Program PWSCF v.5.3.0 (svn rev. 11974) starts on 27Jan2017 at 19:38:38 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: ./Zr5Sb3As.save/ file Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 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 119 98 27 4364 3263 479 Max 121 99 28 4367 3287 482 Sum 4303 3559 979 157129 117895 17253 bravais-lattice index = 14 lattice parameter (alat) = 16.0640 a.u. unit-cell volume = 2470.1205 (a.u.)^3 number of atoms/cell = 18 number of atomic types = 3 number of electrons = 80.00 number of Kohn-Sham states= 96 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 242.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 16.063994 celldm(2)= 1.000000 celldm(3)= 0.688061 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.500000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.500000 0.866025 0.000000 ) a(3) = ( 0.000000 0.000000 0.688061 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 1.453360 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 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 1209 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 Sb read from file: /users/gautes/Pseudo/Sb.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 6eab79124e5b154cf38452ae12125a85 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 1243 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 Zr 4.00 91.22400 Zr( 1.00) As 5.00 74.92160 As( 1.00) Sb 5.00 121.76000 Sb( 1.00) 24 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 1 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 = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s(15) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(16) = ( -1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3440305 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(21) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.3440305 ) double point group D_6h(6/mmm) there are 18 classes and 6 irreducible representations the character table: E -E 2C6 -2C6 2C3 -2C3 C2 3C2' 3C2'' i -i 2S3 -C2 -3C2' -3C2' G_7+ 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 1.73 G_8+ 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 2.00 -2.00 -1.73 G_9+ 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 2.00 -2.00 0.00 G_7- 2.00 -2.00 1.73 -1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 -1.73 G_8- 2.00 -2.00 -1.73 1.73 1.00 -1.00 0.00 0.00 0.00 -2.00 2.00 1.73 G_9- 2.00 -2.00 0.00 0.00 -2.00 2.00 0.00 0.00 0.00 -2.00 2.00 0.00 -2S3 2S6 -2S6 s_h 3s_v 3s_d -s_h -3s_v -3s_d G_7+ -1.73 1.00 -1.00 0.00 0.00 0.00 G_8+ 1.73 1.00 -1.00 0.00 0.00 0.00 G_9+ 0.00 -2.00 2.00 0.00 0.00 0.00 G_7- 1.73 -1.00 1.00 0.00 0.00 0.00 G_8- -1.73 -1.00 1.00 0.00 0.00 0.00 G_9- 0.00 2.00 -2.00 0.00 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C6 5 6 60 deg rotation - cryst. axis [0,0,1] -2C6 -5 -6 60 deg rotation - cryst. axis [0,0,1] E 2C3 7 8 120 deg rotation - cryst. axis [0,0,1] -2C3 -7 -8 120 deg rotation - cryst. axis [0,0,1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 3C2'-3C2' 4 -4 12 -11 11 -12 180 deg rotation - cart. axis [1,0,0] 3C2''-3C2' 3 -3 9 10 -10 -9 180 deg rotation - cart. axis [0,1,0] i 13 inversion -i -13 inversion E 2S3 17 18 inv. 60 deg rotation - cryst. axis [0,0,1] -2S3 -17 -18 inv. 60 deg rotation - cryst. axis [0,0,1] E 2S6 19 20 inv. 120 deg rotation - cryst. axis [0,0,1] -2S6 -19 -20 inv. 120 deg rotation - cryst. axis [0,0,1] E s_h -s_h 14 -14 inv. 180 deg rotation - cart. axis [0,0,1] 3s_v-3s_v 16 -16 24 -23 23 -24 inv. 180 deg rotation - cart. axis [1,0,0] 3s_d-3s_d 15 -15 21 22 -22 -21 inv. 180 deg rotation - cart. axis [0,1,0] Cartesian axes number of k points= 210 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0227273 0.0131216 -0.0000000), wk = 0.0047619 k( 3) = ( 0.0454546 0.0262432 -0.0000000), wk = 0.0047619 k( 4) = ( 0.0681818 0.0393648 -0.0000000), wk = 0.0047619 k( 5) = ( 0.0909091 0.0524864 -0.0000000), wk = 0.0047619 k( 6) = ( 0.1136364 0.0656080 -0.0000000), wk = 0.0047619 k( 7) = ( 0.1363636 0.0787296 -0.0000000), wk = 0.0047619 k( 8) = ( 0.1590909 0.0918512 -0.0000000), wk = 0.0047619 k( 9) = ( 0.1818182 0.1049728 -0.0000000), wk = 0.0047619 k( 10) = ( 0.2045454 0.1180944 -0.0000000), wk = 0.0047619 k( 11) = ( 0.2272727 0.1312160 -0.0000000), wk = 0.0047619 k( 12) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0047619 k( 13) = ( 0.2727273 0.1574592 -0.0000000), wk = 0.0047619 k( 14) = ( 0.2954545 0.1705808 -0.0000000), wk = 0.0047619 k( 15) = ( 0.3181818 0.1837024 -0.0000000), wk = 0.0047619 k( 16) = ( 0.3409091 0.1968240 -0.0000000), wk = 0.0047619 k( 17) = ( 0.3636364 0.2099456 -0.0000000), wk = 0.0047619 k( 18) = ( 0.3863636 0.2230672 -0.0000000), wk = 0.0047619 k( 19) = ( 0.4090909 0.2361887 -0.0000000), wk = 0.0047619 k( 20) = ( 0.4318182 0.2493103 -0.0000000), wk = 0.0047619 k( 21) = ( 0.4545455 0.2624319 -0.0000000), wk = 0.0047619 k( 22) = ( 0.4772727 0.2755535 -0.0000000), wk = 0.0047619 k( 23) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 24) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 25) = ( 0.4871795 0.3108809 -0.0000000), wk = 0.0047619 k( 26) = ( 0.4743590 0.3330867 -0.0000000), wk = 0.0047619 k( 27) = ( 0.4615385 0.3552925 -0.0000000), wk = 0.0047619 k( 28) = ( 0.4487179 0.3774983 -0.0000000), wk = 0.0047619 k( 29) = ( 0.4358974 0.3997040 -0.0000000), wk = 0.0047619 k( 30) = ( 0.4230769 0.4219098 -0.0000000), wk = 0.0047619 k( 31) = ( 0.4102564 0.4441156 -0.0000000), wk = 0.0047619 k( 32) = ( 0.3974359 0.4663214 -0.0000000), wk = 0.0047619 k( 33) = ( 0.3846154 0.4885271 -0.0000000), wk = 0.0047619 k( 34) = ( 0.3717949 0.5107329 -0.0000000), wk = 0.0047619 k( 35) = ( 0.3589744 0.5329387 -0.0000000), wk = 0.0047619 k( 36) = ( 0.3461538 0.5551445 -0.0000000), wk = 0.0047619 k( 37) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 38) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 39) = ( 0.3200000 0.5542563 -0.0000000), wk = 0.0047619 k( 40) = ( 0.3066667 0.5311623 -0.0000000), wk = 0.0047619 k( 41) = ( 0.2933333 0.5080682 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2800000 0.4849742 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0047619 k( 44) = ( 0.2533333 0.4387862 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2400000 0.4156922 -0.0000000), wk = 0.0047619 k( 46) = ( 0.2266667 0.3925982 -0.0000000), wk = 0.0047619 k( 47) = ( 0.2133333 0.3695042 -0.0000000), wk = 0.0047619 k( 48) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0047619 k( 49) = ( 0.1866667 0.3233162 -0.0000000), wk = 0.0047619 k( 50) = ( 0.1733333 0.3002221 -0.0000000), wk = 0.0047619 k( 51) = ( 0.1600000 0.2771281 -0.0000000), wk = 0.0047619 k( 52) = ( 0.1466667 0.2540341 -0.0000000), wk = 0.0047619 k( 53) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0047619 k( 54) = ( 0.1200000 0.2078461 -0.0000000), wk = 0.0047619 k( 55) = ( 0.1066667 0.1847521 -0.0000000), wk = 0.0047619 k( 56) = ( 0.0933333 0.1616581 -0.0000000), wk = 0.0047619 k( 57) = ( 0.0800000 0.1385641 -0.0000000), wk = 0.0047619 k( 58) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0047619 k( 59) = ( 0.0533333 0.0923760 -0.0000000), wk = 0.0047619 k( 60) = ( 0.0400000 0.0692820 -0.0000000), wk = 0.0047619 k( 61) = ( 0.0266667 0.0461880 -0.0000000), wk = 0.0047619 k( 62) = ( 0.0133333 0.0230940 -0.0000000), wk = 0.0047619 k( 63) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 64) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 65) = ( 0.0000000 0.0000000 0.0269141), wk = 0.0047619 k( 66) = ( 0.0000000 0.0000000 0.0538281), wk = 0.0047619 k( 67) = ( 0.0000000 0.0000000 0.0807422), wk = 0.0047619 k( 68) = ( 0.0000000 0.0000000 0.1076563), wk = 0.0047619 k( 69) = ( 0.0000000 0.0000000 0.1345703), wk = 0.0047619 k( 70) = ( 0.0000000 0.0000000 0.1614844), wk = 0.0047619 k( 71) = ( 0.0000000 0.0000000 0.1883985), wk = 0.0047619 k( 72) = ( 0.0000000 0.0000000 0.2153125), wk = 0.0047619 k( 73) = ( 0.0000000 0.0000000 0.2422266), wk = 0.0047619 k( 74) = ( 0.0000000 0.0000000 0.2691407), wk = 0.0047619 k( 75) = ( 0.0000000 0.0000000 0.2960547), wk = 0.0047619 k( 76) = ( 0.0000000 0.0000000 0.3229688), wk = 0.0047619 k( 77) = ( 0.0000000 0.0000000 0.3498829), wk = 0.0047619 k( 78) = ( 0.0000000 0.0000000 0.3767969), wk = 0.0047619 k( 79) = ( 0.0000000 0.0000000 0.4037110), wk = 0.0047619 k( 80) = ( 0.0000000 0.0000000 0.4306251), wk = 0.0047619 k( 81) = ( 0.0000000 0.0000000 0.4575391), wk = 0.0047619 k( 82) = ( 0.0000000 0.0000000 0.4844532), wk = 0.0047619 k( 83) = ( 0.0000000 0.0000000 0.5113672), wk = 0.0047619 k( 84) = ( 0.0000000 0.0000000 0.5382813), wk = 0.0047619 k( 85) = ( 0.0000000 0.0000000 0.5651954), wk = 0.0047619 k( 86) = ( 0.0000000 0.0000000 0.5921094), wk = 0.0047619 k( 87) = ( 0.0000000 0.0000000 0.6190235), wk = 0.0047619 k( 88) = ( 0.0000000 0.0000000 0.6459376), wk = 0.0047619 k( 89) = ( 0.0000000 0.0000000 0.6728516), wk = 0.0047619 k( 90) = ( 0.0000000 0.0000000 0.6997657), wk = 0.0047619 k( 91) = ( 0.0000000 0.0000000 0.7266798), wk = 0.0047619 k( 92) = ( 0.0000000 0.0000000 0.7266798), wk = 0.0047619 k( 93) = ( 0.0227273 0.0131216 0.7266798), wk = 0.0047619 k( 94) = ( 0.0454546 0.0262432 0.7266798), wk = 0.0047619 k( 95) = ( 0.0681818 0.0393648 0.7266798), wk = 0.0047619 k( 96) = ( 0.0909091 0.0524864 0.7266798), wk = 0.0047619 k( 97) = ( 0.1136364 0.0656080 0.7266798), wk = 0.0047619 k( 98) = ( 0.1363636 0.0787296 0.7266798), wk = 0.0047619 k( 99) = ( 0.1590909 0.0918512 0.7266798), wk = 0.0047619 k( 100) = ( 0.1818182 0.1049728 0.7266798), wk = 0.0047619 k( 101) = ( 0.2045454 0.1180944 0.7266798), wk = 0.0047619 k( 102) = ( 0.2272727 0.1312160 0.7266798), wk = 0.0047619 k( 103) = ( 0.2500000 0.1443376 0.7266798), wk = 0.0047619 k( 104) = ( 0.2727273 0.1574592 0.7266798), wk = 0.0047619 k( 105) = ( 0.2954545 0.1705808 0.7266798), wk = 0.0047619 k( 106) = ( 0.3181818 0.1837024 0.7266798), wk = 0.0047619 k( 107) = ( 0.3409091 0.1968240 0.7266798), wk = 0.0047619 k( 108) = ( 0.3636364 0.2099456 0.7266798), wk = 0.0047619 k( 109) = ( 0.3863636 0.2230672 0.7266798), wk = 0.0047619 k( 110) = ( 0.4090909 0.2361887 0.7266798), wk = 0.0047619 k( 111) = ( 0.4318182 0.2493103 0.7266798), wk = 0.0047619 k( 112) = ( 0.4545455 0.2624319 0.7266798), wk = 0.0047619 k( 113) = ( 0.4772727 0.2755535 0.7266798), wk = 0.0047619 k( 114) = ( 0.5000000 0.2886751 0.7266798), wk = 0.0047619 k( 115) = ( 0.5000000 0.2886751 0.7266798), wk = 0.0047619 k( 116) = ( 0.4871795 0.3108809 0.7266798), wk = 0.0047619 k( 117) = ( 0.4743590 0.3330867 0.7266798), wk = 0.0047619 k( 118) = ( 0.4615385 0.3552925 0.7266798), wk = 0.0047619 k( 119) = ( 0.4487179 0.3774983 0.7266798), wk = 0.0047619 k( 120) = ( 0.4358974 0.3997040 0.7266798), wk = 0.0047619 k( 121) = ( 0.4230769 0.4219098 0.7266798), wk = 0.0047619 k( 122) = ( 0.4102564 0.4441156 0.7266798), wk = 0.0047619 k( 123) = ( 0.3974359 0.4663214 0.7266798), wk = 0.0047619 k( 124) = ( 0.3846154 0.4885271 0.7266798), wk = 0.0047619 k( 125) = ( 0.3717949 0.5107329 0.7266798), wk = 0.0047619 k( 126) = ( 0.3589744 0.5329387 0.7266798), wk = 0.0047619 k( 127) = ( 0.3461538 0.5551445 0.7266798), wk = 0.0047619 k( 128) = ( 0.3333333 0.5773503 0.7266798), wk = 0.0047619 k( 129) = ( 0.3333333 0.5773503 0.7266798), wk = 0.0047619 k( 130) = ( 0.3200000 0.5542563 0.7266798), wk = 0.0047619 k( 131) = ( 0.3066667 0.5311623 0.7266798), wk = 0.0047619 k( 132) = ( 0.2933333 0.5080682 0.7266798), wk = 0.0047619 k( 133) = ( 0.2800000 0.4849742 0.7266798), wk = 0.0047619 k( 134) = ( 0.2666667 0.4618802 0.7266798), wk = 0.0047619 k( 135) = ( 0.2533333 0.4387862 0.7266798), wk = 0.0047619 k( 136) = ( 0.2400000 0.4156922 0.7266798), wk = 0.0047619 k( 137) = ( 0.2266667 0.3925982 0.7266798), wk = 0.0047619 k( 138) = ( 0.2133333 0.3695042 0.7266798), wk = 0.0047619 k( 139) = ( 0.2000000 0.3464102 0.7266798), wk = 0.0047619 k( 140) = ( 0.1866667 0.3233162 0.7266798), wk = 0.0047619 k( 141) = ( 0.1733333 0.3002221 0.7266798), wk = 0.0047619 k( 142) = ( 0.1600000 0.2771281 0.7266798), wk = 0.0047619 k( 143) = ( 0.1466667 0.2540341 0.7266798), wk = 0.0047619 k( 144) = ( 0.1333333 0.2309401 0.7266798), wk = 0.0047619 k( 145) = ( 0.1200000 0.2078461 0.7266798), wk = 0.0047619 k( 146) = ( 0.1066667 0.1847521 0.7266798), wk = 0.0047619 k( 147) = ( 0.0933333 0.1616581 0.7266798), wk = 0.0047619 k( 148) = ( 0.0800000 0.1385641 0.7266798), wk = 0.0047619 k( 149) = ( 0.0666667 0.1154701 0.7266798), wk = 0.0047619 k( 150) = ( 0.0533333 0.0923760 0.7266798), wk = 0.0047619 k( 151) = ( 0.0400000 0.0692820 0.7266798), wk = 0.0047619 k( 152) = ( 0.0266667 0.0461880 0.7266798), wk = 0.0047619 k( 153) = ( 0.0133333 0.0230940 0.7266798), wk = 0.0047619 k( 154) = ( 0.0000000 0.0000000 0.7266798), wk = 0.0047619 k( 155) = ( 0.5000000 0.2886751 0.7266798), wk = 0.0047619 k( 156) = ( 0.5000000 0.2886751 0.6997657), wk = 0.0047619 k( 157) = ( 0.5000000 0.2886751 0.6728516), wk = 0.0047619 k( 158) = ( 0.5000000 0.2886751 0.6459376), wk = 0.0047619 k( 159) = ( 0.5000000 0.2886751 0.6190235), wk = 0.0047619 k( 160) = ( 0.5000000 0.2886751 0.5921094), wk = 0.0047619 k( 161) = ( 0.5000000 0.2886751 0.5651954), wk = 0.0047619 k( 162) = ( 0.5000000 0.2886751 0.5382813), wk = 0.0047619 k( 163) = ( 0.5000000 0.2886751 0.5113672), wk = 0.0047619 k( 164) = ( 0.5000000 0.2886751 0.4844532), wk = 0.0047619 k( 165) = ( 0.5000000 0.2886751 0.4575391), wk = 0.0047619 k( 166) = ( 0.5000000 0.2886751 0.4306251), wk = 0.0047619 k( 167) = ( 0.5000000 0.2886751 0.4037110), wk = 0.0047619 k( 168) = ( 0.5000000 0.2886751 0.3767969), wk = 0.0047619 k( 169) = ( 0.5000000 0.2886751 0.3498829), wk = 0.0047619 k( 170) = ( 0.5000000 0.2886751 0.3229688), wk = 0.0047619 k( 171) = ( 0.5000000 0.2886751 0.2960547), wk = 0.0047619 k( 172) = ( 0.5000000 0.2886751 0.2691407), wk = 0.0047619 k( 173) = ( 0.5000000 0.2886751 0.2422266), wk = 0.0047619 k( 174) = ( 0.5000000 0.2886751 0.2153125), wk = 0.0047619 k( 175) = ( 0.5000000 0.2886751 0.1883985), wk = 0.0047619 k( 176) = ( 0.5000000 0.2886751 0.1614844), wk = 0.0047619 k( 177) = ( 0.5000000 0.2886751 0.1345703), wk = 0.0047619 k( 178) = ( 0.5000000 0.2886751 0.1076563), wk = 0.0047619 k( 179) = ( 0.5000000 0.2886751 0.0807422), wk = 0.0047619 k( 180) = ( 0.5000000 0.2886751 0.0538281), wk = 0.0047619 k( 181) = ( 0.5000000 0.2886751 0.0269141), wk = 0.0047619 k( 182) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0047619 k( 183) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0047619 k( 184) = ( 0.3333333 0.5773503 0.0269141), wk = 0.0047619 k( 185) = ( 0.3333333 0.5773503 0.0538281), wk = 0.0047619 k( 186) = ( 0.3333333 0.5773503 0.0807422), wk = 0.0047619 k( 187) = ( 0.3333333 0.5773503 0.1076563), wk = 0.0047619 k( 188) = ( 0.3333333 0.5773503 0.1345703), wk = 0.0047619 k( 189) = ( 0.3333333 0.5773503 0.1614844), wk = 0.0047619 k( 190) = ( 0.3333333 0.5773503 0.1883985), wk = 0.0047619 k( 191) = ( 0.3333333 0.5773503 0.2153125), wk = 0.0047619 k( 192) = ( 0.3333333 0.5773503 0.2422266), wk = 0.0047619 k( 193) = ( 0.3333333 0.5773503 0.2691407), wk = 0.0047619 k( 194) = ( 0.3333333 0.5773503 0.2960547), wk = 0.0047619 k( 195) = ( 0.3333333 0.5773503 0.3229688), wk = 0.0047619 k( 196) = ( 0.3333333 0.5773503 0.3498829), wk = 0.0047619 k( 197) = ( 0.3333333 0.5773503 0.3767969), wk = 0.0047619 k( 198) = ( 0.3333333 0.5773503 0.4037110), wk = 0.0047619 k( 199) = ( 0.3333333 0.5773503 0.4306251), wk = 0.0047619 k( 200) = ( 0.3333333 0.5773503 0.4575391), wk = 0.0047619 k( 201) = ( 0.3333333 0.5773503 0.4844532), wk = 0.0047619 k( 202) = ( 0.3333333 0.5773503 0.5113672), wk = 0.0047619 k( 203) = ( 0.3333333 0.5773503 0.5382813), wk = 0.0047619 k( 204) = ( 0.3333333 0.5773503 0.5651954), wk = 0.0047619 k( 205) = ( 0.3333333 0.5773503 0.5921094), wk = 0.0047619 k( 206) = ( 0.3333333 0.5773503 0.6190235), wk = 0.0047619 k( 207) = ( 0.3333333 0.5773503 0.6459376), wk = 0.0047619 k( 208) = ( 0.3333333 0.5773503 0.6728516), wk = 0.0047619 k( 209) = ( 0.3333333 0.5773503 0.6997657), wk = 0.0047619 k( 210) = ( 0.3333333 0.5773503 0.7266798), wk = 0.0047619 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 2) = ( 0.0227273 0.0000000 0.0000000), wk = 0.0047619 k( 3) = ( 0.0454546 0.0000000 0.0000000), wk = 0.0047619 k( 4) = ( 0.0681818 -0.0000000 0.0000000), wk = 0.0047619 k( 5) = ( 0.0909091 0.0000000 0.0000000), wk = 0.0047619 k( 6) = ( 0.1136364 0.0000000 0.0000000), wk = 0.0047619 k( 7) = ( 0.1363636 -0.0000000 0.0000000), wk = 0.0047619 k( 8) = ( 0.1590909 0.0000000 -0.0000000), wk = 0.0047619 k( 9) = ( 0.1818182 0.0000000 0.0000000), wk = 0.0047619 k( 10) = ( 0.2045454 -0.0000000 -0.0000000), wk = 0.0047619 k( 11) = ( 0.2272727 0.0000000 -0.0000000), wk = 0.0047619 k( 12) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0047619 k( 13) = ( 0.2727273 -0.0000000 -0.0000000), wk = 0.0047619 k( 14) = ( 0.2954545 -0.0000000 0.0000000), wk = 0.0047619 k( 15) = ( 0.3181818 0.0000000 -0.0000000), wk = 0.0047619 k( 16) = ( 0.3409091 0.0000000 0.0000000), wk = 0.0047619 k( 17) = ( 0.3636364 0.0000000 0.0000000), wk = 0.0047619 k( 18) = ( 0.3863636 -0.0000000 -0.0000000), wk = 0.0047619 k( 19) = ( 0.4090909 0.0000000 0.0000000), wk = 0.0047619 k( 20) = ( 0.4318182 -0.0000000 -0.0000000), wk = 0.0047619 k( 21) = ( 0.4545455 0.0000000 -0.0000000), wk = 0.0047619 k( 22) = ( 0.4772727 0.0000000 -0.0000000), wk = 0.0047619 k( 23) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 24) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 25) = ( 0.4871795 0.0256410 -0.0000000), wk = 0.0047619 k( 26) = ( 0.4743590 0.0512821 -0.0000000), wk = 0.0047619 k( 27) = ( 0.4615385 0.0769231 0.0000000), wk = 0.0047619 k( 28) = ( 0.4487179 0.1025641 -0.0000000), wk = 0.0047619 k( 29) = ( 0.4358974 0.1282051 -0.0000000), wk = 0.0047619 k( 30) = ( 0.4230769 0.1538462 0.0000000), wk = 0.0047619 k( 31) = ( 0.4102564 0.1794872 0.0000000), wk = 0.0047619 k( 32) = ( 0.3974359 0.2051282 -0.0000000), wk = 0.0047619 k( 33) = ( 0.3846154 0.2307692 -0.0000000), wk = 0.0047619 k( 34) = ( 0.3717949 0.2564103 -0.0000000), wk = 0.0047619 k( 35) = ( 0.3589744 0.2820513 -0.0000000), wk = 0.0047619 k( 36) = ( 0.3461538 0.3076923 -0.0000000), wk = 0.0047619 k( 37) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0047619 k( 38) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0047619 k( 39) = ( 0.3200000 0.3200000 0.0000000), wk = 0.0047619 k( 40) = ( 0.3066667 0.3066667 0.0000000), wk = 0.0047619 k( 41) = ( 0.2933333 0.2933333 -0.0000000), wk = 0.0047619 k( 42) = ( 0.2800000 0.2800000 -0.0000000), wk = 0.0047619 k( 43) = ( 0.2666667 0.2666667 0.0000000), wk = 0.0047619 k( 44) = ( 0.2533333 0.2533333 -0.0000000), wk = 0.0047619 k( 45) = ( 0.2400000 0.2400000 -0.0000000), wk = 0.0047619 k( 46) = ( 0.2266667 0.2266667 -0.0000000), wk = 0.0047619 k( 47) = ( 0.2133333 0.2133333 0.0000000), wk = 0.0047619 k( 48) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0047619 k( 49) = ( 0.1866667 0.1866667 0.0000000), wk = 0.0047619 k( 50) = ( 0.1733333 0.1733333 -0.0000000), wk = 0.0047619 k( 51) = ( 0.1600000 0.1600000 0.0000000), wk = 0.0047619 k( 52) = ( 0.1466667 0.1466667 0.0000000), wk = 0.0047619 k( 53) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0047619 k( 54) = ( 0.1200000 0.1200000 -0.0000000), wk = 0.0047619 k( 55) = ( 0.1066667 0.1066667 -0.0000000), wk = 0.0047619 k( 56) = ( 0.0933333 0.0933333 -0.0000000), wk = 0.0047619 k( 57) = ( 0.0800000 0.0800000 0.0000000), wk = 0.0047619 k( 58) = ( 0.0666667 0.0666667 -0.0000000), wk = 0.0047619 k( 59) = ( 0.0533333 0.0533333 -0.0000000), wk = 0.0047619 k( 60) = ( 0.0400000 0.0400000 0.0000000), wk = 0.0047619 k( 61) = ( 0.0266667 0.0266667 -0.0000000), wk = 0.0047619 k( 62) = ( 0.0133333 0.0133333 -0.0000000), wk = 0.0047619 k( 63) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 64) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0047619 k( 65) = ( 0.0000000 0.0000000 0.0185185), wk = 0.0047619 k( 66) = ( 0.0000000 0.0000000 0.0370370), wk = 0.0047619 k( 67) = ( 0.0000000 0.0000000 0.0555556), wk = 0.0047619 k( 68) = ( 0.0000000 0.0000000 0.0740741), wk = 0.0047619 k( 69) = ( 0.0000000 0.0000000 0.0925926), wk = 0.0047619 k( 70) = ( 0.0000000 0.0000000 0.1111111), wk = 0.0047619 k( 71) = ( 0.0000000 0.0000000 0.1296296), wk = 0.0047619 k( 72) = ( 0.0000000 0.0000000 0.1481482), wk = 0.0047619 k( 73) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0047619 k( 74) = ( 0.0000000 0.0000000 0.1851852), wk = 0.0047619 k( 75) = ( 0.0000000 0.0000000 0.2037037), wk = 0.0047619 k( 76) = ( 0.0000000 0.0000000 0.2222222), wk = 0.0047619 k( 77) = ( 0.0000000 0.0000000 0.2407407), wk = 0.0047619 k( 78) = ( 0.0000000 0.0000000 0.2592593), wk = 0.0047619 k( 79) = ( 0.0000000 0.0000000 0.2777778), wk = 0.0047619 k( 80) = ( 0.0000000 0.0000000 0.2962963), wk = 0.0047619 k( 81) = ( 0.0000000 0.0000000 0.3148148), wk = 0.0047619 k( 82) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0047619 k( 83) = ( 0.0000000 0.0000000 0.3518519), wk = 0.0047619 k( 84) = ( 0.0000000 0.0000000 0.3703704), wk = 0.0047619 k( 85) = ( 0.0000000 0.0000000 0.3888889), wk = 0.0047619 k( 86) = ( 0.0000000 0.0000000 0.4074074), wk = 0.0047619 k( 87) = ( 0.0000000 0.0000000 0.4259259), wk = 0.0047619 k( 88) = ( 0.0000000 0.0000000 0.4444444), wk = 0.0047619 k( 89) = ( 0.0000000 0.0000000 0.4629630), wk = 0.0047619 k( 90) = ( 0.0000000 0.0000000 0.4814815), wk = 0.0047619 k( 91) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 92) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 93) = ( 0.0227273 0.0000000 0.5000000), wk = 0.0047619 k( 94) = ( 0.0454546 0.0000000 0.5000000), wk = 0.0047619 k( 95) = ( 0.0681818 -0.0000000 0.5000000), wk = 0.0047619 k( 96) = ( 0.0909091 0.0000000 0.5000000), wk = 0.0047619 k( 97) = ( 0.1136364 0.0000000 0.5000000), wk = 0.0047619 k( 98) = ( 0.1363636 -0.0000000 0.5000000), wk = 0.0047619 k( 99) = ( 0.1590909 0.0000000 0.5000000), wk = 0.0047619 k( 100) = ( 0.1818182 0.0000000 0.5000000), wk = 0.0047619 k( 101) = ( 0.2045454 -0.0000000 0.5000000), wk = 0.0047619 k( 102) = ( 0.2272727 0.0000000 0.5000000), wk = 0.0047619 k( 103) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0047619 k( 104) = ( 0.2727273 -0.0000000 0.5000000), wk = 0.0047619 k( 105) = ( 0.2954545 -0.0000000 0.5000000), wk = 0.0047619 k( 106) = ( 0.3181818 0.0000000 0.5000000), wk = 0.0047619 k( 107) = ( 0.3409091 0.0000000 0.5000000), wk = 0.0047619 k( 108) = ( 0.3636364 0.0000000 0.5000000), wk = 0.0047619 k( 109) = ( 0.3863636 -0.0000000 0.5000000), wk = 0.0047619 k( 110) = ( 0.4090909 0.0000000 0.5000000), wk = 0.0047619 k( 111) = ( 0.4318182 -0.0000000 0.5000000), wk = 0.0047619 k( 112) = ( 0.4545455 0.0000000 0.5000000), wk = 0.0047619 k( 113) = ( 0.4772727 0.0000000 0.5000000), wk = 0.0047619 k( 114) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 115) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 116) = ( 0.4871795 0.0256410 0.5000000), wk = 0.0047619 k( 117) = ( 0.4743590 0.0512821 0.5000000), wk = 0.0047619 k( 118) = ( 0.4615385 0.0769231 0.5000000), wk = 0.0047619 k( 119) = ( 0.4487179 0.1025641 0.5000000), wk = 0.0047619 k( 120) = ( 0.4358974 0.1282051 0.5000000), wk = 0.0047619 k( 121) = ( 0.4230769 0.1538462 0.5000000), wk = 0.0047619 k( 122) = ( 0.4102564 0.1794872 0.5000000), wk = 0.0047619 k( 123) = ( 0.3974359 0.2051282 0.5000000), wk = 0.0047619 k( 124) = ( 0.3846154 0.2307692 0.5000000), wk = 0.0047619 k( 125) = ( 0.3717949 0.2564103 0.5000000), wk = 0.0047619 k( 126) = ( 0.3589744 0.2820513 0.5000000), wk = 0.0047619 k( 127) = ( 0.3461538 0.3076923 0.5000000), wk = 0.0047619 k( 128) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 k( 129) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 k( 130) = ( 0.3200000 0.3200000 0.5000000), wk = 0.0047619 k( 131) = ( 0.3066667 0.3066667 0.5000000), wk = 0.0047619 k( 132) = ( 0.2933333 0.2933333 0.5000000), wk = 0.0047619 k( 133) = ( 0.2800000 0.2800000 0.5000000), wk = 0.0047619 k( 134) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0047619 k( 135) = ( 0.2533333 0.2533333 0.5000000), wk = 0.0047619 k( 136) = ( 0.2400000 0.2400000 0.5000000), wk = 0.0047619 k( 137) = ( 0.2266667 0.2266667 0.5000000), wk = 0.0047619 k( 138) = ( 0.2133333 0.2133333 0.5000000), wk = 0.0047619 k( 139) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0047619 k( 140) = ( 0.1866667 0.1866667 0.5000000), wk = 0.0047619 k( 141) = ( 0.1733333 0.1733333 0.5000000), wk = 0.0047619 k( 142) = ( 0.1600000 0.1600000 0.5000000), wk = 0.0047619 k( 143) = ( 0.1466667 0.1466667 0.5000000), wk = 0.0047619 k( 144) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0047619 k( 145) = ( 0.1200000 0.1200000 0.5000000), wk = 0.0047619 k( 146) = ( 0.1066667 0.1066667 0.5000000), wk = 0.0047619 k( 147) = ( 0.0933333 0.0933333 0.5000000), wk = 0.0047619 k( 148) = ( 0.0800000 0.0800000 0.5000000), wk = 0.0047619 k( 149) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0047619 k( 150) = ( 0.0533333 0.0533333 0.5000000), wk = 0.0047619 k( 151) = ( 0.0400000 0.0400000 0.5000000), wk = 0.0047619 k( 152) = ( 0.0266667 0.0266667 0.5000000), wk = 0.0047619 k( 153) = ( 0.0133333 0.0133333 0.5000000), wk = 0.0047619 k( 154) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0047619 k( 155) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0047619 k( 156) = ( 0.5000000 0.0000000 0.4814815), wk = 0.0047619 k( 157) = ( 0.5000000 0.0000000 0.4629630), wk = 0.0047619 k( 158) = ( 0.5000000 0.0000000 0.4444444), wk = 0.0047619 k( 159) = ( 0.5000000 0.0000000 0.4259259), wk = 0.0047619 k( 160) = ( 0.5000000 0.0000000 0.4074074), wk = 0.0047619 k( 161) = ( 0.5000000 0.0000000 0.3888889), wk = 0.0047619 k( 162) = ( 0.5000000 0.0000000 0.3703704), wk = 0.0047619 k( 163) = ( 0.5000000 0.0000000 0.3518519), wk = 0.0047619 k( 164) = ( 0.5000000 0.0000000 0.3333333), wk = 0.0047619 k( 165) = ( 0.5000000 0.0000000 0.3148148), wk = 0.0047619 k( 166) = ( 0.5000000 0.0000000 0.2962963), wk = 0.0047619 k( 167) = ( 0.5000000 0.0000000 0.2777778), wk = 0.0047619 k( 168) = ( 0.5000000 0.0000000 0.2592593), wk = 0.0047619 k( 169) = ( 0.5000000 0.0000000 0.2407407), wk = 0.0047619 k( 170) = ( 0.5000000 0.0000000 0.2222222), wk = 0.0047619 k( 171) = ( 0.5000000 0.0000000 0.2037037), wk = 0.0047619 k( 172) = ( 0.5000000 0.0000000 0.1851852), wk = 0.0047619 k( 173) = ( 0.5000000 0.0000000 0.1666667), wk = 0.0047619 k( 174) = ( 0.5000000 0.0000000 0.1481482), wk = 0.0047619 k( 175) = ( 0.5000000 0.0000000 0.1296296), wk = 0.0047619 k( 176) = ( 0.5000000 0.0000000 0.1111111), wk = 0.0047619 k( 177) = ( 0.5000000 0.0000000 0.0925926), wk = 0.0047619 k( 178) = ( 0.5000000 0.0000000 0.0740741), wk = 0.0047619 k( 179) = ( 0.5000000 0.0000000 0.0555556), wk = 0.0047619 k( 180) = ( 0.5000000 0.0000000 0.0370370), wk = 0.0047619 k( 181) = ( 0.5000000 0.0000000 0.0185185), wk = 0.0047619 k( 182) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0047619 k( 183) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0047619 k( 184) = ( 0.3333333 0.3333333 0.0185185), wk = 0.0047619 k( 185) = ( 0.3333333 0.3333333 0.0370370), wk = 0.0047619 k( 186) = ( 0.3333333 0.3333333 0.0555556), wk = 0.0047619 k( 187) = ( 0.3333333 0.3333333 0.0740741), wk = 0.0047619 k( 188) = ( 0.3333333 0.3333333 0.0925926), wk = 0.0047619 k( 189) = ( 0.3333333 0.3333333 0.1111111), wk = 0.0047619 k( 190) = ( 0.3333333 0.3333333 0.1296296), wk = 0.0047619 k( 191) = ( 0.3333333 0.3333333 0.1481482), wk = 0.0047619 k( 192) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0047619 k( 193) = ( 0.3333333 0.3333333 0.1851852), wk = 0.0047619 k( 194) = ( 0.3333333 0.3333333 0.2037037), wk = 0.0047619 k( 195) = ( 0.3333333 0.3333333 0.2222222), wk = 0.0047619 k( 196) = ( 0.3333333 0.3333333 0.2407407), wk = 0.0047619 k( 197) = ( 0.3333333 0.3333333 0.2592593), wk = 0.0047619 k( 198) = ( 0.3333333 0.3333333 0.2777778), wk = 0.0047619 k( 199) = ( 0.3333333 0.3333333 0.2962963), wk = 0.0047619 k( 200) = ( 0.3333333 0.3333333 0.3148148), wk = 0.0047619 k( 201) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0047619 k( 202) = ( 0.3333333 0.3333333 0.3518519), wk = 0.0047619 k( 203) = ( 0.3333333 0.3333333 0.3703704), wk = 0.0047619 k( 204) = ( 0.3333333 0.3333333 0.3888889), wk = 0.0047619 k( 205) = ( 0.3333333 0.3333333 0.4074074), wk = 0.0047619 k( 206) = ( 0.3333333 0.3333333 0.4259259), wk = 0.0047619 k( 207) = ( 0.3333333 0.3333333 0.4444444), wk = 0.0047619 k( 208) = ( 0.3333333 0.3333333 0.4629630), wk = 0.0047619 k( 209) = ( 0.3333333 0.3333333 0.4814815), wk = 0.0047619 k( 210) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0047619 Dense grid: 157129 G-vectors FFT dimensions: ( 80, 80, 60) Smooth grid: 117895 G-vectors FFT dimensions: ( 75, 75, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 1.20 Mb ( 820, 96) NL pseudopotentials 2.45 Mb ( 410, 392) Each V/rho on FFT grid 0.20 Mb ( 12800) Each G-vector array 0.03 Mb ( 4365) G-vector shells 0.02 Mb ( 2004) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 4.80 Mb ( 820, 384) Each subspace H/S matrix 0.14 Mb ( 96, 96) Each matrix 1.15 Mb ( 392, 2, 96) The potential is recalculated from file : ./Zr5Sb3As.save/charge-density.dat Starting wfc are 244 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 10.4 secs Computing kpt #: 2 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 18.8 secs Computing kpt #: 3 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 27.4 secs Computing kpt #: 4 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 35.9 secs Computing kpt #: 5 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 44.5 secs Computing kpt #: 6 total cpu time spent up to now is 51.1 secs Computing kpt #: 7 total cpu time spent up to now is 57.6 secs Computing kpt #: 8 total cpu time spent up to now is 63.7 secs Computing kpt #: 9 total cpu time spent up to now is 71.0 secs Computing kpt #: 10 total cpu time spent up to now is 79.0 secs Computing kpt #: 11 total cpu time spent up to now is 85.6 secs Computing kpt #: 12 total cpu time spent up to now is 94.0 secs Computing kpt #: 13 total cpu time spent up to now is 102.1 secs Computing kpt #: 14 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 110.7 secs Computing kpt #: 15 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 119.3 secs Computing kpt #: 16 total cpu time spent up to now is 127.4 secs Computing kpt #: 17 total cpu time spent up to now is 134.0 secs Computing kpt #: 18 total cpu time spent up to now is 140.6 secs Computing kpt #: 19 total cpu time spent up to now is 147.5 secs Computing kpt #: 20 total cpu time spent up to now is 155.7 secs Computing kpt #: 21 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 164.4 secs Computing kpt #: 22 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 173.1 secs Computing kpt #: 23 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 181.7 secs Computing kpt #: 24 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 190.3 secs Computing kpt #: 25 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 198.9 secs Computing kpt #: 26 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 207.5 secs Computing kpt #: 27 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 216.1 secs Computing kpt #: 28 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 224.7 secs Computing kpt #: 29 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 233.3 secs Computing kpt #: 30 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 241.8 secs Computing kpt #: 31 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 250.5 secs Computing kpt #: 32 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 259.4 secs Computing kpt #: 33 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 268.2 secs Computing kpt #: 34 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 277.2 secs Computing kpt #: 35 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 286.4 secs Computing kpt #: 36 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 295.3 secs Computing kpt #: 37 total cpu time spent up to now is 301.8 secs Computing kpt #: 38 total cpu time spent up to now is 308.3 secs Computing kpt #: 39 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 317.1 secs Computing kpt #: 40 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 326.0 secs Computing kpt #: 41 total cpu time spent up to now is 333.5 secs Computing kpt #: 42 total cpu time spent up to now is 339.3 secs Computing kpt #: 43 total cpu time spent up to now is 345.0 secs Computing kpt #: 44 total cpu time spent up to now is 350.6 secs Computing kpt #: 45 total cpu time spent up to now is 356.4 secs Computing kpt #: 46 total cpu time spent up to now is 362.2 secs Computing kpt #: 47 total cpu time spent up to now is 368.2 secs Computing kpt #: 48 total cpu time spent up to now is 374.8 secs Computing kpt #: 49 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 383.4 secs Computing kpt #: 50 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 392.6 secs Computing kpt #: 51 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 401.6 secs Computing kpt #: 52 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 410.4 secs Computing kpt #: 53 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 419.3 secs Computing kpt #: 54 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 428.0 secs Computing kpt #: 55 total cpu time spent up to now is 436.4 secs Computing kpt #: 56 total cpu time spent up to now is 443.1 secs Computing kpt #: 57 total cpu time spent up to now is 449.6 secs Computing kpt #: 58 total cpu time spent up to now is 455.7 secs Computing kpt #: 59 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 464.2 secs Computing kpt #: 60 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 472.8 secs Computing kpt #: 61 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 481.3 secs Computing kpt #: 62 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 489.8 secs Computing kpt #: 63 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 498.1 secs Computing kpt #: 64 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 506.5 secs Computing kpt #: 65 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 514.9 secs Computing kpt #: 66 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 523.3 secs Computing kpt #: 67 total cpu time spent up to now is 531.5 secs Computing kpt #: 68 total cpu time spent up to now is 537.9 secs Computing kpt #: 69 total cpu time spent up to now is 543.7 secs Computing kpt #: 70 total cpu time spent up to now is 550.1 secs Computing kpt #: 71 total cpu time spent up to now is 555.8 secs Computing kpt #: 72 total cpu time spent up to now is 562.2 secs Computing kpt #: 73 total cpu time spent up to now is 568.7 secs Computing kpt #: 74 total cpu time spent up to now is 575.2 secs Computing kpt #: 75 total cpu time spent up to now is 581.9 secs Computing kpt #: 76 total cpu time spent up to now is 588.6 secs Computing kpt #: 77 total cpu time spent up to now is 595.5 secs Computing kpt #: 78 total cpu time spent up to now is 602.8 secs Computing kpt #: 79 total cpu time spent up to now is 610.3 secs Computing kpt #: 80 total cpu time spent up to now is 618.3 secs Computing kpt #: 81 total cpu time spent up to now is 626.4 secs Computing kpt #: 82 total cpu time spent up to now is 634.5 secs Computing kpt #: 83 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 643.7 secs Computing kpt #: 84 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 653.0 secs Computing kpt #: 85 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 662.4 secs Computing kpt #: 86 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 671.8 secs Computing kpt #: 87 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 681.3 secs Computing kpt #: 88 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 691.1 secs Computing kpt #: 89 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 700.6 secs Computing kpt #: 90 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 710.3 secs Computing kpt #: 91 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 720.1 secs Computing kpt #: 92 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 729.7 secs Computing kpt #: 93 total cpu time spent up to now is 737.6 secs Computing kpt #: 94 total cpu time spent up to now is 744.5 secs Computing kpt #: 95 total cpu time spent up to now is 751.3 secs Computing kpt #: 96 total cpu time spent up to now is 757.9 secs Computing kpt #: 97 total cpu time spent up to now is 764.1 secs Computing kpt #: 98 total cpu time spent up to now is 770.6 secs Computing kpt #: 99 total cpu time spent up to now is 777.2 secs Computing kpt #: 100 total cpu time spent up to now is 784.0 secs Computing kpt #: 101 total cpu time spent up to now is 790.1 secs Computing kpt #: 102 total cpu time spent up to now is 796.9 secs Computing kpt #: 103 total cpu time spent up to now is 803.7 secs Computing kpt #: 104 total cpu time spent up to now is 810.4 secs Computing kpt #: 105 total cpu time spent up to now is 817.1 secs Computing kpt #: 106 total cpu time spent up to now is 823.9 secs Computing kpt #: 107 total cpu time spent up to now is 831.3 secs Computing kpt #: 108 total cpu time spent up to now is 838.9 secs Computing kpt #: 109 total cpu time spent up to now is 845.6 secs Computing kpt #: 110 total cpu time spent up to now is 852.3 secs Computing kpt #: 111 total cpu time spent up to now is 858.2 secs Computing kpt #: 112 total cpu time spent up to now is 864.0 secs Computing kpt #: 113 total cpu time spent up to now is 869.6 secs Computing kpt #: 114 total cpu time spent up to now is 875.2 secs Computing kpt #: 115 total cpu time spent up to now is 880.7 secs Computing kpt #: 116 total cpu time spent up to now is 886.3 secs Computing kpt #: 117 total cpu time spent up to now is 892.0 secs Computing kpt #: 118 total cpu time spent up to now is 897.9 secs Computing kpt #: 119 total cpu time spent up to now is 904.6 secs Computing kpt #: 120 total cpu time spent up to now is 913.6 secs Computing kpt #: 121 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 922.1 secs Computing kpt #: 122 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 930.9 secs Computing kpt #: 123 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 939.7 secs Computing kpt #: 124 total cpu time spent up to now is 948.6 secs Computing kpt #: 125 total cpu time spent up to now is 957.5 secs Computing kpt #: 126 total cpu time spent up to now is 965.4 secs Computing kpt #: 127 total cpu time spent up to now is 972.8 secs Computing kpt #: 128 total cpu time spent up to now is 980.3 secs Computing kpt #: 129 total cpu time spent up to now is 987.9 secs Computing kpt #: 130 total cpu time spent up to now is 995.5 secs Computing kpt #: 131 total cpu time spent up to now is 1003.1 secs Computing kpt #: 132 total cpu time spent up to now is 1010.6 secs Computing kpt #: 133 total cpu time spent up to now is 1018.3 secs Computing kpt #: 134 total cpu time spent up to now is 1026.3 secs Computing kpt #: 135 total cpu time spent up to now is 1033.8 secs Computing kpt #: 136 total cpu time spent up to now is 1041.8 secs Computing kpt #: 137 total cpu time spent up to now is 1049.8 secs Computing kpt #: 138 total cpu time spent up to now is 1058.7 secs Computing kpt #: 139 total cpu time spent up to now is 1067.7 secs Computing kpt #: 140 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1077.0 secs Computing kpt #: 141 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1086.1 secs Computing kpt #: 142 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1095.2 secs Computing kpt #: 143 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1104.2 secs Computing kpt #: 144 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1113.2 secs Computing kpt #: 145 c_bands: 4 eigenvalues not converged total cpu time spent up to now is 1122.2 secs Computing kpt #: 146 total cpu time spent up to now is 1129.7 secs Computing kpt #: 147 total cpu time spent up to now is 1136.3 secs Computing kpt #: 148 total cpu time spent up to now is 1142.9 secs Computing kpt #: 149 total cpu time spent up to now is 1149.1 secs Computing kpt #: 150 total cpu time spent up to now is 1155.6 secs Computing kpt #: 151 total cpu time spent up to now is 1162.2 secs Computing kpt #: 152 total cpu time spent up to now is 1169.0 secs Computing kpt #: 153 total cpu time spent up to now is 1176.5 secs Computing kpt #: 154 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1186.2 secs Computing kpt #: 155 total cpu time spent up to now is 1191.7 secs Computing kpt #: 156 total cpu time spent up to now is 1197.3 secs Computing kpt #: 157 total cpu time spent up to now is 1203.3 secs Computing kpt #: 158 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1211.8 secs Computing kpt #: 159 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1220.4 secs Computing kpt #: 160 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1228.8 secs Computing kpt #: 161 total cpu time spent up to now is 1236.4 secs Computing kpt #: 162 total cpu time spent up to now is 1244.1 secs Computing kpt #: 163 total cpu time spent up to now is 1250.8 secs Computing kpt #: 164 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1259.5 secs Computing kpt #: 165 total cpu time spent up to now is 1266.8 secs Computing kpt #: 166 total cpu time spent up to now is 1274.8 secs Computing kpt #: 167 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1283.3 secs Computing kpt #: 168 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1292.5 secs Computing kpt #: 169 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1301.1 secs Computing kpt #: 170 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1309.8 secs Computing kpt #: 171 total cpu time spent up to now is 1317.4 secs Computing kpt #: 172 total cpu time spent up to now is 1324.9 secs Computing kpt #: 173 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1333.4 secs Computing kpt #: 174 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1341.9 secs Computing kpt #: 175 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1350.4 secs Computing kpt #: 176 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1358.9 secs Computing kpt #: 177 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1367.5 secs Computing kpt #: 178 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1376.1 secs Computing kpt #: 179 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1384.9 secs Computing kpt #: 180 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1393.9 secs Computing kpt #: 181 c_bands: 3 eigenvalues not converged total cpu time spent up to now is 1402.6 secs Computing kpt #: 182 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1411.2 secs Computing kpt #: 183 total cpu time spent up to now is 1417.7 secs Computing kpt #: 184 total cpu time spent up to now is 1424.2 secs Computing kpt #: 185 total cpu time spent up to now is 1430.7 secs Computing kpt #: 186 total cpu time spent up to now is 1436.7 secs Computing kpt #: 187 total cpu time spent up to now is 1442.6 secs Computing kpt #: 188 total cpu time spent up to now is 1448.3 secs Computing kpt #: 189 total cpu time spent up to now is 1454.8 secs Computing kpt #: 190 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1463.2 secs Computing kpt #: 191 total cpu time spent up to now is 1471.4 secs Computing kpt #: 192 total cpu time spent up to now is 1479.0 secs Computing kpt #: 193 total cpu time spent up to now is 1485.6 secs Computing kpt #: 194 total cpu time spent up to now is 1492.7 secs Computing kpt #: 195 total cpu time spent up to now is 1499.9 secs Computing kpt #: 196 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1508.3 secs Computing kpt #: 197 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1516.5 secs Computing kpt #: 198 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1524.6 secs Computing kpt #: 199 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1532.8 secs Computing kpt #: 200 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1541.0 secs Computing kpt #: 201 total cpu time spent up to now is 1549.1 secs Computing kpt #: 202 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 1557.3 secs Computing kpt #: 203 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1565.7 secs Computing kpt #: 204 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1574.2 secs Computing kpt #: 205 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 1582.8 secs Computing kpt #: 206 total cpu time spent up to now is 1591.3 secs Computing kpt #: 207 total cpu time spent up to now is 1599.0 secs Computing kpt #: 208 total cpu time spent up to now is 1605.2 secs Computing kpt #: 209 total cpu time spent up to now is 1612.4 secs Computing kpt #: 210 total cpu time spent up to now is 1619.8 secs ethr = 1.25E-08, avg # of iterations = 91.9 total cpu time spent up to now is 1619.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 14701 PWs) bands (ev): -2.3858 -2.3858 -0.5223 -0.5223 -0.0556 -0.0556 -0.0550 -0.0550 0.3803 0.3803 0.5528 0.5528 0.5632 0.5632 0.8695 0.8695 4.7965 4.7965 5.0202 5.0202 5.0274 5.0274 5.0708 5.0708 5.2029 5.2029 5.9754 5.9754 6.1603 6.1603 6.1840 6.1840 6.3371 6.3371 6.3421 6.3421 6.4677 6.4677 6.7141 6.7141 6.8110 6.8110 6.8120 6.8120 6.8121 6.8121 6.9624 6.9624 8.2808 8.2808 8.3295 8.3295 8.3760 8.3760 8.6432 8.6432 8.7113 8.7113 8.7116 8.7116 8.8922 8.8922 8.9383 8.9383 8.9560 8.9560 8.9784 8.9784 8.9870 8.9870 9.0320 9.0320 9.4438 9.4438 9.9734 9.9734 11.0102 11.0102 11.0938 11.0938 11.3198 11.3198 11.4914 11.4914 11.5105 11.5105 11.5983 11.5983 11.6848 11.6848 11.8525 11.8525 11.8587 11.8587 11.9987 11.9987 k = 0.0227 0.0131-0.0000 ( 14719 PWs) bands (ev): -2.3850 -2.3850 -0.5234 -0.5234 -0.0571 -0.0571 -0.0560 -0.0560 0.3802 0.3802 0.5539 0.5539 0.5643 0.5643 0.8698 0.8698 4.7969 4.7969 5.0152 5.0152 5.0288 5.0288 5.0721 5.0721 5.2037 5.2037 5.9778 5.9778 6.1626 6.1626 6.1827 6.1827 6.3371 6.3371 6.3465 6.3465 6.4706 6.4706 6.6965 6.6965 6.8124 6.8124 6.8132 6.8132 6.8246 6.8246 6.9640 6.9640 8.2844 8.2844 8.3276 8.3276 8.3720 8.3720 8.6394 8.6394 8.7080 8.7080 8.7098 8.7098 8.8845 8.8845 8.9328 8.9328 8.9633 8.9633 8.9789 8.9789 8.9878 8.9878 9.0373 9.0373 9.4434 9.4434 9.9790 9.9790 11.0079 11.0079 11.0913 11.0913 11.3174 11.3174 11.4823 11.4823 11.5051 11.5051 11.5834 11.5834 11.7074 11.7074 11.8473 11.8473 11.8553 11.8553 12.0005 12.0006 k = 0.0455 0.0262-0.0000 ( 14715 PWs) bands (ev): -2.3828 -2.3828 -0.5268 -0.5268 -0.0619 -0.0619 -0.0584 -0.0584 0.3802 0.3802 0.5570 0.5570 0.5675 0.5675 0.8705 0.8705 4.7981 4.7981 4.9996 4.9996 5.0338 5.0338 5.0764 5.0764 5.2061 5.2061 5.9844 5.9844 6.1691 6.1691 6.1788 6.1788 6.3370 6.3370 6.3593 6.3593 6.4795 6.4795 6.6580 6.6580 6.8150 6.8150 6.8169 6.8169 6.8497 6.8497 6.9690 6.9690 8.2951 8.2951 8.3218 8.3218 8.3599 8.3599 8.6283 8.6283 8.6980 8.6980 8.7048 8.7048 8.8671 8.8671 8.9193 8.9193 8.9696 8.9696 8.9858 8.9858 8.9932 8.9932 9.0509 9.0509 9.4425 9.4425 9.9954 9.9954 11.0010 11.0010 11.0837 11.0837 11.3105 11.3105 11.4488 11.4488 11.4993 11.4993 11.5595 11.5595 11.7503 11.7503 11.8303 11.8303 11.8482 11.8482 12.0049 12.0154 k = 0.0682 0.0394-0.0000 ( 14721 PWs) bands (ev): -2.3792 -2.3792 -0.5323 -0.5323 -0.0697 -0.0697 -0.0621 -0.0621 0.3801 0.3801 0.5618 0.5618 0.5729 0.5729 0.8717 0.8717 4.7999 4.7999 4.9744 4.9744 5.0424 5.0424 5.0844 5.0844 5.2097 5.2097 5.9943 5.9943 6.1725 6.1725 6.1799 6.1799 6.3372 6.3372 6.3788 6.3788 6.4946 6.4946 6.6119 6.6119 6.8191 6.8191 6.8231 6.8231 6.8747 6.8747 6.9769 6.9769 8.3109 8.3109 8.3133 8.3133 8.3406 8.3406 8.6110 8.6110 8.6826 8.6826 8.6961 8.6961 8.8450 8.8450 8.9030 8.9030 8.9625 8.9625 9.0026 9.0026 9.0045 9.0045 9.0698 9.0698 9.4409 9.4409 10.0217 10.0217 10.9893 10.9893 11.0708 11.0708 11.3000 11.3000 11.4005 11.4005 11.4891 11.4891 11.5394 11.5394 11.7913 11.7913 11.8059 11.8059 11.8387 11.8387 12.0094 12.0146 k = 0.0909 0.0525-0.0000 ( 14721 PWs) bands (ev): -2.3743 -2.3743 -0.5401 -0.5401 -0.0801 -0.0801 -0.0671 -0.0671 0.3800 0.3800 0.5679 0.5679 0.5803 0.5803 0.8735 0.8735 4.8022 4.8022 4.9411 4.9411 5.0546 5.0546 5.0961 5.0961 5.2144 5.2144 6.0057 6.0057 6.1642 6.1642 6.1946 6.1946 6.3382 6.3382 6.4025 6.4025 6.5140 6.5140 6.5661 6.5661 6.8247 6.8247 6.8314 6.8314 6.8969 6.8969 6.9868 6.9868 8.2980 8.2980 8.3105 8.3105 8.3388 8.3388 8.5888 8.5888 8.6629 8.6629 8.6836 8.6836 8.8193 8.8193 8.8873 8.8873 8.9523 8.9523 9.0160 9.0160 9.0212 9.0212 9.0930 9.0930 9.4387 9.4387 10.0567 10.0567 10.9725 10.9725 11.0519 11.0519 11.2870 11.2870 11.3470 11.3470 11.4646 11.4646 11.5306 11.5306 11.7679 11.7679 11.8188 11.8188 11.8396 11.8396 12.0037 12.0038 k = 0.1136 0.0656-0.0000 ( 14711 PWs) bands (ev): -2.3680 -2.3680 -0.5500 -0.5500 -0.0924 -0.0924 -0.0733 -0.0733 0.3799 0.3799 0.5748 0.5748 0.5897 0.5897 0.8758 0.8758 4.8048 4.8048 4.9018 4.9018 5.0704 5.0704 5.1116 5.1116 5.2204 5.2204 6.0160 6.0160 6.1552 6.1552 6.2128 6.2128 6.3407 6.3407 6.4253 6.4253 6.5021 6.5021 6.5615 6.5615 6.8316 6.8316 6.8416 6.8416 6.9165 6.9165 6.9976 6.9976 8.2741 8.2741 8.2824 8.2824 8.3677 8.3677 8.5631 8.5631 8.6402 8.6402 8.6669 8.6669 8.7903 8.7903 8.8736 8.8736 8.9415 8.9415 9.0302 9.0302 9.0361 9.0361 9.1194 9.1194 9.4358 9.4358 10.0990 10.0990 10.9502 10.9502 11.0270 11.0270 11.2706 11.2706 11.2940 11.2940 11.4283 11.4283 11.5315 11.5315 11.7280 11.7280 11.8058 11.8058 11.8649 11.8649 11.9903 11.9903 k = 0.1364 0.0787-0.0000 ( 14727 PWs) bands (ev): -2.3605 -2.3605 -0.5620 -0.5620 -0.1062 -0.1062 -0.0804 -0.0804 0.3797 0.3797 0.5823 0.5823 0.6005 0.6005 0.8786 0.8786 4.8077 4.8077 4.8583 4.8583 5.0895 5.0895 5.1307 5.1307 5.2275 5.2275 6.0221 6.0221 6.1477 6.1477 6.2341 6.2341 6.3443 6.3443 6.4245 6.4245 6.4810 6.4810 6.5993 6.5993 6.8397 6.8397 6.8531 6.8531 6.9347 6.9347 7.0079 7.0079 8.2331 8.2331 8.2599 8.2599 8.4020 8.4020 8.5346 8.5346 8.6156 8.6156 8.6461 8.6461 8.7589 8.7589 8.8623 8.8623 8.9314 8.9314 9.0436 9.0436 9.0499 9.0499 9.1477 9.1477 9.4323 9.4323 10.1469 10.1469 10.9215 10.9215 10.9969 10.9969 11.2298 11.2298 11.2650 11.2650 11.3873 11.3873 11.5377 11.5377 11.6832 11.6832 11.7884 11.7884 11.8837 11.8837 11.9801 11.9801 k = 0.1591 0.0919-0.0000 ( 14731 PWs) bands (ev): -2.3519 -2.3519 -0.5760 -0.5760 -0.1208 -0.1208 -0.0882 -0.0882 0.3796 0.3796 0.5902 0.5902 0.6123 0.6123 0.8821 0.8821 4.8072 4.8072 4.8160 4.8160 5.1116 5.1116 5.1531 5.1531 5.2362 5.2362 6.0204 6.0204 6.1443 6.1443 6.2575 6.2575 6.3434 6.3434 6.3892 6.3892 6.4995 6.4995 6.6473 6.6473 6.8487 6.8487 6.8656 6.8656 6.9525 6.9525 7.0170 7.0170 8.1849 8.1849 8.2343 8.2343 8.4390 8.4390 8.5041 8.5041 8.5909 8.5909 8.6217 8.6217 8.7262 8.7262 8.8532 8.8532 8.9229 8.9229 9.0545 9.0545 9.0645 9.0645 9.1767 9.1767 9.4279 9.4279 10.1991 10.1991 10.8852 10.8852 10.9639 10.9639 11.1743 11.1743 11.2509 11.2509 11.3457 11.3457 11.5480 11.5480 11.6344 11.6344 11.7698 11.7698 11.8957 11.8957 11.9734 11.9734 k = 0.1818 0.1050-0.0000 ( 14743 PWs) bands (ev): -2.3423 -2.3423 -0.5918 -0.5918 -0.1358 -0.1358 -0.0965 -0.0965 0.3794 0.3794 0.5983 0.5983 0.6246 0.6246 0.8862 0.8862 4.7630 4.7630 4.8166 4.8166 5.1361 5.1361 5.1782 5.1782 5.2468 5.2468 6.0094 6.0094 6.1458 6.1458 6.2801 6.2801 6.3139 6.3139 6.3809 6.3809 6.5264 6.5264 6.7011 6.7011 6.8584 6.8584 6.8786 6.8786 6.9708 6.9708 7.0251 7.0251 8.1312 8.1312 8.2051 8.2051 8.4658 8.4658 8.4797 8.4797 8.5708 8.5708 8.5943 8.5943 8.6930 8.6930 8.8464 8.8464 8.9164 8.9164 9.0635 9.0635 9.0797 9.0797 9.2056 9.2056 9.4227 9.4227 10.2540 10.2540 10.8409 10.8409 10.9303 10.9303 11.1179 11.1179 11.2377 11.2377 11.3064 11.3064 11.5619 11.5619 11.5829 11.5829 11.7511 11.7511 11.9029 11.9029 11.9698 11.9698 k = 0.2045 0.1181-0.0000 ( 14751 PWs) bands (ev): -2.3318 -2.3318 -0.6093 -0.6093 -0.1508 -0.1508 -0.1052 -0.1052 0.3792 0.3792 0.6063 0.6063 0.6372 0.6372 0.8909 0.8909 4.7148 4.7148 4.8222 4.8222 5.1623 5.1623 5.2046 5.2046 5.2604 5.2604 5.9906 5.9906 6.1491 6.1491 6.2571 6.2571 6.3155 6.3155 6.3942 6.3942 6.5542 6.5542 6.7584 6.7584 6.8686 6.8686 6.8914 6.8914 6.9898 6.9898 7.0329 7.0329 8.0726 8.0726 8.1724 8.1724 8.4353 8.4353 8.4905 8.4905 8.5646 8.5646 8.5730 8.5730 8.6602 8.6602 8.8419 8.8419 8.9117 8.9117 9.0717 9.0717 9.0947 9.0947 9.2336 9.2336 9.4165 9.4165 10.3101 10.3101 10.7899 10.7899 10.8972 10.8972 11.0620 11.0620 11.2232 11.2232 11.2720 11.2720 11.5276 11.5276 11.5812 11.5812 11.7332 11.7332 11.9057 11.9057 11.9686 11.9686 k = 0.2273 0.1312-0.0000 ( 14755 PWs) bands (ev): -2.3207 -2.3207 -0.6280 -0.6280 -0.1652 -0.1652 -0.1139 -0.1139 0.3790 0.3790 0.6141 0.6141 0.6496 0.6496 0.8961 0.8961 4.6669 4.6669 4.8295 4.8295 5.1893 5.1893 5.2303 5.2303 5.2783 5.2783 5.9666 5.9666 6.1462 6.1462 6.2154 6.2154 6.3434 6.3434 6.4142 6.4142 6.5812 6.5812 6.8170 6.8170 6.8791 6.8791 6.9038 6.9038 7.0091 7.0091 7.0422 7.0422 8.0101 8.0101 8.1367 8.1367 8.3996 8.3996 8.4744 8.4744 8.5340 8.5340 8.6071 8.6071 8.6285 8.6285 8.8398 8.8398 8.9089 8.9089 9.0795 9.0795 9.1092 9.1092 9.2602 9.2602 9.4092 9.4092 10.3653 10.3653 10.7354 10.7354 10.8644 10.8644 11.0075 11.0075 11.2050 11.2050 11.2449 11.2449 11.4716 11.4716 11.6036 11.6036 11.7171 11.7171 11.9035 11.9035 11.9692 11.9692 k = 0.2500 0.1443-0.0000 ( 14743 PWs) bands (ev): -2.3091 -2.3091 -0.6477 -0.6477 -0.1790 -0.1790 -0.1226 -0.1226 0.3788 0.3788 0.6214 0.6214 0.6616 0.6616 0.9018 0.9018 4.6204 4.6204 4.8387 4.8387 5.2158 5.2158 5.2540 5.2540 5.3012 5.3012 5.9396 5.9396 6.1215 6.1215 6.1958 6.1958 6.3742 6.3742 6.4376 6.4376 6.6062 6.6062 6.8737 6.8737 6.8910 6.8910 6.9156 6.9156 7.0279 7.0279 7.0554 7.0554 7.9444 7.9444 8.0983 8.0983 8.3628 8.3628 8.4472 8.4472 8.5029 8.5029 8.5983 8.5983 8.6534 8.6534 8.8402 8.8402 8.9076 8.9076 9.0872 9.0872 9.1231 9.1231 9.2850 9.2850 9.4008 9.4008 10.4167 10.4167 10.6815 10.6815 10.8317 10.8317 10.9554 10.9554 11.1828 11.1828 11.2254 11.2254 11.4146 11.4146 11.6299 11.6299 11.7037 11.7037 11.8961 11.8961 11.9711 11.9711 k = 0.2727 0.1575-0.0000 ( 14737 PWs) bands (ev): -2.2972 -2.2972 -0.6679 -0.6679 -0.1918 -0.1918 -0.1310 -0.1310 0.3786 0.3786 0.6282 0.6282 0.6731 0.6731 0.9080 0.9080 4.5759 4.5759 4.8500 4.8500 5.2402 5.2402 5.2771 5.2771 5.3272 5.3272 5.9113 5.9113 6.0808 6.0808 6.1945 6.1945 6.4068 6.4068 6.4624 6.4624 6.6284 6.6284 6.8979 6.8979 6.9261 6.9261 6.9330 6.9330 7.0470 7.0470 7.0735 7.0735 7.8763 7.8763 8.0579 8.0579 8.3256 8.3256 8.4170 8.4170 8.4721 8.4721 8.5703 8.5703 8.7030 8.7030 8.8428 8.8428 8.9077 8.9077 9.0949 9.0949 9.1363 9.1363 9.3069 9.3069 9.3919 9.3919 10.4568 10.4568 10.6367 10.6367 10.7987 10.7987 10.9067 10.9067 11.1601 11.1601 11.2101 11.2101 11.3576 11.3576 11.6595 11.6595 11.6941 11.6941 11.8842 11.8842 11.9735 11.9736 k = 0.2955 0.1706-0.0000 ( 14747 PWs) bands (ev): -2.2853 -2.2853 -0.6883 -0.6883 -0.2035 -0.2035 -0.1391 -0.1391 0.3783 0.3783 0.6343 0.6343 0.6838 0.6838 0.9143 0.9143 4.5340 4.5340 4.8636 4.8636 5.2608 5.2608 5.3021 5.3021 5.3528 5.3528 5.8828 5.8828 6.0398 6.0398 6.1976 6.1976 6.4405 6.4405 6.4865 6.4865 6.6487 6.6487 6.9082 6.9082 6.9370 6.9370 6.9807 6.9807 7.0705 7.0705 7.0953 7.0953 7.8068 7.8068 8.0158 8.0158 8.2889 8.2889 8.3861 8.3861 8.4422 8.4422 8.5449 8.5449 8.7529 8.7529 8.8475 8.8475 8.9090 8.9090 9.1027 9.1027 9.1488 9.1488 9.3236 9.3236 9.3844 9.3844 10.4683 10.4683 10.6187 10.6187 10.7655 10.7655 10.8624 10.8624 11.1393 11.1393 11.1965 11.1965 11.3015 11.3015 11.6832 11.6832 11.6978 11.6978 11.8696 11.8696 11.9736 11.9739 k = 0.3182 0.1837-0.0000 ( 14751 PWs) bands (ev): -2.2736 -2.2736 -0.7083 -0.7083 -0.2141 -0.2141 -0.1466 -0.1466 0.3781 0.3781 0.6397 0.6397 0.6937 0.6937 0.9208 0.9208 4.4953 4.4953 4.8796 4.8796 5.2781 5.2781 5.3288 5.3288 5.3745 5.3745 5.8551 5.8551 6.0043 6.0043 6.2011 6.2011 6.4721 6.4721 6.5093 6.5093 6.6692 6.6692 6.9177 6.9177 6.9474 6.9474 7.0167 7.0167 7.1039 7.1039 7.1186 7.1186 7.7366 7.7366 7.9726 7.9726 8.2537 8.2537 8.3555 8.3555 8.4138 8.4138 8.5227 8.5227 8.8016 8.8016 8.8540 8.8540 8.9113 8.9113 9.1105 9.1105 9.1608 9.1608 9.3297 9.3297 9.3836 9.3836 10.4427 10.4427 10.6361 10.6361 10.7326 10.7326 10.8234 10.8234 11.1217 11.1217 11.1832 11.1832 11.2475 11.2475 11.6851 11.6851 11.7306 11.7306 11.8539 11.8539 11.9683 11.9685 k = 0.3409 0.1968-0.0000 ( 14757 PWs) bands (ev): -2.2624 -2.2624 -0.7275 -0.7275 -0.2235 -0.2235 -0.1535 -0.1535 0.3780 0.3780 0.6443 0.6443 0.7025 0.7025 0.9271 0.9271 4.4600 4.4600 4.8976 4.8976 5.2931 5.2931 5.3554 5.3554 5.3903 5.3903 5.8287 5.8287 5.9777 5.9777 6.2043 6.2043 6.4926 6.4926 6.5358 6.5358 6.6931 6.6931 6.9267 6.9267 6.9579 6.9579 7.0397 7.0397 7.1421 7.1421 7.1467 7.1467 7.6667 7.6667 7.9287 7.9287 8.2210 8.2210 8.3259 8.3259 8.3874 8.3874 8.5038 8.5038 8.8476 8.8476 8.8616 8.8616 8.9149 8.9149 9.1181 9.1181 9.1722 9.1722 9.3222 9.3222 9.3924 9.3924 10.4014 10.4014 10.6663 10.6663 10.7010 10.7010 10.7909 10.7909 11.1074 11.1074 11.1688 11.1688 11.1979 11.1979 11.6900 11.6900 11.7676 11.7676 11.8381 11.8381 11.9627 11.9627 k = 0.3636 0.2099-0.0000 ( 14766 PWs) bands (ev): -2.2519 -2.2519 -0.7454 -0.7454 -0.2316 -0.2316 -0.1597 -0.1597 0.3778 0.3778 0.6482 0.6482 0.7104 0.7104 0.9332 0.9332 4.4287 4.4287 4.9176 4.9176 5.3060 5.3060 5.3782 5.3782 5.4009 5.4009 5.8034 5.8034 5.9618 5.9618 6.2068 6.2068 6.4967 6.4967 6.5696 6.5696 6.7219 6.7219 6.9349 6.9349 6.9692 6.9692 7.0536 7.0536 7.1646 7.1646 7.1926 7.1926 7.5986 7.5986 7.8846 7.8846 8.1918 8.1918 8.2981 8.2981 8.3635 8.3635 8.4884 8.4884 8.8698 8.8698 8.8895 8.8895 8.9199 8.9199 9.1253 9.1253 9.1831 9.1831 9.3066 9.3066 9.4054 9.4054 10.3586 10.3586 10.6695 10.6695 10.6930 10.6930 10.7694 10.7694 11.0965 11.0965 11.1412 11.1412 11.1656 11.1656 11.7000 11.7000 11.8055 11.8055 11.8232 11.8232 11.9577 11.9577 k = 0.3864 0.2231-0.0000 ( 14764 PWs) bands (ev): -2.2425 -2.2425 -0.7614 -0.7614 -0.2384 -0.2384 -0.1651 -0.1651 0.3776 0.3776 0.6515 0.6515 0.7171 0.7171 0.9387 0.9387 4.4017 4.4017 4.9388 4.9388 5.3160 5.3160 5.3880 5.3880 5.4156 5.4156 5.7795 5.7795 5.9569 5.9569 6.2089 6.2089 6.4897 6.4897 6.6052 6.6052 6.7553 6.7553 6.9419 6.9419 6.9818 6.9818 7.0613 7.0613 7.1854 7.1854 7.2358 7.2358 7.5346 7.5346 7.8409 7.8409 8.1671 8.1671 8.2728 8.2728 8.3426 8.3426 8.4764 8.4764 8.8777 8.8777 8.9212 8.9212 8.9314 8.9314 9.1320 9.1320 9.1936 9.1936 9.2875 9.2875 9.4185 9.4185 10.3193 10.3193 10.6431 10.6431 10.6971 10.6971 10.7692 10.7692 11.0887 11.0887 11.1008 11.1008 11.1516 11.1516 11.7151 11.7151 11.8096 11.8096 11.8431 11.8431 11.9534 11.9534 k = 0.4091 0.2362-0.0000 ( 14778 PWs) bands (ev): -2.2344 -2.2344 -0.7752 -0.7752 -0.2440 -0.2440 -0.1696 -0.1696 0.3775 0.3775 0.6540 0.6540 0.7226 0.7226 0.9435 0.9435 4.3792 4.3792 4.9605 4.9605 5.3211 5.3211 5.3868 5.3868 5.4349 5.4349 5.7574 5.7574 5.9610 5.9610 6.2105 6.2105 6.4768 6.4768 6.6388 6.6388 6.7914 6.7914 6.9478 6.9478 6.9950 6.9950 7.0650 7.0650 7.2036 7.2036 7.2697 7.2697 7.4799 7.4799 7.7982 7.7982 8.1475 8.1475 8.2506 8.2506 8.3250 8.3250 8.4675 8.4675 8.8846 8.8846 8.9315 8.9315 8.9598 8.9598 9.1379 9.1379 9.2033 9.2033 9.2674 9.2674 9.4302 9.4302 10.2856 10.2856 10.6201 10.6201 10.6848 10.6848 10.7851 10.7851 11.0639 11.0639 11.0841 11.0841 11.1406 11.1406 11.7342 11.7342 11.7980 11.7980 11.8787 11.8787 11.9499 11.9499 k = 0.4318 0.2493-0.0000 ( 14770 PWs) bands (ev): -2.2278 -2.2278 -0.7864 -0.7864 -0.2484 -0.2484 -0.1731 -0.1731 0.3774 0.3774 0.6560 0.6560 0.7270 0.7270 0.9474 0.9474 4.3614 4.3614 4.9812 4.9812 5.3190 5.3190 5.3853 5.3853 5.4522 5.4522 5.7383 5.7383 5.9706 5.9706 6.2116 6.2116 6.4619 6.4619 6.6676 6.6676 6.8283 6.8283 6.9523 6.9523 7.0041 7.0041 7.0714 7.0714 7.2187 7.2187 7.2812 7.2812 7.4467 7.4467 7.7579 7.7579 8.1330 8.1330 8.2323 8.2323 8.3109 8.3109 8.4614 8.4614 8.8899 8.8899 8.9401 8.9401 8.9841 8.9841 9.1427 9.1427 9.2117 9.2117 9.2484 9.2484 9.4397 9.4397 10.2586 10.2586 10.6016 10.6016 10.6702 10.6702 10.8022 10.8022 11.0337 11.0337 11.0817 11.0817 11.1311 11.1311 11.7551 11.7551 11.7888 11.7888 11.9110 11.9110 11.9474 11.9474 k = 0.4545 0.2624-0.0000 ( 14768 PWs) bands (ev): -2.2229 -2.2229 -0.7946 -0.7946 -0.2515 -0.2515 -0.1757 -0.1757 0.3773 0.3773 0.6574 0.6574 0.7301 0.7301 0.9503 0.9503 4.3486 4.3486 4.9990 4.9990 5.3112 5.3112 5.3865 5.3865 5.4654 5.4654 5.7235 5.7235 5.9814 5.9814 6.2124 6.2124 6.4482 6.4482 6.6895 6.6895 6.8640 6.8640 6.9557 6.9557 7.0008 7.0008 7.0905 7.0905 7.2298 7.2298 7.2596 7.2596 7.4448 7.4448 7.7224 7.7224 8.1234 8.1234 8.2185 8.2185 8.3007 8.3007 8.4574 8.4574 8.8936 8.8936 8.9481 8.9481 9.0016 9.0016 9.1464 9.1464 9.2173 9.2173 9.2335 9.2335 9.4468 9.4468 10.2389 10.2389 10.5881 10.5881 10.6583 10.6583 10.8153 10.8153 11.0113 11.0113 11.0811 11.0811 11.1234 11.1234 11.7735 11.7735 11.7834 11.7834 11.9377 11.9377 11.9460 11.9460 k = 0.4773 0.2756-0.0000 ( 14766 PWs) bands (ev): -2.2199 -2.2199 -0.7996 -0.7996 -0.2533 -0.2533 -0.1772 -0.1772 0.3773 0.3773 0.6582 0.6582 0.7319 0.7319 0.9521 0.9521 4.3409 4.3409 5.0114 5.0114 5.3032 5.3032 5.3887 5.3887 5.4736 5.4736 5.7139 5.7139 5.9897 5.9897 6.2129 6.2129 6.4385 6.4385 6.7029 6.7029 6.8947 6.8947 6.9577 6.9577 6.9872 6.9872 7.1228 7.1228 7.2174 7.2174 7.2379 7.2379 7.4577 7.4577 7.6962 7.6962 8.1179 8.1179 8.2099 8.2099 8.2945 8.2945 8.4553 8.4553 8.8957 8.8957 8.9540 8.9540 9.0121 9.0121 9.1486 9.1486 9.2158 9.2158 9.2285 9.2285 9.4511 9.4511 10.2270 10.2270 10.5799 10.5799 10.6508 10.6508 10.8233 10.8233 10.9975 10.9975 11.0815 11.0815 11.1182 11.1182 11.7760 11.7760 11.7913 11.7913 11.9443 11.9443 11.9584 11.9586 k = 0.5000 0.2887-0.0000 ( 14762 PWs) bands (ev): -2.2189 -2.2189 -0.8013 -0.8013 -0.2540 -0.2540 -0.1778 -0.1778 0.3773 0.3773 0.6584 0.6584 0.7326 0.7326 0.9527 0.9527 4.3383 4.3383 5.0159 5.0159 5.2998 5.2998 5.3897 5.3897 5.4764 5.4764 5.7107 5.7107 5.9928 5.9928 6.2131 6.2131 6.4351 6.4351 6.7074 6.7074 6.9093 6.9093 6.9584 6.9584 6.9779 6.9779 7.1517 7.1517 7.1850 7.1850 7.2399 7.2399 7.4645 7.4645 7.6861 7.6861 8.1162 8.1162 8.2070 8.2070 8.2924 8.2924 8.4546 8.4546 8.8964 8.8964 8.9562 8.9562 9.0156 9.0156 9.1494 9.1494 9.2132 9.2132 9.2288 9.2288 9.4526 9.4526 10.2230 10.2230 10.5771 10.5771 10.6482 10.6482 10.8260 10.8260 10.9928 10.9928 11.0818 11.0818 11.1163 11.1163 11.7750 11.7750 11.7965 11.7965 11.9441 11.9441 11.9663 11.9670 k = 0.5000 0.2887-0.0000 ( 14762 PWs) bands (ev): -2.2189 -2.2189 -0.8013 -0.8013 -0.2540 -0.2540 -0.1778 -0.1778 0.3773 0.3773 0.6584 0.6584 0.7326 0.7326 0.9527 0.9527 4.3383 4.3383 5.0159 5.0159 5.2998 5.2998 5.3897 5.3897 5.4764 5.4764 5.7107 5.7107 5.9928 5.9928 6.2131 6.2131 6.4351 6.4351 6.7074 6.7074 6.9093 6.9093 6.9584 6.9584 6.9779 6.9779 7.1517 7.1517 7.1850 7.1850 7.2399 7.2399 7.4645 7.4645 7.6861 7.6861 8.1162 8.1162 8.2070 8.2070 8.2924 8.2924 8.4546 8.4546 8.8964 8.8964 8.9562 8.9562 9.0156 9.0156 9.1494 9.1494 9.2132 9.2132 9.2288 9.2288 9.4526 9.4526 10.2230 10.2230 10.5771 10.5771 10.6482 10.6482 10.8260 10.8260 10.9928 10.9928 11.0818 11.0818 11.1163 11.1163 11.7750 11.7750 11.7965 11.7965 11.9441 11.9441 11.9664 11.9686 k = 0.4872 0.3109-0.0000 ( 14756 PWs) bands (ev): -2.2186 -2.2186 -0.8003 -0.8003 -0.2657 -0.2657 -0.1681 -0.1681 0.3773 0.3773 0.6591 0.6591 0.7332 0.7332 0.9521 0.9521 4.3385 4.3385 5.0145 5.0145 5.2984 5.2984 5.3902 5.3902 5.4793 5.4793 5.7094 5.7094 5.9924 5.9924 6.2133 6.2133 6.4375 6.4375 6.7091 6.7091 6.9061 6.9061 6.9591 6.9591 6.9790 6.9790 7.1539 7.1539 7.1845 7.1845 7.2388 7.2388 7.4674 7.4674 7.6834 7.6834 8.1152 8.1152 8.2080 8.2080 8.2938 8.2938 8.4484 8.4484 8.8895 8.8895 8.9556 8.9556 9.0154 9.0154 9.1489 9.1489 9.2162 9.2162 9.2379 9.2379 9.4564 9.4564 10.2262 10.2262 10.5703 10.5703 10.6467 10.6467 10.7978 10.7978 11.0207 11.0207 11.0825 11.0825 11.1193 11.1193 11.7677 11.7677 11.7966 11.7966 11.9423 11.9423 11.9678 11.9683 k = 0.4744 0.3331-0.0000 ( 14764 PWs) bands (ev): -2.2178 -2.2178 -0.7973 -0.7973 -0.2915 -0.2915 -0.1482 -0.1482 0.3773 0.3773 0.6611 0.6611 0.7352 0.7352 0.9501 0.9501 4.3390 4.3390 5.0105 5.0105 5.2940 5.2940 5.3920 5.3920 5.4879 5.4879 5.7055 5.7055 5.9910 5.9910 6.2142 6.2142 6.4447 6.4447 6.7138 6.7138 6.8979 6.8979 6.9611 6.9611 6.9817 6.9817 7.1600 7.1600 7.1830 7.1830 7.2357 7.2357 7.4756 7.4756 7.6757 7.6757 8.1121 8.1121 8.2109 8.2109 8.2980 8.2980 8.4304 8.4304 8.8685 8.8685 8.9570 8.9570 9.0152 9.0152 9.1468 9.1468 9.2234 9.2234 9.2643 9.2643 9.4676 9.4676 10.2355 10.2355 10.5503 10.5503 10.6418 10.6418 10.7402 10.7402 11.0695 11.0695 11.0922 11.0922 11.1285 11.1285 11.7444 11.7444 11.7969 11.7969 11.9371 11.9371 11.9698 11.9699 k = 0.4615 0.3553-0.0000 ( 14752 PWs) bands (ev): -2.2165 -2.2165 -0.7924 -0.7924 -0.3227 -0.3227 -0.1268 -0.1268 0.3772 0.3772 0.6642 0.6642 0.7386 0.7386 0.9468 0.9468 4.3397 4.3397 5.0047 5.0047 5.2863 5.2863 5.3950 5.3950 5.5021 5.5021 5.6990 5.6990 5.9887 5.9887 6.2157 6.2157 6.4557 6.4557 6.7212 6.7212 6.8870 6.8870 6.9643 6.9643 6.9851 6.9851 7.1673 7.1673 7.1827 7.1827 7.2307 7.2307 7.4880 7.4880 7.6646 7.6646 8.1064 8.1064 8.2156 8.2156 8.3046 8.3046 8.4022 8.4022 8.8363 8.8363 8.9634 8.9634 9.0147 9.0147 9.1431 9.1431 9.2332 9.2332 9.3034 9.3034 9.4856 9.4856 10.2505 10.2505 10.5188 10.5188 10.6293 10.6293 10.6796 10.6796 11.0783 11.0783 11.1355 11.1355 11.1579 11.1579 11.7028 11.7028 11.7974 11.7974 11.9292 11.9292 11.9633 11.9634 k = 0.4487 0.3775-0.0000 ( 14748 PWs) bands (ev): -2.2147 -2.2147 -0.7854 -0.7854 -0.3563 -0.3563 -0.1067 -0.1067 0.3772 0.3772 0.6679 0.6679 0.7437 0.7437 0.9423 0.9423 4.3406 4.3406 4.9980 4.9980 5.2751 5.2751 5.3995 5.3995 5.5214 5.5214 5.6902 5.6902 5.9854 5.9854 6.2180 6.2180 6.4696 6.4696 6.7305 6.7305 6.8759 6.8759 6.9685 6.9685 6.9891 6.9891 7.1677 7.1677 7.1906 7.1906 7.2240 7.2240 7.5024 7.5024 7.6531 7.6531 8.0977 8.0977 8.2222 8.2222 8.3127 8.3127 8.3661 8.3661 8.7971 8.7971 8.9745 8.9745 9.0142 9.0142 9.1385 9.1385 9.2440 9.2440 9.3509 9.3509 9.5096 9.5096 10.2699 10.2699 10.4783 10.4783 10.5864 10.5864 10.6454 10.6454 11.0783 11.0783 11.1563 11.1563 11.2250 11.2250 11.6439 11.6439 11.7980 11.7980 11.9194 11.9194 11.9480 11.9481 k = 0.4359 0.3997-0.0000 ( 14758 PWs) bands (ev): -2.2126 -2.2126 -0.7765 -0.7765 -0.3911 -0.3911 -0.0886 -0.0886 0.3772 0.3772 0.6717 0.6717 0.7507 0.7507 0.9365 0.9365 4.3414 4.3414 4.9917 4.9917 5.2603 5.2603 5.4057 5.4057 5.5450 5.5450 5.6794 5.6794 5.9808 5.9808 6.2209 6.2209 6.4850 6.4850 6.7409 6.7409 6.8663 6.8663 6.9735 6.9735 6.9944 6.9944 7.1615 7.1615 7.2038 7.2038 7.2166 7.2166 7.5146 7.5146 7.6462 7.6462 8.0852 8.0852 8.2306 8.2306 8.3139 8.3139 8.3323 8.3323 8.7544 8.7544 8.9893 8.9893 9.0137 9.0137 9.1339 9.1339 9.2544 9.2544 9.4039 9.4039 9.5389 9.5389 10.2905 10.2905 10.4325 10.4325 10.5211 10.5211 10.6328 10.6328 11.0768 11.0768 11.1781 11.1781 11.2960 11.2960 11.5731 11.5731 11.7985 11.7985 11.9084 11.9084 11.9321 11.9326 k = 0.4231 0.4219-0.0000 ( 14754 PWs) bands (ev): -2.2102 -2.2102 -0.7658 -0.7658 -0.4262 -0.4262 -0.0729 -0.0729 0.3771 0.3771 0.6752 0.6752 0.7597 0.7597 0.9296 0.9296 4.3420 4.3420 4.9869 4.9869 5.2423 5.2423 5.4137 5.4137 5.5716 5.5716 5.6672 5.6672 5.9747 5.9747 6.2245 6.2245 6.5004 6.5004 6.7516 6.7516 6.8600 6.8600 6.9795 6.9795 7.0016 7.0016 7.1524 7.1524 7.2036 7.2036 7.2224 7.2224 7.5196 7.5196 7.6505 7.6505 8.0685 8.0685 8.2407 8.2407 8.2729 8.2729 8.3381 8.3381 8.7098 8.7098 9.0068 9.0068 9.0133 9.0133 9.1301 9.1301 9.2630 9.2630 9.4608 9.4608 9.5727 9.5727 10.3014 10.3014 10.3896 10.3896 10.4569 10.4569 10.6234 10.6234 11.0741 11.0741 11.2022 11.2022 11.3670 11.3670 11.4967 11.4967 11.7992 11.7992 11.8972 11.8972 11.9140 11.9142 k = 0.4103 0.4441-0.0000 ( 14764 PWs) bands (ev): -2.2076 -2.2076 -0.7531 -0.7531 -0.4612 -0.4612 -0.0597 -0.0597 0.3771 0.3771 0.6783 0.6783 0.7706 0.7706 0.9216 0.9216 4.3422 4.3422 4.9847 4.9847 5.2214 5.2214 5.4237 5.4237 5.5980 5.5980 5.6563 5.6563 5.9666 5.9666 6.2283 6.2283 6.5145 6.5145 6.7619 6.7619 6.8584 6.8584 6.9869 6.9869 7.0106 7.0106 7.1409 7.1409 7.1931 7.1931 7.2358 7.2358 7.5163 7.5163 7.6687 7.6687 8.0474 8.0474 8.2237 8.2237 8.2529 8.2529 8.3506 8.3506 8.6646 8.6646 9.0128 9.0128 9.0256 9.0256 9.1283 9.1283 9.2687 9.2687 9.5209 9.5209 9.6106 9.6106 10.2772 10.2772 10.3499 10.3499 10.4223 10.4223 10.6150 10.6150 11.0703 11.0703 11.2276 11.2276 11.4171 11.4171 11.4394 11.4394 11.8002 11.8002 11.8857 11.8857 11.8928 11.8928 k = 0.3974 0.4663-0.0000 ( 14764 PWs) bands (ev): -2.2049 -2.2049 -0.7387 -0.7387 -0.4955 -0.4955 -0.0490 -0.0490 0.3770 0.3770 0.6807 0.6807 0.7831 0.7831 0.9125 0.9125 4.3418 4.3418 4.9861 4.9861 5.1981 5.1981 5.4356 5.4356 5.6114 5.6114 5.6589 5.6589 5.9562 5.9562 6.2321 6.2321 6.5262 6.5262 6.7713 6.7713 6.8624 6.8624 6.9961 6.9961 7.0205 7.0205 7.1277 7.1277 7.1812 7.1812 7.2455 7.2455 7.5099 7.5099 7.6977 7.6977 8.0223 8.0223 8.1738 8.1738 8.2663 8.2663 8.3644 8.3644 8.6196 8.6196 9.0126 9.0126 9.0432 9.0432 9.1300 9.1300 9.2708 9.2708 9.5836 9.5836 9.6522 9.6522 10.2249 10.2249 10.2878 10.2878 10.4370 10.4370 10.6079 10.6079 11.0656 11.0656 11.2512 11.2512 11.3467 11.3467 11.5048 11.5048 11.8023 11.8023 11.8677 11.8678 11.8786 11.8786 k = 0.3846 0.4885-0.0000 ( 14774 PWs) bands (ev): -2.2024 -2.2024 -0.7225 -0.7225 -0.5286 -0.5286 -0.0406 -0.0406 0.3770 0.3770 0.6825 0.6825 0.7968 0.7968 0.9024 0.9024 4.3410 4.3410 4.9918 4.9918 5.1731 5.1731 5.4493 5.4493 5.6020 5.6020 5.6839 5.6839 5.9432 5.9432 6.2356 6.2356 6.5350 6.5350 6.7791 6.7791 6.8726 6.8726 7.0061 7.0061 7.0301 7.0301 7.1145 7.1145 7.1687 7.1687 7.2489 7.2489 7.5060 7.5060 7.7336 7.7336 7.9944 7.9944 8.1243 8.1243 8.2812 8.2812 8.3789 8.3789 8.5755 8.5755 9.0127 9.0127 9.0571 9.0571 9.1372 9.1372 9.2690 9.2690 9.6483 9.6483 9.6971 9.6971 10.1645 10.1645 10.2180 10.2180 10.4654 10.4654 10.6030 10.6030 11.0600 11.0600 11.2540 11.2540 11.3005 11.3005 11.5667 11.5667 11.8070 11.8070 11.8478 11.8478 11.8702 11.8702 k = 0.3718 0.5107-0.0000 ( 14790 PWs) bands (ev): -2.2002 -2.2002 -0.7046 -0.7046 -0.5602 -0.5602 -0.0344 -0.0344 0.3770 0.3770 0.6838 0.6838 0.8111 0.8111 0.8915 0.8915 4.3398 4.3398 5.0021 5.0021 5.1468 5.1468 5.4649 5.4649 5.5847 5.5847 5.7158 5.7158 5.9274 5.9274 6.2385 6.2385 6.5411 6.5411 6.7853 6.7853 6.8890 6.8890 7.0138 7.0138 7.0374 7.0374 7.1050 7.1050 7.1562 7.1562 7.2450 7.2450 7.5075 7.5075 7.7736 7.7736 7.9655 7.9655 8.0766 8.0766 8.2971 8.2971 8.3937 8.3937 8.5332 8.5332 9.0129 9.0129 9.0655 9.0655 9.1508 9.1508 9.2631 9.2631 9.7146 9.7146 9.7447 9.7447 10.1023 10.1023 10.1471 10.1471 10.4929 10.4929 10.6014 10.6014 11.0534 11.0534 11.2083 11.2083 11.3101 11.3101 11.6191 11.6191 11.8154 11.8154 11.8347 11.8347 11.8639 11.8640 k = 0.3590 0.5329-0.0000 ( 14796 PWs) bands (ev): -2.1984 -2.1984 -0.6851 -0.6851 -0.5898 -0.5898 -0.0303 -0.0303 0.3769 0.3769 0.6846 0.6846 0.8257 0.8257 0.8797 0.8797 4.3384 4.3384 5.0173 5.0173 5.1199 5.1199 5.4822 5.4822 5.5650 5.5650 5.7469 5.7469 5.9099 5.9099 6.2407 6.2407 6.5448 6.5448 6.7899 6.7899 6.9105 6.9105 7.0106 7.0106 7.0442 7.0442 7.1045 7.1045 7.1442 7.1442 7.2354 7.2354 7.5134 7.5134 7.8157 7.8157 7.9380 7.9380 8.0322 8.0322 8.3129 8.3129 8.4083 8.4083 8.4943 8.4943 9.0133 9.0133 9.0694 9.0694 9.1689 9.1689 9.2532 9.2532 9.7813 9.7813 9.7946 9.7946 10.0410 10.0410 10.0770 10.0770 10.5130 10.5130 10.6044 10.6044 11.0457 11.0457 11.1664 11.1664 11.3253 11.3253 11.6560 11.6560 11.8163 11.8163 11.8416 11.8419 11.8556 11.8575 k = 0.3462 0.5551-0.0000 ( 14802 PWs) bands (ev): -2.1972 -2.1972 -0.6641 -0.6641 -0.6170 -0.6170 -0.0279 -0.0279 0.3769 0.3769 0.6850 0.6850 0.8401 0.8401 0.8672 0.8672 4.3372 4.3372 5.0368 5.0368 5.0932 5.0932 5.5010 5.5010 5.5444 5.5444 5.7722 5.7722 5.8936 5.8936 6.2420 6.2420 6.5466 6.5466 6.7929 6.7929 6.9353 6.9353 6.9935 6.9935 7.0515 7.0515 7.1122 7.1122 7.1332 7.1332 7.2247 7.2247 7.5200 7.5200 7.8565 7.8565 7.9142 7.9142 7.9947 7.9947 8.3265 8.3265 8.4219 8.4219 8.4617 8.4617 9.0137 9.0137 9.0707 9.0707 9.1879 9.1879 9.2403 9.2403 9.8379 9.8379 9.8525 9.8525 9.9821 9.9821 10.0123 10.0123 10.5234 10.5234 10.6098 10.6098 11.0383 11.0383 11.1409 11.1409 11.3354 11.3354 11.6749 11.6749 11.8157 11.8157 11.8364 11.8364 11.8538 11.8538 k = 0.3333 0.5774-0.0000 ( 14802 PWs) bands (ev): -2.1967 -2.1967 -0.6430 -0.6430 -0.6402 -0.6402 -0.0272 -0.0272 0.3769 0.3769 0.6852 0.6852 0.8525 0.8525 0.8556 0.8556 4.3367 4.3367 5.0536 5.0536 5.0740 5.0740 5.5173 5.5173 5.5274 5.5274 5.7830 5.7830 5.8861 5.8861 6.2424 6.2424 6.5471 6.5471 6.7940 6.7940 6.9550 6.9550 6.9756 6.9756 7.0547 7.0547 7.1225 7.1225 7.1231 7.1231 7.2196 7.2196 7.5231 7.5231 7.8827 7.8827 7.8983 7.8983 7.9769 7.9769 8.3328 8.3328 8.4294 8.4294 8.4461 8.4461 9.0140 9.0140 9.0710 9.0710 9.1991 9.1991 9.2312 9.2312 9.8646 9.8646 9.9058 9.9058 9.9337 9.9337 9.9777 9.9777 10.5261 10.5261 10.6125 10.6125 11.0351 11.0351 11.1327 11.1327 11.3388 11.3388 11.6798 11.6798 11.8194 11.8194 11.8286 11.8286 11.8533 11.8533 k = 0.3333 0.5774-0.0000 ( 14802 PWs) bands (ev): -2.1967 -2.1967 -0.6430 -0.6430 -0.6402 -0.6402 -0.0272 -0.0272 0.3769 0.3769 0.6852 0.6852 0.8525 0.8525 0.8556 0.8556 4.3367 4.3367 5.0536 5.0536 5.0740 5.0740 5.5173 5.5173 5.5274 5.5274 5.7830 5.7830 5.8861 5.8861 6.2424 6.2424 6.5471 6.5471 6.7940 6.7940 6.9550 6.9550 6.9756 6.9756 7.0547 7.0547 7.1225 7.1225 7.1231 7.1231 7.2196 7.2196 7.5231 7.5231 7.8827 7.8827 7.8983 7.8983 7.9769 7.9769 8.3328 8.3328 8.4294 8.4294 8.4461 8.4461 9.0140 9.0140 9.0710 9.0710 9.1991 9.1991 9.2312 9.2312 9.8646 9.8646 9.9058 9.9058 9.9337 9.9337 9.9777 9.9777 10.5261 10.5261 10.6125 10.6125 11.0351 11.0351 11.1327 11.1327 11.3388 11.3388 11.6798 11.6798 11.8194 11.8194 11.8286 11.8286 11.8533 11.8533 k = 0.3200 0.5543-0.0000 ( 14790 PWs) bands (ev): -2.1972 -2.1972 -0.6641 -0.6641 -0.6168 -0.6168 -0.0279 -0.0279 0.3769 0.3769 0.6850 0.6850 0.8397 0.8397 0.8675 0.8675 4.3375 4.3375 5.0341 5.0341 5.0961 5.0961 5.4994 5.4994 5.5461 5.5461 5.7712 5.7712 5.8941 5.8941 6.2420 6.2420 6.5468 6.5468 6.7924 6.7924 6.9324 6.9324 6.9964 6.9964 7.0510 7.0510 7.1108 7.1108 7.1338 7.1338 7.2263 7.2263 7.5190 7.5190 7.8593 7.8593 7.9098 7.9098 7.9976 7.9976 8.3246 8.3246 8.4309 8.4309 8.4549 8.4549 9.0136 9.0136 9.0709 9.0709 9.1855 9.1855 9.2423 9.2423 9.8362 9.8362 9.8504 9.8504 9.9839 9.9839 10.0145 10.0145 10.5238 10.5238 10.6096 10.6096 11.0385 11.0385 11.1412 11.1412 11.3356 11.3356 11.6762 11.6762 11.8124 11.8124 11.8389 11.8390 11.8534 11.8534 k = 0.3067 0.5312-0.0000 ( 14802 PWs) bands (ev): -2.1989 -2.1989 -0.6830 -0.6830 -0.5907 -0.5907 -0.0300 -0.0300 0.3769 0.3769 0.6846 0.6846 0.8250 0.8250 0.8796 0.8796 4.3400 4.3400 5.0078 5.0078 5.1296 5.1296 5.4773 5.4773 5.5706 5.5706 5.7431 5.7431 5.9102 5.9102 6.2406 6.2406 6.5462 6.5462 6.7863 6.7863 6.9016 6.9016 7.0182 7.0182 7.0420 7.0420 7.1010 7.1010 7.1442 7.1442 7.2441 7.2441 7.5072 7.5072 7.8241 7.8241 7.9280 7.9280 8.0409 8.0409 8.3051 8.3051 8.4445 8.4445 8.4676 8.4676 9.0121 9.0121 9.0708 9.0708 9.1591 9.1591 9.2607 9.2607 9.7763 9.7763 9.7927 9.7927 10.0440 10.0440 10.0815 10.0815 10.5173 10.5173 10.6034 10.6034 11.0465 11.0465 11.1667 11.1667 11.3273 11.3273 11.6680 11.6680 11.8021 11.8021 11.8171 11.8171 11.8570 11.8571 k = 0.2933 0.5081-0.0000 ( 14790 PWs) bands (ev): -2.2018 -2.2018 -0.6982 -0.6982 -0.5635 -0.5635 -0.0331 -0.0331 0.3770 0.3770 0.6840 0.6840 0.8099 0.8099 0.8902 0.8902 4.3449 4.3449 4.9821 4.9821 5.1664 5.1664 5.4553 5.4553 5.5962 5.5962 5.7077 5.7077 5.9254 5.9254 6.2385 6.2385 6.5462 6.5462 6.7734 6.7734 6.8732 6.8732 7.0158 7.0158 7.0353 7.0353 7.1061 7.1061 7.1537 7.1537 7.2673 7.2673 7.4910 7.4910 7.7888 7.7888 7.9565 7.9565 8.0902 8.0902 8.2834 8.2834 8.4651 8.4651 8.4807 8.4807 9.0090 9.0090 9.0709 9.0709 9.1279 9.1279 9.2792 9.2792 9.7078 9.7078 9.7427 9.7427 10.1067 10.1067 10.1524 10.1524 10.5072 10.5072 10.5994 10.5994 11.0555 11.0555 11.2070 11.2070 11.3164 11.3164 11.6576 11.6576 11.7501 11.7501 11.7969 11.7969 11.8629 11.8629 k = 0.2800 0.4850-0.0000 ( 14802 PWs) bands (ev): -2.2061 -2.2061 -0.7097 -0.7097 -0.5352 -0.5352 -0.0371 -0.0371 0.3771 0.3771 0.6832 0.6832 0.7944 0.7944 0.8991 0.8991 4.3526 4.3526 4.9578 4.9578 5.2051 5.2051 5.4338 5.4338 5.6197 5.6197 5.6715 5.6715 5.9357 5.9357 6.2356 6.2356 6.5471 6.5471 6.7519 6.7519 6.8504 6.8504 6.9957 6.9957 7.0248 7.0248 7.1255 7.1255 7.1609 7.1609 7.2900 7.2900 7.4769 7.4769 7.7577 7.7577 7.9938 7.9938 8.1409 8.1409 8.2646 8.2646 8.4852 8.4852 8.4973 8.4973 9.0033 9.0033 9.0711 9.0711 9.0938 9.0938 9.2963 9.2963 9.6403 9.6403 9.6956 9.6956 10.1708 10.1708 10.2222 10.2222 10.4959 10.4959 10.6005 10.6005 11.0647 11.0647 11.2549 11.2549 11.3087 11.3087 11.6465 11.6465 11.6835 11.6835 11.7897 11.7897 11.8698 11.8698 k = 0.2667 0.4619-0.0000 ( 14798 PWs) bands (ev): -2.2118 -2.2118 -0.7172 -0.7172 -0.5060 -0.5060 -0.0418 -0.0418 0.3771 0.3771 0.6820 0.6820 0.7788 0.7788 0.9062 0.9062 4.3635 4.3635 4.9351 4.9351 5.2438 5.2438 5.4132 5.4132 5.6124 5.6124 5.6653 5.6653 5.9401 5.9401 6.2321 6.2321 6.5487 6.5487 6.7227 6.7227 6.8338 6.8338 6.9708 6.9708 7.0104 7.0104 7.1427 7.1427 7.1650 7.1650 7.3073 7.3073 7.4728 7.4728 7.7346 7.7346 8.0373 8.0373 8.1910 8.1910 8.2509 8.2509 8.4986 8.4986 8.5219 8.5219 8.9943 8.9943 9.0561 9.0561 9.0732 9.0732 9.3120 9.3120 9.5754 9.5754 9.6512 9.6512 10.2353 10.2353 10.2886 10.2886 10.4876 10.4876 10.6073 10.6073 11.0744 11.0744 11.2755 11.2755 11.3362 11.3362 11.6156 11.6156 11.6379 11.6379 11.7828 11.7828 11.8783 11.8783 k = 0.2533 0.4388-0.0000 ( 14792 PWs) bands (ev): -2.2187 -2.2187 -0.7210 -0.7210 -0.4761 -0.4761 -0.0469 -0.0469 0.3773 0.3773 0.6806 0.6806 0.7631 0.7631 0.9115 0.9115 4.3779 4.3779 4.9143 4.9143 5.2803 5.2803 5.3941 5.3941 5.5725 5.5725 5.6914 5.6914 5.9395 5.9395 6.2281 6.2281 6.5500 6.5500 6.6889 6.6889 6.8219 6.8219 6.9440 6.9440 6.9952 6.9952 7.1470 7.1470 7.1655 7.1655 7.3153 7.3153 7.4848 7.4848 7.7236 7.7236 8.0849 8.0849 8.2382 8.2382 8.2450 8.2450 8.5095 8.5095 8.5500 8.5500 8.9809 8.9809 9.0194 9.0194 9.0737 9.0737 9.3261 9.3261 9.5141 9.5141 9.6093 9.6093 10.2987 10.2987 10.3492 10.3492 10.4870 10.4870 10.6191 10.6191 11.0851 11.0851 11.2674 11.2674 11.3984 11.3984 11.5525 11.5525 11.6290 11.6290 11.7754 11.7754 11.8881 11.8881 k = 0.2400 0.4157-0.0000 ( 14768 PWs) bands (ev): -2.2270 -2.2270 -0.7210 -0.7210 -0.4456 -0.4456 -0.0524 -0.0524 0.3774 0.3774 0.6788 0.6788 0.7473 0.7473 0.9150 0.9150 4.3960 4.3960 4.8955 4.8955 5.3103 5.3103 5.3783 5.3783 5.5286 5.5286 5.7219 5.7219 5.9367 5.9367 6.2238 6.2238 6.5488 6.5488 6.6534 6.6534 6.8133 6.8133 6.9167 6.9167 6.9798 6.9798 7.1355 7.1355 7.1619 7.1619 7.3114 7.3114 7.5141 7.5141 7.7281 7.7281 8.1347 8.1347 8.2425 8.2425 8.2867 8.2867 8.5195 8.5195 8.5794 8.5794 8.9620 8.9620 8.9827 8.9827 9.0749 9.0749 9.3385 9.3385 9.4572 9.4572 9.5695 9.5695 10.3571 10.3571 10.4028 10.4028 10.4986 10.4986 10.6357 10.6357 11.0970 11.0970 11.2571 11.2571 11.4661 11.4661 11.4954 11.4954 11.6233 11.6233 11.7667 11.7667 11.8991 11.8991 k = 0.2267 0.3926-0.0000 ( 14762 PWs) bands (ev): -2.2364 -2.2364 -0.7175 -0.7175 -0.4148 -0.4148 -0.0579 -0.0579 0.3775 0.3775 0.6765 0.6765 0.7316 0.7316 0.9166 0.9166 4.4179 4.4179 4.8788 4.8788 5.3244 5.3244 5.3727 5.3727 5.4844 5.4844 5.7532 5.7532 5.9356 5.9356 6.2190 6.2190 6.5423 6.5423 6.6182 6.6182 6.8069 6.8069 6.8904 6.8904 6.9644 6.9644 7.1123 7.1123 7.1540 7.1540 7.2941 7.2941 7.5578 7.5578 7.7487 7.7487 8.1852 8.1852 8.2495 8.2495 8.3304 8.3304 8.5293 8.5293 8.6094 8.6094 8.9364 8.9364 8.9480 8.9480 9.0761 9.0761 9.3482 9.3482 9.4067 9.4067 9.5315 9.5315 10.4014 10.4014 10.4560 10.4560 10.5231 10.5231 10.6569 10.6569 11.1103 11.1103 11.2479 11.2479 11.4431 11.4431 11.5388 11.5388 11.6207 11.6207 11.7556 11.7556 11.9110 11.9110 k = 0.2133 0.3695-0.0000 ( 14762 PWs) bands (ev): -2.2468 -2.2468 -0.7108 -0.7108 -0.3838 -0.3838 -0.0633 -0.0633 0.3777 0.3777 0.6737 0.6737 0.7161 0.7161 0.9167 0.9167 4.4437 4.4437 4.8642 4.8642 5.3170 5.3170 5.3793 5.3793 5.4411 5.4411 5.7841 5.7841 5.9409 5.9409 6.2138 6.2138 6.5283 6.5283 6.5854 6.5854 6.7985 6.7985 6.8690 6.8690 6.9493 6.9493 7.0828 7.0828 7.1422 7.1422 7.2644 7.2644 7.6119 7.6119 7.7826 7.7826 8.2339 8.2339 8.2648 8.2648 8.3710 8.3710 8.5390 8.5390 8.6398 8.6398 8.9040 8.9040 8.9163 8.9163 9.0773 9.0773 9.3441 9.3441 9.3743 9.3743 9.4948 9.4948 10.4298 10.4298 10.5149 10.5149 10.5528 10.5528 10.6828 10.6828 11.1249 11.1249 11.2406 11.2406 11.4047 11.4047 11.6066 11.6066 11.6233 11.6233 11.7420 11.7420 11.9236 11.9236 k = 0.2000 0.3464-0.0000 ( 14776 PWs) bands (ev): -2.2581 -2.2581 -0.7012 -0.7012 -0.3528 -0.3528 -0.0684 -0.0684 0.3779 0.3779 0.6702 0.6702 0.7008 0.7008 0.9153 0.9153 4.4732 4.4732 4.8517 4.8517 5.3008 5.3008 5.3830 5.3830 5.4000 5.4000 5.8140 5.8140 5.9567 5.9567 6.2083 6.2083 6.5060 6.5060 6.5557 6.5557 6.7804 6.7804 6.8586 6.8586 6.9344 6.9344 7.0513 7.0513 7.1270 7.1270 7.2257 7.2257 7.6727 7.6727 7.8261 7.8261 8.2723 8.2723 8.2955 8.2955 8.4084 8.4084 8.5486 8.5486 8.6701 8.6701 8.8672 8.8672 8.8867 8.8867 9.0784 9.0784 9.3100 9.3100 9.3762 9.3762 9.4591 9.4591 10.4499 10.4499 10.5758 10.5758 10.5805 10.5805 10.7135 10.7135 11.1408 11.1408 11.2357 11.2357 11.3808 11.3808 11.6248 11.6248 11.6737 11.6737 11.7285 11.7285 11.9364 11.9365 k = 0.1867 0.3233-0.0000 ( 14778 PWs) bands (ev): -2.2699 -2.2699 -0.6891 -0.6891 -0.3221 -0.3221 -0.0730 -0.0730 0.3781 0.3781 0.6658 0.6658 0.6859 0.6859 0.9127 0.9127 4.5064 4.5064 4.8413 4.8413 5.2810 5.2810 5.3619 5.3619 5.3771 5.3771 5.8432 5.8432 5.9842 5.9842 6.2022 6.2022 6.4776 6.4776 6.5281 6.5281 6.7512 6.7512 6.8584 6.8584 6.9200 6.9200 7.0202 7.0202 7.1091 7.1091 7.1816 7.1816 7.7376 7.7376 7.8757 7.8757 8.3010 8.3010 8.3386 8.3386 8.4433 8.4433 8.5581 8.5581 8.7001 8.7001 8.8259 8.8259 8.8614 8.8614 9.0791 9.0791 9.2740 9.2740 9.3838 9.3838 9.4240 9.4240 10.4618 10.4618 10.6056 10.6056 10.6349 10.6349 10.7499 10.7499 11.1579 11.1579 11.2334 11.2334 11.3736 11.3736 11.6332 11.6332 11.6933 11.6933 11.7529 11.7529 11.9489 11.9490 k = 0.1733 0.3002-0.0000 ( 14754 PWs) bands (ev): -2.2821 -2.2821 -0.6750 -0.6750 -0.2919 -0.2919 -0.0770 -0.0770 0.3783 0.3783 0.6603 0.6603 0.6716 0.6716 0.9092 0.9092 4.5431 4.5431 4.8328 4.8328 5.2581 5.2581 5.3294 5.3294 5.3606 5.3606 5.8725 5.8725 6.0218 6.0218 6.1956 6.1956 6.4468 6.4468 6.5009 6.5009 6.7156 6.7156 6.8597 6.8597 6.9066 6.9066 6.9911 6.9911 7.0890 7.0890 7.1364 7.1364 7.8046 7.8046 7.9287 7.9287 8.3315 8.3315 8.3798 8.3798 8.4773 8.4773 8.5666 8.5666 8.7293 8.7293 8.7815 8.7815 8.8421 8.8421 9.0793 9.0793 9.2410 9.2410 9.3884 9.3884 9.3924 9.3924 10.4601 10.4601 10.6337 10.6337 10.6899 10.6899 10.7934 10.7934 11.1760 11.1760 11.2336 11.2336 11.3833 11.3833 11.6444 11.6444 11.6742 11.6742 11.8096 11.8096 11.9580 11.9591 k = 0.1600 0.2771-0.0000 ( 14738 PWs) bands (ev): -2.2945 -2.2945 -0.6594 -0.6594 -0.2624 -0.2624 -0.0800 -0.0800 0.3785 0.3785 0.6527 0.6527 0.6589 0.6589 0.9049 0.9049 4.5829 4.5829 4.8261 4.8261 5.2316 5.2316 5.3029 5.3029 5.3361 5.3361 5.9023 5.9023 6.0667 6.0667 6.1887 6.1887 6.4156 6.4156 6.4738 6.4738 6.6772 6.6772 6.8532 6.8532 6.8955 6.8955 6.9656 6.9656 7.0663 7.0663 7.0955 7.0955 7.8723 7.8723 7.9832 7.9832 8.3653 8.3653 8.4144 8.4144 8.5125 8.5125 8.5728 8.5728 8.7355 8.7355 8.7589 8.7589 8.8296 8.8296 9.0788 9.0788 9.2106 9.2106 9.3547 9.3547 9.3990 9.3990 10.4411 10.4411 10.6692 10.6692 10.7396 10.7396 10.8446 10.8446 11.1952 11.1952 11.2363 11.2363 11.4078 11.4078 11.6480 11.6480 11.6620 11.6620 11.8637 11.8637 11.9508 11.9520 k = 0.1467 0.2540-0.0000 ( 14728 PWs) bands (ev): -2.3067 -2.3067 -0.6427 -0.6427 -0.2339 -0.2339 -0.0821 -0.0821 0.3787 0.3787 0.6414 0.6414 0.6493 0.6493 0.9003 0.9003 4.6254 4.6254 4.8210 4.8210 5.2028 5.2028 5.2816 5.2816 5.3068 5.3068 5.9321 5.9321 6.1148 6.1148 6.1829 6.1829 6.3852 6.3852 6.4475 6.4475 6.6380 6.6380 6.8325 6.8325 6.8862 6.8862 6.9448 6.9448 7.0391 7.0391 7.0659 7.0659 7.9394 7.9394 8.0373 8.0373 8.4019 8.4019 8.4413 8.4413 8.5492 8.5492 8.5743 8.5743 8.6954 8.6954 8.7849 8.7849 8.8247 8.8247 9.0775 9.0775 9.1823 9.1823 9.3203 9.3203 9.4058 9.4058 10.4071 10.4071 10.7116 10.7116 10.7850 10.7850 10.9020 10.9020 11.2144 11.2144 11.2427 11.2427 11.4436 11.4436 11.6257 11.6257 11.6781 11.6781 11.9110 11.9110 11.9477 11.9482 k = 0.1333 0.2309-0.0000 ( 14736 PWs) bands (ev): -2.3187 -2.3187 -0.6257 -0.6257 -0.2065 -0.2065 -0.0829 -0.0829 0.3789 0.3789 0.6289 0.6289 0.6405 0.6405 0.8955 0.8955 4.6701 4.6701 4.8170 4.8170 5.1738 5.1738 5.2607 5.2607 5.2783 5.2783 5.9606 5.9606 6.1513 6.1513 6.1907 6.1907 6.3563 6.3563 6.4234 6.4234 6.5994 6.5994 6.7979 6.7979 6.8762 6.8762 6.9276 6.9276 7.0121 7.0121 7.0471 7.0471 8.0048 8.0048 8.0895 8.0895 8.4403 8.4403 8.4623 8.4623 8.5562 8.5562 8.5948 8.5948 8.6672 8.6672 8.8064 8.8064 8.8298 8.8298 9.0751 9.0751 9.1554 9.1554 9.2859 9.2859 9.4122 9.4122 10.3625 10.3625 10.7579 10.7579 10.8284 10.8284 10.9633 10.9633 11.2305 11.2305 11.2565 11.2565 11.4869 11.4869 11.6034 11.6034 11.6977 11.6977 11.9381 11.9385 11.9467 11.9468 k = 0.1200 0.2078-0.0000 ( 14734 PWs) bands (ev): -2.3302 -2.3302 -0.6086 -0.6086 -0.1806 -0.1806 -0.0826 -0.0826 0.3791 0.3791 0.6168 0.6168 0.6311 0.6311 0.8908 0.8908 4.7164 4.7164 4.8141 4.8141 5.1462 5.1462 5.2325 5.2325 5.2591 5.2591 5.9863 5.9863 6.1531 6.1531 6.2321 6.2321 6.3308 6.3308 6.4035 6.4035 6.5622 6.5622 6.7532 6.7532 6.8655 6.8655 6.9108 6.9108 6.9896 6.9896 7.0344 7.0344 8.0676 8.0676 8.1383 8.1383 8.4768 8.4768 8.4822 8.4822 8.5287 8.5287 8.6351 8.6351 8.6563 8.6563 8.8191 8.8191 8.8475 8.8475 9.0715 9.0715 9.1297 9.1297 9.2517 9.2517 9.4180 9.4180 10.3116 10.3116 10.8044 10.8044 10.8711 10.8711 11.0261 11.0261 11.2417 11.2417 11.2800 11.2800 11.5343 11.5343 11.5833 11.5833 11.7188 11.7188 11.9346 11.9346 11.9431 11.9431 k = 0.1067 0.1848-0.0000 ( 14734 PWs) bands (ev): -2.3409 -2.3409 -0.5922 -0.5922 -0.1565 -0.1565 -0.0811 -0.0811 0.3794 0.3794 0.6053 0.6053 0.6210 0.6210 0.8863 0.8863 4.7634 4.7634 4.8118 4.8118 5.1212 5.1212 5.2006 5.2006 5.2464 5.2464 6.0069 6.0069 6.1475 6.1475 6.2655 6.2655 6.3204 6.3204 6.3915 6.3915 6.5271 6.5271 6.7031 6.7031 6.8551 6.8551 6.8936 6.8936 6.9703 6.9703 7.0252 7.0252 8.1266 8.1266 8.1822 8.1822 8.4809 8.4809 8.5053 8.5053 8.5200 8.5200 8.6562 8.6562 8.6764 8.6764 8.8294 8.8294 8.8699 8.8699 9.0663 9.0663 9.1050 9.1050 9.2178 9.2178 9.4233 9.4233 10.2577 10.2577 10.8481 10.8481 10.9136 10.9136 11.0889 11.0889 11.2518 11.2518 11.3103 11.3103 11.5637 11.5637 11.5858 11.5858 11.7408 11.7408 11.9219 11.9219 11.9473 11.9473 k = 0.0933 0.1617-0.0000 ( 14718 PWs) bands (ev): -2.3508 -2.3508 -0.5769 -0.5769 -0.1343 -0.1343 -0.0784 -0.0784 0.3795 0.3795 0.5946 0.5946 0.6105 0.6105 0.8823 0.8823 4.8058 4.8058 4.8144 4.8144 5.0992 5.0992 5.1699 5.1699 5.2363 5.2363 6.0195 6.0195 6.1446 6.1446 6.2571 6.2571 6.3377 6.3377 6.4008 6.4008 6.4941 6.4941 6.6524 6.6524 6.8455 6.8455 6.8767 6.8767 6.9524 6.9524 7.0171 7.0171 8.1811 8.1811 8.2203 8.2203 8.4445 8.4445 8.5202 8.5202 8.5583 8.5583 8.6620 8.6620 8.7156 8.7156 8.8410 8.8410 8.8920 8.8920 9.0593 9.0593 9.0814 9.0814 9.1845 9.1845 9.4280 9.4280 10.2035 10.2035 10.8870 10.8870 10.9548 10.9548 11.1502 11.1502 11.2631 11.2631 11.3458 11.3458 11.5503 11.5503 11.6340 11.6340 11.7628 11.7628 11.9076 11.9076 11.9541 11.9541 k = 0.0800 0.1386-0.0000 ( 14718 PWs) bands (ev): -2.3597 -2.3597 -0.5629 -0.5629 -0.1144 -0.1144 -0.0748 -0.0748 0.3797 0.3797 0.5849 0.5849 0.5999 0.5999 0.8789 0.8789 4.8067 4.8067 4.8573 4.8573 5.0806 5.0806 5.1421 5.1421 5.2279 5.2279 6.0223 6.0223 6.1472 6.1472 6.2356 6.2356 6.3421 6.3421 6.4415 6.4415 6.4629 6.4629 6.6051 6.6051 6.8369 6.8369 6.8608 6.8608 6.9350 6.9350 7.0082 7.0082 8.2302 8.2302 8.2519 8.2519 8.4057 8.4057 8.5414 8.5414 8.5946 8.5946 8.6702 8.6702 8.7528 8.7528 8.8539 8.8539 8.9127 8.9127 9.0500 9.0500 9.0592 9.0592 9.1523 9.1523 9.4322 9.4322 10.1511 10.1511 10.9206 10.9206 10.9925 10.9925 11.2084 11.2084 11.2775 11.2775 11.3850 11.3850 11.5396 11.5396 11.6815 11.6815 11.7839 11.7839 11.8905 11.8905 11.9643 11.9643 k = 0.0667 0.1155-0.0000 ( 14712 PWs) bands (ev): -2.3674 -2.3674 -0.5508 -0.5508 -0.0970 -0.0970 -0.0705 -0.0705 0.3799 0.3799 0.5762 0.5762 0.5898 0.5898 0.8759 0.8759 4.8045 4.8045 4.9006 4.9006 5.0650 5.0650 5.1183 5.1183 5.2207 5.2207 6.0167 6.0167 6.1545 6.1545 6.2144 6.2144 6.3399 6.3399 6.4333 6.4333 6.4908 6.4908 6.5666 6.5666 6.8295 6.8295 6.8467 6.8467 6.9172 6.9172 6.9982 6.9982 8.2729 8.2729 8.2774 8.2774 8.3703 8.3703 8.5648 8.5648 8.6276 8.6276 8.6795 8.6795 8.7870 8.7870 8.8682 8.8682 8.9314 8.9314 9.0379 9.0379 9.0388 9.0388 9.1220 9.1220 9.4357 9.4357 10.1024 10.1024 10.9486 10.9486 11.0247 11.0247 11.2567 11.2567 11.3014 11.3014 11.4254 11.4254 11.5326 11.5326 11.7259 11.7259 11.8033 11.8033 11.8687 11.8687 11.9783 11.9783 k = 0.0533 0.0924-0.0000 ( 14718 PWs) bands (ev): -2.3739 -2.3739 -0.5406 -0.5406 -0.0823 -0.0823 -0.0661 -0.0661 0.3800 0.3800 0.5686 0.5686 0.5806 0.5806 0.8736 0.8736 4.8022 4.8022 4.9400 4.9400 5.0521 5.0521 5.0994 5.0994 5.2147 5.2147 6.0064 6.0064 6.1636 6.1636 6.1957 6.1957 6.3380 6.3380 6.4053 6.4053 6.5130 6.5130 6.5647 6.5647 6.8232 6.8232 6.8345 6.8345 6.8978 6.8978 6.9874 6.9874 8.2966 8.2966 8.3085 8.3085 8.3404 8.3404 8.5885 8.5885 8.6564 8.6564 8.6890 8.6890 8.8176 8.8176 8.8841 8.8841 8.9477 8.9477 9.0203 9.0203 9.0232 9.0232 9.0945 9.0945 9.4386 9.4386 10.0592 10.0592 10.9713 10.9713 11.0506 11.0506 11.2835 11.2835 11.3457 11.3457 11.4623 11.4623 11.5309 11.5309 11.7660 11.7660 11.8184 11.8184 11.8411 11.8411 11.9961 11.9961 k = 0.0400 0.0693-0.0000 ( 14718 PWs) bands (ev): -2.3790 -2.3790 -0.5326 -0.5326 -0.0707 -0.0707 -0.0618 -0.0618 0.3801 0.3801 0.5622 0.5622 0.5731 0.5731 0.8718 0.8718 4.8000 4.8000 4.9734 4.9734 5.0417 5.0417 5.0855 5.0855 5.2099 5.2099 5.9948 5.9948 6.1721 6.1721 6.1806 6.1806 6.3371 6.3371 6.3801 6.3801 6.4953 6.4953 6.6097 6.6097 6.8182 6.8182 6.8248 6.8248 6.8756 6.8756 6.9773 6.9773 8.3106 8.3106 8.3139 8.3139 8.3394 8.3394 8.6102 8.6102 8.6798 8.6798 8.6978 8.6978 8.8440 8.8440 8.9013 8.9013 8.9609 8.9609 9.0045 9.0045 9.0056 9.0056 9.0708 9.0708 9.4408 9.4408 10.0232 10.0232 10.9886 10.9886 11.0700 11.0700 11.2991 11.2991 11.3983 11.3983 11.4882 11.4882 11.5388 11.5388 11.7922 11.7922 11.8057 11.8057 11.8379 11.8379 12.0109 12.0137 k = 0.0267 0.0462-0.0000 ( 14721 PWs) bands (ev): -2.3828 -2.3828 -0.5269 -0.5269 -0.0622 -0.0622 -0.0584 -0.0584 0.3802 0.3802 0.5572 0.5572 0.5676 0.5676 0.8705 0.8705 4.7982 4.7982 4.9991 4.9991 5.0338 5.0338 5.0767 5.0767 5.2062 5.2062 5.9847 5.9847 6.1694 6.1694 6.1786 6.1786 6.3369 6.3369 6.3598 6.3598 6.4798 6.4798 6.6566 6.6566 6.8146 6.8146 6.8176 6.8176 6.8505 6.8505 6.9692 6.9692 8.2956 8.2956 8.3215 8.3215 8.3594 8.3594 8.6278 8.6278 8.6972 8.6972 8.7050 8.7050 8.8665 8.8665 8.9186 8.9186 8.9693 8.9693 8.9864 8.9864 8.9937 8.9937 9.0514 9.0514 9.4425 9.4425 9.9961 9.9961 11.0007 11.0007 11.0834 11.0834 11.3102 11.3102 11.4474 11.4474 11.4991 11.4991 11.5587 11.5587 11.7518 11.7518 11.8297 11.8297 11.8479 11.8479 12.0050 12.0051 k = 0.0133 0.0231-0.0000 ( 14715 PWs) bands (ev): -2.3850 -2.3850 -0.5234 -0.5234 -0.0571 -0.0571 -0.0560 -0.0560 0.3802 0.3802 0.5539 0.5539 0.5643 0.5643 0.8698 0.8698 4.7969 4.7969 5.0150 5.0150 5.0289 5.0289 5.0721 5.0721 5.2038 5.2038 5.9778 5.9778 6.1626 6.1626 6.1826 6.1826 6.3371 6.3371 6.3466 6.3466 6.4707 6.4707 6.6960 6.6960 6.8123 6.8123 6.8133 6.8133 6.8250 6.8250 6.9641 6.9641 8.2845 8.2845 8.3275 8.3275 8.3718 8.3718 8.6393 8.6393 8.7078 8.7078 8.7098 8.7098 8.8842 8.8842 8.9326 8.9326 8.9635 8.9635 8.9789 8.9789 8.9878 8.9878 9.0375 9.0375 9.4434 9.4434 9.9792 9.9792 11.0079 11.0079 11.0912 11.0912 11.3173 11.3173 11.4820 11.4820 11.5050 11.5050 11.5831 11.5831 11.7081 11.7081 11.8471 11.8471 11.8552 11.8552 12.0006 12.0008 k = 0.0000 0.0000 0.0000 ( 14701 PWs) bands (ev): -2.3858 -2.3858 -0.5223 -0.5223 -0.0556 -0.0556 -0.0550 -0.0550 0.3803 0.3803 0.5528 0.5528 0.5632 0.5632 0.8695 0.8695 4.7965 4.7965 5.0202 5.0202 5.0274 5.0274 5.0708 5.0708 5.2029 5.2029 5.9754 5.9754 6.1603 6.1603 6.1840 6.1840 6.3371 6.3371 6.3421 6.3421 6.4677 6.4677 6.7141 6.7141 6.8110 6.8110 6.8120 6.8120 6.8121 6.8121 6.9624 6.9624 8.2808 8.2808 8.3295 8.3295 8.3760 8.3760 8.6432 8.6432 8.7113 8.7113 8.7116 8.7116 8.8922 8.8922 8.9383 8.9383 8.9560 8.9560 8.9784 8.9784 8.9870 8.9870 9.0320 9.0320 9.4438 9.4438 9.9734 9.9734 11.0102 11.0102 11.0938 11.0938 11.3198 11.3198 11.4914 11.4914 11.5105 11.5105 11.5983 11.5983 11.6848 11.6848 11.8525 11.8525 11.8587 11.8587 11.9987 11.9990 k = 0.0000 0.0000 0.0000 ( 14701 PWs) bands (ev): -2.3858 -2.3858 -0.5223 -0.5223 -0.0556 -0.0556 -0.0550 -0.0550 0.3803 0.3803 0.5528 0.5528 0.5632 0.5632 0.8695 0.8695 4.7965 4.7965 5.0202 5.0202 5.0274 5.0274 5.0708 5.0708 5.2029 5.2029 5.9754 5.9754 6.1603 6.1603 6.1840 6.1840 6.3371 6.3371 6.3421 6.3421 6.4677 6.4677 6.7141 6.7141 6.8110 6.8110 6.8120 6.8120 6.8121 6.8121 6.9624 6.9624 8.2808 8.2808 8.3295 8.3295 8.3760 8.3760 8.6432 8.6432 8.7113 8.7113 8.7116 8.7116 8.8922 8.8922 8.9383 8.9383 8.9560 8.9560 8.9784 8.9784 8.9870 8.9870 9.0320 9.0320 9.4438 9.4438 9.9734 9.9734 11.0102 11.0102 11.0938 11.0938 11.3198 11.3198 11.4914 11.4914 11.5105 11.5105 11.5983 11.5983 11.6848 11.6848 11.8525 11.8525 11.8587 11.8587 11.9987 11.9991 k = 0.0000 0.0000 0.0269 ( 14719 PWs) bands (ev): -2.3843 -2.3843 -0.5211 -0.5211 -0.0547 -0.0547 -0.0541 -0.0541 0.3735 0.3735 0.5530 0.5530 0.5635 0.5635 0.8712 0.8712 4.7982 4.7982 5.0213 5.0213 5.0225 5.0225 5.0653 5.0653 5.2088 5.2088 5.9748 5.9748 6.1607 6.1607 6.1905 6.1905 6.3327 6.3327 6.3406 6.3406 6.4642 6.4642 6.7158 6.7158 6.8111 6.8111 6.8135 6.8135 6.8197 6.8197 6.9645 6.9645 8.2205 8.2205 8.3303 8.3303 8.4359 8.4359 8.6452 8.6452 8.7095 8.7095 8.7098 8.7098 8.8882 8.8882 8.9396 8.9396 8.9572 8.9572 8.9820 8.9820 8.9835 8.9835 9.0380 9.0380 9.4458 9.4458 9.9603 9.9603 11.0087 11.0087 11.0927 11.0927 11.3195 11.3195 11.4984 11.4984 11.5106 11.5106 11.5967 11.5967 11.6844 11.6844 11.8510 11.8510 11.8576 11.8576 11.9804 11.9805 k = 0.0000 0.0000 0.0538 ( 14713 PWs) bands (ev): -2.3800 -2.3800 -0.5176 -0.5176 -0.0519 -0.0519 -0.0513 -0.0513 0.3536 0.3536 0.5537 0.5537 0.5642 0.5642 0.8757 0.8757 4.8034 4.8034 5.0080 5.0080 5.0250 5.0250 5.0495 5.0495 5.2263 5.2263 5.9720 5.9720 6.1619 6.1619 6.2095 6.2095 6.3062 6.3062 6.3510 6.3510 6.4546 6.4546 6.7208 6.7208 6.8082 6.8082 6.8198 6.8198 6.8409 6.8409 6.9713 6.9713 8.1288 8.1288 8.3327 8.3327 8.5257 8.5257 8.6513 8.6513 8.7043 8.7043 8.7048 8.7048 8.8784 8.8784 8.9434 8.9434 8.9609 8.9609 8.9714 8.9714 8.9966 8.9966 9.0517 9.0517 9.4519 9.4519 9.9223 9.9223 11.0042 11.0042 11.0893 11.0893 11.3184 11.3184 11.5087 11.5087 11.5209 11.5209 11.5920 11.5920 11.6831 11.6831 11.8463 11.8463 11.8544 11.8544 11.9348 11.9349 k = 0.0000 0.0000 0.0807 ( 14725 PWs) bands (ev): -2.3728 -2.3728 -0.5117 -0.5117 -0.0474 -0.0474 -0.0467 -0.0467 0.3221 0.3221 0.5549 0.5549 0.5653 0.5653 0.8818 0.8818 4.8121 4.8121 4.9851 4.9851 5.0245 5.0245 5.0316 5.0316 5.2550 5.2550 5.9651 5.9651 6.1638 6.1638 6.2398 6.2398 6.2663 6.2663 6.3686 6.3686 6.4418 6.4418 6.7292 6.7292 6.8034 6.8034 6.8271 6.8271 6.8722 6.8722 6.9835 6.9835 8.0339 8.0339 8.3366 8.3366 8.6122 8.6122 8.6662 8.6662 8.6959 8.6959 8.6967 8.6967 8.8661 8.8661 8.9495 8.9495 8.9594 8.9594 8.9670 8.9670 9.0144 9.0144 9.0686 9.0686 9.4620 9.4620 9.8627 9.8627 10.9970 10.9970 11.0837 11.0837 11.3166 11.3166 11.5088 11.5088 11.5514 11.5514 11.5849 11.5849 11.6811 11.6811 11.8342 11.8342 11.8494 11.8494 11.8798 11.8798 k = 0.0000 0.0000 0.1077 ( 14731 PWs) bands (ev): -2.3628 -2.3628 -0.5035 -0.5035 -0.0410 -0.0410 -0.0403 -0.0403 0.2807 0.2807 0.5564 0.5564 0.5668 0.5668 0.8880 0.8880 4.8242 4.8242 4.9551 4.9551 4.9921 4.9921 5.0414 5.0414 5.2944 5.2944 5.9518 5.9518 6.1656 6.1656 6.2173 6.2173 6.2795 6.2795 6.3906 6.3906 6.4314 6.4314 6.7409 6.7409 6.7968 6.7968 6.8328 6.8328 6.9101 6.9101 7.0019 7.0019 7.9384 7.9384 8.3414 8.3414 8.6545 8.6545 8.6847 8.6847 8.6859 8.6859 8.7271 8.7271 8.8533 8.8533 8.9477 8.9477 8.9579 8.9579 8.9752 8.9752 9.0347 9.0347 9.0871 9.0871 9.4760 9.4760 9.7864 9.7864 10.9874 10.9874 11.0759 11.0759 11.3144 11.3144 11.5085 11.5085 11.5764 11.5764 11.5883 11.5883 11.6788 11.6788 11.7914 11.7914 11.8428 11.8428 11.8476 11.8476 k = 0.0000 0.0000 0.1346 ( 14719 PWs) bands (ev): -2.3499 -2.3499 -0.4930 -0.4930 -0.0328 -0.0328 -0.0321 -0.0321 0.2310 0.2310 0.5583 0.5583 0.5686 0.5686 0.8930 0.8930 4.8397 4.8397 4.9198 4.9198 4.9542 4.9542 5.0547 5.0547 5.3440 5.3440 5.9303 5.9303 6.1517 6.1517 6.1777 6.1777 6.3267 6.3267 6.3995 6.3995 6.4434 6.4434 6.7558 6.7558 6.7887 6.7887 6.8353 6.8353 6.9518 6.9518 7.0260 7.0260 7.8430 7.8430 8.3469 8.3469 8.6673 8.6673 8.6712 8.6712 8.6730 8.6730 8.8167 8.8167 8.8413 8.8413 8.9367 8.9367 8.9684 8.9684 8.9854 8.9854 9.0565 9.0565 9.1064 9.1064 9.4939 9.4939 9.6986 9.6986 10.9757 10.9757 11.0657 11.0657 11.3118 11.3118 11.5085 11.5085 11.5674 11.5674 11.6255 11.6255 11.6772 11.6772 11.7258 11.7258 11.8349 11.8349 11.8349 11.8349 k = 0.0000 0.0000 0.1615 ( 14731 PWs) bands (ev): -2.3342 -2.3342 -0.4802 -0.4802 -0.0229 -0.0229 -0.0221 -0.0221 0.1747 0.1747 0.5603 0.5603 0.5706 0.5706 0.8955 0.8955 4.8586 4.8586 4.8808 4.8808 4.9125 4.9125 5.0718 5.0718 5.4032 5.4032 5.8997 5.8997 6.0934 6.0934 6.1782 6.1782 6.3793 6.3793 6.3924 6.3924 6.4810 6.4810 6.7713 6.7713 6.7819 6.7819 6.8346 6.8346 6.9956 6.9956 7.0548 7.0548 7.7482 7.7482 8.3524 8.3524 8.6560 8.6560 8.6586 8.6586 8.6742 8.6742 8.8303 8.8303 8.9089 8.9089 8.9264 8.9264 8.9808 8.9808 8.9975 8.9975 9.0791 9.0791 9.1261 9.1261 9.5154 9.5154 9.6053 9.6053 10.9622 10.9622 11.0534 11.0534 11.3092 11.3092 11.5089 11.5089 11.5591 11.5591 11.6524 11.6524 11.6579 11.6579 11.6807 11.6807 11.8245 11.8245 11.8261 11.8261 k = 0.0000 0.0000 0.1884 ( 14713 PWs) bands (ev): -2.3156 -2.3156 -0.4651 -0.4651 -0.0113 -0.0113 -0.0105 -0.0105 0.1129 0.1129 0.5625 0.5625 0.5727 0.5727 0.8948 0.8948 4.8394 4.8394 4.8686 4.8686 4.8807 4.8807 5.0929 5.0929 5.4716 5.4716 5.8604 5.8604 6.0273 6.0273 6.1833 6.1833 6.3849 6.3849 6.4355 6.4355 6.5279 6.5279 6.7652 6.7652 6.7985 6.7985 6.8313 6.8313 7.0404 7.0404 7.0869 7.0869 7.6541 7.6541 8.3574 8.3574 8.6395 8.6395 8.6432 8.6432 8.6737 8.6737 8.8214 8.8214 8.9168 8.9168 8.9948 8.9948 9.0001 9.0001 9.0114 9.0114 9.1021 9.1021 9.1461 9.1461 9.5128 9.5128 9.5404 9.5404 10.9474 10.9474 11.0391 11.0391 11.3067 11.3067 11.5095 11.5095 11.5521 11.5521 11.5918 11.5918 11.6583 11.6583 11.6909 11.6909 11.8140 11.8140 11.8167 11.8167 k = 0.0000 0.0000 0.2153 ( 14749 PWs) bands (ev): -2.2943 -2.2943 -0.4477 -0.4477 0.0019 0.0019 0.0028 0.0028 0.0466 0.0466 0.5647 0.5647 0.5748 0.5748 0.8904 0.8904 4.7971 4.7971 4.8239 4.8239 4.9061 4.9061 5.1179 5.1179 5.5487 5.5487 5.8135 5.8135 5.9577 5.9577 6.1898 6.1898 6.3797 6.3797 6.4934 6.4934 6.5796 6.5796 6.7524 6.7524 6.8241 6.8241 6.8264 6.8264 7.0856 7.0856 7.1209 7.1209 7.5612 7.5612 8.3612 8.3612 8.6224 8.6224 8.6273 8.6273 8.6614 8.6614 8.8140 8.8140 8.9079 8.9079 9.0104 9.0104 9.0269 9.0269 9.0898 9.0898 9.1252 9.1252 9.1659 9.1659 9.4286 9.4286 9.5685 9.5685 10.9316 10.9316 11.0233 11.0233 11.3046 11.3046 11.5093 11.5093 11.5292 11.5292 11.5473 11.5473 11.6556 11.6556 11.6824 11.6824 11.8033 11.8033 11.8071 11.8071 k = 0.0000 0.0000 0.2422 ( 14779 PWs) bands (ev): -2.2701 -2.2701 -0.4281 -0.4281 -0.0233 -0.0233 0.0167 0.0167 0.0178 0.0178 0.5668 0.5668 0.5768 0.5768 0.8820 0.8820 4.7548 4.7548 4.7796 4.7796 4.9346 4.9346 5.1471 5.1471 5.6340 5.6340 5.7600 5.7600 5.8855 5.8855 6.1974 6.1974 6.3769 6.3769 6.5514 6.5514 6.6332 6.6332 6.7381 6.7381 6.8215 6.8215 6.8539 6.8539 7.1306 7.1306 7.1561 7.1561 7.4696 7.4696 8.3632 8.3632 8.6051 8.6051 8.6114 8.6114 8.6319 8.6319 8.8068 8.8068 8.8995 8.8995 9.0274 9.0274 9.0438 9.0438 9.1479 9.1479 9.1780 9.1780 9.1853 9.1853 9.3609 9.3609 9.5996 9.5996 10.9154 10.9154 11.0063 11.0063 11.3034 11.3034 11.4712 11.4712 11.5050 11.5050 11.5450 11.5450 11.6387 11.6387 11.6589 11.6589 11.7923 11.7923 11.7973 11.7973 k = 0.0000 0.0000 0.2691 ( 14761 PWs) bands (ev): -2.2432 -2.2432 -0.4064 -0.4064 -0.0960 -0.0960 0.0330 0.0330 0.0342 0.0342 0.5686 0.5686 0.5785 0.5785 0.8695 0.8695 4.7136 4.7136 4.7364 4.7364 4.9662 4.9662 5.1804 5.1804 5.7013 5.7013 5.7266 5.7266 5.8118 5.8118 6.2062 6.2062 6.3765 6.3765 6.6076 6.6076 6.6844 6.6844 6.7227 6.7227 6.8198 6.8198 6.8879 6.8879 7.1750 7.1750 7.1916 7.1916 7.3801 7.3801 8.3630 8.3630 8.5811 8.5811 8.5882 8.5882 8.5957 8.5957 8.7979 8.7979 8.8914 8.8914 9.0456 9.0456 9.0619 9.0619 9.1709 9.1709 9.2043 9.2043 9.2634 9.2634 9.3164 9.3164 9.6332 9.6332 10.8991 10.8991 10.9887 10.9887 11.3032 11.3032 11.4187 11.4187 11.4841 11.4841 11.5455 11.5455 11.5962 11.5962 11.6537 11.6537 11.7810 11.7810 11.7875 11.7875 k = 0.0000 0.0000 0.2961 ( 14737 PWs) bands (ev): -2.2135 -2.2135 -0.3825 -0.3825 -0.1710 -0.1710 0.0508 0.0508 0.0520 0.0520 0.5699 0.5699 0.5797 0.5797 0.8529 0.8529 4.6743 4.6743 4.6954 4.6954 5.0008 5.0008 5.2179 5.2179 5.6385 5.6385 5.7351 5.7351 5.8275 5.8275 6.2165 6.2165 6.3779 6.3779 6.6589 6.6589 6.7074 6.7074 6.7237 6.7237 6.8303 6.8303 6.9262 6.9262 7.2187 7.2187 7.2270 7.2270 7.2933 7.2933 8.3604 8.3604 8.5076 8.5076 8.5723 8.5723 8.5804 8.5804 8.7872 8.7872 8.8834 8.8834 9.0648 9.0648 9.0811 9.0811 9.1935 9.1935 9.2224 9.2224 9.2969 9.2969 9.3465 9.3465 9.6690 9.6690 10.8834 10.8834 10.9711 10.9711 11.3043 11.3043 11.3725 11.3725 11.4248 11.4248 11.5490 11.5490 11.5739 11.5739 11.6516 11.6516 11.7692 11.7692 11.7777 11.7777 k = 0.0000 0.0000 0.3230 ( 14743 PWs) bands (ev): -2.1812 -2.1812 -0.3565 -0.3565 -0.2478 -0.2478 0.0698 0.0698 0.0712 0.0712 0.5706 0.5706 0.5802 0.5802 0.8324 0.8324 4.6375 4.6375 4.6572 4.6572 5.0383 5.0383 5.2596 5.2596 5.5725 5.5725 5.6591 5.6591 5.9325 5.9325 6.2290 6.2290 6.3809 6.3809 6.6821 6.6821 6.7132 6.7132 6.7390 6.7390 6.8642 6.8642 6.9687 6.9687 7.2109 7.2109 7.2613 7.2613 7.2618 7.2618 8.3553 8.3553 8.4144 8.4144 8.5576 8.5576 8.5655 8.5655 8.7752 8.7752 8.8752 8.8752 9.0847 9.0847 9.1012 9.1012 9.2149 9.2149 9.2397 9.2397 9.2999 9.2999 9.4263 9.4263 9.7064 9.7064 10.8687 10.8687 10.9543 10.9543 11.3060 11.3060 11.3342 11.3342 11.3342 11.3342 11.5554 11.5554 11.5716 11.5716 11.6512 11.6512 11.7563 11.7563 11.7678 11.7678 k = 0.0000 0.0000 0.3499 ( 14731 PWs) bands (ev): -2.1461 -2.1461 -0.3285 -0.3285 -0.3259 -0.3259 0.0901 0.0901 0.0916 0.0916 0.5706 0.5706 0.5800 0.5800 0.8081 0.8081 4.6038 4.6038 4.6223 4.6223 5.0785 5.0785 5.3051 5.3051 5.5042 5.5042 5.5828 5.5828 6.0408 6.0408 6.2455 6.2455 6.3853 6.3853 6.6664 6.6664 6.7367 6.7367 6.7470 6.7470 6.9147 6.9147 7.0151 7.0151 7.1360 7.1360 7.2956 7.2956 7.3025 7.3025 8.3070 8.3070 8.3480 8.3480 8.5446 8.5446 8.5507 8.5507 8.7626 8.7626 8.8666 8.8666 9.1053 9.1053 9.1219 9.1219 9.2339 9.2339 9.2559 9.2559 9.3198 9.3198 9.5027 9.5027 9.7450 9.7450 10.8554 10.8554 10.9387 10.9387 11.2282 11.2282 11.2938 11.2938 11.3186 11.3186 11.5648 11.5648 11.5768 11.5768 11.6524 11.6524 11.7411 11.7412 11.7574 11.7574 k = 0.0000 0.0000 0.3768 ( 14743 PWs) bands (ev): -2.1084 -2.1084 -0.4049 -0.4049 -0.2985 -0.2985 0.1115 0.1115 0.1131 0.1131 0.5696 0.5696 0.5788 0.5788 0.7803 0.7803 4.5738 4.5738 4.5912 4.5912 5.1213 5.1213 5.3537 5.3537 5.4345 5.4345 5.5077 5.5077 6.1435 6.1435 6.2742 6.2742 6.3909 6.3909 6.6473 6.6473 6.7272 6.7272 6.7665 6.7665 6.9707 6.9707 7.0646 7.0646 7.0756 7.0756 7.3281 7.3281 7.3422 7.3422 8.1908 8.1908 8.3388 8.3388 8.5336 8.5336 8.5358 8.5358 8.7494 8.7494 8.8573 8.8573 9.1262 9.1262 9.1431 9.1431 9.2503 9.2503 9.2709 9.2709 9.3501 9.3501 9.5754 9.5754 9.7841 9.7841 10.8440 10.8440 10.9251 10.9251 11.1149 11.1149 11.2689 11.2689 11.3250 11.3250 11.5772 11.5772 11.5848 11.5848 11.6556 11.6556 11.7213 11.7213 11.7457 11.7457 k = 0.0000 0.0000 0.4037 ( 14713 PWs) bands (ev): -2.0681 -2.0681 -0.4846 -0.4846 -0.2666 -0.2666 0.1338 0.1338 0.1356 0.1356 0.5675 0.5675 0.5765 0.5765 0.7493 0.7493 4.5479 4.5479 4.5645 4.5645 5.1663 5.1663 5.3638 5.3638 5.3937 5.3937 5.4464 5.4464 6.2133 6.2133 6.3417 6.3417 6.3976 6.3976 6.6272 6.6272 6.7147 6.7147 6.7591 6.7591 7.0277 7.0277 7.0395 7.0395 7.1163 7.1163 7.3589 7.3589 7.3800 7.3800 8.0703 8.0703 8.3280 8.3280 8.5209 8.5209 8.5249 8.5249 8.7354 8.7354 8.8472 8.8472 9.1473 9.1473 9.1644 9.1644 9.2646 9.2646 9.2848 9.2848 9.3842 9.3842 9.6439 9.6439 9.8231 9.8231 10.8343 10.8343 10.9139 10.9139 11.0001 11.0001 11.2485 11.2485 11.3362 11.3362 11.5924 11.5924 11.5937 11.5937 11.6608 11.6608 11.6925 11.6925 11.7304 11.7304 k = 0.0000 0.0000 0.4306 ( 14725 PWs) bands (ev): -2.0252 -2.0252 -0.5645 -0.5645 -0.2329 -0.2329 0.1570 0.1570 0.1590 0.1590 0.5641 0.5641 0.5729 0.5729 0.7152 0.7152 4.5265 4.5265 4.5424 4.5424 5.2116 5.2116 5.2929 5.2929 5.3487 5.3487 5.4772 5.4772 6.2454 6.2454 6.4051 6.4051 6.4520 6.4520 6.6062 6.6062 6.7006 6.7006 6.7205 6.7205 7.0320 7.0320 7.0838 7.0838 7.1687 7.1687 7.3876 7.3876 7.4156 7.4156 7.9492 7.9492 8.3161 8.3161 8.5061 8.5061 8.5188 8.5188 8.7206 8.7206 8.8359 8.8359 9.1682 9.1682 9.1857 9.1857 9.2771 9.2771 9.2974 9.2974 9.4157 9.4157 9.7080 9.7080 9.8614 9.8614 10.8240 10.8240 10.8925 10.8925 10.9056 10.9056 11.2333 11.2333 11.3511 11.3511 11.6021 11.6021 11.6102 11.6102 11.6512 11.6512 11.6677 11.6677 11.7047 11.7047 k = 0.0000 0.0000 0.4575 ( 14725 PWs) bands (ev): -1.9798 -1.9798 -0.6444 -0.6444 -0.1974 -0.1974 0.1810 0.1810 0.1832 0.1832 0.5594 0.5594 0.5679 0.5679 0.6786 0.6786 4.5098 4.5098 4.5254 4.5254 5.2224 5.2224 5.2388 5.2388 5.2999 5.2999 5.5377 5.5377 6.2659 6.2659 6.4134 6.4134 6.5781 6.5781 6.5845 6.5845 6.6605 6.6605 6.6857 6.6857 7.0423 7.0423 7.1381 7.1381 7.2206 7.2206 7.4141 7.4141 7.4487 7.4487 7.8309 7.8309 8.3032 8.3032 8.4921 8.4921 8.5155 8.5155 8.7044 8.7044 8.8234 8.8234 9.1887 9.1887 9.2067 9.2067 9.2878 9.2878 9.3088 9.3088 9.4383 9.4383 9.7673 9.7673 9.8983 9.8983 10.7742 10.7742 10.8375 10.8375 10.9007 10.9007 11.2226 11.2226 11.3696 11.3696 11.5993 11.5993 11.6093 11.6093 11.6295 11.6295 11.6617 11.6617 11.6749 11.6749 k = 0.0000 0.0000 0.4845 ( 14725 PWs) bands (ev): -1.9318 -1.9318 -0.7240 -0.7240 -0.1602 -0.1602 0.2055 0.2055 0.2079 0.2079 0.5532 0.5532 0.5614 0.5614 0.6395 0.6395 4.4983 4.4983 4.5136 4.5136 5.1527 5.1527 5.1884 5.1884 5.3307 5.3307 5.6041 5.6041 6.2839 6.2839 6.4226 6.4226 6.5607 6.5607 6.5912 6.5912 6.6703 6.6703 6.7099 6.7099 7.0572 7.0572 7.1898 7.1898 7.2707 7.2707 7.4379 7.4379 7.4787 7.4787 7.7198 7.7198 8.2896 8.2896 8.4797 8.4797 8.5150 8.5150 8.6869 8.6869 8.8094 8.8094 9.2087 9.2087 9.2270 9.2270 9.2964 9.2964 9.3190 9.3190 9.4448 9.4448 9.8217 9.8217 9.9330 9.9330 10.6946 10.6946 10.8337 10.8337 10.8996 10.8996 11.2152 11.2152 11.3917 11.3917 11.5412 11.5412 11.6039 11.6039 11.6147 11.6147 11.6521 11.6521 11.6810 11.6810 k = 0.0000 0.0000 0.5114 ( 14731 PWs) bands (ev): -1.8815 -1.8815 -0.8032 -0.8032 -0.1214 -0.1214 0.2304 0.2304 0.2330 0.2330 0.5453 0.5453 0.5532 0.5532 0.5985 0.5985 4.4921 4.4921 4.5072 4.5072 5.0844 5.0844 5.1199 5.1199 5.3834 5.3834 5.6748 5.6748 6.3017 6.3017 6.4324 6.4324 6.5097 6.5097 6.5440 6.5440 6.6545 6.6545 6.8438 6.8438 7.0660 7.0660 7.2384 7.2384 7.3175 7.3175 7.4587 7.4587 7.5055 7.5055 7.6226 7.6226 8.2757 8.2757 8.4701 8.4701 8.5175 8.5175 8.6677 8.6677 8.7939 8.7939 9.2277 9.2277 9.2466 9.2466 9.3021 9.3021 9.3279 9.3279 9.4289 9.4289 9.8710 9.8710 9.9650 9.9650 10.6366 10.6366 10.8377 10.8377 10.9026 10.9026 11.2093 11.2093 11.4173 11.4173 11.4804 11.4804 11.5432 11.5432 11.6185 11.6185 11.6696 11.6696 11.6861 11.6861 k = 0.0000 0.0000 0.5383 ( 14731 PWs) bands (ev): -1.8288 -1.8288 -0.8817 -0.8817 -0.0812 -0.0812 0.2555 0.2555 0.2584 0.2584 0.5358 0.5358 0.5434 0.5434 0.5557 0.5557 4.4913 4.4913 4.5065 4.5065 5.0179 5.0179 5.0514 5.0514 5.4405 5.4405 5.7492 5.7492 6.3201 6.3201 6.4335 6.4335 6.4428 6.4428 6.5193 6.5193 6.6386 6.6386 6.9771 6.9771 7.0583 7.0583 7.2837 7.2837 7.3583 7.3583 7.4762 7.4762 7.5285 7.5285 7.5495 7.5495 8.2625 8.2625 8.4645 8.4645 8.5230 8.5230 8.6468 8.6468 8.7769 8.7769 9.2457 9.2457 9.2650 9.2650 9.3010 9.3010 9.3356 9.3356 9.3900 9.3900 9.9149 9.9149 9.9938 9.9938 10.6083 10.6083 10.8464 10.8464 10.9099 10.9099 11.2029 11.2029 11.4188 11.4188 11.4459 11.4459 11.4808 11.4808 11.6213 11.6213 11.6784 11.6784 11.6909 11.6909 k = 0.0000 0.0000 0.5652 ( 14755 PWs) bands (ev): -1.7737 -1.7737 -0.9593 -0.9593 -0.0395 -0.0395 0.2807 0.2807 0.2839 0.2839 0.5115 0.5115 0.5246 0.5246 0.5318 0.5318 4.4960 4.4960 4.5115 4.5115 4.9538 4.9538 4.9849 4.9849 5.5004 5.5004 5.8270 5.8270 6.3397 6.3397 6.3556 6.3556 6.4539 6.4539 6.4952 6.4952 6.6227 6.6227 7.0243 7.0243 7.1066 7.1066 7.3253 7.3253 7.3893 7.3893 7.4901 7.4901 7.5128 7.5128 7.5477 7.5477 8.2518 8.2518 8.4637 8.4637 8.5314 8.5314 8.6241 8.6241 8.7584 8.7584 9.2625 9.2625 9.2712 9.2712 9.2821 9.2821 9.3419 9.3419 9.3503 9.3503 9.9535 9.9535 10.0187 10.0187 10.6104 10.6104 10.8597 10.8597 10.9219 10.9219 11.1936 11.1936 11.3576 11.3576 11.4185 11.4185 11.4769 11.4769 11.6236 11.6236 11.6774 11.6775 11.6896 11.6896 k = 0.0000 0.0000 0.5921 ( 14743 PWs) bands (ev): -1.7164 -1.7164 -1.0359 -1.0359 0.0033 0.0033 0.3058 0.3058 0.3093 0.3093 0.4662 0.4662 0.5117 0.5117 0.5186 0.5186 4.5063 4.5063 4.5222 4.5222 4.8924 4.8924 4.9213 4.9213 5.5625 5.5625 5.9074 5.9074 6.2777 6.2777 6.3612 6.3612 6.4655 6.4655 6.4702 6.4702 6.6069 6.6069 6.9627 6.9627 7.2279 7.2279 7.3630 7.3630 7.4096 7.4096 7.5002 7.5002 7.5137 7.5137 7.5631 7.5631 8.2468 8.2468 8.4685 8.4685 8.5426 8.5426 8.5995 8.5995 8.7387 8.7387 9.1885 9.1885 9.2777 9.2777 9.2977 9.2977 9.3390 9.3390 9.3469 9.3469 9.9867 9.9867 10.0395 10.0395 10.6387 10.6387 10.8777 10.8777 10.9386 10.9386 11.1784 11.1784 11.2979 11.2979 11.3576 11.3576 11.5093 11.5093 11.6259 11.6259 11.6725 11.6725 11.6832 11.6832 k = 0.0000 0.0000 0.6190 ( 14701 PWs) bands (ev): -1.6569 -1.6569 -1.1113 -1.1113 0.0473 0.0473 0.3306 0.3306 0.3343 0.3343 0.4200 0.4200 0.4971 0.4971 0.5036 0.5036 4.5223 4.5223 4.5387 4.5387 4.8341 4.8341 4.8609 4.8609 5.6267 5.6267 5.9896 5.9896 6.2004 6.2004 6.3852 6.3852 6.4436 6.4436 6.4777 6.4777 6.5913 6.5913 6.8821 6.8821 7.3348 7.3348 7.3965 7.3965 7.4272 7.4272 7.5062 7.5062 7.5348 7.5348 7.5753 7.5753 8.2520 8.2520 8.4795 8.4795 8.5563 8.5563 8.5729 8.5729 8.7180 8.7180 9.0788 9.0788 9.2913 9.2913 9.3115 9.3115 9.3372 9.3372 9.3504 9.3504 10.0145 10.0145 10.0559 10.0559 10.6867 10.6867 10.9003 10.9003 10.9602 10.9602 11.1548 11.1548 11.2402 11.2402 11.2987 11.2987 11.5419 11.5419 11.6285 11.6285 11.6675 11.6676 11.6771 11.6772 k = 0.0000 0.0000 0.6459 ( 14742 PWs) bands (ev): -1.5953 -1.5953 -1.1854 -1.1854 0.0923 0.0923 0.3549 0.3549 0.3587 0.3587 0.3735 0.3735 0.4808 0.4808 0.4870 0.4870 4.5437 4.5437 4.5609 4.5609 4.7794 4.7794 4.8042 4.8042 5.6928 5.6928 6.0719 6.0719 6.1239 6.1239 6.4131 6.4131 6.4145 6.4145 6.4904 6.4904 6.5758 6.5758 6.7931 6.7931 7.4189 7.4189 7.4258 7.4258 7.4467 7.4467 7.5080 7.5080 7.5607 7.5607 7.5861 7.5861 8.2727 8.2727 8.4978 8.4978 8.5437 8.5437 8.5723 8.5723 8.6964 8.6964 8.9587 8.9587 9.3031 9.3031 9.3234 9.3234 9.3365 9.3365 9.3522 9.3522 10.0372 10.0372 10.0677 10.0677 10.7478 10.7478 10.9276 10.9276 10.9867 10.9867 11.1208 11.1208 11.1849 11.1849 11.2425 11.2425 11.5732 11.5732 11.6314 11.6314 11.6637 11.6638 11.6714 11.6715 k = 0.0000 0.0000 0.6729 ( 14718 PWs) bands (ev): -1.5316 -1.5316 -1.2580 -1.2580 0.1381 0.1381 0.3259 0.3259 0.3786 0.3786 0.3831 0.3831 0.4630 0.4630 0.4688 0.4688 4.5706 4.5706 4.5886 4.5886 4.7285 4.7285 4.7517 4.7517 5.7608 5.7608 6.0485 6.0485 6.1520 6.1520 6.3810 6.3810 6.4473 6.4473 6.5036 6.5036 6.5607 6.5607 6.7037 6.7037 7.4507 7.4507 7.4665 7.4665 7.4719 7.4719 7.5055 7.5055 7.5844 7.5844 7.5976 7.5976 8.3121 8.3121 8.5109 8.5109 8.5257 8.5257 8.5903 8.5903 8.6745 8.6745 8.8377 8.8377 9.3131 9.3131 9.3333 9.3333 9.3349 9.3349 9.3524 9.3524 10.0547 10.0547 10.0748 10.0748 10.8163 10.8163 10.9596 10.9596 11.0181 11.0181 11.0758 11.0758 11.1324 11.1324 11.1896 11.1896 11.6014 11.6014 11.6345 11.6345 11.6612 11.6614 11.6667 11.6667 k = 0.0000 0.0000 0.6998 ( 14706 PWs) bands (ev): -1.4659 -1.4659 -1.3290 -1.3290 0.1845 0.1845 0.2786 0.2786 0.4014 0.4014 0.4062 0.4062 0.4437 0.4437 0.4492 0.4492 4.6027 4.6027 4.6218 4.6218 4.6820 4.6820 4.7036 4.7036 5.8304 5.8304 5.9744 5.9744 6.2259 6.2259 6.3405 6.3405 6.4912 6.4912 6.5172 6.5172 6.5458 6.5458 6.6203 6.6203 7.4711 7.4711 7.4837 7.4837 7.4938 7.4938 7.4985 7.4985 7.6019 7.6019 7.6079 7.6079 8.3664 8.3664 8.4721 8.4721 8.5682 8.5682 8.6100 8.6100 8.6525 8.6525 8.7257 8.7257 9.3213 9.3213 9.3320 9.3320 9.3411 9.3411 9.3506 9.3506 10.0671 10.0671 10.0771 10.0771 10.8874 10.8874 10.9962 10.9962 11.0205 11.0205 11.0543 11.0543 11.0830 11.0830 11.1403 11.1403 11.6236 11.6236 11.6370 11.6370 11.6604 11.6604 11.6632 11.6632 k = 0.0000 0.0000 0.7267 ( 14712 PWs) bands (ev): -1.3984 -1.3984 -1.3984 -1.3984 0.2314 0.2314 0.2314 0.2314 0.4231 0.4231 0.4231 0.4231 0.4283 0.4283 0.4283 0.4283 4.6399 4.6399 4.6399 4.6399 4.6602 4.6602 4.6602 4.6602 5.9017 5.9017 5.9017 5.9017 6.2894 6.2894 6.2894 6.2894 6.5313 6.5313 6.5313 6.5313 6.5484 6.5484 6.5484 6.5484 7.4871 7.4871 7.4871 7.4871 7.4946 7.4946 7.4946 7.4946 7.6103 7.6103 7.6103 7.6103 8.4236 8.4236 8.4236 8.4236 8.6308 8.6308 8.6308 8.6308 8.6335 8.6335 8.6335 8.6335 9.3275 9.3275 9.3275 9.3275 9.3469 9.3469 9.3469 9.3469 10.0746 10.0746 10.0746 10.0746 10.9568 10.9568 10.9568 10.9568 11.0374 11.0374 11.0374 11.0374 11.0951 11.0951 11.0951 11.0951 11.6354 11.6354 11.6354 11.6355 11.6610 11.6610 11.6610 11.6611 k = 0.0000 0.0000 0.7267 ( 14712 PWs) bands (ev): -1.3984 -1.3984 -1.3984 -1.3984 0.2314 0.2314 0.2314 0.2314 0.4231 0.4231 0.4231 0.4231 0.4283 0.4283 0.4283 0.4283 4.6399 4.6399 4.6399 4.6399 4.6602 4.6602 4.6602 4.6602 5.9017 5.9017 5.9017 5.9017 6.2894 6.2894 6.2894 6.2894 6.5313 6.5313 6.5313 6.5313 6.5484 6.5484 6.5484 6.5484 7.4871 7.4871 7.4871 7.4871 7.4946 7.4946 7.4946 7.4946 7.6103 7.6103 7.6103 7.6103 8.4236 8.4236 8.4236 8.4236 8.6308 8.6308 8.6308 8.6308 8.6335 8.6335 8.6335 8.6335 9.3275 9.3275 9.3275 9.3275 9.3469 9.3469 9.3469 9.3469 10.0746 10.0746 10.0746 10.0746 10.9568 10.9568 10.9568 10.9568 11.0374 11.0374 11.0374 11.0374 11.0951 11.0951 11.0951 11.0951 11.6354 11.6354 11.6355 11.6355 11.6610 11.6610 11.6610 11.6611 k = 0.0227 0.0131 0.7267 ( 14696 PWs) bands (ev): -1.3978 -1.3978 -1.3978 -1.3978 0.2307 0.2307 0.2307 0.2307 0.4228 0.4228 0.4228 0.4228 0.4280 0.4280 0.4280 0.4280 4.6409 4.6409 4.6411 4.6411 4.6616 4.6616 4.6619 4.6619 5.9034 5.9034 5.9034 5.9034 6.2835 6.2835 6.2837 6.2837 6.5162 6.5162 6.5166 6.5166 6.5699 6.5699 6.5702 6.5702 7.4596 7.4596 7.4610 7.4610 7.5046 7.5046 7.5065 7.5065 7.6236 7.6236 7.6240 7.6240 8.4121 8.4121 8.4127 8.4127 8.6050 8.6050 8.6071 8.6071 8.6671 8.6671 8.6686 8.6686 9.3275 9.3275 9.3276 9.3276 9.3469 9.3469 9.3469 9.3469 10.0753 10.0753 10.0753 10.0753 10.9585 10.9585 10.9586 10.9586 11.0357 11.0357 11.0363 11.0363 11.0930 11.0930 11.0936 11.0936 11.5910 11.5910 11.5960 11.5960 11.6509 11.6509 11.6611 11.6611 k = 0.0455 0.0262 0.7267 ( 14686 PWs) bands (ev): -1.3963 -1.3963 -1.3963 -1.3963 0.2286 0.2286 0.2286 0.2286 0.4217 0.4217 0.4217 0.4217 0.4273 0.4273 0.4273 0.4273 4.6418 4.6418 4.6437 4.6437 4.6670 4.6670 4.6689 4.6689 5.9083 5.9083 5.9085 5.9085 6.2664 6.2664 6.2674 6.2674 6.5025 6.5025 6.5043 6.5043 6.6020 6.6020 6.6030 6.6030 7.4176 7.4176 7.4216 7.4216 7.5055 7.5055 7.5118 7.5118 7.6531 7.6531 7.6551 7.6551 8.3806 8.3806 8.3841 8.3841 8.5872 8.5872 8.5952 8.5952 8.7060 8.7060 8.7108 8.7108 9.3275 9.3275 9.3278 9.3278 9.3466 9.3466 9.3470 9.3470 10.0774 10.0774 10.0774 10.0774 10.9629 10.9629 10.9635 10.9635 11.0293 11.0293 11.0338 11.0338 11.0858 11.0858 11.0906 11.0906 11.5325 11.5325 11.5432 11.5432 11.6415 11.6415 11.6617 11.6617 k = 0.0682 0.0394 0.7267 ( 14690 PWs) bands (ev): -1.3938 -1.3938 -1.3938 -1.3938 0.2250 0.2250 0.2251 0.2251 0.4193 0.4193 0.4194 0.4194 0.4267 0.4267 0.4267 0.4267 4.6409 4.6409 4.6450 4.6450 4.6788 4.6788 4.6832 4.6832 5.9161 5.9161 5.9169 5.9169 6.2397 6.2397 6.2425 6.2425 6.4968 6.4968 6.5010 6.5010 6.6366 6.6366 6.6384 6.6384 7.3705 7.3705 7.3773 7.3773 7.5009 7.5009 7.5122 7.5122 7.6865 7.6865 7.6901 7.6901 8.3378 8.3378 8.3459 8.3459 8.5767 8.5767 8.5927 8.5927 8.7455 8.7455 8.7541 8.7541 9.3273 9.3273 9.3284 9.3284 9.3461 9.3461 9.3473 9.3473 10.0807 10.0807 10.0807 10.0807 10.9670 10.9670 10.9690 10.9690 11.0176 11.0176 11.0316 11.0316 11.0737 11.0737 11.0883 11.0883 11.4783 11.4783 11.4943 11.4943 11.6326 11.6326 11.6597 11.6597 k = 0.0909 0.0525 0.7267 ( 14706 PWs) bands (ev): -1.3903 -1.3903 -1.3903 -1.3903 0.2201 0.2201 0.2202 0.2202 0.4157 0.4157 0.4158 0.4158 0.4263 0.4263 0.4263 0.4263 4.6385 4.6385 4.6445 4.6445 4.6979 4.6979 4.7044 4.7044 5.9260 5.9260 5.9279 5.9279 6.2062 6.2062 6.2117 6.2117 6.4985 6.4985 6.5057 6.5057 6.6719 6.6719 6.6745 6.6745 7.3213 7.3213 7.3308 7.3308 7.4925 7.4925 7.5095 7.5095 7.7171 7.7171 7.7222 7.7222 8.2920 8.2920 8.3058 8.3058 8.5712 8.5712 8.5959 8.5959 8.7833 8.7833 8.7959 8.7959 9.3269 9.3269 9.3294 9.3294 9.3452 9.3452 9.3482 9.3482 10.0848 10.0848 10.0850 10.0850 10.9658 10.9658 10.9682 10.9682 11.0045 11.0045 11.0286 11.0286 11.0604 11.0604 11.0875 11.0875 11.4329 11.4329 11.4538 11.4538 11.6257 11.6257 11.6565 11.6565 k = 0.1136 0.0656 0.7267 ( 14720 PWs) bands (ev): -1.3859 -1.3859 -1.3859 -1.3859 0.2139 0.2139 0.2139 0.2139 0.4111 0.4111 0.4112 0.4112 0.4261 0.4261 0.4261 0.4261 4.6353 4.6353 4.6428 4.6428 4.7235 4.7235 4.7318 4.7318 5.9368 5.9368 5.9410 5.9410 6.1688 6.1688 6.1783 6.1783 6.5061 6.5061 6.5168 6.5168 6.7069 6.7069 6.7103 6.7103 7.2709 7.2709 7.2834 7.2834 7.4805 7.4805 7.5038 7.5038 7.7408 7.7408 7.7470 7.7470 8.2500 8.2500 8.2700 8.2700 8.5693 8.5693 8.6027 8.6027 8.8184 8.8184 8.8350 8.8350 9.3263 9.3263 9.3311 9.3311 9.3440 9.3440 9.3496 9.3496 10.0893 10.0893 10.0896 10.0896 10.9517 10.9517 10.9553 10.9553 10.9951 10.9951 11.0121 11.0121 11.0610 11.0610 11.0896 11.0896 11.4007 11.4007 11.4251 11.4251 11.6214 11.6214 11.6534 11.6534 k = 0.1364 0.0787 0.7267 ( 14724 PWs) bands (ev): -1.3806 -1.3806 -1.3806 -1.3806 0.2064 0.2064 0.2065 0.2065 0.4056 0.4056 0.4057 0.4057 0.4259 0.4259 0.4259 0.4259 4.6318 4.6318 4.6405 4.6405 4.7551 4.7551 4.7652 4.7652 5.9466 5.9466 5.9548 5.9548 6.1304 6.1304 6.1456 6.1456 6.5183 6.5183 6.5331 6.5331 6.7407 6.7407 6.7450 6.7450 7.2200 7.2200 7.2353 7.2353 7.4640 7.4640 7.4945 7.4945 7.7543 7.7543 7.7617 7.7617 8.2173 8.2173 8.2437 8.2437 8.5705 8.5705 8.6123 8.6123 8.8501 8.8501 8.8707 8.8707 9.3255 9.3255 9.3335 9.3335 9.3426 9.3426 9.3519 9.3519 10.0935 10.0935 10.0941 10.0941 10.9238 10.9238 10.9357 10.9357 10.9808 10.9808 10.9817 10.9817 11.0750 11.0750 11.0974 11.0974 11.3848 11.3848 11.4105 11.4105 11.6197 11.6197 11.6506 11.6506 k = 0.1591 0.0919 0.7267 ( 14744 PWs) bands (ev): -1.3746 -1.3746 -1.3746 -1.3746 0.1977 0.1977 0.1978 0.1978 0.3995 0.3995 0.3997 0.3997 0.4257 0.4257 0.4257 0.4257 4.6283 4.6283 4.6380 4.6380 4.7924 4.7924 4.8042 4.8042 5.9518 5.9518 5.9662 5.9662 6.0950 6.0950 6.1181 6.1181 6.5339 6.5339 6.5534 6.5534 6.7728 6.7728 6.7780 6.7780 7.1686 7.1686 7.1867 7.1867 7.4424 7.4424 7.4807 7.4807 7.7558 7.7558 7.7651 7.7651 8.1975 8.1975 8.2298 8.2298 8.5746 8.5746 8.6245 8.6245 8.8784 8.8784 8.9029 8.9029 9.3246 9.3246 9.3364 9.3364 9.3414 9.3414 9.3551 9.3551 10.0965 10.0965 10.0975 10.0975 10.8911 10.8911 10.9070 10.9070 10.9472 10.9472 10.9557 10.9557 11.0936 11.0936 11.1111 11.1111 11.3855 11.3855 11.4102 11.4102 11.6200 11.6200 11.6479 11.6479 k = 0.1818 0.1050 0.7267 ( 14744 PWs) bands (ev): -1.3679 -1.3679 -1.3679 -1.3679 0.1879 0.1879 0.1881 0.1881 0.3930 0.3930 0.3933 0.3933 0.4255 0.4255 0.4255 0.4255 4.6250 4.6250 4.6354 4.6354 4.8351 4.8351 4.8484 4.8484 5.9471 5.9471 5.9679 5.9679 6.0704 6.0704 6.1015 6.1015 6.5518 6.5518 6.5768 6.5768 6.8026 6.8026 6.8088 6.8088 7.1169 7.1169 7.1373 7.1373 7.4148 7.4148 7.4614 7.4614 7.7470 7.7470 7.7589 7.7589 8.1910 8.1910 8.2280 8.2280 8.5817 8.5817 8.6392 8.6392 8.9035 8.9035 8.9318 8.9318 9.3235 9.3235 9.3375 9.3375 9.3429 9.3429 9.3595 9.3595 10.0972 10.0972 10.0989 10.0989 10.8564 10.8564 10.8692 10.8692 10.9152 10.9152 10.9226 10.9226 11.1133 11.1133 11.1283 11.1283 11.4003 11.4003 11.4223 11.4223 11.6203 11.6203 11.6429 11.6429 k = 0.2045 0.1181 0.7267 ( 14764 PWs) bands (ev): -1.3607 -1.3607 -1.3607 -1.3607 0.1772 0.1772 0.1774 0.1774 0.3863 0.3863 0.3867 0.3867 0.4252 0.4252 0.4253 0.4253 4.6222 4.6222 4.6331 4.6331 4.8828 4.8828 4.8977 4.8977 5.9294 5.9294 5.9509 5.9509 6.0657 6.0657 6.0992 6.0992 6.5704 6.5704 6.6026 6.6026 6.8296 6.8296 6.8369 6.8369 7.0654 7.0654 7.0871 7.0871 7.3814 7.3814 7.4358 7.4358 7.7320 7.7320 7.7469 7.7469 8.1952 8.1952 8.2352 8.2352 8.5923 8.5923 8.6561 8.6561 8.9259 8.9259 8.9577 8.9577 9.3224 9.3224 9.3362 9.3362 9.3481 9.3481 9.3652 9.3652 10.0943 10.0943 10.0971 10.0971 10.8219 10.8219 10.8260 10.8260 10.8864 10.8864 10.8872 10.8872 11.1328 11.1328 11.1469 11.1469 11.4258 11.4258 11.4438 11.4438 11.6172 11.6172 11.6314 11.6314 k = 0.2273 0.1312 0.7267 ( 14752 PWs) bands (ev): -1.3531 -1.3531 -1.3531 -1.3531 0.1658 0.1658 0.1661 0.1661 0.3796 0.3796 0.3801 0.3801 0.4250 0.4250 0.4250 0.4250 4.6200 4.6200 4.6311 4.6311 4.9354 4.9354 4.9517 4.9517 5.9018 5.9018 5.9197 5.9197 6.0767 6.0767 6.1084 6.1084 6.5879 6.5879 6.6294 6.6294 6.8527 6.8527 6.8614 6.8614 7.0155 7.0155 7.0363 7.0363 7.3433 7.3433 7.4043 7.4043 7.7156 7.7156 7.7331 7.7331 8.2060 8.2060 8.2473 8.2473 8.6062 8.6062 8.6749 8.6749 8.9462 8.9462 8.9811 8.9811 9.3213 9.3213 9.3344 9.3344 9.3552 9.3552 9.3724 9.3724 10.0865 10.0865 10.0907 10.0907 10.7824 10.7824 10.7897 10.7897 10.8506 10.8506 10.8628 10.8628 11.1516 11.1516 11.1655 11.1655 11.4583 11.4583 11.4710 11.4710 11.6053 11.6053 11.6079 11.6079 k = 0.2500 0.1443 0.7267 ( 14744 PWs) bands (ev): -1.3452 -1.3452 -1.3452 -1.3452 0.1538 0.1538 0.1542 0.1542 0.3731 0.3731 0.3736 0.3736 0.4246 0.4246 0.4247 0.4247 4.6184 4.6184 4.6295 4.6295 4.9925 4.9925 5.0101 5.0101 5.8694 5.8694 5.8835 5.8835 6.0941 6.0941 6.1241 6.1241 6.6012 6.6012 6.6556 6.6556 6.8692 6.8692 6.8793 6.8793 6.9717 6.9717 6.9878 6.9878 7.3028 7.3028 7.3682 7.3682 7.7010 7.7010 7.7201 7.7201 8.2200 8.2200 8.2611 8.2611 8.6232 8.6232 8.6947 8.6947 8.9650 8.9650 9.0024 9.0024 9.3203 9.3203 9.3327 9.3327 9.3640 9.3640 9.3814 9.3814 10.0723 10.0723 10.0783 10.0783 10.7418 10.7418 10.7615 10.7615 10.8180 10.8180 10.8424 10.8424 11.1691 11.1691 11.1830 11.1830 11.4937 11.4937 11.4965 11.4965 11.5736 11.5736 11.5848 11.5848 k = 0.2727 0.1575 0.7267 ( 14736 PWs) bands (ev): -1.3371 -1.3371 -1.3371 -1.3371 0.1416 0.1416 0.1419 0.1419 0.3668 0.3668 0.3673 0.3673 0.4243 0.4243 0.4244 0.4244 4.6176 4.6176 4.6285 4.6285 5.0536 5.0536 5.0724 5.0724 5.8356 5.8356 5.8467 5.8467 6.1135 6.1135 6.1430 6.1430 6.6053 6.6053 6.6778 6.6778 6.8697 6.8697 6.8804 6.8804 6.9480 6.9480 6.9529 6.9529 7.2624 7.2624 7.3299 7.3299 7.6892 7.6892 7.7089 7.7089 8.2348 8.2348 8.2741 8.2741 8.6427 8.6427 8.7148 8.7148 8.9834 8.9834 9.0222 9.0222 9.3193 9.3193 9.3311 9.3311 9.3745 9.3745 9.3922 9.3922 10.0511 10.0511 10.0591 10.0591 10.7061 10.7061 10.7375 10.7375 10.7912 10.7912 10.8269 10.8269 11.1851 11.1851 11.1987 11.1987 11.4988 11.4988 11.5112 11.5112 11.5519 11.5519 11.5779 11.5779 k = 0.2955 0.1706 0.7267 ( 14740 PWs) bands (ev): -1.3291 -1.3291 -1.3291 -1.3291 0.1293 0.1293 0.1297 0.1297 0.3609 0.3609 0.3614 0.3614 0.4239 0.4239 0.4240 0.4240 4.6176 4.6176 4.6280 4.6280 5.1183 5.1183 5.1383 5.1383 5.8025 5.8025 5.8113 5.8113 6.1328 6.1328 6.1633 6.1633 6.5934 6.5934 6.6878 6.6878 6.8464 6.8464 6.8633 6.8633 6.9465 6.9465 6.9517 6.9517 7.2245 7.2245 7.2917 7.2917 7.6803 7.6803 7.6997 7.6997 8.2490 8.2490 8.2855 8.2855 8.6638 8.6638 8.7340 8.7340 9.0019 9.0019 9.0410 9.0410 9.3184 9.3184 9.3296 9.3296 9.3871 9.3871 9.4051 9.4051 10.0226 10.0226 10.0327 10.0327 10.6761 10.6761 10.7159 10.7159 10.7736 10.7736 10.8174 10.8174 11.1989 11.1989 11.2115 11.2115 11.4657 11.4657 11.4735 11.4735 11.5825 11.5825 11.5993 11.5993 k = 0.3182 0.1837 0.7267 ( 14728 PWs) bands (ev): -1.3213 -1.3213 -1.3213 -1.3213 0.1173 0.1173 0.1177 0.1177 0.3554 0.3554 0.3560 0.3560 0.4235 0.4235 0.4236 0.4236 4.6182 4.6182 4.6281 4.6281 5.1862 5.1862 5.2070 5.2070 5.7715 5.7715 5.7784 5.7784 6.1507 6.1507 6.1838 6.1838 6.5605 6.5605 6.6699 6.6699 6.8284 6.8284 6.8504 6.8504 6.9548 6.9548 6.9647 6.9647 7.1908 7.1908 7.2556 7.2556 7.6739 7.6739 7.6924 7.6924 8.2619 8.2619 8.2946 8.2946 8.6851 8.6851 8.7512 8.7512 9.0211 9.0211 9.0590 9.0590 9.3176 9.3176 9.3282 9.3282 9.4019 9.4019 9.4203 9.4203 9.9875 9.9875 9.9997 9.9997 10.6516 10.6516 10.6948 10.6948 10.7677 10.7677 10.8146 10.8146 11.2095 11.2095 11.2199 11.2199 11.4204 11.4204 11.4277 11.4277 11.6187 11.6187 11.6260 11.6260 k = 0.3409 0.1968 0.7267 ( 14726 PWs) bands (ev): -1.3139 -1.3139 -1.3139 -1.3139 0.1058 0.1058 0.1062 0.1062 0.3505 0.3505 0.3510 0.3510 0.4232 0.4232 0.4233 0.4233 4.6194 4.6194 4.6285 4.6285 5.2564 5.2564 5.2779 5.2779 5.7437 5.7437 5.7491 5.7491 6.1660 6.1660 6.2035 6.2035 6.5083 6.5083 6.6205 6.6205 6.8317 6.8317 6.8485 6.8485 6.9659 6.9659 6.9786 6.9786 7.1625 7.1625 7.2229 7.2229 7.6694 7.6694 7.6866 7.6866 8.2732 8.2732 8.3017 8.3017 8.7057 8.7057 8.7656 8.7656 9.0411 9.0411 9.0764 9.0764 9.3169 9.3169 9.3268 9.3268 9.4192 9.4192 9.4381 9.4381 9.9471 9.9471 9.9610 9.9610 10.6321 10.6321 10.6742 10.6742 10.7731 10.7731 10.8189 10.8189 11.2154 11.2154 11.2218 11.2218 11.3736 11.3736 11.3840 11.3840 11.6444 11.6444 11.6476 11.6476 k = 0.3636 0.2099 0.7267 ( 14730 PWs) bands (ev): -1.3070 -1.3070 -1.3070 -1.3070 0.0952 0.0952 0.0956 0.0956 0.3461 0.3461 0.3466 0.3466 0.4228 0.4228 0.4229 0.4229 4.6210 4.6210 4.6292 4.6292 5.3277 5.3277 5.3495 5.3495 5.7206 5.7206 5.7244 5.7244 6.1769 6.1769 6.2216 6.2216 6.4432 6.4432 6.5554 6.5554 6.8446 6.8446 6.8534 6.8534 6.9771 6.9771 6.9914 6.9914 7.1401 7.1401 7.1945 7.1945 7.6663 7.6663 7.6819 7.6819 8.2829 8.2829 8.3069 8.3069 8.7246 8.7246 8.7769 8.7769 9.0615 9.0615 9.0931 9.0931 9.3162 9.3162 9.3255 9.3255 9.4392 9.4392 9.4585 9.4585 9.9030 9.9030 9.9183 9.9183 10.6168 10.6168 10.6550 10.6550 10.7875 10.7875 10.8300 10.8300 11.2138 11.2138 11.2142 11.2142 11.3304 11.3304 11.3465 11.3465 11.6481 11.6481 11.6577 11.6577 k = 0.3864 0.2231 0.7267 ( 14742 PWs) bands (ev): -1.3008 -1.3008 -1.3008 -1.3008 0.0857 0.0857 0.0860 0.0860 0.3424 0.3424 0.3428 0.3428 0.4225 0.4225 0.4225 0.4225 4.6230 4.6230 4.6301 4.6301 5.3982 5.3982 5.4193 5.4193 5.7044 5.7044 5.7064 5.7064 6.1807 6.1807 6.2358 6.2358 6.3726 6.3726 6.4871 6.4871 6.8582 6.8582 6.8609 6.8609 6.9878 6.9878 7.0025 7.0025 7.1237 7.1237 7.1707 7.1707 7.6645 7.6645 7.6780 7.6780 8.2910 8.2910 8.3106 8.3106 8.7412 8.7412 8.7851 8.7851 9.0816 9.0816 9.1086 9.1086 9.3157 9.3157 9.3241 9.3241 9.4621 9.4621 9.4817 9.4817 9.8567 9.8567 9.8732 9.8732 10.6052 10.6052 10.6382 10.6382 10.8089 10.8089 10.8471 10.8471 11.1950 11.1950 11.1998 11.1998 11.2968 11.2968 11.3181 11.3181 11.6416 11.6416 11.6509 11.6509 k = 0.4091 0.2362 0.7267 ( 14742 PWs) bands (ev): -1.2956 -1.2956 -1.2955 -1.2955 0.0775 0.0775 0.0778 0.0778 0.3393 0.3393 0.3397 0.3397 0.4222 0.4222 0.4222 0.4222 4.6251 4.6251 4.6309 4.6309 5.4636 5.4636 5.4824 5.4824 5.6987 5.6987 5.6995 5.6995 6.1728 6.1728 6.2354 6.2354 6.3107 6.3107 6.4246 6.4246 6.8683 6.8683 6.8691 6.8691 6.9976 6.9976 7.0113 7.0113 7.1130 7.1130 7.1516 7.1516 7.6635 7.6635 7.6748 7.6748 8.2976 8.2976 8.3130 8.3130 8.7553 8.7553 8.7903 8.7903 9.1004 9.1004 9.1223 9.1223 9.3153 9.3153 9.3226 9.3226 9.4880 9.4880 9.5079 9.5079 9.8098 9.8098 9.8270 9.8270 10.5969 10.5969 10.6239 10.6239 10.8357 10.8357 10.8690 10.8690 11.1658 11.1658 11.1711 11.1711 11.2767 11.2767 11.2981 11.2981 11.6328 11.6328 11.6401 11.6401 k = 0.4318 0.2493 0.7267 ( 14756 PWs) bands (ev): -1.2913 -1.2913 -1.2913 -1.2913 0.0709 0.0709 0.0711 0.0711 0.3369 0.3369 0.3372 0.3372 0.4219 0.4219 0.4220 0.4220 4.6271 4.6271 4.6316 4.6316 5.5160 5.5160 5.5296 5.5296 5.7079 5.7079 5.7136 5.7136 6.1475 6.1475 6.1883 6.1883 6.2930 6.2930 6.3764 6.3764 6.8743 6.8743 6.8764 6.8764 7.0061 7.0061 7.0176 7.0176 7.1076 7.1076 7.1370 7.1370 7.6633 7.6633 7.6720 7.6720 8.3030 8.3030 8.3142 8.3142 8.7670 8.7670 8.7930 8.7930 9.1168 9.1168 9.1334 9.1334 9.3151 9.3151 9.3210 9.3210 9.5171 9.5171 9.5368 9.5368 9.7634 9.7634 9.7813 9.7813 10.5916 10.5916 10.6122 10.6122 10.8661 10.8661 10.8943 10.8943 11.1317 11.1317 11.1339 11.1339 11.2659 11.2659 11.2834 11.2834 11.6255 11.6255 11.6308 11.6308 k = 0.4545 0.2624 0.7267 ( 14752 PWs) bands (ev): -1.2881 -1.2881 -1.2881 -1.2881 0.0661 0.0661 0.0663 0.0663 0.3352 0.3352 0.3354 0.3354 0.4218 0.4218 0.4218 0.4218 4.6290 4.6290 4.6320 4.6320 5.5473 5.5473 5.5544 5.5544 5.7398 5.7398 5.7498 5.7498 6.1048 6.1048 6.1192 6.1192 6.2990 6.2990 6.3462 6.3462 6.8786 6.8786 6.8806 6.8806 7.0130 7.0130 7.0211 7.0211 7.1064 7.1064 7.1262 7.1262 7.6637 7.6637 7.6697 7.6697 8.3072 8.3072 8.3145 8.3145 8.7762 8.7762 8.7934 8.7934 9.1300 9.1300 9.1412 9.1412 9.3153 9.3153 9.3194 9.3194 9.5488 9.5488 9.5680 9.5680 9.7192 9.7192 9.7370 9.7370 10.5891 10.5891 10.6030 10.6030 10.8984 10.8984 10.9207 10.9207 11.0956 11.0956 11.0973 11.0973 11.2598 11.2598 11.2718 11.2718 11.6207 11.6207 11.6242 11.6242 k = 0.4773 0.2756 0.7267 ( 14754 PWs) bands (ev): -1.2862 -1.2862 -1.2862 -1.2862 0.0632 0.0632 0.0632 0.0632 0.3341 0.3341 0.3343 0.3343 0.4216 0.4216 0.4217 0.4217 4.6304 4.6304 4.6320 4.6320 5.5603 5.5603 5.5630 5.5630 5.7839 5.7839 5.7928 5.7928 6.0573 6.0573 6.0587 6.0587 6.3080 6.3080 6.3289 6.3289 6.8813 6.8813 6.8825 6.8825 7.0180 7.0180 7.0222 7.0222 7.1084 7.1084 7.1183 7.1183 7.6646 7.6646 7.6676 7.6676 8.3104 8.3104 8.3140 8.3140 8.7834 8.7834 8.7919 8.7919 9.1394 9.1394 9.1450 9.1450 9.3158 9.3158 9.3180 9.3180 9.5821 9.5821 9.5987 9.5987 9.6803 9.6803 9.6962 9.6962 10.5891 10.5891 10.5961 10.5961 10.9290 10.9290 10.9431 10.9431 11.0637 11.0637 11.0673 11.0673 11.2572 11.2572 11.2633 11.2633 11.6184 11.6184 11.6202 11.6202 k = 0.5000 0.2887 0.7267 ( 14732 PWs) bands (ev): -1.2856 -1.2856 -1.2856 -1.2856 0.0622 0.0622 0.0622 0.0622 0.3338 0.3338 0.3338 0.3338 0.4216 0.4216 0.4216 0.4216 4.6314 4.6314 4.6314 4.6314 5.5642 5.5642 5.5642 5.5642 5.8107 5.8107 5.8107 5.8107 6.0328 6.0328 6.0328 6.0328 6.3176 6.3176 6.3176 6.3176 6.8826 6.8826 6.8826 6.8826 7.0210 7.0210 7.0210 7.0210 7.1125 7.1125 7.1125 7.1125 7.6659 7.6659 7.6659 7.6659 8.3126 8.3126 8.3126 8.3126 8.7886 8.7886 8.7886 8.7886 9.1445 9.1445 9.1445 9.1445 9.3167 9.3167 9.3167 9.3167 9.6091 9.6091 9.6091 9.6091 9.6669 9.6669 9.6669 9.6669 10.5915 10.5915 10.5915 10.5915 10.9485 10.9485 10.9485 10.9485 11.0516 11.0516 11.0516 11.0516 11.2584 11.2584 11.2584 11.2584 11.6183 11.6183 11.6183 11.6183 k = 0.5000 0.2887 0.7267 ( 14732 PWs) bands (ev): -1.2856 -1.2856 -1.2856 -1.2856 0.0622 0.0622 0.0622 0.0622 0.3338 0.3338 0.3338 0.3338 0.4216 0.4216 0.4216 0.4216 4.6314 4.6314 4.6314 4.6314 5.5642 5.5642 5.5642 5.5642 5.8107 5.8107 5.8107 5.8107 6.0328 6.0328 6.0328 6.0328 6.3176 6.3176 6.3176 6.3176 6.8826 6.8826 6.8826 6.8826 7.0210 7.0210 7.0210 7.0210 7.1125 7.1125 7.1125 7.1125 7.6659 7.6659 7.6659 7.6659 8.3126 8.3126 8.3126 8.3126 8.7886 8.7886 8.7886 8.7886 9.1445 9.1445 9.1445 9.1445 9.3167 9.3167 9.3167 9.3167 9.6091 9.6091 9.6091 9.6091 9.6669 9.6669 9.6669 9.6669 10.5915 10.5915 10.5915 10.5915 10.9485 10.9485 10.9485 10.9485 11.0516 11.0516 11.0516 11.0516 11.2584 11.2584 11.2584 11.2584 11.6183 11.6183 11.6183 11.6183 k = 0.4872 0.3109 0.7267 ( 14752 PWs) bands (ev): -1.2854 -1.2854 -1.2854 -1.2854 0.0628 0.0628 0.0628 0.0628 0.3309 0.3309 0.3309 0.3309 0.4235 0.4235 0.4235 0.4235 4.6341 4.6341 4.6341 4.6341 5.5552 5.5552 5.5552 5.5552 5.8109 5.8109 5.8109 5.8109 6.0407 6.0407 6.0407 6.0407 6.3190 6.3190 6.3190 6.3190 6.8824 6.8824 6.8824 6.8824 7.0213 7.0213 7.0213 7.0213 7.1128 7.1128 7.1128 7.1128 7.6579 7.6579 7.6579 7.6579 8.3198 8.3198 8.3198 8.3198 8.7882 8.7882 8.7882 8.7882 9.1435 9.1435 9.1435 9.1435 9.3172 9.3172 9.3172 9.3172 9.6064 9.6064 9.6064 9.6064 9.6647 9.6647 9.6647 9.6647 10.5956 10.5956 10.5956 10.5956 10.9511 10.9511 10.9511 10.9511 11.0528 11.0528 11.0528 11.0528 11.2589 11.2589 11.2589 11.2589 11.6156 11.6156 11.6156 11.6156 k = 0.4744 0.3331 0.7267 ( 14744 PWs) bands (ev): -1.2848 -1.2848 -1.2848 -1.2848 0.0645 0.0645 0.0645 0.0645 0.3228 0.3228 0.3228 0.3228 0.4285 0.4285 0.4285 0.4285 4.6419 4.6419 4.6419 4.6419 5.5300 5.5300 5.5300 5.5300 5.8113 5.8113 5.8113 5.8113 6.0627 6.0627 6.0627 6.0627 6.3232 6.3232 6.3232 6.3232 6.8817 6.8817 6.8817 6.8817 7.0220 7.0220 7.0220 7.0220 7.1138 7.1138 7.1138 7.1138 7.6347 7.6347 7.6347 7.6347 8.3401 8.3401 8.3401 8.3401 8.7872 8.7872 8.7872 8.7872 9.1407 9.1407 9.1407 9.1407 9.3187 9.3187 9.3187 9.3187 9.5987 9.5987 9.5987 9.5987 9.6584 9.6584 9.6584 9.6584 10.6075 10.6075 10.6075 10.6075 10.9588 10.9588 10.9588 10.9588 11.0564 11.0564 11.0564 11.0564 11.2605 11.2605 11.2605 11.2605 11.6075 11.6075 11.6075 11.6075 k = 0.4615 0.3553 0.7267 ( 14748 PWs) bands (ev): -1.2840 -1.2840 -1.2840 -1.2840 0.0674 0.0674 0.0674 0.0674 0.3110 0.3110 0.3110 0.3110 0.4353 0.4353 0.4353 0.4353 4.6549 4.6549 4.6549 4.6549 5.4931 5.4931 5.4931 5.4931 5.8118 5.8118 5.8118 5.8118 6.0946 6.0946 6.0946 6.0946 6.3301 6.3301 6.3301 6.3301 6.8809 6.8809 6.8809 6.8809 7.0231 7.0231 7.0231 7.0231 7.1154 7.1154 7.1154 7.1154 7.5994 7.5994 7.5994 7.5994 8.3708 8.3708 8.3708 8.3708 8.7855 8.7855 8.7855 8.7855 9.1361 9.1361 9.1361 9.1361 9.3213 9.3213 9.3213 9.3213 9.5866 9.5866 9.5866 9.5866 9.6484 9.6484 9.6484 9.6484 10.6266 10.6266 10.6266 10.6266 10.9711 10.9711 10.9711 10.9711 11.0621 11.0621 11.0621 11.0621 11.2632 11.2632 11.2632 11.2632 11.5942 11.5942 11.5942 11.5942 k = 0.4487 0.3775 0.7267 ( 14744 PWs) bands (ev): -1.2828 -1.2828 -1.2828 -1.2828 0.0714 0.0714 0.0714 0.0714 0.2967 0.2967 0.2967 0.2967 0.4425 0.4425 0.4425 0.4425 4.6729 4.6729 4.6729 4.6729 5.4485 5.4485 5.4485 5.4485 5.8124 5.8124 5.8124 5.8124 6.1317 6.1317 6.1317 6.1317 6.3394 6.3394 6.3394 6.3394 6.8804 6.8804 6.8804 6.8804 7.0244 7.0244 7.0244 7.0244 7.1176 7.1176 7.1176 7.1176 7.5553 7.5553 7.5553 7.5553 8.4086 8.4086 8.4086 8.4086 8.7832 8.7832 8.7832 8.7832 9.1299 9.1299 9.1299 9.1299 9.3251 9.3251 9.3251 9.3251 9.5709 9.5709 9.5709 9.5709 9.6352 9.6352 9.6352 9.6352 10.6516 10.6516 10.6516 10.6516 10.9873 10.9873 10.9873 10.9873 11.0693 11.0693 11.0693 11.0693 11.2669 11.2669 11.2669 11.2669 11.5759 11.5759 11.5759 11.5759 k = 0.4359 0.3997 0.7267 ( 14726 PWs) bands (ev): -1.2813 -1.2813 -1.2813 -1.2813 0.0766 0.0766 0.0766 0.0766 0.2810 0.2810 0.2810 0.2810 0.4496 0.4496 0.4496 0.4496 4.6955 4.6955 4.6955 4.6955 5.3994 5.3994 5.3994 5.3994 5.8132 5.8132 5.8132 5.8132 6.1702 6.1702 6.1702 6.1702 6.3507 6.3507 6.3507 6.3507 6.8806 6.8806 6.8806 6.8806 7.0256 7.0256 7.0256 7.0256 7.1205 7.1205 7.1205 7.1205 7.5053 7.5053 7.5053 7.5053 8.4505 8.4505 8.4505 8.4505 8.7802 8.7802 8.7802 8.7802 9.1222 9.1222 9.1222 9.1222 9.3300 9.3300 9.3300 9.3300 9.5528 9.5528 9.5528 9.5528 9.6197 9.6197 9.6197 9.6197 10.6811 10.6811 10.6811 10.6811 11.0062 11.0062 11.0062 11.0062 11.0777 11.0777 11.0777 11.0777 11.2718 11.2718 11.2718 11.2718 11.5531 11.5531 11.5531 11.5531 k = 0.4231 0.4219 0.7267 ( 14704 PWs) bands (ev): -1.2797 -1.2797 -1.2797 -1.2797 0.0828 0.0828 0.0828 0.0828 0.2643 0.2643 0.2643 0.2643 0.4562 0.4562 0.4562 0.4562 4.7226 4.7226 4.7226 4.7226 5.3479 5.3479 5.3479 5.3479 5.8145 5.8145 5.8145 5.8145 6.2074 6.2074 6.2074 6.2074 6.3636 6.3636 6.3636 6.3636 6.8822 6.8822 6.8822 6.8822 7.0266 7.0266 7.0266 7.0266 7.1241 7.1241 7.1241 7.1241 7.4523 7.4523 7.4523 7.4523 8.4941 8.4941 8.4941 8.4941 8.7768 8.7768 8.7768 8.7768 9.1133 9.1133 9.1133 9.1133 9.3364 9.3364 9.3364 9.3364 9.5334 9.5334 9.5334 9.5334 9.6023 9.6023 9.6023 9.6023 10.7138 10.7138 10.7138 10.7138 11.0265 11.0265 11.0265 11.0265 11.0869 11.0869 11.0869 11.0869 11.2776 11.2776 11.2776 11.2776 11.5265 11.5265 11.5265 11.5265 k = 0.4103 0.4441 0.7267 ( 14728 PWs) bands (ev): -1.2780 -1.2780 -1.2780 -1.2780 0.0900 0.0900 0.0900 0.0900 0.2471 0.2471 0.2471 0.2471 0.4619 0.4619 0.4619 0.4619 4.7536 4.7536 4.7536 4.7536 5.2954 5.2954 5.2954 5.2954 5.8164 5.8164 5.8164 5.8164 6.2409 6.2409 6.2409 6.2409 6.3775 6.3775 6.3775 6.3775 6.8858 6.8858 6.8858 6.8858 7.0269 7.0269 7.0269 7.0269 7.1282 7.1282 7.1282 7.1282 7.3984 7.3984 7.3984 7.3984 8.5372 8.5372 8.5372 8.5372 8.7729 8.7729 8.7729 8.7729 9.1037 9.1037 9.1037 9.1037 9.3443 9.3443 9.3443 9.3443 9.5137 9.5137 9.5137 9.5137 9.5838 9.5838 9.5838 9.5838 10.7482 10.7482 10.7482 10.7482 11.0460 11.0460 11.0460 11.0460 11.0969 11.0969 11.0969 11.0969 11.2842 11.2842 11.2842 11.2842 11.4974 11.4974 11.4974 11.4974 k = 0.3974 0.4663 0.7267 ( 14718 PWs) bands (ev): -1.2763 -1.2763 -1.2763 -1.2763 0.0983 0.0983 0.0983 0.0983 0.2298 0.2298 0.2298 0.2298 0.4668 0.4668 0.4668 0.4668 4.7883 4.7883 4.7883 4.7883 5.2429 5.2429 5.2429 5.2429 5.8190 5.8190 5.8190 5.8190 6.2693 6.2693 6.2693 6.2693 6.3916 6.3916 6.3916 6.3916 6.8919 6.8919 6.8919 6.8919 7.0265 7.0265 7.0265 7.0265 7.1330 7.1330 7.1330 7.1330 7.3459 7.3459 7.3459 7.3459 8.5780 8.5780 8.5780 8.5780 8.7690 8.7690 8.7690 8.7690 9.0939 9.0939 9.0939 9.0939 9.3539 9.3539 9.3539 9.3539 9.4945 9.4945 9.4945 9.4945 9.5648 9.5648 9.5648 9.5648 10.7826 10.7826 10.7826 10.7826 11.0622 11.0622 11.0622 11.0622 11.1086 11.1086 11.1086 11.1086 11.2912 11.2912 11.2912 11.2912 11.4672 11.4672 11.4672 11.4673 k = 0.3846 0.4885 0.7267 ( 14738 PWs) bands (ev): -1.2746 -1.2746 -1.2746 -1.2746 0.1074 0.1074 0.1074 0.1074 0.2128 0.2128 0.2128 0.2128 0.4707 0.4707 0.4707 0.4707 4.8259 4.8259 4.8259 4.8259 5.1912 5.1912 5.1912 5.1912 5.8224 5.8224 5.8224 5.8224 6.2917 6.2917 6.2917 6.2917 6.4046 6.4046 6.4046 6.4046 6.9005 6.9005 6.9005 6.9005 7.0248 7.0248 7.0248 7.0248 7.1385 7.1385 7.1385 7.1385 7.2969 7.2969 7.2969 7.2969 8.6144 8.6144 8.6144 8.6144 8.7653 8.7653 8.7653 8.7653 9.0846 9.0846 9.0846 9.0846 9.3654 9.3654 9.3654 9.3654 9.4765 9.4765 9.4765 9.4765 9.5458 9.5458 9.5458 9.5458 10.8153 10.8153 10.8153 10.8153 11.0737 11.0737 11.0737 11.0737 11.1223 11.1223 11.1223 11.1223 11.2976 11.2976 11.2976 11.2976 11.4368 11.4368 11.4368 11.4368 k = 0.3718 0.5107 0.7267 ( 14730 PWs) bands (ev): -1.2731 -1.2731 -1.2731 -1.2731 0.1175 0.1175 0.1175 0.1175 0.1962 0.1962 0.1962 0.1962 0.4737 0.4737 0.4737 0.4737 4.8660 4.8660 4.8660 4.8660 5.1408 5.1408 5.1408 5.1408 5.8262 5.8262 5.8262 5.8262 6.3080 6.3080 6.3080 6.3080 6.4153 6.4153 6.4153 6.4153 6.9112 6.9112 6.9112 6.9112 7.0216 7.0216 7.0216 7.0216 7.1447 7.1447 7.1447 7.1447 7.2537 7.2537 7.2537 7.2537 8.6444 8.6444 8.6444 8.6444 8.7625 8.7625 8.7625 8.7625 9.0766 9.0766 9.0766 9.0766 9.3789 9.3789 9.3789 9.3789 9.4602 9.4602 9.4602 9.4602 9.5274 9.5274 9.5274 9.5274 10.8440 10.8440 10.8440 10.8440 11.0820 11.0820 11.0820 11.0820 11.1355 11.1355 11.1355 11.1355 11.3017 11.3017 11.3017 11.3017 11.4090 11.4090 11.4090 11.4090 k = 0.3590 0.5329 0.7267 ( 14734 PWs) bands (ev): -1.2719 -1.2719 -1.2719 -1.2719 0.1284 0.1284 0.1284 0.1284 0.1805 0.1805 0.1805 0.1805 0.4758 0.4758 0.4758 0.4758 4.9077 4.9077 4.9077 4.9077 5.0923 5.0923 5.0923 5.0923 5.8300 5.8300 5.8300 5.8300 6.3187 6.3187 6.3187 6.3187 6.4229 6.4229 6.4229 6.4229 6.9224 6.9224 6.9224 6.9224 7.0172 7.0172 7.0172 7.0172 7.1518 7.1518 7.1518 7.1518 7.2186 7.2186 7.2186 7.2186 8.6659 8.6659 8.6659 8.6659 8.7614 8.7614 8.7614 8.7614 9.0704 9.0704 9.0704 9.0704 9.3941 9.3941 9.3941 9.3941 9.4458 9.4458 9.4458 9.4458 9.5107 9.5107 9.5107 9.5107 10.8659 10.8659 10.8659 10.8659 11.0914 11.0914 11.0914 11.0914 11.1439 11.1439 11.1439 11.1439 11.3006 11.3006 11.3006 11.3006 11.3894 11.3895 11.3895 11.3895 k = 0.3462 0.5551 0.7267 ( 14774 PWs) bands (ev): -1.2712 -1.2712 -1.2712 -1.2712 0.1400 0.1400 0.1400 0.1400 0.1659 0.1659 0.1659 0.1659 0.4770 0.4770 0.4770 0.4770 4.9492 4.9492 4.9492 4.9492 5.0470 5.0470 5.0470 5.0470 5.8331 5.8331 5.8331 5.8331 6.3244 6.3244 6.3244 6.3244 6.4269 6.4269 6.4269 6.4269 6.9316 6.9316 6.9316 6.9316 7.0128 7.0128 7.0128 7.0128 7.1591 7.1591 7.1591 7.1591 7.1939 7.1939 7.1939 7.1939 8.6779 8.6779 8.6779 8.6779 8.7619 8.7619 8.7619 8.7619 9.0668 9.0668 9.0668 9.0668 9.4097 9.4097 9.4097 9.4097 9.4338 9.4338 9.4338 9.4338 9.4971 9.4971 9.4971 9.4971 10.8791 10.8791 10.8791 10.8791 11.1054 11.1054 11.1054 11.1054 11.1421 11.1421 11.1421 11.1421 11.2952 11.2952 11.2952 11.2952 11.3813 11.3813 11.3813 11.3813 k = 0.3333 0.5774 0.7267 ( 14766 PWs) bands (ev): -1.2709 -1.2709 -1.2709 -1.2709 0.1513 0.1513 0.1513 0.1513 0.1536 0.1536 0.1536 0.1536 0.4773 0.4773 0.4773 0.4773 4.9776 4.9776 4.9776 4.9776 5.0175 5.0175 5.0175 5.0175 5.8344 5.8344 5.8344 5.8344 6.3261 6.3261 6.3261 6.3261 6.4280 6.4280 6.4280 6.4280 6.9352 6.9352 6.9352 6.9352 7.0110 7.0110 7.0110 7.0110 7.1632 7.1632 7.1632 7.1632 7.1840 7.1840 7.1840 7.1840 8.6814 8.6814 8.6814 8.6814 8.7627 8.7627 8.7627 8.7627 9.0656 9.0656 9.0656 9.0656 9.4198 9.4198 9.4198 9.4198 9.4265 9.4265 9.4265 9.4265 9.4909 9.4909 9.4909 9.4909 10.8831 10.8831 10.8831 10.8831 11.1241 11.1241 11.1241 11.1241 11.1275 11.1275 11.1275 11.1275 11.2922 11.2922 11.2922 11.2922 11.3802 11.3802 11.3802 11.3802 k = 0.3333 0.5774 0.7267 ( 14766 PWs) bands (ev): -1.2709 -1.2709 -1.2709 -1.2709 0.1513 0.1513 0.1513 0.1513 0.1536 0.1536 0.1536 0.1536 0.4773 0.4773 0.4773 0.4773 4.9776 4.9776 4.9776 4.9776 5.0175 5.0175 5.0175 5.0175 5.8344 5.8344 5.8344 5.8344 6.3261 6.3261 6.3261 6.3261 6.4280 6.4280 6.4280 6.4280 6.9352 6.9352 6.9352 6.9352 7.0110 7.0110 7.0110 7.0110 7.1632 7.1632 7.1632 7.1632 7.1840 7.1840 7.1840 7.1840 8.6814 8.6814 8.6814 8.6814 8.7627 8.7627 8.7627 8.7627 9.0656 9.0656 9.0656 9.0656 9.4198 9.4198 9.4198 9.4198 9.4265 9.4265 9.4265 9.4265 9.4909 9.4909 9.4909 9.4909 10.8831 10.8831 10.8831 10.8831 11.1241 11.1241 11.1241 11.1241 11.1275 11.1275 11.1275 11.1275 11.2922 11.2922 11.2922 11.2922 11.3802 11.3802 11.3802 11.3802 k = 0.3200 0.5543 0.7267 ( 14764 PWs) bands (ev): -1.2712 -1.2712 -1.2712 -1.2712 0.1401 0.1401 0.1401 0.1401 0.1660 0.1660 0.1660 0.1660 0.4770 0.4770 0.4770 0.4770 4.9488 4.9488 4.9488 4.9488 5.0473 5.0473 5.0473 5.0473 5.8325 5.8325 5.8325 5.8325 6.3247 6.3247 6.3247 6.3247 6.4275 6.4275 6.4275 6.4275 6.9316 6.9316 6.9316 6.9316 7.0126 7.0126 7.0126 7.0126 7.1615 7.1615 7.1615 7.1615 7.1918 7.1918 7.1918 7.1918 8.6786 8.6786 8.6786 8.6786 8.7611 8.7611 8.7611 8.7611 9.0666 9.0666 9.0666 9.0666 9.4139 9.4139 9.4139 9.4139 9.4272 9.4272 9.4272 9.4272 9.4998 9.4998 9.4998 9.4998 10.8798 10.8798 10.8798 10.8798 11.0951 11.0951 11.0951 11.0951 11.1528 11.1528 11.1528 11.1528 11.2953 11.2953 11.2953 11.2953 11.3799 11.3799 11.3799 11.3799 k = 0.3067 0.5312 0.7267 ( 14744 PWs) bands (ev): -1.2723 -1.2723 -1.2723 -1.2723 0.1296 0.1296 0.1296 0.1296 0.1800 0.1800 0.1800 0.1800 0.4758 0.4758 0.4758 0.4758 4.9089 4.9089 4.9089 4.9089 5.0894 5.0894 5.0894 5.0894 5.8257 5.8257 5.8257 5.8257 6.3211 6.3211 6.3211 6.3211 6.4276 6.4276 6.4276 6.4276 6.9230 6.9230 6.9230 6.9230 7.0151 7.0151 7.0151 7.0151 7.1632 7.1632 7.1632 7.1632 7.2071 7.2071 7.2071 7.2071 8.6716 8.6716 8.6716 8.6716 8.7558 8.7558 8.7558 8.7558 9.0686 9.0686 9.0686 9.0686 9.4074 9.4074 9.4074 9.4074 9.4207 9.4207 9.4207 9.4207 9.5241 9.5241 9.5241 9.5241 10.8720 10.8720 10.8720 10.8720 11.0557 11.0557 11.0557 11.0557 11.1833 11.1833 11.1833 11.1833 11.3027 11.3027 11.3027 11.3027 11.3791 11.3791 11.3791 11.3791 k = 0.2933 0.5081 0.7267 ( 14728 PWs) bands (ev): -1.2742 -1.2742 -1.2742 -1.2742 0.1212 0.1212 0.1212 0.1212 0.1945 0.1945 0.1945 0.1945 0.4741 0.4741 0.4741 0.4741 4.8705 4.8705 4.8705 4.8705 5.1301 5.1301 5.1301 5.1301 5.8133 5.8133 5.8133 5.8133 6.3156 6.3156 6.3156 6.3156 6.4317 6.4317 6.4317 6.4317 6.9125 6.9125 6.9125 6.9125 7.0154 7.0154 7.0154 7.0154 7.1706 7.1706 7.1706 7.1706 7.2261 7.2261 7.2261 7.2261 8.6616 8.6616 8.6616 8.6616 8.7466 8.7466 8.7466 8.7466 9.0703 9.0703 9.0703 9.0703 9.4011 9.4011 9.4011 9.4011 9.4120 9.4120 9.4120 9.4120 9.5575 9.5575 9.5575 9.5575 10.8625 10.8625 10.8625 10.8625 11.0121 11.0121 11.0121 11.0121 11.2148 11.2148 11.2148 11.2148 11.3111 11.3111 11.3111 11.3111 11.3788 11.3788 11.3788 11.3788 k = 0.2800 0.4850 0.7267 ( 14714 PWs) bands (ev): -1.2770 -1.2770 -1.2770 -1.2770 0.1148 0.1148 0.1148 0.1148 0.2093 0.2093 0.2093 0.2093 0.4717 0.4717 0.4717 0.4717 4.8348 4.8348 4.8348 4.8348 5.1669 5.1669 5.1669 5.1669 5.7955 5.7955 5.7955 5.7955 6.3074 6.3074 6.3074 6.3074 6.4433 6.4433 6.4433 6.4433 6.9011 6.9011 6.9011 6.9011 7.0126 7.0126 7.0126 7.0126 7.1830 7.1830 7.1830 7.1830 7.2477 7.2477 7.2477 7.2477 8.6490 8.6490 8.6490 8.6490 8.7345 8.7345 8.7345 8.7345 9.0710 9.0710 9.0710 9.0710 9.3932 9.3932 9.3932 9.3932 9.4056 9.4056 9.4056 9.4056 9.5968 9.5968 9.5968 9.5968 10.8531 10.8531 10.8531 10.8531 10.9677 10.9677 10.9677 10.9677 11.2451 11.2451 11.2451 11.2451 11.3185 11.3185 11.3185 11.3185 11.3809 11.3809 11.3809 11.3809 k = 0.2667 0.4619 0.7267 ( 14702 PWs) bands (ev): -1.2806 -1.2806 -1.2806 -1.2806 0.1107 0.1107 0.1107 0.1107 0.2244 0.2244 0.2244 0.2244 0.4689 0.4689 0.4689 0.4689 4.8020 4.8020 4.8020 4.8020 5.1975 5.1975 5.1975 5.1975 5.7744 5.7744 5.7744 5.7744 6.2957 6.2957 6.2957 6.2957 6.4648 6.4648 6.4648 6.4648 6.8886 6.8886 6.8886 6.8886 7.0070 7.0070 7.0070 7.0070 7.1993 7.1993 7.1993 7.1993 7.2712 7.2712 7.2712 7.2712 8.6334 8.6334 8.6334 8.6334 8.7206 8.7206 8.7206 8.7206 9.0698 9.0698 9.0698 9.0698 9.3839 9.3839 9.3839 9.3839 9.4018 9.4018 9.4018 9.4018 9.6407 9.6407 9.6407 9.6407 10.8439 10.8439 10.8439 10.8439 10.9249 10.9249 10.9249 10.9249 11.2715 11.2715 11.2715 11.2715 11.3238 11.3238 11.3238 11.3238 11.3872 11.3872 11.3872 11.3872 k = 0.2533 0.4388 0.7267 ( 14714 PWs) bands (ev): -1.2851 -1.2851 -1.2851 -1.2851 0.1087 0.1087 0.1087 0.1087 0.2397 0.2397 0.2397 0.2397 0.4658 0.4658 0.4658 0.4658 4.7721 4.7721 4.7721 4.7721 5.2194 5.2194 5.2194 5.2194 5.7534 5.7534 5.7534 5.7534 6.2807 6.2807 6.2807 6.2807 6.4963 6.4963 6.4963 6.4963 6.8742 6.8742 6.8742 6.8742 6.9996 6.9996 6.9996 6.9996 7.2190 7.2190 7.2190 7.2190 7.2958 7.2958 7.2958 7.2958 8.6144 8.6144 8.6144 8.6144 8.7062 8.7062 8.7062 8.7062 9.0668 9.0668 9.0668 9.0668 9.3748 9.3748 9.3748 9.3748 9.3987 9.3987 9.3987 9.3987 9.6884 9.6884 9.6884 9.6884 10.8331 10.8331 10.8331 10.8331 10.8879 10.8879 10.8879 10.8879 11.2906 11.2906 11.2906 11.2906 11.3272 11.3272 11.3272 11.3272 11.4004 11.4004 11.4004 11.4004 k = 0.2400 0.4157 0.7267 ( 14718 PWs) bands (ev): -1.2905 -1.2905 -1.2905 -1.2905 0.1089 0.1089 0.1089 0.1089 0.2550 0.2550 0.2550 0.2550 0.4623 0.4623 0.4623 0.4623 4.7454 4.7454 4.7454 4.7454 5.2296 5.2296 5.2296 5.2296 5.7371 5.7371 5.7371 5.7371 6.2628 6.2628 6.2628 6.2628 6.5365 6.5365 6.5365 6.5365 6.8572 6.8572 6.8572 6.8572 6.9909 6.9909 6.9909 6.9909 7.2416 7.2416 7.2416 7.2416 7.3212 7.3212 7.3212 7.3212 8.5913 8.5913 8.5913 8.5913 8.6923 8.6923 8.6923 8.6923 9.0620 9.0620 9.0620 9.0620 9.3665 9.3665 9.3665 9.3665 9.3954 9.3954 9.3954 9.3954 9.7391 9.7391 9.7391 9.7391 10.8137 10.8137 10.8137 10.8137 10.8650 10.8650 10.8650 10.8650 11.3000 11.3000 11.3000 11.3000 11.3294 11.3294 11.3294 11.3294 11.4223 11.4223 11.4223 11.4223 k = 0.2267 0.3926 0.7267 ( 14710 PWs) bands (ev): -1.2967 -1.2967 -1.2967 -1.2967 0.1112 0.1112 0.1112 0.1112 0.2702 0.2702 0.2702 0.2702 0.4587 0.4587 0.4587 0.4587 4.7218 4.7218 4.7218 4.7218 5.2258 5.2258 5.2258 5.2258 5.7297 5.7297 5.7297 5.7297 6.2429 6.2429 6.2429 6.2429 6.5833 6.5833 6.5833 6.5833 6.8373 6.8373 6.8373 6.8373 6.9814 6.9814 6.9814 6.9814 7.2668 7.2668 7.2668 7.2668 7.3473 7.3473 7.3473 7.3473 8.5640 8.5640 8.5640 8.5640 8.6793 8.6793 8.6793 8.6793 9.0555 9.0555 9.0555 9.0555 9.3592 9.3592 9.3592 9.3592 9.3916 9.3916 9.3916 9.3916 9.7917 9.7917 9.7917 9.7917 10.7850 10.7850 10.7850 10.7850 10.8581 10.8581 10.8581 10.8581 11.3011 11.3011 11.3011 11.3011 11.3297 11.3297 11.3297 11.3297 11.4522 11.4522 11.4522 11.4522 k = 0.2133 0.3695 0.7267 ( 14714 PWs) bands (ev): -1.3035 -1.3035 -1.3035 -1.3035 0.1153 0.1153 0.1153 0.1153 0.2852 0.2852 0.2852 0.2852 0.4549 0.4549 0.4549 0.4549 4.7013 4.7013 4.7013 4.7013 5.2073 5.2073 5.2073 5.2073 5.7334 5.7334 5.7334 5.7334 6.2216 6.2216 6.2216 6.2216 6.6345 6.6345 6.6345 6.6345 6.8153 6.8153 6.8153 6.8153 6.9711 6.9711 6.9711 6.9711 7.2941 7.2941 7.2941 7.2941 7.3747 7.3747 7.3747 7.3747 8.5328 8.5328 8.5328 8.5328 8.6674 8.6674 8.6674 8.6674 9.0475 9.0475 9.0475 9.0475 9.3530 9.3530 9.3530 9.3530 9.3870 9.3870 9.3870 9.3870 9.8450 9.8450 9.8450 9.8450 10.7562 10.7562 10.7562 10.7562 10.8593 10.8593 10.8593 10.8593 11.2978 11.2978 11.2978 11.2978 11.3269 11.3269 11.3269 11.3269 11.4878 11.4878 11.4878 11.4878 k = 0.2000 0.3464 0.7267 ( 14720 PWs) bands (ev): -1.3109 -1.3109 -1.3109 -1.3109 0.1212 0.1212 0.1212 0.1212 0.2999 0.2999 0.2999 0.2999 0.4511 0.4511 0.4511 0.4511 4.6839 4.6839 4.6839 4.6839 5.1761 5.1761 5.1761 5.1761 5.7478 5.7478 5.7478 5.7478 6.1994 6.1994 6.1994 6.1994 6.6855 6.6855 6.6855 6.6855 6.7938 6.7938 6.7938 6.7938 6.9599 6.9599 6.9599 6.9599 7.3224 7.3224 7.3224 7.3224 7.4042 7.4042 7.4042 7.4042 8.4980 8.4980 8.4980 8.4980 8.6566 8.6566 8.6566 8.6566 9.0382 9.0382 9.0382 9.0382 9.3478 9.3478 9.3478 9.3478 9.3819 9.3819 9.3819 9.3819 9.8974 9.8974 9.8974 9.8974 10.7321 10.7321 10.7321 10.7321 10.8647 10.8647 10.8647 10.8647 11.2920 11.2920 11.2920 11.2920 11.3208 11.3208 11.3208 11.3208 11.5276 11.5276 11.5276 11.5276 k = 0.1867 0.3233 0.7267 ( 14720 PWs) bands (ev): -1.3188 -1.3188 -1.3188 -1.3188 0.1286 0.1286 0.1286 0.1286 0.3143 0.3143 0.3143 0.3143 0.4474 0.4474 0.4474 0.4474 4.6694 4.6694 4.6694 4.6694 5.1353 5.1353 5.1353 5.1353 5.7711 5.7711 5.7711 5.7711 6.1766 6.1766 6.1766 6.1766 6.7197 6.7197 6.7197 6.7197 6.7887 6.7887 6.7887 6.7887 6.9475 6.9475 6.9475 6.9475 7.3502 7.3502 7.3502 7.3502 7.4374 7.4374 7.4374 7.4374 8.4603 8.4603 8.4603 8.4603 8.6464 8.6464 8.6464 8.6464 9.0275 9.0275 9.0275 9.0275 9.3436 9.3436 9.3436 9.3436 9.3763 9.3763 9.3763 9.3763 9.9470 9.9470 9.9470 9.9470 10.7154 10.7154 10.7154 10.7154 10.8731 10.8731 10.8731 10.8731 11.2838 11.2838 11.2838 11.2838 11.3127 11.3127 11.3127 11.3127 11.5702 11.5702 11.5702 11.5702 k = 0.1733 0.3002 0.7267 ( 14736 PWs) bands (ev): -1.3269 -1.3269 -1.3269 -1.3269 0.1372 0.1372 0.1372 0.1372 0.3281 0.3281 0.3281 0.3281 0.4438 0.4438 0.4438 0.4438 4.6578 4.6578 4.6578 4.6578 5.0883 5.0883 5.0883 5.0883 5.8008 5.8008 5.8008 5.8008 6.1538 6.1538 6.1538 6.1538 6.7101 6.7101 6.7101 6.7101 6.8251 6.8251 6.8251 6.8251 6.9349 6.9349 6.9349 6.9349 7.3760 7.3760 7.3760 7.3760 7.4754 7.4754 7.4754 7.4754 8.4206 8.4206 8.4206 8.4206 8.6370 8.6370 8.6370 8.6370 9.0153 9.0153 9.0153 9.0153 9.3402 9.3402 9.3402 9.3402 9.3707 9.3707 9.3707 9.3707 9.9916 9.9916 9.9916 9.9916 10.7081 10.7081 10.7081 10.7081 10.8841 10.8841 10.8841 10.8841 11.2718 11.2718 11.2718 11.2718 11.3054 11.3054 11.3054 11.3054 11.6139 11.6140 11.6140 11.6140 k = 0.1600 0.2771 0.7267 ( 14734 PWs) bands (ev): -1.3352 -1.3352 -1.3352 -1.3352 0.1467 0.1467 0.1467 0.1467 0.3414 0.3414 0.3414 0.3414 0.4404 0.4404 0.4404 0.4404 4.6488 4.6488 4.6488 4.6488 5.0380 5.0380 5.0380 5.0380 5.8346 5.8346 5.8346 5.8346 6.1315 6.1315 6.1315 6.1315 6.6838 6.6838 6.6838 6.6838 6.8688 6.8688 6.8688 6.8688 6.9284 6.9284 6.9284 6.9284 7.3990 7.3990 7.3990 7.3990 7.5186 7.5186 7.5186 7.5186 8.3798 8.3798 8.3798 8.3798 8.6280 8.6280 8.6280 8.6280 9.0013 9.0013 9.0013 9.0013 9.3375 9.3375 9.3375 9.3375 9.3653 9.3653 9.3653 9.3653 10.0292 10.0292 10.0292 10.0292 10.7116 10.7116 10.7116 10.7116 10.8970 10.8970 10.8970 10.8970 11.2546 11.2546 11.2546 11.2546 11.3014 11.3014 11.3014 11.3014 11.6567 11.6568 11.6568 11.6569 k = 0.1467 0.2540 0.7267 ( 14748 PWs) bands (ev): -1.3436 -1.3436 -1.3436 -1.3436 0.1568 0.1568 0.1568 0.1568 0.3539 0.3539 0.3539 0.3539 0.4373 0.4373 0.4373 0.4373 4.6423 4.6423 4.6423 4.6423 4.9867 4.9867 4.9867 4.9867 5.8705 5.8705 5.8705 5.8705 6.1105 6.1105 6.1105 6.1105 6.6546 6.6546 6.6546 6.6546 6.8777 6.8777 6.8777 6.8777 6.9564 6.9564 6.9564 6.9564 7.4191 7.4191 7.4191 7.4191 7.5658 7.5658 7.5658 7.5658 8.3394 8.3394 8.3394 8.3394 8.6196 8.6196 8.6196 8.6196 8.9854 8.9854 8.9854 8.9854 9.3354 9.3354 9.3354 9.3354 9.3603 9.3603 9.3603 9.3603 10.0583 10.0583 10.0583 10.0583 10.7269 10.7269 10.7269 10.7269 10.9114 10.9114 10.9114 10.9114 11.2330 11.2330 11.2330 11.2330 11.3010 11.3010 11.3010 11.3010 11.6957 11.6957 11.6957 11.6958 k = 0.1333 0.2309 0.7267 ( 14750 PWs) bands (ev): -1.3517 -1.3517 -1.3517 -1.3517 0.1672 0.1672 0.1672 0.1672 0.3656 0.3656 0.3656 0.3656 0.4345 0.4345 0.4345 0.4345 4.6381 4.6381 4.6381 4.6381 4.9359 4.9359 4.9359 4.9359 5.9060 5.9060 5.9060 5.9060 6.0926 6.0926 6.0926 6.0926 6.6253 6.6253 6.6253 6.6253 6.8605 6.8605 6.8605 6.8605 7.0075 7.0075 7.0075 7.0075 7.4368 7.4368 7.4368 7.4368 7.6148 7.6148 7.6148 7.6148 8.3012 8.3012 8.3012 8.3012 8.6118 8.6118 8.6118 8.6118 8.9672 8.9672 8.9672 8.9672 9.3337 9.3337 9.3337 9.3337 9.3561 9.3561 9.3561 9.3561 10.0784 10.0784 10.0784 10.0784 10.7533 10.7533 10.7533 10.7533 10.9270 10.9270 10.9270 10.9270 11.2084 11.2084 11.2084 11.2084 11.3042 11.3042 11.3042 11.3042 11.7289 11.7290 11.7290 11.7290 k = 0.1200 0.2078 0.7267 ( 14746 PWs) bands (ev): -1.3596 -1.3596 -1.3596 -1.3596 0.1776 0.1776 0.1776 0.1776 0.3765 0.3765 0.3765 0.3765 0.4321 0.4321 0.4321 0.4321 4.6358 4.6358 4.6358 4.6358 4.8872 4.8872 4.8872 4.8872 5.9370 5.9370 5.9370 5.9370 6.0812 6.0812 6.0812 6.0812 6.5973 6.5973 6.5973 6.5973 6.8366 6.8366 6.8366 6.8366 7.0615 7.0615 7.0615 7.0615 7.4522 7.4522 7.4522 7.4522 7.6622 7.6622 7.6622 7.6622 8.2677 8.2677 8.2677 8.2677 8.6045 8.6045 8.6045 8.6045 8.9463 8.9463 8.9463 8.9463 9.3323 9.3323 9.3323 9.3323 9.3526 9.3526 9.3526 9.3526 10.0904 10.0904 10.0904 10.0904 10.7890 10.7890 10.7890 10.7890 10.9429 10.9429 10.9429 10.9429 11.1820 11.1820 11.1820 11.1820 11.3114 11.3114 11.3114 11.3114 11.7371 11.7371 11.7371 11.7371 k = 0.1067 0.1848 0.7267 ( 14732 PWs) bands (ev): -1.3670 -1.3670 -1.3670 -1.3670 0.1877 0.1877 0.1877 0.1877 0.3864 0.3864 0.3864 0.3864 0.4302 0.4302 0.4302 0.4302 4.6352 4.6352 4.6352 4.6352 4.8414 4.8414 4.8414 4.8414 5.9565 5.9565 5.9565 5.9565 6.0830 6.0830 6.0830 6.0830 6.5712 6.5712 6.5712 6.5712 6.8090 6.8090 6.8090 6.8090 7.1153 7.1153 7.1153 7.1153 7.4657 7.4657 7.4657 7.4657 7.7034 7.7034 7.7034 7.7034 8.2430 8.2430 8.2430 8.2430 8.5979 8.5979 8.5979 8.5979 8.9225 8.9225 8.9225 8.9225 9.3312 9.3312 9.3312 9.3312 9.3501 9.3501 9.3501 9.3501 10.0957 10.0957 10.0957 10.0957 10.8308 10.8308 10.8308 10.8308 10.9587 10.9587 10.9587 10.9587 11.1551 11.1551 11.1551 11.1551 11.3230 11.3230 11.3230 11.3230 11.7096 11.7096 11.7096 11.7096 k = 0.0933 0.1617 0.7267 ( 14724 PWs) bands (ev): -1.3739 -1.3739 -1.3739 -1.3739 0.1972 0.1972 0.1972 0.1972 0.3953 0.3953 0.3953 0.3953 0.4287 0.4287 0.4287 0.4287 4.6359 4.6359 4.6359 4.6359 4.7994 4.7994 4.7994 4.7994 5.9598 5.9598 5.9598 5.9598 6.1024 6.1024 6.1024 6.1024 6.5480 6.5480 6.5480 6.5480 6.7786 6.7786 6.7786 6.7786 7.1683 7.1683 7.1683 7.1683 7.4775 7.4775 7.4775 7.4775 7.7328 7.7328 7.7328 7.7328 8.2315 8.2315 8.2315 8.2315 8.5922 8.5922 8.5922 8.5922 8.8953 8.8953 8.8953 8.8953 9.3301 9.3301 9.3301 9.3301 9.3484 9.3484 9.3484 9.3484 10.0962 10.0962 10.0962 10.0962 10.8747 10.8747 10.8747 10.8747 10.9734 10.9734 10.9734 10.9734 11.1292 11.1292 11.1292 11.1292 11.3400 11.3400 11.3400 11.3400 11.6837 11.6837 11.6837 11.6837 k = 0.0800 0.1386 0.7267 ( 14724 PWs) bands (ev): -1.3801 -1.3801 -1.3801 -1.3801 0.2058 0.2058 0.2058 0.2058 0.4031 0.4031 0.4031 0.4031 0.4276 0.4276 0.4276 0.4276 4.6375 4.6375 4.6375 4.6375 4.7618 4.7618 4.7618 4.7618 5.9520 5.9520 5.9520 5.9520 6.1340 6.1340 6.1340 6.1340 6.5283 6.5283 6.5283 6.5283 6.7459 6.7459 6.7459 6.7459 7.2205 7.2205 7.2205 7.2205 7.4875 7.4875 7.4875 7.4875 7.7455 7.7455 7.7455 7.7455 8.2373 8.2373 8.2373 8.2373 8.5875 8.5875 8.5875 8.5875 8.8646 8.8646 8.8646 8.8646 9.3293 9.3293 9.3293 9.3293 9.3474 9.3474 9.3474 9.3474 10.0937 10.0937 10.0937 10.0937 10.9162 10.9162 10.9162 10.9162 10.9863 10.9863 10.9863 10.9863 11.1064 11.1064 11.1064 11.1064 11.3636 11.3636 11.3636 11.3636 11.6646 11.6646 11.6646 11.6646 k = 0.0667 0.1155 0.7267 ( 14720 PWs) bands (ev): -1.3855 -1.3855 -1.3855 -1.3855 0.2134 0.2134 0.2134 0.2134 0.4097 0.4097 0.4097 0.4097 0.4269 0.4269 0.4269 0.4269 4.6395 4.6395 4.6395 4.6395 4.7293 4.7293 4.7293 4.7293 5.9400 5.9400 5.9400 5.9400 6.1703 6.1703 6.1703 6.1703 6.5129 6.5129 6.5129 6.5129 6.7113 6.7113 6.7113 6.7113 7.2718 7.2718 7.2718 7.2718 7.4958 7.4958 7.4958 7.4958 7.7402 7.7402 7.7402 7.7402 8.2607 8.2607 8.2607 8.2607 8.5841 8.5841 8.5841 8.5841 8.8303 8.8303 8.8303 8.8303 9.3286 9.3286 9.3286 9.3286 9.3469 9.3469 9.3469 9.3469 10.0897 10.0897 10.0897 10.0897 10.9493 10.9493 10.9493 10.9493 10.9975 10.9975 10.9975 10.9975 11.0896 11.0896 11.0896 11.0896 11.3949 11.3949 11.3949 11.3949 11.6528 11.6528 11.6528 11.6528 k = 0.0533 0.0924 0.7267 ( 14700 PWs) bands (ev): -1.3900 -1.3900 -1.3900 -1.3900 0.2198 0.2198 0.2198 0.2198 0.4151 0.4151 0.4151 0.4151 0.4266 0.4266 0.4266 0.4266 4.6415 4.6415 4.6415 4.6415 4.7025 4.7025 4.7025 4.7025 5.9277 5.9277 5.9277 5.9277 6.2066 6.2066 6.2066 6.2066 6.5027 6.5027 6.5027 6.5027 6.6755 6.6755 6.6755 6.6755 7.3222 7.3222 7.3222 7.3222 7.5024 7.5024 7.5024 7.5024 7.7198 7.7198 7.7198 7.7198 8.2971 8.2971 8.2971 8.2971 8.5827 8.5827 8.5827 8.5827 8.7926 8.7926 8.7926 8.7926 9.3282 9.3282 9.3282 9.3282 9.3467 9.3467 9.3467 9.3467 10.0851 10.0851 10.0851 10.0851 10.9667 10.9667 10.9667 10.9667 11.0096 11.0096 11.0096 11.0096 11.0818 11.0818 11.0818 11.0818 11.4344 11.4344 11.4344 11.4344 11.6479 11.6479 11.6479 11.6479 k = 0.0400 0.0693 0.7267 ( 14688 PWs) bands (ev): -1.3936 -1.3936 -1.3936 -1.3936 0.2248 0.2248 0.2248 0.2248 0.4191 0.4191 0.4191 0.4191 0.4268 0.4268 0.4268 0.4268 4.6429 4.6429 4.6429 4.6429 4.6819 4.6819 4.6819 4.6819 5.9169 5.9169 5.9169 5.9169 6.2396 6.2396 6.2396 6.2396 6.4989 6.4989 6.4989 6.4989 6.6392 6.6392 6.6392 6.6392 7.3713 7.3713 7.3713 7.3713 7.5069 7.5069 7.5069 7.5069 7.6896 7.6896 7.6896 7.6896 8.3399 8.3399 8.3399 8.3399 8.5842 8.5842 8.5842 8.5842 8.7520 8.7520 8.7520 8.7520 9.3279 9.3279 9.3279 9.3279 9.3467 9.3467 9.3467 9.3467 10.0809 10.0809 10.0809 10.0809 10.9682 10.9682 10.9682 10.9682 11.0223 11.0223 11.0223 11.0223 11.0828 11.0828 11.0828 11.0828 11.4818 11.4818 11.4818 11.4818 11.6483 11.6483 11.6483 11.6483 k = 0.0267 0.0462 0.7267 ( 14688 PWs) bands (ev): -1.3962 -1.3962 -1.3962 -1.3962 0.2285 0.2285 0.2285 0.2285 0.4216 0.4216 0.4216 0.4216 0.4273 0.4273 0.4273 0.4273 4.6427 4.6427 4.6427 4.6427 4.6683 4.6683 4.6683 4.6683 5.9086 5.9086 5.9086 5.9086 6.2662 6.2662 6.2662 6.2662 6.5032 6.5032 6.5032 6.5032 6.6036 6.6036 6.6036 6.6036 7.4180 7.4180 7.4180 7.4180 7.5088 7.5088 7.5088 7.5088 7.6552 7.6552 7.6552 7.6552 8.3812 8.3812 8.3812 8.3812 8.5908 8.5908 8.5908 8.5908 8.7098 8.7098 8.7098 8.7098 9.3277 9.3277 9.3277 9.3277 9.3468 9.3468 9.3468 9.3468 10.0775 10.0775 10.0775 10.0775 10.9634 10.9634 10.9634 10.9634 11.0312 11.0312 11.0312 11.0312 11.0882 11.0882 11.0882 11.0882 11.5355 11.5355 11.5355 11.5355 11.6519 11.6519 11.6519 11.6519 k = 0.0133 0.0231 0.7267 ( 14692 PWs) bands (ev): -1.3978 -1.3978 -1.3978 -1.3978 0.2307 0.2307 0.2307 0.2307 0.4228 0.4228 0.4228 0.4228 0.4280 0.4280 0.4280 0.4280 4.6410 4.6410 4.6410 4.6410 4.6618 4.6618 4.6618 4.6618 5.9034 5.9034 5.9034 5.9034 6.2834 6.2834 6.2834 6.2834 6.5161 6.5161 6.5161 6.5161 6.5706 6.5706 6.5706 6.5706 7.4597 7.4597 7.4597 7.4597 7.5057 7.5057 7.5057 7.5057 7.6242 7.6242 7.6242 7.6242 8.4120 8.4120 8.4120 8.4120 8.6057 8.6057 8.6057 8.6057 8.6685 8.6685 8.6685 8.6685 9.3276 9.3276 9.3276 9.3276 9.3469 9.3469 9.3469 9.3469 10.0753 10.0753 10.0753 10.0753 10.9586 10.9586 10.9586 10.9586 11.0359 11.0359 11.0359 11.0359 11.0932 11.0932 11.0932 11.0932 11.5925 11.5925 11.5925 11.5925 11.6559 11.6560 11.6560 11.6560 k = 0.0000 0.0000 0.7267 ( 14712 PWs) bands (ev): -1.3984 -1.3984 -1.3984 -1.3984 0.2314 0.2314 0.2314 0.2314 0.4231 0.4231 0.4231 0.4231 0.4283 0.4283 0.4283 0.4283 4.6399 4.6399 4.6399 4.6399 4.6602 4.6602 4.6602 4.6602 5.9017 5.9017 5.9017 5.9017 6.2894 6.2894 6.2894 6.2894 6.5313 6.5313 6.5313 6.5313 6.5484 6.5484 6.5484 6.5484 7.4871 7.4871 7.4871 7.4871 7.4946 7.4946 7.4946 7.4946 7.6103 7.6103 7.6103 7.6103 8.4236 8.4236 8.4236 8.4236 8.6308 8.6308 8.6308 8.6308 8.6335 8.6335 8.6335 8.6335 9.3275 9.3275 9.3275 9.3275 9.3469 9.3469 9.3469 9.3469 10.0746 10.0746 10.0746 10.0746 10.9568 10.9568 10.9568 10.9568 11.0374 11.0374 11.0374 11.0374 11.0951 11.0951 11.0951 11.0951 11.6354 11.6354 11.6355 11.6355 11.6610 11.6610 11.6610 11.6611 k = 0.5000 0.2887 0.7267 ( 14732 PWs) bands (ev): -1.2856 -1.2856 -1.2856 -1.2856 0.0622 0.0622 0.0622 0.0622 0.3338 0.3338 0.3338 0.3338 0.4216 0.4216 0.4216 0.4216 4.6314 4.6314 4.6314 4.6314 5.5642 5.5642 5.5642 5.5642 5.8107 5.8107 5.8107 5.8107 6.0328 6.0328 6.0328 6.0328 6.3176 6.3176 6.3176 6.3176 6.8826 6.8826 6.8826 6.8826 7.0210 7.0210 7.0210 7.0210 7.1125 7.1125 7.1125 7.1125 7.6659 7.6659 7.6659 7.6659 8.3126 8.3126 8.3126 8.3126 8.7886 8.7886 8.7886 8.7886 9.1445 9.1445 9.1445 9.1445 9.3167 9.3167 9.3167 9.3167 9.6091 9.6091 9.6091 9.6091 9.6669 9.6669 9.6669 9.6669 10.5915 10.5915 10.5915 10.5915 10.9485 10.9485 10.9485 10.9485 11.0516 11.0516 11.0516 11.0516 11.2584 11.2584 11.2584 11.2584 11.6183 11.6183 11.6183 11.6183 k = 0.5000 0.2887 0.6998 ( 14758 PWs) bands (ev): -1.3497 -1.3497 -1.2198 -1.2198 0.0095 0.0095 0.1151 0.1151 0.3137 0.3137 0.3356 0.3356 0.4234 0.4234 0.4368 0.4368 4.6073 4.6073 4.6579 4.6579 5.5209 5.5209 5.6075 5.6075 5.7778 5.7778 5.8464 5.8464 5.9930 5.9930 6.0722 6.0722 6.2947 6.2947 6.3431 6.3431 6.8739 6.8739 6.8896 6.8896 6.9841 6.9841 7.0356 7.0356 7.0558 7.0558 7.1912 7.1912 7.6503 7.6503 7.6717 7.6717 8.2935 8.2935 8.3405 8.3405 8.7825 8.7825 8.7866 8.7866 9.0637 9.0637 9.2293 9.2293 9.3032 9.3032 9.3321 9.3321 9.5677 9.5677 9.6187 9.6187 9.6684 9.6684 9.7027 9.7027 10.5213 10.5213 10.6615 10.6615 10.8730 10.8730 10.9857 10.9857 11.0462 11.0462 11.0815 11.0815 11.1887 11.1887 11.3267 11.3267 11.5634 11.5634 11.6779 11.6780 k = 0.5000 0.2887 0.6729 ( 14748 PWs) bands (ev): -1.4119 -1.4119 -1.1524 -1.1524 -0.0427 -0.0427 0.1680 0.1680 0.2856 0.2856 0.3192 0.3192 0.4419 0.4419 0.4587 0.4587 4.5860 4.5860 4.6861 4.6861 5.4785 5.4785 5.6500 5.6500 5.7485 5.7485 5.8830 5.8830 5.9544 5.9544 6.1096 6.1096 6.2759 6.2759 6.3704 6.3704 6.8494 6.8494 6.8948 6.8948 6.9280 6.9280 7.0277 7.0277 7.0565 7.0565 7.2684 7.2684 7.6266 7.6266 7.6668 7.6668 8.2838 8.2838 8.3753 8.3753 8.7689 8.7689 8.7765 8.7765 8.9890 8.9890 9.2880 9.2880 9.3164 9.3164 9.3493 9.3493 9.5333 9.5333 9.5881 9.5881 9.7127 9.7127 9.7431 9.7431 10.4526 10.4526 10.7244 10.7244 10.8017 10.8017 10.9433 10.9433 11.0695 11.0695 11.1094 11.1094 11.1463 11.1463 11.3905 11.3905 11.5173 11.5173 11.7396 11.7396 k = 0.5000 0.2887 0.6459 ( 14734 PWs) bands (ev): -1.4723 -1.4723 -1.0836 -1.0836 -0.0943 -0.0943 0.2206 0.2206 0.2546 0.2546 0.2950 0.2950 0.4667 0.4667 0.4822 0.4822 4.5680 4.5680 4.7155 4.7155 5.4376 5.4376 5.6896 5.6896 5.7246 5.7246 5.9058 5.9058 5.9306 5.9306 6.1407 6.1407 6.2651 6.2651 6.3993 6.3993 6.7794 6.7794 6.8918 6.8918 6.9173 6.9173 7.0186 7.0186 7.0718 7.0718 7.3384 7.3384 7.5970 7.5970 7.6515 7.6515 8.2825 8.2825 8.4145 8.4145 8.7484 8.7484 8.7591 8.7591 8.9209 8.9209 9.2770 9.2770 9.3677 9.3677 9.3801 9.3801 9.5283 9.5283 9.5565 9.5565 9.7591 9.7591 9.7860 9.7860 10.3866 10.3866 10.7023 10.7023 10.8147 10.8147 10.8850 10.8850 11.0103 11.0103 11.1201 11.1201 11.1875 11.1875 11.4482 11.4482 11.4894 11.4894 11.7921 11.7921 k = 0.5000 0.2887 0.6190 ( 14742 PWs) bands (ev): -1.5308 -1.5308 -1.0134 -1.0134 -0.1452 -0.1452 0.2222 0.2222 0.2680 0.2680 0.2730 0.2730 0.4929 0.4929 0.5058 0.5058 4.5537 4.5537 4.7455 4.7455 5.3989 5.3989 5.6983 5.6983 5.7327 5.7327 5.8761 5.8761 5.9583 5.9583 6.1575 6.1575 6.2695 6.2695 6.4295 6.4295 6.6926 6.6926 6.8900 6.8900 6.9268 6.9268 7.0125 7.0125 7.0902 7.0902 7.3984 7.3984 7.5639 7.5639 7.6277 7.6277 8.2876 8.2876 8.4546 8.4546 8.7213 8.7213 8.7361 8.7361 8.8598 8.8598 9.2647 9.2647 9.3861 9.3861 9.3945 9.3945 9.5259 9.5259 9.5857 9.5857 9.8036 9.8036 9.8304 9.8304 10.3247 10.3247 10.6301 10.6301 10.8178 10.8178 10.8778 10.8778 10.9332 10.9332 11.1262 11.1262 11.2166 11.2166 11.4898 11.4898 11.5047 11.5047 11.7905 11.7908 k = 0.5000 0.2887 0.5921 ( 14720 PWs) bands (ev): -1.5872 -1.5872 -0.9420 -0.9420 -0.1951 -0.1951 0.1893 0.1893 0.2399 0.2399 0.3245 0.3245 0.5187 0.5187 0.5287 0.5287 4.5434 4.5434 4.7754 4.7754 5.3627 5.3627 5.6822 5.6822 5.7638 5.7638 5.8453 5.8453 5.9836 5.9836 6.1555 6.1555 6.2926 6.2926 6.4610 6.4610 6.6118 6.6118 6.8913 6.8913 6.9393 6.9393 7.0084 7.0084 7.1118 7.1118 7.4431 7.4431 7.5318 7.5318 7.5989 7.5989 8.2966 8.2966 8.4916 8.4916 8.6883 8.6883 8.7095 8.7095 8.8056 8.8056 9.2517 9.2517 9.3829 9.3829 9.4047 9.4047 9.4990 9.4990 9.6780 9.6780 9.8441 9.8441 9.8760 9.8760 10.2692 10.2692 10.5580 10.5580 10.7495 10.7495 10.8431 10.8431 10.9482 10.9482 11.1288 11.1288 11.2117 11.2117 11.5362 11.5362 11.5486 11.5486 11.7690 11.7690 k = 0.5000 0.2887 0.5652 ( 14732 PWs) bands (ev): -1.6414 -1.6414 -0.8696 -0.8696 -0.2438 -0.2438 0.1564 0.1564 0.2114 0.2114 0.3751 0.3751 0.5434 0.5434 0.5507 0.5507 4.5376 4.5376 4.8049 4.8049 5.3297 5.3297 5.6678 5.6678 5.7782 5.7782 5.8312 5.8312 5.9926 5.9926 6.1426 6.1426 6.3268 6.3268 6.4937 6.4937 6.5496 6.5496 6.8943 6.8943 6.9524 6.9524 7.0064 7.0064 7.1369 7.1369 7.4532 7.4532 7.5128 7.5128 7.5755 7.5755 8.3068 8.3068 8.5206 8.5206 8.6512 8.6512 8.6813 8.6813 8.7581 8.7581 9.2379 9.2379 9.3766 9.3766 9.4131 9.4131 9.4805 9.4805 9.7750 9.7750 9.8802 9.8802 9.9229 9.9229 10.2235 10.2235 10.4897 10.4897 10.6807 10.6807 10.7596 10.7596 11.0075 11.0075 11.1299 11.1299 11.1854 11.1854 11.5870 11.5870 11.6070 11.6070 11.7428 11.7428 k = 0.5000 0.2887 0.5383 ( 14726 PWs) bands (ev): -1.6935 -1.6935 -0.7964 -0.7964 -0.2912 -0.2912 0.1237 0.1237 0.1830 0.1830 0.4247 0.4247 0.5667 0.5667 0.5715 0.5715 4.5362 4.5362 4.8333 4.8333 5.3001 5.3001 5.6546 5.6546 5.7633 5.7633 5.8456 5.8456 5.9722 5.9722 6.1312 6.1312 6.3654 6.3654 6.5086 6.5086 6.5339 6.5339 6.8985 6.8985 6.9641 6.9641 7.0072 7.0072 7.1658 7.1658 7.4247 7.4247 7.4919 7.4919 7.5796 7.5796 8.3158 8.3158 8.5354 8.5354 8.6126 8.6126 8.6537 8.6537 8.7175 8.7175 9.2233 9.2233 9.3814 9.3814 9.4035 9.4035 9.4791 9.4791 9.8455 9.8455 9.9269 9.9269 9.9710 9.9710 10.1924 10.1924 10.4264 10.4264 10.6166 10.6166 10.6762 10.6762 11.0605 11.0605 11.1300 11.1300 11.1541 11.1541 11.6183 11.6183 11.6889 11.6889 11.7159 11.7159 k = 0.5000 0.2887 0.5114 ( 14746 PWs) bands (ev): -1.7434 -1.7434 -0.7225 -0.7225 -0.3372 -0.3372 0.0915 0.0915 0.1549 0.1549 0.4730 0.4730 0.5882 0.5882 0.5911 0.5911 4.5396 4.5396 4.8603 4.8603 5.2742 5.2742 5.6403 5.6403 5.7426 5.7426 5.8607 5.8607 5.9232 5.9232 6.1295 6.1295 6.4057 6.4057 6.4998 6.4998 6.5709 6.5709 6.9037 6.9037 6.9723 6.9723 7.0121 7.0121 7.1976 7.1976 7.3858 7.3858 7.4566 7.4566 7.5991 7.5991 8.3215 8.3215 8.5263 8.5263 8.5795 8.5795 8.6295 8.6295 8.6845 8.6845 9.2079 9.2079 9.3773 9.3773 9.4037 9.4037 9.4885 9.4885 9.8585 9.8585 10.0000 10.0000 10.0209 10.0209 10.1800 10.1800 10.3695 10.3695 10.5639 10.5639 10.5974 10.5974 11.0995 11.0995 11.1100 11.1100 11.1498 11.1498 11.6414 11.6414 11.6904 11.6904 11.7764 11.7764 k = 0.5000 0.2887 0.4845 ( 14746 PWs) bands (ev): -1.7910 -1.7910 -0.6483 -0.6483 -0.3816 -0.3816 0.0600 0.0600 0.1274 0.1274 0.5197 0.5197 0.6078 0.6078 0.6094 0.6094 4.5477 4.5477 4.8856 4.8856 5.2522 5.2522 5.6224 5.6224 5.7236 5.7236 5.8222 5.8222 5.9051 5.9051 6.1357 6.1357 6.4455 6.4455 6.5075 6.5075 6.6136 6.6136 6.9098 6.9098 6.9764 6.9764 7.0210 7.0210 7.2293 7.2293 7.3449 7.3449 7.4211 7.4211 7.6164 7.6164 8.3222 8.3222 8.4908 8.4908 8.5556 8.5556 8.6087 8.6087 8.6601 8.6601 9.1917 9.1917 9.3495 9.3495 9.4372 9.4372 9.4984 9.4984 9.8392 9.8392 10.0567 10.0567 10.0751 10.0751 10.1832 10.1832 10.3203 10.3203 10.5113 10.5113 10.5529 10.5529 11.0732 11.0732 11.1254 11.1254 11.1698 11.1698 11.6531 11.6531 11.6746 11.6746 11.8261 11.8262 k = 0.5000 0.2887 0.4575 ( 14744 PWs) bands (ev): -1.8363 -1.8363 -0.5740 -0.5740 -0.4243 -0.4243 0.0293 0.0293 0.1008 0.1008 0.5647 0.5647 0.6251 0.6251 0.6266 0.6266 4.5605 4.5605 4.9088 4.9088 5.2342 5.2342 5.6001 5.6001 5.6854 5.6854 5.7627 5.7627 5.9189 5.9189 6.1471 6.1471 6.4794 6.4794 6.5279 6.5279 6.6602 6.6602 6.9171 6.9171 6.9778 6.9778 7.0319 7.0319 7.2509 7.2509 7.3058 7.3058 7.3979 7.3979 7.6272 7.6272 8.3165 8.3165 8.4444 8.4444 8.5326 8.5326 8.5886 8.5886 8.6436 8.6436 9.1748 9.1748 9.3195 9.3195 9.4826 9.4826 9.5047 9.5047 9.8042 9.8042 10.0907 10.0907 10.1098 10.1098 10.1933 10.1933 10.2802 10.2802 10.4490 10.4490 10.5759 10.5759 11.0398 11.0398 11.1414 11.1414 11.1901 11.1901 11.6501 11.6501 11.6741 11.6741 11.8249 11.8249 k = 0.5000 0.2887 0.4306 ( 14760 PWs) bands (ev): -1.8792 -1.8792 -0.5000 -0.5000 -0.4652 -0.4652 -0.0004 -0.0004 0.0754 0.0754 0.6077 0.6077 0.6405 0.6405 0.6422 0.6422 4.5776 4.5776 4.9299 4.9299 5.2201 5.2201 5.5726 5.5726 5.6016 5.6016 5.7485 5.7485 5.9334 5.9334 6.1632 6.1632 6.4998 6.4998 6.5612 6.5612 6.7090 6.7090 6.9264 6.9264 6.9782 6.9782 7.0430 7.0430 7.2420 7.2420 7.2742 7.2742 7.4040 7.4040 7.6305 7.6305 8.3023 8.3023 8.3972 8.3972 8.5085 8.5085 8.5695 8.5695 8.6325 8.6325 9.1574 9.1574 9.2889 9.2889 9.5032 9.5032 9.5377 9.5377 9.7609 9.7609 10.0866 10.0866 10.1205 10.1205 10.2123 10.2123 10.2515 10.2515 10.4058 10.4058 10.6474 10.6474 11.0087 11.0087 11.1578 11.1578 11.2007 11.2007 11.6488 11.6488 11.6750 11.6750 11.8236 11.8236 k = 0.5000 0.2887 0.4037 ( 14758 PWs) bands (ev): -1.9197 -1.9197 -0.5041 -0.5041 -0.4268 -0.4268 -0.0289 -0.0289 0.0515 0.0515 0.6485 0.6485 0.6543 0.6543 0.6561 0.6561 4.5987 4.5987 4.9487 4.9487 5.2096 5.2096 5.4952 5.4952 5.5522 5.5522 5.7528 5.7528 5.9457 5.9457 6.1837 6.1837 6.5069 6.5069 6.6019 6.6019 6.7571 6.7571 6.9390 6.9390 6.9788 6.9788 7.0533 7.0533 7.2096 7.2096 7.2459 7.2459 7.4380 7.4380 7.6266 7.6266 8.2758 8.2758 8.3567 8.3567 8.4839 8.4839 8.5527 8.5527 8.6250 8.6250 9.1396 9.1396 9.2584 9.2584 9.4962 9.4962 9.5940 9.5940 9.7138 9.7138 10.0503 10.0503 10.1045 10.1045 10.2230 10.2230 10.2525 10.2525 10.3966 10.3966 10.7466 10.7466 10.9805 10.9805 11.1713 11.1713 11.2060 11.2060 11.6490 11.6490 11.6777 11.6777 11.8225 11.8226 k = 0.5000 0.2887 0.3768 ( 14760 PWs) bands (ev): -1.9578 -1.9578 -0.5409 -0.5409 -0.3552 -0.3552 -0.0562 -0.0562 0.0296 0.0296 0.6662 0.6662 0.6678 0.6678 0.6875 0.6875 4.6228 4.6228 4.9651 4.9651 5.2011 5.2011 5.3965 5.3965 5.5252 5.5252 5.7640 5.7640 5.9557 5.9557 6.2081 6.2081 6.5031 6.5031 6.6440 6.6440 6.8000 6.8000 6.9565 6.9565 6.9806 6.9806 7.0629 7.0629 7.1742 7.1742 7.2171 7.2171 7.4827 7.4827 7.6174 7.6174 8.2353 8.2353 8.3270 8.3270 8.4591 8.4591 8.5389 8.5389 8.6213 8.6213 9.1216 9.1216 9.2285 9.2285 9.4818 9.4818 9.6434 9.6434 9.6680 9.6680 10.0075 10.0075 10.0605 10.0605 10.2184 10.2184 10.2832 10.2832 10.4207 10.4207 10.8571 10.8571 10.9554 10.9554 11.1687 11.1687 11.2231 11.2231 11.6367 11.6367 11.6937 11.6937 11.8230 11.8259 k = 0.5000 0.2887 0.3499 ( 14750 PWs) bands (ev): -1.9933 -1.9933 -0.5756 -0.5756 -0.2862 -0.2862 -0.0820 -0.0820 0.0108 0.0108 0.6762 0.6762 0.6784 0.6784 0.7238 0.7238 4.6485 4.6485 4.9791 4.9791 5.1897 5.1897 5.3084 5.3084 5.4997 5.4997 5.7800 5.7800 5.9635 5.9635 6.2356 6.2356 6.4890 6.4890 6.6848 6.6848 6.8331 6.8331 6.9740 6.9740 6.9887 6.9887 7.0736 7.0736 7.1415 7.1415 7.1919 7.1919 7.5212 7.5212 7.6123 7.6123 8.1861 8.1861 8.3050 8.3050 8.4348 8.4348 8.5274 8.5274 8.6220 8.6220 9.1037 9.1037 9.1995 9.1995 9.4608 9.4608 9.6131 9.6131 9.6864 9.6864 9.9759 9.9759 10.0019 10.0019 10.2218 10.2218 10.3167 10.3167 10.4652 10.4652 10.9324 10.9324 10.9668 10.9668 11.1584 11.1584 11.2523 11.2523 11.6125 11.6125 11.7196 11.7196 11.8275 11.8305 k = 0.5000 0.2887 0.3230 ( 14762 PWs) bands (ev): -2.0264 -2.0264 -0.6081 -0.6081 -0.2224 -0.2224 -0.1064 -0.1064 -0.0028 -0.0028 0.6840 0.6840 0.6880 0.6880 0.7576 0.7576 4.6729 4.6729 4.9906 4.9906 5.1571 5.1571 5.2541 5.2541 5.4755 5.4755 5.8002 5.8002 5.9693 5.9693 6.2642 6.2642 6.4655 6.4655 6.7222 6.7222 6.8555 6.8555 6.9800 6.9800 7.0062 7.0062 7.0910 7.0910 7.1149 7.1149 7.1735 7.1735 7.5264 7.5264 7.6359 7.6359 8.1344 8.1344 8.2867 8.2867 8.4112 8.4112 8.5176 8.5176 8.6276 8.6276 9.0860 9.0860 9.1718 9.1718 9.4346 9.4346 9.5647 9.5647 9.6933 9.6933 9.9372 9.9372 9.9729 9.9729 10.2340 10.2340 10.3502 10.3502 10.5204 10.5204 10.9134 10.9134 11.0446 11.0446 11.1744 11.1744 11.2879 11.2879 11.5794 11.5794 11.7499 11.7499 11.8175 11.8176 k = 0.5000 0.2887 0.2961 ( 14760 PWs) bands (ev): -2.0569 -2.0569 -0.6383 -0.6383 -0.1692 -0.1692 -0.1291 -0.1291 -0.0061 -0.0061 0.6895 0.6895 0.6964 0.6964 0.7888 0.7888 4.6906 4.6906 4.9993 4.9993 5.1017 5.1017 5.2418 5.2418 5.4529 5.4529 5.8245 5.8245 5.9736 5.9736 6.2892 6.2892 6.4370 6.4370 6.7540 6.7540 6.8698 6.8698 6.9834 6.9834 7.0105 7.0105 7.0960 7.0960 7.1227 7.1227 7.1649 7.1649 7.5015 7.5015 7.6837 7.6837 8.0833 8.0833 8.2705 8.2705 8.3890 8.3890 8.5088 8.5088 8.6386 8.6386 9.0688 9.0688 9.1457 9.1457 9.4045 9.4045 9.5171 9.5171 9.6683 9.6683 9.8728 9.8728 9.9988 9.9988 10.2542 10.2542 10.3831 10.3831 10.5813 10.5813 10.8967 10.8967 11.0558 11.0558 11.2550 11.2550 11.3278 11.3278 11.5388 11.5388 11.7810 11.7810 11.8052 11.8052 k = 0.5000 0.2887 0.2691 ( 14744 PWs) bands (ev): -2.0848 -2.0848 -0.6660 -0.6660 -0.1502 -0.1502 -0.1366 -0.1366 0.0107 0.0107 0.6930 0.6930 0.7037 0.7037 0.8174 0.8174 4.6927 4.6927 5.0040 5.0040 5.0597 5.0597 5.2459 5.2459 5.4322 5.4322 5.8529 5.8529 5.9763 5.9763 6.2979 6.2979 6.4161 6.4161 6.7779 6.7779 6.8777 6.8777 6.9833 6.9833 7.0038 7.0038 7.0918 7.0918 7.1427 7.1427 7.1823 7.1823 7.4651 7.4651 7.7362 7.7362 8.0355 8.0355 8.2561 8.2561 8.3683 8.3683 8.5006 8.5006 8.6547 8.6547 9.0520 9.0520 9.1216 9.1216 9.3723 9.3723 9.4713 9.4713 9.6245 9.6245 9.8097 9.8097 10.0400 10.0400 10.2811 10.2811 10.4147 10.4147 10.6454 10.6454 10.8825 10.8825 11.0419 11.0419 11.3577 11.3577 11.3731 11.3731 11.4920 11.4920 11.7939 11.7939 11.8144 11.8144 k = 0.5000 0.2887 0.2422 ( 14752 PWs) bands (ev): -2.1101 -2.1101 -0.6914 -0.6914 -0.1694 -0.1694 -0.1276 -0.1276 0.0499 0.0499 0.6946 0.6946 0.7100 0.7100 0.8432 0.8432 4.6712 4.6712 5.0051 5.0051 5.0494 5.0494 5.2557 5.2557 5.4136 5.4136 5.8852 5.8852 5.9779 5.9779 6.2729 6.2729 6.4208 6.4208 6.7925 6.7925 6.8779 6.8779 6.9696 6.9696 7.0099 7.0099 7.0966 7.0966 7.1443 7.1443 7.2253 7.2253 7.4234 7.4234 7.7847 7.7847 7.9942 7.9942 8.2437 8.2437 8.3496 8.3496 8.4928 8.4928 8.6756 8.6756 9.0359 9.0359 9.0996 9.0996 9.3391 9.3391 9.4281 9.4281 9.5730 9.5730 9.7494 9.7494 10.0841 10.0841 10.3136 10.3136 10.4445 10.4445 10.7109 10.7109 10.8705 10.8705 11.0273 11.0273 11.4144 11.4144 11.4410 11.4410 11.4665 11.4665 11.7907 11.7907 11.8414 11.8414 k = 0.5000 0.2887 0.2153 ( 14760 PWs) bands (ev): -2.1329 -2.1329 -0.7142 -0.7142 -0.1868 -0.1868 -0.1313 -0.1313 0.1003 0.1003 0.6943 0.6943 0.7153 0.7153 0.8663 0.8663 4.6286 4.6286 5.0086 5.0086 5.0655 5.0655 5.2681 5.2681 5.3976 5.3976 5.9211 5.9211 5.9782 5.9782 6.2227 6.2227 6.4425 6.4425 6.7981 6.7981 6.8690 6.8690 6.9525 6.9525 7.0280 7.0280 7.1069 7.1069 7.1441 7.1441 7.2703 7.2703 7.3794 7.3794 7.8195 7.8195 7.9677 7.9677 8.2333 8.2333 8.3330 8.3330 8.4855 8.4855 8.7006 8.7006 9.0205 9.0205 9.0801 9.0801 9.3061 9.3061 9.3880 9.3880 9.5193 9.5193 9.6928 9.6928 10.1244 10.1244 10.3506 10.3506 10.4719 10.4719 10.7761 10.7761 10.8610 10.8610 11.0178 11.0178 11.3832 11.3832 11.4638 11.4638 11.5665 11.5665 11.7910 11.7910 11.8677 11.8678 k = 0.5000 0.2887 0.1884 ( 14760 PWs) bands (ev): -2.1530 -2.1530 -0.7344 -0.7344 -0.2024 -0.2024 -0.1393 -0.1393 0.1530 0.1530 0.6922 0.6922 0.7197 0.7197 0.8867 0.8867 4.5752 4.5752 5.0127 5.0127 5.1009 5.1009 5.2812 5.2812 5.3849 5.3849 5.9603 5.9603 5.9770 5.9770 6.1617 6.1617 6.4666 6.4666 6.7960 6.7960 6.8543 6.8543 6.9391 6.9391 7.0520 7.0520 7.1202 7.1202 7.1439 7.1439 7.3074 7.3074 7.3399 7.3399 7.8253 7.8253 7.9698 7.9698 8.2249 8.2249 8.3188 8.3188 8.4788 8.4788 8.7288 8.7288 9.0060 9.0060 9.0632 9.0632 9.2744 9.2744 9.3515 9.3515 9.4660 9.4660 9.6406 9.6406 10.1578 10.1578 10.3912 10.3912 10.4966 10.4966 10.8334 10.8334 10.8596 10.8596 11.0154 11.0154 11.3246 11.3246 11.5116 11.5116 11.6590 11.6590 11.7948 11.7948 11.8957 11.8957 k = 0.5000 0.2887 0.1615 ( 14766 PWs) bands (ev): -2.1704 -2.1704 -0.7521 -0.7521 -0.2159 -0.2159 -0.1482 -0.1482 0.2040 0.2040 0.6884 0.6884 0.7234 0.7234 0.9043 0.9043 4.5201 4.5201 5.0152 5.0152 5.1495 5.1495 5.2929 5.2929 5.3766 5.3766 5.9728 5.9728 6.0022 6.0022 6.0974 6.0974 6.4857 6.4857 6.7862 6.7862 6.8420 6.8420 6.9294 6.9294 7.0773 7.0773 7.1314 7.1314 7.1467 7.1467 7.2856 7.2856 7.3567 7.3567 7.8054 7.8054 7.9965 7.9965 8.2185 8.2185 8.3074 8.3074 8.4728 8.4728 8.7593 8.7593 8.9926 8.9926 9.0490 9.0490 9.2448 9.2448 9.3190 9.3190 9.4144 9.4144 9.5936 9.5936 10.1832 10.1832 10.4345 10.4345 10.5181 10.5181 10.8402 10.8402 10.9074 10.9074 11.0200 11.0200 11.2643 11.2643 11.5594 11.5594 11.7416 11.7416 11.8011 11.8011 11.9260 11.9260 k = 0.5000 0.2887 0.1346 ( 14758 PWs) bands (ev): -2.1852 -2.1852 -0.7670 -0.7670 -0.2275 -0.2275 -0.1566 -0.1566 0.2511 0.2511 0.6832 0.6832 0.7264 0.7264 0.9191 0.9191 4.4685 4.4685 5.0163 5.0163 5.2063 5.2063 5.3008 5.3008 5.3741 5.3741 5.9588 5.9588 6.0374 6.0374 6.0480 6.0480 6.4955 6.4955 6.7694 6.7694 6.8396 6.8396 6.9226 6.9226 7.1006 7.1006 7.1279 7.1279 7.1612 7.1612 7.2485 7.2485 7.3886 7.3886 7.7770 7.7770 8.0297 8.0297 8.2139 8.2139 8.2990 8.2990 8.4675 8.4675 8.7910 8.7910 8.9805 8.9805 9.0376 9.0376 9.2179 9.2179 9.2909 9.2909 9.3655 9.3655 9.5523 9.5523 10.2009 10.2009 10.4794 10.4794 10.5365 10.5365 10.8352 10.8352 10.9637 10.9637 11.0304 11.0304 11.2038 11.2038 11.6064 11.6064 11.7997 11.7997 11.8202 11.8202 11.9566 11.9566 k = 0.5000 0.2887 0.1077 ( 14782 PWs) bands (ev): -2.1973 -2.1973 -0.7793 -0.7793 -0.2370 -0.2370 -0.1640 -0.1640 0.2928 0.2928 0.6770 0.6770 0.7287 0.7287 0.9313 0.9313 4.4235 4.4235 5.0166 5.0166 5.2673 5.2673 5.3041 5.3041 5.3777 5.3777 5.9170 5.9170 6.0074 6.0074 6.0908 6.0908 6.4935 6.4935 6.7501 6.7501 6.8488 6.8488 6.9179 6.9179 7.1115 7.1115 7.1196 7.1196 7.1795 7.1795 7.2215 7.2215 7.4157 7.4157 7.7485 7.7485 8.0603 8.0603 8.2108 8.2108 8.2937 8.2937 8.4630 8.4630 8.8224 8.8224 8.9701 8.9701 9.0288 9.0288 9.1947 9.1947 9.2675 9.2675 9.3204 9.3204 9.5174 9.5174 10.2121 10.2121 10.5246 10.5246 10.5517 10.5517 10.8309 10.8309 11.0141 11.0141 11.0444 11.0444 11.1446 11.1446 11.6518 11.6518 11.8066 11.8066 11.8741 11.8741 11.9769 11.9770 k = 0.5000 0.2887 0.0807 ( 14768 PWs) bands (ev): -2.2068 -2.2068 -0.7889 -0.7889 -0.2444 -0.2444 -0.1699 -0.1699 0.3278 0.3278 0.6704 0.6704 0.7304 0.7304 0.9407 0.9407 4.3870 4.3870 5.0165 5.0165 5.3032 5.3032 5.3290 5.3290 5.3868 5.3868 5.8540 5.8540 5.9978 5.9978 6.1339 6.1339 6.4806 6.4806 6.7325 6.7325 6.8681 6.8681 6.9148 6.9148 7.0831 7.0831 7.1339 7.1339 7.1899 7.1899 7.2146 7.2146 7.4370 7.4370 7.7232 7.7232 8.0850 8.0850 8.2089 8.2089 8.2914 8.2914 8.4594 8.4594 8.8517 8.8517 8.9621 8.9621 9.0226 9.0226 9.1755 9.1755 9.2489 9.2489 9.2805 9.2805 9.4895 9.4895 10.2184 10.2184 10.5607 10.5607 10.5713 10.5713 10.8278 10.8278 11.0539 11.0539 11.0611 11.0611 11.0893 11.0893 11.6948 11.6948 11.8058 11.8058 11.9166 11.9166 11.9811 11.9812 k = 0.5000 0.2887 0.0538 ( 14774 PWs) bands (ev): -2.2135 -2.2135 -0.7958 -0.7958 -0.2497 -0.2497 -0.1742 -0.1742 0.3545 0.3545 0.6644 0.6644 0.7316 0.7316 0.9474 0.9474 4.3602 4.3602 5.0162 5.0162 5.3018 5.3018 5.3740 5.3740 5.4104 5.4104 5.7890 5.7890 5.9945 5.9945 6.1727 6.1727 6.4613 6.4613 6.7189 6.7189 6.8944 6.8944 6.9137 6.9137 7.0469 7.0469 7.1438 7.1438 7.1880 7.1880 7.2258 7.2258 7.4523 7.4523 7.7034 7.7034 8.1026 8.1026 8.2077 8.2077 8.2912 8.2912 8.4568 8.4568 8.8757 8.8757 8.9574 8.9574 9.0185 9.0185 9.1613 9.1613 9.2342 9.2342 9.2490 9.2490 9.4692 9.4692 10.2215 10.2215 10.5704 10.5704 10.6090 10.6090 10.8262 10.8262 11.0406 11.0406 11.0703 11.0703 11.0898 11.0898 11.7333 11.7333 11.8020 11.8020 11.9448 11.9448 11.9744 11.9745 k = 0.5000 0.2887 0.0269 ( 14766 PWs) bands (ev): -2.2175 -2.2175 -0.7999 -0.7999 -0.2529 -0.2529 -0.1769 -0.1769 0.3715 0.3715 0.6600 0.6600 0.7323 0.7323 0.9514 0.9514 4.3438 4.3438 5.0160 5.0160 5.3004 5.3004 5.3869 5.3869 5.4545 5.4545 5.7345 5.7345 5.9932 5.9932 6.2018 6.2018 6.4429 6.4429 6.7104 6.7104 6.9089 6.9089 6.9307 6.9307 7.0083 7.0083 7.1497 7.1497 7.1857 7.1857 7.2361 7.2361 7.4614 7.4614 7.6906 7.6906 8.1128 8.1128 8.2072 8.2072 8.2920 8.2920 8.4551 8.4551 8.8912 8.8912 8.9560 8.9560 9.0163 9.0163 9.1524 9.1524 9.2201 9.2201 9.2326 9.2326 9.4568 9.4568 10.2227 10.2227 10.5754 10.5754 10.6374 10.6374 10.8259 10.8259 11.0059 11.0059 11.0788 11.0788 11.1095 11.1095 11.7630 11.7630 11.7981 11.7981 11.9530 11.9530 11.9618 11.9620 k = 0.5000 0.2887-0.0000 ( 14762 PWs) bands (ev): -2.2189 -2.2189 -0.8013 -0.8013 -0.2540 -0.2540 -0.1778 -0.1778 0.3773 0.3773 0.6584 0.6584 0.7326 0.7326 0.9527 0.9527 4.3383 4.3383 5.0159 5.0159 5.2998 5.2998 5.3897 5.3897 5.4764 5.4764 5.7107 5.7107 5.9928 5.9928 6.2131 6.2131 6.4351 6.4351 6.7074 6.7074 6.9093 6.9093 6.9584 6.9584 6.9779 6.9779 7.1517 7.1517 7.1850 7.1850 7.2399 7.2399 7.4645 7.4645 7.6861 7.6861 8.1162 8.1162 8.2070 8.2070 8.2924 8.2924 8.4546 8.4546 8.8964 8.8964 8.9562 8.9562 9.0156 9.0156 9.1494 9.1494 9.2132 9.2132 9.2288 9.2288 9.4526 9.4526 10.2230 10.2230 10.5771 10.5771 10.6482 10.6482 10.8260 10.8260 10.9928 10.9928 11.0818 11.0818 11.1163 11.1163 11.7750 11.7750 11.7965 11.7965 11.9441 11.9441 11.9664 11.9668 k = 0.3333 0.5774-0.0000 ( 14802 PWs) bands (ev): -2.1967 -2.1967 -0.6430 -0.6430 -0.6402 -0.6402 -0.0272 -0.0272 0.3769 0.3769 0.6852 0.6852 0.8525 0.8525 0.8556 0.8556 4.3367 4.3367 5.0536 5.0536 5.0740 5.0740 5.5173 5.5173 5.5274 5.5274 5.7830 5.7830 5.8861 5.8861 6.2424 6.2424 6.5471 6.5471 6.7940 6.7940 6.9550 6.9550 6.9756 6.9756 7.0547 7.0547 7.1225 7.1225 7.1231 7.1231 7.2196 7.2196 7.5231 7.5231 7.8827 7.8827 7.8983 7.8983 7.9769 7.9769 8.3328 8.3328 8.4294 8.4294 8.4461 8.4461 9.0140 9.0140 9.0710 9.0710 9.1991 9.1991 9.2312 9.2312 9.8646 9.8646 9.9058 9.9058 9.9337 9.9337 9.9777 9.9777 10.5261 10.5261 10.6125 10.6125 11.0351 11.0351 11.1327 11.1327 11.3388 11.3388 11.6798 11.6798 11.8194 11.8194 11.8286 11.8286 11.8533 11.8533 k = 0.3333 0.5774 0.0269 ( 14781 PWs) bands (ev): -2.1954 -2.1954 -0.6417 -0.6417 -0.6389 -0.6389 -0.0267 -0.0267 0.3720 0.3720 0.6861 0.6861 0.8516 0.8516 0.8547 0.8547 4.3428 4.3428 5.0510 5.0510 5.0708 5.0708 5.5149 5.5149 5.5263 5.5263 5.7884 5.7884 5.8891 5.8891 6.2309 6.2309 6.5580 6.5580 6.7951 6.7951 6.9503 6.9503 6.9767 6.9767 7.0321 7.0321 7.1156 7.1156 7.1450 7.1450 7.2320 7.2320 7.5215 7.5215 7.8793 7.8793 7.8993 7.8993 7.9773 7.9773 8.3330 8.3330 8.4279 8.4279 8.4443 8.4443 9.0131 9.0131 9.0750 9.0750 9.2024 9.2024 9.2345 9.2345 9.8656 9.8656 9.9055 9.9055 9.9332 9.9332 9.9784 9.9784 10.5269 10.5269 10.6125 10.6125 11.0366 11.0366 11.1308 11.1308 11.3309 11.3309 11.6891 11.6891 11.8097 11.8097 11.8183 11.8183 11.8504 11.8504 k = 0.3333 0.5774 0.0538 ( 14787 PWs) bands (ev): -2.1914 -2.1914 -0.6378 -0.6378 -0.6350 -0.6350 -0.0251 -0.0251 0.3575 0.3575 0.6887 0.6887 0.8491 0.8491 0.8522 0.8522 4.3608 4.3608 5.0430 5.0430 5.0612 5.0612 5.5085 5.5085 5.5233 5.5233 5.8037 5.8037 5.8974 5.8974 6.2007 6.2007 6.5861 6.5861 6.7985 6.7985 6.9366 6.9366 6.9784 6.9784 6.9931 6.9931 7.1007 7.1007 7.1853 7.1853 7.2615 7.2615 7.5168 7.5168 7.8694 7.8694 7.9016 7.9016 7.9783 7.9783 8.3335 8.3335 8.4235 8.4235 8.4388 8.4388 9.0115 9.0115 9.0863 9.0863 9.2120 9.2120 9.2442 9.2442 9.8686 9.8686 9.9046 9.9046 9.9319 9.9319 9.9804 9.9804 10.5291 10.5291 10.6124 10.6124 11.0398 11.0398 11.1265 11.1265 11.3096 11.3096 11.7145 11.7145 11.7817 11.7817 11.7886 11.7886 11.8419 11.8419 k = 0.3333 0.5774 0.0807 ( 14772 PWs) bands (ev): -2.1847 -2.1847 -0.6313 -0.6313 -0.6285 -0.6285 -0.0227 -0.0227 0.3345 0.3345 0.6925 0.6925 0.8448 0.8448 0.8479 0.8479 4.3905 4.3905 5.0301 5.0301 5.0457 5.0457 5.5003 5.5003 5.5193 5.5193 5.8263 5.8263 5.9100 5.9100 6.1598 6.1598 6.6224 6.6224 6.8051 6.8051 6.9143 6.9143 6.9455 6.9455 6.9865 6.9865 7.0861 7.0861 7.2297 7.2297 7.2994 7.2994 7.5090 7.5090 7.8537 7.8537 7.9051 7.9051 7.9798 7.9798 8.3348 8.3348 8.4164 8.4164 8.4301 8.4301 9.0106 9.0106 9.1031 9.1031 9.2277 9.2277 9.2599 9.2599 9.8738 9.8738 9.9031 9.9031 9.9296 9.9296 9.9841 9.9841 10.5326 10.5326 10.6122 10.6122 11.0397 11.0397 11.1241 11.1241 11.2797 11.2797 11.7374 11.7374 11.7432 11.7432 11.7518 11.7518 11.8290 11.8290 k = 0.3333 0.5774 0.1077 ( 14766 PWs) bands (ev): -2.1753 -2.1753 -0.6223 -0.6223 -0.6194 -0.6194 -0.0197 -0.0197 0.3044 0.3044 0.6966 0.6966 0.8388 0.8388 0.8418 0.8418 4.4315 4.4315 5.0127 5.0127 5.0251 5.0251 5.4923 5.4923 5.5153 5.5153 5.8537 5.8537 5.9249 5.9249 6.1147 6.1147 6.6594 6.6594 6.8163 6.8163 6.8852 6.8852 6.8994 6.8994 6.9923 6.9923 7.0737 7.0737 7.2763 7.2763 7.3425 7.3425 7.4984 7.4984 7.8326 7.8326 7.9095 7.9095 7.9817 7.9817 8.3372 8.3372 8.4074 8.4074 8.4186 8.4186 9.0114 9.0114 9.1242 9.1242 9.2488 9.2488 9.2809 9.2809 9.8813 9.8813 9.9012 9.9012 9.9263 9.9263 9.9898 9.9898 10.5372 10.5372 10.6118 10.6118 11.0295 11.0295 11.1295 11.1295 11.2458 11.2458 11.6849 11.6850 11.6875 11.6875 11.7855 11.7855 11.8196 11.8196 k = 0.3333 0.5774 0.1346 ( 14763 PWs) bands (ev): -2.1633 -2.1633 -0.6107 -0.6107 -0.6078 -0.6078 -0.0169 -0.0169 0.2686 0.2686 0.7006 0.7006 0.8310 0.8310 0.8339 0.8339 4.4831 4.4831 4.9918 4.9918 5.0002 5.0002 5.4856 5.4856 5.5121 5.5121 5.8838 5.8838 5.9396 5.9396 6.0700 6.0700 6.6913 6.6913 6.8336 6.8336 6.8511 6.8511 6.8519 6.8519 6.9990 6.9990 7.0627 7.0627 7.3248 7.3248 7.3892 7.3892 7.4853 7.4853 7.8070 7.8070 7.9145 7.9145 7.9839 7.9839 8.3410 8.3410 8.3970 8.3970 8.4051 8.4051 9.0143 9.0143 9.1489 9.1489 9.2745 9.2745 9.3064 9.3064 9.8900 9.8900 9.9002 9.9002 9.9219 9.9219 9.9980 9.9980 10.5424 10.5424 10.6109 10.6109 11.0073 11.0073 11.1411 11.1411 11.2130 11.2130 11.6268 11.6268 11.6268 11.6268 11.7737 11.7737 11.8546 11.8546 k = 0.3333 0.5774 0.1615 ( 14763 PWs) bands (ev): -2.1487 -2.1487 -0.5965 -0.5965 -0.5937 -0.5937 -0.0155 -0.0155 0.2296 0.2296 0.7040 0.7040 0.8213 0.8213 0.8242 0.8242 4.5447 4.5447 4.9682 4.9682 4.9723 4.9723 5.4806 5.4806 5.5101 5.5101 5.9153 5.9153 5.9475 5.9475 6.0333 6.0333 6.7152 6.7152 6.8035 6.8035 6.8138 6.8138 6.8569 6.8569 7.0056 7.0056 7.0521 7.0521 7.3747 7.3747 7.4387 7.4387 7.4706 7.4706 7.7785 7.7785 7.9198 7.9198 7.9859 7.9859 8.3462 8.3462 8.3863 8.3863 8.3905 8.3905 9.0195 9.0195 9.1767 9.1767 9.3041 9.3041 9.3354 9.3354 9.8920 9.8920 9.9085 9.9085 9.9163 9.9163 10.0092 10.0092 10.5481 10.5481 10.6095 10.6095 10.9759 10.9759 11.1418 11.1418 11.1958 11.1958 11.5657 11.5657 11.5680 11.5680 11.7406 11.7406 11.9055 11.9055 k = 0.3333 0.5774 0.1884 ( 14793 PWs) bands (ev): -2.1314 -2.1314 -0.5799 -0.5799 -0.5771 -0.5771 -0.0182 -0.0182 0.1907 0.1907 0.7065 0.7065 0.8096 0.8096 0.8125 0.8125 4.6153 4.6153 4.9426 4.9426 4.9432 4.9432 5.4772 5.4772 5.5093 5.5093 5.9340 5.9340 5.9471 5.9471 6.0197 6.0197 6.7304 6.7304 6.7561 6.7561 6.7744 6.7744 6.8828 6.8828 7.0117 7.0117 7.0410 7.0410 7.4203 7.4203 7.4597 7.4597 7.4900 7.4900 7.7494 7.7494 7.9250 7.9250 7.9878 7.9878 8.3527 8.3527 8.3760 8.3760 8.3763 8.3763 9.0269 9.0269 9.2071 9.2071 9.3363 9.3363 9.3665 9.3665 9.8884 9.8884 9.9094 9.9094 9.9253 9.9253 10.0240 10.0240 10.5537 10.5537 10.6072 10.6072 10.9381 10.9381 11.1162 11.1162 11.2051 11.2051 11.5077 11.5077 11.5119 11.5119 11.6977 11.6977 11.9551 11.9551 k = 0.3333 0.5774 0.2153 ( 14781 PWs) bands (ev): -2.1115 -2.1115 -0.5608 -0.5608 -0.5580 -0.5580 -0.0295 -0.0295 0.1573 0.1573 0.7080 0.7080 0.7960 0.7960 0.7988 0.7988 4.6934 4.6934 4.9124 4.9124 4.9185 4.9185 5.4749 5.4749 5.5094 5.5094 5.9004 5.9004 5.9788 5.9788 6.0282 6.0282 6.7029 6.7029 6.7341 6.7341 6.7462 6.7462 6.9063 6.9063 7.0166 7.0166 7.0288 7.0288 7.4247 7.4247 7.4895 7.4895 7.5416 7.5416 7.7228 7.7228 7.9297 7.9297 7.9897 7.9897 8.3589 8.3589 8.3639 8.3639 8.3682 8.3682 9.0366 9.0366 9.2396 9.2396 9.3700 9.3700 9.3983 9.3983 9.8835 9.8835 9.9013 9.9013 9.9471 9.9471 10.0428 10.0428 10.5591 10.5591 10.6042 10.6042 10.8961 10.8961 11.0827 11.0827 11.2162 11.2162 11.4553 11.4553 11.4611 11.4611 11.6479 11.6479 11.9515 11.9515 k = 0.3333 0.5774 0.2422 ( 14781 PWs) bands (ev): -2.0889 -2.0889 -0.5394 -0.5394 -0.5366 -0.5366 -0.0552 -0.0552 0.1357 0.1357 0.7082 0.7082 0.7802 0.7802 0.7830 0.7830 4.7757 4.7757 4.8827 4.8827 4.8976 4.8976 5.4729 5.4729 5.5100 5.5100 5.8621 5.8621 6.0101 6.0101 6.0440 6.0440 6.6547 6.6547 6.6938 6.6938 6.7545 6.7545 6.9235 6.9235 7.0155 7.0155 7.0185 7.0185 7.4077 7.4077 7.5386 7.5386 7.5908 7.5908 7.7027 7.7027 7.9340 7.9340 7.9927 7.9927 8.3512 8.3512 8.3633 8.3633 8.3688 8.3688 9.0484 9.0484 9.2737 9.2737 9.4037 9.4037 9.4293 9.4293 9.8777 9.8777 9.8919 9.8919 9.9739 9.9739 10.0662 10.0662 10.5643 10.5643 10.6004 10.6004 10.8514 10.8514 11.0489 11.0489 11.2119 11.2119 11.4104 11.4104 11.4171 11.4171 11.5988 11.5988 11.9235 11.9235 k = 0.3333 0.5774 0.2691 ( 14778 PWs) bands (ev): -2.0638 -2.0638 -0.5156 -0.5156 -0.5128 -0.5128 -0.0968 -0.0968 0.1281 0.1281 0.7071 0.7071 0.7623 0.7623 0.7650 0.7650 4.8353 4.8353 4.8546 4.8546 4.9074 4.9074 5.4705 5.4705 5.5102 5.5102 5.8248 5.8248 6.0408 6.0408 6.0618 6.0618 6.6068 6.6068 6.6542 6.6542 6.7617 6.7617 6.9328 6.9328 7.0009 7.0009 7.0144 7.0144 7.3893 7.3893 7.5834 7.5834 7.6338 7.6338 7.6942 7.6942 7.9388 7.9388 7.9996 7.9996 8.3446 8.3446 8.3626 8.3626 8.3766 8.3766 9.0623 9.0623 9.3089 9.3089 9.4358 9.4358 9.4576 9.4576 9.8709 9.8709 9.8813 9.8813 10.0064 10.0064 10.0948 10.0948 10.5693 10.5693 10.5963 10.5963 10.8055 10.8055 11.0169 11.0169 11.1797 11.1797 11.3743 11.3743 11.3814 11.3814 11.5608 11.5608 11.9092 11.9092 k = 0.3333 0.5774 0.2961 ( 14754 PWs) bands (ev): -2.0361 -2.0361 -0.4895 -0.4895 -0.4868 -0.4868 -0.1506 -0.1506 0.1313 0.1313 0.7047 0.7047 0.7422 0.7422 0.7448 0.7448 4.8288 4.8288 4.8308 4.8308 4.9891 4.9891 5.4667 5.4667 5.5094 5.5094 5.7907 5.7907 6.0710 6.0710 6.0800 6.0800 6.5603 6.5603 6.6162 6.6162 6.7675 6.7675 6.9344 6.9344 6.9853 6.9853 7.0023 7.0023 7.3711 7.3711 7.6175 7.6175 7.6652 7.6652 7.7002 7.7002 7.9474 7.9474 8.0146 8.0146 8.3432 8.3432 8.3670 8.3670 8.3839 8.3839 9.0782 9.0782 9.3446 9.3446 9.4644 9.4644 9.4814 9.4814 9.8632 9.8632 9.8696 9.8696 10.0451 10.0451 10.1290 10.1290 10.5747 10.5747 10.5924 10.5924 10.7596 10.7596 10.9873 10.9873 11.1152 11.1152 11.3475 11.3475 11.3550 11.3550 11.5372 11.5372 11.9107 11.9107 k = 0.3333 0.5774 0.3230 ( 14760 PWs) bands (ev): -2.0059 -2.0059 -0.4612 -0.4612 -0.4585 -0.4585 -0.2120 -0.2120 0.1411 0.1411 0.7009 0.7009 0.7198 0.7198 0.7224 0.7224 4.8060 4.8060 4.8143 4.8143 5.0902 5.0902 5.4608 5.4608 5.5067 5.5067 5.7608 5.7608 6.0984 6.0984 6.1008 6.1008 6.5160 6.5160 6.5805 6.5805 6.7715 6.7715 6.9272 6.9272 6.9689 6.9689 6.9841 6.9841 7.3527 7.3527 7.6428 7.6428 7.6797 7.6797 7.7128 7.7128 7.9656 7.9656 8.0423 8.0423 8.3477 8.3477 8.3766 8.3766 8.3901 8.3901 9.0961 9.0961 9.3800 9.3800 9.4875 9.4875 9.4989 9.4989 9.8545 9.8545 9.8573 9.8573 10.0903 10.0903 10.1694 10.1694 10.5814 10.5814 10.5892 10.5892 10.7150 10.7150 10.9606 10.9606 11.0262 11.0262 11.3303 11.3303 11.3383 11.3383 11.5210 11.5210 11.9286 11.9286 k = 0.3333 0.5774 0.3499 ( 14757 PWs) bands (ev): -1.9731 -1.9731 -0.4308 -0.4308 -0.4281 -0.4281 -0.2783 -0.2783 0.1551 0.1551 0.6951 0.6951 0.6951 0.6951 0.6983 0.6983 4.7868 4.7868 4.7988 4.7988 5.1965 5.1965 5.4520 5.4520 5.5014 5.5014 5.7360 5.7360 6.1167 6.1167 6.1303 6.1303 6.4746 6.4746 6.5479 6.5479 6.7722 6.7722 6.9078 6.9078 6.9519 6.9519 6.9677 6.9677 7.3332 7.3332 7.6671 7.6671 7.6758 7.6758 7.7173 7.7173 7.9983 7.9983 8.0840 8.0840 8.3580 8.3580 8.3915 8.3915 8.3956 8.3956 9.1157 9.1157 9.4146 9.4146 9.5033 9.5033 9.5089 9.5089 9.8446 9.8446 9.8446 9.8446 10.1422 10.1422 10.2161 10.2161 10.5857 10.5857 10.5906 10.5906 10.6730 10.6730 10.9202 10.9202 10.9418 10.9418 11.3220 11.3220 11.3303 11.3303 11.5041 11.5041 11.9612 11.9612 k = 0.3333 0.5774 0.3768 ( 14751 PWs) bands (ev): -1.9379 -1.9379 -0.3984 -0.3984 -0.3958 -0.3958 -0.3476 -0.3476 0.1720 0.1720 0.6681 0.6681 0.6704 0.6704 0.6894 0.6894 4.7715 4.7715 4.7865 4.7865 5.3036 5.3036 5.4395 5.4395 5.4933 5.4933 5.7179 5.7179 6.1352 6.1352 6.1596 6.1596 6.4366 6.4366 6.5189 6.5189 6.7656 6.7656 6.8799 6.8799 6.9349 6.9349 6.9578 6.9578 7.3122 7.3122 7.6559 7.6559 7.6867 7.6867 7.7144 7.7144 8.0449 8.0449 8.1371 8.1371 8.3722 8.3722 8.4022 8.4022 8.4115 8.4115 9.1370 9.1370 9.4476 9.4476 9.5104 9.5104 9.5108 9.5108 9.8316 9.8316 9.8329 9.8329 10.2002 10.2002 10.2694 10.2694 10.5726 10.5726 10.6034 10.6034 10.6399 10.6399 10.8204 10.8204 10.9215 10.9215 11.3219 11.3219 11.3301 11.3301 11.4825 11.4825 11.9866 11.9867 k = 0.3333 0.5774 0.4037 ( 14766 PWs) bands (ev): -1.9002 -1.9002 -0.4190 -0.4190 -0.3641 -0.3641 -0.3614 -0.3614 0.1910 0.1910 0.6389 0.6389 0.6412 0.6412 0.6814 0.6814 4.7606 4.7606 4.7780 4.7780 5.4032 5.4032 5.4227 5.4227 5.4857 5.4857 5.7095 5.7095 6.1537 6.1537 6.1887 6.1887 6.4025 6.4025 6.4942 6.4942 6.7445 6.7445 6.8570 6.8570 6.9184 6.9184 6.9524 6.9524 7.2898 7.2898 7.6240 7.6240 7.6723 7.6723 7.7340 7.7340 8.1004 8.1004 8.1975 8.1975 8.3851 8.3851 8.4158 8.4158 8.4363 8.4363 9.1600 9.1600 9.4779 9.4779 9.5048 9.5048 9.5085 9.5085 9.8178 9.8178 9.8189 9.8189 10.2630 10.2630 10.3290 10.3290 10.5246 10.5246 10.6211 10.6211 10.6306 10.6306 10.7367 10.7367 10.9084 10.9084 11.3288 11.3288 11.3364 11.3364 11.4554 11.4554 11.9625 11.9625 k = 0.3333 0.5774 0.4306 ( 14754 PWs) bands (ev): -1.8600 -1.8600 -0.4916 -0.4916 -0.3279 -0.3279 -0.3252 -0.3252 0.2116 0.2116 0.6074 0.6074 0.6097 0.6097 0.6718 0.6718 4.7543 4.7543 4.7738 4.7738 5.4015 5.4015 5.4437 5.4437 5.5201 5.5201 5.7190 5.7190 6.1725 6.1725 6.2177 6.2177 6.3723 6.3723 6.4739 6.4739 6.7075 6.7075 6.8465 6.8465 6.9027 6.9027 6.9500 6.9500 7.2663 7.2663 7.5837 7.5837 7.6396 7.6396 7.7605 7.7605 8.1597 8.1597 8.2614 8.2614 8.3942 8.3942 8.4406 8.4406 8.4656 8.4656 9.1844 9.1844 9.4905 9.4905 9.4980 9.4980 9.5063 9.5063 9.8019 9.8019 9.8026 9.8026 10.3224 10.3224 10.3945 10.3945 10.4444 10.4444 10.6344 10.6344 10.6445 10.6445 10.6907 10.6907 10.9013 10.9013 11.3412 11.3412 11.3478 11.3478 11.4232 11.4232 11.9306 11.9306 k = 0.3333 0.5774 0.4575 ( 14754 PWs) bands (ev): -1.8174 -1.8174 -0.5649 -0.5649 -0.2900 -0.2900 -0.2874 -0.2874 0.2334 0.2334 0.5738 0.5738 0.5761 0.5761 0.6609 0.6609 4.7526 4.7526 4.7742 4.7742 5.3756 5.3756 5.4262 5.4262 5.5769 5.5769 5.7625 5.7625 6.1914 6.1914 6.2463 6.2463 6.3462 6.3462 6.4582 6.4582 6.6632 6.6632 6.8445 6.8445 6.8887 6.8887 6.9502 6.9502 7.2421 7.2421 7.5374 7.5374 7.5996 7.5996 7.7809 7.7809 8.2187 8.2187 8.3257 8.3257 8.4057 8.4057 8.4735 8.4735 8.4996 8.4996 9.2101 9.2101 9.4719 9.4719 9.4805 9.4805 9.5291 9.5291 9.7812 9.7812 9.7849 9.7849 10.2937 10.2937 10.4323 10.4323 10.4653 10.4653 10.6300 10.6300 10.6740 10.6740 10.6903 10.6903 10.9007 10.9007 11.3575 11.3575 11.3619 11.3619 11.3875 11.3875 11.8941 11.8941 k = 0.3333 0.5774 0.4845 ( 14730 PWs) bands (ev): -1.7725 -1.7725 -0.6385 -0.6385 -0.2505 -0.2505 -0.2479 -0.2479 0.2563 0.2563 0.5382 0.5382 0.5404 0.5404 0.6484 0.6484 4.7557 4.7557 4.7792 4.7792 5.3454 5.3454 5.3982 5.3982 5.6054 5.6054 5.8396 5.8396 6.2106 6.2106 6.2743 6.2743 6.3238 6.3238 6.4470 6.4470 6.6209 6.6209 6.8464 6.8464 6.8769 6.8769 6.9532 6.9532 7.2177 7.2177 7.4869 7.4869 7.5554 7.5554 7.7891 7.7891 8.2752 8.2752 8.3880 8.3880 8.4252 8.4252 8.5120 8.5120 8.5382 8.5382 9.2370 9.2370 9.4487 9.4487 9.4581 9.4581 9.5477 9.5477 9.7566 9.7566 9.7635 9.7635 10.1766 10.1766 10.5008 10.5008 10.5405 10.5405 10.6251 10.6251 10.7098 10.7098 10.7163 10.7163 10.9071 10.9071 11.3447 11.3447 11.3759 11.3759 11.3813 11.3813 11.8536 11.8536 k = 0.3333 0.5774 0.5114 ( 14751 PWs) bands (ev): -1.7253 -1.7253 -0.7121 -0.7121 -0.2096 -0.2096 -0.2070 -0.2070 0.2800 0.2800 0.5006 0.5006 0.5028 0.5028 0.6345 0.6345 4.7636 4.7636 4.7889 4.7889 5.3112 5.3112 5.3645 5.3645 5.6210 5.6210 5.9243 5.9243 6.2306 6.2306 6.3010 6.3010 6.3060 6.3060 6.4400 6.4400 6.5882 6.5882 6.8507 6.8507 6.8683 6.8683 6.9588 6.9588 7.1935 7.1935 7.4336 7.4336 7.5086 7.5086 7.7808 7.7808 8.3287 8.3287 8.4463 8.4463 8.4555 8.4555 8.5549 8.5549 8.5811 8.5811 9.2648 9.2648 9.4233 9.4233 9.4329 9.4329 9.5612 9.5612 9.7278 9.7278 9.7381 9.7381 10.0483 10.0483 10.5760 10.5760 10.6190 10.6190 10.6318 10.6318 10.7514 10.7514 10.7531 10.7531 10.9210 10.9210 11.3019 11.3019 11.3941 11.3941 11.3973 11.3973 11.8093 11.8094 k = 0.3333 0.5774 0.5383 ( 14742 PWs) bands (ev): -1.6758 -1.6758 -0.7854 -0.7854 -0.1673 -0.1673 -0.1648 -0.1648 0.3043 0.3043 0.4612 0.4612 0.4634 0.4634 0.6191 0.6191 4.7762 4.7762 4.8032 4.8032 5.2736 5.2736 5.3264 5.3264 5.6350 5.6350 5.9928 5.9928 6.2523 6.2523 6.2951 6.2951 6.3259 6.3259 6.4365 6.4365 6.5737 6.5737 6.8572 6.8572 6.8639 6.8639 6.9667 6.9667 7.1699 7.1699 7.3785 7.3785 7.4607 7.4607 7.7536 7.7536 8.3811 8.3811 8.4954 8.4954 8.4996 8.4996 8.6007 8.6007 8.6270 8.6270 9.2934 9.2934 9.3976 9.3976 9.4073 9.4073 9.5691 9.5691 9.6949 9.6949 9.7083 9.7083 9.9183 9.9183 10.6257 10.6257 10.6755 10.6755 10.6996 10.6996 10.7967 10.7967 10.7983 10.7983 10.9425 10.9425 11.2561 11.2561 11.4097 11.4097 11.4110 11.4110 11.7614 11.7615 k = 0.3333 0.5774 0.5652 ( 14742 PWs) bands (ev): -1.6241 -1.6241 -0.8580 -0.8580 -0.1239 -0.1239 -0.1214 -0.1214 0.3290 0.3290 0.4202 0.4202 0.4224 0.4224 0.6024 0.6024 4.7933 4.7933 4.8221 4.8221 5.2333 5.2333 5.2850 5.2850 5.6513 5.6513 6.0272 6.0272 6.2748 6.2748 6.2952 6.2952 6.3483 6.3483 6.4358 6.4358 6.5869 6.5869 6.8647 6.8647 6.8664 6.8664 6.9758 6.9758 7.1478 7.1478 7.3226 7.3226 7.4126 7.4126 7.7080 7.7080 8.4339 8.4339 8.5417 8.5417 8.5482 8.5482 8.6481 8.6481 8.6731 8.6731 9.3224 9.3224 9.3739 9.3739 9.3840 9.3840 9.5714 9.5714 9.6578 9.6578 9.6742 9.6742 9.7901 9.7901 10.6500 10.6500 10.7533 10.7533 10.7805 10.7805 10.8455 10.8455 10.8502 10.8502 10.9714 10.9714 11.2086 11.2086 11.4192 11.4192 11.4199 11.4199 11.7100 11.7101 k = 0.3333 0.5774 0.5921 ( 14730 PWs) bands (ev): -1.5702 -1.5702 -0.9299 -0.9299 -0.0794 -0.0794 -0.0770 -0.0770 0.3539 0.3539 0.3778 0.3778 0.3800 0.3800 0.5843 0.5843 4.8148 4.8148 4.8454 4.8454 5.1912 5.1912 5.2412 5.2412 5.6714 5.6714 6.0255 6.0255 6.2898 6.2898 6.3076 6.3076 6.3679 6.3679 6.4368 6.4368 6.6340 6.6340 6.8717 6.8717 6.8794 6.8794 6.9846 6.9846 7.1287 7.1287 7.2666 7.2666 7.3652 7.3652 7.6461 7.6461 8.4868 8.4868 8.5913 8.5913 8.5928 8.5928 8.6964 8.6964 8.7155 8.7155 9.3515 9.3515 9.3544 9.3544 9.3658 9.3658 9.5676 9.5676 9.6141 9.6141 9.6363 9.6363 9.6692 9.6692 10.6775 10.6775 10.8334 10.8334 10.8593 10.8593 10.8984 10.8984 10.9067 10.9067 11.0070 11.0070 11.1608 11.1608 11.4194 11.4194 11.4224 11.4224 11.6553 11.6554 k = 0.3333 0.5774 0.6190 ( 14733 PWs) bands (ev): -1.5143 -1.5143 -1.0007 -1.0007 -0.0342 -0.0342 -0.0318 -0.0318 0.3341 0.3341 0.3362 0.3362 0.3792 0.3792 0.5650 0.5650 4.8405 4.8405 4.8728 4.8728 5.1479 5.1479 5.1960 5.1960 5.6959 5.6959 5.9999 5.9999 6.3000 6.3000 6.3197 6.3197 6.3845 6.3845 6.4382 6.4382 6.7088 6.7088 6.8857 6.8857 6.8981 6.8981 6.9902 6.9902 7.1156 7.1156 7.2113 7.2113 7.3195 7.3195 7.5704 7.5704 8.5374 8.5374 8.6344 8.6344 8.6389 8.6389 8.7477 8.7477 8.7498 8.7498 9.3398 9.3398 9.3556 9.3556 9.3807 9.3807 9.5286 9.5286 9.5627 9.5627 9.5895 9.5895 9.5954 9.5954 10.7104 10.7104 10.9084 10.9084 10.9321 10.9321 10.9548 10.9548 10.9684 10.9684 11.0453 11.0453 11.1181 11.1181 11.4101 11.4101 11.4160 11.4160 11.5901 11.5902 k = 0.3333 0.5774 0.6459 ( 14715 PWs) bands (ev): -1.4563 -1.4563 -1.0704 -1.0704 0.0117 0.0117 0.0141 0.0141 0.2894 0.2894 0.2916 0.2916 0.4042 0.4042 0.5446 0.5446 4.8699 4.8699 4.9041 4.9041 5.1042 5.1042 5.1503 5.1503 5.7246 5.7246 5.9625 5.9625 6.3089 6.3089 6.3259 6.3259 6.3985 6.3985 6.4387 6.4387 6.7941 6.7941 6.9070 6.9070 6.9282 6.9282 6.9884 6.9884 7.1126 7.1126 7.1572 7.1572 7.2761 7.2761 7.4835 7.4835 8.5835 8.5835 8.6729 8.6729 8.6753 8.6753 8.7727 8.7727 8.8085 8.8085 9.3246 9.3246 9.3563 9.3563 9.4065 9.4065 9.4316 9.4316 9.5379 9.5379 9.5525 9.5525 9.5529 9.5529 10.7483 10.7483 10.9671 10.9671 10.9960 10.9960 11.0135 11.0135 11.0331 11.0331 11.0563 11.0563 11.1181 11.1181 11.3928 11.3928 11.4025 11.4025 11.5116 11.5116 k = 0.3333 0.5774 0.6729 ( 14763 PWs) bands (ev): -1.3963 -1.3963 -1.1387 -1.1387 0.0580 0.0580 0.0604 0.0604 0.2439 0.2439 0.2461 0.2461 0.4290 0.4290 0.5231 0.5231 4.9029 4.9029 4.9389 4.9389 5.0608 5.0608 5.1049 5.1049 5.7576 5.7576 5.9202 5.9202 6.3164 6.3164 6.3283 6.3283 6.4103 6.4103 6.4374 6.4374 6.8641 6.8641 6.9354 6.9354 6.9764 6.9764 6.9863 6.9863 7.1053 7.1053 7.1217 7.1217 7.2357 7.2357 7.3879 7.3879 8.6238 8.6238 8.6938 8.6938 8.7080 8.7080 8.7820 8.7820 8.8832 8.8832 9.2655 9.2655 9.3690 9.3690 9.3820 9.3820 9.4388 9.4388 9.4967 9.4967 9.5087 9.5087 9.5340 9.5340 10.7904 10.7904 10.9710 10.9710 11.0519 11.0519 11.0586 11.0586 11.0791 11.0791 11.0908 11.0908 11.1673 11.1673 11.3729 11.3729 11.3881 11.3881 11.4351 11.4351 k = 0.3333 0.5774 0.6998 ( 14784 PWs) bands (ev): -1.3345 -1.3345 -1.2056 -1.2056 0.1046 0.1046 0.1069 0.1069 0.1978 0.1978 0.2000 0.2000 0.4534 0.4534 0.5006 0.5006 4.9389 4.9389 4.9769 4.9769 5.0184 5.0184 5.0604 5.0604 5.7944 5.7944 5.8768 5.8768 6.3222 6.3222 6.3282 6.3282 6.4201 6.4201 6.4338 6.4338 6.9063 6.9063 6.9586 6.9586 6.9704 6.9704 7.0563 7.0563 7.0754 7.0754 7.1412 7.1412 7.1989 7.1989 7.2862 7.2862 8.6569 8.6569 8.6948 8.6948 8.7385 8.7385 8.7780 8.7780 8.9701 8.9701 9.1667 9.1667 9.3924 9.3924 9.3932 9.3932 9.4541 9.4541 9.4660 9.4660 9.4674 9.4674 9.5137 9.5137 10.8358 10.8358 10.9304 10.9304 11.0983 11.0983 11.0985 11.0985 11.1178 11.1178 11.1266 11.1266 11.2270 11.2270 11.3613 11.3613 11.3638 11.3638 11.3862 11.3862 k = 0.3333 0.5774 0.7267 ( 14766 PWs) bands (ev): -1.2709 -1.2709 -1.2709 -1.2709 0.1513 0.1513 0.1513 0.1513 0.1536 0.1536 0.1536 0.1536 0.4773 0.4773 0.4773 0.4773 4.9776 4.9776 4.9776 4.9776 5.0175 5.0175 5.0175 5.0175 5.8344 5.8344 5.8344 5.8344 6.3261 6.3261 6.3261 6.3261 6.4280 6.4280 6.4280 6.4280 6.9352 6.9352 6.9352 6.9352 7.0110 7.0110 7.0110 7.0110 7.1632 7.1632 7.1632 7.1632 7.1840 7.1840 7.1840 7.1840 8.6814 8.6814 8.6814 8.6814 8.7627 8.7627 8.7627 8.7627 9.0656 9.0656 9.0656 9.0656 9.4198 9.4198 9.4198 9.4198 9.4265 9.4265 9.4265 9.4265 9.4909 9.4909 9.4909 9.4909 10.8831 10.8831 10.8831 10.8831 11.1241 11.1241 11.1241 11.1241 11.1275 11.1275 11.1275 11.1275 11.2922 11.2922 11.2922 11.2922 11.3802 11.3802 11.3802 11.3802 Writing output data file Zr5Sb3As.save init_run : 0.48s CPU 0.64s WALL ( 1 calls) electrons : 1607.18s CPU 1617.85s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.03s CPU 0.09s WALL ( 1 calls) Called by electrons: c_bands : 1607.16s CPU 1617.84s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.01s WALL ( 1 calls) newd : 0.10s CPU 0.16s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.31s CPU 0.34s WALL ( 210 calls) cegterg : 1499.18s CPU 1508.84s WALL ( 1039 calls) Called by sum_band: Called by *egterg: h_psi : 894.60s CPU 899.98s WALL ( 20552 calls) s_psi : 79.88s CPU 80.37s WALL ( 20552 calls) g_psi : 2.48s CPU 2.36s WALL ( 19303 calls) cdiaghg : 377.14s CPU 381.44s WALL ( 19513 calls) cegterg:over : 83.13s CPU 83.33s WALL ( 19303 calls) cegterg:upda : 85.30s CPU 85.40s WALL ( 19303 calls) cegterg:last : 37.10s CPU 37.01s WALL ( 2083 calls) cdiaghg:chol : 22.93s CPU 22.89s WALL ( 19513 calls) cdiaghg:inve : 16.72s CPU 16.98s WALL ( 19513 calls) cdiaghg:para : 29.63s CPU 30.46s WALL ( 39026 calls) Called by h_psi: h_psi:vloc : 712.88s CPU 717.69s WALL ( 20552 calls) h_psi:vnl : 178.47s CPU 178.79s WALL ( 20552 calls) add_vuspsi : 90.67s CPU 90.80s WALL ( 20552 calls) General routines calbec : 87.70s CPU 87.92s WALL ( 20552 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 674.34s CPU 679.24s WALL ( 2393340 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.23s CPU 0.49s WALL ( 420 calls) Parallel routines fft_scatter : 177.15s CPU 179.75s WALL ( 2393363 calls) PWSCF : 27m30.66s CPU 27m58.90s WALL This run was terminated on: 20: 6:37 27Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=