Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:54:38 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: ./BaZnPF.save/ file Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 6S renormalized file F.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 43 27 8 2919 1449 230 Max 44 28 9 2928 1480 237 Sum 1565 973 293 105209 52677 8415 bravais-lattice index = 14 lattice parameter (alat) = 7.8543 a.u. unit-cell volume = 1102.5335 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 4 number of electrons = 68.00 number of Kohn-Sham states= 82 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 317.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 7.854344 celldm(2)= 1.000000 celldm(3)= 2.275423 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 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 2.275423 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.439479 ) PseudoPot. # 1 for Ba read from file: /users/gautes/Pseudo/Ba.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 3006f3397849ee49953ff32be8e81b23 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1251 points, 11 beta functions with: l(1) = 0 l(2) = 0 l(3) = 0 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 1 l(8) = 2 l(9) = 2 l(10) = 2 l(11) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for F read from file: /users/gautes/Pseudo/F.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: ce20c52fa94def3fe434d52ed9f7ea44 Pseudo is Ultrasoft + core correction, Zval = 7.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1105 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Zn read from file: /users/gautes/Pseudo/Zn.rel-pbe-dn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8d14e5a70806ad8c3d477ea097862760 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1201 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 4 for P read from file: /users/gautes/Pseudo/P.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 667ec27f6326587e4f0d1734a2230026 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1147 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Ba 10.00 137.32700 Ba( 1.00) F 7.00 18.99840 F( 1.00) Zn 12.00 65.40900 Zn( 1.00) P 5.00 30.97380 P( 1.00) 4 Sym. Ops., with inversion, found (note: 12 additional sym.ops. were found but ignored their fractional translations are incommensurate with FFT grid) 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 [1,1,0] cryst. s( 2) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 2) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s( 4) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 4) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [1,1,0] -C2 -2 180 deg rotation - cart. axis [1,1,0] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [1,1,0] -s_h -4 inv. 180 deg rotation - cart. axis [1,1,0] E Cartesian axes number of k points= 320 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0000000 0.0131579 -0.0000000), wk = 0.0031250 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0031250 k( 4) = ( 0.0000000 0.0394737 -0.0000000), wk = 0.0031250 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0031250 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0031250 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0031250 k( 8) = ( 0.0000000 0.0921053 -0.0000000), wk = 0.0031250 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0031250 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0031250 k( 11) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0031250 k( 12) = ( 0.0000000 0.1447368 -0.0000000), wk = 0.0031250 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0031250 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0031250 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0031250 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0031250 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0031250 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0031250 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0031250 k( 20) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0031250 k( 21) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0031250 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0031250 k( 23) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0031250 k( 24) = ( 0.0000000 0.3026316 -0.0000000), wk = 0.0031250 k( 25) = ( 0.0000000 0.3157895 -0.0000000), wk = 0.0031250 k( 26) = ( 0.0000000 0.3289474 -0.0000000), wk = 0.0031250 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0031250 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0031250 k( 29) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0031250 k( 30) = ( 0.0000000 0.3815789 -0.0000000), wk = 0.0031250 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0031250 k( 32) = ( 0.0000000 0.4078947 -0.0000000), wk = 0.0031250 k( 33) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0031250 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0031250 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0031250 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0031250 k( 37) = ( 0.0000000 0.4736842 -0.0000000), wk = 0.0031250 k( 38) = ( 0.0000000 0.4868421 -0.0000000), wk = 0.0031250 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 41) = ( 0.0131579 0.5000000 -0.0000000), wk = 0.0031250 k( 42) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0031250 k( 43) = ( 0.0394737 0.5000000 -0.0000000), wk = 0.0031250 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0031250 k( 45) = ( 0.0657895 0.5000000 -0.0000000), wk = 0.0031250 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0031250 k( 47) = ( 0.0921053 0.5000000 -0.0000000), wk = 0.0031250 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0031250 k( 49) = ( 0.1184210 0.5000000 -0.0000000), wk = 0.0031250 k( 50) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0031250 k( 51) = ( 0.1447368 0.5000000 -0.0000000), wk = 0.0031250 k( 52) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0031250 k( 53) = ( 0.1710526 0.5000000 -0.0000000), wk = 0.0031250 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0031250 k( 55) = ( 0.1973684 0.5000000 -0.0000000), wk = 0.0031250 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0031250 k( 57) = ( 0.2236842 0.5000000 -0.0000000), wk = 0.0031250 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0031250 k( 59) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0031250 k( 60) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0031250 k( 61) = ( 0.2763158 0.5000000 -0.0000000), wk = 0.0031250 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0031250 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0031250 k( 64) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0031250 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0031250 k( 66) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0031250 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0031250 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0031250 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0031250 k( 70) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0031250 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0031250 k( 72) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0031250 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0031250 k( 74) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0031250 k( 75) = ( 0.4605263 0.5000000 -0.0000000), wk = 0.0031250 k( 76) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0031250 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0031250 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 80) = ( 0.4907407 0.4907407 -0.0000000), wk = 0.0031250 k( 81) = ( 0.4814815 0.4814815 -0.0000000), wk = 0.0031250 k( 82) = ( 0.4722222 0.4722222 -0.0000000), wk = 0.0031250 k( 83) = ( 0.4629630 0.4629630 -0.0000000), wk = 0.0031250 k( 84) = ( 0.4537037 0.4537037 -0.0000000), wk = 0.0031250 k( 85) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0031250 k( 86) = ( 0.4351852 0.4351852 -0.0000000), wk = 0.0031250 k( 87) = ( 0.4259259 0.4259259 -0.0000000), wk = 0.0031250 k( 88) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0031250 k( 89) = ( 0.4074074 0.4074074 -0.0000000), wk = 0.0031250 k( 90) = ( 0.3981481 0.3981481 -0.0000000), wk = 0.0031250 k( 91) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0031250 k( 92) = ( 0.3796296 0.3796296 -0.0000000), wk = 0.0031250 k( 93) = ( 0.3703704 0.3703704 -0.0000000), wk = 0.0031250 k( 94) = ( 0.3611111 0.3611111 -0.0000000), wk = 0.0031250 k( 95) = ( 0.3518519 0.3518518 -0.0000000), wk = 0.0031250 k( 96) = ( 0.3425926 0.3425926 -0.0000000), wk = 0.0031250 k( 97) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0031250 k( 98) = ( 0.3240741 0.3240741 -0.0000000), wk = 0.0031250 k( 99) = ( 0.3148148 0.3148148 -0.0000000), wk = 0.0031250 k( 100) = ( 0.3055556 0.3055556 -0.0000000), wk = 0.0031250 k( 101) = ( 0.2962963 0.2962963 -0.0000000), wk = 0.0031250 k( 102) = ( 0.2870370 0.2870370 -0.0000000), wk = 0.0031250 k( 103) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0031250 k( 104) = ( 0.2685185 0.2685185 -0.0000000), wk = 0.0031250 k( 105) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0031250 k( 106) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0031250 k( 107) = ( 0.2407407 0.2407407 -0.0000000), wk = 0.0031250 k( 108) = ( 0.2314815 0.2314815 -0.0000000), wk = 0.0031250 k( 109) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0031250 k( 110) = ( 0.2129630 0.2129630 -0.0000000), wk = 0.0031250 k( 111) = ( 0.2037037 0.2037037 -0.0000000), wk = 0.0031250 k( 112) = ( 0.1944444 0.1944444 -0.0000000), wk = 0.0031250 k( 113) = ( 0.1851852 0.1851852 -0.0000000), wk = 0.0031250 k( 114) = ( 0.1759259 0.1759259 -0.0000000), wk = 0.0031250 k( 115) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0031250 k( 116) = ( 0.1574074 0.1574074 -0.0000000), wk = 0.0031250 k( 117) = ( 0.1481482 0.1481481 -0.0000000), wk = 0.0031250 k( 118) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0031250 k( 119) = ( 0.1296296 0.1296296 -0.0000000), wk = 0.0031250 k( 120) = ( 0.1203704 0.1203704 -0.0000000), wk = 0.0031250 k( 121) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0031250 k( 122) = ( 0.1018518 0.1018518 -0.0000000), wk = 0.0031250 k( 123) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0031250 k( 124) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0031250 k( 125) = ( 0.0740741 0.0740741 -0.0000000), wk = 0.0031250 k( 126) = ( 0.0648148 0.0648148 -0.0000000), wk = 0.0031250 k( 127) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0031250 k( 128) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0031250 k( 129) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0031250 k( 130) = ( 0.0277778 0.0277778 -0.0000000), wk = 0.0031250 k( 131) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0031250 k( 132) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.0129258), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.0258517), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.0387775), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.0517034), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.0646292), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.0775551), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.0904809), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.1034068), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.1163326), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.1292585), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.1421843), wk = 0.0031250 k( 146) = ( 0.0000000 0.0000000 0.1551102), wk = 0.0031250 k( 147) = ( 0.0000000 0.0000000 0.1680360), wk = 0.0031250 k( 148) = ( 0.0000000 0.0000000 0.1809619), wk = 0.0031250 k( 149) = ( 0.0000000 0.0000000 0.1938877), wk = 0.0031250 k( 150) = ( 0.0000000 0.0000000 0.2068136), wk = 0.0031250 k( 151) = ( 0.0000000 0.0000000 0.2197394), wk = 0.0031250 k( 152) = ( 0.0000000 0.0000000 0.2197394), wk = 0.0031250 k( 153) = ( 0.0000000 0.0131579 0.2197394), wk = 0.0031250 k( 154) = ( 0.0000000 0.0263158 0.2197394), wk = 0.0031250 k( 155) = ( 0.0000000 0.0394737 0.2197394), wk = 0.0031250 k( 156) = ( 0.0000000 0.0526316 0.2197394), wk = 0.0031250 k( 157) = ( 0.0000000 0.0657895 0.2197394), wk = 0.0031250 k( 158) = ( 0.0000000 0.0789474 0.2197394), wk = 0.0031250 k( 159) = ( 0.0000000 0.0921053 0.2197394), wk = 0.0031250 k( 160) = ( 0.0000000 0.1052632 0.2197394), wk = 0.0031250 k( 161) = ( 0.0000000 0.1184210 0.2197394), wk = 0.0031250 k( 162) = ( 0.0000000 0.1315790 0.2197394), wk = 0.0031250 k( 163) = ( 0.0000000 0.1447368 0.2197394), wk = 0.0031250 k( 164) = ( 0.0000000 0.1578947 0.2197394), wk = 0.0031250 k( 165) = ( 0.0000000 0.1710526 0.2197394), wk = 0.0031250 k( 166) = ( 0.0000000 0.1842105 0.2197394), wk = 0.0031250 k( 167) = ( 0.0000000 0.1973684 0.2197394), wk = 0.0031250 k( 168) = ( 0.0000000 0.2105263 0.2197394), wk = 0.0031250 k( 169) = ( 0.0000000 0.2236842 0.2197394), wk = 0.0031250 k( 170) = ( 0.0000000 0.2368421 0.2197394), wk = 0.0031250 k( 171) = ( 0.0000000 0.2500000 0.2197394), wk = 0.0031250 k( 172) = ( 0.0000000 0.2631579 0.2197394), wk = 0.0031250 k( 173) = ( 0.0000000 0.2763158 0.2197394), wk = 0.0031250 k( 174) = ( 0.0000000 0.2894737 0.2197394), wk = 0.0031250 k( 175) = ( 0.0000000 0.3026316 0.2197394), wk = 0.0031250 k( 176) = ( 0.0000000 0.3157895 0.2197394), wk = 0.0031250 k( 177) = ( 0.0000000 0.3289474 0.2197394), wk = 0.0031250 k( 178) = ( 0.0000000 0.3421053 0.2197394), wk = 0.0031250 k( 179) = ( 0.0000000 0.3552632 0.2197394), wk = 0.0031250 k( 180) = ( 0.0000000 0.3684211 0.2197394), wk = 0.0031250 k( 181) = ( 0.0000000 0.3815789 0.2197394), wk = 0.0031250 k( 182) = ( 0.0000000 0.3947368 0.2197394), wk = 0.0031250 k( 183) = ( 0.0000000 0.4078947 0.2197394), wk = 0.0031250 k( 184) = ( 0.0000000 0.4210526 0.2197394), wk = 0.0031250 k( 185) = ( 0.0000000 0.4342105 0.2197394), wk = 0.0031250 k( 186) = ( 0.0000000 0.4473684 0.2197394), wk = 0.0031250 k( 187) = ( 0.0000000 0.4605263 0.2197394), wk = 0.0031250 k( 188) = ( 0.0000000 0.4736842 0.2197394), wk = 0.0031250 k( 189) = ( 0.0000000 0.4868421 0.2197394), wk = 0.0031250 k( 190) = ( 0.0000000 0.5000000 0.2197394), wk = 0.0031250 k( 191) = ( 0.0000000 0.5000000 0.2197394), wk = 0.0031250 k( 192) = ( 0.0131579 0.5000000 0.2197394), wk = 0.0031250 k( 193) = ( 0.0263158 0.5000000 0.2197394), wk = 0.0031250 k( 194) = ( 0.0394737 0.5000000 0.2197394), wk = 0.0031250 k( 195) = ( 0.0526316 0.5000000 0.2197394), wk = 0.0031250 k( 196) = ( 0.0657895 0.5000000 0.2197394), wk = 0.0031250 k( 197) = ( 0.0789474 0.5000000 0.2197394), wk = 0.0031250 k( 198) = ( 0.0921053 0.5000000 0.2197394), wk = 0.0031250 k( 199) = ( 0.1052632 0.5000000 0.2197394), wk = 0.0031250 k( 200) = ( 0.1184210 0.5000000 0.2197394), wk = 0.0031250 k( 201) = ( 0.1315790 0.5000000 0.2197394), wk = 0.0031250 k( 202) = ( 0.1447368 0.5000000 0.2197394), wk = 0.0031250 k( 203) = ( 0.1578947 0.5000000 0.2197394), wk = 0.0031250 k( 204) = ( 0.1710526 0.5000000 0.2197394), wk = 0.0031250 k( 205) = ( 0.1842105 0.5000000 0.2197394), wk = 0.0031250 k( 206) = ( 0.1973684 0.5000000 0.2197394), wk = 0.0031250 k( 207) = ( 0.2105263 0.5000000 0.2197394), wk = 0.0031250 k( 208) = ( 0.2236842 0.5000000 0.2197394), wk = 0.0031250 k( 209) = ( 0.2368421 0.5000000 0.2197394), wk = 0.0031250 k( 210) = ( 0.2500000 0.5000000 0.2197394), wk = 0.0031250 k( 211) = ( 0.2631579 0.5000000 0.2197394), wk = 0.0031250 k( 212) = ( 0.2763158 0.5000000 0.2197394), wk = 0.0031250 k( 213) = ( 0.2894737 0.5000000 0.2197394), wk = 0.0031250 k( 214) = ( 0.3026316 0.5000000 0.2197394), wk = 0.0031250 k( 215) = ( 0.3157895 0.5000000 0.2197394), wk = 0.0031250 k( 216) = ( 0.3289474 0.5000000 0.2197394), wk = 0.0031250 k( 217) = ( 0.3421053 0.5000000 0.2197394), wk = 0.0031250 k( 218) = ( 0.3552632 0.5000000 0.2197394), wk = 0.0031250 k( 219) = ( 0.3684211 0.5000000 0.2197394), wk = 0.0031250 k( 220) = ( 0.3815789 0.5000000 0.2197394), wk = 0.0031250 k( 221) = ( 0.3947368 0.5000000 0.2197394), wk = 0.0031250 k( 222) = ( 0.4078947 0.5000000 0.2197394), wk = 0.0031250 k( 223) = ( 0.4210526 0.5000000 0.2197394), wk = 0.0031250 k( 224) = ( 0.4342105 0.5000000 0.2197394), wk = 0.0031250 k( 225) = ( 0.4473684 0.5000000 0.2197394), wk = 0.0031250 k( 226) = ( 0.4605263 0.5000000 0.2197394), wk = 0.0031250 k( 227) = ( 0.4736842 0.5000000 0.2197394), wk = 0.0031250 k( 228) = ( 0.4868421 0.5000000 0.2197394), wk = 0.0031250 k( 229) = ( 0.5000000 0.5000000 0.2197394), wk = 0.0031250 k( 230) = ( 0.5000000 0.5000000 0.2197394), wk = 0.0031250 k( 231) = ( 0.4907407 0.4907407 0.2197394), wk = 0.0031250 k( 232) = ( 0.4814815 0.4814815 0.2197394), wk = 0.0031250 k( 233) = ( 0.4722222 0.4722222 0.2197394), wk = 0.0031250 k( 234) = ( 0.4629630 0.4629630 0.2197394), wk = 0.0031250 k( 235) = ( 0.4537037 0.4537037 0.2197394), wk = 0.0031250 k( 236) = ( 0.4444444 0.4444444 0.2197394), wk = 0.0031250 k( 237) = ( 0.4351852 0.4351852 0.2197394), wk = 0.0031250 k( 238) = ( 0.4259259 0.4259259 0.2197394), wk = 0.0031250 k( 239) = ( 0.4166667 0.4166667 0.2197394), wk = 0.0031250 k( 240) = ( 0.4074074 0.4074074 0.2197394), wk = 0.0031250 k( 241) = ( 0.3981481 0.3981481 0.2197394), wk = 0.0031250 k( 242) = ( 0.3888889 0.3888889 0.2197394), wk = 0.0031250 k( 243) = ( 0.3796296 0.3796296 0.2197394), wk = 0.0031250 k( 244) = ( 0.3703704 0.3703704 0.2197394), wk = 0.0031250 k( 245) = ( 0.3611111 0.3611111 0.2197394), wk = 0.0031250 k( 246) = ( 0.3518519 0.3518518 0.2197394), wk = 0.0031250 k( 247) = ( 0.3425926 0.3425926 0.2197394), wk = 0.0031250 k( 248) = ( 0.3333333 0.3333333 0.2197394), wk = 0.0031250 k( 249) = ( 0.3240741 0.3240741 0.2197394), wk = 0.0031250 k( 250) = ( 0.3148148 0.3148148 0.2197394), wk = 0.0031250 k( 251) = ( 0.3055556 0.3055556 0.2197394), wk = 0.0031250 k( 252) = ( 0.2962963 0.2962963 0.2197394), wk = 0.0031250 k( 253) = ( 0.2870370 0.2870370 0.2197394), wk = 0.0031250 k( 254) = ( 0.2777778 0.2777778 0.2197394), wk = 0.0031250 k( 255) = ( 0.2685185 0.2685185 0.2197394), wk = 0.0031250 k( 256) = ( 0.2592593 0.2592593 0.2197394), wk = 0.0031250 k( 257) = ( 0.2500000 0.2500000 0.2197394), wk = 0.0031250 k( 258) = ( 0.2407407 0.2407407 0.2197394), wk = 0.0031250 k( 259) = ( 0.2314815 0.2314815 0.2197394), wk = 0.0031250 k( 260) = ( 0.2222222 0.2222222 0.2197394), wk = 0.0031250 k( 261) = ( 0.2129630 0.2129630 0.2197394), wk = 0.0031250 k( 262) = ( 0.2037037 0.2037037 0.2197394), wk = 0.0031250 k( 263) = ( 0.1944444 0.1944444 0.2197394), wk = 0.0031250 k( 264) = ( 0.1851852 0.1851852 0.2197394), wk = 0.0031250 k( 265) = ( 0.1759259 0.1759259 0.2197394), wk = 0.0031250 k( 266) = ( 0.1666667 0.1666667 0.2197394), wk = 0.0031250 k( 267) = ( 0.1574074 0.1574074 0.2197394), wk = 0.0031250 k( 268) = ( 0.1481482 0.1481481 0.2197394), wk = 0.0031250 k( 269) = ( 0.1388889 0.1388889 0.2197394), wk = 0.0031250 k( 270) = ( 0.1296296 0.1296296 0.2197394), wk = 0.0031250 k( 271) = ( 0.1203704 0.1203704 0.2197394), wk = 0.0031250 k( 272) = ( 0.1111111 0.1111111 0.2197394), wk = 0.0031250 k( 273) = ( 0.1018518 0.1018518 0.2197394), wk = 0.0031250 k( 274) = ( 0.0925926 0.0925926 0.2197394), wk = 0.0031250 k( 275) = ( 0.0833333 0.0833333 0.2197394), wk = 0.0031250 k( 276) = ( 0.0740741 0.0740741 0.2197394), wk = 0.0031250 k( 277) = ( 0.0648148 0.0648148 0.2197394), wk = 0.0031250 k( 278) = ( 0.0555556 0.0555556 0.2197394), wk = 0.0031250 k( 279) = ( 0.0462963 0.0462963 0.2197394), wk = 0.0031250 k( 280) = ( 0.0370370 0.0370370 0.2197394), wk = 0.0031250 k( 281) = ( 0.0277778 0.0277778 0.2197394), wk = 0.0031250 k( 282) = ( 0.0185185 0.0185185 0.2197394), wk = 0.0031250 k( 283) = ( 0.0092593 0.0092593 0.2197394), wk = 0.0031250 k( 284) = ( 0.0000000 0.0000000 0.2197394), wk = 0.0031250 k( 285) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 286) = ( 0.0000000 0.5000000 0.0129258), wk = 0.0031250 k( 287) = ( 0.0000000 0.5000000 0.0258517), wk = 0.0031250 k( 288) = ( 0.0000000 0.5000000 0.0387775), wk = 0.0031250 k( 289) = ( 0.0000000 0.5000000 0.0517034), wk = 0.0031250 k( 290) = ( 0.0000000 0.5000000 0.0646292), wk = 0.0031250 k( 291) = ( 0.0000000 0.5000000 0.0775551), wk = 0.0031250 k( 292) = ( 0.0000000 0.5000000 0.0904809), wk = 0.0031250 k( 293) = ( 0.0000000 0.5000000 0.1034068), wk = 0.0031250 k( 294) = ( 0.0000000 0.5000000 0.1163326), wk = 0.0031250 k( 295) = ( 0.0000000 0.5000000 0.1292585), wk = 0.0031250 k( 296) = ( 0.0000000 0.5000000 0.1421843), wk = 0.0031250 k( 297) = ( 0.0000000 0.5000000 0.1551102), wk = 0.0031250 k( 298) = ( 0.0000000 0.5000000 0.1680360), wk = 0.0031250 k( 299) = ( 0.0000000 0.5000000 0.1809619), wk = 0.0031250 k( 300) = ( 0.0000000 0.5000000 0.1938877), wk = 0.0031250 k( 301) = ( 0.0000000 0.5000000 0.2068136), wk = 0.0031250 k( 302) = ( 0.0000000 0.5000000 0.2197394), wk = 0.0031250 k( 303) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 304) = ( 0.5000000 0.5000000 0.0129258), wk = 0.0031250 k( 305) = ( 0.5000000 0.5000000 0.0258517), wk = 0.0031250 k( 306) = ( 0.5000000 0.5000000 0.0387775), wk = 0.0031250 k( 307) = ( 0.5000000 0.5000000 0.0517034), wk = 0.0031250 k( 308) = ( 0.5000000 0.5000000 0.0646292), wk = 0.0031250 k( 309) = ( 0.5000000 0.5000000 0.0775551), wk = 0.0031250 k( 310) = ( 0.5000000 0.5000000 0.0904809), wk = 0.0031250 k( 311) = ( 0.5000000 0.5000000 0.1034068), wk = 0.0031250 k( 312) = ( 0.5000000 0.5000000 0.1163326), wk = 0.0031250 k( 313) = ( 0.5000000 0.5000000 0.1292585), wk = 0.0031250 k( 314) = ( 0.5000000 0.5000000 0.1421843), wk = 0.0031250 k( 315) = ( 0.5000000 0.5000000 0.1551102), wk = 0.0031250 k( 316) = ( 0.5000000 0.5000000 0.1680360), wk = 0.0031250 k( 317) = ( 0.5000000 0.5000000 0.1809619), wk = 0.0031250 k( 318) = ( 0.5000000 0.5000000 0.1938877), wk = 0.0031250 k( 319) = ( 0.5000000 0.5000000 0.2068136), wk = 0.0031250 k( 320) = ( 0.5000000 0.5000000 0.2197394), wk = 0.0031250 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 2) = ( 0.0000000 0.0131579 -0.0000000), wk = 0.0031250 k( 3) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0031250 k( 4) = ( 0.0000000 0.0394737 0.0000000), wk = 0.0031250 k( 5) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0031250 k( 6) = ( 0.0000000 0.0657895 -0.0000000), wk = 0.0031250 k( 7) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0031250 k( 8) = ( 0.0000000 0.0921053 -0.0000000), wk = 0.0031250 k( 9) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0031250 k( 10) = ( 0.0000000 0.1184210 -0.0000000), wk = 0.0031250 k( 11) = ( 0.0000000 0.1315790 0.0000000), wk = 0.0031250 k( 12) = ( 0.0000000 0.1447368 -0.0000000), wk = 0.0031250 k( 13) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0031250 k( 14) = ( 0.0000000 0.1710526 -0.0000000), wk = 0.0031250 k( 15) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0031250 k( 16) = ( 0.0000000 0.1973684 -0.0000000), wk = 0.0031250 k( 17) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0031250 k( 18) = ( 0.0000000 0.2236842 -0.0000000), wk = 0.0031250 k( 19) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0031250 k( 20) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0031250 k( 21) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0031250 k( 22) = ( 0.0000000 0.2763158 -0.0000000), wk = 0.0031250 k( 23) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0031250 k( 24) = ( 0.0000000 0.3026316 -0.0000000), wk = 0.0031250 k( 25) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0031250 k( 26) = ( 0.0000000 0.3289474 0.0000000), wk = 0.0031250 k( 27) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0031250 k( 28) = ( 0.0000000 0.3552632 -0.0000000), wk = 0.0031250 k( 29) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0031250 k( 30) = ( 0.0000000 0.3815789 0.0000000), wk = 0.0031250 k( 31) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0031250 k( 32) = ( 0.0000000 0.4078947 -0.0000000), wk = 0.0031250 k( 33) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0031250 k( 34) = ( 0.0000000 0.4342105 -0.0000000), wk = 0.0031250 k( 35) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0031250 k( 36) = ( 0.0000000 0.4605263 -0.0000000), wk = 0.0031250 k( 37) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0031250 k( 38) = ( 0.0000000 0.4868421 0.0000000), wk = 0.0031250 k( 39) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 40) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 41) = ( 0.0131579 0.5000000 0.0000000), wk = 0.0031250 k( 42) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0031250 k( 43) = ( 0.0394737 0.5000000 0.0000000), wk = 0.0031250 k( 44) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0031250 k( 45) = ( 0.0657895 0.5000000 -0.0000000), wk = 0.0031250 k( 46) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0031250 k( 47) = ( 0.0921053 0.5000000 -0.0000000), wk = 0.0031250 k( 48) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0031250 k( 49) = ( 0.1184210 0.5000000 0.0000000), wk = 0.0031250 k( 50) = ( 0.1315790 0.5000000 0.0000000), wk = 0.0031250 k( 51) = ( 0.1447368 0.5000000 0.0000000), wk = 0.0031250 k( 52) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0031250 k( 53) = ( 0.1710526 0.5000000 -0.0000000), wk = 0.0031250 k( 54) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0031250 k( 55) = ( 0.1973684 0.5000000 -0.0000000), wk = 0.0031250 k( 56) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0031250 k( 57) = ( 0.2236842 0.5000000 0.0000000), wk = 0.0031250 k( 58) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0031250 k( 59) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0031250 k( 60) = ( 0.2631579 0.5000000 0.0000000), wk = 0.0031250 k( 61) = ( 0.2763158 0.5000000 -0.0000000), wk = 0.0031250 k( 62) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0031250 k( 63) = ( 0.3026316 0.5000000 -0.0000000), wk = 0.0031250 k( 64) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0031250 k( 65) = ( 0.3289474 0.5000000 -0.0000000), wk = 0.0031250 k( 66) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0031250 k( 67) = ( 0.3552632 0.5000000 -0.0000000), wk = 0.0031250 k( 68) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0031250 k( 69) = ( 0.3815789 0.5000000 -0.0000000), wk = 0.0031250 k( 70) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0031250 k( 71) = ( 0.4078947 0.5000000 -0.0000000), wk = 0.0031250 k( 72) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0031250 k( 73) = ( 0.4342105 0.5000000 -0.0000000), wk = 0.0031250 k( 74) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0031250 k( 75) = ( 0.4605263 0.5000000 -0.0000000), wk = 0.0031250 k( 76) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0031250 k( 77) = ( 0.4868421 0.5000000 -0.0000000), wk = 0.0031250 k( 78) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 79) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 80) = ( 0.4907407 0.4907407 -0.0000000), wk = 0.0031250 k( 81) = ( 0.4814815 0.4814815 -0.0000000), wk = 0.0031250 k( 82) = ( 0.4722222 0.4722222 -0.0000000), wk = 0.0031250 k( 83) = ( 0.4629630 0.4629630 -0.0000000), wk = 0.0031250 k( 84) = ( 0.4537037 0.4537037 -0.0000000), wk = 0.0031250 k( 85) = ( 0.4444444 0.4444444 -0.0000000), wk = 0.0031250 k( 86) = ( 0.4351852 0.4351852 -0.0000000), wk = 0.0031250 k( 87) = ( 0.4259259 0.4259259 -0.0000000), wk = 0.0031250 k( 88) = ( 0.4166667 0.4166667 -0.0000000), wk = 0.0031250 k( 89) = ( 0.4074074 0.4074074 -0.0000000), wk = 0.0031250 k( 90) = ( 0.3981481 0.3981481 -0.0000000), wk = 0.0031250 k( 91) = ( 0.3888889 0.3888889 -0.0000000), wk = 0.0031250 k( 92) = ( 0.3796296 0.3796296 -0.0000000), wk = 0.0031250 k( 93) = ( 0.3703704 0.3703704 0.0000000), wk = 0.0031250 k( 94) = ( 0.3611111 0.3611111 -0.0000000), wk = 0.0031250 k( 95) = ( 0.3518519 0.3518519 -0.0000000), wk = 0.0031250 k( 96) = ( 0.3425926 0.3425926 -0.0000000), wk = 0.0031250 k( 97) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0031250 k( 98) = ( 0.3240741 0.3240741 -0.0000000), wk = 0.0031250 k( 99) = ( 0.3148148 0.3148148 -0.0000000), wk = 0.0031250 k( 100) = ( 0.3055556 0.3055556 -0.0000000), wk = 0.0031250 k( 101) = ( 0.2962963 0.2962963 -0.0000000), wk = 0.0031250 k( 102) = ( 0.2870370 0.2870370 -0.0000000), wk = 0.0031250 k( 103) = ( 0.2777778 0.2777778 -0.0000000), wk = 0.0031250 k( 104) = ( 0.2685185 0.2685185 0.0000000), wk = 0.0031250 k( 105) = ( 0.2592593 0.2592593 0.0000000), wk = 0.0031250 k( 106) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0031250 k( 107) = ( 0.2407407 0.2407407 -0.0000000), wk = 0.0031250 k( 108) = ( 0.2314815 0.2314815 -0.0000000), wk = 0.0031250 k( 109) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0031250 k( 110) = ( 0.2129630 0.2129630 0.0000000), wk = 0.0031250 k( 111) = ( 0.2037037 0.2037037 -0.0000000), wk = 0.0031250 k( 112) = ( 0.1944444 0.1944444 -0.0000000), wk = 0.0031250 k( 113) = ( 0.1851852 0.1851852 -0.0000000), wk = 0.0031250 k( 114) = ( 0.1759259 0.1759259 -0.0000000), wk = 0.0031250 k( 115) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0031250 k( 116) = ( 0.1574074 0.1574074 -0.0000000), wk = 0.0031250 k( 117) = ( 0.1481482 0.1481482 -0.0000000), wk = 0.0031250 k( 118) = ( 0.1388889 0.1388889 -0.0000000), wk = 0.0031250 k( 119) = ( 0.1296296 0.1296296 0.0000000), wk = 0.0031250 k( 120) = ( 0.1203704 0.1203704 -0.0000000), wk = 0.0031250 k( 121) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0031250 k( 122) = ( 0.1018518 0.1018518 -0.0000000), wk = 0.0031250 k( 123) = ( 0.0925926 0.0925926 -0.0000000), wk = 0.0031250 k( 124) = ( 0.0833333 0.0833333 -0.0000000), wk = 0.0031250 k( 125) = ( 0.0740741 0.0740741 -0.0000000), wk = 0.0031250 k( 126) = ( 0.0648148 0.0648148 -0.0000000), wk = 0.0031250 k( 127) = ( 0.0555556 0.0555556 -0.0000000), wk = 0.0031250 k( 128) = ( 0.0462963 0.0462963 -0.0000000), wk = 0.0031250 k( 129) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0031250 k( 130) = ( 0.0277778 0.0277778 -0.0000000), wk = 0.0031250 k( 131) = ( 0.0185185 0.0185185 -0.0000000), wk = 0.0031250 k( 132) = ( 0.0092593 0.0092593 -0.0000000), wk = 0.0031250 k( 133) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 134) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0031250 k( 135) = ( 0.0000000 0.0000000 0.0294118), wk = 0.0031250 k( 136) = ( 0.0000000 0.0000000 0.0588235), wk = 0.0031250 k( 137) = ( 0.0000000 0.0000000 0.0882353), wk = 0.0031250 k( 138) = ( 0.0000000 0.0000000 0.1176471), wk = 0.0031250 k( 139) = ( 0.0000000 0.0000000 0.1470588), wk = 0.0031250 k( 140) = ( 0.0000000 0.0000000 0.1764706), wk = 0.0031250 k( 141) = ( 0.0000000 0.0000000 0.2058823), wk = 0.0031250 k( 142) = ( 0.0000000 0.0000000 0.2352941), wk = 0.0031250 k( 143) = ( 0.0000000 0.0000000 0.2647059), wk = 0.0031250 k( 144) = ( 0.0000000 0.0000000 0.2941177), wk = 0.0031250 k( 145) = ( 0.0000000 0.0000000 0.3235294), wk = 0.0031250 k( 146) = ( 0.0000000 0.0000000 0.3529412), wk = 0.0031250 k( 147) = ( 0.0000000 0.0000000 0.3823529), wk = 0.0031250 k( 148) = ( 0.0000000 0.0000000 0.4117647), wk = 0.0031250 k( 149) = ( 0.0000000 0.0000000 0.4411765), wk = 0.0031250 k( 150) = ( 0.0000000 0.0000000 0.4705882), wk = 0.0031250 k( 151) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 152) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 153) = ( 0.0000000 0.0131579 0.5000000), wk = 0.0031250 k( 154) = ( 0.0000000 0.0263158 0.5000000), wk = 0.0031250 k( 155) = ( 0.0000000 0.0394737 0.5000000), wk = 0.0031250 k( 156) = ( 0.0000000 0.0526316 0.5000000), wk = 0.0031250 k( 157) = ( 0.0000000 0.0657895 0.5000000), wk = 0.0031250 k( 158) = ( 0.0000000 0.0789474 0.5000000), wk = 0.0031250 k( 159) = ( 0.0000000 0.0921053 0.5000000), wk = 0.0031250 k( 160) = ( 0.0000000 0.1052632 0.5000000), wk = 0.0031250 k( 161) = ( 0.0000000 0.1184210 0.5000000), wk = 0.0031250 k( 162) = ( 0.0000000 0.1315790 0.5000000), wk = 0.0031250 k( 163) = ( 0.0000000 0.1447368 0.5000000), wk = 0.0031250 k( 164) = ( 0.0000000 0.1578947 0.5000000), wk = 0.0031250 k( 165) = ( 0.0000000 0.1710526 0.5000000), wk = 0.0031250 k( 166) = ( 0.0000000 0.1842105 0.5000000), wk = 0.0031250 k( 167) = ( 0.0000000 0.1973684 0.5000000), wk = 0.0031250 k( 168) = ( 0.0000000 0.2105263 0.5000000), wk = 0.0031250 k( 169) = ( 0.0000000 0.2236842 0.5000000), wk = 0.0031250 k( 170) = ( 0.0000000 0.2368421 0.5000000), wk = 0.0031250 k( 171) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0031250 k( 172) = ( 0.0000000 0.2631579 0.5000000), wk = 0.0031250 k( 173) = ( 0.0000000 0.2763158 0.5000000), wk = 0.0031250 k( 174) = ( 0.0000000 0.2894737 0.5000000), wk = 0.0031250 k( 175) = ( 0.0000000 0.3026316 0.5000000), wk = 0.0031250 k( 176) = ( 0.0000000 0.3157895 0.5000000), wk = 0.0031250 k( 177) = ( 0.0000000 0.3289474 0.5000000), wk = 0.0031250 k( 178) = ( 0.0000000 0.3421053 0.5000000), wk = 0.0031250 k( 179) = ( 0.0000000 0.3552632 0.5000000), wk = 0.0031250 k( 180) = ( 0.0000000 0.3684211 0.5000000), wk = 0.0031250 k( 181) = ( 0.0000000 0.3815789 0.5000000), wk = 0.0031250 k( 182) = ( 0.0000000 0.3947368 0.5000000), wk = 0.0031250 k( 183) = ( 0.0000000 0.4078947 0.5000000), wk = 0.0031250 k( 184) = ( 0.0000000 0.4210526 0.5000000), wk = 0.0031250 k( 185) = ( 0.0000000 0.4342105 0.5000000), wk = 0.0031250 k( 186) = ( 0.0000000 0.4473684 0.5000000), wk = 0.0031250 k( 187) = ( 0.0000000 0.4605263 0.5000000), wk = 0.0031250 k( 188) = ( 0.0000000 0.4736842 0.5000000), wk = 0.0031250 k( 189) = ( 0.0000000 0.4868421 0.5000000), wk = 0.0031250 k( 190) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 191) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 192) = ( 0.0131579 0.5000000 0.5000000), wk = 0.0031250 k( 193) = ( 0.0263158 0.5000000 0.5000000), wk = 0.0031250 k( 194) = ( 0.0394737 0.5000000 0.5000000), wk = 0.0031250 k( 195) = ( 0.0526316 0.5000000 0.5000000), wk = 0.0031250 k( 196) = ( 0.0657895 0.5000000 0.5000000), wk = 0.0031250 k( 197) = ( 0.0789474 0.5000000 0.5000000), wk = 0.0031250 k( 198) = ( 0.0921053 0.5000000 0.5000000), wk = 0.0031250 k( 199) = ( 0.1052632 0.5000000 0.5000000), wk = 0.0031250 k( 200) = ( 0.1184210 0.5000000 0.5000000), wk = 0.0031250 k( 201) = ( 0.1315790 0.5000000 0.5000000), wk = 0.0031250 k( 202) = ( 0.1447368 0.5000000 0.5000000), wk = 0.0031250 k( 203) = ( 0.1578947 0.5000000 0.5000000), wk = 0.0031250 k( 204) = ( 0.1710526 0.5000000 0.5000000), wk = 0.0031250 k( 205) = ( 0.1842105 0.5000000 0.5000000), wk = 0.0031250 k( 206) = ( 0.1973684 0.5000000 0.5000000), wk = 0.0031250 k( 207) = ( 0.2105263 0.5000000 0.5000000), wk = 0.0031250 k( 208) = ( 0.2236842 0.5000000 0.5000000), wk = 0.0031250 k( 209) = ( 0.2368421 0.5000000 0.5000000), wk = 0.0031250 k( 210) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0031250 k( 211) = ( 0.2631579 0.5000000 0.5000000), wk = 0.0031250 k( 212) = ( 0.2763158 0.5000000 0.5000000), wk = 0.0031250 k( 213) = ( 0.2894737 0.5000000 0.5000000), wk = 0.0031250 k( 214) = ( 0.3026316 0.5000000 0.5000000), wk = 0.0031250 k( 215) = ( 0.3157895 0.5000000 0.5000000), wk = 0.0031250 k( 216) = ( 0.3289474 0.5000000 0.5000000), wk = 0.0031250 k( 217) = ( 0.3421053 0.5000000 0.5000000), wk = 0.0031250 k( 218) = ( 0.3552632 0.5000000 0.5000000), wk = 0.0031250 k( 219) = ( 0.3684211 0.5000000 0.5000000), wk = 0.0031250 k( 220) = ( 0.3815789 0.5000000 0.5000000), wk = 0.0031250 k( 221) = ( 0.3947368 0.5000000 0.5000000), wk = 0.0031250 k( 222) = ( 0.4078947 0.5000000 0.5000000), wk = 0.0031250 k( 223) = ( 0.4210526 0.5000000 0.5000000), wk = 0.0031250 k( 224) = ( 0.4342105 0.5000000 0.5000000), wk = 0.0031250 k( 225) = ( 0.4473684 0.5000000 0.5000000), wk = 0.0031250 k( 226) = ( 0.4605263 0.5000000 0.5000000), wk = 0.0031250 k( 227) = ( 0.4736842 0.5000000 0.5000000), wk = 0.0031250 k( 228) = ( 0.4868421 0.5000000 0.5000000), wk = 0.0031250 k( 229) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 230) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 k( 231) = ( 0.4907407 0.4907407 0.5000000), wk = 0.0031250 k( 232) = ( 0.4814815 0.4814815 0.5000000), wk = 0.0031250 k( 233) = ( 0.4722222 0.4722222 0.5000000), wk = 0.0031250 k( 234) = ( 0.4629630 0.4629630 0.5000000), wk = 0.0031250 k( 235) = ( 0.4537037 0.4537037 0.5000000), wk = 0.0031250 k( 236) = ( 0.4444444 0.4444444 0.5000000), wk = 0.0031250 k( 237) = ( 0.4351852 0.4351852 0.5000000), wk = 0.0031250 k( 238) = ( 0.4259259 0.4259259 0.5000000), wk = 0.0031250 k( 239) = ( 0.4166667 0.4166667 0.5000000), wk = 0.0031250 k( 240) = ( 0.4074074 0.4074074 0.5000000), wk = 0.0031250 k( 241) = ( 0.3981481 0.3981481 0.5000000), wk = 0.0031250 k( 242) = ( 0.3888889 0.3888889 0.5000000), wk = 0.0031250 k( 243) = ( 0.3796296 0.3796296 0.5000000), wk = 0.0031250 k( 244) = ( 0.3703704 0.3703704 0.5000000), wk = 0.0031250 k( 245) = ( 0.3611111 0.3611111 0.5000000), wk = 0.0031250 k( 246) = ( 0.3518519 0.3518519 0.5000000), wk = 0.0031250 k( 247) = ( 0.3425926 0.3425926 0.5000000), wk = 0.0031250 k( 248) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0031250 k( 249) = ( 0.3240741 0.3240741 0.5000000), wk = 0.0031250 k( 250) = ( 0.3148148 0.3148148 0.5000000), wk = 0.0031250 k( 251) = ( 0.3055556 0.3055556 0.5000000), wk = 0.0031250 k( 252) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0031250 k( 253) = ( 0.2870370 0.2870370 0.5000000), wk = 0.0031250 k( 254) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0031250 k( 255) = ( 0.2685185 0.2685185 0.5000000), wk = 0.0031250 k( 256) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0031250 k( 257) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0031250 k( 258) = ( 0.2407407 0.2407407 0.5000000), wk = 0.0031250 k( 259) = ( 0.2314815 0.2314815 0.5000000), wk = 0.0031250 k( 260) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0031250 k( 261) = ( 0.2129630 0.2129630 0.5000000), wk = 0.0031250 k( 262) = ( 0.2037037 0.2037037 0.5000000), wk = 0.0031250 k( 263) = ( 0.1944444 0.1944444 0.5000000), wk = 0.0031250 k( 264) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0031250 k( 265) = ( 0.1759259 0.1759259 0.5000000), wk = 0.0031250 k( 266) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0031250 k( 267) = ( 0.1574074 0.1574074 0.5000000), wk = 0.0031250 k( 268) = ( 0.1481482 0.1481482 0.5000000), wk = 0.0031250 k( 269) = ( 0.1388889 0.1388889 0.5000000), wk = 0.0031250 k( 270) = ( 0.1296296 0.1296296 0.5000000), wk = 0.0031250 k( 271) = ( 0.1203704 0.1203704 0.5000000), wk = 0.0031250 k( 272) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0031250 k( 273) = ( 0.1018518 0.1018518 0.5000000), wk = 0.0031250 k( 274) = ( 0.0925926 0.0925926 0.5000000), wk = 0.0031250 k( 275) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0031250 k( 276) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0031250 k( 277) = ( 0.0648148 0.0648148 0.5000000), wk = 0.0031250 k( 278) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0031250 k( 279) = ( 0.0462963 0.0462963 0.5000000), wk = 0.0031250 k( 280) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0031250 k( 281) = ( 0.0277778 0.0277778 0.5000000), wk = 0.0031250 k( 282) = ( 0.0185185 0.0185185 0.5000000), wk = 0.0031250 k( 283) = ( 0.0092593 0.0092593 0.5000000), wk = 0.0031250 k( 284) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0031250 k( 285) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0031250 k( 286) = ( 0.0000000 0.5000000 0.0294118), wk = 0.0031250 k( 287) = ( 0.0000000 0.5000000 0.0588235), wk = 0.0031250 k( 288) = ( 0.0000000 0.5000000 0.0882353), wk = 0.0031250 k( 289) = ( 0.0000000 0.5000000 0.1176471), wk = 0.0031250 k( 290) = ( 0.0000000 0.5000000 0.1470588), wk = 0.0031250 k( 291) = ( 0.0000000 0.5000000 0.1764706), wk = 0.0031250 k( 292) = ( 0.0000000 0.5000000 0.2058823), wk = 0.0031250 k( 293) = ( 0.0000000 0.5000000 0.2352941), wk = 0.0031250 k( 294) = ( 0.0000000 0.5000000 0.2647059), wk = 0.0031250 k( 295) = ( 0.0000000 0.5000000 0.2941177), wk = 0.0031250 k( 296) = ( 0.0000000 0.5000000 0.3235294), wk = 0.0031250 k( 297) = ( 0.0000000 0.5000000 0.3529412), wk = 0.0031250 k( 298) = ( 0.0000000 0.5000000 0.3823529), wk = 0.0031250 k( 299) = ( 0.0000000 0.5000000 0.4117647), wk = 0.0031250 k( 300) = ( 0.0000000 0.5000000 0.4411765), wk = 0.0031250 k( 301) = ( 0.0000000 0.5000000 0.4705882), wk = 0.0031250 k( 302) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0031250 k( 303) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0031250 k( 304) = ( 0.5000000 0.5000000 0.0294118), wk = 0.0031250 k( 305) = ( 0.5000000 0.5000000 0.0588235), wk = 0.0031250 k( 306) = ( 0.5000000 0.5000000 0.0882353), wk = 0.0031250 k( 307) = ( 0.5000000 0.5000000 0.1176471), wk = 0.0031250 k( 308) = ( 0.5000000 0.5000000 0.1470588), wk = 0.0031250 k( 309) = ( 0.5000000 0.5000000 0.1764706), wk = 0.0031250 k( 310) = ( 0.5000000 0.5000000 0.2058823), wk = 0.0031250 k( 311) = ( 0.5000000 0.5000000 0.2352941), wk = 0.0031250 k( 312) = ( 0.5000000 0.5000000 0.2647059), wk = 0.0031250 k( 313) = ( 0.5000000 0.5000000 0.2941177), wk = 0.0031250 k( 314) = ( 0.5000000 0.5000000 0.3235294), wk = 0.0031250 k( 315) = ( 0.5000000 0.5000000 0.3529412), wk = 0.0031250 k( 316) = ( 0.5000000 0.5000000 0.3823529), wk = 0.0031250 k( 317) = ( 0.5000000 0.5000000 0.4117647), wk = 0.0031250 k( 318) = ( 0.5000000 0.5000000 0.4411765), wk = 0.0031250 k( 319) = ( 0.5000000 0.5000000 0.4705882), wk = 0.0031250 k( 320) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0031250 Dense grid: 105209 G-vectors FFT dimensions: ( 45, 45, 108) Smooth grid: 52677 G-vectors FFT dimensions: ( 36, 36, 81) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.48 Mb ( 382, 82) NL pseudopotentials 0.68 Mb ( 191, 234) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.02 Mb ( 2926) G-vector shells 0.01 Mb ( 1439) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.91 Mb ( 382, 328) Each subspace H/S matrix 0.10 Mb ( 82, 82) Each matrix 0.59 Mb ( 234, 2, 82) The potential is recalculated from file : ./BaZnPF.save/charge-density.dat Starting wfc are 88 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.4 secs Computing kpt #: 2 total cpu time spent up to now is 5.4 secs Computing kpt #: 3 total cpu time spent up to now is 6.5 secs Computing kpt #: 4 total cpu time spent up to now is 7.5 secs Computing kpt #: 5 total cpu time spent up to now is 8.6 secs Computing kpt #: 6 total cpu time spent up to now is 9.6 secs Computing kpt #: 7 total cpu time spent up to now is 10.6 secs Computing kpt #: 8 total cpu time spent up to now is 11.7 secs Computing kpt #: 9 total cpu time spent up to now is 12.7 secs Computing kpt #: 10 total cpu time spent up to now is 13.7 secs Computing kpt #: 11 total cpu time spent up to now is 14.8 secs Computing kpt #: 12 total cpu time spent up to now is 15.8 secs Computing kpt #: 13 total cpu time spent up to now is 16.9 secs Computing kpt #: 14 total cpu time spent up to now is 17.9 secs Computing kpt #: 15 total cpu time spent up to now is 19.0 secs Computing kpt #: 16 total cpu time spent up to now is 20.1 secs Computing kpt #: 17 total cpu time spent up to now is 21.1 secs Computing kpt #: 18 total cpu time spent up to now is 22.2 secs Computing kpt #: 19 total cpu time spent up to now is 23.2 secs Computing kpt #: 20 total cpu time spent up to now is 24.2 secs Computing kpt #: 21 total cpu time spent up to now is 25.3 secs Computing kpt #: 22 total cpu time spent up to now is 26.2 secs Computing kpt #: 23 total cpu time spent up to now is 27.2 secs Computing kpt #: 24 total cpu time spent up to now is 28.3 secs Computing kpt #: 25 total cpu time spent up to now is 29.5 secs Computing kpt #: 26 total cpu time spent up to now is 30.6 secs Computing kpt #: 27 total cpu time spent up to now is 31.7 secs Computing kpt #: 28 total cpu time spent up to now is 32.8 secs Computing kpt #: 29 total cpu time spent up to now is 33.9 secs Computing kpt #: 30 total cpu time spent up to now is 35.1 secs Computing kpt #: 31 total cpu time spent up to now is 36.2 secs Computing kpt #: 32 total cpu time spent up to now is 37.4 secs Computing kpt #: 33 total cpu time spent up to now is 38.7 secs Computing kpt #: 34 total cpu time spent up to now is 39.9 secs Computing kpt #: 35 total cpu time spent up to now is 41.1 secs Computing kpt #: 36 total cpu time spent up to now is 42.2 secs Computing kpt #: 37 total cpu time spent up to now is 43.3 secs Computing kpt #: 38 total cpu time spent up to now is 44.6 secs Computing kpt #: 39 total cpu time spent up to now is 45.7 secs Computing kpt #: 40 total cpu time spent up to now is 46.8 secs Computing kpt #: 41 total cpu time spent up to now is 47.9 secs Computing kpt #: 42 total cpu time spent up to now is 49.0 secs Computing kpt #: 43 total cpu time spent up to now is 50.1 secs Computing kpt #: 44 total cpu time spent up to now is 51.2 secs Computing kpt #: 45 total cpu time spent up to now is 52.3 secs Computing kpt #: 46 total cpu time spent up to now is 53.4 secs Computing kpt #: 47 total cpu time spent up to now is 54.5 secs Computing kpt #: 48 total cpu time spent up to now is 55.6 secs Computing kpt #: 49 total cpu time spent up to now is 56.7 secs Computing kpt #: 50 total cpu time spent up to now is 57.8 secs Computing kpt #: 51 total cpu time spent up to now is 58.9 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 61.1 secs Computing kpt #: 54 total cpu time spent up to now is 62.2 secs Computing kpt #: 55 total cpu time spent up to now is 63.2 secs Computing kpt #: 56 total cpu time spent up to now is 64.3 secs Computing kpt #: 57 total cpu time spent up to now is 65.4 secs Computing kpt #: 58 total cpu time spent up to now is 66.6 secs Computing kpt #: 59 total cpu time spent up to now is 67.7 secs Computing kpt #: 60 total cpu time spent up to now is 68.8 secs Computing kpt #: 61 total cpu time spent up to now is 69.9 secs Computing kpt #: 62 total cpu time spent up to now is 71.1 secs Computing kpt #: 63 total cpu time spent up to now is 72.2 secs Computing kpt #: 64 total cpu time spent up to now is 73.3 secs Computing kpt #: 65 total cpu time spent up to now is 74.5 secs Computing kpt #: 66 total cpu time spent up to now is 75.6 secs Computing kpt #: 67 total cpu time spent up to now is 76.9 secs Computing kpt #: 68 total cpu time spent up to now is 78.1 secs Computing kpt #: 69 total cpu time spent up to now is 79.4 secs Computing kpt #: 70 total cpu time spent up to now is 80.6 secs Computing kpt #: 71 total cpu time spent up to now is 81.9 secs Computing kpt #: 72 total cpu time spent up to now is 83.1 secs Computing kpt #: 73 total cpu time spent up to now is 84.4 secs Computing kpt #: 74 total cpu time spent up to now is 85.6 secs Computing kpt #: 75 total cpu time spent up to now is 87.3 secs Computing kpt #: 76 total cpu time spent up to now is 88.6 secs Computing kpt #: 77 total cpu time spent up to now is 90.3 secs Computing kpt #: 78 total cpu time spent up to now is 91.5 secs Computing kpt #: 79 total cpu time spent up to now is 92.7 secs Computing kpt #: 80 total cpu time spent up to now is 95.2 secs Computing kpt #: 81 total cpu time spent up to now is 96.6 secs Computing kpt #: 82 total cpu time spent up to now is 97.9 secs Computing kpt #: 83 total cpu time spent up to now is 99.1 secs Computing kpt #: 84 total cpu time spent up to now is 100.4 secs Computing kpt #: 85 total cpu time spent up to now is 101.6 secs Computing kpt #: 86 total cpu time spent up to now is 102.8 secs Computing kpt #: 87 total cpu time spent up to now is 104.1 secs Computing kpt #: 88 total cpu time spent up to now is 105.3 secs Computing kpt #: 89 total cpu time spent up to now is 106.6 secs Computing kpt #: 90 total cpu time spent up to now is 107.8 secs Computing kpt #: 91 total cpu time spent up to now is 109.1 secs Computing kpt #: 92 total cpu time spent up to now is 110.3 secs Computing kpt #: 93 total cpu time spent up to now is 111.6 secs Computing kpt #: 94 total cpu time spent up to now is 112.8 secs Computing kpt #: 95 total cpu time spent up to now is 113.9 secs Computing kpt #: 96 total cpu time spent up to now is 115.0 secs Computing kpt #: 97 total cpu time spent up to now is 116.0 secs Computing kpt #: 98 total cpu time spent up to now is 117.1 secs Computing kpt #: 99 total cpu time spent up to now is 118.2 secs Computing kpt #: 100 total cpu time spent up to now is 119.4 secs Computing kpt #: 101 total cpu time spent up to now is 120.5 secs Computing kpt #: 102 total cpu time spent up to now is 121.6 secs Computing kpt #: 103 total cpu time spent up to now is 122.8 secs Computing kpt #: 104 total cpu time spent up to now is 123.9 secs Computing kpt #: 105 total cpu time spent up to now is 124.9 secs Computing kpt #: 106 total cpu time spent up to now is 125.9 secs Computing kpt #: 107 total cpu time spent up to now is 126.9 secs Computing kpt #: 108 total cpu time spent up to now is 128.0 secs Computing kpt #: 109 total cpu time spent up to now is 128.9 secs Computing kpt #: 110 total cpu time spent up to now is 129.9 secs Computing kpt #: 111 total cpu time spent up to now is 130.9 secs Computing kpt #: 112 total cpu time spent up to now is 132.2 secs Computing kpt #: 113 total cpu time spent up to now is 133.2 secs Computing kpt #: 114 total cpu time spent up to now is 134.2 secs Computing kpt #: 115 total cpu time spent up to now is 135.2 secs Computing kpt #: 116 total cpu time spent up to now is 136.2 secs Computing kpt #: 117 total cpu time spent up to now is 137.2 secs Computing kpt #: 118 total cpu time spent up to now is 138.3 secs Computing kpt #: 119 total cpu time spent up to now is 139.3 secs Computing kpt #: 120 total cpu time spent up to now is 140.4 secs Computing kpt #: 121 total cpu time spent up to now is 141.4 secs Computing kpt #: 122 total cpu time spent up to now is 142.5 secs Computing kpt #: 123 total cpu time spent up to now is 143.5 secs Computing kpt #: 124 total cpu time spent up to now is 144.6 secs Computing kpt #: 125 total cpu time spent up to now is 145.6 secs Computing kpt #: 126 total cpu time spent up to now is 146.6 secs Computing kpt #: 127 total cpu time spent up to now is 147.6 secs Computing kpt #: 128 total cpu time spent up to now is 148.6 secs Computing kpt #: 129 total cpu time spent up to now is 149.6 secs Computing kpt #: 130 total cpu time spent up to now is 150.6 secs Computing kpt #: 131 total cpu time spent up to now is 151.6 secs Computing kpt #: 132 total cpu time spent up to now is 152.7 secs Computing kpt #: 133 total cpu time spent up to now is 153.7 secs Computing kpt #: 134 total cpu time spent up to now is 154.7 secs Computing kpt #: 135 total cpu time spent up to now is 155.7 secs Computing kpt #: 136 total cpu time spent up to now is 156.7 secs Computing kpt #: 137 total cpu time spent up to now is 157.8 secs Computing kpt #: 138 total cpu time spent up to now is 159.0 secs Computing kpt #: 139 total cpu time spent up to now is 160.2 secs Computing kpt #: 140 total cpu time spent up to now is 161.4 secs Computing kpt #: 141 total cpu time spent up to now is 162.5 secs Computing kpt #: 142 total cpu time spent up to now is 163.7 secs Computing kpt #: 143 total cpu time spent up to now is 164.8 secs Computing kpt #: 144 total cpu time spent up to now is 165.8 secs Computing kpt #: 145 total cpu time spent up to now is 166.9 secs Computing kpt #: 146 total cpu time spent up to now is 168.0 secs Computing kpt #: 147 total cpu time spent up to now is 169.0 secs Computing kpt #: 148 total cpu time spent up to now is 170.0 secs Computing kpt #: 149 total cpu time spent up to now is 171.0 secs Computing kpt #: 150 total cpu time spent up to now is 172.0 secs Computing kpt #: 151 total cpu time spent up to now is 173.0 secs Computing kpt #: 152 total cpu time spent up to now is 174.1 secs Computing kpt #: 153 total cpu time spent up to now is 175.1 secs Computing kpt #: 154 total cpu time spent up to now is 176.1 secs Computing kpt #: 155 total cpu time spent up to now is 177.2 secs Computing kpt #: 156 total cpu time spent up to now is 178.3 secs Computing kpt #: 157 total cpu time spent up to now is 179.3 secs Computing kpt #: 158 total cpu time spent up to now is 180.5 secs Computing kpt #: 159 total cpu time spent up to now is 181.7 secs Computing kpt #: 160 total cpu time spent up to now is 182.8 secs Computing kpt #: 161 total cpu time spent up to now is 183.8 secs Computing kpt #: 162 total cpu time spent up to now is 184.8 secs Computing kpt #: 163 total cpu time spent up to now is 185.8 secs Computing kpt #: 164 total cpu time spent up to now is 186.8 secs Computing kpt #: 165 total cpu time spent up to now is 187.8 secs Computing kpt #: 166 total cpu time spent up to now is 188.8 secs Computing kpt #: 167 total cpu time spent up to now is 189.8 secs Computing kpt #: 168 total cpu time spent up to now is 190.8 secs Computing kpt #: 169 total cpu time spent up to now is 191.7 secs Computing kpt #: 170 total cpu time spent up to now is 192.7 secs Computing kpt #: 171 total cpu time spent up to now is 193.7 secs Computing kpt #: 172 total cpu time spent up to now is 194.7 secs Computing kpt #: 173 total cpu time spent up to now is 195.8 secs Computing kpt #: 174 total cpu time spent up to now is 196.9 secs Computing kpt #: 175 total cpu time spent up to now is 198.0 secs Computing kpt #: 176 total cpu time spent up to now is 199.1 secs Computing kpt #: 177 total cpu time spent up to now is 200.2 secs Computing kpt #: 178 total cpu time spent up to now is 201.3 secs Computing kpt #: 179 total cpu time spent up to now is 202.3 secs Computing kpt #: 180 total cpu time spent up to now is 203.4 secs Computing kpt #: 181 total cpu time spent up to now is 204.5 secs Computing kpt #: 182 total cpu time spent up to now is 205.6 secs Computing kpt #: 183 total cpu time spent up to now is 206.6 secs Computing kpt #: 184 total cpu time spent up to now is 207.7 secs Computing kpt #: 185 total cpu time spent up to now is 208.8 secs Computing kpt #: 186 total cpu time spent up to now is 209.9 secs Computing kpt #: 187 total cpu time spent up to now is 211.0 secs Computing kpt #: 188 total cpu time spent up to now is 212.1 secs Computing kpt #: 189 total cpu time spent up to now is 213.3 secs Computing kpt #: 190 total cpu time spent up to now is 214.3 secs Computing kpt #: 191 total cpu time spent up to now is 215.3 secs Computing kpt #: 192 total cpu time spent up to now is 216.5 secs Computing kpt #: 193 total cpu time spent up to now is 217.8 secs Computing kpt #: 194 total cpu time spent up to now is 219.0 secs Computing kpt #: 195 total cpu time spent up to now is 220.3 secs Computing kpt #: 196 total cpu time spent up to now is 221.5 secs Computing kpt #: 197 total cpu time spent up to now is 222.8 secs Computing kpt #: 198 total cpu time spent up to now is 223.9 secs Computing kpt #: 199 total cpu time spent up to now is 225.1 secs Computing kpt #: 200 total cpu time spent up to now is 226.1 secs Computing kpt #: 201 total cpu time spent up to now is 227.2 secs Computing kpt #: 202 total cpu time spent up to now is 228.3 secs Computing kpt #: 203 total cpu time spent up to now is 229.4 secs Computing kpt #: 204 total cpu time spent up to now is 230.5 secs Computing kpt #: 205 total cpu time spent up to now is 231.6 secs Computing kpt #: 206 total cpu time spent up to now is 232.6 secs Computing kpt #: 207 total cpu time spent up to now is 233.7 secs Computing kpt #: 208 total cpu time spent up to now is 234.7 secs Computing kpt #: 209 total cpu time spent up to now is 235.9 secs Computing kpt #: 210 total cpu time spent up to now is 236.9 secs Computing kpt #: 211 total cpu time spent up to now is 238.0 secs Computing kpt #: 212 total cpu time spent up to now is 239.1 secs Computing kpt #: 213 total cpu time spent up to now is 240.2 secs Computing kpt #: 214 total cpu time spent up to now is 241.3 secs Computing kpt #: 215 total cpu time spent up to now is 242.4 secs Computing kpt #: 216 total cpu time spent up to now is 243.6 secs Computing kpt #: 217 total cpu time spent up to now is 244.9 secs Computing kpt #: 218 total cpu time spent up to now is 246.1 secs Computing kpt #: 219 total cpu time spent up to now is 247.3 secs Computing kpt #: 220 total cpu time spent up to now is 248.5 secs Computing kpt #: 221 total cpu time spent up to now is 249.7 secs Computing kpt #: 222 total cpu time spent up to now is 250.8 secs Computing kpt #: 223 total cpu time spent up to now is 251.9 secs Computing kpt #: 224 total cpu time spent up to now is 253.0 secs Computing kpt #: 225 total cpu time spent up to now is 254.2 secs Computing kpt #: 226 total cpu time spent up to now is 255.2 secs Computing kpt #: 227 total cpu time spent up to now is 256.3 secs Computing kpt #: 228 total cpu time spent up to now is 257.5 secs Computing kpt #: 229 total cpu time spent up to now is 258.4 secs Computing kpt #: 230 total cpu time spent up to now is 259.4 secs Computing kpt #: 231 total cpu time spent up to now is 260.5 secs Computing kpt #: 232 total cpu time spent up to now is 261.6 secs Computing kpt #: 233 total cpu time spent up to now is 262.6 secs Computing kpt #: 234 total cpu time spent up to now is 263.7 secs Computing kpt #: 235 total cpu time spent up to now is 264.7 secs Computing kpt #: 236 total cpu time spent up to now is 265.8 secs Computing kpt #: 237 total cpu time spent up to now is 266.8 secs Computing kpt #: 238 total cpu time spent up to now is 267.9 secs Computing kpt #: 239 total cpu time spent up to now is 269.0 secs Computing kpt #: 240 total cpu time spent up to now is 270.0 secs Computing kpt #: 241 total cpu time spent up to now is 271.1 secs Computing kpt #: 242 total cpu time spent up to now is 272.2 secs Computing kpt #: 243 total cpu time spent up to now is 273.2 secs Computing kpt #: 244 total cpu time spent up to now is 274.2 secs Computing kpt #: 245 total cpu time spent up to now is 275.2 secs Computing kpt #: 246 total cpu time spent up to now is 276.3 secs Computing kpt #: 247 total cpu time spent up to now is 277.3 secs Computing kpt #: 248 total cpu time spent up to now is 278.3 secs Computing kpt #: 249 total cpu time spent up to now is 279.3 secs Computing kpt #: 250 total cpu time spent up to now is 280.4 secs Computing kpt #: 251 total cpu time spent up to now is 281.4 secs Computing kpt #: 252 total cpu time spent up to now is 282.4 secs Computing kpt #: 253 total cpu time spent up to now is 283.5 secs Computing kpt #: 254 total cpu time spent up to now is 284.6 secs Computing kpt #: 255 total cpu time spent up to now is 285.6 secs Computing kpt #: 256 total cpu time spent up to now is 286.6 secs Computing kpt #: 257 total cpu time spent up to now is 287.7 secs Computing kpt #: 258 total cpu time spent up to now is 288.8 secs Computing kpt #: 259 total cpu time spent up to now is 289.8 secs Computing kpt #: 260 total cpu time spent up to now is 290.9 secs Computing kpt #: 261 total cpu time spent up to now is 292.0 secs Computing kpt #: 262 total cpu time spent up to now is 293.1 secs Computing kpt #: 263 total cpu time spent up to now is 294.1 secs Computing kpt #: 264 total cpu time spent up to now is 295.2 secs Computing kpt #: 265 total cpu time spent up to now is 296.1 secs Computing kpt #: 266 total cpu time spent up to now is 297.1 secs Computing kpt #: 267 total cpu time spent up to now is 298.1 secs Computing kpt #: 268 total cpu time spent up to now is 299.0 secs Computing kpt #: 269 total cpu time spent up to now is 300.0 secs Computing kpt #: 270 total cpu time spent up to now is 301.0 secs Computing kpt #: 271 total cpu time spent up to now is 302.0 secs Computing kpt #: 272 total cpu time spent up to now is 303.0 secs Computing kpt #: 273 total cpu time spent up to now is 304.0 secs Computing kpt #: 274 total cpu time spent up to now is 305.1 secs Computing kpt #: 275 total cpu time spent up to now is 306.1 secs Computing kpt #: 276 total cpu time spent up to now is 307.1 secs Computing kpt #: 277 total cpu time spent up to now is 308.2 secs Computing kpt #: 278 total cpu time spent up to now is 309.2 secs Computing kpt #: 279 total cpu time spent up to now is 310.2 secs Computing kpt #: 280 total cpu time spent up to now is 311.2 secs Computing kpt #: 281 total cpu time spent up to now is 312.3 secs Computing kpt #: 282 total cpu time spent up to now is 313.3 secs Computing kpt #: 283 total cpu time spent up to now is 314.3 secs Computing kpt #: 284 total cpu time spent up to now is 315.3 secs Computing kpt #: 285 total cpu time spent up to now is 316.4 secs Computing kpt #: 286 total cpu time spent up to now is 317.5 secs Computing kpt #: 287 total cpu time spent up to now is 318.6 secs Computing kpt #: 288 total cpu time spent up to now is 319.6 secs Computing kpt #: 289 total cpu time spent up to now is 320.6 secs Computing kpt #: 290 total cpu time spent up to now is 321.7 secs Computing kpt #: 291 total cpu time spent up to now is 322.7 secs Computing kpt #: 292 total cpu time spent up to now is 323.7 secs Computing kpt #: 293 total cpu time spent up to now is 324.8 secs Computing kpt #: 294 total cpu time spent up to now is 325.8 secs Computing kpt #: 295 total cpu time spent up to now is 326.8 secs Computing kpt #: 296 total cpu time spent up to now is 327.8 secs Computing kpt #: 297 total cpu time spent up to now is 328.8 secs Computing kpt #: 298 total cpu time spent up to now is 329.8 secs Computing kpt #: 299 total cpu time spent up to now is 330.9 secs Computing kpt #: 300 total cpu time spent up to now is 331.9 secs Computing kpt #: 301 total cpu time spent up to now is 332.9 secs Computing kpt #: 302 total cpu time spent up to now is 333.9 secs Computing kpt #: 303 total cpu time spent up to now is 335.0 secs Computing kpt #: 304 total cpu time spent up to now is 336.1 secs Computing kpt #: 305 total cpu time spent up to now is 337.1 secs Computing kpt #: 306 total cpu time spent up to now is 338.1 secs Computing kpt #: 307 total cpu time spent up to now is 339.1 secs Computing kpt #: 308 total cpu time spent up to now is 340.0 secs Computing kpt #: 309 total cpu time spent up to now is 341.0 secs Computing kpt #: 310 total cpu time spent up to now is 342.0 secs Computing kpt #: 311 total cpu time spent up to now is 342.9 secs Computing kpt #: 312 total cpu time spent up to now is 343.9 secs Computing kpt #: 313 total cpu time spent up to now is 344.8 secs Computing kpt #: 314 total cpu time spent up to now is 345.8 secs Computing kpt #: 315 total cpu time spent up to now is 346.7 secs Computing kpt #: 316 total cpu time spent up to now is 347.7 secs Computing kpt #: 317 total cpu time spent up to now is 348.6 secs Computing kpt #: 318 total cpu time spent up to now is 349.6 secs Computing kpt #: 319 total cpu time spent up to now is 350.5 secs Computing kpt #: 320 total cpu time spent up to now is 351.5 secs ethr = 1.47E-08, avg # of iterations = 19.2 total cpu time spent up to now is 351.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 6601 PWs) bands (ev): -18.8485 -18.8485 -18.6372 -18.6372 -15.0288 -15.0288 -14.9142 -14.9142 -5.2686 -5.2686 -5.2119 -5.2119 -3.4964 -3.4964 -3.3542 -3.3542 -3.3227 -3.3227 -3.0869 -3.0869 -2.1214 -2.1214 -1.0848 -1.0848 1.3418 1.3418 1.3590 1.3590 1.4262 1.4262 1.4784 1.4784 1.7233 1.7233 1.8423 1.8423 1.8897 1.8897 1.9625 1.9625 2.0766 2.0766 2.2539 2.2539 3.0272 3.0272 3.0315 3.0315 3.1059 3.1059 3.2001 3.2001 3.9441 3.9441 4.0010 4.0010 4.9153 4.9153 6.3174 6.3174 6.3264 6.3264 7.9718 7.9718 8.4867 8.4867 8.5404 8.5404 8.9564 8.9564 10.1350 10.1350 10.8874 10.8874 10.9327 10.9327 12.1889 12.1889 12.8900 12.8900 13.5367 13.5367 k = 0.0000 0.0132-0.0000 ( 6601 PWs) bands (ev): -18.8483 -18.8483 -18.6372 -18.6372 -15.0289 -15.0289 -14.9144 -14.9144 -5.2694 -5.2694 -5.2114 -5.2114 -3.4972 -3.4972 -3.3563 -3.3563 -3.3202 -3.3202 -3.0870 -3.0870 -2.1209 -2.1209 -1.0847 -1.0847 1.3416 1.3416 1.3594 1.3594 1.4263 1.4263 1.4787 1.4787 1.7229 1.7229 1.8428 1.8428 1.8900 1.8900 1.9624 1.9624 2.0765 2.0765 2.2534 2.2534 3.0274 3.0274 3.0321 3.0321 3.1061 3.1061 3.2010 3.2010 3.9436 3.9436 4.0005 4.0005 4.9160 4.9160 6.3100 6.3100 6.3247 6.3247 7.9723 7.9723 8.4818 8.4818 8.5359 8.5359 8.9653 8.9653 10.1394 10.1394 10.8929 10.8929 10.9395 10.9395 12.1879 12.1879 12.8906 12.8906 13.5193 13.5193 k = 0.0000 0.0263-0.0000 ( 6589 PWs) bands (ev): -18.8476 -18.8476 -18.6371 -18.6371 -15.0292 -15.0292 -14.9150 -14.9150 -5.2718 -5.2718 -5.2100 -5.2100 -3.4998 -3.4998 -3.3611 -3.3611 -3.3140 -3.3140 -3.0874 -3.0874 -2.1197 -2.1197 -1.0842 -1.0842 1.3413 1.3413 1.3605 1.3605 1.4264 1.4264 1.4796 1.4796 1.7220 1.7220 1.8443 1.8443 1.8909 1.8909 1.9622 1.9622 2.0762 2.0762 2.2519 2.2519 3.0279 3.0279 3.0337 3.0337 3.1066 3.1066 3.2035 3.2035 3.9422 3.9422 3.9989 3.9989 4.9182 4.9182 6.2808 6.2808 6.3273 6.3273 7.9739 7.9739 8.4642 8.4642 8.5260 8.5260 8.9917 8.9917 10.1525 10.1525 10.9051 10.9051 10.9639 10.9639 12.1845 12.1845 12.8923 12.8923 13.4800 13.4800 k = 0.0000 0.0395-0.0000 ( 6589 PWs) bands (ev): -18.8466 -18.8466 -18.6368 -18.6368 -15.0296 -15.0296 -14.9161 -14.9161 -5.2755 -5.2755 -5.2079 -5.2079 -3.5041 -3.5041 -3.3665 -3.3665 -3.3062 -3.3062 -3.0880 -3.0880 -2.1176 -2.1176 -1.0834 -1.0834 1.3409 1.3409 1.3621 1.3621 1.4267 1.4267 1.4809 1.4809 1.7204 1.7204 1.8464 1.8464 1.8926 1.8926 1.9617 1.9617 2.0757 2.0757 2.2494 2.2494 3.0287 3.0287 3.0363 3.0363 3.1075 3.1075 3.2076 3.2076 3.9399 3.9399 3.9964 3.9964 4.9218 4.9218 6.2323 6.2323 6.3334 6.3334 7.9763 7.9763 8.4293 8.4293 8.5167 8.5167 9.0335 9.0335 10.1747 10.1747 10.9179 10.9179 11.0103 11.0103 12.1783 12.1783 12.8952 12.8952 13.4349 13.4349 k = 0.0000 0.0526-0.0000 ( 6577 PWs) bands (ev): -18.8451 -18.8451 -18.6365 -18.6365 -15.0302 -15.0302 -14.9175 -14.9175 -5.2801 -5.2801 -5.2055 -5.2055 -3.5100 -3.5100 -3.3716 -3.3716 -3.2979 -3.2979 -3.0889 -3.0889 -2.1147 -2.1147 -1.0823 -1.0823 1.3405 1.3405 1.3644 1.3644 1.4270 1.4270 1.4828 1.4828 1.7186 1.7186 1.8488 1.8488 1.8952 1.8952 1.9612 1.9612 2.0751 2.0751 2.2460 2.2460 3.0299 3.0299 3.0400 3.0400 3.1089 3.1089 3.2132 3.2132 3.9367 3.9367 3.9929 3.9929 4.9266 4.9266 6.1675 6.1675 6.3420 6.3420 7.9792 7.9792 8.3780 8.3780 8.5091 8.5091 9.0883 9.0883 10.2065 10.2065 10.9314 10.9314 11.0764 11.0764 12.1684 12.1684 12.8991 12.8991 13.3920 13.3920 k = 0.0000 0.0658-0.0000 ( 6573 PWs) bands (ev): -18.8432 -18.8432 -18.6361 -18.6361 -15.0309 -15.0309 -14.9193 -14.9193 -5.2855 -5.2855 -5.2029 -5.2029 -3.5174 -3.5174 -3.3760 -3.3760 -3.2896 -3.2896 -3.0902 -3.0902 -2.1108 -2.1108 -1.0810 -1.0810 1.3402 1.3402 1.3670 1.3670 1.4275 1.4275 1.4852 1.4852 1.7164 1.7164 1.8511 1.8511 1.8989 1.8989 1.9604 1.9604 2.0744 2.0744 2.2416 2.2416 3.0315 3.0315 3.0447 3.0447 3.1108 3.1108 3.2201 3.2201 3.9326 3.9326 3.9885 3.9885 4.9324 4.9324 6.0894 6.0894 6.3531 6.3531 7.9824 7.9824 8.3142 8.3142 8.5020 8.5020 9.1526 9.1526 10.2487 10.2487 10.9464 10.9464 11.1584 11.1584 12.1538 12.1538 12.9040 12.9040 13.3554 13.3554 k = 0.0000 0.0789-0.0000 ( 6573 PWs) bands (ev): -18.8409 -18.8409 -18.6357 -18.6357 -15.0318 -15.0318 -14.9215 -14.9215 -5.2915 -5.2915 -5.2005 -5.2005 -3.5261 -3.5261 -3.3795 -3.3795 -3.2816 -3.2816 -3.0917 -3.0917 -2.1059 -2.1059 -1.0795 -1.0795 1.3400 1.3400 1.3699 1.3699 1.4282 1.4282 1.4879 1.4879 1.7141 1.7141 1.8530 1.8530 1.9038 1.9038 1.9594 1.9594 2.0736 2.0736 2.2363 2.2363 3.0334 3.0334 3.0503 3.0503 3.1133 3.1133 3.2281 3.2281 3.9277 3.9277 3.9832 3.9832 4.9390 4.9390 6.0005 6.0005 6.3667 6.3667 7.9856 7.9856 8.2413 8.2413 8.4945 8.4945 9.2231 9.2231 10.3020 10.3020 10.9633 10.9633 11.2532 11.2532 12.1333 12.1333 12.9098 12.9098 13.3281 13.3281 k = 0.0000 0.0921-0.0000 ( 6577 PWs) bands (ev): -18.8382 -18.8382 -18.6352 -18.6352 -15.0329 -15.0329 -14.9240 -14.9240 -5.2978 -5.2978 -5.1982 -5.1982 -3.5359 -3.5359 -3.3822 -3.3822 -3.2740 -3.2740 -3.0936 -3.0936 -2.0999 -2.0999 -1.0777 -1.0777 1.3400 1.3400 1.3731 1.3731 1.4290 1.4290 1.4911 1.4911 1.7118 1.7118 1.8542 1.8542 1.9099 1.9099 1.9583 1.9583 2.0728 2.0728 2.2302 2.2302 3.0359 3.0359 3.0567 3.0567 3.1163 3.1163 3.2371 3.2371 3.9220 3.9220 3.9773 3.9773 4.9461 4.9461 5.9034 5.9034 6.3826 6.3826 7.9887 7.9887 8.1619 8.1619 8.4862 8.4862 9.2966 9.2966 10.3670 10.3670 10.9819 10.9819 11.3582 11.3582 12.1061 12.1061 12.9165 12.9165 13.3118 13.3118 k = 0.0000 0.1053-0.0000 ( 6567 PWs) bands (ev): -18.8351 -18.8351 -18.6346 -18.6346 -15.0341 -15.0341 -14.9269 -14.9269 -5.3043 -5.3043 -5.1963 -5.1963 -3.5465 -3.5465 -3.3841 -3.3841 -3.2670 -3.2670 -3.0959 -3.0959 -2.0929 -2.0929 -1.0757 -1.0757 1.3404 1.3404 1.3766 1.3766 1.4301 1.4301 1.4946 1.4946 1.7097 1.7097 1.8548 1.8548 1.9169 1.9169 1.9570 1.9570 2.0722 2.0722 2.2233 2.2233 3.0388 3.0388 3.0640 3.0640 3.1200 3.1200 3.2468 3.2468 3.9156 3.9156 3.9707 3.9707 4.9533 4.9533 5.8002 5.8002 6.4008 6.4008 7.9910 7.9910 8.0788 8.0788 8.4769 8.4769 9.3703 9.3703 10.4440 10.4440 11.0018 11.0018 11.4712 11.4712 12.0718 12.0718 12.9240 12.9240 13.3080 13.3080 k = 0.0000 0.1184-0.0000 ( 6565 PWs) bands (ev): -18.8317 -18.8317 -18.6339 -18.6339 -15.0354 -15.0354 -14.9302 -14.9302 -5.3110 -5.3110 -5.1949 -5.1949 -3.5576 -3.5576 -3.3853 -3.3853 -3.2607 -3.2607 -3.0987 -3.0987 -2.0846 -2.0846 -1.0737 -1.0737 1.3411 1.3411 1.3804 1.3804 1.4314 1.4314 1.4983 1.4983 1.7078 1.7078 1.8548 1.8548 1.9245 1.9245 1.9556 1.9556 2.0719 2.0719 2.2156 2.2156 3.0423 3.0423 3.0719 3.0719 3.1243 3.1243 3.2572 3.2572 3.9083 3.9083 3.9637 3.9637 4.9601 4.9601 5.6930 5.6930 6.4213 6.4213 7.9815 7.9815 8.0050 8.0050 8.4664 8.4664 9.4422 9.4422 10.5329 10.5329 11.0225 11.0225 11.5901 11.5901 12.0305 12.0305 12.9322 12.9322 13.2615 13.2615 k = 0.0000 0.1316-0.0000 ( 6557 PWs) bands (ev): -18.8279 -18.8279 -18.6333 -18.6333 -15.0368 -15.0368 -14.9337 -14.9337 -5.3177 -5.3177 -5.1939 -5.1939 -3.5691 -3.5691 -3.3861 -3.3861 -3.2552 -3.2552 -3.1019 -3.1019 -2.0750 -2.0750 -1.0716 -1.0716 1.3421 1.3421 1.3845 1.3845 1.4329 1.4329 1.5024 1.5024 1.7062 1.7062 1.8543 1.8543 1.9322 1.9322 1.9541 1.9541 2.0721 2.0721 2.2073 2.2073 3.0462 3.0462 3.0805 3.0805 3.1293 3.1293 3.2679 3.2679 3.9002 3.9002 3.9562 3.9562 4.9663 4.9663 5.5833 5.5833 6.4439 6.4439 7.9028 7.9028 7.9995 7.9995 8.4547 8.4547 9.5111 9.5111 10.6329 10.6329 11.0433 11.0433 11.7132 11.7132 11.9831 11.9831 12.9409 12.9409 13.1888 13.1888 k = 0.0000 0.1447-0.0000 ( 6561 PWs) bands (ev): -18.8237 -18.8237 -18.6326 -18.6326 -15.0384 -15.0384 -14.9376 -14.9376 -5.3244 -5.3244 -5.1934 -5.1934 -3.5807 -3.5807 -3.3864 -3.3864 -3.2504 -3.2504 -3.1056 -3.1056 -2.0640 -2.0640 -1.0695 -1.0695 1.3434 1.3434 1.3887 1.3887 1.4346 1.4346 1.5066 1.5066 1.7050 1.7050 1.8534 1.8534 1.9395 1.9395 1.9524 1.9524 2.0730 2.0730 2.1985 2.1985 3.0508 3.0508 3.0897 3.0897 3.1350 3.1350 3.2787 3.2787 3.8913 3.8913 3.9486 3.9486 4.9713 4.9713 5.4724 5.4724 6.4687 6.4687 7.8173 7.8173 8.0010 8.0010 8.4418 8.4418 9.5763 9.5763 10.7425 10.7425 11.0636 11.0636 11.8389 11.8389 11.9310 11.9310 12.9500 12.9500 13.1169 13.1169 k = 0.0000 0.1579-0.0000 ( 6553 PWs) bands (ev): -18.8193 -18.8193 -18.6319 -18.6319 -15.0400 -15.0400 -14.9417 -14.9417 -5.3309 -5.3309 -5.1934 -5.1934 -3.5923 -3.5923 -3.3864 -3.3864 -3.2465 -3.2465 -3.1098 -3.1098 -2.0516 -2.0516 -1.0674 -1.0674 1.3450 1.3450 1.3932 1.3932 1.4365 1.4365 1.5110 1.5110 1.7042 1.7042 1.8523 1.8523 1.9460 1.9460 1.9507 1.9507 2.0749 2.0749 2.1893 2.1893 3.0559 3.0559 3.0993 3.0993 3.1413 3.1413 3.2896 3.2896 3.8815 3.8815 3.9410 3.9410 4.9746 4.9746 5.3618 5.3618 6.4955 6.4955 7.7335 7.7335 8.0026 8.0026 8.4276 8.4276 9.6378 9.6378 10.8592 10.8592 11.0827 11.0827 11.8762 11.8762 11.9658 11.9658 12.9590 12.9590 13.0465 13.0465 k = 0.0000 0.1711-0.0000 ( 6554 PWs) bands (ev): -18.8145 -18.8145 -18.6313 -18.6313 -15.0417 -15.0417 -14.9461 -14.9461 -5.3373 -5.3373 -5.1941 -5.1941 -3.6035 -3.6035 -3.3862 -3.3862 -3.2434 -3.2434 -3.1145 -3.1145 -2.0377 -2.0377 -1.0655 -1.0655 1.3471 1.3471 1.3979 1.3979 1.4387 1.4387 1.5155 1.5155 1.7038 1.7038 1.8508 1.8508 1.9481 1.9481 1.9519 1.9519 2.0780 2.0780 2.1799 2.1799 3.0615 3.0615 3.1092 3.1092 3.1482 3.1482 3.3003 3.3003 3.8708 3.8708 3.9335 3.9335 4.9757 4.9757 5.2523 5.2523 6.5243 6.5243 7.6526 7.6526 8.0036 8.0036 8.4121 8.4121 9.6960 9.6960 10.9790 10.9790 11.1007 11.1007 11.8216 11.8216 12.0923 12.0923 12.9659 12.9659 12.9794 12.9794 k = 0.0000 0.1842-0.0000 ( 6560 PWs) bands (ev): -18.8094 -18.8094 -18.6306 -18.6306 -15.0435 -15.0435 -14.9508 -14.9508 -5.3435 -5.3435 -5.1953 -5.1953 -3.6144 -3.6144 -3.3860 -3.3860 -3.2412 -3.2412 -3.1196 -3.1196 -2.0222 -2.0222 -1.0638 -1.0638 1.3495 1.3495 1.4028 1.4028 1.4412 1.4412 1.5201 1.5201 1.7039 1.7039 1.8491 1.8491 1.9461 1.9461 1.9553 1.9553 2.0820 2.0820 2.1705 2.1705 3.0678 3.0678 3.1195 3.1195 3.1558 3.1558 3.3105 3.3105 3.8592 3.8592 3.9262 3.9262 4.9740 4.9740 5.1451 5.1451 6.5549 6.5549 7.5758 7.5758 8.0041 8.0041 8.3952 8.3952 9.7515 9.7515 11.0848 11.0848 11.1289 11.1289 11.7718 11.7718 12.2168 12.2168 12.9106 12.9106 12.9748 12.9748 k = 0.0000 0.1974-0.0000 ( 6572 PWs) bands (ev): -18.8041 -18.8041 -18.6300 -18.6300 -15.0454 -15.0454 -14.9556 -14.9556 -5.3494 -5.3494 -5.1972 -5.1972 -3.6248 -3.6248 -3.3858 -3.3858 -3.2399 -3.2399 -3.1252 -3.1252 -2.0052 -2.0052 -1.0625 -1.0625 1.3524 1.3524 1.4079 1.4079 1.4438 1.4438 1.5247 1.5247 1.7045 1.7045 1.8473 1.8473 1.9438 1.9438 1.9572 1.9572 2.0867 2.0867 2.1617 2.1617 3.0746 3.0746 3.1299 3.1299 3.1639 3.1639 3.3202 3.3202 3.8466 3.8466 3.9191 3.9191 4.9683 4.9683 5.0416 5.0416 6.5873 6.5873 7.5040 7.5040 8.0038 8.0038 8.3770 8.3770 9.8048 9.8048 11.1138 11.1138 11.2199 11.2199 11.7356 11.7356 12.3378 12.3378 12.8467 12.8467 12.9773 12.9773 k = 0.0000 0.2105-0.0000 ( 6574 PWs) bands (ev): -18.7985 -18.7985 -18.6295 -18.6295 -15.0472 -15.0472 -14.9606 -14.9606 -5.3550 -5.3550 -5.1996 -5.1996 -3.6344 -3.6344 -3.3858 -3.3858 -3.2394 -3.2394 -3.1311 -3.1311 -1.9865 -1.9865 -1.0615 -1.0615 1.3556 1.3556 1.4132 1.4132 1.4467 1.4467 1.5294 1.5294 1.7057 1.7057 1.8454 1.8454 1.9414 1.9414 1.9572 1.9572 2.0908 2.0908 2.1545 2.1545 3.0819 3.0819 3.1405 3.1405 3.1725 3.1725 3.3290 3.3290 3.8331 3.8331 3.9124 3.9124 4.9339 4.9339 4.9671 4.9671 6.6213 6.6213 7.4379 7.4379 8.0026 8.0026 8.3574 8.3574 9.8564 9.8564 11.1203 11.1203 11.3013 11.3013 11.7304 11.7304 12.4536 12.4536 12.7855 12.7855 12.9732 12.9732 k = 0.0000 0.2237-0.0000 ( 6584 PWs) bands (ev): -18.7928 -18.7928 -18.6290 -18.6290 -15.0491 -15.0491 -14.9658 -14.9658 -5.3602 -5.3602 -5.2026 -5.2026 -3.6434 -3.6434 -3.3860 -3.3860 -3.2397 -3.2397 -3.1372 -3.1372 -1.9663 -1.9663 -1.0610 -1.0610 1.3592 1.3592 1.4187 1.4187 1.4499 1.4499 1.5341 1.5341 1.7074 1.7074 1.8434 1.8434 1.9389 1.9389 1.9556 1.9556 2.0925 2.0925 2.1503 2.1503 3.0898 3.0898 3.1512 3.1512 3.1815 3.1815 3.3369 3.3369 3.8188 3.8188 3.9061 3.9061 4.8410 4.8410 4.9514 4.9514 6.6570 6.6570 7.3783 7.3783 8.0003 8.0003 8.3364 8.3364 9.9067 9.9067 11.1202 11.1202 11.3354 11.3354 11.7770 11.7770 12.5626 12.5626 12.7274 12.7274 12.9605 12.9605 k = 0.0000 0.2368-0.0000 ( 6580 PWs) bands (ev): -18.7868 -18.7868 -18.6287 -18.6287 -15.0510 -15.0510 -14.9710 -14.9710 -5.3650 -5.3650 -5.2063 -5.2063 -3.6515 -3.6515 -3.3866 -3.3866 -3.2409 -3.2409 -3.1435 -3.1435 -1.9444 -1.9444 -1.0612 -1.0612 1.3634 1.3634 1.4245 1.4245 1.4533 1.4533 1.5387 1.5387 1.7098 1.7098 1.8414 1.8414 1.9362 1.9362 1.9526 1.9526 2.0903 2.0903 2.1503 2.1503 3.0982 3.0982 3.1620 3.1620 3.1909 3.1909 3.3437 3.3437 3.8037 3.8037 3.9000 3.9000 4.7502 4.7502 4.9345 4.9345 6.6941 6.6941 7.3256 7.3256 7.9969 7.9969 8.3140 8.3140 9.9561 9.9561 11.1145 11.1145 11.3244 11.3244 11.8719 11.8719 12.6611 12.6611 12.6745 12.6745 12.9391 12.9391 k = 0.0000 0.2500-0.0000 ( 6578 PWs) bands (ev): -18.7806 -18.7806 -18.6284 -18.6284 -15.0529 -15.0529 -14.9764 -14.9764 -5.3694 -5.3694 -5.2104 -5.2104 -3.6587 -3.6587 -3.3877 -3.3877 -3.2427 -3.2427 -3.1497 -3.1497 -1.9211 -1.9211 -1.0620 -1.0620 1.3679 1.3679 1.4304 1.4304 1.4569 1.4569 1.5433 1.5433 1.7127 1.7127 1.8394 1.8394 1.9334 1.9334 1.9485 1.9485 2.0842 2.0842 2.1542 2.1542 3.1071 3.1071 3.1729 3.1729 3.2006 3.2006 3.3493 3.3493 3.7878 3.7878 3.8942 3.8942 4.6648 4.6648 4.9134 4.9134 6.7327 6.7327 7.2804 7.2804 7.9920 7.9920 8.2902 8.2902 10.0046 10.0046 11.1034 11.1034 11.2896 11.2896 11.9934 11.9934 12.6207 12.6207 12.7523 12.7523 12.9129 12.9129 k = 0.0000 0.2632-0.0000 ( 6578 PWs) bands (ev): -18.7743 -18.7743 -18.6283 -18.6283 -15.0547 -15.0547 -14.9818 -14.9818 -5.3733 -5.3733 -5.2152 -5.2152 -3.6648 -3.6648 -3.3896 -3.3896 -3.2451 -3.2451 -3.1559 -3.1559 -1.8962 -1.8962 -1.0637 -1.0637 1.3729 1.3729 1.4364 1.4364 1.4607 1.4607 1.5479 1.5479 1.7162 1.7162 1.8374 1.8374 1.9305 1.9305 1.9434 1.9434 2.0754 2.0754 2.1602 2.1602 3.1165 3.1165 3.1839 3.1839 3.2104 3.2104 3.3536 3.3536 3.7713 3.7713 3.8885 3.8885 4.5855 4.5855 4.8879 4.8879 6.7725 6.7725 7.2427 7.2427 7.9856 7.9856 8.2650 8.2650 10.0523 10.0523 11.0872 11.0872 11.2458 11.2458 12.1263 12.1263 12.5733 12.5733 12.8075 12.8075 12.9054 12.9054 k = 0.0000 0.2763-0.0000 ( 6576 PWs) bands (ev): -18.7679 -18.7679 -18.6283 -18.6283 -15.0565 -15.0565 -14.9873 -14.9873 -5.3766 -5.3766 -5.2204 -5.2204 -3.6700 -3.6700 -3.3923 -3.3923 -3.2480 -3.2480 -3.1619 -3.1619 -1.8699 -1.8699 -1.0663 -1.0663 1.3782 1.3782 1.4426 1.4426 1.4647 1.4647 1.5523 1.5523 1.7202 1.7202 1.8355 1.8355 1.9275 1.9275 1.9376 1.9376 2.0650 2.0650 2.1667 2.1667 3.1264 3.1264 3.1949 3.1949 3.2202 3.2202 3.3569 3.3569 3.7542 3.7542 3.8829 3.8829 4.5129 4.5129 4.8578 4.8578 6.8135 6.8135 7.2128 7.2128 7.9775 7.9775 8.2383 8.2383 10.0993 10.0993 11.0664 11.0664 11.2003 11.2003 12.2623 12.2623 12.5308 12.5308 12.7895 12.7895 12.9585 12.9585 k = 0.0000 0.2895-0.0000 ( 6576 PWs) bands (ev): -18.7614 -18.7614 -18.6285 -18.6285 -15.0582 -15.0582 -14.9927 -14.9927 -5.3795 -5.3795 -5.2262 -5.2262 -3.6741 -3.6741 -3.3961 -3.3961 -3.2510 -3.2510 -3.1677 -3.1677 -1.8422 -1.8422 -1.0699 -1.0699 1.3839 1.3839 1.4489 1.4489 1.4688 1.4688 1.5567 1.5567 1.7248 1.7248 1.8337 1.8337 1.9245 1.9245 1.9313 1.9313 2.0538 2.0538 2.1725 2.1725 3.1366 3.1366 3.2060 3.2060 3.2301 3.2301 3.3591 3.3591 3.7366 3.7366 3.8774 3.8774 4.4474 4.4474 4.8235 4.8235 6.8556 6.8556 7.1906 7.1906 7.9675 7.9675 8.2103 8.2103 10.1452 10.1452 11.0416 11.0416 11.1568 11.1568 12.3917 12.3917 12.4997 12.4997 12.7412 12.7412 13.0314 13.0314 k = 0.0000 0.3026-0.0000 ( 6580 PWs) bands (ev): -18.7548 -18.7548 -18.6289 -18.6289 -15.0598 -15.0598 -14.9981 -14.9981 -5.3817 -5.3817 -5.2324 -5.2324 -3.6770 -3.6770 -3.4012 -3.4012 -3.2540 -3.2540 -3.1732 -3.1732 -1.8133 -1.8133 -1.0747 -1.0747 1.3900 1.3900 1.4553 1.4553 1.4731 1.4731 1.5609 1.5609 1.7300 1.7300 1.8320 1.8320 1.9213 1.9213 1.9246 1.9246 2.0423 2.0423 2.1767 2.1767 3.1472 3.1472 3.2168 3.2168 3.2400 3.2400 3.3608 3.3608 3.7185 3.7185 3.8717 3.8717 4.3891 4.3891 4.7852 4.7852 6.8986 6.8986 7.1758 7.1758 7.9554 7.9554 8.1809 8.1809 10.1897 10.1897 11.0134 11.0134 11.1174 11.1174 12.4349 12.4349 12.5574 12.5574 12.6832 12.6832 13.1049 13.1049 k = 0.0000 0.3158-0.0000 ( 6570 PWs) bands (ev): -18.7481 -18.7481 -18.6295 -18.6295 -15.0612 -15.0612 -15.0035 -15.0035 -5.3834 -5.3834 -5.2389 -5.2389 -3.6788 -3.6788 -3.4076 -3.4076 -3.2567 -3.2567 -3.1784 -3.1784 -1.7833 -1.7833 -1.0807 -1.0807 1.3964 1.3964 1.4618 1.4618 1.4775 1.4775 1.5650 1.5650 1.7358 1.7358 1.8304 1.8304 1.9173 1.9173 1.9186 1.9186 2.0306 2.0306 2.1788 2.1788 3.1582 3.1582 3.2274 3.2274 3.2501 3.2501 3.3623 3.3623 3.7001 3.7001 3.8657 3.8657 4.3381 4.3381 4.7434 4.7434 6.9425 6.9425 7.1682 7.1682 7.9413 7.9413 8.1501 8.1501 10.2325 10.2325 10.9825 10.9825 11.0840 11.0840 12.4094 12.4094 12.6191 12.6191 12.6853 12.6853 13.1353 13.1353 k = 0.0000 0.3289-0.0000 ( 6570 PWs) bands (ev): -18.7415 -18.7415 -18.6303 -18.6303 -15.0625 -15.0625 -15.0088 -15.0088 -5.3845 -5.3845 -5.2459 -5.2459 -3.6794 -3.6794 -3.4154 -3.4154 -3.2590 -3.2590 -3.1834 -3.1834 -1.7523 -1.7523 -1.0881 -1.0881 1.4030 1.4030 1.4683 1.4683 1.4819 1.4819 1.5690 1.5690 1.7421 1.7421 1.8290 1.8290 1.9106 1.9106 1.9152 1.9152 2.0188 2.0188 2.1783 2.1783 3.1694 3.1694 3.2374 3.2374 3.2602 3.2602 3.3644 3.3644 3.6814 3.6814 3.8594 3.8594 4.2943 4.2943 4.6987 4.6987 6.9871 6.9871 7.1674 7.1674 7.9249 7.9249 8.1180 8.1180 10.2727 10.2727 10.9496 10.9496 11.0579 11.0579 12.3823 12.3823 12.5506 12.5506 12.8150 12.8150 13.0745 13.0745 k = 0.0000 0.3421-0.0000 ( 6566 PWs) bands (ev): -18.7349 -18.7349 -18.6313 -18.6313 -15.0637 -15.0637 -15.0139 -15.0139 -5.3849 -5.3849 -5.2532 -5.2532 -3.6788 -3.6788 -3.4247 -3.4247 -3.2606 -3.2606 -3.1881 -3.1881 -1.7204 -1.7204 -1.0969 -1.0969 1.4099 1.4099 1.4748 1.4748 1.4864 1.4864 1.5728 1.5728 1.7490 1.7490 1.8278 1.8278 1.9038 1.9038 1.9120 1.9120 2.0071 2.0071 2.1747 2.1747 3.1808 3.1808 3.2466 3.2466 3.2707 3.2707 3.3677 3.3677 3.6625 3.6625 3.8524 3.8524 4.2572 4.2572 4.6517 4.6517 7.0323 7.0323 7.1729 7.1729 7.9061 7.9061 8.0846 8.0846 10.3099 10.3099 10.9152 10.9152 11.0404 11.0404 12.3579 12.3579 12.4786 12.4786 12.9410 12.9410 13.0103 13.0103 k = 0.0000 0.3553-0.0000 ( 6576 PWs) bands (ev): -18.7283 -18.7283 -18.6326 -18.6326 -15.0647 -15.0647 -15.0190 -15.0190 -5.3848 -5.3848 -5.2607 -5.2607 -3.6771 -3.6771 -3.4352 -3.4352 -3.2615 -3.2615 -3.1927 -3.1927 -1.6878 -1.6878 -1.1073 -1.1073 1.4169 1.4169 1.4810 1.4810 1.4910 1.4910 1.5764 1.5764 1.7563 1.7563 1.8266 1.8266 1.8973 1.8973 1.9089 1.9089 1.9957 1.9957 2.1680 2.1680 3.1922 3.1922 3.2548 3.2548 3.2815 3.2815 3.3731 3.3731 3.6435 3.6435 3.8446 3.8446 4.2265 4.2265 4.6032 4.6032 7.0779 7.0779 7.1841 7.1841 7.8850 7.8850 8.0499 8.0499 10.3432 10.3432 10.8799 10.8799 11.0326 11.0326 12.3360 12.3360 12.4050 12.4050 12.9461 12.9461 13.0619 13.0619 k = 0.0000 0.3684-0.0000 ( 6570 PWs) bands (ev): -18.7218 -18.7218 -18.6342 -18.6342 -15.0655 -15.0655 -15.0238 -15.0238 -5.3840 -5.3840 -5.2684 -5.2684 -3.6741 -3.6741 -3.4470 -3.4470 -3.2617 -3.2617 -3.1972 -3.1972 -1.6547 -1.6547 -1.1192 -1.1192 1.4240 1.4240 1.4865 1.4865 1.4963 1.4963 1.5798 1.5798 1.7643 1.7643 1.8256 1.8256 1.8914 1.8914 1.9060 1.9060 1.9845 1.9845 2.1581 2.1581 3.2035 3.2035 3.2619 3.2619 3.2925 3.2925 3.3812 3.3812 3.6245 3.6245 3.8357 3.8357 4.2017 4.2017 4.5540 4.5540 7.1237 7.1237 7.2008 7.2008 7.8615 7.8615 8.0139 8.0139 10.3723 10.3723 10.8443 10.8443 11.0354 11.0354 12.3064 12.3064 12.3409 12.3409 12.8831 12.8831 13.1763 13.1763 k = 0.0000 0.3816-0.0000 ( 6562 PWs) bands (ev): -18.7153 -18.7153 -18.6360 -18.6360 -15.0660 -15.0660 -15.0285 -15.0285 -5.3826 -5.3826 -5.2762 -5.2762 -3.6700 -3.6700 -3.4597 -3.4597 -3.2613 -3.2613 -3.2016 -3.2016 -1.6212 -1.6212 -1.1328 -1.1328 1.4311 1.4311 1.4906 1.4906 1.5025 1.5025 1.5829 1.5829 1.7727 1.7727 1.8248 1.8248 1.8862 1.8862 1.9034 1.9034 1.9736 1.9736 2.1450 2.1450 3.2145 3.2145 3.2680 3.2680 3.3038 3.3038 3.3927 3.3927 3.6056 3.6056 3.8255 3.8255 4.1821 4.1821 4.5048 4.5048 7.1693 7.1693 7.2226 7.2226 7.8356 7.8356 7.9768 7.9768 10.3969 10.3969 10.8087 10.8087 11.0489 11.0489 12.2387 12.2387 12.3175 12.3175 12.8217 12.8217 13.2833 13.2833 k = 0.0000 0.3947-0.0000 ( 6568 PWs) bands (ev): -18.7090 -18.7090 -18.6380 -18.6380 -15.0664 -15.0664 -15.0329 -15.0329 -5.3806 -5.3806 -5.2842 -5.2842 -3.6648 -3.6648 -3.4732 -3.4732 -3.2602 -3.2602 -3.2058 -3.2058 -1.5874 -1.5874 -1.1481 -1.1481 1.4381 1.4381 1.4934 1.4934 1.5096 1.5096 1.5855 1.5855 1.7815 1.7815 1.8242 1.8242 1.8816 1.8816 1.9011 1.9011 1.9633 1.9633 2.1291 2.1291 3.2248 3.2248 3.2731 3.2731 3.3155 3.3155 3.4076 3.4076 3.5869 3.5869 3.8136 3.8136 4.1674 4.1674 4.4566 4.4566 7.2139 7.2139 7.2496 7.2496 7.8074 7.8074 7.9385 7.9385 10.4175 10.4175 10.7737 10.7737 11.0729 11.0729 12.1596 12.1596 12.3085 12.3085 12.7627 12.7627 13.3819 13.3819 k = 0.0000 0.4079-0.0000 ( 6568 PWs) bands (ev): -18.7028 -18.7028 -18.6404 -18.6404 -15.0664 -15.0664 -15.0372 -15.0372 -5.3780 -5.3780 -5.2922 -5.2922 -3.6585 -3.6585 -3.4873 -3.4873 -3.2586 -3.2586 -3.2101 -3.2101 -1.5536 -1.5536 -1.1650 -1.1650 1.4450 1.4450 1.4951 1.4951 1.5173 1.5173 1.5875 1.5875 1.7907 1.7907 1.8238 1.8238 1.8780 1.8780 1.8995 1.8995 1.9536 1.9536 2.1108 2.1108 3.2345 3.2345 3.2771 3.2771 3.3278 3.3278 3.4259 3.4259 3.5686 3.5686 3.7997 3.7997 4.1569 4.1569 4.4100 4.4100 7.2556 7.2556 7.2832 7.2832 7.7771 7.7771 7.8992 7.8992 10.4349 10.4349 10.7396 10.7396 11.1066 11.1066 12.0786 12.0786 12.3050 12.3050 12.7063 12.7063 13.4708 13.4708 k = 0.0000 0.4211-0.0000 ( 6568 PWs) bands (ev): -18.6968 -18.6968 -18.6431 -18.6431 -15.0663 -15.0663 -15.0412 -15.0412 -5.3748 -5.3748 -5.3001 -5.3001 -3.6510 -3.6510 -3.5017 -3.5017 -3.2566 -3.2566 -3.2142 -3.2142 -1.5199 -1.5199 -1.1837 -1.1837 1.4517 1.4517 1.4959 1.4959 1.5254 1.5254 1.5887 1.5887 1.7999 1.7999 1.8239 1.8239 1.8752 1.8752 1.8986 1.8986 1.9448 1.9448 2.0907 2.0907 3.2433 3.2433 3.2801 3.2801 3.3408 3.3408 3.4467 3.4467 3.5513 3.5513 3.7835 3.7835 4.1504 4.1504 4.3660 4.3660 7.2934 7.2934 7.3236 7.3236 7.7448 7.7448 7.8588 7.8588 10.4501 10.4501 10.7066 10.7066 11.1490 11.1490 11.9970 11.9970 12.3063 12.3063 12.6529 12.6529 13.5486 13.5486 k = 0.0000 0.4342-0.0000 ( 6552 PWs) bands (ev): -18.6910 -18.6910 -18.6460 -18.6460 -15.0658 -15.0658 -15.0449 -15.0449 -5.3710 -5.3710 -5.3080 -5.3080 -3.6426 -3.6426 -3.5163 -3.5163 -3.2542 -3.2542 -3.2184 -3.2184 -1.4866 -1.4866 -1.2041 -1.2041 1.4581 1.4581 1.4958 1.4958 1.5337 1.5337 1.5889 1.5889 1.8088 1.8088 1.8245 1.8245 1.8733 1.8733 1.8983 1.8983 1.9376 1.9376 2.0693 2.0693 3.2512 3.2512 3.2821 3.2821 3.3546 3.3546 3.4681 3.4681 3.5364 3.5364 3.7648 3.7648 4.1474 4.1474 4.3253 4.3253 7.3298 7.3298 7.3680 7.3680 7.7106 7.7106 7.8174 7.8174 10.4641 10.4641 10.6751 10.6751 11.1988 11.1988 11.9154 11.9154 12.3121 12.3121 12.6027 12.6027 13.6123 13.6123 k = 0.0000 0.4474-0.0000 ( 6552 PWs) bands (ev): -18.6853 -18.6853 -18.6492 -18.6492 -15.0651 -15.0651 -15.0483 -15.0483 -5.3666 -5.3666 -5.3158 -5.3158 -3.6332 -3.6332 -3.5309 -3.5309 -3.2514 -3.2514 -3.2224 -3.2224 -1.4536 -1.4536 -1.2262 -1.2262 1.4641 1.4641 1.4949 1.4949 1.5419 1.5419 1.5879 1.5879 1.8166 1.8166 1.8256 1.8256 1.8725 1.8725 1.8982 1.8982 1.9331 1.9331 2.0471 2.0471 3.2582 3.2582 3.2831 3.2831 3.3692 3.3692 3.4829 3.4829 3.5309 3.5309 3.7433 3.7433 4.1479 4.1479 4.2884 4.2884 7.3665 7.3665 7.4138 7.4138 7.6749 7.6749 7.7752 7.7752 10.4781 10.4781 10.6453 10.6453 11.2548 11.2548 11.8343 11.8343 12.3224 12.3224 12.5560 12.5560 13.6576 13.6576 k = 0.0000 0.4605-0.0000 ( 6548 PWs) bands (ev): -18.6799 -18.6799 -18.6528 -18.6528 -15.0641 -15.0641 -15.0515 -15.0515 -5.3618 -5.3618 -5.3233 -5.3233 -3.6228 -3.6228 -3.5455 -3.5455 -3.2483 -3.2483 -3.2265 -3.2265 -1.4214 -1.4214 -1.2499 -1.2499 1.4698 1.4698 1.4932 1.4932 1.5501 1.5501 1.5857 1.5857 1.8225 1.8225 1.8274 1.8274 1.8730 1.8730 1.8967 1.8967 1.9332 1.9332 2.0250 2.0250 3.2643 3.2643 3.2831 3.2831 3.3844 3.3844 3.4793 3.4793 3.5460 3.5460 3.7191 3.7191 4.1519 4.1519 4.2558 4.2558 7.4042 7.4042 7.4600 7.4600 7.6379 7.6379 7.7321 7.7321 10.4928 10.4928 10.6174 10.6174 11.3161 11.3161 11.7542 11.7542 12.3370 12.3370 12.5128 12.5128 13.6946 13.6946 k = 0.0000 0.4737-0.0000 ( 6560 PWs) bands (ev): -18.6747 -18.6747 -18.6566 -18.6566 -15.0627 -15.0627 -15.0543 -15.0543 -5.3564 -5.3564 -5.3306 -5.3306 -3.6116 -3.6116 -3.5597 -3.5597 -3.2451 -3.2451 -3.2304 -3.2304 -1.3899 -1.3899 -1.2752 -1.2752 1.4750 1.4750 1.4907 1.4907 1.5579 1.5579 1.5822 1.5822 1.8261 1.8261 1.8295 1.8295 1.8749 1.8749 1.8931 1.8931 1.9391 1.9391 2.0035 2.0035 3.2696 3.2696 3.2822 3.2822 3.4003 3.4003 3.4656 3.4656 3.5727 3.5727 3.6924 3.6924 4.1592 4.1592 4.2278 4.2278 7.4427 7.4427 7.5060 7.5060 7.6001 7.6001 7.6882 7.6882 10.5087 10.5087 10.5915 10.5915 11.3817 11.3817 11.6754 11.6754 12.3559 12.3559 12.4734 12.4734 13.7296 13.7296 k = 0.0000 0.4868-0.0000 ( 6560 PWs) bands (ev): -18.6698 -18.6698 -18.6607 -18.6607 -15.0611 -15.0611 -15.0569 -15.0569 -5.3505 -5.3505 -5.3376 -5.3376 -3.5996 -3.5996 -3.5735 -3.5735 -3.2416 -3.2416 -3.2342 -3.2342 -1.3595 -1.3595 -1.3020 -1.3020 1.4797 1.4797 1.4877 1.4877 1.5652 1.5652 1.5775 1.5775 1.8285 1.8285 1.8305 1.8305 1.8785 1.8785 1.8883 1.8883 1.9503 1.9503 1.9834 1.9834 3.2741 3.2741 3.2804 3.2804 3.4165 3.4165 3.4496 3.4496 3.6027 3.6027 3.6636 3.6636 4.1703 4.1703 4.2043 4.2043 7.4817 7.4817 7.5483 7.5483 7.5649 7.5649 7.6438 7.6438 10.5263 10.5263 10.5676 10.5676 11.4510 11.4510 11.5983 11.5983 12.3791 12.3791 12.4380 12.4380 13.7592 13.7592 k = 0.0000 0.5000-0.0000 ( 6570 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3443 -5.3443 -5.3443 -5.3443 -3.5868 -3.5868 -3.5868 -3.5868 -3.2380 -3.2380 -3.2380 -3.2380 -1.3301 -1.3301 -1.3301 -1.3301 1.4840 1.4840 1.4840 1.4840 1.5718 1.5718 1.5718 1.5718 1.8300 1.8300 1.8300 1.8300 1.8831 1.8831 1.8831 1.8831 1.9653 1.9653 1.9653 1.9653 3.2777 3.2777 3.2777 3.2777 3.4330 3.4330 3.4330 3.4330 3.6334 3.6334 3.6334 3.6334 4.1852 4.1852 4.1852 4.1852 7.5207 7.5207 7.5207 7.5207 7.5989 7.5989 7.5989 7.5989 10.5459 10.5459 10.5459 10.5459 11.5234 11.5234 11.5234 11.5234 12.4065 12.4065 12.4065 12.4065 13.7761 13.7761 k = 0.0000 0.5000-0.0000 ( 6570 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3443 -5.3443 -5.3443 -5.3443 -3.5868 -3.5868 -3.5868 -3.5868 -3.2380 -3.2380 -3.2380 -3.2380 -1.3301 -1.3301 -1.3301 -1.3301 1.4840 1.4840 1.4840 1.4840 1.5718 1.5718 1.5718 1.5718 1.8300 1.8300 1.8300 1.8300 1.8831 1.8831 1.8831 1.8831 1.9653 1.9653 1.9653 1.9653 3.2777 3.2777 3.2777 3.2777 3.4330 3.4330 3.4330 3.4330 3.6334 3.6334 3.6334 3.6334 4.1852 4.1852 4.1852 4.1852 7.5207 7.5207 7.5207 7.5207 7.5989 7.5989 7.5989 7.5989 10.5459 10.5459 10.5459 10.5459 11.5234 11.5234 11.5234 11.5234 12.4065 12.4065 12.4065 12.4065 13.7761 13.7761 k = 0.0132 0.5000-0.0000 ( 6564 PWs) bands (ev): -18.6650 -18.6650 -18.6650 -18.6650 -15.0594 -15.0594 -15.0592 -15.0592 -5.3486 -5.3486 -5.3401 -5.3401 -3.5912 -3.5912 -3.5824 -3.5824 -3.2495 -3.2495 -3.2273 -3.2273 -1.3299 -1.3299 -1.3296 -1.3296 1.4792 1.4792 1.4886 1.4886 1.5660 1.5660 1.5772 1.5772 1.8282 1.8282 1.8315 1.8315 1.8805 1.8805 1.8856 1.8856 1.9651 1.9651 1.9668 1.9668 3.2769 3.2769 3.2788 3.2788 3.4238 3.4238 3.4389 3.4389 3.6283 3.6283 3.6437 3.6437 4.1841 4.1841 4.1861 4.1861 7.5174 7.5174 7.5196 7.5196 7.5908 7.5908 7.5933 7.5933 10.5540 10.5540 10.5544 10.5544 11.5245 11.5245 11.5266 11.5266 12.4050 12.4050 12.4058 12.4058 13.7065 13.7065 k = 0.0263 0.5000-0.0000 ( 6564 PWs) bands (ev): -18.6646 -18.6646 -18.6646 -18.6646 -15.0600 -15.0600 -15.0595 -15.0595 -5.3532 -5.3532 -5.3361 -5.3361 -3.5954 -3.5954 -3.5778 -3.5778 -3.2616 -3.2616 -3.2174 -3.2174 -1.3291 -1.3291 -1.3284 -1.3284 1.4743 1.4743 1.4930 1.4930 1.5599 1.5599 1.5822 1.5822 1.8261 1.8261 1.8324 1.8324 1.8777 1.8777 1.8877 1.8877 1.9663 1.9663 1.9696 1.9696 3.2763 3.2763 3.2802 3.2802 3.4125 3.4125 3.4406 3.4406 3.6291 3.6291 3.6578 3.6578 4.1827 4.1827 4.1867 4.1867 7.5083 7.5083 7.5146 7.5146 7.5687 7.5687 7.5758 7.5758 10.5782 10.5782 10.5790 10.5790 11.5298 11.5298 11.5341 11.5341 12.4015 12.4015 12.4031 12.4031 13.6321 13.6321 k = 0.0395 0.5000-0.0000 ( 6564 PWs) bands (ev): -18.6639 -18.6639 -18.6639 -18.6639 -15.0608 -15.0608 -15.0601 -15.0601 -5.3579 -5.3579 -5.3324 -5.3324 -3.5993 -3.5993 -3.5732 -3.5732 -3.2742 -3.2742 -3.2084 -3.2084 -1.3276 -1.3276 -1.3266 -1.3266 1.4692 1.4693 1.4969 1.4969 1.5537 1.5537 1.5867 1.5867 1.8237 1.8237 1.8326 1.8326 1.8754 1.8754 1.8896 1.8896 1.9686 1.9686 1.9737 1.9737 3.2754 3.2754 3.2819 3.2819 3.4007 3.4007 3.4383 3.4383 3.6356 3.6356 3.6748 3.6748 4.1811 4.1811 4.1871 4.1871 7.4890 7.4890 7.5044 7.5044 7.5351 7.5351 7.5516 7.5516 10.6169 10.6169 10.6184 10.6184 11.5396 11.5396 11.5461 11.5461 12.3961 12.3961 12.3988 12.3988 13.5613 13.5613 k = 0.0526 0.5000-0.0000 ( 6572 PWs) bands (ev): -18.6630 -18.6630 -18.6630 -18.6630 -15.0619 -15.0619 -15.0609 -15.0609 -5.3627 -5.3627 -5.3289 -5.3289 -3.6030 -3.6030 -3.5686 -3.5686 -3.2872 -3.2872 -3.2004 -3.2004 -1.3254 -1.3254 -1.3242 -1.3242 1.4641 1.4641 1.5002 1.5002 1.5477 1.5477 1.5906 1.5906 1.8211 1.8211 1.8319 1.8319 1.8737 1.8737 1.8912 1.8912 1.9718 1.9718 1.9786 1.9786 3.2737 3.2737 3.2835 3.2835 3.3900 3.3900 3.4332 3.4332 3.6467 3.6467 3.6936 3.6936 4.1794 4.1794 4.1873 4.1873 7.4530 7.4530 7.4752 7.4752 7.5049 7.5049 7.5288 7.5288 10.6679 10.6679 10.6703 10.6703 11.5540 11.5540 11.5631 11.5631 12.3892 12.3892 12.3935 12.3935 13.4955 13.4955 k = 0.0658 0.5000-0.0000 ( 6564 PWs) bands (ev): -18.6619 -18.6619 -18.6619 -18.6619 -15.0632 -15.0632 -15.0621 -15.0621 -5.3676 -5.3676 -5.3257 -5.3257 -3.6064 -3.6064 -3.5642 -3.5642 -3.3005 -3.3005 -3.1934 -3.1934 -1.3226 -1.3226 -1.3211 -1.3211 1.4589 1.4589 1.5024 1.5024 1.5425 1.5425 1.5941 1.5941 1.8184 1.8184 1.8303 1.8303 1.8730 1.8730 1.8929 1.8929 1.9758 1.9758 1.9844 1.9844 3.2702 3.2702 3.2847 3.2847 3.3818 3.3818 3.4269 3.4269 3.6612 3.6612 3.7135 3.7135 4.1774 4.1774 4.1874 4.1874 7.4000 7.4000 7.4195 7.4195 7.4877 7.4877 7.5095 7.5095 10.7284 10.7284 10.7318 10.7318 11.5734 11.5734 11.5854 11.5854 12.3817 12.3817 12.3880 12.3880 13.4355 13.4355 k = 0.0789 0.5000-0.0000 ( 6564 PWs) bands (ev): -18.6605 -18.6605 -18.6604 -18.6604 -15.0649 -15.0649 -15.0635 -15.0635 -5.3726 -5.3726 -5.3229 -5.3229 -3.6094 -3.6094 -3.5600 -3.5600 -3.3139 -3.3139 -3.1876 -3.1876 -1.3192 -1.3192 -1.3174 -1.3174 1.4536 1.4536 1.5026 1.5026 1.5388 1.5388 1.5970 1.5970 1.8155 1.8155 1.8278 1.8278 1.8734 1.8734 1.8946 1.8946 1.9804 1.9804 1.9907 1.9907 3.2644 3.2644 3.2849 3.2849 3.3772 3.3772 3.4211 3.4211 3.6778 3.6778 3.7340 3.7340 4.1754 4.1754 4.1873 4.1873 7.3348 7.3348 7.3521 7.3521 7.4703 7.4703 7.4907 7.4907 10.7948 10.7948 10.7996 10.7996 11.5981 11.5981 11.6136 11.6136 12.3744 12.3744 12.3836 12.3836 13.3822 13.3822 k = 0.0921 0.5000-0.0000 ( 6562 PWs) bands (ev): -18.6588 -18.6588 -18.6588 -18.6588 -15.0667 -15.0667 -15.0651 -15.0651 -5.3776 -5.3776 -5.3203 -5.3203 -3.6120 -3.6120 -3.5560 -3.5560 -3.3273 -3.3273 -3.1829 -3.1829 -1.3151 -1.3151 -1.3132 -1.3132 1.4483 1.4483 1.5002 1.5002 1.5374 1.5374 1.5994 1.5994 1.8126 1.8126 1.8246 1.8246 1.8748 1.8748 1.8965 1.8965 1.9854 1.9854 1.9974 1.9974 3.2560 3.2560 3.2834 3.2834 3.3766 3.3766 3.4171 3.4171 3.6956 3.6956 3.7546 3.7546 4.1733 4.1733 4.1872 4.1872 7.2612 7.2612 7.2772 7.2772 7.4505 7.4505 7.4706 7.4706 10.8635 10.8635 10.8698 10.8698 11.6284 11.6284 11.6479 11.6479 12.3691 12.3691 12.3821 12.3821 13.3364 13.3364 k = 0.1053 0.5000-0.0000 ( 6566 PWs) bands (ev): -18.6569 -18.6569 -18.6569 -18.6569 -15.0688 -15.0688 -15.0670 -15.0670 -5.3826 -5.3826 -5.3181 -5.3181 -3.6143 -3.6143 -3.5525 -3.5525 -3.3404 -3.3404 -3.1794 -3.1794 -1.3104 -1.3104 -1.3084 -1.3084 1.4427 1.4427 1.4952 1.4952 1.5383 1.5383 1.6014 1.6014 1.8097 1.8097 1.8210 1.8210 1.8771 1.8771 1.8986 1.8986 1.9907 1.9907 2.0043 2.0043 3.2454 3.2454 3.2799 3.2799 3.3799 3.3799 3.4160 3.4160 3.7138 3.7138 3.7750 3.7750 4.1713 4.1713 4.1871 4.1871 7.1816 7.1816 7.1967 7.1967 7.4280 7.4280 7.4482 7.4482 10.9307 10.9307 10.9388 10.9388 11.6637 11.6637 11.6881 11.6881 12.3679 12.3679 12.3859 12.3859 13.2988 13.2988 k = 0.1184 0.5000-0.0000 ( 6568 PWs) bands (ev): -18.6549 -18.6549 -18.6548 -18.6548 -15.0711 -15.0711 -15.0691 -15.0691 -5.3877 -5.3877 -5.3162 -5.3162 -3.6162 -3.6162 -3.5495 -3.5495 -3.3531 -3.3531 -3.1770 -3.1770 -1.3052 -1.3052 -1.3031 -1.3031 1.4371 1.4371 1.4884 1.4884 1.5408 1.5408 1.6029 1.6029 1.8068 1.8068 1.8172 1.8172 1.8801 1.8801 1.9010 1.9010 1.9962 1.9962 2.0112 2.0112 3.2334 3.2334 3.2743 3.2743 3.3864 3.3864 3.4180 3.4180 3.7319 3.7319 3.7949 3.7949 4.1695 4.1695 4.1871 4.1871 7.0980 7.0980 7.1123 7.1123 7.4028 7.4028 7.4234 7.4234 10.9930 10.9930 11.0031 11.0031 11.7028 11.7028 11.7326 11.7326 12.3744 12.3744 12.3982 12.3982 13.2700 13.2700 k = 0.1316 0.5000-0.0000 ( 6568 PWs) bands (ev): -18.6526 -18.6526 -18.6526 -18.6526 -15.0737 -15.0737 -15.0715 -15.0715 -5.3926 -5.3926 -5.3147 -5.3147 -3.6176 -3.6176 -3.5471 -3.5471 -3.3652 -3.3652 -3.1759 -3.1759 -1.2995 -1.2995 -1.2973 -1.2973 1.4314 1.4314 1.4804 1.4804 1.5443 1.5443 1.6042 1.6042 1.8040 1.8040 1.8134 1.8134 1.8836 1.8836 1.9037 1.9037 2.0019 2.0019 2.0181 2.0181 3.2207 3.2207 3.2668 3.2668 3.3955 3.3955 3.4232 3.4232 3.7496 3.7496 3.8139 3.8139 4.1679 4.1679 4.1872 4.1872 7.0119 7.0119 7.0255 7.0255 7.3749 7.3749 7.3959 7.3959 11.0478 11.0478 11.0600 11.0600 11.7428 11.7428 11.7779 11.7779 12.3931 12.3931 12.4232 12.4232 13.2507 13.2507 k = 0.1447 0.5000-0.0000 ( 6572 PWs) bands (ev): -18.6501 -18.6501 -18.6501 -18.6501 -15.0764 -15.0764 -15.0741 -15.0741 -5.3975 -5.3975 -5.3136 -5.3136 -3.6187 -3.6187 -3.5455 -3.5455 -3.3764 -3.3764 -3.1759 -3.1759 -1.2932 -1.2932 -1.2911 -1.2911 1.4256 1.4256 1.4718 1.4718 1.5483 1.5483 1.6051 1.6051 1.8014 1.8014 1.8097 1.8097 1.8876 1.8876 1.9067 1.9067 2.0075 2.0075 2.0249 2.0249 3.2078 3.2078 3.2580 3.2580 3.4066 3.4066 3.4310 3.4310 3.7665 3.7665 3.8317 3.8317 4.1667 4.1667 4.1873 4.1873 6.9246 6.9246 6.9374 6.9374 7.3444 7.3444 7.3658 7.3658 11.0936 11.0936 11.1082 11.1082 11.7798 11.7798 11.8187 11.8187 12.4298 12.4298 12.4650 12.4650 13.2413 13.2413 k = 0.1579 0.5000-0.0000 ( 6576 PWs) bands (ev): -18.6475 -18.6475 -18.6475 -18.6475 -15.0793 -15.0793 -15.0768 -15.0768 -5.4022 -5.4022 -5.3129 -5.3129 -3.6193 -3.6193 -3.5450 -3.5450 -3.3865 -3.3865 -3.1771 -3.1771 -1.2865 -1.2865 -1.2844 -1.2844 1.4196 1.4196 1.4628 1.4628 1.5526 1.5526 1.6059 1.6059 1.7988 1.7988 1.8062 1.8062 1.8919 1.8919 1.9099 1.9099 2.0131 2.0131 2.0315 2.0315 3.1951 3.1951 3.2483 3.2483 3.4193 3.4193 3.4410 3.4410 3.7824 3.7824 3.8482 3.8482 4.1659 4.1659 4.1877 4.1877 6.8373 6.8373 6.8492 6.8492 7.3113 7.3113 7.3331 7.3331 11.1299 11.1299 11.1471 11.1471 11.8103 11.8103 11.8500 11.8500 12.4887 12.4887 12.5267 12.5267 13.2419 13.2419 k = 0.1711 0.5000-0.0000 ( 6572 PWs) bands (ev): -18.6447 -18.6447 -18.6447 -18.6447 -15.0823 -15.0823 -15.0797 -15.0797 -5.4069 -5.4069 -5.3126 -5.3126 -3.6195 -3.6195 -3.5455 -3.5455 -3.3952 -3.3952 -3.1794 -3.1794 -1.2793 -1.2793 -1.2774 -1.2774 1.4136 1.4136 1.4535 1.4535 1.5572 1.5572 1.6066 1.6066 1.7965 1.7965 1.8031 1.8031 1.8966 1.8966 1.9135 1.9135 2.0186 2.0186 2.0378 2.0378 3.1828 3.1828 3.2383 3.2383 3.4333 3.4333 3.4527 3.4527 3.7971 3.7971 3.8632 3.8632 4.1656 4.1656 4.1881 4.1881 6.7509 6.7509 6.7617 6.7617 7.2757 7.2757 7.2979 7.2979 11.1571 11.1571 11.1774 11.1774 11.8321 11.8321 11.8690 11.8690 12.5711 12.5711 12.6088 12.6088 13.2528 13.2528 k = 0.1842 0.5000-0.0000 ( 6578 PWs) bands (ev): -18.6418 -18.6418 -18.6417 -18.6417 -15.0855 -15.0855 -15.0828 -15.0828 -5.4113 -5.4113 -5.3127 -5.3127 -3.6193 -3.6193 -3.5472 -3.5472 -3.4025 -3.4025 -3.1829 -3.1829 -1.2718 -1.2718 -1.2701 -1.2701 1.4074 1.4074 1.4441 1.4441 1.5619 1.5619 1.6073 1.6073 1.7942 1.7942 1.8002 1.8002 1.9014 1.9014 1.9172 1.9172 2.0239 2.0239 2.0438 2.0438 3.1712 3.1712 3.2283 3.2283 3.4483 3.4483 3.4656 3.4656 3.8107 3.8107 3.8764 3.8764 4.1658 4.1658 4.1885 4.1885 6.6663 6.6663 6.6758 6.6758 7.2378 7.2378 7.2602 7.2602 11.1760 11.1760 11.1998 11.1998 11.8457 11.8457 11.8767 11.8767 12.6743 12.6743 12.7090 12.7090 13.2741 13.2741 k = 0.1974 0.5000-0.0000 ( 6582 PWs) bands (ev): -18.6387 -18.6387 -18.6387 -18.6387 -15.0888 -15.0888 -15.0860 -15.0860 -5.4155 -5.4155 -5.3132 -5.3132 -3.6187 -3.6187 -3.5502 -3.5502 -3.4082 -3.4082 -3.1874 -3.1874 -1.2640 -1.2640 -1.2625 -1.2625 1.4011 1.4011 1.4346 1.4346 1.5667 1.5667 1.6081 1.6081 1.7921 1.7921 1.7975 1.7975 1.9064 1.9064 1.9212 1.9212 2.0290 2.0290 2.0494 2.0494 3.1604 3.1604 3.2185 3.2185 3.4641 3.4641 3.4794 3.4794 3.8230 3.8230 3.8879 3.8879 4.1665 4.1665 4.1890 4.1890 6.5841 6.5841 6.5923 6.5923 7.1977 7.1977 7.2201 7.2201 11.1877 11.1877 11.2153 11.2153 11.8527 11.8527 11.8759 11.8759 12.7935 12.7935 12.8235 12.8235 13.3057 13.3057 k = 0.2105 0.5000-0.0000 ( 6590 PWs) bands (ev): -18.6356 -18.6356 -18.6356 -18.6356 -15.0922 -15.0922 -15.0894 -15.0894 -5.4195 -5.4195 -5.3141 -5.3141 -3.6177 -3.6177 -3.5543 -3.5543 -3.4124 -3.4124 -3.1928 -3.1928 -1.2559 -1.2559 -1.2546 -1.2546 1.3947 1.3947 1.4252 1.4252 1.5717 1.5717 1.6090 1.6090 1.7902 1.7902 1.7951 1.7951 1.9114 1.9114 1.9254 1.9254 2.0338 2.0338 2.0546 2.0546 3.1503 3.1503 3.2090 3.2090 3.4805 3.4805 3.4938 3.4938 3.8342 3.8342 3.8976 3.8976 4.1676 4.1676 4.1892 4.1892 6.5051 6.5051 6.5118 6.5118 7.1556 7.1556 7.1779 7.1779 11.1931 11.1931 11.2248 11.2248 11.8551 11.8551 11.8694 11.8694 12.9233 12.9233 12.9477 12.9477 13.3479 13.3479 k = 0.2237 0.5000-0.0000 ( 6594 PWs) bands (ev): -18.6324 -18.6324 -18.6324 -18.6324 -15.0957 -15.0957 -15.0928 -15.0928 -5.4232 -5.4232 -5.3155 -5.3155 -3.6165 -3.6165 -3.5594 -3.5594 -3.4151 -3.4151 -3.1992 -3.1992 -1.2476 -1.2476 -1.2466 -1.2466 1.3882 1.3882 1.4158 1.4158 1.5768 1.5768 1.6102 1.6102 1.7885 1.7885 1.7930 1.7930 1.9166 1.9166 1.9297 1.9297 2.0384 2.0384 2.0594 2.0594 3.1411 3.1411 3.2000 3.2000 3.4973 3.4973 3.5085 3.5085 3.8442 3.8442 3.9056 3.9056 4.1689 4.1689 4.1890 4.1890 6.4299 6.4299 6.4349 6.4349 7.1115 7.1115 7.1336 7.1336 11.1933 11.1933 11.2292 11.2292 11.8546 11.8546 11.8597 11.8597 13.0585 13.0585 13.0769 13.0769 13.4010 13.4010 k = 0.2368 0.5000-0.0000 ( 6598 PWs) bands (ev): -18.6291 -18.6291 -18.6291 -18.6291 -15.0992 -15.0992 -15.0963 -15.0963 -5.4266 -5.4266 -5.3173 -5.3173 -3.6149 -3.6149 -3.5652 -3.5652 -3.4165 -3.4165 -3.2064 -3.2064 -1.2392 -1.2392 -1.2385 -1.2385 1.3817 1.3817 1.4065 1.4065 1.5821 1.5821 1.6117 1.6117 1.7869 1.7869 1.7912 1.7912 1.9219 1.9219 1.9342 1.9342 2.0426 2.0426 2.0637 2.0637 3.1329 3.1329 3.1916 3.1916 3.5142 3.5142 3.5233 3.5233 3.8533 3.8533 3.9121 3.9121 4.1701 4.1701 4.1883 4.1883 6.3589 6.3589 6.3621 6.3621 7.0658 7.0658 7.0875 7.0875 11.1893 11.1893 11.2292 11.2292 11.8484 11.8484 11.8525 11.8525 13.1934 13.1934 13.2064 13.2064 13.4660 13.4660 k = 0.2500 0.5000-0.0000 ( 6598 PWs) bands (ev): -18.6258 -18.6258 -18.6258 -18.6258 -15.1028 -15.1028 -15.0998 -15.0998 -5.4297 -5.4297 -5.3195 -5.3195 -3.6132 -3.6132 -3.5715 -3.5715 -3.4169 -3.4169 -3.2144 -3.2144 -1.2307 -1.2307 -1.2303 -1.2303 1.3752 1.3752 1.3975 1.3975 1.5875 1.5875 1.6135 1.6135 1.7854 1.7854 1.7895 1.7895 1.9271 1.9271 1.9389 1.9389 2.0465 2.0465 2.0676 2.0676 3.1255 3.1255 3.1838 3.1838 3.5310 3.5310 3.5380 3.5380 3.8616 3.8616 3.9173 3.9173 4.1709 4.1709 4.1868 4.1868 6.2928 6.2928 6.2941 6.2941 7.0185 7.0185 7.0398 7.0398 11.1819 11.1819 11.2258 11.2258 11.8364 11.8364 11.8492 11.8492 13.3220 13.3220 13.3316 13.3316 13.5438 13.5438 k = 0.2632 0.5000-0.0000 ( 6598 PWs) bands (ev): -18.6225 -18.6225 -18.6225 -18.6225 -15.1063 -15.1063 -15.1034 -15.1034 -5.4324 -5.4324 -5.3221 -5.3221 -3.6112 -3.6112 -3.5780 -3.5780 -3.4164 -3.4164 -3.2230 -3.2230 -1.2221 -1.2221 -1.2220 -1.2220 1.3688 1.3688 1.3886 1.3886 1.5930 1.5930 1.6157 1.6157 1.7841 1.7841 1.7879 1.7879 1.9324 1.9324 1.9436 1.9436 2.0501 2.0501 2.0709 2.0709 3.1190 3.1190 3.1766 3.1766 3.5476 3.5476 3.5522 3.5522 3.8694 3.8694 3.9216 3.9216 4.1712 4.1712 4.1844 4.1844 6.2311 6.2311 6.2318 6.2318 6.9699 6.9699 6.9905 6.9905 11.1722 11.1722 11.2195 11.2195 11.8243 11.8243 11.8453 11.8453 13.4387 13.4387 13.4490 13.4490 13.6326 13.6326 k = 0.2763 0.5000-0.0000 ( 6606 PWs) bands (ev): -18.6193 -18.6193 -18.6192 -18.6192 -15.1098 -15.1098 -15.1069 -15.1069 -5.4348 -5.4348 -5.3251 -5.3251 -3.6091 -3.6091 -3.5845 -3.5845 -3.4153 -3.4153 -3.2321 -3.2321 -1.2138 -1.2138 -1.2136 -1.2136 1.3623 1.3623 1.3800 1.3800 1.5986 1.5986 1.6183 1.6183 1.7828 1.7828 1.7865 1.7865 1.9375 1.9375 1.9483 1.9483 2.0532 2.0532 2.0737 2.0737 3.1135 3.1135 3.1700 3.1700 3.5637 3.5637 3.5659 3.5659 3.8767 3.8767 3.9250 3.9250 4.1704 4.1704 4.1808 4.1808 6.1736 6.1736 6.1763 6.1763 6.9202 6.9202 6.9401 6.9401 11.1608 11.1608 11.2110 11.2110 11.8125 11.8125 11.8408 11.8408 13.5428 13.5428 13.5571 13.5571 13.7059 13.7059 k = 0.2895 0.5000-0.0000 ( 6608 PWs) bands (ev): -18.6160 -18.6160 -18.6160 -18.6160 -15.1133 -15.1133 -15.1104 -15.1104 -5.4367 -5.4367 -5.3284 -5.3284 -3.6070 -3.6070 -3.5907 -3.5907 -3.4137 -3.4137 -3.2417 -3.2417 -1.2057 -1.2057 -1.2052 -1.2052 1.3560 1.3560 1.3717 1.3717 1.6044 1.6044 1.6214 1.6214 1.7815 1.7815 1.7852 1.7852 1.9427 1.9427 1.9532 1.9532 2.0560 2.0560 2.0759 2.0759 3.1088 3.1088 3.1640 3.1640 3.5789 3.5789 3.5792 3.5792 3.8839 3.8839 3.9280 3.9280 4.1685 4.1685 4.1759 4.1759 6.1220 6.1220 6.1267 6.1267 6.8696 6.8696 6.8886 6.8886 11.1484 11.1484 11.2010 11.2010 11.8009 11.8009 11.8357 11.8357 13.6376 13.6376 13.6557 13.6557 13.7512 13.7512 k = 0.3026 0.5000-0.0000 ( 6600 PWs) bands (ev): -18.6128 -18.6128 -18.6128 -18.6128 -15.1167 -15.1167 -15.1139 -15.1139 -5.4382 -5.4382 -5.3321 -5.3321 -3.6049 -3.6049 -3.5965 -3.5965 -3.4118 -3.4118 -3.2516 -3.2516 -1.1977 -1.1977 -1.1969 -1.1969 1.3499 1.3499 1.3637 1.3637 1.6104 1.6104 1.6248 1.6248 1.7804 1.7804 1.7839 1.7839 1.9478 1.9478 1.9580 1.9580 2.0584 2.0584 2.0776 2.0776 3.1049 3.1049 3.1586 3.1586 3.5910 3.5910 3.5938 3.5938 3.8910 3.8910 3.9309 3.9309 4.1651 4.1651 4.1697 4.1697 6.0764 6.0764 6.0831 6.0831 6.8184 6.8184 6.8363 6.8363 11.1358 11.1358 11.1901 11.1901 11.7896 11.7896 11.8299 11.8299 13.7241 13.7241 13.7345 13.7345 13.7938 13.7938 k = 0.3158 0.5000-0.0000 ( 6612 PWs) bands (ev): -18.6097 -18.6097 -18.6097 -18.6097 -15.1200 -15.1200 -15.1173 -15.1173 -5.4393 -5.4393 -5.3362 -5.3362 -3.6028 -3.6028 -3.6019 -3.6019 -3.4096 -3.4096 -3.2617 -3.2617 -1.1899 -1.1899 -1.1889 -1.1889 1.3439 1.3439 1.3561 1.3561 1.6164 1.6164 1.6286 1.6286 1.7791 1.7791 1.7826 1.7826 1.9527 1.9527 1.9628 1.9628 2.0603 2.0603 2.0787 2.0787 3.1019 3.1019 3.1537 3.1537 3.6022 3.6022 3.6074 3.6074 3.8982 3.8982 3.9337 3.9337 4.1602 4.1602 4.1621 4.1621 6.0372 6.0372 6.0457 6.0457 6.7667 6.7667 6.7834 6.7834 11.1234 11.1234 11.1787 11.1787 11.7785 11.7785 11.8232 11.8232 13.7651 13.7651 13.7909 13.7909 13.8704 13.8704 k = 0.3289 0.5000-0.0000 ( 6614 PWs) bands (ev): -18.6067 -18.6067 -18.6067 -18.6067 -15.1232 -15.1232 -15.1206 -15.1206 -5.4400 -5.4400 -5.3405 -5.3405 -3.6066 -3.6066 -3.6009 -3.6009 -3.4072 -3.4072 -3.2719 -3.2719 -1.1823 -1.1823 -1.1811 -1.1811 1.3381 1.3381 1.3488 1.3488 1.6225 1.6225 1.6328 1.6328 1.7779 1.7779 1.7812 1.7812 1.9576 1.9576 1.9675 1.9675 2.0618 2.0618 2.0793 2.0793 3.0997 3.0997 3.1494 3.1494 3.6123 3.6123 3.6198 3.6198 3.9056 3.9056 3.9368 3.9368 4.1531 4.1531 4.1537 4.1537 6.0043 6.0043 6.0144 6.0144 6.7148 6.7148 6.7303 6.7303 11.1116 11.1116 11.1672 11.1672 11.7676 11.7676 11.8156 11.8156 13.7740 13.7740 13.8199 13.8199 13.9507 13.9507 k = 0.3421 0.5000-0.0000 ( 6610 PWs) bands (ev): -18.6039 -18.6039 -18.6038 -18.6038 -15.1262 -15.1262 -15.1238 -15.1238 -5.4402 -5.4402 -5.3452 -5.3452 -3.6107 -3.6107 -3.5992 -3.5992 -3.4048 -3.4048 -3.2821 -3.2821 -1.1750 -1.1750 -1.1737 -1.1737 1.3327 1.3327 1.3420 1.3420 1.6288 1.6288 1.6373 1.6373 1.7765 1.7765 1.7799 1.7799 1.9625 1.9625 1.9722 1.9722 2.0630 2.0630 2.0794 2.0794 3.0982 3.0982 3.1455 3.1455 3.6214 3.6214 3.6309 3.6309 3.9133 3.9133 3.9403 3.9403 4.1430 4.1430 4.1457 4.1457 5.9778 5.9778 5.9894 5.9894 6.6629 6.6629 6.6770 6.6770 11.1007 11.1007 11.1560 11.1560 11.7568 11.7568 11.8070 11.8070 13.7785 13.7785 13.8294 13.8294 14.0367 14.0367 k = 0.3553 0.5000-0.0000 ( 6622 PWs) bands (ev): -18.6011 -18.6011 -18.6011 -18.6011 -15.1291 -15.1291 -15.1268 -15.1268 -5.4399 -5.4399 -5.3500 -5.3500 -3.6140 -3.6140 -3.5978 -3.5978 -3.4023 -3.4023 -3.2921 -3.2921 -1.1681 -1.1681 -1.1667 -1.1667 1.3275 1.3275 1.3356 1.3356 1.6350 1.6350 1.6420 1.6420 1.7751 1.7751 1.7784 1.7784 1.9671 1.9671 1.9767 1.9767 2.0637 2.0637 2.0790 2.0790 3.0974 3.0974 3.1421 3.1421 3.6294 3.6294 3.6406 3.6406 3.9211 3.9211 3.9443 3.9443 4.1318 4.1318 4.1363 4.1363 5.9577 5.9577 5.9705 5.9705 6.6113 6.6113 6.6239 6.6239 11.0911 11.0911 11.1453 11.1453 11.7462 11.7462 11.7975 11.7975 13.7829 13.7829 13.8345 13.8345 14.1261 14.1261 k = 0.3684 0.5000-0.0000 ( 6626 PWs) bands (ev): -18.5986 -18.5986 -18.5985 -18.5985 -15.1318 -15.1318 -15.1296 -15.1296 -5.4391 -5.4391 -5.3551 -5.3551 -3.6166 -3.6166 -3.5967 -3.5967 -3.3997 -3.3997 -3.3018 -3.3018 -1.1616 -1.1616 -1.1601 -1.1601 1.3226 1.3226 1.3297 1.3297 1.6413 1.6413 1.6470 1.6470 1.7736 1.7736 1.7768 1.7768 1.9717 1.9717 1.9811 1.9811 2.0641 2.0641 2.0781 2.0781 3.0972 3.0972 3.1390 3.1390 3.6364 3.6364 3.6489 3.6489 3.9292 3.9292 3.9487 3.9487 4.1198 4.1198 4.1256 4.1256 5.9438 5.9438 5.9574 5.9574 6.5601 6.5601 6.5712 6.5712 11.0828 11.0828 11.1353 11.1353 11.7359 11.7359 11.7872 11.7872 13.7889 13.7889 13.8395 13.8395 14.2151 14.2151 k = 0.3816 0.5000-0.0000 ( 6618 PWs) bands (ev): -18.5962 -18.5962 -18.5962 -18.5962 -15.1343 -15.1343 -15.1323 -15.1323 -5.4379 -5.4379 -5.3604 -5.3604 -3.6185 -3.6185 -3.5960 -3.5960 -3.3971 -3.3971 -3.3111 -3.3111 -1.1555 -1.1555 -1.1540 -1.1540 1.3182 1.3182 1.3243 1.3243 1.6475 1.6475 1.6521 1.6521 1.7721 1.7721 1.7751 1.7751 1.9762 1.9762 1.9854 1.9854 2.0642 2.0642 2.0768 2.0768 3.0977 3.0977 3.1363 3.1363 3.6425 3.6425 3.6558 3.6558 3.9374 3.9374 3.9536 3.9536 4.1073 4.1073 4.1140 4.1140 5.9358 5.9358 5.9501 5.9501 6.5097 6.5097 6.5191 6.5191 11.0759 11.0759 11.1260 11.1260 11.7260 11.7260 11.7761 11.7761 13.7972 13.7972 13.8460 13.8460 14.3016 14.3016 k = 0.3947 0.5000-0.0000 ( 6616 PWs) bands (ev): -18.5940 -18.5940 -18.5940 -18.5940 -15.1365 -15.1365 -15.1347 -15.1347 -5.4363 -5.4363 -5.3658 -5.3658 -3.6196 -3.6196 -3.5958 -3.5958 -3.3945 -3.3945 -3.3200 -3.3200 -1.1499 -1.1499 -1.1484 -1.1484 1.3142 1.3142 1.3193 1.3193 1.6535 1.6535 1.6573 1.6573 1.7705 1.7705 1.7734 1.7734 1.9806 1.9806 1.9894 1.9894 2.0640 2.0640 2.0751 2.0751 3.0987 3.0987 3.1339 3.1339 3.6477 3.6477 3.6614 3.6614 3.9456 3.9456 3.9590 3.9590 4.0945 4.0945 4.1018 4.1018 5.9336 5.9336 5.9481 5.9481 6.4603 6.4603 6.4680 6.4680 11.0705 11.0705 11.1174 11.1174 11.7166 11.7166 11.7646 11.7646 13.8080 13.8080 13.8543 13.8543 14.3837 14.3837 k = 0.4079 0.5000-0.0000 ( 6620 PWs) bands (ev): -18.5920 -18.5920 -18.5920 -18.5920 -15.1386 -15.1386 -15.1370 -15.1370 -5.4342 -5.4342 -5.3712 -5.3712 -3.6201 -3.6201 -3.5960 -3.5960 -3.3918 -3.3918 -3.3284 -3.3284 -1.1449 -1.1449 -1.1434 -1.1434 1.3106 1.3106 1.3149 1.3149 1.6593 1.6593 1.6623 1.6623 1.7688 1.7688 1.7714 1.7714 1.9848 1.9848 1.9931 1.9931 2.0635 2.0635 2.0732 2.0732 3.1001 3.1001 3.1316 3.1316 3.6522 3.6522 3.6657 3.6657 3.9538 3.9538 3.9647 3.9647 4.0819 4.0819 4.0891 4.0891 5.9368 5.9368 5.9511 5.9511 6.4122 6.4122 6.4181 6.4181 11.0666 11.0666 11.1096 11.1096 11.7081 11.7081 11.7528 11.7528 13.8211 13.8211 13.8642 13.8642 14.4598 14.4598 k = 0.4211 0.5000-0.0000 ( 6620 PWs) bands (ev): -18.5903 -18.5903 -18.5903 -18.5903 -15.1403 -15.1403 -15.1389 -15.1389 -5.4316 -5.4316 -5.3768 -5.3768 -3.6199 -3.6199 -3.5967 -3.5967 -3.3892 -3.3892 -3.3361 -3.3361 -1.1404 -1.1404 -1.1391 -1.1391 1.3074 1.3074 1.3110 1.3110 1.6649 1.6649 1.6672 1.6672 1.7671 1.7671 1.7695 1.7695 1.9888 1.9888 1.9964 1.9964 2.0628 2.0628 2.0710 2.0710 3.1019 3.1019 3.1294 3.1294 3.6561 3.6561 3.6688 3.6688 3.9619 3.9619 3.9706 3.9706 4.0695 4.0695 4.0764 4.0764 5.9449 5.9449 5.9588 5.9588 6.3657 6.3657 6.3698 6.3698 11.0641 11.0641 11.1026 11.1026 11.7006 11.7006 11.7411 11.7411 13.8361 13.8361 13.8753 13.8753 14.5282 14.5282 k = 0.4342 0.5000-0.0000 ( 6614 PWs) bands (ev): -18.5888 -18.5888 -18.5888 -18.5888 -15.1418 -15.1418 -15.1407 -15.1407 -5.4287 -5.4287 -5.3823 -5.3823 -3.6190 -3.6190 -3.5979 -3.5979 -3.3864 -3.3864 -3.3433 -3.3433 -1.1365 -1.1365 -1.1353 -1.1353 1.3048 1.3048 1.3077 1.3077 1.6700 1.6700 1.6718 1.6718 1.7655 1.7655 1.7675 1.7675 1.9926 1.9926 1.9994 1.9994 2.0621 2.0621 2.0688 2.0688 3.1041 3.1041 3.1274 3.1274 3.6595 3.6595 3.6709 3.6709 3.9700 3.9700 3.9767 3.9767 4.0577 4.0577 4.0640 4.0640 5.9575 5.9575 5.9707 5.9707 6.3211 6.3211 6.3235 6.3235 11.0629 11.0629 11.0962 11.0962 11.6945 11.6945 11.7298 11.7298 13.8522 13.8522 13.8867 13.8867 14.5871 14.5871 k = 0.4474 0.5000-0.0000 ( 6618 PWs) bands (ev): -18.5876 -18.5876 -18.5876 -18.5876 -15.1431 -15.1431 -15.1421 -15.1421 -5.4253 -5.4253 -5.3878 -5.3878 -3.6177 -3.6177 -3.5995 -3.5995 -3.3836 -3.3836 -3.3498 -3.3498 -1.1333 -1.1333 -1.1323 -1.1323 1.3026 1.3026 1.3048 1.3048 1.6745 1.6745 1.6758 1.6758 1.7639 1.7639 1.7656 1.7656 1.9960 1.9960 2.0018 2.0018 2.0614 2.0614 2.0666 2.0666 3.1064 3.1064 3.1253 3.1253 3.6625 3.6625 3.6721 3.6721 3.9779 3.9779 3.9830 3.9830 4.0467 4.0467 4.0521 4.0521 5.9740 5.9740 5.9860 5.9860 6.2790 6.2790 6.2797 6.2797 11.0629 11.0629 11.0903 11.0903 11.6898 11.6898 11.7192 11.7192 13.8685 13.8685 13.8976 13.8976 14.6347 14.6347 k = 0.4605 0.5000-0.0000 ( 6622 PWs) bands (ev): -18.5866 -18.5866 -18.5866 -18.5866 -15.1440 -15.1440 -15.1433 -15.1433 -5.4216 -5.4216 -5.3932 -5.3932 -3.6159 -3.6159 -3.6015 -3.6015 -3.3805 -3.3805 -3.3557 -3.3557 -1.1307 -1.1307 -1.1299 -1.1299 1.3009 1.3009 1.3026 1.3026 1.6782 1.6782 1.6792 1.6792 1.7625 1.7625 1.7638 1.7638 1.9991 1.9991 2.0037 2.0037 2.0607 2.0607 2.0645 2.0645 3.1088 3.1088 3.1232 3.1232 3.6650 3.6650 3.6726 3.6726 3.9858 3.9858 3.9894 3.9894 4.0365 4.0365 4.0407 4.0407 5.9933 5.9933 6.0039 6.0039 6.2394 6.2394 6.2402 6.2402 11.0639 11.0639 11.0850 11.0850 11.6869 11.6869 11.7096 11.7096 13.8839 13.8839 13.9068 13.9068 14.6693 14.6693 k = 0.4737 0.5000-0.0000 ( 6622 PWs) bands (ev): -18.5859 -18.5859 -18.5859 -18.5859 -15.1446 -15.1446 -15.1441 -15.1441 -5.4175 -5.4175 -5.3984 -5.3984 -3.6138 -3.6138 -3.6038 -3.6038 -3.3773 -3.3773 -3.3609 -3.3609 -1.1288 -1.1288 -1.1283 -1.1283 1.2998 1.2998 1.3009 1.3009 1.6811 1.6811 1.6817 1.6817 1.7615 1.7615 1.7624 1.7624 2.0017 2.0017 2.0048 2.0048 2.0603 2.0603 2.0628 2.0628 3.1114 3.1114 3.1210 3.1210 3.6672 3.6672 3.6724 3.6724 3.9938 3.9938 3.9960 3.9960 4.0271 4.0271 4.0302 4.0302 6.0141 6.0141 6.0225 6.0225 6.2043 6.2043 6.2061 6.2061 11.0658 11.0658 11.0801 11.0801 11.6859 11.6859 11.7014 11.7014 13.8973 13.8973 13.9131 13.9131 14.6906 14.6906 k = 0.4868 0.5000-0.0000 ( 6612 PWs) bands (ev): -18.5855 -18.5855 -18.5855 -18.5855 -15.1450 -15.1450 -15.1447 -15.1447 -5.4131 -5.4131 -5.4036 -5.4036 -3.6114 -3.6114 -3.6063 -3.6063 -3.3738 -3.3738 -3.3657 -3.3657 -1.1276 -1.1276 -1.1273 -1.1273 1.2993 1.2993 1.2998 1.2998 1.6830 1.6830 1.6833 1.6833 1.7609 1.7609 1.7614 1.7614 2.0037 2.0037 2.0053 2.0053 2.0602 2.0602 2.0614 2.0614 3.1139 3.1139 3.1188 3.1188 3.6691 3.6691 3.6718 3.6718 4.0020 4.0020 4.0028 4.0028 4.0187 4.0187 4.0204 4.0204 6.0327 6.0327 6.0378 6.0378 6.1784 6.1784 6.1802 6.1802 11.0685 11.0685 11.0758 11.0758 11.6869 11.6869 11.6947 11.6947 13.9076 13.9076 13.9156 13.9156 14.7012 14.7013 k = 0.5000 0.5000-0.0000 ( 6592 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6088 -3.6088 -3.6088 -3.6088 -3.3700 -3.3700 -3.3699 -3.3699 -1.1271 -1.1271 -1.1271 -1.1271 1.2994 1.2994 1.2994 1.2994 1.6838 1.6838 1.6838 1.6838 1.7609 1.7609 1.7609 1.7609 2.0049 2.0049 2.0049 2.0049 2.0606 2.0606 2.0606 2.0606 3.1164 3.1164 3.1164 3.1164 3.6706 3.6706 3.6706 3.6706 4.0085 4.0085 4.0085 4.0085 4.0129 4.0129 4.0129 4.0129 6.0426 6.0426 6.0426 6.0426 6.1690 6.1690 6.1690 6.1690 11.0719 11.0719 11.0719 11.0719 11.6899 11.6899 11.6899 11.6899 13.9138 13.9138 13.9138 13.9138 14.7055 14.7055 k = 0.5000 0.5000-0.0000 ( 6592 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6088 -3.6088 -3.6088 -3.6088 -3.3700 -3.3700 -3.3699 -3.3699 -1.1271 -1.1271 -1.1271 -1.1271 1.2994 1.2994 1.2994 1.2994 1.6838 1.6838 1.6838 1.6838 1.7609 1.7609 1.7609 1.7609 2.0049 2.0049 2.0049 2.0049 2.0606 2.0606 2.0606 2.0606 3.1164 3.1164 3.1164 3.1164 3.6706 3.6706 3.6706 3.6706 4.0085 4.0085 4.0085 4.0085 4.0129 4.0129 4.0129 4.0129 6.0426 6.0426 6.0426 6.0426 6.1690 6.1690 6.1690 6.1690 11.0719 11.0719 11.0719 11.0719 11.6899 11.6899 11.6899 11.6899 13.9138 13.9138 13.9138 13.9138 14.7055 14.7055 k = 0.4907 0.4907-0.0000 ( 6612 PWs) bands (ev): -18.5856 -18.5856 -18.5854 -18.5854 -15.1450 -15.1450 -15.1447 -15.1447 -5.4131 -5.4131 -5.4036 -5.4036 -3.6114 -3.6114 -3.6062 -3.6062 -3.3738 -3.3738 -3.3657 -3.3657 -1.1281 -1.1281 -1.1268 -1.1268 1.2991 1.2991 1.2999 1.2999 1.6830 1.6830 1.6834 1.6834 1.7609 1.7609 1.7614 1.7614 2.0036 2.0036 2.0053 2.0053 2.0600 2.0600 2.0617 2.0617 3.1138 3.1138 3.1188 3.1188 3.6690 3.6690 3.6718 3.6718 3.9988 3.9988 4.0086 4.0086 4.0141 4.0141 4.0224 4.0224 6.0257 6.0257 6.0461 6.0461 6.1702 6.1702 6.1871 6.1871 11.0685 11.0685 11.0758 11.0758 11.6869 11.6869 11.6947 11.6947 13.9071 13.9071 13.9162 13.9162 14.7012 14.7013 k = 0.4815 0.4815-0.0000 ( 6620 PWs) bands (ev): -18.5863 -18.5863 -18.5855 -18.5855 -15.1447 -15.1447 -15.1441 -15.1441 -5.4175 -5.4175 -5.3985 -5.3985 -3.6140 -3.6140 -3.6036 -3.6036 -3.3772 -3.3772 -3.3611 -3.3611 -1.1311 -1.1311 -1.1259 -1.1259 1.2989 1.2989 1.3018 1.3018 1.6809 1.6809 1.6820 1.6820 1.7612 1.7612 1.7627 1.7627 2.0017 2.0017 2.0049 2.0049 2.0590 2.0590 2.0641 2.0641 3.1108 3.1108 3.1216 3.1216 3.6669 3.6669 3.6728 3.6728 3.9868 3.9868 4.0088 4.0088 4.0178 4.0178 4.0337 4.0337 5.9905 5.9905 6.0553 6.0553 6.1741 6.1741 6.2269 6.2269 11.0652 11.0652 11.0807 11.0807 11.6858 11.6858 11.7014 11.7014 13.8938 13.8938 13.9165 13.9165 14.6922 14.6922 k = 0.4722 0.4722-0.0000 ( 6612 PWs) bands (ev): -18.5875 -18.5875 -18.5857 -18.5857 -15.1441 -15.1441 -15.1431 -15.1431 -5.4216 -5.4216 -5.3931 -5.3931 -3.6167 -3.6167 -3.6007 -3.6007 -3.3802 -3.3802 -3.3560 -3.3560 -1.1361 -1.1361 -1.1245 -1.1245 1.2985 1.2985 1.3050 1.3050 1.6776 1.6776 1.6799 1.6799 1.7617 1.7617 1.7647 1.7647 1.9991 1.9991 2.0038 2.0038 2.0575 2.0575 2.0678 2.0678 3.1070 3.1070 3.1251 3.1251 3.6639 3.6639 3.6738 3.6738 3.9742 3.9742 4.0093 4.0093 4.0240 4.0240 4.0453 4.0453 5.9501 5.9501 6.0704 6.0704 6.1805 6.1805 6.2747 6.2747 11.0620 11.0620 11.0869 11.0869 11.6864 11.6864 11.7099 11.7099 13.8739 13.8739 13.9158 13.9158 14.6786 14.6786 k = 0.4630 0.4630-0.0000 ( 6610 PWs) bands (ev): -18.5891 -18.5891 -18.5860 -18.5860 -15.1434 -15.1434 -15.1418 -15.1418 -5.4255 -5.4255 -5.3876 -5.3876 -3.6195 -3.6195 -3.5977 -3.5977 -3.3828 -3.3828 -3.3505 -3.3505 -1.1430 -1.1430 -1.1226 -1.1226 1.2980 1.2980 1.3094 1.3094 1.6733 1.6733 1.6770 1.6770 1.7623 1.7623 1.7671 1.7671 1.9961 1.9961 2.0020 2.0020 2.0553 2.0553 2.0728 2.0728 3.1022 3.1022 3.1295 3.1295 3.6600 3.6600 3.6748 3.6748 3.9609 3.9609 4.0099 4.0099 4.0326 4.0326 4.0573 4.0573 5.9090 5.9090 6.0914 6.0914 6.1897 6.1897 6.3264 6.3264 11.0587 11.0587 11.0946 11.0946 11.6887 11.6887 11.7198 11.7198 13.8483 13.8483 13.9142 13.9142 14.6608 14.6608 k = 0.4537 0.4537-0.0000 ( 6598 PWs) bands (ev): -18.5912 -18.5912 -18.5864 -18.5864 -15.1424 -15.1424 -15.1401 -15.1401 -5.4291 -5.4291 -5.3818 -5.3818 -3.6226 -3.6226 -3.5943 -3.5943 -3.3851 -3.3851 -3.3446 -3.3446 -1.1520 -1.1520 -1.1201 -1.1201 1.2975 1.2975 1.3149 1.3149 1.6683 1.6683 1.6734 1.6734 1.7632 1.7632 1.7699 1.7699 1.9926 1.9926 1.9996 1.9996 2.0525 2.0525 2.0789 2.0789 3.0966 3.0966 3.1348 3.1348 3.6552 3.6552 3.6757 3.6757 3.9467 3.9467 4.0108 4.0108 4.0437 4.0437 4.0697 4.0697 5.8686 5.8686 6.1177 6.1177 6.2015 6.2015 6.3804 6.3804 11.0556 11.0556 11.1037 11.1037 11.6924 11.6924 11.7309 11.7309 13.8186 13.8186 13.9117 13.9117 14.6396 14.6396 k = 0.4444 0.4444-0.0000 ( 6610 PWs) bands (ev): -18.5937 -18.5937 -18.5869 -18.5869 -15.1412 -15.1412 -15.1381 -15.1381 -5.4324 -5.4324 -5.3758 -5.3758 -3.6258 -3.6258 -3.5906 -3.5906 -3.3870 -3.3870 -3.3383 -3.3383 -1.1628 -1.1628 -1.1172 -1.1172 1.2968 1.2968 1.3214 1.3214 1.6627 1.6627 1.6691 1.6691 1.7641 1.7641 1.7727 1.7727 1.9889 1.9889 1.9966 1.9966 2.0493 2.0493 2.0859 2.0859 3.0900 3.0900 3.1412 3.1412 3.6494 3.6494 3.6764 3.6764 3.9315 3.9315 4.0118 4.0118 4.0572 4.0572 4.0828 4.0828 5.8296 5.8296 6.1488 6.1488 6.2164 6.2164 6.4361 6.4361 11.0529 11.0529 11.1143 11.1143 11.6974 11.6974 11.7428 11.7428 13.7862 13.7862 13.9080 13.9080 14.6158 14.6158 k = 0.4352 0.4352-0.0000 ( 6610 PWs) bands (ev): -18.5967 -18.5967 -18.5874 -18.5874 -15.1397 -15.1397 -15.1357 -15.1357 -5.4354 -5.4354 -5.3697 -5.3697 -3.6292 -3.6292 -3.5866 -3.5866 -3.3885 -3.3885 -3.3316 -3.3316 -1.1756 -1.1756 -1.1139 -1.1139 1.2960 1.2960 1.3290 1.3290 1.6567 1.6567 1.6643 1.6643 1.7650 1.7650 1.7756 1.7756 1.9849 1.9849 1.9931 1.9931 2.0455 2.0455 2.0937 2.0937 3.0828 3.0828 3.1486 3.1486 3.6426 3.6426 3.6769 3.6769 3.9154 3.9154 4.0129 4.0129 4.0732 4.0732 4.0969 4.0969 5.7922 5.7922 6.1838 6.1838 6.2348 6.2348 6.4931 6.4931 11.0510 11.0510 11.1261 11.1261 11.7035 11.7035 11.7551 11.7551 13.7524 13.7524 13.9029 13.9029 14.5902 14.5902 k = 0.4259 0.4259-0.0000 ( 6612 PWs) bands (ev): -18.6001 -18.6001 -18.5880 -18.5880 -15.1381 -15.1381 -15.1330 -15.1330 -5.4382 -5.4382 -5.3634 -5.3634 -3.6328 -3.6328 -3.5822 -3.5822 -3.3897 -3.3897 -3.3245 -3.3245 -1.1903 -1.1903 -1.1102 -1.1102 1.2952 1.2952 1.3375 1.3375 1.6505 1.6505 1.6589 1.6589 1.7658 1.7658 1.7785 1.7785 1.9808 1.9808 1.9891 1.9891 2.0414 2.0414 2.1021 2.1021 3.0751 3.0751 3.1571 3.1571 3.6348 3.6348 3.6768 3.6768 3.8983 3.8983 4.0142 4.0142 4.0917 4.0917 4.1119 4.1119 5.7568 5.7568 6.2202 6.2202 6.2589 6.2589 6.5513 6.5513 11.0503 11.0503 11.1389 11.1389 11.7104 11.7104 11.7674 11.7674 13.7185 13.7185 13.8963 13.8963 14.5634 14.5634 k = 0.4167 0.4167-0.0000 ( 6614 PWs) bands (ev): -18.6039 -18.6039 -18.5887 -18.5887 -15.1363 -15.1363 -15.1299 -15.1299 -5.4406 -5.4406 -5.3570 -5.3570 -3.6366 -3.6366 -3.5774 -3.5774 -3.3905 -3.3905 -3.3170 -3.3170 -1.2068 -1.2068 -1.1062 -1.1062 1.2944 1.2944 1.3470 1.3470 1.6442 1.6442 1.6532 1.6532 1.7667 1.7667 1.7814 1.7814 1.9765 1.9765 1.9846 1.9846 2.0371 2.0371 2.1110 2.1110 3.0669 3.0669 3.1667 3.1667 3.6260 3.6260 3.6761 3.6761 3.8802 3.8802 4.0155 4.0155 4.1124 4.1124 4.1283 4.1283 5.7234 5.7234 6.2534 6.2534 6.2927 6.2927 6.6105 6.6105 11.0511 11.0511 11.1525 11.1525 11.7181 11.7181 11.7794 11.7794 13.6853 13.6853 13.8884 13.8884 14.5357 14.5357 k = 0.4074 0.4074-0.0000 ( 6620 PWs) bands (ev): -18.6082 -18.6082 -18.5895 -18.5895 -15.1343 -15.1343 -15.1265 -15.1265 -5.4427 -5.4427 -5.3504 -5.3504 -3.6405 -3.6405 -3.5723 -3.5723 -3.3910 -3.3910 -3.3091 -3.3091 -1.2250 -1.2250 -1.1019 -1.1019 1.2935 1.2935 1.3571 1.3571 1.6379 1.6379 1.6472 1.6472 1.7674 1.7674 1.7840 1.7840 1.9720 1.9720 1.9797 1.9797 2.0326 2.0326 2.1204 2.1204 3.0586 3.0586 3.1773 3.1773 3.6163 3.6163 3.6746 3.6746 3.8610 3.8610 4.0168 4.0168 4.1349 4.1349 4.1464 4.1464 5.6923 5.6923 6.2824 6.2824 6.3368 6.3368 6.6705 6.6705 11.0539 11.0539 11.1666 11.1666 11.7262 11.7262 11.7907 11.7907 13.6539 13.6539 13.8792 13.8792 14.5069 14.5069 k = 0.3981 0.3981-0.0000 ( 6620 PWs) bands (ev): -18.6127 -18.6127 -18.5903 -18.5903 -15.1321 -15.1321 -15.1227 -15.1227 -5.4445 -5.4445 -5.3437 -5.3437 -3.6444 -3.6444 -3.5668 -3.5668 -3.3911 -3.3911 -3.3009 -3.3009 -1.2450 -1.2450 -1.0974 -1.0974 1.2928 1.2928 1.3678 1.3678 1.6317 1.6317 1.6410 1.6410 1.7681 1.7681 1.7866 1.7866 1.9672 1.9672 1.9746 1.9746 2.0282 2.0282 2.1300 2.1300 3.0503 3.0503 3.1889 3.1889 3.6057 3.6057 3.6721 3.6721 3.8409 3.8409 4.0182 4.0182 4.1580 4.1580 4.1677 4.1677 5.6634 5.6634 6.3105 6.3105 6.3872 6.3872 6.7312 6.7312 11.0588 11.0588 11.1809 11.1809 11.7345 11.7345 11.8012 11.8012 13.6249 13.6249 13.8694 13.8694 14.4764 14.4764 k = 0.3889 0.3889-0.0000 ( 6616 PWs) bands (ev): -18.6177 -18.6177 -18.5913 -18.5913 -15.1298 -15.1298 -15.1187 -15.1187 -5.4460 -5.4460 -5.3369 -5.3369 -3.6484 -3.6484 -3.5609 -3.5609 -3.3909 -3.3909 -3.2924 -3.2924 -1.2667 -1.2667 -1.0928 -1.0928 1.2920 1.2920 1.3791 1.3791 1.6255 1.6255 1.6348 1.6348 1.7687 1.7687 1.7891 1.7891 1.9620 1.9620 1.9695 1.9695 2.0239 2.0239 2.1397 2.1397 3.0422 3.0422 3.2016 3.2016 3.5943 3.5943 3.6685 3.6685 3.8198 3.8198 4.0196 4.0196 4.1800 4.1800 4.1937 4.1937 5.6370 5.6370 6.3397 6.3397 6.4417 6.4417 6.7925 6.7925 11.0663 11.0663 11.1950 11.1950 11.7428 11.7428 11.8109 11.8109 13.5990 13.5990 13.8595 13.8595 14.4425 14.4425 k = 0.3796 0.3796-0.0000 ( 6620 PWs) bands (ev): -18.6230 -18.6230 -18.5922 -18.5922 -15.1273 -15.1273 -15.1144 -15.1144 -5.4471 -5.4471 -5.3299 -5.3299 -3.6523 -3.6523 -3.5547 -3.5547 -3.3903 -3.3903 -3.2836 -3.2836 -1.2899 -1.2899 -1.0881 -1.0881 1.2914 1.2914 1.3905 1.3905 1.6194 1.6194 1.6287 1.6287 1.7691 1.7691 1.7913 1.7913 1.9561 1.9561 1.9647 1.9647 2.0198 2.0198 2.1493 2.1493 3.0346 3.0346 3.2152 3.2152 3.5820 3.5820 3.6635 3.6635 3.7980 3.7980 4.0209 4.0209 4.2022 4.2022 4.2231 4.2231 5.6132 5.6132 6.3706 6.3706 6.4988 6.4988 6.8543 6.8543 11.0765 11.0765 11.2086 11.2086 11.7507 11.7507 11.8198 11.8198 13.5768 13.5768 13.8502 13.8502 14.4001 14.4001 k = 0.3704 0.3704-0.0000 ( 6628 PWs) bands (ev): -18.6286 -18.6286 -18.5933 -18.5933 -15.1246 -15.1246 -15.1098 -15.1098 -5.4480 -5.4480 -5.3230 -5.3230 -3.6562 -3.6562 -3.5482 -3.5482 -3.3894 -3.3894 -3.2744 -3.2744 -1.3145 -1.3145 -1.0835 -1.0835 1.2909 1.2909 1.4019 1.4019 1.6131 1.6131 1.6231 1.6231 1.7695 1.7695 1.7934 1.7934 1.9495 1.9495 1.9604 1.9604 2.0161 2.0161 2.1586 2.1586 3.0276 3.0276 3.2297 3.2297 3.5689 3.5689 3.6571 3.6571 3.7753 3.7753 4.0222 4.0222 4.2255 4.2255 4.2550 4.2550 5.5919 5.5919 6.4036 6.4036 6.5578 6.5578 6.9164 6.9164 11.0897 11.0897 11.2214 11.2214 11.7579 11.7579 11.8281 11.8281 13.5586 13.5586 13.8421 13.8421 14.3299 14.3299 k = 0.3611 0.3611-0.0000 ( 6620 PWs) bands (ev): -18.6346 -18.6346 -18.5944 -18.5944 -15.1218 -15.1218 -15.1049 -15.1049 -5.4484 -5.4484 -5.3159 -5.3159 -3.6600 -3.6600 -3.5415 -3.5415 -3.3881 -3.3881 -3.2651 -3.2651 -1.3405 -1.3405 -1.0789 -1.0789 1.2906 1.2906 1.4130 1.4130 1.6067 1.6067 1.6183 1.6183 1.7699 1.7699 1.7952 1.7952 1.9424 1.9424 1.9566 1.9566 2.0128 2.0128 2.1675 2.1675 3.0215 3.0215 3.2452 3.2452 3.5552 3.5552 3.6492 3.6492 3.7521 3.7521 4.0234 4.0234 4.2502 4.2502 4.2888 4.2888 5.5733 5.5733 6.4386 6.4386 6.6182 6.6182 6.9786 6.9786 11.1060 11.1060 11.2331 11.2331 11.7643 11.7643 11.8362 11.8362 13.5447 13.5447 13.8356 13.8356 14.2256 14.2256 k = 0.3519 0.3519-0.0000 ( 6604 PWs) bands (ev): -18.6408 -18.6408 -18.5955 -18.5955 -15.1189 -15.1189 -15.0997 -15.0997 -5.4485 -5.4485 -5.3089 -5.3089 -3.6635 -3.6635 -3.5345 -3.5345 -3.3865 -3.3865 -3.2555 -3.2555 -1.3678 -1.3678 -1.0744 -1.0744 1.2904 1.2904 1.4237 1.4237 1.5999 1.5999 1.6145 1.6145 1.7703 1.7703 1.7968 1.7968 1.9350 1.9350 1.9533 1.9533 2.0100 2.0100 2.1758 2.1758 3.0165 3.0165 3.2615 3.2615 3.5407 3.5407 3.6396 3.6396 3.7285 3.7285 4.0244 4.0244 4.2766 4.2766 4.3243 4.3243 5.5573 5.5573 6.4757 6.4757 6.6793 6.6793 7.0409 7.0409 11.1255 11.1255 11.2436 11.2436 11.7697 11.7697 11.8444 11.8444 13.5350 13.5350 13.8306 13.8306 14.1121 14.1121 k = 0.3426 0.3426-0.0000 ( 6596 PWs) bands (ev): -18.6472 -18.6472 -18.5968 -18.5968 -15.1159 -15.1159 -15.0944 -15.0944 -5.4483 -5.4483 -5.3018 -5.3018 -3.6669 -3.6669 -3.5274 -3.5274 -3.3844 -3.3844 -3.2458 -3.2458 -1.3961 -1.3961 -1.0700 -1.0700 1.2903 1.2903 1.4336 1.4336 1.5929 1.5929 1.6116 1.6116 1.7707 1.7707 1.7982 1.7982 1.9276 1.9276 1.9504 1.9504 2.0077 2.0077 2.1833 2.1833 3.0126 3.0126 3.2787 3.2787 3.5256 3.5256 3.6283 3.6283 3.7045 3.7045 4.0253 4.0253 4.3048 4.3048 4.3613 4.3613 5.5441 5.5441 6.5149 6.5149 6.7407 6.7407 7.1031 7.1031 11.1483 11.1483 11.2528 11.2528 11.7743 11.7743 11.8528 11.8528 13.5291 13.5291 13.8254 13.8254 14.0003 14.0003 k = 0.3333 0.3333-0.0000 ( 6592 PWs) bands (ev): -18.6540 -18.6540 -18.5980 -18.5980 -15.1128 -15.1128 -15.0888 -15.0888 -5.4477 -5.4477 -5.2947 -5.2947 -3.6699 -3.6699 -3.5201 -3.5201 -3.3820 -3.3820 -3.2360 -3.2360 -1.4254 -1.4254 -1.0659 -1.0659 1.2905 1.2905 1.4424 1.4424 1.5857 1.5857 1.6096 1.6096 1.7712 1.7712 1.7993 1.7993 1.9204 1.9204 1.9479 1.9479 2.0058 2.0058 2.1897 2.1897 3.0101 3.0101 3.2966 3.2966 3.5100 3.5100 3.6151 3.6151 3.6805 3.6805 4.0261 4.0261 4.3348 4.3348 4.3994 4.3994 5.5336 5.5336 6.5562 6.5562 6.8020 6.8020 7.1649 7.1649 11.1740 11.1740 11.2609 11.2609 11.7785 11.7785 11.8615 11.8615 13.5254 13.5254 13.8086 13.8086 13.9051 13.9051 k = 0.3241 0.3241-0.0000 ( 6596 PWs) bands (ev): -18.6609 -18.6609 -18.5993 -18.5993 -15.1097 -15.1097 -15.0830 -15.0830 -5.4468 -5.4468 -5.2877 -5.2877 -3.6727 -3.6727 -3.5127 -3.5127 -3.3791 -3.3791 -3.2261 -3.2261 -1.4556 -1.4556 -1.0620 -1.0620 1.2908 1.2908 1.4500 1.4500 1.5783 1.5783 1.6083 1.6083 1.7717 1.7717 1.8004 1.8004 1.9137 1.9137 1.9459 1.9459 2.0045 2.0045 2.1949 2.1949 3.0089 3.0089 3.3152 3.3152 3.4938 3.4938 3.6001 3.6001 3.6566 3.6566 4.0266 4.0266 4.3668 4.3668 4.4385 4.4385 5.5259 5.5259 6.5995 6.5995 6.8626 6.8626 7.2262 7.2262 11.2018 11.2018 11.2687 11.2687 11.7830 11.7830 11.8704 11.8704 13.5192 13.5192 13.7450 13.7450 13.8663 13.8663 k = 0.3148 0.3148-0.0000 ( 6598 PWs) bands (ev): -18.6680 -18.6680 -18.6007 -18.6007 -15.1064 -15.1064 -15.0770 -15.0770 -5.4454 -5.4454 -5.2807 -5.2807 -3.6750 -3.6750 -3.5053 -3.5053 -3.3759 -3.3759 -3.2161 -3.2161 -1.4865 -1.4865 -1.0585 -1.0585 1.2913 1.2913 1.4562 1.4562 1.5709 1.5709 1.6076 1.6076 1.7720 1.7720 1.8017 1.8017 1.9075 1.9075 1.9443 1.9443 2.0037 2.0037 2.1989 2.1989 3.0092 3.0092 3.3344 3.3344 3.4772 3.4772 3.5833 3.5833 3.6331 3.6331 4.0270 4.0270 4.4008 4.4008 4.4782 4.4782 5.5209 5.5209 6.6448 6.6448 6.9223 6.9223 7.2868 7.2868 11.2291 11.2291 11.2788 11.2788 11.7886 11.7886 11.8795 11.8795 13.4957 13.4957 13.6640 13.6640 13.7366 13.7366 k = 0.3056 0.3056-0.0000 ( 6610 PWs) bands (ev): -18.6752 -18.6752 -18.6021 -18.6021 -15.1031 -15.1031 -15.0709 -15.0709 -5.4437 -5.4437 -5.2738 -5.2738 -3.6770 -3.6770 -3.4979 -3.4979 -3.3722 -3.3722 -3.2062 -3.2062 -1.5179 -1.5179 -1.0553 -1.0553 1.2920 1.2920 1.4610 1.4610 1.5634 1.5634 1.6071 1.6071 1.7717 1.7717 1.8038 1.8038 1.9021 1.9021 1.9432 1.9432 2.0035 2.0035 2.2015 2.2015 3.0109 3.0109 3.3541 3.3541 3.4602 3.4602 3.5647 3.5647 3.6101 3.6101 4.0271 4.0271 4.4368 4.4368 4.5183 4.5183 5.5186 5.5186 6.6921 6.6921 6.9807 6.9807 7.3464 7.3464 11.2486 11.2486 11.2986 11.2986 11.7960 11.7960 11.8886 11.8886 13.4314 13.4314 13.5422 13.5422 13.6509 13.6509 k = 0.2963 0.2963-0.0000 ( 6602 PWs) bands (ev): -18.6826 -18.6826 -18.6035 -18.6035 -15.0997 -15.0997 -15.0646 -15.0646 -5.4417 -5.4417 -5.2669 -5.2669 -3.6785 -3.6785 -3.4906 -3.4906 -3.3681 -3.3681 -3.1964 -3.1964 -1.5497 -1.5497 -1.0524 -1.0524 1.2929 1.2929 1.4645 1.4645 1.5559 1.5559 1.6065 1.6065 1.7704 1.7704 1.8074 1.8074 1.8977 1.8977 1.9425 1.9425 2.0040 2.0040 2.2027 2.2027 3.0140 3.0140 3.3741 3.3741 3.4429 3.4429 3.5446 3.5446 3.5877 3.5877 4.0271 4.0271 4.4749 4.4749 4.5584 4.5584 5.5189 5.5189 6.7413 6.7413 7.0377 7.0377 7.4049 7.4049 11.2571 11.2571 11.3315 11.3315 11.8060 11.8060 11.8976 11.8976 13.3315 13.3315 13.3754 13.3754 13.6470 13.6470 k = 0.2870 0.2870-0.0000 ( 6590 PWs) bands (ev): -18.6901 -18.6901 -18.6049 -18.6049 -15.0964 -15.0964 -15.0581 -15.0581 -5.4393 -5.4393 -5.2603 -5.2603 -3.6795 -3.6795 -3.4834 -3.4834 -3.3635 -3.3635 -3.1868 -3.1868 -1.5817 -1.5817 -1.0499 -1.0499 1.2939 1.2939 1.4669 1.4669 1.5483 1.5483 1.6056 1.6056 1.7677 1.7677 1.8128 1.8128 1.8942 1.8942 1.9423 1.9423 2.0051 2.0051 2.2024 2.2024 3.0184 3.0184 3.3939 3.3939 3.4256 3.4256 3.5237 3.5237 3.5659 3.5659 4.0268 4.0268 4.5152 4.5152 4.5983 4.5983 5.5219 5.5219 6.7923 6.7923 7.0930 7.0930 7.4619 7.4619 11.2598 11.2598 11.3718 11.3718 11.8195 11.8195 11.9064 11.9064 13.1831 13.1831 13.2412 13.2412 13.6619 13.6619 k = 0.2778 0.2778-0.0000 ( 6582 PWs) bands (ev): -18.6976 -18.6976 -18.6064 -18.6064 -15.0929 -15.0929 -15.0516 -15.0516 -5.4365 -5.4365 -5.2537 -5.2537 -3.6799 -3.6799 -3.4764 -3.4764 -3.3585 -3.3585 -3.1773 -3.1773 -1.6138 -1.6138 -1.0478 -1.0478 1.2952 1.2952 1.4682 1.4682 1.5408 1.5408 1.6041 1.6041 1.7637 1.7637 1.8199 1.8199 1.8915 1.8915 1.9425 1.9425 2.0069 2.0069 2.2007 2.2007 3.0237 3.0237 3.4043 3.4043 3.4167 3.4167 3.5031 3.5031 3.5444 3.5444 4.0263 4.0263 4.5578 4.5578 4.6377 4.6377 5.5276 5.5276 6.8452 6.8452 7.1466 7.1466 7.5172 7.5172 11.2603 11.2603 11.4162 11.4162 11.8370 11.8370 11.9151 11.9151 13.0070 13.0070 13.1308 13.1308 13.5730 13.5730 k = 0.2685 0.2685-0.0000 ( 6572 PWs) bands (ev): -18.7053 -18.7053 -18.6079 -18.6079 -15.0895 -15.0895 -15.0450 -15.0450 -5.4333 -5.4333 -5.2474 -5.2474 -3.6798 -3.6798 -3.4697 -3.4697 -3.3530 -3.3530 -3.1681 -3.1681 -1.6458 -1.6458 -1.0461 -1.0461 1.2966 1.2966 1.4687 1.4687 1.5332 1.5332 1.6018 1.6018 1.7587 1.7587 1.8285 1.8285 1.8897 1.8897 1.9431 1.9431 2.0095 2.0095 2.1977 2.1977 3.0300 3.0300 3.3882 3.3882 3.4304 3.4304 3.4862 3.4862 3.5233 3.5233 4.0256 4.0256 4.6025 4.6025 4.6762 4.6762 5.5358 5.5358 6.8998 6.8998 7.1984 7.1984 7.5706 7.5706 11.2595 11.2595 11.4633 11.4633 11.8590 11.8590 11.9238 11.9238 12.8281 12.8281 13.0232 13.0232 13.4670 13.4670 k = 0.2593 0.2593-0.0000 ( 6554 PWs) bands (ev): -18.7129 -18.7129 -18.6094 -18.6094 -15.0861 -15.0861 -15.0384 -15.0384 -5.4298 -5.4298 -5.2412 -5.2412 -3.6792 -3.6792 -3.4633 -3.4633 -3.3472 -3.3472 -3.1593 -3.1593 -1.6776 -1.6776 -1.0448 -1.0448 1.2982 1.2982 1.4686 1.4686 1.5256 1.5256 1.5988 1.5988 1.7530 1.7530 1.8380 1.8380 1.8887 1.8887 1.9441 1.9441 2.0129 2.0129 2.1934 2.1934 3.0368 3.0368 3.3701 3.3701 3.4321 3.4321 3.4830 3.4830 3.5029 3.5029 4.0247 4.0247 4.6496 4.6496 4.7136 4.7136 5.5465 5.5465 6.9562 6.9562 7.2487 7.2487 7.6217 7.6217 11.2579 11.2579 11.5122 11.5122 11.8850 11.8850 11.9330 11.9330 12.6489 12.6489 12.9183 12.9183 13.3586 13.3586 k = 0.2500 0.2500-0.0000 ( 6571 PWs) bands (ev): -18.7206 -18.7206 -18.6109 -18.6109 -15.0827 -15.0827 -15.0317 -15.0317 -5.4259 -5.4259 -5.2353 -5.2353 -3.6779 -3.6779 -3.4571 -3.4571 -3.3409 -3.3409 -3.1508 -3.1508 -1.7089 -1.7089 -1.0439 -1.0439 1.2999 1.2999 1.4678 1.4678 1.5178 1.5178 1.5949 1.5949 1.7468 1.7468 1.8477 1.8477 1.8883 1.8883 1.9454 1.9454 2.0172 2.0172 2.1878 2.1878 3.0438 3.0438 3.3519 3.3519 3.4173 3.4173 3.4806 3.4806 3.4988 3.4988 4.0235 4.0235 4.6988 4.6988 4.7495 4.7495 5.5598 5.5598 7.0141 7.0141 7.2974 7.2974 7.6702 7.6702 11.2556 11.2556 11.5622 11.5622 11.9121 11.9121 11.9458 11.9458 12.4706 12.4706 12.8169 12.8169 13.2481 13.2481 k = 0.2407 0.2407-0.0000 ( 6573 PWs) bands (ev): -18.7282 -18.7282 -18.6124 -18.6124 -15.0794 -15.0794 -15.0250 -15.0250 -5.4217 -5.4217 -5.2297 -5.2297 -3.6760 -3.6760 -3.4513 -3.4513 -3.3343 -3.3343 -3.1429 -3.1429 -1.7398 -1.7398 -1.0434 -1.0434 1.3017 1.3017 1.4666 1.4666 1.5101 1.5101 1.5904 1.5904 1.7405 1.7405 1.8571 1.8571 1.8890 1.8890 1.9470 1.9470 2.0224 2.0224 2.1813 2.1813 3.0508 3.0508 3.3335 3.3335 3.3971 3.3971 3.4610 3.4610 3.5185 3.5185 4.0222 4.0222 4.7501 4.7501 4.7841 4.7841 5.5756 5.5756 7.0736 7.0736 7.3449 7.3449 7.7160 7.7160 11.2525 11.2525 11.6124 11.6124 11.9292 11.9292 11.9721 11.9721 12.2947 12.2947 12.7200 12.7200 13.1359 13.1359 k = 0.2315 0.2315-0.0000 ( 6575 PWs) bands (ev): -18.7358 -18.7358 -18.6139 -18.6139 -15.0761 -15.0761 -15.0183 -15.0183 -5.4171 -5.4171 -5.2243 -5.2243 -3.6734 -3.6734 -3.4459 -3.4459 -3.3274 -3.3274 -3.1354 -3.1354 -1.7699 -1.7699 -1.0433 -1.0433 1.3035 1.3035 1.4651 1.4651 1.5024 1.5024 1.5854 1.5854 1.7342 1.7342 1.8651 1.8651 1.8910 1.8910 1.9490 1.9490 2.0287 2.0287 2.1740 2.1740 3.0575 3.0575 3.3152 3.3152 3.3759 3.3759 3.4415 3.4415 3.5406 3.5406 4.0206 4.0206 4.8015 4.8015 4.8187 4.8187 5.5938 5.5938 7.1346 7.1346 7.3915 7.3915 7.7588 7.7588 11.2480 11.2480 11.6619 11.6619 11.9301 11.9301 12.0121 12.0121 12.1278 12.1278 12.6291 12.6291 13.0225 13.0225 k = 0.2222 0.2222-0.0000 ( 6575 PWs) bands (ev): -18.7433 -18.7433 -18.6154 -18.6154 -15.0728 -15.0728 -15.0116 -15.0116 -5.4122 -5.4122 -5.2193 -5.2193 -3.6702 -3.6702 -3.4408 -3.4408 -3.3203 -3.3203 -3.1285 -3.1285 -1.7993 -1.7993 -1.0435 -1.0435 1.3055 1.3055 1.4633 1.4633 1.4946 1.4946 1.5800 1.5800 1.7281 1.7281 1.8706 1.8706 1.8951 1.8951 1.9513 1.9513 2.0359 2.0359 2.1660 2.1660 3.0635 3.0635 3.2970 3.2970 3.3548 3.3548 3.4226 3.4226 3.5635 3.5635 4.0189 4.0189 4.8409 4.8409 4.8653 4.8653 5.6144 5.6144 7.1969 7.1969 7.4374 7.4374 7.7983 7.7983 11.2411 11.2411 11.7097 11.7097 11.8797 11.8797 12.0048 12.0048 12.0661 12.0661 12.5457 12.5457 12.9081 12.9081 k = 0.2130 0.2130-0.0000 ( 6589 PWs) bands (ev): -18.7507 -18.7507 -18.6169 -18.6169 -15.0696 -15.0696 -15.0050 -15.0050 -5.4069 -5.4069 -5.2146 -5.2146 -3.6663 -3.6663 -3.4360 -3.4360 -3.3131 -3.3131 -3.1223 -3.1223 -1.8277 -1.8277 -1.0441 -1.0441 1.3076 1.3076 1.4611 1.4611 1.4870 1.4870 1.5742 1.5742 1.7224 1.7224 1.8736 1.8736 1.9008 1.9008 1.9537 1.9537 2.0441 2.0441 2.1576 2.1576 3.0685 3.0685 3.2789 3.2789 3.3342 3.3342 3.4045 3.4045 3.5868 3.5868 4.0170 4.0170 4.8693 4.8693 4.9227 4.9227 5.6374 5.6374 7.2606 7.2606 7.4831 7.4831 7.8344 7.8344 11.2307 11.2307 11.7331 11.7331 11.7551 11.7551 11.9846 11.9846 12.1196 12.1196 12.4719 12.4719 12.7932 12.7932 k = 0.2037 0.2037-0.0000 ( 6573 PWs) bands (ev): -18.7579 -18.7579 -18.6184 -18.6184 -15.0664 -15.0664 -14.9985 -14.9985 -5.4014 -5.4014 -5.2103 -5.2103 -3.6617 -3.6617 -3.4316 -3.4316 -3.3059 -3.3059 -3.1167 -3.1167 -1.8550 -1.8550 -1.0451 -1.0451 1.3097 1.3097 1.4587 1.4587 1.4795 1.4795 1.5684 1.5684 1.7173 1.7173 1.8751 1.8751 1.9073 1.9073 1.9562 1.9562 2.0531 2.0531 2.1492 2.1492 3.0723 3.0723 3.2611 3.2611 3.3143 3.3143 3.3876 3.3876 3.6103 3.6103 4.0150 4.0150 4.8938 4.8938 4.9835 4.9835 5.6626 5.6626 7.3254 7.3254 7.5289 7.5289 7.8669 7.8669 11.2149 11.2149 11.5657 11.5657 11.7945 11.7945 11.9863 11.9863 12.1802 12.1802 12.4097 12.4097 12.6781 12.6781 k = 0.1944 0.1944-0.0000 ( 6575 PWs) bands (ev): -18.7651 -18.7651 -18.6198 -18.6198 -15.0634 -15.0634 -14.9920 -14.9920 -5.3956 -5.3956 -5.2063 -5.2063 -3.6565 -3.6565 -3.4274 -3.4274 -3.2987 -3.2987 -3.1118 -3.1118 -1.8812 -1.8812 -1.0463 -1.0463 1.3118 1.3118 1.4557 1.4557 1.4723 1.4723 1.5623 1.5623 1.7126 1.7126 1.8756 1.8756 1.9135 1.9135 1.9587 1.9587 2.0624 2.0624 2.1412 2.1412 3.0748 3.0748 3.2435 3.2435 3.2951 3.2951 3.3718 3.3718 3.6338 3.6338 4.0129 4.0129 4.9152 4.9152 5.0468 5.0468 5.6902 5.6902 7.3913 7.3913 7.5751 7.5751 7.8959 7.8959 11.1922 11.1922 11.3956 11.3956 11.8277 11.8277 11.9920 11.9920 12.2462 12.2462 12.3613 12.3613 12.5632 12.5632 k = 0.1852 0.1852-0.0000 ( 6567 PWs) bands (ev): -18.7720 -18.7720 -18.6212 -18.6212 -15.0604 -15.0604 -14.9857 -14.9857 -5.3895 -5.3895 -5.2027 -5.2027 -3.6506 -3.6506 -3.4236 -3.4236 -3.2917 -3.2917 -3.1077 -3.1077 -1.9061 -1.9061 -1.0479 -1.0479 1.3141 1.3141 1.4521 1.4521 1.4657 1.4657 1.5563 1.5563 1.7086 1.7086 1.8756 1.8756 1.9192 1.9192 1.9608 1.9608 2.0714 2.0714 2.1343 2.1343 3.0759 3.0759 3.2262 3.2262 3.2768 3.2768 3.3573 3.3573 3.6573 3.6573 4.0107 4.0107 4.9334 4.9334 5.1124 5.1124 5.7198 5.7198 7.4582 7.4582 7.6222 7.6222 7.9212 7.9212 11.1600 11.1600 11.2273 11.2273 11.8518 11.8518 11.9993 11.9993 12.3144 12.3144 12.3312 12.3312 12.4491 12.4491 k = 0.1759 0.1759-0.0000 ( 6565 PWs) bands (ev): -18.7788 -18.7788 -18.6226 -18.6226 -15.0575 -15.0575 -14.9795 -14.9795 -5.3831 -5.3831 -5.1996 -5.1996 -3.6441 -3.6441 -3.4200 -3.4200 -3.2851 -3.2851 -3.1042 -3.1042 -1.9297 -1.9297 -1.0496 -1.0496 1.3162 1.3162 1.4474 1.4474 1.4600 1.4600 1.5502 1.5502 1.7052 1.7052 1.8753 1.8753 1.9242 1.9242 1.9625 1.9625 2.0789 2.0789 2.1299 2.1299 3.0755 3.0755 3.2093 3.2093 3.2593 3.2593 3.3440 3.3440 3.6806 3.6806 4.0084 4.0084 4.9485 4.9485 5.1801 5.1801 5.7515 5.7515 7.5257 7.5257 7.6703 7.6703 7.9429 7.9429 11.0559 11.0559 11.1234 11.1234 11.8647 11.8647 12.0075 12.0075 12.3070 12.3070 12.3386 12.3386 12.3959 12.3959 k = 0.1667 0.1667-0.0000 ( 6563 PWs) bands (ev): -18.7854 -18.7854 -18.6240 -18.6240 -15.0548 -15.0548 -14.9735 -14.9735 -5.3766 -5.3766 -5.1969 -5.1969 -3.6369 -3.6369 -3.4167 -3.4167 -3.2788 -3.2788 -3.1014 -3.1014 -1.9519 -1.9519 -1.0516 -1.0516 1.3184 1.3184 1.4416 1.4416 1.4555 1.4555 1.5442 1.5442 1.7026 1.7026 1.8748 1.8748 1.9285 1.9285 1.9634 1.9634 2.0829 2.0829 2.1299 2.1299 3.0739 3.0739 3.1929 3.1929 3.2427 3.2427 3.3320 3.3320 3.7037 3.7037 4.0061 4.0061 4.9606 4.9606 5.2498 5.2498 5.7851 5.7851 7.5939 7.5939 7.7197 7.7197 7.9611 7.9611 10.8916 10.8916 11.0728 11.0728 11.8641 11.8641 12.0165 12.0165 12.2198 12.2198 12.3143 12.3143 12.4775 12.4775 k = 0.1574 0.1574-0.0000 ( 6567 PWs) bands (ev): -18.7917 -18.7917 -18.6253 -18.6253 -15.0521 -15.0521 -14.9677 -14.9677 -5.3698 -5.3698 -5.1947 -5.1947 -3.6292 -3.6292 -3.4136 -3.4136 -3.2732 -3.2732 -3.0992 -3.0992 -1.9726 -1.9726 -1.0538 -1.0538 1.3205 1.3205 1.4351 1.4351 1.4518 1.4518 1.5383 1.5383 1.7006 1.7006 1.8742 1.8742 1.9321 1.9321 1.9633 1.9633 2.0829 2.0829 2.1349 2.1349 3.0712 3.0712 3.1770 3.1770 3.2268 3.2268 3.3211 3.3211 3.7265 3.7265 4.0037 4.0037 4.9697 4.9697 5.3212 5.3212 5.8204 5.8204 7.6624 7.6624 7.7706 7.7706 7.9760 7.9760 10.7291 10.7291 11.0149 11.0149 11.8490 11.8490 12.0256 12.0256 12.1101 12.1101 12.3305 12.3305 12.5649 12.5649 k = 0.1481 0.1481-0.0000 ( 6567 PWs) bands (ev): -18.7977 -18.7977 -18.6265 -18.6265 -15.0496 -15.0496 -14.9621 -14.9621 -5.3628 -5.3628 -5.1929 -5.1929 -3.6209 -3.6209 -3.4107 -3.4107 -3.2682 -3.2682 -3.0976 -3.0976 -1.9918 -1.9918 -1.0561 -1.0561 1.3226 1.3226 1.4282 1.4282 1.4486 1.4486 1.5326 1.5326 1.6993 1.6993 1.8733 1.8733 1.9352 1.9352 1.9622 1.9622 2.0804 2.0804 2.1434 2.1434 3.0677 3.0677 3.1617 3.1617 3.2118 3.2118 3.3110 3.3110 3.7488 3.7488 4.0014 4.0014 4.9759 4.9759 5.3942 5.3942 5.8572 5.8572 7.7309 7.7309 7.8230 7.8230 7.9879 7.9879 10.5695 10.5695 10.9504 10.9504 11.8189 11.8189 11.9963 11.9963 12.0406 12.0406 12.3623 12.3623 12.6572 12.6572 k = 0.1389 0.1389-0.0000 ( 6561 PWs) bands (ev): -18.8035 -18.8035 -18.6277 -18.6277 -15.0472 -15.0472 -14.9567 -14.9567 -5.3557 -5.3557 -5.1917 -5.1917 -3.6121 -3.6121 -3.4079 -3.4079 -3.2641 -3.2641 -3.0965 -3.0965 -2.0095 -2.0095 -1.0585 -1.0585 1.3246 1.3246 1.4214 1.4214 1.4456 1.4456 1.5271 1.5271 1.6987 1.6987 1.8724 1.8724 1.9376 1.9376 1.9601 1.9601 2.0772 2.0772 2.1537 2.1537 3.0636 3.0636 3.1470 3.1470 3.1977 3.1977 3.3016 3.3016 3.7707 3.7707 3.9991 3.9991 4.9794 4.9794 5.4686 5.4686 5.8952 5.8952 7.7992 7.7992 7.8769 7.8769 7.9968 7.9968 10.4134 10.4134 10.8810 10.8810 11.7750 11.7750 11.8910 11.8910 12.0497 12.0497 12.4077 12.4077 12.7537 12.7537 k = 0.1296 0.1296-0.0000 ( 6569 PWs) bands (ev): -18.8091 -18.8091 -18.6289 -18.6289 -15.0449 -15.0449 -14.9516 -14.9516 -5.3485 -5.3485 -5.1909 -5.1909 -3.6029 -3.6029 -3.4053 -3.4053 -3.2611 -3.2611 -3.0957 -3.0957 -2.0258 -2.0258 -1.0610 -1.0610 1.3265 1.3265 1.4145 1.4145 1.4428 1.4428 1.5217 1.5217 1.6987 1.6987 1.8713 1.8713 1.9390 1.9390 1.9573 1.9573 2.0743 2.0743 2.1646 2.1646 3.0592 3.0592 3.1330 3.1330 3.1844 3.1844 3.2926 3.2926 3.7919 3.7919 3.9969 3.9969 4.9806 4.9806 5.5440 5.5440 5.9341 5.9341 7.8665 7.8665 7.9324 7.9324 8.0035 8.0035 10.2611 10.2611 10.8085 10.8085 11.7191 11.7191 11.7865 11.7865 12.0610 12.0610 12.4648 12.4648 12.8523 12.8523 k = 0.1204 0.1204-0.0000 ( 6575 PWs) bands (ev): -18.8143 -18.8143 -18.6300 -18.6300 -15.0427 -15.0427 -14.9467 -14.9467 -5.3412 -5.3412 -5.1905 -5.1905 -3.5932 -3.5932 -3.4027 -3.4027 -3.2592 -3.2592 -3.0951 -3.0951 -2.0405 -2.0405 -1.0636 -1.0636 1.3284 1.3284 1.4078 1.4078 1.4402 1.4402 1.5166 1.5166 1.6992 1.6992 1.8702 1.8702 1.9387 1.9387 1.9547 1.9547 2.0722 2.0722 2.1755 2.1755 3.0548 3.0548 3.1197 3.1197 3.1721 3.1721 3.2839 3.2839 3.8123 3.8123 3.9949 3.9949 4.9795 4.9795 5.6201 5.6201 5.9737 5.9737 7.9319 7.9319 7.9893 7.9893 8.0088 8.0088 10.1132 10.1132 10.7345 10.7345 11.6532 11.6532 11.6853 11.6853 12.0728 12.0728 12.5319 12.5319 12.9359 12.9359 k = 0.1111 0.1111-0.0000 ( 6559 PWs) bands (ev): -18.8191 -18.8191 -18.6310 -18.6310 -15.0407 -15.0407 -14.9421 -14.9421 -5.3339 -5.3339 -5.1907 -5.1907 -3.5833 -3.5833 -3.4001 -3.4001 -3.2585 -3.2585 -3.0947 -3.0947 -2.0538 -2.0538 -1.0661 -1.0661 1.3302 1.3302 1.4015 1.4015 1.4379 1.4379 1.5117 1.5117 1.7003 1.7003 1.8689 1.8689 1.9360 1.9360 1.9536 1.9536 2.0710 2.0710 2.1862 2.1862 3.0505 3.0505 3.1072 3.1072 3.1608 3.1608 3.2754 3.2754 3.8319 3.8319 3.9931 3.9931 4.9766 4.9766 5.6964 5.6964 6.0134 6.0134 7.9872 7.9872 8.0203 8.0203 8.0474 8.0474 9.9701 9.9701 10.6607 10.6607 11.5761 11.5761 11.5918 11.5918 12.0850 12.0850 12.6073 12.6073 12.9514 12.9514 k = 0.1019 0.1019-0.0000 ( 6555 PWs) bands (ev): -18.8237 -18.8237 -18.6320 -18.6320 -15.0389 -15.0389 -14.9378 -14.9378 -5.3265 -5.3265 -5.1913 -5.1913 -3.5732 -3.5732 -3.3976 -3.3976 -3.2592 -3.2592 -3.0942 -3.0942 -2.0657 -2.0657 -1.0686 -1.0686 1.3318 1.3318 1.3955 1.3955 1.4357 1.4357 1.5070 1.5070 1.7019 1.7019 1.8674 1.8674 1.9309 1.9309 1.9540 1.9540 2.0704 2.0704 2.1963 2.1963 3.0465 3.0465 3.0955 3.0955 3.1505 3.1505 3.2669 3.2669 3.8505 3.8505 3.9915 3.9915 4.9721 4.9721 5.7724 5.7724 6.0529 6.0529 8.0020 8.0020 8.0687 8.0687 8.1063 8.1063 9.8325 9.8325 10.5883 10.5883 11.4860 11.4860 11.5109 11.5109 12.0972 12.0972 12.6894 12.6894 12.9453 12.9453 k = 0.0926 0.0926-0.0000 ( 6563 PWs) bands (ev): -18.8279 -18.8279 -18.6328 -18.6328 -15.0372 -15.0372 -14.9339 -14.9339 -5.3192 -5.3192 -5.1923 -5.1923 -3.5630 -3.5630 -3.3949 -3.3949 -3.2613 -3.2613 -3.0937 -3.0937 -2.0762 -2.0762 -1.0711 -1.0711 1.3333 1.3333 1.3897 1.3897 1.4337 1.4337 1.5025 1.5025 1.7037 1.7037 1.8656 1.8656 1.9248 1.9248 1.9549 1.9549 2.0705 2.0705 2.2059 2.2059 3.0428 3.0428 3.0847 3.0847 3.1412 3.1412 3.2584 3.2584 3.8678 3.8678 3.9903 3.9903 4.9665 4.9665 5.8475 5.8475 6.0917 6.0917 8.0024 8.0024 8.1277 8.1277 8.1655 8.1655 9.7010 9.7010 10.5184 10.5184 11.3959 11.3959 11.4324 11.4324 12.1096 12.1096 12.7766 12.7766 12.9376 12.9376 k = 0.0833 0.0833-0.0000 ( 6555 PWs) bands (ev): -18.8317 -18.8317 -18.6337 -18.6337 -15.0356 -15.0356 -14.9302 -14.9302 -5.3120 -5.3120 -5.1938 -5.1938 -3.5528 -3.5528 -3.3920 -3.3920 -3.2648 -3.2648 -3.0930 -3.0930 -2.0855 -2.0855 -1.0734 -1.0734 1.3348 1.3348 1.3844 1.3844 1.4320 1.4320 1.4984 1.4984 1.7060 1.7060 1.8637 1.8637 1.9184 1.9184 1.9561 1.9561 2.0710 2.0710 2.2148 2.2148 3.0396 3.0396 3.0748 3.0748 3.1331 3.1331 3.2500 3.2500 3.8838 3.8838 3.9895 3.9895 4.9600 4.9600 5.9209 5.9209 6.1292 6.1292 8.0002 8.0002 8.1853 8.1853 8.2239 8.2239 9.5764 9.5764 10.4521 10.4521 11.3101 11.3101 11.3545 11.3545 12.1217 12.1217 12.8674 12.8674 12.9302 12.9302 k = 0.0741 0.0741-0.0000 ( 6557 PWs) bands (ev): -18.8352 -18.8352 -18.6344 -18.6344 -15.0342 -15.0342 -14.9269 -14.9269 -5.3050 -5.3050 -5.1956 -5.1956 -3.5429 -3.5429 -3.3889 -3.3889 -3.2696 -3.2696 -3.0923 -3.0923 -2.0935 -2.0935 -1.0756 -1.0756 1.3361 1.3361 1.3795 1.3795 1.4306 1.4306 1.4946 1.4946 1.7084 1.7084 1.8613 1.8613 1.9122 1.9122 1.9573 1.9573 2.0717 2.0717 2.2228 2.2228 3.0368 3.0368 3.0659 3.0659 3.1262 3.1262 3.2417 3.2417 3.8981 3.8981 3.9892 3.9892 4.9530 4.9530 5.9918 5.9918 6.1650 6.1650 7.9968 7.9968 8.2401 8.2401 8.2806 8.2806 9.4596 9.4596 10.3902 10.3902 11.2298 11.2298 11.2789 11.2789 12.1336 12.1336 12.9218 12.9218 12.9618 12.9618 k = 0.0648 0.0648-0.0000 ( 6557 PWs) bands (ev): -18.8382 -18.8382 -18.6351 -18.6351 -15.0329 -15.0329 -14.9240 -14.9240 -5.2981 -5.2981 -5.1978 -5.1978 -3.5334 -3.5334 -3.3855 -3.3855 -3.2755 -3.2755 -3.0914 -3.0914 -2.1004 -2.1004 -1.0776 -1.0776 1.3373 1.3373 1.3751 1.3751 1.4294 1.4294 1.4910 1.4910 1.7110 1.7110 1.8587 1.8587 1.9066 1.9066 1.9585 1.9585 2.0726 2.0726 2.2299 2.2299 3.0345 3.0345 3.0579 3.0579 3.1204 3.1204 3.2336 3.2336 3.9105 3.9105 3.9896 3.9896 4.9458 4.9458 6.0591 6.0591 6.1985 6.1985 7.9927 7.9927 8.2916 8.2916 8.3344 8.3344 9.3518 9.3518 10.3336 10.3336 11.1557 11.1557 11.2070 11.2070 12.1449 12.1449 12.9154 12.9154 13.0557 13.0557 k = 0.0556 0.0556-0.0000 ( 6553 PWs) bands (ev): -18.8409 -18.8409 -18.6356 -18.6356 -15.0318 -15.0318 -14.9214 -14.9214 -5.2916 -5.2916 -5.2002 -5.2002 -3.5245 -3.5245 -3.3816 -3.3816 -3.2824 -3.2824 -3.0905 -3.0905 -2.1062 -2.1062 -1.0794 -1.0794 1.3383 1.3383 1.3711 1.3711 1.4284 1.4284 1.4879 1.4879 1.7137 1.7137 1.8557 1.8557 1.9017 1.9017 1.9596 1.9596 2.0735 2.0735 2.2362 2.2362 3.0325 3.0325 3.0510 3.0510 3.1157 3.1157 3.2260 3.2260 3.9209 3.9209 3.9906 3.9906 4.9388 4.9388 6.1216 6.1216 6.2291 6.2291 7.9883 7.9883 8.3389 8.3389 8.3841 8.3841 9.2540 9.2540 10.2830 10.2830 11.0888 11.0888 11.1405 11.1405 12.1555 12.1555 12.9091 12.9091 13.1491 13.1491 k = 0.0463 0.0463-0.0000 ( 6561 PWs) bands (ev): -18.8432 -18.8432 -18.6361 -18.6361 -15.0309 -15.0309 -14.9193 -14.9193 -5.2856 -5.2856 -5.2028 -5.2028 -3.5165 -3.5165 -3.3771 -3.3771 -3.2900 -3.2900 -3.0895 -3.0895 -2.1109 -2.1109 -1.0810 -1.0810 1.3392 1.3392 1.3676 1.3676 1.4276 1.4276 1.4851 1.4851 1.7162 1.7162 1.8526 1.8526 1.8978 1.8978 1.9605 1.9605 2.0744 2.0744 2.2416 2.2416 3.0309 3.0309 3.0450 3.0450 3.1121 3.1121 3.2189 3.2189 3.9291 3.9291 3.9924 3.9924 4.9323 4.9323 6.1781 6.1781 6.2562 6.2562 7.9840 7.9840 8.3812 8.3812 8.4288 8.4288 9.1677 9.1677 10.2390 10.2390 11.0300 11.0300 11.0810 11.0810 12.1650 12.1650 12.9036 12.9036 13.2399 13.2399 k = 0.0370 0.0370-0.0000 ( 6573 PWs) bands (ev): -18.8451 -18.8451 -18.6365 -18.6365 -15.0302 -15.0302 -14.9175 -14.9175 -5.2801 -5.2801 -5.2054 -5.2054 -3.5095 -3.5095 -3.3721 -3.3721 -3.2981 -3.2981 -3.0887 -3.0887 -2.1148 -2.1148 -1.0824 -1.0824 1.3400 1.3400 1.3647 1.3647 1.4271 1.4271 1.4828 1.4828 1.7185 1.7185 1.8494 1.8494 1.8947 1.8947 1.9612 1.9612 2.0752 2.0752 2.2461 2.2461 3.0296 3.0296 3.0402 3.0402 3.1095 3.1095 3.2126 3.2126 3.9352 3.9352 3.9946 3.9946 4.9265 4.9265 6.2270 6.2270 6.2793 6.2793 7.9800 7.9800 8.4175 8.4175 8.4672 8.4672 9.0943 9.0943 10.2022 10.2022 10.9802 10.9802 11.0298 11.0298 12.1732 12.1732 12.8989 12.8989 13.3260 13.3260 k = 0.0278 0.0278-0.0000 ( 6583 PWs) bands (ev): -18.8466 -18.8466 -18.6368 -18.6368 -15.0296 -15.0296 -14.9160 -14.9160 -5.2754 -5.2754 -5.2079 -5.2079 -3.5039 -3.5039 -3.3666 -3.3666 -3.3063 -3.3063 -3.0879 -3.0879 -2.1177 -2.1177 -1.0834 -1.0834 1.3408 1.3408 1.3623 1.3623 1.4267 1.4267 1.4809 1.4809 1.7204 1.7204 1.8466 1.8466 1.8924 1.8924 1.9618 1.9618 2.0758 2.0758 2.2494 2.2494 3.0286 3.0286 3.0364 3.0364 3.1077 3.1077 3.2074 3.2074 3.9394 3.9394 3.9970 3.9970 4.9217 4.9217 6.2668 6.2668 6.2980 6.2980 7.9766 7.9766 8.4470 8.4470 8.4984 8.4984 9.0352 9.0352 10.1731 10.1731 10.9403 10.9403 10.9883 10.9883 12.1799 12.1799 12.8951 12.8951 13.4044 13.4044 k = 0.0185 0.0185-0.0000 ( 6591 PWs) bands (ev): -18.8476 -18.8476 -18.6371 -18.6371 -15.0292 -15.0292 -14.9150 -14.9150 -5.2718 -5.2718 -5.2100 -5.2100 -3.4998 -3.4998 -3.3611 -3.3611 -3.3141 -3.3141 -3.0874 -3.0874 -2.1197 -2.1197 -1.0842 -1.0842 1.3413 1.3413 1.3605 1.3605 1.4264 1.4264 1.4796 1.4796 1.7220 1.7220 1.8443 1.8443 1.8909 1.8909 1.9622 1.9622 2.0762 2.0762 2.2519 2.2519 3.0278 3.0278 3.0337 3.0337 3.1067 3.1067 3.2034 3.2034 3.9421 3.9421 3.9991 3.9991 4.9182 4.9182 6.2959 6.2959 6.3122 6.3122 7.9740 7.9740 8.4688 8.4688 8.5215 8.5215 8.9918 8.9918 10.1521 10.1521 10.9111 10.9111 10.9577 10.9577 12.1849 12.1849 12.8923 12.8923 13.4708 13.4708 k = 0.0093 0.0093-0.0000 ( 6601 PWs) bands (ev): -18.8483 -18.8483 -18.6372 -18.6372 -15.0289 -15.0289 -14.9144 -14.9144 -5.2694 -5.2694 -5.2114 -5.2114 -3.4972 -3.4972 -3.3563 -3.3563 -3.3202 -3.3202 -3.0870 -3.0870 -2.1210 -2.1210 -1.0847 -1.0847 1.3416 1.3416 1.3594 1.3594 1.4263 1.4263 1.4787 1.4787 1.7229 1.7229 1.8428 1.8428 1.8900 1.8900 1.9624 1.9624 2.0765 2.0765 2.2534 2.2534 3.0274 3.0274 3.0321 3.0321 3.1061 3.1061 3.2009 3.2009 3.9436 3.9436 4.0005 4.0005 4.9160 4.9160 6.3125 6.3125 6.3222 6.3222 7.9723 7.9723 8.4822 8.4822 8.5356 8.5356 8.9653 8.9653 10.1393 10.1393 10.8933 10.8933 10.9390 10.9390 12.1879 12.1879 12.8906 12.8906 13.5185 13.5185 k = 0.0000 0.0000 0.0000 ( 6601 PWs) bands (ev): -18.8485 -18.8485 -18.6372 -18.6372 -15.0288 -15.0288 -14.9142 -14.9142 -5.2686 -5.2686 -5.2119 -5.2119 -3.4964 -3.4964 -3.3542 -3.3542 -3.3227 -3.3227 -3.0869 -3.0869 -2.1214 -2.1214 -1.0848 -1.0848 1.3418 1.3418 1.3590 1.3590 1.4262 1.4262 1.4784 1.4784 1.7233 1.7233 1.8423 1.8423 1.8897 1.8897 1.9625 1.9625 2.0766 2.0766 2.2539 2.2539 3.0272 3.0272 3.0315 3.0315 3.1059 3.1059 3.2001 3.2001 3.9441 3.9441 4.0010 4.0010 4.9153 4.9153 6.3174 6.3174 6.3264 6.3264 7.9718 7.9718 8.4867 8.4867 8.5404 8.5404 8.9564 8.9564 10.1350 10.1350 10.8874 10.8874 10.9327 10.9327 12.1889 12.1889 12.8900 12.8900 13.5367 13.5367 k = 0.0000 0.0000 0.0000 ( 6601 PWs) bands (ev): -18.8485 -18.8485 -18.6372 -18.6372 -15.0288 -15.0288 -14.9142 -14.9142 -5.2686 -5.2686 -5.2119 -5.2119 -3.4964 -3.4964 -3.3542 -3.3542 -3.3227 -3.3227 -3.0869 -3.0869 -2.1214 -2.1214 -1.0848 -1.0848 1.3418 1.3418 1.3590 1.3590 1.4262 1.4262 1.4784 1.4784 1.7233 1.7233 1.8423 1.8423 1.8897 1.8897 1.9625 1.9625 2.0766 2.0766 2.2539 2.2539 3.0272 3.0272 3.0315 3.0315 3.1059 3.1059 3.2001 3.2001 3.9441 3.9441 4.0010 4.0010 4.9153 4.9153 6.3174 6.3174 6.3264 6.3264 7.9718 7.9718 8.4867 8.4867 8.5404 8.5404 8.9564 8.9564 10.1350 10.1350 10.8874 10.8874 10.9327 10.9327 12.1889 12.1889 12.8900 12.8900 13.5367 13.5367 k = 0.0000 0.0000 0.0129 ( 6605 PWs) bands (ev): -18.8485 -18.8485 -18.6372 -18.6372 -15.0288 -15.0288 -14.9142 -14.9142 -5.2685 -5.2685 -5.2120 -5.2120 -3.4964 -3.4964 -3.3542 -3.3542 -3.3225 -3.3225 -3.0869 -3.0869 -2.1217 -2.1217 -1.0846 -1.0846 1.3418 1.3418 1.3590 1.3590 1.4261 1.4261 1.4785 1.4785 1.7235 1.7235 1.8423 1.8423 1.8897 1.8897 1.9624 1.9624 2.0766 2.0766 2.2539 2.2539 3.0273 3.0273 3.0316 3.0316 3.1060 3.1060 3.1988 3.1988 3.9440 3.9440 4.0009 4.0009 4.9172 4.9172 6.3174 6.3174 6.3264 6.3264 7.9695 7.9695 8.4866 8.4866 8.5404 8.5404 8.9572 8.9572 10.1358 10.1358 10.8815 10.8815 10.9374 10.9374 12.1971 12.1971 12.8823 12.8823 13.5398 13.5398 k = 0.0000 0.0000 0.0259 ( 6601 PWs) bands (ev): -18.8485 -18.8485 -18.6372 -18.6372 -15.0288 -15.0288 -14.9142 -14.9142 -5.2683 -5.2683 -5.2124 -5.2124 -3.4965 -3.4965 -3.3542 -3.3542 -3.3217 -3.3217 -3.0869 -3.0869 -2.1227 -2.1227 -1.0841 -1.0841 1.3418 1.3418 1.3588 1.3588 1.4260 1.4260 1.4785 1.4785 1.7243 1.7243 1.8424 1.8424 1.8898 1.8898 1.9623 1.9623 2.0767 2.0767 2.2539 2.2539 3.0276 3.0276 3.0316 3.0316 3.1064 3.1064 3.1951 3.1951 3.9438 3.9438 4.0007 4.0007 4.9228 4.9228 6.3173 6.3173 6.3263 6.3263 7.9628 7.9628 8.4864 8.4864 8.5403 8.5403 8.9597 8.9597 10.1380 10.1380 10.8646 10.8646 10.9513 10.9513 12.2210 12.2210 12.8599 12.8599 13.5482 13.5482 k = 0.0000 0.0000 0.0388 ( 6597 PWs) bands (ev): -18.8485 -18.8485 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2679 -5.2679 -5.2130 -5.2130 -3.4967 -3.4967 -3.3542 -3.3542 -3.3204 -3.3204 -3.0869 -3.0869 -2.1243 -2.1243 -1.0832 -1.0832 1.3418 1.3418 1.3586 1.3586 1.4255 1.4255 1.4786 1.4786 1.7255 1.7255 1.8423 1.8423 1.8898 1.8898 1.9622 1.9622 2.0767 2.0767 2.2541 2.2541 3.0280 3.0280 3.0317 3.0317 3.1069 3.1069 3.1890 3.1890 3.9434 3.9434 4.0003 4.0003 4.9320 4.9320 6.3173 6.3173 6.3261 6.3261 7.9519 7.9519 8.4861 8.4861 8.5402 8.5402 8.9638 8.9638 10.1418 10.1418 10.8379 10.8379 10.9740 10.9740 12.2592 12.2592 12.8252 12.8252 13.5599 13.5599 k = 0.0000 0.0000 0.0517 ( 6580 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2673 -5.2673 -5.2139 -5.2139 -3.4970 -3.4970 -3.3542 -3.3542 -3.3186 -3.3186 -3.0869 -3.0869 -2.1264 -2.1264 -1.0820 -1.0820 1.3419 1.3419 1.3585 1.3585 1.4250 1.4250 1.4789 1.4789 1.7272 1.7272 1.8422 1.8422 1.8899 1.8899 1.9621 1.9621 2.0767 2.0767 2.2542 2.2542 3.0286 3.0286 3.0319 3.0319 3.1077 3.1077 3.1809 3.1809 3.9429 3.9429 3.9998 3.9998 4.9444 4.9444 6.3173 6.3173 6.3259 6.3259 7.9373 7.9373 8.4857 8.4857 8.5400 8.5400 8.9695 8.9695 10.1473 10.1473 10.8035 10.8035 11.0047 11.0047 12.3096 12.3096 12.7808 12.7808 13.5721 13.5721 k = 0.0000 0.0000 0.0646 ( 6592 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2666 -5.2666 -5.2150 -5.2150 -3.4973 -3.4973 -3.3542 -3.3542 -3.3165 -3.3165 -3.0868 -3.0868 -2.1291 -2.1291 -1.0805 -1.0805 1.3419 1.3419 1.3582 1.3582 1.4243 1.4243 1.4791 1.4791 1.7293 1.7293 1.8420 1.8420 1.8899 1.8899 1.9619 1.9619 2.0767 2.0767 2.2544 2.2544 3.0293 3.0293 3.0320 3.0320 3.1086 3.1086 3.1710 3.1710 3.9423 3.9423 3.9992 3.9992 4.9596 4.9596 6.3172 6.3172 6.3256 6.3256 7.9194 7.9194 8.4852 8.4852 8.5398 8.5398 8.9765 8.9765 10.1545 10.1545 10.7634 10.7634 11.0425 11.0425 12.3701 12.3701 12.7297 12.7297 13.5822 13.5822 k = 0.0000 0.0000 0.0776 ( 6584 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2657 -5.2657 -5.2163 -5.2163 -3.4976 -3.4976 -3.3543 -3.3543 -3.3140 -3.3140 -3.0868 -3.0868 -2.1321 -2.1321 -1.0789 -1.0789 1.3419 1.3419 1.3580 1.3580 1.4235 1.4235 1.4793 1.4793 1.7318 1.7318 1.8418 1.8418 1.8899 1.8899 1.9618 1.9618 2.0767 2.0767 2.2546 2.2546 3.0302 3.0302 3.0322 3.0322 3.1096 3.1096 3.1597 3.1597 3.9416 3.9416 3.9985 3.9985 4.9770 4.9770 6.3172 6.3172 6.3253 6.3253 7.8988 7.8988 8.4846 8.4846 8.5396 8.5396 8.9848 8.9848 10.1633 10.1633 10.7198 10.7198 11.0861 11.0861 12.4383 12.4383 12.6744 12.6744 13.5883 13.5883 k = 0.0000 0.0000 0.0905 ( 6584 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2647 -5.2647 -5.2178 -5.2178 -3.4980 -3.4980 -3.3543 -3.3543 -3.3113 -3.3113 -3.0868 -3.0868 -2.1355 -2.1355 -1.0770 -1.0770 1.3419 1.3419 1.3577 1.3577 1.4227 1.4227 1.4796 1.4796 1.7344 1.7344 1.8415 1.8415 1.8899 1.8899 1.9617 1.9617 2.0767 2.0767 2.2549 2.2549 3.0311 3.0311 3.0325 3.0325 3.1108 3.1108 3.1475 3.1475 3.9409 3.9409 3.9977 3.9977 4.9960 4.9960 6.3171 6.3171 6.3250 6.3250 7.8764 7.8764 8.4841 8.4841 8.5394 8.5394 8.9940 8.9940 10.1736 10.1736 10.6744 10.6744 11.1342 11.1342 12.5123 12.5123 12.6170 12.6170 13.5886 13.5886 k = 0.0000 0.0000 0.1034 ( 6596 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2635 -5.2635 -5.2194 -5.2194 -3.4984 -3.4984 -3.3543 -3.3543 -3.3084 -3.3084 -3.0868 -3.0868 -2.1390 -2.1390 -1.0751 -1.0751 1.3419 1.3419 1.3573 1.3573 1.4218 1.4218 1.4798 1.4798 1.7373 1.7373 1.8412 1.8412 1.8899 1.8899 1.9614 1.9614 2.0768 2.0768 2.2551 2.2551 3.0321 3.0321 3.0327 3.0327 3.1120 3.1120 3.1348 3.1348 3.9401 3.9401 3.9969 3.9969 5.0160 5.0160 6.3171 6.3171 6.3246 6.3246 7.8529 7.8529 8.4834 8.4834 8.5391 8.5391 9.0041 9.0041 10.1853 10.1853 10.6288 10.6288 11.1856 11.1856 12.5596 12.5596 12.5900 12.5900 13.5825 13.5825 k = 0.0000 0.0000 0.1163 ( 6572 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2623 -5.2623 -5.2212 -5.2212 -3.4987 -3.4987 -3.3543 -3.3543 -3.3055 -3.3055 -3.0867 -3.0867 -2.1426 -2.1426 -1.0731 -1.0731 1.3419 1.3419 1.3571 1.3571 1.4210 1.4210 1.4801 1.4801 1.7404 1.7404 1.8409 1.8409 1.8899 1.8899 1.9613 1.9613 2.0769 2.0769 2.2555 2.2555 3.0329 3.0329 3.0331 3.0331 3.1133 3.1133 3.1219 3.1219 3.9393 3.9393 3.9960 3.9960 5.0364 5.0364 6.3170 6.3170 6.3243 6.3243 7.8290 7.8290 8.4828 8.4828 8.5389 8.5389 9.0146 9.0146 10.1979 10.1979 10.5844 10.5844 11.2385 11.2385 12.5038 12.5038 12.6697 12.6697 13.5695 13.5695 k = 0.0000 0.0000 0.1293 ( 6568 PWs) bands (ev): -18.8484 -18.8484 -18.6373 -18.6373 -15.0288 -15.0288 -14.9142 -14.9142 -5.2610 -5.2610 -5.2230 -5.2230 -3.4991 -3.4991 -3.3543 -3.3543 -3.3026 -3.3026 -3.0867 -3.0867 -2.1462 -2.1462 -1.0712 -1.0712 1.3419 1.3419 1.3568 1.3568 1.4202 1.4202 1.4804 1.4804 1.7434 1.7434 1.8406 1.8406 1.8899 1.8899 1.9611 1.9611 2.0769 2.0769 2.2558 2.2558 3.0331 3.0331 3.0341 3.0341 3.1095 3.1095 3.1145 3.1145 3.9385 3.9385 3.9952 3.9952 5.0563 5.0563 6.3170 6.3170 6.3239 6.3239 7.8056 7.8056 8.4823 8.4823 8.5386 8.5386 9.0252 9.0252 10.2112 10.2112 10.5423 10.5423 11.2913 11.2913 12.4511 12.4511 12.7494 12.7494 13.5503 13.5503 k = 0.0000 0.0000 0.1422 ( 6568 PWs) bands (ev): -18.8484 -18.8484 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2596 -5.2596 -5.2249 -5.2249 -3.4994 -3.4994 -3.3543 -3.3543 -3.2999 -3.2999 -3.0867 -3.0867 -2.1495 -2.1495 -1.0694 -1.0694 1.3419 1.3419 1.3565 1.3565 1.4195 1.4195 1.4805 1.4805 1.7462 1.7462 1.8402 1.8402 1.8899 1.8899 1.9610 1.9610 2.0769 2.0769 2.2560 2.2560 3.0333 3.0333 3.0350 3.0350 3.0978 3.0978 3.1157 3.1157 3.9378 3.9378 3.9944 3.9944 5.0753 5.0753 6.3170 6.3170 6.3236 6.3236 7.7835 7.7835 8.4817 8.4817 8.5384 8.5384 9.0357 9.0357 10.2244 10.2244 10.5036 10.5036 11.3423 11.3423 12.4030 12.4030 12.8272 12.8272 13.5261 13.5261 k = 0.0000 0.0000 0.1551 ( 6560 PWs) bands (ev): -18.8484 -18.8484 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2581 -5.2581 -5.2267 -5.2267 -3.4997 -3.4997 -3.3544 -3.3544 -3.2974 -3.2974 -3.0866 -3.0866 -2.1526 -2.1526 -1.0678 -1.0678 1.3419 1.3419 1.3562 1.3562 1.4189 1.4189 1.4807 1.4807 1.7488 1.7488 1.8400 1.8400 1.8900 1.8900 1.9609 1.9609 2.0769 2.0769 2.2563 2.2563 3.0335 3.0335 3.0359 3.0359 3.0872 3.0872 3.1168 3.1168 3.9371 3.9371 3.9937 3.9937 5.0925 5.0925 6.3169 6.3169 6.3233 6.3233 7.7633 7.7633 8.4812 8.4812 8.5382 8.5382 9.0454 9.0454 10.2371 10.2371 10.4691 10.4691 11.3896 11.3896 12.3606 12.3606 12.9008 12.9008 13.4989 13.4989 k = 0.0000 0.0000 0.1680 ( 6576 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2568 -5.2568 -5.2285 -5.2285 -3.4999 -3.4999 -3.3544 -3.3544 -3.2953 -3.2953 -3.0866 -3.0866 -2.1553 -2.1553 -1.0664 -1.0664 1.3417 1.3417 1.3561 1.3561 1.4183 1.4183 1.4808 1.4808 1.7512 1.7512 1.8395 1.8395 1.8899 1.8899 1.9609 1.9609 2.0768 2.0768 2.2565 2.2565 3.0337 3.0337 3.0367 3.0367 3.0780 3.0780 3.1177 3.1177 3.9365 3.9365 3.9930 3.9930 5.1075 5.1075 6.3169 6.3169 6.3230 6.3230 7.7458 7.7458 8.4808 8.4808 8.5380 8.5380 9.0542 9.0542 10.2486 10.2486 10.4398 10.4398 11.4314 11.4314 12.3250 12.3250 12.9677 12.9677 13.4714 13.4714 k = 0.0000 0.0000 0.1810 ( 6580 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2555 -5.2555 -5.2300 -5.2300 -3.5001 -3.5001 -3.3544 -3.3544 -3.2935 -3.2935 -3.0866 -3.0866 -2.1574 -2.1574 -1.0652 -1.0652 1.3417 1.3417 1.3559 1.3559 1.4177 1.4177 1.4809 1.4809 1.7531 1.7531 1.8393 1.8393 1.8898 1.8898 1.9607 1.9607 2.0768 2.0768 2.2567 2.2567 3.0339 3.0339 3.0373 3.0373 3.0706 3.0706 3.1185 3.1185 3.9361 3.9361 3.9925 3.9925 5.1198 5.1198 6.3169 6.3169 6.3228 6.3228 7.7316 7.7316 8.4805 8.4805 8.5378 8.5378 9.0615 9.0615 10.2584 10.2584 10.4162 10.4162 11.4659 11.4659 12.2969 12.2969 13.0248 13.0248 13.4461 13.4461 k = 0.0000 0.0000 0.1939 ( 6576 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2544 -5.2544 -5.2313 -5.2313 -3.5003 -3.5003 -3.3544 -3.3544 -3.2922 -3.2922 -3.0866 -3.0866 -2.1591 -2.1591 -1.0644 -1.0644 1.3417 1.3417 1.3557 1.3557 1.4175 1.4175 1.4810 1.4810 1.7545 1.7545 1.8391 1.8391 1.8899 1.8899 1.9606 1.9606 2.0768 2.0768 2.2569 2.2569 3.0339 3.0339 3.0379 3.0379 3.0651 3.0651 3.1191 3.1191 3.9357 3.9357 3.9921 3.9921 5.1288 5.1288 6.3169 6.3169 6.3226 6.3226 7.7210 7.7210 8.4802 8.4802 8.5377 8.5377 9.0670 9.0670 10.2658 10.2658 10.3989 10.3989 11.4917 11.4917 12.2767 12.2767 13.0689 13.0689 13.4259 13.4259 k = 0.0000 0.0000 0.2068 ( 6568 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2537 -5.2537 -5.2321 -5.2321 -3.5004 -3.5004 -3.3544 -3.3544 -3.2914 -3.2914 -3.0866 -3.0866 -2.1600 -2.1600 -1.0639 -1.0639 1.3417 1.3417 1.3556 1.3556 1.4173 1.4173 1.4810 1.4810 1.7554 1.7554 1.8390 1.8390 1.8899 1.8899 1.9607 1.9607 2.0768 2.0768 2.2570 2.2570 3.0340 3.0340 3.0382 3.0382 3.0617 3.0617 3.1194 3.1194 3.9355 3.9355 3.9919 3.9919 5.1344 5.1344 6.3168 6.3168 6.3225 6.3225 7.7145 7.7145 8.4801 8.4801 8.5376 8.5376 9.0704 9.0704 10.2704 10.2704 10.3883 10.3883 11.5076 11.5076 12.2646 12.2646 13.0970 13.0970 13.4127 13.4127 k = 0.0000 0.0000 0.2197 ( 6568 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2535 -5.2535 -5.2324 -5.2324 -3.5004 -3.5004 -3.3544 -3.3544 -3.2911 -3.2911 -3.0866 -3.0866 -2.1604 -2.1604 -1.0637 -1.0637 1.3417 1.3417 1.3556 1.3556 1.4172 1.4172 1.4810 1.4810 1.7557 1.7557 1.8390 1.8390 1.8899 1.8899 1.9607 1.9607 2.0768 2.0768 2.2571 2.2571 3.0340 3.0340 3.0383 3.0383 3.0606 3.0606 3.1195 3.1195 3.9354 3.9354 3.9918 3.9918 5.1363 5.1363 6.3168 6.3168 6.3225 6.3225 7.7124 7.7124 8.4800 8.4800 8.5376 8.5376 9.0715 9.0715 10.2720 10.2720 10.3848 10.3848 11.5130 11.5130 12.2605 12.2605 13.1067 13.1067 13.4082 13.4082 k = 0.0000 0.0000 0.2197 ( 6568 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2535 -5.2535 -5.2324 -5.2324 -3.5004 -3.5004 -3.3544 -3.3544 -3.2911 -3.2911 -3.0866 -3.0866 -2.1604 -2.1604 -1.0637 -1.0637 1.3417 1.3417 1.3556 1.3556 1.4172 1.4172 1.4810 1.4810 1.7557 1.7557 1.8390 1.8390 1.8899 1.8899 1.9607 1.9607 2.0768 2.0768 2.2571 2.2571 3.0340 3.0340 3.0383 3.0383 3.0606 3.0606 3.1195 3.1195 3.9354 3.9354 3.9918 3.9918 5.1363 5.1363 6.3168 6.3168 6.3225 6.3225 7.7124 7.7124 8.4800 8.4800 8.5376 8.5376 9.0715 9.0715 10.2720 10.2720 10.3848 10.3848 11.5130 11.5130 12.2605 12.2605 13.1067 13.1067 13.4082 13.4082 k = 0.0000 0.0132 0.2197 ( 6566 PWs) bands (ev): -18.8481 -18.8481 -18.6374 -18.6374 -15.0289 -15.0289 -14.9144 -14.9144 -5.2554 -5.2554 -5.2308 -5.2308 -3.5016 -3.5016 -3.3539 -3.3539 -3.2910 -3.2910 -3.0866 -3.0866 -2.1599 -2.1599 -1.0636 -1.0636 1.3415 1.3415 1.3560 1.3560 1.4174 1.4174 1.4812 1.4812 1.7548 1.7548 1.8398 1.8398 1.8904 1.8904 1.9606 1.9606 2.0767 2.0767 2.2566 2.2566 3.0346 3.0346 3.0381 3.0381 3.0620 3.0620 3.1198 3.1198 3.9352 3.9352 3.9915 3.9915 5.1358 5.1358 6.3078 6.3078 6.3216 6.3216 7.7149 7.7149 8.4759 8.4759 8.5337 8.5337 9.0805 9.0805 10.2763 10.2763 10.3913 10.3913 11.5161 11.5161 12.2616 12.2616 13.0980 13.0980 13.3831 13.3831 k = 0.0000 0.0263 0.2197 ( 6558 PWs) bands (ev): -18.8475 -18.8475 -18.6372 -18.6372 -15.0291 -15.0291 -14.9150 -14.9150 -5.2601 -5.2601 -5.2270 -5.2270 -3.5052 -3.5052 -3.3524 -3.3524 -3.2906 -3.2906 -3.0868 -3.0868 -2.1583 -2.1583 -1.0633 -1.0633 1.3412 1.3412 1.3573 1.3573 1.4178 1.4178 1.4818 1.4818 1.7523 1.7523 1.8420 1.8420 1.8918 1.8918 1.9604 1.9604 2.0765 2.0765 2.2550 2.2550 3.0361 3.0361 3.0379 3.0379 3.0659 3.0659 3.1205 3.1205 3.9344 3.9344 3.9908 3.9908 5.1343 5.1343 6.2752 6.2752 6.3251 6.3251 7.7221 7.7221 8.4617 8.4617 8.5243 8.5243 9.1068 9.1068 10.2892 10.2892 10.4107 10.4107 11.5255 11.5255 12.2646 12.2646 13.0665 13.0665 13.3378 13.3378 k = 0.0000 0.0395 0.2197 ( 6570 PWs) bands (ev): -18.8464 -18.8464 -18.6370 -18.6370 -15.0295 -15.0295 -14.9161 -14.9161 -5.2661 -5.2661 -5.2226 -5.2226 -3.5108 -3.5108 -3.3502 -3.3502 -3.2899 -3.2899 -3.0871 -3.0871 -2.1558 -2.1558 -1.0629 -1.0629 1.3405 1.3405 1.3592 1.3592 1.4184 1.4184 1.4828 1.4828 1.7485 1.7485 1.8450 1.8450 1.8942 1.8942 1.9601 1.9601 2.0762 2.0762 2.2525 2.2525 3.0376 3.0376 3.0390 3.0390 3.0721 3.0721 3.1218 3.1218 3.9330 3.9330 3.9895 3.9895 5.1319 5.1319 6.2224 6.2224 6.3316 6.3316 7.7334 7.7334 8.4339 8.4339 8.5140 8.5140 9.1486 9.1486 10.3113 10.3113 10.4414 10.4414 11.5411 11.5411 12.2697 12.2697 13.0034 13.0034 13.3101 13.3101 k = 0.0000 0.0526 0.2197 ( 6578 PWs) bands (ev): -18.8449 -18.8449 -18.6367 -18.6367 -15.0301 -15.0301 -14.9175 -14.9175 -5.2727 -5.2727 -5.2182 -5.2182 -3.5181 -3.5181 -3.3477 -3.3477 -3.2887 -3.2887 -3.0875 -3.0875 -2.1521 -2.1521 -1.0624 -1.0624 1.3399 1.3399 1.3616 1.3616 1.4193 1.4193 1.4843 1.4843 1.7439 1.7439 1.8481 1.8481 1.8979 1.8979 1.9595 1.9595 2.0756 2.0756 2.2490 2.2490 3.0381 3.0381 3.0425 3.0425 3.0800 3.0800 3.1235 3.1235 3.9310 3.9310 3.9879 3.9879 5.1283 5.1283 6.1525 6.1525 6.3407 6.3407 7.7479 7.7479 8.3922 8.3922 8.5050 8.5050 9.2032 9.2032 10.3430 10.3430 10.4816 10.4816 11.5631 11.5631 12.2769 12.2769 12.9140 12.9140 13.3074 13.3074 k = 0.0000 0.0658 0.2197 ( 6580 PWs) bands (ev): -18.8431 -18.8431 -18.6363 -18.6363 -15.0309 -15.0309 -14.9193 -14.9193 -5.2796 -5.2796 -5.2139 -5.2139 -3.5268 -3.5268 -3.3453 -3.3453 -3.2869 -3.2869 -3.0882 -3.0882 -2.1473 -2.1473 -1.0617 -1.0617 1.3394 1.3394 1.3644 1.3644 1.4205 1.4205 1.4861 1.4861 1.7389 1.7389 1.8508 1.8508 1.9030 1.9030 1.9589 1.9589 2.0751 2.0751 2.2446 2.2446 3.0392 3.0392 3.0471 3.0471 3.0897 3.0897 3.1259 3.1259 3.9282 3.9282 3.9860 3.9860 5.1237 5.1237 6.0686 6.0686 6.3524 6.3524 7.7647 7.7647 8.3394 8.3394 8.4966 8.4966 9.2673 9.2673 10.3854 10.3854 10.5290 10.5290 11.5915 11.5915 12.2861 12.2861 12.8106 12.8106 13.3217 13.3217 k = 0.0000 0.0789 0.2197 ( 6570 PWs) bands (ev): -18.8408 -18.8408 -18.6358 -18.6358 -15.0318 -15.0318 -14.9215 -14.9215 -5.2868 -5.2868 -5.2101 -5.2101 -3.5366 -3.5366 -3.3434 -3.3434 -3.2846 -3.2846 -3.0893 -3.0893 -2.1414 -2.1414 -1.0608 -1.0608 1.3392 1.3392 1.3675 1.3675 1.4218 1.4218 1.4884 1.4884 1.7340 1.7340 1.8528 1.8528 1.9094 1.9094 1.9582 1.9582 2.0746 2.0746 2.2393 2.2393 3.0409 3.0409 3.0527 3.0527 3.1007 3.1007 3.1290 3.1290 3.9244 3.9244 3.9839 3.9839 5.1179 5.1179 5.9735 5.9735 6.3667 6.3667 7.7831 7.7831 8.2782 8.2782 8.4877 8.4877 9.3374 9.3374 10.4391 10.4391 10.5814 10.5814 11.6264 11.6264 12.2974 12.2974 12.7016 12.7016 13.3338 13.3338 k = 0.0000 0.0921 0.2197 ( 6574 PWs) bands (ev): -18.8381 -18.8381 -18.6353 -18.6353 -15.0328 -15.0328 -14.9240 -14.9240 -5.2941 -5.2941 -5.2067 -5.2067 -3.5472 -3.5472 -3.3420 -3.3420 -3.2817 -3.2817 -3.0907 -3.0907 -2.1342 -2.1342 -1.0599 -1.0599 1.3392 1.3392 1.3709 1.3709 1.4234 1.4234 1.4910 1.4910 1.7291 1.7291 1.8539 1.8539 1.9167 1.9167 1.9572 1.9572 2.0742 2.0742 2.2332 2.2332 3.0432 3.0432 3.0591 3.0591 3.1127 3.1127 3.1332 3.1332 3.9197 3.9197 3.9817 3.9817 5.1108 5.1108 5.8701 5.8701 6.3834 6.3834 7.8027 7.8027 8.2111 8.2111 8.4781 8.4781 9.4101 9.4101 10.5048 10.5048 10.6365 10.6365 11.6680 11.6680 12.3107 12.3107 12.5916 12.5916 13.2750 13.2750 k = 0.0000 0.1053 0.2197 ( 6578 PWs) bands (ev): -18.8350 -18.8350 -18.6347 -18.6347 -15.0340 -15.0340 -14.9269 -14.9269 -5.3014 -5.3014 -5.2038 -5.2038 -3.5582 -3.5582 -3.3412 -3.3412 -3.2783 -3.2783 -3.0926 -3.0926 -2.1257 -2.1257 -1.0589 -1.0589 1.3395 1.3395 1.3746 1.3746 1.4252 1.4252 1.4939 1.4939 1.7246 1.7246 1.8543 1.8543 1.9247 1.9247 1.9561 1.9561 2.0741 2.0741 2.2263 2.2263 3.0462 3.0462 3.0664 3.0664 3.1244 3.1244 3.1397 3.1397 3.9139 3.9139 3.9795 3.9795 5.1024 5.1024 5.7605 5.7605 6.4025 6.4025 7.8230 7.8230 8.1401 8.1401 8.4675 8.4675 9.4823 9.4823 10.5827 10.5827 10.6925 10.6925 11.7160 11.7160 12.3259 12.3259 12.4835 12.4835 13.2006 13.2006 k = 0.0000 0.1184 0.2197 ( 6582 PWs) bands (ev): -18.8316 -18.8316 -18.6341 -18.6341 -15.0353 -15.0353 -14.9302 -14.9302 -5.3087 -5.3087 -5.2015 -5.2015 -3.5696 -3.5696 -3.3412 -3.3412 -3.2745 -3.2745 -3.0951 -3.0951 -2.1159 -2.1159 -1.0579 -1.0579 1.3401 1.3401 1.3785 1.3785 1.4272 1.4272 1.4971 1.4971 1.7204 1.7204 1.8541 1.8541 1.9327 1.9327 1.9548 1.9548 2.0744 2.0744 2.2186 2.2186 3.0498 3.0498 3.0744 3.0744 3.1332 3.1332 3.1510 3.1510 3.9070 3.9070 3.9772 3.9772 5.0924 5.0924 5.6468 5.6468 6.4239 6.4239 7.8438 7.8438 8.0668 8.0668 8.4556 8.4556 9.5519 9.5519 10.6718 10.6718 10.7482 10.7482 11.7705 11.7705 12.3401 12.3401 12.3821 12.3821 13.1261 13.1261 k = 0.0000 0.1316 0.2197 ( 6588 PWs) bands (ev): -18.8278 -18.8278 -18.6334 -18.6334 -15.0368 -15.0368 -14.9338 -14.9338 -5.3159 -5.3159 -5.1997 -5.1997 -3.5811 -3.5811 -3.3417 -3.3417 -3.2705 -3.2705 -3.0982 -3.0982 -2.1046 -2.1046 -1.0569 -1.0569 1.3410 1.3410 1.3826 1.3826 1.4294 1.4294 1.5007 1.5007 1.7168 1.7168 1.8535 1.8535 1.9404 1.9404 1.9534 1.9534 2.0753 2.0753 2.2104 2.2104 3.0539 3.0539 3.0831 3.0831 3.1396 3.1396 3.1666 3.1666 3.8988 3.8988 3.9748 3.9748 5.0809 5.0809 5.5307 5.5307 6.4476 6.4476 7.8648 7.8648 7.9925 7.9925 8.4426 8.4426 9.6174 9.6174 10.7662 10.7662 10.8064 10.8064 11.8310 11.8310 12.2758 12.2758 12.3674 12.3674 13.0528 13.0528 k = 0.0000 0.1447 0.2197 ( 6584 PWs) bands (ev): -18.8236 -18.8236 -18.6328 -18.6328 -15.0383 -15.0383 -14.9376 -14.9376 -5.3229 -5.3229 -5.1986 -5.1986 -3.5925 -3.5925 -3.3426 -3.3426 -3.2665 -3.2665 -3.1019 -3.1019 -2.0919 -2.0919 -1.0559 -1.0559 1.3423 1.3423 1.3870 1.3870 1.4317 1.4317 1.5046 1.5046 1.7139 1.7139 1.8525 1.8525 1.9472 1.9472 1.9519 1.9519 2.0770 2.0770 2.2017 2.2017 3.0586 3.0586 3.0924 3.0924 3.1454 3.1454 3.1845 3.1845 3.8896 3.8896 3.9721 3.9721 5.0676 5.0676 5.4136 5.4136 6.4735 6.4735 7.8858 7.8858 7.9186 7.9186 8.4284 8.4284 9.6785 9.6785 10.8368 10.8368 10.8923 10.8923 11.8969 11.8969 12.1858 12.1858 12.3894 12.3894 12.9811 12.9811 k = 0.0000 0.1579 0.2197 ( 6592 PWs) bands (ev): -18.8192 -18.8192 -18.6321 -18.6321 -15.0400 -15.0400 -14.9418 -14.9418 -5.3298 -5.3298 -5.1981 -5.1981 -3.6037 -3.6037 -3.3440 -3.3440 -3.2627 -3.2627 -3.1063 -3.1063 -2.0776 -2.0776 -1.0550 -1.0550 1.3440 1.3440 1.3916 1.3916 1.4342 1.4342 1.5086 1.5086 1.7115 1.7115 1.8512 1.8512 1.9502 1.9502 1.9528 1.9528 2.0795 2.0795 2.1926 2.1926 3.0639 3.0639 3.1022 3.1022 3.1514 3.1514 3.2039 3.2039 3.8793 3.8793 3.9691 3.9691 5.0525 5.0525 5.2967 5.2967 6.5015 6.5015 7.8459 7.8459 7.9064 7.9064 8.4128 8.4128 9.7350 9.7350 10.8839 10.8839 11.0000 11.0000 11.9673 11.9673 12.1071 12.1071 12.4152 12.4152 12.9113 12.9113 k = 0.0000 0.1711 0.2197 ( 6592 PWs) bands (ev): -18.8144 -18.8144 -18.6314 -18.6314 -15.0417 -15.0417 -14.9462 -14.9462 -5.3365 -5.3365 -5.1982 -5.1982 -3.6146 -3.6146 -3.3457 -3.3457 -3.2592 -3.2592 -3.1114 -3.1114 -2.0617 -2.0617 -1.0543 -1.0543 1.3461 1.3461 1.3964 1.3964 1.4369 1.4369 1.5129 1.5129 1.7098 1.7098 1.8497 1.8497 1.9482 1.9482 1.9569 1.9569 2.0830 2.0830 2.1834 2.1834 3.0697 3.0697 3.1123 3.1123 3.1577 3.1577 3.2244 3.2244 3.8680 3.8680 3.9654 3.9654 5.0353 5.0353 5.1812 5.1812 6.5315 6.5315 7.7753 7.7753 7.9264 7.9264 8.3961 8.3961 9.7876 9.7876 10.9233 10.9233 11.1058 11.1058 12.0408 12.0408 12.0466 12.0466 12.4448 12.4448 12.8438 12.8438 k = 0.0000 0.1842 0.2197 ( 6588 PWs) bands (ev): -18.8093 -18.8093 -18.6308 -18.6308 -15.0435 -15.0435 -14.9508 -14.9508 -5.3429 -5.3429 -5.1989 -5.1989 -3.6250 -3.6250 -3.3476 -3.3476 -3.2560 -3.2560 -3.1172 -3.1172 -2.0443 -2.0443 -1.0537 -1.0537 1.3485 1.3485 1.4014 1.4014 1.4398 1.4398 1.5174 1.5174 1.7087 1.7087 1.8481 1.8481 1.9463 1.9463 1.9594 1.9594 2.0871 2.0871 2.1744 2.1744 3.0760 3.0760 3.1228 3.1228 3.1644 3.1644 3.2459 3.2459 3.8558 3.8558 3.9608 3.9608 5.0160 5.0160 5.0682 5.0682 6.5634 6.5634 7.7077 7.7077 7.9454 7.9454 8.3780 8.3780 9.8368 9.8368 10.9567 10.9567 11.1964 11.1964 12.0143 12.0143 12.1156 12.1156 12.4790 12.4790 12.7787 12.7787 k = 0.0000 0.1974 0.2197 ( 6590 PWs) bands (ev): -18.8040 -18.8040 -18.6302 -18.6302 -15.0453 -15.0453 -14.9556 -14.9556 -5.3490 -5.3490 -5.2003 -5.2003 -3.6348 -3.6348 -3.3499 -3.3499 -3.2533 -3.2533 -3.1236 -3.1236 -2.0252 -2.0252 -1.0535 -1.0535 1.3514 1.3514 1.4067 1.4067 1.4429 1.4429 1.5219 1.5219 1.7084 1.7084 1.8462 1.8462 1.9442 1.9442 1.9601 1.9601 2.0912 2.0912 2.1662 2.1662 3.0828 3.0828 3.1335 3.1335 3.1716 3.1716 3.2680 3.2680 3.8427 3.8427 3.9549 3.9549 4.9582 4.9582 4.9951 4.9951 6.5971 6.5971 7.6436 7.6436 7.9631 7.9631 8.3588 8.3588 9.8833 9.8833 10.9843 10.9843 11.2578 11.2578 12.0227 12.0227 12.1893 12.1893 12.5191 12.5191 12.7164 12.7164 k = 0.0000 0.2105 0.2197 ( 6598 PWs) bands (ev): -18.7984 -18.7984 -18.6296 -18.6296 -15.0472 -15.0472 -14.9606 -14.9606 -5.3547 -5.3547 -5.2024 -5.2024 -3.6440 -3.6440 -3.3525 -3.3525 -3.2511 -3.2511 -3.1304 -3.1304 -2.0046 -2.0046 -1.0537 -1.0537 1.3547 1.3547 1.4121 1.4121 1.4460 1.4460 1.5266 1.5266 1.7087 1.7087 1.8443 1.8443 1.9419 1.9419 1.9592 1.9592 2.0942 2.0942 2.1597 2.1597 3.0900 3.0900 3.1442 3.1442 3.1792 3.1792 3.2907 3.2907 3.8288 3.8288 3.9472 3.9472 4.8533 4.8533 4.9712 4.9712 6.6325 6.6325 7.5837 7.5837 7.9790 7.9790 8.3383 8.3383 9.9277 9.9277 11.0063 11.0063 11.2816 11.2816 12.0788 12.0788 12.2586 12.2586 12.5664 12.5664 12.6571 12.6571 k = 0.0000 0.2237 0.2197 ( 6602 PWs) bands (ev): -18.7926 -18.7926 -18.6292 -18.6292 -15.0491 -15.0491 -14.9658 -14.9658 -5.3600 -5.3600 -5.2050 -5.2050 -3.6524 -3.6524 -3.3554 -3.3554 -3.2496 -3.2496 -3.1377 -3.1377 -1.9823 -1.9823 -1.0543 -1.0543 1.3584 1.3584 1.4177 1.4177 1.4494 1.4494 1.5313 1.5313 1.7098 1.7098 1.8424 1.8424 1.9395 1.9395 1.9568 1.9568 2.0945 2.0945 2.1561 2.1561 3.0977 3.0977 3.1551 3.1551 3.1873 3.1873 3.3137 3.3137 3.8142 3.8142 3.9372 3.9372 4.7540 4.7540 4.9452 4.9452 6.6694 6.6694 7.5283 7.5283 7.9928 7.9928 8.3165 8.3165 9.9705 9.9705 11.0228 11.0228 11.2724 11.2724 12.1766 12.1766 12.3206 12.3206 12.6003 12.6003 12.6237 12.6237 k = 0.0000 0.2368 0.2197 ( 6600 PWs) bands (ev): -18.7867 -18.7867 -18.6288 -18.6288 -15.0510 -15.0510 -14.9710 -14.9710 -5.3648 -5.3648 -5.2083 -5.2083 -3.6600 -3.6600 -3.3587 -3.3587 -3.2486 -3.2486 -3.1452 -3.1452 -1.9585 -1.9585 -1.0554 -1.0554 1.3626 1.3626 1.4235 1.4235 1.4530 1.4530 1.5361 1.5361 1.7115 1.7115 1.8404 1.8404 1.9370 1.9370 1.9534 1.9534 2.0912 2.0912 2.1560 2.1560 3.1058 3.1058 3.1659 3.1659 3.1958 3.1958 3.3368 3.3368 3.7990 3.7990 3.9242 3.9242 4.6615 4.6615 4.9170 4.9170 6.7079 6.7079 7.4780 7.4780 8.0041 8.0041 8.2936 8.2936 10.0121 10.0121 11.0339 11.0339 11.2425 11.2425 12.3009 12.3009 12.3734 12.3734 12.5499 12.5499 12.6880 12.6880 k = 0.0000 0.2500 0.2197 ( 6596 PWs) bands (ev): -18.7805 -18.7805 -18.6285 -18.6285 -15.0529 -15.0529 -14.9764 -14.9764 -5.3693 -5.3693 -5.2122 -5.2122 -3.6667 -3.6667 -3.3626 -3.3626 -3.2482 -3.2482 -3.1529 -3.1529 -1.9332 -1.9332 -1.0572 -1.0572 1.3672 1.3672 1.4295 1.4295 1.4567 1.4567 1.5408 1.5408 1.7140 1.7140 1.8385 1.8385 1.9344 1.9344 1.9488 1.9488 2.0846 2.0846 2.1591 2.1591 3.1143 3.1143 3.1766 3.1766 3.2046 3.2046 3.3598 3.3598 3.7831 3.7831 3.9074 3.9074 4.5773 4.5773 4.8865 4.8865 6.7476 6.7476 7.4329 7.4329 8.0125 8.0125 8.2694 8.2694 10.0528 10.0528 11.0400 11.0400 11.2026 11.2026 12.4039 12.4039 12.4406 12.4406 12.5152 12.5152 12.7595 12.7595 k = 0.0000 0.2632 0.2197 ( 6590 PWs) bands (ev): -18.7742 -18.7742 -18.6284 -18.6284 -15.0547 -15.0547 -14.9818 -14.9818 -5.3732 -5.3732 -5.2167 -5.2167 -3.6724 -3.6724 -3.3671 -3.3671 -3.2484 -3.2484 -3.1604 -3.1604 -1.9064 -1.9064 -1.0597 -1.0597 1.3722 1.3722 1.4356 1.4356 1.4607 1.4607 1.5455 1.5455 1.7171 1.7171 1.8366 1.8366 1.9315 1.9315 1.9436 1.9436 2.0756 2.0756 2.1638 2.1638 3.1231 3.1231 3.1873 3.1873 3.2135 3.2135 3.3826 3.3826 3.7668 3.7668 3.8861 3.8861 4.5025 4.5025 4.8539 4.8539 6.7886 6.7886 7.3934 7.3934 8.0175 8.0175 8.2441 8.2441 10.0927 10.0927 11.0413 11.0413 11.1599 11.1599 12.4235 12.4235 12.4587 12.4587 12.6136 12.6136 12.8336 12.8336 k = 0.0000 0.2763 0.2197 ( 6586 PWs) bands (ev): -18.7678 -18.7678 -18.6284 -18.6284 -15.0565 -15.0565 -14.9873 -14.9873 -5.3765 -5.3765 -5.2217 -5.2217 -3.6771 -3.6771 -3.3724 -3.3724 -3.2491 -3.2491 -3.1676 -3.1676 -1.8783 -1.8783 -1.0630 -1.0630 1.3777 1.3777 1.4419 1.4419 1.4647 1.4647 1.5502 1.5502 1.7208 1.7208 1.8347 1.8347 1.9286 1.9286 1.9377 1.9377 2.0653 2.0653 2.1688 2.1688 3.1322 3.1322 3.1980 3.1980 3.2226 3.2226 3.4047 3.4047 3.7499 3.7499 3.8600 3.8600 4.4381 4.4381 4.8194 4.8194 6.8307 6.8307 7.3595 7.3595 8.0190 8.0190 8.2177 8.2177 10.1319 10.1319 11.0382 11.0382 11.1184 11.1184 12.3946 12.3946 12.4681 12.4681 12.7623 12.7623 12.9055 12.9055 k = 0.0000 0.2895 0.2197 ( 6578 PWs) bands (ev): -18.7613 -18.7613 -18.6286 -18.6286 -15.0582 -15.0582 -14.9927 -14.9927 -5.3794 -5.3794 -5.2272 -5.2272 -3.6806 -3.6806 -3.3787 -3.3787 -3.2503 -3.2503 -3.1745 -3.1745 -1.8490 -1.8490 -1.0673 -1.0673 1.3835 1.3835 1.4483 1.4483 1.4690 1.4690 1.5548 1.5548 1.7252 1.7252 1.8330 1.8330 1.9255 1.9255 1.9314 1.9314 2.0541 2.0541 2.1733 2.1733 3.1415 3.1415 3.2086 3.2086 3.2318 3.2318 3.4261 3.4261 3.7326 3.7326 3.8290 3.8290 4.3845 4.3845 4.7831 4.7831 6.8738 6.8738 7.3315 7.3315 8.0165 8.0165 8.1901 8.1901 10.1704 10.1704 11.0310 11.0310 11.0810 11.0810 12.3577 12.3577 12.4744 12.4744 12.9051 12.9051 12.9707 12.9707 k = 0.0000 0.3026 0.2197 ( 6588 PWs) bands (ev): -18.7547 -18.7547 -18.6290 -18.6290 -15.0598 -15.0598 -14.9981 -14.9981 -5.3816 -5.3816 -5.2332 -5.2332 -3.6831 -3.6831 -3.3860 -3.3860 -3.2517 -3.2517 -3.1808 -3.1808 -1.8185 -1.8185 -1.0726 -1.0726 1.3896 1.3896 1.4547 1.4547 1.4733 1.4733 1.5592 1.5592 1.7302 1.7302 1.8314 1.8314 1.9220 1.9220 1.9251 1.9251 2.0425 2.0425 2.1765 2.1765 3.1511 3.1511 3.2191 3.2191 3.2408 3.2408 3.4464 3.4464 3.7148 3.7148 3.7942 3.7942 4.3414 4.3414 4.7455 4.7455 6.9177 6.9177 7.3092 7.3092 8.0099 8.0099 8.1614 8.1614 10.2083 10.2083 11.0201 11.0201 11.0493 11.0493 12.3228 12.3228 12.4690 12.4690 13.0240 13.0240 13.0268 13.0268 k = 0.0000 0.3158 0.2197 ( 6576 PWs) bands (ev): -18.7481 -18.7481 -18.6296 -18.6296 -15.0612 -15.0612 -15.0035 -15.0035 -5.3833 -5.3833 -5.2396 -5.2396 -3.6844 -3.6844 -3.3944 -3.3944 -3.2533 -3.2533 -3.1866 -3.1866 -1.7870 -1.7870 -1.0790 -1.0790 1.3962 1.3962 1.4613 1.4613 1.4777 1.4777 1.5635 1.5635 1.7359 1.7359 1.8300 1.8300 1.9168 1.9168 1.9203 1.9203 2.0308 2.0308 2.1779 2.1779 3.1608 3.1608 3.2293 3.2293 3.2499 3.2499 3.4654 3.4654 3.6965 3.6965 3.7573 3.7573 4.3079 4.3079 4.7067 4.7067 6.9624 6.9624 7.2926 7.2926 7.9992 7.9992 8.1315 8.1315 10.2452 10.2452 11.0058 11.0058 11.0245 11.0245 12.2913 12.2913 12.4503 12.4503 13.0706 13.0706 13.1032 13.1032 k = 0.0000 0.3289 0.2197 ( 6572 PWs) bands (ev): -18.7414 -18.7414 -18.6304 -18.6304 -15.0625 -15.0625 -15.0088 -15.0088 -5.3843 -5.3843 -5.2464 -5.2464 -3.6846 -3.6846 -3.4041 -3.4041 -3.2547 -3.2547 -3.1920 -3.1920 -1.7546 -1.7546 -1.0867 -1.0867 1.4029 1.4029 1.4679 1.4679 1.4821 1.4821 1.5678 1.5678 1.7421 1.7421 1.8288 1.8288 1.9103 1.9103 1.9168 1.9168 2.0191 2.0191 2.1770 2.1770 3.1705 3.1705 3.2391 3.2391 3.2590 3.2590 3.4828 3.4828 3.6772 3.6772 3.7205 3.7205 4.2825 4.2825 4.6671 4.6671 7.0076 7.0076 7.2817 7.2817 7.9842 7.9842 8.1007 8.1007 10.2811 10.2811 10.9886 10.9886 11.0074 11.0074 12.2634 12.2634 12.4182 12.4182 13.0729 13.0729 13.1081 13.1081 k = 0.0000 0.3421 0.2197 ( 6568 PWs) bands (ev): -18.7348 -18.7348 -18.6314 -18.6314 -15.0637 -15.0637 -15.0139 -15.0139 -5.3848 -5.3848 -5.2535 -5.2535 -3.6836 -3.6836 -3.4149 -3.4149 -3.2560 -3.2560 -3.1968 -3.1968 -1.7215 -1.7215 -1.0957 -1.0957 1.4099 1.4099 1.4745 1.4745 1.4866 1.4866 1.5718 1.5718 1.7489 1.7489 1.8276 1.8276 1.9037 1.9037 1.9136 1.9136 2.0074 2.0074 2.1735 2.1735 3.1803 3.1803 3.2481 3.2481 3.2686 3.2686 3.4981 3.4981 3.6558 3.6558 3.6873 3.6873 4.2635 4.2635 4.6273 4.6273 7.0534 7.0534 7.2763 7.2763 7.9650 7.9650 8.0687 8.0687 10.3158 10.3158 10.9689 10.9689 10.9986 10.9986 12.2392 12.2392 12.3740 12.3740 12.9993 12.9993 13.1377 13.1377 k = 0.0000 0.3553 0.2197 ( 6572 PWs) bands (ev): -18.7282 -18.7282 -18.6327 -18.6327 -15.0647 -15.0647 -15.0189 -15.0189 -5.3846 -5.3846 -5.2609 -5.2609 -3.6814 -3.6814 -3.4268 -3.4268 -3.2569 -3.2569 -3.2013 -3.2013 -1.6878 -1.6878 -1.1061 -1.1061 1.4171 1.4171 1.4808 1.4808 1.4911 1.4911 1.5757 1.5757 1.7563 1.7563 1.8267 1.8267 1.8974 1.8974 1.9104 1.9104 1.9959 1.9959 2.1672 2.1672 3.1900 3.1900 3.2558 3.2558 3.2788 3.2788 3.5110 3.5110 3.6312 3.6312 3.6606 3.6606 4.2498 4.2498 4.5876 4.5876 7.0994 7.0994 7.2763 7.2763 7.9419 7.9419 8.0357 8.0357 10.3490 10.3490 10.9471 10.9471 10.9985 10.9985 12.2183 12.2183 12.3204 12.3204 12.9259 12.9259 13.1608 13.1608 k = 0.0000 0.3684 0.2197 ( 6586 PWs) bands (ev): -18.7217 -18.7217 -18.6342 -18.6342 -15.0655 -15.0655 -15.0238 -15.0238 -5.3838 -5.3838 -5.2685 -5.2685 -3.6780 -3.6780 -3.4398 -3.4398 -3.2573 -3.2573 -3.2055 -3.2055 -1.6537 -1.6537 -1.1180 -1.1180 1.4243 1.4243 1.4864 1.4864 1.4962 1.4962 1.5792 1.5792 1.7642 1.7642 1.8259 1.8259 1.8916 1.8916 1.9074 1.9074 1.9846 1.9846 2.1578 2.1578 3.1995 3.1995 3.2621 3.2621 3.2899 3.2899 3.5209 3.5209 3.6055 3.6055 3.6400 3.6400 4.2401 4.2401 4.5485 4.5485 7.1455 7.1455 7.2814 7.2814 7.9151 7.9151 8.0016 8.0016 10.3805 10.3805 10.9234 10.9234 11.0073 11.0073 12.1982 12.1982 12.2619 12.2619 12.8542 12.8542 13.1759 13.1759 k = 0.0000 0.3816 0.2197 ( 6590 PWs) bands (ev): -18.7153 -18.7153 -18.6360 -18.6360 -15.0660 -15.0660 -15.0285 -15.0285 -5.3824 -5.3824 -5.2763 -5.2763 -3.6735 -3.6735 -3.4535 -3.4535 -3.2573 -3.2573 -3.2095 -3.2095 -1.6193 -1.6193 -1.1314 -1.1314 1.4315 1.4315 1.4907 1.4907 1.5023 1.5023 1.5825 1.5825 1.7727 1.7727 1.8253 1.8253 1.8864 1.8864 1.9046 1.9046 1.9738 1.9738 2.1456 2.1456 3.2087 3.2087 3.2670 3.2670 3.3019 3.3019 3.5270 3.5270 3.5826 3.5826 3.6231 3.6231 4.2336 4.2336 4.5104 4.5104 7.1916 7.1916 7.2915 7.2915 7.8849 7.8849 7.9666 7.9666 10.4105 10.4105 10.8982 10.8982 11.0247 11.0247 12.1634 12.1634 12.2163 12.2163 12.7848 12.7848 13.1876 13.1876 k = 0.0000 0.3947 0.2197 ( 6588 PWs) bands (ev): -18.7090 -18.7090 -18.6381 -18.6381 -15.0664 -15.0664 -15.0330 -15.0330 -5.3804 -5.3804 -5.2842 -5.2842 -3.6679 -3.6679 -3.4679 -3.4679 -3.2568 -3.2568 -3.2133 -3.2133 -1.5848 -1.5848 -1.1465 -1.1465 1.4387 1.4387 1.4937 1.4937 1.5093 1.5093 1.5852 1.5852 1.7817 1.7817 1.8250 1.8250 1.8821 1.8821 1.9022 1.9022 1.9634 1.9634 2.1306 2.1306 3.2177 3.2177 3.2706 3.2706 3.3146 3.3146 3.5282 3.5282 3.5645 3.5645 3.6093 3.6093 4.2298 4.2298 4.4738 4.4738 7.2372 7.2372 7.3067 7.3067 7.8517 7.8517 7.9305 7.9305 10.4391 10.4391 10.8719 10.8719 11.0507 11.0507 12.0995 12.0995 12.2001 12.2001 12.7180 12.7180 13.1994 13.1994 k = 0.0000 0.4079 0.2197 ( 6596 PWs) bands (ev): -18.7028 -18.7028 -18.6404 -18.6404 -15.0665 -15.0665 -15.0372 -15.0372 -5.3777 -5.3777 -5.2921 -5.2921 -3.6611 -3.6611 -3.4828 -3.4828 -3.2559 -3.2559 -3.2170 -3.2170 -1.5504 -1.5504 -1.1632 -1.1632 1.4457 1.4457 1.4955 1.4955 1.5170 1.5170 1.5873 1.5873 1.7911 1.7911 1.8249 1.8249 1.8785 1.8785 1.9004 1.9004 1.9537 1.9537 2.1131 2.1131 3.2261 3.2261 3.2731 3.2731 3.3279 3.3279 3.5244 3.5244 3.5511 3.5511 3.5987 3.5987 4.2282 4.2282 4.4392 4.4392 7.2816 7.2816 7.3273 7.3273 7.8161 7.8161 7.8934 7.8934 10.4664 10.4664 10.8447 10.8447 11.0845 11.0845 12.0251 12.0251 12.1960 12.1960 12.6543 12.6543 13.2122 13.2122 k = 0.0000 0.4211 0.2197 ( 6604 PWs) bands (ev): -18.6968 -18.6968 -18.6431 -18.6431 -15.0663 -15.0663 -15.0412 -15.0412 -5.3745 -5.3745 -5.3000 -5.3000 -3.6532 -3.6532 -3.4979 -3.4979 -3.2546 -3.2546 -3.2206 -3.2206 -1.5163 -1.5163 -1.1816 -1.1816 1.4525 1.4525 1.4964 1.4964 1.5251 1.5251 1.5886 1.5886 1.8006 1.8006 1.8253 1.8253 1.8757 1.8757 1.8993 1.8993 1.9449 1.9449 2.0935 2.0935 3.2341 3.2341 3.2747 3.2747 3.3417 3.3417 3.5170 3.5170 3.5411 3.5411 3.5910 3.5910 4.2286 4.2286 4.4069 4.4069 7.3227 7.3227 7.3549 7.3549 7.7784 7.7784 7.8553 7.8553 10.4928 10.4928 10.8169 10.8169 11.1256 11.1256 11.9473 11.9473 12.1982 12.1982 12.5939 12.5939 13.2263 13.2263 k = 0.0000 0.4342 0.2197 ( 6592 PWs) bands (ev): -18.6909 -18.6909 -18.6460 -18.6460 -15.0658 -15.0658 -15.0449 -15.0449 -5.3707 -5.3707 -5.3078 -5.3078 -3.6443 -3.6443 -3.5132 -3.5132 -3.2529 -3.2529 -3.2241 -3.2241 -1.4825 -1.4825 -1.2017 -1.2017 1.4589 1.4589 1.4964 1.4964 1.5334 1.5334 1.5888 1.5888 1.8098 1.8098 1.8263 1.8263 1.8738 1.8738 1.8989 1.8989 1.9378 1.9378 2.0725 2.0725 3.2416 3.2416 3.2754 3.2754 3.3561 3.3561 3.5070 3.5070 3.5343 3.5343 3.5849 3.5849 4.2308 4.2308 4.3771 4.3771 7.3584 7.3584 7.3911 7.3911 7.7391 7.7391 7.8164 7.8164 10.5186 10.5186 10.7887 10.7887 11.1731 11.1731 11.8683 11.8683 12.2057 12.2057 12.5372 12.5372 13.2415 13.2415 k = 0.0000 0.4474 0.2197 ( 6592 PWs) bands (ev): -18.6853 -18.6853 -18.6493 -18.6493 -15.0651 -15.0651 -15.0483 -15.0483 -5.3663 -5.3663 -5.3155 -5.3155 -3.6345 -3.6345 -3.5284 -3.5284 -3.2509 -3.2509 -3.2275 -3.2275 -1.4494 -1.4494 -1.2234 -1.2234 1.4650 1.4650 1.4956 1.4956 1.5417 1.5417 1.5879 1.5879 1.8180 1.8180 1.8278 1.8278 1.8728 1.8728 1.8984 1.8984 1.9335 1.9335 2.0505 2.0505 3.2483 3.2483 3.2754 3.2754 3.3708 3.3708 3.4945 3.4945 3.5317 3.5317 3.5792 3.5792 4.2349 4.2349 4.3502 4.3502 7.3914 7.3914 7.4330 7.4330 7.6989 7.6989 7.7765 7.7765 10.5443 10.5443 10.7604 10.7604 11.2265 11.2265 11.7892 11.7892 12.2180 12.2180 12.4844 12.4844 13.2573 13.2573 k = 0.0000 0.4605 0.2197 ( 6594 PWs) bands (ev): -18.6799 -18.6799 -18.6528 -18.6528 -15.0641 -15.0641 -15.0515 -15.0515 -5.3614 -5.3614 -5.3230 -5.3230 -3.6237 -3.6237 -3.5435 -3.5435 -3.2486 -3.2486 -3.2309 -3.2309 -1.4171 -1.4171 -1.2468 -1.2468 1.4708 1.4708 1.4940 1.4940 1.5499 1.5499 1.5857 1.5857 1.8243 1.8243 1.8301 1.8301 1.8731 1.8731 1.8967 1.8967 1.9340 1.9340 2.0283 2.0283 3.2544 3.2544 3.2746 3.2746 3.3859 3.3859 3.4800 3.4800 3.5330 3.5330 3.5729 3.5729 4.2409 4.2409 4.3262 4.3262 7.4250 7.4250 7.4768 7.4768 7.6581 7.6581 7.7358 7.7358 10.5700 10.5700 10.7322 10.7322 11.2850 11.2850 11.7107 11.7107 12.2352 12.2352 12.4356 12.4356 13.2733 13.2733 k = 0.0000 0.4737 0.2197 ( 6594 PWs) bands (ev): -18.6747 -18.6747 -18.6566 -18.6566 -15.0627 -15.0627 -15.0544 -15.0544 -5.3560 -5.3560 -5.3303 -5.3303 -3.6120 -3.6120 -3.5582 -3.5582 -3.2461 -3.2461 -3.2342 -3.2342 -1.3856 -1.3856 -1.2717 -1.2717 1.4760 1.4760 1.4916 1.4916 1.5578 1.5578 1.5822 1.5822 1.8284 1.8284 1.8323 1.8323 1.8750 1.8750 1.8930 1.8930 1.9403 1.9403 2.0066 2.0066 3.2597 3.2597 3.2732 3.2732 3.4013 3.4013 3.4646 3.4646 3.5372 3.5372 3.5659 3.5659 4.2490 4.2490 4.3053 4.3053 7.4602 7.4602 7.5206 7.5206 7.6174 7.6174 7.6944 7.6944 10.5959 10.5959 10.7041 10.7041 11.3480 11.3480 11.6335 11.6335 12.2571 12.2571 12.3910 12.3910 13.2887 13.2887 k = 0.0000 0.4868 0.2197 ( 6590 PWs) bands (ev): -18.6698 -18.6698 -18.6607 -18.6607 -15.0611 -15.0611 -15.0569 -15.0569 -5.3502 -5.3502 -5.3373 -5.3373 -3.5996 -3.5996 -3.5726 -3.5726 -3.2433 -3.2433 -3.2374 -3.2374 -1.3552 -1.3552 -1.2982 -1.2982 1.4807 1.4807 1.4886 1.4886 1.5651 1.5651 1.5775 1.5775 1.8310 1.8310 1.8334 1.8334 1.8784 1.8784 1.8882 1.8882 1.9520 1.9520 1.9861 1.9861 3.2643 3.2643 3.2710 3.2710 3.4170 3.4170 3.4488 3.4488 3.5433 3.5433 3.5583 3.5583 4.2593 4.2593 4.2872 4.2872 7.4972 7.4972 7.5608 7.5608 7.5806 7.5806 7.6522 7.6522 10.6223 10.6223 10.6764 10.6764 11.4149 11.4149 11.5581 11.5581 12.2837 12.2837 12.3507 12.3507 13.3027 13.3027 k = 0.0000 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2404 -3.2404 -3.2404 -3.2404 -1.3260 -1.3260 -1.3260 -1.3260 1.4850 1.4850 1.4850 1.4850 1.5718 1.5718 1.5718 1.5718 1.8328 1.8328 1.8328 1.8328 1.8830 1.8830 1.8830 1.8830 1.9675 1.9675 1.9675 1.9675 3.2680 3.2680 3.2680 3.2680 3.4328 3.4328 3.4328 3.4328 3.5506 3.5506 3.5506 3.5506 4.2719 4.2719 4.2719 4.2719 7.5353 7.5353 7.5353 7.5353 7.6098 7.6098 7.6098 7.6098 10.6491 10.6491 10.6491 10.6491 11.4851 11.4851 11.4851 11.4851 12.3149 12.3149 12.3149 12.3149 13.3146 13.3146 k = 0.0000 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2404 -3.2404 -3.2404 -3.2404 -1.3260 -1.3260 -1.3260 -1.3260 1.4850 1.4850 1.4850 1.4850 1.5718 1.5718 1.5718 1.5718 1.8328 1.8328 1.8328 1.8328 1.8830 1.8830 1.8830 1.8830 1.9675 1.9675 1.9675 1.9675 3.2680 3.2680 3.2680 3.2680 3.4328 3.4328 3.4328 3.4328 3.5506 3.5506 3.5506 3.5506 4.2719 4.2719 4.2719 4.2719 7.5353 7.5353 7.5353 7.5353 7.6098 7.6098 7.6098 7.6098 10.6491 10.6491 10.6491 10.6491 11.4851 11.4851 11.4851 11.4851 12.3149 12.3149 12.3149 12.3149 13.3146 13.3146 k = 0.0132 0.5000 0.2197 ( 6592 PWs) bands (ev): -18.6650 -18.6650 -18.6650 -18.6650 -15.0594 -15.0594 -15.0592 -15.0592 -5.3483 -5.3483 -5.3397 -5.3397 -3.5900 -3.5900 -3.5827 -3.5827 -3.2509 -3.2509 -3.2305 -3.2305 -1.3257 -1.3257 -1.3257 -1.3257 1.4801 1.4801 1.4896 1.4896 1.5659 1.5659 1.5773 1.5773 1.8308 1.8308 1.8343 1.8343 1.8804 1.8804 1.8855 1.8855 1.9674 1.9674 1.9691 1.9691 3.2674 3.2674 3.2699 3.2699 3.4164 3.4164 3.4391 3.4391 3.5439 3.5439 3.5679 3.5679 4.2706 4.2706 4.2735 4.2735 7.5316 7.5316 7.5340 7.5340 7.6016 7.6016 7.6035 7.6035 10.6576 10.6576 10.6581 10.6581 11.4877 11.4877 11.4881 11.4881 12.3105 12.3105 12.3118 12.3118 13.3221 13.3221 k = 0.0263 0.5000 0.2197 ( 6604 PWs) bands (ev): -18.6646 -18.6646 -18.6646 -18.6646 -15.0600 -15.0600 -15.0595 -15.0595 -5.3529 -5.3529 -5.3357 -5.3357 -3.5935 -3.5935 -3.5790 -3.5790 -3.2620 -3.2620 -3.2214 -3.2214 -1.3248 -1.3248 -1.3247 -1.3247 1.4750 1.4750 1.4940 1.4940 1.5598 1.5598 1.5823 1.5823 1.8285 1.8285 1.8352 1.8352 1.8778 1.8778 1.8877 1.8877 1.9684 1.9684 1.9719 1.9719 3.2682 3.2682 3.2733 3.2733 3.3954 3.3954 3.4319 3.4319 3.5514 3.5514 3.5904 3.5904 4.2696 4.2696 4.2754 4.2754 7.5216 7.5216 7.5283 7.5283 7.5789 7.5789 7.5848 7.5848 10.6831 10.6831 10.6840 10.6840 11.4960 11.4960 11.4969 11.4969 12.2991 12.2991 12.3016 12.3016 13.3450 13.3450 k = 0.0395 0.5000 0.2197 ( 6604 PWs) bands (ev): -18.6639 -18.6639 -18.6639 -18.6639 -15.0608 -15.0608 -15.0601 -15.0601 -5.3577 -5.3577 -5.3320 -5.3320 -3.5968 -3.5968 -3.5754 -3.5754 -3.2735 -3.2735 -3.2131 -3.2131 -1.3232 -1.3232 -1.3230 -1.3230 1.4698 1.4698 1.4980 1.4980 1.5536 1.5536 1.5868 1.5868 1.8259 1.8259 1.8353 1.8353 1.8756 1.8756 1.8896 1.8896 1.9707 1.9707 1.9759 1.9759 3.2699 3.2699 3.2778 3.2778 3.3730 3.3730 3.4153 3.4153 3.5687 3.5687 3.6152 3.6152 4.2688 4.2688 4.2776 4.2776 7.5012 7.5012 7.5181 7.5181 7.5427 7.5427 7.5585 7.5585 10.7241 10.7241 10.7253 10.7253 11.5105 11.5105 11.5120 11.5120 12.2818 12.2818 12.2853 12.2853 13.3816 13.3816 k = 0.0526 0.5000 0.2197 ( 6592 PWs) bands (ev): -18.6630 -18.6630 -18.6630 -18.6630 -15.0619 -15.0619 -15.0609 -15.0609 -5.3625 -5.3625 -5.3285 -5.3285 -3.6000 -3.6000 -3.5719 -3.5719 -3.2853 -3.2853 -3.2057 -3.2057 -1.3210 -1.3210 -1.3207 -1.3207 1.4646 1.4646 1.5013 1.5013 1.5477 1.5477 1.5908 1.5908 1.8232 1.8232 1.8346 1.8346 1.8742 1.8742 1.8914 1.8914 1.9739 1.9739 1.9809 1.9809 3.2718 3.2718 3.2834 3.2834 3.3514 3.3514 3.3950 3.3950 3.5906 3.5906 3.6410 3.6410 4.2683 4.2683 4.2800 4.2800 7.4639 7.4639 7.4905 7.4905 7.5074 7.5074 7.5328 7.5328 10.7784 10.7784 10.7795 10.7795 11.5317 11.5317 11.5339 11.5339 12.2604 12.2604 12.2645 12.2645 13.4298 13.4298 k = 0.0658 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6619 -18.6619 -18.6619 -18.6619 -15.0633 -15.0633 -15.0621 -15.0621 -5.3675 -5.3675 -5.3253 -5.3253 -3.6028 -3.6028 -3.5686 -3.5686 -3.2972 -3.2972 -3.1993 -3.1993 -1.3182 -1.3182 -1.3178 -1.3178 1.4593 1.4593 1.5033 1.5033 1.5425 1.5425 1.5943 1.5943 1.8203 1.8203 1.8327 1.8327 1.8739 1.8739 1.8932 1.8932 1.9779 1.9779 1.9867 1.9867 3.2721 3.2721 3.2892 3.2892 3.3330 3.3330 3.3743 3.3743 3.6143 3.6143 3.6671 3.6671 4.2681 4.2681 4.2828 4.2828 7.4093 7.4093 7.4315 7.4315 7.4890 7.4890 7.5100 7.5100 10.8427 10.8427 10.8436 10.8436 11.5606 11.5606 11.5640 11.5640 12.2365 12.2365 12.2409 12.2409 13.4865 13.4865 k = 0.0789 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6605 -18.6605 -18.6604 -18.6604 -15.0649 -15.0649 -15.0635 -15.0635 -5.3725 -5.3725 -5.3224 -5.3224 -3.6054 -3.6054 -3.5656 -3.5656 -3.3091 -3.3091 -3.1939 -3.1939 -1.3148 -1.3148 -1.3143 -1.3143 1.4538 1.4538 1.5032 1.5032 1.5391 1.5391 1.5972 1.5972 1.8173 1.8173 1.8299 1.8299 1.8746 1.8746 1.8950 1.8950 1.9825 1.9825 1.9930 1.9930 3.2667 3.2667 3.2934 3.2934 3.3223 3.3223 3.3561 3.3561 3.6385 3.6385 3.6929 3.6929 4.2681 4.2681 4.2857 4.2857 7.3425 7.3425 7.3624 7.3624 7.4680 7.4680 7.4869 7.4869 10.9134 10.9134 10.9139 10.9139 11.5984 11.5984 11.6035 11.6035 12.2121 12.2121 12.2160 12.2160 13.5455 13.5455 k = 0.0921 0.5000 0.2197 ( 6580 PWs) bands (ev): -18.6588 -18.6588 -18.6588 -18.6588 -15.0667 -15.0667 -15.0651 -15.0651 -5.3776 -5.3776 -5.3198 -5.3198 -3.6077 -3.6077 -3.5630 -3.5630 -3.3209 -3.3209 -3.1895 -3.1895 -1.3107 -1.3107 -1.3102 -1.3102 1.4483 1.4483 1.5003 1.5003 1.5381 1.5381 1.5997 1.5997 1.8142 1.8142 1.8264 1.8264 1.8763 1.8763 1.8970 1.8970 1.9876 1.9876 1.9998 1.9998 3.2532 3.2532 3.2913 3.2913 3.3218 3.3218 3.3458 3.3458 3.6626 3.6626 3.7183 3.7183 4.2684 4.2684 4.2890 4.2890 7.2673 7.2673 7.2861 7.2861 7.4438 7.4438 7.4617 7.4617 10.9864 10.9864 10.9864 10.9864 11.6462 11.6462 11.6542 11.6542 12.1890 12.1890 12.1911 12.1911 13.5872 13.5872 k = 0.1053 0.5000 0.2197 ( 6576 PWs) bands (ev): -18.6569 -18.6569 -18.6569 -18.6569 -15.0688 -15.0688 -15.0670 -15.0670 -5.3827 -5.3827 -5.3176 -5.3176 -3.6096 -3.6096 -3.5609 -3.5609 -3.3323 -3.3323 -3.1862 -3.1862 -1.3062 -1.3062 -1.3055 -1.3055 1.4427 1.4427 1.4950 1.4950 1.5393 1.5393 1.6017 1.6017 1.8111 1.8111 1.8226 1.8226 1.8789 1.8789 1.8992 1.8992 1.9931 1.9931 2.0068 2.0068 3.2349 3.2349 3.2795 3.2795 3.3283 3.3283 3.3470 3.3470 3.6861 3.6861 3.7428 3.7428 4.2689 4.2689 4.2924 4.2924 7.1861 7.1861 7.2043 7.2043 7.4164 7.4164 7.4340 7.4340 11.0571 11.0571 11.0576 11.0576 11.7042 11.7042 11.7173 11.7173 12.1678 12.1678 12.1694 12.1694 13.5809 13.5809 k = 0.1184 0.5000 0.2197 ( 6568 PWs) bands (ev): -18.6549 -18.6549 -18.6548 -18.6548 -15.0711 -15.0711 -15.0692 -15.0692 -5.3878 -5.3878 -5.3158 -5.3158 -3.6112 -3.6112 -3.5595 -3.5595 -3.3432 -3.3432 -3.1841 -3.1841 -1.3011 -1.3011 -1.3003 -1.3003 1.4369 1.4369 1.4878 1.4878 1.5420 1.5420 1.6033 1.6033 1.8081 1.8081 1.8186 1.8186 1.8820 1.8820 1.9017 1.9017 1.9987 1.9987 2.0139 2.0139 3.2152 3.2152 3.2619 3.2619 3.3386 3.3386 3.3559 3.3559 3.7087 3.7087 3.7664 3.7664 4.2696 4.2696 4.2959 4.2959 7.1010 7.1010 7.1187 7.1187 7.3860 7.3860 7.4033 7.4033 11.1227 11.1227 11.1237 11.1237 11.7705 11.7705 11.7924 11.7924 12.1482 12.1482 12.1572 12.1572 13.5474 13.5474 k = 0.1316 0.5000 0.2197 ( 6572 PWs) bands (ev): -18.6526 -18.6526 -18.6526 -18.6526 -15.0737 -15.0737 -15.0715 -15.0715 -5.3928 -5.3928 -5.3143 -5.3143 -3.6124 -3.6124 -3.5587 -3.5587 -3.3535 -3.3535 -3.1831 -3.1831 -1.2955 -1.2955 -1.2946 -1.2946 1.4310 1.4310 1.4796 1.4796 1.5455 1.5455 1.6045 1.6045 1.8051 1.8051 1.8146 1.8146 1.8857 1.8857 1.9045 1.9045 2.0045 2.0045 2.0210 2.0210 3.1954 3.1954 3.2425 3.2425 3.3513 3.3513 3.3686 3.3686 3.7303 3.7303 3.7888 3.7888 4.2705 4.2705 4.2995 4.2995 7.0135 7.0135 7.0306 7.0306 7.3527 7.3527 7.3699 7.3699 11.1813 11.1813 11.1826 11.1826 11.8377 11.8377 11.8745 11.8745 12.1376 12.1376 12.1601 12.1601 13.5085 13.5085 k = 0.1447 0.5000 0.2197 ( 6576 PWs) bands (ev): -18.6501 -18.6501 -18.6501 -18.6501 -15.0764 -15.0764 -15.0741 -15.0741 -5.3977 -5.3977 -5.3132 -5.3132 -3.6132 -3.6132 -3.5588 -3.5588 -3.3629 -3.3629 -3.1832 -3.1832 -1.2894 -1.2894 -1.2884 -1.2884 1.4250 1.4250 1.4707 1.4707 1.5495 1.5495 1.6055 1.6055 1.8023 1.8023 1.8107 1.8107 1.8897 1.8897 1.9075 1.9075 2.0104 2.0104 2.0279 2.0279 3.1762 3.1762 3.2229 3.2229 3.3657 3.3657 3.3833 3.3833 3.7507 3.7507 3.8098 3.8098 4.2715 4.2715 4.3031 4.3031 6.9249 6.9249 6.9415 6.9415 7.3167 7.3167 7.3339 7.3339 11.2323 11.2323 11.2340 11.2340 11.8909 11.8909 11.9464 11.9464 12.1520 12.1520 12.1920 12.1920 13.4703 13.4703 k = 0.1579 0.5000 0.2197 ( 6568 PWs) bands (ev): -18.6475 -18.6475 -18.6475 -18.6475 -15.0793 -15.0793 -15.0768 -15.0768 -5.4025 -5.4025 -5.3125 -5.3125 -3.6137 -3.6137 -3.5597 -3.5597 -3.3712 -3.3712 -3.1844 -3.1844 -1.2829 -1.2829 -1.2818 -1.2818 1.4190 1.4190 1.4616 1.4616 1.5538 1.5538 1.6063 1.6063 1.7996 1.7996 1.8070 1.8070 1.8941 1.8941 1.9109 1.9109 2.0162 2.0162 2.0348 2.0348 3.1578 3.1578 3.2039 3.2039 3.3815 3.3815 3.3994 3.3994 3.7697 3.7697 3.8294 3.8294 4.2726 4.2726 4.3066 4.3066 6.8364 6.8364 6.8523 6.8523 7.2783 7.2783 7.2953 7.2953 11.2760 11.2760 11.2783 11.2783 11.9173 11.9173 11.9793 11.9793 12.2180 12.2180 12.2635 12.2635 13.4351 13.4351 k = 0.1711 0.5000 0.2197 ( 6568 PWs) bands (ev): -18.6447 -18.6447 -18.6447 -18.6447 -15.0823 -15.0823 -15.0797 -15.0797 -5.4072 -5.4072 -5.3122 -5.3122 -3.6138 -3.6138 -3.5616 -3.5616 -3.3785 -3.3785 -3.1866 -3.1866 -1.2760 -1.2760 -1.2748 -1.2748 1.4127 1.4127 1.4521 1.4521 1.5584 1.5584 1.6071 1.6071 1.7971 1.7971 1.8036 1.8036 1.8988 1.8988 1.9144 1.9144 2.0221 2.0221 2.0414 2.0414 3.1404 3.1404 3.1857 3.1857 3.3985 3.3985 3.4165 3.4165 3.7874 3.7874 3.8473 3.8473 4.2737 4.2737 4.3097 4.3097 6.7491 6.7491 6.7641 6.7641 7.2377 7.2377 7.2543 7.2543 11.3134 11.3134 11.3165 11.3165 11.9209 11.9209 11.9777 11.9777 12.3278 12.3278 12.3679 12.3679 13.4040 13.4040 k = 0.1842 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6418 -18.6418 -18.6417 -18.6417 -15.0855 -15.0855 -15.0828 -15.0828 -5.4116 -5.4116 -5.3124 -5.3124 -3.6135 -3.6135 -3.5644 -3.5644 -3.3845 -3.3845 -3.1900 -3.1900 -1.2687 -1.2687 -1.2674 -1.2674 1.4063 1.4063 1.4424 1.4424 1.5630 1.5630 1.6078 1.6078 1.7947 1.7947 1.8004 1.8004 1.9035 1.9035 1.9182 1.9182 2.0277 2.0277 2.0477 2.0477 3.1242 3.1242 3.1685 3.1685 3.4164 3.4164 3.4343 3.4343 3.8037 3.8037 3.8635 3.8635 4.2746 4.2746 4.3124 4.3124 6.6638 6.6638 6.6778 6.6778 7.1952 7.1952 7.2113 7.2113 11.3451 11.3451 11.3496 11.3496 11.9125 11.9125 11.9623 11.9623 12.4581 12.4581 12.4919 12.4919 13.3775 13.3775 k = 0.1974 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6387 -18.6387 -18.6387 -18.6387 -15.0888 -15.0888 -15.0861 -15.0861 -5.4159 -5.4159 -5.3129 -5.3129 -3.6129 -3.6129 -3.5681 -3.5681 -3.3893 -3.3893 -3.1943 -3.1943 -1.2611 -1.2611 -1.2597 -1.2597 1.3998 1.3998 1.4328 1.4328 1.5678 1.5678 1.6086 1.6086 1.7926 1.7926 1.7976 1.7976 1.9085 1.9085 1.9222 1.9222 2.0332 2.0332 2.0537 2.0537 3.1092 3.1092 3.1523 3.1523 3.4350 3.4350 3.4526 3.4526 3.8185 3.8185 3.8780 3.8780 4.2754 4.2754 4.3144 4.3144 6.5813 6.5813 6.5941 6.5941 7.1509 7.1509 7.1664 7.1664 11.3716 11.3716 11.3785 11.3785 11.8987 11.8987 11.9416 11.9416 12.5973 12.5973 12.6262 12.6262 13.3562 13.3562 k = 0.2105 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6356 -18.6356 -18.6356 -18.6356 -15.0922 -15.0922 -15.0894 -15.0894 -5.4199 -5.4199 -5.3139 -5.3139 -3.6120 -3.6120 -3.5725 -3.5725 -3.3930 -3.3930 -3.1995 -3.1995 -1.2533 -1.2533 -1.2518 -1.2518 1.3933 1.3933 1.4232 1.4232 1.5728 1.5728 1.6096 1.6096 1.7906 1.7906 1.7950 1.7950 1.9136 1.9136 1.9264 1.9264 2.0385 2.0385 2.0593 2.0593 3.0954 3.0954 3.1373 3.1373 3.4542 3.4542 3.4711 3.4711 3.8320 3.8320 3.8906 3.8906 4.2757 4.2757 4.3156 4.3156 6.5023 6.5023 6.5137 6.5137 7.1051 7.1051 7.1199 7.1199 11.3933 11.3933 11.4035 11.4035 11.8828 11.8828 11.9183 11.9183 12.7396 12.7396 12.7647 12.7647 13.3409 13.3409 k = 0.2237 0.5000 0.2197 ( 6580 PWs) bands (ev): -18.6324 -18.6324 -18.6324 -18.6324 -15.0957 -15.0957 -15.0928 -15.0928 -5.4237 -5.4237 -5.3153 -5.3153 -3.6108 -3.6108 -3.5776 -3.5776 -3.3956 -3.3956 -3.2056 -3.2056 -1.2453 -1.2453 -1.2436 -1.2436 1.3867 1.3867 1.4136 1.4136 1.5779 1.5779 1.6109 1.6109 1.7888 1.7888 1.7927 1.7927 1.9188 1.9188 1.9308 1.9308 2.0436 2.0436 2.0646 2.0646 3.0828 3.0828 3.1235 3.1235 3.4737 3.4737 3.4897 3.4897 3.8442 3.8442 3.9015 3.9015 4.2756 4.2756 4.3157 4.3157 6.4275 6.4275 6.4373 6.4373 7.0580 7.0580 7.0720 7.0720 11.4101 11.4101 11.4249 11.4249 11.8667 11.8667 11.8937 11.8937 12.8798 12.8798 12.9014 12.9014 13.3331 13.3331 k = 0.2368 0.5000 0.2197 ( 6580 PWs) bands (ev): -18.6291 -18.6291 -18.6291 -18.6291 -15.0992 -15.0992 -15.0963 -15.0963 -5.4271 -5.4271 -5.3171 -5.3171 -3.6093 -3.6093 -3.5831 -3.5831 -3.3972 -3.3972 -3.2126 -3.2126 -1.2371 -1.2371 -1.2354 -1.2354 1.3801 1.3801 1.4042 1.4042 1.5831 1.5831 1.6125 1.6125 1.7871 1.7871 1.7905 1.7905 1.9241 1.9241 1.9353 1.9353 2.0484 2.0484 2.0694 2.0694 3.0716 3.0716 3.1109 3.1109 3.4933 3.4933 3.5079 3.5079 3.8552 3.8552 3.9107 3.9107 4.2747 4.2747 4.3146 4.3146 6.3574 6.3574 6.3654 6.3654 7.0099 7.0099 7.0229 7.0229 11.4218 11.4218 11.4427 11.4427 11.8516 11.8516 11.8687 11.8687 13.0101 13.0101 13.0276 13.0276 13.3377 13.3377 k = 0.2500 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.6258 -18.6258 -18.6258 -18.6258 -15.1028 -15.1028 -15.0998 -15.0998 -5.4302 -5.4302 -5.3193 -5.3193 -3.6077 -3.6077 -3.5888 -3.5888 -3.3980 -3.3980 -3.2202 -3.2202 -1.2288 -1.2288 -1.2270 -1.2270 1.3735 1.3735 1.3950 1.3950 1.5885 1.5885 1.6145 1.6145 1.7856 1.7856 1.7885 1.7885 1.9293 1.9293 1.9400 1.9400 2.0529 2.0529 2.0738 2.0738 3.0615 3.0615 3.0995 3.0995 3.5128 3.5128 3.5256 3.5256 3.8651 3.8651 3.9183 3.9183 4.2730 4.2730 4.3121 4.3121 6.2926 6.2926 6.2986 6.2986 6.9610 6.9610 6.9729 6.9729 11.4283 11.4283 11.4565 11.4565 11.8384 11.8384 11.8441 11.8441 13.1147 13.1147 13.1248 13.1248 13.3678 13.3678 k = 0.2632 0.5000 0.2197 ( 6592 PWs) bands (ev): -18.6225 -18.6225 -18.6225 -18.6225 -15.1063 -15.1063 -15.1034 -15.1034 -5.4330 -5.4330 -5.3220 -5.3220 -3.6060 -3.6060 -3.5946 -3.5946 -3.3982 -3.3982 -3.2284 -3.2284 -1.2205 -1.2205 -1.2186 -1.2186 1.3669 1.3669 1.3860 1.3860 1.5940 1.5940 1.6168 1.6168 1.7842 1.7842 1.7867 1.7867 1.9345 1.9345 1.9447 1.9447 2.0572 2.0572 2.0777 2.0777 3.0528 3.0528 3.0893 3.0893 3.5317 3.5317 3.5425 3.5425 3.8743 3.8743 3.9245 3.9245 4.2702 4.2702 4.3081 4.3081 6.2334 6.2334 6.2372 6.2372 6.9115 6.9115 6.9222 6.9222 11.4293 11.4293 11.4660 11.4660 11.8210 11.8210 11.8277 11.8277 13.1737 13.1737 13.1742 13.1742 13.4403 13.4403 k = 0.2763 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6193 -18.6193 -18.6192 -18.6192 -15.1098 -15.1098 -15.1069 -15.1069 -5.4353 -5.4353 -5.3250 -5.3250 -3.6041 -3.6041 -3.6003 -3.6003 -3.3979 -3.3979 -3.2372 -3.2372 -1.2122 -1.2122 -1.2102 -1.2102 1.3604 1.3604 1.3773 1.3773 1.5997 1.5997 1.6196 1.6196 1.7828 1.7828 1.7850 1.7850 1.9398 1.9398 1.9494 1.9494 2.0611 2.0611 2.0811 2.0811 3.0453 3.0453 3.0804 3.0804 3.5500 3.5500 3.5582 3.5582 3.8827 3.8827 3.9294 3.9294 4.2663 4.2663 4.3025 4.3025 6.1801 6.1801 6.1816 6.1816 6.8617 6.8617 6.8710 6.8710 11.4251 11.4251 11.4706 11.4706 11.8001 11.8001 11.8197 11.8197 13.1874 13.1874 13.1969 13.1969 13.5446 13.5446 k = 0.2895 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.6160 -18.6160 -18.6160 -18.6160 -15.1133 -15.1133 -15.1104 -15.1104 -5.4373 -5.4373 -5.3284 -5.3284 -3.6057 -3.6057 -3.6023 -3.6023 -3.3971 -3.3971 -3.2463 -3.2463 -1.2040 -1.2040 -1.2019 -1.2019 1.3540 1.3540 1.3689 1.3689 1.6055 1.6055 1.6228 1.6228 1.7815 1.7815 1.7834 1.7834 1.9449 1.9449 1.9542 1.9542 2.0647 2.0647 2.0841 2.0841 3.0390 3.0390 3.0726 3.0726 3.5671 3.5671 3.5724 3.5724 3.8908 3.8908 3.9334 3.9334 4.2613 4.2613 4.2953 4.2953 6.1321 6.1321 6.1330 6.1330 6.8116 6.8116 6.8196 6.8196 11.4161 11.4161 11.4697 11.4697 11.7827 11.7827 11.8145 11.8145 13.1874 13.1874 13.2039 13.2039 13.6577 13.6577 k = 0.3026 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.6128 -18.6128 -18.6128 -18.6128 -15.1167 -15.1167 -15.1139 -15.1139 -5.4388 -5.4388 -5.3322 -5.3322 -3.6107 -3.6107 -3.6004 -3.6004 -3.3959 -3.3959 -3.2557 -3.2557 -1.1959 -1.1959 -1.1937 -1.1937 1.3478 1.3478 1.3608 1.3608 1.6115 1.6115 1.6264 1.6264 1.7803 1.7803 1.7818 1.7818 1.9500 1.9500 1.9590 1.9590 2.0679 2.0679 2.0866 2.0866 3.0339 3.0339 3.0661 3.0661 3.5828 3.5828 3.5849 3.5849 3.8986 3.8986 3.9366 3.9366 4.2551 4.2551 4.2866 4.2866 6.0889 6.0889 6.0922 6.0922 6.7616 6.7616 6.7680 6.7680 11.4030 11.4030 11.4632 11.4632 11.7691 11.7691 11.8116 11.8116 13.1831 13.1831 13.2053 13.2053 13.7672 13.7672 k = 0.3158 0.5000 0.2197 ( 6600 PWs) bands (ev): -18.6097 -18.6097 -18.6097 -18.6097 -15.1200 -15.1200 -15.1173 -15.1173 -5.4399 -5.4399 -5.3362 -5.3362 -3.6152 -3.6152 -3.5987 -3.5987 -3.3946 -3.3946 -3.2654 -3.2654 -1.1879 -1.1879 -1.1857 -1.1857 1.3417 1.3417 1.3531 1.3531 1.6176 1.6176 1.6304 1.6304 1.7789 1.7789 1.7802 1.7802 1.9549 1.9549 1.9637 1.9637 2.0708 2.0708 2.0885 2.0885 3.0299 3.0299 3.0606 3.0606 3.5953 3.5953 3.5967 3.5967 3.9065 3.9065 3.9395 3.9395 4.2479 4.2479 4.2765 4.2765 6.0520 6.0520 6.0578 6.0578 6.7118 6.7118 6.7166 6.7166 11.3868 11.3868 11.4514 11.4514 11.7597 11.7597 11.8104 11.8104 13.1781 13.1781 13.2051 13.2051 13.8673 13.8673 k = 0.3289 0.5000 0.2197 ( 6604 PWs) bands (ev): -18.6067 -18.6067 -18.6067 -18.6067 -15.1232 -15.1232 -15.1206 -15.1206 -5.4406 -5.4406 -5.3406 -5.3406 -3.6192 -3.6192 -3.5972 -3.5972 -3.3930 -3.3930 -3.2750 -3.2750 -1.1802 -1.1802 -1.1781 -1.1781 1.3359 1.3359 1.3458 1.3458 1.6239 1.6239 1.6347 1.6347 1.7777 1.7777 1.7787 1.7787 1.9598 1.9598 1.9684 1.9684 2.0734 2.0734 2.0901 2.0901 3.0270 3.0270 3.0562 3.0562 3.6035 3.6035 3.6083 3.6083 3.9146 3.9146 3.9423 3.9423 4.2396 4.2396 4.2652 4.2652 6.0215 6.0215 6.0297 6.0297 6.6624 6.6624 6.6655 6.6655 11.3684 11.3684 11.4350 11.4350 11.7540 11.7540 11.8102 11.8102 13.1743 13.1743 13.2052 13.2052 13.9540 13.9540 k = 0.3421 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6039 -18.6039 -18.6038 -18.6038 -15.1262 -15.1262 -15.1238 -15.1238 -5.4407 -5.4407 -5.3453 -5.3453 -3.6224 -3.6224 -3.5960 -3.5960 -3.3914 -3.3914 -3.2846 -3.2846 -1.1728 -1.1728 -1.1707 -1.1707 1.3304 1.3304 1.3389 1.3389 1.6302 1.6302 1.6395 1.6395 1.7764 1.7764 1.7771 1.7771 1.9646 1.9646 1.9730 1.9730 2.0756 2.0756 2.0912 2.0912 3.0252 3.0252 3.0528 3.0528 3.6093 3.6093 3.6176 3.6176 3.9230 3.9230 3.9454 3.9454 4.2306 4.2306 4.2531 4.2531 5.9974 5.9974 6.0078 6.0078 6.6135 6.6135 6.6149 6.6149 11.3488 11.3488 11.4152 11.4152 11.7512 11.7512 11.8105 11.8105 13.1725 13.1725 13.2064 13.2064 14.0245 14.0245 k = 0.3553 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6011 -18.6011 -18.6011 -18.6011 -15.1291 -15.1291 -15.1268 -15.1268 -5.4405 -5.4405 -5.3502 -5.3502 -3.6251 -3.6251 -3.5950 -3.5950 -3.3896 -3.3896 -3.2941 -3.2941 -1.1658 -1.1658 -1.1637 -1.1637 1.3252 1.3252 1.3326 1.3326 1.6366 1.6366 1.6445 1.6445 1.7750 1.7750 1.7755 1.7755 1.9693 1.9693 1.9774 1.9774 2.0775 2.0775 2.0918 2.0918 3.0243 3.0243 3.0504 3.0504 3.6128 3.6128 3.6241 3.6241 3.9319 3.9319 3.9490 3.9490 4.2210 4.2210 4.2404 4.2404 5.9793 5.9793 5.9919 5.9919 6.5649 6.5649 6.5652 6.5652 11.3287 11.3287 11.3932 11.3932 11.7506 11.7506 11.8107 11.8107 13.1732 13.1732 13.2092 13.2092 14.0768 14.0768 k = 0.3684 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.5986 -18.5986 -18.5985 -18.5985 -15.1318 -15.1318 -15.1296 -15.1296 -5.4397 -5.4397 -5.3553 -5.3553 -3.6270 -3.6270 -3.5945 -3.5945 -3.3878 -3.3878 -3.3032 -3.3032 -1.1592 -1.1592 -1.1571 -1.1571 1.3203 1.3203 1.3267 1.3267 1.6430 1.6430 1.6497 1.6497 1.7735 1.7735 1.7738 1.7738 1.9738 1.9738 1.9817 1.9817 2.0791 2.0791 2.0921 2.0921 3.0243 3.0243 3.0487 3.0487 3.6139 3.6139 3.6278 3.6278 3.9410 3.9410 3.9534 3.9534 4.2111 4.2111 4.2274 4.2274 5.9671 5.9671 5.9816 5.9816 6.5158 6.5158 6.5178 6.5178 11.3089 11.3089 11.3702 11.3702 11.7513 11.7513 11.8105 11.8105 13.1768 13.1768 13.2141 13.2141 14.1106 14.1106 k = 0.3816 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.5962 -18.5962 -18.5962 -18.5962 -15.1343 -15.1343 -15.1323 -15.1323 -5.4385 -5.4385 -5.3606 -5.3606 -3.6281 -3.6281 -3.5943 -3.5943 -3.3859 -3.3859 -3.3119 -3.3119 -1.1530 -1.1530 -1.1511 -1.1511 1.3158 1.3158 1.3212 1.3212 1.6493 1.6493 1.6550 1.6550 1.7720 1.7720 1.7720 1.7720 1.9782 1.9782 1.9858 1.9858 2.0803 2.0803 2.0920 2.0920 3.0251 3.0251 3.0477 3.0477 3.6131 3.6131 3.6288 3.6288 3.9505 3.9505 3.9586 3.9586 4.2011 4.2011 4.2144 4.2144 5.9606 5.9606 5.9766 5.9766 6.4676 6.4676 6.4714 6.4714 11.2900 11.2900 11.3470 11.3470 11.7530 11.7530 11.8097 11.8097 13.1833 13.1833 13.2209 13.2209 14.1276 14.1276 k = 0.3947 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.5940 -18.5940 -18.5940 -18.5940 -15.1365 -15.1365 -15.1347 -15.1347 -5.4368 -5.4368 -5.3660 -5.3660 -3.6286 -3.6286 -3.5947 -3.5947 -3.3840 -3.3840 -3.3202 -3.3202 -1.1473 -1.1473 -1.1455 -1.1455 1.3118 1.3118 1.3163 1.3163 1.6555 1.6555 1.6603 1.6603 1.7702 1.7702 1.7703 1.7703 1.9823 1.9823 1.9896 1.9896 2.0813 2.0813 2.0916 2.0916 3.0266 3.0266 3.0473 3.0473 3.6107 3.6107 3.6273 3.6273 3.9600 3.9600 3.9646 3.9646 4.1913 4.1913 4.2018 4.2018 5.9594 5.9594 5.9767 5.9767 6.4205 6.4205 6.4261 6.4261 11.2724 11.2724 11.3244 11.3244 11.7551 11.7551 11.8082 11.8082 13.1925 13.1925 13.2295 13.2295 14.1307 14.1307 k = 0.4079 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.5920 -18.5920 -18.5920 -18.5920 -15.1386 -15.1386 -15.1370 -15.1370 -5.4347 -5.4347 -5.3715 -5.3715 -3.6284 -3.6284 -3.5956 -3.5956 -3.3820 -3.3820 -3.3279 -3.3279 -1.1422 -1.1422 -1.1405 -1.1405 1.3081 1.3081 1.3119 1.3119 1.6614 1.6614 1.6656 1.6656 1.7682 1.7682 1.7685 1.7685 1.9862 1.9862 1.9930 1.9930 2.0821 2.0821 2.0909 2.0909 3.0287 3.0287 3.0474 3.0474 3.6071 3.6071 3.6238 3.6238 3.9693 3.9693 3.9712 3.9712 4.1818 4.1818 4.1898 4.1898 5.9631 5.9631 5.9815 5.9815 6.3747 6.3747 6.3821 6.3821 11.2566 11.2566 11.3030 11.3030 11.7576 11.7576 11.8059 11.8059 13.2041 13.2041 13.2396 13.2396 14.1236 14.1236 k = 0.4211 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5903 -18.5903 -18.5903 -18.5903 -15.1403 -15.1403 -15.1389 -15.1389 -5.4322 -5.4322 -5.3770 -5.3770 -3.6276 -3.6276 -3.5969 -3.5969 -3.3800 -3.3800 -3.3349 -3.3349 -1.1376 -1.1376 -1.1361 -1.1361 1.3050 1.3050 1.3081 1.3081 1.6671 1.6671 1.6706 1.6706 1.7664 1.7664 1.7668 1.7668 1.9899 1.9899 1.9961 1.9961 2.0826 2.0826 2.0901 2.0901 3.0311 3.0311 3.0477 3.0477 3.6028 3.6028 3.6188 3.6188 3.9781 3.9781 3.9783 3.9783 4.1729 4.1729 4.1787 4.1787 5.9715 5.9715 5.9906 5.9906 6.3303 6.3303 6.3394 6.3394 11.2428 11.2428 11.2832 11.2832 11.7602 11.7602 11.8030 11.8030 13.2175 13.2175 13.2506 13.2506 14.1098 14.1098 k = 0.4342 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5888 -18.5888 -18.5888 -18.5888 -15.1418 -15.1418 -15.1406 -15.1406 -5.4292 -5.4292 -5.3826 -5.3826 -3.6262 -3.6262 -3.5988 -3.5988 -3.3779 -3.3779 -3.3414 -3.3414 -1.1337 -1.1337 -1.1324 -1.1324 1.3023 1.3023 1.3048 1.3048 1.6724 1.6724 1.6752 1.6752 1.7645 1.7645 1.7649 1.7649 1.9933 1.9933 1.9987 1.9987 2.0830 2.0830 2.0891 2.0891 3.0339 3.0339 3.0480 3.0480 3.5983 3.5983 3.6129 3.6129 3.9851 3.9851 3.9866 3.9866 4.1647 4.1647 4.1687 4.1687 5.9842 5.9842 6.0037 6.0037 6.2875 6.2875 6.2983 6.2983 11.2313 11.2313 11.2654 11.2654 11.7629 11.7629 11.7996 11.7996 13.2321 13.2321 13.2617 13.2617 14.0927 14.0927 k = 0.4474 0.5000 0.2197 ( 6592 PWs) bands (ev): -18.5876 -18.5876 -18.5876 -18.5876 -15.1431 -15.1431 -15.1421 -15.1421 -5.4258 -5.4258 -5.3881 -5.3881 -3.6242 -3.6242 -3.6010 -3.6010 -3.3757 -3.3757 -3.3472 -3.3472 -1.1304 -1.1304 -1.1293 -1.1293 1.3002 1.3002 1.3021 1.3021 1.6770 1.6770 1.6793 1.6793 1.7627 1.7627 1.7632 1.7632 1.9963 1.9963 2.0009 2.0009 2.0833 2.0833 2.0881 2.0881 3.0367 3.0367 3.0483 3.0483 3.5942 3.5942 3.6068 3.6068 3.9917 3.9917 3.9939 3.9939 4.1575 4.1575 4.1600 4.1600 6.0008 6.0008 6.0204 6.0204 6.2465 6.2465 6.2588 6.2588 11.2222 11.2222 11.2498 11.2498 11.7658 11.7658 11.7958 11.7958 13.2468 13.2468 13.2721 13.2721 14.0750 14.0750 k = 0.4605 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5866 -18.5866 -18.5866 -18.5866 -15.1440 -15.1440 -15.1433 -15.1433 -5.4221 -5.4221 -5.3935 -5.3935 -3.6218 -3.6218 -3.6037 -3.6037 -3.3733 -3.3733 -3.3524 -3.3524 -1.1277 -1.1277 -1.1270 -1.1270 1.2985 1.2985 1.2999 1.2999 1.6810 1.6810 1.6827 1.6827 1.7612 1.7612 1.7616 1.7616 1.9989 1.9989 2.0025 2.0025 2.0836 2.0836 2.0871 2.0871 3.0395 3.0395 3.0484 3.0484 3.5910 3.5910 3.6008 3.6008 3.9977 3.9977 3.9999 3.9999 4.1515 4.1515 4.1529 4.1529 6.0211 6.0211 6.0405 6.0405 6.2074 6.2074 6.2212 6.2212 11.2159 11.2159 11.2367 11.2367 11.7689 11.7689 11.7917 11.7917 13.2607 13.2607 13.2808 13.2808 14.0592 14.0592 k = 0.4737 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.5859 -18.5859 -18.5859 -18.5859 -15.1446 -15.1446 -15.1441 -15.1441 -5.4180 -5.4180 -5.3988 -5.3988 -3.6191 -3.6191 -3.6066 -3.6066 -3.3707 -3.3707 -3.3570 -3.3570 -1.1258 -1.1258 -1.1253 -1.1253 1.2973 1.2973 1.2983 1.2983 1.6840 1.6840 1.6852 1.6852 1.7600 1.7600 1.7603 1.7603 2.0009 2.0009 2.0034 2.0034 2.0838 2.0838 2.0861 2.0861 3.0420 3.0420 3.0480 3.0480 3.5889 3.5889 3.5957 3.5957 4.0024 4.0024 4.0042 4.0042 4.1469 4.1469 4.1476 4.1476 6.0447 6.0447 6.0635 6.0635 6.1706 6.1706 6.1856 6.1856 11.2123 11.2123 11.2262 11.2262 11.7723 11.7723 11.7876 11.7876 13.2728 13.2728 13.2867 13.2867 14.0472 14.0472 k = 0.4868 0.5000 0.2197 ( 6588 PWs) bands (ev): -18.5855 -18.5855 -18.5855 -18.5855 -15.1450 -15.1450 -15.1447 -15.1447 -5.4136 -5.4136 -5.4040 -5.4040 -3.6161 -3.6161 -3.6097 -3.6097 -3.3679 -3.3679 -3.3611 -3.3611 -1.1246 -1.1246 -1.1243 -1.1243 1.2968 1.2968 1.2973 1.2973 1.6861 1.6861 1.6867 1.6867 1.7593 1.7593 1.7595 1.7595 2.0025 2.0025 2.0038 2.0038 2.0841 2.0841 2.0853 2.0853 3.0442 3.0442 3.0473 3.0473 3.5882 3.5882 3.5917 3.5917 4.0058 4.0058 4.0068 4.0068 4.1440 4.1440 4.1443 4.1443 6.0711 6.0711 6.0885 6.0885 6.1370 6.1370 6.1525 6.1525 11.2115 11.2115 11.2185 11.2185 11.7758 11.7758 11.7835 11.7835 13.2820 13.2820 13.2891 13.2891 14.0405 14.0405 k = 0.5000 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6129 -3.6129 -3.6129 -3.6129 -3.3647 -3.3647 -3.3647 -3.3647 -1.1241 -1.1241 -1.1241 -1.1241 1.2968 1.2968 1.2968 1.2968 1.6870 1.6870 1.6870 1.6870 1.7591 1.7591 1.7591 1.7591 2.0035 2.0035 2.0035 2.0035 2.0846 2.0846 2.0846 2.0846 3.0460 3.0460 3.0460 3.0460 3.5892 3.5892 3.5892 3.5892 4.0073 4.0073 4.0073 4.0073 4.1431 4.1431 4.1431 4.1431 6.0974 6.0974 6.0974 6.0974 6.1245 6.1245 6.1245 6.1245 11.2136 11.2136 11.2136 11.2136 11.7796 11.7796 11.7796 11.7796 13.2876 13.2876 13.2876 13.2876 14.0400 14.0400 k = 0.5000 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6129 -3.6129 -3.6129 -3.6129 -3.3647 -3.3647 -3.3647 -3.3647 -1.1241 -1.1241 -1.1241 -1.1241 1.2968 1.2968 1.2968 1.2968 1.6870 1.6870 1.6870 1.6870 1.7591 1.7591 1.7591 1.7591 2.0035 2.0035 2.0035 2.0035 2.0846 2.0846 2.0846 2.0846 3.0460 3.0460 3.0460 3.0460 3.5892 3.5892 3.5892 3.5892 4.0073 4.0073 4.0073 4.0073 4.1431 4.1431 4.1431 4.1431 6.0974 6.0974 6.0974 6.0974 6.1245 6.1245 6.1245 6.1245 11.2136 11.2136 11.2136 11.2136 11.7796 11.7796 11.7796 11.7796 13.2876 13.2876 13.2876 13.2876 14.0400 14.0400 k = 0.4907 0.4907 0.2197 ( 6586 PWs) bands (ev): -18.5856 -18.5856 -18.5854 -18.5854 -15.1450 -15.1450 -15.1447 -15.1447 -5.4136 -5.4136 -5.4040 -5.4040 -3.6161 -3.6161 -3.6097 -3.6097 -3.3679 -3.3679 -3.3611 -3.3611 -1.1251 -1.1251 -1.1238 -1.1238 1.2966 1.2966 1.2974 1.2974 1.6861 1.6861 1.6868 1.6868 1.7592 1.7592 1.7596 1.7596 2.0025 2.0025 2.0038 2.0038 2.0839 2.0839 2.0856 2.0856 3.0441 3.0441 3.0475 3.0475 3.5880 3.5880 3.5919 3.5919 4.0058 4.0058 4.0068 4.0068 4.1440 4.1440 4.1444 4.1444 6.0647 6.0647 6.1065 6.1065 6.1195 6.1195 6.1583 6.1583 11.2115 11.2115 11.2185 11.2185 11.7758 11.7758 11.7835 11.7835 13.2809 13.2809 13.2903 13.2903 14.0397 14.0397 k = 0.4815 0.4815 0.2197 ( 6594 PWs) bands (ev): -18.5863 -18.5863 -18.5855 -18.5855 -15.1447 -15.1447 -15.1441 -15.1441 -5.4180 -5.4180 -5.3988 -5.3988 -3.6193 -3.6193 -3.6064 -3.6064 -3.3706 -3.3706 -3.3571 -3.3571 -1.1281 -1.1281 -1.1230 -1.1230 1.2963 1.2963 1.2993 1.2993 1.6837 1.6837 1.6856 1.6856 1.7594 1.7594 1.7608 1.7608 2.0009 2.0009 2.0035 2.0035 2.0821 2.0821 2.0877 2.0877 3.0408 3.0408 3.0493 3.0493 3.5874 3.5874 3.5970 3.5970 4.0023 4.0023 4.0044 4.0044 4.1466 4.1466 4.1479 4.1479 6.0253 6.0253 6.1120 6.1120 6.1249 6.1249 6.2019 6.2019 11.2120 11.2120 11.2264 11.2264 11.7723 11.7723 11.7877 11.7877 13.2662 13.2662 13.2937 13.2937 14.0423 14.0423 k = 0.4722 0.4722 0.2197 ( 6590 PWs) bands (ev): -18.5875 -18.5875 -18.5857 -18.5857 -15.1441 -15.1441 -15.1431 -15.1431 -5.4221 -5.4221 -5.3935 -5.3935 -3.6225 -3.6225 -3.6030 -3.6030 -3.3730 -3.3730 -3.3527 -3.3527 -1.1331 -1.1331 -1.1216 -1.1216 1.2959 1.2959 1.3025 1.3025 1.6802 1.6802 1.6836 1.6836 1.7598 1.7598 1.7628 1.7628 1.9988 1.9988 2.0027 2.0027 2.0794 2.0794 2.0911 2.0911 3.0363 3.0363 3.0521 3.0521 3.5867 3.5867 3.6045 3.6045 3.9968 3.9968 4.0006 4.0006 4.1512 4.1512 4.1536 4.1536 5.9862 5.9862 6.1201 6.1201 6.1351 6.1351 6.2481 6.2481 11.2149 11.2149 11.2373 11.2373 11.7691 11.7691 11.7920 11.7920 13.2440 13.2440 13.2988 13.2988 14.0469 14.0469 k = 0.4630 0.4630 0.2197 ( 6596 PWs) bands (ev): -18.5891 -18.5891 -18.5860 -18.5860 -15.1434 -15.1434 -15.1418 -15.1418 -5.4260 -5.4260 -5.3879 -5.3879 -3.6259 -3.6259 -3.5993 -3.5993 -3.3751 -3.3751 -3.3479 -3.3479 -1.1401 -1.1401 -1.1197 -1.1197 1.2953 1.2953 1.3068 1.3068 1.6756 1.6756 1.6808 1.6808 1.7604 1.7604 1.7653 1.7653 1.9961 1.9961 2.0014 2.0014 2.0757 2.0757 2.0956 2.0956 3.0307 3.0307 3.0559 3.0559 3.5859 3.5859 3.6138 3.6138 3.9891 3.9891 3.9957 3.9957 4.1577 4.1577 4.1612 4.1612 5.9481 5.9481 6.1310 6.1310 6.1496 6.1496 6.2961 6.2961 11.2201 11.2201 11.2512 11.2512 11.7662 11.7662 11.7966 11.7966 13.2166 13.2166 13.3057 13.3057 14.0532 14.0532 k = 0.4537 0.4537 0.2197 ( 6592 PWs) bands (ev): -18.5912 -18.5912 -18.5864 -18.5864 -15.1424 -15.1424 -15.1401 -15.1401 -5.4296 -5.4296 -5.3821 -5.3821 -3.6293 -3.6293 -3.5955 -3.5955 -3.3768 -3.3768 -3.3426 -3.3426 -1.1491 -1.1491 -1.1173 -1.1173 1.2946 1.2946 1.3123 1.3123 1.6703 1.6703 1.6773 1.6773 1.7611 1.7611 1.7681 1.7681 1.9930 1.9930 1.9996 1.9996 2.0710 2.0710 2.1011 2.1011 3.0246 3.0246 3.0607 3.0607 3.5848 3.5848 3.6239 3.6239 3.9794 3.9794 3.9902 3.9902 4.1662 4.1662 4.1706 4.1706 5.9111 5.9111 6.1448 6.1448 6.1684 6.1684 6.3459 6.3459 11.2273 11.2273 11.2679 11.2679 11.7639 11.7639 11.8015 11.8015 13.1862 13.1862 13.3139 13.3139 14.0612 14.0612 k = 0.4444 0.4444 0.2197 ( 6598 PWs) bands (ev): -18.5937 -18.5937 -18.5869 -18.5869 -15.1411 -15.1411 -15.1381 -15.1381 -5.4330 -5.4330 -5.3761 -5.3761 -3.6329 -3.6329 -3.5913 -3.5913 -3.3781 -3.3781 -3.3370 -3.3370 -1.1600 -1.1600 -1.1145 -1.1145 1.2937 1.2937 1.3191 1.3191 1.6643 1.6643 1.6732 1.6732 1.7618 1.7618 1.7710 1.7710 1.9894 1.9894 1.9972 1.9972 2.0655 2.0655 2.1073 2.1073 3.0185 3.0185 3.0666 3.0666 3.5832 3.5832 3.6339 3.6339 3.9676 3.9676 3.9846 3.9846 4.1764 4.1764 4.1820 4.1820 5.8754 5.8754 6.1614 6.1614 6.1914 6.1914 6.3973 6.3973 11.2365 11.2365 11.2871 11.2871 11.7622 11.7622 11.8068 11.8068 13.1549 13.1549 13.3231 13.3231 14.0707 14.0707 k = 0.4352 0.4352 0.2197 ( 6598 PWs) bands (ev): -18.5967 -18.5967 -18.5874 -18.5874 -15.1397 -15.1397 -15.1357 -15.1357 -5.4360 -5.4360 -5.3700 -5.3700 -3.6367 -3.6367 -3.5868 -3.5868 -3.3792 -3.3792 -3.3308 -3.3308 -1.1729 -1.1729 -1.1112 -1.1112 1.2928 1.2928 1.3268 1.3268 1.6581 1.6581 1.6685 1.6685 1.7626 1.7626 1.7739 1.7739 1.9857 1.9857 1.9945 1.9945 2.0594 2.0594 2.1142 2.1142 3.0129 3.0129 3.0737 3.0737 3.5811 3.5811 3.6430 3.6430 3.9538 3.9538 3.9791 3.9791 4.1879 4.1879 4.1958 4.1958 5.8410 5.8410 6.1808 6.1808 6.2186 6.2186 6.4504 6.4504 11.2475 11.2475 11.3083 11.3083 11.7614 11.7614 11.8126 11.8126 13.1245 13.1245 13.3328 13.3328 14.0813 14.0813 k = 0.4259 0.4259 0.2197 ( 6598 PWs) bands (ev): -18.6001 -18.6001 -18.5880 -18.5880 -15.1381 -15.1381 -15.1330 -15.1330 -5.4388 -5.4388 -5.3637 -5.3637 -3.6405 -3.6405 -3.5820 -3.5820 -3.3799 -3.3799 -3.3243 -3.3243 -1.1877 -1.1877 -1.1076 -1.1076 1.2919 1.2919 1.3356 1.3356 1.6516 1.6516 1.6632 1.6632 1.7635 1.7635 1.7768 1.7768 1.9817 1.9817 1.9911 1.9911 2.0528 2.0528 2.1215 2.1215 3.0082 3.0082 3.0820 3.0820 3.5783 3.5783 3.6505 3.6505 3.9382 3.9382 3.9740 3.9740 4.2003 4.2003 4.2124 4.2124 5.8079 5.8079 6.2028 6.2028 6.2497 6.2497 6.5052 6.5052 11.2603 11.2603 11.3310 11.3310 11.7617 11.7617 11.8189 11.8189 13.0966 13.0966 13.3426 13.3426 14.0926 14.0926 k = 0.4167 0.4167 0.2197 ( 6596 PWs) bands (ev): -18.6039 -18.6039 -18.5887 -18.5887 -15.1363 -15.1363 -15.1299 -15.1299 -5.4412 -5.4412 -5.3572 -5.3572 -3.6445 -3.6445 -3.5768 -3.5768 -3.3802 -3.3802 -3.3174 -3.3174 -1.2044 -1.2044 -1.1036 -1.1036 1.2909 1.2909 1.3452 1.3452 1.6450 1.6450 1.6575 1.6575 1.7643 1.7643 1.7797 1.7797 1.9777 1.9777 1.9872 1.9872 2.0460 2.0460 2.1292 2.1292 3.0045 3.0045 3.0916 3.0916 3.5748 3.5748 3.6560 3.6560 3.9208 3.9208 3.9695 3.9695 4.2134 4.2134 4.2316 4.2316 5.7761 5.7761 6.2275 6.2275 6.2848 6.2848 6.5616 6.5616 11.2746 11.2746 11.3546 11.3546 11.7632 11.7632 11.8261 11.8261 13.0725 13.0725 13.3517 13.3517 14.1028 14.1028 k = 0.4074 0.4074 0.2197 ( 6596 PWs) bands (ev): -18.6081 -18.6081 -18.5895 -18.5895 -15.1343 -15.1343 -15.1265 -15.1265 -5.4433 -5.4433 -5.3506 -5.3506 -3.6486 -3.6486 -3.5712 -3.5712 -3.3803 -3.3803 -3.3101 -3.3101 -1.2229 -1.2229 -1.0995 -1.0995 1.2899 1.2899 1.3554 1.3554 1.6384 1.6384 1.6514 1.6514 1.7651 1.7651 1.7824 1.7824 1.9735 1.9735 1.9827 1.9827 2.0393 2.0393 2.1370 2.1370 3.0021 3.0021 3.1024 3.1024 3.5704 3.5704 3.6593 3.6593 3.9019 3.9019 3.9656 3.9656 4.2273 4.2273 4.2533 4.2533 5.7457 5.7457 6.2548 6.2548 6.3237 6.3237 6.6196 6.6196 11.2905 11.2905 11.3782 11.3782 11.7663 11.7663 11.8341 11.8341 13.0533 13.0533 13.3596 13.3596 14.0987 14.0987 k = 0.3981 0.3981 0.2197 ( 6608 PWs) bands (ev): -18.6127 -18.6127 -18.5904 -18.5904 -15.1321 -15.1321 -15.1227 -15.1227 -5.4451 -5.4451 -5.3438 -5.3438 -3.6527 -3.6527 -3.5653 -3.5653 -3.3801 -3.3801 -3.3023 -3.3023 -1.2432 -1.2432 -1.0951 -1.0951 1.2890 1.2890 1.3662 1.3662 1.6320 1.6320 1.6451 1.6451 1.7658 1.7658 1.7849 1.7849 1.9691 1.9691 1.9774 1.9774 2.0328 2.0328 2.1448 2.1448 3.0010 3.0010 3.1145 3.1145 3.5650 3.5650 3.6602 3.6602 3.8815 3.8815 3.9626 3.9626 4.2421 4.2421 4.2770 4.2770 5.7167 5.7167 6.2845 6.2845 6.3662 6.3662 6.6793 6.6793 11.3077 11.3077 11.4012 11.4012 11.7710 11.7710 11.8433 11.8433 13.0400 13.0400 13.3654 13.3654 14.0502 14.0502 k = 0.3889 0.3889 0.2197 ( 6600 PWs) bands (ev): -18.6177 -18.6177 -18.5913 -18.5913 -15.1298 -15.1298 -15.1187 -15.1187 -5.4466 -5.4466 -5.3370 -5.3370 -3.6568 -3.6568 -3.5591 -3.5591 -3.3796 -3.3796 -3.2943 -3.2943 -1.2652 -1.2652 -1.0906 -1.0906 1.2882 1.2882 1.3775 1.3775 1.6258 1.6258 1.6386 1.6386 1.7664 1.7664 1.7874 1.7874 1.9648 1.9648 1.9717 1.9717 2.0268 2.0268 2.1525 2.1525 3.0012 3.0012 3.1280 3.1280 3.5586 3.5586 3.6587 3.6587 3.8599 3.8599 3.9606 3.9606 4.2579 4.2579 4.3024 4.3024 5.6893 5.6893 6.3166 6.3166 6.4122 6.4122 6.7405 6.7405 11.3263 11.3263 11.4228 11.4228 11.7776 11.7776 11.8540 11.8540 13.0335 13.0335 13.3685 13.3685 13.9752 13.9752 k = 0.3796 0.3796 0.2197 ( 6596 PWs) bands (ev): -18.6230 -18.6230 -18.5922 -18.5922 -15.1273 -15.1273 -15.1144 -15.1144 -5.4478 -5.4478 -5.3301 -5.3301 -3.6608 -3.6608 -3.5525 -3.5525 -3.3788 -3.3788 -3.2859 -3.2859 -1.2888 -1.2888 -1.0860 -1.0860 1.2874 1.2874 1.3891 1.3891 1.6197 1.6197 1.6321 1.6321 1.7670 1.7670 1.7896 1.7896 1.9600 1.9600 1.9657 1.9657 2.0215 2.0215 2.1600 2.1600 3.0026 3.0026 3.1428 3.1428 3.5511 3.5511 3.6552 3.6552 3.8371 3.8371 3.9594 3.9594 4.2747 4.2747 4.3291 4.3291 5.6634 5.6634 6.3510 6.3510 6.4613 6.4613 6.8031 6.8031 11.3461 11.3461 11.4422 11.4422 11.7860 11.7860 11.8666 11.8666 13.0344 13.0344 13.3682 13.3682 13.8847 13.8847 k = 0.3704 0.3704 0.2197 ( 6604 PWs) bands (ev): -18.6286 -18.6286 -18.5933 -18.5933 -15.1246 -15.1246 -15.1098 -15.1098 -5.4486 -5.4486 -5.3231 -5.3231 -3.6648 -3.6648 -3.5455 -3.5455 -3.3777 -3.3777 -3.2772 -3.2772 -1.3140 -1.3140 -1.0814 -1.0814 1.2868 1.2868 1.4006 1.4006 1.6137 1.6137 1.6259 1.6259 1.7675 1.7675 1.7916 1.7916 1.9541 1.9541 1.9604 1.9604 2.0168 2.0168 2.1670 2.1670 3.0052 3.0052 3.1590 3.1590 3.5424 3.5424 3.6497 3.6497 3.8133 3.8133 3.9592 3.9592 4.2927 4.2927 4.3566 4.3566 5.6392 5.6392 6.3876 6.3876 6.5134 6.5134 6.8670 6.8670 11.3668 11.3668 11.4590 11.4590 11.7961 11.7961 11.8815 11.8815 13.0432 13.0432 13.3638 13.3638 13.7839 13.7839 k = 0.3611 0.3611 0.2197 ( 6602 PWs) bands (ev): -18.6345 -18.6345 -18.5944 -18.5944 -15.1218 -15.1218 -15.1049 -15.1049 -5.4491 -5.4491 -5.3160 -5.3160 -3.6686 -3.6686 -3.5383 -3.5383 -3.3763 -3.3763 -3.2682 -3.2682 -1.3405 -1.3405 -1.0768 -1.0768 1.2864 1.2864 1.4119 1.4119 1.6076 1.6076 1.6203 1.6203 1.7680 1.7680 1.7934 1.7934 1.9468 1.9468 1.9563 1.9563 2.0129 2.0129 2.1735 2.1735 3.0087 3.0087 3.1767 3.1767 3.5326 3.5326 3.6425 3.6425 3.7887 3.7887 3.9598 3.9598 4.3121 4.3121 4.3847 4.3847 5.6167 5.6167 6.4263 6.4263 6.5682 6.5682 6.9322 6.9322 11.3884 11.3884 11.4728 11.4728 11.8075 11.8075 11.8994 11.8994 13.0601 13.0601 13.3549 13.3549 13.6772 13.6772 k = 0.3519 0.3519 0.2197 ( 6610 PWs) bands (ev): -18.6408 -18.6408 -18.5956 -18.5956 -15.1189 -15.1189 -15.0997 -15.0997 -5.4492 -5.4492 -5.3089 -5.3089 -3.6723 -3.6723 -3.5307 -3.5307 -3.3746 -3.3746 -3.2590 -3.2590 -1.3684 -1.3684 -1.0724 -1.0724 1.2862 1.2862 1.4226 1.4226 1.6012 1.6012 1.6156 1.6156 1.7685 1.7685 1.7949 1.7949 1.9389 1.9389 1.9529 1.9529 2.0097 2.0097 2.1793 2.1793 3.0131 3.0131 3.1957 3.1957 3.5217 3.5217 3.6337 3.6337 3.7635 3.7635 3.9612 3.9612 4.3330 4.3330 4.4131 4.4131 5.5961 5.5961 6.4670 6.4670 6.6253 6.6253 6.9983 6.9983 11.4103 11.4103 11.4839 11.4839 11.8200 11.8200 11.9209 11.9209 13.0847 13.0847 13.3410 13.3410 13.5680 13.5680 k = 0.3426 0.3426 0.2197 ( 6610 PWs) bands (ev): -18.6472 -18.6472 -18.5968 -18.5968 -15.1159 -15.1159 -15.0944 -15.0944 -5.4490 -5.4490 -5.3019 -5.3019 -3.6757 -3.6757 -3.5229 -3.5229 -3.3726 -3.3726 -3.2496 -3.2496 -1.3974 -1.3974 -1.0681 -1.0681 1.2862 1.2862 1.4325 1.4325 1.5944 1.5944 1.6120 1.6120 1.7691 1.7691 1.7962 1.7962 1.9309 1.9309 1.9501 1.9501 2.0071 2.0071 2.1844 2.1844 3.0180 3.0180 3.2161 3.2161 3.5098 3.5098 3.6235 3.6235 3.7378 3.7378 3.9633 3.9633 4.3555 4.3555 4.4416 4.4416 5.5773 5.5773 6.5097 6.5097 6.6845 6.6845 7.0653 7.0653 11.4314 11.4314 11.4932 11.4932 11.8331 11.8331 11.9466 11.9466 13.1161 13.1161 13.3216 13.3216 13.4601 13.4601 k = 0.3333 0.3333 0.2197 ( 6616 PWs) bands (ev): -18.6539 -18.6539 -18.5981 -18.5981 -15.1128 -15.1128 -15.0888 -15.0888 -5.4484 -5.4484 -5.2948 -5.2948 -3.6789 -3.6789 -3.5149 -3.5149 -3.3703 -3.3703 -3.2401 -3.2401 -1.4275 -1.4275 -1.0640 -1.0640 1.2864 1.2864 1.4413 1.4413 1.5872 1.5872 1.6095 1.6095 1.7698 1.7698 1.7972 1.7972 1.9231 1.9231 1.9477 1.9477 2.0052 2.0052 2.1886 2.1886 3.0234 3.0234 3.2379 3.2379 3.4968 3.4968 3.6121 3.6121 3.7119 3.7119 3.9658 3.9658 4.3798 4.3798 4.4701 4.4701 5.5606 5.5606 6.5543 6.5543 6.7454 6.7454 7.1328 7.1328 11.4490 11.4490 11.5037 11.5037 11.8466 11.8466 11.9768 11.9768 13.1505 13.1505 13.2953 13.2953 13.3602 13.3602 k = 0.3241 0.3241 0.2197 ( 6612 PWs) bands (ev): -18.6608 -18.6608 -18.5994 -18.5994 -15.1097 -15.1097 -15.0830 -15.0830 -5.4475 -5.4475 -5.2877 -5.2877 -3.6817 -3.6817 -3.5066 -3.5066 -3.3678 -3.3678 -3.2304 -3.2304 -1.4584 -1.4584 -1.0601 -1.0601 1.2869 1.2869 1.4489 1.4489 1.5798 1.5798 1.6079 1.6079 1.7706 1.7706 1.7983 1.7983 1.9158 1.9158 1.9458 1.9458 2.0039 2.0039 2.1919 2.1919 3.0290 3.0290 3.2611 3.2611 3.4830 3.4830 3.5994 3.5994 3.6859 3.6859 3.9688 3.9688 4.4061 4.4061 4.4985 4.4985 5.5461 5.5461 6.6007 6.6007 6.8077 6.8077 7.2006 7.2006 11.4586 11.4586 11.5200 11.5200 11.8603 11.8603 12.0115 12.0115 13.1644 13.1644 13.2635 13.2635 13.2914 13.2914 k = 0.3148 0.3148 0.2197 ( 6596 PWs) bands (ev): -18.6679 -18.6679 -18.6007 -18.6007 -15.1064 -15.1064 -15.0770 -15.0770 -5.4462 -5.4462 -5.2807 -5.2807 -3.6842 -3.6842 -3.4982 -3.4982 -3.3650 -3.3650 -3.2207 -3.2207 -1.4900 -1.4900 -1.0565 -1.0565 1.2876 1.2876 1.4551 1.4551 1.5723 1.5723 1.6070 1.6070 1.7711 1.7711 1.7997 1.7997 1.9092 1.9092 1.9444 1.9444 2.0032 2.0032 2.1942 2.1942 3.0346 3.0346 3.2854 3.2854 3.4684 3.4684 3.5854 3.5854 3.6602 3.6602 3.9719 3.9719 4.4346 4.4346 4.5267 4.5267 5.5337 5.5337 6.6488 6.6488 6.8709 6.8709 7.2684 7.2684 11.4595 11.4595 11.5434 11.5434 11.8743 11.8743 12.0510 12.0510 13.1031 13.1031 13.2451 13.2451 13.2901 13.2901 k = 0.3056 0.3056 0.2197 ( 6596 PWs) bands (ev): -18.6752 -18.6752 -18.6021 -18.6021 -15.1031 -15.1031 -15.0708 -15.0708 -5.4445 -5.4445 -5.2738 -5.2738 -3.6862 -3.6862 -3.4896 -3.4896 -3.3619 -3.3619 -3.2110 -3.2110 -1.5222 -1.5222 -1.0532 -1.0532 1.2885 1.2885 1.4599 1.4599 1.5646 1.5646 1.6063 1.6063 1.7708 1.7708 1.8021 1.8021 1.9035 1.9035 1.9434 1.9434 2.0030 2.0030 2.1956 2.1956 3.0402 3.0402 3.3109 3.3109 3.4530 3.4530 3.5701 3.5701 3.6349 3.6349 3.9751 3.9751 4.4653 4.4653 4.5548 4.5548 5.5237 5.5237 6.6986 6.6986 6.9348 6.9348 7.3358 7.3358 11.4540 11.4540 11.5718 11.5718 11.8885 11.8885 12.0950 12.0950 13.0136 13.0136 13.2093 13.2093 13.3403 13.3403 k = 0.2963 0.2963 0.2197 ( 6600 PWs) bands (ev): -18.6825 -18.6825 -18.6035 -18.6035 -15.0997 -15.0997 -15.0646 -15.0646 -5.4425 -5.4425 -5.2671 -5.2671 -3.6879 -3.6879 -3.4810 -3.4810 -3.3585 -3.3585 -3.2014 -3.2014 -1.5548 -1.5548 -1.0503 -1.0503 1.2896 1.2896 1.4634 1.4634 1.5569 1.5569 1.6055 1.6055 1.7693 1.7693 1.8059 1.8059 1.8988 1.8988 1.9429 1.9429 2.0035 2.0035 2.1958 2.1958 3.0455 3.0455 3.3373 3.3373 3.4370 3.4370 3.5532 3.5532 3.6106 3.6106 3.9783 3.9783 4.4984 4.4984 4.5827 4.5827 5.5161 5.5161 6.7499 6.7499 6.9991 6.9991 7.4024 7.4024 11.4445 11.4445 11.6034 11.6034 11.9030 11.9030 12.1434 12.1434 12.9236 12.9236 13.1705 13.1705 13.3991 13.3991 k = 0.2870 0.2870 0.2197 ( 6588 PWs) bands (ev): -18.6900 -18.6900 -18.6050 -18.6050 -15.0964 -15.0964 -15.0581 -15.0581 -5.4400 -5.4400 -5.2604 -5.2604 -3.6890 -3.6890 -3.4723 -3.4723 -3.3549 -3.3549 -3.1919 -3.1919 -1.5877 -1.5877 -1.0477 -1.0477 1.2910 1.2910 1.4657 1.4657 1.5491 1.5491 1.6045 1.6045 1.7664 1.7664 1.8117 1.8117 1.8950 1.8950 1.9429 1.9429 2.0047 2.0047 2.1952 2.1952 3.0504 3.0504 3.3645 3.3645 3.4206 3.4206 3.5348 3.5348 3.5874 3.5874 3.9813 3.9813 4.5340 4.5340 4.6106 4.6106 5.5110 5.5110 6.8028 6.8028 7.0634 7.0634 7.4678 7.4678 11.4321 11.4321 11.6373 11.6373 11.9177 11.9177 12.1960 12.1960 12.8376 12.8376 13.1296 13.1296 13.3799 13.3799 k = 0.2778 0.2778 0.2197 ( 6584 PWs) bands (ev): -18.6976 -18.6976 -18.6065 -18.6065 -15.0929 -15.0929 -15.0516 -15.0516 -5.4373 -5.4373 -5.2539 -5.2539 -3.6896 -3.6896 -3.4636 -3.4636 -3.3510 -3.3510 -3.1825 -3.1825 -1.6206 -1.6206 -1.0454 -1.0454 1.2925 1.2925 1.4669 1.4669 1.5413 1.5413 1.6028 1.6028 1.7623 1.7623 1.8190 1.8190 1.8922 1.8922 1.9432 1.9432 2.0066 2.0066 2.1935 2.1935 3.0549 3.0549 3.3912 3.3912 3.4047 3.4047 3.5150 3.5150 3.5655 3.5655 3.9841 3.9841 4.5722 4.5722 4.6384 4.6384 5.5086 5.5086 6.8571 6.8571 7.1275 7.1275 7.5315 7.5315 11.4176 11.4176 11.6732 11.6732 11.9323 11.9323 12.2527 12.2527 12.7568 12.7568 13.0871 13.0871 13.2058 13.2058 k = 0.2685 0.2685 0.2197 ( 6580 PWs) bands (ev): -18.7052 -18.7052 -18.6079 -18.6079 -15.0895 -15.0895 -15.0450 -15.0450 -5.4341 -5.4341 -5.2476 -5.2476 -3.6897 -3.6897 -3.4549 -3.4549 -3.3469 -3.3469 -3.1733 -3.1733 -1.6534 -1.6534 -1.0436 -1.0436 1.2942 1.2942 1.4674 1.4674 1.5334 1.5334 1.6004 1.6004 1.7572 1.7572 1.8278 1.8278 1.8902 1.8902 1.9439 1.9439 2.0092 2.0092 2.1908 2.1908 3.0588 3.0588 3.3855 3.3855 3.4204 3.4204 3.4946 3.4946 3.5449 3.5449 3.9866 3.9866 4.6131 4.6131 4.6662 4.6662 5.5088 5.5088 6.9127 6.9127 7.1913 7.1913 7.5930 7.5930 11.4017 11.4017 11.7105 11.7105 11.9463 11.9463 12.3131 12.3131 12.6815 12.6815 13.0298 13.0298 13.0445 13.0445 k = 0.2593 0.2593 0.2197 ( 6580 PWs) bands (ev): -18.7128 -18.7128 -18.6094 -18.6094 -15.0861 -15.0861 -15.0384 -15.0384 -5.4306 -5.4306 -5.2415 -5.2415 -3.6893 -3.6893 -3.4463 -3.4463 -3.3426 -3.3426 -3.1645 -3.1645 -1.6860 -1.6860 -1.0421 -1.0421 1.2960 1.2960 1.4672 1.4672 1.5255 1.5255 1.5972 1.5972 1.7514 1.7514 1.8375 1.8375 1.8891 1.8891 1.9450 1.9450 2.0127 2.0127 2.1872 2.1872 3.0622 3.0622 3.3681 3.3681 3.4423 3.4423 3.4783 3.4783 3.5256 3.5256 3.9888 3.9888 4.6566 4.6566 4.6939 4.6939 5.5119 5.5119 6.9698 6.9698 7.2544 7.2544 7.6518 7.6518 11.3849 11.3849 11.7488 11.7488 11.9587 11.9587 12.3769 12.3769 12.6114 12.6114 12.8580 12.8580 13.0001 13.0001 k = 0.2500 0.2500 0.2197 ( 6568 PWs) bands (ev): -18.7205 -18.7205 -18.6110 -18.6110 -15.0827 -15.0827 -15.0317 -15.0317 -5.4267 -5.4267 -5.2357 -5.2357 -3.6882 -3.6882 -3.4378 -3.4378 -3.3381 -3.3381 -3.1560 -3.1560 -1.7183 -1.7183 -1.0409 -1.0409 1.2979 1.2979 1.4665 1.4665 1.5177 1.5177 1.5933 1.5933 1.7453 1.7453 1.8474 1.8474 1.8887 1.8887 1.9465 1.9465 2.0172 2.0172 2.1828 2.1828 3.0650 3.0650 3.3504 3.3504 3.4379 3.4379 3.4847 3.4847 3.5103 3.5103 3.9906 3.9906 4.7025 4.7025 4.7221 4.7221 5.5178 5.5178 7.0280 7.0280 7.3168 7.3168 7.7073 7.7073 11.3678 11.3678 11.7874 11.7874 11.9673 11.9673 12.4428 12.4428 12.5461 12.5461 12.6917 12.6917 12.9038 12.9038 k = 0.2407 0.2407 0.2197 ( 6566 PWs) bands (ev): -18.7281 -18.7281 -18.6125 -18.6125 -15.0794 -15.0794 -15.0250 -15.0250 -5.4224 -5.4224 -5.2302 -5.2302 -3.6866 -3.6866 -3.4296 -3.4296 -3.3334 -3.3334 -3.1478 -3.1478 -1.7500 -1.7500 -1.0401 -1.0401 1.3000 1.3000 1.4654 1.4654 1.5098 1.5098 1.5888 1.5888 1.7390 1.7390 1.8568 1.8568 1.8892 1.8892 1.9483 1.9483 2.0225 2.0225 2.1776 2.1776 3.0672 3.0672 3.3325 3.3325 3.4175 3.4175 3.4801 3.4801 3.5221 3.5221 3.9919 3.9919 4.7454 4.7454 4.7558 4.7558 5.5267 5.5267 7.0875 7.0875 7.3784 7.3784 7.7590 7.7590 11.3508 11.3508 11.8256 11.8256 11.9673 11.9673 12.4750 12.4750 12.5110 12.5110 12.5452 12.5452 12.7771 12.7771 k = 0.2315 0.2315 0.2197 ( 6572 PWs) bands (ev): -18.7357 -18.7357 -18.6140 -18.6140 -15.0761 -15.0761 -15.0183 -15.0183 -5.4178 -5.4178 -5.2249 -5.2249 -3.6843 -3.6843 -3.4215 -3.4215 -3.3286 -3.3286 -3.1402 -3.1402 -1.7811 -1.7811 -1.0397 -1.0397 1.3020 1.3020 1.4639 1.4639 1.5019 1.5019 1.5836 1.5836 1.7328 1.7328 1.8648 1.8648 1.8912 1.8912 1.9504 1.9504 2.0289 2.0289 2.1718 2.1718 3.0689 3.0689 3.3146 3.3146 3.3950 3.3950 3.4620 3.4620 3.5495 3.5495 3.9929 3.9929 4.7747 4.7747 4.8057 4.8057 5.5386 5.5386 7.1480 7.1480 7.4392 7.4392 7.8063 7.8063 11.3341 11.3341 11.8624 11.8624 11.9479 11.9479 12.3828 12.3828 12.4404 12.4404 12.5816 12.5816 12.6531 12.6531 k = 0.2222 0.2222 0.2197 ( 6580 PWs) bands (ev): -18.7432 -18.7432 -18.6155 -18.6155 -15.0728 -15.0728 -15.0116 -15.0116 -5.4129 -5.4129 -5.2200 -5.2200 -3.6814 -3.6814 -3.4136 -3.4136 -3.3237 -3.3237 -3.1330 -3.1330 -1.8114 -1.8114 -1.0396 -1.0396 1.3042 1.3042 1.4621 1.4621 1.4940 1.4940 1.5781 1.5781 1.7268 1.7268 1.8704 1.8704 1.8950 1.8950 1.9526 1.9526 2.0363 2.0363 2.1654 2.1654 3.0700 3.0700 3.2967 3.2967 3.3724 3.3724 3.4423 3.4423 3.5785 3.5785 3.9935 3.9935 4.8019 4.8019 4.8602 4.8602 5.5535 5.5535 7.2096 7.2096 7.4991 7.4991 7.8487 7.8487 11.3176 11.3176 11.8873 11.8873 11.8997 11.8997 12.2911 12.2911 12.3836 12.3836 12.5212 12.5212 12.6495 12.6495 k = 0.2130 0.2130 0.2197 ( 6584 PWs) bands (ev): -18.7506 -18.7506 -18.6170 -18.6170 -15.0696 -15.0696 -15.0050 -15.0050 -5.4076 -5.4076 -5.2155 -5.2155 -3.6778 -3.6778 -3.4061 -3.4061 -3.3187 -3.3187 -3.1263 -3.1263 -1.8407 -1.8407 -1.0397 -1.0397 1.3064 1.3064 1.4600 1.4600 1.4862 1.4862 1.5722 1.5722 1.7213 1.7213 1.8734 1.8734 1.9007 1.9007 1.9551 1.9551 2.0446 2.0446 2.1588 2.1588 3.0707 3.0707 3.2789 3.2789 3.3501 3.3501 3.4219 3.4219 3.6076 3.6076 3.9938 3.9938 4.8285 4.8285 4.9176 4.9176 5.5714 5.5714 7.2722 7.2722 7.5581 7.5581 7.8859 7.8859 11.3010 11.3010 11.7843 11.7843 11.9281 11.9281 12.2429 12.2429 12.3359 12.3359 12.3975 12.3975 12.6868 12.6868 k = 0.2037 0.2037 0.2197 ( 6592 PWs) bands (ev): -18.7579 -18.7579 -18.6185 -18.6185 -15.0664 -15.0664 -14.9985 -14.9985 -5.4021 -5.4021 -5.2113 -5.2113 -3.6736 -3.6736 -3.3989 -3.3989 -3.3138 -3.3138 -3.1203 -3.1203 -1.8691 -1.8691 -1.0402 -1.0402 1.3086 1.3086 1.4576 1.4576 1.4785 1.4785 1.5662 1.5662 1.7163 1.7163 1.8748 1.8748 1.9071 1.9071 1.9576 1.9576 2.0536 2.0536 2.1521 2.1521 3.0708 3.0708 3.2613 3.2613 3.3285 3.3285 3.4011 3.4011 3.6364 3.6364 3.9937 3.9937 4.8545 4.8545 4.9777 4.9777 5.5924 5.5924 7.3356 7.3356 7.6163 7.6163 7.9175 7.9175 11.2834 11.2834 11.6460 11.6460 11.9539 11.9539 12.2195 12.2195 12.2751 12.2751 12.3015 12.3015 12.6836 12.6836 k = 0.1944 0.1944 0.2197 ( 6580 PWs) bands (ev): -18.7650 -18.7650 -18.6199 -18.6199 -15.0634 -15.0634 -14.9920 -14.9920 -5.3962 -5.3962 -5.2075 -5.2075 -3.6687 -3.6687 -3.3920 -3.3920 -3.3089 -3.3089 -3.1148 -3.1148 -1.8963 -1.8963 -1.0408 -1.0408 1.3109 1.3109 1.4548 1.4548 1.4712 1.4712 1.5601 1.5601 1.7119 1.7119 1.8752 1.8752 1.9134 1.9134 1.9601 1.9601 2.0631 2.0631 2.1458 2.1458 3.0706 3.0706 3.2439 3.2439 3.3076 3.3076 3.3800 3.3800 3.6645 3.6645 3.9933 3.9933 4.8798 4.8798 5.0404 5.0404 5.6165 5.6165 7.3999 7.3999 7.6737 7.6737 7.9432 7.9432 11.2632 11.2632 11.4921 11.4921 11.9736 11.9736 12.1452 12.1452 12.2057 12.2057 12.2901 12.2901 12.6578 12.6578 k = 0.1852 0.1852 0.2197 ( 6576 PWs) bands (ev): -18.7719 -18.7719 -18.6213 -18.6213 -15.0604 -15.0604 -14.9857 -14.9857 -5.3900 -5.3900 -5.2042 -5.2042 -3.6631 -3.6631 -3.3854 -3.3854 -3.3042 -3.3042 -3.1100 -3.1100 -1.9224 -1.9224 -1.0417 -1.0417 1.3131 1.3131 1.4512 1.4512 1.4644 1.4644 1.5539 1.5539 1.7083 1.7083 1.8751 1.8751 1.9192 1.9192 1.9624 1.9624 2.0722 2.0722 2.1405 2.1405 3.0700 3.0700 3.2269 3.2269 3.2876 3.2876 3.3586 3.3586 3.6917 3.6917 3.9927 3.9927 4.9043 4.9043 5.1056 5.1056 5.6435 5.6435 7.4649 7.4649 7.7305 7.7305 7.9630 7.9630 11.2383 11.2383 11.3324 11.3324 11.9834 11.9834 12.0288 12.0288 12.1767 12.1767 12.3019 12.3019 12.6258 12.6258 k = 0.1759 0.1759 0.2197 ( 6572 PWs) bands (ev): -18.7787 -18.7787 -18.6227 -18.6227 -15.0575 -15.0575 -14.9795 -14.9795 -5.3836 -5.3836 -5.2013 -5.2013 -3.6569 -3.6569 -3.3793 -3.3793 -3.2996 -3.2996 -3.1058 -3.1058 -1.9471 -1.9471 -1.0428 -1.0428 1.3154 1.3154 1.4466 1.4466 1.4587 1.4587 1.5478 1.5478 1.7053 1.7053 1.8747 1.8747 1.9243 1.9243 1.9643 1.9643 2.0800 2.0800 2.1370 2.1370 3.0691 3.0691 3.2102 3.2102 3.2686 3.2686 3.3371 3.3371 3.7179 3.7179 3.9918 3.9918 4.9279 4.9279 5.1731 5.1731 5.6734 5.6734 7.5304 7.5304 7.7865 7.7865 7.9769 7.9769 11.1664 11.1664 11.2114 11.2114 11.9015 11.9015 11.9966 11.9966 12.1535 12.1535 12.3255 12.3255 12.5929 12.5929 k = 0.1667 0.1667 0.2197 ( 6572 PWs) bands (ev): -18.7853 -18.7853 -18.6241 -18.6241 -15.0548 -15.0548 -14.9735 -14.9735 -5.3769 -5.3769 -5.1989 -5.1989 -3.6501 -3.6501 -3.3736 -3.3736 -3.2954 -3.2954 -3.1021 -3.1021 -1.9706 -1.9706 -1.0440 -1.0440 1.3175 1.3175 1.4408 1.4408 1.4541 1.4541 1.5417 1.5417 1.7031 1.7031 1.8742 1.8742 1.9287 1.9287 1.9656 1.9656 2.0851 2.0851 2.1369 2.1369 3.0679 3.0679 3.1940 3.1940 3.2506 3.2506 3.3155 3.3155 3.7429 3.7429 3.9908 3.9908 4.9504 4.9504 5.2428 5.2428 5.7060 5.7060 7.5965 7.5965 7.8419 7.8419 7.9849 7.9849 11.0060 11.0060 11.1712 11.1712 11.7838 11.7838 11.9940 11.9940 12.1409 12.1409 12.3553 12.3553 12.5610 12.5610 k = 0.1574 0.1574 0.2197 ( 6584 PWs) bands (ev): -18.7916 -18.7916 -18.6254 -18.6254 -15.0521 -15.0521 -14.9677 -14.9677 -5.3700 -5.3700 -5.1970 -5.1970 -3.6427 -3.6427 -3.3682 -3.3682 -3.2916 -3.2916 -3.0991 -3.0991 -1.9926 -1.9926 -1.0454 -1.0454 1.3196 1.3196 1.4342 1.4342 1.4502 1.4502 1.5357 1.5357 1.7018 1.7018 1.8734 1.8734 1.9325 1.9325 1.9661 1.9661 2.0865 2.0865 2.1411 2.1411 3.0664 3.0664 3.1783 3.1783 3.2337 3.2337 3.2941 3.2941 3.7666 3.7666 3.9896 3.9896 4.9718 4.9718 5.3144 5.3144 5.7412 5.7412 7.6628 7.6628 7.8965 7.8965 7.9875 7.9875 10.8453 10.8453 11.1238 11.1238 11.6671 11.6671 11.9844 11.9844 12.1421 12.1421 12.3889 12.3889 12.5309 12.5309 k = 0.1481 0.1481 0.2197 ( 6586 PWs) bands (ev): -18.7976 -18.7976 -18.6267 -18.6267 -15.0496 -15.0496 -14.9621 -14.9621 -5.3629 -5.3629 -5.1956 -5.1956 -3.6347 -3.6347 -3.3633 -3.3633 -3.2882 -3.2882 -3.0966 -3.0966 -2.0132 -2.0132 -1.0469 -1.0469 1.3217 1.3217 1.4272 1.4272 1.4469 1.4469 1.5300 1.5300 1.7012 1.7012 1.8726 1.8726 1.9358 1.9358 1.9658 1.9658 2.0851 2.0851 2.1487 2.1487 3.0646 3.0646 3.1631 3.1631 3.2180 3.2180 3.2728 3.2728 3.7889 3.7889 3.9884 3.9884 4.9919 4.9919 5.3878 5.3878 5.7788 5.7788 7.7294 7.7294 7.9503 7.9503 7.9851 7.9851 10.6868 10.6868 11.0683 11.0683 11.5524 11.5524 11.9674 11.9674 12.1585 12.1585 12.4246 12.4246 12.5038 12.5038 k = 0.1389 0.1389 0.2197 ( 6578 PWs) bands (ev): -18.8034 -18.8034 -18.6279 -18.6279 -15.0471 -15.0471 -14.9567 -14.9567 -5.3557 -5.3557 -5.1947 -5.1947 -3.6262 -3.6262 -3.3588 -3.3588 -3.2854 -3.2854 -3.0946 -3.0946 -2.0324 -2.0324 -1.0484 -1.0484 1.3237 1.3237 1.4202 1.4202 1.4438 1.4438 1.5245 1.5245 1.7015 1.7015 1.8717 1.8717 1.9385 1.9385 1.9644 1.9644 2.0825 2.0825 2.1583 2.1583 3.0626 3.0626 3.1486 3.1486 3.2035 3.2035 3.2520 3.2520 3.8098 3.8098 3.9872 3.9872 5.0107 5.0107 5.4626 5.4626 5.8185 5.8185 7.7958 7.7958 7.9764 7.9764 8.0049 8.0049 10.5311 10.5311 11.0057 11.0057 11.4401 11.4401 11.9435 11.9435 12.1899 12.1899 12.4525 12.4525 12.4888 12.4888 k = 0.1296 0.1296 0.2197 ( 6582 PWs) bands (ev): -18.8089 -18.8089 -18.6290 -18.6290 -15.0449 -15.0449 -14.9516 -14.9516 -5.3482 -5.3482 -5.1944 -5.1944 -3.6171 -3.6171 -3.3548 -3.3548 -3.2831 -3.2831 -3.0931 -3.0931 -2.0501 -2.0501 -1.0499 -1.0499 1.3256 1.3256 1.4132 1.4132 1.4408 1.4408 1.5192 1.5192 1.7025 1.7025 1.8706 1.8706 1.9406 1.9406 1.9621 1.9621 2.0796 2.0796 2.1688 2.1688 3.0604 3.0604 3.1347 3.1347 3.1903 3.1903 3.2316 3.2316 3.8290 3.8290 3.9859 3.9859 5.0282 5.0282 5.5385 5.5385 5.8600 5.8600 7.8619 7.8619 7.9654 7.9654 8.0569 8.0569 10.3788 10.3788 10.9379 10.9379 11.3304 11.3304 11.9140 11.9140 12.2350 12.2350 12.4416 12.4416 12.5166 12.5166 k = 0.1204 0.1204 0.2197 ( 6596 PWs) bands (ev): -18.8141 -18.8141 -18.6301 -18.6301 -15.0427 -15.0427 -14.9467 -14.9467 -5.3407 -5.3407 -5.1945 -5.1945 -3.6076 -3.6076 -3.3513 -3.3513 -3.2816 -3.2816 -3.0918 -3.0918 -2.0663 -2.0663 -1.0515 -1.0515 1.3274 1.3274 1.4065 1.4065 1.4378 1.4378 1.5142 1.5142 1.7043 1.7043 1.8694 1.8694 1.9417 1.9417 1.9591 1.9591 2.0771 2.0771 2.1793 2.1793 3.0579 3.0579 3.1215 3.1215 3.1783 3.1783 3.2119 3.2119 3.8467 3.8467 3.9848 3.9848 5.0442 5.0442 5.6151 5.6151 5.9030 5.9030 7.9258 7.9258 7.9521 7.9521 8.1082 8.1082 10.2307 10.2307 10.8670 10.8670 11.2238 11.2238 11.8800 11.8800 12.2922 12.2922 12.4197 12.4197 12.5591 12.5591 k = 0.1111 0.1111 0.2197 ( 6596 PWs) bands (ev): -18.8190 -18.8190 -18.6311 -18.6311 -15.0407 -15.0407 -14.9421 -14.9421 -5.3330 -5.3330 -5.1952 -5.1952 -3.5977 -3.5977 -3.3483 -3.3483 -3.2807 -3.2807 -3.0909 -3.0909 -2.0812 -2.0812 -1.0530 -1.0530 1.3291 1.3291 1.4000 1.4000 1.4351 1.4351 1.5095 1.5095 1.7067 1.7067 1.8681 1.8681 1.9413 1.9413 1.9563 1.9563 2.0752 2.0752 2.1898 2.1898 3.0553 3.0553 3.1092 3.1092 3.1675 3.1675 3.1930 3.1930 3.8627 3.8627 3.9839 3.9839 5.0589 5.0589 5.6920 5.6920 5.9469 5.9469 7.9300 7.9300 7.9945 7.9945 8.1584 8.1584 10.0873 10.0873 10.7950 10.7950 11.1206 11.1206 11.8429 11.8429 12.3597 12.3597 12.3979 12.3979 12.6050 12.6050 k = 0.1019 0.1019 0.2197 ( 6602 PWs) bands (ev): -18.8236 -18.8236 -18.6321 -18.6321 -15.0388 -15.0388 -14.9378 -14.9378 -5.3253 -5.3253 -5.1964 -5.1964 -3.5874 -3.5874 -3.3459 -3.3459 -3.2805 -3.2805 -3.0902 -3.0902 -2.0946 -2.0946 -1.0546 -1.0546 1.3307 1.3307 1.3938 1.3938 1.4324 1.4324 1.5051 1.5051 1.7099 1.7099 1.8667 1.8667 1.9384 1.9384 1.9548 1.9548 2.0740 2.0740 2.1997 2.1997 3.0526 3.0526 3.0976 3.0976 3.1579 3.1579 3.1751 3.1751 3.8771 3.8771 3.9832 3.9832 5.0721 5.0721 5.7686 5.7686 5.9914 5.9914 7.9095 7.9095 8.0578 8.0578 8.2070 8.2070 9.9492 9.9492 10.7234 10.7234 11.0212 11.0212 11.8039 11.8039 12.3771 12.3771 12.4361 12.4361 12.6530 12.6530 k = 0.0926 0.0926 0.2197 ( 6598 PWs) bands (ev): -18.8278 -18.8278 -18.6330 -18.6330 -15.0371 -15.0371 -14.9339 -14.9339 -5.3176 -5.3176 -5.1981 -5.1981 -3.5770 -3.5770 -3.3441 -3.3441 -3.2810 -3.2810 -3.0896 -3.0896 -2.1066 -2.1066 -1.0560 -1.0560 1.3322 1.3322 1.3880 1.3880 1.4299 1.4299 1.5010 1.5010 1.7137 1.7137 1.8651 1.8651 1.9332 1.9332 1.9549 1.9549 2.0733 2.0733 2.2091 2.2091 3.0499 3.0499 3.0870 3.0870 3.1491 3.1491 3.1586 3.1586 3.8897 3.8897 3.9828 3.9828 5.0840 5.0840 5.8443 5.8443 6.0359 6.0359 7.8868 7.8868 8.1199 8.1199 8.2539 8.2539 9.8172 9.8172 10.6539 10.6539 10.9262 10.9262 11.7640 11.7640 12.3577 12.3577 12.5198 12.5198 12.7026 12.7026 k = 0.0833 0.0833 0.2197 ( 6594 PWs) bands (ev): -18.8316 -18.8316 -18.6338 -18.6338 -15.0356 -15.0356 -14.9302 -14.9302 -5.3098 -5.3098 -5.2003 -5.2003 -3.5664 -3.5664 -3.3429 -3.3429 -3.2819 -3.2819 -3.0891 -3.0891 -2.1173 -2.1173 -1.0574 -1.0574 1.3336 1.3336 1.3826 1.3826 1.4276 1.4276 1.4973 1.4973 1.7180 1.7180 1.8633 1.8633 1.9268 1.9268 1.9556 1.9556 2.0732 2.0732 2.2179 2.2179 3.0471 3.0471 3.0772 3.0772 3.1388 3.1388 3.1459 3.1459 3.9006 3.9006 3.9828 3.9828 5.0945 5.0945 5.9182 5.9182 6.0797 6.0797 7.8628 7.8628 8.1799 8.1799 8.2986 8.2986 9.6922 9.6922 10.5877 10.5877 10.8360 10.8360 11.7243 11.7243 12.3399 12.3399 12.6095 12.6095 12.7537 12.7537 k = 0.0741 0.0741 0.2197 ( 6588 PWs) bands (ev): -18.8350 -18.8350 -18.6346 -18.6346 -15.0341 -15.0341 -14.9269 -14.9269 -5.3021 -5.3021 -5.2030 -5.2030 -3.5559 -3.5559 -3.3425 -3.3425 -3.2832 -3.2832 -3.0887 -3.0887 -2.1267 -2.1267 -1.0586 -1.0586 1.3350 1.3350 1.3776 1.3776 1.4255 1.4255 1.4940 1.4940 1.7228 1.7228 1.8613 1.8613 1.9200 1.9200 1.9564 1.9564 2.0734 2.0734 2.2258 2.2258 3.0446 3.0446 3.0683 3.0683 3.1253 3.1253 3.1386 3.1386 3.9097 3.9097 3.9831 3.9831 5.1037 5.1037 5.9894 5.9894 6.1223 6.1223 7.8383 7.8383 8.2369 8.2369 8.3409 8.3409 9.5751 9.5751 10.5259 10.5259 10.7514 10.7514 11.6858 11.6858 12.3237 12.3237 12.7040 12.7040 12.8059 12.8059 k = 0.0648 0.0648 0.2197 ( 6584 PWs) bands (ev): -18.8381 -18.8381 -18.6352 -18.6352 -15.0329 -15.0329 -14.9240 -14.9240 -5.2945 -5.2945 -5.2062 -5.2062 -3.5455 -3.5455 -3.3428 -3.3428 -3.2848 -3.2848 -3.0883 -3.0883 -2.1348 -2.1348 -1.0597 -1.0597 1.3362 1.3362 1.3730 1.3730 1.4236 1.4236 1.4910 1.4910 1.7279 1.7279 1.8588 1.8588 1.9132 1.9132 1.9574 1.9574 2.0738 2.0738 2.2330 2.2330 3.0422 3.0422 3.0605 3.0605 3.1120 3.1120 3.1334 3.1334 3.9172 3.9172 3.9840 3.9840 5.1116 5.1116 6.0570 6.0570 6.1628 6.1628 7.8140 7.8140 8.2902 8.2902 8.3804 8.3804 9.4669 9.4669 10.4694 10.4694 10.6732 10.6732 11.6494 11.6494 12.3092 12.3092 12.8011 12.8011 12.8600 12.8600 k = 0.0556 0.0556 0.2197 ( 6568 PWs) bands (ev): -18.8408 -18.8408 -18.6358 -18.6358 -15.0318 -15.0318 -14.9214 -14.9214 -5.2870 -5.2870 -5.2098 -5.2098 -3.5355 -3.5355 -3.3439 -3.3439 -3.2864 -3.2864 -3.0879 -3.0879 -2.1418 -2.1418 -1.0608 -1.0608 1.3374 1.3374 1.3688 1.3688 1.4219 1.4219 1.4884 1.4884 1.7333 1.7333 1.8560 1.8560 1.9071 1.9071 1.9582 1.9582 2.0745 2.0745 2.2393 2.2393 3.0403 3.0403 3.0536 3.0536 3.0998 3.0998 3.1293 3.1293 3.9231 3.9231 3.9852 3.9852 5.1184 5.1184 6.1198 6.1198 6.2004 6.2004 7.7907 7.7907 8.3387 8.3387 8.4167 8.4167 9.3690 9.3690 10.4189 10.4189 10.6021 10.6021 11.6159 11.6159 12.2965 12.2965 12.8905 12.8905 12.9243 12.9243 k = 0.0463 0.0463 0.2197 ( 6580 PWs) bands (ev): -18.8431 -18.8431 -18.6363 -18.6363 -15.0309 -15.0309 -14.9193 -14.9193 -5.2797 -5.2797 -5.2138 -5.2138 -3.5262 -3.5262 -3.3457 -3.3457 -3.2878 -3.2878 -3.0875 -3.0875 -2.1475 -2.1475 -1.0617 -1.0617 1.3384 1.3384 1.3651 1.3651 1.4205 1.4205 1.4861 1.4861 1.7386 1.7386 1.8526 1.8526 1.9016 1.9016 1.9590 1.9590 2.0751 2.0751 2.2446 2.2446 3.0388 3.0388 3.0477 3.0477 3.0890 3.0890 3.1261 3.1261 3.9275 3.9275 3.9866 3.9866 5.1240 5.1240 6.1763 6.1763 6.2343 6.2343 7.7690 7.7690 8.3812 8.3812 8.4495 8.4495 9.2826 9.2826 10.3751 10.3751 10.5393 10.5393 11.5861 11.5861 12.2856 12.2856 12.9510 12.9510 13.0177 13.0177 k = 0.0370 0.0370 0.2197 ( 6572 PWs) bands (ev): -18.8450 -18.8450 -18.6367 -18.6367 -15.0301 -15.0301 -14.9175 -14.9175 -5.2727 -5.2727 -5.2181 -5.2181 -3.5177 -3.5177 -3.3479 -3.3479 -3.2890 -3.2890 -3.0872 -3.0872 -2.1522 -2.1522 -1.0624 -1.0624 1.3394 1.3394 1.3619 1.3619 1.4193 1.4193 1.4843 1.4843 1.7438 1.7438 1.8489 1.8489 1.8973 1.8973 1.9596 1.9596 2.0756 2.0756 2.2491 2.2491 3.0378 3.0378 3.0429 3.0429 3.0796 3.0796 3.1236 3.1236 3.9307 3.9307 3.9882 3.9882 5.1285 5.1285 6.2252 6.2252 6.2637 6.2637 7.7499 7.7499 8.4168 8.4168 8.4785 8.4785 9.2092 9.2092 10.3386 10.3386 10.4857 10.4857 11.5606 11.5606 12.2767 12.2767 12.9999 12.9999 13.1197 13.1197 k = 0.0278 0.0278 0.2197 ( 6568 PWs) bands (ev): -18.8464 -18.8464 -18.6370 -18.6370 -15.0295 -15.0295 -14.9160 -14.9160 -5.2660 -5.2660 -5.2226 -5.2226 -3.5106 -3.5106 -3.3503 -3.3503 -3.2900 -3.2900 -3.0870 -3.0870 -2.1558 -2.1558 -1.0629 -1.0629 1.3403 1.3403 1.3593 1.3593 1.4184 1.4184 1.4828 1.4828 1.7485 1.7485 1.8453 1.8453 1.8940 1.8940 1.9601 1.9601 2.0762 2.0762 2.2525 2.2525 3.0372 3.0372 3.0394 3.0394 3.0719 3.0719 3.1218 3.1218 3.9330 3.9330 3.9896 3.9896 5.1319 5.1319 6.2651 6.2651 6.2878 6.2878 7.7341 7.7341 8.4447 8.4447 8.5030 8.5030 9.1502 9.1502 10.3097 10.3097 10.4425 10.4425 11.5402 11.5402 12.2696 12.2696 13.0423 13.0423 13.2199 13.2199 k = 0.0185 0.0185 0.2197 ( 6564 PWs) bands (ev): -18.8475 -18.8475 -18.6372 -18.6372 -15.0291 -15.0291 -14.9150 -14.9150 -5.2601 -5.2601 -5.2271 -5.2271 -3.5051 -3.5051 -3.3524 -3.3524 -3.2906 -3.2906 -3.0868 -3.0868 -2.1584 -2.1584 -1.0634 -1.0634 1.3411 1.3411 1.3573 1.3573 1.4178 1.4178 1.4818 1.4818 1.7523 1.7523 1.8420 1.8420 1.8917 1.8917 1.9604 1.9604 2.0765 2.0765 2.2550 2.2550 3.0360 3.0360 3.0380 3.0380 3.0659 3.0659 3.1205 3.1205 3.9344 3.9344 3.9908 3.9908 5.1344 5.1344 6.2944 6.2944 6.3058 6.3058 7.7222 7.7222 8.4644 8.4644 8.5217 8.5217 9.1069 9.1069 10.2888 10.2888 10.4108 10.4108 11.5252 11.5252 12.2646 12.2646 13.0763 13.0763 13.3112 13.3112 k = 0.0093 0.0093 0.2197 ( 6564 PWs) bands (ev): -18.8481 -18.8481 -18.6374 -18.6374 -15.0289 -15.0289 -14.9144 -14.9144 -5.2554 -5.2554 -5.2308 -5.2308 -3.5016 -3.5016 -3.3539 -3.3539 -3.2910 -3.2910 -3.0866 -3.0866 -2.1599 -2.1599 -1.0636 -1.0636 1.3416 1.3416 1.3560 1.3560 1.4174 1.4174 1.4812 1.4812 1.7548 1.7548 1.8398 1.8398 1.8904 1.8904 1.9606 1.9606 2.0767 2.0767 2.2566 2.2566 3.0345 3.0345 3.0381 3.0381 3.0620 3.0620 3.1198 3.1198 3.9352 3.9352 3.9915 3.9915 5.1358 5.1358 6.3117 6.3117 6.3178 6.3178 7.7149 7.7149 8.4761 8.4761 8.5335 8.5335 9.0804 9.0804 10.2762 10.2762 10.3913 10.3913 11.5161 11.5161 12.2615 12.2615 13.0988 13.0988 13.3808 13.3808 k = 0.0000 0.0000 0.2197 ( 6568 PWs) bands (ev): -18.8483 -18.8483 -18.6374 -18.6374 -15.0288 -15.0288 -14.9142 -14.9142 -5.2535 -5.2535 -5.2324 -5.2324 -3.5004 -3.5004 -3.3544 -3.3544 -3.2911 -3.2911 -3.0866 -3.0866 -2.1604 -2.1604 -1.0637 -1.0637 1.3417 1.3417 1.3556 1.3556 1.4172 1.4172 1.4810 1.4810 1.7557 1.7557 1.8390 1.8390 1.8899 1.8899 1.9607 1.9607 2.0768 2.0768 2.2571 2.2571 3.0340 3.0340 3.0383 3.0383 3.0606 3.0606 3.1195 3.1195 3.9354 3.9354 3.9918 3.9918 5.1363 5.1363 6.3168 6.3168 6.3225 6.3225 7.7124 7.7124 8.4800 8.4800 8.5376 8.5376 9.0715 9.0715 10.2720 10.2720 10.3848 10.3848 11.5130 11.5130 12.2605 12.2605 13.1067 13.1067 13.4082 13.4082 k = 0.0000 0.5000-0.0000 ( 6570 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3443 -5.3443 -5.3443 -5.3443 -3.5868 -3.5868 -3.5868 -3.5868 -3.2380 -3.2380 -3.2380 -3.2380 -1.3301 -1.3301 -1.3301 -1.3301 1.4840 1.4840 1.4840 1.4840 1.5718 1.5718 1.5718 1.5718 1.8300 1.8300 1.8300 1.8300 1.8831 1.8831 1.8831 1.8831 1.9653 1.9653 1.9653 1.9653 3.2777 3.2777 3.2777 3.2777 3.4330 3.4330 3.4330 3.4330 3.6334 3.6334 3.6334 3.6334 4.1852 4.1852 4.1852 4.1852 7.5207 7.5207 7.5207 7.5207 7.5989 7.5989 7.5989 7.5989 10.5459 10.5459 10.5459 10.5459 11.5234 11.5234 11.5234 11.5234 12.4065 12.4065 12.4065 12.4065 13.7761 13.7761 k = 0.0000 0.5000 0.0129 ( 6562 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3443 -5.3443 -5.3443 -5.3443 -3.5868 -3.5868 -3.5868 -3.5868 -3.2380 -3.2380 -3.2380 -3.2380 -1.3301 -1.3301 -1.3301 -1.3301 1.4840 1.4840 1.4840 1.4840 1.5718 1.5718 1.5718 1.5718 1.8300 1.8300 1.8300 1.8300 1.8832 1.8832 1.8832 1.8832 1.9653 1.9653 1.9653 1.9653 3.2776 3.2776 3.2776 3.2776 3.4330 3.4330 3.4330 3.4330 3.6326 3.6326 3.6326 3.6326 4.1860 4.1860 4.1860 4.1860 7.5208 7.5208 7.5208 7.5208 7.5990 7.5990 7.5990 7.5990 10.5466 10.5466 10.5466 10.5466 11.5234 11.5234 11.5234 11.5234 12.4056 12.4056 12.4056 12.4056 13.7692 13.7692 k = 0.0000 0.5000 0.0259 ( 6558 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3442 -5.3442 -5.3442 -5.3442 -3.5868 -3.5868 -3.5868 -3.5868 -3.2381 -3.2381 -3.2381 -3.2381 -1.3300 -1.3300 -1.3300 -1.3300 1.4840 1.4840 1.4840 1.4840 1.5718 1.5718 1.5718 1.5718 1.8301 1.8301 1.8301 1.8301 1.8832 1.8832 1.8832 1.8832 1.9654 1.9654 1.9654 1.9654 3.2774 3.2774 3.2774 3.2774 3.4330 3.4330 3.4330 3.4330 3.6302 3.6302 3.6302 3.6302 4.1886 4.1886 4.1886 4.1886 7.5212 7.5212 7.5212 7.5212 7.5993 7.5993 7.5993 7.5993 10.5487 10.5487 10.5487 10.5487 11.5234 11.5234 11.5235 11.5235 12.4032 12.4032 12.4032 12.4032 13.7488 13.7488 k = 0.0000 0.5000 0.0388 ( 6548 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3442 -5.3442 -5.3442 -5.3442 -3.5868 -3.5868 -3.5868 -3.5868 -3.2382 -3.2382 -3.2382 -3.2382 -1.3298 -1.3298 -1.3298 -1.3298 1.4841 1.4841 1.4841 1.4841 1.5718 1.5718 1.5718 1.5718 1.8303 1.8303 1.8303 1.8303 1.8832 1.8832 1.8832 1.8832 1.9655 1.9655 1.9655 1.9655 3.2771 3.2771 3.2771 3.2771 3.4330 3.4330 3.4330 3.4330 3.6262 3.6262 3.6262 3.6262 4.1926 4.1926 4.1926 4.1926 7.5218 7.5218 7.5218 7.5218 7.5998 7.5998 7.5998 7.5998 10.5521 10.5521 10.5521 10.5521 11.5234 11.5234 11.5234 11.5234 12.3992 12.3992 12.3992 12.3992 13.7169 13.7169 k = 0.0000 0.5000 0.0517 ( 6572 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3442 -5.3442 -5.3442 -5.3442 -3.5868 -3.5868 -3.5868 -3.5868 -3.2383 -3.2383 -3.2383 -3.2383 -1.3296 -1.3296 -1.3296 -1.3296 1.4841 1.4841 1.4841 1.4841 1.5718 1.5718 1.5718 1.5718 1.8303 1.8303 1.8303 1.8303 1.8831 1.8831 1.8831 1.8831 1.9656 1.9656 1.9656 1.9656 3.2766 3.2766 3.2766 3.2766 3.4330 3.4330 3.4330 3.4330 3.6210 3.6210 3.6210 3.6210 4.1980 4.1980 4.1980 4.1980 7.5226 7.5226 7.5226 7.5226 7.6004 7.6004 7.6004 7.6004 10.5569 10.5569 10.5569 10.5569 11.5232 11.5232 11.5232 11.5232 12.3939 12.3939 12.3939 12.3939 13.6771 13.6771 k = 0.0000 0.5000 0.0646 ( 6560 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3442 -5.3442 -5.3442 -5.3442 -3.5868 -3.5868 -3.5868 -3.5868 -3.2385 -3.2385 -3.2385 -3.2385 -1.3293 -1.3293 -1.3293 -1.3293 1.4842 1.4842 1.4842 1.4842 1.5718 1.5718 1.5718 1.5718 1.8306 1.8306 1.8306 1.8306 1.8832 1.8832 1.8832 1.8832 1.9658 1.9658 1.9658 1.9658 3.2760 3.2760 3.2760 3.2760 3.4329 3.4329 3.4329 3.4329 3.6148 3.6148 3.6148 3.6148 4.2045 4.2045 4.2045 4.2045 7.5236 7.5236 7.5236 7.5236 7.6011 7.6011 7.6011 7.6011 10.5628 10.5628 10.5628 10.5628 11.5226 11.5226 11.5226 11.5226 12.3874 12.3874 12.3874 12.3874 13.6328 13.6328 k = 0.0000 0.5000 0.0776 ( 6560 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3442 -5.3442 -5.3442 -5.3442 -3.5867 -3.5867 -3.5867 -3.5867 -3.2387 -3.2387 -3.2387 -3.2387 -1.3290 -1.3290 -1.3290 -1.3290 1.4843 1.4843 1.4843 1.4843 1.5718 1.5718 1.5718 1.5718 1.8308 1.8308 1.8308 1.8308 1.8831 1.8831 1.8831 1.8831 1.9660 1.9660 1.9660 1.9660 3.2753 3.2753 3.2753 3.2753 3.4329 3.4329 3.4329 3.4329 3.6078 3.6078 3.6078 3.6078 4.2118 4.2118 4.2118 4.2118 7.5247 7.5247 7.5247 7.5247 7.6019 7.6019 7.6019 7.6019 10.5699 10.5699 10.5699 10.5699 11.5215 11.5215 11.5215 11.5215 12.3800 12.3800 12.3800 12.3800 13.5872 13.5872 k = 0.0000 0.5000 0.0905 ( 6566 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3441 -5.3441 -5.3441 -5.3441 -3.5867 -3.5867 -3.5867 -3.5867 -3.2389 -3.2389 -3.2389 -3.2389 -1.3286 -1.3286 -1.3286 -1.3286 1.4843 1.4843 1.4843 1.4843 1.5718 1.5718 1.5718 1.5718 1.8310 1.8310 1.8310 1.8310 1.8831 1.8831 1.8831 1.8831 1.9661 1.9661 1.9661 1.9661 3.2745 3.2745 3.2745 3.2745 3.4328 3.4328 3.4328 3.4328 3.6003 3.6003 3.6003 3.6003 4.2195 4.2195 4.2195 4.2195 7.5260 7.5260 7.5260 7.5260 7.6029 7.6029 7.6029 7.6029 10.5779 10.5779 10.5779 10.5779 11.5198 11.5198 11.5198 11.5198 12.3719 12.3719 12.3719 12.3719 13.5422 13.5422 k = 0.0000 0.5000 0.1034 ( 6562 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3441 -5.3441 -5.3441 -5.3441 -3.5866 -3.5866 -3.5866 -3.5866 -3.2391 -3.2391 -3.2391 -3.2391 -1.3282 -1.3282 -1.3282 -1.3282 1.4845 1.4845 1.4845 1.4845 1.5718 1.5718 1.5718 1.5718 1.8313 1.8313 1.8313 1.8313 1.8831 1.8831 1.8831 1.8831 1.9664 1.9664 1.9664 1.9664 3.2737 3.2737 3.2737 3.2737 3.4328 3.4328 3.4328 3.4328 3.5926 3.5926 3.5926 3.5926 4.2275 4.2275 4.2275 4.2275 7.5273 7.5273 7.5273 7.5273 7.6038 7.6038 7.6038 7.6038 10.5867 10.5867 10.5867 10.5867 11.5173 11.5173 11.5173 11.5173 12.3635 12.3635 12.3635 12.3635 13.4997 13.4997 k = 0.0000 0.5000 0.1163 ( 6568 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3441 -5.3441 -5.3441 -5.3441 -3.5866 -3.5866 -3.5866 -3.5866 -3.2393 -3.2393 -3.2393 -3.2393 -1.3279 -1.3279 -1.3279 -1.3279 1.4845 1.4845 1.4845 1.4845 1.5718 1.5718 1.5718 1.5718 1.8316 1.8316 1.8316 1.8316 1.8831 1.8831 1.8831 1.8831 1.9666 1.9666 1.9666 1.9666 3.2728 3.2728 3.2728 3.2728 3.4328 3.4328 3.4328 3.4328 3.5851 3.5851 3.5851 3.5851 4.2355 4.2355 4.2355 4.2355 7.5287 7.5287 7.5287 7.5287 7.6048 7.6048 7.6048 7.6048 10.5961 10.5961 10.5961 10.5961 11.5140 11.5140 11.5140 11.5140 12.3551 12.3551 12.3551 12.3551 13.4606 13.4606 k = 0.0000 0.5000 0.1293 ( 6570 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3440 -5.3440 -5.3440 -5.3440 -3.5865 -3.5865 -3.5865 -3.5865 -3.2395 -3.2395 -3.2395 -3.2395 -1.3275 -1.3275 -1.3275 -1.3275 1.4846 1.4846 1.4846 1.4846 1.5718 1.5718 1.5718 1.5718 1.8318 1.8318 1.8318 1.8318 1.8831 1.8831 1.8831 1.8831 1.9668 1.9668 1.9668 1.9668 3.2719 3.2719 3.2719 3.2719 3.4328 3.4328 3.4328 3.4328 3.5778 3.5778 3.5778 3.5778 4.2431 4.2431 4.2431 4.2431 7.5300 7.5300 7.5300 7.5300 7.6058 7.6058 7.6058 7.6058 10.6057 10.6057 10.6057 10.6057 11.5099 11.5099 11.5099 11.5099 12.3469 12.3469 12.3469 12.3469 13.4257 13.4257 k = 0.0000 0.5000 0.1422 ( 6576 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3440 -5.3440 -5.3440 -5.3440 -3.5865 -3.5865 -3.5865 -3.5865 -3.2397 -3.2397 -3.2397 -3.2397 -1.3272 -1.3272 -1.3272 -1.3272 1.4847 1.4847 1.4847 1.4847 1.5718 1.5718 1.5718 1.5718 1.8320 1.8320 1.8320 1.8320 1.8831 1.8831 1.8831 1.8831 1.9669 1.9669 1.9669 1.9669 3.2710 3.2710 3.2710 3.2710 3.4328 3.4328 3.4328 3.4328 3.5711 3.5711 3.5711 3.5711 4.2501 4.2501 4.2501 4.2501 7.5313 7.5313 7.5313 7.5313 7.6068 7.6068 7.6068 7.6068 10.6153 10.6153 10.6153 10.6153 11.5054 11.5054 11.5054 11.5054 12.3392 12.3392 12.3392 12.3392 13.3955 13.3955 k = 0.0000 0.5000 0.1551 ( 6568 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3440 -5.3440 -5.3440 -5.3440 -3.5865 -3.5865 -3.5865 -3.5865 -3.2399 -3.2399 -3.2399 -3.2399 -1.3268 -1.3268 -1.3268 -1.3268 1.4848 1.4848 1.4848 1.4848 1.5718 1.5718 1.5718 1.5718 1.8323 1.8323 1.8323 1.8323 1.8831 1.8831 1.8831 1.8831 1.9672 1.9672 1.9672 1.9672 3.2702 3.2702 3.2702 3.2702 3.4328 3.4328 3.4328 3.4328 3.5652 3.5652 3.5652 3.5652 4.2564 4.2564 4.2564 4.2564 7.5324 7.5324 7.5324 7.5324 7.6076 7.6076 7.6076 7.6076 10.6244 10.6244 10.6244 10.6244 11.5005 11.5005 11.5005 11.5005 12.3323 12.3323 12.3323 12.3323 13.3702 13.3702 k = 0.0000 0.5000 0.1680 ( 6580 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3440 -5.3440 -5.3440 -5.3440 -3.5864 -3.5864 -3.5864 -3.5864 -3.2401 -3.2401 -3.2401 -3.2401 -1.3266 -1.3266 -1.3266 -1.3266 1.4849 1.4849 1.4849 1.4849 1.5718 1.5718 1.5718 1.5718 1.8325 1.8325 1.8325 1.8325 1.8830 1.8830 1.8830 1.8830 1.9673 1.9673 1.9673 1.9673 3.2695 3.2695 3.2695 3.2695 3.4328 3.4328 3.4328 3.4328 3.5601 3.5601 3.5601 3.5601 4.2618 4.2618 4.2618 4.2618 7.5334 7.5334 7.5334 7.5334 7.6083 7.6083 7.6083 7.6083 10.6326 10.6326 10.6326 10.6326 11.4958 11.4958 11.4958 11.4958 12.3263 12.3263 12.3263 12.3263 13.3498 13.3498 k = 0.0000 0.5000 0.1810 ( 6580 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2402 -3.2402 -3.2402 -3.2402 -1.3263 -1.3263 -1.3263 -1.3263 1.4849 1.4849 1.4849 1.4849 1.5718 1.5718 1.5718 1.5718 1.8326 1.8326 1.8326 1.8326 1.8831 1.8831 1.8831 1.8831 1.9674 1.9674 1.9674 1.9674 3.2688 3.2688 3.2688 3.2688 3.4328 3.4328 3.4328 3.4328 3.5560 3.5560 3.5560 3.5560 4.2662 4.2662 4.2662 4.2662 7.5342 7.5342 7.5342 7.5342 7.6089 7.6089 7.6089 7.6089 10.6395 10.6395 10.6395 10.6395 11.4915 11.4915 11.4915 11.4915 12.3214 12.3214 12.3214 12.3214 13.3342 13.3342 k = 0.0000 0.5000 0.1939 ( 6580 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2403 -3.2403 -3.2403 -3.2403 -1.3262 -1.3262 -1.3262 -1.3262 1.4850 1.4850 1.4850 1.4850 1.5718 1.5718 1.5718 1.5718 1.8327 1.8327 1.8327 1.8327 1.8831 1.8831 1.8831 1.8831 1.9675 1.9675 1.9675 1.9675 3.2684 3.2684 3.2684 3.2684 3.4328 3.4328 3.4328 3.4328 3.5530 3.5530 3.5530 3.5530 4.2693 4.2693 4.2693 4.2693 7.5348 7.5348 7.5348 7.5348 7.6094 7.6094 7.6094 7.6094 10.6447 10.6447 10.6447 10.6447 11.4880 11.4880 11.4880 11.4880 12.3179 12.3179 12.3179 12.3179 13.3232 13.3232 k = 0.0000 0.5000 0.2068 ( 6590 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2404 -3.2404 -3.2404 -3.2404 -1.3261 -1.3261 -1.3261 -1.3261 1.4849 1.4849 1.4849 1.4849 1.5718 1.5718 1.5718 1.5718 1.8328 1.8328 1.8328 1.8328 1.8830 1.8830 1.8830 1.8830 1.9675 1.9675 1.9675 1.9675 3.2681 3.2681 3.2681 3.2681 3.4328 3.4328 3.4328 3.4328 3.5512 3.5512 3.5512 3.5512 4.2713 4.2713 4.2713 4.2713 7.5352 7.5352 7.5352 7.5352 7.6097 7.6097 7.6097 7.6097 10.6480 10.6480 10.6480 10.6480 11.4858 11.4858 11.4858 11.4858 12.3157 12.3157 12.3157 12.3157 13.3167 13.3167 k = 0.0000 0.5000 0.2197 ( 6596 PWs) bands (ev): -18.6651 -18.6651 -18.6651 -18.6651 -15.0592 -15.0592 -15.0592 -15.0592 -5.3439 -5.3439 -5.3439 -5.3439 -3.5864 -3.5864 -3.5864 -3.5864 -3.2404 -3.2404 -3.2404 -3.2404 -1.3260 -1.3260 -1.3260 -1.3260 1.4850 1.4850 1.4850 1.4850 1.5718 1.5718 1.5718 1.5718 1.8328 1.8328 1.8328 1.8328 1.8830 1.8830 1.8830 1.8830 1.9675 1.9675 1.9675 1.9675 3.2680 3.2680 3.2680 3.2680 3.4328 3.4328 3.4328 3.4328 3.5506 3.5506 3.5506 3.5506 4.2719 4.2719 4.2719 4.2719 7.5353 7.5353 7.5353 7.5353 7.6098 7.6098 7.6098 7.6098 10.6491 10.6491 10.6491 10.6491 11.4851 11.4851 11.4851 11.4851 12.3149 12.3149 12.3149 12.3149 13.3146 13.3146 k = 0.5000 0.5000-0.0000 ( 6592 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6088 -3.6088 -3.6088 -3.6088 -3.3700 -3.3700 -3.3699 -3.3699 -1.1271 -1.1271 -1.1271 -1.1271 1.2994 1.2994 1.2994 1.2994 1.6838 1.6838 1.6838 1.6838 1.7609 1.7609 1.7609 1.7609 2.0049 2.0049 2.0049 2.0049 2.0606 2.0606 2.0606 2.0606 3.1164 3.1164 3.1164 3.1164 3.6706 3.6706 3.6706 3.6706 4.0085 4.0085 4.0085 4.0085 4.0129 4.0129 4.0129 4.0129 6.0426 6.0426 6.0426 6.0426 6.1690 6.1690 6.1690 6.1690 11.0719 11.0719 11.0719 11.0719 11.6899 11.6899 11.6899 11.6899 13.9138 13.9138 13.9138 13.9138 14.7055 14.7055 k = 0.5000 0.5000 0.0129 ( 6624 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6089 -3.6089 -3.6089 -3.6089 -3.3699 -3.3699 -3.3699 -3.3699 -1.1271 -1.1271 -1.1271 -1.1271 1.2993 1.2993 1.2993 1.2993 1.6837 1.6837 1.6837 1.6837 1.7608 1.7608 1.7608 1.7608 2.0048 2.0048 2.0048 2.0048 2.0607 2.0607 2.0607 2.0607 3.1158 3.1158 3.1158 3.1158 3.6697 3.6697 3.6697 3.6697 4.0082 4.0082 4.0082 4.0082 4.0145 4.0145 4.0145 4.0145 6.0432 6.0432 6.0432 6.0432 6.1685 6.1685 6.1685 6.1685 11.0729 11.0729 11.0729 11.0729 11.6906 11.6906 11.6906 11.6906 13.9072 13.9072 13.9072 13.9072 14.6760 14.6760 k = 0.5000 0.5000 0.0259 ( 6632 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6090 -3.6090 -3.6090 -3.6090 -3.3698 -3.3698 -3.3698 -3.3698 -1.1270 -1.1270 -1.1270 -1.1270 1.2992 1.2992 1.2992 1.2992 1.6838 1.6838 1.6838 1.6838 1.7608 1.7608 1.7608 1.7608 2.0047 2.0047 2.0047 2.0047 2.0613 2.0613 2.0613 2.0613 3.1140 3.1140 3.1140 3.1140 3.6669 3.6669 3.6669 3.6669 4.0078 4.0078 4.0078 4.0078 4.0188 4.0188 4.0188 4.0188 6.0448 6.0448 6.0448 6.0448 6.1672 6.1672 6.1672 6.1672 11.0760 11.0760 11.0760 11.0760 11.6927 11.6927 11.6927 11.6927 13.8876 13.8876 13.8876 13.8876 14.6190 14.6190 k = 0.5000 0.5000 0.0388 ( 6608 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6091 -3.6091 -3.6091 -3.6091 -3.3696 -3.3696 -3.3696 -3.3696 -1.1269 -1.1269 -1.1269 -1.1269 1.2991 1.2991 1.2991 1.2991 1.6840 1.6840 1.6840 1.6840 1.7608 1.7608 1.7608 1.7608 2.0047 2.0047 2.0047 2.0047 2.0623 2.0623 2.0623 2.0623 3.1112 3.1112 3.1112 3.1112 3.6626 3.6626 3.6626 3.6626 4.0076 4.0076 4.0076 4.0076 4.0253 4.0253 4.0253 4.0253 6.0474 6.0474 6.0474 6.0474 6.1651 6.1651 6.1651 6.1651 11.0811 11.0811 11.0811 11.0811 11.6962 11.6962 11.6962 11.6962 13.8565 13.8565 13.8565 13.8565 14.5569 14.5569 k = 0.5000 0.5000 0.0517 ( 6616 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6094 -3.6094 -3.6094 -3.6094 -3.3693 -3.3693 -3.3693 -3.3693 -1.1267 -1.1267 -1.1267 -1.1267 1.2989 1.2989 1.2989 1.2989 1.6842 1.6842 1.6842 1.6842 1.7607 1.7607 1.7607 1.7607 2.0046 2.0046 2.0046 2.0046 2.0635 2.0635 2.0635 2.0635 3.1073 3.1073 3.1073 3.1073 3.6569 3.6569 3.6569 3.6569 4.0075 4.0075 4.0075 4.0075 4.0336 4.0336 4.0336 4.0336 6.0509 6.0509 6.0509 6.0509 6.1623 6.1623 6.1623 6.1623 11.0881 11.0881 11.0881 11.0881 11.7010 11.7010 11.7010 11.7010 13.8158 13.8158 13.8158 13.8158 14.4951 14.4951 k = 0.5000 0.5000 0.0646 ( 6616 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4085 -5.4085 -5.4085 -5.4085 -3.6097 -3.6097 -3.6097 -3.6097 -3.3689 -3.3689 -3.3689 -3.3689 -1.1265 -1.1265 -1.1265 -1.1265 1.2987 1.2987 1.2987 1.2987 1.6844 1.6844 1.6844 1.6844 1.7605 1.7605 1.7605 1.7605 2.0045 2.0045 2.0045 2.0045 2.0650 2.0650 2.0650 2.0650 3.1026 3.1026 3.1026 3.1026 3.6503 3.6503 3.6503 3.6503 4.0074 4.0074 4.0074 4.0074 4.0435 4.0435 4.0435 4.0435 6.0552 6.0552 6.0552 6.0552 6.1588 6.1588 6.1588 6.1588 11.0968 11.0968 11.0968 11.0968 11.7069 11.7069 11.7069 11.7069 13.7678 13.7678 13.7678 13.7678 14.4351 14.4351 k = 0.5000 0.5000 0.0776 ( 6608 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4086 -5.4086 -5.4086 -5.4086 -3.6100 -3.6100 -3.6100 -3.6100 -3.3685 -3.3685 -3.3685 -3.3685 -1.1263 -1.1263 -1.1263 -1.1263 1.2986 1.2986 1.2986 1.2986 1.6847 1.6847 1.6847 1.6847 1.7604 1.7604 1.7604 1.7604 2.0044 2.0044 2.0044 2.0044 2.0669 2.0669 2.0669 2.0669 3.0971 3.0971 3.0971 3.0971 3.6431 3.6431 3.6431 3.6431 4.0074 4.0074 4.0074 4.0074 4.0544 4.0544 4.0544 4.0544 6.0601 6.0601 6.0601 6.0601 6.1548 6.1548 6.1548 6.1548 11.1070 11.1070 11.1070 11.1070 11.7137 11.7137 11.7137 11.7137 13.7147 13.7147 13.7147 13.7147 14.3778 14.3778 k = 0.5000 0.5000 0.0905 ( 6600 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4086 -5.4086 -5.4086 -5.4086 -3.6103 -3.6103 -3.6103 -3.6103 -3.3680 -3.3680 -3.3680 -3.3680 -1.1260 -1.1260 -1.1260 -1.1260 1.2983 1.2983 1.2983 1.2983 1.6850 1.6850 1.6850 1.6850 1.7602 1.7602 1.7602 1.7602 2.0044 2.0044 2.0044 2.0044 2.0689 2.0689 2.0689 2.0689 3.0911 3.0911 3.0911 3.0911 3.6355 3.6355 3.6355 3.6355 4.0073 4.0073 4.0073 4.0073 4.0660 4.0660 4.0660 4.0660 6.0654 6.0654 6.0654 6.0654 6.1505 6.1505 6.1505 6.1505 11.1185 11.1185 11.1185 11.1185 11.7213 11.7213 11.7213 11.7213 13.6586 13.6586 13.6586 13.6586 14.3236 14.3236 k = 0.5000 0.5000 0.1034 ( 6608 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4087 -5.4087 -5.4087 -5.4087 -3.6107 -3.6107 -3.6107 -3.6107 -3.3675 -3.3675 -3.3675 -3.3675 -1.1257 -1.1257 -1.1257 -1.1257 1.2981 1.2981 1.2981 1.2981 1.6852 1.6852 1.6852 1.6852 1.7601 1.7601 1.7601 1.7601 2.0042 2.0042 2.0042 2.0042 2.0710 2.0710 2.0710 2.0710 3.0847 3.0847 3.0847 3.0847 3.6280 3.6280 3.6280 3.6280 4.0073 4.0073 4.0073 4.0073 4.0779 4.0779 4.0779 4.0779 6.0709 6.0709 6.0709 6.0709 6.1459 6.1459 6.1459 6.1459 11.1309 11.1309 11.1309 11.1309 11.7293 11.7293 11.7293 11.7293 13.6016 13.6016 13.6016 13.6016 14.2732 14.2732 k = 0.5000 0.5000 0.1163 ( 6600 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4087 -5.4087 -5.4087 -5.4087 -3.6111 -3.6111 -3.6111 -3.6111 -3.3671 -3.3671 -3.3671 -3.3671 -1.1255 -1.1255 -1.1255 -1.1255 1.2979 1.2979 1.2979 1.2979 1.6856 1.6856 1.6856 1.6856 1.7599 1.7599 1.7599 1.7599 2.0041 2.0041 2.0041 2.0041 2.0733 2.0733 2.0733 2.0733 3.0782 3.0782 3.0782 3.0782 3.6207 3.6207 3.6207 3.6207 4.0073 4.0073 4.0073 4.0073 4.0896 4.0896 4.0896 4.0896 6.0764 6.0764 6.0764 6.0764 6.1414 6.1414 6.1414 6.1414 11.1438 11.1438 11.1438 11.1438 11.7376 11.7376 11.7376 11.7376 13.5454 13.5454 13.5454 13.5454 14.2268 14.2268 k = 0.5000 0.5000 0.1293 ( 6592 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4087 -5.4087 -5.4087 -5.4087 -3.6115 -3.6115 -3.6115 -3.6115 -3.3666 -3.3666 -3.3666 -3.3666 -1.1252 -1.1252 -1.1252 -1.1252 1.2976 1.2976 1.2976 1.2976 1.6859 1.6859 1.6859 1.6859 1.7597 1.7597 1.7597 1.7597 2.0040 2.0040 2.0040 2.0040 2.0755 2.0755 2.0755 2.0755 3.0718 3.0718 3.0718 3.0718 3.6139 3.6139 3.6139 3.6139 4.0073 4.0073 4.0073 4.0073 4.1007 4.1007 4.1007 4.1007 6.0816 6.0816 6.0816 6.0816 6.1370 6.1370 6.1370 6.1370 11.1570 11.1570 11.1570 11.1570 11.7458 11.7458 11.7458 11.7458 13.4918 13.4918 13.4918 13.4918 14.1848 14.1848 k = 0.5000 0.5000 0.1422 ( 6608 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4088 -5.4088 -5.4088 -5.4088 -3.6118 -3.6118 -3.6118 -3.6118 -3.3661 -3.3661 -3.3661 -3.3661 -1.1249 -1.1249 -1.1249 -1.1249 1.2974 1.2974 1.2974 1.2974 1.6861 1.6861 1.6861 1.6861 1.7595 1.7595 1.7595 1.7595 2.0038 2.0038 2.0038 2.0038 2.0776 2.0776 2.0776 2.0776 3.0657 3.0657 3.0657 3.0657 3.6077 3.6077 3.6077 3.6077 4.0073 4.0073 4.0073 4.0073 4.1111 4.1111 4.1111 4.1111 6.0864 6.0864 6.0864 6.0864 6.1331 6.1331 6.1331 6.1331 11.1697 11.1697 11.1697 11.1697 11.7536 11.7536 11.7536 11.7536 13.4420 13.4420 13.4420 13.4420 14.1475 14.1475 k = 0.5000 0.5000 0.1551 ( 6596 PWs) bands (ev): -18.5854 -18.5854 -18.5854 -18.5854 -15.1450 -15.1450 -15.1450 -15.1450 -5.4088 -5.4088 -5.4088 -5.4088 -3.6121 -3.6121 -3.6121 -3.6121 -3.3657 -3.3657 -3.3657 -3.3657 -1.1247 -1.1247 -1.1247 -1.1247 1.2972 1.2972 1.2972 1.2972 1.6864 1.6864 1.6864 1.6864 1.7595 1.7595 1.7595 1.7595 2.0037 2.0037 2.0037 2.0037 2.0796 2.0796 2.0796 2.0796 3.0602 3.0602 3.0602 3.0602 3.6022 3.6022 3.6022 3.6022 4.0073 4.0073 4.0073 4.0073 4.1204 4.1204 4.1204 4.1204 6.0904 6.0904 6.0904 6.0904 6.1298 6.1298 6.1298 6.1298 11.1817 11.1817 11.1817 11.1817 11.7609 11.7609 11.7609 11.7609 13.3975 13.3975 13.3975 13.3975 14.1154 14.1154 k = 0.5000 0.5000 0.1680 ( 6580 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4088 -5.4088 -5.4088 -5.4088 -3.6124 -3.6124 -3.6124 -3.6124 -3.3654 -3.3654 -3.3654 -3.3654 -1.1245 -1.1245 -1.1245 -1.1245 1.2971 1.2971 1.2971 1.2971 1.6866 1.6866 1.6866 1.6866 1.7594 1.7594 1.7594 1.7594 2.0037 2.0037 2.0037 2.0037 2.0813 2.0813 2.0813 2.0813 3.0553 3.0553 3.0553 3.0553 3.5976 3.5976 3.5976 3.5976 4.0073 4.0073 4.0073 4.0073 4.1283 4.1283 4.1283 4.1283 6.0935 6.0935 6.0935 6.0935 6.1274 6.1274 6.1274 6.1274 11.1924 11.1924 11.1924 11.1924 11.7672 11.7672 11.7672 11.7672 13.3594 13.3594 13.3594 13.3594 14.0886 14.0886 k = 0.5000 0.5000 0.1810 ( 6556 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6126 -3.6126 -3.6126 -3.6126 -3.3651 -3.3651 -3.3651 -3.3651 -1.1243 -1.1243 -1.1243 -1.1243 1.2970 1.2970 1.2970 1.2970 1.6868 1.6868 1.6868 1.6868 1.7593 1.7593 1.7593 1.7593 2.0036 2.0036 2.0036 2.0036 2.0828 2.0828 2.0828 2.0828 3.0514 3.0514 3.0514 3.0514 3.5940 3.5940 3.5940 3.5940 4.0073 4.0073 4.0073 4.0073 4.1347 4.1347 4.1347 4.1347 6.0955 6.0955 6.0955 6.0955 6.1258 6.1258 6.1258 6.1258 11.2013 11.2013 11.2013 11.2013 11.7725 11.7725 11.7725 11.7725 13.3286 13.3286 13.3286 13.3286 14.0675 14.0675 k = 0.5000 0.5000 0.1939 ( 6576 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6128 -3.6128 -3.6128 -3.6128 -3.3649 -3.3649 -3.3649 -3.3649 -1.1242 -1.1242 -1.1242 -1.1242 1.2969 1.2969 1.2969 1.2969 1.6869 1.6869 1.6869 1.6869 1.7592 1.7592 1.7592 1.7592 2.0035 2.0035 2.0035 2.0035 2.0838 2.0838 2.0838 2.0838 3.0484 3.0484 3.0484 3.0484 3.5913 3.5913 3.5913 3.5913 4.0073 4.0073 4.0073 4.0073 4.1393 4.1393 4.1393 4.1393 6.0967 6.0967 6.0967 6.0967 6.1249 6.1249 6.1249 6.1249 11.2080 11.2080 11.2080 11.2080 11.7764 11.7764 11.7764 11.7764 13.3060 13.3060 13.3060 13.3060 14.0523 14.0523 k = 0.5000 0.5000 0.2068 ( 6580 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6129 -3.6129 -3.6129 -3.6129 -3.3647 -3.3647 -3.3647 -3.3647 -1.1241 -1.1241 -1.1241 -1.1241 1.2968 1.2968 1.2968 1.2968 1.6870 1.6870 1.6870 1.6870 1.7591 1.7591 1.7591 1.7591 2.0035 2.0035 2.0035 2.0035 2.0844 2.0844 2.0844 2.0844 3.0466 3.0466 3.0466 3.0466 3.5897 3.5897 3.5897 3.5897 4.0073 4.0073 4.0073 4.0073 4.1422 4.1422 4.1422 4.1422 6.0973 6.0973 6.0973 6.0973 6.1246 6.1246 6.1246 6.1246 11.2121 11.2121 11.2121 11.2121 11.7788 11.7788 11.7788 11.7788 13.2922 13.2922 13.2922 13.2922 14.0431 14.0431 k = 0.5000 0.5000 0.2197 ( 6584 PWs) bands (ev): -18.5853 -18.5853 -18.5853 -18.5853 -15.1450 -15.1450 -15.1450 -15.1450 -5.4089 -5.4089 -5.4089 -5.4089 -3.6129 -3.6129 -3.6129 -3.6129 -3.3647 -3.3647 -3.3647 -3.3647 -1.1241 -1.1241 -1.1241 -1.1241 1.2968 1.2968 1.2968 1.2968 1.6870 1.6870 1.6870 1.6870 1.7591 1.7591 1.7591 1.7591 2.0035 2.0035 2.0035 2.0035 2.0846 2.0846 2.0846 2.0846 3.0460 3.0460 3.0460 3.0460 3.5892 3.5892 3.5892 3.5892 4.0073 4.0073 4.0073 4.0073 4.1431 4.1431 4.1431 4.1431 6.0974 6.0974 6.0974 6.0974 6.1245 6.1245 6.1245 6.1245 11.2136 11.2136 11.2136 11.2136 11.7796 11.7796 11.7796 11.7796 13.2876 13.2876 13.2876 13.2876 14.0400 14.0400 Writing output data file BaZnPF.save init_run : 0.46s CPU 0.64s WALL ( 1 calls) electrons : 343.86s CPU 348.18s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.07s WALL ( 1 calls) Called by electrons: c_bands : 343.85s CPU 348.17s 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 : 0.14s CPU 0.20s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.11s CPU 0.15s WALL ( 320 calls) cegterg : 320.24s CPU 323.57s WALL ( 379 calls) Called by sum_band: Called by *egterg: h_psi : 153.48s CPU 155.67s WALL ( 6833 calls) s_psi : 16.54s CPU 16.52s WALL ( 6833 calls) g_psi : 0.46s CPU 0.56s WALL ( 6134 calls) cdiaghg : 121.04s CPU 122.42s WALL ( 6454 calls) cegterg:over : 18.25s CPU 18.40s WALL ( 6134 calls) cegterg:upda : 15.96s CPU 15.78s WALL ( 6134 calls) cegterg:last : 7.56s CPU 7.64s WALL ( 1019 calls) cdiaghg:chol : 7.35s CPU 7.35s WALL ( 6454 calls) cdiaghg:inve : 5.36s CPU 5.44s WALL ( 6454 calls) cdiaghg:para : 9.87s CPU 9.83s WALL ( 12908 calls) Called by h_psi: h_psi:vloc : 120.06s CPU 122.14s WALL ( 6833 calls) h_psi:vnl : 32.76s CPU 32.96s WALL ( 6833 calls) add_vuspsi : 17.94s CPU 17.98s WALL ( 6833 calls) General routines calbec : 14.80s CPU 14.95s WALL ( 6833 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 112.64s CPU 114.71s WALL ( 1154800 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.32s CPU 0.47s WALL ( 640 calls) Parallel routines fft_scatter : 40.50s CPU 41.68s WALL ( 1154823 calls) PWSCF : 6m15.98s CPU 6m34.63s WALL This run was terminated on: 14: 1:13 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=