2.3314 2.3314 2.6773 2.6773 3.0335 3.0335 3.2120 3.2120 3.3979 3.3979 4.1545 4.1545 4.2141 4.2141 4.5174 4.5174 4.7197 4.7197 4.8386 4.8386 4.8746 4.8746 5.6633 5.6633 5.7085 5.7085 5.8945 5.8945 6.5477 6.5477 6.9462 6.9462 10.9784 10.9784 12.0829 12.0829 13.5653 13.5653 13.8212 13.8212 14.4731 14.4731 14.5211 14.5211 k = 0.0714-0.0000-0.0000 ( 4283 PWs) bands (ev): -16.4473 -16.4473 -16.3725 -16.3725 -12.6938 -12.6938 -12.5522 -12.5522 -10.8643 -10.8643 -10.7075 -10.7075 -9.7684 -9.7684 -9.6689 -9.6689 -2.3342 -2.3342 -2.2964 -2.2964 -1.0288 -1.0288 -0.8693 -0.8693 -0.5559 -0.5559 0.8988 0.8988 1.0116 1.0116 1.8571 1.8571 2.3492 2.3492 2.7076 2.7076 2.9775 2.9775 3.1750 3.1750 3.3978 3.3978 4.1505 4.1505 4.2163 4.2163 4.5107 4.5107 4.7451 4.7451 4.8211 4.8211 4.8373 4.8373 5.6185 5.6185 5.6801 5.6801 5.8922 5.8922 6.5457 6.5457 6.9406 6.9406 11.0252 11.0252 12.1083 12.1083 13.6176 13.6176 13.8582 13.8582 14.4603 14.4603 14.4885 14.4885 k = 0.0804-0.0000-0.0000 ( 4287 PWs) bands (ev): -16.4317 -16.4317 -16.3572 -16.3572 -12.6960 -12.6960 -12.5566 -12.5566 -10.8564 -10.8564 -10.6988 -10.6988 -9.7652 -9.7652 -9.6658 -9.6658 -2.3325 -2.3325 -2.2950 -2.2950 -1.0848 -1.0848 -0.9363 -0.9363 -0.5409 -0.5409 0.9053 0.9053 1.0202 1.0202 1.8651 1.8651 2.3686 2.3686 2.7398 2.7398 2.9188 2.9188 3.1341 3.1341 3.3954 3.3954 4.1456 4.1456 4.2179 4.2179 4.5030 4.5030 4.7602 4.7602 4.7956 4.7956 4.8149 4.8149 5.5691 5.5691 5.6488 5.6488 5.8893 5.8893 6.5434 6.5434 6.9342 6.9342 11.0770 11.0770 12.1365 12.1365 13.6737 13.6737 13.8965 13.8965 14.4494 14.4494 14.4570 14.4570 k = 0.0893-0.0000-0.0000 ( 4283 PWs) bands (ev): -16.4143 -16.4143 -16.3400 -16.3400 -12.6985 -12.6985 -12.5616 -12.5616 -10.8476 -10.8476 -10.6891 -10.6891 -9.7615 -9.7615 -9.6623 -9.6623 -2.3308 -2.3308 -2.2937 -2.2937 -1.1449 -1.1449 -1.0083 -1.0083 -0.5244 -0.5244 0.9123 0.9123 1.0297 1.0297 1.8740 1.8740 2.3892 2.3892 2.7731 2.7731 2.8578 2.8578 3.0897 3.0897 3.3908 3.3908 4.1396 4.1396 4.2183 4.2183 4.4941 4.4941 4.7494 4.7494 4.7534 4.7534 4.8324 4.8324 5.5153 5.5153 5.6149 5.6149 5.8856 5.8856 6.5408 6.5408 6.9270 6.9270 11.1334 11.1334 12.1672 12.1672 13.7316 13.7316 13.9339 13.9339 14.4289 14.4289 14.4424 14.4424 k = 0.0982-0.0000-0.0000 ( 4279 PWs) bands (ev): -16.3951 -16.3951 -16.3212 -16.3212 -12.7015 -12.7015 -12.5672 -12.5672 -10.8378 -10.8378 -10.6784 -10.6784 -9.7576 -9.7576 -9.6586 -9.6586 -2.3291 -2.3291 -2.2925 -2.2925 -1.2089 -1.2089 -1.0843 -1.0843 -0.5065 -0.5065 0.9198 0.9198 1.0400 1.0400 1.8836 1.8836 2.4108 2.4108 2.7927 2.7927 2.8092 2.8092 3.0423 3.0423 3.3842 3.3842 4.1324 4.1324 4.2168 4.2168 4.4839 4.4839 4.7073 4.7073 4.7282 4.7282 4.8625 4.8625 5.4578 5.4578 5.5787 5.5787 5.8810 5.8810 6.5378 6.5378 6.9189 6.9189 11.1940 11.1940 12.2002 12.2002 13.7884 13.7884 13.9667 13.9667 14.4076 14.4076 14.4422 14.4422 k = 0.1071-0.0000-0.0000 ( 4279 PWs) bands (ev): -16.3742 -16.3742 -16.3005 -16.3005 -12.7050 -12.7050 -12.5735 -12.5735 -10.8272 -10.8272 -10.6668 -10.6668 -9.7534 -9.7534 -9.6546 -9.6546 -2.3275 -2.3275 -2.2915 -2.2915 -1.2762 -1.2762 -1.1640 -1.1640 -0.4872 -0.4872 0.9276 0.9276 1.0511 1.0511 1.8941 1.8941 2.4332 2.4332 2.7296 2.7296 2.8419 2.8419 2.9922 2.9922 3.3754 3.3754 4.1240 4.1240 4.2127 4.2127 4.4724 4.4724 4.6616 4.6616 4.7023 4.7023 4.8961 4.8961 5.3969 5.3969 5.5408 5.5408 5.8755 5.8755 6.5345 6.5345 6.9100 6.9100 11.2583 11.2583 12.2354 12.2354 13.8402 13.8402 13.9904 13.9904 14.3976 14.3976 14.4527 14.4527 k = 0.1161-0.0000-0.0000 ( 4273 PWs) bands (ev): -16.3514 -16.3514 -16.2782 -16.2782 -12.7090 -12.7090 -12.5806 -12.5806 -10.8156 -10.8156 -10.6543 -10.6543 -9.7489 -9.7489 -9.6503 -9.6503 -2.3260 -2.3260 -2.2909 -2.2909 -1.3463 -1.3463 -1.2465 -1.2465 -0.4664 -0.4664 0.9358 0.9358 1.0629 1.0629 1.9052 1.9052 2.4562 2.4562 2.6641 2.6641 2.8755 2.8755 2.9399 2.9399 3.3644 3.3644 4.1141 4.1141 4.2048 4.2048 4.4594 4.4594 4.6166 4.6166 4.6751 4.6751 4.9312 4.9312 5.3331 5.3331 5.5014 5.5014 5.8691 5.8691 6.5307 6.5307 6.9002 6.9002 11.3260 11.3260 12.2723 12.2723 13.8826 13.8826 14.0002 14.0002 14.4033 14.4033 14.4782 14.4782 k = 0.1250-0.0000-0.0000 ( 4277 PWs) bands (ev): -16.3270 -16.3270 -16.2540 -16.2540 -12.7137 -12.7137 -12.5885 -12.5885 -10.8031 -10.8031 -10.6409 -10.6409 -9.7441 -9.7441 -9.6458 -9.6458 -2.3248 -2.3248 -2.2906 -2.2906 -1.4188 -1.4188 -1.3314 -1.3314 -0.4442 -0.4442 0.9443 0.9443 1.0754 1.0754 1.9171 1.9171 2.4795 2.4795 2.5979 2.5979 2.8836 2.8836 2.9104 2.9104 3.3513 3.3513 4.1027 4.1027 4.1918 4.1918 4.4448 4.4448 4.5739 4.5739 4.6475 4.6475 4.9670 4.9670 5.2669 5.2669 5.4610 5.4610 5.8616 5.8616 6.5266 6.5266 6.8895 6.8895 11.3966 11.3966 12.3108 12.3108 13.9118 13.9118 13.9941 13.9941 14.4264 14.4264 14.5223 14.5223 k = 0.1339-0.0000-0.0000 ( 4279 PWs) bands (ev): -16.3008 -16.3008 -16.2282 -16.2282 -12.7190 -12.7190 -12.5972 -12.5972 -10.7897 -10.7897 -10.6266 -10.6266 -9.7392 -9.7392 -9.6412 -9.6412 -2.3238 -2.3238 -2.2908 -2.2908 -1.4932 -1.4932 -1.4181 -1.4181 -0.4205 -0.4205 0.9530 0.9530 1.0884 1.0884 1.9296 1.9296 2.5028 2.5028 2.5315 2.5315 2.8283 2.8283 2.9414 2.9414 3.3359 3.3359 4.0896 4.0896 4.1722 4.1722 4.4284 4.4284 4.5353 4.5353 4.6201 4.6201 5.0032 5.0032 5.1988 5.1988 5.4200 5.4200 5.8530 5.8530 6.5221 6.5221 6.8779 6.8779 11.4697 11.4697 12.3505 12.3505 13.9265 13.9265 13.9741 13.9741 14.4644 14.4644 14.5862 14.5862 k = 0.1429-0.0000-0.0000 ( 4279 PWs) bands (ev): -16.2728 -16.2728 -16.2007 -16.2007 -12.7250 -12.7250 -12.6067 -12.6067 -10.7754 -10.7754 -10.6114 -10.6114 -9.7341 -9.7341 -9.6364 -9.6364 -2.3232 -2.3232 -2.2917 -2.2917 -1.5691 -1.5691 -1.5061 -1.5061 -0.3955 -0.3955 0.9619 0.9619 1.1019 1.1019 1.9426 1.9426 2.4649 2.4649 2.5264 2.5264 2.7708 2.7708 2.9716 2.9716 3.3183 3.3183 4.0748 4.0748 4.1448 4.1448 4.4102 4.4102 4.5023 4.5023 4.5934 4.5934 5.0395 5.0395 5.1293 5.1293 5.3790 5.3790 5.8434 5.8434 6.5172 6.5172 6.8654 6.8654 11.5449 11.5449 12.3913 12.3913 13.9282 13.9282 13.9441 13.9441 14.5128 14.5128 14.6684 14.6684 k = 0.1518-0.0000-0.0000 ( 4280 PWs) bands (ev): -16.2432 -16.2432 -16.1716 -16.1716 -12.7319 -12.7319 -12.6172 -12.6172 -10.7602 -10.7602 -10.5955 -10.5955 -9.7288 -9.7288 -9.6315 -9.6315 -2.3230 -2.3230 -2.2932 -2.2932 -1.6460 -1.6460 -1.5950 -1.5950 -0.3690 -0.3690 0.9710 0.9710 1.1159 1.1159 1.9562 1.9562 2.3990 2.3990 2.5494 2.5494 2.7124 2.7124 3.0001 3.0001 3.2985 3.2985 4.0579 4.0579 4.1091 4.1091 4.3898 4.3898 4.4757 4.4757 4.5677 4.5677 5.0586 5.0586 5.0761 5.0761 5.3383 5.3383 5.8327 5.8327 6.5119 6.5119 6.8520 6.8520 11.6218 11.6218 12.4328 12.4328 13.9076 13.9076 13.9196 13.9196 14.5678 14.5678 14.7657 14.7657 k = 0.1607-0.0000-0.0000 ( 4280 PWs) bands (ev): -16.2119 -16.2119 -16.1408 -16.1408 -12.7396 -12.7396 -12.6287 -12.6287 -10.7442 -10.7442 -10.5787 -10.5787 -9.7233 -9.7233 -9.6265 -9.6265 -2.3233 -2.3233 -2.2956 -2.2956 -1.7236 -1.7236 -1.6843 -1.6843 -0.3411 -0.3411 0.9802 0.9802 1.1301 1.1301 1.9702 1.9702 2.3339 2.3339 2.5718 2.5718 2.6534 2.6534 3.0263 3.0263 3.2764 3.2764 4.0386 4.0386 4.0659 4.0659 4.3673 4.3673 4.4552 4.4552 4.5433 4.5433 4.9881 4.9881 5.1122 5.1122 5.2984 5.2984 5.8210 5.8210 6.5061 6.5061 6.8376 6.8376 11.7000 11.7000 12.4748 12.4748 13.8670 13.8670 13.9035 13.9035 14.6262 14.6262 14.8751 14.8751 k = 0.1696-0.0000-0.0000 ( 4288 PWs) bands (ev): -16.1789 -16.1789 -16.1083 -16.1083 -12.7483 -12.7483 -12.6413 -12.6413 -10.7272 -10.7272 -10.5611 -10.5611 -9.7178 -9.7178 -9.6214 -9.6214 -2.3243 -2.3243 -2.2990 -2.2990 -1.8014 -1.8014 -1.7737 -1.7737 -0.3118 -0.3118 0.9895 0.9895 1.1446 1.1446 1.9845 1.9845 2.2701 2.2701 2.5882 2.5882 2.5993 2.5993 3.0502 3.0502 3.2522 3.2522 4.0118 4.0118 4.0215 4.0215 4.3424 4.3424 4.4400 4.4400 4.5206 4.5206 4.9176 4.9176 5.1482 5.1482 5.2598 5.2598 5.8082 5.8082 6.4999 6.4999 6.8222 6.8222 11.7792 11.7792 12.5170 12.5170 13.8241 13.8241 13.8824 13.8824 14.6856 14.6856 14.9939 14.9939 k = 0.1786-0.0000-0.0000 ( 4278 PWs) bands (ev): -16.1443 -16.1443 -16.0742 -16.0742 -12.7579 -12.7579 -12.6549 -12.6549 -10.7094 -10.7094 -10.5428 -10.5428 -9.7122 -9.7122 -9.6164 -9.6164 -2.3260 -2.3260 -2.3034 -2.3034 -1.8791 -1.8791 -1.8626 -1.8626 -0.2813 -0.2813 0.9987 0.9987 1.1592 1.1592 1.9991 1.9991 2.2078 2.2078 2.5337 2.5337 2.6152 2.6152 3.0715 3.0715 3.2260 3.2260 3.9597 3.9597 3.9951 3.9951 4.3150 4.3150 4.4287 4.4287 4.4999 4.4999 4.8479 4.8479 5.1837 5.1837 5.2231 5.2231 5.7944 5.7944 6.4933 6.4933 6.8059 6.8059 11.8591 11.8591 12.5592 12.5592 13.7799 13.7799 13.8579 13.8579 14.7447 14.7447 15.1203 15.1203 k = 0.1875-0.0000-0.0000 ( 4280 PWs) bands (ev): -16.1080 -16.1080 -16.0385 -16.0385 -12.7687 -12.7687 -12.6697 -12.6697 -10.6907 -10.6907 -10.5238 -10.5238 -9.7066 -9.7066 -9.6113 -9.6113 -2.3285 -2.3285 -2.3091 -2.3091 -1.9564 -1.9564 -1.9509 -1.9509 -0.2494 -0.2494 1.0078 1.0078 1.1737 1.1737 2.0139 2.0139 2.1474 2.1474 2.4747 2.4747 2.6345 2.6345 3.0900 3.0900 3.1979 3.1979 3.9020 3.9020 3.9683 3.9683 4.2850 4.2850 4.4201 4.4201 4.4811 4.4811 4.7797 4.7797 5.1868 5.1868 5.2205 5.2205 5.7797 5.7797 6.4863 6.4863 6.7885 6.7885 11.9391 11.9391 12.6011 12.6011 13.7352 13.7352 13.8311 13.8311 14.8019 14.8019 15.2523 15.2523 k = 0.1964-0.0000-0.0000 ( 4292 PWs) bands (ev): -16.0702 -16.0702 -16.0013 -16.0013 -12.7806 -12.7806 -12.6857 -12.6857 -10.6712 -10.6712 -10.5042 -10.5042 -9.7010 -9.7010 -9.6064 -9.6064 -2.3319 -2.3319 -2.3161 -2.3161 -2.0382 -2.0382 -2.0329 -2.0329 -0.2162 -0.2162 1.0168 1.0168 1.1880 1.1880 2.0286 2.0286 2.0892 2.0892 2.4163 2.4163 2.6523 2.6523 3.1055 3.1055 3.1682 3.1682 3.8425 3.8425 3.9387 3.9387 4.2525 4.2525 4.4132 4.4132 4.4646 4.4646 4.7134 4.7134 5.1544 5.1544 5.2552 5.2552 5.7641 5.7641 6.4789 6.4789 6.7702 6.7702 12.0191 12.0191 12.6424 12.6424 13.6906 13.6906 13.8029 13.8029 14.8564 14.8564 15.3888 15.3888 k = 0.2054-0.0000-0.0000 ( 4302 PWs) bands (ev): -16.0308 -16.0308 -15.9626 -15.9626 -12.7937 -12.7937 -12.7029 -12.7029 -10.6509 -10.6509 -10.4839 -10.4839 -9.6954 -9.6954 -9.6015 -9.6015 -2.3363 -2.3363 -2.3246 -2.3246 -2.1241 -2.1241 -2.1084 -2.1084 -0.1818 -0.1818 1.0257 1.0257 1.2020 1.2020 2.0322 2.0322 2.0446 2.0446 2.3588 2.3588 2.6681 2.6681 3.1180 3.1180 3.1372 3.1372 3.7823 3.7823 3.9059 3.9059 4.2173 4.2173 4.4075 4.4075 4.4503 4.4503 4.6497 4.6497 5.1241 5.1241 5.2900 5.2900 5.7478 5.7478 6.4710 6.4710 6.7509 6.7509 12.0987 12.0987 12.6831 12.6831 13.6464 13.6464 13.7740 13.7740 14.9072 14.9072 15.5283 15.5283 k = 0.2143-0.0000-0.0000 ( 4306 PWs) bands (ev): -15.9898 -15.9898 -15.9223 -15.9223 -12.8081 -12.8081 -12.7215 -12.7215 -10.6298 -10.6298 -10.4630 -10.4630 -9.6899 -9.6899 -9.5968 -9.5968 -2.3418 -2.3418 -2.3346 -2.3346 -2.2085 -2.2085 -2.1825 -2.1825 -0.1463 -0.1463 1.0342 1.0342 1.2155 1.2155 1.9802 1.9802 2.0581 2.0581 2.3027 2.3027 2.6816 2.6816 3.1051 3.1051 3.1275 3.1275 3.7225 3.7225 3.8698 3.8698 4.1796 4.1796 4.4025 4.4025 4.4383 4.4383 4.5892 4.5892 5.0964 5.0964 5.3244 5.3244 5.7307 5.7307 6.4627 6.4627 6.7306 6.7306 12.1776 12.1776 12.7227 12.7227 13.6031 13.6031 13.7448 13.7448 14.9538 14.9538 15.6698 15.6698 k = 0.2232-0.0000-0.0000 ( 4296 PWs) bands (ev): -15.9474 -15.9474 -15.8806 -15.8806 -12.8239 -12.8239 -12.7415 -12.7415 -10.6079 -10.6079 -10.4415 -10.4415 -9.6845 -9.6845 -9.5924 -9.5924 -2.3485 -2.3485 -2.3463 -2.3463 -2.2910 -2.2910 -2.2550 -2.2550 -0.1095 -0.1095 1.0425 1.0425 1.2283 1.2283 1.9305 1.9305 2.0716 2.0716 2.2485 2.2485 2.6921 2.6921 3.0724 3.0724 3.1338 3.1338 3.6641 3.6641 3.8301 3.8301 4.1395 4.1395 4.3977 4.3977 4.4285 4.4285 4.5322 4.5322 5.0713 5.0713 5.3584 5.3584 5.7129 5.7129 6.4541 6.4541 6.7093 6.7093 12.2554 12.2554 12.7613 12.7613 13.5608 13.5608 13.7157 13.7157 14.9956 14.9956 15.8119 15.8119 k = 0.2321-0.0000-0.0000 ( 4304 PWs) bands (ev): -15.9034 -15.9034 -15.8374 -15.8374 -12.8411 -12.8411 -12.7629 -12.7629 -10.5853 -10.5853 -10.4196 -10.4196 -9.6793 -9.6793 -9.5881 -9.5881 -2.3719 -2.3719 -2.3598 -2.3598 -2.3559 -2.3559 -2.3256 -2.3256 -0.0717 -0.0717 1.0503 1.0503 1.2403 1.2403 1.8840 1.8840 2.0836 2.0836 2.1972 2.1972 2.6992 2.6992 3.0395 3.0395 3.1371 3.1371 3.6079 3.6079 3.7870 3.7870 4.0972 4.0972 4.3932 4.3932 4.4208 4.4208 4.4792 4.4792 5.0488 5.0488 5.3920 5.3920 5.6947 5.6947 6.4451 6.4451 6.6870 6.6870 12.3319 12.3319 12.7984 12.7984 13.5197 13.5197 13.6870 13.6870 15.0324 15.0324 15.9529 15.9529 k = 0.2411-0.0000-0.0000 ( 4302 PWs) bands (ev): -15.8580 -15.8580 -15.7928 -15.7928 -12.8597 -12.8597 -12.7857 -12.7857 -10.5619 -10.5619 -10.3972 -10.3972 -9.6742 -9.6742 -9.5842 -9.5842 -2.4498 -2.4498 -2.3947 -2.3947 -2.3747 -2.3747 -2.3654 -2.3654 -0.0328 -0.0328 1.0577 1.0577 1.2512 1.2512 1.8411 1.8411 2.0897 2.0897 2.1529 2.1529 2.7023 2.7023 3.0067 3.0067 3.1374 3.1374 3.5547 3.5547 3.7406 3.7406 4.0528 4.0528 4.3887 4.3887 4.4151 4.4151 4.4303 4.4303 5.0288 5.0288 5.4251 5.4251 5.6761 5.6761 6.4357 6.4357 6.6637 6.6637 12.4068 12.4068 12.8341 12.8341 13.4802 13.4802 13.6589 13.6589 15.0638 15.0638 16.0909 16.0909 k = 0.2500-0.0000-0.0000 ( 4294 PWs) bands (ev): -15.8112 -15.8112 -15.7468 -15.7468 -12.8799 -12.8799 -12.8101 -12.8101 -10.5379 -10.5379 -10.3743 -10.3743 -9.6694 -9.6694 -9.5806 -9.5806 -2.5254 -2.5254 -2.4607 -2.4607 -2.3921 -2.3921 -2.3760 -2.3760 0.0071 0.0071 1.0645 1.0645 1.2609 1.2609 1.8021 1.8021 2.0727 2.0727 2.1331 2.1331 2.7010 2.7010 2.9744 2.9744 3.1347 3.1347 3.5052 3.5052 3.6913 3.6913 4.0067 4.0067 4.3822 4.3822 4.3875 4.3875 4.4115 4.4115 5.0112 5.0112 5.4577 5.4577 5.6573 5.6573 6.4260 6.4260 6.6394 6.6394 12.4799 12.4799 12.8682 12.8682 13.4423 13.4423 13.6317 13.6317 15.0900 15.0900 16.2236 16.2236 k = 0.2589-0.0000-0.0000 ( 4296 PWs) bands (ev): -15.7630 -15.7630 -15.6994 -15.6994 -12.9017 -12.9017 -12.8361 -12.8361 -10.5132 -10.5132 -10.3511 -10.3511 -9.6648 -9.6648 -9.5774 -9.5774 -2.5984 -2.5984 -2.5245 -2.5245 -2.4112 -2.4112 -2.3880 -2.3880 0.0480 0.0480 1.0708 1.0708 1.2691 1.2691 1.7670 1.7670 2.0332 2.0332 2.1373 2.1373 2.6948 2.6948 2.9432 2.9432 3.1293 3.1293 3.4600 3.4600 3.6394 3.6394 3.9590 3.9590 4.3443 4.3443 4.3803 4.3803 4.4095 4.4095 4.9957 4.9957 5.4898 5.4898 5.6383 5.6383 6.4160 6.4160 6.6140 6.6140 12.5508 12.5508 12.9005 12.9005 13.4061 13.4061 13.6053 13.6053 15.1109 15.1109 16.3479 16.3479 k = 0.2679-0.0000-0.0000 ( 4302 PWs) bands (ev): -15.7135 -15.7135 -15.6508 -15.6508 -12.9252 -12.9252 -12.8637 -12.8637 -10.4879 -10.4879 -10.3275 -10.3275 -9.6605 -9.6605 -9.5747 -9.5747 -2.6686 -2.6686 -2.5857 -2.5857 -2.4323 -2.4323 -2.4016 -2.4016 0.0898 0.0898 1.0765 1.0765 1.2758 1.2758 1.7361 1.7361 1.9900 1.9900 2.1463 2.1463 2.6833 2.6833 2.9133 2.9133 3.1212 3.1212 3.4194 3.4194 3.5857 3.5857 3.9101 3.9101 4.3074 4.3074 4.3760 4.3760 4.4093 4.4093 4.9821 4.9821 5.5213 5.5213 5.6193 5.6193 6.4057 6.4057 6.5877 6.5877 12.6193 12.6193 12.9310 12.9310 13.3717 13.3717 13.5801 13.5801 15.1268 15.1268 16.4605 16.4605 k = 0.2768-0.0000-0.0000 ( 4310 PWs) bands (ev): -15.6627 -15.6627 -15.6009 -15.6009 -12.9503 -12.9503 -12.8929 -12.8929 -10.4620 -10.4620 -10.3036 -10.3036 -9.6566 -9.6566 -9.5724 -9.5724 -2.7357 -2.7357 -2.6441 -2.6441 -2.4553 -2.4553 -2.4166 -2.4166 0.1323 0.1323 1.0814 1.0814 1.2806 1.2806 1.7096 1.7096 1.9477 1.9477 2.1556 2.1556 2.6665 2.6665 2.8851 2.8851 3.1105 3.1105 3.3836 3.3836 3.5308 3.5308 3.8601 3.8601 4.2741 4.2741 4.3718 4.3718 4.4107 4.4107 4.9702 4.9702 5.5524 5.5524 5.6006 5.6006 6.3951 6.3951 6.5604 6.5604 12.6852 12.6852 12.9595 12.9595 13.3393 13.3393 13.5560 13.5560 15.1378 15.1378 16.5592 16.5592 k = 0.2857-0.0000-0.0000 ( 4310 PWs) bands (ev): -15.6106 -15.6106 -15.5498 -15.5498 -12.9771 -12.9771 -12.9238 -12.9238 -10.4355 -10.4355 -10.2796 -10.2796 -9.6531 -9.6531 -9.5707 -9.5707 -2.7997 -2.7997 -2.6995 -2.6995 -2.4803 -2.4803 -2.4331 -2.4331 0.1757 0.1757 1.0857 1.0857 1.2836 1.2836 1.6875 1.6875 1.9071 1.9071 2.1642 2.1642 2.6446 2.6446 2.8589 2.8589 3.0975 3.0975 3.3525 3.3525 3.4752 3.4752 3.8094 3.8094 4.2442 4.2442 4.3678 4.3678 4.4135 4.4135 4.9597 4.9597 5.5813 5.5813 5.5837 5.5837 6.3844 6.3844 6.5321 6.5321 12.7484 12.7484 12.9860 12.9860 13.3088 13.3088 13.5333 13.5333 15.1443 15.1443 16.4868 16.4868 k = 0.2946-0.0000-0.0000 ( 4308 PWs) bands (ev): -15.5573 -15.5573 -15.4975 -15.4975 -13.0057 -13.0057 -12.9563 -12.9563 -10.4086 -10.4086 -10.2553 -10.2553 -9.6499 -9.6499 -9.5696 -9.5696 -2.8604 -2.8604 -2.7518 -2.7518 -2.5071 -2.5071 -2.4512 -2.4512 0.2197 0.2197 1.0892 1.0892 1.2845 1.2845 1.6699 1.6699 1.8688 1.8688 2.1716 2.1716 2.6182 2.6182 2.8351 2.8351 3.0823 3.0823 3.3256 3.3256 3.4197 3.4197 3.7581 3.7581 4.2173 4.2173 4.3640 4.3640 4.4177 4.4177 4.9504 4.9504 5.5644 5.5644 5.6127 5.6127 6.3734 6.3734 6.5029 6.5029 12.8086 12.8086 13.0104 13.0104 13.2805 13.2805 13.5118 13.5118 15.1469 15.1469 16.3894 16.3894 k = 0.3036-0.0000-0.0000 ( 4304 PWs) bands (ev): -15.5029 -15.5029 -15.4441 -15.4441 -13.0361 -13.0361 -12.9906 -12.9906 -10.3813 -10.3813 -10.2309 -10.2309 -9.6473 -9.6473 -9.5692 -9.5692 -2.9178 -2.9178 -2.8010 -2.8010 -2.5357 -2.5357 -2.4707 -2.4707 0.2644 0.2644 1.0919 1.0919 1.2835 1.2835 1.6567 1.6567 1.8325 1.8325 2.1776 2.1776 2.5879 2.5879 2.8139 2.8139 3.0651 3.0651 3.3021 3.3021 3.3648 3.3648 3.7065 3.7065 4.1933 4.1933 4.3604 4.3604 4.4231 4.4231 4.9421 4.9421 5.5473 5.5473 5.6420 5.6420 6.3623 6.3623 6.4728 6.4728 12.8657 12.8657 13.0328 13.0328 13.2542 13.2542 13.4918 13.4918 15.1457 15.1457 16.2944 16.2944 k = 0.3125-0.0000-0.0000 ( 4304 PWs) bands (ev): -15.4473 -15.4473 -15.3896 -15.3896 -13.0682 -13.0682 -13.0266 -13.0266 -10.3535 -10.3535 -10.2064 -10.2064 -9.6451 -9.6451 -9.5694 -9.5694 -2.9716 -2.9716 -2.8470 -2.8470 -2.5659 -2.5659 -2.4918 -2.4918 0.3096 0.3096 1.0939 1.0939 1.2804 1.2804 1.6480 1.6480 1.7985 1.7985 2.1821 2.1821 2.5546 2.5546 2.7954 2.7954 3.0461 3.0461 3.2813 3.2813 3.3111 3.3111 3.6548 3.6548 4.1721 4.1721 4.3572 4.3572 4.4298 4.4298 4.9344 4.9344 5.5311 5.5311 5.6706 5.6706 6.3510 6.3510 6.4418 6.4418 12.9194 12.9194 13.0531 13.0531 13.2300 13.2300 13.4731 13.4731 15.1415 15.1415 16.2021 16.2021 k = 0.3214-0.0000-0.0000 ( 4304 PWs) bands (ev): -15.3907 -15.3907 -15.3341 -15.3341 -13.1021 -13.1021 -13.0644 -13.0644 -10.3255 -10.3255 -10.1819 -10.1819 -9.6434 -9.6434 -9.5703 -9.5703 -3.0219 -3.0219 -2.8896 -2.8896 -2.5978 -2.5978 -2.5142 -2.5142 0.3553 0.3553 1.0951 1.0951 1.2754 1.2754 1.6436 1.6436 1.7666 1.7666 2.1848 2.1848 2.5191 2.5191 2.7799 2.7799 3.0252 3.0252 3.2589 3.2589 3.2625 3.2625 3.6032 3.6032 4.1534 4.1534 4.3543 4.3543 4.4374 4.4374 4.9272 4.9272 5.5161 5.5161 5.6986 5.6986 6.3397 6.3397 6.4099 6.4099 12.9698 12.9698 13.0713 13.0713 13.2079 13.2079 13.4559 13.4559 15.1345 15.1345 16.1125 16.1125 k = 0.3304-0.0000-0.0000 ( 4320 PWs) bands (ev): -15.3330 -15.3330 -15.2777 -15.2777 -13.1379 -13.1379 -13.1038 -13.1038 -10.2971 -10.2971 -10.1574 -10.1574 -9.6423 -9.6423 -9.5721 -9.5721 -3.0686 -3.0686 -2.9288 -2.9288 -2.6311 -2.6311 -2.5380 -2.5380 0.4014 0.4014 1.0955 1.0955 1.2686 1.2686 1.6433 1.6433 1.7366 1.7366 2.1858 2.1858 2.4823 2.4823 2.7672 2.7672 3.0026 3.0026 3.2091 3.2091 3.2445 3.2445 3.5519 3.5519 4.1372 4.1372 4.3516 4.3516 4.4461 4.4461 4.9204 4.9204 5.5025 5.5025 5.7259 5.7259 6.3283 6.3283 6.3772 6.3772 13.0167 13.0167 13.0874 13.0874 13.1879 13.1879 13.4400 13.4400 15.1253 15.1253 16.0258 16.0258 k = 0.3393-0.0000-0.0000 ( 4326 PWs) bands (ev): -15.2744 -15.2744 -15.2203 -15.2203 -13.1754 -13.1754 -13.1450 -13.1450 -10.2685 -10.2685 -10.1330 -10.1330 -9.6418 -9.6418 -9.5746 -9.5746 -3.1116 -3.1116 -2.9646 -2.9646 -2.6656 -2.6656 -2.5630 -2.5630 0.4478 0.4478 1.0951 1.0951 1.2603 1.2603 1.6471 1.6471 1.7085 1.7085 2.1849 2.1849 2.4451 2.4451 2.7575 2.7575 2.9784 2.9784 3.1617 3.1617 3.2271 3.2271 3.5013 3.5013 4.1235 4.1235 4.3493 4.3493 4.4557 4.4557 4.9136 4.9136 5.4904 5.4904 5.7525 5.7525 6.3168 6.3168 6.3437 6.3437 13.0601 13.0601 13.1016 13.1016 13.1699 13.1699 13.4257 13.4257 15.1144 15.1144 15.9422 15.9422 k = 0.3482-0.0000-0.0000 ( 4330 PWs) bands (ev): -15.2149 -15.2149 -15.1620 -15.1620 -13.2147 -13.2147 -13.1879 -13.1879 -10.2398 -10.2398 -10.1087 -10.1087 -9.6419 -9.6419 -9.5780 -9.5780 -3.1508 -3.1508 -2.9970 -2.9970 -2.7012 -2.7012 -2.5892 -2.5892 0.4943 0.4943 1.0941 1.0941 1.2505 1.2505 1.6548 1.6548 1.6820 1.6820 2.1823 2.1823 2.4080 2.4080 2.7506 2.7506 2.9526 2.9526 3.1171 3.1171 3.2095 3.2095 3.4515 3.4515 4.1122 4.1122 4.3470 4.3470 4.4661 4.4661 4.9068 4.9068 5.4801 5.4801 5.7783 5.7783 6.3050 6.3050 6.3097 6.3097 13.0999 13.0999 13.1138 13.1138 13.1541 13.1541 13.4128 13.4128 15.1022 15.1022 15.8618 15.8618 k = 0.3571-0.0000-0.0000 ( 4334 PWs) bands (ev): -15.1545 -15.1545 -15.1030 -15.1030 -13.2557 -13.2557 -13.2325 -13.2325 -10.2110 -10.2110 -10.0846 -10.0846 -9.6426 -9.6426 -9.5823 -9.5823 -3.1863 -3.1863 -3.0258 -3.0258 -2.7377 -2.7377 -2.6163 -2.6163 0.5410 0.5410 1.0925 1.0925 1.2396 1.2396 1.6561 1.6561 1.6670 1.6670 2.1781 2.1781 2.3716 2.3716 2.7465 2.7465 2.9250 2.9250 3.0754 3.0754 3.1915 3.1915 3.4030 3.4030 4.1032 4.1032 4.3448 4.3448 4.4772 4.4772 4.8998 4.8998 5.4718 5.4718 5.8035 5.8035 6.2744 6.2744 6.2940 6.2940 13.1241 13.1241 13.1356 13.1356 13.1409 13.1409 13.4012 13.4012 15.0891 15.0891 15.7847 15.7847 k = 0.3661-0.0000-0.0000 ( 4342 PWs) bands (ev): -15.0933 -15.0933 -15.0432 -15.0432 -13.2985 -13.2985 -13.2787 -13.2787 -10.1821 -10.1821 -10.0607 -10.0607 -9.6441 -9.6441 -9.5876 -9.5876 -3.2180 -3.2180 -3.0513 -3.0513 -2.7748 -2.7748 -2.6444 -2.6444 0.5877 0.5877 1.0903 1.0903 1.2277 1.2277 1.6322 1.6322 1.6817 1.6817 2.1724 2.1724 2.3364 2.3364 2.7450 2.7450 2.8955 2.8955 3.0369 3.0369 3.1727 3.1727 3.3559 3.3559 4.0966 4.0966 4.3424 4.3424 4.4890 4.4890 4.8925 4.8925 5.4657 5.4657 5.8279 5.8279 6.2388 6.2388 6.2825 6.2825 13.1279 13.1279 13.1326 13.1326 13.1694 13.1694 13.3910 13.3910 15.0757 15.0757 15.7109 15.7109 k = 0.3750-0.0000-0.0000 ( 4346 PWs) bands (ev): -15.0315 -15.0315 -14.9827 -14.9827 -13.3429 -13.3429 -13.3265 -13.3265 -10.1533 -10.1533 -10.0371 -10.0371 -9.6463 -9.6463 -9.5938 -9.5938 -3.2460 -3.2460 -3.0732 -3.0732 -2.8124 -2.8124 -2.6732 -2.6732 0.6343 0.6343 1.0877 1.0877 1.2150 1.2150 1.6088 1.6088 1.7003 1.7003 2.1655 2.1655 2.3028 2.3028 2.7460 2.7460 2.8641 2.8641 3.0018 3.0018 3.1531 3.1531 3.3106 3.3106 4.0922 4.0922 4.3397 4.3397 4.5015 4.5015 4.8847 4.8847 5.4620 5.4620 5.8516 5.8516 6.2027 6.2027 6.2711 6.2711 13.1179 13.1179 13.1393 13.1393 13.1989 13.1989 13.3822 13.3822 15.0622 15.0622 15.6406 15.6406 k = 0.3839-0.0000-0.0000 ( 4346 PWs) bands (ev): -14.9689 -14.9689 -14.9217 -14.9217 -13.3890 -13.3890 -13.3759 -13.3759 -10.1246 -10.1246 -10.0139 -10.0139 -9.6492 -9.6492 -9.6010 -9.6010 -3.2702 -3.2702 -3.0917 -3.0917 -2.8502 -2.8502 -2.7026 -2.7026 0.6807 0.6807 1.0848 1.0848 1.2019 1.2019 1.5858 1.5858 1.7223 1.7223 2.1576 2.1576 2.2711 2.2711 2.7491 2.7491 2.8306 2.8306 2.9699 2.9699 3.1325 3.1325 3.2674 3.2674 4.0900 4.0900 4.3366 4.3366 4.5146 4.5146 4.8765 4.8765 5.4609 5.4609 5.8744 5.8744 6.1661 6.1661 6.2597 6.2597 13.1096 13.1096 13.1444 13.1444 13.2252 13.2252 13.3746 13.3746 15.0491 15.0491 15.5739 15.5739 k = 0.3929-0.0000-0.0000 ( 4348 PWs) bands (ev): -14.9058 -14.9058 -14.8601 -14.8601 -13.4367 -13.4367 -13.4268 -13.4268 -10.0960 -10.0960 -9.9910 -9.9910 -9.6529 -9.6529 -9.6092 -9.6092 -3.2906 -3.2906 -3.1069 -3.1069 -2.8881 -2.8881 -2.7323 -2.7323 0.7269 0.7269 1.0815 1.0815 1.1885 1.1885 1.5629 1.5629 1.7475 1.7475 2.1490 2.1490 2.2415 2.2415 2.7542 2.7542 2.7949 2.7949 2.9415 2.9415 3.1110 3.1110 3.2266 3.2266 4.0900 4.0900 4.3327 4.3327 4.5282 4.5282 4.8676 4.8676 5.4625 5.4625 5.8965 5.8965 6.1291 6.1291 6.2483 6.2483 13.1029 13.1029 13.1480 13.1480 13.2483 13.2483 13.3682 13.3682 15.0367 15.0367 15.5107 15.5107 k = 0.4018-0.0000-0.0000 ( 4348 PWs) bands (ev): -14.8422 -14.8422 -14.7980 -14.7980 -13.4859 -13.4859 -13.4792 -13.4792 -10.0677 -10.0677 -9.9686 -9.9686 -9.6574 -9.6574 -9.6184 -9.6184 -3.3073 -3.3073 -3.1187 -3.1187 -2.9258 -2.9258 -2.7623 -2.7623 0.7726 0.7726 1.0782 1.0782 1.1750 1.1750 1.5398 1.5398 1.7757 1.7757 2.1402 2.1402 2.2142 2.2142 2.7557 2.7557 2.7623 2.7623 2.9165 2.9165 3.0887 3.0887 3.1883 3.1883 4.0921 4.0921 4.3280 4.3280 4.5423 4.5423 4.8581 4.8581 5.4670 5.4670 5.9178 5.9178 6.0917 6.0917 6.2370 6.2370 13.0979 13.0979 13.1501 13.1501 13.2684 13.2684 13.3630 13.3630 15.0253 15.0253 15.4512 15.4512 k = 0.4107-0.0000-0.0000 ( 4338 PWs) bands (ev): -14.7781 -14.7781 -14.7356 -14.7356 -13.5366 -13.5366 -13.5330 -13.5330 -10.0397 -10.0397 -9.9467 -9.9467 -9.6627 -9.6627 -9.6287 -9.6287 -3.3203 -3.3203 -3.1273 -3.1273 -2.9630 -2.9630 -2.7923 -2.7923 0.8179 0.8179 1.0749 1.0749 1.1616 1.1616 1.5163 1.5163 1.8068 1.8068 2.1312 2.1312 2.1895 2.1895 2.7162 2.7162 2.7699 2.7699 2.8949 2.8949 3.0658 3.0658 3.1527 3.1527 4.0962 4.0962 4.3224 4.3224 4.5568 4.5568 4.8480 4.8480 5.4743 5.4743 5.9384 5.9384 6.0542 6.0542 6.2256 6.2256 13.0944 13.0944 13.1510 13.1510 13.2858 13.2858 13.3588 13.3588 15.0153 15.0153 15.3954 15.3954 k = 0.4196-0.0000-0.0000 ( 4334 PWs) bands (ev): -14.7137 -14.7137 -14.6728 -14.6728 -13.5887 -13.5887 -13.5881 -13.5881 -10.0121 -10.0121 -9.9253 -9.9253 -9.6689 -9.6689 -9.6401 -9.6401 -3.3297 -3.3297 -3.1326 -3.1326 -2.9996 -2.9996 -2.8222 -2.8222 0.8625 0.8625 1.0717 1.0717 1.1486 1.1486 1.4921 1.4921 1.8405 1.8405 2.1225 2.1225 2.1673 2.1673 2.6737 2.6737 2.7797 2.7797 2.8767 2.8767 3.0425 3.0425 3.1197 3.1197 4.1021 4.1021 4.3156 4.3156 4.5718 4.5718 4.8372 4.8372 5.4845 5.4845 5.9580 5.9580 6.0165 6.0165 6.2143 6.2143 13.0923 13.0923 13.1507 13.1507 13.3004 13.3004 13.3555 13.3555 15.0069 15.0069 15.3432 15.3432 k = 0.4286-0.0000-0.0000 ( 4330 PWs) bands (ev): -14.6490 -14.6490 -14.6099 -14.6099 -13.6444 -13.6444 -13.6421 -13.6421 -9.9848 -9.9848 -9.9045 -9.9045 -9.6759 -9.6759 -9.6525 -9.6525 -3.3356 -3.3356 -3.1349 -3.1349 -3.0353 -3.0353 -2.8518 -2.8518 0.9065 0.9065 1.0688 1.0688 1.1362 1.1362 1.4670 1.4670 1.8768 1.8768 2.1142 2.1142 2.1477 2.1477 2.6290 2.6290 2.7908 2.7908 2.8619 2.8619 3.0191 3.0191 3.0893 3.0893 4.1097 4.1097 4.3077 4.3077 4.5870 4.5870 4.8258 4.8258 5.4976 5.4976 5.9742 5.9742 5.9817 5.9817 6.2029 6.2029 13.0915 13.0915 13.1494 13.1494 13.3127 13.3127 13.3531 13.3531 15.0004 15.0004 15.2949 15.2949 k = 0.4375-0.0000-0.0000 ( 4332 PWs) bands (ev): -14.5841 -14.5841 -14.5468 -14.5468 -13.7020 -13.7020 -13.6968 -13.6968 -9.9581 -9.9581 -9.8844 -9.8844 -9.6838 -9.6838 -9.6660 -9.6660 -3.3379 -3.3379 -3.1341 -3.1341 -3.0699 -3.0699 -2.8809 -2.8809 0.9497 0.9497 1.0663 1.0663 1.1244 1.1244 1.4408 1.4408 1.9154 1.9154 2.1065 2.1065 2.1308 2.1308 2.5826 2.5826 2.8029 2.8029 2.8506 2.8506 2.9958 2.9958 3.0612 3.0612 4.1188 4.1188 4.2987 4.2987 4.6025 4.6025 4.8136 4.8136 5.5136 5.5136 5.9406 5.9406 5.9958 5.9958 6.1914 6.1914 13.0918 13.0918 13.1471 13.1471 13.3227 13.3227 13.3515 13.3515 14.9960 14.9960 15.2502 15.2502 k = 0.4464-0.0000-0.0000 ( 4328 PWs) bands (ev): -14.5190 -14.5190 -14.4836 -14.4836 -13.7606 -13.7606 -13.7527 -13.7527 -9.9320 -9.9320 -9.8648 -9.8648 -9.6925 -9.6925 -9.6806 -9.6806 -3.3369 -3.3369 -3.1305 -3.1305 -3.1032 -3.1032 -2.9093 -2.9093 0.9920 0.9920 1.0643 1.0643 1.1134 1.1134 1.4136 1.4136 1.9562 1.9562 2.0996 2.0996 2.1164 2.1164 2.5348 2.5348 2.8158 2.8158 2.8428 2.8428 2.9729 2.9729 3.0352 3.0352 4.1293 4.1293 4.2885 4.2885 4.6182 4.6182 4.8009 4.8009 5.5322 5.5322 5.9033 5.9033 6.0133 6.0133 6.1798 6.1798 13.0932 13.0932 13.1441 13.1441 13.3308 13.3308 13.3505 13.3505 14.9940 14.9940 15.2093 15.2093 k = 0.4554-0.0000-0.0000 ( 4328 PWs) bands (ev): -14.4539 -14.4539 -14.4204 -14.4204 -13.8203 -13.8203 -13.8097 -13.8097 -9.9064 -9.9064 -9.8460 -9.8460 -9.7022 -9.7022 -9.6962 -9.6962 -3.3326 -3.3326 -3.1351 -3.1351 -3.1240 -3.1240 -2.9368 -2.9368 1.0334 1.0334 1.0630 1.0630 1.1034 1.1034 1.3852 1.3852 1.9988 1.9988 2.0936 2.0936 2.1046 2.1046 2.4858 2.4858 2.8289 2.8289 2.8390 2.8390 2.9508 2.9508 3.0110 3.0110 4.1410 4.1410 4.2773 4.2773 4.6341 4.6341 4.7875 4.7875 5.5535 5.5535 5.8663 5.8663 6.0301 6.0301 6.1680 6.1680 13.0955 13.0955 13.1403 13.1403 13.3371 13.3371 13.3500 13.3500 14.9945 14.9945 15.1722 15.1722 k = 0.4643-0.0000-0.0000 ( 4334 PWs) bands (ev): -14.3889 -14.3889 -14.3574 -14.3574 -13.8809 -13.8809 -13.8677 -13.8677 -9.8816 -9.8816 -9.8279 -9.8279 -9.7135 -9.7135 -9.7121 -9.7121 -3.3251 -3.3251 -3.1652 -3.1652 -3.1150 -3.1150 -2.9632 -2.9632 1.0622 1.0622 1.0739 1.0739 1.0944 1.0944 1.3555 1.3555 2.0429 2.0429 2.0887 2.0887 2.0952 2.0952 2.4360 2.4360 2.8352 2.8352 2.8461 2.8461 2.9297 2.9297 2.9885 2.9885 4.1537 4.1537 4.2651 4.2651 4.6501 4.6501 4.7736 4.7736 5.5771 5.5771 5.8297 5.8297 6.0462 6.0462 6.1560 6.1560 13.0986 13.0986 13.1360 13.1360 13.3418 13.3418 13.3498 13.3498 14.9977 14.9977 15.1387 15.1387 k = 0.4732-0.0000-0.0000 ( 4330 PWs) bands (ev): -14.3240 -14.3240 -14.2945 -14.2945 -13.9424 -13.9424 -13.9266 -13.9266 -9.8574 -9.8574 -9.8106 -9.8106 -9.7308 -9.7308 -9.7240 -9.7240 -3.3145 -3.3145 -3.1935 -3.1935 -3.1033 -3.1033 -2.9884 -2.9884 1.0626 1.0626 1.0864 1.0864 1.1132 1.1132 1.3246 1.3246 2.0805 2.0805 2.0880 2.0880 2.0931 2.0931 2.3857 2.3857 2.8379 2.8379 2.8607 2.8607 2.9101 2.9101 2.9673 2.9673 4.1671 4.1671 4.2521 4.2521 4.6661 4.6661 4.7592 4.7592 5.6030 5.6030 5.7939 5.7939 6.0617 6.0617 6.1437 6.1437 13.1023 13.1023 13.1313 13.1313 13.3452 13.3452 13.3499 13.3499 15.0039 15.0039 15.1089 15.1089 k = 0.4821-0.0000-0.0000 ( 4336 PWs) bands (ev): -14.2593 -14.2593 -14.2320 -14.2320 -14.0046 -14.0046 -13.9864 -13.9864 -9.8341 -9.8341 -9.7941 -9.7941 -9.7495 -9.7495 -9.7363 -9.7363 -3.3009 -3.3009 -3.2198 -3.2198 -3.0893 -3.0893 -3.0121 -3.0121 1.0639 1.0639 1.0797 1.0797 1.1514 1.1514 1.2924 1.2924 2.0803 2.0803 2.0830 2.0830 2.1375 2.1375 2.3352 2.3352 2.8433 2.8433 2.8765 2.8765 2.8921 2.8921 2.9474 2.9474 4.1811 4.1811 4.2385 4.2385 4.6821 4.6821 4.7444 4.7444 5.6309 5.6309 5.7588 5.7588 6.0766 6.0766 6.1312 6.1312 13.1066 13.1066 13.1264 13.1264 13.3475 13.3475 13.3500 13.3500 15.0131 15.0131 15.0828 15.0828 k = 0.4911-0.0000-0.0000 ( 4324 PWs) bands (ev): -14.1949 -14.1949 -14.1698 -14.1698 -14.0675 -14.0675 -14.0469 -14.0469 -9.8116 -9.8116 -9.7784 -9.7784 -9.7693 -9.7693 -9.7494 -9.7494 -3.2845 -3.2845 -3.2438 -3.2438 -3.0730 -3.0730 -3.0342 -3.0342 1.0662 1.0662 1.0740 1.0740 1.1884 1.1884 1.2589 1.2589 2.0788 2.0788 2.0799 2.0799 2.1857 2.1857 2.2849 2.2849 2.8515 2.8515 2.8762 2.8762 2.8931 2.8931 2.9284 2.9284 4.1955 4.1955 4.2243 4.2243 4.6980 4.6980 4.7292 4.7292 5.6607 5.6607 5.7248 5.7248 6.0910 6.0910 6.1182 6.1182 13.1113 13.1113 13.1213 13.1213 13.3490 13.3490 13.3500 13.3500 15.0255 15.0255 15.0602 15.0602 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -14.1310 -14.1310 -14.1310 -14.1310 -14.1080 -14.1080 -14.1080 -14.1080 -9.7900 -9.7900 -9.7900 -9.7900 -9.7635 -9.7635 -9.7635 -9.7635 -3.2654 -3.2654 -3.2654 -3.2654 -3.0546 -3.0546 -3.0546 -3.0546 1.0695 1.0695 1.0695 1.0695 1.2243 1.2243 1.2243 1.2243 2.0786 2.0786 2.0786 2.0786 2.2350 2.2350 2.2350 2.2350 2.8626 2.8626 2.8626 2.8626 2.9104 2.9104 2.9104 2.9104 4.2099 4.2099 4.2099 4.2099 4.7137 4.7137 4.7137 4.7137 5.6921 5.6921 5.6921 5.6921 6.1048 6.1048 6.1048 6.1048 13.1162 13.1162 13.1162 13.1162 13.3498 13.3498 13.3498 13.3498 15.0411 15.0411 15.0411 15.0411 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -14.1310 -14.1310 -14.1310 -14.1310 -14.1080 -14.1080 -14.1080 -14.1080 -9.7900 -9.7900 -9.7900 -9.7900 -9.7635 -9.7635 -9.7635 -9.7635 -3.2654 -3.2654 -3.2654 -3.2654 -3.0546 -3.0546 -3.0546 -3.0546 1.0695 1.0695 1.0695 1.0695 1.2243 1.2243 1.2243 1.2243 2.0786 2.0786 2.0786 2.0786 2.2350 2.2350 2.2350 2.2350 2.8626 2.8626 2.8626 2.8626 2.9104 2.9104 2.9104 2.9104 4.2099 4.2099 4.2099 4.2099 4.7137 4.7137 4.7137 4.7137 5.6921 5.6921 5.6921 5.6921 6.1048 6.1048 6.1048 6.1048 13.1162 13.1162 13.1162 13.1162 13.3498 13.3498 13.3498 13.3498 15.0411 15.0411 15.0411 15.0411 k = 0.5000 0.0090-0.0000 ( 4336 PWs) bands (ev): -14.1309 -14.1309 -14.1309 -14.1309 -14.1080 -14.1080 -14.1080 -14.1080 -9.7900 -9.7900 -9.7900 -9.7900 -9.7636 -9.7636 -9.7636 -9.7636 -3.2656 -3.2656 -3.2656 -3.2656 -3.0549 -3.0549 -3.0549 -3.0549 1.0644 1.0644 1.0652 1.0652 1.2280 1.2280 1.2293 1.2293 2.0754 2.0754 2.0757 2.0757 2.2357 2.2357 2.2365 2.2365 2.8558 2.8558 2.8600 2.8600 2.9160 2.9160 2.9201 2.9201 4.2099 4.2099 4.2103 4.2103 4.7130 4.7130 4.7136 4.7136 5.6926 5.6926 5.6933 5.6933 6.1052 6.1052 6.1054 6.1054 13.1152 13.1152 13.1153 13.1153 13.3493 13.3493 13.3493 13.3493 15.0418 15.0418 15.0419 15.0419 k = 0.5000 0.0179-0.0000 ( 4340 PWs) bands (ev): -14.1307 -14.1307 -14.1307 -14.1307 -14.1079 -14.1079 -14.1079 -14.1079 -9.7901 -9.7901 -9.7901 -9.7901 -9.7638 -9.7638 -9.7638 -9.7638 -3.2663 -3.2663 -3.2663 -3.2663 -3.0559 -3.0559 -3.0558 -3.0558 1.0512 1.0512 1.0525 1.0525 1.2392 1.2392 1.2417 1.2417 2.0663 2.0663 2.0667 2.0667 2.2388 2.2388 2.2402 2.2402 2.8458 2.8458 2.8516 2.8516 2.9335 2.9335 2.9390 2.9390 4.2102 4.2102 4.2110 4.2110 4.7114 4.7114 4.7126 4.7126 5.6950 5.6950 5.6964 5.6964 6.1065 6.1065 6.1069 6.1069 13.1124 13.1124 13.1125 13.1125 13.3479 13.3479 13.3480 13.3480 15.0439 15.0439 15.0440 15.0440 k = 0.5000 0.0269-0.0000 ( 4338 PWs) bands (ev): -14.1303 -14.1303 -14.1303 -14.1303 -14.1076 -14.1076 -14.1076 -14.1076 -9.7903 -9.7903 -9.7902 -9.7902 -9.7642 -9.7642 -9.7642 -9.7642 -3.2674 -3.2674 -3.2674 -3.2674 -3.0575 -3.0575 -3.0574 -3.0574 1.0327 1.0327 1.0341 1.0341 1.2554 1.2554 1.2587 1.2587 2.0517 2.0517 2.0522 2.0522 2.2441 2.2441 2.2460 2.2460 2.8367 2.8367 2.8428 2.8428 2.9569 2.9569 2.9626 2.9626 4.2108 4.2108 4.2121 4.2121 4.7090 4.7090 4.7108 4.7108 5.6991 5.6991 5.7012 5.7012 6.1088 6.1088 6.1093 6.1093 13.1078 13.1078 13.1080 13.1080 13.3456 13.3456 13.3459 13.3459 15.0474 15.0474 15.0475 15.0475 k = 0.5000 0.0359-0.0000 ( 4330 PWs) bands (ev): -14.1298 -14.1298 -14.1298 -14.1298 -14.1073 -14.1073 -14.1073 -14.1073 -9.7905 -9.7905 -9.7904 -9.7904 -9.7648 -9.7648 -9.7648 -9.7648 -3.2689 -3.2689 -3.2689 -3.2689 -3.0597 -3.0597 -3.0595 -3.0595 1.0107 1.0107 1.0123 1.0123 1.2744 1.2744 1.2783 1.2783 2.0322 2.0322 2.0327 2.0327 2.2517 2.2517 2.2539 2.2539 2.8293 2.8293 2.8353 2.8353 2.9838 2.9838 2.9895 2.9895 4.2117 4.2117 4.2135 4.2135 4.7060 4.7060 4.7083 4.7083 5.7049 5.7049 5.7076 5.7076 6.1119 6.1119 6.1126 6.1126 13.1015 13.1015 13.1017 13.1017 13.3424 13.3424 13.3428 13.3428 15.0523 15.0523 15.0525 15.0525 k = 0.5000 0.0448-0.0000 ( 4330 PWs) bands (ev): -14.1292 -14.1292 -14.1292 -14.1292 -14.1069 -14.1069 -14.1069 -14.1069 -9.7907 -9.7907 -9.7907 -9.7907 -9.7655 -9.7655 -9.7655 -9.7655 -3.2708 -3.2708 -3.2708 -3.2708 -3.0624 -3.0624 -3.0623 -3.0623 0.9868 0.9868 0.9882 0.9882 1.2948 1.2948 1.2992 1.2992 2.0085 2.0085 2.0089 2.0089 2.2613 2.2613 2.2638 2.2638 2.8237 2.8237 2.8294 2.8294 3.0133 3.0133 3.0187 3.0187 4.2130 4.2130 4.2152 4.2152 4.7024 4.7024 4.7052 4.7052 5.7122 5.7122 5.7155 5.7155 6.1160 6.1160 6.1168 6.1168 13.0936 13.0936 13.0939 13.0939 13.3384 13.3384 13.3388 13.3388 15.0586 15.0586 15.0588 15.0588 k = 0.5000 0.0538-0.0000 ( 4330 PWs) bands (ev): -14.1285 -14.1285 -14.1285 -14.1285 -14.1064 -14.1064 -14.1063 -14.1063 -9.7910 -9.7910 -9.7910 -9.7910 -9.7664 -9.7664 -9.7664 -9.7664 -3.2731 -3.2731 -3.2731 -3.2731 -3.0658 -3.0658 -3.0656 -3.0656 0.9614 0.9614 0.9628 0.9628 1.3159 1.3159 1.3207 1.3207 1.9815 1.9815 1.9817 1.9817 2.2730 2.2730 2.2757 2.2757 2.8198 2.8198 2.8251 2.8251 3.0447 3.0447 3.0498 3.0498 4.2146 4.2146 4.2171 4.2171 4.6984 4.6984 4.7018 4.7018 5.7209 5.7209 5.7247 5.7247 6.1210 6.1210 6.1219 6.1219 13.0843 13.0843 13.0847 13.0847 13.3333 13.3333 13.3338 13.3338 15.0662 15.0662 15.0664 15.0664 k = 0.5000 0.0628-0.0000 ( 4326 PWs) bands (ev): -14.1276 -14.1276 -14.1276 -14.1276 -14.1058 -14.1058 -14.1057 -14.1057 -9.7914 -9.7914 -9.7914 -9.7914 -9.7675 -9.7675 -9.7674 -9.7674 -3.2757 -3.2757 -3.2757 -3.2757 -3.0697 -3.0697 -3.0695 -3.0695 0.9352 0.9352 0.9364 0.9364 1.3371 1.3371 1.3422 1.3422 1.9516 1.9516 1.9518 1.9518 2.2868 2.2868 2.2896 2.2896 2.8171 2.8171 2.8220 2.8220 3.0774 3.0774 3.0822 3.0822 4.2165 4.2165 4.2194 4.2194 4.6942 4.6942 4.6980 4.6980 5.7307 5.7307 5.7350 5.7350 6.1268 6.1268 6.1279 6.1279 13.0738 13.0738 13.0743 13.0743 13.3275 13.3275 13.3280 13.3280 15.0751 15.0751 15.0753 15.0753 k = 0.5000 0.0717-0.0000 ( 4326 PWs) bands (ev): -14.1266 -14.1266 -14.1266 -14.1266 -14.1051 -14.1051 -14.1051 -14.1051 -9.7918 -9.7918 -9.7918 -9.7918 -9.7686 -9.7686 -9.7686 -9.7686 -3.2787 -3.2787 -3.2786 -3.2786 -3.0741 -3.0741 -3.0739 -3.0739 0.9084 0.9084 0.9095 0.9095 1.3581 1.3581 1.3636 1.3636 1.9198 1.9198 1.9199 1.9199 2.3026 2.3026 2.3054 2.3054 2.8154 2.8154 2.8198 2.8198 3.1111 3.1111 3.1155 3.1155 4.2187 4.2187 4.2220 4.2220 4.6900 4.6900 4.6941 4.6941 5.7414 5.7414 5.7463 5.7463 6.1334 6.1334 6.1346 6.1346 13.0624 13.0624 13.0629 13.0629 13.3207 13.3207 13.3213 13.3213 15.0853 15.0853 15.0856 15.0856 k = 0.5000 0.0807-0.0000 ( 4328 PWs) bands (ev): -14.1255 -14.1255 -14.1255 -14.1255 -14.1044 -14.1044 -14.1043 -14.1043 -9.7923 -9.7923 -9.7922 -9.7922 -9.7699 -9.7699 -9.7699 -9.7699 -3.2819 -3.2819 -3.2818 -3.2818 -3.0791 -3.0791 -3.0788 -3.0788 0.8812 0.8812 0.8821 0.8821 1.3788 1.3788 1.3846 1.3846 1.8865 1.8865 1.8865 1.8865 2.3202 2.3202 2.3231 2.3231 2.8143 2.8143 2.8182 2.8182 3.1452 3.1452 3.1494 3.1494 4.2213 4.2213 4.2249 4.2249 4.6858 4.6858 4.6903 4.6903 5.7530 5.7530 5.7582 5.7582 6.1408 6.1408 6.1421 6.1421 13.0501 13.0501 13.0508 13.0508 13.3131 13.3131 13.3138 13.3138 15.0966 15.0966 15.0970 15.0970 k = 0.5000 0.0896-0.0000 ( 4324 PWs) bands (ev): -14.1243 -14.1243 -14.1243 -14.1243 -14.1036 -14.1036 -14.1035 -14.1035 -9.7928 -9.7928 -9.7928 -9.7928 -9.7714 -9.7714 -9.7713 -9.7713 -3.2853 -3.2853 -3.2853 -3.2853 -3.0844 -3.0844 -3.0842 -3.0842 0.8536 0.8536 0.8544 0.8544 1.3989 1.3989 1.4050 1.4050 1.8524 1.8524 1.8526 1.8526 2.3397 2.3397 2.3426 2.3426 2.8135 2.8135 2.8169 2.8169 3.1796 3.1796 3.1834 3.1834 4.2243 4.2243 4.2281 4.2281 4.6817 4.6817 4.6866 4.6866 5.7652 5.7652 5.7708 5.7708 6.1488 6.1488 6.1503 6.1503 13.0374 13.0374 13.0381 13.0381 13.3047 13.3047 13.3054 13.3054 15.1091 15.1091 15.1095 15.1095 k = 0.5000 0.0986-0.0000 ( 4316 PWs) bands (ev): -14.1230 -14.1230 -14.1230 -14.1230 -14.1027 -14.1027 -14.1027 -14.1027 -9.7933 -9.7933 -9.7933 -9.7933 -9.7729 -9.7729 -9.7728 -9.7728 -3.2890 -3.2890 -3.2889 -3.2889 -3.0902 -3.0902 -3.0899 -3.0899 0.8260 0.8260 0.8267 0.8267 1.4181 1.4181 1.4245 1.4245 1.8183 1.8183 1.8185 1.8185 2.3609 2.3609 2.3639 2.3639 2.8127 2.8127 2.8156 2.8156 3.2138 3.2138 3.2174 3.2174 4.2278 4.2278 4.2319 4.2319 4.6780 4.6780 4.6831 4.6831 5.7778 5.7778 5.7837 5.7837 6.1575 6.1575 6.1590 6.1590 13.0244 13.0244 13.0252 13.0252 13.2955 13.2955 13.2963 13.2963 15.1227 15.1227 15.1232 15.1232 k = 0.5000 0.1076-0.0000 ( 4320 PWs) bands (ev): -14.1216 -14.1216 -14.1216 -14.1216 -14.1018 -14.1018 -14.1018 -14.1018 -9.7939 -9.7939 -9.7939 -9.7939 -9.7745 -9.7745 -9.7744 -9.7744 -3.2928 -3.2928 -3.2927 -3.2927 -3.0964 -3.0964 -3.0961 -3.0961 0.7983 0.7983 0.7988 0.7988 1.4362 1.4362 1.4428 1.4428 1.7848 1.7848 1.7850 1.7850 2.3837 2.3837 2.3866 2.3866 2.8116 2.8116 2.8141 2.8141 3.2477 3.2477 3.2510 3.2510 4.2317 4.2317 4.2361 4.2361 4.6746 4.6746 4.6800 4.6800 5.7907 5.7907 5.7969 5.7969 6.1666 6.1666 6.1682 6.1682 13.0113 13.0113 13.0121 13.0121 13.2856 13.2856 13.2865 13.2865 15.1372 15.1372 15.1377 15.1377 k = 0.5000 0.1165-0.0000 ( 4324 PWs) bands (ev): -14.1201 -14.1201 -14.1201 -14.1201 -14.1008 -14.1008 -14.1008 -14.1008 -9.7945 -9.7945 -9.7945 -9.7945 -9.7762 -9.7762 -9.7762 -9.7762 -3.2967 -3.2967 -3.2966 -3.2966 -3.1029 -3.1029 -3.1026 -3.1026 0.7707 0.7707 0.7711 0.7711 1.4526 1.4526 1.4594 1.4594 1.7529 1.7529 1.7531 1.7531 2.4077 2.4077 2.4107 2.4107 2.8100 2.8100 2.8121 2.8121 3.2811 3.2811 3.2841 3.2841 4.2363 4.2363 4.2408 4.2408 4.6716 4.6716 4.6771 4.6771 5.8039 5.8039 5.8103 5.8103 6.1760 6.1760 6.1777 6.1777 12.9984 12.9984 12.9993 12.9993 13.2751 13.2751 13.2760 13.2760 15.1525 15.1525 15.1532 15.1532 k = 0.5000 0.1255-0.0000 ( 4320 PWs) bands (ev): -14.1186 -14.1186 -14.1186 -14.1186 -14.0998 -14.0998 -14.0998 -14.0998 -9.7952 -9.7952 -9.7952 -9.7952 -9.7780 -9.7780 -9.7779 -9.7779 -3.3006 -3.3006 -3.3006 -3.3006 -3.1096 -3.1096 -3.1093 -3.1093 0.7432 0.7432 0.7435 0.7435 1.4665 1.4665 1.4733 1.4733 1.7238 1.7238 1.7239 1.7239 2.4329 2.4329 2.4359 2.4359 2.8078 2.8078 2.8095 2.8095 3.3137 3.3137 3.3165 3.3165 4.2414 4.2414 4.2461 4.2461 4.6691 4.6691 4.6747 4.6747 5.8172 5.8172 5.8237 5.8237 6.1856 6.1856 6.1874 6.1874 12.9858 12.9858 12.9868 12.9868 13.2641 13.2641 13.2649 13.2649 15.1686 15.1686 15.1693 15.1693 k = 0.5000 0.1345-0.0000 ( 4320 PWs) bands (ev): -14.1170 -14.1170 -14.1170 -14.1170 -14.0988 -14.0988 -14.0988 -14.0988 -9.7959 -9.7959 -9.7958 -9.7958 -9.7798 -9.7798 -9.7798 -9.7798 -3.3046 -3.3046 -3.3045 -3.3045 -3.1167 -3.1167 -3.1163 -3.1163 0.7160 0.7160 0.7162 0.7162 1.4764 1.4764 1.4830 1.4830 1.6991 1.6991 1.6994 1.6994 2.4588 2.4588 2.4619 2.4619 2.8047 2.8047 2.8063 2.8063 3.3455 3.3455 3.3480 3.3480 4.2473 4.2473 4.2521 4.2521 4.6669 4.6669 4.6727 4.6727 5.8306 5.8306 5.8372 5.8372 6.1952 6.1952 6.1971 6.1971 12.9738 12.9738 12.9748 12.9748 13.2526 13.2526 13.2534 13.2534 15.1852 15.1852 15.1861 15.1861 k = 0.5000 0.1434-0.0000 ( 4324 PWs) bands (ev): -14.1153 -14.1153 -14.1153 -14.1153 -14.0978 -14.0978 -14.0978 -14.0978 -9.7966 -9.7966 -9.7966 -9.7966 -9.7817 -9.7817 -9.7816 -9.7816 -3.3085 -3.3085 -3.3085 -3.3085 -3.1239 -3.1239 -3.1236 -3.1236 0.6891 0.6891 0.6892 0.6892 1.4805 1.4805 1.4865 1.4865 1.6810 1.6810 1.6819 1.6819 2.4850 2.4850 2.4883 2.4883 2.8009 2.8009 2.8023 2.8023 3.3763 3.3763 3.3787 3.3787 4.2538 4.2538 4.2587 4.2587 4.6653 4.6653 4.6710 4.6710 5.8440 5.8440 5.8506 5.8506 6.2047 6.2047 6.2067 6.2067 12.9626 12.9626 12.9636 12.9636 13.2406 13.2406 13.2415 13.2415 15.2023 15.2023 15.2032 15.2032 k = 0.5000 0.1524-0.0000 ( 4314 PWs) bands (ev): -14.1137 -14.1137 -14.1136 -14.1136 -14.0968 -14.0968 -14.0967 -14.0967 -9.7973 -9.7973 -9.7973 -9.7973 -9.7836 -9.7836 -9.7835 -9.7835 -3.3124 -3.3124 -3.3124 -3.3124 -3.1313 -3.1313 -3.1309 -3.1309 0.6627 0.6627 0.6628 0.6628 1.4768 1.4768 1.4819 1.4819 1.6716 1.6716 1.6735 1.6735 2.5110 2.5110 2.5145 2.5145 2.7965 2.7965 2.7978 2.7978 3.4061 3.4061 3.4083 3.4083 4.2609 4.2609 4.2659 4.2659 4.6640 4.6640 4.6698 4.6698 5.8573 5.8573 5.8639 5.8639 6.2138 6.2138 6.2159 6.2159 12.9523 12.9523 12.9533 12.9533 13.2285 13.2285 13.2294 13.2294 15.2197 15.2197 15.2207 15.2207 k = 0.5000 0.1614-0.0000 ( 4314 PWs) bands (ev): -14.1119 -14.1119 -14.1119 -14.1119 -14.0957 -14.0957 -14.0957 -14.0957 -9.7981 -9.7981 -9.7980 -9.7980 -9.7855 -9.7855 -9.7855 -9.7855 -3.3162 -3.3162 -3.3161 -3.3161 -3.1387 -3.1387 -3.1384 -3.1384 0.6369 0.6369 0.6369 0.6369 1.4652 1.4652 1.4692 1.4692 1.6714 1.6714 1.6744 1.6744 2.5361 2.5361 2.5400 2.5400 2.7919 2.7919 2.7932 2.7932 3.4349 3.4349 3.4370 3.4370 4.2686 4.2686 4.2736 4.2736 4.6632 4.6632 4.6689 4.6689 5.8707 5.8707 5.8772 5.8772 6.2225 6.2225 6.2246 6.2246 12.9429 12.9429 12.9440 12.9440 13.2161 13.2161 13.2170 13.2170 15.2372 15.2372 15.2383 15.2383 k = 0.5000 0.1703-0.0000 ( 4306 PWs) bands (ev): -14.1102 -14.1102 -14.1102 -14.1102 -14.0947 -14.0947 -14.0947 -14.0947 -9.7988 -9.7988 -9.7988 -9.7988 -9.7874 -9.7874 -9.7874 -9.7874 -3.3198 -3.3198 -3.3198 -3.3198 -3.1462 -3.1462 -3.1459 -3.1459 0.6116 0.6116 0.6117 0.6117 1.4472 1.4472 1.4503 1.4503 1.6790 1.6790 1.6829 1.6829 2.5592 2.5592 2.5636 2.5636 2.7876 2.7876 2.7893 2.7893 3.4626 3.4626 3.4645 3.4645 4.2768 4.2768 4.2818 4.2818 4.6627 4.6627 4.6683 4.6683 5.8840 5.8840 5.8904 5.8904 6.2306 6.2306 6.2327 6.2327 12.9347 12.9347 12.9359 12.9359 13.2037 13.2037 13.2046 13.2046 15.2546 15.2546 15.2558 15.2558 k = 0.5000 0.1793-0.0000 ( 4320 PWs) bands (ev): -14.1085 -14.1085 -14.1084 -14.1084 -14.0937 -14.0937 -14.0937 -14.0937 -9.7996 -9.7996 -9.7996 -9.7996 -9.7893 -9.7893 -9.7892 -9.7892 -3.3233 -3.3233 -3.3232 -3.3232 -3.1538 -3.1538 -3.1534 -3.1534 0.5872 0.5872 0.5873 0.5873 1.4253 1.4253 1.4277 1.4277 1.6921 1.6921 1.6968 1.6968 2.5790 2.5790 2.5840 2.5840 2.7849 2.7849 2.7870 2.7870 3.4891 3.4891 3.4909 3.4909 4.2853 4.2853 4.2903 4.2903 4.6626 4.6626 4.6680 4.6680 5.8973 5.8973 5.9035 5.9035 6.2378 6.2378 6.2400 6.2400 12.9277 12.9277 12.9288 12.9288 13.1913 13.1913 13.1922 13.1922 15.2717 15.2717 15.2730 15.2730 k = 0.5000 0.1883-0.0000 ( 4324 PWs) bands (ev): -14.1067 -14.1067 -14.1067 -14.1067 -14.0928 -14.0928 -14.0927 -14.0927 -9.8004 -9.8004 -9.8003 -9.8003 -9.7912 -9.7912 -9.7911 -9.7911 -3.3265 -3.3265 -3.3265 -3.3265 -3.1612 -3.1612 -3.1609 -3.1609 0.5636 0.5636 0.5638 0.5638 1.4014 1.4014 1.4033 1.4033 1.7089 1.7089 1.7140 1.7140 2.5938 2.5938 2.5995 2.5995 2.7853 2.7853 2.7879 2.7879 3.5144 3.5144 3.5162 3.5162 4.2940 4.2940 4.2990 4.2990 4.6629 4.6629 4.6681 4.6681 5.9106 5.9106 5.9166 5.9166 6.2441 6.2441 6.2463 6.2463 12.9218 12.9218 12.9230 12.9230 13.1791 13.1791 13.1799 13.1799 15.2884 15.2884 15.2898 15.2898 k = 0.5000 0.1972-0.0000 ( 4328 PWs) bands (ev): -14.1050 -14.1050 -14.1050 -14.1050 -14.0919 -14.0919 -14.0918 -14.0918 -9.8012 -9.8012 -9.8011 -9.8011 -9.7929 -9.7929 -9.7928 -9.7928 -3.3295 -3.3295 -3.3295 -3.3295 -3.1686 -3.1686 -3.1682 -3.1682 0.5410 0.5410 0.5412 0.5412 1.3769 1.3769 1.3785 1.3785 1.7282 1.7282 1.7336 1.7336 2.6020 2.6020 2.6083 2.6083 2.7903 2.7903 2.7934 2.7934 3.5386 3.5386 3.5402 3.5402 4.3028 4.3028 4.3078 4.3078 4.6635 4.6635 4.6684 4.6684 5.9239 5.9239 5.9297 5.9297 6.2494 6.2494 6.2516 6.2516 12.9172 12.9172 12.9184 12.9184 13.1671 13.1671 13.1679 13.1679 15.3046 15.3046 15.3060 15.3060 k = 0.5000 0.2062-0.0000 ( 4324 PWs) bands (ev): -14.1033 -14.1033 -14.1033 -14.1033 -14.0910 -14.0910 -14.0909 -14.0909 -9.8020 -9.8020 -9.8019 -9.8019 -9.7946 -9.7946 -9.7945 -9.7945 -3.3323 -3.3323 -3.3323 -3.3323 -3.1758 -3.1758 -3.1754 -3.1754 0.5195 0.5195 0.5197 0.5197 1.3526 1.3526 1.3539 1.3539 1.7491 1.7491 1.7548 1.7548 2.6029 2.6029 2.6095 2.6095 2.8007 2.8007 2.8041 2.8041 3.5614 3.5614 3.5630 3.5630 4.3116 4.3116 4.3165 4.3165 4.6643 4.6643 4.6689 4.6689 5.9372 5.9372 5.9427 5.9427 6.2535 6.2535 6.2557 6.2557 12.9138 12.9138 12.9150 12.9150 13.1554 13.1554 13.1562 13.1562 15.3199 15.3199 15.3214 15.3214 k = 0.5000 0.2152-0.0000 ( 4332 PWs) bands (ev): -14.1017 -14.1017 -14.1016 -14.1016 -14.0902 -14.0902 -14.0901 -14.0901 -9.8028 -9.8028 -9.8028 -9.8028 -9.7962 -9.7962 -9.7961 -9.7961 -3.3348 -3.3348 -3.3348 -3.3348 -3.1828 -3.1828 -3.1824 -3.1824 0.4992 0.4992 0.4994 0.4994 1.3292 1.3292 1.3303 1.3303 1.7712 1.7712 1.7770 1.7770 2.5971 2.5971 2.6038 2.6038 2.8159 2.8159 2.8193 2.8193 3.5829 3.5829 3.5845 3.5845 4.3202 4.3202 4.3250 4.3250 4.6654 4.6654 4.6696 4.6696 5.9505 5.9505 5.9557 5.9557 6.2565 6.2565 6.2586 6.2586 12.9116 12.9116 12.9127 12.9127 13.1442 13.1442 13.1449 13.1449 15.3343 15.3343 15.3358 15.3358 k = 0.5000 0.2241-0.0000 ( 4332 PWs) bands (ev): -14.1001 -14.1001 -14.1001 -14.1001 -14.0894 -14.0894 -14.0894 -14.0894 -9.8037 -9.8037 -9.8036 -9.8036 -9.7976 -9.7976 -9.7975 -9.7975 -3.3371 -3.3371 -3.3371 -3.3371 -3.1895 -3.1895 -3.1892 -3.1892 0.4801 0.4801 0.4803 0.4803 1.3068 1.3068 1.3078 1.3078 1.7941 1.7941 1.7999 1.7999 2.5859 2.5859 2.5926 2.5926 2.8343 2.8343 2.8375 2.8375 3.6030 3.6030 3.6045 3.6045 4.3285 4.3285 4.3331 4.3331 4.6666 4.6666 4.6704 4.6704 5.9638 5.9638 5.9686 5.9686 6.2582 6.2582 6.2603 6.2603 12.9103 12.9103 12.9114 12.9114 13.1334 13.1334 13.1342 13.1342 15.3477 15.3477 15.3492 15.3492 k = 0.5000 0.2331-0.0000 ( 4332 PWs) bands (ev): -14.0986 -14.0986 -14.0985 -14.0985 -14.0888 -14.0888 -14.0887 -14.0887 -9.8045 -9.8045 -9.8045 -9.8045 -9.7989 -9.7989 -9.7988 -9.7988 -3.3391 -3.3391 -3.3391 -3.3391 -3.1959 -3.1959 -3.1956 -3.1956 0.4624 0.4624 0.4626 0.4626 1.2859 1.2859 1.2867 1.2867 1.8175 1.8175 1.8233 1.8233 2.5709 2.5709 2.5774 2.5774 2.8543 2.8543 2.8574 2.8574 3.6217 3.6217 3.6231 3.6231 4.3364 4.3364 4.3409 4.3409 4.6678 4.6678 4.6712 4.6712 5.9772 5.9772 5.9815 5.9815 6.2587 6.2587 6.2607 6.2607 12.9100 12.9100 12.9111 12.9111 13.1233 13.1233 13.1240 13.1240 15.3600 15.3600 15.3614 15.3614 k = 0.5000 0.2420-0.0000 ( 4336 PWs) bands (ev): -14.0971 -14.0971 -14.0970 -14.0970 -14.0882 -14.0882 -14.0882 -14.0882 -9.8054 -9.8054 -9.8053 -9.8053 -9.8001 -9.8001 -9.8000 -9.8000 -3.3408 -3.3408 -3.3408 -3.3408 -3.2019 -3.2019 -3.2016 -3.2016 0.4461 0.4461 0.4463 0.4463 1.2666 1.2666 1.2672 1.2672 1.8411 1.8411 1.8468 1.8468 2.5534 2.5534 2.5596 2.5596 2.8748 2.8748 2.8776 2.8776 3.6388 3.6388 3.6401 3.6401 4.3439 4.3439 4.3481 4.3481 4.6691 4.6691 4.6721 4.6721 5.9904 5.9904 5.9943 5.9943 6.2580 6.2580 6.2599 6.2599 12.9105 12.9105 12.9115 12.9115 13.1138 13.1138 13.1144 13.1144 15.3710 15.3710 15.3724 15.3724 k = 0.5000 0.2510-0.0000 ( 4336 PWs) bands (ev): -14.0957 -14.0957 -14.0957 -14.0957 -14.0877 -14.0877 -14.0877 -14.0877 -9.8063 -9.8063 -9.8062 -9.8062 -9.8010 -9.8010 -9.8010 -9.8010 -3.3422 -3.3422 -3.3422 -3.3422 -3.2075 -3.2075 -3.2073 -3.2073 0.4313 0.4313 0.4315 0.4315 1.2490 1.2490 1.2495 1.2495 1.8645 1.8645 1.8701 1.8701 2.5343 2.5343 2.5402 2.5402 2.8948 2.8948 2.8974 2.8974 3.6542 3.6542 3.6555 3.6555 4.3509 4.3509 4.3549 4.3549 4.6703 4.6703 4.6728 4.6728 6.0034 6.0034 6.0070 6.0070 6.2562 6.2562 6.2580 6.2580 12.9117 12.9117 12.9126 12.9126 13.1051 13.1051 13.1057 13.1057 15.3807 15.3807 15.3821 15.3821 k = 0.5000 0.2600-0.0000 ( 4332 PWs) bands (ev): -14.0944 -14.0944 -14.0944 -14.0944 -14.0873 -14.0873 -14.0873 -14.0873 -9.8071 -9.8071 -9.8070 -9.8070 -9.8019 -9.8019 -9.8018 -9.8018 -3.3434 -3.3434 -3.3434 -3.3434 -3.2126 -3.2126 -3.2124 -3.2124 0.4181 0.4181 0.4183 0.4183 1.2332 1.2332 1.2337 1.2337 1.8875 1.8875 1.8928 1.8928 2.5145 2.5145 2.5201 2.5201 2.9137 2.9137 2.9160 2.9160 3.6679 3.6679 3.6691 3.6691 4.3573 4.3573 4.3610 4.3610 4.6713 4.6713 4.6735 4.6735 6.0162 6.0162 6.0193 6.0193 6.2534 6.2534 6.2550 6.2550 12.9133 12.9133 12.9141 12.9141 13.0972 13.0972 13.0977 13.0977 15.3891 15.3891 15.3904 15.3904 k = 0.5000 0.2689-0.0000 ( 4332 PWs) bands (ev): -14.0932 -14.0932 -14.0932 -14.0932 -14.0870 -14.0870 -14.0870 -14.0870 -9.8079 -9.8079 -9.8078 -9.8078 -9.8025 -9.8025 -9.8025 -9.8025 -3.3444 -3.3444 -3.3444 -3.3444 -3.2172 -3.2172 -3.2170 -3.2170 0.4065 0.4065 0.4067 0.4067 1.2194 1.2194 1.2199 1.2199 1.9096 1.9096 1.9146 1.9146 2.4947 2.4947 2.4999 2.4999 2.9309 2.9309 2.9330 2.9330 3.6799 3.6799 3.6810 3.6810 4.3632 4.3632 4.3665 4.3665 4.6722 4.6722 4.6740 4.6740 6.0284 6.0284 6.0311 6.0311 6.2498 6.2498 6.2513 6.2513 12.9152 12.9152 12.9160 12.9160 13.0901 13.0901 13.0906 13.0906 15.3963 15.3963 15.3975 15.3975 k = 0.5000 0.2779-0.0000 ( 4320 PWs) bands (ev): -14.0921 -14.0921 -14.0921 -14.0921 -14.0868 -14.0868 -14.0868 -14.0868 -9.8086 -9.8086 -9.8086 -9.8086 -9.8031 -9.8031 -9.8030 -9.8030 -3.3452 -3.3452 -3.3451 -3.3451 -3.2212 -3.2212 -3.2210 -3.2210 0.3967 0.3967 0.3968 0.3968 1.2077 1.2077 1.2080 1.2080 1.9303 1.9303 1.9348 1.9348 2.4758 2.4758 2.4805 2.4805 2.9462 2.9462 2.9479 2.9479 3.6901 3.6901 3.6911 3.6911 4.3684 4.3684 4.3712 4.3712 4.6729 4.6729 4.6744 4.6744 6.0399 6.0399 6.0421 6.0421 6.2457 6.2457 6.2470 6.2470 12.9172 12.9172 12.9179 12.9179 13.0841 13.0841 13.0845 13.0845 15.4022 15.4022 15.4033 15.4033 k = 0.5000 0.2869-0.0000 ( 4324 PWs) bands (ev): -14.0911 -14.0911 -14.0911 -14.0911 -14.0868 -14.0868 -14.0867 -14.0867 -9.8092 -9.8092 -9.8092 -9.8092 -9.8035 -9.8035 -9.8035 -9.8035 -3.3457 -3.3457 -3.3457 -3.3457 -3.2245 -3.2245 -3.2243 -3.2243 0.3885 0.3885 0.3886 0.3886 1.1980 1.1980 1.1982 1.1982 1.9490 1.9490 1.9529 1.9529 2.4587 2.4587 2.4627 2.4627 2.9590 2.9590 2.9604 2.9604 3.6985 3.6985 3.6993 3.6993 4.3729 4.3729 4.3752 4.3752 4.6735 4.6735 4.6746 4.6746 6.0503 6.0503 6.0521 6.0521 6.2414 6.2414 6.2424 6.2424 12.9192 12.9192 12.9197 12.9197 13.0790 13.0790 13.0793 13.0793 15.4070 15.4070 15.4078 15.4078 k = 0.5000 0.2958-0.0000 ( 4324 PWs) bands (ev): -14.0903 -14.0903 -14.0902 -14.0902 -14.0868 -14.0868 -14.0867 -14.0867 -9.8097 -9.8097 -9.8097 -9.8097 -9.8038 -9.8038 -9.8038 -9.8038 -3.3462 -3.3462 -3.3461 -3.3461 -3.2271 -3.2271 -3.2270 -3.2270 0.3822 0.3822 0.3823 0.3823 1.1904 1.1904 1.1906 1.1906 1.9649 1.9649 1.9680 1.9680 2.4441 2.4441 2.4473 2.4473 2.9694 2.9694 2.9704 2.9704 3.7050 3.7050 3.7056 3.7056 4.3765 4.3765 4.3784 4.3784 4.6739 4.6739 4.6747 4.6747 6.0593 6.0593 6.0606 6.0606 6.2373 6.2373 6.2381 6.2381 12.9209 12.9209 12.9214 12.9214 13.0750 13.0750 13.0753 13.0753 15.4106 15.4106 15.4113 15.4113 k = 0.5000 0.3048-0.0000 ( 4324 PWs) bands (ev): -14.0896 -14.0896 -14.0895 -14.0895 -14.0869 -14.0869 -14.0868 -14.0868 -9.8100 -9.8100 -9.8100 -9.8100 -9.8041 -9.8041 -9.8041 -9.8041 -3.3464 -3.3464 -3.3464 -3.3464 -3.2290 -3.2290 -3.2290 -3.2290 0.3776 0.3776 0.3777 0.3777 1.1850 1.1850 1.1851 1.1851 1.9772 1.9772 1.9794 1.9794 2.4330 2.4330 2.4353 2.4353 2.9769 2.9769 2.9776 2.9776 3.7097 3.7097 3.7101 3.7101 4.3793 4.3793 4.3806 4.3806 4.6742 4.6742 4.6747 4.6747 6.0662 6.0662 6.0671 6.0671 6.2339 6.2339 6.2344 6.2344 12.9223 12.9223 12.9226 12.9226 13.0721 13.0721 13.0723 13.0723 15.4132 15.4132 15.4136 15.4136 k = 0.5000 0.3138-0.0000 ( 4328 PWs) bands (ev): -14.0891 -14.0891 -14.0891 -14.0891 -14.0870 -14.0870 -14.0869 -14.0869 -9.8103 -9.8103 -9.8103 -9.8103 -9.8042 -9.8042 -9.8042 -9.8042 -3.3466 -3.3466 -3.3466 -3.3466 -3.2302 -3.2302 -3.2302 -3.2302 0.3749 0.3749 0.3749 0.3749 1.1817 1.1817 1.1818 1.1818 1.9852 1.9852 1.9864 1.9864 2.4262 2.4262 2.4274 2.4274 2.9816 2.9816 2.9819 2.9819 3.7126 3.7126 3.7128 3.7128 4.3812 4.3812 4.3818 4.3818 4.6744 4.6744 4.6746 4.6746 6.0707 6.0707 6.0712 6.0712 6.2316 6.2316 6.2319 6.2319 12.9232 12.9232 12.9233 12.9233 13.0703 13.0703 13.0704 13.0704 15.4147 15.4147 15.4150 15.4150 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0870 -14.0870 -14.0870 -14.0870 -9.8103 -9.8103 -9.8103 -9.8103 -9.8043 -9.8043 -9.8043 -9.8043 -3.3466 -3.3466 -3.3466 -3.3466 -3.2306 -3.2306 -3.2306 -3.2306 0.3740 0.3740 0.3740 0.3740 1.1806 1.1806 1.1806 1.1806 1.9884 1.9884 1.9884 1.9884 2.4243 2.4243 2.4243 2.4243 2.9833 2.9833 2.9833 2.9833 3.7136 3.7136 3.7136 3.7136 4.3820 4.3820 4.3820 4.3820 4.6745 4.6745 4.6745 4.6745 6.0724 6.0724 6.0724 6.0724 6.2309 6.2309 6.2309 6.2309 12.9236 12.9236 12.9236 12.9236 13.0698 13.0698 13.0698 13.0698 15.4153 15.4153 15.4153 15.4153 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0870 -14.0870 -14.0870 -14.0870 -9.8103 -9.8103 -9.8103 -9.8103 -9.8043 -9.8043 -9.8043 -9.8043 -3.3466 -3.3466 -3.3466 -3.3466 -3.2306 -3.2306 -3.2306 -3.2306 0.3740 0.3740 0.3740 0.3740 1.1806 1.1806 1.1806 1.1806 1.9884 1.9884 1.9884 1.9884 2.4243 2.4243 2.4243 2.4243 2.9833 2.9833 2.9833 2.9833 3.7136 3.7136 3.7136 3.7136 4.3820 4.3820 4.3820 4.3820 4.6745 4.6745 4.6745 4.6745 6.0724 6.0724 6.0724 6.0724 6.2309 6.2309 6.2309 6.2309 12.9236 12.9236 12.9236 12.9236 13.0698 13.0698 13.0698 13.0698 15.4153 15.4153 15.4153 15.4153 k = 0.4911 0.3227-0.0000 ( 4332 PWs) bands (ev): -14.1487 -14.1487 -14.1487 -14.1487 -14.0278 -14.0278 -14.0278 -14.0278 -9.8116 -9.8116 -9.8109 -9.8109 -9.8046 -9.8046 -9.8040 -9.8040 -3.3493 -3.3493 -3.3492 -3.3492 -3.2254 -3.2254 -3.2253 -3.2253 0.3742 0.3742 0.3742 0.3742 1.1800 1.1800 1.1804 1.1804 1.9880 1.9880 1.9891 1.9891 2.4247 2.4247 2.4265 2.4265 2.9843 2.9843 2.9845 2.9845 3.7143 3.7143 3.7145 3.7145 4.3798 4.3798 4.3811 4.3811 4.6747 4.6747 4.6761 4.6761 6.0724 6.0724 6.0724 6.0724 6.2308 6.2308 6.2309 6.2309 12.9237 12.9237 12.9238 12.9238 13.0701 13.0701 13.0702 13.0702 15.4158 15.4158 15.4162 15.4162 k = 0.4821 0.3227-0.0000 ( 4336 PWs) bands (ev): -14.2100 -14.2100 -14.2100 -14.2100 -13.9684 -13.9684 -13.9684 -13.9684 -9.8144 -9.8144 -9.8134 -9.8134 -9.8052 -9.8052 -9.8042 -9.8042 -3.3558 -3.3558 -3.3557 -3.3557 -3.2111 -3.2111 -3.2110 -3.2110 0.3750 0.3750 0.3750 0.3750 1.1783 1.1783 1.1791 1.1791 1.9881 1.9881 1.9902 1.9902 2.4277 2.4277 2.4312 2.4312 2.9877 2.9877 2.9880 2.9880 3.7166 3.7166 3.7170 3.7170 4.3746 4.3746 4.3771 4.3771 4.6765 4.6765 4.6792 4.6792 6.0725 6.0725 6.0725 6.0725 6.2306 6.2306 6.2308 6.2308 12.9244 12.9244 12.9245 12.9245 13.0711 13.0711 13.0713 13.0713 15.4177 15.4177 15.4185 15.4185 k = 0.4732 0.3227-0.0000 ( 4336 PWs) bands (ev): -14.2717 -14.2717 -14.2717 -14.2717 -13.9097 -13.9097 -13.9097 -13.9097 -9.8184 -9.8184 -9.8173 -9.8173 -9.8063 -9.8063 -9.8052 -9.8052 -3.3637 -3.3637 -3.3635 -3.3635 -3.1903 -3.1903 -3.1902 -3.1902 0.3761 0.3761 0.3762 0.3762 1.1758 1.1758 1.1769 1.1769 1.9891 1.9891 1.9919 1.9919 2.4330 2.4330 2.4379 2.4379 2.9935 2.9935 2.9940 2.9940 3.7204 3.7204 3.7211 3.7211 4.3666 4.3666 4.3701 4.3701 4.6799 4.6799 4.6838 4.6838 6.0725 6.0725 6.0726 6.0726 6.2303 6.2303 6.2306 6.2306 12.9256 12.9256 12.9257 12.9257 13.0728 13.0728 13.0730 13.0730 15.4209 15.4209 15.4221 15.4221 k = 0.4643 0.3227-0.0000 ( 4340 PWs) bands (ev): -14.3337 -14.3337 -14.3337 -14.3337 -13.8520 -13.8520 -13.8520 -13.8520 -9.8236 -9.8236 -9.8224 -9.8224 -9.8081 -9.8081 -9.8070 -9.8070 -3.3711 -3.3711 -3.3709 -3.3709 -3.1649 -3.1649 -3.1647 -3.1647 0.3776 0.3776 0.3778 0.3778 1.1723 1.1723 1.1739 1.1739 1.9913 1.9913 1.9949 1.9949 2.4400 2.4400 2.4462 2.4462 3.0019 3.0019 3.0025 3.0025 3.7258 3.7258 3.7267 3.7267 4.3560 4.3560 4.3605 4.3605 4.6846 4.6846 4.6896 4.6896 6.0726 6.0726 6.0727 6.0727 6.2299 6.2299 6.2303 6.2303 12.9273 12.9273 12.9275 12.9275 13.0749 13.0749 13.0752 13.0752 15.4254 15.4254 15.4270 15.4270 k = 0.4554 0.3227-0.0000 ( 4332 PWs) bands (ev): -14.3960 -14.3960 -14.3960 -14.3960 -13.7952 -13.7952 -13.7951 -13.7951 -9.8298 -9.8298 -9.8285 -9.8285 -9.8108 -9.8108 -9.8097 -9.8097 -3.3767 -3.3767 -3.3765 -3.3765 -3.1360 -3.1360 -3.1359 -3.1359 0.3793 0.3793 0.3795 0.3795 1.1682 1.1682 1.1702 1.1702 1.9954 1.9954 1.9996 1.9996 2.4480 2.4480 2.4554 2.4554 3.0130 3.0130 3.0139 3.0139 3.7326 3.7326 3.7336 3.7336 4.3431 4.3431 4.3485 4.3485 4.6905 4.6905 4.6965 4.6965 6.0728 6.0728 6.0729 6.0729 6.2294 6.2294 6.2299 6.2299 12.9298 12.9298 12.9300 12.9300 13.0775 13.0775 13.0779 13.0779 15.4312 15.4312 15.4332 15.4332 k = 0.4464 0.3227-0.0000 ( 4336 PWs) bands (ev): -14.4584 -14.4584 -14.4584 -14.4584 -13.7394 -13.7394 -13.7394 -13.7394 -9.8370 -9.8370 -9.8358 -9.8358 -9.8144 -9.8144 -9.8133 -9.8133 -3.3800 -3.3800 -3.3798 -3.3798 -3.1045 -3.1045 -3.1044 -3.1044 0.3809 0.3809 0.3811 0.3811 1.1635 1.1635 1.1658 1.1658 2.0019 2.0019 2.0065 2.0065 2.4565 2.4565 2.4648 2.4648 3.0269 3.0269 3.0281 3.0281 3.7407 3.7407 3.7419 3.7419 4.3282 4.3282 4.3342 4.3342 4.6972 4.6972 4.7040 4.7040 6.0729 6.0729 6.0730 6.0730 6.2288 6.2288 6.2293 6.2293 12.9330 12.9330 12.9332 12.9332 13.0803 13.0803 13.0807 13.0807 15.4380 15.4380 15.4404 15.4404 k = 0.4375 0.3227-0.0000 ( 4320 PWs) bands (ev): -14.5209 -14.5209 -14.5209 -14.5209 -13.6848 -13.6848 -13.6848 -13.6848 -9.8453 -9.8453 -9.8440 -9.8440 -9.8187 -9.8187 -9.8176 -9.8176 -3.3805 -3.3805 -3.3802 -3.3802 -3.0708 -3.0708 -3.0707 -3.0707 0.3822 0.3822 0.3825 0.3825 1.1585 1.1585 1.1611 1.1611 2.0113 2.0113 2.0162 2.0162 2.4649 2.4649 2.4739 2.4739 3.0438 3.0438 3.0452 3.0452 3.7502 3.7502 3.7515 3.7515 4.3116 4.3116 4.3182 4.3182 4.7047 4.7047 4.7122 4.7122 6.0730 6.0730 6.0732 6.0732 6.2281 6.2281 6.2287 6.2287 12.9372 12.9372 12.9374 12.9374 13.0832 13.0832 13.0836 13.0836 15.4459 15.4459 15.4487 15.4487 k = 0.4286 0.3227-0.0000 ( 4320 PWs) bands (ev): -14.5834 -14.5834 -14.5833 -14.5833 -13.6314 -13.6314 -13.6314 -13.6314 -9.8545 -9.8545 -9.8533 -9.8533 -9.8239 -9.8239 -9.8229 -9.8229 -3.3779 -3.3779 -3.3776 -3.3776 -3.0353 -3.0353 -3.0352 -3.0352 0.3829 0.3829 0.3834 0.3834 1.1535 1.1535 1.1565 1.1565 2.0239 2.0239 2.0289 2.0289 2.4728 2.4728 2.4824 2.4824 3.0636 3.0636 3.0654 3.0654 3.7607 3.7607 3.7622 3.7622 4.2934 4.2934 4.3004 4.3004 4.7127 4.7127 4.7208 4.7208 6.0732 6.0732 6.0733 6.0733 6.2272 6.2272 6.2279 6.2279 12.9423 12.9423 12.9426 12.9426 13.0859 13.0859 13.0864 13.0864 15.4546 15.4546 15.4578 15.4578 k = 0.4196 0.3227-0.0000 ( 4312 PWs) bands (ev): -14.6457 -14.6457 -14.6457 -14.6457 -13.5793 -13.5793 -13.5793 -13.5793 -9.8646 -9.8646 -9.8634 -9.8634 -9.8299 -9.8299 -9.8288 -9.8288 -3.3721 -3.3721 -3.3718 -3.3718 -2.9983 -2.9983 -2.9982 -2.9982 0.3828 0.3828 0.3834 0.3834 1.1489 1.1489 1.1521 1.1521 2.0399 2.0399 2.0450 2.0450 2.4800 2.4800 2.4899 2.4899 3.0862 3.0862 3.0883 3.0883 3.7723 3.7723 3.7739 3.7739 4.2739 4.2739 4.2814 4.2814 4.7210 4.7210 4.7296 4.7296 6.0733 6.0733 6.0735 6.0735 6.2263 6.2263 6.2270 6.2270 12.9486 12.9486 12.9489 12.9489 13.0884 13.0884 13.0890 13.0890 15.4640 15.4640 15.4675 15.4675 k = 0.4107 0.3227-0.0000 ( 4308 PWs) bands (ev): -14.7079 -14.7079 -14.7079 -14.7079 -13.5286 -13.5286 -13.5286 -13.5286 -9.8757 -9.8757 -9.8745 -9.8745 -9.8365 -9.8365 -9.8356 -9.8356 -3.3628 -3.3628 -3.3625 -3.3625 -2.9601 -2.9601 -2.9600 -2.9600 0.3815 0.3815 0.3822 0.3822 1.1451 1.1451 1.1485 1.1485 2.0595 2.0595 2.0646 2.0646 2.4864 2.4864 2.4965 2.4965 3.1114 3.1114 3.1139 3.1139 3.7849 3.7849 3.7866 3.7866 4.2533 4.2533 4.2612 4.2612 4.7295 4.7295 4.7386 4.7386 6.0734 6.0734 6.0736 6.0736 6.2252 6.2252 6.2260 6.2260 12.9561 12.9561 12.9564 12.9564 13.0905 13.0905 13.0911 13.0911 15.4739 15.4739 15.4777 15.4777 k = 0.4018 0.3227-0.0000 ( 4314 PWs) bands (ev): -14.7698 -14.7698 -14.7698 -14.7698 -13.4793 -13.4793 -13.4793 -13.4793 -9.8876 -9.8876 -9.8865 -9.8865 -9.8439 -9.8439 -9.8430 -9.8430 -3.3500 -3.3500 -3.3498 -3.3498 -2.9209 -2.9209 -2.9208 -2.9208 0.3788 0.3788 0.3797 0.3797 1.1426 1.1426 1.1461 1.1461 2.0826 2.0826 2.0877 2.0877 2.4921 2.4921 2.5024 2.5024 3.1389 3.1389 3.1417 3.1417 3.7984 3.7984 3.8001 3.8001 4.2319 4.2319 4.2400 4.2400 4.7382 4.7382 4.7476 4.7476 6.0735 6.0735 6.0737 6.0737 6.2240 6.2240 6.2248 6.2248 12.9647 12.9647 12.9650 12.9650 13.0921 13.0921 13.0928 13.0928 15.4840 15.4840 15.4882 15.4882 k = 0.3929 0.3227-0.0000 ( 4318 PWs) bands (ev): -14.8314 -14.8314 -14.8313 -14.8313 -13.4315 -13.4315 -13.4315 -13.4315 -9.9004 -9.9004 -9.8993 -9.8993 -9.8520 -9.8520 -9.8511 -9.8511 -3.3336 -3.3336 -3.3334 -3.3334 -2.8809 -2.8809 -2.8808 -2.8808 0.3744 0.3744 0.3754 0.3754 1.1417 1.1417 1.1453 1.1453 2.1092 2.1092 2.1142 2.1142 2.4974 2.4974 2.5076 2.5076 3.1683 3.1683 3.1715 3.1715 3.8128 3.8128 3.8145 3.8145 4.2097 4.2097 4.2181 4.2181 4.7470 4.7470 4.7568 4.7568 6.0736 6.0736 6.0737 6.0737 6.2226 6.2226 6.2235 6.2235 12.9744 12.9744 12.9748 12.9748 13.0932 13.0932 13.0939 13.0939 15.4942 15.4942 15.4986 15.4986 k = 0.3839 0.3227-0.0000 ( 4318 PWs) bands (ev): -14.8925 -14.8925 -14.8925 -14.8925 -13.3852 -13.3852 -13.3852 -13.3852 -9.9140 -9.9140 -9.9129 -9.9129 -9.8606 -9.8606 -9.8598 -9.8598 -3.3136 -3.3136 -3.3133 -3.3133 -2.8404 -2.8404 -2.8403 -2.8403 0.3680 0.3680 0.3693 0.3693 1.1428 1.1428 1.1464 1.1464 2.1390 2.1390 2.1439 2.1439 2.5025 2.5025 2.5126 2.5126 3.1992 3.1992 3.2027 3.2027 3.8279 3.8279 3.8296 3.8296 4.1871 4.1871 4.1957 4.1957 4.7558 4.7558 4.7659 4.7659 6.0736 6.0736 6.0737 6.0737 6.2212 6.2212 6.2220 6.2220 12.9850 12.9850 12.9854 12.9854 13.0939 13.0939 13.0946 13.0946 15.5040 15.5040 15.5087 15.5087 k = 0.3750 0.3227-0.0000 ( 4310 PWs) bands (ev): -14.9531 -14.9531 -14.9531 -14.9531 -13.3406 -13.3406 -13.3405 -13.3405 -9.9283 -9.9283 -9.9273 -9.9273 -9.8699 -9.8699 -9.8691 -9.8691 -3.2897 -3.2897 -3.2894 -3.2894 -2.7995 -2.7995 -2.7994 -2.7994 0.3597 0.3597 0.3612 0.3612 1.1462 1.1462 1.1498 1.1498 2.1718 2.1718 2.1765 2.1765 2.5078 2.5078 2.5177 2.5177 3.2311 3.2311 3.2350 3.2350 3.8437 3.8437 3.8454 3.8454 4.1642 4.1642 4.1731 4.1731 4.7647 4.7647 4.7750 4.7750 6.0735 6.0735 6.0736 6.0736 6.2195 6.2195 6.2204 6.2204 12.9960 12.9960 12.9965 12.9965 13.0946 13.0946 13.0954 13.0954 15.5133 15.5133 15.5182 15.5182 k = 0.3661 0.3227-0.0000 ( 4316 PWs) bands (ev): -15.0132 -15.0132 -15.0132 -15.0132 -13.2975 -13.2975 -13.2975 -13.2975 -9.9433 -9.9433 -9.9423 -9.9423 -9.8796 -9.8796 -9.8789 -9.8789 -3.2621 -3.2621 -3.2618 -3.2618 -2.7586 -2.7586 -2.7585 -2.7585 0.3493 0.3493 0.3511 0.3511 1.1520 1.1520 1.1556 1.1556 2.2070 2.2070 2.2115 2.2115 2.5139 2.5139 2.5236 2.5236 3.2636 3.2636 3.2677 3.2677 3.8601 3.8601 3.8619 3.8619 4.1412 4.1412 4.1504 4.1504 4.7735 4.7735 4.7840 4.7840 6.0734 6.0734 6.0735 6.0735 6.2177 6.2177 6.2186 6.2186 13.0066 13.0066 13.0071 13.0071 13.0961 13.0961 13.0969 13.0969 15.5216 15.5216 15.5268 15.5268 k = 0.3571 0.3227-0.0000 ( 4316 PWs) bands (ev): -15.0726 -15.0726 -15.0726 -15.0726 -13.2562 -13.2562 -13.2561 -13.2561 -9.9590 -9.9590 -9.9580 -9.9580 -9.8899 -9.8899 -9.8892 -9.8892 -3.2307 -3.2307 -3.2305 -3.2305 -2.7178 -2.7178 -2.7177 -2.7177 0.3369 0.3369 0.3389 0.3389 1.1605 1.1605 1.1639 1.1639 2.2442 2.2442 2.2484 2.2484 2.5215 2.5215 2.5307 2.5307 3.2962 3.2962 3.3004 3.3004 3.8772 3.8772 3.8791 3.8791 4.1185 4.1185 4.1281 4.1281 4.7823 4.7823 4.7930 4.7930 6.0732 6.0732 6.0733 6.0733 6.2158 6.2158 6.2167 6.2167 13.0150 13.0150 13.0156 13.0156 13.0999 13.0999 13.1008 13.1008 15.5286 15.5286 15.5339 15.5339 k = 0.3482 0.3227-0.0000 ( 4304 PWs) bands (ev): -15.1313 -15.1313 -15.1313 -15.1313 -13.2165 -13.2165 -13.2165 -13.2165 -9.9752 -9.9752 -9.9743 -9.9743 -9.9006 -9.9006 -9.8999 -9.8999 -3.1955 -3.1955 -3.1952 -3.1952 -2.6773 -2.6773 -2.6772 -2.6772 0.3226 0.3226 0.3249 0.3249 1.1714 1.1714 1.1748 1.1748 2.2826 2.2826 2.2863 2.2863 2.5312 2.5312 2.5398 2.5398 3.3283 3.3283 3.3327 3.3327 3.8948 3.8948 3.8968 3.8968 4.0966 4.0966 4.1066 4.1066 4.7910 4.7910 4.8019 4.8019 6.0730 6.0730 6.0730 6.0730 6.2137 6.2137 6.2145 6.2145 13.0192 13.0192 13.0198 13.0198 13.1082 13.1082 13.1090 13.1090 15.5338 15.5338 15.5392 15.5392 k = 0.3393 0.3227-0.0000 ( 4294 PWs) bands (ev): -15.1892 -15.1892 -15.1892 -15.1892 -13.1786 -13.1786 -13.1786 -13.1786 -9.9919 -9.9919 -9.9910 -9.9910 -9.9116 -9.9116 -9.9111 -9.9111 -3.1565 -3.1565 -3.1563 -3.1563 -2.6373 -2.6373 -2.6372 -2.6372 0.3066 0.3066 0.3091 0.3091 1.1849 1.1849 1.1881 1.1881 2.3212 2.3212 2.3242 2.3242 2.5442 2.5442 2.5520 2.5520 3.3594 3.3594 3.3639 3.3639 3.9125 3.9125 3.9149 3.9149 4.0758 4.0758 4.0866 4.0866 4.7997 4.7997 4.8108 4.8108 6.0726 6.0726 6.0727 6.0727 6.2114 6.2114 6.2122 6.2122 13.0180 13.0180 13.0185 13.0185 13.1220 13.1220 13.1226 13.1226 15.5368 15.5368 15.5423 15.5423 k = 0.3304 0.3227-0.0000 ( 4294 PWs) bands (ev): -15.2463 -15.2463 -15.2463 -15.2463 -13.1424 -13.1424 -13.1424 -13.1424 -10.0092 -10.0092 -10.0083 -10.0083 -9.9231 -9.9231 -9.9226 -9.9226 -3.1138 -3.1138 -3.1135 -3.1135 -2.5981 -2.5981 -2.5980 -2.5980 0.2891 0.2891 0.2918 0.2918 1.2006 1.2006 1.2037 1.2037 2.3586 2.3586 2.3606 2.3606 2.5618 2.5618 2.5684 2.5684 3.3890 3.3890 3.3936 3.3936 3.9299 3.9299 3.9329 3.9329 4.0573 4.0573 4.0690 4.0690 4.8084 4.8084 4.8197 4.8197 6.0721 6.0721 6.0723 6.0723 6.2090 6.2090 6.2098 6.2098 13.0116 13.0116 13.0119 13.0119 13.1410 13.1410 13.1416 13.1416 15.5370 15.5370 15.5426 15.5426 k = 0.3214 0.3227-0.0000 ( 4310 PWs) bands (ev): -15.3026 -15.3026 -15.3025 -15.3025 -13.1080 -13.1080 -13.1079 -13.1079 -10.0268 -10.0268 -10.0260 -10.0260 -9.9348 -9.9348 -9.9343 -9.9343 -3.0673 -3.0673 -3.0670 -3.0670 -2.5598 -2.5598 -2.5596 -2.5596 0.2703 0.2703 0.2733 0.2733 1.2183 1.2183 1.2213 1.2213 2.3933 2.3933 2.3940 2.3940 2.5853 2.5853 2.5904 2.5904 3.4165 3.4165 3.4211 3.4211 3.9455 3.9455 3.9494 3.9494 4.0429 4.0429 4.0559 4.0559 4.8171 4.8171 4.8286 4.8286 6.0716 6.0716 6.0718 6.0718 6.2063 6.2063 6.2070 6.2070 13.0007 13.0007 13.0009 13.0009 13.1643 13.1643 13.1647 13.1647 15.5339 15.5339 15.5396 15.5396 k = 0.3125 0.3227-0.0000 ( 4310 PWs) bands (ev): -15.3578 -15.3578 -15.3578 -15.3578 -13.0753 -13.0753 -13.0752 -13.0752 -10.0448 -10.0448 -10.0440 -10.0440 -9.9468 -9.9468 -9.9464 -9.9464 -3.0171 -3.0171 -3.0168 -3.0168 -2.5225 -2.5225 -2.5224 -2.5224 0.2506 0.2506 0.2537 0.2537 1.2380 1.2380 1.2408 1.2408 2.4234 2.4234 2.4242 2.4242 2.6157 2.6157 2.6190 2.6190 3.4413 3.4413 3.4459 3.4459 3.9566 3.9566 3.9611 3.9611 4.0366 4.0366 4.0506 4.0506 4.8258 4.8258 4.8374 4.8374 6.0709 6.0709 6.0712 6.0712 6.2035 6.2035 6.2041 6.2041 12.9862 12.9862 12.9864 12.9864 13.1910 13.1910 13.1914 13.1914 15.5271 15.5271 15.5327 15.5327 k = 0.3036 0.3227-0.0000 ( 4310 PWs) bands (ev): -15.4121 -15.4121 -15.4121 -15.4121 -13.0443 -13.0443 -13.0442 -13.0442 -10.0630 -10.0630 -10.0622 -10.0622 -9.9591 -9.9591 -9.9586 -9.9586 -2.9634 -2.9634 -2.9631 -2.9631 -2.4865 -2.4865 -2.4863 -2.4863 0.2302 0.2302 0.2335 0.2335 1.2592 1.2592 1.2618 1.2618 2.4485 2.4485 2.4509 2.4509 2.6527 2.6527 2.6543 2.6543 3.4628 3.4628 3.4675 3.4675 3.9604 3.9604 3.9640 3.9640 4.0429 4.0429 4.0564 4.0564 4.8345 4.8345 4.8463 4.8463 6.0701 6.0701 6.0705 6.0705 6.2004 6.2004 6.2010 6.2010 12.9685 12.9685 12.9687 12.9687 13.2207 13.2207 13.2210 13.2210 15.5158 15.5158 15.5213 15.5213 k = 0.2946 0.3227-0.0000 ( 4316 PWs) bands (ev): -15.4653 -15.4653 -15.4653 -15.4653 -13.0150 -13.0150 -13.0149 -13.0149 -10.0815 -10.0815 -10.0808 -10.0808 -9.9715 -9.9715 -9.9711 -9.9711 -2.9061 -2.9061 -2.9058 -2.9058 -2.4519 -2.4519 -2.4517 -2.4517 0.2092 0.2092 0.2126 0.2126 1.2817 1.2817 1.2842 1.2842 2.4703 2.4703 2.4738 2.4738 2.6951 2.6951 2.6954 2.6954 3.4805 3.4805 3.4852 3.4852 3.9581 3.9581 3.9599 3.9599 4.0609 4.0609 4.0730 4.0730 4.8433 4.8433 4.8553 4.8553 6.0692 6.0692 6.0697 6.0697 6.1971 6.1971 6.1977 6.1977 12.9479 12.9479 12.9480 12.9480 13.2530 13.2530 13.2532 13.2532 15.4995 15.4995 15.5049 15.5049 k = 0.2857 0.3227-0.0000 ( 4324 PWs) bands (ev): -15.5174 -15.5174 -15.5174 -15.5174 -12.9874 -12.9874 -12.9873 -12.9873 -10.1001 -10.1001 -10.0994 -10.0994 -9.9840 -9.9840 -9.9836 -9.9836 -2.8453 -2.8453 -2.8450 -2.8450 -2.4188 -2.4188 -2.4186 -2.4186 0.1880 0.1880 0.1915 0.1915 1.3053 1.3053 1.3077 1.3077 2.4901 2.4901 2.4944 2.4944 2.7405 2.7405 2.7413 2.7413 3.4942 3.4942 3.4989 3.4989 3.9535 3.9535 3.9540 3.9540 4.0858 4.0858 4.0969 4.0969 4.8522 4.8522 4.8643 4.8643 6.0682 6.0682 6.0688 6.0688 6.1936 6.1936 6.1941 6.1941 12.9245 12.9245 12.9247 12.9247 13.2876 13.2876 13.2878 13.2878 15.4777 15.4777 15.4830 15.4830 k = 0.2768 0.3227-0.0000 ( 4324 PWs) bands (ev): -15.5683 -15.5683 -15.5683 -15.5683 -12.9615 -12.9615 -12.9614 -12.9614 -10.1189 -10.1189 -10.1182 -10.1182 -9.9966 -9.9966 -9.9963 -9.9963 -2.7813 -2.7813 -2.7810 -2.7810 -2.3874 -2.3874 -2.3871 -2.3871 0.1667 0.1667 0.1703 0.1703 1.3297 1.3297 1.3320 1.3320 2.5088 2.5088 2.5137 2.5137 2.7880 2.7880 2.7895 2.7895 3.5038 3.5038 3.5086 3.5086 3.9492 3.9492 3.9495 3.9495 4.1151 4.1151 4.1257 4.1257 4.8613 4.8613 4.8735 4.8735 6.0671 6.0671 6.0677 6.0677 6.1899 6.1899 6.1902 6.1902 12.8985 12.8985 12.8987 12.8987 13.3246 13.3246 13.3247 13.3247 15.4498 15.4498 15.4549 15.4549 k = 0.2679 0.3227-0.0000 ( 4324 PWs) bands (ev): -15.6180 -15.6180 -15.6180 -15.6180 -12.9372 -12.9372 -12.9371 -12.9371 -10.1377 -10.1377 -10.1370 -10.1370 -10.0093 -10.0093 -10.0090 -10.0090 -2.7141 -2.7141 -2.7138 -2.7138 -2.3576 -2.3576 -2.3573 -2.3573 0.1454 0.1454 0.1491 0.1491 1.3547 1.3547 1.3569 1.3569 2.5274 2.5274 2.5325 2.5325 2.8361 2.8361 2.8382 2.8382 3.5098 3.5098 3.5146 3.5146 3.9467 3.9467 3.9474 3.9474 4.1478 4.1478 4.1581 4.1581 4.8705 4.8705 4.8829 4.8829 6.0659 6.0659 6.0666 6.0666 6.1859 6.1859 6.1862 6.1862 12.8700 12.8700 12.8702 12.8702 13.3636 13.3636 13.3638 13.3638 15.4154 15.4154 15.4203 15.4203 k = 0.2589 0.3227-0.0000 ( 4328 PWs) bands (ev): -15.6665 -15.6665 -15.6665 -15.6665 -12.9145 -12.9145 -12.9144 -12.9144 -10.1564 -10.1564 -10.1558 -10.1558 -10.0219 -10.0219 -10.0217 -10.0217 -2.6440 -2.6440 -2.6436 -2.6436 -2.3295 -2.3295 -2.3292 -2.3292 0.1244 0.1244 0.1281 0.1281 1.3801 1.3801 1.3822 1.3822 2.5464 2.5464 2.5516 2.5516 2.8833 2.8833 2.8857 2.8857 3.5129 3.5129 3.5177 3.5177 3.9467 3.9467 3.9477 3.9477 4.1833 4.1833 4.1937 4.1937 4.8800 4.8800 4.8925 4.8925 6.0645 6.0645 6.0653 6.0653 6.1817 6.1817 6.1818 6.1818 12.8391 12.8391 12.8393 12.8393 13.4047 13.4047 13.4048 13.4048 15.3742 15.3742 15.3788 15.3788 k = 0.2500 0.3227-0.0000 ( 4320 PWs) bands (ev): -15.7137 -15.7137 -15.7137 -15.7137 -12.8933 -12.8933 -12.8932 -12.8932 -10.1751 -10.1751 -10.1745 -10.1745 -10.0345 -10.0345 -10.0343 -10.0343 -2.5710 -2.5710 -2.5706 -2.5706 -2.3032 -2.3032 -2.3028 -2.3028 0.1037 0.1037 0.1074 0.1074 1.4056 1.4056 1.4077 1.4077 2.5661 2.5661 2.5714 2.5714 2.9280 2.9280 2.9307 2.9307 3.5144 3.5144 3.5192 3.5192 3.9493 3.9493 3.9504 3.9504 4.2215 4.2215 4.2320 4.2320 4.8898 4.8898 4.9024 4.9024 6.0630 6.0630 6.0639 6.0639 6.1772 6.1772 6.1772 6.1772 12.8059 12.8059 12.8061 12.8061 13.4476 13.4476 13.4477 13.4477 15.3262 15.3262 15.3305 15.3305 k = 0.2411 0.3227-0.0000 ( 4320 PWs) bands (ev): -15.7596 -15.7596 -15.7596 -15.7596 -12.8736 -12.8736 -12.8735 -12.8735 -10.1937 -10.1937 -10.1931 -10.1931 -10.0471 -10.0471 -10.0469 -10.0469 -2.4956 -2.4956 -2.4951 -2.4951 -2.2785 -2.2785 -2.2779 -2.2779 0.0835 0.0835 0.0872 0.0872 1.4310 1.4310 1.4330 1.4330 2.5868 2.5868 2.5921 2.5921 2.9685 2.9685 2.9712 2.9712 3.5161 3.5161 3.5208 3.5208 3.9539 3.9539 3.9553 3.9553 4.2622 4.2622 4.2728 4.2728 4.8999 4.8999 4.9127 4.9127 6.0613 6.0613 6.0624 6.0624 6.1722 6.1722 6.1724 6.1724 12.7705 12.7705 12.7707 12.7707 13.4923 13.4923 13.4923 13.4923 15.2713 15.2713 15.2753 15.2753 k = 0.2321 0.3227-0.0000 ( 4324 PWs) bands (ev): -15.8041 -15.8041 -15.8041 -15.8041 -12.8554 -12.8554 -12.8553 -12.8553 -10.2121 -10.2121 -10.2115 -10.2115 -10.0596 -10.0596 -10.0594 -10.0594 -2.4184 -2.4184 -2.4177 -2.4177 -2.2551 -2.2551 -2.2543 -2.2543 0.0637 0.0637 0.0674 0.0674 1.4562 1.4562 1.4581 1.4581 2.6085 2.6085 2.6138 2.6138 3.0029 3.0029 3.0055 3.0055 3.5198 3.5198 3.5242 3.5242 3.9605 3.9605 3.9620 3.9620 4.3052 4.3052 4.3159 4.3159 4.9105 4.9105 4.9235 4.9235 6.0594 6.0594 6.0607 6.0607 6.1670 6.1670 6.1673 6.1673 12.7331 12.7331 12.7333 12.7333 13.5384 13.5384 13.5384 13.5384 15.2099 15.2099 15.2135 15.2135 k = 0.2232 0.3227-0.0000 ( 4326 PWs) bands (ev): -15.8472 -15.8472 -15.8472 -15.8472 -12.8385 -12.8385 -12.8384 -12.8384 -10.2302 -10.2302 -10.2297 -10.2297 -10.0719 -10.0719 -10.0717 -10.0717 -2.3408 -2.3408 -2.3397 -2.3397 -2.2318 -2.2318 -2.2306 -2.2306 0.0445 0.0445 0.0481 0.0481 1.4807 1.4807 1.4827 1.4827 2.6315 2.6315 2.6367 2.6367 3.0294 3.0294 3.0317 3.0317 3.5274 3.5274 3.5313 3.5313 3.9686 3.9686 3.9704 3.9704 4.3503 4.3503 4.3611 4.3611 4.9216 4.9216 4.9347 4.9347 6.0574 6.0574 6.0588 6.0588 6.1614 6.1614 6.1620 6.1620 12.6938 12.6938 12.6941 12.6941 13.5858 13.5858 13.5859 13.5859 15.1424 15.1424 15.1457 15.1457 k = 0.2143 0.3227-0.0000 ( 4322 PWs) bands (ev): -15.8888 -15.8888 -15.8888 -15.8888 -12.8230 -12.8230 -12.8229 -12.8229 -10.2481 -10.2481 -10.2476 -10.2476 -10.0840 -10.0840 -10.0838 -10.0838 -2.2688 -2.2688 -2.2670 -2.2670 -2.2029 -2.2029 -2.2008 -2.2008 0.0259 0.0259 0.0295 0.0295 1.5046 1.5046 1.5065 1.5065 2.6557 2.6557 2.6608 2.6608 3.0467 3.0467 3.0486 3.0486 3.5400 3.5400 3.5432 3.5432 3.9782 3.9782 3.9803 3.9803 4.3972 4.3972 4.4080 4.4080 4.9333 4.9333 4.9466 4.9466 6.0552 6.0552 6.0568 6.0568 6.1556 6.1556 6.1563 6.1563 12.6529 12.6529 12.6532 12.6532 13.6344 13.6344 13.6344 13.6344 15.0697 15.0697 15.0727 15.0727 k = 0.2054 0.3227-0.0000 ( 4322 PWs) bands (ev): -15.9290 -15.9290 -15.9290 -15.9290 -12.8087 -12.8087 -12.8086 -12.8086 -10.2656 -10.2656 -10.2651 -10.2651 -10.0959 -10.0959 -10.0957 -10.0957 -2.2226 -2.2226 -2.2209 -2.2209 -2.1472 -2.1472 -2.1454 -2.1454 0.0079 0.0079 0.0114 0.0114 1.5276 1.5276 1.5295 1.5295 2.6811 2.6811 2.6861 2.6861 3.0543 3.0543 3.0557 3.0557 3.5580 3.5580 3.5604 3.5604 3.9893 3.9893 3.9918 3.9918 4.4456 4.4456 4.4566 4.4566 4.9458 4.9458 4.9591 4.9591 6.0527 6.0527 6.0545 6.0545 6.1494 6.1494 6.1503 6.1503 12.6105 12.6105 12.6109 12.6109 13.6838 13.6838 13.6838 13.6838 14.9926 14.9926 14.9953 14.9953 k = 0.1964 0.3227-0.0000 ( 4318 PWs) bands (ev): -15.9677 -15.9677 -15.9677 -15.9677 -12.7956 -12.7956 -12.7955 -12.7955 -10.2827 -10.2827 -10.2823 -10.2823 -10.1075 -10.1075 -10.1074 -10.1074 -2.1995 -2.1995 -2.1986 -2.1986 -2.0679 -2.0679 -2.0667 -2.0667 -0.0094 -0.0094 -0.0060 -0.0060 1.5494 1.5494 1.5513 1.5513 2.7077 2.7077 2.7126 2.7126 3.0526 3.0526 3.0535 3.0535 3.5806 3.5806 3.5822 3.5822 4.0019 4.0019 4.0049 4.0049 4.4955 4.4955 4.5064 4.5064 4.9590 4.9590 4.9725 4.9725 6.0500 6.0500 6.0521 6.0521 6.1429 6.1429 6.1440 6.1440 12.5669 12.5669 12.5672 12.5672 13.7335 13.7335 13.7335 13.7335 14.9122 14.9122 14.9146 14.9146 k = 0.1875 0.3227-0.0000 ( 4314 PWs) bands (ev): -16.0049 -16.0049 -16.0048 -16.0048 -12.7836 -12.7836 -12.7835 -12.7835 -10.2994 -10.2994 -10.2990 -10.2990 -10.1189 -10.1189 -10.1188 -10.1188 -2.1837 -2.1837 -2.1831 -2.1831 -1.9819 -1.9819 -1.9810 -1.9810 -0.0260 -0.0260 -0.0227 -0.0227 1.5699 1.5699 1.5719 1.5719 2.7353 2.7353 2.7401 2.7401 3.0429 3.0429 3.0433 3.0433 3.6062 3.6062 3.6069 3.6069 4.0164 4.0164 4.0199 4.0199 4.5465 4.5465 4.5573 4.5573 4.9732 4.9732 4.9868 4.9868 6.0471 6.0471 6.0494 6.0494 6.1360 6.1360 6.1374 6.1374 12.5223 12.5223 12.5226 12.5226 13.7833 13.7833 13.7833 13.7833 14.8296 14.8296 14.8318 14.8318 k = 0.1786 0.3227-0.0000 ( 4310 PWs) bands (ev): -16.0405 -16.0405 -16.0404 -16.0404 -12.7727 -12.7727 -12.7726 -12.7726 -10.3156 -10.3156 -10.3152 -10.3152 -10.1299 -10.1299 -10.1298 -10.1298 -2.1710 -2.1710 -2.1706 -2.1706 -1.8934 -1.8934 -1.8927 -1.8927 -0.0420 -0.0420 -0.0388 -0.0388 1.5890 1.5890 1.5909 1.5909 2.7638 2.7638 2.7686 2.7686 3.0266 3.0266 3.0267 3.0267 3.6328 3.6328 3.6330 3.6330 4.0328 4.0328 4.0369 4.0369 4.5982 4.5982 4.6090 4.6090 4.9884 4.9884 5.0020 5.0020 6.0438 6.0438 6.0464 6.0464 6.1289 6.1289 6.1305 6.1305 12.4769 12.4769 12.4772 12.4772 13.8323 13.8323 13.8323 13.8323 14.7464 14.7464 14.7483 14.7483 k = 0.1696 0.3227-0.0000 ( 4314 PWs) bands (ev): -16.0745 -16.0745 -16.0745 -16.0745 -12.7628 -12.7628 -12.7627 -12.7627 -10.3313 -10.3313 -10.3309 -10.3309 -10.1406 -10.1406 -10.1405 -10.1405 -2.1604 -2.1604 -2.1601 -2.1601 -1.8035 -1.8035 -1.8029 -1.8029 -0.0573 -0.0573 -0.0542 -0.0542 1.6064 1.6064 1.6084 1.6084 2.7928 2.7928 2.7977 2.7977 3.0055 3.0055 3.0055 3.0055 3.6582 3.6582 3.6591 3.6591 4.0514 4.0514 4.0561 4.0561 4.6506 4.6506 4.6612 4.6612 5.0048 5.0048 5.0184 5.0184 6.0402 6.0402 6.0431 6.0431 6.1213 6.1213 6.1233 6.1233 12.4310 12.4310 12.4313 12.4313 13.8796 13.8796 13.8797 13.8797 14.6641 14.6641 14.6658 14.6658 k = 0.1607 0.3227-0.0000 ( 4306 PWs) bands (ev): -16.1069 -16.1069 -16.1069 -16.1069 -12.7538 -12.7538 -12.7538 -12.7538 -10.3464 -10.3464 -10.3461 -10.3461 -10.1510 -10.1510 -10.1509 -10.1509 -2.1515 -2.1515 -2.1512 -2.1512 -1.7129 -1.7129 -1.7123 -1.7123 -0.0719 -0.0719 -0.0690 -0.0690 1.6220 1.6220 1.6241 1.6241 2.8218 2.8218 2.8269 2.8269 2.9812 2.9812 2.9812 2.9812 3.6817 3.6817 3.6832 3.6832 4.0723 4.0723 4.0774 4.0774 4.7031 4.7031 4.7137 4.7137 5.0224 5.0224 5.0360 5.0360 6.0363 6.0363 6.0395 6.0395 6.1135 6.1135 6.1159 6.1159 12.3849 12.3849 12.3853 12.3853 13.9237 13.9237 13.9238 13.9238 14.5850 14.5850 14.5865 14.5865 k = 0.1518 0.3227-0.0000 ( 4304 PWs) bands (ev): -16.1377 -16.1377 -16.1377 -16.1377 -12.7458 -12.7458 -12.7457 -12.7457 -10.3609 -10.3609 -10.3606 -10.3606 -10.1609 -10.1609 -10.1608 -10.1608 -2.1440 -2.1440 -2.1438 -2.1438 -1.6219 -1.6219 -1.6214 -1.6214 -0.0859 -0.0859 -0.0830 -0.0830 1.6358 1.6358 1.6379 1.6379 2.8489 2.8489 2.8546 2.8546 2.9560 2.9560 2.9566 2.9566 3.7025 3.7025 3.7044 3.7044 4.0952 4.0952 4.1007 4.1007 4.7557 4.7557 4.7660 4.7660 5.0413 5.0413 5.0548 5.0548 6.0320 6.0320 6.0356 6.0356 6.1054 6.1054 6.1081 6.1081 12.3389 12.3389 12.3392 12.3392 13.9622 13.9622 13.9623 13.9623 14.5121 14.5121 14.5134 14.5134 k = 0.1429 0.3227-0.0000 ( 4300 PWs) bands (ev): -16.1668 -16.1668 -16.1668 -16.1668 -12.7385 -12.7385 -12.7384 -12.7384 -10.3748 -10.3748 -10.3745 -10.3745 -10.1704 -10.1704 -10.1703 -10.1703 -2.1378 -2.1378 -2.1376 -2.1376 -1.5311 -1.5311 -1.5305 -1.5305 -0.0992 -0.0992 -0.0965 -0.0965 1.6476 1.6476 1.6497 1.6497 2.8677 2.8677 2.8745 2.8745 2.9370 2.9370 2.9387 2.9387 3.7202 3.7202 3.7224 3.7224 4.1197 4.1197 4.1255 4.1255 4.8078 4.8078 4.8179 4.8179 5.0616 5.0616 5.0750 5.0750 6.0273 6.0273 6.0313 6.0313 6.0970 6.0970 6.1002 6.1002 12.2933 12.2933 12.2936 12.2936 13.9907 13.9907 13.9909 13.9909 14.4502 14.4502 14.4513 14.4513 k = 0.1339 0.3227-0.0000 ( 4300 PWs) bands (ev): -16.1943 -16.1943 -16.1943 -16.1943 -12.7320 -12.7320 -12.7319 -12.7319 -10.3880 -10.3880 -10.3877 -10.3877 -10.1795 -10.1795 -10.1794 -10.1794 -2.1327 -2.1327 -2.1325 -2.1325 -1.4408 -1.4408 -1.4403 -1.4403 -0.1118 -0.1118 -0.1093 -0.1093 1.6573 1.6573 1.6595 1.6595 2.8624 2.8624 2.8682 2.8682 2.9431 2.9431 2.9438 2.9438 3.7347 3.7347 3.7371 3.7371 4.1453 4.1453 4.1512 4.1512 4.8592 4.8592 4.8690 4.8690 5.0834 5.0834 5.0964 5.0964 6.0221 6.0221 6.0265 6.0265 6.0885 6.0885 6.0920 6.0920 12.2483 12.2483 12.2486 12.2486 14.0032 14.0032 14.0034 14.0034 14.4059 14.4059 14.4068 14.4068 k = 0.1250 0.3227-0.0000 ( 4304 PWs) bands (ev): -16.2201 -16.2201 -16.2201 -16.2201 -12.7262 -12.7262 -12.7261 -12.7261 -10.4006 -10.4006 -10.4003 -10.4003 -10.1881 -10.1881 -10.1880 -10.1880 -2.1285 -2.1285 -2.1284 -2.1284 -1.3515 -1.3515 -1.3510 -1.3510 -0.1238 -0.1238 -0.1214 -0.1214 1.6650 1.6650 1.6672 1.6672 2.8378 2.8378 2.8422 2.8422 2.9673 2.9673 2.9679 2.9679 3.7463 3.7463 3.7488 3.7488 4.1714 4.1714 4.1773 4.1773 4.9095 4.9095 4.9188 4.9188 5.1067 5.1067 5.1192 5.1192 6.0164 6.0164 6.0213 6.0213 6.0797 6.0797 6.0838 6.0838 12.2044 12.2044 12.2047 12.2047 13.9937 13.9937 13.9940 13.9940 14.3854 14.3854 14.3861 14.3861 k = 0.1161 0.3227-0.0000 ( 4296 PWs) bands (ev): -16.2441 -16.2441 -16.2441 -16.2441 -12.7210 -12.7210 -12.7210 -12.7210 -10.4123 -10.4123 -10.4121 -10.4121 -10.1961 -10.1961 -10.1961 -10.1961 -2.1252 -2.1252 -2.1251 -2.1251 -1.2638 -1.2638 -1.2632 -1.2632 -0.1352 -0.1352 -0.1330 -0.1330 1.6705 1.6705 1.6728 1.6728 2.8077 2.8077 2.8114 2.8114 2.9959 2.9959 2.9970 2.9970 3.7553 3.7553 3.7577 3.7577 4.1971 4.1971 4.2029 4.2029 4.9583 4.9583 4.9670 4.9670 5.1314 5.1314 5.1433 5.1433 6.0102 6.0102 6.0156 6.0156 6.0709 6.0709 6.0754 6.0754 12.1617 12.1617 12.1620 12.1620 13.9626 13.9626 13.9629 13.9629 14.3888 14.3888 14.3893 14.3893 k = 0.1071 0.3227-0.0000 ( 4300 PWs) bands (ev): -16.2665 -16.2665 -16.2665 -16.2665 -12.7165 -12.7165 -12.7164 -12.7164 -10.4233 -10.4233 -10.4231 -10.4231 -10.2037 -10.2037 -10.2037 -10.2037 -2.1226 -2.1226 -2.1226 -2.1226 -1.1781 -1.1781 -1.1775 -1.1775 -0.1460 -0.1460 -0.1439 -0.1439 1.6740 1.6740 1.6762 1.6762 2.7761 2.7761 2.7795 2.7795 3.0255 3.0255 3.0268 3.0268 3.7621 3.7621 3.7644 3.7644 4.2221 4.2221 4.2277 4.2277 5.0051 5.0051 5.0131 5.0131 5.1575 5.1575 5.1686 5.1686 6.0035 6.0035 6.0093 6.0093 6.0622 6.0622 6.0671 6.0671 12.1207 12.1207 12.1210 12.1210 13.9167 13.9167 13.9171 13.9171 14.4093 14.4093 14.4097 14.4097 k = 0.0982 0.3227-0.0000 ( 4300 PWs) bands (ev): -16.2871 -16.2871 -16.2871 -16.2871 -12.7125 -12.7125 -12.7124 -12.7124 -10.4336 -10.4336 -10.4334 -10.4334 -10.2108 -10.2108 -10.2107 -10.2107 -2.1207 -2.1207 -2.1206 -2.1206 -1.0950 -1.0950 -1.0944 -1.0944 -0.1562 -0.1562 -0.1543 -0.1543 1.6754 1.6754 1.6777 1.6777 2.7447 2.7447 2.7478 2.7478 3.0548 3.0548 3.0561 3.0561 3.7671 3.7671 3.7693 3.7693 4.2456 4.2456 4.2510 4.2510 5.0495 5.0495 5.0566 5.0566 5.1850 5.1850 5.1949 5.1949 5.9962 5.9962 6.0025 6.0025 6.0536 6.0536 6.0589 6.0589 12.0816 12.0816 12.0819 12.0819 13.8637 13.8637 13.8641 13.8641 14.4395 14.4395 14.4399 14.4399 k = 0.0893 0.3227-0.0000 ( 4300 PWs) bands (ev): -16.3060 -16.3060 -16.3060 -16.3060 -12.7090 -12.7090 -12.7089 -12.7089 -10.4430 -10.4430 -10.4428 -10.4428 -10.2173 -10.2173 -10.2172 -10.2172 -2.1193 -2.1193 -2.1192 -2.1192 -1.0151 -1.0151 -1.0145 -1.0145 -0.1659 -0.1659 -0.1641 -0.1641 1.6750 1.6750 1.6772 1.6772 2.7142 2.7142 2.7171 2.7171 3.0831 3.0831 3.0845 3.0845 3.7706 3.7706 3.7727 3.7727 4.2675 4.2675 4.2725 4.2725 5.0910 5.0910 5.0969 5.0969 5.2136 5.2136 5.2221 5.2221 5.9885 5.9885 5.9950 5.9950 6.0453 6.0453 6.0509 6.0509 12.0447 12.0447 12.0450 12.0450 13.8088 13.8088 13.8091 13.8091 14.4743 14.4743 14.4746 14.4746 k = 0.0804 0.3227-0.0000 ( 4312 PWs) bands (ev): -16.3231 -16.3231 -16.3231 -16.3231 -12.7059 -12.7059 -12.7059 -12.7059 -10.4516 -10.4516 -10.4514 -10.4514 -10.2232 -10.2232 -10.2232 -10.2232 -2.1183 -2.1183 -2.1182 -2.1182 -0.9390 -0.9390 -0.9384 -0.9384 -0.1751 -0.1751 -0.1734 -0.1734 1.6728 1.6728 1.6749 1.6749 2.6851 2.6851 2.6878 2.6878 3.1101 3.1101 3.1113 3.1113 3.7730 3.7730 3.7749 3.7749 4.2875 4.2875 4.2921 4.2921 5.1292 5.1292 5.1338 5.1338 5.2430 5.2430 5.2499 5.2499 5.9803 5.9803 5.9869 5.9869 6.0375 6.0375 6.0431 6.0431 12.0104 12.0104 12.0106 12.0106 13.7551 13.7551 13.7553 13.7553 14.5105 14.5105 14.5109 14.5109 k = 0.0714 0.3227-0.0000 ( 4304 PWs) bands (ev): -16.3384 -16.3384 -16.3384 -16.3384 -12.7033 -12.7033 -12.7033 -12.7033 -10.4593 -10.4593 -10.4591 -10.4591 -10.2285 -10.2285 -10.2285 -10.2285 -2.1176 -2.1176 -2.1175 -2.1175 -0.8674 -0.8674 -0.8669 -0.8669 -0.1837 -0.1837 -0.1822 -0.1822 1.6691 1.6691 1.6712 1.6712 2.6580 2.6580 2.6604 2.6604 3.1353 3.1353 3.1364 3.1364 3.7746 3.7746 3.7763 3.7763 4.3054 4.3054 4.3095 4.3095 5.1637 5.1637 5.1670 5.1670 5.2727 5.2727 5.2779 5.2779 5.9718 5.9718 5.9784 5.9784 6.0303 6.0303 6.0358 6.0358 11.9788 11.9788 11.9790 11.9790 13.7045 13.7045 13.7047 13.7047 14.5464 14.5464 14.5468 14.5468 k = 0.0625 0.3227-0.0000 ( 4304 PWs) bands (ev): -16.3520 -16.3520 -16.3520 -16.3520 -12.7011 -12.7011 -12.7011 -12.7011 -10.4662 -10.4662 -10.4660 -10.4660 -10.2333 -10.2333 -10.2332 -10.2332 -2.1172 -2.1172 -2.1171 -2.1171 -0.8012 -0.8012 -0.8006 -0.8006 -0.1919 -0.1919 -0.1905 -0.1905 1.6643 1.6643 1.6662 1.6662 2.6332 2.6332 2.6354 2.6354 3.1583 3.1583 3.1594 3.1594 3.7755 3.7755 3.7770 3.7770 4.3211 4.3211 4.3248 4.3248 5.1944 5.1944 5.1964 5.1964 5.3018 5.3018 5.3054 5.3054 5.9632 5.9632 5.9695 5.9695 6.0236 6.0236 6.0289 6.0289 11.9503 11.9503 11.9505 11.9505 13.6581 13.6581 13.6583 13.6583 14.5806 14.5806 14.5809 14.5809 k = 0.0536 0.3227-0.0000 ( 4296 PWs) bands (ev): -16.3637 -16.3637 -16.3637 -16.3637 -12.6992 -12.6992 -12.6992 -12.6992 -10.4721 -10.4721 -10.4720 -10.4720 -10.2374 -10.2374 -10.2374 -10.2374 -2.1169 -2.1169 -2.1169 -2.1169 -0.7409 -0.7409 -0.7404 -0.7404 -0.1995 -0.1995 -0.1983 -0.1983 1.6588 1.6588 1.6605 1.6605 2.6111 2.6111 2.6131 2.6131 3.1790 3.1790 3.1799 3.1799 3.7760 3.7760 3.7773 3.7773 4.3346 4.3346 4.3378 4.3378 5.2211 5.2211 5.2220 5.2220 5.3295 5.3295 5.3318 5.3318 5.9547 5.9547 5.9605 5.9605 6.0178 6.0178 6.0226 6.0226 11.9250 11.9250 11.9252 11.9252 13.6168 13.6168 13.6169 13.6169 14.6122 14.6122 14.6125 14.6125 k = 0.0446 0.3227-0.0000 ( 4306 PWs) bands (ev): -16.3737 -16.3737 -16.3737 -16.3737 -12.6977 -12.6977 -12.6977 -12.6977 -10.4772 -10.4772 -10.4771 -10.4771 -10.2409 -10.2409 -10.2409 -10.2409 -2.1169 -2.1169 -2.1168 -2.1168 -0.6876 -0.6876 -0.6871 -0.6871 -0.2067 -0.2067 -0.2056 -0.2056 1.6529 1.6529 1.6544 1.6544 2.5921 2.5921 2.5937 2.5937 3.1969 3.1969 3.1977 3.1977 3.7762 3.7762 3.7772 3.7772 4.3460 4.3460 4.3487 4.3487 5.2438 5.2438 5.2439 5.2439 5.3548 5.3548 5.3561 5.3561 5.9466 5.9466 5.9518 5.9518 6.0127 6.0127 6.0169 6.0169 11.9033 11.9033 11.9035 11.9035 13.5811 13.5811 13.5812 13.5812 14.6403 14.6403 14.6405 14.6405 k = 0.0357 0.3227-0.0000 ( 4306 PWs) bands (ev): -16.3819 -16.3819 -16.3819 -16.3819 -12.6965 -12.6965 -12.6964 -12.6964 -10.4814 -10.4814 -10.4813 -10.4813 -10.2438 -10.2438 -10.2438 -10.2438 -2.1168 -2.1168 -2.1168 -2.1168 -0.6420 -0.6420 -0.6415 -0.6415 -0.2132 -0.2132 -0.2123 -0.2123 1.6472 1.6472 1.6484 1.6484 2.5762 2.5762 2.5776 2.5776 3.2120 3.2120 3.2126 3.2126 3.7762 3.7762 3.7770 3.7770 4.3553 4.3553 4.3574 4.3574 5.2621 5.2621 5.2624 5.2624 5.3770 5.3770 5.3775 5.3775 5.9393 5.9393 5.9437 5.9437 6.0085 6.0085 6.0120 6.0120 11.8853 11.8853 11.8854 11.8854 13.5514 13.5514 13.5515 13.5515 14.6644 14.6644 14.6646 14.6646 k = 0.0268 0.3227-0.0000 ( 4310 PWs) bands (ev): -16.3882 -16.3882 -16.3882 -16.3882 -12.6955 -12.6955 -12.6955 -12.6955 -10.4846 -10.4846 -10.4846 -10.4846 -10.2460 -10.2460 -10.2460 -10.2460 -2.1169 -2.1169 -2.1169 -2.1169 -0.6050 -0.6050 -0.6046 -0.6046 -0.2188 -0.2188 -0.2182 -0.2182 1.6421 1.6421 1.6431 1.6431 2.5638 2.5638 2.5648 2.5648 3.2239 3.2239 3.2244 3.2244 3.7761 3.7761 3.7768 3.7768 4.3625 4.3625 4.3641 4.3641 5.2765 5.2765 5.2769 5.2769 5.3951 5.3951 5.3952 5.3952 5.9332 5.9332 5.9366 5.9366 6.0052 6.0052 6.0079 6.0079 11.8711 11.8711 11.8712 11.8712 13.5280 13.5280 13.5281 13.5281 14.6839 14.6839 14.6841 14.6841 k = 0.0179 0.3227-0.0000 ( 4310 PWs) bands (ev): -16.3928 -16.3928 -16.3928 -16.3928 -12.6949 -12.6949 -12.6949 -12.6949 -10.4870 -10.4870 -10.4869 -10.4869 -10.2477 -10.2477 -10.2477 -10.2477 -2.1170 -2.1170 -2.1169 -2.1169 -0.5776 -0.5776 -0.5774 -0.5774 -0.2233 -0.2233 -0.2228 -0.2228 1.6382 1.6382 1.6388 1.6388 2.5549 2.5549 2.5556 2.5556 3.2326 3.2326 3.2329 3.2329 3.7761 3.7761 3.7765 3.7765 4.3676 4.3676 4.3687 4.3687 5.2869 5.2869 5.2873 5.2873 5.4085 5.4085 5.4086 5.4086 5.9286 5.9286 5.9310 5.9310 6.0030 6.0030 6.0048 6.0048 11.8608 11.8608 11.8609 11.8609 13.5112 13.5112 13.5112 13.5112 14.6983 14.6983 14.6984 14.6984 k = 0.0089 0.3227-0.0000 ( 4306 PWs) bands (ev): -16.3955 -16.3955 -16.3955 -16.3955 -12.6945 -12.6945 -12.6945 -12.6945 -10.4883 -10.4883 -10.4883 -10.4883 -10.2486 -10.2486 -10.2486 -10.2486 -2.1170 -2.1170 -2.1170 -2.1170 -0.5607 -0.5607 -0.5606 -0.5606 -0.2261 -0.2261 -0.2259 -0.2259 1.6357 1.6357 1.6361 1.6361 2.5496 2.5496 2.5499 2.5499 3.2378 3.2378 3.2380 3.2380 3.7761 3.7761 3.7763 3.7763 4.3708 4.3708 4.3714 4.3714 5.2933 5.2933 5.2935 5.2935 5.4167 5.4167 5.4168 5.4168 5.9260 5.9260 5.9272 5.9272 6.0018 6.0018 6.0027 6.0027 11.8547 11.8547 11.8547 11.8547 13.5011 13.5011 13.5011 13.5011 14.7071 14.7071 14.7072 14.7072 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6943 -12.6943 -12.6943 -12.6943 -10.4888 -10.4888 -10.4888 -10.4888 -10.2489 -10.2489 -10.2489 -10.2489 -2.1170 -2.1170 -2.1170 -2.1170 -0.5550 -0.5550 -0.5550 -0.5550 -0.2271 -0.2271 -0.2271 -0.2271 1.6350 1.6350 1.6350 1.6350 2.5479 2.5479 2.5479 2.5479 3.2396 3.2396 3.2396 3.2396 3.7761 3.7761 3.7761 3.7761 4.3721 4.3721 4.3721 4.3721 5.2955 5.2955 5.2955 5.2955 5.4196 5.4196 5.4196 5.4196 5.9255 5.9255 5.9255 5.9255 6.0017 6.0017 6.0017 6.0017 11.8526 11.8526 11.8526 11.8526 13.4977 13.4977 13.4977 13.4977 14.7101 14.7101 14.7101 14.7101 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6943 -12.6943 -12.6943 -12.6943 -10.4888 -10.4888 -10.4888 -10.4888 -10.2489 -10.2489 -10.2489 -10.2489 -2.1170 -2.1170 -2.1170 -2.1170 -0.5550 -0.5550 -0.5550 -0.5550 -0.2271 -0.2271 -0.2271 -0.2271 1.6350 1.6350 1.6350 1.6350 2.5479 2.5479 2.5479 2.5479 3.2396 3.2396 3.2396 3.2396 3.7761 3.7761 3.7761 3.7761 4.3721 4.3721 4.3721 4.3721 5.2955 5.2955 5.2955 5.2955 5.4196 5.4196 5.4196 5.4196 5.9255 5.9255 5.9255 5.9255 6.0017 6.0017 6.0017 6.0017 11.8526 11.8526 11.8526 11.8526 13.4977 13.4977 13.4977 13.4977 14.7101 14.7101 14.7101 14.7101 k = 0.0000 0.3138-0.0000 ( 4310 PWs) bands (ev): -16.3982 -16.3982 -16.3948 -16.3948 -12.6967 -12.6967 -12.6917 -12.6917 -10.5149 -10.5149 -10.4622 -10.4622 -10.2698 -10.2698 -10.2280 -10.2280 -2.1182 -2.1182 -2.1163 -2.1163 -0.5558 -0.5558 -0.5544 -0.5544 -0.2558 -0.2558 -0.1982 -0.1982 1.6280 1.6280 1.6401 1.6401 2.5136 2.5136 2.5857 2.5857 3.2396 3.2396 3.2401 3.2401 3.7683 3.7683 3.7819 3.7819 4.3478 4.3478 4.3948 4.3948 5.2757 5.2757 5.3155 5.3155 5.4024 5.4024 5.4368 5.4368 5.8947 5.8947 5.9552 5.9552 5.9854 5.9854 6.0203 6.0203 11.8364 11.8364 11.8675 11.8675 13.4955 13.4955 13.5000 13.5000 14.7067 14.7067 14.7130 14.7130 k = 0.0000 0.3048-0.0000 ( 4312 PWs) bands (ev): -16.4003 -16.4003 -16.3936 -16.3936 -12.6986 -12.6986 -12.6887 -12.6887 -10.5405 -10.5405 -10.4351 -10.4351 -10.2904 -10.2904 -10.2069 -10.2069 -2.1199 -2.1199 -2.1161 -2.1161 -0.5568 -0.5568 -0.5539 -0.5539 -0.2843 -0.2843 -0.1691 -0.1691 1.6185 1.6185 1.6441 1.6441 2.4838 2.4838 2.6258 2.6258 3.2399 3.2399 3.2408 3.2408 3.7579 3.7579 3.7859 3.7859 4.3220 4.3220 4.4160 4.4160 5.2561 5.2561 5.3357 5.3357 5.3852 5.3852 5.4540 5.4540 5.8644 5.8644 5.9700 5.9700 5.9811 5.9811 6.0438 6.0438 11.8188 11.8188 11.8810 11.8810 13.4934 13.4934 13.5026 13.5026 14.7029 14.7029 14.7156 14.7156 k = 0.0000 0.2958-0.0000 ( 4320 PWs) bands (ev): -16.4027 -16.4027 -16.3926 -16.3926 -12.7002 -12.7002 -12.6853 -12.6853 -10.5654 -10.5654 -10.4077 -10.4077 -10.3108 -10.3108 -10.1857 -10.1857 -2.1222 -2.1222 -2.1165 -2.1165 -0.5580 -0.5580 -0.5537 -0.5537 -0.3126 -0.3126 -0.1398 -0.1398 1.6058 1.6058 1.6474 1.6474 2.4596 2.4596 2.6672 2.6672 3.2406 3.2406 3.2419 3.2419 3.7447 3.7447 3.7887 3.7887 4.2949 4.2949 4.4356 4.4356 5.2368 5.2368 5.3559 5.3559 5.3682 5.3682 5.4711 5.4711 5.8352 5.8352 5.9549 5.9549 6.0011 6.0011 6.0739 6.0739 11.7997 11.7997 11.8931 11.8931 13.4913 13.4913 13.5053 13.5053 14.6987 14.6987 14.7177 14.7177 k = 0.0000 0.2869-0.0000 ( 4316 PWs) bands (ev): -16.4054 -16.4054 -16.3919 -16.3919 -12.7015 -12.7015 -12.6816 -12.6816 -10.5896 -10.5896 -10.3800 -10.3800 -10.3310 -10.3310 -10.1644 -10.1644 -2.1251 -2.1251 -2.1173 -2.1173 -0.5594 -0.5594 -0.5536 -0.5536 -0.3407 -0.3407 -0.1103 -0.1103 1.5895 1.5895 1.6505 1.6505 2.4416 2.4416 2.7086 2.7086 3.2416 3.2416 3.2434 3.2434 3.7284 3.7284 3.7908 3.7908 4.2666 4.2666 4.4539 4.4539 5.2178 5.2178 5.3512 5.3512 5.3763 5.3763 5.4881 5.4881 5.8074 5.8074 5.9399 5.9399 6.0162 6.0162 6.1096 6.1096 11.7792 11.7792 11.9040 11.9040 13.4893 13.4893 13.5082 13.5082 14.6942 14.6942 14.7194 14.7194 k = 0.0000 0.2779-0.0000 ( 4312 PWs) bands (ev): -16.4083 -16.4083 -16.3915 -16.3915 -12.7025 -12.7025 -12.6775 -12.6775 -10.6131 -10.6131 -10.3522 -10.3522 -10.3510 -10.3510 -10.1430 -10.1430 -2.1285 -2.1285 -2.1185 -2.1185 -0.5610 -0.5610 -0.5538 -0.5538 -0.3685 -0.3685 -0.0806 -0.0806 1.5693 1.5693 1.6540 1.6540 2.4304 2.4304 2.7490 2.7490 3.2430 3.2430 3.2452 3.2452 3.7087 3.7087 3.7926 3.7926 4.2375 4.2375 4.4708 4.4708 5.1992 5.1992 5.3343 5.3343 5.3966 5.3966 5.5051 5.5051 5.7811 5.7811 5.9251 5.9251 6.0283 6.0283 6.1489 6.1489 11.7573 11.7573 11.9137 11.9137 13.4874 13.4874 13.5114 13.5114 14.6893 14.6893 14.7206 14.7206 k = 0.0000 0.2689-0.0000 ( 4312 PWs) bands (ev): -16.4114 -16.4114 -16.3913 -16.3913 -12.7032 -12.7032 -12.6731 -12.6731 -10.6357 -10.6357 -10.3707 -10.3707 -10.3241 -10.3241 -10.1216 -10.1216 -2.1325 -2.1325 -2.1203 -2.1203 -0.5627 -0.5627 -0.5541 -0.5541 -0.3959 -0.3959 -0.0506 -0.0506 1.5453 1.5453 1.6580 1.6580 2.4260 2.4260 2.7874 2.7874 3.2446 3.2446 3.2474 3.2474 3.6854 3.6854 3.7947 3.7947 4.2078 4.2078 4.4867 4.4867 5.1810 5.1810 5.3176 5.3176 5.4170 5.4170 5.5219 5.5219 5.7558 5.7558 5.9105 5.9105 6.0385 6.0385 6.1901 6.1901 11.7339 11.7339 11.9223 11.9223 13.4854 13.4854 13.5149 13.5149 14.6841 14.6841 14.7214 14.7214 k = 0.0000 0.2600-0.0000 ( 4320 PWs) bands (ev): -16.4148 -16.4148 -16.3914 -16.3914 -12.7036 -12.7036 -12.6684 -12.6684 -10.6576 -10.6576 -10.3902 -10.3902 -10.2960 -10.2960 -10.1002 -10.1002 -2.1372 -2.1372 -2.1226 -2.1226 -0.5646 -0.5646 -0.5546 -0.5546 -0.4228 -0.4228 -0.0202 -0.0202 1.5177 1.5177 1.6628 1.6628 2.4283 2.4283 2.8228 2.8228 3.2466 3.2466 3.2498 3.2498 3.6586 3.6586 3.7975 3.7975 4.1779 4.1779 4.5017 4.5017 5.1631 5.1631 5.3010 5.3010 5.4372 5.4372 5.5386 5.5386 5.7314 5.7314 5.8965 5.8965 6.0476 6.0476 6.2326 6.2326 11.7091 11.7091 11.9297 11.9297 13.4833 13.4833 13.5187 13.5187 14.6785 14.6785 14.7219 14.7219 k = 0.0000 0.2510-0.0000 ( 4320 PWs) bands (ev): -16.4183 -16.4183 -16.3918 -16.3918 -12.7038 -12.7038 -12.6635 -12.6635 -10.6785 -10.6785 -10.4093 -10.4093 -10.2679 -10.2679 -10.0788 -10.0788 -2.1424 -2.1424 -2.1253 -2.1253 -0.5667 -0.5667 -0.5553 -0.5553 -0.4493 -0.4493 0.0107 0.0107 1.4871 1.4871 1.6684 1.6684 2.4368 2.4368 2.8543 2.8543 3.2489 3.2489 3.2526 3.2526 3.6281 3.6281 3.8016 3.8016 4.1480 4.1480 4.5159 4.5159 5.1458 5.1458 5.2846 5.2846 5.4573 5.4573 5.5550 5.5550 5.7073 5.7073 5.8834 5.8834 6.0559 6.0559 6.2757 6.2757 11.6828 11.6828 11.9362 11.9362 13.4810 13.4810 13.5227 13.5227 14.6727 14.6727 14.7218 14.7218 k = 0.0000 0.2420-0.0000 ( 4316 PWs) bands (ev): -16.4221 -16.4221 -16.3924 -16.3924 -12.7037 -12.7037 -12.6582 -12.6582 -10.6985 -10.6985 -10.4282 -10.4282 -10.2399 -10.2399 -10.0575 -10.0575 -2.1482 -2.1482 -2.1285 -2.1285 -0.5689 -0.5689 -0.5561 -0.5561 -0.4751 -0.4751 0.0420 0.0420 1.4542 1.4542 1.6751 1.6751 2.4507 2.4507 2.8813 2.8813 3.2514 3.2514 3.2556 3.2556 3.5943 3.5943 3.8072 3.8072 4.1186 4.1186 4.5296 4.5296 5.1289 5.1289 5.2685 5.2685 5.4773 5.4773 5.5712 5.5712 5.6831 5.6831 5.8715 5.8715 6.0640 6.0640 6.3191 6.3191 11.6550 11.6550 11.9419 11.9419 13.4787 13.4787 13.5272 13.5272 14.6666 14.6666 14.7214 14.7214 k = 0.0000 0.2331-0.0000 ( 4308 PWs) bands (ev): -16.4260 -16.4260 -16.3932 -16.3932 -12.7034 -12.7034 -12.6527 -12.6527 -10.7176 -10.7176 -10.4467 -10.4467 -10.2121 -10.2121 -10.0362 -10.0362 -2.1546 -2.1546 -2.1323 -2.1323 -0.5712 -0.5712 -0.5571 -0.5571 -0.5003 -0.5003 0.0738 0.0738 1.4195 1.4195 1.6827 1.6827 2.4694 2.4694 2.9031 2.9031 3.2542 3.2542 3.2589 3.2589 3.5575 3.5575 3.8147 3.8147 4.0897 4.0897 4.5428 4.5428 5.1126 5.1126 5.2526 5.2526 5.4970 5.4970 5.5871 5.5871 5.6582 5.6582 5.8611 5.8611 6.0720 6.0720 6.3622 6.3622 11.6258 11.6258 11.9467 11.9467 13.4761 13.4761 13.5319 13.5319 14.6603 14.6603 14.7206 14.7206 k = 0.0000 0.2241-0.0000 ( 4312 PWs) bands (ev): -16.4300 -16.4300 -16.3943 -16.3943 -12.7029 -12.7029 -12.6470 -12.6470 -10.7356 -10.7356 -10.4649 -10.4649 -10.1845 -10.1845 -10.0151 -10.0151 -2.1616 -2.1616 -2.1366 -2.1366 -0.5736 -0.5736 -0.5582 -0.5582 -0.5247 -0.5247 0.1063 0.1063 1.3839 1.3839 1.6912 1.6912 2.4917 2.4917 2.9194 2.9194 3.2572 3.2572 3.2624 3.2624 3.5181 3.5181 3.8242 3.8242 4.0617 4.0617 4.5556 4.5556 5.0968 5.0968 5.2370 5.2370 5.5165 5.5165 5.6023 5.6023 5.6326 5.6326 5.8524 5.8524 6.0803 6.0803 6.4050 6.4050 11.5950 11.5950 11.9509 11.9509 13.4733 13.4733 13.5371 13.5371 14.6538 14.6538 14.7195 14.7195 k = 0.0000 0.2152-0.0000 ( 4312 PWs) bands (ev): -16.4341 -16.4341 -16.3955 -16.3955 -12.7023 -12.7023 -12.6411 -12.6411 -10.7527 -10.7527 -10.4827 -10.4827 -10.1573 -10.1573 -9.9942 -9.9942 -2.1691 -2.1691 -2.1414 -2.1414 -0.5762 -0.5762 -0.5594 -0.5594 -0.5482 -0.5482 0.1394 0.1394 1.3480 1.3480 1.7005 1.7005 2.5169 2.5169 2.9300 2.9300 3.2604 3.2604 3.2661 3.2661 3.4767 3.4767 3.8356 3.8356 4.0346 4.0346 4.5681 4.5681 5.0816 5.0816 5.2217 5.2217 5.5355 5.5355 5.6030 5.6030 5.6199 5.6199 5.8455 5.8455 6.0891 6.0891 6.4470 6.4470 11.5629 11.5629 11.9545 11.9545 13.4702 13.4702 13.5426 13.5426 14.6471 14.6471 14.7180 14.7180 k = 0.0000 0.2062-0.0000 ( 4312 PWs) bands (ev): -16.4384 -16.4384 -16.3969 -16.3969 -12.7016 -12.7016 -12.6351 -12.6351 -10.7687 -10.7687 -10.5002 -10.5002 -10.1305 -10.1305 -9.9734 -9.9734 -2.1771 -2.1771 -2.1468 -2.1468 -0.5789 -0.5789 -0.5707 -0.5707 -0.5607 -0.5607 0.1732 0.1732 1.3123 1.3123 1.7106 1.7106 2.5437 2.5437 2.9349 2.9349 3.2637 3.2637 3.2700 3.2700 3.4343 3.4343 3.8487 3.8487 4.0087 4.0087 4.5802 4.5802 5.0670 5.0670 5.2066 5.2066 5.5532 5.5532 5.5758 5.5758 5.6338 5.6338 5.8405 5.8405 6.0988 6.0988 6.4881 6.4881 11.5293 11.5293 11.9576 11.9576 13.4669 13.4669 13.5485 13.5485 14.6403 14.6403 14.7162 14.7162 k = 0.0000 0.1972-0.0000 ( 4316 PWs) bands (ev): -16.4427 -16.4427 -16.3985 -16.3985 -12.7008 -12.7008 -12.6290 -12.6290 -10.7836 -10.7836 -10.5172 -10.5172 -10.1043 -10.1043 -9.9529 -9.9529 -2.1856 -2.1856 -2.1527 -2.1527 -0.5926 -0.5926 -0.5812 -0.5812 -0.5622 -0.5622 0.2077 0.2077 1.2773 1.2773 1.7212 1.7212 2.5712 2.5712 2.9345 2.9345 3.2673 3.2673 3.2740 3.2740 3.3919 3.3919 3.8634 3.8634 3.9840 3.9840 4.5918 4.5918 5.0530 5.0530 5.1920 5.1920 5.5418 5.5418 5.5746 5.5746 5.6483 5.6483 5.8373 5.8373 6.1097 6.1097 6.5281 6.5281 11.4943 11.4943 11.9603 11.9603 13.4633 13.4633 13.5548 13.5548 14.6335 14.6335 14.7140 14.7140 k = 0.0000 0.1883-0.0000 ( 4316 PWs) bands (ev): -16.4470 -16.4470 -16.4001 -16.4001 -12.6998 -12.6998 -12.6227 -12.6227 -10.7975 -10.7975 -10.5339 -10.5339 -10.0786 -10.0786 -9.9327 -9.9327 -2.1945 -2.1945 -2.1592 -2.1592 -0.6130 -0.6130 -0.5840 -0.5840 -0.5638 -0.5638 0.2429 0.2429 1.2435 1.2435 1.7322 1.7322 2.5978 2.5978 2.9292 2.9292 3.2709 3.2709 3.2780 3.2780 3.3507 3.3507 3.8791 3.8791 3.9607 3.9607 4.6028 4.6028 5.0396 5.0396 5.1777 5.1777 5.5092 5.5092 5.5920 5.5920 5.6625 5.6625 5.8358 5.8358 6.1220 6.1220 6.5668 6.5668 11.4580 11.4580 11.9627 11.9627 13.4594 13.4594 13.5614 13.5614 14.6265 14.6265 14.7116 14.7116 k = 0.0000 0.1793-0.0000 ( 4316 PWs) bands (ev): -16.4514 -16.4514 -16.4019 -16.4019 -12.6989 -12.6989 -12.6165 -12.6165 -10.8104 -10.8104 -10.5501 -10.5501 -10.0536 -10.0536 -9.9129 -9.9129 -2.2038 -2.2038 -2.1662 -2.1662 -0.6323 -0.6323 -0.5867 -0.5867 -0.5654 -0.5654 0.2788 0.2788 1.2111 1.2111 1.7435 1.7435 2.6220 2.6220 2.9195 2.9195 3.2745 3.2745 3.2818 3.2818 3.3124 3.3124 3.8955 3.8955 3.9391 3.9391 4.6130 4.6130 5.0270 5.0270 5.1637 5.1637 5.4741 5.4741 5.6094 5.6094 5.6762 5.6762 5.8357 5.8357 6.1360 6.1360 6.6040 6.6040 11.4206 11.4206 11.9649 11.9649 13.4553 13.4553 13.5685 13.5685 14.6196 14.6196 14.7090 14.7090 k = 0.0000 0.1703-0.0000 ( 4314 PWs) bands (ev): -16.4558 -16.4558 -16.4038 -16.4038 -12.6979 -12.6979 -12.6102 -12.6102 -10.8222 -10.8222 -10.5659 -10.5659 -10.0293 -10.0293 -9.8934 -9.8934 -2.2133 -2.2133 -2.1737 -2.1737 -0.6505 -0.6505 -0.5894 -0.5894 -0.5670 -0.5670 0.3154 0.3154 1.1806 1.1806 1.7549 1.7549 2.6421 2.6421 2.9059 2.9059 3.2753 3.2753 3.2784 3.2784 3.2889 3.2889 3.9120 3.9120 3.9198 3.9198 4.6220 4.6220 5.0149 5.0149 5.1502 5.1502 5.4369 5.4369 5.6264 5.6264 5.6895 5.6895 5.8369 5.8369 6.1519 6.1519 6.6397 6.6397 11.3820 11.3820 11.9669 11.9669 13.4508 13.4508 13.5758 13.5758 14.6128 14.6128 14.7062 14.7062 k = 0.0000 0.1614-0.0000 ( 4312 PWs) bands (ev): -16.4601 -16.4601 -16.4058 -16.4058 -12.6968 -12.6968 -12.6040 -12.6040 -10.8329 -10.8329 -10.5812 -10.5812 -10.0058 -10.0058 -9.8744 -9.8744 -2.2230 -2.2230 -2.1817 -2.1817 -0.6674 -0.6674 -0.5921 -0.5921 -0.5687 -0.5687 0.3525 0.3525 1.1521 1.1521 1.7661 1.7661 2.6558 2.6558 2.8891 2.8891 3.2488 3.2488 3.2820 3.2820 3.2918 3.2918 3.9016 3.9016 3.9298 3.9298 4.6296 4.6296 5.0036 5.0036 5.1371 5.1371 5.3978 5.3978 5.6429 5.6429 5.7023 5.7023 5.8391 5.8391 6.1698 6.1698 6.6736 6.6736 11.3425 11.3425 11.9689 11.9689 13.4462 13.4462 13.5834 13.5834 14.6059 14.6059 14.7032 14.7032 k = 0.0000 0.1524-0.0000 ( 4308 PWs) bands (ev): -16.4643 -16.4643 -16.4078 -16.4078 -12.6958 -12.6958 -12.5978 -12.5978 -10.8426 -10.8426 -10.5960 -10.5960 -9.9832 -9.9832 -9.8559 -9.8559 -2.2328 -2.2328 -2.1901 -2.1901 -0.6831 -0.6831 -0.5948 -0.5948 -0.5704 -0.5704 0.3902 0.3902 1.1257 1.1257 1.7770 1.7770 2.6614 2.6614 2.8695 2.8695 3.2290 3.2290 3.2858 3.2858 3.2959 3.2959 3.8867 3.8867 3.9467 3.9467 4.6357 4.6357 4.9930 4.9930 5.1245 5.1245 5.3568 5.3568 5.6588 5.6588 5.7145 5.7145 5.8422 5.8422 6.1898 6.1898 6.7058 6.7058 11.3023 11.3023 11.9708 11.9708 13.4414 13.4414 13.5913 13.5913 14.5992 14.5992 14.7001 14.7001 k = 0.0000 0.1434-0.0000 ( 4304 PWs) bands (ev): -16.4685 -16.4685 -16.4098 -16.4098 -12.6948 -12.6948 -12.5918 -12.5918 -10.8514 -10.8514 -10.6104 -10.6104 -9.9615 -9.9615 -9.8380 -9.8380 -2.2427 -2.2427 -2.1988 -2.1988 -0.6976 -0.6976 -0.5974 -0.5974 -0.5720 -0.5720 0.4283 0.4283 1.1017 1.1017 1.7874 1.7874 2.6576 2.6576 2.8477 2.8477 3.2180 3.2180 3.2895 3.2895 3.3001 3.3001 3.8749 3.8749 3.9636 3.9636 4.6398 4.6398 4.9831 4.9831 5.1124 5.1124 5.3140 5.3140 5.6741 5.6741 5.7262 5.7262 5.8459 5.8459 6.2119 6.2119 6.7362 6.7362 11.2615 11.2615 11.9727 11.9727 13.4364 13.4364 13.5993 13.5993 14.5926 14.5926 14.6970 14.6970 k = 0.0000 0.1345-0.0000 ( 4302 PWs) bands (ev): -16.4725 -16.4725 -16.4119 -16.4119 -12.6939 -12.6939 -12.5859 -12.5859 -10.8591 -10.8591 -10.6241 -10.6241 -9.9409 -9.9409 -9.8208 -9.8208 -2.2525 -2.2525 -2.2078 -2.2078 -0.7109 -0.7109 -0.6000 -0.6000 -0.5737 -0.5737 0.4667 0.4667 1.0800 1.0800 1.7971 1.7971 2.6443 2.6443 2.8243 2.8243 3.2158 3.2158 3.2931 3.2931 3.3043 3.3043 3.8667 3.8667 3.9803 3.9803 4.6420 4.6420 4.9738 4.9738 5.1007 5.1007 5.2695 5.2695 5.6888 5.6888 5.7372 5.7372 5.8501 5.8501 6.2360 6.2360 6.7647 6.7647 11.2206 11.2206 11.9746 11.9746 13.4313 13.4313 13.6074 13.6074 14.5862 14.5862 14.6937 14.6937 k = 0.0000 0.1255-0.0000 ( 4302 PWs) bands (ev): -16.4764 -16.4764 -16.4139 -16.4139 -12.6930 -12.6930 -12.5802 -12.5802 -10.8659 -10.8659 -10.6374 -10.6374 -9.9212 -9.9212 -9.8043 -9.8043 -2.2622 -2.2622 -2.2170 -2.2170 -0.7229 -0.7229 -0.6025 -0.6025 -0.5754 -0.5754 0.5052 0.5052 1.0608 1.0608 1.8060 1.8060 2.6226 2.6226 2.7998 2.7998 3.2209 3.2209 3.2967 3.2967 3.3084 3.3084 3.8627 3.8627 3.9967 3.9967 4.6420 4.6420 4.9653 4.9653 5.0896 5.0896 5.2234 5.2234 5.7027 5.7027 5.7477 5.7477 5.8547 5.8547 6.2618 6.2618 6.7913 6.7913 11.1796 11.1796 11.9765 11.9765 13.4261 13.4261 13.6155 13.6155 14.5801 14.5801 14.6905 14.6905 k = 0.0000 0.1165-0.0000 ( 4302 PWs) bands (ev): -16.4802 -16.4802 -16.4159 -16.4159 -12.6921 -12.6921 -12.5748 -12.5748 -10.8718 -10.8718 -10.6500 -10.6500 -9.9027 -9.9027 -9.7885 -9.7885 -2.2717 -2.2717 -2.2263 -2.2263 -0.7338 -0.7338 -0.6049 -0.6049 -0.5770 -0.5770 0.5435 0.5435 1.0439 1.0439 1.8138 1.8138 2.5944 2.5944 2.7746 2.7746 3.2312 3.2312 3.3001 3.3001 3.3123 3.3123 3.8635 3.8635 4.0129 4.0129 4.6398 4.6398 4.9575 4.9575 5.0790 5.0790 5.1759 5.1759 5.7159 5.7159 5.7575 5.7575 5.8595 5.8595 6.2891 6.2891 6.8159 6.8159 11.1391 11.1391 11.9785 11.9785 13.4210 13.4210 13.6235 13.6235 14.5742 14.5742 14.6873 14.6873 k = 0.0000 0.1076-0.0000 ( 4290 PWs) bands (ev): -16.4837 -16.4837 -16.4178 -16.4178 -12.6913 -12.6913 -12.5696 -12.5696 -10.8768 -10.8768 -10.6621 -10.6621 -9.8854 -9.8854 -9.7736 -9.7736 -2.2809 -2.2809 -2.2356 -2.2356 -0.7435 -0.7435 -0.6072 -0.6072 -0.5786 -0.5786 0.5816 0.5816 1.0294 1.0294 1.8205 1.8205 2.5616 2.5616 2.7491 2.7491 3.2442 3.2442 3.3034 3.3034 3.3161 3.3161 3.8698 3.8698 4.0289 4.0289 4.6356 4.6356 4.9504 4.9504 5.0689 5.0689 5.1271 5.1271 5.7283 5.7283 5.7666 5.7666 5.8643 5.8643 6.3174 6.3174 6.8385 6.8385 11.0993 11.0993 11.9805 11.9805 13.4159 13.4159 13.6313 13.6313 14.5686 14.5686 14.6842 14.6842 k = 0.0000 0.0986-0.0000 ( 4290 PWs) bands (ev): -16.4871 -16.4871 -16.4196 -16.4196 -12.6905 -12.6905 -12.5646 -12.5646 -10.8810 -10.8810 -10.6735 -10.6735 -9.8693 -9.8693 -9.7596 -9.7596 -2.2896 -2.2896 -2.2447 -2.2447 -0.7522 -0.7522 -0.6093 -0.6093 -0.5801 -0.5801 0.6189 0.6189 1.0172 1.0172 1.8259 1.8259 2.5262 2.5262 2.7240 2.7240 3.2579 3.2579 3.3065 3.3065 3.3198 3.3198 3.8820 3.8820 4.0447 4.0447 4.6295 4.6295 4.9439 4.9439 5.0589 5.0589 5.0777 5.0777 5.7400 5.7400 5.7750 5.7750 5.8691 5.8691 6.3464 6.3464 6.8592 6.8592 11.0606 11.0606 11.9824 11.9824 13.4109 13.4109 13.6389 13.6389 14.5633 14.5633 14.6812 14.6812 k = 0.0000 0.0896-0.0000 ( 4286 PWs) bands (ev): -16.4902 -16.4902 -16.4214 -16.4214 -12.6899 -12.6899 -12.5600 -12.5600 -10.8845 -10.8845 -10.6842 -10.6842 -9.8544 -9.8544 -9.7466 -9.7466 -2.2980 -2.2980 -2.2535 -2.2535 -0.7598 -0.7598 -0.6113 -0.6113 -0.5815 -0.5815 0.6554 0.6554 1.0070 1.0070 1.8300 1.8300 2.4899 2.4899 2.6995 2.6995 3.2707 3.2707 3.3094 3.3094 3.3232 3.3232 3.9001 3.9001 4.0603 4.0603 4.6217 4.6217 4.9381 4.9381 5.0250 5.0250 5.0519 5.0519 5.7508 5.7508 5.7827 5.7827 5.8738 5.8738 6.3754 6.3754 6.8780 6.8780 11.0234 11.0234 11.9844 11.9844 13.4062 13.4062 13.6461 13.6461 14.5583 14.5583 14.6782 14.6782 k = 0.0000 0.0807-0.0000 ( 4274 PWs) bands (ev): -16.4931 -16.4931 -16.4230 -16.4230 -12.6893 -12.6893 -12.5558 -12.5558 -10.8872 -10.8872 -10.6941 -10.6941 -9.8408 -9.8408 -9.7346 -9.7346 -2.3058 -2.3058 -2.2619 -2.2619 -0.7665 -0.7665 -0.6132 -0.6132 -0.5827 -0.5827 0.6905 0.6905 0.9989 0.9989 1.8328 1.8328 2.4538 2.4538 2.6760 2.6760 3.2818 3.2818 3.3121 3.3121 3.3264 3.3264 3.9241 3.9241 4.0756 4.0756 4.6124 4.6124 4.9330 4.9330 4.9738 4.9738 5.0435 5.0435 5.7607 5.7607 5.7896 5.7896 5.8783 5.8783 6.4039 6.4039 6.8948 6.8948 10.9881 10.9881 11.9863 11.9863 13.4017 13.4017 13.6530 13.6530 14.5538 14.5538 14.6755 14.6755 k = 0.0000 0.0717-0.0000 ( 4286 PWs) bands (ev): -16.4958 -16.4958 -16.4245 -16.4245 -12.6887 -12.6887 -12.5519 -12.5519 -10.8894 -10.8894 -10.7033 -10.7033 -9.8285 -9.8285 -9.7237 -9.7237 -2.3129 -2.3129 -2.2699 -2.2699 -0.7723 -0.7723 -0.6150 -0.6150 -0.5840 -0.5840 0.7238 0.7238 0.9925 0.9925 1.8344 1.8344 2.4190 2.4190 2.6540 2.6540 3.2906 3.2906 3.3146 3.3146 3.3292 3.3292 3.9533 3.9533 4.0906 4.0906 4.6021 4.6021 4.9215 4.9215 4.9288 4.9288 5.0361 5.0361 5.7698 5.7698 5.7957 5.7957 5.8824 5.8824 6.4314 6.4314 6.9097 6.9097 10.9551 10.9551 11.9881 11.9881 13.3974 13.3974 13.6592 13.6592 14.5495 14.5495 14.6729 14.6729 k = 0.0000 0.0628-0.0000 ( 4292 PWs) bands (ev): -16.4982 -16.4982 -16.4259 -16.4259 -12.6883 -12.6883 -12.5484 -12.5484 -10.8910 -10.8910 -10.7116 -10.7116 -9.8176 -9.8176 -9.7140 -9.7140 -2.3194 -2.3194 -2.2772 -2.2772 -0.7773 -0.7773 -0.6165 -0.6165 -0.5851 -0.5851 0.7550 0.7550 0.9876 0.9876 1.8348 1.8348 2.3864 2.3864 2.6338 2.6338 3.2973 3.2973 3.3168 3.3168 3.3318 3.3318 3.9871 3.9871 4.1049 4.1049 4.5911 4.5911 4.8696 4.8696 4.9247 4.9247 5.0295 5.0295 5.7780 5.7780 5.8011 5.8011 5.8863 5.8863 6.4573 6.4573 6.9227 6.9227 10.9248 10.9248 11.9898 11.9898 13.3936 13.3936 13.6650 13.6650 14.5458 14.5458 14.6706 14.6706 k = 0.0000 0.0538-0.0000 ( 4292 PWs) bands (ev): -16.5002 -16.5002 -16.4271 -16.4271 -12.6879 -12.6879 -12.5453 -12.5453 -10.8922 -10.8922 -10.7190 -10.7190 -9.8080 -9.8080 -9.7054 -9.7054 -2.3252 -2.3252 -2.2838 -2.2838 -0.7815 -0.7815 -0.6179 -0.6179 -0.5860 -0.5860 0.7836 0.7836 0.9841 0.9841 1.8342 1.8342 2.3567 2.3567 2.6157 2.6157 3.3020 3.3020 3.3186 3.3186 3.3341 3.3341 4.0242 4.0242 4.1186 4.1186 4.5799 4.5799 4.8181 4.8181 4.9214 4.9214 5.0238 5.0238 5.7852 5.7852 5.8056 5.8056 5.8897 5.8897 6.4811 6.4811 6.9338 6.9338 10.8976 10.8976 11.9914 11.9914 13.3901 13.3901 13.6701 13.6701 14.5425 14.5425 14.6685 14.6685 k = 0.0000 0.0448-0.0000 ( 4293 PWs) bands (ev): -16.5020 -16.5020 -16.4281 -16.4281 -12.6875 -12.6875 -12.5427 -12.5427 -10.8930 -10.8930 -10.7254 -10.7254 -9.7999 -9.7999 -9.6981 -9.6981 -2.3301 -2.3301 -2.2895 -2.2895 -0.7849 -0.7849 -0.6190 -0.6190 -0.5869 -0.5869 0.8089 0.8089 0.9817 0.9817 1.8329 1.8329 2.3305 2.3305 2.6000 2.6000 3.3050 3.3050 3.3202 3.3202 3.3361 3.3361 4.0633 4.0633 4.1311 4.1311 4.5690 4.5690 4.7680 4.7680 4.9186 4.9186 5.0188 5.0188 5.7915 5.7915 5.8094 5.8094 5.8926 5.8926 6.5022 6.5022 6.9432 6.9432 10.8739 10.8739 11.9928 11.9928 13.3871 13.3871 13.6745 13.6745 14.5397 14.5397 14.6667 14.6667 k = 0.0000 0.0359-0.0000 ( 4301 PWs) bands (ev): -16.5035 -16.5035 -16.4290 -16.4290 -12.6873 -12.6873 -12.5406 -12.5406 -10.8935 -10.8935 -10.7308 -10.7308 -9.7933 -9.7933 -9.6921 -9.6921 -2.3343 -2.3343 -2.2944 -2.2944 -0.7877 -0.7877 -0.6200 -0.6200 -0.5876 -0.5876 0.8306 0.8306 0.9801 0.9801 1.8312 1.8312 2.3083 2.3083 2.5869 2.5869 3.3069 3.3069 3.3215 3.3215 3.3377 3.3377 4.1024 4.1024 4.1423 4.1423 4.5590 4.5590 4.7205 4.7205 4.9165 4.9165 5.0147 5.0147 5.7968 5.7968 5.8124 5.8124 5.8951 5.8951 6.5202 6.5202 6.9507 6.9507 10.8540 10.8540 11.9939 11.9939 13.3846 13.3846 13.6781 13.6781 14.5373 14.5373 14.6651 14.6651 k = 0.0000 0.0269-0.0000 ( 4301 PWs) bands (ev): -16.5047 -16.5047 -16.4296 -16.4296 -12.6871 -12.6871 -12.5389 -12.5389 -10.8938 -10.8938 -10.7351 -10.7351 -9.7880 -9.7880 -9.6874 -9.6874 -2.3375 -2.3375 -2.2982 -2.2982 -0.7898 -0.7898 -0.6207 -0.6207 -0.5881 -0.5881 0.8481 0.8481 0.9791 0.9791 1.8293 1.8293 2.2906 2.2906 2.5765 2.5765 3.3080 3.3080 3.3226 3.3226 3.3390 3.3390 4.1393 4.1393 4.1518 4.1518 4.5503 4.5503 4.6775 4.6775 4.9148 4.9148 5.0115 5.0115 5.8010 5.8010 5.8146 5.8146 5.8971 5.8971 6.5347 6.5347 6.9565 6.9565 10.8382 10.8382 11.9949 11.9949 13.3826 13.3826 13.6810 13.6810 14.5354 14.5354 14.6640 14.6640 k = 0.0000 0.0179-0.0000 ( 4297 PWs) bands (ev): -16.5055 -16.5055 -16.4301 -16.4301 -12.6869 -12.6869 -12.5376 -12.5376 -10.8940 -10.8940 -10.7382 -10.7382 -9.7843 -9.7843 -9.6840 -9.6840 -2.3399 -2.3399 -2.3010 -2.3010 -0.7912 -0.7912 -0.6213 -0.6213 -0.5885 -0.5885 0.8609 0.8609 0.9786 0.9786 1.8278 1.8278 2.2778 2.2778 2.5690 2.5690 3.3086 3.3086 3.3233 3.3233 3.3400 3.3400 4.1582 4.1582 4.1715 4.1715 4.5437 4.5437 4.6419 4.6419 4.9136 4.9136 5.0092 5.0092 5.8042 5.8042 5.8161 5.8161 5.8985 5.8985 6.5453 6.5453 6.9607 6.9607 10.8267 10.8267 11.9956 11.9956 13.3812 13.3812 13.6831 13.6831 14.5341 14.5341 14.6631 14.6631 k = 0.0000 0.0090-0.0000 ( 4299 PWs) bands (ev): -16.5060 -16.5060 -16.4304 -16.4304 -12.6868 -12.6868 -12.5369 -12.5369 -10.8940 -10.8940 -10.7400 -10.7400 -9.7821 -9.7821 -9.6820 -9.6820 -2.3413 -2.3413 -2.3027 -2.3027 -0.7921 -0.7921 -0.6216 -0.6216 -0.5887 -0.5887 0.8688 0.8688 0.9784 0.9784 1.8267 1.8267 2.2699 2.2699 2.5645 2.5645 3.3088 3.3088 3.3238 3.3238 3.3405 3.3405 4.1628 4.1628 4.1933 4.1933 4.5395 4.5395 4.6177 4.6177 4.9129 4.9129 5.0078 5.0078 5.8061 5.8061 5.8169 5.8169 5.8993 5.8993 6.5517 6.5517 6.9631 6.9631 10.8198 10.8198 11.9960 11.9960 13.3804 13.3804 13.6844 13.6844 14.5333 14.5333 14.6626 14.6626 k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -16.5062 -16.5062 -16.4305 -16.4305 -12.6868 -12.6868 -12.5367 -12.5367 -10.8940 -10.8940 -10.7407 -10.7407 -9.7813 -9.7813 -9.6813 -9.6813 -2.3417 -2.3417 -2.3032 -2.3032 -0.7924 -0.7924 -0.6217 -0.6217 -0.5888 -0.5888 0.8714 0.8714 0.9783 0.9783 1.8263 1.8263 2.2673 2.2673 2.5630 2.5630 3.3089 3.3089 3.3239 3.3239 3.3407 3.3407 4.1643 4.1643 4.2013 4.2013 4.5380 4.5380 4.6090 4.6090 4.9127 4.9127 5.0073 5.0073 5.8068 5.8068 5.8172 5.8172 5.8996 5.8996 6.5539 6.5539 6.9640 6.9640 10.8174 10.8174 11.9961 11.9961 13.3801 13.3801 13.6848 13.6848 14.5331 14.5331 14.6624 14.6624 k = 0.0000 0.0000 0.0000 ( 4295 PWs) bands (ev): -16.5062 -16.5062 -16.4305 -16.4305 -12.6868 -12.6868 -12.5367 -12.5367 -10.8940 -10.8940 -10.7407 -10.7407 -9.7813 -9.7813 -9.6813 -9.6813 -2.3417 -2.3417 -2.3032 -2.3032 -0.7924 -0.7924 -0.6217 -0.6217 -0.5888 -0.5888 0.8714 0.8714 0.9783 0.9783 1.8263 1.8263 2.2673 2.2673 2.5630 2.5630 3.3089 3.3089 3.3239 3.3239 3.3407 3.3407 4.1643 4.1643 4.2013 4.2013 4.5380 4.5380 4.6090 4.6090 4.9127 4.9127 5.0073 5.0073 5.8068 5.8068 5.8172 5.8172 5.8996 5.8996 6.5539 6.5539 6.9640 6.9640 10.8174 10.8174 11.9961 11.9961 13.3801 13.3801 13.6848 13.6848 14.5331 14.5331 14.6624 14.6624 k = 0.0000 0.0000 0.0089 ( 4303 PWs) bands (ev): -16.5060 -16.5060 -16.4307 -16.4307 -12.6865 -12.6865 -12.5370 -12.5370 -10.8938 -10.8938 -10.7411 -10.7411 -9.7810 -9.7810 -9.6814 -9.6814 -2.3417 -2.3417 -2.3033 -2.3033 -0.7905 -0.7905 -0.6217 -0.6217 -0.5889 -0.5889 0.8318 0.8318 1.0169 1.0169 1.8249 1.8249 2.2703 2.2703 2.5629 2.5629 3.3077 3.3077 3.3240 3.3240 3.3407 3.3407 4.1241 4.1241 4.2393 4.2393 4.5377 4.5377 4.6129 4.6129 4.9128 4.9128 5.0071 5.0071 5.8068 5.8068 5.8171 5.8171 5.8964 5.8964 6.5545 6.5545 6.9629 6.9629 10.8203 10.8203 11.9938 11.9938 13.3808 13.3808 13.6843 13.6843 14.5334 14.5334 14.6622 14.6622 k = 0.0000 0.0000 0.0178 ( 4307 PWs) bands (ev): -16.5055 -16.5055 -16.4312 -16.4312 -12.6854 -12.6854 -12.5378 -12.5378 -10.8931 -10.8931 -10.7425 -10.7425 -9.7800 -9.7800 -9.6818 -9.6818 -2.3416 -2.3416 -2.3037 -2.3037 -0.7847 -0.7847 -0.6215 -0.6215 -0.5891 -0.5891 0.7629 0.7629 1.0827 1.0827 1.8210 1.8210 2.2792 2.2792 2.5626 2.5626 3.3043 3.3043 3.3241 3.3241 3.3406 3.3406 4.0680 4.0680 4.2892 4.2892 4.5377 4.5377 4.6237 4.6237 4.9133 4.9133 5.0063 5.0063 5.8070 5.8070 5.8169 5.8169 5.8869 5.8869 6.5564 6.5564 6.9597 6.9597 10.8288 10.8288 11.9868 11.9868 13.3831 13.3831 13.6828 13.6828 14.5342 14.5342 14.6613 14.6613 k = 0.0000 0.0000 0.0267 ( 4291 PWs) bands (ev): -16.5048 -16.5048 -16.4320 -16.4320 -12.6837 -12.6837 -12.5393 -12.5393 -10.8920 -10.8920 -10.7448 -10.7448 -9.7784 -9.7784 -9.6824 -9.6824 -2.3414 -2.3414 -2.3042 -2.3042 -0.7752 -0.7752 -0.6211 -0.6211 -0.5894 -0.5894 0.6890 0.6890 1.1515 1.1515 1.8148 1.8148 2.2936 2.2936 2.5625 2.5625 3.2985 3.2985 3.3244 3.3244 3.3405 3.3405 4.0092 4.0092 4.3376 4.3376 4.5397 4.5397 4.6396 4.6396 4.9142 4.9142 5.0052 5.0052 5.8072 5.8072 5.8164 5.8164 5.8713 5.8713 6.5595 6.5595 6.9544 6.9544 10.8429 10.8429 11.9751 11.9751 13.3868 13.3868 13.6803 13.6803 14.5356 14.5356 14.6600 14.6600 k = 0.0000 0.0000 0.0356 ( 4293 PWs) bands (ev): -16.5037 -16.5037 -16.4332 -16.4332 -12.6814 -12.6814 -12.5413 -12.5413 -10.8904 -10.8904 -10.7478 -10.7478 -9.7762 -9.7762 -9.6833 -9.6833 -2.3411 -2.3411 -2.3050 -2.3050 -0.7618 -0.7618 -0.6206 -0.6206 -0.5899 -0.5899 0.6136 0.6136 1.2192 1.2192 1.8069 1.8069 2.3128 2.3128 2.5631 2.5631 3.2900 3.2900 3.3247 3.3247 3.3403 3.3403 3.9484 3.9484 4.3839 4.3839 4.5453 4.5453 4.6590 4.6590 4.9153 4.9153 5.0035 5.0035 5.8076 5.8076 5.8150 5.8150 5.8504 5.8504 6.5640 6.5640 6.9472 6.9472 10.8623 10.8623 11.9590 11.9590 13.3920 13.3920 13.6767 13.6767 14.5375 14.5375 14.6581 14.6581 k = 0.0000 0.0000 0.0445 ( 4285 PWs) bands (ev): -16.5023 -16.5023 -16.4346 -16.4346 -12.6784 -12.6784 -12.5439 -12.5439 -10.8884 -10.8884 -10.7517 -10.7517 -9.7734 -9.7734 -9.6845 -9.6845 -2.3408 -2.3408 -2.3059 -2.3059 -0.7447 -0.7447 -0.6200 -0.6200 -0.5905 -0.5905 0.5380 0.5380 1.2843 1.2843 1.7978 1.7978 2.3363 2.3363 2.5652 2.5652 3.2788 3.2788 3.3251 3.3251 3.3401 3.3401 3.8861 3.8861 4.4277 4.4277 4.5550 4.5550 4.6810 4.6810 4.9168 4.9168 5.0015 5.0015 5.8078 5.8078 5.8082 5.8082 5.8294 5.8294 6.5697 6.5697 6.9380 6.9380 10.8868 10.8868 11.9384 11.9384 13.3986 13.3986 13.6722 13.6722 14.5399 14.5399 14.6557 14.6557 k = 0.0000 0.0000 0.0534 ( 4287 PWs) bands (ev): -16.5007 -16.5007 -16.4364 -16.4364 -12.6748 -12.6748 -12.5471 -12.5471 -10.8859 -10.8859 -10.7563 -10.7563 -9.7702 -9.7702 -9.6859 -9.6859 -2.3403 -2.3403 -2.3071 -2.3071 -0.7239 -0.7239 -0.6193 -0.6193 -0.5913 -0.5913 0.4627 0.4627 1.3461 1.3461 1.7881 1.7881 2.3633 2.3633 2.5693 2.5693 3.2648 3.2648 3.3255 3.3255 3.3398 3.3398 3.8224 3.8224 4.4689 4.4689 4.5690 4.5690 4.7049 4.7049 4.9186 4.9186 4.9990 4.9990 5.7818 5.7818 5.8086 5.8086 5.8218 5.8218 6.5767 6.5767 6.9269 6.9269 10.9161 10.9161 11.9136 11.9136 13.4064 13.4064 13.6666 13.6666 14.5428 14.5428 14.6527 14.6527 k = 0.0000 0.0000 0.0623 ( 4289 PWs) bands (ev): -16.4988 -16.4988 -16.4384 -16.4384 -12.6706 -12.6706 -12.5507 -12.5507 -10.8829 -10.8829 -10.7616 -10.7616 -9.7665 -9.7665 -9.6876 -9.6876 -2.3398 -2.3398 -2.3084 -2.3084 -0.6996 -0.6996 -0.6184 -0.6184 -0.5922 -0.5922 0.3881 0.3881 1.4036 1.4036 1.7782 1.7782 2.3932 2.3932 2.5763 2.5763 3.2479 3.2479 3.3260 3.3260 3.3394 3.3394 3.7577 3.7577 4.5073 4.5073 4.5870 4.5870 4.7308 4.7308 4.9207 4.9207 4.9961 4.9961 5.7445 5.7445 5.8092 5.8092 5.8202 5.8202 6.5850 6.5850 6.9142 6.9142 10.9499 10.9499 11.8848 11.8848 13.4155 13.4155 13.6600 13.6600 14.5462 14.5462 14.6494 14.6494 k = 0.0000 0.0000 0.0712 ( 4293 PWs) bands (ev): -16.4966 -16.4966 -16.4407 -16.4407 -12.6659 -12.6659 -12.5549 -12.5549 -10.8795 -10.8795 -10.7674 -10.7674 -9.7624 -9.7624 -9.6896 -9.6896 -2.3391 -2.3391 -2.3098 -2.3098 -0.6717 -0.6717 -0.6175 -0.6175 -0.5932 -0.5932 0.3143 0.3143 1.4562 1.4562 1.7685 1.7685 2.4255 2.4255 2.5868 2.5868 3.2285 3.2285 3.3266 3.3266 3.3390 3.3390 3.6921 3.6921 4.5430 4.5430 4.6079 4.6079 4.7588 4.7588 4.9231 4.9231 4.9929 4.9929 5.7015 5.7015 5.8098 5.8098 5.8196 5.8196 6.5947 6.5947 6.8999 6.8999 10.9876 10.9876 11.8522 11.8522 13.4257 13.4257 13.6524 13.6524 14.5500 14.5500 14.6455 14.6455 k = 0.0000 0.0000 0.0801 ( 4299 PWs) bands (ev): -16.4942 -16.4942 -16.4433 -16.4433 -12.6607 -12.6607 -12.5595 -12.5595 -10.8757 -10.8757 -10.7737 -10.7737 -9.7580 -9.7580 -9.6918 -9.6918 -2.3383 -2.3383 -2.3115 -2.3115 -0.6404 -0.6404 -0.6164 -0.6164 -0.5943 -0.5943 0.2417 0.2417 1.5035 1.5035 1.7591 1.7591 2.4595 2.4595 2.6013 2.6013 3.2071 3.2071 3.3272 3.3272 3.3386 3.3386 3.6261 3.6261 4.5757 4.5757 4.6305 4.6305 4.7897 4.7897 4.9258 4.9258 4.9895 4.9895 5.6539 5.6539 5.8105 5.8105 5.8192 5.8192 6.6056 6.6056 6.8843 6.8843 11.0290 11.0290 11.8159 11.8159 13.4369 13.4369 13.6438 13.6438 14.5542 14.5542 14.6413 14.6413 k = 0.0000 0.0000 0.0890 ( 4285 PWs) bands (ev): -16.4915 -16.4915 -16.4460 -16.4460 -12.6551 -12.6551 -12.5646 -12.5646 -10.8714 -10.8714 -10.7804 -10.7804 -9.7534 -9.7534 -9.6944 -9.6944 -2.3373 -2.3373 -2.3132 -2.3132 -0.6153 -0.6153 -0.6057 -0.6057 -0.5954 -0.5954 0.1704 0.1704 1.5449 1.5449 1.7502 1.7502 2.4949 2.4949 2.6196 2.6196 3.1845 3.1845 3.3279 3.3279 3.3381 3.3381 3.5599 3.5599 4.6054 4.6054 4.6530 4.6530 4.8242 4.8242 4.9288 4.9288 4.9857 4.9857 5.6025 5.6025 5.8112 5.8112 5.8190 5.8190 6.6178 6.6178 6.8675 6.8675 11.0736 11.0736 11.7765 11.7765 13.4490 13.4490 13.6343 13.6343 14.5588 14.5588 14.6368 14.6368 k = 0.0000 0.0000 0.0979 ( 4279 PWs) bands (ev): -16.4887 -16.4887 -16.4489 -16.4489 -12.6492 -12.6492 -12.5700 -12.5700 -10.8667 -10.8667 -10.7873 -10.7873 -9.7486 -9.7486 -9.6972 -9.6972 -2.3362 -2.3362 -2.3150 -2.3150 -0.6140 -0.6140 -0.5967 -0.5967 -0.5677 -0.5677 0.1006 0.1006 1.5805 1.5805 1.7419 1.7419 2.5309 2.5309 2.6414 2.6414 3.1619 3.1619 3.3286 3.3286 3.3376 3.3376 3.4942 3.4942 4.6321 4.6321 4.6738 4.6738 4.8630 4.8630 4.9320 4.9320 4.9818 4.9818 5.5479 5.5479 5.8120 5.8120 5.8187 5.8187 6.6313 6.6313 6.8496 6.8496 11.1208 11.1208 11.7340 11.7340 13.4618 13.4618 13.6239 13.6239 14.5638 14.5638 14.6319 14.6319 k = 0.0000 0.0000 0.1067 ( 4275 PWs) bands (ev): -16.4857 -16.4857 -16.4520 -16.4520 -12.6429 -12.6429 -12.5759 -12.5759 -10.8616 -10.8616 -10.7945 -10.7945 -9.7437 -9.7437 -9.7003 -9.7003 -2.3349 -2.3349 -2.3169 -2.3169 -0.6127 -0.6127 -0.5980 -0.5980 -0.5267 -0.5267 0.0325 0.0325 1.6105 1.6105 1.7341 1.7341 2.5671 2.5671 2.6652 2.6652 3.1408 3.1408 3.3292 3.3292 3.3370 3.3370 3.4295 3.4295 4.6555 4.6555 4.6915 4.6915 4.9068 4.9068 4.9355 4.9355 4.9777 4.9777 5.4905 5.4905 5.8127 5.8127 5.8184 5.8184 6.6459 6.6459 6.8310 6.8310 11.1703 11.1703 11.6888 11.6888 13.4753 13.4753 13.6127 13.6127 14.5691 14.5691 14.6267 14.6267 k = 0.0000 0.0000 0.1156 ( 4270 PWs) bands (ev): -16.4826 -16.4826 -16.4553 -16.4553 -12.6363 -12.6363 -12.5820 -12.5820 -10.8561 -10.8561 -10.8018 -10.8018 -9.7388 -9.7388 -9.7037 -9.7037 -2.3335 -2.3335 -2.3189 -2.3189 -0.6113 -0.6113 -0.5994 -0.5994 -0.4826 -0.4826 -0.0338 -0.0338 1.6352 1.6352 1.7267 1.7267 2.6026 2.6026 2.6887 2.6887 3.1239 3.1239 3.3295 3.3295 3.3363 3.3363 3.3670 3.3670 4.6756 4.6756 4.7055 4.7055 4.9392 4.9392 4.9549 4.9549 4.9739 4.9739 5.4310 5.4310 5.8135 5.8135 5.8181 5.8181 6.6616 6.6616 6.8118 6.8118 11.2215 11.2215 11.6413 11.6413 13.4892 13.4892 13.6006 13.6006 14.5746 14.5746 14.6213 14.6213 k = 0.0000 0.0000 0.1245 ( 4278 PWs) bands (ev): -16.4793 -16.4793 -16.4586 -16.4586 -12.6296 -12.6296 -12.5884 -12.5884 -10.8502 -10.8502 -10.8091 -10.8091 -9.7339 -9.7339 -9.7073 -9.7073 -2.3320 -2.3320 -2.3209 -2.3209 -0.6099 -0.6099 -0.6009 -0.6009 -0.4355 -0.4355 -0.0981 -0.0981 1.6552 1.6552 1.7194 1.7194 2.6365 2.6365 2.7087 2.7087 3.1142 3.1142 3.3047 3.3047 3.3322 3.3322 3.3358 3.3358 4.6923 4.6923 4.7154 4.7154 4.9431 4.9431 4.9686 4.9686 5.0085 5.0085 5.3700 5.3700 5.8142 5.8142 5.8177 5.8177 6.6784 6.6784 6.7923 6.7923 11.2740 11.2740 11.5918 11.5918 13.5034 13.5034 13.5879 13.5879 14.5802 14.5802 14.6155 14.6155 k = 0.0000 0.0000 0.1334 ( 4276 PWs) bands (ev): -16.4759 -16.4759 -16.4620 -16.4620 -12.6227 -12.6227 -12.5951 -12.5951 -10.8440 -10.8440 -10.8164 -10.8164 -9.7290 -9.7290 -9.7112 -9.7112 -2.3303 -2.3303 -2.3228 -2.3228 -0.6084 -0.6084 -0.6024 -0.6024 -0.3857 -0.3857 -0.1603 -0.1603 1.6713 1.6713 1.7120 1.7120 2.6675 2.6675 2.7211 2.7211 3.1154 3.1154 3.2494 3.2494 3.3322 3.3322 3.3351 3.3351 4.7054 4.7054 4.7212 4.7212 4.9471 4.9471 4.9644 4.9644 5.0645 5.0645 5.3081 5.3081 5.8149 5.8149 5.8172 5.8172 6.6960 6.6960 6.7725 6.7725 11.3274 11.3274 11.5406 11.5406 13.5178 13.5178 13.5746 13.5746 14.5860 14.5860 14.6097 14.6097 k = 0.0000 0.0000 0.1423 ( 4276 PWs) bands (ev): -16.4725 -16.4725 -16.4655 -16.4655 -12.6157 -12.6157 -12.6019 -12.6019 -10.8374 -10.8374 -10.8236 -10.8236 -9.7243 -9.7243 -9.7154 -9.7154 -2.3286 -2.3286 -2.3248 -2.3248 -0.6069 -0.6069 -0.6039 -0.6039 -0.3331 -0.3331 -0.2203 -0.2203 1.6844 1.6844 1.7041 1.7041 2.6939 2.6939 2.7228 2.7228 3.1303 3.1303 3.1999 3.1999 3.3329 3.3329 3.3343 3.3343 4.7150 4.7150 4.7230 4.7230 4.9513 4.9513 4.9600 4.9600 5.1234 5.1234 5.2459 5.2459 5.8156 5.8156 5.8167 5.8167 6.7144 6.7144 6.7528 6.7528 11.3812 11.3812 11.4882 11.4882 13.5323 13.5323 13.5608 13.5608 14.5919 14.5919 14.6038 14.6038 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -16.4690 -16.4690 -16.4690 -16.4690 -12.6088 -12.6088 -12.6088 -12.6088 -10.8306 -10.8306 -10.8306 -10.8306 -9.7198 -9.7198 -9.7198 -9.7198 -2.3267 -2.3267 -2.3267 -2.3267 -0.6054 -0.6054 -0.6054 -0.6054 -0.2779 -0.2779 -0.2779 -0.2779 1.6950 1.6950 1.6950 1.6950 2.7132 2.7132 2.7132 2.7132 3.1592 3.1592 3.1592 3.1592 3.3336 3.3336 3.3336 3.3336 4.7209 4.7209 4.7209 4.7209 4.9556 4.9556 4.9556 4.9556 5.1841 5.1841 5.1841 5.1841 5.8162 5.8162 5.8162 5.8162 6.7334 6.7334 6.7334 6.7334 11.4349 11.4349 11.4349 11.4349 13.5467 13.5467 13.5467 13.5467 14.5979 14.5979 14.5979 14.5979 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -16.4690 -16.4690 -16.4690 -16.4690 -12.6088 -12.6088 -12.6088 -12.6088 -10.8306 -10.8306 -10.8306 -10.8306 -9.7198 -9.7198 -9.7198 -9.7198 -2.3267 -2.3267 -2.3267 -2.3267 -0.6054 -0.6054 -0.6054 -0.6054 -0.2779 -0.2779 -0.2779 -0.2779 1.6950 1.6950 1.6950 1.6950 2.7132 2.7132 2.7132 2.7132 3.1592 3.1592 3.1592 3.1592 3.3336 3.3336 3.3336 3.3336 4.7209 4.7209 4.7209 4.7209 4.9556 4.9556 4.9556 4.9556 5.1841 5.1841 5.1841 5.1841 5.8162 5.8162 5.8162 5.8162 6.7334 6.7334 6.7334 6.7334 11.4349 11.4349 11.4349 11.4349 13.5467 13.5467 13.5467 13.5467 14.5979 14.5979 14.5979 14.5979 k = 0.0089-0.0000 0.1512 ( 4282 PWs) bands (ev): -16.4681 -16.4681 -16.4681 -16.4681 -12.6089 -12.6089 -12.6089 -12.6089 -10.8301 -10.8301 -10.8301 -10.8301 -9.7196 -9.7196 -9.7195 -9.7195 -2.3266 -2.3266 -2.3266 -2.3266 -0.6112 -0.6112 -0.6111 -0.6111 -0.2759 -0.2759 -0.2756 -0.2756 1.6957 1.6957 1.6961 1.6961 2.7139 2.7139 2.7142 2.7142 3.1597 3.1597 3.1601 3.1601 3.3304 3.3304 3.3309 3.3309 4.7200 4.7200 4.7203 4.7203 4.9518 4.9518 4.9528 4.9528 5.1853 5.1853 5.1861 5.1861 5.8140 5.8140 5.8146 5.8146 6.7332 6.7332 6.7333 6.7333 11.4372 11.4372 11.4373 11.4373 13.5502 13.5502 13.5502 13.5502 14.5953 14.5953 14.5960 14.5960 k = 0.0179-0.0000 0.1512 ( 4282 PWs) bands (ev): -16.4654 -16.4654 -16.4654 -16.4654 -12.6094 -12.6094 -12.6094 -12.6094 -10.8286 -10.8286 -10.8286 -10.8286 -9.7191 -9.7191 -9.7189 -9.7189 -2.3262 -2.3262 -2.3262 -2.3262 -0.6279 -0.6279 -0.6278 -0.6278 -0.2699 -0.2699 -0.2693 -0.2693 1.6981 1.6981 1.6988 1.6988 2.7164 2.7164 2.7171 2.7171 3.1615 3.1615 3.1623 3.1623 3.3213 3.3213 3.3225 3.3225 4.7177 4.7177 4.7184 4.7184 4.9418 4.9418 4.9435 4.9435 5.1895 5.1895 5.1911 5.1911 5.8081 5.8081 5.8093 5.8093 6.7328 6.7328 6.7330 6.7330 11.4441 11.4441 11.4443 11.4443 13.5607 13.5607 13.5608 13.5608 14.5885 14.5885 14.5899 14.5899 k = 0.0268-0.0000 0.1512 ( 4282 PWs) bands (ev): -16.4608 -16.4608 -16.4608 -16.4608 -12.6103 -12.6103 -12.6103 -12.6103 -10.8261 -10.8261 -10.8261 -10.8261 -9.7182 -9.7182 -9.7179 -9.7179 -2.3255 -2.3255 -2.3255 -2.3255 -0.6547 -0.6547 -0.6546 -0.6546 -0.2606 -0.2606 -0.2599 -0.2599 1.7021 1.7021 1.7031 1.7031 2.7207 2.7207 2.7217 2.7217 3.1646 3.1646 3.1659 3.1659 3.3065 3.3065 3.3084 3.3084 4.7138 4.7138 4.7148 4.7148 4.9261 4.9261 4.9286 4.9286 5.1961 5.1961 5.1983 5.1983 5.7986 5.7986 5.8004 5.8004 6.7320 6.7320 6.7323 6.7323 11.4556 11.4556 11.4559 11.4559 13.5780 13.5780 13.5782 13.5782 14.5778 14.5778 14.5799 14.5799 k = 0.0357-0.0000 0.1512 ( 4274 PWs) bands (ev): -16.4544 -16.4544 -16.4544 -16.4544 -12.6115 -12.6115 -12.6115 -12.6115 -10.8226 -10.8226 -10.8225 -10.8225 -9.7169 -9.7169 -9.7165 -9.7165 -2.3245 -2.3245 -2.3245 -2.3245 -0.6903 -0.6903 -0.6903 -0.6903 -0.2490 -0.2490 -0.2481 -0.2481 1.7075 1.7075 1.7088 1.7088 2.7265 2.7265 2.7279 2.7279 3.1686 3.1686 3.1707 3.1707 3.2865 3.2865 3.2893 3.2893 4.7082 4.7082 4.7096 4.7096 4.9059 4.9059 4.9090 4.9090 5.2039 5.2039 5.2066 5.2066 5.7859 5.7859 5.7882 5.7882 6.7310 6.7310 6.7314 6.7314 11.4716 11.4716 11.4720 11.4720 13.6020 13.6020 13.6022 13.6022 14.5639 14.5639 14.5665 14.5665 k = 0.0446-0.0000 0.1512 ( 4270 PWs) bands (ev): -16.4461 -16.4461 -16.4461 -16.4461 -12.6131 -12.6131 -12.6131 -12.6131 -10.8181 -10.8181 -10.8180 -10.8180 -9.7152 -9.7152 -9.7148 -9.7148 -2.3234 -2.3234 -2.3233 -2.3233 -0.7336 -0.7336 -0.7336 -0.7336 -0.2357 -0.2357 -0.2348 -0.2348 1.7141 1.7141 1.7157 1.7157 2.7338 2.7338 2.7355 2.7355 3.1728 3.1728 3.1761 3.1761 3.2619 3.2619 3.2662 3.2662 4.7006 4.7006 4.7025 4.7025 4.8818 4.8818 4.8855 4.8855 5.2121 5.2121 5.2152 5.2152 5.7703 5.7703 5.7732 5.7732 6.7297 6.7297 6.7302 6.7302 11.4920 11.4920 11.4924 11.4924 13.6322 13.6322 13.6325 13.6325 14.5472 14.5472 14.5503 14.5503 k = 0.0536-0.0000 0.1512 ( 4282 PWs) bands (ev): -16.4361 -16.4361 -16.4361 -16.4361 -12.6150 -12.6150 -12.6150 -12.6150 -10.8126 -10.8126 -10.8125 -10.8125 -9.7132 -9.7132 -9.7127 -9.7127 -2.3220 -2.3220 -2.3220 -2.3220 -0.7838 -0.7838 -0.7837 -0.7837 -0.2214 -0.2214 -0.2204 -0.2204 1.7218 1.7218 1.7236 1.7236 2.7423 2.7423 2.7443 2.7443 3.1747 3.1747 3.1801 3.1801 3.2352 3.2352 3.2418 3.2418 4.6906 4.6906 4.6930 4.6930 4.8549 4.8549 4.8591 4.8591 5.2196 5.2196 5.2230 5.2230 5.7523 5.7523 5.7558 5.7558 6.7280 6.7280 6.7286 6.7286 11.5165 11.5165 11.5171 11.5171 13.6681 13.6681 13.6684 13.6684 14.5287 14.5287 14.5322 14.5322 k = 0.0625-0.0000 0.1512 ( 4286 PWs) bands (ev): -16.4243 -16.4243 -16.4242 -16.4242 -12.6174 -12.6174 -12.6174 -12.6174 -10.8061 -10.8061 -10.8059 -10.8059 -9.7109 -9.7109 -9.7102 -9.7102 -2.3205 -2.3205 -2.3204 -2.3204 -0.8399 -0.8399 -0.8397 -0.8397 -0.2061 -0.2061 -0.2051 -0.2051 1.7302 1.7302 1.7322 1.7322 2.7517 2.7517 2.7540 2.7540 3.1658 3.1658 3.1724 3.1724 3.2171 3.2171 3.2250 3.2250 4.6777 4.6777 4.6805 4.6805 4.8262 4.8262 4.8308 4.8308 5.2257 5.2257 5.2293 5.2293 5.7327 5.7327 5.7367 5.7367 6.7260 6.7260 6.7267 6.7267 11.5451 11.5451 11.5458 11.5458 13.7088 13.7088 13.7092 13.7092 14.5095 14.5095 14.5133 14.5133 k = 0.0714-0.0000 0.1512 ( 4284 PWs) bands (ev): -16.4106 -16.4106 -16.4106 -16.4106 -12.6202 -12.6202 -12.6202 -12.6202 -10.7986 -10.7986 -10.7984 -10.7984 -9.7082 -9.7082 -9.7075 -9.7075 -2.3189 -2.3189 -2.3188 -2.3188 -0.9012 -0.9012 -0.9009 -0.9009 -0.1901 -0.1901 -0.1890 -0.1890 1.7391 1.7391 1.7414 1.7414 2.7618 2.7618 2.7644 2.7644 3.1384 3.1384 3.1421 3.1421 3.2188 3.2188 3.2240 3.2240 4.6610 4.6610 4.6642 4.6642 4.7967 4.7967 4.8017 4.8017 5.2294 5.2294 5.2331 5.2331 5.7123 5.7123 5.7168 5.7168 6.7236 6.7236 6.7244 6.7244 11.5775 11.5775 11.5783 11.5783 13.7533 13.7533 13.7537 13.7537 14.4907 14.4907 14.4947 14.4947 k = 0.0804-0.0000 0.1512 ( 4290 PWs) bands (ev): -16.3951 -16.3951 -16.3951 -16.3951 -12.6235 -12.6235 -12.6235 -12.6235 -10.7901 -10.7901 -10.7899 -10.7899 -9.7051 -9.7051 -9.7044 -9.7044 -2.3173 -2.3173 -2.3171 -2.3171 -0.9672 -0.9672 -0.9668 -0.9668 -0.1734 -0.1734 -0.1723 -0.1723 1.7483 1.7483 1.7508 1.7508 2.7724 2.7724 2.7752 2.7752 3.0996 3.0996 3.1010 3.1010 3.2288 3.2288 3.2322 3.2322 4.6396 4.6396 4.6429 4.6429 4.7678 4.7678 4.7729 4.7729 5.2298 5.2298 5.2335 5.2335 5.6921 5.6921 5.6970 5.6970 6.7208 6.7208 6.7217 6.7217 11.6135 11.6135 11.6144 11.6144 13.7999 13.7999 13.8003 13.8003 14.4741 14.4741 14.4783 14.4783 k = 0.0893-0.0000 0.1512 ( 4290 PWs) bands (ev): -16.3779 -16.3779 -16.3779 -16.3779 -12.6274 -12.6274 -12.6274 -12.6274 -10.7807 -10.7807 -10.7805 -10.7805 -9.7018 -9.7018 -9.7010 -9.7010 -2.3156 -2.3156 -2.3155 -2.3155 -1.0373 -1.0373 -1.0367 -1.0367 -0.1559 -0.1559 -0.1548 -0.1548 1.7576 1.7576 1.7603 1.7603 2.7831 2.7831 2.7861 2.7861 3.0549 3.0549 3.0550 3.0550 3.2419 3.2419 3.2442 3.2442 4.6126 4.6126 4.6157 4.6157 4.7406 4.7406 4.7455 4.7455 5.2260 5.2260 5.2296 5.2296 5.6731 5.6731 5.6783 5.6783 6.7176 6.7176 6.7186 6.7186 11.6529 11.6529 11.6538 11.6538 13.8463 13.8463 13.8467 13.8467 14.4619 14.4619 14.4662 14.4662 k = 0.0982-0.0000 0.1512 ( 4286 PWs) bands (ev): -16.3588 -16.3588 -16.3588 -16.3588 -12.6317 -12.6317 -12.6317 -12.6317 -10.7703 -10.7703 -10.7701 -10.7701 -9.6982 -9.6982 -9.6973 -9.6973 -2.3141 -2.3141 -2.3139 -2.3139 -1.1108 -1.1108 -1.1101 -1.1101 -0.1376 -0.1376 -0.1365 -0.1365 1.7667 1.7667 1.7695 1.7695 2.7936 2.7936 2.7966 2.7966 3.0055 3.0055 3.0066 3.0066 3.2568 3.2568 3.2585 3.2585 4.5798 4.5798 4.5823 4.5823 4.7155 4.7155 4.7199 4.7199 5.2173 5.2173 5.2206 5.2206 5.6565 5.6565 5.6618 5.6618 6.7139 6.7139 6.7151 6.7151 11.6953 11.6953 11.6963 11.6963 13.8893 13.8893 13.8896 13.8896 14.4574 14.4574 14.4615 14.4615 k = 0.1071-0.0000 0.1512 ( 4284 PWs) bands (ev): -16.3380 -16.3380 -16.3380 -16.3380 -12.6367 -12.6367 -12.6367 -12.6367 -10.7589 -10.7589 -10.7587 -10.7587 -9.6944 -9.6944 -9.6933 -9.6933 -2.3127 -2.3127 -2.3125 -2.3125 -1.1873 -1.1873 -1.1865 -1.1865 -0.1186 -0.1186 -0.1175 -0.1175 1.7755 1.7755 1.7785 1.7785 2.8035 2.8035 2.8063 2.8063 2.9536 2.9536 2.9559 2.9559 3.2731 3.2731 3.2744 3.2744 4.5417 4.5417 4.5436 4.5436 4.6919 4.6919 4.6956 4.6956 5.2032 5.2032 5.2060 5.2060 5.6430 5.6430 5.6482 5.6482 6.7097 6.7097 6.7110 6.7110 11.7405 11.7405 11.7416 11.7416 13.9249 13.9249 13.9250 13.9250 14.4643 14.4643 14.4681 14.4681 k = 0.1161-0.0000 0.1512 ( 4288 PWs) bands (ev): -16.3155 -16.3155 -16.3155 -16.3155 -12.6424 -12.6424 -12.6423 -12.6423 -10.7466 -10.7466 -10.7464 -10.7464 -9.6903 -9.6903 -9.6892 -9.6892 -2.3116 -2.3116 -2.3114 -2.3114 -1.2663 -1.2663 -1.2654 -1.2654 -0.0986 -0.0986 -0.0976 -0.0976 1.7838 1.7838 1.7869 1.7869 2.8123 2.8123 2.8138 2.8138 2.9000 2.9000 2.9044 2.9044 3.2905 3.2905 3.2915 3.2915 4.4993 4.4993 4.5005 4.5005 4.6688 4.6688 4.6717 4.6717 5.1837 5.1837 5.1858 5.1858 5.6330 5.6330 5.6380 5.6380 6.7051 6.7051 6.7064 6.7064 11.7882 11.7882 11.7893 11.7893 13.9489 13.9489 13.9494 13.9494 14.4862 14.4862 14.4895 14.4895 k = 0.1250-0.0000 0.1512 ( 4298 PWs) bands (ev): -16.2912 -16.2912 -16.2912 -16.2912 -12.6487 -12.6487 -12.6487 -12.6487 -10.7334 -10.7334 -10.7332 -10.7332 -9.6859 -9.6859 -9.6848 -9.6848 -2.3109 -2.3109 -2.3106 -2.3106 -1.3472 -1.3472 -1.3462 -1.3462 -0.0778 -0.0778 -0.0768 -0.0768 1.7914 1.7914 1.7947 1.7947 2.8125 2.8125 2.8167 2.8167 2.8483 2.8483 2.8593 2.8593 3.3090 3.3090 3.3098 3.3098 4.4538 4.4538 4.4543 4.4543 4.6450 4.6450 4.6473 4.6473 5.1591 5.1591 5.1604 5.1604 5.6265 5.6265 5.6312 5.6312 6.6998 6.6998 6.7013 6.7013 11.8381 11.8381 11.8393 11.8393 13.9593 13.9593 13.9604 13.9604 14.5250 14.5250 14.5275 14.5275 k = 0.1339-0.0000 0.1512 ( 4302 PWs) bands (ev): -16.2652 -16.2652 -16.2652 -16.2652 -12.6558 -12.6558 -12.6558 -12.6558 -10.7193 -10.7193 -10.7190 -10.7190 -9.6814 -9.6814 -9.6802 -9.6802 -2.3106 -2.3106 -2.3102 -2.3102 -1.4297 -1.4297 -1.4285 -1.4285 -0.0561 -0.0561 -0.0551 -0.0551 1.7982 1.7982 1.8016 1.8016 2.7779 2.7779 2.7820 2.7820 2.8335 2.8335 2.8451 2.8451 3.3283 3.3283 3.3290 3.3290 4.4059 4.4059 4.4060 4.4060 4.6198 4.6198 4.6215 4.6215 5.1303 5.1303 5.1307 5.1307 5.6232 5.6232 5.6275 5.6275 6.6941 6.6941 6.6956 6.6956 11.8900 11.8900 11.8912 11.8912 13.9566 13.9566 13.9583 13.9583 14.5795 14.5795 14.5813 14.5813 k = 0.1429-0.0000 0.1512 ( 4306 PWs) bands (ev): -16.2375 -16.2375 -16.2375 -16.2375 -12.6637 -12.6637 -12.6637 -12.6637 -10.7043 -10.7043 -10.7040 -10.7040 -9.6768 -9.6768 -9.6755 -9.6755 -2.3110 -2.3110 -2.3105 -2.3105 -1.5131 -1.5131 -1.5119 -1.5119 -0.0334 -0.0334 -0.0324 -0.0324 1.8041 1.8041 1.8076 1.8076 2.7248 2.7248 2.7262 2.7262 2.8378 2.8378 2.8474 2.8474 3.3484 3.3484 3.3490 3.3490 4.3560 4.3560 4.3566 4.3566 4.5924 4.5924 4.5936 4.5936 5.0979 5.0979 5.0983 5.0983 5.6226 5.6226 5.6264 5.6264 6.6877 6.6877 6.6894 6.6894 11.9434 11.9434 11.9447 11.9447 13.9433 13.9433 13.9455 13.9455 14.6468 14.6468 14.6480 14.6480 k = 0.1518-0.0000 0.1512 ( 4292 PWs) bands (ev): -16.2080 -16.2080 -16.2080 -16.2080 -12.6724 -12.6724 -12.6724 -12.6724 -10.6884 -10.6884 -10.6881 -10.6881 -9.6720 -9.6720 -9.6706 -9.6706 -2.3121 -2.3121 -2.3115 -2.3115 -1.5972 -1.5972 -1.5958 -1.5958 -0.0098 -0.0098 -0.0088 -0.0088 1.8089 1.8089 1.8124 1.8124 2.6686 2.6686 2.6688 2.6688 2.8418 2.8418 2.8510 2.8510 3.3689 3.3689 3.3695 3.3695 4.3054 4.3054 4.3065 4.3065 4.5623 4.5623 4.5631 4.5631 5.0631 5.0631 5.0644 5.0644 5.6239 5.6239 5.6273 5.6273 6.6807 6.6807 6.6825 6.6825 11.9981 11.9981 11.9995 11.9995 13.9222 13.9222 13.9249 13.9249 14.7235 14.7235 14.7240 14.7240 k = 0.1607-0.0000 0.1512 ( 4284 PWs) bands (ev): -16.1770 -16.1770 -16.1769 -16.1769 -12.6821 -12.6821 -12.6821 -12.6821 -10.6717 -10.6717 -10.6713 -10.6713 -9.6671 -9.6671 -9.6656 -9.6656 -2.3140 -2.3140 -2.3133 -2.3133 -1.6814 -1.6814 -1.6798 -1.6798 0.0148 0.0148 0.0157 0.0157 1.8124 1.8124 1.8161 1.8161 2.6115 2.6115 2.6120 2.6120 2.8443 2.8443 2.8534 2.8534 3.3899 3.3899 3.3904 3.3904 4.2545 4.2545 4.2560 4.2560 4.5290 4.5290 4.5296 4.5296 5.0275 5.0275 5.0296 5.0296 5.6266 5.6266 5.6296 5.6296 6.6730 6.6730 6.6749 6.6749 12.0539 12.0539 12.0553 12.0553 13.8958 13.8958 13.8988 13.8988 14.8062 14.8062 14.8062 14.8062 k = 0.1696-0.0000 0.1512 ( 4278 PWs) bands (ev): -16.1442 -16.1442 -16.1442 -16.1442 -12.6928 -12.6928 -12.6928 -12.6928 -10.6541 -10.6541 -10.6538 -10.6538 -9.6621 -9.6621 -9.6606 -9.6606 -2.3171 -2.3171 -2.3162 -2.3162 -1.7653 -1.7653 -1.7636 -1.7636 0.0403 0.0403 0.0412 0.0412 1.8146 1.8146 1.8183 1.8183 2.5547 2.5547 2.5558 2.5558 2.8449 2.8449 2.8541 2.8541 3.4110 3.4110 3.4116 3.4116 4.2038 4.2038 4.2058 4.2058 4.4924 4.4924 4.4928 4.4928 4.9922 4.9922 4.9950 4.9950 5.6302 5.6302 5.6328 5.6328 6.6647 6.6647 6.6667 6.6667 12.1104 12.1104 12.1119 12.1119 13.8658 13.8658 13.8691 13.8691 14.8919 14.8919 14.8923 14.8923 k = 0.1786-0.0000 0.1512 ( 4282 PWs) bands (ev): -16.1099 -16.1099 -16.1098 -16.1098 -12.7045 -12.7045 -12.7045 -12.7045 -10.6357 -10.6357 -10.6354 -10.6354 -9.6571 -9.6571 -9.6556 -9.6556 -2.3215 -2.3215 -2.3204 -2.3204 -1.8486 -1.8486 -1.8466 -1.8466 0.0668 0.0668 0.0677 0.0677 1.8153 1.8153 1.8190 1.8190 2.4990 2.4990 2.5004 2.5004 2.8433 2.8433 2.8527 2.8527 3.4322 3.4322 3.4329 3.4329 4.1538 4.1538 4.1562 4.1562 4.4522 4.4522 4.4525 4.4525 4.9579 4.9579 4.9612 4.9612 5.6343 5.6343 5.6366 5.6366 6.6557 6.6557 6.6577 6.6577 12.1673 12.1673 12.1689 12.1689 13.8336 13.8336 13.8370 13.8370 14.9786 14.9786 14.9795 14.9795 k = 0.1875-0.0000 0.1512 ( 4286 PWs) bands (ev): -16.0739 -16.0739 -16.0739 -16.0739 -12.7174 -12.7174 -12.7174 -12.7174 -10.6165 -10.6165 -10.6162 -10.6162 -9.6521 -9.6521 -9.6505 -9.6505 -2.3276 -2.3276 -2.3262 -2.3262 -1.9306 -1.9306 -1.9283 -1.9283 0.0942 0.0942 0.0950 0.0950 1.8143 1.8143 1.8180 1.8180 2.4446 2.4446 2.4465 2.4465 2.8394 2.8394 2.8490 2.8490 3.4533 3.4533 3.4541 3.4541 4.1049 4.1049 4.1076 4.1076 4.4085 4.4085 4.4090 4.4090 4.9252 4.9252 4.9290 4.9290 5.6386 5.6386 5.6406 5.6406 6.6460 6.6460 6.6481 6.6481 12.2244 12.2244 12.2260 12.2260 13.8000 13.8000 13.8036 13.8036 15.0645 15.0645 15.0657 15.0657 k = 0.1964-0.0000 0.1512 ( 4284 PWs) bands (ev): -16.0364 -16.0364 -16.0363 -16.0363 -12.7314 -12.7314 -12.7314 -12.7314 -10.5966 -10.5966 -10.5962 -10.5962 -9.6472 -9.6472 -9.6455 -9.6455 -2.3358 -2.3358 -2.3340 -2.3340 -2.0107 -2.0107 -2.0080 -2.0080 0.1225 0.1225 0.1234 0.1234 1.8114 1.8114 1.8151 1.8151 2.3921 2.3921 2.3942 2.3942 2.8330 2.8330 2.8429 2.8429 3.4740 3.4740 3.4751 3.4751 4.0575 4.0575 4.0605 4.0605 4.3617 4.3617 4.3624 4.3624 4.8945 4.8945 4.8987 4.8987 5.6429 5.6429 5.6446 5.6446 6.6355 6.6355 6.6377 6.6377 12.2814 12.2814 12.2830 12.2830 13.7658 13.7658 13.7695 13.7695 15.1477 15.1477 15.1493 15.1493 k = 0.2054-0.0000 0.1512 ( 4278 PWs) bands (ev): -15.9972 -15.9972 -15.9972 -15.9972 -12.7467 -12.7467 -12.7467 -12.7467 -10.5759 -10.5759 -10.5756 -10.5756 -9.6423 -9.6423 -9.6406 -9.6406 -2.3469 -2.3469 -2.3446 -2.3446 -2.0880 -2.0880 -2.0848 -2.0848 0.1518 0.1518 0.1526 0.1526 1.8066 1.8066 1.8103 1.8103 2.3418 2.3418 2.3441 2.3441 2.8241 2.8241 2.8342 2.8342 3.4941 3.4941 3.4955 3.4955 4.0119 4.0119 4.0152 4.0152 4.3123 4.3123 4.3133 4.3133 4.8659 4.8659 4.8704 4.8704 5.6469 5.6469 5.6484 5.6484 6.6243 6.6243 6.6265 6.6265 12.3380 12.3380 12.3396 12.3396 13.7315 13.7315 13.7353 13.7353 15.2269 15.2269 15.2288 15.2288 k = 0.2143-0.0000 0.1512 ( 4278 PWs) bands (ev): -15.9566 -15.9566 -15.9566 -15.9566 -12.7633 -12.7633 -12.7633 -12.7633 -10.5545 -10.5545 -10.5542 -10.5542 -9.6376 -9.6376 -9.6358 -9.6358 -2.3624 -2.3624 -2.3594 -2.3594 -2.1609 -2.1609 -2.1570 -2.1570 0.1819 0.1819 0.1826 0.1826 1.7997 1.7997 1.8033 1.8033 2.2938 2.2938 2.2964 2.2964 2.8126 2.8126 2.8229 2.8229 3.5133 3.5133 3.5150 3.5150 3.9683 3.9683 3.9719 3.9719 4.2608 4.2608 4.2624 4.2624 4.8395 4.8395 4.8441 4.8441 5.6507 5.6507 5.6520 5.6520 6.6123 6.6123 6.6146 6.6146 12.3939 12.3939 12.3956 12.3956 13.6974 13.6974 13.7013 13.7013 15.3006 15.3006 15.3027 15.3027 k = 0.2232-0.0000 0.1512 ( 4278 PWs) bands (ev): -15.9145 -15.9145 -15.9145 -15.9145 -12.7812 -12.7812 -12.7812 -12.7812 -10.5325 -10.5325 -10.5322 -10.5322 -9.6330 -9.6330 -9.6312 -9.6312 -2.3851 -2.3851 -2.3812 -2.3812 -2.2265 -2.2265 -2.2218 -2.2218 0.2128 0.2128 0.2136 0.2136 1.7907 1.7907 1.7942 1.7942 2.2485 2.2485 2.2513 2.2513 2.7986 2.7986 2.8090 2.8090 3.5311 3.5311 3.5333 3.5333 3.9270 3.9270 3.9307 3.9307 4.2082 4.2082 4.2104 4.2104 4.8151 4.8151 4.8199 4.8199 5.6540 5.6540 5.6552 5.6552 6.5995 6.5995 6.6018 6.6018 12.4490 12.4490 12.4508 12.4508 13.6640 13.6640 13.6680 13.6680 15.3679 15.3679 15.3701 15.3701 k = 0.2321-0.0000 0.1512 ( 4286 PWs) bands (ev): -15.8709 -15.8709 -15.8709 -15.8709 -12.8006 -12.8006 -12.8006 -12.8006 -10.5098 -10.5098 -10.5095 -10.5095 -9.6286 -9.6286 -9.6268 -9.6268 -2.4190 -2.4190 -2.4147 -2.4147 -2.2800 -2.2800 -2.2748 -2.2748 0.2447 0.2447 0.2454 0.2454 1.7796 1.7796 1.7829 1.7829 2.2060 2.2060 2.2090 2.2090 2.7822 2.7822 2.7927 2.7927 3.5469 3.5469 3.5497 3.5497 3.8881 3.8881 3.8919 3.8919 4.1553 4.1553 4.1584 4.1584 4.7928 4.7928 4.7976 4.7976 5.6570 5.6570 5.6579 5.6579 6.5859 6.5859 6.5883 6.5883 12.5030 12.5030 12.5048 12.5048 13.6314 13.6314 13.6354 13.6354 15.4280 15.4280 15.4303 15.4303 k = 0.2411-0.0000 0.1512 ( 4284 PWs) bands (ev): -15.8259 -15.8259 -15.8259 -15.8259 -12.8215 -12.8215 -12.8215 -12.8215 -10.4866 -10.4866 -10.4863 -10.4863 -9.6244 -9.6244 -9.6226 -9.6226 -2.4662 -2.4662 -2.4622 -2.4622 -2.3188 -2.3188 -2.3140 -2.3140 0.2773 0.2773 0.2780 0.2780 1.7665 1.7665 1.7696 1.7696 2.1662 2.1662 2.1694 2.1694 2.7636 2.7636 2.7740 2.7740 3.5600 3.5600 3.5635 3.5635 3.8515 3.8515 3.8553 3.8553 4.1037 4.1037 4.1078 4.1078 4.7722 4.7722 4.7772 4.7772 5.6595 5.6595 5.6603 5.6603 6.5715 6.5715 6.5739 6.5739 12.5557 12.5557 12.5575 12.5575 13.5999 13.5999 13.6040 13.6040 15.4806 15.4806 15.4828 15.4828 k = 0.2500-0.0000 0.1512 ( 4280 PWs) bands (ev): -15.7795 -15.7795 -15.7795 -15.7795 -12.8439 -12.8439 -12.8439 -12.8439 -10.4627 -10.4627 -10.4625 -10.4625 -9.6206 -9.6206 -9.6187 -9.6187 -2.5226 -2.5226 -2.5195 -2.5195 -2.3471 -2.3471 -2.3432 -2.3432 0.3106 0.3106 0.3113 0.3113 1.7514 1.7514 1.7543 1.7543 2.1292 2.1292 2.1325 2.1325 2.7429 2.7429 2.7532 2.7532 3.5691 3.5691 3.5735 3.5735 3.8170 3.8170 3.8206 3.8206 4.0549 4.0549 4.0603 4.0603 4.7534 4.7534 4.7584 4.7584 5.6617 5.6617 5.6623 5.6623 6.5563 6.5563 6.5588 6.5588 12.6069 12.6069 12.6088 12.6088 13.5696 13.5696 13.5737 13.5737 15.5257 15.5257 15.5278 15.5278 k = 0.2589-0.0000 0.1512 ( 4284 PWs) bands (ev): -15.7318 -15.7318 -15.7317 -15.7317 -12.8678 -12.8678 -12.8678 -12.8678 -10.4384 -10.4384 -10.4381 -10.4381 -9.6170 -9.6170 -9.6151 -9.6151 -2.5830 -2.5830 -2.5806 -2.5806 -2.3708 -2.3708 -2.3676 -2.3676 0.3448 0.3448 0.3454 0.3454 1.7348 1.7348 1.7374 1.7374 2.0947 2.0947 2.0981 2.0981 2.7204 2.7204 2.7306 2.7306 3.5732 3.5732 3.5783 3.5783 3.7838 3.7838 3.7870 3.7870 4.0113 4.0113 4.0182 4.0182 4.7361 4.7361 4.7411 4.7411 5.6634 5.6634 5.6639 5.6639 6.5403 6.5403 6.5428 6.5428 12.6563 12.6563 12.6583 12.6583 13.5407 13.5407 13.5449 13.5449 15.5633 15.5633 15.5653 15.5653 k = 0.2679-0.0000 0.1512 ( 4274 PWs) bands (ev): -15.6827 -15.6827 -15.6826 -15.6826 -12.8934 -12.8934 -12.8934 -12.8934 -10.4136 -10.4136 -10.4133 -10.4133 -9.6138 -9.6138 -9.6119 -9.6119 -2.6440 -2.6440 -2.6421 -2.6421 -2.3930 -2.3930 -2.3903 -2.3903 0.3796 0.3796 0.3802 0.3802 1.7170 1.7170 1.7193 1.7193 2.0625 2.0625 2.0660 2.0660 2.6966 2.6966 2.7066 2.7066 3.5710 3.5710 3.5769 3.5769 3.7504 3.7504 3.7531 3.7531 3.9759 3.9759 3.9842 3.9842 4.7203 4.7203 4.7254 4.7254 5.6649 5.6649 5.6652 5.6652 6.5234 6.5234 6.5260 6.5260 12.7040 12.7040 12.7060 12.7060 13.5133 13.5133 13.5175 13.5175 15.5941 15.5941 15.5959 15.5959 k = 0.2768-0.0000 0.1512 ( 4280 PWs) bands (ev): -15.6323 -15.6323 -15.6323 -15.6323 -12.9207 -12.9207 -12.9206 -12.9206 -10.3884 -10.3884 -10.3881 -10.3881 -9.6110 -9.6110 -9.6091 -9.6091 -2.7038 -2.7038 -2.7023 -2.7023 -2.4153 -2.4153 -2.4131 -2.4131 0.4150 0.4150 0.4156 0.4156 1.6983 1.6983 1.7002 1.7002 2.0323 2.0323 2.0358 2.0358 2.6716 2.6716 2.6814 2.6814 3.5619 3.5619 3.5684 3.5684 3.7150 3.7150 3.7172 3.7172 3.9513 3.9513 3.9607 3.9607 4.7059 4.7059 4.7111 4.7111 5.6661 5.6661 5.6663 5.6663 6.5058 6.5058 6.5083 6.5083 12.7496 12.7496 12.7516 12.7516 13.4875 13.4875 13.4918 13.4918 15.6187 15.6187 15.6202 15.6202 k = 0.2857-0.0000 0.1512 ( 4292 PWs) bands (ev): -15.5807 -15.5807 -15.5807 -15.5807 -12.9496 -12.9496 -12.9496 -12.9496 -10.3627 -10.3627 -10.3625 -10.3625 -9.6087 -9.6087 -9.6067 -9.6067 -2.7616 -2.7616 -2.7605 -2.7605 -2.4385 -2.4385 -2.4366 -2.4366 0.4511 0.4511 0.4516 0.4516 1.6791 1.6791 1.6807 1.6807 2.0036 2.0036 2.0073 2.0073 2.6459 2.6459 2.6553 2.6553 3.5459 3.5459 3.5529 3.5529 3.6765 3.6765 3.6787 3.6787 3.9386 3.9386 3.9486 3.9486 4.6928 4.6928 4.6980 4.6980 5.6671 5.6671 5.6672 5.6672 6.4873 6.4873 6.4899 6.4899 12.7930 12.7930 12.7951 12.7951 13.4633 13.4633 13.4677 13.4677 15.6378 15.6378 15.6391 15.6391 k = 0.2946-0.0000 0.1512 ( 4298 PWs) bands (ev): -15.5279 -15.5279 -15.5279 -15.5279 -12.9802 -12.9802 -12.9802 -12.9802 -10.3368 -10.3368 -10.3366 -10.3366 -9.6069 -9.6069 -9.6049 -9.6049 -2.8169 -2.8169 -2.8159 -2.8159 -2.4629 -2.4629 -2.4612 -2.4612 0.4877 0.4877 0.4883 0.4883 1.6597 1.6597 1.6610 1.6610 1.9764 1.9764 1.9802 1.9802 2.6197 2.6197 2.6288 2.6288 3.5235 3.5235 3.5309 3.5309 3.6355 3.6355 3.6380 3.6380 3.9367 3.9367 3.9468 3.9468 4.6809 4.6809 4.6862 4.6862 5.6681 5.6681 5.6681 5.6681 6.4680 6.4680 6.4706 6.4706 12.8341 12.8341 12.8363 12.8363 13.4409 13.4409 13.4453 13.4453 15.6521 15.6521 15.6531 15.6531 k = 0.3036-0.0000 0.1512 ( 4302 PWs) bands (ev): -15.4740 -15.4740 -15.4740 -15.4740 -13.0126 -13.0126 -13.0126 -13.0126 -10.3106 -10.3106 -10.3104 -10.3104 -9.6056 -9.6056 -9.6036 -9.6036 -2.8693 -2.8693 -2.8685 -2.8685 -2.4886 -2.4886 -2.4871 -2.4871 0.5248 0.5248 0.5254 0.5254 1.6403 1.6403 1.6414 1.6414 1.9505 1.9505 1.9543 1.9543 2.5934 2.5934 2.6021 2.6021 3.4953 3.4953 3.5029 3.5029 3.5940 3.5940 3.5969 3.5969 3.9431 3.9431 3.9529 3.9529 4.6702 4.6702 4.6755 4.6755 5.6690 5.6690 5.6691 5.6691 6.4479 6.4479 6.4506 6.4506 12.8729 12.8729 12.8751 12.8751 13.4203 13.4203 13.4246 13.4246 15.6626 15.6626 15.6634 15.6634 k = 0.3125-0.0000 0.1512 ( 4312 PWs) bands (ev): -15.4189 -15.4189 -15.4189 -15.4189 -13.0468 -13.0468 -13.0468 -13.0468 -10.2841 -10.2841 -10.2840 -10.2840 -9.6048 -9.6048 -9.6029 -9.6029 -2.9186 -2.9186 -2.9179 -2.9179 -2.5157 -2.5157 -2.5144 -2.5144 0.5624 0.5624 0.5629 0.5629 1.6213 1.6213 1.6220 1.6220 1.9257 1.9257 1.9297 1.9297 2.5671 2.5671 2.5754 2.5754 3.4617 3.4617 3.4692 3.4692 3.5539 3.5539 3.5572 3.5572 3.9556 3.9556 3.9650 3.9650 4.6604 4.6604 4.6658 4.6658 5.6700 5.6700 5.6703 5.6703 6.4271 6.4271 6.4297 6.4297 12.9092 12.9092 12.9114 12.9114 13.4014 13.4014 13.4058 13.4058 15.6699 15.6699 15.6704 15.6704 k = 0.3214-0.0000 0.1512 ( 4320 PWs) bands (ev): -15.3628 -15.3628 -15.3628 -15.3628 -13.0827 -13.0827 -13.0826 -13.0826 -10.2575 -10.2575 -10.2574 -10.2574 -9.6047 -9.6047 -9.6028 -9.6028 -2.9646 -2.9646 -2.9640 -2.9640 -2.5441 -2.5441 -2.5429 -2.5429 0.6003 0.6003 0.6008 0.6008 1.6026 1.6026 1.6030 1.6030 1.9022 1.9022 1.9062 1.9062 2.5410 2.5410 2.5490 2.5490 3.4234 3.4234 3.4304 3.4304 3.5167 3.5167 3.5198 3.5198 3.9722 3.9722 3.9813 3.9813 4.6515 4.6515 4.6570 4.6570 5.6713 5.6713 5.6717 5.6717 6.4055 6.4055 6.4082 6.4082 12.9430 12.9430 12.9453 12.9453 13.3843 13.3843 13.3887 13.3887 15.6747 15.6747 15.6750 15.6750 k = 0.3304-0.0000 0.1512 ( 4308 PWs) bands (ev): -15.3057 -15.3057 -15.3057 -15.3057 -13.1203 -13.1203 -13.1203 -13.1203 -10.2308 -10.2308 -10.2307 -10.2307 -9.6053 -9.6053 -9.6033 -9.6033 -3.0073 -3.0073 -3.0068 -3.0068 -2.5738 -2.5738 -2.5728 -2.5728 0.6385 0.6385 0.6390 0.6390 1.5842 1.5842 1.5844 1.5844 1.8800 1.8800 1.8842 1.8842 2.5154 2.5154 2.5229 2.5229 3.3817 3.3817 3.3879 3.3879 3.4821 3.4821 3.4847 3.4847 3.9918 3.9918 4.0005 4.0005 4.6434 4.6434 4.6489 4.6489 5.6729 5.6729 5.6735 5.6735 6.3832 6.3832 6.3859 6.3859 12.9743 12.9743 12.9766 12.9766 13.3691 13.3691 13.3735 13.3735 15.6778 15.6778 15.6779 15.6779 k = 0.3393-0.0000 0.1512 ( 4308 PWs) bands (ev): -15.2477 -15.2477 -15.2477 -15.2477 -13.1597 -13.1597 -13.1597 -13.1597 -10.2040 -10.2040 -10.2040 -10.2040 -9.6065 -9.6065 -9.6046 -9.6046 -3.0464 -3.0464 -3.0460 -3.0460 -2.6047 -2.6047 -2.6038 -2.6038 0.6768 0.6768 0.6773 0.6773 1.5660 1.5660 1.5661 1.5661 1.8595 1.8595 1.8637 1.8637 2.4901 2.4901 2.4973 2.4973 3.3382 3.3382 3.3434 3.3434 3.4494 3.4494 3.4514 3.4514 4.0134 4.0134 4.0218 4.0218 4.6359 4.6359 4.6415 4.6415 5.6750 5.6750 5.6757 5.6757 6.3603 6.3603 6.3629 6.3629 13.0031 13.0031 13.0054 13.0054 13.3555 13.3555 13.3599 13.3599 15.6796 15.6796 15.6797 15.6797 k = 0.3482-0.0000 0.1512 ( 4320 PWs) bands (ev): -15.1888 -15.1888 -15.1888 -15.1888 -13.2008 -13.2008 -13.2008 -13.2008 -10.1772 -10.1772 -10.1772 -10.1772 -9.6085 -9.6085 -9.6066 -9.6066 -3.0821 -3.0821 -3.0817 -3.0817 -2.6367 -2.6367 -2.6359 -2.6359 0.7152 0.7152 0.7157 0.7157 1.5478 1.5478 1.5482 1.5482 1.8408 1.8408 1.8451 1.8451 2.4653 2.4653 2.4721 2.4721 3.2942 3.2942 3.2986 3.2986 3.4178 3.4178 3.4191 3.4191 4.0365 4.0365 4.0445 4.0445 4.6289 4.6289 4.6345 4.6345 5.6778 5.6778 5.6786 5.6786 6.3366 6.3366 6.3393 6.3393 13.0293 13.0293 13.0316 13.0316 13.3436 13.3436 13.3479 13.3479 15.6806 15.6806 15.6810 15.6810 k = 0.3571-0.0000 0.1512 ( 4328 PWs) bands (ev): -15.1291 -15.1291 -15.1291 -15.1291 -13.2437 -13.2437 -13.2437 -13.2437 -10.1505 -10.1505 -10.1504 -10.1504 -9.6112 -9.6112 -9.6093 -9.6093 -3.1141 -3.1141 -3.1138 -3.1138 -2.6696 -2.6696 -2.6689 -2.6689 0.7535 0.7535 0.7540 0.7540 1.5297 1.5297 1.5302 1.5302 1.8243 1.8243 1.8287 1.8287 2.4409 2.4409 2.4474 2.4474 3.2507 3.2507 3.2545 3.2545 3.3867 3.3867 3.3876 3.3876 4.0605 4.0605 4.0684 4.0684 4.6221 4.6221 4.6279 4.6279 5.6812 5.6812 5.6822 5.6822 6.3124 6.3124 6.3151 6.3151 13.0531 13.0531 13.0554 13.0554 13.3333 13.3333 13.3376 13.3376 15.6815 15.6815 15.6820 15.6820 k = 0.3661-0.0000 0.1512 ( 4316 PWs) bands (ev): -15.0686 -15.0686 -15.0686 -15.0686 -13.2882 -13.2882 -13.2882 -13.2882 -10.1239 -10.1239 -10.1238 -10.1238 -9.6147 -9.6147 -9.6129 -9.6129 -3.1426 -3.1426 -3.1423 -3.1423 -2.7033 -2.7033 -2.7026 -2.7026 0.7916 0.7916 0.7921 0.7921 1.5114 1.5114 1.5122 1.5122 1.8104 1.8104 1.8148 1.8148 2.4168 2.4168 2.4230 2.4230 3.2086 3.2086 3.2117 3.2117 3.3561 3.3561 3.3565 3.3565 4.0853 4.0853 4.0930 4.0930 4.6155 4.6155 4.6214 4.6214 5.6856 5.6856 5.6867 5.6867 6.2876 6.2876 6.2903 6.2903 13.0746 13.0746 13.0769 13.0769 13.3244 13.3244 13.3286 13.3286 15.6827 15.6827 15.6834 15.6834 k = 0.3750-0.0000 0.1512 ( 4304 PWs) bands (ev): -15.0074 -15.0074 -15.0074 -15.0074 -13.3344 -13.3344 -13.3344 -13.3344 -10.0975 -10.0975 -10.0973 -10.0973 -9.6191 -9.6191 -9.6172 -9.6172 -3.1675 -3.1675 -3.1672 -3.1672 -2.7375 -2.7375 -2.7369 -2.7369 0.8293 0.8293 0.8299 0.8299 1.4928 1.4928 1.4939 1.4939 1.7993 1.7993 1.8038 1.8038 2.3929 2.3929 2.3988 2.3988 3.1683 3.1683 3.1710 3.1710 3.3258 3.3258 3.3258 3.3258 4.1106 4.1106 4.1181 4.1181 4.6089 4.6089 4.6148 4.6148 5.6909 5.6909 5.6921 5.6921 6.2623 6.2623 6.2650 6.2650 13.0940 13.0940 13.0961 13.0961 13.3169 13.3169 13.3209 13.3209 15.6845 15.6845 15.6853 15.6853 k = 0.3839-0.0000 0.1512 ( 4300 PWs) bands (ev): -14.9456 -14.9456 -14.9456 -14.9456 -13.3822 -13.3822 -13.3821 -13.3821 -10.0713 -10.0713 -10.0711 -10.0711 -9.6243 -9.6243 -9.6225 -9.6225 -3.1888 -3.1888 -3.1885 -3.1885 -2.7721 -2.7721 -2.7715 -2.7715 0.8664 0.8664 0.8670 0.8670 1.4740 1.4740 1.4753 1.4753 1.7913 1.7913 1.7958 1.7958 2.3689 2.3689 2.3746 2.3746 3.1305 3.1305 3.1327 3.1327 3.2955 3.2955 3.2957 3.2957 4.1362 4.1362 4.1435 4.1435 4.6020 4.6020 4.6080 4.6080 5.6973 5.6973 5.6987 5.6987 6.2366 6.2366 6.2393 6.2393 13.1113 13.1113 13.1133 13.1133 13.3104 13.3104 13.3143 13.3143 15.6873 15.6873 15.6883 15.6883 k = 0.3929-0.0000 0.1512 ( 4302 PWs) bands (ev): -14.8832 -14.8832 -14.8832 -14.8832 -13.4315 -13.4315 -13.4315 -13.4315 -10.0454 -10.0454 -10.0451 -10.0451 -9.6304 -9.6304 -9.6286 -9.6286 -3.2065 -3.2065 -3.2063 -3.2063 -2.8069 -2.8069 -2.8064 -2.8064 0.9027 0.9027 0.9034 0.9034 1.4549 1.4549 1.4563 1.4563 1.7866 1.7866 1.7910 1.7910 2.3447 2.3447 2.3502 2.3502 3.0955 3.0955 3.0974 3.0974 3.2655 3.2655 3.2660 3.2660 4.1619 4.1619 4.1691 4.1691 4.5948 4.5948 4.6009 4.6009 5.7049 5.7049 5.7064 5.7064 6.2105 6.2105 6.2132 6.2132 13.1268 13.1268 13.1287 13.1287 13.3049 13.3049 13.3086 13.3086 15.6913 15.6913 15.6924 15.6924 k = 0.4018-0.0000 0.1512 ( 4300 PWs) bands (ev): -14.8204 -14.8204 -14.8203 -14.8203 -13.4823 -13.4823 -13.4823 -13.4823 -10.0199 -10.0199 -10.0195 -10.0195 -9.6374 -9.6374 -9.6357 -9.6357 -3.2207 -3.2207 -3.2205 -3.2205 -2.8416 -2.8416 -2.8412 -2.8412 0.9380 0.9380 0.9388 0.9388 1.4356 1.4356 1.4372 1.4372 1.7854 1.7854 1.7897 1.7897 2.3200 2.3200 2.3252 2.3252 3.0637 3.0637 3.0654 3.0654 3.2360 3.2360 3.2367 3.2367 4.1876 4.1876 4.1947 4.1947 4.5871 4.5871 4.5933 4.5933 5.7137 5.7137 5.7153 5.7153 6.1841 6.1841 6.1868 6.1868 13.1408 13.1408 13.1425 13.1425 13.3000 13.3000 13.3035 13.3035 15.6968 15.6968 15.6979 15.6979 k = 0.4107-0.0000 0.1512 ( 4304 PWs) bands (ev): -14.7571 -14.7571 -14.7571 -14.7571 -13.5346 -13.5346 -13.5346 -13.5346 -9.9947 -9.9947 -9.9943 -9.9943 -9.6453 -9.6453 -9.6436 -9.6436 -3.2314 -3.2314 -3.2313 -3.2313 -2.8762 -2.8762 -2.8758 -2.8758 0.9722 0.9722 0.9730 0.9730 1.4161 1.4161 1.4179 1.4179 1.7876 1.7876 1.7918 1.7918 2.2946 2.2946 2.2996 2.2996 3.0356 3.0356 3.0371 3.0371 3.2070 3.2070 3.2079 3.2079 4.2131 4.2131 4.2201 4.2201 4.5787 4.5787 4.5850 4.5850 5.7239 5.7239 5.7256 5.7256 6.1575 6.1575 6.1602 6.1602 13.1534 13.1534 13.1550 13.1550 13.2956 13.2956 13.2989 13.2989 15.7038 15.7038 15.7051 15.7051 k = 0.4196-0.0000 0.1512 ( 4312 PWs) bands (ev): -14.6935 -14.6935 -14.6935 -14.6935 -13.5882 -13.5882 -13.5882 -13.5882 -9.9701 -9.9701 -9.9696 -9.9696 -9.6542 -9.6542 -9.6526 -9.6526 -3.2387 -3.2387 -3.2386 -3.2386 -2.9103 -2.9103 -2.9099 -2.9099 1.0049 1.0049 1.0058 1.0058 1.3967 1.3967 1.3986 1.3986 1.7934 1.7934 1.7975 1.7975 2.2682 2.2682 2.2730 2.2730 3.0114 3.0114 3.0128 3.0128 3.1787 3.1787 3.1798 3.1798 4.2384 4.2384 4.2454 4.2454 4.5696 4.5696 4.5759 4.5759 5.7354 5.7354 5.7372 5.7372 6.1307 6.1307 6.1334 6.1334 13.1650 13.1650 13.1663 13.1663 13.2914 13.2914 13.2945 13.2945 15.7127 15.7127 15.7140 15.7140 k = 0.4286-0.0000 0.1512 ( 4312 PWs) bands (ev): -14.6296 -14.6296 -14.6296 -14.6296 -13.6431 -13.6431 -13.6431 -13.6431 -9.9459 -9.9459 -9.9454 -9.9454 -9.6640 -9.6640 -9.6624 -9.6624 -3.2426 -3.2426 -3.2425 -3.2425 -2.9438 -2.9438 -2.9435 -2.9435 1.0361 1.0361 1.0371 1.0371 1.3773 1.3773 1.3793 1.3793 1.8027 1.8027 1.8068 1.8068 2.2406 2.2406 2.2452 2.2452 2.9914 2.9914 2.9927 2.9927 3.1512 3.1512 3.1524 3.1524 4.2634 4.2634 4.2703 4.2703 4.5595 4.5595 4.5659 4.5659 5.7483 5.7483 5.7502 5.7502 6.1039 6.1039 6.1065 6.1065 13.1756 13.1756 13.1767 13.1767 13.2873 13.2873 13.2901 13.2901 15.7236 15.7236 15.7249 15.7249 k = 0.4375-0.0000 0.1512 ( 4308 PWs) bands (ev): -14.5656 -14.5656 -14.5656 -14.5656 -13.6993 -13.6993 -13.6993 -13.6993 -9.9223 -9.9223 -9.9217 -9.9217 -9.6748 -9.6748 -9.6733 -9.6733 -3.2433 -3.2433 -3.2432 -3.2432 -2.9764 -2.9764 -2.9761 -2.9761 1.0656 1.0656 1.0667 1.0667 1.3581 1.3581 1.3602 1.3602 1.8156 1.8156 1.8196 1.8196 2.2118 2.2118 2.2163 2.2163 2.9758 2.9758 2.9770 2.9770 3.1246 3.1246 3.1260 3.1260 4.2880 4.2880 4.2949 4.2949 4.5486 4.5486 4.5550 4.5550 5.7626 5.7626 5.7646 5.7646 6.0770 6.0770 6.0797 6.0797 13.1856 13.1856 13.1864 13.1864 13.2831 13.2831 13.2856 13.2856 15.7364 15.7364 15.7378 15.7378 k = 0.4464-0.0000 0.1512 ( 4312 PWs) bands (ev): -14.5015 -14.5015 -14.5014 -14.5014 -13.7566 -13.7566 -13.7566 -13.7566 -9.8994 -9.8994 -9.8987 -9.8987 -9.6865 -9.6865 -9.6851 -9.6851 -3.2408 -3.2408 -3.2407 -3.2407 -3.0080 -3.0080 -3.0078 -3.0078 1.0934 1.0934 1.0946 1.0946 1.3392 1.3392 1.3413 1.3413 1.8319 1.8319 1.8358 1.8358 2.1818 2.1818 2.1861 2.1861 2.9645 2.9645 2.9657 2.9657 3.0992 3.0992 3.1006 3.1006 4.3121 4.3121 4.3189 4.3189 4.5365 4.5365 4.5430 4.5430 5.7783 5.7783 5.7804 5.7804 6.0504 6.0504 6.0530 6.0530 13.1950 13.1950 13.1956 13.1956 13.2786 13.2786 13.2809 13.2809 15.7513 15.7513 15.7527 15.7527 k = 0.4554-0.0000 0.1512 ( 4316 PWs) bands (ev): -14.4373 -14.4373 -14.4373 -14.4373 -13.8149 -13.8149 -13.8149 -13.8149 -9.8771 -9.8771 -9.8764 -9.8764 -9.6992 -9.6992 -9.6979 -9.6979 -3.2352 -3.2352 -3.2351 -3.2351 -3.0384 -3.0384 -3.0382 -3.0382 1.1194 1.1194 1.1208 1.1208 1.3205 1.3205 1.3226 1.3226 1.8514 1.8514 1.8552 1.8552 2.1506 2.1506 2.1548 2.1548 2.9576 2.9576 2.9588 2.9588 3.0750 3.0750 3.0765 3.0765 4.3356 4.3356 4.3424 4.3424 4.5235 4.5235 4.5300 4.5300 5.7954 5.7954 5.7975 5.7975 6.0239 6.0239 6.0265 6.0265 13.2040 13.2040 13.2044 13.2044 13.2737 13.2737 13.2757 13.2757 15.7684 15.7684 15.7698 15.7698 k = 0.4643-0.0000 0.1512 ( 4312 PWs) bands (ev): -14.3733 -14.3733 -14.3732 -14.3732 -13.8743 -13.8743 -13.8742 -13.8742 -9.8555 -9.8555 -9.8547 -9.8547 -9.7129 -9.7129 -9.7116 -9.7116 -3.2266 -3.2266 -3.2266 -3.2266 -3.0673 -3.0673 -3.0672 -3.0672 1.1437 1.1437 1.1452 1.1452 1.3020 1.3020 1.3041 1.3041 1.8740 1.8740 1.8777 1.8777 2.1185 2.1185 2.1225 2.1225 2.9549 2.9549 2.9562 2.9562 3.0524 3.0524 3.0538 3.0538 4.3584 4.3584 4.3652 4.3652 4.5093 4.5093 4.5158 4.5158 5.8137 5.8137 5.8160 5.8160 5.9978 5.9978 6.0003 6.0003 13.2127 13.2127 13.2128 13.2128 13.2685 13.2685 13.2703 13.2703 15.7876 15.7876 15.7890 15.7890 k = 0.4732-0.0000 0.1512 ( 4310 PWs) bands (ev): -14.3094 -14.3094 -14.3093 -14.3093 -13.9345 -13.9345 -13.9345 -13.9345 -9.8347 -9.8347 -9.8338 -9.8338 -9.7276 -9.7276 -9.7263 -9.7263 -3.2152 -3.2152 -3.2152 -3.2152 -3.0947 -3.0947 -3.0945 -3.0945 1.1665 1.1665 1.1681 1.1681 1.2836 1.2836 1.2857 1.2857 1.8993 1.8993 1.9030 1.9030 2.0858 2.0858 2.0897 2.0897 2.9562 2.9562 2.9575 2.9575 3.0314 3.0314 3.0329 3.0329 4.3805 4.3805 4.3873 4.3873 4.4940 4.4940 4.5006 4.5006 5.8333 5.8333 5.8356 5.8356 5.9721 5.9721 5.9746 5.9746 13.2209 13.2209 13.2210 13.2210 13.2629 13.2629 13.2644 13.2644 15.8089 15.8089 15.8103 15.8103 k = 0.4821-0.0000 0.1512 ( 4306 PWs) bands (ev): -14.2457 -14.2457 -14.2457 -14.2457 -13.9955 -13.9955 -13.9955 -13.9955 -9.8147 -9.8147 -9.8137 -9.8137 -9.7432 -9.7432 -9.7420 -9.7420 -3.2011 -3.2011 -3.2011 -3.2011 -3.1202 -3.1202 -3.1201 -3.1201 1.1880 1.1880 1.1897 1.1897 1.2653 1.2653 1.2673 1.2673 1.9269 1.9269 1.9306 1.9306 2.0528 2.0528 2.0566 2.0566 2.9612 2.9612 2.9626 2.9626 3.0124 3.0124 3.0138 3.0138 4.4018 4.4018 4.4085 4.4085 4.4776 4.4776 4.4842 4.4842 5.8541 5.8541 5.8565 5.8565 5.9469 5.9469 5.9495 5.9495 13.2287 13.2287 13.2291 13.2291 13.2568 13.2568 13.2581 13.2581 15.8324 15.8324 15.8337 15.8337 k = 0.4911-0.0000 0.1512 ( 4310 PWs) bands (ev): -14.1824 -14.1824 -14.1824 -14.1824 -14.0572 -14.0572 -14.0572 -14.0572 -9.7955 -9.7955 -9.7945 -9.7945 -9.7597 -9.7597 -9.7586 -9.7586 -3.1844 -3.1844 -3.1843 -3.1843 -3.1438 -3.1438 -3.1437 -3.1437 1.2084 1.2084 1.2102 1.2102 1.2467 1.2467 1.2487 1.2487 1.9566 1.9566 1.9602 1.9602 2.0200 2.0200 2.0237 2.0237 2.9697 2.9697 2.9710 2.9710 2.9955 2.9955 2.9970 2.9970 4.4222 4.4222 4.4289 4.4289 4.4602 4.4602 4.4668 4.4668 5.8759 5.8759 5.8783 5.8783 5.9225 5.9225 5.9250 5.9250 13.2362 13.2362 13.2368 13.2368 13.2503 13.2503 13.2514 13.2514 15.8580 15.8580 15.8592 15.8592 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -9.7771 -9.7771 -9.7771 -9.7771 -9.7761 -9.7761 -9.7761 -9.7761 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 1.2278 1.2278 1.2278 1.2278 1.2298 1.2298 1.2298 1.2298 1.9877 1.9877 1.9877 1.9877 1.9914 1.9914 1.9914 1.9914 2.9812 2.9812 2.9812 2.9812 2.9826 2.9826 2.9826 2.9826 4.4417 4.4417 4.4417 4.4417 4.4484 4.4484 4.4484 4.4484 5.8988 5.8988 5.8988 5.8988 5.9012 5.9012 5.9012 5.9012 13.2434 13.2434 13.2434 13.2434 13.2443 13.2443 13.2443 13.2443 15.8856 15.8857 15.8860 15.8867 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -9.7771 -9.7771 -9.7771 -9.7771 -9.7761 -9.7761 -9.7761 -9.7761 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 1.2278 1.2278 1.2278 1.2278 1.2298 1.2298 1.2298 1.2298 1.9877 1.9877 1.9877 1.9877 1.9914 1.9914 1.9914 1.9914 2.9812 2.9812 2.9812 2.9812 2.9826 2.9826 2.9826 2.9826 4.4417 4.4417 4.4417 4.4417 4.4484 4.4484 4.4484 4.4484 5.8988 5.8988 5.8988 5.8988 5.9012 5.9012 5.9012 5.9012 13.2434 13.2434 13.2434 13.2434 13.2443 13.2443 13.2443 13.2443 15.8856 15.8856 15.8856 15.8862 k = 0.5000 0.0090 0.1512 ( 4312 PWs) bands (ev): -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -9.7772 -9.7772 -9.7772 -9.7772 -9.7762 -9.7762 -9.7761 -9.7761 -3.1655 -3.1655 -3.1655 -3.1655 -3.1654 -3.1654 -3.1654 -3.1654 1.2264 1.2264 1.2266 1.2266 1.2284 1.2284 1.2285 1.2285 1.9884 1.9884 1.9884 1.9884 1.9919 1.9919 1.9922 1.9922 2.9823 2.9823 2.9824 2.9824 2.9836 2.9836 2.9839 2.9839 4.4411 4.4411 4.4420 4.4420 4.4482 4.4482 4.4482 4.4482 5.8994 5.8994 5.8994 5.8994 5.9015 5.9015 5.9022 5.9022 13.2428 13.2428 13.2428 13.2428 13.2436 13.2436 13.2436 13.2436 15.8859 15.8859 15.8859 15.8859 k = 0.5000 0.0179 0.1512 ( 4312 PWs) bands (ev): -14.1193 -14.1193 -14.1193 -14.1193 -14.1193 -14.1193 -14.1193 -14.1193 -9.7774 -9.7774 -9.7773 -9.7773 -9.7764 -9.7764 -9.7763 -9.7763 -3.1663 -3.1663 -3.1662 -3.1662 -3.1662 -3.1662 -3.1662 -3.1662 1.2224 1.2224 1.2227 1.2227 1.2244 1.2244 1.2246 1.2246 1.9902 1.9902 1.9903 1.9903 1.9936 1.9936 1.9941 1.9941 2.9856 2.9856 2.9858 2.9858 2.9868 2.9868 2.9875 2.9875 4.4402 4.4402 4.4420 4.4420 4.4477 4.4477 4.4478 4.4478 5.9013 5.9013 5.9014 5.9014 5.9031 5.9031 5.9045 5.9045 13.2409 13.2409 13.2410 13.2410 13.2417 13.2417 13.2418 13.2418 15.8867 15.8868 15.8868 15.8869 k = 0.5000 0.0269 0.1512 ( 4308 PWs) bands (ev): -14.1190 -14.1190 -14.1190 -14.1190 -14.1190 -14.1190 -14.1190 -14.1190 -9.7777 -9.7777 -9.7776 -9.7776 -9.7767 -9.7767 -9.7765 -9.7765 -3.1676 -3.1676 -3.1675 -3.1675 -3.1675 -3.1675 -3.1675 -3.1675 1.2157 1.2157 1.2163 1.2163 1.2178 1.2178 1.2180 1.2180 1.9934 1.9934 1.9935 1.9935 1.9966 1.9966 1.9974 1.9974 2.9911 2.9911 2.9913 2.9913 2.9922 2.9922 2.9932 2.9932 4.4389 4.4389 4.4416 4.4416 4.4468 4.4468 4.4470 4.4470 5.9045 5.9045 5.9046 5.9046 5.9060 5.9060 5.9080 5.9080 13.2377 13.2377 13.2379 13.2379 13.2385 13.2385 13.2386 13.2386 15.8882 15.8883 15.8885 15.8889 k = 0.5000 0.0359 0.1512 ( 4308 PWs) bands (ev): -14.1186 -14.1186 -14.1186 -14.1186 -14.1186 -14.1186 -14.1186 -14.1186 -9.7781 -9.7781 -9.7779 -9.7779 -9.7771 -9.7771 -9.7769 -9.7769 -3.1694 -3.1694 -3.1693 -3.1693 -3.1693 -3.1693 -3.1692 -3.1692 1.2065 1.2065 1.2072 1.2072 1.2086 1.2086 1.2090 1.2090 1.9979 1.9979 1.9980 1.9980 2.0010 2.0010 2.0020 2.0020 2.9986 2.9986 2.9988 2.9988 2.9995 2.9995 3.0009 3.0009 4.4375 4.4375 4.4410 4.4410 4.4457 4.4457 4.4459 4.4459 5.9090 5.9090 5.9091 5.9091 5.9101 5.9101 5.9128 5.9128 13.2334 13.2334 13.2335 13.2335 13.2342 13.2342 13.2343 13.2343 15.8902 15.8902 15.8903 15.8904 k = 0.5000 0.0448 0.1512 ( 4312 PWs) bands (ev): -14.1181 -14.1181 -14.1181 -14.1181 -14.1181 -14.1181 -14.1181 -14.1181 -9.7786 -9.7786 -9.7784 -9.7784 -9.7776 -9.7776 -9.7774 -9.7774 -3.1716 -3.1716 -3.1715 -3.1715 -3.1715 -3.1715 -3.1715 -3.1715 1.1948 1.1948 1.1957 1.1957 1.1971 1.1971 1.1974 1.1974 2.0038 2.0038 2.0040 2.0040 2.0067 2.0067 2.0079 2.0079 3.0078 3.0078 3.0080 3.0080 3.0087 3.0087 3.0103 3.0103 4.4358 4.4358 4.4402 4.4402 4.4444 4.4444 4.4446 4.4446 5.9146 5.9146 5.9147 5.9147 5.9153 5.9153 5.9187 5.9187 13.2279 13.2279 13.2281 13.2281 13.2287 13.2287 13.2289 13.2289 15.8927 15.8927 15.8929 15.8929 k = 0.5000 0.0538 0.1512 ( 4312 PWs) bands (ev): -14.1175 -14.1175 -14.1175 -14.1175 -14.1174 -14.1174 -14.1174 -14.1174 -9.7793 -9.7793 -9.7790 -9.7790 -9.7783 -9.7783 -9.7779 -9.7779 -3.1744 -3.1744 -3.1742 -3.1742 -3.1742 -3.1742 -3.1742 -3.1742 1.1809 1.1809 1.1819 1.1819 1.1831 1.1831 1.1836 1.1836 2.0112 2.0112 2.0115 2.0115 2.0139 2.0139 2.0153 2.0153 3.0186 3.0186 3.0189 3.0189 3.0194 3.0194 3.0214 3.0214 4.4339 4.4339 4.4391 4.4391 4.4429 4.4429 4.4431 4.4431 5.9214 5.9214 5.9215 5.9215 5.9218 5.9218 5.9258 5.9258 13.2214 13.2214 13.2216 13.2216 13.2221 13.2221 13.2223 13.2223 15.8956 15.8957 15.8960 15.8963 k = 0.5000 0.0628 0.1512 ( 4308 PWs) bands (ev): -14.1167 -14.1167 -14.1167 -14.1167 -14.1167 -14.1167 -14.1167 -14.1167 -9.7800 -9.7800 -9.7796 -9.7796 -9.7790 -9.7790 -9.7786 -9.7786 -3.1775 -3.1775 -3.1774 -3.1774 -3.1773 -3.1773 -3.1773 -3.1773 1.1647 1.1647 1.1658 1.1658 1.1670 1.1670 1.1675 1.1675 2.0201 2.0201 2.0205 2.0205 2.0226 2.0226 2.0243 2.0243 3.0307 3.0307 3.0309 3.0309 3.0315 3.0315 3.0337 3.0337 4.4320 4.4320 4.4380 4.4380 4.4414 4.4414 4.4415 4.4415 5.9293 5.9293 5.9293 5.9293 5.9293 5.9293 5.9339 5.9339 13.2139 13.2139 13.2141 13.2141 13.2147 13.2147 13.2149 13.2149 15.8990 15.8992 15.8995 15.8999 k = 0.5000 0.0717 0.1512 ( 4308 PWs) bands (ev): -14.1159 -14.1159 -14.1159 -14.1159 -14.1159 -14.1159 -14.1159 -14.1159 -9.7808 -9.7808 -9.7804 -9.7804 -9.7798 -9.7798 -9.7794 -9.7794 -3.1811 -3.1811 -3.1809 -3.1809 -3.1809 -3.1809 -3.1808 -3.1808 1.1465 1.1465 1.1477 1.1477 1.1488 1.1488 1.1494 1.1494 2.0306 2.0306 2.0311 2.0311 2.0329 2.0329 2.0348 2.0348 3.0438 3.0438 3.0440 3.0440 3.0445 3.0445 3.0469 3.0469 4.4300 4.4300 4.4368 4.4368 4.4398 4.4398 4.4398 4.4398 5.9377 5.9377 5.9381 5.9381 5.9381 5.9381 5.9429 5.9429 13.2055 13.2055 13.2058 13.2058 13.2063 13.2063 13.2065 13.2065 15.9026 15.9027 15.9030 15.9032 k = 0.5000 0.0807 0.1512 ( 4312 PWs) bands (ev): -14.1150 -14.1150 -14.1150 -14.1150 -14.1150 -14.1150 -14.1150 -14.1150 -9.7817 -9.7817 -9.7812 -9.7812 -9.7807 -9.7807 -9.7803 -9.7803 -3.1850 -3.1850 -3.1848 -3.1848 -3.1848 -3.1848 -3.1847 -3.1847 1.1265 1.1265 1.1278 1.1278 1.1289 1.1289 1.1294 1.1294 2.0427 2.0427 2.0433 2.0433 2.0448 2.0448 2.0469 2.0469 3.0575 3.0575 3.0576 3.0576 3.0581 3.0581 3.0609 3.0609 4.4282 4.4282 4.4357 4.4357 4.4382 4.4382 4.4382 4.4382 5.9471 5.9471 5.9478 5.9478 5.9478 5.9478 5.9528 5.9528 13.1964 13.1964 13.1967 13.1967 13.1972 13.1972 13.1974 13.1974 15.9066 15.9068 15.9070 15.9074 k = 0.5000 0.0896 0.1512 ( 4312 PWs) bands (ev): -14.1140 -14.1140 -14.1140 -14.1140 -14.1139 -14.1139 -14.1139 -14.1139 -9.7827 -9.7827 -9.7822 -9.7822 -9.7817 -9.7817 -9.7812 -9.7812 -3.1892 -3.1892 -3.1890 -3.1890 -3.1890 -3.1890 -3.1889 -3.1889 1.1048 1.1048 1.1062 1.1062 1.1072 1.1072 1.1078 1.1078 2.0563 2.0563 2.0572 2.0572 2.0583 2.0583 2.0606 2.0606 3.0716 3.0716 3.0716 3.0716 3.0721 3.0721 3.0751 3.0751 4.4265 4.4265 4.4347 4.4347 4.4368 4.4368 4.4369 4.4369 5.9572 5.9572 5.9582 5.9582 5.9583 5.9583 5.9635 5.9635 13.1867 13.1867 13.1870 13.1870 13.1874 13.1874 13.1877 13.1877 15.9106 15.9106 15.9111 15.9114 k = 0.5000 0.0986 0.1512 ( 4312 PWs) bands (ev): -14.1129 -14.1129 -14.1129 -14.1129 -14.1129 -14.1129 -14.1129 -14.1129 -9.7837 -9.7837 -9.7832 -9.7832 -9.7828 -9.7828 -9.7822 -9.7822 -3.1937 -3.1937 -3.1936 -3.1936 -3.1935 -3.1935 -3.1934 -3.1934 1.0818 1.0818 1.0832 1.0832 1.0842 1.0842 1.0848 1.0848 2.0716 2.0716 2.0726 2.0726 2.0734 2.0734 2.0760 2.0760 3.0855 3.0855 3.0856 3.0856 3.0860 3.0860 3.0892 3.0892 4.4252 4.4252 4.4340 4.4340 4.4356 4.4356 4.4359 4.4359 5.9680 5.9680 5.9693 5.9693 5.9694 5.9694 5.9747 5.9747 13.1764 13.1764 13.1768 13.1768 13.1772 13.1772 13.1775 13.1775 15.9147 15.9148 15.9153 15.9155 k = 0.5000 0.1076 0.1512 ( 4308 PWs) bands (ev): -14.1117 -14.1117 -14.1117 -14.1117 -14.1117 -14.1117 -14.1117 -14.1117 -9.7848 -9.7848 -9.7843 -9.7843 -9.7840 -9.7840 -9.7833 -9.7833 -3.1985 -3.1985 -3.1983 -3.1983 -3.1983 -3.1983 -3.1982 -3.1982 1.0576 1.0576 1.0590 1.0590 1.0600 1.0600 1.0606 1.0606 2.0885 2.0885 2.0897 2.0897 2.0901 2.0901 2.0929 2.0929 3.0991 3.0991 3.0993 3.0993 3.0996 3.0996 3.1030 3.1030 4.4243 4.4243 4.4338 4.4338 4.4348 4.4348 4.4353 4.4353 5.9793 5.9793 5.9808 5.9808 5.9811 5.9811 5.9865 5.9865 13.1658 13.1658 13.1662 13.1662 13.1666 13.1666 13.1669 13.1669 15.9189 15.9192 15.9195 15.9196 k = 0.5000 0.1165 0.1512 ( 4296 PWs) bands (ev): -14.1105 -14.1105 -14.1105 -14.1105 -14.1105 -14.1105 -14.1105 -14.1105 -9.7860 -9.7860 -9.7854 -9.7854 -9.7852 -9.7852 -9.7845 -9.7845 -3.2034 -3.2034 -3.2033 -3.2033 -3.2032 -3.2032 -3.2031 -3.2031 1.0324 1.0324 1.0339 1.0339 1.0348 1.0348 1.0354 1.0354 2.1069 2.1069 2.1083 2.1083 2.1084 2.1084 2.1114 2.1114 3.1119 3.1119 3.1122 3.1122 3.1124 3.1124 3.1161 3.1161 4.4241 4.4241 4.4341 4.4341 4.4346 4.4346 4.4354 4.4354 5.9911 5.9911 5.9928 5.9928 5.9932 5.9932 5.9987 5.9987 13.1550 13.1550 13.1555 13.1555 13.1558 13.1558 13.1561 13.1561 15.9229 15.9231 15.9235 15.9235 k = 0.5000 0.1255 0.1512 ( 4300 PWs) bands (ev): -14.1092 -14.1092 -14.1092 -14.1092 -14.1092 -14.1092 -14.1092 -14.1092 -9.7873 -9.7873 -9.7866 -9.7866 -9.7864 -9.7864 -9.7857 -9.7857 -3.2086 -3.2086 -3.2084 -3.2084 -3.2084 -3.2084 -3.2082 -3.2082 1.0066 1.0066 1.0080 1.0080 1.0089 1.0089 1.0095 1.0095 2.1268 2.1268 2.1282 2.1282 2.1284 2.1284 2.1314 2.1314 3.1237 3.1237 3.1241 3.1241 3.1242 3.1242 3.1280 3.1280 4.4246 4.4246 4.4351 4.4351 4.4351 4.4351 4.4361 4.4361 6.0031 6.0031 6.0050 6.0050 6.0055 6.0055 6.0110 6.0110 13.1441 13.1441 13.1445 13.1445 13.1448 13.1448 13.1451 13.1451 15.9267 15.9267 15.9272 15.9274 k = 0.5000 0.1345 0.1512 ( 4304 PWs) bands (ev): -14.1079 -14.1079 -14.1079 -14.1079 -14.1079 -14.1079 -14.1079 -14.1079 -9.7885 -9.7885 -9.7878 -9.7878 -9.7877 -9.7877 -9.7870 -9.7870 -3.2138 -3.2138 -3.2136 -3.2136 -3.2136 -3.2136 -3.2135 -3.2135 0.9802 0.9802 0.9817 0.9817 0.9825 0.9825 0.9830 0.9830 2.1482 2.1482 2.1494 2.1494 2.1499 2.1499 2.1528 2.1528 3.1341 3.1341 3.1346 3.1346 3.1347 3.1347 3.1387 3.1387 4.4259 4.4259 4.4364 4.4364 4.4369 4.4369 4.4377 4.4377 6.0152 6.0152 6.0173 6.0173 6.0180 6.0180 6.0235 6.0235 13.1331 13.1331 13.1336 13.1336 13.1339 13.1339 13.1342 13.1342 15.9301 15.9304 15.9307 15.9308 k = 0.5000 0.1434 0.1512 ( 4312 PWs) bands (ev): -14.1066 -14.1066 -14.1066 -14.1066 -14.1066 -14.1066 -14.1066 -14.1066 -9.7898 -9.7898 -9.7891 -9.7891 -9.7891 -9.7891 -9.7883 -9.7883 -3.2191 -3.2191 -3.2189 -3.2189 -3.2189 -3.2189 -3.2188 -3.2188 0.9536 0.9536 0.9550 0.9550 0.9559 0.9559 0.9563 0.9563 2.1708 2.1708 2.1719 2.1719 2.1728 2.1728 2.1755 2.1755 3.1428 3.1428 3.1433 3.1433 3.1436 3.1436 3.1476 3.1476 4.4283 4.4283 4.4386 4.4386 4.4397 4.4397 4.4402 4.4402 6.0274 6.0274 6.0295 6.0295 6.0304 6.0304 6.0359 6.0359 13.1223 13.1223 13.1228 13.1228 13.1231 13.1231 13.1233 13.1233 15.9332 15.9332 15.9335 15.9340 k = 0.5000 0.1524 0.1512 ( 4304 PWs) bands (ev): -14.1052 -14.1052 -14.1052 -14.1052 -14.1052 -14.1052 -14.1052 -14.1052 -9.7912 -9.7912 -9.7904 -9.7904 -9.7904 -9.7904 -9.7896 -9.7896 -3.2244 -3.2244 -3.2243 -3.2243 -3.2242 -3.2242 -3.2241 -3.2241 0.9269 0.9269 0.9284 0.9284 0.9292 0.9292 0.9296 0.9296 2.1948 2.1948 2.1958 2.1958 2.1969 2.1969 2.1995 2.1995 3.1497 3.1497 3.1502 3.1502 3.1506 3.1506 3.1547 3.1547 4.4317 4.4317 4.4418 4.4418 4.4435 4.4435 4.4439 4.4439 6.0394 6.0394 6.0417 6.0417 6.0427 6.0427 6.0482 6.0482 13.1118 13.1118 13.1123 13.1123 13.1125 13.1125 13.1128 13.1128 15.9358 15.9358 15.9361 15.9363 k = 0.5000 0.1614 0.1512 ( 4304 PWs) bands (ev): -14.1038 -14.1038 -14.1038 -14.1038 -14.1038 -14.1038 -14.1038 -14.1038 -9.7925 -9.7925 -9.7918 -9.7918 -9.7917 -9.7917 -9.7909 -9.7909 -3.2298 -3.2298 -3.2296 -3.2296 -3.2296 -3.2296 -3.2294 -3.2294 0.9004 0.9004 0.9019 0.9019 0.9026 0.9026 0.9030 0.9030 2.2199 2.2199 2.2207 2.2207 2.2222 2.2222 2.2247 2.2247 3.1545 3.1545 3.1549 3.1549 3.1556 3.1556 3.1596 3.1596 4.4362 4.4362 4.4461 4.4461 4.4484 4.4484 4.4486 4.4486 6.0511 6.0511 6.0535 6.0535 6.0548 6.0548 6.0602 6.0602 13.1016 13.1016 13.1021 13.1021 13.1023 13.1023 13.1026 13.1026 15.9379 15.9380 15.9381 15.9386 k = 0.5000 0.1703 0.1512 ( 4312 PWs) bands (ev): -14.1025 -14.1025 -14.1025 -14.1025 -14.1025 -14.1025 -14.1024 -14.1024 -9.7939 -9.7939 -9.7932 -9.7932 -9.7930 -9.7930 -9.7923 -9.7923 -3.2351 -3.2351 -3.2349 -3.2349 -3.2349 -3.2349 -3.2347 -3.2347 0.8743 0.8743 0.8757 0.8757 0.8764 0.8764 0.8768 0.8768 2.2461 2.2461 2.2468 2.2468 2.2486 2.2486 2.2509 2.2509 3.1570 3.1570 3.1573 3.1573 3.1582 3.1582 3.1622 3.1622 4.4420 4.4420 4.4516 4.4516 4.4544 4.4544 4.4545 4.4545 6.0625 6.0625 6.0649 6.0649 6.0665 6.0665 6.0718 6.0718 13.0918 13.0918 13.0923 13.0923 13.0925 13.0925 13.0928 13.0928 15.9393 15.9394 15.9395 15.9396 k = 0.5000 0.1793 0.1512 ( 4312 PWs) bands (ev): -14.1011 -14.1011 -14.1011 -14.1011 -14.1011 -14.1011 -14.1011 -14.1011 -9.7952 -9.7952 -9.7945 -9.7945 -9.7943 -9.7943 -9.7936 -9.7936 -3.2402 -3.2402 -3.2401 -3.2401 -3.2400 -3.2400 -3.2399 -3.2399 0.8487 0.8487 0.8501 0.8501 0.8508 0.8508 0.8510 0.8510 2.2733 2.2733 2.2738 2.2738 2.2759 2.2759 2.2782 2.2782 3.1570 3.1570 3.1573 3.1573 3.1584 3.1584 3.1624 3.1624 4.4489 4.4489 4.4582 4.4582 4.4615 4.4615 4.4616 4.4616 6.0734 6.0734 6.0759 6.0759 6.0777 6.0777 6.0829 6.0829 13.0826 13.0826 13.0831 13.0831 13.0833 13.0833 13.0835 13.0835 15.9402 15.9403 15.9403 15.9403 k = 0.5000 0.1883 0.1512 ( 4312 PWs) bands (ev): -14.0997 -14.0997 -14.0997 -14.0997 -14.0997 -14.0997 -14.0997 -14.0997 -9.7965 -9.7965 -9.7959 -9.7959 -9.7956 -9.7956 -9.7949 -9.7949 -3.2453 -3.2453 -3.2451 -3.2451 -3.2451 -3.2451 -3.2449 -3.2449 0.8238 0.8238 0.8251 0.8251 0.8258 0.8258 0.8260 0.8260 2.3014 2.3014 2.3018 2.3018 2.3040 2.3040 2.3063 2.3063 3.1547 3.1547 3.1548 3.1548 3.1562 3.1562 3.1601 3.1601 4.4570 4.4570 4.4659 4.4659 4.4697 4.4697 4.4698 4.4698 6.0838 6.0838 6.0862 6.0862 6.0883 6.0883 6.0934 6.0934 13.0739 13.0739 13.0744 13.0744 13.0746 13.0746 13.0748 13.0748 15.9405 15.9405 15.9405 15.9405 k = 0.5000 0.1972 0.1512 ( 4308 PWs) bands (ev): -14.0984 -14.0984 -14.0984 -14.0984 -14.0984 -14.0984 -14.0984 -14.0984 -9.7978 -9.7978 -9.7972 -9.7972 -9.7968 -9.7968 -9.7962 -9.7962 -3.2502 -3.2502 -3.2500 -3.2500 -3.2499 -3.2499 -3.2498 -3.2498 0.7998 0.7998 0.8011 0.8011 0.8017 0.8017 0.8019 0.8019 2.3302 2.3302 2.3304 2.3304 2.3329 2.3329 2.3351 2.3351 3.1498 3.1498 3.1498 3.1498 3.1514 3.1514 3.1553 3.1553 4.4660 4.4660 4.4745 4.4745 4.4788 4.4788 4.4790 4.4790 6.0935 6.0935 6.0959 6.0959 6.0983 6.0983 6.1032 6.1032 13.0659 13.0659 13.0664 13.0664 13.0666 13.0666 13.0668 13.0668 15.9401 15.9401 15.9402 15.9402 k = 0.5000 0.2062 0.1512 ( 4316 PWs) bands (ev): -14.0972 -14.0972 -14.0971 -14.0971 -14.0971 -14.0971 -14.0971 -14.0971 -9.7990 -9.7990 -9.7985 -9.7985 -9.7981 -9.7981 -9.7975 -9.7975 -3.2549 -3.2549 -3.2547 -3.2547 -3.2546 -3.2546 -3.2545 -3.2545 0.7768 0.7768 0.7781 0.7781 0.7787 0.7787 0.7788 0.7788 2.3597 2.3597 2.3597 2.3597 2.3624 2.3624 2.3646 2.3646 3.1423 3.1423 3.1425 3.1425 3.1442 3.1442 3.1481 3.1481 4.4760 4.4760 4.4840 4.4840 4.4888 4.4888 4.4891 4.4891 6.1025 6.1025 6.1049 6.1049 6.1076 6.1076 6.1123 6.1123 13.0586 13.0586 13.0590 13.0590 13.0592 13.0592 13.0593 13.0593 15.9392 15.9392 15.9393 15.9395 k = 0.5000 0.2152 0.1512 ( 4308 PWs) bands (ev): -14.0959 -14.0959 -14.0959 -14.0959 -14.0959 -14.0959 -14.0959 -14.0959 -9.8002 -9.8002 -9.7997 -9.7997 -9.7992 -9.7992 -9.7987 -9.7987 -3.2593 -3.2593 -3.2591 -3.2591 -3.2591 -3.2591 -3.2589 -3.2589 0.7549 0.7549 0.7562 0.7562 0.7568 0.7568 0.7568 0.7568 2.3895 2.3895 2.3897 2.3897 2.3924 2.3924 2.3946 2.3946 3.1325 3.1325 3.1328 3.1328 3.1346 3.1346 3.1384 3.1384 4.4866 4.4866 4.4942 4.4942 4.4995 4.4995 4.4998 4.4998 6.1107 6.1107 6.1131 6.1131 6.1162 6.1162 6.1206 6.1206 13.0519 13.0519 13.0524 13.0524 13.0525 13.0525 13.0526 13.0526 15.9377 15.9377 15.9378 15.9379 k = 0.5000 0.2241 0.1512 ( 4312 PWs) bands (ev): -14.0948 -14.0948 -14.0947 -14.0947 -14.0947 -14.0947 -14.0947 -14.0947 -9.8014 -9.8014 -9.8009 -9.8009 -9.8004 -9.8004 -9.7999 -9.7999 -3.2635 -3.2635 -3.2634 -3.2634 -3.2633 -3.2633 -3.2631 -3.2631 0.7344 0.7344 0.7357 0.7357 0.7361 0.7361 0.7362 0.7362 2.4197 2.4197 2.4200 2.4200 2.4228 2.4228 2.4249 2.4249 3.1204 3.1204 3.1209 3.1209 3.1227 3.1227 3.1265 3.1265 4.4978 4.4978 4.5048 4.5048 4.5106 4.5106 4.5110 4.5110 6.1182 6.1182 6.1205 6.1205 6.1239 6.1239 6.1281 6.1281 13.0459 13.0459 13.0464 13.0464 13.0465 13.0465 13.0466 13.0466 15.9358 15.9358 15.9360 15.9360 k = 0.5000 0.2331 0.1512 ( 4316 PWs) bands (ev): -14.0937 -14.0937 -14.0936 -14.0936 -14.0936 -14.0936 -14.0936 -14.0936 -9.8025 -9.8025 -9.8020 -9.8020 -9.8014 -9.8014 -9.8010 -9.8010 -3.2674 -3.2674 -3.2673 -3.2673 -3.2672 -3.2672 -3.2670 -3.2670 0.7153 0.7153 0.7165 0.7165 0.7168 0.7168 0.7169 0.7169 2.4500 2.4500 2.4506 2.4506 2.4533 2.4533 2.4554 2.4554 3.1062 3.1062 3.1070 3.1070 3.1087 3.1087 3.1125 3.1125 4.5092 4.5092 4.5156 4.5156 4.5219 4.5219 4.5224 4.5224 6.1249 6.1249 6.1271 6.1271 6.1309 6.1309 6.1348 6.1348 13.0406 13.0406 13.0410 13.0410 13.0412 13.0412 13.0412 13.0412 15.9335 15.9335 15.9337 15.9337 k = 0.5000 0.2420 0.1512 ( 4312 PWs) bands (ev): -14.0926 -14.0926 -14.0926 -14.0926 -14.0926 -14.0926 -14.0926 -14.0926 -9.8035 -9.8035 -9.8031 -9.8031 -9.8024 -9.8024 -9.8020 -9.8020 -3.2710 -3.2710 -3.2709 -3.2709 -3.2708 -3.2708 -3.2707 -3.2707 0.6977 0.6977 0.6988 0.6988 0.6991 0.6991 0.6992 0.6992 2.4803 2.4803 2.4811 2.4811 2.4837 2.4837 2.4859 2.4859 3.0902 3.0902 3.0913 3.0913 3.0928 3.0928 3.0967 3.0967 4.5206 4.5206 4.5264 4.5264 4.5333 4.5333 4.5337 4.5337 6.1309 6.1309 6.1329 6.1329 6.1371 6.1371 6.1407 6.1407 13.0360 13.0360 13.0364 13.0364 13.0365 13.0365 13.0366 13.0366 15.9309 15.9309 15.9312 15.9312 k = 0.5000 0.2510 0.1512 ( 4316 PWs) bands (ev): -14.0917 -14.0917 -14.0917 -14.0917 -14.0917 -14.0917 -14.0917 -14.0917 -9.8044 -9.8044 -9.8040 -9.8040 -9.8033 -9.8033 -9.8029 -9.8029 -3.2743 -3.2743 -3.2742 -3.2742 -3.2741 -3.2741 -3.2739 -3.2739 0.6816 0.6816 0.6828 0.6828 0.6829 0.6829 0.6832 0.6832 2.5104 2.5104 2.5115 2.5115 2.5139 2.5139 2.5162 2.5162 3.0726 3.0726 3.0741 3.0741 3.0754 3.0754 3.0794 3.0794 4.5317 4.5317 4.5370 4.5370 4.5443 4.5443 4.5448 4.5448 6.1360 6.1360 6.1379 6.1379 6.1425 6.1425 6.1458 6.1458 13.0320 13.0320 13.0323 13.0323 13.0325 13.0325 13.0325 13.0325 15.9282 15.9282 15.9285 15.9285 k = 0.5000 0.2600 0.1512 ( 4320 PWs) bands (ev): -14.0908 -14.0908 -14.0908 -14.0908 -14.0908 -14.0908 -14.0908 -14.0908 -9.8052 -9.8052 -9.8049 -9.8049 -9.8041 -9.8041 -9.8038 -9.8038 -3.2772 -3.2772 -3.2771 -3.2771 -3.2770 -3.2770 -3.2769 -3.2769 0.6673 0.6673 0.6684 0.6684 0.6685 0.6685 0.6688 0.6688 2.5399 2.5399 2.5414 2.5414 2.5434 2.5434 2.5459 2.5459 3.0539 3.0539 3.0558 3.0558 3.0568 3.0568 3.0609 3.0609 4.5423 4.5423 4.5469 4.5469 4.5548 4.5548 4.5552 4.5552 6.1405 6.1405 6.1421 6.1421 6.1472 6.1472 6.1501 6.1501 13.0286 13.0286 13.0289 13.0289 13.0290 13.0290 13.0291 13.0291 15.9255 15.9255 15.9257 15.9257 k = 0.5000 0.2689 0.1512 ( 4320 PWs) bands (ev): -14.0901 -14.0901 -14.0901 -14.0901 -14.0901 -14.0901 -14.0901 -14.0901 -9.8059 -9.8059 -9.8057 -9.8057 -9.8048 -9.8048 -9.8045 -9.8045 -3.2798 -3.2798 -3.2797 -3.2797 -3.2796 -3.2796 -3.2795 -3.2795 0.6548 0.6548 0.6558 0.6558 0.6558 0.6558 0.6561 0.6561 2.5686 2.5686 2.5703 2.5703 2.5720 2.5720 2.5746 2.5746 3.0345 3.0345 3.0368 3.0368 3.0374 3.0374 3.0416 3.0416 4.5521 4.5521 4.5561 4.5561 4.5645 4.5645 4.5649 4.5649 6.1442 6.1442 6.1457 6.1457 6.1511 6.1511 6.1537 6.1537 13.0258 13.0258 13.0261 13.0261 13.0262 13.0262 13.0262 13.0262 15.9228 15.9228 15.9230 15.9230 k = 0.5000 0.2779 0.1512 ( 4324 PWs) bands (ev): -14.0895 -14.0895 -14.0894 -14.0894 -14.0894 -14.0894 -14.0894 -14.0894 -9.8066 -9.8066 -9.8064 -9.8064 -9.8054 -9.8054 -9.8052 -9.8052 -3.2820 -3.2820 -3.2819 -3.2819 -3.2818 -3.2818 -3.2817 -3.2817 0.6441 0.6441 0.6449 0.6449 0.6451 0.6451 0.6453 0.6453 2.5957 2.5957 2.5979 2.5979 2.5991 2.5991 2.6020 2.6020 3.0149 3.0149 3.0177 3.0177 3.0178 3.0178 3.0222 3.0222 4.5609 4.5609 4.5643 4.5643 4.5731 4.5731 4.5735 4.5735 6.1473 6.1473 6.1486 6.1486 6.1544 6.1544 6.1566 6.1566 13.0235 13.0235 13.0238 13.0238 13.0238 13.0238 13.0238 13.0238 15.9204 15.9204 15.9206 15.9206 k = 0.5000 0.2869 0.1512 ( 4340 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0889 -14.0889 -14.0889 -14.0889 -9.8071 -9.8071 -9.8069 -9.8069 -9.8059 -9.8059 -9.8057 -9.8057 -3.2838 -3.2838 -3.2838 -3.2838 -3.2836 -3.2836 -3.2835 -3.2835 0.6353 0.6353 0.6359 0.6359 0.6362 0.6362 0.6364 0.6364 2.6208 2.6208 2.6234 2.6234 2.6239 2.6239 2.6270 2.6270 2.9960 2.9960 2.9987 2.9987 2.9994 2.9994 3.0034 3.0034 4.5685 4.5685 4.5712 4.5712 4.5805 4.5805 4.5808 4.5808 6.1498 6.1498 6.1508 6.1508 6.1571 6.1571 6.1588 6.1588 13.0217 13.0217 13.0219 13.0219 13.0219 13.0219 13.0220 13.0220 15.9182 15.9182 15.9183 15.9183 k = 0.5000 0.2958 0.1512 ( 4340 PWs) bands (ev): -14.0885 -14.0885 -14.0885 -14.0885 -14.0885 -14.0885 -14.0885 -14.0885 -9.8075 -9.8075 -9.8074 -9.8074 -9.8063 -9.8063 -9.8062 -9.8062 -3.2853 -3.2853 -3.2852 -3.2852 -3.2850 -3.2850 -3.2850 -3.2850 0.6284 0.6284 0.6288 0.6288 0.6293 0.6293 0.6294 0.6294 2.6428 2.6428 2.6454 2.6454 2.6459 2.6459 2.6489 2.6489 2.9789 2.9789 2.9812 2.9812 2.9828 2.9828 2.9862 2.9862 4.5747 4.5747 4.5767 4.5767 4.5865 4.5865 4.5867 4.5867 6.1517 6.1517 6.1525 6.1525 6.1592 6.1592 6.1605 6.1605 13.0203 13.0203 13.0205 13.0205 13.0205 13.0205 13.0205 13.0205 15.9164 15.9164 15.9165 15.9165 k = 0.5000 0.3048 0.1512 ( 4340 PWs) bands (ev): -14.0882 -14.0882 -14.0882 -14.0882 -14.0882 -14.0882 -14.0882 -14.0882 -9.8078 -9.8078 -9.8077 -9.8077 -9.8066 -9.8066 -9.8065 -9.8065 -3.2863 -3.2863 -3.2862 -3.2862 -3.2860 -3.2860 -3.2860 -3.2860 0.6234 0.6234 0.6238 0.6238 0.6243 0.6243 0.6244 0.6244 2.6604 2.6604 2.6623 2.6623 2.6640 2.6640 2.6662 2.6662 2.9649 2.9649 2.9667 2.9667 2.9695 2.9695 2.9719 2.9719 4.5793 4.5793 4.5806 4.5806 4.5909 4.5909 4.5910 4.5910 6.1531 6.1531 6.1536 6.1536 6.1607 6.1607 6.1616 6.1616 13.0194 13.0194 13.0195 13.0195 13.0195 13.0195 13.0196 13.0196 15.9151 15.9151 15.9151 15.9151 k = 0.5000 0.3138 0.1512 ( 4344 PWs) bands (ev): -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -9.8079 -9.8079 -9.8079 -9.8079 -9.8067 -9.8067 -9.8067 -9.8067 -3.2869 -3.2869 -3.2869 -3.2869 -3.2866 -3.2866 -3.2866 -3.2866 0.6205 0.6205 0.6207 0.6207 0.6213 0.6213 0.6214 0.6214 2.6721 2.6721 2.6732 2.6732 2.6761 2.6761 2.6773 2.6773 2.9558 2.9558 2.9567 2.9567 2.9608 2.9608 2.9621 2.9621 4.5822 4.5822 4.5829 4.5829 4.5935 4.5935 4.5936 4.5936 6.1539 6.1539 6.1542 6.1542 6.1617 6.1617 6.1621 6.1621 13.0188 13.0188 13.0189 13.0189 13.0190 13.0190 13.0190 13.0190 15.9142 15.9142 15.9143 15.9143 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -9.8080 -9.8080 -9.8080 -9.8080 -9.8068 -9.8068 -9.8068 -9.8068 -3.2871 -3.2871 -3.2871 -3.2871 -3.2868 -3.2868 -3.2868 -3.2868 0.6196 0.6196 0.6196 0.6196 0.6203 0.6203 0.6203 0.6203 2.6766 2.6766 2.6766 2.6766 2.6808 2.6808 2.6808 2.6808 2.9529 2.9529 2.9529 2.9529 2.9582 2.9582 2.9582 2.9582 4.5834 4.5834 4.5834 4.5834 4.5945 4.5945 4.5945 4.5945 6.1543 6.1543 6.1543 6.1543 6.1622 6.1622 6.1622 6.1622 13.0187 13.0187 13.0187 13.0187 13.0188 13.0188 13.0188 13.0188 15.9140 15.9140 15.9140 15.9140 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -9.8080 -9.8080 -9.8080 -9.8080 -9.8068 -9.8068 -9.8068 -9.8068 -3.2871 -3.2871 -3.2871 -3.2871 -3.2868 -3.2868 -3.2868 -3.2868 0.6196 0.6196 0.6196 0.6196 0.6203 0.6203 0.6203 0.6203 2.6766 2.6766 2.6766 2.6766 2.6808 2.6808 2.6808 2.6808 2.9529 2.9529 2.9529 2.9529 2.9582 2.9582 2.9582 2.9582 4.5834 4.5834 4.5834 4.5834 4.5945 4.5945 4.5945 4.5945 6.1543 6.1543 6.1543 6.1543 6.1622 6.1622 6.1622 6.1622 13.0187 13.0187 13.0187 13.0187 13.0188 13.0188 13.0188 13.0188 15.9140 15.9140 15.9140 15.9140 k = 0.4911 0.3227 0.1512 ( 4352 PWs) bands (ev): -14.1487 -14.1487 -14.1487 -14.1487 -14.0278 -14.0278 -14.0278 -14.0278 -9.8109 -9.8109 -9.8109 -9.8109 -9.8048 -9.8048 -9.8048 -9.8048 -3.3076 -3.3076 -3.3076 -3.3076 -3.2637 -3.2637 -3.2637 -3.2637 0.6039 0.6039 0.6039 0.6039 0.6371 0.6371 0.6371 0.6371 2.6413 2.6413 2.6413 2.6413 2.7142 2.7142 2.7142 2.7142 2.9430 2.9430 2.9430 2.9430 2.9716 2.9716 2.9716 2.9716 4.5813 4.5813 4.5813 4.5813 4.5964 4.5964 4.5964 4.5964 6.1542 6.1542 6.1542 6.1542 6.1622 6.1622 6.1622 6.1622 13.0132 13.0132 13.0132 13.0132 13.0245 13.0245 13.0245 13.0245 15.9035 15.9035 15.9035 15.9035 k = 0.4821 0.3227 0.1512 ( 4356 PWs) bands (ev): -14.2100 -14.2100 -14.2100 -14.2100 -13.9684 -13.9684 -13.9684 -13.9684 -9.8154 -9.8154 -9.8154 -9.8154 -9.8034 -9.8034 -9.8034 -9.8034 -3.3256 -3.3256 -3.3256 -3.3256 -3.2381 -3.2381 -3.2381 -3.2381 0.5889 0.5889 0.5889 0.5889 0.6555 0.6555 0.6555 0.6555 2.6036 2.6036 2.6036 2.6036 2.7455 2.7455 2.7455 2.7455 2.9367 2.9367 2.9367 2.9367 2.9895 2.9895 2.9895 2.9895 4.5770 4.5770 4.5770 4.5770 4.6003 4.6003 4.6003 4.6003 6.1539 6.1539 6.1539 6.1539 6.1625 6.1625 6.1625 6.1625 13.0082 13.0082 13.0082 13.0082 13.0305 13.0305 13.0305 13.0305 15.8926 15.8926 15.8926 15.8926 k = 0.4732 0.3227 0.1512 ( 4356 PWs) bands (ev): -14.2717 -14.2717 -14.2717 -14.2717 -13.9097 -13.9097 -13.9097 -13.9097 -9.8208 -9.8208 -9.8208 -9.8208 -9.8029 -9.8029 -9.8029 -9.8029 -3.3407 -3.3407 -3.3407 -3.3407 -3.2102 -3.2102 -3.2102 -3.2102 0.5748 0.5748 0.5748 0.5748 0.6750 0.6750 0.6750 0.6750 2.5662 2.5662 2.5662 2.5662 2.7692 2.7692 2.7692 2.7692 2.9395 2.9395 2.9395 2.9395 3.0087 3.0087 3.0087 3.0087 4.5721 4.5721 4.5721 4.5721 4.6044 4.6044 4.6044 4.6044 6.1534 6.1534 6.1534 6.1534 6.1628 6.1628 6.1628 6.1628 13.0038 13.0038 13.0038 13.0038 13.0364 13.0364 13.0364 13.0364 15.8825 15.8825 15.8825 15.8825 k = 0.4643 0.3227 0.1512 ( 4336 PWs) bands (ev): -14.3337 -14.3337 -14.3337 -14.3337 -13.8520 -13.8520 -13.8520 -13.8520 -9.8272 -9.8272 -9.8272 -9.8272 -9.8034 -9.8034 -9.8034 -9.8034 -3.3529 -3.3529 -3.3529 -3.3529 -3.1802 -3.1802 -3.1802 -3.1802 0.5617 0.5617 0.5617 0.5617 0.6958 0.6958 0.6958 0.6958 2.5298 2.5298 2.5298 2.5298 2.7825 2.7825 2.7825 2.7825 2.9546 2.9546 2.9546 2.9546 3.0289 3.0289 3.0289 3.0289 4.5672 4.5672 4.5672 4.5672 4.6084 4.6084 4.6084 4.6084 6.1527 6.1527 6.1527 6.1527 6.1632 6.1632 6.1632 6.1632 13.0002 13.0002 13.0002 13.0002 13.0422 13.0422 13.0422 13.0422 15.8730 15.8730 15.8730 15.8730 k = 0.4554 0.3227 0.1512 ( 4340 PWs) bands (ev): -14.3960 -14.3960 -14.3960 -14.3960 -13.7952 -13.7952 -13.7952 -13.7952 -9.8346 -9.8346 -9.8346 -9.8346 -9.8049 -9.8049 -9.8049 -9.8049 -3.3620 -3.3620 -3.3620 -3.3620 -3.1483 -3.1483 -3.1483 -3.1483 0.5492 0.5492 0.5492 0.5492 0.7177 0.7177 0.7177 0.7177 2.4947 2.4947 2.4947 2.4947 2.7861 2.7861 2.7861 2.7861 2.9810 2.9810 2.9810 2.9810 3.0494 3.0494 3.0494 3.0494 4.5623 4.5623 4.5623 4.5623 4.6121 4.6121 4.6121 4.6121 6.1520 6.1520 6.1520 6.1520 6.1636 6.1636 6.1636 6.1636 12.9975 12.9975 12.9975 12.9975 13.0477 13.0477 13.0477 13.0477 15.8639 15.8639 15.8639 15.8639 k = 0.4464 0.3227 0.1512 ( 4336 PWs) bands (ev): -14.4584 -14.4584 -14.4584 -14.4584 -13.7394 -13.7394 -13.7394 -13.7394 -9.8428 -9.8428 -9.8428 -9.8428 -9.8074 -9.8074 -9.8074 -9.8074 -3.3679 -3.3679 -3.3679 -3.3679 -3.1146 -3.1146 -3.1146 -3.1146 0.5374 0.5374 0.5374 0.5374 0.7408 0.7408 0.7408 0.7408 2.4612 2.4612 2.4612 2.4612 2.7837 2.7837 2.7837 2.7837 3.0153 3.0153 3.0153 3.0153 3.0702 3.0702 3.0702 3.0702 4.5577 4.5577 4.5577 4.5577 4.6153 4.6153 4.6153 4.6153 6.1513 6.1513 6.1513 6.1513 6.1639 6.1639 6.1639 6.1639 12.9958 12.9958 12.9958 12.9958 13.0527 13.0527 13.0527 13.0527 15.8552 15.8552 15.8552 15.8552 k = 0.4375 0.3227 0.1512 ( 4336 PWs) bands (ev): -14.5209 -14.5209 -14.5209 -14.5209 -13.6848 -13.6848 -13.6848 -13.6848 -9.8519 -9.8519 -9.8519 -9.8519 -9.8109 -9.8109 -9.8109 -9.8109 -3.3704 -3.3704 -3.3704 -3.3704 -3.0794 -3.0794 -3.0794 -3.0794 0.5260 0.5260 0.5260 0.5260 0.7650 0.7650 0.7650 0.7650 2.4297 2.4297 2.4297 2.4297 2.7786 2.7786 2.7786 2.7786 3.0539 3.0539 3.0539 3.0539 3.0911 3.0911 3.0911 3.0911 4.5534 4.5534 4.5534 4.5534 4.6182 4.6182 4.6182 4.6182 6.1506 6.1506 6.1506 6.1506 6.1642 6.1642 6.1642 6.1642 12.9953 12.9953 12.9953 12.9953 13.0571 13.0571 13.0571 13.0571 15.8466 15.8466 15.8466 15.8466 k = 0.4286 0.3227 0.1512 ( 4332 PWs) bands (ev): -14.5833 -14.5833 -14.5833 -14.5833 -13.6314 -13.6314 -13.6314 -13.6314 -9.8618 -9.8618 -9.8618 -9.8618 -9.8154 -9.8154 -9.8154 -9.8154 -3.3696 -3.3696 -3.3696 -3.3696 -3.0428 -3.0428 -3.0428 -3.0428 0.5150 0.5150 0.5150 0.5150 0.7902 0.7902 0.7902 0.7902 2.4004 2.4004 2.4004 2.4004 2.7729 2.7729 2.7729 2.7729 3.0944 3.0944 3.0944 3.0944 3.1123 3.1123 3.1123 3.1123 4.5497 4.5497 4.5497 4.5497 4.6205 4.6205 4.6205 4.6205 6.1499 6.1499 6.1499 6.1499 6.1643 6.1643 6.1643 6.1643 12.9962 12.9962 12.9962 12.9962 13.0608 13.0608 13.0608 13.0608 15.8380 15.8380 15.8380 15.8380 k = 0.4196 0.3227 0.1512 ( 4324 PWs) bands (ev): -14.6457 -14.6457 -14.6457 -14.6457 -13.5793 -13.5793 -13.5793 -13.5793 -9.8725 -9.8725 -9.8725 -9.8725 -9.8207 -9.8207 -9.8207 -9.8207 -3.3652 -3.3652 -3.3652 -3.3652 -3.0050 -3.0050 -3.0050 -3.0050 0.5041 0.5041 0.5041 0.5041 0.8163 0.8163 0.8163 0.8163 2.3735 2.3735 2.3735 2.3735 2.7678 2.7678 2.7678 2.7678 3.1286 3.1286 3.1286 3.1286 3.1407 3.1407 3.1407 3.1407 4.5464 4.5464 4.5464 4.5464 4.6224 4.6224 4.6224 4.6224 6.1492 6.1492 6.1492 6.1492 6.1643 6.1643 6.1643 6.1643 12.9985 12.9985 12.9985 12.9985 13.0636 13.0636 13.0636 13.0636 15.8292 15.8292 15.8292 15.8292 k = 0.4107 0.3227 0.1512 ( 4320 PWs) bands (ev): -14.7079 -14.7079 -14.7079 -14.7079 -13.5286 -13.5286 -13.5286 -13.5286 -9.8840 -9.8840 -9.8840 -9.8840 -9.8270 -9.8270 -9.8270 -9.8270 -3.3573 -3.3573 -3.3573 -3.3573 -2.9661 -2.9661 -2.9661 -2.9661 0.4933 0.4933 0.4933 0.4933 0.8432 0.8432 0.8432 0.8432 2.3494 2.3494 2.3494 2.3494 2.7641 2.7641 2.7641 2.7641 3.1499 3.1499 3.1499 3.1499 3.1822 3.1822 3.1822 3.1822 4.5439 4.5439 4.5439 4.5439 4.6238 4.6238 4.6238 4.6238 6.1485 6.1485 6.1485 6.1485 6.1641 6.1641 6.1641 6.1641 13.0024 13.0024 13.0024 13.0024 13.0653 13.0653 13.0653 13.0653 15.8200 15.8200 15.8200 15.8200 k = 0.4018 0.3227 0.1512 ( 4320 PWs) bands (ev): -14.7698 -14.7698 -14.7698 -14.7698 -13.4793 -13.4793 -13.4793 -13.4793 -9.8962 -9.8962 -9.8962 -9.8962 -9.8342 -9.8342 -9.8342 -9.8342 -3.3457 -3.3457 -3.3457 -3.3457 -2.9264 -2.9264 -2.9264 -2.9264 0.4823 0.4823 0.4823 0.4823 0.8708 0.8708 0.8708 0.8708 2.3281 2.3281 2.3281 2.3281 2.7622 2.7622 2.7622 2.7622 3.1693 3.1693 3.1693 3.1693 3.2251 3.2251 3.2251 3.2251 4.5420 4.5420 4.5420 4.5420 4.6247 4.6247 4.6247 4.6247 6.1478 6.1478 6.1478 6.1478 6.1637 6.1637 6.1637 6.1637 13.0079 13.0079 13.0079 13.0079 13.0658 13.0658 13.0658 13.0658 15.8101 15.8101 15.8101 15.8101 k = 0.3929 0.3227 0.1512 ( 4324 PWs) bands (ev): -14.8313 -14.8313 -14.8313 -14.8313 -13.4315 -13.4315 -13.4315 -13.4315 -9.9090 -9.9090 -9.9090 -9.9090 -9.8421 -9.8421 -9.8421 -9.8421 -3.3305 -3.3305 -3.3305 -3.3305 -2.8861 -2.8861 -2.8861 -2.8861 0.4710 0.4710 0.4710 0.4710 0.8989 0.8989 0.8989 0.8989 2.3099 2.3099 2.3099 2.3099 2.7623 2.7623 2.7623 2.7623 3.1881 3.1881 3.1881 3.1881 3.2679 3.2679 3.2679 3.2679 4.5410 4.5410 4.5410 4.5410 4.6252 4.6252 4.6252 4.6252 6.1472 6.1472 6.1472 6.1472 6.1632 6.1632 6.1632 6.1632 13.0152 13.0152 13.0152 13.0152 13.0650 13.0650 13.0650 13.0650 15.7993 15.7993 15.7993 15.7993 k = 0.3839 0.3227 0.1512 ( 4316 PWs) bands (ev): -14.8925 -14.8925 -14.8925 -14.8925 -13.3852 -13.3852 -13.3852 -13.3852 -9.9225 -9.9225 -9.9225 -9.9225 -9.8509 -9.8509 -9.8509 -9.8509 -3.3115 -3.3115 -3.3115 -3.3115 -2.8454 -2.8454 -2.8454 -2.8454 0.4593 0.4593 0.4593 0.4593 0.9274 0.9274 0.9274 0.9274 2.2949 2.2949 2.2949 2.2949 2.7647 2.7647 2.7647 2.7647 3.2062 3.2062 3.2062 3.2062 3.3104 3.3104 3.3104 3.3104 4.5408 4.5408 4.5408 4.5408 4.6253 4.6253 4.6253 4.6253 6.1466 6.1466 6.1466 6.1466 6.1624 6.1624 6.1624 6.1624 13.0244 13.0244 13.0244 13.0244 13.0628 13.0628 13.0628 13.0628 15.7875 15.7875 15.7875 15.7875 k = 0.3750 0.3227 0.1512 ( 4324 PWs) bands (ev): -14.9531 -14.9531 -14.9531 -14.9531 -13.3406 -13.3406 -13.3406 -13.3406 -9.9365 -9.9365 -9.9365 -9.9365 -9.8604 -9.8604 -9.8604 -9.8604 -3.2887 -3.2887 -3.2887 -3.2887 -2.8045 -2.8045 -2.8045 -2.8045 0.4471 0.4471 0.4471 0.4471 0.9562 0.9562 0.9562 0.9562 2.2834 2.2834 2.2834 2.2834 2.7694 2.7694 2.7694 2.7694 3.2237 3.2237 3.2237 3.2237 3.3522 3.3522 3.3522 3.3522 4.5415 4.5415 4.5415 4.5415 4.6250 4.6250 4.6250 4.6250 6.1460 6.1460 6.1460 6.1460 6.1615 6.1615 6.1615 6.1615 13.0356 13.0356 13.0356 13.0356 13.0590 13.0590 13.0590 13.0590 15.7742 15.7742 15.7742 15.7742 k = 0.3661 0.3227 0.1512 ( 4328 PWs) bands (ev): -15.0132 -15.0132 -15.0132 -15.0132 -13.2976 -13.2976 -13.2976 -13.2976 -9.9510 -9.9510 -9.9510 -9.9510 -9.8707 -9.8707 -9.8707 -9.8707 -3.2621 -3.2621 -3.2621 -3.2621 -2.7635 -2.7635 -2.7635 -2.7635 0.4343 0.4343 0.4343 0.4343 0.9850 0.9850 0.9850 0.9850 2.2753 2.2753 2.2753 2.2753 2.7765 2.7765 2.7765 2.7765 3.2408 3.2408 3.2408 3.2408 3.3932 3.3932 3.3932 3.3932 4.5433 4.5433 4.5433 4.5433 4.6244 4.6244 4.6244 4.6244 6.1455 6.1455 6.1455 6.1455 6.1603 6.1603 6.1603 6.1603 13.0481 13.0481 13.0481 13.0481 13.0542 13.0542 13.0542 13.0542 15.7593 15.7593 15.7593 15.7593 k = 0.3571 0.3227 0.1512 ( 4328 PWs) bands (ev): -15.0726 -15.0726 -15.0726 -15.0726 -13.2562 -13.2562 -13.2562 -13.2562 -9.9660 -9.9660 -9.9660 -9.9660 -9.8816 -9.8816 -9.8816 -9.8816 -3.2316 -3.2316 -3.2316 -3.2316 -2.7227 -2.7227 -2.7227 -2.7227 0.4208 0.4208 0.4208 0.4208 1.0137 1.0137 1.0137 1.0137 2.2709 2.2709 2.2709 2.2709 2.7859 2.7859 2.7859 2.7859 3.2575 3.2575 3.2575 3.2575 3.4334 3.4334 3.4334 3.4334 4.5460 4.5460 4.5460 4.5460 4.6236 4.6236 4.6236 4.6236 6.1449 6.1449 6.1449 6.1449 6.1588 6.1588 6.1588 6.1588 13.0457 13.0457 13.0457 13.0457 13.0648 13.0648 13.0648 13.0648 15.7425 15.7425 15.7425 15.7425 k = 0.3482 0.3227 0.1512 ( 4328 PWs) bands (ev): -15.1313 -15.1313 -15.1313 -15.1313 -13.2166 -13.2166 -13.2166 -13.2166 -9.9814 -9.9814 -9.9814 -9.9814 -9.8931 -9.8931 -9.8931 -9.8931 -3.1974 -3.1974 -3.1974 -3.1974 -2.6822 -2.6822 -2.6822 -2.6822 0.4065 0.4065 0.4065 0.4065 1.0423 1.0423 1.0423 1.0423 2.2701 2.2701 2.2701 2.2701 2.7976 2.7976 2.7976 2.7976 3.2738 3.2738 3.2738 3.2738 3.4726 3.4726 3.4726 3.4726 4.5498 4.5498 4.5498 4.5498 4.6227 4.6227 4.6227 4.6227 6.1443 6.1443 6.1443 6.1443 6.1571 6.1571 6.1571 6.1571 13.0366 13.0366 13.0366 13.0366 13.0823 13.0823 13.0823 13.0823 15.7236 15.7236 15.7236 15.7236 k = 0.3393 0.3227 0.1512 ( 4324 PWs) bands (ev): -15.1892 -15.1892 -15.1892 -15.1892 -13.1787 -13.1787 -13.1787 -13.1787 -9.9972 -9.9972 -9.9972 -9.9972 -9.9052 -9.9052 -9.9052 -9.9052 -3.1593 -3.1593 -3.1593 -3.1593 -2.6422 -2.6422 -2.6422 -2.6422 0.3913 0.3913 0.3913 0.3913 1.0707 1.0707 1.0707 1.0707 2.2730 2.2730 2.2730 2.2730 2.8114 2.8114 2.8114 2.8114 3.2899 3.2899 3.2899 3.2899 3.5108 3.5108 3.5108 3.5108 4.5546 4.5546 4.5546 4.5546 4.6218 4.6218 4.6218 4.6218 6.1437 6.1437 6.1437 6.1437 6.1552 6.1552 6.1552 6.1552 13.0255 13.0255 13.0255 13.0255 13.1021 13.1021 13.1021 13.1021 15.7021 15.7021 15.7021 15.7021 k = 0.3304 0.3227 0.1512 ( 4320 PWs) bands (ev): -15.2463 -15.2463 -15.2463 -15.2463 -13.1425 -13.1425 -13.1425 -13.1425 -10.0133 -10.0133 -10.0133 -10.0133 -9.9178 -9.9178 -9.9178 -9.9178 -3.1175 -3.1175 -3.1175 -3.1175 -2.6030 -2.6030 -2.6030 -2.6030 0.3754 0.3754 0.3754 0.3754 1.0987 1.0987 1.0987 1.0987 2.2794 2.2794 2.2794 2.2794 2.8272 2.8272 2.8272 2.8272 3.3060 3.3060 3.3060 3.3060 3.5479 3.5479 3.5479 3.5479 4.5606 4.5606 4.5606 4.5606 4.6209 4.6209 4.6209 4.6209 6.1429 6.1429 6.1429 6.1429 6.1531 6.1531 6.1531 6.1531 13.0123 13.0123 13.0123 13.0123 13.1243 13.1243 13.1243 13.1243 15.6778 15.6778 15.6778 15.6778 k = 0.3214 0.3227 0.1512 ( 4316 PWs) bands (ev): -15.3025 -15.3025 -15.3025 -15.3025 -13.1081 -13.1081 -13.1081 -13.1081 -10.0296 -10.0296 -10.0296 -10.0296 -9.9308 -9.9308 -9.9308 -9.9308 -3.0719 -3.0719 -3.0719 -3.0719 -2.5646 -2.5646 -2.5646 -2.5646 0.3586 0.3586 0.3586 0.3586 1.1263 1.1263 1.1263 1.1263 2.2893 2.2893 2.2893 2.2893 2.8445 2.8445 2.8445 2.8445 3.3221 3.3221 3.3221 3.3221 3.5840 3.5840 3.5840 3.5840 4.5676 4.5676 4.5676 4.5676 4.6202 4.6202 4.6202 4.6202 6.1420 6.1420 6.1420 6.1420 6.1509 6.1509 6.1509 6.1509 12.9971 12.9971 12.9971 12.9971 13.1489 13.1489 13.1489 13.1489 15.6505 15.6505 15.6505 15.6505 k = 0.3125 0.3227 0.1512 ( 4308 PWs) bands (ev): -15.3578 -15.3578 -15.3578 -15.3578 -13.0754 -13.0754 -13.0754 -13.0754 -10.0461 -10.0461 -10.0461 -10.0461 -9.9443 -9.9443 -9.9443 -9.9443 -3.0226 -3.0226 -3.0226 -3.0226 -2.5273 -2.5273 -2.5273 -2.5273 0.3410 0.3410 0.3410 0.3410 1.1536 1.1536 1.1536 1.1536 2.3025 2.3025 2.3025 2.3025 2.8633 2.8633 2.8633 2.8633 3.3384 3.3384 3.3384 3.3384 3.6191 3.6191 3.6191 3.6191 4.5756 4.5756 4.5756 4.5756 4.6199 4.6199 4.6199 4.6199 6.1407 6.1407 6.1407 6.1407 6.1486 6.1486 6.1486 6.1486 12.9796 12.9796 12.9796 12.9796 13.1757 13.1757 13.1757 13.1757 15.6197 15.6197 15.6197 15.6197 k = 0.3036 0.3227 0.1512 ( 4312 PWs) bands (ev): -15.4121 -15.4121 -15.4121 -15.4121 -13.0444 -13.0444 -13.0444 -13.0444 -10.0628 -10.0628 -10.0628 -10.0628 -9.9581 -9.9581 -9.9581 -9.9581 -2.9697 -2.9697 -2.9697 -2.9697 -2.4912 -2.4912 -2.4912 -2.4912 0.3227 0.3227 0.3227 0.3227 1.1804 1.1804 1.1804 1.1804 2.3188 2.3188 2.3188 2.3188 2.8829 2.8829 2.8829 2.8829 3.3552 3.3552 3.3552 3.3552 3.6533 3.6533 3.6533 3.6533 4.5847 4.5847 4.5847 4.5847 4.6200 4.6200 4.6200 4.6200 6.1388 6.1388 6.1388 6.1388 6.1465 6.1465 6.1465 6.1465 12.9600 12.9600 12.9600 12.9600 13.2050 13.2050 13.2050 13.2050 15.5853 15.5853 15.5853 15.5853 k = 0.2946 0.3227 0.1512 ( 4308 PWs) bands (ev): -15.4652 -15.4652 -15.4652 -15.4652 -13.0152 -13.0152 -13.0152 -13.0152 -10.0796 -10.0796 -10.0796 -10.0796 -9.9722 -9.9722 -9.9722 -9.9722 -2.9132 -2.9132 -2.9132 -2.9132 -2.4564 -2.4564 -2.4564 -2.4564 0.3036 0.3036 0.3036 0.3036 1.2069 1.2069 1.2069 1.2069 2.3379 2.3379 2.3379 2.3379 2.9031 2.9031 2.9031 2.9031 3.3724 3.3724 3.3724 3.3724 3.6866 3.6866 3.6866 3.6866 4.5947 4.5947 4.5947 4.5947 4.6210 4.6210 4.6210 4.6210 6.1363 6.1363 6.1363 6.1363 6.1448 6.1448 6.1448 6.1448 12.9382 12.9382 12.9382 12.9382 13.2366 13.2366 13.2366 13.2366 15.5470 15.5470 15.5470 15.5470 k = 0.2857 0.3227 0.1512 ( 4308 PWs) bands (ev): -15.5173 -15.5173 -15.5173 -15.5173 -12.9876 -12.9876 -12.9876 -12.9876 -10.0965 -10.0965 -10.0965 -10.0965 -9.9866 -9.9866 -9.9866 -9.9866 -2.8534 -2.8534 -2.8534 -2.8534 -2.4231 -2.4231 -2.4231 -2.4231 0.2839 0.2839 0.2839 0.2839 1.2330 1.2330 1.2330 1.2330 2.3596 2.3596 2.3596 2.3596 2.9233 2.9233 2.9233 2.9233 3.3903 3.3903 3.3903 3.3903 3.7192 3.7192 3.7192 3.7192 4.6053 4.6053 4.6053 4.6053 4.6234 4.6234 4.6234 4.6234 6.1330 6.1330 6.1330 6.1330 6.1433 6.1433 6.1433 6.1433 12.9142 12.9142 12.9142 12.9142 13.2704 13.2704 13.2704 13.2704 15.5045 15.5045 15.5045 15.5045 k = 0.2768 0.3227 0.1512 ( 4304 PWs) bands (ev): -15.5683 -15.5683 -15.5683 -15.5683 -12.9617 -12.9617 -12.9617 -12.9617 -10.1133 -10.1133 -10.1133 -10.1133 -10.0012 -10.0012 -10.0012 -10.0012 -2.7901 -2.7901 -2.7901 -2.7901 -2.3913 -2.3913 -2.3913 -2.3913 0.2636 0.2636 0.2636 0.2636 1.2589 1.2589 1.2589 1.2589 2.3836 2.3836 2.3836 2.3836 2.9431 2.9431 2.9431 2.9431 3.4090 3.4090 3.4090 3.4090 3.7512 3.7512 3.7512 3.7512 4.6150 4.6150 4.6150 4.6150 4.6285 4.6285 4.6285 4.6285 6.1292 6.1292 6.1292 6.1292 6.1420 6.1420 6.1420 6.1420 12.8881 12.8881 12.8881 12.8881 13.3065 13.3065 13.3065 13.3065 15.4576 15.4576 15.4576 15.4576 k = 0.2679 0.3227 0.1512 ( 4300 PWs) bands (ev): -15.6180 -15.6180 -15.6180 -15.6180 -12.9375 -12.9375 -12.9375 -12.9375 -10.1301 -10.1301 -10.1301 -10.1301 -10.0158 -10.0158 -10.0158 -10.0158 -2.7237 -2.7237 -2.7237 -2.7237 -2.3611 -2.3611 -2.3611 -2.3611 0.2427 0.2427 0.2427 0.2427 1.2844 1.2844 1.2844 1.2844 2.4095 2.4095 2.4095 2.4095 2.9620 2.9620 2.9620 2.9620 3.4285 3.4285 3.4285 3.4285 3.7827 3.7827 3.7827 3.7827 4.6221 4.6221 4.6221 4.6221 4.6387 4.6387 4.6387 4.6387 6.1248 6.1248 6.1248 6.1248 6.1407 6.1407 6.1407 6.1407 12.8598 12.8598 12.8598 12.8598 13.3449 13.3449 13.3449 13.3449 15.4062 15.4062 15.4062 15.4062 k = 0.2589 0.3227 0.1512 ( 4304 PWs) bands (ev): -15.6665 -15.6665 -15.6665 -15.6665 -12.9148 -12.9148 -12.9148 -12.9148 -10.1468 -10.1468 -10.1468 -10.1468 -10.0306 -10.0306 -10.0306 -10.0306 -2.6542 -2.6542 -2.6542 -2.6542 -2.3327 -2.3327 -2.3327 -2.3327 0.2215 0.2215 0.2215 0.2215 1.3096 1.3096 1.3096 1.3096 2.4372 2.4372 2.4372 2.4372 2.9794 2.9794 2.9794 2.9794 3.4490 3.4490 3.4490 3.4490 3.8139 3.8139 3.8139 3.8139 4.6278 4.6278 4.6278 4.6278 4.6525 4.6525 4.6525 4.6525 6.1200 6.1200 6.1200 6.1200 6.1394 6.1394 6.1394 6.1394 12.8295 12.8295 12.8295 12.8295 13.3853 13.3853 13.3853 13.3853 15.3503 15.3503 15.3503 15.3503 k = 0.2500 0.3227 0.1512 ( 4308 PWs) bands (ev): -15.7137 -15.7137 -15.7137 -15.7137 -12.8937 -12.8937 -12.8937 -12.8937 -10.1634 -10.1634 -10.1634 -10.1634 -10.0454 -10.0454 -10.0454 -10.0454 -2.5818 -2.5818 -2.5818 -2.5818 -2.3060 -2.3060 -2.3060 -2.3060 0.1998 0.1998 0.1998 0.1998 1.3346 1.3346 1.3346 1.3346 2.4663 2.4663 2.4663 2.4663 2.9948 2.9948 2.9948 2.9948 3.4704 3.4704 3.4704 3.4704 3.8448 3.8448 3.8448 3.8448 4.6342 4.6342 4.6342 4.6342 4.6685 4.6685 4.6685 4.6685 6.1147 6.1147 6.1147 6.1147 6.1380 6.1380 6.1380 6.1380 12.7971 12.7971 12.7971 12.7971 13.4277 13.4277 13.4277 13.4277 15.2898 15.2898 15.2898 15.2898 k = 0.2411 0.3227 0.1512 ( 4288 PWs) bands (ev): -15.7595 -15.7595 -15.7595 -15.7595 -12.8740 -12.8740 -12.8740 -12.8740 -10.1798 -10.1798 -10.1798 -10.1798 -10.0602 -10.0602 -10.0602 -10.0602 -2.5066 -2.5066 -2.5066 -2.5066 -2.2810 -2.2810 -2.2810 -2.2810 0.1780 0.1780 0.1780 0.1780 1.3593 1.3593 1.3593 1.3593 2.4966 2.4966 2.4966 2.4966 3.0077 3.0077 3.0077 3.0077 3.4928 3.4928 3.4928 3.4928 3.8755 3.8755 3.8755 3.8755 4.6419 4.6419 4.6419 4.6419 4.6861 4.6861 4.6861 4.6861 6.1091 6.1091 6.1091 6.1091 6.1364 6.1364 6.1364 6.1364 12.7629 12.7629 12.7629 12.7629 13.4721 13.4721 13.4721 13.4721 15.2249 15.2249 15.2249 15.2249 k = 0.2321 0.3227 0.1512 ( 4292 PWs) bands (ev): -15.8040 -15.8040 -15.8040 -15.8040 -12.8558 -12.8558 -12.8558 -12.8558 -10.1960 -10.1960 -10.1960 -10.1960 -10.0749 -10.0749 -10.0749 -10.0749 -2.4289 -2.4289 -2.4289 -2.4289 -2.2578 -2.2578 -2.2578 -2.2578 0.1560 0.1560 0.1560 0.1560 1.3836 1.3836 1.3836 1.3836 2.5279 2.5279 2.5279 2.5279 3.0178 3.0178 3.0178 3.0178 3.5160 3.5160 3.5160 3.5160 3.9061 3.9061 3.9061 3.9061 4.6514 4.6514 4.6514 4.6514 4.7052 4.7052 4.7052 4.7052 6.1032 6.1032 6.1032 6.1032 6.1345 6.1345 6.1345 6.1345 12.7270 12.7270 12.7270 12.7270 13.5182 13.5182 13.5182 13.5182 15.1557 15.1557 15.1557 15.1557 k = 0.2232 0.3227 0.1512 ( 4292 PWs) bands (ev): -15.8471 -15.8471 -15.8471 -15.8471 -12.8390 -12.8390 -12.8390 -12.8390 -10.2119 -10.2119 -10.2119 -10.2119 -10.0895 -10.0895 -10.0895 -10.0895 -2.3489 -2.3489 -2.3489 -2.3489 -2.2364 -2.2364 -2.2364 -2.2364 0.1339 0.1339 0.1339 0.1339 1.4074 1.4074 1.4074 1.4074 2.5600 2.5600 2.5600 2.5600 3.0247 3.0247 3.0247 3.0247 3.5400 3.5400 3.5400 3.5400 3.9363 3.9363 3.9363 3.9363 4.6629 4.6629 4.6629 4.6629 4.7257 4.7257 4.7257 4.7257 6.0968 6.0968 6.0968 6.0968 6.1325 6.1325 6.1325 6.1325 12.6893 12.6893 12.6893 12.6893 13.5658 13.5658 13.5658 13.5658 15.0826 15.0826 15.0826 15.0826 k = 0.2143 0.3227 0.1512 ( 4296 PWs) bands (ev): -15.8888 -15.8888 -15.8888 -15.8888 -12.8235 -12.8235 -12.8235 -12.8235 -10.2275 -10.2275 -10.2275 -10.2275 -10.1039 -10.1039 -10.1039 -10.1039 -2.2668 -2.2668 -2.2668 -2.2668 -2.2167 -2.2167 -2.2167 -2.2167 0.1117 0.1117 0.1117 0.1117 1.4308 1.4308 1.4308 1.4308 2.5928 2.5928 2.5928 2.5928 3.0281 3.0281 3.0281 3.0281 3.5646 3.5646 3.5646 3.5646 3.9660 3.9660 3.9660 3.9660 4.6767 4.6767 4.6767 4.6767 4.7477 4.7477 4.7477 4.7477 6.0902 6.0902 6.0902 6.0902 6.1302 6.1302 6.1302 6.1302 12.6502 12.6502 12.6502 12.6502 13.6148 13.6148 13.6148 13.6148 15.0061 15.0061 15.0061 15.0061 k = 0.2054 0.3227 0.1512 ( 4300 PWs) bands (ev): -15.9290 -15.9290 -15.9290 -15.9290 -12.8093 -12.8093 -12.8093 -12.8093 -10.2428 -10.2428 -10.2428 -10.2428 -10.1181 -10.1181 -10.1181 -10.1181 -2.1993 -2.1993 -2.1993 -2.1993 -2.1821 -2.1821 -2.1821 -2.1821 0.0897 0.0897 0.0897 0.0897 1.4535 1.4535 1.4535 1.4535 2.6262 2.6262 2.6262 2.6262 3.0279 3.0279 3.0279 3.0279 3.5895 3.5895 3.5895 3.5895 3.9950 3.9950 3.9950 3.9950 4.6931 4.6931 4.6931 4.6931 4.7711 4.7711 4.7711 4.7711 6.0831 6.0831 6.0831 6.0831 6.1275 6.1275 6.1275 6.1275 12.6098 12.6098 12.6098 12.6098 13.6649 13.6649 13.6649 13.6649 14.9267 14.9267 14.9267 14.9267 k = 0.1964 0.3227 0.1512 ( 4296 PWs) bands (ev): -15.9676 -15.9676 -15.9676 -15.9676 -12.7963 -12.7963 -12.7963 -12.7963 -10.2577 -10.2577 -10.2577 -10.2577 -10.1320 -10.1320 -10.1320 -10.1320 -2.1827 -2.1827 -2.1827 -2.1827 -2.0966 -2.0966 -2.0966 -2.0966 0.0678 0.0678 0.0678 0.0678 1.4756 1.4756 1.4756 1.4756 2.6602 2.6602 2.6602 2.6602 3.0240 3.0240 3.0240 3.0240 3.6147 3.6147 3.6147 3.6147 4.0230 4.0230 4.0230 4.0230 4.7122 4.7122 4.7122 4.7122 4.7960 4.7960 4.7960 4.7960 6.0758 6.0758 6.0758 6.0758 6.1246 6.1246 6.1246 6.1246 12.5683 12.5683 12.5683 12.5683 13.7157 13.7157 13.7157 13.7157 14.8453 14.8453 14.8453 14.8453 k = 0.1875 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.0048 -16.0048 -16.0048 -16.0048 -12.7844 -12.7844 -12.7844 -12.7844 -10.2722 -10.2722 -10.2722 -10.2722 -10.1456 -10.1456 -10.1456 -10.1456 -2.1679 -2.1679 -2.1679 -2.1679 -2.0095 -2.0095 -2.0095 -2.0095 0.0462 0.0462 0.0462 0.0462 1.4968 1.4968 1.4968 1.4968 2.6946 2.6946 2.6946 2.6946 3.0164 3.0164 3.0164 3.0164 3.6397 3.6397 3.6397 3.6397 4.0497 4.0497 4.0497 4.0497 4.7343 4.7343 4.7343 4.7343 4.8224 4.8224 4.8224 4.8224 6.0681 6.0681 6.0681 6.0681 6.1213 6.1213 6.1213 6.1213 12.5259 12.5259 12.5259 12.5259 13.7667 13.7667 13.7667 13.7667 14.7626 14.7626 14.7626 14.7626 k = 0.1786 0.3227 0.1512 ( 4304 PWs) bands (ev): -16.0404 -16.0404 -16.0404 -16.0404 -12.7735 -12.7735 -12.7735 -12.7735 -10.2862 -10.2862 -10.2862 -10.2862 -10.1589 -10.1589 -10.1589 -10.1589 -2.1547 -2.1547 -2.1547 -2.1547 -1.9212 -1.9212 -1.9212 -1.9212 0.0247 0.0247 0.0247 0.0247 1.5170 1.5170 1.5170 1.5170 2.7293 2.7293 2.7293 2.7293 3.0053 3.0053 3.0053 3.0053 3.6645 3.6645 3.6645 3.6645 4.0747 4.0747 4.0747 4.0747 4.7595 4.7595 4.7595 4.7595 4.8501 4.8501 4.8501 4.8501 6.0601 6.0601 6.0601 6.0601 6.1175 6.1175 6.1175 6.1175 12.4829 12.4829 12.4829 12.4829 13.8173 13.8173 13.8173 13.8173 14.6798 14.6798 14.6798 14.6798 k = 0.1696 0.3227 0.1512 ( 4308 PWs) bands (ev): -16.0744 -16.0744 -16.0744 -16.0744 -12.7637 -12.7637 -12.7637 -12.7637 -10.2998 -10.2998 -10.2998 -10.2998 -10.1718 -10.1718 -10.1718 -10.1718 -2.1430 -2.1430 -2.1430 -2.1430 -1.8321 -1.8321 -1.8321 -1.8321 0.0036 0.0036 0.0036 0.0036 1.5362 1.5362 1.5362 1.5362 2.7644 2.7644 2.7644 2.7644 2.9907 2.9907 2.9907 2.9907 3.6887 3.6887 3.6887 3.6887 4.0978 4.0978 4.0978 4.0978 4.7876 4.7876 4.7876 4.7876 4.8791 4.8791 4.8791 4.8791 6.0518 6.0518 6.0518 6.0518 6.1134 6.1134 6.1134 6.1134 12.4394 12.4394 12.4394 12.4394 13.8665 13.8665 13.8665 13.8665 14.5983 14.5983 14.5983 14.5983 k = 0.1607 0.3227 0.1512 ( 4308 PWs) bands (ev): -16.1069 -16.1069 -16.1069 -16.1069 -12.7548 -12.7548 -12.7548 -12.7548 -10.3128 -10.3128 -10.3128 -10.3128 -10.1842 -10.1842 -10.1842 -10.1842 -2.1325 -2.1325 -2.1325 -2.1325 -1.7425 -1.7425 -1.7425 -1.7425 -0.0171 -0.0171 -0.0171 -0.0171 1.5544 1.5544 1.5544 1.5544 2.7997 2.7997 2.7997 2.7997 2.9729 2.9729 2.9729 2.9729 3.7122 3.7122 3.7122 3.7122 4.1188 4.1188 4.1188 4.1188 4.8187 4.8187 4.8187 4.8187 4.9094 4.9094 4.9094 4.9094 6.0433 6.0433 6.0433 6.0433 6.1089 6.1089 6.1089 6.1089 12.3958 12.3958 12.3958 12.3958 13.9128 13.9128 13.9128 13.9128 14.5202 14.5202 14.5202 14.5202 k = 0.1518 0.3227 0.1512 ( 4304 PWs) bands (ev): -16.1376 -16.1376 -16.1376 -16.1376 -12.7468 -12.7468 -12.7468 -12.7468 -10.3253 -10.3253 -10.3253 -10.3253 -10.1962 -10.1962 -10.1962 -10.1962 -2.1233 -2.1233 -2.1233 -2.1233 -1.6527 -1.6527 -1.6527 -1.6527 -0.0374 -0.0374 -0.0374 -0.0374 1.5713 1.5713 1.5713 1.5713 2.8349 2.8349 2.8349 2.8349 2.9523 2.9523 2.9523 2.9523 3.7347 3.7347 3.7347 3.7347 4.1376 4.1376 4.1376 4.1376 4.8525 4.8525 4.8525 4.8525 4.9407 4.9407 4.9407 4.9407 6.0345 6.0345 6.0345 6.0345 6.1038 6.1038 6.1038 6.1038 12.3522 12.3522 12.3522 12.3522 13.9533 13.9533 13.9533 13.9533 14.4487 14.4487 14.4487 14.4487 k = 0.1429 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.1668 -16.1668 -16.1668 -16.1668 -12.7396 -12.7396 -12.7396 -12.7396 -10.3373 -10.3373 -10.3373 -10.3373 -10.2077 -10.2077 -10.2077 -10.2077 -2.1153 -2.1153 -2.1153 -2.1153 -1.5632 -1.5632 -1.5632 -1.5632 -0.0574 -0.0574 -0.0574 -0.0574 1.5870 1.5870 1.5870 1.5870 2.8699 2.8699 2.8699 2.8699 2.9293 2.9293 2.9293 2.9293 3.7560 3.7560 3.7560 3.7560 4.1542 4.1542 4.1542 4.1542 4.8886 4.8886 4.8886 4.8886 4.9728 4.9728 4.9728 4.9728 6.0254 6.0254 6.0254 6.0254 6.0983 6.0983 6.0983 6.0983 12.3091 12.3091 12.3091 12.3091 13.9831 13.9831 13.9831 13.9831 14.3892 14.3892 14.3892 14.3892 k = 0.1339 0.3227 0.1512 ( 4304 PWs) bands (ev): -16.1942 -16.1942 -16.1942 -16.1942 -12.7332 -12.7332 -12.7332 -12.7332 -10.3486 -10.3486 -10.3486 -10.3486 -10.2187 -10.2187 -10.2187 -10.2187 -2.1083 -2.1083 -2.1083 -2.1083 -1.4743 -1.4743 -1.4743 -1.4743 -0.0769 -0.0769 -0.0769 -0.0769 1.6015 1.6015 1.6015 1.6015 2.8964 2.8964 2.8964 2.8964 2.9122 2.9122 2.9122 2.9122 3.7761 3.7761 3.7761 3.7761 4.1687 4.1687 4.1687 4.1687 4.9267 4.9267 4.9267 4.9267 5.0056 5.0056 5.0056 5.0056 6.0162 6.0162 6.0162 6.0162 6.0923 6.0923 6.0923 6.0923 12.2667 12.2667 12.2667 12.2667 13.9942 13.9942 13.9942 13.9942 14.3499 14.3499 14.3499 14.3499 k = 0.1250 0.3227 0.1512 ( 4304 PWs) bands (ev): -16.2200 -16.2200 -16.2200 -16.2200 -12.7275 -12.7275 -12.7275 -12.7275 -10.3594 -10.3594 -10.3594 -10.3594 -10.2291 -10.2291 -10.2291 -10.2291 -2.1023 -2.1023 -2.1023 -2.1023 -1.3863 -1.3863 -1.3863 -1.3863 -0.0960 -0.0960 -0.0960 -0.0960 1.6147 1.6147 1.6147 1.6147 2.8739 2.8739 2.8739 2.8739 2.9418 2.9418 2.9418 2.9418 3.7948 3.7948 3.7948 3.7948 4.1812 4.1812 4.1812 4.1812 4.9662 4.9662 4.9662 4.9662 5.0388 5.0388 5.0388 5.0388 6.0068 6.0068 6.0068 6.0068 6.0858 6.0858 6.0858 6.0858 12.2252 12.2252 12.2252 12.2252 13.9800 13.9800 13.9800 13.9800 14.3379 14.3379 14.3379 14.3379 k = 0.1161 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.2441 -16.2441 -16.2441 -16.2441 -12.7224 -12.7224 -12.7224 -12.7224 -10.3695 -10.3695 -10.3695 -10.3695 -10.2389 -10.2389 -10.2389 -10.2389 -2.0971 -2.0971 -2.0971 -2.0971 -1.2998 -1.2998 -1.2998 -1.2998 -0.1148 -0.1148 -0.1148 -0.1148 1.6267 1.6267 1.6267 1.6267 2.8451 2.8451 2.8451 2.8451 2.9756 2.9756 2.9756 2.9756 3.8120 3.8120 3.8120 3.8120 4.1918 4.1918 4.1918 4.1918 5.0066 5.0066 5.0066 5.0066 5.0721 5.0721 5.0721 5.0721 5.9973 5.9973 5.9973 5.9973 6.0789 6.0789 6.0789 6.0789 12.1849 12.1849 12.1849 12.1849 13.9430 13.9430 13.9430 13.9430 14.3509 14.3509 14.3509 14.3509 k = 0.1071 0.3227 0.1512 ( 4304 PWs) bands (ev): -16.2664 -16.2664 -16.2664 -16.2664 -12.7179 -12.7179 -12.7179 -12.7179 -10.3789 -10.3789 -10.3789 -10.3789 -10.2481 -10.2481 -10.2481 -10.2481 -2.0927 -2.0927 -2.0927 -2.0927 -1.2151 -1.2151 -1.2151 -1.2151 -0.1332 -0.1332 -0.1332 -0.1332 1.6374 1.6374 1.6374 1.6374 2.8149 2.8149 2.8149 2.8149 3.0087 3.0087 3.0087 3.0087 3.8277 3.8277 3.8277 3.8277 4.2008 4.2008 4.2008 4.2008 5.0474 5.0474 5.0474 5.0474 5.1051 5.1051 5.1051 5.1051 5.9877 5.9877 5.9877 5.9877 6.0715 6.0715 6.0715 6.0715 12.1462 12.1462 12.1462 12.1462 13.8923 13.8923 13.8923 13.8923 14.3797 14.3797 14.3797 14.3797 k = 0.0982 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.2871 -16.2871 -16.2871 -16.2871 -12.7140 -12.7140 -12.7140 -12.7140 -10.3876 -10.3876 -10.3876 -10.3876 -10.2566 -10.2566 -10.2566 -10.2566 -2.0890 -2.0890 -2.0890 -2.0890 -1.1328 -1.1328 -1.1328 -1.1328 -0.1513 -0.1513 -0.1513 -0.1513 1.6471 1.6471 1.6471 1.6471 2.7841 2.7841 2.7841 2.7841 3.0408 3.0408 3.0408 3.0408 3.8419 3.8419 3.8419 3.8419 4.2083 4.2083 4.2083 4.2083 5.0880 5.0880 5.0880 5.0880 5.1376 5.1376 5.1376 5.1376 5.9782 5.9782 5.9782 5.9782 6.0636 6.0636 6.0636 6.0636 12.1094 12.1094 12.1094 12.1094 13.8363 13.8363 13.8363 13.8363 14.4165 14.4165 14.4165 14.4165 k = 0.0893 0.3227 0.1512 ( 4288 PWs) bands (ev): -16.3059 -16.3059 -16.3059 -16.3059 -12.7105 -12.7105 -12.7105 -12.7105 -10.3957 -10.3957 -10.3957 -10.3957 -10.2645 -10.2645 -10.2645 -10.2645 -2.0858 -2.0858 -2.0858 -2.0858 -1.0532 -1.0532 -1.0532 -1.0532 -0.1693 -0.1693 -0.1693 -0.1693 1.6556 1.6556 1.6556 1.6556 2.7531 2.7531 2.7531 2.7531 3.0716 3.0716 3.0716 3.0716 3.8546 3.8546 3.8546 3.8546 4.2146 4.2146 4.2146 4.2146 5.1278 5.1278 5.1278 5.1278 5.1692 5.1692 5.1692 5.1692 5.9687 5.9687 5.9687 5.9687 6.0554 6.0554 6.0554 6.0554 12.0746 12.0746 12.0746 12.0746 13.7795 13.7795 13.7795 13.7795 14.4566 14.4566 14.4566 14.4566 k = 0.0804 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.3230 -16.3230 -16.3230 -16.3230 -12.7075 -12.7075 -12.7075 -12.7075 -10.4030 -10.4030 -10.4030 -10.4030 -10.2717 -10.2717 -10.2717 -10.2717 -2.0833 -2.0833 -2.0833 -2.0833 -0.9770 -0.9770 -0.9770 -0.9770 -0.1871 -0.1871 -0.1871 -0.1871 1.6630 1.6630 1.6630 1.6630 2.7226 2.7226 2.7226 2.7226 3.1005 3.1005 3.1005 3.1005 3.8658 3.8658 3.8658 3.8658 4.2198 4.2198 4.2198 4.2198 5.1663 5.1663 5.1663 5.1663 5.1994 5.1994 5.1994 5.1994 5.9594 5.9594 5.9594 5.9594 6.0470 6.0470 6.0470 6.0470 12.0422 12.0422 12.0422 12.0422 13.7246 13.7246 13.7246 13.7246 14.4971 14.4971 14.4971 14.4971 k = 0.0714 0.3227 0.1512 ( 4300 PWs) bands (ev): -16.3384 -16.3384 -16.3384 -16.3384 -12.7050 -12.7050 -12.7050 -12.7050 -10.4097 -10.4097 -10.4097 -10.4097 -10.2782 -10.2782 -10.2782 -10.2782 -2.0812 -2.0812 -2.0812 -2.0812 -0.9046 -0.9046 -0.9046 -0.9046 -0.2049 -0.2049 -0.2049 -0.2049 1.6695 1.6695 1.6695 1.6695 2.6931 2.6931 2.6931 2.6931 3.1275 3.1275 3.1275 3.1275 3.8755 3.8755 3.8755 3.8755 4.2240 4.2240 4.2240 4.2240 5.2029 5.2029 5.2029 5.2029 5.2281 5.2281 5.2281 5.2281 5.9504 5.9504 5.9504 5.9504 6.0384 6.0384 6.0384 6.0384 12.0125 12.0125 12.0125 12.0125 13.6733 13.6733 13.6733 13.6733 14.5366 14.5366 14.5366 14.5366 k = 0.0625 0.3227 0.1512 ( 4312 PWs) bands (ev): -16.3519 -16.3519 -16.3519 -16.3519 -12.7028 -12.7028 -12.7028 -12.7028 -10.4155 -10.4155 -10.4155 -10.4155 -10.2840 -10.2840 -10.2840 -10.2840 -2.0794 -2.0794 -2.0794 -2.0794 -0.8365 -0.8365 -0.8365 -0.8365 -0.2227 -0.2227 -0.2227 -0.2227 1.6750 1.6750 1.6750 1.6750 2.6652 2.6652 2.6652 2.6652 3.1522 3.1522 3.1522 3.1522 3.8839 3.8839 3.8839 3.8839 4.2274 4.2274 4.2274 4.2274 5.2370 5.2370 5.2370 5.2370 5.2547 5.2547 5.2547 5.2547 5.9419 5.9419 5.9419 5.9419 6.0299 6.0299 6.0299 6.0299 11.9856 11.9856 11.9856 11.9856 13.6264 13.6264 13.6264 13.6264 14.5738 14.5738 14.5738 14.5738 k = 0.0536 0.3227 0.1512 ( 4316 PWs) bands (ev): -16.3637 -16.3637 -16.3637 -16.3637 -12.7010 -12.7010 -12.7010 -12.7010 -10.4206 -10.4206 -10.4206 -10.4206 -10.2890 -10.2890 -10.2890 -10.2890 -2.0781 -2.0781 -2.0781 -2.0781 -0.7733 -0.7733 -0.7733 -0.7733 -0.2408 -0.2408 -0.2408 -0.2408 1.6797 1.6797 1.6797 1.6797 2.6394 2.6394 2.6394 2.6394 3.1742 3.1742 3.1742 3.1742 3.8910 3.8910 3.8910 3.8910 4.2302 4.2302 4.2302 4.2302 5.2678 5.2678 5.2678 5.2678 5.2791 5.2791 5.2791 5.2791 5.9339 5.9339 5.9339 5.9339 6.0216 6.0216 6.0216 6.0216 11.9618 11.9618 11.9618 11.9618 13.5848 13.5848 13.5848 13.5848 14.6079 14.6079 14.6079 14.6079 k = 0.0446 0.3227 0.1512 ( 4320 PWs) bands (ev): -16.3737 -16.3737 -16.3737 -16.3737 -12.6995 -12.6995 -12.6995 -12.6995 -10.4250 -10.4250 -10.4250 -10.4250 -10.2933 -10.2933 -10.2933 -10.2933 -2.0770 -2.0770 -2.0770 -2.0770 -0.7157 -0.7157 -0.7157 -0.7157 -0.2589 -0.2589 -0.2589 -0.2589 1.6835 1.6835 1.6835 1.6835 2.6165 2.6165 2.6165 2.6165 3.1934 3.1934 3.1934 3.1934 3.8969 3.8969 3.8969 3.8969 4.2323 4.2323 4.2323 4.2323 5.2944 5.2944 5.2944 5.2944 5.3014 5.3014 5.3014 5.3014 5.9267 5.9267 5.9267 5.9267 6.0138 6.0138 6.0138 6.0138 11.9413 11.9413 11.9413 11.9413 13.5490 13.5490 13.5490 13.5490 14.6382 14.6382 14.6382 14.6382 k = 0.0357 0.3227 0.1512 ( 4324 PWs) bands (ev): -16.3818 -16.3818 -16.3818 -16.3818 -12.6983 -12.6983 -12.6983 -12.6983 -10.4285 -10.4285 -10.4285 -10.4285 -10.2968 -10.2968 -10.2968 -10.2968 -2.0762 -2.0762 -2.0762 -2.0762 -0.6644 -0.6644 -0.6644 -0.6644 -0.2770 -0.2770 -0.2770 -0.2770 1.6866 1.6866 1.6866 1.6866 2.5968 2.5968 2.5968 2.5968 3.2094 3.2094 3.2094 3.2094 3.9015 3.9015 3.9015 3.9015 4.2340 4.2340 4.2340 4.2340 5.3152 5.3152 5.3152 5.3152 5.3223 5.3223 5.3223 5.3223 5.9204 5.9204 5.9204 5.9204 6.0068 6.0068 6.0068 6.0068 11.9243 11.9243 11.9243 11.9243 13.5192 13.5192 13.5192 13.5192 14.6640 14.6640 14.6640 14.6640 k = 0.0268 0.3227 0.1512 ( 4328 PWs) bands (ev): -16.3882 -16.3882 -16.3882 -16.3882 -12.6974 -12.6974 -12.6974 -12.6974 -10.4313 -10.4313 -10.4313 -10.4313 -10.2995 -10.2995 -10.2995 -10.2995 -2.0756 -2.0756 -2.0756 -2.0756 -0.6206 -0.6206 -0.6206 -0.6206 -0.2944 -0.2944 -0.2944 -0.2944 1.6890 1.6890 1.6890 1.6890 2.5809 2.5809 2.5809 2.5809 3.2221 3.2221 3.2221 3.2221 3.9051 3.9051 3.9051 3.9051 4.2352 4.2352 4.2352 4.2352 5.3304 5.3304 5.3304 5.3304 5.3405 5.3405 5.3405 5.3405 5.9153 5.9153 5.9153 5.9153 6.0009 6.0009 6.0009 6.0009 11.9109 11.9109 11.9109 11.9109 13.4957 13.4957 13.4957 13.4957 14.6846 14.6846 14.6846 14.6846 k = 0.0179 0.3227 0.1512 ( 4320 PWs) bands (ev): -16.3927 -16.3927 -16.3927 -16.3927 -12.6967 -12.6967 -12.6967 -12.6967 -10.4333 -10.4333 -10.4333 -10.4333 -10.3015 -10.3015 -10.3015 -10.3015 -2.0751 -2.0751 -2.0751 -2.0751 -0.5860 -0.5860 -0.5860 -0.5860 -0.3098 -0.3098 -0.3098 -0.3098 1.6906 1.6906 1.6906 1.6906 2.5692 2.5692 2.5692 2.5692 3.2313 3.2313 3.2313 3.2313 3.9076 3.9076 3.9076 3.9076 4.2360 4.2360 4.2360 4.2360 5.3412 5.3412 5.3412 5.3412 5.3542 5.3542 5.3542 5.3542 5.9115 5.9115 5.9115 5.9115 5.9964 5.9964 5.9964 5.9964 11.9013 11.9013 11.9013 11.9013 13.4789 13.4789 13.4789 13.4789 14.6998 14.6998 14.6998 14.6998 k = 0.0089 0.3227 0.1512 ( 4328 PWs) bands (ev): -16.3955 -16.3955 -16.3955 -16.3955 -12.6963 -12.6963 -12.6963 -12.6963 -10.4345 -10.4345 -10.4345 -10.4345 -10.3027 -10.3027 -10.3027 -10.3027 -2.0749 -2.0749 -2.0749 -2.0749 -0.5631 -0.5631 -0.5631 -0.5631 -0.3210 -0.3210 -0.3210 -0.3210 1.6916 1.6916 1.6916 1.6916 2.5621 2.5621 2.5621 2.5621 3.2369 3.2369 3.2369 3.2369 3.9091 3.9091 3.9091 3.9091 4.2365 4.2365 4.2365 4.2365 5.3477 5.3477 5.3477 5.3477 5.3627 5.3627 5.3627 5.3627 5.9092 5.9092 5.9092 5.9092 5.9936 5.9936 5.9936 5.9936 11.8955 11.8955 11.8955 11.8955 13.4687 13.4687 13.4687 13.4687 14.7091 14.7091 14.7091 14.7091 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6962 -12.6962 -12.6962 -12.6962 -10.4349 -10.4349 -10.4349 -10.4349 -10.3031 -10.3031 -10.3031 -10.3031 -2.0748 -2.0748 -2.0748 -2.0748 -0.5550 -0.5550 -0.5550 -0.5550 -0.3252 -0.3252 -0.3252 -0.3252 1.6919 1.6919 1.6919 1.6919 2.5597 2.5597 2.5597 2.5597 3.2388 3.2388 3.2388 3.2388 3.9096 3.9096 3.9096 3.9096 4.2367 4.2367 4.2367 4.2367 5.3499 5.3499 5.3499 5.3499 5.3655 5.3655 5.3655 5.3655 5.9084 5.9084 5.9084 5.9084 5.9926 5.9926 5.9926 5.9926 11.8935 11.8935 11.8935 11.8935 13.4653 13.4653 13.4653 13.4653 14.7122 14.7122 14.7122 14.7122 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6962 -12.6962 -12.6962 -12.6962 -10.4349 -10.4349 -10.4349 -10.4349 -10.3031 -10.3031 -10.3031 -10.3031 -2.0748 -2.0748 -2.0748 -2.0748 -0.5550 -0.5550 -0.5550 -0.5550 -0.3252 -0.3252 -0.3252 -0.3252 1.6919 1.6919 1.6919 1.6919 2.5597 2.5597 2.5597 2.5597 3.2388 3.2388 3.2388 3.2388 3.9096 3.9096 3.9096 3.9096 4.2367 4.2367 4.2367 4.2367 5.3499 5.3499 5.3499 5.3499 5.3655 5.3655 5.3655 5.3655 5.9084 5.9084 5.9084 5.9084 5.9926 5.9926 5.9926 5.9926 11.8935 11.8935 11.8935 11.8935 13.4653 13.4653 13.4653 13.4653 14.7122 14.7122 14.7122 14.7122 k = 0.0000 0.3138 0.1512 ( 4334 PWs) bands (ev): -16.3965 -16.3965 -16.3965 -16.3965 -12.6960 -12.6960 -12.6960 -12.6960 -10.4390 -10.4390 -10.4390 -10.4390 -10.2986 -10.2986 -10.2986 -10.2986 -2.0753 -2.0753 -2.0753 -2.0753 -0.5551 -0.5551 -0.5551 -0.5551 -0.3249 -0.3249 -0.3249 -0.3249 1.6894 1.6894 1.6894 1.6894 2.5633 2.5633 2.5633 2.5633 3.2389 3.2389 3.2389 3.2389 3.9082 3.9082 3.9082 3.9082 4.2356 4.2356 4.2356 4.2356 5.3375 5.3375 5.3375 5.3375 5.3781 5.3781 5.3781 5.3781 5.9030 5.9030 5.9030 5.9030 5.9989 5.9989 5.9989 5.9989 11.8928 11.8928 11.8928 11.8928 13.4655 13.4655 13.4655 13.4655 14.7120 14.7120 14.7120 14.7120 k = 0.0000 0.3048 0.1512 ( 4326 PWs) bands (ev): -16.3969 -16.3969 -16.3969 -16.3969 -12.6955 -12.6955 -12.6955 -12.6955 -10.4500 -10.4500 -10.4500 -10.4500 -10.2866 -10.2866 -10.2866 -10.2866 -2.0766 -2.0766 -2.0766 -2.0766 -0.5554 -0.5554 -0.5554 -0.5554 -0.3239 -0.3239 -0.3239 -0.3239 1.6819 1.6819 1.6819 1.6819 2.5741 2.5741 2.5741 2.5741 3.2395 3.2395 3.2395 3.2395 3.9039 3.9039 3.9039 3.9039 4.2326 4.2326 4.2326 4.2326 5.3197 5.3197 5.3197 5.3197 5.3961 5.3961 5.3961 5.3961 5.8900 5.8900 5.8900 5.8900 6.0145 6.0145 6.0145 6.0145 11.8905 11.8905 11.8905 11.8905 13.4661 13.4661 13.4661 13.4661 14.7114 14.7114 14.7114 14.7114 k = 0.0000 0.2958 0.1512 ( 4326 PWs) bands (ev): -16.3976 -16.3976 -16.3976 -16.3976 -12.6945 -12.6945 -12.6945 -12.6945 -10.4654 -10.4654 -10.4654 -10.4654 -10.2696 -10.2696 -10.2696 -10.2696 -2.0788 -2.0788 -2.0788 -2.0788 -0.5559 -0.5559 -0.5559 -0.5559 -0.3223 -0.3223 -0.3223 -0.3223 1.6700 1.6700 1.6700 1.6700 2.5913 2.5913 2.5913 2.5913 3.2404 3.2404 3.2404 3.2404 3.8967 3.8967 3.8967 3.8967 4.2276 4.2276 4.2276 4.2276 5.3016 5.3016 5.3016 5.3016 5.4148 5.4148 5.4148 5.4148 5.8738 5.8738 5.8738 5.8738 6.0352 6.0352 6.0352 6.0352 11.8866 11.8866 11.8866 11.8866 13.4670 13.4670 13.4670 13.4670 14.7103 14.7103 14.7103 14.7103 k = 0.0000 0.2869 0.1512 ( 4324 PWs) bands (ev): -16.3986 -16.3986 -16.3986 -16.3986 -12.6933 -12.6933 -12.6933 -12.6933 -10.4830 -10.4830 -10.4830 -10.4830 -10.2497 -10.2497 -10.2497 -10.2497 -2.0818 -2.0818 -2.0818 -2.0818 -0.5565 -0.5565 -0.5565 -0.5565 -0.3202 -0.3202 -0.3202 -0.3202 1.6546 1.6546 1.6546 1.6546 2.6140 2.6140 2.6140 2.6140 3.2417 3.2417 3.2417 3.2417 3.8867 3.8867 3.8867 3.8867 4.2212 4.2212 4.2212 4.2212 5.2836 5.2836 5.2836 5.2836 5.4335 5.4335 5.4335 5.4335 5.8563 5.8563 5.8563 5.8563 6.0586 6.0586 6.0586 6.0586 11.8813 11.8813 11.8813 11.8813 13.4683 13.4683 13.4683 13.4683 14.7088 14.7088 14.7088 14.7088 k = 0.0000 0.2779 0.1512 ( 4322 PWs) bands (ev): -16.3999 -16.3999 -16.3999 -16.3999 -12.6917 -12.6917 -12.6917 -12.6917 -10.5017 -10.5017 -10.5017 -10.5017 -10.2281 -10.2281 -10.2281 -10.2281 -2.0857 -2.0857 -2.0857 -2.0857 -0.5574 -0.5574 -0.5574 -0.5574 -0.3175 -0.3175 -0.3175 -0.3175 1.6365 1.6365 1.6365 1.6365 2.6413 2.6413 2.6413 2.6413 3.2433 3.2433 3.2433 3.2433 3.8737 3.8737 3.8737 3.8737 4.2135 4.2135 4.2135 4.2135 5.2658 5.2658 5.2658 5.2658 5.4522 5.4522 5.4522 5.4522 5.8384 5.8384 5.8384 5.8384 6.0838 6.0838 6.0838 6.0838 11.8746 11.8746 11.8746 11.8746 13.4700 13.4700 13.4700 13.4700 14.7070 14.7070 14.7070 14.7070 k = 0.0000 0.2689 0.1512 ( 4322 PWs) bands (ev): -16.4014 -16.4014 -16.4014 -16.4014 -12.6897 -12.6897 -12.6897 -12.6897 -10.5210 -10.5210 -10.5210 -10.5210 -10.2053 -10.2053 -10.2053 -10.2053 -2.0904 -2.0904 -2.0904 -2.0904 -0.5584 -0.5584 -0.5584 -0.5584 -0.3145 -0.3145 -0.3145 -0.3145 1.6168 1.6168 1.6168 1.6168 2.6720 2.6720 2.6720 2.6720 3.2453 3.2453 3.2453 3.2453 3.8578 3.8578 3.8578 3.8578 4.2052 4.2052 4.2052 4.2052 5.2482 5.2482 5.2482 5.2482 5.4709 5.4709 5.4709 5.4709 5.8205 5.8205 5.8205 5.8205 6.1102 6.1102 6.1102 6.1102 11.8664 11.8664 11.8664 11.8664 13.4719 13.4719 13.4719 13.4719 14.7047 14.7047 14.7047 14.7047 k = 0.0000 0.2600 0.1512 ( 4318 PWs) bands (ev): -16.4031 -16.4031 -16.4031 -16.4031 -12.6875 -12.6875 -12.6875 -12.6875 -10.5402 -10.5402 -10.5402 -10.5402 -10.1819 -10.1819 -10.1819 -10.1819 -2.0959 -2.0959 -2.0959 -2.0959 -0.5596 -0.5596 -0.5596 -0.5596 -0.3111 -0.3111 -0.3111 -0.3111 1.5964 1.5964 1.5964 1.5964 2.7051 2.7051 2.7051 2.7051 3.2475 3.2475 3.2475 3.2475 3.8389 3.8389 3.8389 3.8389 4.1967 4.1967 4.1967 4.1967 5.2309 5.2309 5.2309 5.2309 5.4894 5.4894 5.4894 5.4894 5.8025 5.8025 5.8025 5.8025 6.1376 6.1376 6.1376 6.1376 11.8569 11.8569 11.8569 11.8569 13.4742 13.4742 13.4742 13.4742 14.7021 14.7021 14.7021 14.7021 k = 0.0000 0.2510 0.1512 ( 4314 PWs) bands (ev): -16.4051 -16.4051 -16.4051 -16.4051 -12.6849 -12.6849 -12.6849 -12.6849 -10.5593 -10.5593 -10.5593 -10.5593 -10.1581 -10.1581 -10.1581 -10.1581 -2.1021 -2.1021 -2.1021 -2.1021 -0.5610 -0.5610 -0.5610 -0.5610 -0.3075 -0.3075 -0.3075 -0.3075 1.5760 1.5760 1.5760 1.5760 2.7393 2.7393 2.7393 2.7393 3.2501 3.2501 3.2501 3.2501 3.8173 3.8173 3.8173 3.8173 4.1885 4.1885 4.1885 4.1885 5.2139 5.2139 5.2139 5.2139 5.5079 5.5079 5.5079 5.5079 5.7845 5.7845 5.7845 5.7845 6.1658 6.1658 6.1658 6.1658 11.8461 11.8461 11.8461 11.8461 13.4767 13.4767 13.4767 13.4767 14.6990 14.6990 14.6990 14.6990 k = 0.0000 0.2420 0.1512 ( 4300 PWs) bands (ev): -16.4073 -16.4073 -16.4073 -16.4073 -12.6821 -12.6821 -12.6821 -12.6821 -10.5781 -10.5781 -10.5781 -10.5781 -10.1342 -10.1342 -10.1342 -10.1342 -2.1090 -2.1090 -2.1090 -2.1090 -0.5625 -0.5625 -0.5625 -0.5625 -0.3038 -0.3038 -0.3038 -0.3038 1.5563 1.5563 1.5563 1.5563 2.7739 2.7739 2.7739 2.7739 3.2530 3.2530 3.2530 3.2530 3.7931 3.7931 3.7931 3.7931 4.1813 4.1813 4.1813 4.1813 5.1972 5.1972 5.1972 5.1972 5.5261 5.5261 5.5261 5.5261 5.7663 5.7663 5.7663 5.7663 6.1945 6.1945 6.1945 6.1945 11.8340 11.8340 11.8340 11.8340 13.4794 13.4794 13.4794 13.4794 14.6957 14.6957 14.6957 14.6957 k = 0.0000 0.2331 0.1512 ( 4302 PWs) bands (ev): -16.4097 -16.4097 -16.4097 -16.4097 -12.6791 -12.6791 -12.6791 -12.6791 -10.5964 -10.5964 -10.5964 -10.5964 -10.1101 -10.1101 -10.1101 -10.1101 -2.1166 -2.1166 -2.1166 -2.1166 -0.5641 -0.5641 -0.5641 -0.5641 -0.3001 -0.3001 -0.3001 -0.3001 1.5380 1.5380 1.5380 1.5380 2.8077 2.8077 2.8077 2.8077 3.2561 3.2561 3.2561 3.2561 3.7664 3.7664 3.7664 3.7664 4.1755 4.1755 4.1755 4.1755 5.1809 5.1809 5.1809 5.1809 5.5440 5.5440 5.5440 5.5440 5.7479 5.7479 5.7479 5.7479 6.2236 6.2236 6.2236 6.2236 11.8208 11.8208 11.8208 11.8208 13.4822 13.4822 13.4822 13.4822 14.6921 14.6921 14.6921 14.6921 k = 0.0000 0.2241 0.1512 ( 4306 PWs) bands (ev): -16.4122 -16.4122 -16.4122 -16.4122 -12.6758 -12.6758 -12.6758 -12.6758 -10.6142 -10.6142 -10.6142 -10.6142 -10.0862 -10.0862 -10.0862 -10.0862 -2.1247 -2.1247 -2.1247 -2.1247 -0.5659 -0.5659 -0.5659 -0.5659 -0.2965 -0.2965 -0.2965 -0.2965 1.5216 1.5216 1.5216 1.5216 2.8400 2.8400 2.8400 2.8400 3.2594 3.2594 3.2594 3.2594 3.7375 3.7375 3.7375 3.7375 4.1716 4.1716 4.1716 4.1716 5.1651 5.1651 5.1651 5.1651 5.5617 5.5617 5.5617 5.5617 5.7292 5.7292 5.7292 5.7292 6.2530 6.2530 6.2530 6.2530 11.8065 11.8065 11.8065 11.8065 13.4853 13.4853 13.4853 13.4853 14.6882 14.6882 14.6882 14.6882 k = 0.0000 0.2152 0.1512 ( 4310 PWs) bands (ev): -16.4150 -16.4150 -16.4150 -16.4150 -12.6724 -12.6724 -12.6724 -12.6724 -10.6314 -10.6314 -10.6314 -10.6314 -10.0624 -10.0624 -10.0624 -10.0624 -2.1335 -2.1335 -2.1335 -2.1335 -0.5678 -0.5678 -0.5678 -0.5678 -0.2930 -0.2930 -0.2930 -0.2930 1.5073 1.5073 1.5073 1.5073 2.8699 2.8699 2.8699 2.8699 3.2629 3.2629 3.2629 3.2629 3.7069 3.7069 3.7069 3.7069 4.1701 4.1701 4.1701 4.1701 5.1497 5.1497 5.1497 5.1497 5.5790 5.5790 5.5790 5.5790 5.7101 5.7101 5.7101 5.7101 6.2825 6.2825 6.2825 6.2825 11.7912 11.7912 11.7912 11.7912 13.4884 13.4884 13.4884 13.4884 14.6840 14.6840 14.6840 14.6840 k = 0.0000 0.2062 0.1512 ( 4304 PWs) bands (ev): -16.4178 -16.4178 -16.4178 -16.4178 -12.6688 -12.6688 -12.6688 -12.6688 -10.6480 -10.6480 -10.6480 -10.6480 -10.0388 -10.0388 -10.0388 -10.0388 -2.1427 -2.1427 -2.1427 -2.1427 -0.5697 -0.5697 -0.5697 -0.5697 -0.2898 -0.2898 -0.2898 -0.2898 1.4956 1.4956 1.4956 1.4956 2.8966 2.8966 2.8966 2.8966 3.2667 3.2667 3.2667 3.2667 3.6749 3.6749 3.6749 3.6749 4.1714 4.1714 4.1714 4.1714 5.1347 5.1347 5.1347 5.1347 5.5959 5.5959 5.5959 5.5959 5.6906 5.6906 5.6906 5.6906 6.3119 6.3119 6.3119 6.3119 11.7750 11.7750 11.7750 11.7750 13.4917 13.4917 13.4917 13.4917 14.6796 14.6796 14.6796 14.6796 k = 0.0000 0.1972 0.1512 ( 4304 PWs) bands (ev): -16.4208 -16.4208 -16.4208 -16.4208 -12.6652 -12.6652 -12.6652 -12.6652 -10.6639 -10.6639 -10.6639 -10.6639 -10.0156 -10.0156 -10.0156 -10.0156 -2.1524 -2.1524 -2.1524 -2.1524 -0.5718 -0.5718 -0.5718 -0.5718 -0.2870 -0.2870 -0.2870 -0.2870 1.4866 1.4866 1.4866 1.4866 2.9194 2.9194 2.9194 2.9194 3.2705 3.2705 3.2705 3.2705 3.6418 3.6418 3.6418 3.6418 4.1759 4.1759 4.1759 4.1759 5.1202 5.1202 5.1202 5.1202 5.6121 5.6121 5.6121 5.6121 5.6708 5.6708 5.6708 5.6708 6.3412 6.3412 6.3412 6.3412 11.7579 11.7579 11.7579 11.7579 13.4951 13.4951 13.4951 13.4951 14.6750 14.6750 14.6750 14.6750 k = 0.0000 0.1883 0.1512 ( 4300 PWs) bands (ev): -16.4238 -16.4238 -16.4238 -16.4238 -12.6614 -12.6614 -12.6614 -12.6614 -10.6791 -10.6791 -10.6791 -10.6791 -9.9927 -9.9927 -9.9927 -9.9927 -2.1625 -2.1625 -2.1625 -2.1625 -0.5739 -0.5739 -0.5739 -0.5739 -0.2845 -0.2845 -0.2845 -0.2845 1.4805 1.4805 1.4805 1.4805 2.9379 2.9379 2.9379 2.9379 3.2745 3.2745 3.2745 3.2745 3.6083 3.6083 3.6083 3.6083 4.1838 4.1838 4.1838 4.1838 5.1062 5.1062 5.1062 5.1062 5.6264 5.6264 5.6264 5.6264 5.6519 5.6519 5.6519 5.6519 6.3702 6.3702 6.3702 6.3702 11.7400 11.7400 11.7400 11.7400 13.4986 13.4986 13.4986 13.4986 14.6704 14.6704 14.6704 14.6704 k = 0.0000 0.1793 0.1512 ( 4296 PWs) bands (ev): -16.4269 -16.4269 -16.4269 -16.4269 -12.6576 -12.6576 -12.6576 -12.6576 -10.6936 -10.6936 -10.6936 -10.6936 -9.9704 -9.9704 -9.9704 -9.9704 -2.1729 -2.1729 -2.1729 -2.1729 -0.5760 -0.5760 -0.5760 -0.5760 -0.2823 -0.2823 -0.2823 -0.2823 1.4773 1.4773 1.4773 1.4773 2.9515 2.9515 2.9515 2.9515 3.2785 3.2785 3.2785 3.2785 3.5746 3.5746 3.5746 3.5746 4.1953 4.1953 4.1953 4.1953 5.0928 5.0928 5.0928 5.0928 5.6236 5.6236 5.6236 5.6236 5.6489 5.6489 5.6489 5.6489 6.3988 6.3988 6.3988 6.3988 11.7215 11.7215 11.7215 11.7215 13.5021 13.5021 13.5021 13.5021 14.6655 14.6655 14.6655 14.6655 k = 0.0000 0.1703 0.1512 ( 4300 PWs) bands (ev): -16.4301 -16.4301 -16.4301 -16.4301 -12.6537 -12.6537 -12.6537 -12.6537 -10.7074 -10.7074 -10.7074 -10.7074 -9.9486 -9.9486 -9.9486 -9.9486 -2.1835 -2.1835 -2.1835 -2.1835 -0.5782 -0.5782 -0.5782 -0.5782 -0.2806 -0.2806 -0.2806 -0.2806 1.4770 1.4770 1.4770 1.4770 2.9599 2.9599 2.9599 2.9599 3.2826 3.2826 3.2826 3.2826 3.5412 3.5412 3.5412 3.5412 4.2106 4.2106 4.2106 4.2106 5.0798 5.0798 5.0798 5.0798 5.6034 5.6034 5.6034 5.6034 5.6621 5.6621 5.6621 5.6621 6.4268 6.4268 6.4268 6.4268 11.7024 11.7024 11.7024 11.7024 13.5056 13.5056 13.5056 13.5056 14.6606 14.6606 14.6606 14.6606 k = 0.0000 0.1614 0.1512 ( 4302 PWs) bands (ev): -16.4333 -16.4333 -16.4333 -16.4333 -12.6499 -12.6499 -12.6499 -12.6499 -10.7204 -10.7204 -10.7204 -10.7204 -9.9274 -9.9274 -9.9274 -9.9274 -2.1944 -2.1944 -2.1944 -2.1944 -0.5804 -0.5804 -0.5804 -0.5804 -0.2792 -0.2792 -0.2792 -0.2792 1.4796 1.4796 1.4796 1.4796 2.9632 2.9632 2.9632 2.9632 3.2868 3.2868 3.2868 3.2868 3.5083 3.5083 3.5083 3.5083 4.2295 4.2295 4.2295 4.2295 5.0675 5.0675 5.0675 5.0675 5.5809 5.5809 5.5809 5.5809 5.6764 5.6764 5.6764 5.6764 6.4542 6.4542 6.4542 6.4542 11.6829 11.6829 11.6829 11.6829 13.5091 13.5091 13.5091 13.5091 14.6556 14.6556 14.6556 14.6556 k = 0.0000 0.1524 0.1512 ( 4290 PWs) bands (ev): -16.4364 -16.4364 -16.4364 -16.4364 -12.6461 -12.6461 -12.6461 -12.6461 -10.7327 -10.7327 -10.7327 -10.7327 -9.9070 -9.9070 -9.9070 -9.9070 -2.2053 -2.2053 -2.2053 -2.2053 -0.5826 -0.5826 -0.5826 -0.5826 -0.2782 -0.2782 -0.2782 -0.2782 1.4849 1.4849 1.4849 1.4849 2.9614 2.9614 2.9614 2.9614 3.2909 3.2909 3.2909 3.2909 3.4763 3.4763 3.4763 3.4763 4.2518 4.2518 4.2518 4.2518 5.0557 5.0557 5.0557 5.0557 5.5575 5.5575 5.5575 5.5575 5.6904 5.6904 5.6904 5.6904 6.4809 6.4809 6.4809 6.4809 11.6631 11.6631 11.6631 11.6631 13.5127 13.5127 13.5127 13.5127 14.6506 14.6506 14.6506 14.6506 k = 0.0000 0.1434 0.1512 ( 4290 PWs) bands (ev): -16.4396 -16.4396 -16.4396 -16.4396 -12.6424 -12.6424 -12.6424 -12.6424 -10.7442 -10.7442 -10.7442 -10.7442 -9.8873 -9.8873 -9.8873 -9.8873 -2.2162 -2.2162 -2.2162 -2.2162 -0.5848 -0.5848 -0.5848 -0.5848 -0.2775 -0.2775 -0.2775 -0.2775 1.4927 1.4927 1.4927 1.4927 2.9549 2.9549 2.9549 2.9549 3.2949 3.2949 3.2949 3.2949 3.4454 3.4454 3.4454 3.4454 4.2774 4.2774 4.2774 4.2774 5.0446 5.0446 5.0446 5.0446 5.5332 5.5332 5.5332 5.5332 5.7038 5.7038 5.7038 5.7038 6.5068 6.5068 6.5068 6.5068 11.6432 11.6432 11.6432 11.6432 13.5161 13.5161 13.5161 13.5161 14.6456 14.6456 14.6456 14.6456 k = 0.0000 0.1345 0.1512 ( 4290 PWs) bands (ev): -16.4426 -16.4426 -16.4426 -16.4426 -12.6387 -12.6387 -12.6387 -12.6387 -10.7550 -10.7550 -10.7550 -10.7550 -9.8684 -9.8684 -9.8684 -9.8684 -2.2271 -2.2271 -2.2271 -2.2271 -0.5869 -0.5869 -0.5869 -0.5869 -0.2771 -0.2771 -0.2771 -0.2771 1.5029 1.5029 1.5029 1.5029 2.9442 2.9442 2.9442 2.9442 3.2989 3.2989 3.2989 3.2989 3.4156 3.4156 3.4156 3.4156 4.3057 4.3057 4.3057 4.3057 5.0340 5.0340 5.0340 5.0340 5.5083 5.5083 5.5083 5.5083 5.7167 5.7167 5.7167 5.7167 6.5317 6.5317 6.5317 6.5317 11.6232 11.6232 11.6232 11.6232 13.5195 13.5195 13.5195 13.5195 14.6407 14.6407 14.6407 14.6407 k = 0.0000 0.1255 0.1512 ( 4294 PWs) bands (ev): -16.4456 -16.4456 -16.4456 -16.4456 -12.6352 -12.6352 -12.6352 -12.6352 -10.7650 -10.7650 -10.7650 -10.7650 -9.8504 -9.8504 -9.8504 -9.8504 -2.2378 -2.2378 -2.2378 -2.2378 -0.5890 -0.5890 -0.5890 -0.5890 -0.2769 -0.2769 -0.2769 -0.2769 1.5151 1.5151 1.5151 1.5151 2.9299 2.9299 2.9299 2.9299 3.3027 3.3027 3.3027 3.3027 3.3870 3.3870 3.3870 3.3870 4.3365 4.3365 4.3365 4.3365 5.0241 5.0241 5.0241 5.0241 5.4828 5.4828 5.4828 5.4828 5.7290 5.7290 5.7290 5.7290 6.5556 6.5556 6.5556 6.5556 11.6034 11.6034 11.6034 11.6034 13.5228 13.5228 13.5228 13.5228 14.6360 14.6360 14.6360 14.6360 k = 0.0000 0.1165 0.1512 ( 4290 PWs) bands (ev): -16.4485 -16.4485 -16.4485 -16.4485 -12.6319 -12.6319 -12.6319 -12.6319 -10.7743 -10.7743 -10.7743 -10.7743 -9.8333 -9.8333 -9.8333 -9.8333 -2.2483 -2.2483 -2.2483 -2.2483 -0.5910 -0.5910 -0.5910 -0.5910 -0.2768 -0.2768 -0.2768 -0.2768 1.5291 1.5291 1.5291 1.5291 2.9126 2.9126 2.9126 2.9126 3.3064 3.3064 3.3064 3.3064 3.3598 3.3598 3.3598 3.3598 4.3692 4.3692 4.3692 4.3692 5.0148 5.0148 5.0148 5.0148 5.4568 5.4568 5.4568 5.4568 5.7405 5.7405 5.7405 5.7405 6.5783 6.5783 6.5783 6.5783 11.5839 11.5839 11.5839 11.5839 13.5259 13.5259 13.5259 13.5259 14.6313 14.6313 14.6313 14.6313 k = 0.0000 0.1076 0.1512 ( 4288 PWs) bands (ev): -16.4513 -16.4513 -16.4513 -16.4513 -12.6287 -12.6287 -12.6287 -12.6287 -10.7828 -10.7828 -10.7828 -10.7828 -9.8173 -9.8173 -9.8173 -9.8173 -2.2585 -2.2585 -2.2585 -2.2585 -0.5930 -0.5930 -0.5930 -0.5930 -0.2769 -0.2769 -0.2769 -0.2769 1.5446 1.5446 1.5446 1.5446 2.8932 2.8932 2.8932 2.8932 3.3097 3.3097 3.3097 3.3097 3.3341 3.3341 3.3341 3.3341 4.4034 4.4034 4.4034 4.4034 5.0061 5.0061 5.0061 5.0061 5.4303 5.4303 5.4303 5.4303 5.7513 5.7513 5.7513 5.7513 6.5998 6.5998 6.5998 6.5998 11.5649 11.5649 11.5649 11.5649 13.5289 13.5289 13.5289 13.5289 14.6268 14.6268 14.6268 14.6268 k = 0.0000 0.0986 0.1512 ( 4292 PWs) bands (ev): -16.4539 -16.4539 -16.4539 -16.4539 -12.6257 -12.6257 -12.6257 -12.6257 -10.7906 -10.7906 -10.7906 -10.7906 -9.8023 -9.8023 -9.8023 -9.8023 -2.2683 -2.2683 -2.2683 -2.2683 -0.5948 -0.5948 -0.5948 -0.5948 -0.2770 -0.2770 -0.2770 -0.2770 1.5610 1.5610 1.5610 1.5610 2.8724 2.8724 2.8724 2.8724 3.3066 3.3066 3.3066 3.3066 3.3158 3.3158 3.3158 3.3158 4.4385 4.4385 4.4385 4.4385 4.9981 4.9981 4.9981 4.9981 5.4036 5.4036 5.4036 5.4036 5.7614 5.7614 5.7614 5.7614 6.6200 6.6200 6.6200 6.6200 11.5466 11.5466 11.5466 11.5466 13.5317 13.5317 13.5317 13.5317 14.6226 14.6226 14.6226 14.6226 k = 0.0000 0.0896 0.1512 ( 4294 PWs) bands (ev): -16.4564 -16.4564 -16.4564 -16.4564 -12.6228 -12.6228 -12.6228 -12.6228 -10.7977 -10.7977 -10.7977 -10.7977 -9.7884 -9.7884 -9.7884 -9.7884 -2.2776 -2.2776 -2.2776 -2.2776 -0.5965 -0.5965 -0.5965 -0.5965 -0.2772 -0.2772 -0.2772 -0.2772 1.5782 1.5782 1.5782 1.5782 2.8509 2.8509 2.8509 2.8509 3.2850 3.2850 3.2850 3.2850 3.3174 3.3174 3.3174 3.3174 4.4741 4.4741 4.4741 4.4741 4.9908 4.9908 4.9908 4.9908 5.3767 5.3767 5.3767 5.3767 5.7707 5.7707 5.7707 5.7707 6.6388 6.6388 6.6388 6.6388 11.5291 11.5291 11.5291 11.5291 13.5343 13.5343 13.5343 13.5343 14.6186 14.6186 14.6186 14.6186 k = 0.0000 0.0807 0.1512 ( 4302 PWs) bands (ev): -16.4587 -16.4587 -16.4587 -16.4587 -12.6203 -12.6203 -12.6203 -12.6203 -10.8041 -10.8041 -10.8041 -10.8041 -9.7757 -9.7757 -9.7757 -9.7757 -2.2863 -2.2863 -2.2863 -2.2863 -0.5982 -0.5982 -0.5982 -0.5982 -0.2774 -0.2774 -0.2774 -0.2774 1.5956 1.5956 1.5956 1.5956 2.8293 2.8293 2.8293 2.8293 3.2633 3.2633 3.2633 3.2633 3.3202 3.3202 3.3202 3.3202 4.5096 4.5096 4.5096 4.5096 4.9841 4.9841 4.9841 4.9841 5.3498 5.3498 5.3498 5.3498 5.7792 5.7792 5.7792 5.7792 6.6561 6.6561 6.6561 6.6561 11.5126 11.5126 11.5126 11.5126 13.5366 13.5366 13.5366 13.5366 14.6148 14.6148 14.6148 14.6148 k = 0.0000 0.0717 0.1512 ( 4296 PWs) bands (ev): -16.4608 -16.4608 -16.4608 -16.4608 -12.6179 -12.6179 -12.6179 -12.6179 -10.8097 -10.8097 -10.8097 -10.8097 -9.7642 -9.7642 -9.7642 -9.7642 -2.2943 -2.2943 -2.2943 -2.2943 -0.5996 -0.5996 -0.5996 -0.5996 -0.2775 -0.2775 -0.2775 -0.2775 1.6129 1.6129 1.6129 1.6129 2.8082 2.8082 2.8082 2.8082 3.2431 3.2431 3.2431 3.2431 3.3229 3.3229 3.3229 3.3229 4.5446 4.5446 4.5446 4.5446 4.9782 4.9782 4.9782 4.9782 5.3233 5.3233 5.3233 5.3233 5.7868 5.7868 5.7868 5.7868 6.6719 6.6719 6.6719 6.6719 11.4973 11.4973 11.4973 11.4973 13.5387 13.5387 13.5387 13.5387 14.6114 14.6114 14.6114 14.6114 k = 0.0000 0.0628 0.1512 ( 4304 PWs) bands (ev): -16.4627 -16.4627 -16.4627 -16.4627 -12.6158 -12.6158 -12.6158 -12.6158 -10.8147 -10.8147 -10.8147 -10.8147 -9.7540 -9.7540 -9.7540 -9.7540 -2.3016 -2.3016 -2.3016 -2.3016 -0.6009 -0.6009 -0.6009 -0.6009 -0.2777 -0.2777 -0.2777 -0.2777 1.6296 1.6296 1.6296 1.6296 2.7882 2.7882 2.7882 2.7882 3.2246 3.2246 3.2246 3.2246 3.3253 3.3253 3.3253 3.3253 4.5785 4.5785 4.5785 4.5785 4.9729 4.9729 4.9729 4.9729 5.2973 5.2973 5.2973 5.2973 5.7936 5.7936 5.7936 5.7936 6.6860 6.6860 6.6860 6.6860 11.4834 11.4834 11.4834 11.4834 13.5406 13.5406 13.5406 13.5406 14.6083 14.6083 14.6083 14.6083 k = 0.0000 0.0538 0.1512 ( 4294 PWs) bands (ev): -16.4643 -16.4643 -16.4643 -16.4643 -12.6140 -12.6140 -12.6140 -12.6140 -10.8189 -10.8189 -10.8189 -10.8189 -9.7450 -9.7450 -9.7450 -9.7450 -2.3080 -2.3080 -2.3080 -2.3080 -0.6021 -0.6021 -0.6021 -0.6021 -0.2778 -0.2778 -0.2778 -0.2778 1.6452 1.6452 1.6452 1.6452 2.7698 2.7698 2.7698 2.7698 3.2080 3.2080 3.2080 3.2080 3.3274 3.3274 3.3274 3.3274 4.6107 4.6107 4.6107 4.6107 4.9683 4.9683 4.9683 4.9683 5.2724 5.2724 5.2724 5.2724 5.7996 5.7996 5.7996 5.7996 6.6983 6.6983 6.6983 6.6983 11.4710 11.4710 11.4710 11.4710 13.5422 13.5422 13.5422 13.5422 14.6056 14.6056 14.6056 14.6056 k = 0.0000 0.0448 0.1512 ( 4290 PWs) bands (ev): -16.4657 -16.4657 -16.4657 -16.4657 -12.6124 -12.6124 -12.6124 -12.6124 -10.8225 -10.8225 -10.8225 -10.8225 -9.7373 -9.7373 -9.7373 -9.7373 -2.3136 -2.3136 -2.3136 -2.3136 -0.6031 -0.6031 -0.6031 -0.6031 -0.2778 -0.2778 -0.2778 -0.2778 1.6594 1.6594 1.6594 1.6594 2.7534 2.7534 2.7534 2.7534 3.1936 3.1936 3.1936 3.1936 3.3293 3.3293 3.3293 3.3293 4.6405 4.6405 4.6405 4.6405 4.9644 4.9644 4.9644 4.9644 5.2490 5.2490 5.2490 5.2490 5.8046 5.8046 5.8046 5.8046 6.7089 6.7089 6.7089 6.7089 11.4602 11.4602 11.4602 11.4602 13.5436 13.5436 13.5436 13.5436 14.6033 14.6033 14.6033 14.6033 k = 0.0000 0.0359 0.1512 ( 4288 PWs) bands (ev): -16.4669 -16.4669 -16.4669 -16.4669 -12.6111 -12.6111 -12.6111 -12.6111 -10.8255 -10.8255 -10.8255 -10.8255 -9.7310 -9.7310 -9.7310 -9.7310 -2.3183 -2.3183 -2.3183 -2.3183 -0.6039 -0.6039 -0.6039 -0.6039 -0.2779 -0.2779 -0.2779 -0.2779 1.6716 1.6716 1.6716 1.6716 2.7394 2.7394 2.7394 2.7394 3.1815 3.1815 3.1815 3.1815 3.3308 3.3308 3.3308 3.3308 4.6670 4.6670 4.6670 4.6670 4.9613 4.9613 4.9613 4.9613 5.2279 5.2279 5.2279 5.2279 5.8087 5.8087 5.8087 5.8087 6.7177 6.7177 6.7177 6.7177 11.4513 11.4513 11.4513 11.4513 13.5447 13.5447 13.5447 13.5447 14.6013 14.6013 14.6013 14.6013 k = 0.0000 0.0269 0.1512 ( 4282 PWs) bands (ev): -16.4678 -16.4678 -16.4678 -16.4678 -12.6101 -12.6101 -12.6101 -12.6101 -10.8277 -10.8277 -10.8277 -10.8277 -9.7261 -9.7261 -9.7261 -9.7261 -2.3220 -2.3220 -2.3220 -2.3220 -0.6045 -0.6045 -0.6045 -0.6045 -0.2779 -0.2779 -0.2779 -0.2779 1.6816 1.6816 1.6816 1.6816 2.7281 2.7281 2.7281 2.7281 3.1718 3.1718 3.1718 3.1718 3.3320 3.3320 3.3320 3.3320 4.6893 4.6893 4.6893 4.6893 4.9588 4.9588 4.9588 4.9588 5.2099 5.2099 5.2099 5.2099 5.8120 5.8120 5.8120 5.8120 6.7245 6.7245 6.7245 6.7245 11.4442 11.4442 11.4442 11.4442 13.5456 13.5456 13.5456 13.5456 14.5999 14.5999 14.5999 14.5999 k = 0.0000 0.0179 0.1512 ( 4270 PWs) bands (ev): -16.4685 -16.4685 -16.4685 -16.4685 -12.6094 -12.6094 -12.6094 -12.6094 -10.8293 -10.8293 -10.8293 -10.8293 -9.7226 -9.7226 -9.7226 -9.7226 -2.3246 -2.3246 -2.3246 -2.3246 -0.6050 -0.6050 -0.6050 -0.6050 -0.2779 -0.2779 -0.2779 -0.2779 1.6890 1.6890 1.6890 1.6890 2.7199 2.7199 2.7199 2.7199 3.1648 3.1648 3.1648 3.1648 3.3329 3.3329 3.3329 3.3329 4.7064 4.7064 4.7064 4.7064 4.9570 4.9570 4.9570 4.9570 5.1960 5.1960 5.1960 5.1960 5.8143 5.8143 5.8143 5.8143 6.7295 6.7295 6.7295 6.7295 11.4390 11.4390 11.4390 11.4390 13.5462 13.5462 13.5462 13.5462 14.5988 14.5988 14.5988 14.5988 k = 0.0000 0.0090 0.1512 ( 4270 PWs) bands (ev): -16.4689 -16.4689 -16.4689 -16.4689 -12.6089 -12.6089 -12.6089 -12.6089 -10.8303 -10.8303 -10.8303 -10.8303 -9.7205 -9.7205 -9.7205 -9.7205 -2.3262 -2.3262 -2.3262 -2.3262 -0.6053 -0.6053 -0.6053 -0.6053 -0.2779 -0.2779 -0.2779 -0.2779 1.6935 1.6935 1.6935 1.6935 2.7149 2.7149 2.7149 2.7149 3.1606 3.1606 3.1606 3.1606 3.3334 3.3334 3.3334 3.3334 4.7172 4.7172 4.7172 4.7172 4.9560 4.9560 4.9560 4.9560 5.1871 5.1871 5.1871 5.1871 5.8157 5.8157 5.8157 5.8157 6.7324 6.7324 6.7324 6.7324 11.4359 11.4359 11.4359 11.4359 13.5466 13.5466 13.5466 13.5466 14.5981 14.5981 14.5981 14.5981 k = 0.0000 0.0000 0.1512 ( 4274 PWs) bands (ev): -16.4690 -16.4690 -16.4690 -16.4690 -12.6088 -12.6088 -12.6088 -12.6088 -10.8306 -10.8306 -10.8306 -10.8306 -9.7198 -9.7198 -9.7198 -9.7198 -2.3267 -2.3267 -2.3267 -2.3267 -0.6054 -0.6054 -0.6054 -0.6054 -0.2779 -0.2779 -0.2779 -0.2779 1.6950 1.6950 1.6950 1.6950 2.7132 2.7132 2.7132 2.7132 3.1592 3.1592 3.1592 3.1592 3.3336 3.3336 3.3336 3.3336 4.7209 4.7209 4.7209 4.7209 4.9556 4.9556 4.9556 4.9556 5.1841 5.1841 5.1841 5.1841 5.8162 5.8162 5.8162 5.8162 6.7334 6.7334 6.7334 6.7334 11.4349 11.4349 11.4349 11.4349 13.5467 13.5467 13.5467 13.5467 14.5979 14.5979 14.5979 14.5979 k = 0.0000 0.3227-0.0000 ( 4318 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6943 -12.6943 -12.6943 -12.6943 -10.4888 -10.4888 -10.4888 -10.4888 -10.2489 -10.2489 -10.2489 -10.2489 -2.1170 -2.1170 -2.1170 -2.1170 -0.5550 -0.5550 -0.5550 -0.5550 -0.2271 -0.2271 -0.2271 -0.2271 1.6350 1.6350 1.6350 1.6350 2.5479 2.5479 2.5479 2.5479 3.2396 3.2396 3.2396 3.2396 3.7761 3.7761 3.7761 3.7761 4.3721 4.3721 4.3721 4.3721 5.2955 5.2955 5.2955 5.2955 5.4196 5.4196 5.4196 5.4196 5.9255 5.9255 5.9255 5.9255 6.0017 6.0017 6.0017 6.0017 11.8526 11.8526 11.8526 11.8526 13.4977 13.4977 13.4977 13.4977 14.7101 14.7101 14.7101 14.7101 k = 0.0000 0.3227 0.0089 ( 4310 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6944 -12.6944 -12.6944 -12.6944 -10.4885 -10.4885 -10.4885 -10.4885 -10.2493 -10.2493 -10.2493 -10.2493 -2.1167 -2.1167 -2.1167 -2.1167 -0.5550 -0.5550 -0.5550 -0.5550 -0.2279 -0.2279 -0.2279 -0.2279 1.6355 1.6355 1.6355 1.6355 2.5480 2.5480 2.5480 2.5480 3.2396 3.2396 3.2396 3.2396 3.7770 3.7770 3.7770 3.7770 4.3712 4.3712 4.3712 4.3712 5.2958 5.2958 5.2958 5.2958 5.4193 5.4193 5.4193 5.4193 5.9254 5.9254 5.9254 5.9254 6.0016 6.0016 6.0016 6.0016 11.8530 11.8530 11.8530 11.8530 13.4974 13.4974 13.4974 13.4974 14.7101 14.7101 14.7101 14.7101 k = 0.0000 0.3227 0.0178 ( 4298 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6944 -12.6944 -12.6944 -12.6944 -10.4874 -10.4874 -10.4874 -10.4874 -10.2504 -10.2504 -10.2504 -10.2504 -2.1156 -2.1156 -2.1156 -2.1156 -0.5550 -0.5550 -0.5550 -0.5550 -0.2304 -0.2304 -0.2304 -0.2304 1.6370 1.6370 1.6370 1.6370 2.5483 2.5483 2.5483 2.5483 3.2396 3.2396 3.2396 3.2396 3.7795 3.7795 3.7795 3.7795 4.3686 4.3686 4.3686 4.3686 5.2966 5.2966 5.2966 5.2966 5.4186 5.4186 5.4186 5.4186 5.9250 5.9250 5.9250 5.9250 6.0014 6.0014 6.0014 6.0014 11.8540 11.8540 11.8540 11.8540 13.4966 13.4966 13.4966 13.4966 14.7102 14.7102 14.7102 14.7102 k = 0.0000 0.3227 0.0267 ( 4302 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6945 -12.6945 -12.6945 -12.6945 -10.4856 -10.4856 -10.4856 -10.4856 -10.2521 -10.2521 -10.2521 -10.2521 -2.1140 -2.1140 -2.1140 -2.1140 -0.5550 -0.5550 -0.5550 -0.5550 -0.2345 -0.2345 -0.2345 -0.2345 1.6395 1.6395 1.6395 1.6395 2.5488 2.5488 2.5488 2.5488 3.2396 3.2396 3.2396 3.2396 3.7837 3.7837 3.7837 3.7837 4.3643 4.3643 4.3643 4.3643 5.2979 5.2979 5.2979 5.2979 5.4173 5.4173 5.4173 5.4173 5.9243 5.9243 5.9243 5.9243 6.0010 6.0010 6.0010 6.0010 11.8557 11.8557 11.8557 11.8557 13.4952 13.4952 13.4952 13.4952 14.7103 14.7103 14.7103 14.7103 k = 0.0000 0.3227 0.0356 ( 4302 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6946 -12.6946 -12.6946 -12.6946 -10.4832 -10.4832 -10.4832 -10.4832 -10.2546 -10.2546 -10.2546 -10.2546 -2.1117 -2.1117 -2.1117 -2.1117 -0.5550 -0.5550 -0.5550 -0.5550 -0.2400 -0.2400 -0.2400 -0.2400 1.6428 1.6428 1.6428 1.6428 2.5494 2.5494 2.5494 2.5494 3.2395 3.2395 3.2395 3.2395 3.7895 3.7895 3.7895 3.7895 4.3584 4.3584 4.3584 4.3584 5.2997 5.2997 5.2997 5.2997 5.4155 5.4155 5.4155 5.4155 5.9233 5.9233 5.9233 5.9233 6.0004 6.0004 6.0004 6.0004 11.8579 11.8579 11.8579 11.8579 13.4934 13.4934 13.4934 13.4934 14.7104 14.7104 14.7104 14.7104 k = 0.0000 0.3227 0.0445 ( 4308 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6947 -12.6947 -12.6947 -12.6947 -10.4802 -10.4802 -10.4802 -10.4802 -10.2576 -10.2576 -10.2576 -10.2576 -2.1089 -2.1089 -2.1089 -2.1089 -0.5550 -0.5550 -0.5550 -0.5550 -0.2467 -0.2467 -0.2467 -0.2467 1.6469 1.6469 1.6469 1.6469 2.5502 2.5502 2.5502 2.5502 3.2395 3.2395 3.2395 3.2395 3.7968 3.7968 3.7968 3.7968 4.3510 4.3510 4.3510 4.3510 5.3020 5.3020 5.3020 5.3020 5.4132 5.4132 5.4132 5.4132 5.9222 5.9222 5.9222 5.9222 5.9997 5.9997 5.9997 5.9997 11.8607 11.8607 11.8607 11.8607 13.4912 13.4912 13.4912 13.4912 14.7105 14.7105 14.7105 14.7105 k = 0.0000 0.3227 0.0534 ( 4300 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6949 -12.6949 -12.6949 -12.6949 -10.4766 -10.4766 -10.4766 -10.4766 -10.2612 -10.2612 -10.2612 -10.2612 -2.1056 -2.1056 -2.1056 -2.1056 -0.5550 -0.5550 -0.5550 -0.5550 -0.2545 -0.2545 -0.2545 -0.2545 1.6515 1.6515 1.6515 1.6515 2.5512 2.5512 2.5512 2.5512 3.2394 3.2394 3.2394 3.2394 3.8055 3.8055 3.8055 3.8055 4.3421 4.3421 4.3421 4.3421 5.3047 5.3047 5.3047 5.3047 5.4105 5.4105 5.4105 5.4105 5.9208 5.9208 5.9208 5.9208 5.9990 5.9990 5.9990 5.9990 11.8639 11.8639 11.8639 11.8639 13.4886 13.4886 13.4886 13.4886 14.7108 14.7108 14.7108 14.7108 k = 0.0000 0.3227 0.0623 ( 4306 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6950 -12.6950 -12.6950 -12.6950 -10.4725 -10.4725 -10.4725 -10.4725 -10.2653 -10.2653 -10.2653 -10.2653 -2.1020 -2.1020 -2.1020 -2.1020 -0.5550 -0.5550 -0.5550 -0.5550 -0.2630 -0.2630 -0.2630 -0.2630 1.6565 1.6565 1.6565 1.6565 2.5522 2.5522 2.5522 2.5522 3.2393 3.2393 3.2393 3.2393 3.8155 3.8155 3.8155 3.8155 4.3320 4.3320 4.3320 4.3320 5.3079 5.3079 5.3079 5.3079 5.4073 5.4073 5.4073 5.4073 5.9194 5.9194 5.9194 5.9194 5.9982 5.9982 5.9982 5.9982 11.8674 11.8674 11.8674 11.8674 13.4858 13.4858 13.4858 13.4858 14.7109 14.7109 14.7109 14.7109 k = 0.0000 0.3227 0.0712 ( 4324 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6952 -12.6952 -12.6952 -12.6952 -10.4680 -10.4680 -10.4680 -10.4680 -10.2698 -10.2698 -10.2698 -10.2698 -2.0983 -2.0983 -2.0983 -2.0983 -0.5550 -0.5550 -0.5550 -0.5550 -0.2719 -0.2719 -0.2719 -0.2719 1.6617 1.6617 1.6617 1.6617 2.5532 2.5532 2.5532 2.5532 3.2392 3.2392 3.2392 3.2392 3.8264 3.8264 3.8264 3.8264 4.3208 4.3208 4.3208 4.3208 5.3115 5.3115 5.3115 5.3115 5.4038 5.4038 5.4038 5.4038 5.9178 5.9178 5.9178 5.9178 5.9973 5.9973 5.9973 5.9973 11.8711 11.8711 11.8711 11.8711 13.4829 13.4829 13.4829 13.4829 14.7111 14.7111 14.7111 14.7111 k = 0.0000 0.3227 0.0801 ( 4332 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6954 -12.6954 -12.6954 -12.6954 -10.4633 -10.4633 -10.4633 -10.4633 -10.2746 -10.2746 -10.2746 -10.2746 -2.0944 -2.0944 -2.0944 -2.0944 -0.5550 -0.5550 -0.5550 -0.5550 -0.2809 -0.2809 -0.2809 -0.2809 1.6669 1.6669 1.6669 1.6669 2.5543 2.5543 2.5543 2.5543 3.2392 3.2392 3.2392 3.2392 3.8382 3.8382 3.8382 3.8382 4.3089 4.3089 4.3089 4.3089 5.3155 5.3155 5.3155 5.3155 5.3998 5.3998 5.3998 5.3998 5.9162 5.9162 5.9162 5.9162 5.9965 5.9965 5.9965 5.9965 11.8749 11.8749 11.8749 11.8749 13.4799 13.4799 13.4799 13.4799 14.7112 14.7112 14.7112 14.7112 k = 0.0000 0.3227 0.0890 ( 4332 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6955 -12.6955 -12.6955 -12.6955 -10.4583 -10.4583 -10.4583 -10.4583 -10.2796 -10.2796 -10.2796 -10.2796 -2.0905 -2.0905 -2.0905 -2.0905 -0.5550 -0.5550 -0.5550 -0.5550 -0.2898 -0.2898 -0.2898 -0.2898 1.6720 1.6720 1.6720 1.6720 2.5554 2.5554 2.5554 2.5554 3.2391 3.2391 3.2391 3.2391 3.8505 3.8505 3.8505 3.8505 4.2964 4.2964 4.2964 4.2964 5.3198 5.3198 5.3198 5.3198 5.3956 5.3956 5.3956 5.3956 5.9147 5.9147 5.9147 5.9147 5.9957 5.9957 5.9957 5.9957 11.8786 11.8786 11.8786 11.8786 13.4770 13.4770 13.4770 13.4770 14.7114 14.7114 14.7114 14.7114 k = 0.0000 0.3227 0.0979 ( 4324 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6957 -12.6957 -12.6957 -12.6957 -10.4533 -10.4533 -10.4533 -10.4533 -10.2845 -10.2845 -10.2845 -10.2845 -2.0868 -2.0868 -2.0868 -2.0868 -0.5550 -0.5550 -0.5550 -0.5550 -0.2982 -0.2982 -0.2982 -0.2982 1.6768 1.6768 1.6768 1.6768 2.5564 2.5564 2.5564 2.5564 3.2390 3.2390 3.2390 3.2390 3.8629 3.8629 3.8629 3.8629 4.2839 4.2839 4.2839 4.2839 5.3244 5.3244 5.3244 5.3244 5.3910 5.3910 5.3910 5.3910 5.9132 5.9132 5.9132 5.9132 5.9950 5.9950 5.9950 5.9950 11.8821 11.8821 11.8821 11.8821 13.4742 13.4742 13.4742 13.4742 14.7117 14.7117 14.7117 14.7117 k = 0.0000 0.3227 0.1067 ( 4326 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6958 -12.6958 -12.6958 -12.6958 -10.4486 -10.4486 -10.4486 -10.4486 -10.2894 -10.2894 -10.2894 -10.2894 -2.0835 -2.0835 -2.0835 -2.0835 -0.5550 -0.5550 -0.5550 -0.5550 -0.3058 -0.3058 -0.3058 -0.3058 1.6811 1.6811 1.6811 1.6811 2.5573 2.5573 2.5573 2.5573 3.2389 3.2389 3.2389 3.2389 3.8749 3.8749 3.8749 3.8749 4.2717 4.2717 4.2717 4.2717 5.3292 5.3292 5.3292 5.3292 5.3862 5.3862 5.3862 5.3862 5.9118 5.9118 5.9118 5.9118 5.9943 5.9943 5.9943 5.9943 11.8854 11.8854 11.8854 11.8854 13.4717 13.4717 13.4717 13.4717 14.7118 14.7118 14.7118 14.7118 k = 0.0000 0.3227 0.1156 ( 4318 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6960 -12.6960 -12.6960 -12.6960 -10.4441 -10.4441 -10.4441 -10.4441 -10.2938 -10.2938 -10.2938 -10.2938 -2.0805 -2.0805 -2.0805 -2.0805 -0.5549 -0.5549 -0.5549 -0.5549 -0.3125 -0.3125 -0.3125 -0.3125 1.6849 1.6849 1.6849 1.6849 2.5582 2.5582 2.5582 2.5582 3.2389 3.2389 3.2389 3.2389 3.8860 3.8860 3.8860 3.8860 4.2605 4.2605 4.2605 4.2605 5.3342 5.3342 5.3342 5.3342 5.3813 5.3813 5.3813 5.3813 5.9106 5.9106 5.9106 5.9106 5.9937 5.9937 5.9937 5.9937 11.8882 11.8882 11.8882 11.8882 13.4695 13.4695 13.4695 13.4695 14.7120 14.7120 14.7120 14.7120 k = 0.0000 0.3227 0.1245 ( 4322 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6961 -12.6961 -12.6961 -12.6961 -10.4403 -10.4403 -10.4403 -10.4403 -10.2976 -10.2976 -10.2976 -10.2976 -2.0781 -2.0781 -2.0781 -2.0781 -0.5550 -0.5550 -0.5550 -0.5550 -0.3179 -0.3179 -0.3179 -0.3179 1.6879 1.6879 1.6879 1.6879 2.5588 2.5588 2.5588 2.5588 3.2388 3.2388 3.2388 3.2388 3.8957 3.8957 3.8957 3.8957 4.2508 4.2508 4.2508 4.2508 5.3392 5.3392 5.3392 5.3392 5.3763 5.3763 5.3763 5.3763 5.9097 5.9097 5.9097 5.9097 5.9932 5.9932 5.9932 5.9932 11.8904 11.8904 11.8904 11.8904 13.4677 13.4677 13.4677 13.4677 14.7121 14.7121 14.7121 14.7121 k = 0.0000 0.3227 0.1334 ( 4326 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6961 -12.6961 -12.6961 -12.6961 -10.4374 -10.4374 -10.4374 -10.4374 -10.3005 -10.3005 -10.3005 -10.3005 -2.0763 -2.0763 -2.0763 -2.0763 -0.5550 -0.5550 -0.5550 -0.5550 -0.3219 -0.3219 -0.3219 -0.3219 1.6901 1.6901 1.6901 1.6901 2.5593 2.5593 2.5593 2.5593 3.2388 3.2388 3.2388 3.2388 3.9032 3.9032 3.9032 3.9032 4.2432 4.2432 4.2432 4.2432 5.3440 5.3440 5.3440 5.3440 5.3715 5.3715 5.3715 5.3715 5.9089 5.9089 5.9089 5.9089 5.9929 5.9929 5.9929 5.9929 11.8921 11.8921 11.8921 11.8921 13.4664 13.4664 13.4664 13.4664 14.7122 14.7122 14.7122 14.7122 k = 0.0000 0.3227 0.1423 ( 4330 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6962 -12.6962 -12.6962 -12.6962 -10.4355 -10.4355 -10.4355 -10.4355 -10.3024 -10.3024 -10.3024 -10.3024 -2.0752 -2.0752 -2.0752 -2.0752 -0.5550 -0.5550 -0.5550 -0.5550 -0.3244 -0.3244 -0.3244 -0.3244 1.6915 1.6915 1.6915 1.6915 2.5596 2.5596 2.5596 2.5596 3.2388 3.2388 3.2388 3.2388 3.9080 3.9080 3.9080 3.9080 4.2383 4.2383 4.2383 4.2383 5.3481 5.3481 5.3481 5.3481 5.3674 5.3674 5.3674 5.3674 5.9085 5.9085 5.9085 5.9085 5.9927 5.9927 5.9927 5.9927 11.8932 11.8932 11.8932 11.8932 13.4655 13.4655 13.4655 13.4655 14.7122 14.7122 14.7122 14.7122 k = 0.0000 0.3227 0.1512 ( 4332 PWs) bands (ev): -16.3964 -16.3964 -16.3964 -16.3964 -12.6962 -12.6962 -12.6962 -12.6962 -10.4349 -10.4349 -10.4349 -10.4349 -10.3031 -10.3031 -10.3031 -10.3031 -2.0748 -2.0748 -2.0748 -2.0748 -0.5550 -0.5550 -0.5550 -0.5550 -0.3252 -0.3252 -0.3252 -0.3252 1.6919 1.6919 1.6919 1.6919 2.5597 2.5597 2.5597 2.5597 3.2388 3.2388 3.2388 3.2388 3.9096 3.9096 3.9096 3.9096 4.2367 4.2367 4.2367 4.2367 5.3499 5.3499 5.3499 5.3499 5.3655 5.3655 5.3655 5.3655 5.9084 5.9084 5.9084 5.9084 5.9926 5.9926 5.9926 5.9926 11.8935 11.8935 11.8935 11.8935 13.4653 13.4653 13.4653 13.4653 14.7122 14.7122 14.7122 14.7122 k = 0.5000-0.0000 0.1512 ( 4316 PWs) bands (ev): -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -14.1195 -9.7771 -9.7771 -9.7771 -9.7771 -9.7761 -9.7761 -9.7761 -9.7761 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 -3.1652 1.2278 1.2278 1.2278 1.2278 1.2298 1.2298 1.2298 1.2298 1.9877 1.9877 1.9877 1.9877 1.9914 1.9914 1.9914 1.9914 2.9812 2.9812 2.9812 2.9812 2.9826 2.9826 2.9826 2.9826 4.4417 4.4417 4.4417 4.4417 4.4484 4.4484 4.4484 4.4484 5.8988 5.8988 5.8988 5.8988 5.9012 5.9012 5.9012 5.9012 13.2434 13.2434 13.2434 13.2434 13.2443 13.2443 13.2443 13.2443 15.8856 15.8856 15.8856 15.8856 k = 0.5000-0.0000 0.1423 ( 4312 PWs) bands (ev): -14.1206 -14.1206 -14.1206 -14.1206 -14.1185 -14.1185 -14.1185 -14.1185 -9.7779 -9.7779 -9.7779 -9.7779 -9.7753 -9.7753 -9.7753 -9.7753 -3.1748 -3.1748 -3.1748 -3.1748 -3.1554 -3.1554 -3.1554 -3.1554 1.2178 1.2178 1.2178 1.2178 1.2384 1.2384 1.2384 1.2384 1.9790 1.9790 1.9790 1.9790 2.0028 2.0028 2.0028 2.0028 2.9805 2.9805 2.9805 2.9805 2.9820 2.9820 2.9820 2.9820 4.4209 4.4209 4.4209 4.4209 4.4695 4.4695 4.4695 4.4695 5.8810 5.8810 5.8810 5.8810 5.9189 5.9189 5.9189 5.9189 13.2330 13.2330 13.2330 13.2330 13.2545 13.2545 13.2545 13.2545 15.7983 15.7983 15.7983 15.7983 k = 0.5000-0.0000 0.1334 ( 4312 PWs) bands (ev): -14.1216 -14.1216 -14.1216 -14.1216 -14.1174 -14.1174 -14.1174 -14.1174 -9.7791 -9.7791 -9.7791 -9.7791 -9.7741 -9.7741 -9.7741 -9.7741 -3.1843 -3.1843 -3.1843 -3.1843 -3.1457 -3.1457 -3.1457 -3.1457 1.2058 1.2058 1.2058 1.2058 1.2462 1.2462 1.2462 1.2462 1.9717 1.9717 1.9717 1.9717 2.0180 2.0180 2.0180 2.0180 2.9783 2.9783 2.9783 2.9783 2.9801 2.9801 2.9801 2.9801 4.3975 4.3975 4.3975 4.3975 4.4935 4.4935 4.4935 4.4935 5.8622 5.8622 5.8622 5.8622 5.9377 5.9377 5.9377 5.9377 13.2221 13.2221 13.2221 13.2221 13.2648 13.2648 13.2648 13.2648 15.7138 15.7138 15.7138 15.7138 k = 0.5000-0.0000 0.1245 ( 4312 PWs) bands (ev): -14.1227 -14.1227 -14.1227 -14.1227 -14.1164 -14.1164 -14.1164 -14.1164 -9.7803 -9.7803 -9.7803 -9.7803 -9.7729 -9.7729 -9.7729 -9.7729 -3.1935 -3.1935 -3.1935 -3.1935 -3.1360 -3.1360 -3.1360 -3.1360 1.1929 1.1929 1.1929 1.1929 1.2522 1.2522 1.2522 1.2522 1.9675 1.9675 1.9675 1.9675 2.0351 2.0351 2.0351 2.0351 2.9748 2.9748 2.9748 2.9748 2.9770 2.9770 2.9770 2.9770 4.3748 4.3748 4.3748 4.3748 4.5174 4.5174 4.5174 4.5174 5.8437 5.8437 5.8437 5.8437 5.9560 5.9560 5.9560 5.9560 13.2113 13.2113 13.2113 13.2113 13.2748 13.2748 13.2748 13.2748 15.6329 15.6329 15.6329 15.6329 k = 0.5000-0.0000 0.1156 ( 4306 PWs) bands (ev): -14.1237 -14.1237 -14.1237 -14.1237 -14.1154 -14.1154 -14.1154 -14.1154 -9.7814 -9.7814 -9.7814 -9.7814 -9.7718 -9.7718 -9.7718 -9.7718 -3.2025 -3.2025 -3.2025 -3.2025 -3.1265 -3.1265 -3.1265 -3.1265 1.1796 1.1796 1.1796 1.1796 1.2561 1.2561 1.2561 1.2561 1.9665 1.9665 1.9665 1.9665 2.0536 2.0536 2.0536 2.0536 2.9698 2.9698 2.9698 2.9698 2.9728 2.9728 2.9728 2.9728 4.3531 4.3531 4.3531 4.3531 4.5409 4.5409 4.5409 4.5409 5.8256 5.8256 5.8256 5.8256 5.9740 5.9740 5.9740 5.9740 13.2005 13.2005 13.2005 13.2005 13.2844 13.2844 13.2844 13.2844 15.5560 15.5560 15.5560 15.5560 k = 0.5000-0.0000 0.1067 ( 4312 PWs) bands (ev): -14.1246 -14.1246 -14.1246 -14.1246 -14.1144 -14.1144 -14.1144 -14.1144 -9.7826 -9.7826 -9.7826 -9.7826 -9.7707 -9.7707 -9.7707 -9.7707 -3.2110 -3.2110 -3.2110 -3.2110 -3.1173 -3.1173 -3.1173 -3.1173 1.1662 1.1662 1.1662 1.1662 1.2581 1.2581 1.2581 1.2581 1.9688 1.9688 1.9688 1.9688 2.0730 2.0730 2.0730 2.0730 2.9633 2.9633 2.9633 2.9633 2.9678 2.9678 2.9678 2.9678 4.3325 4.3325 4.3325 4.3325 4.5636 4.5636 4.5636 4.5636 5.8082 5.8082 5.8082 5.8082 5.9912 5.9912 5.9912 5.9912 13.1899 13.1899 13.1899 13.1899 13.2935 13.2935 13.2935 13.2935 15.4835 15.4835 15.4835 15.4835 k = 0.5000-0.0000 0.0979 ( 4300 PWs) bands (ev): -14.1256 -14.1256 -14.1256 -14.1256 -14.1135 -14.1135 -14.1135 -14.1135 -9.7836 -9.7836 -9.7836 -9.7836 -9.7696 -9.7696 -9.7696 -9.7696 -3.2191 -3.2191 -3.2191 -3.2191 -3.1084 -3.1084 -3.1084 -3.1084 1.1529 1.1529 1.1529 1.1529 1.2582 1.2582 1.2582 1.2582 1.9742 1.9742 1.9742 1.9742 2.0929 2.0929 2.0929 2.0929 2.9555 2.9555 2.9555 2.9555 2.9622 2.9622 2.9622 2.9622 4.3132 4.3132 4.3132 4.3132 4.5853 4.5853 4.5853 4.5853 5.7914 5.7914 5.7914 5.7914 6.0077 6.0077 6.0077 6.0077 13.1797 13.1797 13.1797 13.1797 13.3021 13.3021 13.3021 13.3021 15.4157 15.4157 15.4157 15.4157 k = 0.5000-0.0000 0.0890 ( 4312 PWs) bands (ev): -14.1264 -14.1264 -14.1264 -14.1264 -14.1126 -14.1126 -14.1126 -14.1126 -9.7846 -9.7846 -9.7846 -9.7846 -9.7686 -9.7686 -9.7686 -9.7686 -3.2267 -3.2267 -3.2267 -3.2267 -3.0999 -3.0999 -3.0999 -3.0999 1.1400 1.1400 1.1400 1.1400 1.2567 1.2567 1.2567 1.2567 1.9822 1.9822 1.9822 1.9822 2.1128 2.1128 2.1128 2.1128 2.9464 2.9464 2.9464 2.9464 2.9560 2.9560 2.9560 2.9560 4.2953 4.2953 4.2953 4.2953 4.6059 4.6059 4.6059 4.6059 5.7756 5.7756 5.7756 5.7756 6.0233 6.0233 6.0233 6.0233 13.1698 13.1698 13.1698 13.1698 13.3100 13.3100 13.3100 13.3100 15.3528 15.3528 15.3528 15.3528 k = 0.5000-0.0000 0.0801 ( 4328 PWs) bands (ev): -14.1272 -14.1272 -14.1272 -14.1272 -14.1118 -14.1118 -14.1118 -14.1118 -9.7856 -9.7856 -9.7856 -9.7856 -9.7677 -9.7677 -9.7677 -9.7677 -3.2337 -3.2337 -3.2337 -3.2337 -3.0919 -3.0919 -3.0919 -3.0919 1.1278 1.1278 1.1278 1.1278 1.2539 1.2539 1.2539 1.2539 1.9924 1.9924 1.9924 1.9924 2.1324 2.1324 2.1324 2.1324 2.9363 2.9363 2.9363 2.9363 2.9496 2.9496 2.9496 2.9496 4.2790 4.2790 4.2790 4.2790 4.6252 4.6252 4.6252 4.6252 5.7607 5.7607 5.7607 5.7607 6.0379 6.0379 6.0379 6.0379 13.1605 13.1605 13.1605 13.1605 13.3174 13.3174 13.3174 13.3174 15.2952 15.2952 15.2952 15.2952 k = 0.5000-0.0000 0.0712 ( 4328 PWs) bands (ev): -14.1280 -14.1280 -14.1280 -14.1280 -14.1111 -14.1111 -14.1111 -14.1111 -9.7865 -9.7865 -9.7865 -9.7865 -9.7669 -9.7669 -9.7669 -9.7669 -3.2402 -3.2402 -3.2402 -3.2402 -3.0846 -3.0846 -3.0846 -3.0846 1.1163 1.1163 1.1163 1.1163 1.2501 1.2501 1.2501 1.2501 2.0043 2.0043 2.0043 2.0043 2.1513 2.1513 2.1513 2.1513 2.9254 2.9254 2.9254 2.9254 2.9431 2.9431 2.9431 2.9431 4.2644 4.2644 4.2644 4.2644 4.6429 4.6429 4.6429 4.6429 5.7471 5.7471 5.7471 5.7471 6.0513 6.0513 6.0513 6.0513 13.1518 13.1518 13.1518 13.1518 13.3240 13.3240 13.3240 13.3240 15.2430 15.2430 15.2430 15.2430 k = 0.5000-0.0000 0.0623 ( 4328 PWs) bands (ev): -14.1287 -14.1287 -14.1287 -14.1287 -14.1104 -14.1104 -14.1104 -14.1104 -9.7873 -9.7873 -9.7873 -9.7873 -9.7661 -9.7661 -9.7661 -9.7661 -3.2459 -3.2459 -3.2459 -3.2459 -3.0779 -3.0779 -3.0779 -3.0779 1.1059 1.1059 1.1059 1.1059 1.2457 1.2457 1.2457 1.2457 2.0172 2.0172 2.0172 2.0172 2.1690 2.1690 2.1690 2.1690 2.9141 2.9141 2.9141 2.9141 2.9367 2.9367 2.9367 2.9367 4.2515 4.2515 4.2515 4.2515 4.6589 4.6589 4.6589 4.6589 5.7347 5.7347 5.7347 5.7347 6.0634 6.0634 6.0634 6.0634 13.1440 13.1440 13.1440 13.1440 13.3299 13.3299 13.3299 13.3299 15.1964 15.1964 15.1964 15.1964 k = 0.5000-0.0000 0.0534 ( 4332 PWs) bands (ev): -14.1293 -14.1293 -14.1293 -14.1293 -14.1098 -14.1098 -14.1098 -14.1098 -9.7880 -9.7880 -9.7880 -9.7880 -9.7654 -9.7654 -9.7654 -9.7654 -3.2510 -3.2510 -3.2510 -3.2510 -3.0719 -3.0719 -3.0719 -3.0719 1.0966 1.0966 1.0966 1.0966 1.2411 1.2411 1.2411 1.2411 2.0304 2.0304 2.0304 2.0304 2.1852 2.1852 2.1852 2.1852 2.9029 2.9029 2.9029 2.9029 2.9305 2.9305 2.9305 2.9305 4.2404 4.2404 4.2404 4.2404 4.6731 4.6731 4.6731 4.6731 5.7237 5.7237 5.7237 5.7237 6.0741 6.0741 6.0741 6.0741 13.1369 13.1369 13.1369 13.1369 13.3351 13.3351 13.3351 13.3351 15.1557 15.1557 15.1557 15.1557 k = 0.5000-0.0000 0.0445 ( 4336 PWs) bands (ev): -14.1298 -14.1298 -14.1298 -14.1298 -14.1093 -14.1093 -14.1093 -14.1093 -9.7886 -9.7886 -9.7886 -9.7886 -9.7648 -9.7648 -9.7648 -9.7648 -3.2553 -3.2553 -3.2553 -3.2553 -3.0667 -3.0667 -3.0667 -3.0667 1.0885 1.0885 1.0885 1.0885 1.2366 1.2366 1.2366 1.2366 2.0432 2.0432 2.0432 2.0432 2.1997 2.1997 2.1997 2.1997 2.8921 2.8921 2.8921 2.8921 2.9249 2.9249 2.9249 2.9249 4.2310 4.2310 4.2310 4.2310 4.6853 4.6853 4.6853 4.6853 5.7142 5.7142 5.7142 5.7142 6.0833 6.0833 6.0833 6.0833 13.1308 13.1308 13.1308 13.1308 13.3395 13.3395 13.3395 13.3395 15.1210 15.1210 15.1210 15.1210 k = 0.5000-0.0000 0.0356 ( 4336 PWs) bands (ev): -14.1302 -14.1302 -14.1302 -14.1302 -14.1088 -14.1088 -14.1088 -14.1088 -9.7891 -9.7891 -9.7891 -9.7891 -9.7644 -9.7644 -9.7644 -9.7644 -3.2589 -3.2589 -3.2589 -3.2589 -3.0624 -3.0624 -3.0624 -3.0624 1.0818 1.0818 1.0818 1.0818 1.2325 1.2325 1.2325 1.2325 2.0549 2.0549 2.0549 2.0549 2.2119 2.2119 2.2119 2.2119 2.8824 2.8824 2.8824 2.8824 2.9200 2.9200 2.9200 2.9200 4.2234 4.2234 4.2234 4.2234 4.6954 4.6954 4.6954 4.6954 5.7064 5.7064 5.7064 5.7064 6.0909 6.0909 6.0909 6.0909 13.1256 13.1256 13.1256 13.1256 13.3432 13.3432 13.3432 13.3432 15.0924 15.0924 15.0924 15.0924 k = 0.5000-0.0000 0.0267 ( 4340 PWs) bands (ev): -14.1305 -14.1305 -14.1305 -14.1305 -14.1085 -14.1085 -14.1085 -14.1085 -9.7895 -9.7895 -9.7895 -9.7895 -9.7640 -9.7640 -9.7640 -9.7640 -3.2618 -3.2618 -3.2618 -3.2618 -3.0590 -3.0590 -3.0590 -3.0590 1.0764 1.0764 1.0764 1.0764 1.2290 1.2290 1.2290 1.2290 2.0647 2.0647 2.0647 2.0647 2.2218 2.2218 2.2218 2.2218 2.8741 2.8741 2.8741 2.8741 2.9159 2.9159 2.9159 2.9159 4.2175 4.2175 4.2175 4.2175 4.7033 4.7033 4.7033 4.7033 5.7001 5.7001 5.7001 5.7001 6.0970 6.0970 6.0970 6.0970 13.1215 13.1215 13.1215 13.1215 13.3461 13.3461 13.3461 13.3461 15.0700 15.0700 15.0700 15.0700 k = 0.5000-0.0000 0.0178 ( 4336 PWs) bands (ev): -14.1308 -14.1308 -14.1308 -14.1308 -14.1082 -14.1082 -14.1082 -14.1082 -9.7898 -9.7898 -9.7898 -9.7898 -9.7637 -9.7637 -9.7637 -9.7637 -3.2638 -3.2638 -3.2638 -3.2638 -3.0566 -3.0566 -3.0566 -3.0566 1.0726 1.0726 1.0726 1.0726 1.2264 1.2264 1.2264 1.2264 2.0723 2.0723 2.0723 2.0723 2.2291 2.2291 2.2291 2.2291 2.8679 2.8679 2.8679 2.8679 2.9129 2.9129 2.9129 2.9129 4.2133 4.2133 4.2133 4.2133 4.7091 4.7091 4.7091 4.7091 5.6957 5.6957 5.6957 5.6957 6.1013 6.1013 6.1013 6.1013 13.1186 13.1186 13.1186 13.1186 13.3481 13.3481 13.3481 13.3481 15.0540 15.0540 15.0540 15.0540 k = 0.5000-0.0000 0.0089 ( 4332 PWs) bands (ev): -14.1309 -14.1309 -14.1309 -14.1309 -14.1081 -14.1081 -14.1081 -14.1081 -9.7899 -9.7899 -9.7899 -9.7899 -9.7635 -9.7635 -9.7635 -9.7635 -3.2650 -3.2650 -3.2650 -3.2650 -3.0551 -3.0551 -3.0551 -3.0551 1.0703 1.0703 1.0703 1.0703 1.2248 1.2248 1.2248 1.2248 2.0770 2.0770 2.0770 2.0770 2.2335 2.2335 2.2335 2.2335 2.8639 2.8639 2.8639 2.8639 2.9110 2.9110 2.9110 2.9110 4.2108 4.2108 4.2108 4.2108 4.7125 4.7125 4.7125 4.7125 5.6930 5.6930 5.6930 5.6930 6.1040 6.1040 6.1040 6.1040 13.1168 13.1168 13.1168 13.1168 13.3494 13.3494 13.3494 13.3494 15.0444 15.0444 15.0444 15.0444 k = 0.5000-0.0000-0.0000 ( 4320 PWs) bands (ev): -14.1310 -14.1310 -14.1310 -14.1310 -14.1080 -14.1080 -14.1080 -14.1080 -9.7900 -9.7900 -9.7900 -9.7900 -9.7635 -9.7635 -9.7635 -9.7635 -3.2654 -3.2654 -3.2654 -3.2654 -3.0546 -3.0546 -3.0546 -3.0546 1.0695 1.0695 1.0695 1.0695 1.2243 1.2243 1.2243 1.2243 2.0786 2.0786 2.0786 2.0786 2.2350 2.2350 2.2350 2.2350 2.8626 2.8626 2.8626 2.8626 2.9104 2.9104 2.9104 2.9104 4.2099 4.2099 4.2099 4.2099 4.7137 4.7137 4.7137 4.7137 5.6921 5.6921 5.6921 5.6921 6.1048 6.1048 6.1048 6.1048 13.1162 13.1162 13.1162 13.1162 13.3498 13.3498 13.3498 13.3498 15.0411 15.0411 15.0411 15.0411 k = 0.5000 0.3227-0.0000 ( 4312 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0870 -14.0870 -14.0870 -14.0870 -9.8103 -9.8103 -9.8103 -9.8103 -9.8043 -9.8043 -9.8043 -9.8043 -3.3466 -3.3466 -3.3466 -3.3466 -3.2306 -3.2306 -3.2306 -3.2306 0.3740 0.3740 0.3740 0.3740 1.1806 1.1806 1.1806 1.1806 1.9884 1.9884 1.9884 1.9884 2.4243 2.4243 2.4243 2.4243 2.9833 2.9833 2.9833 2.9833 3.7136 3.7136 3.7136 3.7136 4.3820 4.3820 4.3820 4.3820 4.6745 4.6745 4.6745 4.6745 6.0724 6.0724 6.0724 6.0724 6.2309 6.2309 6.2309 6.2309 12.9236 12.9236 12.9236 12.9236 13.0698 13.0698 13.0698 13.0698 15.4153 15.4153 15.4153 15.4153 k = 0.5000 0.3227 0.0089 ( 4312 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0870 -14.0870 -14.0870 -14.0870 -9.8103 -9.8103 -9.8103 -9.8103 -9.8043 -9.8043 -9.8043 -9.8043 -3.3464 -3.3464 -3.3464 -3.3464 -3.2308 -3.2308 -3.2308 -3.2308 0.3747 0.3747 0.3747 0.3747 1.1756 1.1756 1.1756 1.1756 1.9948 1.9948 1.9948 1.9948 2.4255 2.4255 2.4255 2.4255 2.9822 2.9822 2.9822 2.9822 3.7095 3.7095 3.7095 3.7095 4.3838 4.3838 4.3838 4.3838 4.6742 4.6742 4.6742 4.6742 6.0728 6.0728 6.0728 6.0728 6.2306 6.2306 6.2306 6.2306 12.9241 12.9241 12.9241 12.9241 13.0697 13.0697 13.0697 13.0697 15.4173 15.4173 15.4173 15.4173 k = 0.5000 0.3227 0.0178 ( 4328 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0870 -14.0870 -14.0870 -14.0870 -9.8103 -9.8103 -9.8103 -9.8103 -9.8043 -9.8043 -9.8043 -9.8043 -3.3456 -3.3456 -3.3456 -3.3456 -3.2315 -3.2315 -3.2315 -3.2315 0.3771 0.3771 0.3771 0.3771 1.1610 1.1610 1.1610 1.1610 2.0135 2.0135 2.0135 2.0135 2.4290 2.4290 2.4290 2.4290 2.9790 2.9790 2.9790 2.9790 3.6973 3.6973 3.6973 3.6973 4.3892 4.3892 4.3892 4.3892 4.6734 4.6734 4.6734 4.6734 6.0740 6.0740 6.0740 6.0740 6.2298 6.2298 6.2298 6.2298 12.9255 12.9255 12.9255 12.9255 13.0693 13.0693 13.0693 13.0693 15.4232 15.4232 15.4232 15.4232 k = 0.5000 0.3227 0.0267 ( 4328 PWs) bands (ev): -14.0889 -14.0889 -14.0889 -14.0889 -14.0871 -14.0871 -14.0871 -14.0871 -9.8102 -9.8102 -9.8102 -9.8102 -9.8044 -9.8044 -9.8044 -9.8044 -3.3443 -3.3443 -3.3443 -3.3443 -3.2327 -3.2327 -3.2327 -3.2327 0.3810 0.3810 0.3810 0.3810 1.1381 1.1381 1.1381 1.1381 2.0431 2.0431 2.0431 2.0431 2.4350 2.4350 2.4350 2.4350 2.9737 2.9737 2.9737 2.9737 3.6775 3.6775 3.6775 3.6775 4.3976 4.3976 4.3976 4.3976 4.6720 4.6720 4.6720 4.6720 6.0760 6.0760 6.0760 6.0760 6.2283 6.2283 6.2283 6.2283 12.9279 12.9279 12.9279 12.9279 13.0687 13.0687 13.0687 13.0687 15.4330 15.4330 15.4330 15.4330 k = 0.5000 0.3227 0.0356 ( 4328 PWs) bands (ev): -14.0888 -14.0888 -14.0888 -14.0888 -14.0871 -14.0871 -14.0871 -14.0871 -9.8101 -9.8101 -9.8101 -9.8101 -9.8045 -9.8045 -9.8045 -9.8045 -3.3425 -3.3425 -3.3425 -3.3425 -3.2343 -3.2343 -3.2343 -3.2343 0.3865 0.3865 0.3865 0.3865 1.1086 1.1086 1.1086 1.1086 2.0819 2.0819 2.0819 2.0819 2.4432 2.4432 2.4432 2.4432 2.9664 2.9664 2.9664 2.9664 3.6508 3.6508 3.6508 3.6508 4.4087 4.4087 4.4087 4.4087 4.6700 4.6700 4.6700 4.6700 6.0788 6.0788 6.0788 6.0788 6.2263 6.2263 6.2263 6.2263 12.9313 12.9313 12.9313 12.9313 13.0679 13.0679 13.0679 13.0679 15.4467 15.4467 15.4467 15.4467 k = 0.5000 0.3227 0.0445 ( 4328 PWs) bands (ev): -14.0888 -14.0888 -14.0888 -14.0888 -14.0871 -14.0871 -14.0871 -14.0871 -9.8100 -9.8100 -9.8100 -9.8100 -9.8046 -9.8046 -9.8046 -9.8046 -3.3403 -3.3403 -3.3403 -3.3403 -3.2363 -3.2363 -3.2363 -3.2363 0.3936 0.3936 0.3936 0.3936 1.0743 1.0743 1.0743 1.0743 2.1282 2.1282 2.1282 2.1282 2.4537 2.4537 2.4537 2.4537 2.9572 2.9572 2.9572 2.9572 3.6178 3.6178 3.6178 3.6178 4.4217 4.4217 4.4217 4.4217 4.6675 4.6675 4.6675 4.6675 6.0823 6.0823 6.0823 6.0823 6.2238 6.2238 6.2238 6.2238 12.9355 12.9355 12.9355 12.9355 13.0667 13.0667 13.0667 13.0667 15.4641 15.4641 15.4641 15.4641 k = 0.5000 0.3227 0.0534 ( 4332 PWs) bands (ev): -14.0888 -14.0888 -14.0888 -14.0888 -14.0872 -14.0872 -14.0872 -14.0872 -9.8099 -9.8099 -9.8099 -9.8099 -9.8047 -9.8047 -9.8047 -9.8047 -3.3375 -3.3375 -3.3375 -3.3375 -3.2388 -3.2388 -3.2388 -3.2388 0.4023 0.4023 0.4023 0.4023 1.0366 1.0366 1.0366 1.0366 2.1803 2.1803 2.1803 2.1803 2.4662 2.4662 2.4662 2.4662 2.9461 2.9461 2.9461 2.9461 3.5792 3.5792 3.5792 3.5792 4.4360 4.4360 4.4360 4.4360 4.6643 4.6643 4.6643 4.6643 6.0864 6.0864 6.0864 6.0864 6.2207 6.2207 6.2207 6.2207 12.9404 12.9404 12.9404 12.9404 13.0652 13.0652 13.0652 13.0652 15.4853 15.4853 15.4853 15.4853 k = 0.5000 0.3227 0.0623 ( 4320 PWs) bands (ev): -14.0887 -14.0887 -14.0887 -14.0887 -14.0872 -14.0872 -14.0872 -14.0872 -9.8098 -9.8098 -9.8098 -9.8098 -9.8049 -9.8049 -9.8049 -9.8049 -3.3344 -3.3344 -3.3344 -3.3344 -3.2416 -3.2416 -3.2416 -3.2416 0.4128 0.4128 0.4128 0.4128 0.9969 0.9969 0.9969 0.9969 2.2369 2.2369 2.2369 2.2369 2.4806 2.4806 2.4806 2.4806 2.9333 2.9333 2.9333 2.9333 3.5359 3.5359 3.5359 3.5359 4.4511 4.4511 4.4511 4.4511 4.6607 4.6607 4.6607 4.6607 6.0912 6.0912 6.0912 6.0912 6.2170 6.2170 6.2170 6.2170 12.9461 12.9461 12.9461 12.9461 13.0634 13.0634 13.0634 13.0634 15.5102 15.5102 15.5102 15.5102 k = 0.5000 0.3227 0.0712 ( 4324 PWs) bands (ev): -14.0886 -14.0886 -14.0886 -14.0886 -14.0873 -14.0873 -14.0873 -14.0873 -9.8096 -9.8096 -9.8096 -9.8096 -9.8050 -9.8050 -9.8050 -9.8050 -3.3308 -3.3308 -3.3308 -3.3308 -3.2449 -3.2449 -3.2449 -3.2449 0.4250 0.4250 0.4250 0.4250 0.9560 0.9560 0.9560 0.9560 2.2967 2.2967 2.2967 2.2967 2.4969 2.4969 2.4969 2.4969 2.9190 2.9190 2.9190 2.9190 3.4883 3.4883 3.4883 3.4883 4.4666 4.4666 4.4666 4.4666 4.6564 4.6564 4.6564 4.6564 6.0965 6.0965 6.0965 6.0965 6.2129 6.2129 6.2129 6.2129 12.9524 12.9524 12.9524 12.9524 13.0611 13.0611 13.0611 13.0611 15.5385 15.5385 15.5385 15.5385 k = 0.5000 0.3227 0.0801 ( 4320 PWs) bands (ev): -14.0886 -14.0886 -14.0886 -14.0886 -14.0873 -14.0873 -14.0873 -14.0873 -9.8094 -9.8094 -9.8094 -9.8094 -9.8052 -9.8052 -9.8052 -9.8052 -3.3269 -3.3269 -3.3269 -3.3269 -3.2485 -3.2485 -3.2485 -3.2485 0.4391 0.4391 0.4391 0.4391 0.9148 0.9148 0.9148 0.9148 2.3589 2.3589 2.3589 2.3589 2.5148 2.5148 2.5148 2.5148 2.9035 2.9035 2.9035 2.9035 3.4371 3.4371 3.4371 3.4371 4.4822 4.4822 4.4822 4.4822 4.6515 4.6515 4.6515 4.6515 6.1023 6.1023 6.1023 6.1023 6.2083 6.2083 6.2083 6.2083 12.9592 12.9592 12.9592 12.9592 13.0584 13.0584 13.0584 13.0584 15.5701 15.5701 15.5701 15.5701 k = 0.5000 0.3227 0.0890 ( 4324 PWs) bands (ev): -14.0885 -14.0885 -14.0885 -14.0885 -14.0874 -14.0874 -14.0874 -14.0874 -9.8092 -9.8092 -9.8092 -9.8092 -9.8054 -9.8054 -9.8054 -9.8054 -3.3226 -3.3226 -3.3226 -3.3226 -3.2525 -3.2525 -3.2525 -3.2525 0.4549 0.4549 0.4549 0.4549 0.8738 0.8738 0.8738 0.8738 2.4225 2.4225 2.4225 2.4225 2.5341 2.5341 2.5341 2.5341 2.8872 2.8872 2.8872 2.8872 3.3827 3.3827 3.3827 3.3827 4.4975 4.4975 4.4975 4.4975 4.6460 4.6460 4.6460 4.6460 6.1085 6.1085 6.1085 6.1085 6.2033 6.2033 6.2033 6.2033 12.9663 12.9663 12.9663 12.9663 13.0552 13.0552 13.0552 13.0552 15.6050 15.6050 15.6050 15.6050 k = 0.5000 0.3227 0.0979 ( 4332 PWs) bands (ev): -14.0885 -14.0885 -14.0885 -14.0885 -14.0875 -14.0875 -14.0875 -14.0875 -9.8090 -9.8090 -9.8090 -9.8090 -9.8057 -9.8057 -9.8057 -9.8057 -3.3180 -3.3180 -3.3180 -3.3180 -3.2568 -3.2568 -3.2568 -3.2568 0.4727 0.4727 0.4727 0.4727 0.8334 0.8334 0.8334 0.8334 2.4863 2.4863 2.4863 2.4863 2.5547 2.5547 2.5547 2.5547 2.8708 2.8708 2.8708 2.8708 3.3256 3.3256 3.3256 3.3256 4.5124 4.5124 4.5124 4.5124 4.6399 4.6399 4.6399 4.6399 6.1151 6.1151 6.1151 6.1151 6.1979 6.1979 6.1979 6.1979 12.9738 12.9738 12.9738 12.9738 13.0515 13.0515 13.0515 13.0515 15.6427 15.6427 15.6427 15.6427 k = 0.5000 0.3227 0.1067 ( 4332 PWs) bands (ev): -14.0884 -14.0884 -14.0884 -14.0884 -14.0875 -14.0875 -14.0875 -14.0875 -9.8088 -9.8088 -9.8088 -9.8088 -9.8059 -9.8059 -9.8059 -9.8059 -3.3132 -3.3132 -3.3132 -3.3132 -3.2613 -3.2613 -3.2613 -3.2613 0.4923 0.4923 0.4923 0.4923 0.7941 0.7941 0.7941 0.7941 2.5483 2.5483 2.5483 2.5483 2.5768 2.5768 2.5768 2.5768 2.8554 2.8554 2.8554 2.8554 3.2662 3.2662 3.2662 3.2662 4.5268 4.5268 4.5268 4.5268 4.6332 4.6332 4.6332 4.6332 6.1219 6.1219 6.1219 6.1219 6.1920 6.1920 6.1920 6.1920 12.9814 12.9814 12.9814 12.9814 13.0474 13.0474 13.0474 13.0474 15.6832 15.6832 15.6832 15.6832 k = 0.5000 0.3227 0.1156 ( 4336 PWs) bands (ev): -14.0883 -14.0883 -14.0883 -14.0883 -14.0876 -14.0876 -14.0876 -14.0876 -9.8086 -9.8086 -9.8086 -9.8086 -9.8061 -9.8061 -9.8061 -9.8061 -3.3082 -3.3082 -3.3082 -3.3082 -3.2661 -3.2661 -3.2661 -3.2661 0.5139 0.5139 0.5139 0.5139 0.7560 0.7560 0.7560 0.7560 2.5949 2.5949 2.5949 2.5949 2.6108 2.6108 2.6108 2.6108 2.8437 2.8437 2.8437 2.8437 3.2050 3.2050 3.2050 3.2050 4.5405 4.5405 4.5405 4.5405 4.6259 4.6259 4.6259 4.6259 6.1289 6.1289 6.1289 6.1289 6.1859 6.1859 6.1859 6.1859 12.9891 12.9891 12.9891 12.9891 13.0426 13.0426 13.0426 13.0426 15.7262 15.7262 15.7262 15.7262 k = 0.5000 0.3227 0.1245 ( 4340 PWs) bands (ev): -14.0882 -14.0882 -14.0882 -14.0882 -14.0877 -14.0877 -14.0877 -14.0877 -9.8084 -9.8084 -9.8084 -9.8084 -9.8064 -9.8064 -9.8064 -9.8064 -3.3030 -3.3030 -3.3030 -3.3030 -3.2711 -3.2711 -3.2711 -3.2711 0.5375 0.5375 0.5375 0.5375 0.7195 0.7195 0.7195 0.7195 2.6187 2.6187 2.6187 2.6187 2.6577 2.6577 2.6577 2.6577 2.8417 2.8417 2.8417 2.8417 3.1425 3.1425 3.1425 3.1425 4.5535 4.5535 4.5535 4.5535 4.6179 4.6179 4.6179 4.6179 6.1360 6.1360 6.1360 6.1360 6.1795 6.1795 6.1795 6.1795 12.9968 12.9968 12.9968 12.9968 13.0374 13.0374 13.0374 13.0374 15.7712 15.7712 15.7712 15.7712 k = 0.5000 0.3227 0.1334 ( 4356 PWs) bands (ev): -14.0881 -14.0881 -14.0881 -14.0881 -14.0878 -14.0878 -14.0878 -14.0878 -9.8082 -9.8082 -9.8082 -9.8082 -9.8066 -9.8066 -9.8066 -9.8066 -3.2977 -3.2977 -3.2977 -3.2977 -3.2763 -3.2763 -3.2763 -3.2763 0.5630 0.5630 0.5630 0.5630 0.6845 0.6845 0.6845 0.6845 2.6406 2.6406 2.6406 2.6406 2.6855 2.6855 2.6855 2.6855 2.8595 2.8595 2.8595 2.8595 3.0793 3.0793 3.0793 3.0793 4.5657 4.5657 4.5657 4.5657 4.6093 4.6093 4.6093 4.6093 6.1432 6.1432 6.1432 6.1432 6.1729 6.1729 6.1729 6.1729 13.0044 13.0044 13.0044 13.0044 13.0316 13.0316 13.0316 13.0316 15.8180 15.8180 15.8180 15.8180 k = 0.5000 0.3227 0.1423 ( 4360 PWs) bands (ev): -14.0881 -14.0881 -14.0881 -14.0881 -14.0879 -14.0879 -14.0879 -14.0879 -9.8080 -9.8080 -9.8080 -9.8080 -9.8067 -9.8067 -9.8067 -9.8067 -3.2923 -3.2923 -3.2923 -3.2923 -3.2816 -3.2816 -3.2816 -3.2816 0.5905 0.5905 0.5905 0.5905 0.6513 0.6513 0.6513 0.6513 2.6611 2.6611 2.6611 2.6611 2.6896 2.6896 2.6896 2.6896 2.9005 2.9005 2.9005 2.9005 3.0165 3.0165 3.0165 3.0165 4.5767 4.5767 4.5767 4.5767 4.6005 4.6005 4.6005 4.6005 6.1500 6.1500 6.1500 6.1500 6.1664 6.1664 6.1664 6.1664 13.0117 13.0117 13.0117 13.0117 13.0253 13.0253 13.0253 13.0253 15.8662 15.8662 15.8662 15.8662 k = 0.5000 0.3227 0.1512 ( 4352 PWs) bands (ev): -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -14.0880 -9.8080 -9.8080 -9.8080 -9.8080 -9.8068 -9.8068 -9.8068 -9.8068 -3.2871 -3.2871 -3.2871 -3.2871 -3.2868 -3.2868 -3.2868 -3.2868 0.6196 0.6196 0.6196 0.6196 0.6203 0.6203 0.6203 0.6203 2.6766 2.6766 2.6766 2.6766 2.6808 2.6808 2.6808 2.6808 2.9529 2.9529 2.9529 2.9529 2.9582 2.9582 2.9582 2.9582 4.5834 4.5834 4.5834 4.5834 4.5945 4.5945 4.5945 4.5945 6.1543 6.1543 6.1543 6.1543 6.1622 6.1622 6.1622 6.1622 13.0187 13.0187 13.0187 13.0187 13.0188 13.0188 13.0188 13.0188 15.9140 15.9140 15.9140 15.9140 Writing output data file AlHO2.save init_run : 0.24s CPU 0.35s WALL ( 1 calls) electrons : 433.28s CPU 438.73s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.03s WALL ( 1 calls) Called by electrons: c_bands : 433.26s CPU 438.71s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.06s CPU 0.09s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.09s CPU 0.16s WALL ( 448 calls) cegterg : 399.18s CPU 403.58s WALL ( 538 calls) Called by sum_band: Called by *egterg: h_psi : 161.28s CPU 164.19s WALL ( 9773 calls) s_psi : 59.48s CPU 59.67s WALL ( 9773 calls) g_psi : 0.59s CPU 0.50s WALL ( 8787 calls) cdiaghg : 159.64s CPU 161.41s WALL ( 9235 calls) cegterg:over : 17.63s CPU 17.67s WALL ( 8787 calls) cegterg:upda : 15.77s CPU 15.83s WALL ( 8787 calls) cegterg:last : 7.00s CPU 7.12s WALL ( 1526 calls) cdiaghg:chol : 9.56s CPU 9.57s WALL ( 9235 calls) cdiaghg:inve : 6.98s CPU 7.14s WALL ( 9235 calls) cdiaghg:para : 12.94s CPU 12.94s WALL ( 18470 calls) Called by h_psi: h_psi:vloc : 120.50s CPU 123.16s WALL ( 9773 calls) h_psi:vnl : 40.20s CPU 40.48s WALL ( 9773 calls) add_vuspsi : 21.27s CPU 21.42s WALL ( 9773 calls) General routines calbec : 18.86s CPU 19.03s WALL ( 9773 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 112.81s CPU 115.41s WALL ( 1593352 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.31s CPU 0.42s WALL ( 896 calls) Parallel routines fft_scatter : 43.24s CPU 44.23s WALL ( 1593375 calls) PWSCF : 7m44.50s CPU 8m 5.75s WALL This run was terminated on: 19:36:45 24Dec2016 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=