Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 8:42:30 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 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 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: ./RbYTe2.save/ file Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 5S 5P renormalized file Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 17 10 2 1935 892 116 Max 18 11 3 1952 929 155 Sum 1261 745 211 139775 65289 10277 bravais-lattice index = 14 lattice parameter (alat) = 8.3764 a.u. unit-cell volume = 1985.5320 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 3 number of electrons = 64.00 number of Kohn-Sham states= 76 kinetic-energy cutoff = 39.0000 Ry charge density cutoff = 259.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.376399 celldm(2)= 1.000000 celldm(3)= 3.900984 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 3.900984 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 0.577350 -0.000000 ) b(2) = ( 0.000000 1.154701 -0.000000 ) b(3) = ( 0.000000 0.000000 0.256346 ) PseudoPot. # 1 for Te read from file: /users/gautes/Pseudo/Te.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: d7fe42880ce6991a805b4693d1f2335c Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1245 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Rb read from file: /users/gautes/Pseudo/Rb.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 948b8f0a9070089a35782939cf30e963 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1219 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 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 Te 6.00 127.60000 Te( 1.00) Rb 9.00 85.46780 Rb( 1.00) Y 11.00 88.90590 Y( 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 ) ( 1.9504918 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.9504918 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 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 ) ( 1.9504918 ) 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 ) ( 1.9504918 ) 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 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.9504918 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.9504918 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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 ) ( -1.9504918 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(15) = ( 1.0000000 -0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.9504918 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( -1.9504918 ) 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 ) ( -1.9504918 ) 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 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.9504918 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 1.9504918 ) isym = 23 inv. 180 deg rotation - cryst. axis [0,1,0] cryst. s(23) = ( 1 1 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(23) = ( 0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 24 inv. 180 deg rotation - cryst. axis [1,1,0] cryst. s(24) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(24) = ( 0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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= 265 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0121951 0.0070409 -0.0000000), wk = 0.0037736 k( 3) = ( 0.0243902 0.0140817 -0.0000000), wk = 0.0037736 k( 4) = ( 0.0365854 0.0211226 -0.0000000), wk = 0.0037736 k( 5) = ( 0.0487805 0.0281634 -0.0000000), wk = 0.0037736 k( 6) = ( 0.0609756 0.0352043 -0.0000000), wk = 0.0037736 k( 7) = ( 0.0731707 0.0422451 -0.0000000), wk = 0.0037736 k( 8) = ( 0.0853658 0.0492860 -0.0000000), wk = 0.0037736 k( 9) = ( 0.0975610 0.0563269 -0.0000000), wk = 0.0037736 k( 10) = ( 0.1097561 0.0633677 -0.0000000), wk = 0.0037736 k( 11) = ( 0.1219512 0.0704086 -0.0000000), wk = 0.0037736 k( 12) = ( 0.1341463 0.0774494 -0.0000000), wk = 0.0037736 k( 13) = ( 0.1463415 0.0844903 -0.0000000), wk = 0.0037736 k( 14) = ( 0.1585366 0.0915311 -0.0000000), wk = 0.0037736 k( 15) = ( 0.1707317 0.0985720 -0.0000000), wk = 0.0037736 k( 16) = ( 0.1829268 0.1056129 -0.0000000), wk = 0.0037736 k( 17) = ( 0.1951219 0.1126537 -0.0000000), wk = 0.0037736 k( 18) = ( 0.2073171 0.1196946 -0.0000000), wk = 0.0037736 k( 19) = ( 0.2195122 0.1267354 -0.0000000), wk = 0.0037736 k( 20) = ( 0.2317073 0.1337763 -0.0000000), wk = 0.0037736 k( 21) = ( 0.2439024 0.1408171 -0.0000000), wk = 0.0037736 k( 22) = ( 0.2560976 0.1478580 -0.0000000), wk = 0.0037736 k( 23) = ( 0.2682927 0.1548989 -0.0000000), wk = 0.0037736 k( 24) = ( 0.2804878 0.1619397 -0.0000000), wk = 0.0037736 k( 25) = ( 0.2926829 0.1689806 -0.0000000), wk = 0.0037736 k( 26) = ( 0.3048781 0.1760214 -0.0000000), wk = 0.0037736 k( 27) = ( 0.3170732 0.1830623 -0.0000000), wk = 0.0037736 k( 28) = ( 0.3292683 0.1901031 -0.0000000), wk = 0.0037736 k( 29) = ( 0.3414634 0.1971440 -0.0000000), wk = 0.0037736 k( 30) = ( 0.3536585 0.2041849 -0.0000000), wk = 0.0037736 k( 31) = ( 0.3658537 0.2112257 -0.0000000), wk = 0.0037736 k( 32) = ( 0.3780488 0.2182666 -0.0000000), wk = 0.0037736 k( 33) = ( 0.3902439 0.2253074 -0.0000000), wk = 0.0037736 k( 34) = ( 0.4024390 0.2323483 -0.0000000), wk = 0.0037736 k( 35) = ( 0.4146341 0.2393891 -0.0000000), wk = 0.0037736 k( 36) = ( 0.4268293 0.2464300 -0.0000000), wk = 0.0037736 k( 37) = ( 0.4390244 0.2534708 -0.0000000), wk = 0.0037736 k( 38) = ( 0.4512195 0.2605117 -0.0000000), wk = 0.0037736 k( 39) = ( 0.4634146 0.2675526 -0.0000000), wk = 0.0037736 k( 40) = ( 0.4756098 0.2745934 -0.0000000), wk = 0.0037736 k( 41) = ( 0.4878049 0.2816343 -0.0000000), wk = 0.0037736 k( 42) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037736 k( 43) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037736 k( 44) = ( 0.4930556 0.3007033 -0.0000000), wk = 0.0037736 k( 45) = ( 0.4861111 0.3127314 -0.0000000), wk = 0.0037736 k( 46) = ( 0.4791667 0.3247595 -0.0000000), wk = 0.0037736 k( 47) = ( 0.4722222 0.3367877 -0.0000000), wk = 0.0037736 k( 48) = ( 0.4652778 0.3488158 -0.0000000), wk = 0.0037736 k( 49) = ( 0.4583333 0.3608439 -0.0000000), wk = 0.0037736 k( 50) = ( 0.4513889 0.3728720 -0.0000000), wk = 0.0037736 k( 51) = ( 0.4444444 0.3849002 -0.0000000), wk = 0.0037736 k( 52) = ( 0.4375000 0.3969283 -0.0000000), wk = 0.0037736 k( 53) = ( 0.4305556 0.4089564 -0.0000000), wk = 0.0037736 k( 54) = ( 0.4236111 0.4209846 -0.0000000), wk = 0.0037736 k( 55) = ( 0.4166667 0.4330127 -0.0000000), wk = 0.0037736 k( 56) = ( 0.4097222 0.4450408 -0.0000000), wk = 0.0037736 k( 57) = ( 0.4027778 0.4570690 -0.0000000), wk = 0.0037736 k( 58) = ( 0.3958333 0.4690971 -0.0000000), wk = 0.0037736 k( 59) = ( 0.3888889 0.4811252 -0.0000000), wk = 0.0037736 k( 60) = ( 0.3819444 0.4931534 -0.0000000), wk = 0.0037736 k( 61) = ( 0.3750000 0.5051815 -0.0000000), wk = 0.0037736 k( 62) = ( 0.3680556 0.5172096 -0.0000000), wk = 0.0037736 k( 63) = ( 0.3611111 0.5292377 -0.0000000), wk = 0.0037736 k( 64) = ( 0.3541667 0.5412659 -0.0000000), wk = 0.0037736 k( 65) = ( 0.3472222 0.5532940 -0.0000000), wk = 0.0037736 k( 66) = ( 0.3402778 0.5653221 -0.0000000), wk = 0.0037736 k( 67) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037736 k( 68) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037736 k( 69) = ( 0.3263889 0.5653221 -0.0000000), wk = 0.0037736 k( 70) = ( 0.3194444 0.5532940 -0.0000000), wk = 0.0037736 k( 71) = ( 0.3125000 0.5412659 -0.0000000), wk = 0.0037736 k( 72) = ( 0.3055556 0.5292378 -0.0000000), wk = 0.0037736 k( 73) = ( 0.2986111 0.5172096 -0.0000000), wk = 0.0037736 k( 74) = ( 0.2916667 0.5051815 -0.0000000), wk = 0.0037736 k( 75) = ( 0.2847222 0.4931534 -0.0000000), wk = 0.0037736 k( 76) = ( 0.2777778 0.4811252 -0.0000000), wk = 0.0037736 k( 77) = ( 0.2708333 0.4690971 -0.0000000), wk = 0.0037736 k( 78) = ( 0.2638889 0.4570690 -0.0000000), wk = 0.0037736 k( 79) = ( 0.2569444 0.4450408 -0.0000000), wk = 0.0037736 k( 80) = ( 0.2500000 0.4330127 -0.0000000), wk = 0.0037736 k( 81) = ( 0.2430556 0.4209846 -0.0000000), wk = 0.0037736 k( 82) = ( 0.2361111 0.4089564 -0.0000000), wk = 0.0037736 k( 83) = ( 0.2291667 0.3969283 -0.0000000), wk = 0.0037736 k( 84) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0037736 k( 85) = ( 0.2152778 0.3728721 -0.0000000), wk = 0.0037736 k( 86) = ( 0.2083333 0.3608439 -0.0000000), wk = 0.0037736 k( 87) = ( 0.2013889 0.3488158 -0.0000000), wk = 0.0037736 k( 88) = ( 0.1944444 0.3367876 -0.0000000), wk = 0.0037736 k( 89) = ( 0.1875000 0.3247595 -0.0000000), wk = 0.0037736 k( 90) = ( 0.1805556 0.3127314 -0.0000000), wk = 0.0037736 k( 91) = ( 0.1736111 0.3007033 -0.0000000), wk = 0.0037736 k( 92) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0037736 k( 93) = ( 0.1597222 0.2766470 -0.0000000), wk = 0.0037736 k( 94) = ( 0.1527778 0.2646189 -0.0000000), wk = 0.0037736 k( 95) = ( 0.1458333 0.2525907 -0.0000000), wk = 0.0037736 k( 96) = ( 0.1388889 0.2405626 -0.0000000), wk = 0.0037736 k( 97) = ( 0.1319444 0.2285345 -0.0000000), wk = 0.0037736 k( 98) = ( 0.1250000 0.2165064 -0.0000000), wk = 0.0037736 k( 99) = ( 0.1180556 0.2044782 -0.0000000), wk = 0.0037736 k( 100) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0037736 k( 101) = ( 0.1041667 0.1804220 -0.0000000), wk = 0.0037736 k( 102) = ( 0.0972222 0.1683938 -0.0000000), wk = 0.0037736 k( 103) = ( 0.0902778 0.1563657 -0.0000000), wk = 0.0037736 k( 104) = ( 0.0833333 0.1443376 -0.0000000), wk = 0.0037736 k( 105) = ( 0.0763889 0.1323094 -0.0000000), wk = 0.0037736 k( 106) = ( 0.0694444 0.1202813 -0.0000000), wk = 0.0037736 k( 107) = ( 0.0625000 0.1082532 -0.0000000), wk = 0.0037736 k( 108) = ( 0.0555556 0.0962251 -0.0000000), wk = 0.0037736 k( 109) = ( 0.0486111 0.0841969 -0.0000000), wk = 0.0037736 k( 110) = ( 0.0416667 0.0721688 -0.0000000), wk = 0.0037736 k( 111) = ( 0.0347222 0.0601406 -0.0000000), wk = 0.0037736 k( 112) = ( 0.0277778 0.0481125 -0.0000000), wk = 0.0037736 k( 113) = ( 0.0208333 0.0360844 -0.0000000), wk = 0.0037736 k( 114) = ( 0.0138889 0.0240563 -0.0000000), wk = 0.0037736 k( 115) = ( 0.0069444 0.0120281 -0.0000000), wk = 0.0037736 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 118) = ( 0.0000000 0.0000000 0.0128173), wk = 0.0037736 k( 119) = ( 0.0000000 0.0000000 0.0256346), wk = 0.0037736 k( 120) = ( 0.0000000 0.0000000 0.0384518), wk = 0.0037736 k( 121) = ( 0.0000000 0.0000000 0.0512691), wk = 0.0037736 k( 122) = ( 0.0000000 0.0000000 0.0640864), wk = 0.0037736 k( 123) = ( 0.0000000 0.0000000 0.0769037), wk = 0.0037736 k( 124) = ( 0.0000000 0.0000000 0.0897210), wk = 0.0037736 k( 125) = ( 0.0000000 0.0000000 0.1025382), wk = 0.0037736 k( 126) = ( 0.0000000 0.0000000 0.1153555), wk = 0.0037736 k( 127) = ( 0.0000000 0.0000000 0.1281728), wk = 0.0037736 k( 128) = ( 0.0000000 0.0000000 0.1281728), wk = 0.0037736 k( 129) = ( 0.0121951 0.0070409 0.1281728), wk = 0.0037736 k( 130) = ( 0.0243902 0.0140817 0.1281728), wk = 0.0037736 k( 131) = ( 0.0365854 0.0211226 0.1281728), wk = 0.0037736 k( 132) = ( 0.0487805 0.0281634 0.1281728), wk = 0.0037736 k( 133) = ( 0.0609756 0.0352043 0.1281728), wk = 0.0037736 k( 134) = ( 0.0731707 0.0422451 0.1281728), wk = 0.0037736 k( 135) = ( 0.0853658 0.0492860 0.1281728), wk = 0.0037736 k( 136) = ( 0.0975610 0.0563269 0.1281728), wk = 0.0037736 k( 137) = ( 0.1097561 0.0633677 0.1281728), wk = 0.0037736 k( 138) = ( 0.1219512 0.0704086 0.1281728), wk = 0.0037736 k( 139) = ( 0.1341463 0.0774494 0.1281728), wk = 0.0037736 k( 140) = ( 0.1463415 0.0844903 0.1281728), wk = 0.0037736 k( 141) = ( 0.1585366 0.0915311 0.1281728), wk = 0.0037736 k( 142) = ( 0.1707317 0.0985720 0.1281728), wk = 0.0037736 k( 143) = ( 0.1829268 0.1056129 0.1281728), wk = 0.0037736 k( 144) = ( 0.1951219 0.1126537 0.1281728), wk = 0.0037736 k( 145) = ( 0.2073171 0.1196946 0.1281728), wk = 0.0037736 k( 146) = ( 0.2195122 0.1267354 0.1281728), wk = 0.0037736 k( 147) = ( 0.2317073 0.1337763 0.1281728), wk = 0.0037736 k( 148) = ( 0.2439024 0.1408171 0.1281728), wk = 0.0037736 k( 149) = ( 0.2560976 0.1478580 0.1281728), wk = 0.0037736 k( 150) = ( 0.2682927 0.1548989 0.1281728), wk = 0.0037736 k( 151) = ( 0.2804878 0.1619397 0.1281728), wk = 0.0037736 k( 152) = ( 0.2926829 0.1689806 0.1281728), wk = 0.0037736 k( 153) = ( 0.3048781 0.1760214 0.1281728), wk = 0.0037736 k( 154) = ( 0.3170732 0.1830623 0.1281728), wk = 0.0037736 k( 155) = ( 0.3292683 0.1901031 0.1281728), wk = 0.0037736 k( 156) = ( 0.3414634 0.1971440 0.1281728), wk = 0.0037736 k( 157) = ( 0.3536585 0.2041849 0.1281728), wk = 0.0037736 k( 158) = ( 0.3658537 0.2112257 0.1281728), wk = 0.0037736 k( 159) = ( 0.3780488 0.2182666 0.1281728), wk = 0.0037736 k( 160) = ( 0.3902439 0.2253074 0.1281728), wk = 0.0037736 k( 161) = ( 0.4024390 0.2323483 0.1281728), wk = 0.0037736 k( 162) = ( 0.4146341 0.2393891 0.1281728), wk = 0.0037736 k( 163) = ( 0.4268293 0.2464300 0.1281728), wk = 0.0037736 k( 164) = ( 0.4390244 0.2534708 0.1281728), wk = 0.0037736 k( 165) = ( 0.4512195 0.2605117 0.1281728), wk = 0.0037736 k( 166) = ( 0.4634146 0.2675526 0.1281728), wk = 0.0037736 k( 167) = ( 0.4756098 0.2745934 0.1281728), wk = 0.0037736 k( 168) = ( 0.4878049 0.2816343 0.1281728), wk = 0.0037736 k( 169) = ( 0.5000000 0.2886751 0.1281728), wk = 0.0037736 k( 170) = ( 0.5000000 0.2886751 0.1281728), wk = 0.0037736 k( 171) = ( 0.4930556 0.3007033 0.1281728), wk = 0.0037736 k( 172) = ( 0.4861111 0.3127314 0.1281728), wk = 0.0037736 k( 173) = ( 0.4791667 0.3247595 0.1281728), wk = 0.0037736 k( 174) = ( 0.4722222 0.3367877 0.1281728), wk = 0.0037736 k( 175) = ( 0.4652778 0.3488158 0.1281728), wk = 0.0037736 k( 176) = ( 0.4583333 0.3608439 0.1281728), wk = 0.0037736 k( 177) = ( 0.4513889 0.3728720 0.1281728), wk = 0.0037736 k( 178) = ( 0.4444444 0.3849002 0.1281728), wk = 0.0037736 k( 179) = ( 0.4375000 0.3969283 0.1281728), wk = 0.0037736 k( 180) = ( 0.4305556 0.4089564 0.1281728), wk = 0.0037736 k( 181) = ( 0.4236111 0.4209846 0.1281728), wk = 0.0037736 k( 182) = ( 0.4166667 0.4330127 0.1281728), wk = 0.0037736 k( 183) = ( 0.4097222 0.4450408 0.1281728), wk = 0.0037736 k( 184) = ( 0.4027778 0.4570690 0.1281728), wk = 0.0037736 k( 185) = ( 0.3958333 0.4690971 0.1281728), wk = 0.0037736 k( 186) = ( 0.3888889 0.4811252 0.1281728), wk = 0.0037736 k( 187) = ( 0.3819444 0.4931534 0.1281728), wk = 0.0037736 k( 188) = ( 0.3750000 0.5051815 0.1281728), wk = 0.0037736 k( 189) = ( 0.3680556 0.5172096 0.1281728), wk = 0.0037736 k( 190) = ( 0.3611111 0.5292377 0.1281728), wk = 0.0037736 k( 191) = ( 0.3541667 0.5412659 0.1281728), wk = 0.0037736 k( 192) = ( 0.3472222 0.5532940 0.1281728), wk = 0.0037736 k( 193) = ( 0.3402778 0.5653221 0.1281728), wk = 0.0037736 k( 194) = ( 0.3333333 0.5773503 0.1281728), wk = 0.0037736 k( 195) = ( 0.3333333 0.5773503 0.1281728), wk = 0.0037736 k( 196) = ( 0.3263889 0.5653221 0.1281728), wk = 0.0037736 k( 197) = ( 0.3194444 0.5532940 0.1281728), wk = 0.0037736 k( 198) = ( 0.3125000 0.5412659 0.1281728), wk = 0.0037736 k( 199) = ( 0.3055556 0.5292378 0.1281728), wk = 0.0037736 k( 200) = ( 0.2986111 0.5172096 0.1281728), wk = 0.0037736 k( 201) = ( 0.2916667 0.5051815 0.1281728), wk = 0.0037736 k( 202) = ( 0.2847222 0.4931534 0.1281728), wk = 0.0037736 k( 203) = ( 0.2777778 0.4811252 0.1281728), wk = 0.0037736 k( 204) = ( 0.2708333 0.4690971 0.1281728), wk = 0.0037736 k( 205) = ( 0.2638889 0.4570690 0.1281728), wk = 0.0037736 k( 206) = ( 0.2569444 0.4450408 0.1281728), wk = 0.0037736 k( 207) = ( 0.2500000 0.4330127 0.1281728), wk = 0.0037736 k( 208) = ( 0.2430556 0.4209846 0.1281728), wk = 0.0037736 k( 209) = ( 0.2361111 0.4089564 0.1281728), wk = 0.0037736 k( 210) = ( 0.2291667 0.3969283 0.1281728), wk = 0.0037736 k( 211) = ( 0.2222222 0.3849002 0.1281728), wk = 0.0037736 k( 212) = ( 0.2152778 0.3728721 0.1281728), wk = 0.0037736 k( 213) = ( 0.2083333 0.3608439 0.1281728), wk = 0.0037736 k( 214) = ( 0.2013889 0.3488158 0.1281728), wk = 0.0037736 k( 215) = ( 0.1944444 0.3367876 0.1281728), wk = 0.0037736 k( 216) = ( 0.1875000 0.3247595 0.1281728), wk = 0.0037736 k( 217) = ( 0.1805556 0.3127314 0.1281728), wk = 0.0037736 k( 218) = ( 0.1736111 0.3007033 0.1281728), wk = 0.0037736 k( 219) = ( 0.1666667 0.2886751 0.1281728), wk = 0.0037736 k( 220) = ( 0.1597222 0.2766470 0.1281728), wk = 0.0037736 k( 221) = ( 0.1527778 0.2646189 0.1281728), wk = 0.0037736 k( 222) = ( 0.1458333 0.2525907 0.1281728), wk = 0.0037736 k( 223) = ( 0.1388889 0.2405626 0.1281728), wk = 0.0037736 k( 224) = ( 0.1319444 0.2285345 0.1281728), wk = 0.0037736 k( 225) = ( 0.1250000 0.2165064 0.1281728), wk = 0.0037736 k( 226) = ( 0.1180556 0.2044782 0.1281728), wk = 0.0037736 k( 227) = ( 0.1111111 0.1924501 0.1281728), wk = 0.0037736 k( 228) = ( 0.1041667 0.1804220 0.1281728), wk = 0.0037736 k( 229) = ( 0.0972222 0.1683938 0.1281728), wk = 0.0037736 k( 230) = ( 0.0902778 0.1563657 0.1281728), wk = 0.0037736 k( 231) = ( 0.0833333 0.1443376 0.1281728), wk = 0.0037736 k( 232) = ( 0.0763889 0.1323094 0.1281728), wk = 0.0037736 k( 233) = ( 0.0694444 0.1202813 0.1281728), wk = 0.0037736 k( 234) = ( 0.0625000 0.1082532 0.1281728), wk = 0.0037736 k( 235) = ( 0.0555556 0.0962251 0.1281728), wk = 0.0037736 k( 236) = ( 0.0486111 0.0841969 0.1281728), wk = 0.0037736 k( 237) = ( 0.0416667 0.0721688 0.1281728), wk = 0.0037736 k( 238) = ( 0.0347222 0.0601406 0.1281728), wk = 0.0037736 k( 239) = ( 0.0277778 0.0481125 0.1281728), wk = 0.0037736 k( 240) = ( 0.0208333 0.0360844 0.1281728), wk = 0.0037736 k( 241) = ( 0.0138889 0.0240563 0.1281728), wk = 0.0037736 k( 242) = ( 0.0069444 0.0120281 0.1281728), wk = 0.0037736 k( 243) = ( 0.0000000 0.0000000 0.1281728), wk = 0.0037736 k( 244) = ( 0.5000000 0.2886751 0.1281728), wk = 0.0037736 k( 245) = ( 0.5000000 0.2886751 0.1153555), wk = 0.0037736 k( 246) = ( 0.5000000 0.2886751 0.1025382), wk = 0.0037736 k( 247) = ( 0.5000000 0.2886751 0.0897210), wk = 0.0037736 k( 248) = ( 0.5000000 0.2886751 0.0769037), wk = 0.0037736 k( 249) = ( 0.5000000 0.2886751 0.0640864), wk = 0.0037736 k( 250) = ( 0.5000000 0.2886751 0.0512691), wk = 0.0037736 k( 251) = ( 0.5000000 0.2886751 0.0384518), wk = 0.0037736 k( 252) = ( 0.5000000 0.2886751 0.0256346), wk = 0.0037736 k( 253) = ( 0.5000000 0.2886751 0.0128173), wk = 0.0037736 k( 254) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037736 k( 255) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037736 k( 256) = ( 0.3333333 0.5773503 0.0128173), wk = 0.0037736 k( 257) = ( 0.3333333 0.5773503 0.0256346), wk = 0.0037736 k( 258) = ( 0.3333333 0.5773503 0.0384518), wk = 0.0037736 k( 259) = ( 0.3333333 0.5773503 0.0512691), wk = 0.0037736 k( 260) = ( 0.3333333 0.5773503 0.0640864), wk = 0.0037736 k( 261) = ( 0.3333333 0.5773503 0.0769037), wk = 0.0037736 k( 262) = ( 0.3333333 0.5773503 0.0897210), wk = 0.0037736 k( 263) = ( 0.3333333 0.5773503 0.1025382), wk = 0.0037736 k( 264) = ( 0.3333333 0.5773503 0.1153555), wk = 0.0037736 k( 265) = ( 0.3333333 0.5773503 0.1281728), wk = 0.0037736 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 2) = ( 0.0121951 0.0000000 0.0000000), wk = 0.0037736 k( 3) = ( 0.0243902 0.0000000 0.0000000), wk = 0.0037736 k( 4) = ( 0.0365854 0.0000000 0.0000000), wk = 0.0037736 k( 5) = ( 0.0487805 0.0000000 0.0000000), wk = 0.0037736 k( 6) = ( 0.0609756 -0.0000000 0.0000000), wk = 0.0037736 k( 7) = ( 0.0731707 0.0000000 0.0000000), wk = 0.0037736 k( 8) = ( 0.0853658 -0.0000000 0.0000000), wk = 0.0037736 k( 9) = ( 0.0975610 0.0000000 0.0000000), wk = 0.0037736 k( 10) = ( 0.1097561 0.0000000 0.0000000), wk = 0.0037736 k( 11) = ( 0.1219512 -0.0000000 0.0000000), wk = 0.0037736 k( 12) = ( 0.1341463 0.0000000 0.0000000), wk = 0.0037736 k( 13) = ( 0.1463415 0.0000000 0.0000000), wk = 0.0037736 k( 14) = ( 0.1585366 -0.0000000 0.0000000), wk = 0.0037736 k( 15) = ( 0.1707317 -0.0000000 0.0000000), wk = 0.0037736 k( 16) = ( 0.1829268 -0.0000000 0.0000000), wk = 0.0037736 k( 17) = ( 0.1951219 0.0000000 0.0000000), wk = 0.0037736 k( 18) = ( 0.2073171 -0.0000000 0.0000000), wk = 0.0037736 k( 19) = ( 0.2195122 0.0000000 0.0000000), wk = 0.0037736 k( 20) = ( 0.2317073 -0.0000000 0.0000000), wk = 0.0037736 k( 21) = ( 0.2439024 -0.0000000 0.0000000), wk = 0.0037736 k( 22) = ( 0.2560976 0.0000000 0.0000000), wk = 0.0037736 k( 23) = ( 0.2682927 0.0000000 0.0000000), wk = 0.0037736 k( 24) = ( 0.2804878 0.0000000 -0.0000000), wk = 0.0037736 k( 25) = ( 0.2926829 -0.0000000 0.0000000), wk = 0.0037736 k( 26) = ( 0.3048781 0.0000000 -0.0000000), wk = 0.0037736 k( 27) = ( 0.3170732 0.0000000 0.0000000), wk = 0.0037736 k( 28) = ( 0.3292683 -0.0000000 -0.0000000), wk = 0.0037736 k( 29) = ( 0.3414634 -0.0000000 0.0000000), wk = 0.0037736 k( 30) = ( 0.3536585 -0.0000000 0.0000000), wk = 0.0037736 k( 31) = ( 0.3658537 -0.0000000 0.0000000), wk = 0.0037736 k( 32) = ( 0.3780488 0.0000000 0.0000000), wk = 0.0037736 k( 33) = ( 0.3902439 0.0000000 0.0000000), wk = 0.0037736 k( 34) = ( 0.4024390 0.0000000 0.0000000), wk = 0.0037736 k( 35) = ( 0.4146341 0.0000000 0.0000000), wk = 0.0037736 k( 36) = ( 0.4268293 -0.0000000 -0.0000000), wk = 0.0037736 k( 37) = ( 0.4390244 0.0000000 0.0000000), wk = 0.0037736 k( 38) = ( 0.4512195 -0.0000000 0.0000000), wk = 0.0037736 k( 39) = ( 0.4634146 -0.0000000 0.0000000), wk = 0.0037736 k( 40) = ( 0.4756098 -0.0000000 -0.0000000), wk = 0.0037736 k( 41) = ( 0.4878049 -0.0000000 0.0000000), wk = 0.0037736 k( 42) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 43) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 44) = ( 0.4930556 0.0138889 0.0000000), wk = 0.0037736 k( 45) = ( 0.4861111 0.0277778 0.0000000), wk = 0.0037736 k( 46) = ( 0.4791667 0.0416667 0.0000000), wk = 0.0037736 k( 47) = ( 0.4722222 0.0555556 -0.0000000), wk = 0.0037736 k( 48) = ( 0.4652778 0.0694444 0.0000000), wk = 0.0037736 k( 49) = ( 0.4583333 0.0833333 0.0000000), wk = 0.0037736 k( 50) = ( 0.4513889 0.0972222 0.0000000), wk = 0.0037736 k( 51) = ( 0.4444444 0.1111111 0.0000000), wk = 0.0037736 k( 52) = ( 0.4375000 0.1250000 0.0000000), wk = 0.0037736 k( 53) = ( 0.4305556 0.1388889 -0.0000000), wk = 0.0037736 k( 54) = ( 0.4236111 0.1527778 -0.0000000), wk = 0.0037736 k( 55) = ( 0.4166667 0.1666667 -0.0000000), wk = 0.0037736 k( 56) = ( 0.4097222 0.1805556 -0.0000000), wk = 0.0037736 k( 57) = ( 0.4027778 0.1944444 0.0000000), wk = 0.0037736 k( 58) = ( 0.3958333 0.2083333 0.0000000), wk = 0.0037736 k( 59) = ( 0.3888889 0.2222222 0.0000000), wk = 0.0037736 k( 60) = ( 0.3819444 0.2361111 0.0000000), wk = 0.0037736 k( 61) = ( 0.3750000 0.2500000 0.0000000), wk = 0.0037736 k( 62) = ( 0.3680556 0.2638889 0.0000000), wk = 0.0037736 k( 63) = ( 0.3611111 0.2777778 0.0000000), wk = 0.0037736 k( 64) = ( 0.3541667 0.2916667 0.0000000), wk = 0.0037736 k( 65) = ( 0.3472222 0.3055556 0.0000000), wk = 0.0037736 k( 66) = ( 0.3402778 0.3194444 -0.0000000), wk = 0.0037736 k( 67) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0037736 k( 68) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0037736 k( 69) = ( 0.3263889 0.3263889 -0.0000000), wk = 0.0037736 k( 70) = ( 0.3194444 0.3194444 -0.0000000), wk = 0.0037736 k( 71) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0037736 k( 72) = ( 0.3055556 0.3055556 0.0000000), wk = 0.0037736 k( 73) = ( 0.2986111 0.2986111 0.0000000), wk = 0.0037736 k( 74) = ( 0.2916667 0.2916667 -0.0000000), wk = 0.0037736 k( 75) = ( 0.2847222 0.2847222 -0.0000000), wk = 0.0037736 k( 76) = ( 0.2777778 0.2777778 0.0000000), wk = 0.0037736 k( 77) = ( 0.2708333 0.2708333 0.0000000), wk = 0.0037736 k( 78) = ( 0.2638889 0.2638889 0.0000000), wk = 0.0037736 k( 79) = ( 0.2569444 0.2569444 0.0000000), wk = 0.0037736 k( 80) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0037736 k( 81) = ( 0.2430556 0.2430556 0.0000000), wk = 0.0037736 k( 82) = ( 0.2361111 0.2361111 0.0000000), wk = 0.0037736 k( 83) = ( 0.2291667 0.2291667 0.0000000), wk = 0.0037736 k( 84) = ( 0.2222222 0.2222222 0.0000000), wk = 0.0037736 k( 85) = ( 0.2152778 0.2152778 0.0000000), wk = 0.0037736 k( 86) = ( 0.2083333 0.2083333 0.0000000), wk = 0.0037736 k( 87) = ( 0.2013889 0.2013889 0.0000000), wk = 0.0037736 k( 88) = ( 0.1944444 0.1944444 0.0000000), wk = 0.0037736 k( 89) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0037736 k( 90) = ( 0.1805556 0.1805556 0.0000000), wk = 0.0037736 k( 91) = ( 0.1736111 0.1736111 0.0000000), wk = 0.0037736 k( 92) = ( 0.1666667 0.1666667 -0.0000000), wk = 0.0037736 k( 93) = ( 0.1597222 0.1597222 -0.0000000), wk = 0.0037736 k( 94) = ( 0.1527778 0.1527778 0.0000000), wk = 0.0037736 k( 95) = ( 0.1458333 0.1458333 0.0000000), wk = 0.0037736 k( 96) = ( 0.1388889 0.1388889 0.0000000), wk = 0.0037736 k( 97) = ( 0.1319444 0.1319444 0.0000000), wk = 0.0037736 k( 98) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0037736 k( 99) = ( 0.1180556 0.1180556 -0.0000000), wk = 0.0037736 k( 100) = ( 0.1111111 0.1111111 0.0000000), wk = 0.0037736 k( 101) = ( 0.1041667 0.1041667 0.0000000), wk = 0.0037736 k( 102) = ( 0.0972222 0.0972222 0.0000000), wk = 0.0037736 k( 103) = ( 0.0902778 0.0902778 0.0000000), wk = 0.0037736 k( 104) = ( 0.0833333 0.0833333 0.0000000), wk = 0.0037736 k( 105) = ( 0.0763889 0.0763889 0.0000000), wk = 0.0037736 k( 106) = ( 0.0694444 0.0694444 0.0000000), wk = 0.0037736 k( 107) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0037736 k( 108) = ( 0.0555556 0.0555556 0.0000000), wk = 0.0037736 k( 109) = ( 0.0486111 0.0486111 0.0000000), wk = 0.0037736 k( 110) = ( 0.0416667 0.0416667 0.0000000), wk = 0.0037736 k( 111) = ( 0.0347222 0.0347222 0.0000000), wk = 0.0037736 k( 112) = ( 0.0277778 0.0277778 0.0000000), wk = 0.0037736 k( 113) = ( 0.0208333 0.0208333 0.0000000), wk = 0.0037736 k( 114) = ( 0.0138889 0.0138889 0.0000000), wk = 0.0037736 k( 115) = ( 0.0069444 0.0069444 0.0000000), wk = 0.0037736 k( 116) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 117) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037736 k( 118) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0037736 k( 119) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0037736 k( 120) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0037736 k( 121) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0037736 k( 122) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0037736 k( 123) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0037736 k( 124) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0037736 k( 125) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0037736 k( 126) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0037736 k( 127) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 128) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 129) = ( 0.0121951 0.0000000 0.5000000), wk = 0.0037736 k( 130) = ( 0.0243902 0.0000000 0.5000000), wk = 0.0037736 k( 131) = ( 0.0365854 0.0000000 0.5000000), wk = 0.0037736 k( 132) = ( 0.0487805 0.0000000 0.5000000), wk = 0.0037736 k( 133) = ( 0.0609756 -0.0000000 0.5000000), wk = 0.0037736 k( 134) = ( 0.0731707 0.0000000 0.5000000), wk = 0.0037736 k( 135) = ( 0.0853658 -0.0000000 0.5000000), wk = 0.0037736 k( 136) = ( 0.0975610 0.0000000 0.5000000), wk = 0.0037736 k( 137) = ( 0.1097561 0.0000000 0.5000000), wk = 0.0037736 k( 138) = ( 0.1219512 -0.0000000 0.5000000), wk = 0.0037736 k( 139) = ( 0.1341463 0.0000000 0.5000000), wk = 0.0037736 k( 140) = ( 0.1463415 0.0000000 0.5000000), wk = 0.0037736 k( 141) = ( 0.1585366 -0.0000000 0.5000000), wk = 0.0037736 k( 142) = ( 0.1707317 -0.0000000 0.5000000), wk = 0.0037736 k( 143) = ( 0.1829268 -0.0000000 0.5000000), wk = 0.0037736 k( 144) = ( 0.1951219 0.0000000 0.5000000), wk = 0.0037736 k( 145) = ( 0.2073171 -0.0000000 0.5000000), wk = 0.0037736 k( 146) = ( 0.2195122 0.0000000 0.5000000), wk = 0.0037736 k( 147) = ( 0.2317073 -0.0000000 0.5000000), wk = 0.0037736 k( 148) = ( 0.2439024 -0.0000000 0.5000000), wk = 0.0037736 k( 149) = ( 0.2560976 0.0000000 0.5000000), wk = 0.0037736 k( 150) = ( 0.2682927 0.0000000 0.5000000), wk = 0.0037736 k( 151) = ( 0.2804878 0.0000000 0.5000000), wk = 0.0037736 k( 152) = ( 0.2926829 -0.0000000 0.5000000), wk = 0.0037736 k( 153) = ( 0.3048781 0.0000000 0.5000000), wk = 0.0037736 k( 154) = ( 0.3170732 0.0000000 0.5000000), wk = 0.0037736 k( 155) = ( 0.3292683 -0.0000000 0.5000000), wk = 0.0037736 k( 156) = ( 0.3414634 -0.0000000 0.5000000), wk = 0.0037736 k( 157) = ( 0.3536585 -0.0000000 0.5000000), wk = 0.0037736 k( 158) = ( 0.3658537 -0.0000000 0.5000000), wk = 0.0037736 k( 159) = ( 0.3780488 0.0000000 0.5000000), wk = 0.0037736 k( 160) = ( 0.3902439 0.0000000 0.5000000), wk = 0.0037736 k( 161) = ( 0.4024390 0.0000000 0.5000000), wk = 0.0037736 k( 162) = ( 0.4146341 0.0000000 0.5000000), wk = 0.0037736 k( 163) = ( 0.4268293 -0.0000000 0.5000000), wk = 0.0037736 k( 164) = ( 0.4390244 0.0000000 0.5000000), wk = 0.0037736 k( 165) = ( 0.4512195 -0.0000000 0.5000000), wk = 0.0037736 k( 166) = ( 0.4634146 -0.0000000 0.5000000), wk = 0.0037736 k( 167) = ( 0.4756098 -0.0000000 0.5000000), wk = 0.0037736 k( 168) = ( 0.4878049 -0.0000000 0.5000000), wk = 0.0037736 k( 169) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037736 k( 170) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037736 k( 171) = ( 0.4930556 0.0138889 0.5000000), wk = 0.0037736 k( 172) = ( 0.4861111 0.0277778 0.5000000), wk = 0.0037736 k( 173) = ( 0.4791667 0.0416667 0.5000000), wk = 0.0037736 k( 174) = ( 0.4722222 0.0555556 0.5000000), wk = 0.0037736 k( 175) = ( 0.4652778 0.0694444 0.5000000), wk = 0.0037736 k( 176) = ( 0.4583333 0.0833333 0.5000000), wk = 0.0037736 k( 177) = ( 0.4513889 0.0972222 0.5000000), wk = 0.0037736 k( 178) = ( 0.4444444 0.1111111 0.5000000), wk = 0.0037736 k( 179) = ( 0.4375000 0.1250000 0.5000000), wk = 0.0037736 k( 180) = ( 0.4305556 0.1388889 0.5000000), wk = 0.0037736 k( 181) = ( 0.4236111 0.1527778 0.5000000), wk = 0.0037736 k( 182) = ( 0.4166667 0.1666667 0.5000000), wk = 0.0037736 k( 183) = ( 0.4097222 0.1805556 0.5000000), wk = 0.0037736 k( 184) = ( 0.4027778 0.1944444 0.5000000), wk = 0.0037736 k( 185) = ( 0.3958333 0.2083333 0.5000000), wk = 0.0037736 k( 186) = ( 0.3888889 0.2222222 0.5000000), wk = 0.0037736 k( 187) = ( 0.3819444 0.2361111 0.5000000), wk = 0.0037736 k( 188) = ( 0.3750000 0.2500000 0.5000000), wk = 0.0037736 k( 189) = ( 0.3680556 0.2638889 0.5000000), wk = 0.0037736 k( 190) = ( 0.3611111 0.2777778 0.5000000), wk = 0.0037736 k( 191) = ( 0.3541667 0.2916667 0.5000000), wk = 0.0037736 k( 192) = ( 0.3472222 0.3055556 0.5000000), wk = 0.0037736 k( 193) = ( 0.3402778 0.3194444 0.5000000), wk = 0.0037736 k( 194) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037736 k( 195) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037736 k( 196) = ( 0.3263889 0.3263889 0.5000000), wk = 0.0037736 k( 197) = ( 0.3194444 0.3194444 0.5000000), wk = 0.0037736 k( 198) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0037736 k( 199) = ( 0.3055556 0.3055556 0.5000000), wk = 0.0037736 k( 200) = ( 0.2986111 0.2986111 0.5000000), wk = 0.0037736 k( 201) = ( 0.2916667 0.2916667 0.5000000), wk = 0.0037736 k( 202) = ( 0.2847222 0.2847222 0.5000000), wk = 0.0037736 k( 203) = ( 0.2777778 0.2777778 0.5000000), wk = 0.0037736 k( 204) = ( 0.2708333 0.2708333 0.5000000), wk = 0.0037736 k( 205) = ( 0.2638889 0.2638889 0.5000000), wk = 0.0037736 k( 206) = ( 0.2569444 0.2569444 0.5000000), wk = 0.0037736 k( 207) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0037736 k( 208) = ( 0.2430556 0.2430556 0.5000000), wk = 0.0037736 k( 209) = ( 0.2361111 0.2361111 0.5000000), wk = 0.0037736 k( 210) = ( 0.2291667 0.2291667 0.5000000), wk = 0.0037736 k( 211) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0037736 k( 212) = ( 0.2152778 0.2152778 0.5000000), wk = 0.0037736 k( 213) = ( 0.2083333 0.2083333 0.5000000), wk = 0.0037736 k( 214) = ( 0.2013889 0.2013889 0.5000000), wk = 0.0037736 k( 215) = ( 0.1944444 0.1944444 0.5000000), wk = 0.0037736 k( 216) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0037736 k( 217) = ( 0.1805556 0.1805556 0.5000000), wk = 0.0037736 k( 218) = ( 0.1736111 0.1736111 0.5000000), wk = 0.0037736 k( 219) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0037736 k( 220) = ( 0.1597222 0.1597222 0.5000000), wk = 0.0037736 k( 221) = ( 0.1527778 0.1527778 0.5000000), wk = 0.0037736 k( 222) = ( 0.1458333 0.1458333 0.5000000), wk = 0.0037736 k( 223) = ( 0.1388889 0.1388889 0.5000000), wk = 0.0037736 k( 224) = ( 0.1319444 0.1319444 0.5000000), wk = 0.0037736 k( 225) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0037736 k( 226) = ( 0.1180556 0.1180556 0.5000000), wk = 0.0037736 k( 227) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0037736 k( 228) = ( 0.1041667 0.1041667 0.5000000), wk = 0.0037736 k( 229) = ( 0.0972222 0.0972222 0.5000000), wk = 0.0037736 k( 230) = ( 0.0902778 0.0902778 0.5000000), wk = 0.0037736 k( 231) = ( 0.0833333 0.0833333 0.5000000), wk = 0.0037736 k( 232) = ( 0.0763889 0.0763889 0.5000000), wk = 0.0037736 k( 233) = ( 0.0694444 0.0694444 0.5000000), wk = 0.0037736 k( 234) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0037736 k( 235) = ( 0.0555556 0.0555556 0.5000000), wk = 0.0037736 k( 236) = ( 0.0486111 0.0486111 0.5000000), wk = 0.0037736 k( 237) = ( 0.0416667 0.0416667 0.5000000), wk = 0.0037736 k( 238) = ( 0.0347222 0.0347222 0.5000000), wk = 0.0037736 k( 239) = ( 0.0277778 0.0277778 0.5000000), wk = 0.0037736 k( 240) = ( 0.0208333 0.0208333 0.5000000), wk = 0.0037736 k( 241) = ( 0.0138889 0.0138889 0.5000000), wk = 0.0037736 k( 242) = ( 0.0069444 0.0069444 0.5000000), wk = 0.0037736 k( 243) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037736 k( 244) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0037736 k( 245) = ( 0.5000000 0.0000000 0.4500000), wk = 0.0037736 k( 246) = ( 0.5000000 0.0000000 0.4000000), wk = 0.0037736 k( 247) = ( 0.5000000 0.0000000 0.3500000), wk = 0.0037736 k( 248) = ( 0.5000000 0.0000000 0.3000000), wk = 0.0037736 k( 249) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0037736 k( 250) = ( 0.5000000 0.0000000 0.2000000), wk = 0.0037736 k( 251) = ( 0.5000000 0.0000000 0.1500000), wk = 0.0037736 k( 252) = ( 0.5000000 0.0000000 0.1000000), wk = 0.0037736 k( 253) = ( 0.5000000 0.0000000 0.0500000), wk = 0.0037736 k( 254) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0037736 k( 255) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0037736 k( 256) = ( 0.3333333 0.3333333 0.0500000), wk = 0.0037736 k( 257) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0037736 k( 258) = ( 0.3333333 0.3333333 0.1500000), wk = 0.0037736 k( 259) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0037736 k( 260) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0037736 k( 261) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0037736 k( 262) = ( 0.3333333 0.3333333 0.3500000), wk = 0.0037736 k( 263) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0037736 k( 264) = ( 0.3333333 0.3333333 0.4500000), wk = 0.0037736 k( 265) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037736 Dense grid: 139775 G-vectors FFT dimensions: ( 45, 45, 180) Smooth grid: 65289 G-vectors FFT dimensions: ( 36, 36, 135) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.28 Mb ( 242, 76) NL pseudopotentials 0.50 Mb ( 121, 272) Each V/rho on FFT grid 0.09 Mb ( 6075) Each G-vector array 0.01 Mb ( 1937) G-vector shells 0.01 Mb ( 977) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.12 Mb ( 242, 304) Each subspace H/S matrix 0.04 Mb ( 50, 50) Each matrix 0.63 Mb ( 272, 2, 76) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./RbYTe2.save/charge-density.dat Starting wfc are 116 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 4.5 secs Computing kpt #: 2 total cpu time spent up to now is 6.0 secs Computing kpt #: 3 total cpu time spent up to now is 7.4 secs Computing kpt #: 4 total cpu time spent up to now is 8.9 secs Computing kpt #: 5 total cpu time spent up to now is 10.3 secs Computing kpt #: 6 total cpu time spent up to now is 11.8 secs Computing kpt #: 7 total cpu time spent up to now is 13.2 secs Computing kpt #: 8 total cpu time spent up to now is 14.6 secs Computing kpt #: 9 total cpu time spent up to now is 16.0 secs Computing kpt #: 10 total cpu time spent up to now is 17.5 secs Computing kpt #: 11 total cpu time spent up to now is 19.0 secs Computing kpt #: 12 total cpu time spent up to now is 20.6 secs Computing kpt #: 13 total cpu time spent up to now is 22.1 secs Computing kpt #: 14 total cpu time spent up to now is 23.9 secs Computing kpt #: 15 total cpu time spent up to now is 25.6 secs Computing kpt #: 16 total cpu time spent up to now is 27.3 secs Computing kpt #: 17 total cpu time spent up to now is 29.0 secs Computing kpt #: 18 total cpu time spent up to now is 30.8 secs Computing kpt #: 19 total cpu time spent up to now is 32.5 secs Computing kpt #: 20 total cpu time spent up to now is 34.2 secs Computing kpt #: 21 total cpu time spent up to now is 35.8 secs Computing kpt #: 22 total cpu time spent up to now is 37.6 secs Computing kpt #: 23 total cpu time spent up to now is 39.4 secs Computing kpt #: 24 total cpu time spent up to now is 41.1 secs Computing kpt #: 25 total cpu time spent up to now is 42.8 secs Computing kpt #: 26 total cpu time spent up to now is 44.7 secs Computing kpt #: 27 total cpu time spent up to now is 46.6 secs Computing kpt #: 28 total cpu time spent up to now is 48.4 secs Computing kpt #: 29 total cpu time spent up to now is 50.3 secs Computing kpt #: 30 total cpu time spent up to now is 52.1 secs Computing kpt #: 31 total cpu time spent up to now is 53.9 secs Computing kpt #: 32 total cpu time spent up to now is 55.6 secs Computing kpt #: 33 total cpu time spent up to now is 57.3 secs Computing kpt #: 34 total cpu time spent up to now is 59.1 secs Computing kpt #: 35 total cpu time spent up to now is 60.8 secs Computing kpt #: 36 total cpu time spent up to now is 62.6 secs Computing kpt #: 37 total cpu time spent up to now is 64.4 secs Computing kpt #: 38 total cpu time spent up to now is 66.2 secs Computing kpt #: 39 total cpu time spent up to now is 68.0 secs Computing kpt #: 40 total cpu time spent up to now is 69.8 secs Computing kpt #: 41 total cpu time spent up to now is 71.6 secs Computing kpt #: 42 total cpu time spent up to now is 73.3 secs Computing kpt #: 43 total cpu time spent up to now is 75.0 secs Computing kpt #: 44 total cpu time spent up to now is 76.7 secs Computing kpt #: 45 total cpu time spent up to now is 78.5 secs Computing kpt #: 46 total cpu time spent up to now is 80.2 secs Computing kpt #: 47 total cpu time spent up to now is 81.8 secs Computing kpt #: 48 total cpu time spent up to now is 83.5 secs Computing kpt #: 49 total cpu time spent up to now is 85.0 secs Computing kpt #: 50 total cpu time spent up to now is 86.6 secs Computing kpt #: 51 total cpu time spent up to now is 88.1 secs Computing kpt #: 52 total cpu time spent up to now is 89.6 secs Computing kpt #: 53 total cpu time spent up to now is 91.3 secs Computing kpt #: 54 total cpu time spent up to now is 92.8 secs Computing kpt #: 55 total cpu time spent up to now is 94.4 secs Computing kpt #: 56 total cpu time spent up to now is 95.9 secs Computing kpt #: 57 total cpu time spent up to now is 97.5 secs Computing kpt #: 58 total cpu time spent up to now is 99.1 secs Computing kpt #: 59 total cpu time spent up to now is 100.7 secs Computing kpt #: 60 total cpu time spent up to now is 102.1 secs Computing kpt #: 61 total cpu time spent up to now is 103.6 secs Computing kpt #: 62 total cpu time spent up to now is 104.9 secs Computing kpt #: 63 total cpu time spent up to now is 106.3 secs Computing kpt #: 64 total cpu time spent up to now is 107.8 secs Computing kpt #: 65 total cpu time spent up to now is 109.2 secs Computing kpt #: 66 total cpu time spent up to now is 110.6 secs Computing kpt #: 67 total cpu time spent up to now is 111.9 secs Computing kpt #: 68 total cpu time spent up to now is 113.3 secs Computing kpt #: 69 total cpu time spent up to now is 114.7 secs Computing kpt #: 70 total cpu time spent up to now is 116.1 secs Computing kpt #: 71 total cpu time spent up to now is 117.5 secs Computing kpt #: 72 total cpu time spent up to now is 119.0 secs Computing kpt #: 73 total cpu time spent up to now is 120.5 secs Computing kpt #: 74 total cpu time spent up to now is 122.1 secs Computing kpt #: 75 total cpu time spent up to now is 123.5 secs Computing kpt #: 76 total cpu time spent up to now is 125.2 secs Computing kpt #: 77 total cpu time spent up to now is 126.8 secs Computing kpt #: 78 total cpu time spent up to now is 128.5 secs Computing kpt #: 79 total cpu time spent up to now is 130.0 secs Computing kpt #: 80 total cpu time spent up to now is 132.6 secs Computing kpt #: 81 total cpu time spent up to now is 134.2 secs Computing kpt #: 82 total cpu time spent up to now is 135.9 secs Computing kpt #: 83 total cpu time spent up to now is 137.6 secs Computing kpt #: 84 total cpu time spent up to now is 139.3 secs Computing kpt #: 85 total cpu time spent up to now is 141.0 secs Computing kpt #: 86 total cpu time spent up to now is 142.7 secs Computing kpt #: 87 total cpu time spent up to now is 144.5 secs Computing kpt #: 88 total cpu time spent up to now is 146.4 secs Computing kpt #: 89 total cpu time spent up to now is 148.1 secs Computing kpt #: 90 total cpu time spent up to now is 149.9 secs Computing kpt #: 91 total cpu time spent up to now is 151.6 secs Computing kpt #: 92 total cpu time spent up to now is 153.4 secs Computing kpt #: 93 total cpu time spent up to now is 155.1 secs Computing kpt #: 94 total cpu time spent up to now is 156.8 secs Computing kpt #: 95 total cpu time spent up to now is 158.6 secs Computing kpt #: 96 total cpu time spent up to now is 160.3 secs Computing kpt #: 97 total cpu time spent up to now is 162.0 secs Computing kpt #: 98 total cpu time spent up to now is 163.9 secs Computing kpt #: 99 total cpu time spent up to now is 165.6 secs Computing kpt #: 100 total cpu time spent up to now is 167.5 secs Computing kpt #: 101 total cpu time spent up to now is 169.3 secs Computing kpt #: 102 total cpu time spent up to now is 171.1 secs Computing kpt #: 103 total cpu time spent up to now is 172.7 secs Computing kpt #: 104 total cpu time spent up to now is 174.3 secs Computing kpt #: 105 total cpu time spent up to now is 175.9 secs Computing kpt #: 106 total cpu time spent up to now is 177.4 secs Computing kpt #: 107 total cpu time spent up to now is 178.8 secs Computing kpt #: 108 total cpu time spent up to now is 180.4 secs Computing kpt #: 109 total cpu time spent up to now is 182.0 secs Computing kpt #: 110 total cpu time spent up to now is 183.6 secs Computing kpt #: 111 total cpu time spent up to now is 185.1 secs Computing kpt #: 112 total cpu time spent up to now is 186.5 secs Computing kpt #: 113 total cpu time spent up to now is 188.1 secs Computing kpt #: 114 total cpu time spent up to now is 189.5 secs Computing kpt #: 115 total cpu time spent up to now is 190.9 secs Computing kpt #: 116 total cpu time spent up to now is 192.4 secs Computing kpt #: 117 total cpu time spent up to now is 193.9 secs Computing kpt #: 118 total cpu time spent up to now is 195.6 secs Computing kpt #: 119 total cpu time spent up to now is 197.0 secs Computing kpt #: 120 total cpu time spent up to now is 198.5 secs Computing kpt #: 121 total cpu time spent up to now is 199.9 secs Computing kpt #: 122 total cpu time spent up to now is 201.3 secs Computing kpt #: 123 total cpu time spent up to now is 202.7 secs Computing kpt #: 124 total cpu time spent up to now is 204.0 secs Computing kpt #: 125 total cpu time spent up to now is 205.5 secs Computing kpt #: 126 total cpu time spent up to now is 207.1 secs Computing kpt #: 127 total cpu time spent up to now is 208.5 secs Computing kpt #: 128 total cpu time spent up to now is 210.0 secs Computing kpt #: 129 total cpu time spent up to now is 211.3 secs Computing kpt #: 130 total cpu time spent up to now is 212.8 secs Computing kpt #: 131 total cpu time spent up to now is 214.4 secs Computing kpt #: 132 total cpu time spent up to now is 215.9 secs Computing kpt #: 133 total cpu time spent up to now is 217.4 secs Computing kpt #: 134 total cpu time spent up to now is 218.9 secs Computing kpt #: 135 total cpu time spent up to now is 220.4 secs Computing kpt #: 136 total cpu time spent up to now is 221.8 secs Computing kpt #: 137 total cpu time spent up to now is 223.3 secs Computing kpt #: 138 total cpu time spent up to now is 224.7 secs Computing kpt #: 139 total cpu time spent up to now is 226.2 secs Computing kpt #: 140 total cpu time spent up to now is 227.6 secs Computing kpt #: 141 total cpu time spent up to now is 229.1 secs Computing kpt #: 142 total cpu time spent up to now is 230.7 secs Computing kpt #: 143 total cpu time spent up to now is 232.1 secs Computing kpt #: 144 total cpu time spent up to now is 233.6 secs Computing kpt #: 145 total cpu time spent up to now is 235.1 secs Computing kpt #: 146 total cpu time spent up to now is 236.7 secs Computing kpt #: 147 total cpu time spent up to now is 238.1 secs Computing kpt #: 148 total cpu time spent up to now is 239.7 secs Computing kpt #: 149 total cpu time spent up to now is 241.1 secs Computing kpt #: 150 total cpu time spent up to now is 242.9 secs Computing kpt #: 151 total cpu time spent up to now is 244.5 secs Computing kpt #: 152 total cpu time spent up to now is 246.2 secs Computing kpt #: 153 total cpu time spent up to now is 247.7 secs Computing kpt #: 154 total cpu time spent up to now is 249.2 secs Computing kpt #: 155 total cpu time spent up to now is 250.7 secs Computing kpt #: 156 total cpu time spent up to now is 252.2 secs Computing kpt #: 157 total cpu time spent up to now is 253.7 secs Computing kpt #: 158 total cpu time spent up to now is 255.4 secs Computing kpt #: 159 total cpu time spent up to now is 257.1 secs Computing kpt #: 160 total cpu time spent up to now is 258.8 secs Computing kpt #: 161 total cpu time spent up to now is 260.3 secs Computing kpt #: 162 total cpu time spent up to now is 261.8 secs Computing kpt #: 163 total cpu time spent up to now is 263.4 secs Computing kpt #: 164 total cpu time spent up to now is 265.0 secs Computing kpt #: 165 total cpu time spent up to now is 266.7 secs Computing kpt #: 166 total cpu time spent up to now is 268.4 secs Computing kpt #: 167 total cpu time spent up to now is 270.0 secs Computing kpt #: 168 total cpu time spent up to now is 271.6 secs Computing kpt #: 169 total cpu time spent up to now is 273.2 secs Computing kpt #: 170 total cpu time spent up to now is 274.9 secs Computing kpt #: 171 total cpu time spent up to now is 276.4 secs Computing kpt #: 172 total cpu time spent up to now is 277.8 secs Computing kpt #: 173 total cpu time spent up to now is 279.4 secs Computing kpt #: 174 total cpu time spent up to now is 281.0 secs Computing kpt #: 175 total cpu time spent up to now is 282.6 secs Computing kpt #: 176 total cpu time spent up to now is 284.1 secs Computing kpt #: 177 total cpu time spent up to now is 285.6 secs Computing kpt #: 178 total cpu time spent up to now is 287.0 secs Computing kpt #: 179 total cpu time spent up to now is 288.4 secs Computing kpt #: 180 total cpu time spent up to now is 290.0 secs Computing kpt #: 181 total cpu time spent up to now is 291.5 secs Computing kpt #: 182 total cpu time spent up to now is 293.1 secs Computing kpt #: 183 total cpu time spent up to now is 294.7 secs Computing kpt #: 184 total cpu time spent up to now is 296.1 secs Computing kpt #: 185 total cpu time spent up to now is 297.6 secs Computing kpt #: 186 total cpu time spent up to now is 299.1 secs Computing kpt #: 187 total cpu time spent up to now is 300.4 secs Computing kpt #: 188 total cpu time spent up to now is 301.8 secs Computing kpt #: 189 total cpu time spent up to now is 303.2 secs Computing kpt #: 190 total cpu time spent up to now is 304.5 secs Computing kpt #: 191 total cpu time spent up to now is 306.0 secs Computing kpt #: 192 total cpu time spent up to now is 307.4 secs Computing kpt #: 193 total cpu time spent up to now is 308.7 secs Computing kpt #: 194 total cpu time spent up to now is 310.2 secs Computing kpt #: 195 total cpu time spent up to now is 311.5 secs Computing kpt #: 196 total cpu time spent up to now is 312.8 secs Computing kpt #: 197 total cpu time spent up to now is 314.3 secs Computing kpt #: 198 total cpu time spent up to now is 315.7 secs Computing kpt #: 199 total cpu time spent up to now is 317.2 secs Computing kpt #: 200 total cpu time spent up to now is 318.5 secs Computing kpt #: 201 total cpu time spent up to now is 320.0 secs Computing kpt #: 202 total cpu time spent up to now is 321.5 secs Computing kpt #: 203 total cpu time spent up to now is 323.0 secs Computing kpt #: 204 total cpu time spent up to now is 324.7 secs Computing kpt #: 205 total cpu time spent up to now is 326.2 secs Computing kpt #: 206 total cpu time spent up to now is 327.7 secs Computing kpt #: 207 total cpu time spent up to now is 329.2 secs Computing kpt #: 208 total cpu time spent up to now is 330.8 secs Computing kpt #: 209 total cpu time spent up to now is 332.2 secs Computing kpt #: 210 total cpu time spent up to now is 333.8 secs Computing kpt #: 211 total cpu time spent up to now is 335.3 secs Computing kpt #: 212 total cpu time spent up to now is 337.0 secs Computing kpt #: 213 total cpu time spent up to now is 338.7 secs Computing kpt #: 214 total cpu time spent up to now is 340.4 secs Computing kpt #: 215 total cpu time spent up to now is 342.1 secs Computing kpt #: 216 total cpu time spent up to now is 343.7 secs Computing kpt #: 217 total cpu time spent up to now is 345.5 secs Computing kpt #: 218 total cpu time spent up to now is 347.2 secs Computing kpt #: 219 total cpu time spent up to now is 349.0 secs Computing kpt #: 220 total cpu time spent up to now is 350.7 secs Computing kpt #: 221 total cpu time spent up to now is 352.5 secs Computing kpt #: 222 total cpu time spent up to now is 354.3 secs Computing kpt #: 223 total cpu time spent up to now is 356.0 secs Computing kpt #: 224 total cpu time spent up to now is 357.8 secs Computing kpt #: 225 total cpu time spent up to now is 359.4 secs Computing kpt #: 226 total cpu time spent up to now is 361.2 secs Computing kpt #: 227 total cpu time spent up to now is 363.0 secs Computing kpt #: 228 total cpu time spent up to now is 364.7 secs Computing kpt #: 229 total cpu time spent up to now is 366.1 secs Computing kpt #: 230 total cpu time spent up to now is 367.6 secs Computing kpt #: 231 total cpu time spent up to now is 369.1 secs Computing kpt #: 232 total cpu time spent up to now is 370.6 secs Computing kpt #: 233 total cpu time spent up to now is 372.1 secs Computing kpt #: 234 total cpu time spent up to now is 373.6 secs Computing kpt #: 235 total cpu time spent up to now is 375.1 secs Computing kpt #: 236 total cpu time spent up to now is 377.0 secs Computing kpt #: 237 total cpu time spent up to now is 378.3 secs Computing kpt #: 238 total cpu time spent up to now is 379.8 secs Computing kpt #: 239 total cpu time spent up to now is 381.3 secs Computing kpt #: 240 total cpu time spent up to now is 383.1 secs Computing kpt #: 241 total cpu time spent up to now is 384.5 secs Computing kpt #: 242 total cpu time spent up to now is 385.9 secs Computing kpt #: 243 total cpu time spent up to now is 387.5 secs Computing kpt #: 244 total cpu time spent up to now is 389.1 secs Computing kpt #: 245 total cpu time spent up to now is 390.6 secs Computing kpt #: 246 total cpu time spent up to now is 392.1 secs Computing kpt #: 247 total cpu time spent up to now is 393.7 secs Computing kpt #: 248 total cpu time spent up to now is 395.3 secs Computing kpt #: 249 total cpu time spent up to now is 397.1 secs Computing kpt #: 250 total cpu time spent up to now is 398.7 secs Computing kpt #: 251 total cpu time spent up to now is 400.5 secs Computing kpt #: 252 total cpu time spent up to now is 402.2 secs Computing kpt #: 253 total cpu time spent up to now is 404.0 secs Computing kpt #: 254 total cpu time spent up to now is 405.7 secs Computing kpt #: 255 total cpu time spent up to now is 407.1 secs Computing kpt #: 256 total cpu time spent up to now is 408.5 secs Computing kpt #: 257 total cpu time spent up to now is 410.0 secs Computing kpt #: 258 total cpu time spent up to now is 411.3 secs Computing kpt #: 259 total cpu time spent up to now is 412.7 secs Computing kpt #: 260 total cpu time spent up to now is 414.1 secs Computing kpt #: 261 total cpu time spent up to now is 415.6 secs Computing kpt #: 262 total cpu time spent up to now is 417.0 secs Computing kpt #: 263 total cpu time spent up to now is 418.4 secs Computing kpt #: 264 total cpu time spent up to now is 419.9 secs Computing kpt #: 265 total cpu time spent up to now is 421.3 secs ethr = 1.56E-08, avg # of iterations = 20.2 total cpu time spent up to now is 421.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 8195 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0110 -6.0110 -5.9869 -5.9869 -5.3393 -5.3393 -5.2436 -5.2436 -5.0270 -5.0270 -5.0270 -5.0270 -4.8479 -4.8479 -4.4172 -4.4172 -4.2248 -4.2248 -3.8787 -3.8787 2.3496 2.3496 2.8044 2.8044 4.0216 4.0216 4.0369 4.0369 4.0900 4.0900 4.3750 4.3750 4.3795 4.3795 4.8297 4.8297 5.4283 5.4283 5.6591 5.6591 5.9410 5.9410 5.9671 5.9671 7.5718 7.5718 7.8589 7.8589 7.8607 7.8607 7.8692 7.8692 7.8721 7.8721 8.1473 8.1473 k = 0.0122 0.0070-0.0000 ( 8207 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5274 -16.5274 -16.5273 -16.5273 -16.4951 -16.4951 -16.4951 -16.4951 -6.0109 -6.0109 -5.9869 -5.9869 -5.3391 -5.3391 -5.2436 -5.2436 -5.0278 -5.0278 -5.0274 -5.0274 -4.8463 -4.8463 -4.4169 -4.4169 -4.2243 -4.2243 -3.8790 -3.8790 2.3511 2.3511 2.8051 2.8051 4.0172 4.0172 4.0200 4.0200 4.1047 4.1047 4.3766 4.3766 4.3796 4.3796 4.8304 4.8304 5.4239 5.4239 5.6559 5.6559 5.9341 5.9341 5.9606 5.9606 7.5734 7.5734 7.8593 7.8593 7.8630 7.8630 7.8706 7.8706 7.8749 7.8749 8.1510 8.1510 k = 0.0244 0.0141-0.0000 ( 8215 PWs) bands (ev): -36.9977 -36.9977 -36.9977 -36.9977 -21.2603 -21.2603 -21.2603 -21.2603 -17.9551 -17.9551 -17.9551 -17.9551 -16.5274 -16.5274 -16.5273 -16.5273 -16.4953 -16.4953 -16.4953 -16.4953 -6.0107 -6.0107 -5.9870 -5.9870 -5.3385 -5.3385 -5.2437 -5.2437 -5.0302 -5.0302 -5.0287 -5.0287 -4.8416 -4.8416 -4.4161 -4.4161 -4.2230 -4.2230 -3.8797 -3.8797 2.3554 2.3554 2.8073 2.8073 3.9799 3.9799 4.0151 4.0151 4.1273 4.1273 4.3688 4.3688 4.3924 4.3924 4.8321 4.8321 5.4108 5.4108 5.6461 5.6461 5.9141 5.9141 5.9416 5.9416 7.5780 7.5780 7.8578 7.8578 7.8715 7.8715 7.8732 7.8732 7.8846 7.8846 8.1623 8.1623 k = 0.0366 0.0211-0.0000 ( 8211 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2602 -21.2602 -21.2602 -21.2602 -17.9552 -17.9552 -17.9552 -17.9552 -16.5274 -16.5274 -16.5274 -16.5274 -16.4956 -16.4956 -16.4956 -16.4956 -6.0105 -6.0105 -5.9872 -5.9872 -5.3375 -5.3375 -5.2439 -5.2439 -5.0340 -5.0340 -5.0308 -5.0308 -4.8339 -4.8339 -4.4146 -4.4146 -4.2207 -4.2207 -3.8810 -3.8810 2.3625 2.3625 2.8109 2.8109 3.9371 3.9371 4.0068 4.0068 4.1468 4.1468 4.3568 4.3568 4.4123 4.4123 4.8335 4.8335 5.3891 5.3891 5.6294 5.6294 5.8833 5.8833 5.9114 5.9114 7.5856 7.5856 7.8543 7.8543 7.8743 7.8743 7.8869 7.8869 7.9010 7.9010 8.1818 8.1818 k = 0.0488 0.0282-0.0000 ( 8213 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2601 -21.2601 -21.2601 -21.2601 -17.9554 -17.9554 -17.9554 -17.9554 -16.5274 -16.5274 -16.5274 -16.5274 -16.4961 -16.4961 -16.4961 -16.4961 -6.0101 -6.0101 -5.9875 -5.9875 -5.3361 -5.3361 -5.2441 -5.2441 -5.0388 -5.0388 -5.0337 -5.0337 -4.8237 -4.8237 -4.4126 -4.4126 -4.2177 -4.2177 -3.8827 -3.8827 2.3724 2.3724 2.8159 2.8159 3.8916 3.8916 3.9947 3.9947 4.1624 4.1624 4.3423 4.3423 4.4373 4.4373 4.8329 4.8329 5.3588 5.3588 5.6052 5.6052 5.8452 5.8452 5.8720 5.8720 7.5958 7.5958 7.8481 7.8481 7.8739 7.8739 7.9071 7.9071 7.9232 7.9232 8.2097 8.2097 k = 0.0610 0.0352-0.0000 ( 8209 PWs) bands (ev): -36.9976 -36.9976 -36.9975 -36.9975 -21.2598 -21.2598 -21.2598 -21.2598 -17.9557 -17.9557 -17.9556 -17.9556 -16.5275 -16.5275 -16.5275 -16.5275 -16.4967 -16.4967 -16.4967 -16.4967 -6.0097 -6.0097 -5.9879 -5.9879 -5.3343 -5.3343 -5.2444 -5.2444 -5.0444 -5.0444 -5.0373 -5.0373 -4.8111 -4.8111 -4.4099 -4.4099 -4.2138 -4.2138 -3.8849 -3.8849 2.3851 2.3851 2.8223 2.8223 3.8446 3.8446 3.9784 3.9784 4.1748 4.1748 4.3268 4.3268 4.4650 4.4650 4.8282 4.8282 5.3203 5.3203 5.5729 5.5729 5.8038 5.8038 5.8259 5.8259 7.6079 7.6079 7.8394 7.8394 7.8704 7.8704 7.9324 7.9324 7.9508 7.9508 8.2457 8.2457 k = 0.0732 0.0422-0.0000 ( 8199 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2596 -21.2596 -21.2596 -21.2596 -17.9559 -17.9559 -17.9559 -17.9559 -16.5276 -16.5276 -16.5275 -16.5275 -16.4974 -16.4974 -16.4974 -16.4974 -6.0092 -6.0092 -5.9885 -5.9885 -5.3320 -5.3320 -5.2447 -5.2447 -5.0505 -5.0505 -5.0417 -5.0417 -4.7965 -4.7965 -4.4067 -4.4067 -4.2092 -4.2092 -3.8876 -3.8876 2.4005 2.4005 2.8299 2.8299 3.7967 3.7967 3.9577 3.9577 4.1849 4.1849 4.3117 4.3117 4.4934 4.4934 4.8173 4.8173 5.2740 5.2740 5.5324 5.5324 5.7625 5.7625 5.7756 5.7756 7.6212 7.6212 7.8287 7.8287 7.8634 7.8634 7.9621 7.9621 7.9831 7.9831 8.2883 8.2883 k = 0.0854 0.0493-0.0000 ( 8203 PWs) bands (ev): -36.9975 -36.9975 -36.9974 -36.9974 -21.2593 -21.2593 -21.2593 -21.2593 -17.9563 -17.9563 -17.9562 -17.9562 -16.5276 -16.5276 -16.5276 -16.5276 -16.4982 -16.4982 -16.4982 -16.4982 -6.0088 -6.0088 -5.9891 -5.9891 -5.3294 -5.3294 -5.2450 -5.2450 -5.0570 -5.0570 -5.0466 -5.0466 -4.7801 -4.7801 -4.4028 -4.4028 -4.2039 -4.2039 -3.8908 -3.8908 2.4184 2.4184 2.8387 2.8387 3.7485 3.7485 3.9327 3.9327 4.1936 4.1936 4.2980 4.2980 4.5202 4.5202 4.7980 4.7980 5.2208 5.2208 5.4851 5.4851 5.7189 5.7189 5.7281 5.7281 7.6337 7.6337 7.8176 7.8176 7.8534 7.8534 7.9958 7.9958 8.0195 8.0195 8.3360 8.3360 k = 0.0976 0.0563-0.0000 ( 8211 PWs) bands (ev): -36.9974 -36.9974 -36.9974 -36.9974 -21.2589 -21.2589 -21.2589 -21.2589 -17.9566 -17.9566 -17.9566 -17.9566 -16.5277 -16.5277 -16.5277 -16.5277 -16.4992 -16.4992 -16.4991 -16.4991 -6.0083 -6.0083 -5.9898 -5.9898 -5.3265 -5.3265 -5.2453 -5.2453 -5.0636 -5.0636 -5.0521 -5.0521 -4.7620 -4.7620 -4.3984 -4.3984 -4.1980 -4.1980 -3.8944 -3.8944 2.4389 2.4389 2.8486 2.8486 3.7004 3.7004 3.9035 3.9035 4.2014 4.2014 4.2862 4.2862 4.5433 4.5433 4.7687 4.7687 5.1623 5.1623 5.4339 5.4339 5.6665 5.6665 5.6920 5.6920 7.6425 7.6425 7.8079 7.8079 7.8422 7.8422 8.0328 8.0328 8.0593 8.0593 8.3867 8.3867 k = 0.1098 0.0634-0.0000 ( 8219 PWs) bands (ev): -36.9974 -36.9974 -36.9973 -36.9973 -21.2586 -21.2586 -21.2586 -21.2586 -17.9570 -17.9570 -17.9570 -17.9570 -16.5279 -16.5279 -16.5279 -16.5279 -16.5002 -16.5002 -16.5002 -16.5002 -6.0079 -6.0079 -5.9907 -5.9907 -5.3231 -5.3231 -5.2456 -5.2456 -5.0702 -5.0702 -5.0581 -5.0581 -4.7425 -4.7425 -4.3933 -4.3933 -4.1915 -4.1915 -3.8985 -3.8985 2.4617 2.4617 2.8595 2.8595 3.6527 3.6527 3.8707 3.8707 4.2086 4.2086 4.2765 4.2765 4.5604 4.5604 4.7284 4.7284 5.1005 5.1005 5.3817 5.3817 5.6134 5.6134 5.6603 5.6603 7.6438 7.6438 7.7990 7.7990 7.8349 7.8349 8.0728 8.0728 8.1019 8.1019 8.4388 8.4388 k = 0.1220 0.0704-0.0000 ( 8215 PWs) bands (ev): -36.9973 -36.9973 -36.9973 -36.9973 -21.2581 -21.2581 -21.2581 -21.2581 -17.9575 -17.9575 -17.9575 -17.9575 -16.5280 -16.5280 -16.5280 -16.5280 -16.5013 -16.5013 -16.5013 -16.5013 -6.0076 -6.0076 -5.9917 -5.9917 -5.3194 -5.3194 -5.2459 -5.2459 -5.0768 -5.0768 -5.0644 -5.0644 -4.7216 -4.7216 -4.3876 -4.3876 -4.1846 -4.1846 -3.9030 -3.9030 2.4867 2.4867 2.8712 2.8712 3.6058 3.6058 3.8349 3.8349 4.2153 4.2153 4.2687 4.2687 4.5680 4.5680 4.6774 4.6774 5.0388 5.0388 5.3311 5.3311 5.5616 5.5616 5.6308 5.6308 7.6348 7.6348 7.7853 7.7853 7.8406 7.8406 8.1150 8.1150 8.1465 8.1465 8.4906 8.4906 k = 0.1341 0.0774-0.0000 ( 8205 PWs) bands (ev): -36.9972 -36.9972 -36.9972 -36.9972 -21.2577 -21.2577 -21.2577 -21.2577 -17.9580 -17.9580 -17.9580 -17.9580 -16.5283 -16.5283 -16.5282 -16.5282 -16.5024 -16.5024 -16.5024 -16.5024 -6.0074 -6.0074 -5.9929 -5.9929 -5.3154 -5.3154 -5.2462 -5.2462 -5.0832 -5.0832 -5.0710 -5.0710 -4.6995 -4.6995 -4.3813 -4.3813 -4.1772 -4.1772 -3.9078 -3.9078 2.5138 2.5138 2.8835 2.8835 3.5597 3.5597 3.7967 3.7967 4.2218 4.2218 4.2623 4.2623 4.5598 4.5598 4.6196 4.6196 4.9814 4.9814 5.2833 5.2833 5.5116 5.5116 5.6029 5.6029 7.6160 7.6160 7.7658 7.7658 7.8602 7.8602 8.1591 8.1591 8.1925 8.1925 8.5404 8.5404 k = 0.1463 0.0845-0.0000 ( 8211 PWs) bands (ev): -36.9971 -36.9971 -36.9971 -36.9971 -21.2572 -21.2572 -21.2572 -21.2572 -17.9585 -17.9585 -17.9585 -17.9585 -16.5285 -16.5285 -16.5285 -16.5285 -16.5036 -16.5036 -16.5036 -16.5036 -6.0074 -6.0074 -5.9942 -5.9942 -5.3112 -5.3112 -5.2465 -5.2465 -5.0893 -5.0893 -5.0778 -5.0778 -4.6763 -4.6763 -4.3744 -4.3744 -4.1696 -4.1696 -3.9131 -3.9131 2.5427 2.5427 2.8961 2.8961 3.5148 3.5148 3.7567 3.7567 4.2277 4.2277 4.2569 4.2569 4.5205 4.5205 4.5686 4.5686 4.9327 4.9327 5.2384 5.2384 5.4639 5.4639 5.5756 5.5756 7.5898 7.5898 7.7427 7.7427 7.8896 7.8896 8.2044 8.2044 8.2392 8.2392 8.5852 8.5852 k = 0.1585 0.0915-0.0000 ( 8205 PWs) bands (ev): -36.9970 -36.9970 -36.9970 -36.9970 -21.2567 -21.2567 -21.2567 -21.2567 -17.9591 -17.9591 -17.9591 -17.9591 -16.5288 -16.5288 -16.5288 -16.5288 -16.5049 -16.5049 -16.5049 -16.5049 -6.0075 -6.0075 -5.9958 -5.9958 -5.3066 -5.3066 -5.2468 -5.2468 -5.0952 -5.0952 -5.0847 -5.0847 -4.6520 -4.6520 -4.3669 -4.3669 -4.1616 -4.1616 -3.9186 -3.9186 2.5732 2.5732 2.9089 2.9089 3.4711 3.4711 3.7155 3.7155 4.2324 4.2324 4.2517 4.2517 4.4513 4.4513 4.5247 4.5247 4.8958 4.8958 5.1960 5.1960 5.4184 5.4184 5.5486 5.5486 7.5586 7.5586 7.7175 7.7175 7.9257 7.9257 8.2505 8.2505 8.2862 8.2862 8.6083 8.6083 k = 0.1707 0.0986-0.0000 ( 8201 PWs) bands (ev): -36.9969 -36.9969 -36.9969 -36.9969 -21.2561 -21.2561 -21.2561 -21.2561 -17.9597 -17.9597 -17.9597 -17.9597 -16.5292 -16.5292 -16.5292 -16.5292 -16.5061 -16.5061 -16.5061 -16.5061 -6.0078 -6.0078 -5.9974 -5.9974 -5.3019 -5.3019 -5.2472 -5.2472 -5.1007 -5.1007 -5.0915 -5.0915 -4.6268 -4.6268 -4.3588 -4.3588 -4.1535 -4.1535 -3.9246 -3.9246 2.6049 2.6049 2.9216 2.9216 3.4287 3.4287 3.6735 3.6735 4.2319 4.2319 4.2473 4.2473 4.3753 4.3753 4.4722 4.4722 4.8695 4.8695 5.1553 5.1553 5.3754 5.3754 5.5213 5.5213 7.5239 7.5239 7.6906 7.6906 7.9668 7.9668 8.2970 8.2970 8.3328 8.3328 8.5938 8.5938 k = 0.1829 0.1056-0.0000 ( 8199 PWs) bands (ev): -36.9968 -36.9968 -36.9968 -36.9968 -21.2556 -21.2556 -21.2556 -21.2556 -17.9603 -17.9603 -17.9603 -17.9603 -16.5296 -16.5296 -16.5296 -16.5296 -16.5074 -16.5074 -16.5074 -16.5074 -6.0084 -6.0084 -5.9993 -5.9993 -5.2971 -5.2971 -5.2476 -5.2476 -5.1058 -5.1058 -5.0982 -5.0982 -4.6007 -4.6007 -4.3501 -4.3501 -4.1452 -4.1452 -3.9307 -3.9307 2.6375 2.6375 2.9336 2.9336 3.3878 3.3878 3.6310 3.6310 4.2112 4.2112 4.2468 4.2468 4.3094 4.3094 4.4127 4.4127 4.8502 4.8502 5.1159 5.1159 5.3348 5.3348 5.4935 5.4935 7.4868 7.4868 7.6627 7.6627 8.0117 8.0117 8.3432 8.3432 8.3785 8.3785 8.5761 8.5761 k = 0.1951 0.1127-0.0000 ( 8195 PWs) bands (ev): -36.9967 -36.9967 -36.9967 -36.9967 -21.2550 -21.2550 -21.2550 -21.2550 -17.9609 -17.9609 -17.9609 -17.9609 -16.5302 -16.5302 -16.5302 -16.5302 -16.5086 -16.5086 -16.5086 -16.5086 -6.0092 -6.0092 -6.0013 -6.0013 -5.2922 -5.2922 -5.2481 -5.2481 -5.1104 -5.1104 -5.1045 -5.1045 -4.5740 -4.5740 -4.3410 -4.3410 -4.1368 -4.1368 -3.9372 -3.9372 2.6705 2.6705 2.9447 2.9447 3.3483 3.3483 3.5881 3.5881 4.1553 4.1553 4.2413 4.2413 4.2753 4.2753 4.3553 4.3553 4.8338 4.8338 5.0772 5.0772 5.2966 5.2966 5.4647 5.4647 7.4484 7.4484 7.6339 7.6339 8.0597 8.0597 8.3888 8.3888 8.4230 8.4230 8.5648 8.5648 k = 0.2073 0.1197-0.0000 ( 8187 PWs) bands (ev): -36.9966 -36.9966 -36.9966 -36.9966 -21.2544 -21.2544 -21.2544 -21.2544 -17.9616 -17.9616 -17.9616 -17.9616 -16.5308 -16.5308 -16.5308 -16.5308 -16.5097 -16.5097 -16.5097 -16.5097 -6.0103 -6.0103 -6.0035 -6.0035 -5.2875 -5.2875 -5.2488 -5.2488 -5.1146 -5.1146 -5.1104 -5.1104 -4.5466 -4.5466 -4.3314 -4.3314 -4.1284 -4.1284 -3.9438 -3.9438 2.7031 2.7031 2.9544 2.9544 3.3105 3.3105 3.5450 3.5450 4.0788 4.0788 4.2117 4.2117 4.2684 4.2684 4.3151 4.3151 4.8176 4.8176 5.0391 5.0391 5.2607 5.2607 5.4350 5.4350 7.4093 7.4093 7.6047 7.6047 8.1102 8.1102 8.4333 8.4333 8.4658 8.4658 8.5618 8.5618 k = 0.2195 0.1267-0.0000 ( 8184 PWs) bands (ev): -36.9965 -36.9965 -36.9965 -36.9965 -21.2538 -21.2538 -21.2538 -21.2538 -17.9623 -17.9623 -17.9623 -17.9623 -16.5316 -16.5316 -16.5315 -16.5315 -16.5108 -16.5108 -16.5108 -16.5108 -6.0116 -6.0116 -6.0059 -6.0059 -5.2829 -5.2829 -5.2495 -5.2495 -5.1184 -5.1184 -5.1155 -5.1155 -4.5187 -4.5187 -4.3213 -4.3213 -4.1199 -4.1199 -3.9507 -3.9507 2.7345 2.7345 2.9621 2.9621 3.2743 3.2743 3.5015 3.5015 3.9988 3.9988 4.1592 4.1592 4.2691 4.2691 4.2979 4.2979 4.7998 4.7998 5.0013 5.0013 5.2267 5.2267 5.4042 5.4042 7.3702 7.3702 7.5753 7.5753 8.1626 8.1626 8.4758 8.4758 8.5067 8.5067 8.5679 8.5679 k = 0.2317 0.1338-0.0000 ( 8158 PWs) bands (ev): -36.9964 -36.9964 -36.9963 -36.9963 -21.2531 -21.2531 -21.2531 -21.2531 -17.9630 -17.9630 -17.9629 -17.9629 -16.5324 -16.5324 -16.5324 -16.5324 -16.5118 -16.5118 -16.5118 -16.5118 -6.0131 -6.0131 -6.0085 -6.0085 -5.2786 -5.2786 -5.2505 -5.2505 -5.1222 -5.1222 -5.1193 -5.1193 -4.4904 -4.4904 -4.3108 -4.3108 -4.1116 -4.1116 -3.9576 -3.9576 2.7634 2.7634 2.9673 2.9673 3.2400 3.2400 3.4579 3.4579 3.9215 3.9215 4.0996 4.0996 4.2701 4.2701 4.2930 4.2930 4.7799 4.7799 4.9640 4.9640 5.1943 5.1943 5.3725 5.3725 7.3315 7.3315 7.5461 7.5461 8.2162 8.2162 8.5155 8.5155 8.5457 8.5457 8.5837 8.5837 k = 0.2439 0.1408-0.0000 ( 8158 PWs) bands (ev): -36.9962 -36.9962 -36.9962 -36.9962 -21.2525 -21.2525 -21.2525 -21.2525 -17.9636 -17.9636 -17.9636 -17.9636 -16.5334 -16.5334 -16.5334 -16.5334 -16.5127 -16.5127 -16.5126 -16.5126 -6.0149 -6.0149 -6.0112 -6.0112 -5.2748 -5.2748 -5.2517 -5.2517 -5.1259 -5.1259 -5.1218 -5.1218 -4.4619 -4.4619 -4.3000 -4.3000 -4.1033 -4.1033 -3.9646 -3.9646 2.7881 2.7881 2.9695 2.9695 3.2080 3.2080 3.4140 3.4140 3.8498 3.8498 4.0418 4.0418 4.2700 4.2700 4.2932 4.2932 4.7576 4.7576 4.9271 4.9271 5.1633 5.1633 5.3400 5.3400 7.2937 7.2937 7.5173 7.5173 8.2704 8.2704 8.5521 8.5521 8.5834 8.5834 8.6088 8.6088 k = 0.2561 0.1479-0.0000 ( 8160 PWs) bands (ev): -36.9961 -36.9961 -36.9961 -36.9961 -21.2519 -21.2519 -21.2519 -21.2519 -17.9643 -17.9643 -17.9643 -17.9643 -16.5345 -16.5345 -16.5344 -16.5344 -16.5134 -16.5134 -16.5134 -16.5134 -6.0170 -6.0170 -6.0140 -6.0140 -5.2716 -5.2716 -5.2532 -5.2532 -5.1290 -5.1290 -5.1233 -5.1233 -4.4332 -4.4332 -4.2890 -4.2890 -4.0951 -4.0951 -3.9717 -3.9717 2.8062 2.8062 2.9680 2.9680 3.1792 3.1792 3.3703 3.3703 3.7857 3.7857 3.9895 3.9895 4.2691 4.2691 4.2955 4.2955 4.7331 4.7331 4.8908 4.8908 5.1332 5.1332 5.3069 5.3069 7.2572 7.2572 7.4891 7.4891 8.3243 8.3243 8.5874 8.5874 8.6206 8.6206 8.6405 8.6405 k = 0.2683 0.1549-0.0000 ( 8162 PWs) bands (ev): -36.9960 -36.9960 -36.9960 -36.9960 -21.2513 -21.2513 -21.2513 -21.2513 -17.9650 -17.9650 -17.9650 -17.9650 -16.5356 -16.5356 -16.5356 -16.5356 -16.5141 -16.5141 -16.5141 -16.5141 -6.0192 -6.0192 -6.0169 -6.0169 -5.2691 -5.2691 -5.2548 -5.2548 -5.1311 -5.1311 -5.1240 -5.1240 -4.4047 -4.4047 -4.2777 -4.2777 -4.0870 -4.0870 -3.9787 -3.9787 2.8148 2.8148 2.9620 2.9620 3.1551 3.1551 3.3276 3.3276 3.7309 3.7309 3.9444 3.9444 4.2677 4.2677 4.2984 4.2984 4.7068 4.7068 4.8550 4.8550 5.1040 5.1040 5.2736 5.2736 7.2221 7.2221 7.4617 7.4617 8.3774 8.3774 8.6242 8.6242 8.6565 8.6565 8.6762 8.6762 k = 0.2805 0.1619-0.0000 ( 8152 PWs) bands (ev): -36.9959 -36.9959 -36.9959 -36.9959 -21.2506 -21.2506 -21.2506 -21.2506 -17.9657 -17.9657 -17.9657 -17.9657 -16.5369 -16.5369 -16.5369 -16.5369 -16.5147 -16.5147 -16.5147 -16.5147 -6.0217 -6.0217 -6.0200 -6.0200 -5.2674 -5.2674 -5.2567 -5.2567 -5.1323 -5.1323 -5.1240 -5.1240 -4.3763 -4.3763 -4.2663 -4.2663 -4.0792 -4.0792 -3.9855 -3.9855 2.8115 2.8115 2.9498 2.9498 3.1377 3.1377 3.2869 3.2869 3.6866 3.6866 3.9074 3.9074 4.2656 4.2656 4.3013 4.3013 4.6790 4.6790 4.8198 4.8198 5.0753 5.0753 5.2404 5.2404 7.1886 7.1886 7.4353 7.4353 8.4292 8.4292 8.6632 8.6632 8.6905 8.6905 8.7156 8.7156 k = 0.2927 0.1690-0.0000 ( 8160 PWs) bands (ev): -36.9958 -36.9958 -36.9958 -36.9958 -21.2500 -21.2500 -21.2500 -21.2500 -17.9664 -17.9664 -17.9664 -17.9664 -16.5382 -16.5382 -16.5382 -16.5382 -16.5152 -16.5152 -16.5152 -16.5152 -6.0243 -6.0243 -6.0231 -6.0231 -5.2666 -5.2666 -5.2587 -5.2587 -5.1323 -5.1323 -5.1234 -5.1234 -4.3484 -4.3484 -4.2549 -4.2549 -4.0715 -4.0715 -3.9921 -3.9921 2.7954 2.7954 2.9297 2.9297 3.1279 3.1279 3.2497 3.2497 3.6534 3.6534 3.8786 3.8786 4.2629 4.2629 4.3039 4.3039 4.6502 4.6502 4.7854 4.7854 5.0473 5.0473 5.2076 5.2076 7.1569 7.1569 7.4100 7.4100 8.4796 8.4796 8.7027 8.7027 8.7227 8.7227 8.7591 8.7591 k = 0.3049 0.1760-0.0000 ( 8152 PWs) bands (ev): -36.9957 -36.9957 -36.9957 -36.9957 -21.2494 -21.2494 -21.2494 -21.2494 -17.9671 -17.9671 -17.9671 -17.9671 -16.5395 -16.5395 -16.5395 -16.5395 -16.5156 -16.5156 -16.5155 -16.5155 -6.0270 -6.0270 -6.0262 -6.0262 -5.2666 -5.2666 -5.2608 -5.2608 -5.1314 -5.1314 -5.1222 -5.1222 -4.3211 -4.3211 -4.2436 -4.2436 -4.0641 -4.0641 -3.9985 -3.9985 2.7678 2.7678 2.9010 2.9010 3.1244 3.1244 3.2174 3.2174 3.6316 3.6316 3.8578 3.8578 4.2595 4.2595 4.3062 4.3062 4.6207 4.6207 4.7517 4.7517 5.0200 5.0200 5.1757 5.1757 7.1269 7.1269 7.3860 7.3860 8.5286 8.5286 8.7400 8.7400 8.7542 8.7542 8.8068 8.8068 k = 0.3171 0.1831-0.0000 ( 8144 PWs) bands (ev): -36.9956 -36.9956 -36.9956 -36.9956 -21.2488 -21.2488 -21.2488 -21.2488 -17.9678 -17.9678 -17.9678 -17.9678 -16.5409 -16.5409 -16.5409 -16.5409 -16.5159 -16.5159 -16.5159 -16.5159 -6.0298 -6.0298 -6.0294 -6.0294 -5.2675 -5.2675 -5.2629 -5.2629 -5.1296 -5.1296 -5.1206 -5.1206 -4.2946 -4.2946 -4.2323 -4.2323 -4.0569 -4.0569 -4.0044 -4.0044 2.7310 2.7310 2.8651 2.8651 3.1240 3.1240 3.1909 3.1909 3.6207 3.6207 3.8440 3.8440 4.2551 4.2551 4.3079 4.3079 4.5909 4.5909 4.7188 4.7188 4.9936 4.9936 5.1451 5.1451 7.0987 7.0987 7.3633 7.3633 8.5766 8.5766 8.7730 8.7730 8.7857 8.7857 8.8573 8.8573 k = 0.3293 0.1901-0.0000 ( 8150 PWs) bands (ev): -36.9955 -36.9955 -36.9955 -36.9955 -21.2483 -21.2483 -21.2483 -21.2483 -17.9684 -17.9684 -17.9684 -17.9684 -16.5423 -16.5423 -16.5423 -16.5423 -16.5161 -16.5161 -16.5161 -16.5161 -6.0328 -6.0328 -6.0324 -6.0324 -5.2690 -5.2690 -5.2650 -5.2650 -5.1271 -5.1271 -5.1185 -5.1185 -4.2693 -4.2693 -4.2213 -4.2213 -4.0501 -4.0501 -4.0096 -4.0096 2.6878 2.6878 2.8239 2.8239 3.1230 3.1230 3.1711 3.1711 3.6198 3.6198 3.8363 3.8363 4.2498 4.2498 4.3092 4.3092 4.5612 4.5612 4.6869 4.6869 4.9683 4.9683 5.1160 5.1160 7.0724 7.0724 7.3421 7.3421 8.6238 8.6238 8.8022 8.8022 8.8169 8.8169 8.9057 8.9057 k = 0.3415 0.1971-0.0000 ( 8154 PWs) bands (ev): -36.9954 -36.9954 -36.9954 -36.9954 -21.2477 -21.2477 -21.2477 -21.2477 -17.9690 -17.9690 -17.9690 -17.9690 -16.5436 -16.5436 -16.5436 -16.5436 -16.5164 -16.5164 -16.5164 -16.5164 -6.0359 -6.0359 -6.0353 -6.0353 -5.2711 -5.2711 -5.2671 -5.2671 -5.1240 -5.1240 -5.1160 -5.1160 -4.2455 -4.2455 -4.2103 -4.2103 -4.0438 -4.0438 -4.0139 -4.0139 2.6408 2.6408 2.7795 2.7795 3.1189 3.1189 3.1581 3.1581 3.6277 3.6277 3.8336 3.8336 4.2435 4.2435 4.3100 4.3100 4.5318 4.5318 4.6558 4.6558 4.9444 4.9444 5.0887 5.0887 7.0478 7.0478 7.3222 7.3222 8.6702 8.6702 8.8290 8.8290 8.8470 8.8470 8.9415 8.9415 k = 0.3537 0.2042-0.0000 ( 8150 PWs) bands (ev): -36.9953 -36.9953 -36.9953 -36.9953 -21.2472 -21.2472 -21.2472 -21.2472 -17.9696 -17.9696 -17.9696 -17.9696 -16.5449 -16.5449 -16.5449 -16.5449 -16.5165 -16.5165 -16.5165 -16.5165 -6.0389 -6.0389 -6.0382 -6.0382 -5.2734 -5.2734 -5.2692 -5.2692 -5.1205 -5.1205 -5.1133 -5.1133 -4.2241 -4.2241 -4.1989 -4.1989 -4.0387 -4.0387 -4.0166 -4.0166 2.5919 2.5919 2.7339 2.7339 3.1118 3.1118 3.1507 3.1507 3.6426 3.6426 3.8348 3.8348 4.2359 4.2359 4.3105 4.3105 4.5032 4.5032 4.6259 4.6259 4.9221 4.9221 5.0636 5.0636 7.0249 7.0249 7.3038 7.3038 8.7158 8.7158 8.8542 8.8542 8.8755 8.8755 8.9601 8.9601 k = 0.3659 0.2112-0.0000 ( 8150 PWs) bands (ev): -36.9952 -36.9952 -36.9952 -36.9952 -21.2467 -21.2467 -21.2467 -21.2467 -17.9701 -17.9701 -17.9701 -17.9701 -16.5462 -16.5462 -16.5462 -16.5462 -16.5167 -16.5167 -16.5167 -16.5167 -6.0419 -6.0419 -6.0410 -6.0410 -5.2758 -5.2758 -5.2714 -5.2714 -5.1167 -5.1167 -5.1105 -5.1105 -4.2066 -4.2066 -4.1860 -4.1860 -4.0357 -4.0357 -4.0165 -4.0165 2.5429 2.5429 2.6885 2.6885 3.1037 3.1037 3.1461 3.1461 3.6627 3.6627 3.8388 3.8388 4.2272 4.2272 4.3107 4.3107 4.4758 4.4758 4.5971 4.5971 4.9016 4.9016 5.0407 5.0407 7.0039 7.0039 7.2868 7.2868 8.7603 8.7603 8.8778 8.8778 8.9023 8.9023 8.9716 8.9716 k = 0.3780 0.2183-0.0000 ( 8142 PWs) bands (ev): -36.9951 -36.9951 -36.9951 -36.9951 -21.2463 -21.2463 -21.2463 -21.2463 -17.9706 -17.9706 -17.9706 -17.9706 -16.5474 -16.5474 -16.5474 -16.5474 -16.5168 -16.5168 -16.5168 -16.5168 -6.0447 -6.0447 -6.0436 -6.0436 -5.2782 -5.2782 -5.2736 -5.2736 -5.1129 -5.1129 -5.1076 -5.1076 -4.1941 -4.1941 -4.1707 -4.1707 -4.0353 -4.0353 -4.0133 -4.0133 2.4951 2.4951 2.6443 2.6443 3.0964 3.0964 3.1425 3.1425 3.6866 3.6866 3.8448 3.8448 4.2172 4.2172 4.3108 4.3108 4.4499 4.4499 4.5696 4.5696 4.8830 4.8830 5.0202 5.0202 6.9845 6.9845 7.2713 7.2713 8.8032 8.8032 8.8998 8.8998 8.9273 8.9273 8.9814 8.9814 k = 0.3902 0.2253-0.0000 ( 8150 PWs) bands (ev): -36.9951 -36.9951 -36.9951 -36.9951 -21.2458 -21.2458 -21.2458 -21.2458 -17.9711 -17.9711 -17.9711 -17.9711 -16.5485 -16.5485 -16.5485 -16.5485 -16.5168 -16.5168 -16.5168 -16.5168 -6.0474 -6.0474 -6.0461 -6.0461 -5.2805 -5.2805 -5.2757 -5.2757 -5.1091 -5.1091 -5.1047 -5.1047 -4.1853 -4.1853 -4.1546 -4.1546 -4.0361 -4.0361 -4.0081 -4.0081 2.4496 2.4496 2.6024 2.6024 3.0902 3.0903 3.1392 3.1392 3.7126 3.7126 3.8519 3.8519 4.2058 4.2058 4.3108 4.3108 4.4260 4.4260 4.5435 4.5435 4.8664 4.8664 5.0022 5.0022 6.9669 6.9669 7.2573 7.2573 8.8436 8.8436 8.9200 8.9200 8.9507 8.9507 8.9908 8.9908 k = 0.4024 0.2323-0.0000 ( 8156 PWs) bands (ev): -36.9950 -36.9950 -36.9950 -36.9950 -21.2455 -21.2455 -21.2454 -21.2454 -17.9716 -17.9716 -17.9716 -17.9716 -16.5496 -16.5496 -16.5496 -16.5496 -16.5169 -16.5169 -16.5169 -16.5169 -6.0498 -6.0498 -6.0485 -6.0485 -5.2827 -5.2827 -5.2778 -5.2778 -5.1055 -5.1055 -5.1019 -5.1019 -4.1787 -4.1787 -4.1394 -4.1394 -4.0370 -4.0370 -4.0021 -4.0021 2.4072 2.4072 2.5634 2.5634 3.0854 3.0854 3.1362 3.1362 3.7396 3.7396 3.8594 3.8594 4.1932 4.1932 4.3109 4.3109 4.4045 4.4045 4.5190 4.5190 4.8518 4.8518 4.9865 4.9865 6.9511 6.9511 7.2447 7.2447 8.8803 8.8803 8.9384 8.9384 8.9722 8.9722 9.0002 9.0002 k = 0.4146 0.2394-0.0000 ( 8142 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2451 -21.2451 -21.2451 -21.2451 -17.9719 -17.9719 -17.9719 -17.9719 -16.5505 -16.5505 -16.5505 -16.5505 -16.5170 -16.5170 -16.5170 -16.5170 -6.0521 -6.0521 -6.0506 -6.0506 -5.2848 -5.2848 -5.2797 -5.2797 -5.1021 -5.1021 -5.0992 -5.0992 -4.1735 -4.1735 -4.1259 -4.1259 -4.0376 -4.0376 -3.9959 -3.9959 2.3685 2.3685 2.5280 2.5280 3.0818 3.0818 3.1334 3.1334 3.7666 3.7666 3.8670 3.8670 4.1796 4.1796 4.3110 4.3110 4.3861 4.3861 4.4961 4.4961 4.8392 4.8392 4.9732 4.9732 6.9370 6.9370 7.2336 7.2336 8.9114 8.9114 8.9548 8.9548 8.9917 8.9917 9.0091 9.0091 k = 0.4268 0.2464-0.0000 ( 8162 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2448 -21.2448 -21.2448 -21.2448 -17.9723 -17.9723 -17.9723 -17.9723 -16.5513 -16.5513 -16.5513 -16.5513 -16.5170 -16.5170 -16.5170 -16.5170 -6.0541 -6.0541 -6.0525 -6.0525 -5.2866 -5.2866 -5.2814 -5.2814 -5.0990 -5.0990 -5.0968 -5.0968 -4.1696 -4.1696 -4.1143 -4.1143 -4.0378 -4.0378 -3.9897 -3.9897 2.3341 2.3341 2.4964 2.4964 3.0791 3.0791 3.1310 3.1310 3.7927 3.7927 3.8740 3.8740 4.1651 4.1651 4.3110 4.3110 4.3710 4.3710 4.4751 4.4751 4.8286 4.8286 4.9620 4.9620 6.9247 6.9247 7.2239 7.2239 8.9328 8.9328 8.9695 8.9695 9.0066 9.0066 9.0178 9.0178 k = 0.4390 0.2535-0.0000 ( 8154 PWs) bands (ev): -36.9949 -36.9949 -36.9948 -36.9948 -21.2445 -21.2445 -21.2445 -21.2445 -17.9726 -17.9726 -17.9726 -17.9726 -16.5520 -16.5520 -16.5520 -16.5520 -16.5170 -16.5170 -16.5170 -16.5170 -6.0558 -6.0558 -6.0542 -6.0542 -5.2882 -5.2882 -5.2829 -5.2829 -5.0963 -5.0963 -5.0946 -5.0946 -4.1666 -4.1666 -4.1047 -4.1047 -4.0376 -4.0376 -3.9840 -3.9840 2.3043 2.3043 2.4692 2.4692 3.0772 3.0772 3.1290 3.1290 3.8170 3.8170 3.8804 3.8804 4.1505 4.1505 4.3106 4.3106 4.3598 4.3598 4.4560 4.4560 4.8199 4.8199 4.9529 4.9529 6.9142 6.9142 7.2157 7.2157 8.9397 8.9397 8.9827 8.9827 9.0145 9.0145 9.0309 9.0309 k = 0.4512 0.2605-0.0000 ( 8162 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2443 -21.2443 -21.2443 -21.2443 -17.9728 -17.9728 -17.9728 -17.9728 -16.5526 -16.5526 -16.5526 -16.5526 -16.5170 -16.5170 -16.5170 -16.5170 -6.0573 -6.0573 -6.0556 -6.0556 -5.2895 -5.2895 -5.2841 -5.2841 -5.0940 -5.0940 -5.0928 -5.0928 -4.1645 -4.1645 -4.0970 -4.0970 -4.0372 -4.0372 -3.9788 -3.9788 2.2795 2.2795 2.4466 2.4466 3.0760 3.0760 3.1275 3.1275 3.8389 3.8389 3.8858 3.8858 4.1362 4.1362 4.3094 4.3094 4.3528 4.3528 4.4391 4.4391 4.8129 4.8129 4.9457 4.9457 6.9056 6.9056 7.2090 7.2090 8.9345 8.9345 8.9941 8.9941 9.0241 9.0241 9.0434 9.0434 k = 0.4634 0.2676-0.0000 ( 8170 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2442 -21.2442 -21.2442 -21.2442 -17.9730 -17.9730 -17.9730 -17.9730 -16.5531 -16.5531 -16.5531 -16.5531 -16.5171 -16.5171 -16.5171 -16.5171 -6.0585 -6.0585 -6.0567 -6.0567 -5.2906 -5.2906 -5.2851 -5.2851 -5.0922 -5.0922 -5.0913 -5.0913 -4.1631 -4.1631 -4.0911 -4.0911 -4.0367 -4.0367 -3.9745 -3.9745 2.2600 2.2600 2.4288 2.4288 3.0751 3.0751 3.1263 3.1263 3.8575 3.8575 3.8902 3.8902 4.1233 4.1233 4.3074 4.3074 4.3500 4.3500 4.4246 4.4246 4.8076 4.8076 4.9403 4.9403 6.8988 6.8988 7.2038 7.2038 8.9252 8.9252 9.0031 9.0031 9.0342 9.0342 9.0524 9.0524 k = 0.4756 0.2746-0.0000 ( 8166 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2440 -21.2440 -21.2440 -21.2440 -17.9732 -17.9732 -17.9732 -17.9732 -16.5534 -16.5534 -16.5534 -16.5534 -16.5171 -16.5171 -16.5171 -16.5171 -6.0593 -6.0593 -6.0575 -6.0575 -5.2913 -5.2913 -5.2858 -5.2858 -5.0909 -5.0909 -5.0902 -5.0902 -4.1622 -4.1622 -4.0870 -4.0870 -4.0363 -4.0363 -3.9713 -3.9713 2.2459 2.2459 2.4160 2.4160 3.0746 3.0746 3.1255 3.1255 3.8716 3.8716 3.8937 3.8937 4.1128 4.1128 4.3051 4.3051 4.3500 4.3500 4.4130 4.4130 4.8039 4.8039 4.9365 4.9365 6.8940 6.8940 7.2000 7.2000 8.9167 8.9167 9.0097 9.0097 9.0423 9.0423 9.0588 9.0588 k = 0.4878 0.2816-0.0000 ( 8162 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2440 -21.2440 -17.9732 -17.9732 -17.9732 -17.9732 -16.5536 -16.5536 -16.5536 -16.5536 -16.5171 -16.5171 -16.5171 -16.5171 -6.0598 -6.0598 -6.0579 -6.0579 -5.2918 -5.2918 -5.2862 -5.2862 -5.0902 -5.0902 -5.0895 -5.0895 -4.1617 -4.1617 -4.0846 -4.0846 -4.0360 -4.0360 -3.9693 -3.9693 2.2374 2.2374 2.4082 2.4082 3.0744 3.0744 3.1251 3.1251 3.8802 3.8802 3.8962 3.8962 4.1058 4.1058 4.3034 4.3034 4.3513 4.3513 4.4052 4.4052 4.8017 4.8017 4.9343 4.9343 6.8911 6.8911 7.1978 7.1978 8.9111 8.9111 9.0138 9.0138 9.0473 9.0473 9.0628 9.0628 k = 0.5000 0.2887-0.0000 ( 8166 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0600 -6.0600 -6.0581 -6.0581 -5.2920 -5.2920 -5.2864 -5.2864 -5.0899 -5.0899 -5.0892 -5.0892 -4.1615 -4.1615 -4.0838 -4.0838 -4.0359 -4.0359 -3.9686 -3.9686 2.2346 2.2346 2.4056 2.4056 3.0743 3.0743 3.1249 3.1249 3.8830 3.8830 3.8973 3.8973 4.1034 4.1034 4.3027 4.3027 4.3520 4.3520 4.4024 4.4024 4.8010 4.8010 4.9335 4.9335 6.8901 6.8901 7.1970 7.1970 8.9091 8.9091 9.0152 9.0152 9.0490 9.0490 9.0641 9.0641 k = 0.5000 0.2887-0.0000 ( 8166 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0600 -6.0600 -6.0581 -6.0581 -5.2920 -5.2920 -5.2864 -5.2864 -5.0899 -5.0899 -5.0892 -5.0892 -4.1615 -4.1615 -4.0838 -4.0838 -4.0359 -4.0359 -3.9686 -3.9686 2.2346 2.2346 2.4056 2.4056 3.0743 3.0743 3.1249 3.1249 3.8830 3.8830 3.8973 3.8973 4.1034 4.1034 4.3027 4.3027 4.3520 4.3520 4.4024 4.4024 4.8010 4.8010 4.9335 4.9335 6.8901 6.8901 7.1970 7.1970 8.9091 8.9091 9.0152 9.0152 9.0490 9.0490 9.0641 9.0641 k = 0.4931 0.3007-0.0000 ( 8168 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5536 -16.5536 -16.5171 -16.5171 -16.5171 -16.5171 -6.0610 -6.0610 -6.0570 -6.0570 -5.2935 -5.2935 -5.2848 -5.2848 -5.0901 -5.0901 -5.0894 -5.0894 -4.1612 -4.1612 -4.0833 -4.0833 -4.0360 -4.0360 -3.9686 -3.9686 2.2361 2.2361 2.4068 2.4068 3.0745 3.0745 3.1252 3.1252 3.8828 3.8828 3.8969 3.8969 4.1030 4.1030 4.3015 4.3015 4.3514 4.3514 4.4006 4.4006 4.7956 4.7956 4.9279 4.9279 6.8959 6.8959 7.2030 7.2030 8.9103 8.9103 9.0131 9.0131 9.0405 9.0405 9.0604 9.0604 k = 0.4861 0.3127-0.0000 ( 8172 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5536 -16.5536 -16.5536 -16.5536 -16.5173 -16.5173 -16.5173 -16.5173 -6.0625 -6.0625 -6.0553 -6.0553 -5.2963 -5.2963 -5.2819 -5.2819 -5.0905 -5.0905 -5.0897 -5.0897 -4.1604 -4.1604 -4.0821 -4.0821 -4.0363 -4.0363 -3.9684 -3.9684 2.2406 2.2406 2.4102 2.4102 3.0749 3.0749 3.1260 3.1260 3.8820 3.8820 3.8959 3.8959 4.1020 4.1020 4.2978 4.2978 4.3495 4.3495 4.3951 4.3951 4.7799 4.7799 4.9115 4.9115 6.9131 6.9131 7.2206 7.2206 8.9136 8.9136 9.0069 9.0069 9.0248 9.0248 9.0540 9.0540 k = 0.4792 0.3248-0.0000 ( 8168 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5535 -16.5535 -16.5535 -16.5535 -16.5175 -16.5175 -16.5175 -16.5175 -6.0641 -6.0641 -6.0535 -6.0535 -5.2993 -5.2993 -5.2787 -5.2787 -5.0913 -5.0913 -5.0903 -5.0903 -4.1591 -4.1591 -4.0801 -4.0801 -4.0369 -4.0369 -3.9680 -3.9680 2.2481 2.2481 2.4158 2.4158 3.0755 3.0755 3.1272 3.1272 3.8805 3.8805 3.8940 3.8940 4.1004 4.1004 4.2920 4.2920 4.3462 4.3462 4.3856 4.3856 4.7547 4.7547 4.8856 4.8856 6.9409 6.9409 7.2492 7.2492 8.9179 8.9179 8.9971 8.9971 9.0084 9.0084 9.0449 9.0449 k = 0.4722 0.3368-0.0000 ( 8160 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2438 -21.2438 -21.2438 -21.2438 -17.9734 -17.9734 -17.9734 -17.9734 -16.5533 -16.5533 -16.5533 -16.5533 -16.5178 -16.5178 -16.5178 -16.5178 -6.0656 -6.0656 -6.0517 -6.0517 -5.3025 -5.3025 -5.2753 -5.2753 -5.0925 -5.0925 -5.0910 -5.0910 -4.1573 -4.1573 -4.0773 -4.0773 -4.0377 -4.0377 -3.9675 -3.9675 2.2585 2.2585 2.4238 2.4238 3.0764 3.0764 3.1289 3.1289 3.8782 3.8782 3.8911 3.8911 4.0986 4.0986 4.2844 4.2844 4.3409 4.3409 4.3715 4.3715 4.7215 4.7215 4.8520 4.8520 6.9779 6.9779 7.2876 7.2876 8.9219 8.9219 8.9847 8.9847 8.9927 8.9927 9.0333 9.0333 k = 0.4653 0.3488-0.0000 ( 8156 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2438 -21.2438 -21.2438 -21.2438 -17.9734 -17.9734 -17.9734 -17.9734 -16.5531 -16.5531 -16.5531 -16.5531 -16.5183 -16.5183 -16.5183 -16.5183 -6.0671 -6.0671 -6.0498 -6.0498 -5.3057 -5.3057 -5.2718 -5.2718 -5.0940 -5.0940 -5.0918 -5.0918 -4.1551 -4.1551 -4.0739 -4.0739 -4.0388 -4.0388 -3.9669 -3.9669 2.2719 2.2719 2.4339 2.4339 3.0774 3.0774 3.1312 3.1312 3.8747 3.8747 3.8872 3.8872 4.0967 4.0967 4.2753 4.2753 4.3330 4.3330 4.3523 4.3523 4.6824 4.6824 4.8130 4.8130 7.0230 7.0230 7.3343 7.3343 8.9232 8.9232 8.9706 8.9706 8.9784 8.9784 9.0197 9.0197 k = 0.4583 0.3608-0.0000 ( 8164 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2437 -21.2437 -21.2437 -21.2437 -17.9735 -17.9735 -17.9735 -17.9735 -16.5528 -16.5528 -16.5528 -16.5528 -16.5188 -16.5188 -16.5188 -16.5188 -6.0685 -6.0685 -6.0479 -6.0479 -5.3089 -5.3089 -5.2682 -5.2682 -5.0959 -5.0959 -5.0926 -5.0926 -4.1523 -4.1523 -4.0697 -4.0697 -4.0400 -4.0400 -3.9662 -3.9662 2.2881 2.2881 2.4461 2.4461 3.0784 3.0784 3.1338 3.1338 3.8696 3.8696 3.8821 3.8821 4.0951 4.0951 4.2651 4.2651 4.3215 4.3215 4.3274 4.3274 4.6397 4.6397 4.7711 4.7711 7.0745 7.0745 7.3878 7.3878 8.9197 8.9197 8.9556 8.9556 8.9660 8.9660 9.0048 9.0048 k = 0.4514 0.3729-0.0000 ( 8170 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2436 -21.2436 -21.2436 -21.2436 -17.9736 -17.9736 -17.9736 -17.9736 -16.5525 -16.5525 -16.5525 -16.5525 -16.5194 -16.5194 -16.5194 -16.5194 -6.0698 -6.0698 -6.0460 -6.0460 -5.3122 -5.3122 -5.2646 -5.2646 -5.0980 -5.0980 -5.0935 -5.0935 -4.1492 -4.1492 -4.0649 -4.0649 -4.0414 -4.0414 -3.9654 -3.9654 2.3072 2.3072 2.4605 2.4605 3.0795 3.0795 3.1368 3.1368 3.8621 3.8621 3.8755 3.8755 4.0938 4.0938 4.2541 4.2541 4.2964 4.2964 4.3062 4.3062 4.5962 4.5962 4.7284 4.7284 7.1314 7.1314 7.4466 7.4466 8.9105 8.9105 8.9399 8.9399 8.9553 8.9553 8.9894 8.9894 k = 0.4444 0.3849-0.0000 ( 8162 PWs) bands (ev): -36.9947 -36.9947 -36.9946 -36.9946 -21.2435 -21.2435 -21.2435 -21.2435 -17.9737 -17.9737 -17.9737 -17.9737 -16.5522 -16.5522 -16.5522 -16.5522 -16.5200 -16.5200 -16.5200 -16.5200 -6.0711 -6.0711 -6.0442 -6.0442 -5.3155 -5.3155 -5.2610 -5.2610 -5.1004 -5.1004 -5.0944 -5.0944 -4.1457 -4.1457 -4.0598 -4.0598 -4.0429 -4.0429 -3.9645 -3.9645 2.3290 2.3290 2.4769 2.4769 3.0804 3.0804 3.1402 3.1402 3.8516 3.8516 3.8671 3.8671 4.0928 4.0928 4.2413 4.2413 4.2610 4.2610 4.2857 4.2857 4.5549 4.5549 4.6867 4.6867 7.1923 7.1923 7.5092 7.5092 8.8969 8.8969 8.9227 8.9227 8.9441 8.9441 8.9750 8.9750 k = 0.4375 0.3969-0.0000 ( 8158 PWs) bands (ev): -36.9947 -36.9947 -36.9946 -36.9946 -21.2434 -21.2434 -21.2434 -21.2434 -17.9738 -17.9738 -17.9738 -17.9738 -16.5518 -16.5518 -16.5518 -16.5518 -16.5207 -16.5207 -16.5207 -16.5207 -6.0723 -6.0723 -6.0424 -6.0424 -5.3189 -5.3189 -5.2573 -5.2573 -5.1031 -5.1031 -5.0952 -5.0952 -4.1418 -4.1418 -4.0545 -4.0545 -4.0441 -4.0441 -3.9635 -3.9635 2.3535 2.3535 2.4953 2.4953 3.0811 3.0811 3.1438 3.1438 3.8374 3.8374 3.8562 3.8562 4.0918 4.0918 4.2151 4.2151 4.2325 4.2325 4.2619 4.2619 4.5183 4.5183 4.6470 4.6470 7.2563 7.2563 7.5741 7.5741 8.8806 8.8806 8.9035 8.9035 8.9308 8.9308 8.9625 8.9625 k = 0.4306 0.4090-0.0000 ( 8170 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2432 -21.2432 -21.2432 -21.2432 -17.9739 -17.9739 -17.9739 -17.9739 -16.5514 -16.5514 -16.5514 -16.5514 -16.5215 -16.5215 -16.5215 -16.5215 -6.0735 -6.0735 -6.0406 -6.0406 -5.3222 -5.3222 -5.2537 -5.2537 -5.1059 -5.1059 -5.0959 -5.0959 -4.1376 -4.1376 -4.0511 -4.0511 -4.0433 -4.0433 -3.9625 -3.9625 2.3806 2.3806 2.5155 2.5155 3.0816 3.0816 3.1475 3.1475 3.8187 3.8187 3.8416 3.8416 4.0893 4.0893 4.1742 4.1742 4.2105 4.2105 4.2413 4.2413 4.4875 4.4875 4.6099 4.6099 7.3228 7.3228 7.6400 7.6400 8.8619 8.8619 8.8822 8.8822 8.9149 8.9149 8.9527 8.9527 k = 0.4236 0.4210-0.0000 ( 8164 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2431 -21.2431 -21.2431 -21.2431 -17.9741 -17.9741 -17.9741 -17.9741 -16.5510 -16.5510 -16.5510 -16.5510 -16.5223 -16.5223 -16.5223 -16.5223 -6.0746 -6.0746 -6.0389 -6.0389 -5.3256 -5.3256 -5.2501 -5.2501 -5.1088 -5.1088 -5.0965 -5.0965 -4.1332 -4.1332 -4.0514 -4.0514 -4.0385 -4.0385 -3.9614 -3.9614 2.4102 2.4102 2.5375 2.5375 3.0816 3.0816 3.1512 3.1512 3.7948 3.7948 3.8218 3.8218 4.0806 4.0806 4.1377 4.1377 4.1817 4.1817 4.2285 4.2285 4.4621 4.4621 4.5754 4.5754 7.3909 7.3909 7.7057 7.7057 8.8403 8.8403 8.8592 8.8592 8.8975 8.8975 8.9451 8.9451 k = 0.4167 0.4330-0.0000 ( 8160 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2430 -21.2430 -21.2430 -21.2430 -17.9742 -17.9742 -17.9742 -17.9742 -16.5506 -16.5506 -16.5506 -16.5506 -16.5232 -16.5232 -16.5232 -16.5232 -6.0756 -6.0756 -6.0373 -6.0373 -5.3290 -5.3290 -5.2465 -5.2465 -5.1119 -5.1119 -5.0970 -5.0970 -4.1286 -4.1286 -4.0533 -4.0533 -4.0321 -4.0321 -3.9603 -3.9603 2.4422 2.4422 2.5610 2.5610 3.0812 3.0812 3.1545 3.1545 3.7648 3.7648 3.7950 3.7950 4.0576 4.0576 4.1162 4.1162 4.1536 4.1536 4.2200 4.2200 4.4407 4.4407 4.5432 4.5432 7.4604 7.4604 7.7701 7.7701 8.8151 8.8151 8.8354 8.8354 8.8797 8.8797 8.9391 8.9391 k = 0.4097 0.4450-0.0000 ( 8160 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2429 -21.2429 -21.2429 -21.2429 -17.9743 -17.9743 -17.9743 -17.9743 -16.5501 -16.5501 -16.5501 -16.5501 -16.5240 -16.5240 -16.5240 -16.5240 -6.0766 -6.0766 -6.0358 -6.0358 -5.3323 -5.3323 -5.2431 -5.2431 -5.1149 -5.1149 -5.0973 -5.0973 -4.1239 -4.1239 -4.0556 -4.0556 -4.0253 -4.0253 -3.9591 -3.9591 2.4764 2.4764 2.5860 2.5860 3.0801 3.0801 3.1574 3.1574 3.7280 3.7280 3.7605 3.7605 4.0271 4.0271 4.1009 4.1009 4.1356 4.1356 4.2137 4.2137 4.4221 4.4221 4.5132 4.5132 7.5306 7.5306 7.8322 7.8322 8.7859 8.7859 8.8116 8.8116 8.8623 8.8623 8.9340 8.9340 k = 0.4028 0.4571-0.0000 ( 8168 PWs) bands (ev): -36.9946 -36.9946 -36.9945 -36.9945 -21.2427 -21.2427 -21.2427 -21.2427 -17.9745 -17.9745 -17.9745 -17.9745 -16.5497 -16.5497 -16.5497 -16.5497 -16.5249 -16.5249 -16.5249 -16.5249 -6.0776 -6.0776 -6.0344 -6.0344 -5.3355 -5.3355 -5.2398 -5.2398 -5.1179 -5.1179 -5.0975 -5.0975 -4.1191 -4.1191 -4.0581 -4.0581 -4.0183 -4.0183 -3.9580 -3.9580 2.5127 2.5127 2.6123 2.6123 3.0782 3.0782 3.1595 3.1595 3.6840 3.6840 3.7194 3.7194 3.9998 3.9998 4.0823 4.0823 4.1302 4.1302 4.2092 4.2092 4.4050 4.4050 4.4855 4.4855 7.6011 7.6011 7.8909 7.8909 8.7535 8.7535 8.7887 8.7887 8.8454 8.8454 8.9291 8.9291 k = 0.3958 0.4691-0.0000 ( 8172 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2426 -21.2426 -21.2426 -21.2426 -17.9746 -17.9746 -17.9746 -17.9746 -16.5492 -16.5492 -16.5492 -16.5492 -16.5258 -16.5258 -16.5258 -16.5258 -6.0784 -6.0784 -6.0332 -6.0332 -5.3387 -5.3387 -5.2367 -5.2367 -5.1208 -5.1208 -5.0975 -5.0975 -4.1144 -4.1144 -4.0606 -4.0606 -4.0115 -4.0115 -3.9568 -3.9568 2.5509 2.5509 2.6395 2.6395 3.0753 3.0753 3.1603 3.1603 3.6334 3.6334 3.6746 3.6746 3.9782 3.9782 4.0652 4.0652 4.1299 4.1299 4.2061 4.2061 4.3883 4.3883 4.4603 4.4603 7.6716 7.6716 7.9454 7.9454 8.7186 8.7186 8.7677 8.7677 8.8282 8.8282 8.9237 8.9237 k = 0.3889 0.4811-0.0000 ( 8176 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2425 -21.2425 -21.2425 -21.2425 -17.9747 -17.9747 -17.9747 -17.9747 -16.5488 -16.5488 -16.5488 -16.5488 -16.5266 -16.5266 -16.5266 -16.5266 -6.0792 -6.0792 -6.0320 -6.0320 -5.3416 -5.3416 -5.2339 -5.2339 -5.1235 -5.1235 -5.0974 -5.0974 -4.1097 -4.1097 -4.0632 -4.0632 -4.0049 -4.0049 -3.9556 -3.9556 2.5908 2.5908 2.6674 2.6674 3.0711 3.0711 3.1596 3.1596 3.5780 3.5780 3.6292 3.6292 3.9618 3.9618 4.0522 4.0522 4.1310 4.1310 4.2044 4.2044 4.3714 4.3714 4.4381 4.4381 7.7414 7.7414 7.9947 7.9947 8.6824 8.6824 8.7496 8.7496 8.8100 8.8100 8.9175 8.9175 k = 0.3819 0.4932-0.0000 ( 8180 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2424 -21.2424 -21.2423 -21.2423 -17.9748 -17.9748 -17.9748 -17.9748 -16.5484 -16.5484 -16.5484 -16.5484 -16.5274 -16.5274 -16.5274 -16.5274 -6.0800 -6.0800 -6.0310 -6.0310 -5.3444 -5.3444 -5.2313 -5.2313 -5.1259 -5.1259 -5.0972 -5.0972 -4.1052 -4.1052 -4.0658 -4.0658 -3.9987 -3.9987 -3.9544 -3.9544 2.6321 2.6321 2.6956 2.6956 3.0653 3.0653 3.1567 3.1567 3.5206 3.5206 3.5854 3.5854 3.9493 3.9493 4.0434 4.0434 4.1319 4.1319 4.2041 4.2041 4.3537 4.3537 4.4192 4.4192 7.8099 7.8099 8.0380 8.0380 8.6463 8.6463 8.7353 8.7353 8.7903 8.7903 8.9100 8.9100 k = 0.3750 0.5052-0.0000 ( 8176 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2422 -21.2422 -21.2422 -21.2422 -17.9749 -17.9749 -17.9749 -17.9749 -16.5480 -16.5480 -16.5480 -16.5480 -16.5281 -16.5281 -16.5281 -16.5281 -6.0807 -6.0807 -6.0302 -6.0302 -5.3469 -5.3469 -5.2291 -5.2291 -5.1281 -5.1281 -5.0969 -5.0969 -4.1009 -4.1009 -4.0682 -4.0682 -3.9931 -3.9931 -3.9531 -3.9531 2.6744 2.6744 2.7237 2.7237 3.0573 3.0573 3.1515 3.1515 3.4643 3.4643 3.5450 3.5450 3.9398 3.9398 4.0382 4.0382 4.1322 4.1322 4.2050 4.2050 4.3353 4.3353 4.4039 4.4039 7.8760 7.8760 8.0745 8.0745 8.6117 8.6117 8.7254 8.7254 8.7687 8.7687 8.9011 8.9011 k = 0.3681 0.5172-0.0000 ( 8176 PWs) bands (ev): -36.9945 -36.9945 -36.9944 -36.9944 -21.2421 -21.2421 -21.2421 -21.2421 -17.9750 -17.9750 -17.9750 -17.9750 -16.5476 -16.5476 -16.5476 -16.5476 -16.5288 -16.5288 -16.5288 -16.5288 -6.0813 -6.0813 -6.0295 -6.0295 -5.3491 -5.3491 -5.2272 -5.2272 -5.1299 -5.1299 -5.0966 -5.0966 -4.0970 -4.0970 -4.0705 -4.0705 -3.9883 -3.9883 -3.9518 -3.9518 2.7173 2.7173 2.7510 2.7510 3.0462 3.0462 3.1437 3.1437 3.4117 3.4117 3.5097 3.5097 3.9326 3.9326 4.0359 4.0359 4.1316 4.1316 4.2072 4.2072 4.3167 4.3167 4.3919 4.3919 7.9383 7.9383 8.1039 8.1039 8.5805 8.5805 8.7203 8.7203 8.7455 8.7455 8.8909 8.8909 k = 0.3611 0.5292-0.0000 ( 8168 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2421 -21.2421 -21.2420 -21.2420 -17.9751 -17.9751 -17.9751 -17.9751 -16.5473 -16.5473 -16.5473 -16.5473 -16.5293 -16.5293 -16.5293 -16.5293 -6.0818 -6.0818 -6.0290 -6.0290 -5.3510 -5.3510 -5.2257 -5.2257 -5.1314 -5.1314 -5.0962 -5.0962 -4.0936 -4.0936 -4.0726 -4.0726 -3.9842 -3.9842 -3.9505 -3.9505 2.7593 2.7593 2.7775 2.7775 3.0313 3.0313 3.1336 3.1336 3.3652 3.3652 3.4807 3.4807 3.9272 3.9272 4.0357 4.0357 4.1305 4.1305 4.2106 4.2106 4.2986 4.2986 4.3825 4.3825 7.9947 7.9947 8.1261 8.1261 8.5548 8.5548 8.7148 8.7148 8.7260 8.7260 8.8795 8.8795 k = 0.3542 0.5413-0.0000 ( 8160 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2420 -21.2420 -21.2420 -21.2420 -17.9752 -17.9752 -17.9752 -17.9752 -16.5471 -16.5471 -16.5471 -16.5471 -16.5298 -16.5298 -16.5298 -16.5298 -6.0822 -6.0822 -6.0286 -6.0286 -5.3525 -5.3525 -5.2245 -5.2245 -5.1325 -5.1325 -5.0959 -5.0959 -4.0908 -4.0908 -4.0742 -4.0742 -3.9811 -3.9811 -3.9492 -3.9492 2.7931 2.7931 2.8085 2.8085 3.0118 3.0118 3.1223 3.1223 3.3272 3.3272 3.4585 3.4585 3.9232 3.9232 4.0368 4.0368 4.1291 4.1291 4.2151 4.2151 4.2818 4.2818 4.3755 4.3755 8.0423 8.0423 8.1416 8.1416 8.5376 8.5376 8.6913 8.6913 8.7275 8.7275 8.8676 8.8676 k = 0.3472 0.5533-0.0000 ( 8150 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5470 -16.5470 -16.5470 -16.5470 -16.5301 -16.5301 -16.5301 -16.5301 -6.0825 -6.0825 -6.0283 -6.0283 -5.3536 -5.3536 -5.2238 -5.2238 -5.1332 -5.1332 -5.0956 -5.0956 -4.0887 -4.0887 -4.0754 -4.0754 -3.9790 -3.9790 -3.9481 -3.9481 2.8126 2.8126 2.8476 2.8476 2.9875 2.9875 3.1118 3.1118 3.2993 3.2993 3.4433 3.4433 3.9206 3.9206 4.0383 4.0383 4.1280 4.1280 4.2204 4.2204 4.2671 4.2671 4.3705 4.3705 8.0777 8.0777 8.1513 8.1513 8.5314 8.5314 8.6650 8.6650 8.7345 8.7345 8.8560 8.8560 k = 0.3403 0.5653-0.0000 ( 8144 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0827 -6.0827 -6.0281 -6.0281 -5.3543 -5.3543 -5.2233 -5.2233 -5.1336 -5.1336 -5.0954 -5.0954 -4.0876 -4.0876 -4.0761 -4.0761 -3.9777 -3.9777 -3.9473 -3.9473 2.8240 2.8240 2.8848 2.8848 2.9600 2.9600 3.1042 3.1042 3.2826 3.2826 3.4346 3.4346 3.9190 3.9190 4.0395 4.0395 4.1275 4.1275 4.2259 4.2259 4.2555 4.2555 4.3674 4.3674 8.0984 8.0984 8.1562 8.1562 8.5359 8.5359 8.6412 8.6412 8.7417 8.7417 8.8468 8.8468 k = 0.3333 0.5774-0.0000 ( 8124 PWs) bands (ev): -36.9944 -36.9944 -36.9943 -36.9943 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8278 2.8278 2.9076 2.9076 2.9404 2.9404 3.1014 3.1014 3.2771 3.2771 3.4318 3.4318 3.9184 3.9184 4.0400 4.0400 4.1275 4.1275 4.2289 4.2289 4.2503 4.2503 4.3663 4.3663 8.1048 8.1048 8.1576 8.1576 8.5419 8.5419 8.6294 8.6294 8.7451 8.7451 8.8430 8.8430 k = 0.3333 0.5774-0.0000 ( 8124 PWs) bands (ev): -36.9944 -36.9944 -36.9943 -36.9943 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8278 2.8278 2.9076 2.9076 2.9404 2.9404 3.1014 3.1014 3.2771 3.2771 3.4318 3.4318 3.9184 3.9184 4.0400 4.0400 4.1275 4.1275 4.2289 4.2289 4.2503 4.2503 4.3663 4.3663 8.1048 8.1048 8.1576 8.1576 8.5419 8.5419 8.6294 8.6294 8.7451 8.7451 8.8430 8.8430 k = 0.3264 0.5653-0.0000 ( 8140 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0827 -6.0827 -6.0281 -6.0281 -5.3542 -5.3542 -5.2233 -5.2233 -5.1336 -5.1336 -5.0954 -5.0954 -4.0875 -4.0875 -4.0762 -4.0762 -3.9777 -3.9777 -3.9473 -3.9473 2.8244 2.8244 2.8867 2.8867 2.9582 2.9582 3.1041 3.1041 3.2824 3.2824 3.4345 3.4345 3.9190 3.9190 4.0396 4.0396 4.1270 4.1270 4.2264 4.2264 4.2552 4.2552 4.3675 4.3675 8.0997 8.0997 8.1565 8.1565 8.5315 8.5315 8.6442 8.6442 8.7411 8.7411 8.8473 8.8473 k = 0.3194 0.5533-0.0000 ( 8156 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9752 -17.9752 -17.9752 -17.9752 -16.5469 -16.5469 -16.5469 -16.5469 -16.5301 -16.5301 -16.5301 -16.5301 -6.0825 -6.0825 -6.0282 -6.0282 -5.3535 -5.3535 -5.2236 -5.2236 -5.1334 -5.1334 -5.0957 -5.0957 -4.0879 -4.0879 -4.0763 -4.0763 -3.9788 -3.9788 -3.9485 -3.9485 2.8154 2.8154 2.8558 2.8558 2.9802 2.9802 3.1112 3.1112 3.2981 3.2981 3.4422 3.4422 3.9208 3.9208 4.0389 4.0389 4.1247 4.1247 4.2228 4.2228 4.2662 4.2662 4.3716 4.3716 8.0870 8.0870 8.1538 8.1538 8.5063 8.5063 8.6793 8.6793 8.7303 8.7303 8.8587 8.8587 k = 0.3125 0.5413-0.0000 ( 8166 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2420 -21.2420 -21.2420 -21.2420 -17.9752 -17.9752 -17.9752 -17.9752 -16.5470 -16.5470 -16.5470 -16.5470 -16.5298 -16.5298 -16.5298 -16.5298 -6.0821 -6.0821 -6.0284 -6.0284 -5.3524 -5.3524 -5.2241 -5.2241 -5.1330 -5.1330 -5.0962 -5.0962 -4.0884 -4.0884 -4.0768 -4.0768 -3.9807 -3.9807 -3.9506 -3.9506 2.8029 2.8029 2.8258 2.8258 2.9967 2.9967 3.1208 3.1208 3.3228 3.3228 3.4548 3.4548 3.9239 3.9239 4.0383 4.0383 4.1192 4.1192 4.2206 4.2206 4.2807 4.2807 4.3792 4.3792 8.0700 8.0700 8.1501 8.1501 8.4753 8.4753 8.7075 8.7075 8.7291 8.7291 8.8746 8.8746 k = 0.3056 0.5292-0.0000 ( 8166 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2421 -21.2421 -21.2421 -21.2421 -17.9751 -17.9751 -17.9751 -17.9751 -16.5471 -16.5471 -16.5471 -16.5471 -16.5295 -16.5295 -16.5295 -16.5295 -6.0815 -6.0815 -6.0285 -6.0285 -5.3507 -5.3507 -5.2247 -5.2247 -5.1326 -5.1326 -5.0970 -5.0970 -4.0889 -4.0889 -4.0777 -4.0777 -3.9833 -3.9833 -3.9537 -3.9537 2.7885 2.7885 2.7993 2.7993 3.0076 3.0076 3.1310 3.1310 3.3548 3.3548 3.4721 3.4721 3.9287 3.9287 4.0384 4.0384 4.1105 4.1105 4.2191 4.2191 4.2983 4.2983 4.3908 4.3908 8.0511 8.0511 8.1459 8.1459 8.4417 8.4417 8.6914 8.6914 8.7702 8.7702 8.8926 8.8926 k = 0.2986 0.5172-0.0000 ( 8180 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2422 -21.2422 -21.2422 -21.2422 -17.9750 -17.9750 -17.9750 -17.9750 -16.5471 -16.5471 -16.5471 -16.5471 -16.5291 -16.5291 -16.5291 -16.5291 -6.0807 -6.0807 -6.0287 -6.0287 -5.3486 -5.3486 -5.2253 -5.2253 -5.1322 -5.1322 -5.0980 -5.0980 -4.0897 -4.0897 -4.0787 -4.0787 -3.9869 -3.9869 -3.9577 -3.9577 2.7707 2.7707 2.7802 2.7802 3.0140 3.0140 3.1404 3.1404 3.3921 3.3921 3.4938 3.4938 3.9354 3.9354 4.0390 4.0390 4.0995 4.0995 4.2171 4.2171 4.3191 4.3191 4.4069 4.4069 8.0317 8.0317 8.1414 8.1414 8.4067 8.4067 8.6701 8.6701 8.8111 8.8111 8.9113 8.9113 k = 0.2917 0.5052-0.0000 ( 8180 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2424 -21.2424 -21.2424 -21.2424 -17.9748 -17.9748 -17.9748 -17.9748 -16.5472 -16.5472 -16.5472 -16.5472 -16.5286 -16.5286 -16.5286 -16.5286 -6.0798 -6.0798 -6.0288 -6.0288 -5.3460 -5.3460 -5.2259 -5.2259 -5.1318 -5.1318 -5.0993 -5.0993 -4.0912 -4.0912 -4.0794 -4.0794 -3.9916 -3.9916 -3.9624 -3.9624 2.7520 2.7520 2.7679 2.7679 3.0172 3.0172 3.1483 3.1483 3.4324 3.4324 3.5195 3.5195 3.9440 3.9440 4.0392 4.0392 4.0884 4.0884 4.2138 4.2138 4.3429 4.3429 4.4272 4.4272 8.0128 8.0128 8.1366 8.1366 8.3709 8.3709 8.6472 8.6472 8.8458 8.8458 8.9300 8.9300 k = 0.2847 0.4932-0.0000 ( 8166 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2425 -21.2425 -21.2425 -21.2425 -17.9746 -17.9746 -17.9746 -17.9746 -16.5471 -16.5471 -16.5471 -16.5471 -16.5281 -16.5281 -16.5281 -16.5281 -6.0786 -6.0786 -6.0289 -6.0289 -5.3430 -5.3430 -5.2266 -5.2266 -5.1316 -5.1316 -5.1010 -5.1010 -4.0939 -4.0939 -4.0794 -4.0794 -3.9977 -3.9977 -3.9675 -3.9675 2.7368 2.7368 2.7590 2.7590 3.0182 3.0182 3.1544 3.1544 3.4739 3.4739 3.5489 3.5489 3.9548 3.9548 4.0356 4.0356 4.0814 4.0814 4.2090 4.2090 4.3694 4.3694 4.4516 4.4516 7.9947 7.9947 8.1315 8.1315 8.3344 8.3344 8.6233 8.6233 8.8717 8.8717 8.9483 8.9483 k = 0.2778 0.4811-0.0000 ( 8164 PWs) bands (ev): -36.9946 -36.9946 -36.9945 -36.9945 -21.2428 -21.2428 -21.2428 -21.2428 -17.9744 -17.9744 -17.9744 -17.9744 -16.5470 -16.5470 -16.5470 -16.5470 -16.5275 -16.5275 -16.5275 -16.5275 -6.0772 -6.0772 -6.0289 -6.0289 -5.3395 -5.3395 -5.2273 -5.2273 -5.1314 -5.1314 -5.1030 -5.1030 -4.0980 -4.0980 -4.0786 -4.0786 -4.0055 -4.0055 -3.9729 -3.9729 2.7261 2.7261 2.7534 2.7534 3.0178 3.0178 3.1589 3.1589 3.5149 3.5149 3.5815 3.5815 3.9675 3.9675 4.0250 4.0250 4.0830 4.0830 4.2030 4.2030 4.3982 4.3982 4.4796 4.4796 7.9778 7.9778 8.1261 8.1261 8.2974 8.2974 8.5986 8.5986 8.8877 8.8877 8.9659 8.9659 k = 0.2708 0.4691-0.0000 ( 8172 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2430 -21.2430 -21.2430 -21.2430 -17.9741 -17.9741 -17.9741 -17.9741 -16.5469 -16.5469 -16.5469 -16.5469 -16.5270 -16.5270 -16.5270 -16.5270 -6.0755 -6.0755 -6.0288 -6.0288 -5.3357 -5.3357 -5.2280 -5.2280 -5.1313 -5.1313 -5.1053 -5.1053 -4.1031 -4.1031 -4.0770 -4.0770 -4.0152 -4.0152 -3.9783 -3.9783 2.7202 2.7202 2.7514 2.7514 3.0164 3.0164 3.1620 3.1620 3.5539 3.5539 3.6168 3.6168 3.9807 3.9807 4.0108 4.0108 4.0919 4.0919 4.1965 4.1965 4.4290 4.4290 4.5107 4.5107 7.9620 7.9620 8.1201 8.1201 8.2602 8.2602 8.5734 8.5734 8.8943 8.8943 8.9826 8.9826 k = 0.2639 0.4571-0.0000 ( 8172 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2433 -21.2433 -21.2433 -21.2433 -17.9738 -17.9738 -17.9738 -17.9738 -16.5466 -16.5466 -16.5466 -16.5466 -16.5264 -16.5264 -16.5264 -16.5264 -6.0737 -6.0737 -6.0286 -6.0286 -5.3314 -5.3314 -5.2287 -5.2287 -5.1314 -5.1314 -5.1079 -5.1079 -4.1094 -4.1094 -4.0749 -4.0749 -4.0267 -4.0267 -3.9835 -3.9835 2.7192 2.7192 2.7529 2.7529 3.0146 3.0146 3.1640 3.1640 3.5898 3.5898 3.6537 3.6537 3.9817 3.9817 4.0088 4.0088 4.1057 4.1057 4.1905 4.1905 4.4614 4.4614 4.5444 4.5444 7.9472 7.9472 8.1132 8.1132 8.2231 8.2231 8.5477 8.5477 8.8939 8.8939 8.9983 8.9983 k = 0.2569 0.4450-0.0000 ( 8168 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2436 -21.2436 -21.2436 -21.2436 -17.9734 -17.9734 -17.9734 -17.9734 -16.5463 -16.5463 -16.5463 -16.5463 -16.5258 -16.5258 -16.5258 -16.5258 -6.0716 -6.0716 -6.0283 -6.0283 -5.3269 -5.3269 -5.2294 -5.2294 -5.1315 -5.1315 -5.1108 -5.1108 -4.1166 -4.1166 -4.0728 -4.0728 -4.0397 -4.0397 -3.9887 -3.9887 2.7230 2.7230 2.7582 2.7582 3.0126 3.0126 3.1653 3.1653 3.6222 3.6222 3.6905 3.6905 3.9667 3.9667 4.0249 4.0249 4.1232 4.1232 4.1860 4.1860 4.4952 4.4952 4.5806 4.5806 7.9333 7.9333 8.1050 8.1050 8.1866 8.1866 8.5217 8.5217 8.8898 8.8898 9.0126 9.0126 k = 0.2500 0.4330-0.0000 ( 8164 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9731 -17.9731 -17.9731 -17.9731 -16.5459 -16.5459 -16.5459 -16.5459 -16.5252 -16.5252 -16.5252 -16.5252 -6.0692 -6.0692 -6.0278 -6.0278 -5.3220 -5.3220 -5.2302 -5.2302 -5.1317 -5.1317 -5.1139 -5.1139 -4.1246 -4.1246 -4.0722 -4.0722 -4.0524 -4.0524 -3.9939 -3.9939 2.7316 2.7316 2.7671 2.7671 3.0108 3.0108 3.1663 3.1663 3.6502 3.6502 3.7248 3.7248 3.9524 3.9524 4.0445 4.0445 4.1432 4.1432 4.1853 4.1853 4.5299 4.5299 4.6187 4.6187 7.9201 7.9201 8.0943 8.0943 8.1520 8.1520 8.4955 8.4955 8.8848 8.8848 9.0256 9.0256 k = 0.2431 0.4210-0.0000 ( 8160 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2443 -21.2443 -21.2443 -21.2443 -17.9727 -17.9727 -17.9727 -17.9727 -16.5454 -16.5454 -16.5454 -16.5454 -16.5246 -16.5246 -16.5246 -16.5246 -6.0667 -6.0667 -6.0272 -6.0272 -5.3169 -5.3169 -5.2310 -5.2310 -5.1320 -5.1320 -5.1173 -5.1173 -4.1335 -4.1335 -4.0800 -4.0800 -4.0579 -4.0579 -3.9992 -3.9992 2.7448 2.7448 2.7796 2.7796 3.0095 3.0095 3.1671 3.1671 3.6727 3.6727 3.7542 3.7542 3.9441 3.9441 4.0640 4.0640 4.1642 4.1642 4.1917 4.1917 4.5655 4.5655 4.6586 4.6586 7.9074 7.9074 8.0784 8.0784 8.1223 8.1223 8.4693 8.4693 8.8812 8.8812 9.0370 9.0370 k = 0.2361 0.4090-0.0000 ( 8158 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2447 -21.2447 -21.2447 -21.2447 -17.9722 -17.9722 -17.9722 -17.9722 -16.5448 -16.5448 -16.5448 -16.5448 -16.5240 -16.5240 -16.5240 -16.5240 -6.0640 -6.0640 -6.0265 -6.0265 -5.3115 -5.3115 -5.2319 -5.2319 -5.1324 -5.1324 -5.1209 -5.1209 -4.1432 -4.1432 -4.0965 -4.0965 -4.0559 -4.0559 -4.0046 -4.0046 2.7622 2.7622 2.7954 2.7954 3.0088 3.0088 3.1679 3.1679 3.6879 3.6879 3.7765 3.7765 3.9457 3.9457 4.0817 4.0817 4.1838 4.1838 4.2095 4.2095 4.6015 4.6015 4.6998 4.6998 7.8951 7.8951 8.0535 8.0535 8.1015 8.1015 8.4430 8.4430 8.8807 8.8807 9.0469 9.0469 k = 0.2292 0.3969-0.0000 ( 8134 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2452 -21.2452 -21.2452 -21.2452 -17.9717 -17.9717 -17.9717 -17.9717 -16.5442 -16.5442 -16.5442 -16.5442 -16.5234 -16.5234 -16.5234 -16.5234 -6.0610 -6.0610 -6.0255 -6.0255 -5.3059 -5.3059 -5.2329 -5.2329 -5.1329 -5.1329 -5.1245 -5.1245 -4.1537 -4.1537 -4.1159 -4.1159 -4.0519 -4.0519 -4.0100 -4.0100 2.7834 2.7834 2.8142 2.8142 3.0089 3.0089 3.1691 3.1691 3.6941 3.6941 3.7923 3.7923 3.9586 3.9586 4.0964 4.0964 4.2055 4.2055 4.2368 4.2368 4.6378 4.6378 4.7422 4.7422 7.8830 7.8830 8.0222 8.0222 8.0874 8.0874 8.4170 8.4170 8.8843 8.8843 9.0551 9.0551 k = 0.2222 0.3849-0.0000 ( 8142 PWs) bands (ev): -36.9950 -36.9950 -36.9950 -36.9950 -21.2456 -21.2456 -21.2456 -21.2456 -17.9712 -17.9712 -17.9712 -17.9712 -16.5434 -16.5434 -16.5434 -16.5434 -16.5228 -16.5228 -16.5228 -16.5228 -6.0579 -6.0579 -6.0245 -6.0245 -5.3002 -5.3002 -5.2341 -5.2341 -5.1339 -5.1339 -5.1277 -5.1277 -4.1653 -4.1653 -4.1366 -4.1366 -4.0472 -4.0472 -4.0156 -4.0156 2.8076 2.8076 2.8356 2.8356 3.0102 3.0102 3.1709 3.1709 3.6915 3.6915 3.8045 3.8045 3.9800 3.9800 4.1090 4.1090 4.2329 4.2329 4.2691 4.2691 4.6742 4.6742 4.7855 4.7855 7.8712 7.8712 7.9892 7.9892 8.0758 8.0758 8.3911 8.3911 8.8926 8.8926 9.0616 9.0616 k = 0.2153 0.3729-0.0000 ( 8142 PWs) bands (ev): -36.9951 -36.9951 -36.9951 -36.9951 -21.2461 -21.2461 -21.2461 -21.2461 -17.9707 -17.9707 -17.9707 -17.9707 -16.5426 -16.5426 -16.5426 -16.5426 -16.5221 -16.5221 -16.5221 -16.5221 -6.0547 -6.0547 -6.0233 -6.0233 -5.2945 -5.2945 -5.2354 -5.2354 -5.1358 -5.1358 -5.1298 -5.1298 -4.1786 -4.1786 -4.1575 -4.1575 -4.0423 -4.0423 -4.0210 -4.0210 2.8339 2.8339 2.8588 2.8588 3.0128 3.0128 3.1736 3.1736 3.6829 3.6829 3.8153 3.8153 4.0060 4.0060 4.1213 4.1213 4.2657 4.2657 4.3049 4.3049 4.7104 4.7104 4.8295 4.8295 7.8597 7.8597 7.9566 7.9566 8.0651 8.0651 8.3656 8.3656 8.9058 8.9058 9.0665 9.0665 k = 0.2083 0.3608-0.0000 ( 8140 PWs) bands (ev): -36.9952 -36.9952 -36.9952 -36.9952 -21.2466 -21.2466 -21.2466 -21.2466 -17.9701 -17.9701 -17.9701 -17.9701 -16.5418 -16.5418 -16.5417 -16.5417 -16.5215 -16.5215 -16.5215 -16.5215 -6.0513 -6.0513 -6.0220 -6.0220 -5.2887 -5.2887 -5.2369 -5.2369 -5.1388 -5.1388 -5.1305 -5.1305 -4.1956 -4.1956 -4.1763 -4.1763 -4.0384 -4.0384 -4.0252 -4.0252 2.8608 2.8608 2.8831 2.8831 3.0172 3.0172 3.1779 3.1779 3.6719 3.6719 3.8255 3.8255 4.0336 4.0336 4.1345 4.1345 4.3027 4.3027 4.3436 4.3436 4.7461 4.7461 4.8738 4.8738 7.8487 7.8487 7.9253 7.9253 8.0549 8.0549 8.3405 8.3405 8.9234 8.9234 9.0695 9.0695 k = 0.2014 0.3488-0.0000 ( 8132 PWs) bands (ev): -36.9953 -36.9953 -36.9953 -36.9953 -21.2472 -21.2472 -21.2472 -21.2472 -17.9695 -17.9695 -17.9695 -17.9695 -16.5408 -16.5408 -16.5408 -16.5408 -16.5209 -16.5209 -16.5209 -16.5209 -6.0478 -6.0478 -6.0206 -6.0206 -5.2830 -5.2830 -5.2387 -5.2387 -5.1422 -5.1422 -5.1305 -5.1305 -4.2175 -4.2175 -4.1917 -4.1917 -4.0392 -4.0392 -4.0246 -4.0246 2.8863 2.8863 2.9073 2.9073 3.0240 3.0240 3.1847 3.1847 3.6620 3.6620 3.8359 3.8359 4.0612 4.0612 4.1488 4.1488 4.3429 4.3429 4.3848 4.3848 4.7812 4.7812 4.9183 4.9183 7.8381 7.8381 7.8960 7.8960 8.0452 8.0452 8.3160 8.3160 8.9445 8.9445 9.0704 9.0704 k = 0.1944 0.3368-0.0000 ( 8130 PWs) bands (ev): -36.9954 -36.9954 -36.9954 -36.9954 -21.2477 -21.2477 -21.2477 -21.2477 -17.9689 -17.9689 -17.9689 -17.9689 -16.5399 -16.5399 -16.5398 -16.5398 -16.5202 -16.5202 -16.5202 -16.5202 -6.0443 -6.0443 -6.0191 -6.0191 -5.2775 -5.2775 -5.2407 -5.2407 -5.1455 -5.1455 -5.1301 -5.1301 -4.2423 -4.2423 -4.2051 -4.2051 -4.0444 -4.0444 -4.0197 -4.0197 2.9077 2.9077 2.9299 2.9299 3.0342 3.0342 3.1956 3.1956 3.6557 3.6557 3.8474 3.8474 4.0877 4.0877 4.1642 4.1642 4.3857 4.3857 4.4284 4.4284 4.8154 4.8154 4.9628 4.9628 7.8282 7.8282 7.8693 7.8693 8.0359 8.0359 8.2921 8.2921 8.9637 8.9637 9.0313 9.0313 k = 0.1875 0.3248-0.0000 ( 8144 PWs) bands (ev): -36.9955 -36.9955 -36.9955 -36.9955 -21.2483 -21.2483 -21.2483 -21.2483 -17.9683 -17.9683 -17.9683 -17.9683 -16.5388 -16.5388 -16.5388 -16.5388 -16.5195 -16.5195 -16.5195 -16.5195 -6.0407 -6.0407 -6.0175 -6.0175 -5.2723 -5.2723 -5.2429 -5.2429 -5.1484 -5.1484 -5.1292 -5.1292 -4.2688 -4.2688 -4.2179 -4.2179 -4.0508 -4.0508 -4.0134 -4.0134 2.9218 2.9218 2.9494 2.9494 3.0489 3.0489 3.2123 3.2123 3.6550 3.6550 3.8612 3.8612 4.1129 4.1129 4.1799 4.1799 4.4305 4.4305 4.4740 4.4740 4.8485 4.8485 5.0071 5.0071 7.8186 7.8186 7.8458 7.8458 8.0273 8.0273 8.2689 8.2689 8.9420 8.9420 9.0192 9.0192 k = 0.1806 0.3127-0.0000 ( 8150 PWs) bands (ev): -36.9956 -36.9956 -36.9956 -36.9956 -21.2489 -21.2489 -21.2489 -21.2489 -17.9676 -17.9676 -17.9676 -17.9676 -16.5378 -16.5378 -16.5378 -16.5378 -16.5188 -16.5188 -16.5188 -16.5188 -6.0371 -6.0371 -6.0159 -6.0159 -5.2677 -5.2677 -5.2454 -5.2454 -5.1507 -5.1507 -5.1281 -5.1281 -4.2961 -4.2961 -4.2305 -4.2305 -4.0578 -4.0578 -4.0067 -4.0067 2.9266 2.9266 2.9648 2.9648 3.0683 3.0683 3.2357 3.2357 3.6615 3.6615 3.8784 3.8784 4.1364 4.1364 4.1953 4.1953 4.4769 4.4769 4.5215 4.5215 4.8805 4.8805 5.0508 5.0508 7.8089 7.8089 7.8266 7.8266 8.0193 8.0193 8.2464 8.2464 8.8816 8.8816 9.0464 9.0464 k = 0.1736 0.3007-0.0000 ( 8160 PWs) bands (ev): -36.9957 -36.9957 -36.9957 -36.9957 -21.2495 -21.2495 -21.2495 -21.2495 -17.9669 -17.9669 -17.9669 -17.9669 -16.5368 -16.5368 -16.5368 -16.5368 -16.5180 -16.5180 -16.5180 -16.5180 -6.0335 -6.0335 -6.0142 -6.0142 -5.2638 -5.2638 -5.2479 -5.2479 -5.1522 -5.1522 -5.1265 -5.1265 -4.3242 -4.3242 -4.2429 -4.2429 -4.0651 -4.0651 -3.9997 -3.9997 2.9218 2.9218 2.9758 2.9758 3.0915 3.0915 3.2655 3.2655 3.6765 3.6765 3.9002 3.9002 4.1584 4.1584 4.2101 4.2101 4.5242 4.5242 4.5707 4.5707 4.9114 4.9114 5.0938 5.0938 7.7978 7.7978 7.8131 7.8131 8.0121 8.0121 8.2247 8.2247 8.8154 8.8154 9.0504 9.0504 k = 0.1667 0.2887-0.0000 ( 8160 PWs) bands (ev): -36.9958 -36.9958 -36.9958 -36.9958 -21.2501 -21.2501 -21.2501 -21.2501 -17.9663 -17.9663 -17.9663 -17.9663 -16.5358 -16.5358 -16.5358 -16.5358 -16.5172 -16.5172 -16.5172 -16.5172 -6.0300 -6.0300 -6.0126 -6.0126 -5.2613 -5.2613 -5.2500 -5.2500 -5.1527 -5.1527 -5.1247 -5.1247 -4.3526 -4.3526 -4.2552 -4.2552 -4.0727 -4.0727 -3.9925 -3.9925 2.9086 2.9086 2.9830 2.9830 3.1172 3.1172 3.3001 3.3001 3.7006 3.7006 3.9273 3.9273 4.1787 4.1787 4.2237 4.2237 4.5719 4.5719 4.6213 4.6213 4.9411 4.9411 5.1360 5.1360 7.7864 7.7864 7.8046 7.8046 8.0057 8.0057 8.2037 8.2037 8.7479 8.7479 9.0350 9.0350 k = 0.1597 0.2766-0.0000 ( 8163 PWs) bands (ev): -36.9960 -36.9960 -36.9959 -36.9959 -21.2508 -21.2508 -21.2508 -21.2508 -17.9656 -17.9656 -17.9656 -17.9656 -16.5348 -16.5348 -16.5348 -16.5348 -16.5164 -16.5164 -16.5164 -16.5164 -6.0267 -6.0267 -6.0109 -6.0109 -5.2613 -5.2613 -5.2507 -5.2507 -5.1521 -5.1521 -5.1224 -5.1224 -4.3814 -4.3814 -4.2673 -4.2673 -4.0805 -4.0805 -3.9853 -3.9853 2.8886 2.8886 2.9867 2.9867 3.1445 3.1445 3.3377 3.3377 3.7343 3.7343 3.9603 3.9603 4.1977 4.1977 4.2360 4.2360 4.6193 4.6193 4.6731 4.6731 4.9701 4.9701 5.1771 5.1771 7.7772 7.7772 7.7984 7.7984 8.0002 8.0002 8.1835 8.1835 8.6802 8.6802 9.0115 9.0115 k = 0.1528 0.2646-0.0000 ( 8169 PWs) bands (ev): -36.9961 -36.9961 -36.9960 -36.9960 -21.2514 -21.2514 -21.2514 -21.2514 -17.9649 -17.9649 -17.9649 -17.9649 -16.5339 -16.5339 -16.5339 -16.5339 -16.5154 -16.5154 -16.5154 -16.5154 -6.0234 -6.0234 -6.0093 -6.0093 -5.2638 -5.2638 -5.2499 -5.2499 -5.1503 -5.1503 -5.1198 -5.1198 -4.4103 -4.4103 -4.2791 -4.2791 -4.0885 -4.0885 -3.9780 -3.9780 2.8636 2.8636 2.9876 2.9876 3.1728 3.1728 3.3766 3.3766 3.7772 3.7772 3.9989 3.9989 4.2157 4.2157 4.2469 4.2469 4.6654 4.6654 4.7258 4.7258 4.9989 4.9989 5.2170 5.2170 7.7713 7.7713 7.7935 7.7935 7.9955 7.9955 8.1639 8.1639 8.6133 8.6133 8.9784 8.9784 k = 0.1458 0.2526-0.0000 ( 8173 PWs) bands (ev): -36.9962 -36.9962 -36.9962 -36.9962 -21.2520 -21.2520 -21.2520 -21.2520 -17.9642 -17.9642 -17.9642 -17.9642 -16.5331 -16.5331 -16.5330 -16.5330 -16.5144 -16.5144 -16.5144 -16.5144 -6.0204 -6.0204 -6.0077 -6.0077 -5.2677 -5.2677 -5.2487 -5.2487 -5.1473 -5.1473 -5.1168 -5.1168 -4.4392 -4.4392 -4.2907 -4.2907 -4.0966 -4.0966 -3.9707 -3.9707 2.8347 2.8347 2.9857 2.9857 3.2019 3.2019 3.4157 3.4157 3.8285 3.8285 4.0424 4.0424 4.2333 4.2333 4.2567 4.2567 4.7090 4.7090 4.7792 4.7792 5.0283 5.0283 5.2556 5.2556 7.7690 7.7690 7.7892 7.7892 7.9916 7.9916 8.1450 8.1450 8.5476 8.5476 8.9382 8.9382 k = 0.1389 0.2406-0.0000 ( 8177 PWs) bands (ev): -36.9963 -36.9963 -36.9963 -36.9963 -21.2527 -21.2527 -21.2527 -21.2527 -17.9635 -17.9635 -17.9635 -17.9635 -16.5323 -16.5323 -16.5322 -16.5322 -16.5134 -16.5134 -16.5134 -16.5134 -6.0176 -6.0176 -6.0061 -6.0061 -5.2721 -5.2721 -5.2478 -5.2478 -5.1433 -5.1433 -5.1135 -5.1135 -4.4680 -4.4680 -4.3020 -4.3020 -4.1048 -4.1048 -3.9635 -3.9635 2.8032 2.8032 2.9814 2.9814 3.2321 3.2321 3.4548 3.4548 3.8868 3.8868 4.0892 4.0892 4.2516 4.2516 4.2661 4.2661 4.7490 4.7490 4.8330 4.8330 5.0594 5.0594 5.2927 5.2927 7.7700 7.7700 7.7853 7.7853 7.9884 7.9884 8.1265 8.1265 8.4838 8.4838 8.8957 8.8957 k = 0.1319 0.2285-0.0000 ( 8169 PWs) bands (ev): -36.9964 -36.9964 -36.9964 -36.9964 -21.2533 -21.2533 -21.2533 -21.2533 -17.9628 -17.9628 -17.9628 -17.9628 -16.5315 -16.5315 -16.5315 -16.5315 -16.5122 -16.5122 -16.5122 -16.5122 -6.0151 -6.0151 -6.0045 -6.0045 -5.2770 -5.2770 -5.2471 -5.2471 -5.1384 -5.1384 -5.1097 -5.1097 -4.4965 -4.4965 -4.3128 -4.3128 -4.1132 -4.1132 -3.9563 -3.9563 2.7700 2.7700 2.9748 2.9748 3.2633 3.2633 3.4936 3.4936 3.9499 3.9499 4.1359 4.1359 4.2701 4.2701 4.2787 4.2787 4.7842 4.7842 4.8869 4.8869 5.0934 5.0934 5.3285 5.3285 7.7738 7.7738 7.7818 7.7818 7.9857 7.9857 8.1085 8.1085 8.4222 8.4222 8.8548 8.8548 k = 0.1250 0.2165-0.0000 ( 8171 PWs) bands (ev): -36.9965 -36.9965 -36.9965 -36.9965 -21.2539 -21.2539 -21.2539 -21.2539 -17.9621 -17.9621 -17.9621 -17.9621 -16.5309 -16.5309 -16.5309 -16.5309 -16.5111 -16.5111 -16.5111 -16.5111 -6.0129 -6.0129 -6.0030 -6.0030 -5.2820 -5.2820 -5.2467 -5.2467 -5.1327 -5.1327 -5.1056 -5.1056 -4.5246 -4.5246 -4.3233 -4.3233 -4.1216 -4.1216 -3.9494 -3.9494 2.7358 2.7358 2.9664 2.9664 3.2960 3.2960 3.5325 3.5325 4.0149 4.0149 4.1772 4.1772 4.2836 4.2836 4.3060 4.3060 4.8137 4.8137 4.9404 4.9404 5.1313 5.1313 5.3629 5.3629 7.7747 7.7747 7.7833 7.7833 7.9835 7.9835 8.0907 8.0907 8.3633 8.3633 8.8177 8.8177 k = 0.1181 0.2045-0.0000 ( 8185 PWs) bands (ev): -36.9966 -36.9966 -36.9966 -36.9966 -21.2545 -21.2545 -21.2545 -21.2545 -17.9614 -17.9614 -17.9614 -17.9614 -16.5303 -16.5303 -16.5303 -16.5303 -16.5098 -16.5098 -16.5098 -16.5098 -6.0111 -6.0111 -6.0014 -6.0014 -5.2872 -5.2872 -5.2465 -5.2465 -5.1265 -5.1265 -5.1012 -5.1012 -4.5523 -4.5523 -4.3333 -4.3333 -4.1300 -4.1300 -3.9425 -3.9425 2.7012 2.7012 2.9564 2.9564 3.3301 3.3301 3.5715 3.5715 4.0774 4.0774 4.2074 4.2074 4.3005 4.3005 4.3467 4.3467 4.8378 4.8378 4.9934 4.9934 5.1736 5.1736 5.3960 5.3960 7.7699 7.7699 7.7916 7.7916 7.9817 7.9817 8.0730 8.0730 8.3074 8.3074 8.7859 8.7859 k = 0.1111 0.1925-0.0000 ( 8187 PWs) bands (ev): -36.9967 -36.9967 -36.9967 -36.9967 -21.2551 -21.2551 -21.2551 -21.2551 -17.9608 -17.9608 -17.9608 -17.9608 -16.5298 -16.5298 -16.5298 -16.5298 -16.5086 -16.5086 -16.5086 -16.5086 -6.0097 -6.0097 -5.9998 -5.9998 -5.2924 -5.2924 -5.2464 -5.2464 -5.1198 -5.1198 -5.0964 -5.0964 -4.5794 -4.5794 -4.3428 -4.3428 -4.1384 -4.1384 -3.9359 -3.9359 2.6669 2.6669 2.9451 2.9451 3.3659 3.3659 3.6106 3.6106 4.1308 4.1308 4.2258 4.2258 4.3287 4.3287 4.3972 4.3972 4.8577 4.8577 5.0455 5.0455 5.2202 5.2202 5.4281 5.4281 7.7635 7.7635 7.8015 7.8015 7.9800 7.9800 8.0554 8.0554 8.2551 8.2551 8.7600 8.7600 k = 0.1042 0.1804-0.0000 ( 8201 PWs) bands (ev): -36.9968 -36.9968 -36.9968 -36.9968 -21.2557 -21.2557 -21.2557 -21.2557 -17.9602 -17.9602 -17.9602 -17.9602 -16.5294 -16.5294 -16.5294 -16.5294 -16.5073 -16.5073 -16.5073 -16.5073 -6.0087 -6.0087 -5.9982 -5.9982 -5.2974 -5.2974 -5.2463 -5.2463 -5.1129 -5.1129 -5.0913 -5.0913 -4.6058 -4.6058 -4.3518 -4.3518 -4.1467 -4.1467 -3.9296 -3.9296 2.6331 2.6331 2.9330 2.9330 3.4033 3.4033 3.6500 3.6500 4.1694 4.1694 4.2361 4.2361 4.3728 4.3728 4.4510 4.4510 4.8759 4.8759 5.0965 5.0965 5.2703 5.2703 5.4594 5.4594 7.7555 7.7555 7.8119 7.8119 7.9784 7.9784 8.0377 8.0377 8.2065 8.2065 8.7383 8.7383 k = 0.0972 0.1684-0.0000 ( 8201 PWs) bands (ev): -36.9969 -36.9969 -36.9969 -36.9969 -21.2562 -21.2562 -21.2562 -21.2562 -17.9596 -17.9596 -17.9596 -17.9596 -16.5290 -16.5290 -16.5290 -16.5290 -16.5060 -16.5060 -16.5060 -16.5060 -6.0080 -6.0080 -5.9967 -5.9967 -5.3024 -5.3024 -5.2463 -5.2463 -5.1058 -5.1058 -5.0858 -5.0858 -4.6314 -4.6314 -4.3603 -4.3603 -4.1549 -4.1549 -3.9235 -3.9235 2.6002 2.6002 2.9203 2.9203 3.4424 3.4424 3.6895 3.6895 4.1926 4.1926 4.2424 4.2424 4.4302 4.4302 4.5022 4.5022 4.8961 4.8961 5.1465 5.1465 5.3234 5.3234 5.4903 5.4903 7.7458 7.7458 7.8216 7.8216 7.9766 7.9766 8.0201 8.0201 8.1620 8.1620 8.7129 8.7129 k = 0.0903 0.1564-0.0000 ( 8203 PWs) bands (ev): -36.9970 -36.9970 -36.9970 -36.9970 -21.2568 -21.2568 -21.2568 -21.2568 -17.9590 -17.9590 -17.9590 -17.9590 -16.5287 -16.5287 -16.5287 -16.5287 -16.5047 -16.5047 -16.5047 -16.5047 -6.0076 -6.0076 -5.9952 -5.9952 -5.3072 -5.3072 -5.2462 -5.2462 -5.0987 -5.0987 -5.0801 -5.0801 -4.6562 -4.6562 -4.3682 -4.3682 -4.1630 -4.1630 -3.9177 -3.9177 2.5685 2.5685 2.9074 2.9074 3.4831 3.4831 3.7288 3.7288 4.2048 4.2048 4.2474 4.2474 4.4925 4.4925 4.5463 4.5463 4.9223 4.9223 5.1956 5.1956 5.3785 5.3785 5.5211 5.5211 7.7343 7.7343 7.8300 7.8300 7.9744 7.9744 8.0026 8.0026 8.1218 8.1218 8.6740 8.6740 k = 0.0833 0.1443-0.0000 ( 8207 PWs) bands (ev): -36.9971 -36.9971 -36.9971 -36.9971 -21.2573 -21.2573 -21.2573 -21.2573 -17.9584 -17.9584 -17.9584 -17.9584 -16.5284 -16.5284 -16.5284 -16.5284 -16.5035 -16.5035 -16.5035 -16.5035 -6.0074 -6.0074 -5.9939 -5.9939 -5.3117 -5.3117 -5.2461 -5.2461 -5.0915 -5.0915 -5.0743 -5.0743 -4.6801 -4.6801 -4.3755 -4.3755 -4.1708 -4.1708 -3.9122 -3.9122 2.5384 2.5384 2.8944 2.8944 3.5253 3.5253 3.7676 3.7676 4.2099 4.2099 4.2528 4.2528 4.5456 4.5456 4.5870 4.5870 4.9580 4.9580 5.2444 5.2444 5.4350 5.4350 5.5521 5.5521 7.7209 7.7209 7.8367 7.8367 7.9718 7.9718 7.9853 7.9853 8.0859 8.0859 8.6244 8.6244 k = 0.0764 0.1323-0.0000 ( 8205 PWs) bands (ev): -36.9972 -36.9972 -36.9972 -36.9972 -21.2578 -21.2578 -21.2578 -21.2578 -17.9579 -17.9579 -17.9579 -17.9579 -16.5282 -16.5282 -16.5282 -16.5282 -16.5023 -16.5023 -16.5023 -16.5023 -6.0075 -6.0075 -5.9926 -5.9926 -5.3160 -5.3160 -5.2459 -5.2459 -5.0844 -5.0844 -5.0683 -5.0683 -4.7028 -4.7028 -4.3822 -4.3822 -4.1783 -4.1783 -3.9071 -3.9071 2.5099 2.5099 2.8818 2.8818 3.5689 3.5689 3.8055 3.8055 4.2103 4.2103 4.2592 4.2592 4.5693 4.5693 4.6384 4.6384 5.0038 5.0038 5.2934 5.2934 5.4924 5.4924 5.5839 5.5839 7.7058 7.7058 7.8416 7.8416 7.9676 7.9676 7.9694 7.9694 8.0541 8.0541 8.5697 8.5697 k = 0.0694 0.1203-0.0000 ( 8209 PWs) bands (ev): -36.9973 -36.9973 -36.9973 -36.9973 -21.2582 -21.2582 -21.2582 -21.2582 -17.9574 -17.9574 -17.9574 -17.9574 -16.5280 -16.5280 -16.5280 -16.5280 -16.5011 -16.5011 -16.5011 -16.5011 -6.0077 -6.0077 -5.9915 -5.9915 -5.3199 -5.3199 -5.2457 -5.2457 -5.0773 -5.0773 -5.0624 -5.0624 -4.7245 -4.7245 -4.3884 -4.3884 -4.1855 -4.1855 -3.9023 -3.9023 2.4833 2.4833 2.8697 2.8697 3.6138 3.6138 3.8419 3.8419 4.2080 4.2080 4.2668 4.2668 4.5712 4.5712 4.6915 4.6915 5.0574 5.0574 5.3431 5.3431 5.5503 5.5503 5.6166 5.6166 7.6894 7.6894 7.8450 7.8450 7.9523 7.9523 7.9643 7.9643 8.0262 8.0262 8.5122 8.5122 k = 0.0625 0.1083-0.0000 ( 8215 PWs) bands (ev): -36.9974 -36.9974 -36.9973 -36.9973 -21.2586 -21.2586 -21.2586 -21.2586 -17.9570 -17.9570 -17.9570 -17.9570 -16.5279 -16.5279 -16.5278 -16.5278 -16.5000 -16.5000 -16.5000 -16.5000 -6.0080 -6.0080 -5.9906 -5.9906 -5.3235 -5.3235 -5.2455 -5.2455 -5.0703 -5.0703 -5.0566 -5.0566 -4.7449 -4.7449 -4.3939 -4.3939 -4.1923 -4.1923 -3.8980 -3.8980 2.4588 2.4588 2.8582 2.8582 3.6596 3.6596 3.8761 3.8761 4.2039 4.2039 4.2757 4.2757 4.5607 4.5607 4.7376 4.7376 5.1149 5.1149 5.3936 5.3936 5.6081 5.6081 5.6508 5.6508 7.6723 7.6723 7.8472 7.8472 7.9372 7.9372 7.9586 7.9586 8.0017 8.0017 8.4539 8.4539 k = 0.0556 0.0962-0.0000 ( 8231 PWs) bands (ev): -36.9974 -36.9974 -36.9974 -36.9974 -21.2590 -21.2590 -21.2590 -21.2590 -17.9566 -17.9566 -17.9566 -17.9566 -16.5277 -16.5277 -16.5277 -16.5277 -16.4990 -16.4990 -16.4990 -16.4990 -6.0084 -6.0084 -5.9897 -5.9897 -5.3268 -5.3268 -5.2452 -5.2452 -5.0634 -5.0634 -5.0510 -5.0510 -4.7641 -4.7641 -4.3989 -4.3989 -4.1986 -4.1986 -3.8940 -3.8940 2.4365 2.4365 2.8475 2.8475 3.7063 3.7063 3.9076 3.9076 4.1984 4.1984 4.2863 4.2863 4.5421 4.5421 4.7743 4.7743 5.1728 5.1728 5.4442 5.4442 5.6652 5.6652 5.6871 5.6871 7.6549 7.6549 7.8488 7.8488 7.9234 7.9234 7.9512 7.9512 7.9801 7.9801 8.3962 8.3962 k = 0.0486 0.0842-0.0000 ( 8227 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2593 -21.2593 -21.2593 -21.2593 -17.9562 -17.9562 -17.9562 -17.9562 -16.5276 -16.5276 -16.5276 -16.5276 -16.4981 -16.4981 -16.4981 -16.4981 -6.0088 -6.0088 -5.9890 -5.9890 -5.3297 -5.3297 -5.2449 -5.2449 -5.0566 -5.0566 -5.0459 -5.0459 -4.7817 -4.7817 -4.4032 -4.4032 -4.2044 -4.2044 -3.8905 -3.8905 2.4166 2.4166 2.8378 2.8378 3.7535 3.7535 3.9356 3.9356 4.1917 4.1917 4.2987 4.2987 4.5183 4.5183 4.8011 4.8011 5.2282 5.2282 5.4930 5.4930 5.7189 5.7189 5.7277 5.7277 7.6380 7.6380 7.8502 7.8502 7.9109 7.9109 7.9414 7.9414 7.9612 7.9612 8.3409 8.3409 k = 0.0417 0.0722-0.0000 ( 8207 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2596 -21.2596 -21.2596 -21.2596 -17.9559 -17.9559 -17.9559 -17.9559 -16.5275 -16.5275 -16.5275 -16.5275 -16.4973 -16.4973 -16.4973 -16.4973 -6.0093 -6.0093 -5.9884 -5.9884 -5.3322 -5.3322 -5.2446 -5.2446 -5.0501 -5.0501 -5.0412 -5.0412 -4.7978 -4.7978 -4.4070 -4.4070 -4.2096 -4.2096 -3.8874 -3.8874 2.3991 2.3991 2.8292 2.8292 3.8008 3.8008 3.9598 3.9598 4.1836 4.1836 4.3126 4.3126 4.4914 4.4914 4.8188 4.8188 5.2790 5.2790 5.5376 5.5376 5.7632 5.7632 5.7782 5.7782 7.6221 7.6221 7.8517 7.8517 7.9000 7.9000 7.9286 7.9286 7.9444 7.9444 8.2900 8.2900 k = 0.0347 0.0601-0.0000 ( 8209 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2599 -21.2599 -21.2599 -21.2599 -17.9556 -17.9556 -17.9556 -17.9556 -16.5275 -16.5275 -16.5275 -16.5275 -16.4966 -16.4966 -16.4966 -16.4966 -6.0097 -6.0097 -5.9879 -5.9879 -5.3344 -5.3344 -5.2443 -5.2443 -5.0440 -5.0440 -5.0370 -5.0370 -4.8120 -4.8120 -4.4101 -4.4101 -4.2141 -4.2141 -3.8848 -3.8848 2.3841 2.3841 2.8218 2.8218 3.8479 3.8479 3.9797 3.9797 4.1738 4.1738 4.3278 4.3278 4.4632 4.4632 4.8288 4.8288 5.3235 5.3235 5.5760 5.5760 5.8056 5.8056 5.8286 5.8286 7.6077 7.6077 7.8533 7.8533 7.8908 7.8908 7.9135 7.9135 7.9286 7.9286 8.2454 8.2454 k = 0.0278 0.0481-0.0000 ( 8211 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2601 -21.2601 -21.2601 -21.2601 -17.9554 -17.9554 -17.9554 -17.9554 -16.5274 -16.5274 -16.5274 -16.5274 -16.4961 -16.4961 -16.4961 -16.4961 -6.0101 -6.0101 -5.9875 -5.9875 -5.3362 -5.3362 -5.2441 -5.2441 -5.0385 -5.0385 -5.0335 -5.0335 -4.8243 -4.8243 -4.4127 -4.4127 -4.2179 -4.2179 -3.8826 -3.8826 2.3718 2.3718 2.8156 2.8156 3.8942 3.8942 3.9955 3.9955 4.1615 4.1615 4.3431 4.3431 4.4358 4.4358 4.8330 4.8330 5.3608 5.3608 5.6070 5.6070 5.8471 5.8471 5.8742 5.8742 7.5953 7.5953 7.8551 7.8551 7.8833 7.8833 7.8979 7.8979 7.9127 7.9127 8.2088 8.2088 k = 0.0208 0.0361-0.0000 ( 8219 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2602 -21.2602 -21.2602 -21.2602 -17.9552 -17.9552 -17.9552 -17.9552 -16.5274 -16.5274 -16.5274 -16.5274 -16.4956 -16.4956 -16.4956 -16.4956 -6.0105 -6.0105 -5.9872 -5.9872 -5.3375 -5.3375 -5.2439 -5.2439 -5.0338 -5.0338 -5.0307 -5.0307 -4.8343 -4.8343 -4.4147 -4.4147 -4.2208 -4.2208 -3.8809 -3.8809 2.3621 2.3621 2.8107 2.8107 3.9390 3.9390 4.0072 4.0072 4.1461 4.1461 4.3574 4.3574 4.4114 4.4114 4.8334 4.8334 5.3902 5.3902 5.6303 5.6303 5.8847 5.8847 5.9128 5.9128 7.5853 7.5853 7.8569 7.8569 7.8775 7.8775 7.8832 7.8832 7.8971 7.8971 8.1810 8.1810 k = 0.0139 0.0241-0.0000 ( 8219 PWs) bands (ev): -36.9977 -36.9977 -36.9977 -36.9977 -21.2603 -21.2603 -21.2603 -21.2603 -17.9551 -17.9551 -17.9551 -17.9551 -16.5274 -16.5274 -16.5273 -16.5273 -16.4953 -16.4953 -16.4953 -16.4953 -6.0107 -6.0107 -5.9870 -5.9870 -5.3385 -5.3385 -5.2437 -5.2437 -5.0301 -5.0301 -5.0287 -5.0287 -4.8418 -4.8418 -4.4161 -4.4161 -4.2230 -4.2230 -3.8797 -3.8797 2.3552 2.3552 2.8072 2.8072 3.9810 3.9810 4.0153 4.0153 4.1267 4.1267 4.3691 4.3691 4.3919 4.3919 4.8320 4.8320 5.4113 5.4113 5.6465 5.6465 5.9148 5.9148 5.9423 5.9423 7.5779 7.5779 7.8585 7.8585 7.8709 7.8709 7.8734 7.8734 7.8837 7.8837 8.1619 8.1619 k = 0.0069 0.0120-0.0000 ( 8207 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5274 -16.5274 -16.5273 -16.5273 -16.4951 -16.4951 -16.4951 -16.4951 -6.0109 -6.0109 -5.9869 -5.9869 -5.3391 -5.3391 -5.2436 -5.2436 -5.0278 -5.0278 -5.0274 -5.0274 -4.8464 -4.8464 -4.4169 -4.4169 -4.2243 -4.2243 -3.8790 -3.8790 2.3510 2.3510 2.8051 2.8051 4.0176 4.0176 4.0200 4.0200 4.1044 4.1044 4.3767 4.3767 4.3795 4.3795 4.8304 4.8304 5.4240 5.4240 5.6559 5.6559 5.9342 5.9342 5.9608 5.9608 7.5733 7.5733 7.8593 7.8593 7.8629 7.8629 7.8706 7.8706 7.8748 7.8748 8.1509 8.1509 k = 0.0000 0.0000 0.0000 ( 8195 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0110 -6.0110 -5.9869 -5.9869 -5.3393 -5.3393 -5.2436 -5.2436 -5.0270 -5.0270 -5.0270 -5.0270 -4.8479 -4.8479 -4.4172 -4.4172 -4.2248 -4.2248 -3.8787 -3.8787 2.3496 2.3496 2.8044 2.8044 4.0216 4.0216 4.0369 4.0369 4.0900 4.0900 4.3750 4.3750 4.3795 4.3795 4.8297 4.8297 5.4283 5.4283 5.6591 5.6591 5.9410 5.9410 5.9671 5.9671 7.5718 7.5718 7.8589 7.8589 7.8607 7.8607 7.8692 7.8692 7.8721 7.8721 8.1473 8.1473 k = 0.0000 0.0000 0.0000 ( 8195 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0110 -6.0110 -5.9869 -5.9869 -5.3393 -5.3393 -5.2436 -5.2436 -5.0270 -5.0270 -5.0270 -5.0270 -4.8479 -4.8479 -4.4172 -4.4172 -4.2248 -4.2248 -3.8787 -3.8787 2.3496 2.3496 2.8044 2.8044 4.0216 4.0216 4.0369 4.0369 4.0900 4.0900 4.3750 4.3750 4.3795 4.3795 4.8297 4.8297 5.4283 5.4283 5.6591 5.6591 5.9410 5.9410 5.9671 5.9671 7.5718 7.5718 7.8589 7.8589 7.8607 7.8607 7.8692 7.8692 7.8721 7.8721 8.1473 8.1473 k = 0.0000 0.0000 0.0128 ( 8189 PWs) bands (ev): -36.9977 -36.9977 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0108 -6.0108 -5.9870 -5.9870 -5.3389 -5.3389 -5.2446 -5.2446 -5.0270 -5.0270 -5.0270 -5.0270 -4.8458 -4.8458 -4.4235 -4.4235 -4.2188 -4.2188 -3.8800 -3.8800 2.3517 2.3517 2.8003 2.8003 4.0216 4.0216 4.0348 4.0348 4.0979 4.0979 4.3750 4.3750 4.3795 4.3795 4.8265 4.8265 5.4288 5.4288 5.6557 5.6557 5.9411 5.9411 5.9669 5.9669 7.5778 7.5778 7.8590 7.8590 7.8608 7.8608 7.8692 7.8692 7.8721 7.8721 8.1454 8.1454 k = 0.0000 0.0000 0.0256 ( 8165 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0104 -6.0104 -5.9874 -5.9874 -5.3377 -5.3377 -5.2473 -5.2473 -5.0270 -5.0270 -5.0270 -5.0270 -4.8393 -4.8393 -4.4404 -4.4404 -4.2029 -4.2029 -3.8839 -3.8839 2.3580 2.3580 2.7883 2.7883 4.0215 4.0215 4.0309 4.0309 4.1192 4.1192 4.3751 4.3751 4.3794 4.3794 4.8168 4.8168 5.4302 5.4302 5.6460 5.6460 5.9416 5.9416 5.9665 5.9665 7.5956 7.5956 7.8591 7.8591 7.8610 7.8610 7.8691 7.8691 7.8723 7.8723 8.1398 8.1398 k = 0.0000 0.0000 0.0385 ( 8165 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0097 -6.0097 -5.9882 -5.9882 -5.3357 -5.3357 -5.2517 -5.2517 -5.0270 -5.0270 -5.0270 -5.0270 -4.8288 -4.8288 -4.4642 -4.4642 -4.1807 -4.1807 -3.8903 -3.8903 2.3684 2.3684 2.7691 2.7691 4.0214 4.0214 4.0274 4.0274 4.1505 4.1505 4.3753 4.3753 4.3793 4.3793 4.8005 4.8005 5.4327 5.4327 5.6308 5.6308 5.9424 5.9424 5.9657 5.9657 7.6237 7.6237 7.8592 7.8592 7.8614 7.8614 7.8690 7.8690 7.8726 7.8726 8.1304 8.1304 k = 0.0000 0.0000 0.0513 ( 8159 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0087 -6.0087 -5.9892 -5.9892 -5.3330 -5.3330 -5.2574 -5.2574 -5.0270 -5.0270 -5.0270 -5.0270 -4.8146 -4.8146 -4.4918 -4.4918 -4.1554 -4.1554 -3.8993 -3.8993 2.3828 2.3828 2.7441 2.7441 4.0213 4.0213 4.0248 4.0248 4.1900 4.1900 4.3754 4.3754 4.3791 4.3791 4.7777 4.7777 5.4362 5.4362 5.6117 5.6117 5.9434 5.9434 5.9646 5.9646 7.6604 7.6604 7.8594 7.8594 7.8619 7.8619 7.8688 7.8688 7.8731 7.8731 8.1173 8.1173 k = 0.0000 0.0000 0.0641 ( 8147 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0075 -6.0075 -5.9904 -5.9904 -5.3295 -5.3295 -5.2641 -5.2641 -5.0270 -5.0270 -5.0270 -5.0270 -4.7972 -4.7972 -4.5216 -4.5216 -4.1286 -4.1286 -3.9106 -3.9106 2.4010 2.4010 2.7144 2.7144 4.0211 4.0211 4.0231 4.0231 4.2363 4.2363 4.3757 4.3757 4.3789 4.3789 4.7482 4.7482 5.4411 5.4411 5.5901 5.5901 5.9447 5.9447 5.9632 5.9632 7.7032 7.7032 7.8596 7.8596 7.8624 7.8624 7.8685 7.8685 7.8741 7.8741 8.1004 8.1004 k = 0.0000 0.0000 0.0769 ( 8147 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0060 -6.0060 -5.9919 -5.9919 -5.3253 -5.3253 -5.2714 -5.2714 -5.0270 -5.0270 -5.0270 -5.0270 -4.7768 -4.7768 -4.5523 -4.5523 -4.1015 -4.1015 -3.9244 -3.9244 2.4229 2.4229 2.6815 2.6815 4.0210 4.0210 4.0219 4.0219 4.2877 4.2877 4.3759 4.3759 4.3786 4.3786 4.7123 4.7123 5.4473 5.4473 5.5677 5.5677 5.9463 5.9463 5.9616 5.9616 7.7490 7.7490 7.8597 7.8597 7.8631 7.8631 7.8681 7.8681 7.8762 7.8762 8.0797 8.0797 k = 0.0000 0.0000 0.0897 ( 8147 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0044 -6.0044 -5.9935 -5.9935 -5.3203 -5.3203 -5.2791 -5.2791 -5.0270 -5.0270 -5.0270 -5.0270 -4.7539 -4.7539 -4.5833 -4.5833 -4.0747 -4.0747 -3.9403 -3.9403 2.4481 2.4481 2.6466 2.6466 4.0208 4.0208 4.0212 4.0212 4.3429 4.3429 4.3762 4.3762 4.3783 4.3783 4.6703 4.6703 5.4552 5.4552 5.5458 5.5458 5.9480 5.9480 5.9599 5.9599 7.7938 7.7938 7.8596 7.8596 7.8638 7.8638 7.8677 7.8677 7.8809 7.8809 8.0549 8.0549 k = 0.0000 0.0000 0.1025 ( 8153 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0027 -6.0027 -5.9952 -5.9952 -5.3147 -5.3147 -5.2868 -5.2868 -5.0270 -5.0270 -5.0270 -5.0270 -4.7289 -4.7289 -4.6142 -4.6142 -4.0487 -4.0487 -3.9584 -3.9584 2.4764 2.4764 2.6108 2.6108 4.0207 4.0207 4.0208 4.0208 4.3766 4.3766 4.3780 4.3780 4.4003 4.4003 4.6229 4.6229 5.4648 5.4648 5.5253 5.5253 5.9499 5.9499 5.9579 5.9579 7.8301 7.8301 7.8592 7.8592 7.8645 7.8645 7.8672 7.8672 7.8936 7.8936 8.0261 8.0261 k = 0.0000 0.0000 0.1154 ( 8141 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -6.0008 -6.0008 -5.9971 -5.9971 -5.3084 -5.3084 -5.2944 -5.2944 -5.0270 -5.0270 -5.0270 -5.0270 -4.7022 -4.7022 -4.6445 -4.6445 -4.0238 -4.0238 -3.9785 -3.9785 2.5073 2.5073 2.5752 2.5752 4.0206 4.0206 4.0206 4.0206 4.3769 4.3769 4.3776 4.3776 4.4584 4.4584 4.5711 4.5711 5.4765 5.4765 5.5067 5.5067 5.9519 5.9519 5.9559 5.9559 7.8489 7.8489 7.8582 7.8582 7.8652 7.8652 7.8666 7.8666 7.9214 7.9214 7.9934 7.9934 k = 0.0000 0.0000 0.1282 ( 8164 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -5.9990 -5.9990 -5.9990 -5.9990 -5.3016 -5.3016 -5.3016 -5.3016 -5.0270 -5.0270 -5.0270 -5.0270 -4.6739 -4.6739 -4.6739 -4.6739 -4.0003 -4.0003 -4.0003 -4.0003 2.5405 2.5405 2.5405 2.5405 4.0206 4.0206 4.0206 4.0206 4.3773 4.3773 4.3773 4.3773 4.5158 4.5158 4.5158 4.5158 5.4905 5.4905 5.4905 5.4905 5.9539 5.9539 5.9539 5.9539 7.8556 7.8556 7.8556 7.8556 7.8659 7.8659 7.8659 7.8659 7.9575 7.9575 7.9575 7.9575 k = 0.0000 0.0000 0.1282 ( 8164 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -5.9990 -5.9990 -5.9990 -5.9990 -5.3016 -5.3016 -5.3016 -5.3016 -5.0270 -5.0270 -5.0270 -5.0270 -4.6739 -4.6739 -4.6739 -4.6739 -4.0003 -4.0003 -4.0003 -4.0003 2.5405 2.5405 2.5405 2.5405 4.0206 4.0206 4.0206 4.0206 4.3773 4.3773 4.3773 4.3773 4.5158 4.5158 4.5158 4.5158 5.4905 5.4905 5.4905 5.4905 5.9539 5.9539 5.9539 5.9539 7.8556 7.8556 7.8556 7.8556 7.8659 7.8659 7.8659 7.8659 7.9575 7.9575 7.9575 7.9575 k = 0.0122 0.0070 0.1282 ( 8176 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4951 -16.4951 -16.4951 -16.4951 -5.9990 -5.9990 -5.9990 -5.9990 -5.3015 -5.3015 -5.3015 -5.3015 -5.0275 -5.0275 -5.0275 -5.0275 -4.6730 -4.6730 -4.6730 -4.6730 -4.0004 -4.0004 -4.0004 -4.0004 2.5416 2.5416 2.5416 2.5416 4.0179 4.0179 4.0179 4.0179 4.3689 4.3689 4.3689 4.3689 4.5251 4.5251 4.5251 4.5251 5.4865 5.4865 5.4865 5.4865 5.9473 5.9473 5.9473 5.9473 7.8562 7.8562 7.8562 7.8562 7.8677 7.8677 7.8677 7.8677 7.9609 7.9609 7.9609 7.9609 k = 0.0244 0.0141 0.1282 ( 8174 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2603 -21.2603 -21.2603 -21.2603 -17.9551 -17.9551 -17.9551 -17.9551 -16.5274 -16.5274 -16.5274 -16.5274 -16.4953 -16.4953 -16.4953 -16.4953 -5.9989 -5.9989 -5.9989 -5.9989 -5.3011 -5.3011 -5.3011 -5.3011 -5.0290 -5.0290 -5.0290 -5.0290 -4.6702 -4.6702 -4.6702 -4.6702 -4.0005 -4.0005 -4.0005 -4.0005 2.5449 2.5449 2.5449 2.5449 4.0097 4.0097 4.0097 4.0097 4.3493 4.3493 4.3493 4.3493 4.5473 4.5473 4.5473 4.5473 5.4745 5.4745 5.4745 5.4745 5.9281 5.9281 5.9281 5.9281 7.8550 7.8550 7.8550 7.8550 7.8755 7.8755 7.8755 7.8755 7.9713 7.9713 7.9713 7.9713 k = 0.0366 0.0211 0.1282 ( 8166 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2602 -21.2602 -21.2602 -21.2602 -17.9552 -17.9552 -17.9552 -17.9552 -16.5274 -16.5274 -16.5274 -16.5274 -16.4956 -16.4956 -16.4956 -16.4956 -5.9989 -5.9989 -5.9989 -5.9989 -5.3004 -5.3004 -5.3004 -5.3004 -5.0315 -5.0315 -5.0315 -5.0315 -4.6656 -4.6656 -4.6656 -4.6656 -4.0007 -4.0007 -4.0007 -4.0007 2.5505 2.5505 2.5505 2.5505 3.9956 3.9956 3.9956 3.9956 4.3264 4.3264 4.3264 4.3264 4.5747 4.5747 4.5747 4.5747 5.4546 5.4546 5.4546 5.4546 5.8979 5.8979 5.8979 5.8979 7.8497 7.8497 7.8497 7.8497 7.8905 7.8905 7.8905 7.8905 7.9884 7.9884 7.9884 7.9884 k = 0.0488 0.0282 0.1282 ( 8184 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2601 -21.2601 -21.2601 -21.2601 -17.9554 -17.9554 -17.9554 -17.9554 -16.5274 -16.5274 -16.5274 -16.5274 -16.4961 -16.4961 -16.4961 -16.4961 -5.9989 -5.9989 -5.9989 -5.9989 -5.2994 -5.2994 -5.2994 -5.2994 -5.0349 -5.0349 -5.0349 -5.0349 -4.6593 -4.6593 -4.6593 -4.6593 -4.0010 -4.0010 -4.0010 -4.0010 2.5582 2.5582 2.5582 2.5582 3.9756 3.9756 3.9756 3.9756 4.3048 4.3048 4.3048 4.3048 4.6023 4.6023 4.6023 4.6023 5.4269 5.4269 5.4269 5.4269 5.8590 5.8590 5.8590 5.8590 7.8406 7.8406 7.8406 7.8406 7.9114 7.9114 7.9114 7.9114 8.0112 8.0112 8.0112 8.0112 k = 0.0610 0.0352 0.1282 ( 8188 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2598 -21.2598 -21.2598 -21.2598 -17.9556 -17.9556 -17.9556 -17.9556 -16.5275 -16.5275 -16.5275 -16.5275 -16.4967 -16.4967 -16.4967 -16.4967 -5.9989 -5.9989 -5.9989 -5.9989 -5.2982 -5.2982 -5.2982 -5.2982 -5.0391 -5.0391 -5.0391 -5.0391 -4.6514 -4.6514 -4.6514 -4.6514 -4.0014 -4.0014 -4.0014 -4.0014 2.5681 2.5681 2.5681 2.5681 3.9496 3.9496 3.9496 3.9496 4.2865 4.2865 4.2865 4.2865 4.6275 4.6275 4.6275 4.6275 5.3918 5.3918 5.3918 5.3918 5.8140 5.8140 5.8140 5.8140 7.8280 7.8280 7.8280 7.8280 7.9374 7.9374 7.9374 7.9374 8.0382 8.0382 8.0382 8.0382 k = 0.0732 0.0422 0.1282 ( 8186 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2596 -21.2596 -21.2596 -21.2596 -17.9559 -17.9559 -17.9559 -17.9559 -16.5275 -16.5275 -16.5275 -16.5275 -16.4974 -16.4974 -16.4974 -16.4974 -5.9989 -5.9989 -5.9989 -5.9989 -5.2967 -5.2967 -5.2967 -5.2967 -5.0440 -5.0440 -5.0440 -5.0440 -4.6418 -4.6418 -4.6418 -4.6418 -4.0019 -4.0019 -4.0019 -4.0019 2.5801 2.5801 2.5801 2.5801 3.9181 3.9181 3.9181 3.9181 4.2721 4.2721 4.2721 4.2721 4.6479 4.6479 4.6479 4.6479 5.3501 5.3501 5.3501 5.3501 5.7657 5.7657 5.7657 5.7657 7.8121 7.8121 7.8121 7.8121 7.9678 7.9678 7.9678 7.9678 8.0675 8.0675 8.0675 8.0675 k = 0.0854 0.0493 0.1282 ( 8190 PWs) bands (ev): -36.9974 -36.9974 -36.9974 -36.9974 -21.2593 -21.2593 -21.2593 -21.2593 -17.9563 -17.9563 -17.9563 -17.9563 -16.5276 -16.5276 -16.5276 -16.5276 -16.4982 -16.4982 -16.4982 -16.4982 -5.9990 -5.9990 -5.9990 -5.9990 -5.2950 -5.2950 -5.2950 -5.2950 -5.0495 -5.0495 -5.0495 -5.0495 -4.6308 -4.6308 -4.6308 -4.6308 -4.0025 -4.0025 -4.0025 -4.0025 2.5940 2.5940 2.5940 2.5940 3.8822 3.8822 3.8822 3.8822 4.2615 4.2615 4.2615 4.2615 4.6615 4.6615 4.6615 4.6615 5.3031 5.3031 5.3031 5.3031 5.7163 5.7163 5.7163 5.7163 7.7934 7.7934 7.7934 7.7934 8.0018 8.0018 8.0018 8.0018 8.0977 8.0977 8.0977 8.0977 k = 0.0976 0.0563 0.1282 ( 8190 PWs) bands (ev): -36.9974 -36.9974 -36.9974 -36.9974 -21.2589 -21.2589 -21.2589 -21.2589 -17.9566 -17.9566 -17.9566 -17.9566 -16.5277 -16.5277 -16.5277 -16.5277 -16.4992 -16.4992 -16.4992 -16.4992 -5.9991 -5.9991 -5.9991 -5.9991 -5.2931 -5.2931 -5.2931 -5.2931 -5.0555 -5.0555 -5.0555 -5.0555 -4.6184 -4.6184 -4.6184 -4.6184 -4.0032 -4.0032 -4.0032 -4.0032 2.6098 2.6098 2.6098 2.6098 3.8427 3.8427 3.8427 3.8427 4.2541 4.2541 4.2541 4.2541 4.6661 4.6661 4.6661 4.6661 5.2532 5.2532 5.2532 5.2532 5.6675 5.6675 5.6675 5.6675 7.7721 7.7721 7.7721 7.7721 8.0388 8.0388 8.0388 8.0388 8.1278 8.1278 8.1278 8.1278 k = 0.1098 0.0634 0.1282 ( 8190 PWs) bands (ev): -36.9973 -36.9973 -36.9973 -36.9973 -21.2586 -21.2586 -21.2586 -21.2586 -17.9570 -17.9570 -17.9570 -17.9570 -16.5279 -16.5279 -16.5279 -16.5279 -16.5002 -16.5002 -16.5002 -16.5002 -5.9993 -5.9993 -5.9993 -5.9993 -5.2909 -5.2909 -5.2909 -5.2909 -5.0618 -5.0618 -5.0618 -5.0618 -4.6048 -4.6048 -4.6048 -4.6048 -4.0040 -4.0040 -4.0040 -4.0040 2.6274 2.6274 2.6274 2.6274 3.8008 3.8008 3.8008 3.8008 4.2492 4.2492 4.2492 4.2492 4.6591 4.6591 4.6591 4.6591 5.2035 5.2035 5.2035 5.2035 5.6206 5.6206 5.6206 5.6206 7.7483 7.7483 7.7483 7.7483 8.0780 8.0780 8.0780 8.0780 8.1573 8.1573 8.1573 8.1573 k = 0.1220 0.0704 0.1282 ( 8190 PWs) bands (ev): -36.9972 -36.9972 -36.9972 -36.9972 -21.2581 -21.2581 -21.2581 -21.2581 -17.9575 -17.9575 -17.9575 -17.9575 -16.5280 -16.5280 -16.5280 -16.5280 -16.5013 -16.5013 -16.5013 -16.5013 -5.9997 -5.9997 -5.9997 -5.9997 -5.2885 -5.2885 -5.2885 -5.2885 -5.0683 -5.0683 -5.0683 -5.0683 -4.5899 -4.5899 -4.5899 -4.5899 -4.0049 -4.0049 -4.0049 -4.0049 2.6465 2.6465 2.6465 2.6465 3.7572 3.7572 3.7572 3.7572 4.2462 4.2462 4.2462 4.2462 4.6383 4.6383 4.6383 4.6383 5.1569 5.1569 5.1569 5.1569 5.5759 5.5759 5.5759 5.5759 7.7224 7.7224 7.7224 7.7224 8.1181 8.1181 8.1181 8.1181 8.1865 8.1865 8.1865 8.1865 k = 0.1341 0.0774 0.1282 ( 8186 PWs) bands (ev): -36.9972 -36.9972 -36.9972 -36.9972 -21.2577 -21.2577 -21.2577 -21.2577 -17.9580 -17.9580 -17.9580 -17.9580 -16.5282 -16.5282 -16.5282 -16.5282 -16.5024 -16.5024 -16.5024 -16.5024 -6.0002 -6.0002 -6.0002 -6.0002 -5.2860 -5.2860 -5.2860 -5.2860 -5.0750 -5.0750 -5.0750 -5.0750 -4.5740 -4.5740 -4.5740 -4.5740 -4.0059 -4.0059 -4.0059 -4.0059 2.6672 2.6672 2.6672 2.6672 3.7125 3.7125 3.7125 3.7125 4.2444 4.2444 4.2444 4.2444 4.6029 4.6029 4.6029 4.6029 5.1159 5.1159 5.1159 5.1159 5.5338 5.5338 5.5338 5.5338 7.6945 7.6945 7.6945 7.6945 8.1575 8.1575 8.1575 8.1575 8.2166 8.2166 8.2166 8.2166 k = 0.1463 0.0845 0.1282 ( 8176 PWs) bands (ev): -36.9971 -36.9971 -36.9971 -36.9971 -21.2572 -21.2572 -21.2572 -21.2572 -17.9585 -17.9585 -17.9585 -17.9585 -16.5285 -16.5285 -16.5285 -16.5285 -16.5036 -16.5036 -16.5036 -16.5036 -6.0008 -6.0008 -6.0008 -6.0008 -5.2833 -5.2833 -5.2833 -5.2833 -5.0817 -5.0817 -5.0817 -5.0817 -4.5570 -4.5570 -4.5570 -4.5570 -4.0071 -4.0071 -4.0071 -4.0071 2.6890 2.6890 2.6890 2.6890 3.6675 3.6675 3.6675 3.6675 4.2431 4.2431 4.2431 4.2431 4.5536 4.5536 4.5536 4.5536 5.0810 5.0810 5.0810 5.0810 5.4942 5.4942 5.4942 5.4942 7.6648 7.6648 7.6648 7.6648 8.1941 8.1941 8.1941 8.1941 8.2494 8.2494 8.2494 8.2494 k = 0.1585 0.0915 0.1282 ( 8172 PWs) bands (ev): -36.9970 -36.9970 -36.9970 -36.9970 -21.2567 -21.2567 -21.2567 -21.2567 -17.9591 -17.9591 -17.9591 -17.9591 -16.5288 -16.5288 -16.5288 -16.5288 -16.5049 -16.5049 -16.5049 -16.5049 -6.0016 -6.0016 -6.0016 -6.0016 -5.2805 -5.2805 -5.2805 -5.2805 -5.0884 -5.0884 -5.0884 -5.0884 -4.5391 -4.5391 -4.5391 -4.5391 -4.0083 -4.0083 -4.0083 -4.0083 2.7119 2.7119 2.7119 2.7119 3.6223 3.6223 3.6223 3.6223 4.2414 4.2414 4.2414 4.2414 4.4936 4.4936 4.4936 4.4936 5.0509 5.0509 5.0509 5.0509 5.4570 5.4570 5.4570 5.4570 7.6337 7.6337 7.6337 7.6337 8.2262 8.2262 8.2262 8.2262 8.2867 8.2867 8.2867 8.2867 k = 0.1707 0.0986 0.1282 ( 8178 PWs) bands (ev): -36.9969 -36.9969 -36.9969 -36.9969 -21.2561 -21.2561 -21.2561 -21.2561 -17.9597 -17.9597 -17.9597 -17.9597 -16.5292 -16.5292 -16.5292 -16.5292 -16.5061 -16.5061 -16.5061 -16.5061 -6.0026 -6.0026 -6.0026 -6.0026 -5.2777 -5.2777 -5.2777 -5.2777 -5.0948 -5.0948 -5.0948 -5.0948 -4.5203 -4.5203 -4.5203 -4.5203 -4.0096 -4.0096 -4.0096 -4.0096 2.7354 2.7354 2.7354 2.7354 3.5773 3.5773 3.5773 3.5773 4.2377 4.2377 4.2377 4.2377 4.4278 4.4278 4.4278 4.4278 5.0238 5.0238 5.0238 5.0238 5.4220 5.4220 5.4220 5.4220 7.6014 7.6014 7.6014 7.6014 8.2548 8.2548 8.2548 8.2548 8.3277 8.3277 8.3277 8.3277 k = 0.1829 0.1056 0.1282 ( 8192 PWs) bands (ev): -36.9968 -36.9968 -36.9968 -36.9968 -21.2556 -21.2556 -21.2556 -21.2556 -17.9603 -17.9603 -17.9603 -17.9603 -16.5296 -16.5296 -16.5296 -16.5296 -16.5074 -16.5074 -16.5074 -16.5074 -6.0038 -6.0038 -6.0038 -6.0038 -5.2748 -5.2748 -5.2748 -5.2748 -5.1010 -5.1010 -5.1010 -5.1010 -4.5008 -4.5008 -4.5008 -4.5008 -4.0111 -4.0111 -4.0111 -4.0111 2.7593 2.7593 2.7593 2.7593 3.5326 3.5326 3.5326 3.5326 4.2272 4.2272 4.2272 4.2272 4.3639 4.3639 4.3639 4.3639 4.9977 4.9977 4.9977 4.9977 5.3890 5.3890 5.3890 5.3890 7.5683 7.5683 7.5683 7.5683 8.2817 8.2817 8.2817 8.2817 8.3707 8.3707 8.3707 8.3707 k = 0.1951 0.1127 0.1282 ( 8190 PWs) bands (ev): -36.9967 -36.9967 -36.9967 -36.9967 -21.2550 -21.2550 -21.2550 -21.2550 -17.9609 -17.9609 -17.9609 -17.9609 -16.5302 -16.5302 -16.5302 -16.5302 -16.5086 -16.5086 -16.5086 -16.5086 -6.0053 -6.0053 -6.0053 -6.0053 -5.2721 -5.2721 -5.2721 -5.2721 -5.1068 -5.1068 -5.1068 -5.1068 -4.4806 -4.4806 -4.4806 -4.4806 -4.0126 -4.0126 -4.0126 -4.0126 2.7830 2.7830 2.7830 2.7830 3.4883 3.4883 3.4883 3.4883 4.1987 4.1987 4.1987 4.1987 4.3163 4.3163 4.3163 4.3163 4.9712 4.9712 4.9712 4.9712 5.3574 5.3574 5.3574 5.3574 7.5346 7.5346 7.5346 7.5346 8.3088 8.3088 8.3088 8.3088 8.4142 8.4142 8.4142 8.4142 k = 0.2073 0.1197 0.1282 ( 8178 PWs) bands (ev): -36.9966 -36.9966 -36.9966 -36.9966 -21.2544 -21.2544 -21.2544 -21.2544 -17.9616 -17.9616 -17.9616 -17.9616 -16.5308 -16.5308 -16.5308 -16.5308 -16.5097 -16.5097 -16.5097 -16.5097 -6.0069 -6.0069 -6.0069 -6.0069 -5.2695 -5.2695 -5.2695 -5.2695 -5.1121 -5.1121 -5.1121 -5.1121 -4.4599 -4.4599 -4.4599 -4.4599 -4.0142 -4.0142 -4.0142 -4.0142 2.8060 2.8060 2.8060 2.8060 3.4445 3.4445 3.4445 3.4445 4.1450 4.1450 4.1450 4.1450 4.2942 4.2942 4.2942 4.2942 4.9436 4.9436 4.9436 4.9436 5.3269 5.3269 5.3269 5.3269 7.5008 7.5008 7.5008 7.5008 8.3371 8.3371 8.3371 8.3371 8.4574 8.4574 8.4574 8.4574 k = 0.2195 0.1267 0.1282 ( 8178 PWs) bands (ev): -36.9965 -36.9965 -36.9965 -36.9965 -21.2538 -21.2538 -21.2538 -21.2538 -17.9623 -17.9623 -17.9623 -17.9623 -16.5315 -16.5315 -16.5315 -16.5315 -16.5108 -16.5108 -16.5108 -16.5108 -6.0087 -6.0087 -6.0087 -6.0087 -5.2672 -5.2672 -5.2672 -5.2672 -5.1168 -5.1168 -5.1168 -5.1168 -4.4386 -4.4386 -4.4386 -4.4386 -4.0159 -4.0159 -4.0159 -4.0159 2.8277 2.8277 2.8277 2.8277 3.4012 3.4012 3.4012 3.4012 4.0792 4.0792 4.0792 4.0792 4.2868 4.2868 4.2868 4.2868 4.9148 4.9148 4.9148 4.9148 5.2970 5.2970 5.2970 5.2970 7.4672 7.4672 7.4672 7.4672 8.3673 8.3673 8.3673 8.3673 8.4997 8.4997 8.4997 8.4997 k = 0.2317 0.1338 0.1282 ( 8182 PWs) bands (ev): -36.9964 -36.9964 -36.9964 -36.9964 -21.2531 -21.2531 -21.2531 -21.2531 -17.9630 -17.9630 -17.9630 -17.9630 -16.5324 -16.5324 -16.5324 -16.5324 -16.5118 -16.5118 -16.5118 -16.5118 -6.0108 -6.0108 -6.0108 -6.0108 -5.2652 -5.2652 -5.2652 -5.2652 -5.1208 -5.1208 -5.1208 -5.1208 -4.4170 -4.4170 -4.4170 -4.4170 -4.0175 -4.0175 -4.0175 -4.0175 2.8470 2.8470 2.8470 2.8470 3.3587 3.3587 3.3587 3.3587 4.0124 4.0124 4.0124 4.0124 4.2846 4.2846 4.2846 4.2846 4.8847 4.8847 4.8847 4.8847 5.2674 5.2674 5.2674 5.2674 7.4341 7.4341 7.4341 7.4341 8.3998 8.3998 8.3998 8.3998 8.5409 8.5409 8.5409 8.5409 k = 0.2439 0.1408 0.1282 ( 8180 PWs) bands (ev): -36.9963 -36.9963 -36.9963 -36.9963 -21.2525 -21.2525 -21.2525 -21.2525 -17.9636 -17.9636 -17.9636 -17.9636 -16.5334 -16.5334 -16.5334 -16.5334 -16.5127 -16.5127 -16.5127 -16.5127 -6.0131 -6.0131 -6.0131 -6.0131 -5.2636 -5.2636 -5.2636 -5.2636 -5.1240 -5.1240 -5.1240 -5.1240 -4.3952 -4.3952 -4.3952 -4.3952 -4.0192 -4.0192 -4.0192 -4.0192 2.8628 2.8628 2.8628 2.8628 3.3171 3.3171 3.3171 3.3171 3.9494 3.9494 3.9494 3.9494 4.2843 4.2843 4.2843 4.2843 4.8535 4.8535 4.8535 4.8535 5.2378 5.2378 5.2378 5.2378 7.4017 7.4017 7.4017 7.4017 8.4347 8.4347 8.4347 8.4347 8.5808 8.5808 8.5808 8.5808 k = 0.2561 0.1479 0.1282 ( 8174 PWs) bands (ev): -36.9961 -36.9961 -36.9961 -36.9961 -21.2519 -21.2519 -21.2519 -21.2519 -17.9643 -17.9643 -17.9643 -17.9643 -16.5344 -16.5344 -16.5344 -16.5344 -16.5134 -16.5134 -16.5134 -16.5134 -6.0155 -6.0155 -6.0155 -6.0155 -5.2625 -5.2625 -5.2625 -5.2625 -5.1264 -5.1264 -5.1264 -5.1264 -4.3732 -4.3732 -4.3732 -4.3732 -4.0209 -4.0209 -4.0209 -4.0209 2.8735 2.8735 2.8735 2.8735 3.2774 3.2774 3.2774 3.2774 3.8928 3.8928 3.8928 3.8928 4.2847 4.2847 4.2847 4.2847 4.8216 4.8216 4.8216 4.8216 5.2081 5.2081 5.2081 5.2081 7.3702 7.3702 7.3702 7.3702 8.4720 8.4720 8.4720 8.4720 8.6191 8.6191 8.6191 8.6191 k = 0.2683 0.1549 0.1282 ( 8178 PWs) bands (ev): -36.9960 -36.9960 -36.9960 -36.9960 -21.2513 -21.2513 -21.2513 -21.2513 -17.9650 -17.9650 -17.9650 -17.9650 -16.5356 -16.5356 -16.5356 -16.5356 -16.5141 -16.5141 -16.5141 -16.5141 -6.0181 -6.0181 -6.0181 -6.0181 -5.2620 -5.2620 -5.2620 -5.2620 -5.1278 -5.1278 -5.1278 -5.1278 -4.3512 -4.3512 -4.3512 -4.3512 -4.0225 -4.0225 -4.0225 -4.0225 2.8773 2.8773 2.8773 2.8773 3.2406 3.2406 3.2406 3.2406 3.8443 3.8443 3.8443 3.8443 4.2852 4.2852 4.2852 4.2852 4.7891 4.7891 4.7891 4.7891 5.1782 5.1782 5.1782 5.1782 7.3399 7.3399 7.3399 7.3399 8.5114 8.5114 8.5114 8.5114 8.6560 8.6560 8.6560 8.6560 k = 0.2805 0.1619 0.1282 ( 8174 PWs) bands (ev): -36.9959 -36.9959 -36.9959 -36.9959 -21.2506 -21.2506 -21.2506 -21.2506 -17.9657 -17.9657 -17.9657 -17.9657 -16.5369 -16.5369 -16.5369 -16.5369 -16.5147 -16.5147 -16.5147 -16.5147 -6.0208 -6.0208 -6.0208 -6.0208 -5.2620 -5.2620 -5.2620 -5.2620 -5.1284 -5.1284 -5.1284 -5.1284 -4.3294 -4.3294 -4.3294 -4.3294 -4.0240 -4.0240 -4.0240 -4.0240 2.8721 2.8721 2.8721 2.8721 3.2083 3.2083 3.2083 3.2083 3.8047 3.8047 3.8047 3.8047 4.2855 4.2855 4.2855 4.2855 4.7563 4.7563 4.7563 4.7563 5.1484 5.1484 5.1484 5.1484 7.3108 7.3108 7.3108 7.3108 8.5527 8.5527 8.5527 8.5527 8.6914 8.6914 8.6914 8.6914 k = 0.2927 0.1690 0.1282 ( 8174 PWs) bands (ev): -36.9958 -36.9958 -36.9958 -36.9958 -21.2500 -21.2500 -21.2500 -21.2500 -17.9664 -17.9664 -17.9664 -17.9664 -16.5382 -16.5382 -16.5382 -16.5382 -16.5152 -16.5152 -16.5152 -16.5152 -6.0237 -6.0237 -6.0237 -6.0237 -5.2626 -5.2626 -5.2626 -5.2626 -5.1280 -5.1280 -5.1280 -5.1280 -4.3080 -4.3080 -4.3080 -4.3080 -4.0254 -4.0254 -4.0254 -4.0254 2.8564 2.8564 2.8564 2.8564 3.1822 3.1822 3.1822 3.1822 3.7746 3.7746 3.7746 3.7746 4.2855 4.2855 4.2855 4.2855 4.7235 4.7235 4.7235 4.7235 5.1188 5.1188 5.1188 5.1188 7.2830 7.2830 7.2830 7.2830 8.5954 8.5954 8.5954 8.5954 8.7255 8.7255 8.7255 8.7255 k = 0.3049 0.1760 0.1282 ( 8166 PWs) bands (ev): -36.9957 -36.9957 -36.9957 -36.9957 -21.2494 -21.2494 -21.2494 -21.2494 -17.9671 -17.9671 -17.9671 -17.9671 -16.5395 -16.5395 -16.5395 -16.5395 -16.5156 -16.5156 -16.5156 -16.5156 -6.0266 -6.0266 -6.0266 -6.0266 -5.2637 -5.2637 -5.2637 -5.2637 -5.1269 -5.1269 -5.1269 -5.1269 -4.2870 -4.2870 -4.2870 -4.2870 -4.0265 -4.0265 -4.0265 -4.0265 2.8300 2.8300 2.8300 2.8300 3.1626 3.1626 3.1626 3.1626 3.7537 3.7537 3.7537 3.7537 4.2850 4.2850 4.2850 4.2850 4.6907 4.6907 4.6907 4.6907 5.0897 5.0897 5.0897 5.0897 7.2566 7.2566 7.2566 7.2566 8.6390 8.6390 8.6390 8.6390 8.7582 8.7582 8.7582 8.7582 k = 0.3171 0.1831 0.1282 ( 8154 PWs) bands (ev): -36.9956 -36.9956 -36.9956 -36.9956 -21.2488 -21.2488 -21.2488 -21.2488 -17.9678 -17.9678 -17.9678 -17.9678 -16.5409 -16.5409 -16.5409 -16.5409 -16.5159 -16.5159 -16.5159 -16.5159 -6.0296 -6.0296 -6.0296 -6.0296 -5.2652 -5.2652 -5.2652 -5.2652 -5.1251 -5.1251 -5.1251 -5.1251 -4.2667 -4.2667 -4.2667 -4.2667 -4.0273 -4.0273 -4.0273 -4.0273 2.7944 2.7944 2.7944 2.7944 3.1488 3.1488 3.1488 3.1488 3.7414 3.7414 3.7414 3.7414 4.2840 4.2840 4.2840 4.2840 4.6583 4.6583 4.6583 4.6583 5.0615 5.0615 5.0615 5.0615 7.2317 7.2317 7.2317 7.2317 8.6826 8.6826 8.6826 8.6826 8.7897 8.7897 8.7897 8.7897 k = 0.3293 0.1901 0.1282 ( 8138 PWs) bands (ev): -36.9955 -36.9955 -36.9955 -36.9955 -21.2483 -21.2483 -21.2483 -21.2483 -17.9684 -17.9684 -17.9684 -17.9684 -16.5423 -16.5423 -16.5423 -16.5423 -16.5161 -16.5161 -16.5161 -16.5161 -6.0326 -6.0326 -6.0326 -6.0326 -5.2670 -5.2670 -5.2670 -5.2670 -5.1228 -5.1228 -5.1228 -5.1228 -4.2474 -4.2474 -4.2474 -4.2474 -4.0277 -4.0277 -4.0277 -4.0277 2.7522 2.7522 2.7522 2.7522 3.1391 3.1391 3.1391 3.1391 3.7369 3.7369 3.7369 3.7369 4.2825 4.2825 4.2825 4.2825 4.6262 4.6262 4.6262 4.6262 5.0345 5.0345 5.0345 5.0345 7.2083 7.2083 7.2083 7.2083 8.7257 8.7257 8.7257 8.7257 8.8202 8.8202 8.8202 8.8202 k = 0.3415 0.1971 0.1282 ( 8144 PWs) bands (ev): -36.9954 -36.9954 -36.9954 -36.9954 -21.2477 -21.2477 -21.2477 -21.2477 -17.9690 -17.9690 -17.9690 -17.9690 -16.5436 -16.5436 -16.5436 -16.5436 -16.5164 -16.5164 -16.5164 -16.5164 -6.0356 -6.0356 -6.0356 -6.0356 -5.2691 -5.2691 -5.2691 -5.2691 -5.1200 -5.1200 -5.1200 -5.1200 -4.2291 -4.2291 -4.2291 -4.2291 -4.0276 -4.0276 -4.0276 -4.0276 2.7061 2.7061 2.7061 2.7061 3.1320 3.1320 3.1320 3.1320 3.7389 3.7389 3.7389 3.7389 4.2804 4.2804 4.2804 4.2804 4.5946 4.5946 4.5946 4.5946 5.0090 5.0090 5.0090 5.0090 7.1864 7.1864 7.1864 7.1864 8.7671 8.7671 8.7671 8.7671 8.8497 8.8497 8.8497 8.8497 k = 0.3537 0.2042 0.1282 ( 8166 PWs) bands (ev): -36.9953 -36.9953 -36.9953 -36.9953 -21.2472 -21.2472 -21.2472 -21.2472 -17.9696 -17.9696 -17.9696 -17.9696 -16.5449 -16.5449 -16.5449 -16.5449 -16.5165 -16.5165 -16.5165 -16.5165 -6.0386 -6.0386 -6.0386 -6.0386 -5.2713 -5.2713 -5.2713 -5.2713 -5.1169 -5.1169 -5.1169 -5.1169 -4.2122 -4.2122 -4.2122 -4.2122 -4.0269 -4.0269 -4.0269 -4.0269 2.6583 2.6583 2.6583 2.6583 3.1265 3.1265 3.1265 3.1265 3.7461 3.7461 3.7461 3.7461 4.2779 4.2779 4.2779 4.2779 4.5637 4.5637 4.5637 4.5637 4.9853 4.9853 4.9853 4.9853 7.1660 7.1660 7.1660 7.1660 8.8060 8.8060 8.8060 8.8060 8.8784 8.8784 8.8784 8.8784 k = 0.3659 0.2112 0.1282 ( 8162 PWs) bands (ev): -36.9952 -36.9952 -36.9952 -36.9952 -21.2467 -21.2467 -21.2467 -21.2467 -17.9701 -17.9701 -17.9701 -17.9701 -16.5462 -16.5462 -16.5462 -16.5462 -16.5167 -16.5167 -16.5167 -16.5167 -6.0414 -6.0414 -6.0414 -6.0414 -5.2736 -5.2736 -5.2736 -5.2736 -5.1136 -5.1136 -5.1136 -5.1136 -4.1968 -4.1968 -4.1968 -4.1968 -4.0256 -4.0256 -4.0256 -4.0256 2.6106 2.6106 2.6106 2.6106 3.1221 3.1221 3.1221 3.1221 3.7573 3.7573 3.7573 3.7573 4.2751 4.2751 4.2751 4.2751 4.5336 4.5336 4.5336 4.5336 4.9636 4.9636 4.9636 4.9636 7.1471 7.1471 7.1471 7.1471 8.8415 8.8415 8.8415 8.8415 8.9061 8.9061 8.9061 8.9061 k = 0.3780 0.2183 0.1282 ( 8182 PWs) bands (ev): -36.9952 -36.9952 -36.9952 -36.9952 -21.2463 -21.2463 -21.2463 -21.2463 -17.9706 -17.9706 -17.9706 -17.9706 -16.5474 -16.5474 -16.5474 -16.5474 -16.5168 -16.5168 -16.5168 -16.5168 -6.0442 -6.0442 -6.0442 -6.0442 -5.2759 -5.2759 -5.2759 -5.2759 -5.1102 -5.1102 -5.1102 -5.1102 -4.1832 -4.1832 -4.1832 -4.1832 -4.0235 -4.0235 -4.0235 -4.0235 2.5641 2.5641 2.5641 2.5641 3.1183 3.1183 3.1183 3.1183 3.7712 3.7712 3.7712 3.7712 4.2720 4.2720 4.2720 4.2720 4.5046 4.5046 4.5046 4.5046 4.9440 4.9440 4.9440 4.9440 7.1298 7.1298 7.1298 7.1298 8.8728 8.8728 8.8728 8.8728 8.9323 8.9323 8.9323 8.9323 k = 0.3902 0.2253 0.1282 ( 8166 PWs) bands (ev): -36.9951 -36.9951 -36.9951 -36.9951 -21.2458 -21.2458 -21.2458 -21.2458 -17.9711 -17.9711 -17.9711 -17.9711 -16.5485 -16.5485 -16.5485 -16.5485 -16.5168 -16.5168 -16.5168 -16.5168 -6.0467 -6.0467 -6.0467 -6.0467 -5.2782 -5.2782 -5.2782 -5.2782 -5.1069 -5.1069 -5.1069 -5.1069 -4.1714 -4.1714 -4.1714 -4.1714 -4.0207 -4.0207 -4.0207 -4.0207 2.5200 2.5200 2.5200 2.5200 3.1151 3.1151 3.1151 3.1151 3.7869 3.7869 3.7869 3.7869 4.2688 4.2688 4.2688 4.2688 4.4767 4.4767 4.4767 4.4767 4.9266 4.9266 4.9266 4.9266 7.1141 7.1141 7.1141 7.1141 8.8997 8.8997 8.8997 8.8997 8.9565 8.9565 8.9565 8.9565 k = 0.4024 0.2323 0.1282 ( 8162 PWs) bands (ev): -36.9950 -36.9950 -36.9950 -36.9950 -21.2455 -21.2455 -21.2455 -21.2455 -17.9716 -17.9716 -17.9716 -17.9716 -16.5496 -16.5496 -16.5496 -16.5496 -16.5169 -16.5169 -16.5169 -16.5169 -6.0492 -6.0492 -6.0492 -6.0492 -5.2803 -5.2803 -5.2803 -5.2803 -5.1037 -5.1037 -5.1037 -5.1037 -4.1614 -4.1614 -4.1614 -4.1614 -4.0171 -4.0171 -4.0171 -4.0171 2.4790 2.4790 2.4790 2.4790 3.1124 3.1124 3.1124 3.1124 3.8032 3.8032 3.8032 3.8032 4.2658 4.2658 4.2658 4.2658 4.4504 4.4504 4.4504 4.4504 4.9115 4.9115 4.9115 4.9115 7.0999 7.0999 7.0999 7.0999 8.9221 8.9221 8.9221 8.9221 8.9776 8.9776 8.9776 8.9776 k = 0.4146 0.2394 0.1282 ( 8154 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2451 -21.2451 -21.2451 -21.2451 -17.9719 -17.9719 -17.9719 -17.9719 -16.5505 -16.5505 -16.5505 -16.5505 -16.5170 -16.5170 -16.5170 -16.5170 -6.0514 -6.0514 -6.0514 -6.0514 -5.2823 -5.2823 -5.2823 -5.2823 -5.1006 -5.1006 -5.1006 -5.1006 -4.1533 -4.1533 -4.1533 -4.1533 -4.0131 -4.0131 -4.0131 -4.0131 2.4416 2.4416 2.4416 2.4416 3.1102 3.1102 3.1102 3.1102 3.8195 3.8195 3.8195 3.8195 4.2631 4.2631 4.2631 4.2631 4.4257 4.4257 4.4257 4.4257 4.8985 4.8985 4.8985 4.8985 7.0873 7.0873 7.0873 7.0873 8.9401 8.9401 8.9401 8.9401 8.9952 8.9952 8.9952 8.9952 k = 0.4268 0.2464 0.1282 ( 8150 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2448 -21.2448 -21.2448 -21.2448 -17.9723 -17.9723 -17.9723 -17.9723 -16.5513 -16.5513 -16.5513 -16.5513 -16.5170 -16.5170 -16.5170 -16.5170 -6.0533 -6.0533 -6.0533 -6.0533 -5.2840 -5.2840 -5.2840 -5.2840 -5.0979 -5.0979 -5.0979 -5.0979 -4.1469 -4.1469 -4.1469 -4.1469 -4.0088 -4.0088 -4.0088 -4.0088 2.4084 2.4084 2.4084 2.4084 3.1085 3.1085 3.1085 3.1085 3.8349 3.8349 3.8349 3.8349 4.2609 4.2609 4.2609 4.2609 4.4030 4.4030 4.4030 4.4030 4.8876 4.8876 4.8876 4.8876 7.0763 7.0763 7.0763 7.0763 8.9537 8.9537 8.9537 8.9537 9.0096 9.0096 9.0096 9.0096 k = 0.4390 0.2535 0.1282 ( 8154 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2445 -21.2445 -21.2445 -21.2445 -17.9726 -17.9726 -17.9726 -17.9726 -16.5520 -16.5520 -16.5520 -16.5520 -16.5170 -16.5170 -16.5170 -16.5170 -6.0550 -6.0550 -6.0550 -6.0550 -5.2856 -5.2856 -5.2856 -5.2856 -5.0954 -5.0954 -5.0954 -5.0954 -4.1419 -4.1419 -4.1419 -4.1419 -4.0045 -4.0045 -4.0045 -4.0045 2.3798 2.3798 2.3798 2.3798 3.1071 3.1071 3.1071 3.1071 3.8490 3.8490 3.8490 3.8490 4.2594 4.2594 4.2594 4.2594 4.3825 4.3825 4.3825 4.3825 4.8786 4.8786 4.8786 4.8786 7.0670 7.0670 7.0670 7.0670 8.9632 8.9632 8.9632 8.9632 9.0214 9.0214 9.0214 9.0214 k = 0.4512 0.2605 0.1282 ( 8160 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2443 -21.2443 -21.2443 -21.2443 -17.9728 -17.9728 -17.9728 -17.9728 -16.5526 -16.5526 -16.5526 -16.5526 -16.5170 -16.5170 -16.5170 -16.5170 -6.0564 -6.0564 -6.0564 -6.0564 -5.2868 -5.2868 -5.2868 -5.2868 -5.0934 -5.0934 -5.0934 -5.0934 -4.1383 -4.1383 -4.1383 -4.1383 -4.0005 -4.0005 -4.0005 -4.0005 2.3560 2.3560 2.3560 2.3560 3.1061 3.1061 3.1061 3.1061 3.8611 3.8611 3.8611 3.8611 4.2587 4.2587 4.2587 4.2587 4.3646 4.3646 4.3646 4.3646 4.8715 4.8715 4.8715 4.8715 7.0593 7.0593 7.0593 7.0593 8.9691 8.9691 8.9691 8.9691 9.0311 9.0311 9.0311 9.0311 k = 0.4634 0.2676 0.1282 ( 8144 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2442 -21.2442 -21.2442 -21.2442 -17.9730 -17.9730 -17.9730 -17.9730 -16.5531 -16.5531 -16.5531 -16.5531 -16.5171 -16.5171 -16.5171 -16.5171 -6.0576 -6.0576 -6.0576 -6.0576 -5.2879 -5.2879 -5.2879 -5.2879 -5.0917 -5.0917 -5.0917 -5.0917 -4.1357 -4.1357 -4.1357 -4.1357 -3.9971 -3.9971 -3.9971 -3.9971 2.3372 2.3372 2.3372 2.3372 3.1055 3.1055 3.1055 3.1055 3.8710 3.8710 3.8710 3.8710 4.2588 4.2588 4.2588 4.2588 4.3497 4.3497 4.3497 4.3497 4.8661 4.8661 4.8661 4.8661 7.0533 7.0533 7.0533 7.0533 8.9723 8.9723 8.9723 8.9723 9.0388 9.0388 9.0388 9.0388 k = 0.4756 0.2746 0.1282 ( 8142 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2440 -21.2440 -21.2440 -21.2440 -17.9732 -17.9732 -17.9732 -17.9732 -16.5534 -16.5534 -16.5534 -16.5534 -16.5171 -16.5171 -16.5171 -16.5171 -6.0584 -6.0584 -6.0584 -6.0584 -5.2886 -5.2886 -5.2886 -5.2886 -5.0905 -5.0905 -5.0905 -5.0905 -4.1339 -4.1339 -4.1339 -4.1339 -3.9944 -3.9944 -3.9944 -3.9944 2.3237 2.3237 2.3237 2.3237 3.1050 3.1050 3.1050 3.1050 3.8782 3.8782 3.8782 3.8782 4.2594 4.2594 4.2594 4.2594 4.3382 4.3382 4.3382 4.3382 4.8624 4.8624 4.8624 4.8624 7.0490 7.0490 7.0490 7.0490 8.9737 8.9737 8.9737 8.9737 9.0445 9.0445 9.0445 9.0445 k = 0.4878 0.2816 0.1282 ( 8144 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2440 -21.2440 -21.2440 -21.2440 -17.9732 -17.9732 -17.9732 -17.9732 -16.5536 -16.5536 -16.5536 -16.5536 -16.5171 -16.5171 -16.5171 -16.5171 -6.0589 -6.0589 -6.0589 -6.0589 -5.2890 -5.2890 -5.2890 -5.2890 -5.0898 -5.0898 -5.0898 -5.0898 -4.1329 -4.1329 -4.1329 -4.1329 -3.9928 -3.9928 -3.9928 -3.9928 2.3156 2.3156 2.3156 2.3156 3.1048 3.1048 3.1048 3.1048 3.8826 3.8826 3.8826 3.8826 4.2601 4.2601 4.2601 4.2601 4.3308 4.3308 4.3308 4.3308 4.8601 4.8601 4.8601 4.8601 7.0464 7.0464 7.0464 7.0464 8.9743 8.9743 8.9743 8.9743 9.0480 9.0480 9.0480 9.0480 k = 0.5000 0.2887 0.1282 ( 8144 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0590 -6.0590 -6.0590 -6.0590 -5.2892 -5.2892 -5.2892 -5.2892 -5.0896 -5.0896 -5.0896 -5.0896 -4.1326 -4.1326 -4.1326 -4.1326 -3.9923 -3.9923 -3.9923 -3.9923 2.3128 2.3128 2.3128 2.3128 3.1047 3.1047 3.1047 3.1047 3.8841 3.8841 3.8841 3.8841 4.2605 4.2605 4.2605 4.2605 4.3283 4.3283 4.3283 4.3283 4.8594 4.8594 4.8594 4.8594 7.0455 7.0455 7.0455 7.0455 8.9744 8.9744 8.9744 8.9744 9.0492 9.0492 9.0492 9.0492 k = 0.5000 0.2887 0.1282 ( 8144 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0590 -6.0590 -6.0590 -6.0590 -5.2892 -5.2892 -5.2892 -5.2892 -5.0896 -5.0896 -5.0896 -5.0896 -4.1326 -4.1326 -4.1326 -4.1326 -3.9923 -3.9923 -3.9923 -3.9923 2.3128 2.3128 2.3128 2.3128 3.1047 3.1047 3.1047 3.1047 3.8841 3.8841 3.8841 3.8841 4.2605 4.2605 4.2605 4.2605 4.3283 4.3283 4.3283 4.3283 4.8594 4.8594 4.8594 4.8594 7.0455 7.0455 7.0455 7.0455 8.9744 8.9744 8.9744 8.9744 9.0492 9.0492 9.0492 9.0492 k = 0.4931 0.3007 0.1282 ( 8154 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0607 -6.0607 -6.0573 -6.0573 -5.2925 -5.2925 -5.2859 -5.2859 -5.0898 -5.0898 -5.0896 -5.0896 -4.1330 -4.1330 -4.1317 -4.1317 -3.9931 -3.9931 -3.9913 -3.9913 2.3132 2.3132 2.3151 2.3151 3.1040 3.1040 3.1058 3.1058 3.8834 3.8834 3.8844 3.8844 4.2583 4.2583 4.2589 4.2589 4.3281 4.3281 4.3284 4.3284 4.8520 4.8520 4.8557 4.8557 7.0502 7.0502 7.0526 7.0526 8.9738 8.9738 8.9738 8.9738 9.0446 9.0446 9.0474 9.0474 k = 0.4861 0.3127 0.1282 ( 8150 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5536 -16.5536 -16.5536 -16.5536 -16.5173 -16.5173 -16.5173 -16.5173 -6.0624 -6.0624 -6.0554 -6.0554 -5.2957 -5.2957 -5.2825 -5.2825 -5.0904 -5.0904 -5.0899 -5.0899 -4.1328 -4.1328 -4.1302 -4.1302 -3.9939 -3.9939 -3.9903 -3.9903 2.3163 2.3163 2.3201 2.3201 3.1037 3.1037 3.1073 3.1073 3.8822 3.8822 3.8841 3.8841 4.2528 4.2528 4.2539 4.2539 4.3275 4.3275 4.3278 4.3278 4.8339 4.8339 4.8414 4.8414 7.0664 7.0664 7.0712 7.0712 8.9717 8.9717 8.9718 8.9718 9.0351 9.0351 9.0396 9.0396 k = 0.4792 0.3248 0.1282 ( 8150 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5535 -16.5535 -16.5535 -16.5535 -16.5175 -16.5175 -16.5175 -16.5175 -6.0640 -6.0640 -6.0536 -6.0536 -5.2990 -5.2990 -5.2790 -5.2790 -5.0913 -5.0913 -5.0903 -5.0903 -4.1322 -4.1322 -4.1282 -4.1282 -3.9946 -3.9946 -3.9892 -3.9892 2.3220 2.3220 2.3277 2.3277 3.1038 3.1038 3.1091 3.1091 3.8804 3.8804 3.8832 3.8832 4.2447 4.2447 4.2460 4.2460 4.3257 4.3257 4.3257 4.3257 4.8062 4.8062 4.8173 4.8173 7.0934 7.0934 7.1005 7.1005 8.9674 8.9674 8.9680 8.9680 9.0227 9.0227 9.0277 9.0277 k = 0.4722 0.3368 0.1282 ( 8158 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2438 -21.2438 -21.2438 -21.2438 -17.9734 -17.9734 -17.9734 -17.9734 -16.5533 -16.5533 -16.5533 -16.5533 -16.5178 -16.5178 -16.5178 -16.5178 -6.0656 -6.0656 -6.0517 -6.0517 -5.3022 -5.3022 -5.2756 -5.2756 -5.0925 -5.0925 -5.0910 -5.0910 -4.1310 -4.1310 -4.1258 -4.1258 -3.9951 -3.9951 -3.9880 -3.9880 2.3304 2.3304 2.3379 2.3379 3.1041 3.1041 3.1114 3.1114 3.8778 3.8778 3.8816 3.8816 4.2349 4.2349 4.2360 4.2360 4.3208 4.3208 4.3219 4.3219 4.7706 4.7706 4.7853 4.7853 7.1300 7.1300 7.1392 7.1392 8.9600 8.9600 8.9618 8.9618 9.0097 9.0097 9.0136 9.0136 k = 0.4653 0.3488 0.1282 ( 8162 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2438 -21.2438 -21.2438 -21.2438 -17.9734 -17.9734 -17.9734 -17.9734 -16.5531 -16.5531 -16.5531 -16.5531 -16.5183 -16.5183 -16.5183 -16.5183 -6.0670 -6.0670 -6.0498 -6.0498 -5.3055 -5.3055 -5.2720 -5.2720 -5.0940 -5.0940 -5.0918 -5.0918 -4.1293 -4.1293 -4.1230 -4.1230 -3.9956 -3.9956 -3.9868 -3.9868 2.3413 2.3413 2.3508 2.3508 3.1047 3.1047 3.1141 3.1141 3.8743 3.8743 3.8788 3.8788 4.2239 4.2239 4.2246 4.2246 4.3122 4.3122 4.3153 4.3153 4.7294 4.7294 4.7473 4.7473 7.1748 7.1748 7.1859 7.1859 8.9494 8.9494 8.9526 8.9526 8.9972 8.9972 8.9992 8.9992 k = 0.4583 0.3608 0.1282 ( 8154 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2437 -21.2437 -21.2437 -21.2437 -17.9735 -17.9735 -17.9735 -17.9735 -16.5528 -16.5528 -16.5528 -16.5528 -16.5188 -16.5188 -16.5188 -16.5188 -6.0684 -6.0684 -6.0479 -6.0479 -5.3088 -5.3088 -5.2684 -5.2684 -5.0959 -5.0959 -5.0926 -5.0926 -4.1271 -4.1271 -4.1198 -4.1198 -3.9960 -3.9960 -3.9854 -3.9854 2.3548 2.3548 2.3662 2.3662 3.1054 3.1054 3.1170 3.1170 3.8694 3.8694 3.8746 3.8746 4.2123 4.2123 4.2123 4.2123 4.2989 4.2989 4.3050 4.3050 4.6853 4.6853 4.7057 4.7057 7.2262 7.2262 7.2390 7.2390 8.9364 8.9364 8.9404 8.9404 8.9848 8.9848 8.9853 8.9853 k = 0.4514 0.3729 0.1282 ( 8154 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2436 -21.2436 -21.2436 -21.2436 -17.9736 -17.9736 -17.9736 -17.9736 -16.5525 -16.5525 -16.5525 -16.5525 -16.5194 -16.5194 -16.5194 -16.5194 -6.0698 -6.0698 -6.0461 -6.0461 -5.3121 -5.3121 -5.2648 -5.2648 -5.0980 -5.0980 -5.0935 -5.0935 -4.1245 -4.1245 -4.1164 -4.1164 -3.9962 -3.9962 -3.9838 -3.9838 2.3707 2.3707 2.3842 2.3842 3.1061 3.1061 3.1202 3.1202 3.8627 3.8627 3.8685 3.8685 4.1991 4.1991 4.2001 4.2001 4.2802 4.2802 4.2909 4.2909 4.6408 4.6408 4.6629 4.6629 7.2829 7.2829 7.2972 7.2972 8.9222 8.9222 8.9256 8.9256 8.9716 8.9716 8.9720 8.9720 k = 0.4444 0.3849 0.1282 ( 8162 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2435 -21.2435 -21.2435 -21.2435 -17.9737 -17.9737 -17.9737 -17.9737 -16.5522 -16.5522 -16.5522 -16.5522 -16.5200 -16.5200 -16.5200 -16.5200 -6.0711 -6.0711 -6.0442 -6.0442 -5.3154 -5.3154 -5.2611 -5.2611 -5.1004 -5.1004 -5.0944 -5.0944 -4.1217 -4.1217 -4.1127 -4.1127 -3.9963 -3.9963 -3.9822 -3.9822 2.3891 2.3891 2.4047 2.4047 3.1068 3.1068 3.1236 3.1236 3.8536 3.8536 3.8599 3.8599 4.1848 4.1848 4.1868 4.1868 4.2564 4.2564 4.2734 4.2734 4.5986 4.5986 4.6210 4.6210 7.3434 7.3434 7.3589 7.3589 8.9078 8.9078 8.9085 8.9085 8.9569 8.9569 8.9595 8.9595 k = 0.4375 0.3969 0.1282 ( 8154 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2434 -21.2434 -21.2434 -21.2434 -17.9738 -17.9738 -17.9738 -17.9738 -16.5518 -16.5518 -16.5518 -16.5518 -16.5207 -16.5207 -16.5207 -16.5207 -6.0723 -6.0723 -6.0424 -6.0424 -5.3188 -5.3188 -5.2574 -5.2574 -5.1031 -5.1031 -5.0952 -5.0952 -4.1185 -4.1185 -4.1089 -4.1089 -3.9962 -3.9962 -3.9804 -3.9804 2.4097 2.4097 2.4275 2.4275 3.1073 3.1073 3.1272 3.1272 3.8411 3.8411 3.8479 3.8479 4.1686 4.1686 4.1704 4.1704 4.2302 4.2302 4.2539 4.2539 4.5604 4.5604 4.5819 4.5819 7.4067 7.4067 7.4231 7.4231 8.8890 8.8890 8.8930 8.8930 8.9410 8.9410 8.9480 8.9480 k = 0.4306 0.4090 0.1282 ( 8146 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2432 -21.2432 -21.2432 -21.2432 -17.9739 -17.9739 -17.9739 -17.9739 -16.5514 -16.5514 -16.5514 -16.5514 -16.5215 -16.5215 -16.5215 -16.5215 -6.0735 -6.0735 -6.0406 -6.0406 -5.3222 -5.3222 -5.2537 -5.2537 -5.1059 -5.1059 -5.0959 -5.0959 -4.1152 -4.1152 -4.1051 -4.1051 -3.9959 -3.9959 -3.9784 -3.9784 2.4327 2.4327 2.4527 2.4527 3.1074 3.1074 3.1308 3.1308 3.8241 3.8241 3.8317 3.8317 4.1470 4.1470 4.1494 4.1494 4.2074 4.2074 4.2353 4.2353 4.5270 4.5270 4.5463 4.5463 7.4717 7.4717 7.4887 7.4887 8.8669 8.8669 8.8769 8.8769 8.9249 8.9249 8.9378 8.9378 k = 0.4236 0.4210 0.1282 ( 8156 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2431 -21.2431 -21.2431 -21.2431 -17.9741 -17.9741 -17.9741 -17.9741 -16.5510 -16.5510 -16.5510 -16.5510 -16.5223 -16.5223 -16.5223 -16.5223 -6.0746 -6.0746 -6.0389 -6.0389 -5.3256 -5.3256 -5.2501 -5.2501 -5.1088 -5.1088 -5.0965 -5.0965 -4.1118 -4.1118 -4.1012 -4.1012 -3.9954 -3.9954 -3.9762 -3.9762 2.4577 2.4577 2.4800 2.4800 3.1069 3.1069 3.1343 3.1343 3.8011 3.8011 3.8102 3.8102 4.1157 4.1157 4.1269 4.1269 4.1920 4.1920 4.2200 4.2200 4.4980 4.4980 4.5144 4.5144 7.5375 7.5375 7.5548 7.5548 8.8421 8.8421 8.8579 8.8579 8.9102 8.9102 8.9291 8.9291 k = 0.4167 0.4330 0.1282 ( 8160 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2430 -21.2430 -21.2430 -21.2430 -17.9742 -17.9742 -17.9742 -17.9742 -16.5506 -16.5506 -16.5506 -16.5506 -16.5232 -16.5232 -16.5232 -16.5232 -6.0756 -6.0756 -6.0373 -6.0373 -5.3290 -5.3290 -5.2465 -5.2465 -5.1119 -5.1119 -5.0970 -5.0970 -4.1083 -4.1083 -4.0975 -4.0975 -3.9946 -3.9946 -3.9738 -3.9738 2.4848 2.4848 2.5095 2.5095 3.1055 3.1055 3.1377 3.1377 3.7707 3.7707 3.7828 3.7828 4.0819 4.0819 4.1026 4.1026 4.1822 4.1822 4.2090 4.2090 4.4727 4.4727 4.4859 4.4859 7.6035 7.6035 7.6207 7.6207 8.8148 8.8148 8.8351 8.8351 8.8979 8.8979 8.9214 8.9214 k = 0.4097 0.4450 0.1282 ( 8158 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2429 -21.2429 -21.2429 -21.2429 -17.9743 -17.9743 -17.9743 -17.9743 -16.5501 -16.5501 -16.5501 -16.5501 -16.5240 -16.5240 -16.5240 -16.5240 -6.0766 -6.0766 -6.0358 -6.0358 -5.3323 -5.3323 -5.2431 -5.2431 -5.1149 -5.1149 -5.0973 -5.0973 -4.1050 -4.1050 -4.0940 -4.0940 -3.9936 -3.9936 -3.9713 -3.9713 2.5137 2.5137 2.5409 2.5409 3.1030 3.1030 3.1408 3.1408 3.7319 3.7319 3.7493 3.7493 4.0508 4.0508 4.0792 4.0792 4.1755 4.1755 4.2018 4.2018 4.4501 4.4501 4.4599 4.4599 7.6690 7.6690 7.6859 7.6859 8.7856 8.7856 8.8090 8.8090 8.8875 8.8875 8.9141 8.9141 k = 0.4028 0.4571 0.1282 ( 8160 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2427 -21.2427 -21.2427 -21.2427 -17.9745 -17.9745 -17.9745 -17.9745 -16.5497 -16.5497 -16.5497 -16.5497 -16.5249 -16.5249 -16.5249 -16.5249 -6.0776 -6.0776 -6.0344 -6.0344 -5.3355 -5.3355 -5.2398 -5.2398 -5.1179 -5.1179 -5.0975 -5.0975 -4.1018 -4.1018 -4.0908 -4.0908 -3.9923 -3.9923 -3.9686 -3.9686 2.5443 2.5443 2.5741 2.5741 3.0990 3.0990 3.1435 3.1435 3.6853 3.6853 3.7106 3.7106 4.0252 4.0252 4.0587 4.0587 4.1707 4.1707 4.1975 4.1975 4.4297 4.4297 4.4360 4.4360 7.7335 7.7335 7.7497 7.7497 8.7550 8.7550 8.7809 8.7809 8.8777 8.8777 8.9064 8.9064 k = 0.3958 0.4691 0.1282 ( 8168 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2426 -21.2426 -21.2426 -21.2426 -17.9746 -17.9746 -17.9746 -17.9746 -16.5492 -16.5492 -16.5492 -16.5492 -16.5258 -16.5258 -16.5258 -16.5258 -6.0784 -6.0784 -6.0332 -6.0332 -5.3386 -5.3386 -5.2367 -5.2367 -5.1208 -5.1208 -5.0975 -5.0975 -4.0989 -4.0989 -4.0878 -4.0878 -3.9908 -3.9908 -3.9658 -3.9658 2.5764 2.5764 2.6089 2.6089 3.0931 3.0931 3.1455 3.1455 3.6326 3.6326 3.6684 3.6684 4.0054 4.0054 4.0420 4.0420 4.1670 4.1670 4.1953 4.1953 4.4111 4.4111 4.4138 4.4138 7.7964 7.7964 7.8116 7.8116 8.7239 8.7239 8.7519 8.7519 8.8674 8.8674 8.8973 8.8973 k = 0.3889 0.4811 0.1282 ( 8164 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2425 -21.2425 -21.2425 -21.2425 -17.9747 -17.9747 -17.9747 -17.9747 -16.5488 -16.5488 -16.5488 -16.5488 -16.5266 -16.5266 -16.5266 -16.5266 -6.0792 -6.0792 -6.0320 -6.0320 -5.3416 -5.3416 -5.2339 -5.2339 -5.1235 -5.1235 -5.0974 -5.0974 -4.0963 -4.0963 -4.0852 -4.0852 -3.9891 -3.9891 -3.9629 -3.9629 2.6098 2.6098 2.6450 2.6450 3.0848 3.0848 3.1467 3.1467 3.5762 3.5762 3.6247 3.6247 3.9907 3.9907 4.0290 4.0290 4.1639 4.1639 4.1946 4.1946 4.3930 4.3930 4.3941 4.3941 7.8571 7.8571 7.8708 7.8708 8.6931 8.6931 8.7235 8.7235 8.8558 8.8558 8.8865 8.8865 k = 0.3819 0.4932 0.1282 ( 8164 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2423 -21.2423 -21.2423 -21.2423 -17.9748 -17.9748 -17.9748 -17.9748 -16.5484 -16.5484 -16.5484 -16.5484 -16.5274 -16.5274 -16.5274 -16.5274 -6.0800 -6.0800 -6.0310 -6.0310 -5.3444 -5.3444 -5.2313 -5.2313 -5.1259 -5.1259 -5.0972 -5.0972 -4.0940 -4.0940 -4.0829 -4.0829 -3.9872 -3.9872 -3.9600 -3.9600 2.6442 2.6442 2.6821 2.6821 3.0737 3.0737 3.1468 3.1468 3.5188 3.5188 3.5819 3.5819 3.9802 3.9802 4.0193 4.0193 4.1613 4.1613 4.1949 4.1949 4.3735 4.3735 4.3787 4.3787 7.9148 7.9148 7.9267 7.9267 8.6638 8.6638 8.6970 8.6970 8.8424 8.8424 8.8734 8.8734 k = 0.3750 0.5052 0.1282 ( 8172 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2422 -21.2422 -21.2422 -21.2422 -17.9749 -17.9749 -17.9749 -17.9749 -16.5480 -16.5480 -16.5480 -16.5480 -16.5281 -16.5281 -16.5281 -16.5281 -6.0807 -6.0807 -6.0302 -6.0302 -5.3469 -5.3469 -5.2291 -5.2291 -5.1281 -5.1281 -5.0969 -5.0969 -4.0920 -4.0920 -4.0810 -4.0810 -3.9853 -3.9853 -3.9571 -3.9571 2.6793 2.6793 2.7198 2.7198 3.0592 3.0592 3.1453 3.1453 3.4627 3.4627 3.5420 3.5420 3.9728 3.9728 4.0124 4.0124 4.1588 4.1588 4.1960 4.1960 4.3556 4.3556 4.3649 4.3649 7.9685 7.9685 7.9783 7.9783 8.6371 8.6371 8.6738 8.6738 8.8268 8.8268 8.8582 8.8582 k = 0.3681 0.5172 0.1282 ( 8164 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2421 -21.2421 -21.2421 -21.2421 -17.9750 -17.9750 -17.9750 -17.9750 -16.5476 -16.5476 -16.5476 -16.5476 -16.5288 -16.5288 -16.5288 -16.5288 -6.0813 -6.0813 -6.0295 -6.0295 -5.3491 -5.3491 -5.2272 -5.2272 -5.1299 -5.1299 -5.0966 -5.0966 -4.0905 -4.0905 -4.0794 -4.0794 -3.9833 -3.9833 -3.9544 -3.9544 2.7146 2.7146 2.7573 2.7573 3.0413 3.0413 3.1417 3.1417 3.4104 3.4104 3.5068 3.5068 3.9677 3.9677 4.0076 4.0076 4.1564 4.1564 4.1976 4.1976 4.3393 4.3393 4.3530 4.3530 8.0169 8.0169 8.0241 8.0241 8.6145 8.6145 8.6557 8.6557 8.8088 8.8088 8.8411 8.8411 k = 0.3611 0.5292 0.1282 ( 8172 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2421 -21.2421 -21.2420 -21.2420 -17.9751 -17.9751 -17.9751 -17.9751 -16.5474 -16.5474 -16.5473 -16.5473 -16.5293 -16.5293 -16.5293 -16.5293 -6.0818 -6.0818 -6.0290 -6.0290 -5.3510 -5.3510 -5.2257 -5.2257 -5.1314 -5.1314 -5.0962 -5.0962 -4.0892 -4.0892 -4.0782 -4.0782 -3.9815 -3.9815 -3.9520 -3.9520 2.7495 2.7495 2.7937 2.7937 3.0201 3.0201 3.1352 3.1352 3.3643 3.3643 3.4774 3.4774 3.9645 3.9645 4.0045 4.0045 4.1543 4.1543 4.1995 4.1995 4.3250 4.3250 4.3430 4.3430 8.0585 8.0585 8.0629 8.0629 8.5975 8.5975 8.6445 8.6445 8.7887 8.7887 8.8227 8.8227 k = 0.3542 0.5413 0.1282 ( 8160 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2420 -21.2420 -21.2420 -21.2420 -17.9752 -17.9752 -17.9752 -17.9752 -16.5471 -16.5471 -16.5471 -16.5471 -16.5298 -16.5298 -16.5298 -16.5298 -6.0822 -6.0822 -6.0286 -6.0286 -5.3525 -5.3525 -5.2245 -5.2245 -5.1325 -5.1325 -5.0959 -5.0959 -4.0883 -4.0883 -4.0773 -4.0773 -3.9798 -3.9798 -3.9499 -3.9499 2.7833 2.7833 2.8275 2.8275 2.9963 2.9963 3.1255 3.1255 3.3271 3.3271 3.4546 3.4546 3.9624 3.9624 4.0026 4.0026 4.1525 4.1525 4.2017 4.2017 4.3129 4.3129 4.3350 4.3350 8.0915 8.0915 8.0931 8.0931 8.5873 8.5873 8.6419 8.6419 8.7664 8.7664 8.8042 8.8042 k = 0.3472 0.5533 0.1282 ( 8156 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5470 -16.5470 -16.5470 -16.5470 -16.5301 -16.5301 -16.5301 -16.5301 -6.0825 -6.0825 -6.0283 -6.0283 -5.3536 -5.3536 -5.2238 -5.2238 -5.1332 -5.1332 -5.0956 -5.0956 -4.0877 -4.0877 -4.0767 -4.0767 -3.9785 -3.9785 -3.9483 -3.9483 2.8142 2.8142 2.8561 2.8561 2.9719 2.9719 3.1137 3.1137 3.3006 3.3006 3.4385 3.4385 3.9612 3.9612 4.0015 4.0015 4.1512 4.1512 4.2039 4.2039 4.3034 4.3034 4.3291 4.3291 8.1139 8.1139 8.1146 8.1146 8.5840 8.5840 8.6488 8.6488 8.7424 8.7424 8.7872 8.7872 k = 0.3403 0.5653 0.1282 ( 8162 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0827 -6.0827 -6.0281 -6.0281 -5.3543 -5.3543 -5.2233 -5.2233 -5.1336 -5.1336 -5.0954 -5.0954 -4.0874 -4.0874 -4.0763 -4.0763 -3.9776 -3.9776 -3.9473 -3.9473 2.8389 2.8389 2.8758 2.8758 2.9508 2.9508 3.1033 3.1033 3.2853 3.2853 3.4291 3.4291 3.9606 3.9606 4.0009 4.0009 4.1506 4.1506 4.2057 4.2057 4.2971 4.2971 4.3254 4.3254 8.1254 8.1254 8.1275 8.1275 8.5856 8.5856 8.6651 8.6651 8.7167 8.7167 8.7741 8.7741 k = 0.3333 0.5774 0.1282 ( 8154 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8491 2.8491 2.8828 2.8828 2.9416 2.9416 3.0991 3.0991 3.2804 3.2804 3.4260 3.4260 3.9604 3.9604 4.0007 4.0007 4.1504 4.1504 4.2066 4.2066 4.2948 4.2948 4.3241 4.3241 8.1288 8.1288 8.1315 8.1315 8.5875 8.5875 8.6892 8.6892 8.6899 8.6899 8.7688 8.7688 k = 0.3333 0.5774 0.1282 ( 8154 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8491 2.8491 2.8828 2.8828 2.9416 2.9416 3.0991 3.0991 3.2804 3.2804 3.4260 3.4260 3.9604 3.9604 4.0007 4.0007 4.1504 4.1504 4.2066 4.2066 4.2948 4.2948 4.3241 4.3241 8.1288 8.1288 8.1315 8.1315 8.5875 8.5875 8.6892 8.6892 8.6899 8.6899 8.7688 8.7688 k = 0.3264 0.5653 0.1282 ( 8160 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0827 -6.0827 -6.0281 -6.0281 -5.3543 -5.3543 -5.2233 -5.2233 -5.1336 -5.1336 -5.0954 -5.0954 -4.0874 -4.0874 -4.0763 -4.0763 -3.9777 -3.9777 -3.9473 -3.9473 2.8398 2.8398 2.8764 2.8764 2.9500 2.9500 3.1029 3.1029 3.2851 3.2851 3.4290 3.4290 3.9606 3.9606 4.0009 4.0009 4.1504 4.1504 4.2054 4.2054 4.2974 4.2974 4.3255 4.3255 8.1261 8.1261 8.1283 8.1283 8.5840 8.5840 8.6612 8.6612 8.7199 8.7199 8.7750 8.7750 k = 0.3194 0.5533 0.1282 ( 8148 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9752 -17.9752 -17.9752 -17.9752 -16.5469 -16.5469 -16.5469 -16.5469 -16.5301 -16.5301 -16.5301 -16.5301 -6.0825 -6.0825 -6.0282 -6.0282 -5.3535 -5.3535 -5.2236 -5.2236 -5.1333 -5.1333 -5.0957 -5.0957 -4.0877 -4.0877 -4.0766 -4.0766 -3.9787 -3.9787 -3.9485 -3.9485 2.8197 2.8197 2.8604 2.8604 2.9676 2.9676 3.1111 3.1111 3.2992 3.2992 3.4377 3.4377 3.9616 3.9616 4.0017 4.0017 4.1498 4.1498 4.2018 4.2018 4.3053 4.3053 4.3303 4.3303 8.1190 8.1190 8.1203 8.1203 8.5722 8.5722 8.6318 8.6318 8.7537 8.7537 8.7928 8.7928 k = 0.3125 0.5413 0.1282 ( 8156 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2420 -21.2420 -21.2420 -21.2420 -17.9752 -17.9752 -17.9752 -17.9752 -16.5470 -16.5470 -16.5470 -16.5470 -16.5298 -16.5298 -16.5298 -16.5298 -6.0821 -6.0821 -6.0284 -6.0284 -5.3524 -5.3524 -5.2241 -5.2241 -5.1330 -5.1330 -5.0962 -5.0962 -4.0882 -4.0882 -4.0771 -4.0771 -3.9806 -3.9806 -3.9507 -3.9507 2.7973 2.7973 2.8397 2.8397 2.9863 2.9863 3.1195 3.1195 3.3219 3.3219 3.4519 3.4519 3.9636 3.9636 4.0032 4.0032 4.1478 4.1478 4.1956 4.1956 4.3183 4.3183 4.3389 4.3389 8.1093 8.1093 8.1093 8.1093 8.5533 8.5533 8.6014 8.6014 8.7888 8.7888 8.8189 8.8189 k = 0.3056 0.5292 0.1282 ( 8164 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2421 -21.2421 -21.2421 -21.2421 -17.9751 -17.9751 -17.9751 -17.9751 -16.5471 -16.5471 -16.5471 -16.5471 -16.5295 -16.5295 -16.5295 -16.5295 -6.0815 -6.0815 -6.0285 -6.0285 -5.3507 -5.3507 -5.2247 -5.2247 -5.1326 -5.1326 -5.0970 -5.0970 -4.0888 -4.0888 -4.0778 -4.0778 -3.9833 -3.9833 -3.9537 -3.9537 2.7759 2.7759 2.8181 2.8181 3.0032 3.0032 3.1255 3.1255 3.3521 3.3521 3.4712 3.4712 3.9670 3.9670 4.0059 4.0059 4.1440 4.1440 4.1872 4.1872 4.3359 4.3359 4.3515 4.3515 8.0968 8.0968 8.0983 8.0983 8.5295 8.5295 8.5702 8.5702 8.8233 8.8233 8.8491 8.8491 k = 0.2986 0.5172 0.1282 ( 8164 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2422 -21.2422 -21.2422 -21.2422 -17.9750 -17.9750 -17.9749 -17.9749 -16.5471 -16.5471 -16.5471 -16.5471 -16.5291 -16.5291 -16.5291 -16.5291 -6.0807 -6.0807 -6.0287 -6.0287 -5.3486 -5.3486 -5.2253 -5.2253 -5.1322 -5.1322 -5.0980 -5.0980 -4.0897 -4.0897 -4.0787 -4.0787 -3.9869 -3.9869 -3.9577 -3.9577 2.7571 2.7571 2.7978 2.7978 3.0173 3.0173 3.1289 3.1289 3.3877 3.3877 3.4948 3.4948 3.9721 3.9721 4.0099 4.0099 4.1380 4.1380 4.1772 4.1772 4.3574 4.3574 4.3684 4.3684 8.0837 8.0837 8.0868 8.0868 8.5027 8.5027 8.5382 8.5382 8.8555 8.8555 8.8797 8.8797 k = 0.2917 0.5052 0.1282 ( 8172 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2424 -21.2424 -21.2424 -21.2424 -17.9748 -17.9748 -17.9748 -17.9748 -16.5472 -16.5472 -16.5472 -16.5472 -16.5286 -16.5286 -16.5286 -16.5286 -6.0798 -6.0798 -6.0288 -6.0288 -5.3460 -5.3460 -5.2259 -5.2259 -5.1318 -5.1318 -5.0993 -5.0993 -4.0909 -4.0909 -4.0799 -4.0799 -3.9913 -3.9913 -3.9626 -3.9626 2.7416 2.7416 2.7802 2.7802 3.0284 3.0284 3.1300 3.1300 3.4269 3.4269 3.5221 3.5221 3.9792 3.9792 4.0154 4.0154 4.1298 4.1298 4.1661 4.1661 4.3821 4.3821 4.3893 4.3893 8.0706 8.0706 8.0752 8.0752 8.4739 8.4739 8.5057 8.5057 8.8843 8.8843 8.9084 8.9084 k = 0.2847 0.4932 0.1282 ( 8176 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2426 -21.2425 -21.2425 -21.2425 -17.9746 -17.9746 -17.9746 -17.9746 -16.5471 -16.5471 -16.5471 -16.5471 -16.5281 -16.5281 -16.5281 -16.5281 -6.0786 -6.0786 -6.0289 -6.0289 -5.3430 -5.3430 -5.2266 -5.2266 -5.1316 -5.1316 -5.1010 -5.1010 -4.0925 -4.0925 -4.0814 -4.0814 -3.9964 -3.9964 -3.9684 -3.9684 2.7300 2.7300 2.7661 2.7661 3.0369 3.0369 3.1294 3.1294 3.4679 3.4679 3.5521 3.5521 3.9886 3.9886 4.0225 4.0225 4.1199 4.1199 4.1546 4.1546 4.4097 4.4097 4.4138 4.4138 8.0578 8.0578 8.0640 8.0640 8.4439 8.4439 8.4726 8.4726 8.9090 8.9090 8.9336 8.9336 k = 0.2778 0.4811 0.1282 ( 8164 PWs) bands (ev): -36.9945 -36.9945 -36.9945 -36.9945 -21.2428 -21.2428 -21.2428 -21.2428 -17.9744 -17.9744 -17.9744 -17.9744 -16.5470 -16.5470 -16.5470 -16.5470 -16.5275 -16.5275 -16.5275 -16.5275 -6.0772 -6.0772 -6.0289 -6.0289 -5.3395 -5.3395 -5.2273 -5.2273 -5.1314 -5.1314 -5.1030 -5.1030 -4.0946 -4.0946 -4.0834 -4.0834 -4.0021 -4.0021 -3.9749 -3.9749 2.7226 2.7226 2.7559 2.7559 3.0430 3.0430 3.1278 3.1278 3.5096 3.5096 3.5838 3.5838 4.0001 4.0001 4.0306 4.0306 4.1091 4.1091 4.1437 4.1437 4.4397 4.4397 4.4415 4.4415 8.0453 8.0453 8.0531 8.0531 8.4131 8.4131 8.4392 8.4392 8.9293 8.9293 8.9544 8.9544 k = 0.2708 0.4691 0.1282 ( 8158 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2430 -21.2430 -21.2430 -21.2430 -17.9741 -17.9741 -17.9741 -17.9741 -16.5469 -16.5469 -16.5469 -16.5469 -16.5270 -16.5270 -16.5270 -16.5270 -6.0755 -6.0755 -6.0288 -6.0288 -5.3357 -5.3357 -5.2280 -5.2280 -5.1313 -5.1313 -5.1053 -5.1053 -4.0974 -4.0974 -4.0859 -4.0859 -4.0082 -4.0082 -3.9820 -3.9820 2.7194 2.7194 2.7500 2.7500 3.0473 3.0473 3.1255 3.1255 3.5508 3.5508 3.6162 3.6162 4.0130 4.0130 4.0388 4.0388 4.0985 4.0985 4.1351 4.1351 4.4719 4.4719 4.4719 4.4719 8.0332 8.0332 8.0425 8.0425 8.3818 8.3818 8.4055 8.4055 8.9453 8.9453 8.9706 8.9706 k = 0.2639 0.4571 0.1282 ( 8168 PWs) bands (ev): -36.9946 -36.9946 -36.9946 -36.9946 -21.2433 -21.2433 -21.2433 -21.2433 -17.9738 -17.9738 -17.9738 -17.9738 -16.5466 -16.5466 -16.5466 -16.5466 -16.5264 -16.5264 -16.5264 -16.5264 -6.0737 -6.0737 -6.0286 -6.0286 -5.3314 -5.3314 -5.2287 -5.2287 -5.1313 -5.1313 -5.1079 -5.1079 -4.1013 -4.1013 -4.0893 -4.0893 -4.0144 -4.0144 -3.9895 -3.9895 2.7207 2.7207 2.7485 2.7485 3.0501 3.0501 3.1228 3.1228 3.5908 3.5908 3.6482 3.6482 4.0255 4.0255 4.0452 4.0452 4.0912 4.0912 4.1316 4.1316 4.5047 4.5047 4.5058 4.5058 8.0214 8.0214 8.0321 8.0321 8.3503 8.3503 8.3717 8.3717 8.9578 8.9578 8.9824 8.9824 k = 0.2569 0.4450 0.1282 ( 8150 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2436 -21.2436 -21.2436 -21.2436 -17.9734 -17.9734 -17.9734 -17.9734 -16.5463 -16.5463 -16.5463 -16.5463 -16.5258 -16.5258 -16.5258 -16.5258 -6.0716 -6.0716 -6.0283 -6.0283 -5.3269 -5.3269 -5.2294 -5.2294 -5.1315 -5.1315 -5.1108 -5.1108 -4.1065 -4.1065 -4.0939 -4.0939 -4.0204 -4.0204 -3.9970 -3.9970 2.7264 2.7264 2.7513 2.7513 3.0520 3.0520 3.1200 3.1200 3.6284 3.6284 3.6786 3.6786 4.0328 4.0328 4.0478 4.0478 4.0927 4.0927 4.1360 4.1360 4.5394 4.5394 4.5414 4.5414 8.0097 8.0097 8.0217 8.0217 8.3190 8.3190 8.3381 8.3381 8.9675 8.9675 8.9907 8.9907 k = 0.2500 0.4330 0.1282 ( 8150 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9731 -17.9731 -17.9731 -17.9731 -16.5459 -16.5459 -16.5459 -16.5459 -16.5252 -16.5252 -16.5252 -16.5252 -6.0692 -6.0692 -6.0278 -6.0278 -5.3220 -5.3220 -5.2302 -5.2302 -5.1317 -5.1317 -5.1140 -5.1140 -4.1134 -4.1134 -4.0999 -4.0999 -4.0257 -4.0257 -4.0041 -4.0041 2.7365 2.7365 2.7584 2.7584 3.0531 3.0531 3.1173 3.1173 3.6627 3.6627 3.7062 3.7062 4.0321 4.0321 4.0470 4.0470 4.1068 4.1068 4.1490 4.1490 4.5758 4.5758 4.5783 4.5783 7.9978 7.9978 8.0111 8.0111 8.2879 8.2879 8.3048 8.3048 8.9755 8.9755 8.9965 8.9965 k = 0.2431 0.4210 0.1282 ( 8158 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2443 -21.2443 -21.2443 -21.2443 -17.9727 -17.9727 -17.9727 -17.9727 -16.5454 -16.5454 -16.5454 -16.5454 -16.5246 -16.5246 -16.5246 -16.5246 -6.0667 -6.0667 -6.0272 -6.0272 -5.3169 -5.3169 -5.2310 -5.2310 -5.1319 -5.1319 -5.1175 -5.1175 -4.1223 -4.1223 -4.1078 -4.1078 -4.0301 -4.0301 -4.0105 -4.0105 2.7507 2.7507 2.7697 2.7697 3.0539 3.0539 3.1148 3.1148 3.6926 3.6926 3.7294 3.7294 4.0282 4.0282 4.0458 4.0458 4.1302 4.1302 4.1690 4.1690 4.6135 4.6135 4.6162 4.6162 7.9857 7.9857 8.0003 8.0003 8.2574 8.2574 8.2720 8.2720 8.9826 8.9826 9.0008 9.0008 k = 0.2361 0.4090 0.1282 ( 8162 PWs) bands (ev): -36.9949 -36.9949 -36.9949 -36.9949 -21.2447 -21.2447 -21.2447 -21.2447 -17.9722 -17.9722 -17.9722 -17.9722 -16.5448 -16.5448 -16.5448 -16.5448 -16.5240 -16.5240 -16.5240 -16.5240 -6.0640 -6.0640 -6.0265 -6.0265 -5.3115 -5.3115 -5.2319 -5.2319 -5.1321 -5.1321 -5.1212 -5.1212 -4.1332 -4.1332 -4.1177 -4.1177 -4.0335 -4.0335 -4.0158 -4.0158 2.7689 2.7689 2.7848 2.7848 3.0545 3.0545 3.1128 3.1128 3.7169 3.7169 3.7472 3.7472 4.0260 4.0260 4.0472 4.0472 4.1591 4.1591 4.1941 4.1941 4.6522 4.6522 4.6551 4.6551 7.9733 7.9733 7.9890 7.9890 8.2276 8.2276 8.2401 8.2401 8.9896 8.9896 9.0045 9.0045 k = 0.2292 0.3969 0.1282 ( 8158 PWs) bands (ev): -36.9950 -36.9950 -36.9950 -36.9950 -21.2452 -21.2452 -21.2452 -21.2452 -17.9717 -17.9717 -17.9717 -17.9717 -16.5442 -16.5442 -16.5442 -16.5442 -16.5234 -16.5234 -16.5234 -16.5234 -6.0610 -6.0610 -6.0256 -6.0256 -5.3059 -5.3059 -5.2329 -5.2329 -5.1323 -5.1323 -5.1250 -5.1250 -4.1461 -4.1461 -4.1297 -4.1297 -4.0358 -4.0358 -4.0200 -4.0200 2.7906 2.7906 2.8034 2.8034 3.0554 3.0554 3.1115 3.1115 3.7348 3.7348 3.7590 3.7590 4.0283 4.0283 4.0530 4.0530 4.1919 4.1919 4.2233 4.2233 4.6916 4.6916 4.6946 4.6946 7.9606 7.9606 7.9772 7.9772 8.1988 8.1988 8.2091 8.2091 8.9971 8.9971 9.0083 9.0083 k = 0.2222 0.3849 0.1282 ( 8148 PWs) bands (ev): -36.9950 -36.9950 -36.9950 -36.9950 -21.2456 -21.2456 -21.2456 -21.2456 -17.9712 -17.9712 -17.9712 -17.9712 -16.5434 -16.5434 -16.5434 -16.5434 -16.5228 -16.5228 -16.5228 -16.5228 -6.0579 -6.0579 -6.0245 -6.0245 -5.3003 -5.3003 -5.2341 -5.2341 -5.1325 -5.1325 -5.1290 -5.1290 -4.1609 -4.1609 -4.1438 -4.1438 -4.0371 -4.0371 -4.0230 -4.0230 2.8153 2.8153 2.8248 2.8248 3.0566 3.0566 3.1110 3.1110 3.7464 3.7464 3.7650 3.7650 4.0362 4.0362 4.0639 4.0639 4.2279 4.2279 4.2559 4.2559 4.7315 4.7315 4.7346 4.7346 7.9475 7.9475 7.9650 7.9650 8.1711 8.1711 8.1795 8.1795 9.0054 9.0054 9.0127 9.0127 k = 0.2153 0.3729 0.1282 ( 8156 PWs) bands (ev): -36.9951 -36.9951 -36.9951 -36.9951 -21.2461 -21.2461 -21.2461 -21.2461 -17.9707 -17.9707 -17.9707 -17.9707 -16.5426 -16.5426 -16.5426 -16.5426 -16.5221 -16.5221 -16.5221 -16.5221 -6.0547 -6.0547 -6.0233 -6.0233 -5.2945 -5.2945 -5.2354 -5.2354 -5.1330 -5.1330 -5.1325 -5.1325 -4.1772 -4.1772 -4.1597 -4.1597 -4.0376 -4.0376 -4.0250 -4.0250 2.8422 2.8422 2.8483 2.8483 3.0587 3.0587 3.1116 3.1116 3.7526 3.7526 3.7667 3.7667 4.0494 4.0494 4.0791 4.0791 4.2666 4.2666 4.2913 4.2913 4.7715 4.7715 4.7748 4.7748 7.9342 7.9342 7.9524 7.9524 8.1448 8.1448 8.1514 8.1514 9.0144 9.0144 9.0179 9.0179 k = 0.2083 0.3608 0.1282 ( 8160 PWs) bands (ev): -36.9952 -36.9952 -36.9952 -36.9952 -21.2466 -21.2466 -21.2466 -21.2466 -17.9701 -17.9701 -17.9701 -17.9701 -16.5418 -16.5418 -16.5418 -16.5418 -16.5215 -16.5215 -16.5215 -16.5215 -6.0513 -6.0513 -6.0220 -6.0220 -5.2887 -5.2887 -5.2369 -5.2369 -5.1370 -5.1370 -5.1323 -5.1323 -4.1948 -4.1948 -4.1772 -4.1772 -4.0374 -4.0374 -4.0261 -4.0261 2.8700 2.8700 2.8727 2.8727 3.0624 3.0624 3.1140 3.1140 3.7556 3.7556 3.7661 3.7661 4.0669 4.0669 4.0973 4.0973 4.3078 4.3078 4.3295 4.3295 4.8115 4.8115 4.8150 4.8150 7.9209 7.9209 7.9395 7.9395 8.1200 8.1200 8.1250 8.1250 9.0238 9.0238 9.0239 9.0239 k = 0.2014 0.3488 0.1282 ( 8156 PWs) bands (ev): -36.9953 -36.9953 -36.9953 -36.9953 -21.2472 -21.2472 -21.2472 -21.2472 -17.9695 -17.9695 -17.9695 -17.9695 -16.5408 -16.5408 -16.5408 -16.5408 -16.5209 -16.5209 -16.5209 -16.5209 -6.0478 -6.0478 -6.0206 -6.0206 -5.2831 -5.2831 -5.2386 -5.2386 -5.1409 -5.1409 -5.1319 -5.1319 -4.2136 -4.2136 -4.1961 -4.1961 -4.0368 -4.0368 -4.0265 -4.0265 2.8964 2.8964 2.8968 2.8968 3.0688 3.0688 3.1188 3.1188 3.7577 3.7577 3.7656 3.7656 4.0871 4.0871 4.1171 4.1171 4.3511 4.3511 4.3700 4.3700 4.8510 4.8510 4.8549 4.8549 7.9077 7.9077 7.9267 7.9267 8.0968 8.0968 8.1005 8.1005 9.0296 9.0296 9.0331 9.0331 k = 0.1944 0.3368 0.1282 ( 8160 PWs) bands (ev): -36.9954 -36.9954 -36.9954 -36.9954 -21.2477 -21.2477 -21.2477 -21.2477 -17.9689 -17.9689 -17.9689 -17.9689 -16.5399 -16.5399 -16.5399 -16.5399 -16.5202 -16.5202 -16.5202 -16.5202 -6.0443 -6.0443 -6.0191 -6.0191 -5.2776 -5.2776 -5.2405 -5.2405 -5.1445 -5.1445 -5.1312 -5.1312 -4.2333 -4.2333 -4.2160 -4.2160 -4.0357 -4.0357 -4.0265 -4.0265 2.9174 2.9174 2.9198 2.9198 3.0798 3.0798 3.1274 3.1274 3.7610 3.7610 3.7670 3.7670 4.1088 4.1088 4.1374 4.1374 4.3964 4.3964 4.4127 4.4127 4.8900 4.8900 4.8945 4.8945 7.8949 7.8949 7.9139 7.9139 8.0755 8.0755 8.0781 8.0781 9.0338 9.0338 9.0402 9.0402 k = 0.1875 0.3248 0.1282 ( 8156 PWs) bands (ev): -36.9955 -36.9955 -36.9955 -36.9955 -21.2483 -21.2483 -21.2483 -21.2483 -17.9683 -17.9683 -17.9683 -17.9683 -16.5388 -16.5388 -16.5388 -16.5388 -16.5195 -16.5195 -16.5195 -16.5195 -6.0407 -6.0407 -6.0175 -6.0175 -5.2725 -5.2725 -5.2426 -5.2426 -5.1476 -5.1476 -5.1303 -5.1303 -4.2538 -4.2538 -4.2368 -4.2368 -4.0343 -4.0343 -4.0260 -4.0260 2.9334 2.9334 2.9361 2.9361 3.0976 3.0976 3.1411 3.1411 3.7676 3.7676 3.7723 3.7723 4.1309 4.1309 4.1573 4.1573 4.4434 4.4434 4.4573 4.4573 4.9281 4.9281 4.9334 4.9334 7.8828 7.8828 7.9015 7.9015 8.0561 8.0561 8.0580 8.0580 9.0318 9.0318 9.0401 9.0401 k = 0.1806 0.3127 0.1282 ( 8156 PWs) bands (ev): -36.9956 -36.9956 -36.9956 -36.9956 -21.2489 -21.2489 -21.2489 -21.2489 -17.9676 -17.9676 -17.9676 -17.9676 -16.5378 -16.5378 -16.5378 -16.5378 -16.5188 -16.5188 -16.5188 -16.5188 -6.0371 -6.0371 -6.0159 -6.0159 -5.2679 -5.2679 -5.2450 -5.2450 -5.1501 -5.1501 -5.1290 -5.1290 -4.2748 -4.2748 -4.2583 -4.2583 -4.0327 -4.0327 -4.0252 -4.0252 2.9427 2.9427 2.9442 2.9442 3.1227 3.1227 3.1608 3.1608 3.7791 3.7791 3.7829 3.7829 4.1527 4.1527 4.1762 4.1762 4.4920 4.4920 4.5036 4.5036 4.9652 4.9652 4.9715 4.9715 7.8715 7.8715 7.8898 7.8898 8.0388 8.0388 8.0401 8.0401 9.0135 9.0135 9.0209 9.0209 k = 0.1736 0.3007 0.1282 ( 8164 PWs) bands (ev): -36.9957 -36.9957 -36.9957 -36.9957 -21.2495 -21.2495 -21.2495 -21.2495 -17.9669 -17.9669 -17.9669 -17.9669 -16.5368 -16.5368 -16.5368 -16.5368 -16.5180 -16.5180 -16.5180 -16.5180 -6.0335 -6.0335 -6.0143 -6.0143 -5.2640 -5.2640 -5.2475 -5.2475 -5.1519 -5.1519 -5.1273 -5.1273 -4.2963 -4.2963 -4.2803 -4.2803 -4.0309 -4.0309 -4.0241 -4.0241 2.9444 2.9444 2.9447 2.9447 3.1540 3.1540 3.1862 3.1862 3.7965 3.7965 3.8001 3.8001 4.1738 4.1738 4.1936 4.1936 4.5418 4.5418 4.5513 4.5513 5.0010 5.0010 5.0086 5.0086 7.8614 7.8614 7.8788 7.8788 8.0235 8.0235 8.0246 8.0246 8.9738 8.9738 8.9793 8.9793 k = 0.1667 0.2887 0.1282 ( 8156 PWs) bands (ev): -36.9958 -36.9958 -36.9958 -36.9958 -21.2501 -21.2501 -21.2501 -21.2501 -17.9663 -17.9663 -17.9663 -17.9663 -16.5358 -16.5358 -16.5358 -16.5358 -16.5172 -16.5172 -16.5172 -16.5172 -6.0300 -6.0300 -6.0126 -6.0126 -5.2609 -5.2609 -5.2501 -5.2501 -5.1526 -5.1526 -5.1253 -5.1253 -4.3181 -4.3181 -4.3027 -4.3027 -4.0290 -4.0290 -4.0229 -4.0229 2.9383 2.9383 2.9401 2.9401 3.1892 3.1892 3.2162 3.2162 3.8205 3.8205 3.8249 3.8249 4.1939 4.1939 4.2094 4.2094 4.5927 4.5927 4.6000 4.6000 5.0354 5.0354 5.0446 5.0446 7.8525 7.8525 7.8688 7.8688 8.0102 8.0102 8.0113 8.0113 8.9225 8.9225 8.9271 8.9271 k = 0.1597 0.2766 0.1282 ( 8158 PWs) bands (ev): -36.9959 -36.9959 -36.9959 -36.9959 -21.2508 -21.2508 -21.2508 -21.2508 -17.9656 -17.9656 -17.9656 -17.9656 -16.5348 -16.5348 -16.5348 -16.5348 -16.5164 -16.5164 -16.5164 -16.5164 -6.0266 -6.0266 -6.0110 -6.0110 -5.2588 -5.2588 -5.2530 -5.2530 -5.1522 -5.1522 -5.1230 -5.1230 -4.3401 -4.3401 -4.3254 -4.3254 -4.0270 -4.0270 -4.0215 -4.0215 2.9272 2.9272 2.9300 2.9300 3.2266 3.2266 3.2494 3.2494 3.8515 3.8515 3.8575 3.8575 4.2132 4.2132 4.2234 4.2234 4.6442 4.6442 4.6494 4.6494 5.0683 5.0683 5.0795 5.0795 7.8450 7.8450 7.8601 7.8601 7.9989 7.9989 8.0002 8.0002 8.8668 8.8668 8.8715 8.8715 k = 0.1528 0.2646 0.1282 ( 8154 PWs) bands (ev): -36.9960 -36.9960 -36.9960 -36.9960 -21.2514 -21.2514 -21.2514 -21.2514 -17.9649 -17.9649 -17.9649 -17.9649 -16.5339 -16.5339 -16.5339 -16.5339 -16.5154 -16.5154 -16.5154 -16.5154 -6.0233 -6.0233 -6.0094 -6.0094 -5.2578 -5.2578 -5.2559 -5.2559 -5.1505 -5.1505 -5.1202 -5.1202 -4.3621 -4.3621 -4.3481 -4.3481 -4.0250 -4.0250 -4.0201 -4.0201 2.9123 2.9123 2.9155 2.9155 3.2650 3.2650 3.2846 3.2846 3.8890 3.8890 3.8980 3.8980 4.2318 4.2318 4.2357 4.2357 4.6960 4.6960 4.6989 4.6989 5.0999 5.0999 5.1132 5.1132 7.8392 7.8392 7.8527 7.8527 7.9894 7.9894 7.9911 7.9911 8.8097 8.8097 8.8150 8.8150 k = 0.1458 0.2526 0.1282 ( 8156 PWs) bands (ev): -36.9961 -36.9961 -36.9961 -36.9961 -21.2520 -21.2520 -21.2520 -21.2520 -17.9642 -17.9642 -17.9642 -17.9642 -16.5330 -16.5330 -16.5330 -16.5330 -16.5144 -16.5144 -16.5144 -16.5144 -6.0202 -6.0202 -6.0079 -6.0079 -5.2589 -5.2589 -5.2577 -5.2577 -5.1475 -5.1475 -5.1171 -5.1171 -4.3840 -4.3840 -4.3708 -4.3708 -4.0230 -4.0230 -4.0186 -4.0186 2.8944 2.8944 2.8977 2.8977 3.3039 3.3039 3.3210 3.3210 3.9321 3.9321 3.9459 3.9459 4.2464 4.2464 4.2502 4.2502 4.7474 4.7474 4.7481 4.7481 5.1302 5.1302 5.1459 5.1459 7.8349 7.8349 7.8467 7.8467 7.9816 7.9816 7.9838 7.9838 8.7524 8.7524 8.7588 8.7588 k = 0.1389 0.2406 0.1282 ( 8164 PWs) bands (ev): -36.9963 -36.9963 -36.9963 -36.9963 -21.2527 -21.2527 -21.2527 -21.2527 -17.9635 -17.9635 -17.9635 -17.9635 -16.5322 -16.5322 -16.5322 -16.5322 -16.5134 -16.5134 -16.5134 -16.5134 -6.0172 -6.0172 -6.0065 -6.0065 -5.2620 -5.2620 -5.2587 -5.2587 -5.1434 -5.1434 -5.1136 -5.1136 -4.4058 -4.4058 -4.3934 -4.3934 -4.0209 -4.0209 -4.0171 -4.0171 2.8741 2.8741 2.8772 2.8772 3.3430 3.3430 3.3584 3.3584 3.9793 3.9793 4.0002 4.0002 4.2560 4.2560 4.2694 4.2694 4.7964 4.7964 4.7980 4.7980 5.1598 5.1598 5.1780 5.1780 7.8322 7.8322 7.8423 7.8423 7.9753 7.9753 7.9780 7.9780 8.6959 8.6959 8.7037 8.7037 k = 0.1319 0.2285 0.1282 ( 8182 PWs) bands (ev): -36.9964 -36.9964 -36.9964 -36.9964 -21.2533 -21.2533 -21.2533 -21.2533 -17.9628 -17.9628 -17.9628 -17.9628 -16.5315 -16.5315 -16.5315 -16.5315 -16.5122 -16.5122 -16.5122 -16.5122 -6.0145 -6.0145 -6.0051 -6.0051 -5.2651 -5.2651 -5.2604 -5.2604 -5.1383 -5.1383 -5.1098 -5.1098 -4.4273 -4.4273 -4.4157 -4.4157 -4.0189 -4.0189 -4.0155 -4.0155 2.8520 2.8520 2.8548 2.8548 3.3824 3.3824 3.3965 3.3965 4.0281 4.0281 4.0592 4.0592 4.2651 4.2651 4.2910 4.2910 4.8430 4.8430 4.8468 4.8468 5.1890 5.1890 5.2098 5.2098 7.8310 7.8310 7.8393 7.8393 7.9703 7.9703 7.9734 7.9734 8.6406 8.6406 8.6501 8.6501 k = 0.1250 0.2165 0.1282 ( 8192 PWs) bands (ev): -36.9965 -36.9965 -36.9965 -36.9965 -21.2539 -21.2539 -21.2539 -21.2539 -17.9621 -17.9621 -17.9621 -17.9621 -16.5309 -16.5309 -16.5309 -16.5309 -16.5111 -16.5111 -16.5111 -16.5111 -6.0120 -6.0120 -6.0039 -6.0039 -5.2682 -5.2682 -5.2628 -5.2628 -5.1322 -5.1322 -5.1056 -5.1056 -4.4484 -4.4484 -4.4377 -4.4377 -4.0170 -4.0170 -4.0141 -4.0141 2.8287 2.8287 2.8311 2.8311 3.4222 3.4222 3.4353 3.4353 4.0752 4.0752 4.1202 4.1202 4.2754 4.2754 4.3170 4.3170 4.8872 4.8872 4.8931 4.8931 5.2188 5.2188 5.2419 5.2419 7.8312 7.8312 7.8376 7.8376 7.9663 7.9663 7.9698 7.9698 8.5869 8.5869 8.5984 8.5984 k = 0.1181 0.2045 0.1282 ( 8188 PWs) bands (ev): -36.9966 -36.9966 -36.9966 -36.9966 -21.2545 -21.2545 -21.2545 -21.2545 -17.9614 -17.9614 -17.9614 -17.9614 -16.5303 -16.5303 -16.5303 -16.5303 -16.5098 -16.5098 -16.5098 -16.5098 -6.0097 -6.0097 -6.0028 -6.0028 -5.2712 -5.2712 -5.2656 -5.2656 -5.1255 -5.1255 -5.1011 -5.1011 -4.4690 -4.4690 -4.4592 -4.4592 -4.0151 -4.0151 -4.0126 -4.0126 2.8046 2.8046 2.8067 2.8067 3.4626 3.4626 3.4749 3.4749 4.1170 4.1170 4.1772 4.1772 4.2918 4.2918 4.3503 4.3503 4.9284 4.9284 4.9359 4.9359 5.2502 5.2502 5.2752 5.2752 7.8325 7.8325 7.8371 7.8371 7.9630 7.9630 7.9668 7.9668 8.5353 8.5353 8.5488 8.5488 k = 0.1111 0.1925 0.1282 ( 8204 PWs) bands (ev): -36.9967 -36.9967 -36.9967 -36.9967 -21.2551 -21.2551 -21.2551 -21.2551 -17.9608 -17.9608 -17.9608 -17.9608 -16.5298 -16.5298 -16.5298 -16.5298 -16.5086 -16.5086 -16.5086 -16.5086 -6.0076 -6.0076 -6.0019 -6.0019 -5.2742 -5.2742 -5.2687 -5.2687 -5.1183 -5.1183 -5.0964 -5.0964 -4.4891 -4.4891 -4.4802 -4.4802 -4.0134 -4.0134 -4.0112 -4.0112 2.7801 2.7801 2.7819 2.7819 3.5036 3.5036 3.5153 3.5153 4.1503 4.1503 4.2181 4.2181 4.3248 4.3248 4.3923 4.3923 4.9661 4.9661 4.9747 4.9747 5.2842 5.2842 5.3103 5.3103 7.8345 7.8345 7.8373 7.8373 7.9602 7.9602 7.9642 7.9642 8.4858 8.4858 8.5015 8.5015 k = 0.1042 0.1804 0.1282 ( 8194 PWs) bands (ev): -36.9968 -36.9968 -36.9968 -36.9968 -21.2557 -21.2557 -21.2557 -21.2557 -17.9602 -17.9602 -17.9602 -17.9602 -16.5294 -16.5294 -16.5294 -16.5294 -16.5073 -16.5073 -16.5073 -16.5073 -6.0058 -6.0058 -6.0011 -6.0011 -5.2771 -5.2771 -5.2720 -5.2720 -5.1107 -5.1107 -5.0913 -5.0913 -4.5085 -4.5085 -4.5006 -4.5006 -4.0117 -4.0117 -4.0099 -4.0099 2.7557 2.7557 2.7571 2.7571 3.5453 3.5453 3.5565 3.5565 4.1749 4.1749 4.2379 4.2379 4.3781 4.3781 4.4418 4.4418 5.0005 5.0005 5.0093 5.0093 5.3215 5.3215 5.3477 5.3477 7.8369 7.8369 7.8381 7.8381 7.9576 7.9576 7.9616 7.9616 8.4386 8.4386 8.4563 8.4563 k = 0.0972 0.1684 0.1282 ( 8196 PWs) bands (ev): -36.9969 -36.9969 -36.9969 -36.9969 -21.2562 -21.2562 -21.2562 -21.2562 -17.9596 -17.9596 -17.9596 -17.9596 -16.5290 -16.5290 -16.5290 -16.5290 -16.5060 -16.5060 -16.5060 -16.5060 -6.0043 -6.0043 -6.0004 -6.0004 -5.2799 -5.2799 -5.2753 -5.2753 -5.1029 -5.1029 -5.0861 -5.0861 -4.5273 -4.5273 -4.5203 -4.5203 -4.0101 -4.0101 -4.0086 -4.0086 2.7316 2.7316 2.7327 2.7327 3.5878 3.5878 3.5984 3.5984 4.1922 4.1922 4.2462 4.2462 4.4400 4.4400 4.4952 4.4952 5.0322 5.0322 5.0407 5.0407 5.3624 5.3624 5.3878 5.3878 7.8391 7.8391 7.8394 7.8394 7.9551 7.9551 7.9588 7.9588 8.3936 8.3936 8.4132 8.4132 k = 0.0903 0.1564 0.1282 ( 8200 PWs) bands (ev): -36.9970 -36.9970 -36.9970 -36.9970 -21.2568 -21.2568 -21.2568 -21.2568 -17.9590 -17.9590 -17.9590 -17.9590 -16.5287 -16.5287 -16.5287 -16.5287 -16.5047 -16.5047 -16.5047 -16.5047 -6.0030 -6.0030 -5.9999 -5.9999 -5.2826 -5.2826 -5.2786 -5.2786 -5.0949 -5.0949 -5.0806 -5.0806 -4.5452 -4.5452 -4.5392 -4.5392 -4.0087 -4.0087 -4.0075 -4.0075 2.7081 2.7081 2.7090 2.7090 3.6308 3.6308 3.6409 3.6409 4.2047 4.2047 4.2500 4.2500 4.5010 4.5010 4.5478 4.5478 5.0628 5.0628 5.0705 5.0705 5.4067 5.4067 5.4304 5.4304 7.8400 7.8400 7.8416 7.8416 7.9524 7.9524 7.9556 7.9556 8.3506 8.3506 8.3716 8.3716 k = 0.0833 0.1443 0.1282 ( 8192 PWs) bands (ev): -36.9971 -36.9971 -36.9971 -36.9971 -21.2573 -21.2573 -21.2573 -21.2573 -17.9584 -17.9584 -17.9584 -17.9584 -16.5284 -16.5284 -16.5284 -16.5284 -16.5035 -16.5035 -16.5035 -16.5035 -6.0019 -6.0019 -5.9994 -5.9994 -5.2852 -5.2852 -5.2818 -5.2818 -5.0869 -5.0869 -5.0750 -5.0750 -4.5624 -4.5624 -4.5572 -4.5572 -4.0074 -4.0074 -4.0064 -4.0064 2.6855 2.6855 2.6862 2.6862 3.6742 3.6742 3.6837 3.6837 4.2140 4.2140 4.2521 4.2521 4.5559 4.5559 4.5952 4.5952 5.0945 5.0945 5.1014 5.1014 5.4540 5.4540 5.4754 5.4754 7.8407 7.8407 7.8433 7.8433 7.9494 7.9494 7.9519 7.9519 8.3091 8.3091 8.3310 8.3310 k = 0.0764 0.1323 0.1282 ( 8190 PWs) bands (ev): -36.9972 -36.9972 -36.9972 -36.9972 -21.2578 -21.2578 -21.2578 -21.2578 -17.9579 -17.9579 -17.9579 -17.9579 -16.5282 -16.5282 -16.5282 -16.5282 -16.5023 -16.5023 -16.5023 -16.5023 -6.0010 -6.0010 -5.9991 -5.9991 -5.2876 -5.2876 -5.2848 -5.2848 -5.0790 -5.0790 -5.0694 -5.0694 -4.5785 -4.5785 -4.5742 -4.5742 -4.0062 -4.0062 -4.0054 -4.0054 2.6640 2.6640 2.6645 2.6645 3.7178 3.7178 3.7267 3.7267 4.2216 4.2216 4.2536 4.2536 4.6010 4.6010 4.6333 4.6333 5.1295 5.1295 5.1356 5.1356 5.5036 5.5036 5.5222 5.5222 7.8412 7.8412 7.8445 7.8445 7.9460 7.9460 7.9475 7.9475 8.2689 8.2689 8.2909 8.2909 k = 0.0694 0.1203 0.1282 ( 8194 PWs) bands (ev): -36.9973 -36.9973 -36.9973 -36.9973 -21.2582 -21.2582 -21.2582 -21.2582 -17.9574 -17.9574 -17.9574 -17.9574 -16.5280 -16.5280 -16.5280 -16.5280 -16.5011 -16.5011 -16.5011 -16.5011 -6.0003 -6.0003 -5.9989 -5.9989 -5.2899 -5.2899 -5.2877 -5.2877 -5.0714 -5.0714 -5.0637 -5.0637 -4.5937 -4.5937 -4.5902 -4.5902 -4.0051 -4.0051 -4.0045 -4.0045 2.6438 2.6438 2.6442 2.6442 3.7612 3.7612 3.7693 3.7693 4.2286 4.2286 4.2553 4.2553 4.6336 4.6336 4.6595 4.6595 5.1692 5.1692 5.1748 5.1748 5.5548 5.5548 5.5706 5.5706 7.8415 7.8415 7.8453 7.8453 7.9420 7.9420 7.9425 7.9425 8.2293 8.2293 8.2506 8.2506 k = 0.0625 0.1083 0.1282 ( 8186 PWs) bands (ev): -36.9973 -36.9973 -36.9973 -36.9973 -21.2586 -21.2586 -21.2586 -21.2586 -17.9570 -17.9570 -17.9570 -17.9570 -16.5278 -16.5278 -16.5278 -16.5278 -16.5000 -16.5000 -16.5000 -16.5000 -5.9998 -5.9998 -5.9988 -5.9988 -5.2920 -5.2920 -5.2903 -5.2903 -5.0640 -5.0640 -5.0581 -5.0581 -4.6079 -4.6079 -4.6051 -4.6051 -4.0041 -4.0041 -4.0037 -4.0037 2.6250 2.6250 2.6253 2.6253 3.8038 3.8038 3.8110 3.8110 4.2358 4.2358 4.2579 4.2579 4.6529 4.6529 4.6732 4.6732 5.2135 5.2135 5.2186 5.2186 5.6072 5.6072 5.6200 5.6200 7.8418 7.8418 7.8457 7.8457 7.9369 7.9369 7.9373 7.9373 8.1900 8.1900 8.2098 8.2098 k = 0.0556 0.0962 0.1282 ( 8192 PWs) bands (ev): -36.9974 -36.9974 -36.9974 -36.9974 -21.2590 -21.2590 -21.2590 -21.2590 -17.9566 -17.9566 -17.9566 -17.9566 -16.5277 -16.5277 -16.5277 -16.5277 -16.4990 -16.4990 -16.4990 -16.4990 -5.9994 -5.9994 -5.9987 -5.9987 -5.2939 -5.2939 -5.2927 -5.2927 -5.0570 -5.0570 -5.0527 -5.0527 -4.6209 -4.6209 -4.6188 -4.6188 -4.0033 -4.0033 -4.0030 -4.0030 2.6079 2.6079 2.6081 2.6081 3.8449 3.8449 3.8511 3.8511 4.2442 4.2442 4.2620 4.2620 4.6596 4.6596 4.6750 4.6750 5.2607 5.2607 5.2652 5.2652 5.6603 5.6603 5.6702 5.6702 7.8423 7.8423 7.8461 7.8461 7.9306 7.9306 7.9319 7.9319 8.1509 8.1509 8.1685 8.1685 k = 0.0486 0.0842 0.1282 ( 8190 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2593 -21.2593 -21.2593 -21.2593 -17.9562 -17.9562 -17.9562 -17.9562 -16.5276 -16.5276 -16.5276 -16.5276 -16.4981 -16.4981 -16.4981 -16.4981 -5.9992 -5.9992 -5.9987 -5.9987 -5.2956 -5.2956 -5.2948 -5.2948 -5.0505 -5.0505 -5.0475 -5.0475 -4.6327 -4.6327 -4.6312 -4.6312 -4.0026 -4.0026 -4.0023 -4.0023 2.5925 2.5925 2.5926 2.5926 3.8837 3.8837 3.8888 3.8888 4.2545 4.2545 4.2685 4.2685 4.6555 4.6555 4.6668 4.6668 5.3083 5.3083 5.3119 5.3119 5.7133 5.7133 5.7206 5.7206 7.8433 7.8433 7.8468 7.8468 7.9236 7.9236 7.9254 7.9254 8.1123 8.1123 8.1272 8.1272 k = 0.0417 0.0722 0.1282 ( 8190 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2596 -21.2596 -21.2596 -21.2596 -17.9559 -17.9559 -17.9559 -17.9559 -16.5275 -16.5275 -16.5275 -16.5275 -16.4973 -16.4973 -16.4973 -16.4973 -5.9990 -5.9990 -5.9987 -5.9987 -5.2971 -5.2971 -5.2966 -5.2966 -5.0446 -5.0446 -5.0426 -5.0426 -4.6432 -4.6432 -4.6422 -4.6422 -4.0019 -4.0019 -4.0018 -4.0018 2.5790 2.5790 2.5790 2.5790 3.9192 3.9192 3.9231 3.9231 4.2675 4.2675 4.2779 4.2779 4.6427 4.6427 4.6507 4.6507 5.3535 5.3535 5.3561 5.3561 5.7654 5.7654 5.7703 5.7703 7.8449 7.8449 7.8479 7.8479 7.9157 7.9157 7.9177 7.9177 8.0751 8.0751 8.0868 8.0868 k = 0.0347 0.0601 0.1282 ( 8190 PWs) bands (ev): -36.9975 -36.9975 -36.9975 -36.9975 -21.2599 -21.2599 -21.2599 -21.2599 -17.9556 -17.9556 -17.9556 -17.9556 -16.5275 -16.5275 -16.5275 -16.5275 -16.4966 -16.4966 -16.4966 -16.4966 -5.9990 -5.9990 -5.9988 -5.9988 -5.2985 -5.2985 -5.2981 -5.2981 -5.0394 -5.0394 -5.0382 -5.0382 -4.6523 -4.6523 -4.6517 -4.6517 -4.0014 -4.0014 -4.0014 -4.0014 2.5673 2.5673 2.5674 2.5674 3.9503 3.9503 3.9529 3.9529 4.2838 4.2838 4.2911 4.2911 4.6232 4.6232 4.6286 4.6286 5.3941 5.3941 5.3957 5.3957 5.8150 5.8150 5.8180 5.8180 7.8472 7.8472 7.8496 7.8496 7.9066 7.9066 7.9085 7.9085 8.0406 8.0406 8.0491 8.0491 k = 0.0278 0.0481 0.1282 ( 8182 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2601 -21.2601 -21.2601 -21.2601 -17.9554 -17.9554 -17.9554 -17.9554 -16.5274 -16.5274 -16.5274 -16.5274 -16.4961 -16.4961 -16.4961 -16.4961 -5.9989 -5.9989 -5.9988 -5.9988 -5.2996 -5.2996 -5.2994 -5.2994 -5.0350 -5.0350 -5.0344 -5.0344 -4.6599 -4.6599 -4.6596 -4.6596 -4.0010 -4.0010 -4.0010 -4.0010 2.5577 2.5577 2.5578 2.5578 3.9761 3.9761 3.9776 3.9776 4.3036 4.3036 4.3081 4.3081 4.5992 4.5992 4.6025 4.6025 5.4283 5.4283 5.4292 5.4292 5.8603 5.8603 5.8619 5.8619 7.8500 7.8500 7.8518 7.8518 7.8962 7.8962 7.8975 7.8975 8.0108 8.0108 8.0161 8.0161 k = 0.0208 0.0361 0.1282 ( 8174 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2602 -21.2602 -21.2602 -21.2602 -17.9552 -17.9552 -17.9552 -17.9552 -16.5274 -16.5274 -16.5274 -16.5274 -16.4956 -16.4956 -16.4956 -16.4956 -5.9989 -5.9989 -5.9989 -5.9989 -5.3004 -5.3004 -5.3004 -5.3004 -5.0316 -5.0316 -5.0313 -5.0313 -4.6659 -4.6659 -4.6658 -4.6658 -4.0007 -4.0007 -4.0007 -4.0007 2.5502 2.5502 2.5502 2.5502 3.9960 3.9960 3.9967 3.9967 4.3261 4.3261 4.3285 4.3285 4.5726 4.5726 4.5744 4.5744 5.4554 5.4554 5.4558 5.4558 5.8989 5.8989 5.8996 5.8996 7.8531 7.8531 7.8542 7.8542 7.8850 7.8850 7.8855 7.8855 7.9872 7.9872 7.9898 7.9898 k = 0.0139 0.0241 0.1282 ( 8174 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2603 -21.2603 -21.2603 -21.2603 -17.9551 -17.9551 -17.9551 -17.9551 -16.5274 -16.5274 -16.5274 -16.5274 -16.4953 -16.4953 -16.4953 -16.4953 -5.9989 -5.9989 -5.9989 -5.9989 -5.3011 -5.3011 -5.3011 -5.3011 -5.0290 -5.0290 -5.0290 -5.0290 -4.6703 -4.6703 -4.6703 -4.6703 -4.0005 -4.0005 -4.0005 -4.0005 2.5448 2.5448 2.5448 2.5448 4.0098 4.0098 4.0101 4.0101 4.3494 4.3494 4.3503 4.3503 4.5463 4.5463 4.5470 4.5470 5.4749 5.4749 5.4750 5.4750 5.9287 5.9287 5.9289 5.9289 7.8556 7.8556 7.8561 7.8561 7.8744 7.8744 7.8744 7.8744 7.9706 7.9706 7.9714 7.9714 k = 0.0069 0.0120 0.1282 ( 8168 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4951 -16.4951 -16.4951 -16.4951 -5.9990 -5.9990 -5.9990 -5.9990 -5.3015 -5.3015 -5.3015 -5.3015 -5.0275 -5.0275 -5.0275 -5.0275 -4.6730 -4.6730 -4.6730 -4.6730 -4.0004 -4.0004 -4.0004 -4.0004 2.5415 2.5415 2.5415 2.5415 4.0179 4.0179 4.0180 4.0180 4.3690 4.3690 4.3692 4.3692 4.5248 4.5248 4.5249 4.5249 5.4866 5.4866 5.4866 5.4866 5.9475 5.9475 5.9475 5.9475 7.8562 7.8562 7.8563 7.8563 7.8676 7.8676 7.8676 7.8676 7.9608 7.9608 7.9609 7.9609 k = 0.0000 0.0000 0.1282 ( 8164 PWs) bands (ev): -36.9976 -36.9976 -36.9976 -36.9976 -21.2604 -21.2604 -21.2604 -21.2604 -17.9550 -17.9550 -17.9550 -17.9550 -16.5273 -16.5273 -16.5273 -16.5273 -16.4950 -16.4950 -16.4950 -16.4950 -5.9990 -5.9990 -5.9990 -5.9990 -5.3016 -5.3016 -5.3016 -5.3016 -5.0270 -5.0270 -5.0270 -5.0270 -4.6739 -4.6739 -4.6739 -4.6739 -4.0003 -4.0003 -4.0003 -4.0003 2.5405 2.5405 2.5405 2.5405 4.0206 4.0206 4.0206 4.0206 4.3773 4.3773 4.3773 4.3773 4.5158 4.5158 4.5158 4.5158 5.4905 5.4905 5.4905 5.4905 5.9539 5.9539 5.9539 5.9539 7.8556 7.8556 7.8556 7.8556 7.8659 7.8659 7.8659 7.8659 7.9575 7.9575 7.9575 7.9575 k = 0.5000 0.2887 0.1282 ( 8144 PWs) bands (ev): -36.9947 -36.9947 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0590 -6.0590 -6.0590 -6.0590 -5.2892 -5.2892 -5.2892 -5.2892 -5.0896 -5.0896 -5.0896 -5.0896 -4.1326 -4.1326 -4.1326 -4.1326 -3.9923 -3.9923 -3.9923 -3.9923 2.3128 2.3128 2.3128 2.3128 3.1047 3.1047 3.1047 3.1047 3.8841 3.8841 3.8841 3.8841 4.2605 4.2605 4.2605 4.2605 4.3283 4.3283 4.3283 4.3283 4.8594 4.8594 4.8594 4.8594 7.0455 7.0455 7.0455 7.0455 8.9744 8.9744 8.9744 8.9744 9.0492 9.0492 9.0492 9.0492 k = 0.5000 0.2887 0.1154 ( 8158 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0592 -6.0592 -6.0589 -6.0589 -5.2896 -5.2896 -5.2887 -5.2887 -5.0896 -5.0896 -5.0895 -5.0895 -4.1377 -4.1377 -4.1271 -4.1271 -3.9969 -3.9969 -3.9880 -3.9880 2.2998 2.2998 2.3262 2.3262 3.1008 3.1008 3.1084 3.1084 3.8835 3.8835 3.8850 3.8850 4.2382 4.2382 4.2813 4.2813 4.3266 4.3266 4.3312 4.3312 4.8494 4.8494 4.8697 4.8697 7.0217 7.0217 7.0692 7.0692 8.9663 8.9663 8.9818 8.9818 9.0484 9.0484 9.0500 9.0500 k = 0.5000 0.2887 0.1025 ( 8160 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0593 -6.0593 -6.0587 -6.0587 -5.2900 -5.2900 -5.2883 -5.2883 -5.0897 -5.0897 -5.0895 -5.0895 -4.1424 -4.1424 -4.1214 -4.1214 -4.0018 -4.0018 -3.9840 -3.9840 2.2874 2.2874 2.3396 2.3396 3.0967 3.0967 3.1118 3.1118 3.8831 3.8831 3.8861 3.8861 4.2156 4.2156 4.2980 4.2980 4.3280 4.3280 4.3346 4.3346 4.8400 4.8400 4.8802 4.8802 6.9983 6.9983 7.0923 7.0923 8.9578 8.9578 8.9885 8.9885 9.0478 9.0478 9.0510 9.0510 k = 0.5000 0.2887 0.0897 ( 8178 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0594 -6.0594 -6.0586 -6.0586 -5.2904 -5.2904 -5.2879 -5.2879 -5.0897 -5.0897 -5.0894 -5.0894 -4.1467 -4.1467 -4.1155 -4.1155 -4.0070 -4.0070 -3.9805 -3.9805 2.2759 2.2759 2.3527 2.3527 3.0926 3.0926 3.1148 3.1148 3.8829 3.8829 3.8874 3.8874 4.1935 4.1935 4.3061 4.3061 4.3352 4.3352 4.3399 4.3399 4.8313 4.8313 4.8906 4.8906 6.9760 6.9760 7.1142 7.1142 8.9490 8.9490 8.9944 8.9944 9.0474 9.0474 9.0521 9.0521 k = 0.5000 0.2887 0.0769 ( 8170 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0596 -6.0596 -6.0585 -6.0585 -5.2908 -5.2908 -5.2875 -5.2875 -5.0898 -5.0898 -5.0894 -5.0894 -4.1505 -4.1505 -4.1095 -4.1095 -4.0123 -4.0123 -3.9774 -3.9774 2.2655 2.2655 2.3651 2.3651 3.0885 3.0885 3.1175 3.1175 3.8828 3.8828 3.8890 3.8890 4.1724 4.1724 4.3074 4.3074 4.3402 4.3402 4.3524 4.3524 4.8236 4.8236 4.9005 4.9005 6.9552 6.9552 7.1345 7.1345 8.9402 8.9402 8.9996 8.9996 9.0472 9.0472 9.0532 9.0532 k = 0.5000 0.2887 0.0641 ( 8160 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2439 -21.2439 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0597 -6.0597 -6.0584 -6.0584 -5.2911 -5.2911 -5.2872 -5.2872 -5.0898 -5.0898 -5.0893 -5.0893 -4.1538 -4.1538 -4.1035 -4.1035 -4.0176 -4.0176 -3.9748 -3.9748 2.2564 2.2564 2.3765 2.3765 3.0847 3.0847 3.1197 3.1197 3.8828 3.8828 3.8908 3.8908 4.1532 4.1532 4.3066 4.3066 4.3436 4.3436 4.3665 4.3665 4.8168 4.8168 4.9096 4.9096 6.9366 6.9366 7.1525 7.1525 8.9319 8.9319 9.0040 9.0040 9.0472 9.0472 9.0544 9.0544 k = 0.5000 0.2887 0.0513 ( 8160 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0598 -6.0598 -6.0583 -6.0583 -5.2914 -5.2914 -5.2869 -5.2869 -5.0898 -5.0898 -5.0893 -5.0893 -4.1565 -4.1565 -4.0978 -4.0978 -4.0229 -4.0229 -3.9726 -3.9726 2.2487 2.2487 2.3864 2.3864 3.0812 3.0812 3.1216 3.1216 3.8828 3.8828 3.8926 3.8926 4.1363 4.1363 4.3054 4.3054 4.3464 4.3464 4.3790 4.3790 4.8112 4.8112 4.9177 4.9177 6.9205 6.9205 7.1680 7.1680 8.9243 8.9243 9.0078 9.0078 9.0474 9.0474 9.0558 9.0558 k = 0.5000 0.2887 0.0385 ( 8164 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0599 -6.0599 -6.0582 -6.0582 -5.2917 -5.2917 -5.2867 -5.2867 -5.0899 -5.0899 -5.0893 -5.0893 -4.1587 -4.1587 -4.0924 -4.0924 -4.0277 -4.0277 -3.9709 -3.9709 2.2426 2.2426 2.3945 2.3945 3.0784 3.0784 3.1231 3.1231 3.8829 3.8829 3.8944 3.8944 4.1224 4.1224 4.3043 4.3043 4.3488 4.3488 4.3891 4.3891 4.8067 4.8067 4.9244 4.9244 6.9075 6.9075 7.1804 7.1804 8.9180 8.9180 9.0109 9.0109 9.0479 9.0479 9.0575 9.0575 k = 0.5000 0.2887 0.0256 ( 8172 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0599 -6.0599 -6.0581 -6.0581 -5.2918 -5.2918 -5.2865 -5.2865 -5.0899 -5.0899 -5.0893 -5.0893 -4.1602 -4.1602 -4.0880 -4.0880 -4.0319 -4.0319 -3.9696 -3.9696 2.2382 2.2382 2.4006 2.4006 3.0762 3.0762 3.1241 3.1241 3.8830 3.8830 3.8959 3.8959 4.1120 4.1120 4.3035 4.3035 4.3505 4.3505 4.3964 4.3964 4.8035 4.8035 4.9294 4.9294 6.8979 6.8979 7.1896 7.1896 8.9132 8.9132 9.0132 9.0132 9.0484 9.0484 9.0598 9.0598 k = 0.5000 0.2887 0.0128 ( 8174 PWs) bands (ev): -36.9948 -36.9948 -36.9948 -36.9948 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0599 -6.0599 -6.0581 -6.0581 -5.2919 -5.2919 -5.2864 -5.2864 -5.0899 -5.0899 -5.0892 -5.0892 -4.1612 -4.1612 -4.0849 -4.0849 -4.0348 -4.0348 -3.9689 -3.9689 2.2355 2.2355 2.4044 2.4044 3.0748 3.0748 3.1247 3.1247 3.8830 3.8830 3.8969 3.8969 4.1055 4.1055 4.3029 4.3029 4.3516 4.3516 4.4009 4.4009 4.8016 4.8016 4.9325 4.9325 6.8921 6.8921 7.1951 7.1951 8.9101 8.9101 9.0147 9.0147 9.0489 9.0489 9.0625 9.0625 k = 0.5000 0.2887-0.0000 ( 8166 PWs) bands (ev): -36.9948 -36.9948 -36.9947 -36.9947 -21.2440 -21.2440 -21.2439 -21.2439 -17.9733 -17.9733 -17.9733 -17.9733 -16.5537 -16.5537 -16.5537 -16.5537 -16.5171 -16.5171 -16.5171 -16.5171 -6.0600 -6.0600 -6.0581 -6.0581 -5.2920 -5.2920 -5.2864 -5.2864 -5.0899 -5.0899 -5.0892 -5.0892 -4.1615 -4.1615 -4.0838 -4.0838 -4.0359 -4.0359 -3.9686 -3.9686 2.2346 2.2346 2.4056 2.4056 3.0743 3.0743 3.1249 3.1249 3.8830 3.8830 3.8973 3.8973 4.1034 4.1034 4.3027 4.3027 4.3520 4.3520 4.4024 4.4024 4.8010 4.8010 4.9335 4.9335 6.8901 6.8901 7.1970 7.1970 8.9091 8.9091 9.0152 9.0152 9.0490 9.0490 9.0641 9.0641 k = 0.3333 0.5774-0.0000 ( 8124 PWs) bands (ev): -36.9944 -36.9944 -36.9943 -36.9943 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8278 2.8278 2.9076 2.9076 2.9404 2.9404 3.1014 3.1014 3.2771 3.2771 3.4318 3.4318 3.9184 3.9184 4.0400 4.0400 4.1275 4.1275 4.2289 4.2289 4.2503 4.2503 4.3663 4.3663 8.1048 8.1048 8.1576 8.1576 8.5419 8.5419 8.6294 8.6294 8.7451 8.7451 8.8430 8.8430 k = 0.3333 0.5774 0.0128 ( 8148 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8282 2.8282 2.9072 2.9072 2.9404 2.9404 3.1014 3.1014 3.2771 3.2771 3.4317 3.4317 3.9191 3.9191 4.0393 4.0393 4.1279 4.1279 4.2285 4.2285 4.2510 4.2510 4.3657 4.3657 8.1051 8.1051 8.1573 8.1573 8.5427 8.5427 8.6304 8.6304 8.7440 8.7440 8.8417 8.8417 k = 0.3333 0.5774 0.0256 ( 8142 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8293 2.8293 2.9058 2.9058 2.9405 2.9405 3.1012 3.1012 3.2774 3.2774 3.4313 3.4313 3.9212 3.9212 4.0374 4.0374 4.1292 4.1292 4.2272 4.2272 4.2531 4.2531 4.3638 4.3638 8.1060 8.1060 8.1562 8.1562 8.5451 8.5451 8.6333 8.6333 8.7408 8.7408 8.8377 8.8377 k = 0.3333 0.5774 0.0385 ( 8151 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8310 2.8310 2.9037 2.9037 2.9406 2.9406 3.1009 3.1009 3.2777 3.2777 3.4306 3.4306 3.9246 3.9246 4.0344 4.0344 4.1313 4.1313 4.2252 4.2252 4.2565 4.2565 4.3606 4.3606 8.1075 8.1075 8.1545 8.1545 8.5491 8.5491 8.6381 8.6381 8.7357 8.7357 8.8314 8.8314 k = 0.3333 0.5774 0.0513 ( 8163 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8334 2.8334 2.9008 2.9008 2.9408 2.9408 3.1006 3.1006 3.2782 3.2782 3.4298 3.4298 3.9291 3.9291 4.0302 4.0302 4.1341 4.1341 4.2225 4.2225 4.2611 4.2611 4.3564 4.3564 8.1095 8.1095 8.1522 8.1522 8.5544 8.5544 8.6446 8.6446 8.7289 8.7289 8.8229 8.8229 k = 0.3333 0.5774 0.0641 ( 8169 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8363 2.8363 2.8974 2.8974 2.9410 2.9410 3.1003 3.1003 3.2787 3.2787 3.4289 3.4289 3.9347 3.9347 4.0251 4.0251 4.1374 4.1374 4.2193 4.2193 4.2667 4.2667 4.3511 4.3511 8.1120 8.1120 8.1493 8.1493 8.5608 8.5608 8.6526 8.6526 8.7210 8.7210 8.8128 8.8128 k = 0.3333 0.5774 0.0769 ( 8181 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8395 2.8395 2.8937 2.8937 2.9412 2.9412 3.0999 3.0999 3.2792 3.2792 3.4280 3.4280 3.9409 3.9409 4.0193 4.0193 4.1409 4.1409 4.2159 4.2159 4.2730 4.2730 4.3451 4.3451 8.1150 8.1150 8.1460 8.1460 8.5678 8.5678 8.6616 8.6616 8.7124 8.7124 8.8017 8.8017 k = 0.3333 0.5774 0.0897 ( 8175 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8429 2.8429 2.8898 2.8898 2.9414 2.9414 3.0996 3.0996 3.2797 3.2797 3.4272 3.4272 3.9474 3.9474 4.0131 4.0131 4.1444 4.1444 4.2124 4.2124 4.2799 4.2799 4.3385 4.3385 8.1183 8.1183 8.1424 8.1424 8.5749 8.5749 8.6712 8.6712 8.7038 8.7038 8.7903 8.7903 k = 0.3333 0.5774 0.1025 ( 8169 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8460 2.8460 2.8863 2.8863 2.9415 2.9415 3.0993 3.0993 3.2801 3.2801 3.4265 3.4265 3.9536 3.9536 4.0072 4.0072 4.1475 4.1475 4.2094 4.2094 4.2867 4.2867 4.3320 4.3320 8.1220 8.1220 8.1385 8.1385 8.5813 8.5813 8.6802 8.6802 8.6964 8.6964 8.7797 8.7797 k = 0.3333 0.5774 0.1154 ( 8157 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8483 2.8483 2.8838 2.8838 2.9416 2.9416 3.0992 3.0992 3.2803 3.2803 3.4261 3.4261 3.9584 3.9584 4.0026 4.0026 4.1496 4.1496 4.2073 4.2073 4.2924 4.2924 4.3265 4.3265 8.1259 8.1259 8.1345 8.1345 8.5858 8.5858 8.6872 8.6872 8.6911 8.6911 8.7719 8.7719 k = 0.3333 0.5774 0.1282 ( 8154 PWs) bands (ev): -36.9944 -36.9944 -36.9944 -36.9944 -21.2419 -21.2419 -21.2419 -21.2419 -17.9753 -17.9753 -17.9753 -17.9753 -16.5469 -16.5469 -16.5469 -16.5469 -16.5303 -16.5303 -16.5303 -16.5303 -6.0828 -6.0828 -6.0281 -6.0281 -5.3545 -5.3545 -5.2232 -5.2232 -5.1337 -5.1337 -5.0953 -5.0953 -4.0873 -4.0873 -4.0762 -4.0762 -3.9773 -3.9773 -3.9469 -3.9469 2.8491 2.8491 2.8828 2.8828 2.9416 2.9416 3.0991 3.0991 3.2804 3.2804 3.4260 3.4260 3.9604 3.9604 4.0007 4.0007 4.1504 4.1504 4.2066 4.2066 4.2948 4.2948 4.3241 4.3241 8.1288 8.1288 8.1315 8.1315 8.5875 8.5875 8.6892 8.6892 8.6899 8.6899 8.7688 8.7688 Writing output data file RbYTe2.save init_run : 0.39s CPU 0.52s WALL ( 1 calls) electrons : 414.26s CPU 418.37s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 414.25s CPU 418.36s 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 : 0.14s CPU 0.15s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.09s WALL ( 265 calls) cegterg : 377.13s CPU 380.15s WALL ( 358 calls) Called by sum_band: Called by *egterg: h_psi : 189.64s CPU 192.67s WALL ( 5964 calls) s_psi : 18.68s CPU 18.77s WALL ( 5964 calls) g_psi : 0.30s CPU 0.28s WALL ( 5341 calls) cdiaghg : 158.02s CPU 158.48s WALL ( 5606 calls) cegterg:over : 18.76s CPU 18.74s WALL ( 5341 calls) cegterg:upda : 10.61s CPU 10.43s WALL ( 5341 calls) cegterg:last : 6.32s CPU 6.38s WALL ( 981 calls) cdiaghg:chol : 5.78s CPU 5.84s WALL ( 5606 calls) cdiaghg:inve : 4.41s CPU 4.52s WALL ( 5606 calls) cdiaghg:para : 10.17s CPU 10.34s WALL ( 11212 calls) Called by h_psi: h_psi:vloc : 159.50s CPU 162.45s WALL ( 5964 calls) h_psi:vnl : 29.88s CPU 29.94s WALL ( 5964 calls) add_vuspsi : 15.67s CPU 15.65s WALL ( 5964 calls) General routines calbec : 14.17s CPU 14.27s WALL ( 5964 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 154.07s CPU 156.92s WALL ( 971664 calls) interpolate : 0.00s CPU 0.01s WALL ( 4 calls) davcio : 0.17s CPU 0.56s WALL ( 530 calls) Parallel routines fft_scatter : 113.42s CPU 115.40s WALL ( 971687 calls) PWSCF : 7m52.57s CPU 8m17.64s WALL This run was terminated on: 8:50:48 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. 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