Program PWSCF v.5.3.0 (svn rev. 11974) starts on 3Jan2017 at 13:22:28 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./TiAs.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 28 28 8 1268 1268 196 Max 29 29 9 1277 1277 201 Sum 1039 1039 301 45911 45911 7103 bravais-lattice index = 14 lattice parameter (alat) = 6.8881 a.u. unit-cell volume = 474.3428 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 34.00 number of Kohn-Sham states= 42 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.888051 celldm(2)= 1.000000 celldm(3)= 1.675995 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 1.675995 ) 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 0.596661 ) PseudoPot. # 1 for As read from file: /users/gautes/Pseudo/As.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 91883ac77fc8b4c49e33555c42516b17 Pseudo is Ultrasoft + core correction, Zval = 5.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1209 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Ti read from file: /users/gautes/Pseudo/Ti.rel-pbe-oncvpsp.UPF MD5 check sum: 490816c065db03488b8f3a1c39de4952 Pseudo is Norm-conserving, Zval = 12.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 600 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 atomic species valence mass pseudopotential As 5.00 74.92160 As( 1.00) Ti 12.00 47.86700 Ti( 1.00) 24 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( 0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( 0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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 ) ( 0.8379973 ) 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= 361 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0100000 0.0057735 -0.0000000), wk = 0.0027701 k( 3) = ( 0.0200000 0.0115470 -0.0000000), wk = 0.0027701 k( 4) = ( 0.0300000 0.0173205 -0.0000000), wk = 0.0027701 k( 5) = ( 0.0400000 0.0230940 -0.0000000), wk = 0.0027701 k( 6) = ( 0.0500000 0.0288675 -0.0000000), wk = 0.0027701 k( 7) = ( 0.0600000 0.0346410 -0.0000000), wk = 0.0027701 k( 8) = ( 0.0700000 0.0404145 -0.0000000), wk = 0.0027701 k( 9) = ( 0.0800000 0.0461880 -0.0000000), wk = 0.0027701 k( 10) = ( 0.0900000 0.0519615 -0.0000000), wk = 0.0027701 k( 11) = ( 0.1000000 0.0577350 -0.0000000), wk = 0.0027701 k( 12) = ( 0.1100000 0.0635085 -0.0000000), wk = 0.0027701 k( 13) = ( 0.1200000 0.0692820 -0.0000000), wk = 0.0027701 k( 14) = ( 0.1300000 0.0750555 -0.0000000), wk = 0.0027701 k( 15) = ( 0.1400000 0.0808290 -0.0000000), wk = 0.0027701 k( 16) = ( 0.1500000 0.0866025 -0.0000000), wk = 0.0027701 k( 17) = ( 0.1600000 0.0923760 -0.0000000), wk = 0.0027701 k( 18) = ( 0.1700000 0.0981495 -0.0000000), wk = 0.0027701 k( 19) = ( 0.1800000 0.1039230 -0.0000000), wk = 0.0027701 k( 20) = ( 0.1900000 0.1096966 -0.0000000), wk = 0.0027701 k( 21) = ( 0.2000000 0.1154701 -0.0000000), wk = 0.0027701 k( 22) = ( 0.2100000 0.1212436 -0.0000000), wk = 0.0027701 k( 23) = ( 0.2200000 0.1270171 -0.0000000), wk = 0.0027701 k( 24) = ( 0.2300000 0.1327906 -0.0000000), wk = 0.0027701 k( 25) = ( 0.2400000 0.1385641 -0.0000000), wk = 0.0027701 k( 26) = ( 0.2500000 0.1443376 -0.0000000), wk = 0.0027701 k( 27) = ( 0.2600000 0.1501111 -0.0000000), wk = 0.0027701 k( 28) = ( 0.2700000 0.1558846 -0.0000000), wk = 0.0027701 k( 29) = ( 0.2800000 0.1616581 -0.0000000), wk = 0.0027701 k( 30) = ( 0.2900000 0.1674316 -0.0000000), wk = 0.0027701 k( 31) = ( 0.3000000 0.1732051 -0.0000000), wk = 0.0027701 k( 32) = ( 0.3100000 0.1789786 -0.0000000), wk = 0.0027701 k( 33) = ( 0.3200000 0.1847521 -0.0000000), wk = 0.0027701 k( 34) = ( 0.3300000 0.1905256 -0.0000000), wk = 0.0027701 k( 35) = ( 0.3400000 0.1962991 -0.0000000), wk = 0.0027701 k( 36) = ( 0.3500000 0.2020726 -0.0000000), wk = 0.0027701 k( 37) = ( 0.3600000 0.2078461 -0.0000000), wk = 0.0027701 k( 38) = ( 0.3700000 0.2136196 -0.0000000), wk = 0.0027701 k( 39) = ( 0.3800000 0.2193931 -0.0000000), wk = 0.0027701 k( 40) = ( 0.3900000 0.2251666 -0.0000000), wk = 0.0027701 k( 41) = ( 0.4000000 0.2309401 -0.0000000), wk = 0.0027701 k( 42) = ( 0.4100000 0.2367136 -0.0000000), wk = 0.0027701 k( 43) = ( 0.4200000 0.2424871 -0.0000000), wk = 0.0027701 k( 44) = ( 0.4300000 0.2482606 -0.0000000), wk = 0.0027701 k( 45) = ( 0.4400000 0.2540341 -0.0000000), wk = 0.0027701 k( 46) = ( 0.4500000 0.2598076 -0.0000000), wk = 0.0027701 k( 47) = ( 0.4600000 0.2655811 -0.0000000), wk = 0.0027701 k( 48) = ( 0.4700000 0.2713546 -0.0000000), wk = 0.0027701 k( 49) = ( 0.4800000 0.2771281 -0.0000000), wk = 0.0027701 k( 50) = ( 0.4900000 0.2829016 -0.0000000), wk = 0.0027701 k( 51) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027701 k( 52) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027701 k( 53) = ( 0.4942529 0.2986294 -0.0000000), wk = 0.0027701 k( 54) = ( 0.4885058 0.3085838 -0.0000000), wk = 0.0027701 k( 55) = ( 0.4827586 0.3185381 -0.0000000), wk = 0.0027701 k( 56) = ( 0.4770115 0.3284924 -0.0000000), wk = 0.0027701 k( 57) = ( 0.4712644 0.3384467 -0.0000000), wk = 0.0027701 k( 58) = ( 0.4655172 0.3484010 -0.0000000), wk = 0.0027701 k( 59) = ( 0.4597701 0.3583553 -0.0000000), wk = 0.0027701 k( 60) = ( 0.4540230 0.3683097 -0.0000000), wk = 0.0027701 k( 61) = ( 0.4482759 0.3782640 -0.0000000), wk = 0.0027701 k( 62) = ( 0.4425287 0.3882183 -0.0000000), wk = 0.0027701 k( 63) = ( 0.4367816 0.3981726 -0.0000000), wk = 0.0027701 k( 64) = ( 0.4310345 0.4081269 -0.0000000), wk = 0.0027701 k( 65) = ( 0.4252874 0.4180812 -0.0000000), wk = 0.0027701 k( 66) = ( 0.4195402 0.4280355 -0.0000000), wk = 0.0027701 k( 67) = ( 0.4137931 0.4379899 -0.0000000), wk = 0.0027701 k( 68) = ( 0.4080460 0.4479442 -0.0000000), wk = 0.0027701 k( 69) = ( 0.4022988 0.4578985 -0.0000000), wk = 0.0027701 k( 70) = ( 0.3965517 0.4678528 -0.0000000), wk = 0.0027701 k( 71) = ( 0.3908046 0.4778071 -0.0000000), wk = 0.0027701 k( 72) = ( 0.3850575 0.4877614 -0.0000000), wk = 0.0027701 k( 73) = ( 0.3793103 0.4977157 -0.0000000), wk = 0.0027701 k( 74) = ( 0.3735632 0.5076701 -0.0000000), wk = 0.0027701 k( 75) = ( 0.3678161 0.5176244 -0.0000000), wk = 0.0027701 k( 76) = ( 0.3620690 0.5275787 -0.0000000), wk = 0.0027701 k( 77) = ( 0.3563218 0.5375330 -0.0000000), wk = 0.0027701 k( 78) = ( 0.3505747 0.5474873 -0.0000000), wk = 0.0027701 k( 79) = ( 0.3448276 0.5574416 -0.0000000), wk = 0.0027701 k( 80) = ( 0.3390805 0.5673960 -0.0000000), wk = 0.0027701 k( 81) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027701 k( 82) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027701 k( 83) = ( 0.3275862 0.5673960 -0.0000000), wk = 0.0027701 k( 84) = ( 0.3218391 0.5574416 -0.0000000), wk = 0.0027701 k( 85) = ( 0.3160920 0.5474873 -0.0000000), wk = 0.0027701 k( 86) = ( 0.3103448 0.5375330 -0.0000000), wk = 0.0027701 k( 87) = ( 0.3045977 0.5275787 -0.0000000), wk = 0.0027701 k( 88) = ( 0.2988506 0.5176244 -0.0000000), wk = 0.0027701 k( 89) = ( 0.2931034 0.5076701 -0.0000000), wk = 0.0027701 k( 90) = ( 0.2873563 0.4977157 -0.0000000), wk = 0.0027701 k( 91) = ( 0.2816092 0.4877614 -0.0000000), wk = 0.0027701 k( 92) = ( 0.2758621 0.4778071 -0.0000000), wk = 0.0027701 k( 93) = ( 0.2701149 0.4678528 -0.0000000), wk = 0.0027701 k( 94) = ( 0.2643678 0.4578985 -0.0000000), wk = 0.0027701 k( 95) = ( 0.2586207 0.4479442 -0.0000000), wk = 0.0027701 k( 96) = ( 0.2528736 0.4379899 -0.0000000), wk = 0.0027701 k( 97) = ( 0.2471264 0.4280355 -0.0000000), wk = 0.0027701 k( 98) = ( 0.2413793 0.4180812 -0.0000000), wk = 0.0027701 k( 99) = ( 0.2356322 0.4081269 -0.0000000), wk = 0.0027701 k( 100) = ( 0.2298851 0.3981726 -0.0000000), wk = 0.0027701 k( 101) = ( 0.2241379 0.3882183 -0.0000000), wk = 0.0027701 k( 102) = ( 0.2183908 0.3782640 -0.0000000), wk = 0.0027701 k( 103) = ( 0.2126437 0.3683097 -0.0000000), wk = 0.0027701 k( 104) = ( 0.2068966 0.3583553 -0.0000000), wk = 0.0027701 k( 105) = ( 0.2011494 0.3484010 -0.0000000), wk = 0.0027701 k( 106) = ( 0.1954023 0.3384467 -0.0000000), wk = 0.0027701 k( 107) = ( 0.1896552 0.3284924 -0.0000000), wk = 0.0027701 k( 108) = ( 0.1839080 0.3185381 -0.0000000), wk = 0.0027701 k( 109) = ( 0.1781609 0.3085838 -0.0000000), wk = 0.0027701 k( 110) = ( 0.1724138 0.2986294 -0.0000000), wk = 0.0027701 k( 111) = ( 0.1666667 0.2886751 -0.0000000), wk = 0.0027701 k( 112) = ( 0.1609195 0.2787208 -0.0000000), wk = 0.0027701 k( 113) = ( 0.1551724 0.2687665 -0.0000000), wk = 0.0027701 k( 114) = ( 0.1494253 0.2588122 -0.0000000), wk = 0.0027701 k( 115) = ( 0.1436782 0.2488579 -0.0000000), wk = 0.0027701 k( 116) = ( 0.1379310 0.2389036 -0.0000000), wk = 0.0027701 k( 117) = ( 0.1321839 0.2289492 -0.0000000), wk = 0.0027701 k( 118) = ( 0.1264368 0.2189949 -0.0000000), wk = 0.0027701 k( 119) = ( 0.1206897 0.2090406 -0.0000000), wk = 0.0027701 k( 120) = ( 0.1149425 0.1990863 -0.0000000), wk = 0.0027701 k( 121) = ( 0.1091954 0.1891320 -0.0000000), wk = 0.0027701 k( 122) = ( 0.1034483 0.1791777 -0.0000000), wk = 0.0027701 k( 123) = ( 0.0977012 0.1692234 -0.0000000), wk = 0.0027701 k( 124) = ( 0.0919540 0.1592690 -0.0000000), wk = 0.0027701 k( 125) = ( 0.0862069 0.1493147 -0.0000000), wk = 0.0027701 k( 126) = ( 0.0804598 0.1393604 -0.0000000), wk = 0.0027701 k( 127) = ( 0.0747126 0.1294061 -0.0000000), wk = 0.0027701 k( 128) = ( 0.0689655 0.1194518 -0.0000000), wk = 0.0027701 k( 129) = ( 0.0632184 0.1094975 -0.0000000), wk = 0.0027701 k( 130) = ( 0.0574713 0.0995431 -0.0000000), wk = 0.0027701 k( 131) = ( 0.0517241 0.0895888 -0.0000000), wk = 0.0027701 k( 132) = ( 0.0459770 0.0796345 -0.0000000), wk = 0.0027701 k( 133) = ( 0.0402299 0.0696802 -0.0000000), wk = 0.0027701 k( 134) = ( 0.0344828 0.0597259 -0.0000000), wk = 0.0027701 k( 135) = ( 0.0287356 0.0497716 -0.0000000), wk = 0.0027701 k( 136) = ( 0.0229885 0.0398173 -0.0000000), wk = 0.0027701 k( 137) = ( 0.0172414 0.0298629 -0.0000000), wk = 0.0027701 k( 138) = ( 0.0114942 0.0199086 -0.0000000), wk = 0.0027701 k( 139) = ( 0.0057471 0.0099543 -0.0000000), wk = 0.0027701 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 142) = ( 0.0000000 0.0000000 0.0114742), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0229485), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0344227), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0458970), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0573712), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.0688455), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.0803197), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.0917939), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.1032682), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.1147424), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.1262167), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.1376909), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.1491652), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.1606394), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.1721137), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.1835879), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.1950621), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.2065364), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.2180106), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.2294849), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.2409591), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.2524334), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.2639076), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.2753818), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.2868561), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.2983303), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.2983303), wk = 0.0027701 k( 169) = ( 0.0100000 0.0057735 0.2983303), wk = 0.0027701 k( 170) = ( 0.0200000 0.0115470 0.2983303), wk = 0.0027701 k( 171) = ( 0.0300000 0.0173205 0.2983303), wk = 0.0027701 k( 172) = ( 0.0400000 0.0230940 0.2983303), wk = 0.0027701 k( 173) = ( 0.0500000 0.0288675 0.2983303), wk = 0.0027701 k( 174) = ( 0.0600000 0.0346410 0.2983303), wk = 0.0027701 k( 175) = ( 0.0700000 0.0404145 0.2983303), wk = 0.0027701 k( 176) = ( 0.0800000 0.0461880 0.2983303), wk = 0.0027701 k( 177) = ( 0.0900000 0.0519615 0.2983303), wk = 0.0027701 k( 178) = ( 0.1000000 0.0577350 0.2983303), wk = 0.0027701 k( 179) = ( 0.1100000 0.0635085 0.2983303), wk = 0.0027701 k( 180) = ( 0.1200000 0.0692820 0.2983303), wk = 0.0027701 k( 181) = ( 0.1300000 0.0750555 0.2983303), wk = 0.0027701 k( 182) = ( 0.1400000 0.0808290 0.2983303), wk = 0.0027701 k( 183) = ( 0.1500000 0.0866025 0.2983303), wk = 0.0027701 k( 184) = ( 0.1600000 0.0923760 0.2983303), wk = 0.0027701 k( 185) = ( 0.1700000 0.0981495 0.2983303), wk = 0.0027701 k( 186) = ( 0.1800000 0.1039230 0.2983303), wk = 0.0027701 k( 187) = ( 0.1900000 0.1096966 0.2983303), wk = 0.0027701 k( 188) = ( 0.2000000 0.1154701 0.2983303), wk = 0.0027701 k( 189) = ( 0.2100000 0.1212436 0.2983303), wk = 0.0027701 k( 190) = ( 0.2200000 0.1270171 0.2983303), wk = 0.0027701 k( 191) = ( 0.2300000 0.1327906 0.2983303), wk = 0.0027701 k( 192) = ( 0.2400000 0.1385641 0.2983303), wk = 0.0027701 k( 193) = ( 0.2500000 0.1443376 0.2983303), wk = 0.0027701 k( 194) = ( 0.2600000 0.1501111 0.2983303), wk = 0.0027701 k( 195) = ( 0.2700000 0.1558846 0.2983303), wk = 0.0027701 k( 196) = ( 0.2800000 0.1616581 0.2983303), wk = 0.0027701 k( 197) = ( 0.2900000 0.1674316 0.2983303), wk = 0.0027701 k( 198) = ( 0.3000000 0.1732051 0.2983303), wk = 0.0027701 k( 199) = ( 0.3100000 0.1789786 0.2983303), wk = 0.0027701 k( 200) = ( 0.3200000 0.1847521 0.2983303), wk = 0.0027701 k( 201) = ( 0.3300000 0.1905256 0.2983303), wk = 0.0027701 k( 202) = ( 0.3400000 0.1962991 0.2983303), wk = 0.0027701 k( 203) = ( 0.3500000 0.2020726 0.2983303), wk = 0.0027701 k( 204) = ( 0.3600000 0.2078461 0.2983303), wk = 0.0027701 k( 205) = ( 0.3700000 0.2136196 0.2983303), wk = 0.0027701 k( 206) = ( 0.3800000 0.2193931 0.2983303), wk = 0.0027701 k( 207) = ( 0.3900000 0.2251666 0.2983303), wk = 0.0027701 k( 208) = ( 0.4000000 0.2309401 0.2983303), wk = 0.0027701 k( 209) = ( 0.4100000 0.2367136 0.2983303), wk = 0.0027701 k( 210) = ( 0.4200000 0.2424871 0.2983303), wk = 0.0027701 k( 211) = ( 0.4300000 0.2482606 0.2983303), wk = 0.0027701 k( 212) = ( 0.4400000 0.2540341 0.2983303), wk = 0.0027701 k( 213) = ( 0.4500000 0.2598076 0.2983303), wk = 0.0027701 k( 214) = ( 0.4600000 0.2655811 0.2983303), wk = 0.0027701 k( 215) = ( 0.4700000 0.2713546 0.2983303), wk = 0.0027701 k( 216) = ( 0.4800000 0.2771281 0.2983303), wk = 0.0027701 k( 217) = ( 0.4900000 0.2829016 0.2983303), wk = 0.0027701 k( 218) = ( 0.5000000 0.2886751 0.2983303), wk = 0.0027701 k( 219) = ( 0.5000000 0.2886751 0.2983303), wk = 0.0027701 k( 220) = ( 0.4942529 0.2986294 0.2983303), wk = 0.0027701 k( 221) = ( 0.4885058 0.3085838 0.2983303), wk = 0.0027701 k( 222) = ( 0.4827586 0.3185381 0.2983303), wk = 0.0027701 k( 223) = ( 0.4770115 0.3284924 0.2983303), wk = 0.0027701 k( 224) = ( 0.4712644 0.3384467 0.2983303), wk = 0.0027701 k( 225) = ( 0.4655172 0.3484010 0.2983303), wk = 0.0027701 k( 226) = ( 0.4597701 0.3583553 0.2983303), wk = 0.0027701 k( 227) = ( 0.4540230 0.3683097 0.2983303), wk = 0.0027701 k( 228) = ( 0.4482759 0.3782640 0.2983303), wk = 0.0027701 k( 229) = ( 0.4425287 0.3882183 0.2983303), wk = 0.0027701 k( 230) = ( 0.4367816 0.3981726 0.2983303), wk = 0.0027701 k( 231) = ( 0.4310345 0.4081269 0.2983303), wk = 0.0027701 k( 232) = ( 0.4252874 0.4180812 0.2983303), wk = 0.0027701 k( 233) = ( 0.4195402 0.4280355 0.2983303), wk = 0.0027701 k( 234) = ( 0.4137931 0.4379899 0.2983303), wk = 0.0027701 k( 235) = ( 0.4080460 0.4479442 0.2983303), wk = 0.0027701 k( 236) = ( 0.4022988 0.4578985 0.2983303), wk = 0.0027701 k( 237) = ( 0.3965517 0.4678528 0.2983303), wk = 0.0027701 k( 238) = ( 0.3908046 0.4778071 0.2983303), wk = 0.0027701 k( 239) = ( 0.3850575 0.4877614 0.2983303), wk = 0.0027701 k( 240) = ( 0.3793103 0.4977157 0.2983303), wk = 0.0027701 k( 241) = ( 0.3735632 0.5076701 0.2983303), wk = 0.0027701 k( 242) = ( 0.3678161 0.5176244 0.2983303), wk = 0.0027701 k( 243) = ( 0.3620690 0.5275787 0.2983303), wk = 0.0027701 k( 244) = ( 0.3563218 0.5375330 0.2983303), wk = 0.0027701 k( 245) = ( 0.3505747 0.5474873 0.2983303), wk = 0.0027701 k( 246) = ( 0.3448276 0.5574416 0.2983303), wk = 0.0027701 k( 247) = ( 0.3390805 0.5673960 0.2983303), wk = 0.0027701 k( 248) = ( 0.3333333 0.5773503 0.2983303), wk = 0.0027701 k( 249) = ( 0.3333333 0.5773503 0.2983303), wk = 0.0027701 k( 250) = ( 0.3275862 0.5673960 0.2983303), wk = 0.0027701 k( 251) = ( 0.3218391 0.5574416 0.2983303), wk = 0.0027701 k( 252) = ( 0.3160920 0.5474873 0.2983303), wk = 0.0027701 k( 253) = ( 0.3103448 0.5375330 0.2983303), wk = 0.0027701 k( 254) = ( 0.3045977 0.5275787 0.2983303), wk = 0.0027701 k( 255) = ( 0.2988506 0.5176244 0.2983303), wk = 0.0027701 k( 256) = ( 0.2931034 0.5076701 0.2983303), wk = 0.0027701 k( 257) = ( 0.2873563 0.4977157 0.2983303), wk = 0.0027701 k( 258) = ( 0.2816092 0.4877614 0.2983303), wk = 0.0027701 k( 259) = ( 0.2758621 0.4778071 0.2983303), wk = 0.0027701 k( 260) = ( 0.2701149 0.4678528 0.2983303), wk = 0.0027701 k( 261) = ( 0.2643678 0.4578985 0.2983303), wk = 0.0027701 k( 262) = ( 0.2586207 0.4479442 0.2983303), wk = 0.0027701 k( 263) = ( 0.2528736 0.4379899 0.2983303), wk = 0.0027701 k( 264) = ( 0.2471264 0.4280355 0.2983303), wk = 0.0027701 k( 265) = ( 0.2413793 0.4180812 0.2983303), wk = 0.0027701 k( 266) = ( 0.2356322 0.4081269 0.2983303), wk = 0.0027701 k( 267) = ( 0.2298851 0.3981726 0.2983303), wk = 0.0027701 k( 268) = ( 0.2241379 0.3882183 0.2983303), wk = 0.0027701 k( 269) = ( 0.2183908 0.3782640 0.2983303), wk = 0.0027701 k( 270) = ( 0.2126437 0.3683097 0.2983303), wk = 0.0027701 k( 271) = ( 0.2068966 0.3583553 0.2983303), wk = 0.0027701 k( 272) = ( 0.2011494 0.3484010 0.2983303), wk = 0.0027701 k( 273) = ( 0.1954023 0.3384467 0.2983303), wk = 0.0027701 k( 274) = ( 0.1896552 0.3284924 0.2983303), wk = 0.0027701 k( 275) = ( 0.1839080 0.3185381 0.2983303), wk = 0.0027701 k( 276) = ( 0.1781609 0.3085838 0.2983303), wk = 0.0027701 k( 277) = ( 0.1724138 0.2986294 0.2983303), wk = 0.0027701 k( 278) = ( 0.1666667 0.2886751 0.2983303), wk = 0.0027701 k( 279) = ( 0.1609195 0.2787208 0.2983303), wk = 0.0027701 k( 280) = ( 0.1551724 0.2687665 0.2983303), wk = 0.0027701 k( 281) = ( 0.1494253 0.2588122 0.2983303), wk = 0.0027701 k( 282) = ( 0.1436782 0.2488579 0.2983303), wk = 0.0027701 k( 283) = ( 0.1379310 0.2389036 0.2983303), wk = 0.0027701 k( 284) = ( 0.1321839 0.2289492 0.2983303), wk = 0.0027701 k( 285) = ( 0.1264368 0.2189949 0.2983303), wk = 0.0027701 k( 286) = ( 0.1206897 0.2090406 0.2983303), wk = 0.0027701 k( 287) = ( 0.1149425 0.1990863 0.2983303), wk = 0.0027701 k( 288) = ( 0.1091954 0.1891320 0.2983303), wk = 0.0027701 k( 289) = ( 0.1034483 0.1791777 0.2983303), wk = 0.0027701 k( 290) = ( 0.0977012 0.1692234 0.2983303), wk = 0.0027701 k( 291) = ( 0.0919540 0.1592690 0.2983303), wk = 0.0027701 k( 292) = ( 0.0862069 0.1493147 0.2983303), wk = 0.0027701 k( 293) = ( 0.0804598 0.1393604 0.2983303), wk = 0.0027701 k( 294) = ( 0.0747126 0.1294061 0.2983303), wk = 0.0027701 k( 295) = ( 0.0689655 0.1194518 0.2983303), wk = 0.0027701 k( 296) = ( 0.0632184 0.1094975 0.2983303), wk = 0.0027701 k( 297) = ( 0.0574713 0.0995431 0.2983303), wk = 0.0027701 k( 298) = ( 0.0517241 0.0895888 0.2983303), wk = 0.0027701 k( 299) = ( 0.0459770 0.0796345 0.2983303), wk = 0.0027701 k( 300) = ( 0.0402299 0.0696802 0.2983303), wk = 0.0027701 k( 301) = ( 0.0344828 0.0597259 0.2983303), wk = 0.0027701 k( 302) = ( 0.0287356 0.0497716 0.2983303), wk = 0.0027701 k( 303) = ( 0.0229885 0.0398173 0.2983303), wk = 0.0027701 k( 304) = ( 0.0172414 0.0298629 0.2983303), wk = 0.0027701 k( 305) = ( 0.0114942 0.0199086 0.2983303), wk = 0.0027701 k( 306) = ( 0.0057471 0.0099543 0.2983303), wk = 0.0027701 k( 307) = ( 0.0000000 0.0000000 0.2983303), wk = 0.0027701 k( 308) = ( 0.5000000 0.2886751 0.2983303), wk = 0.0027701 k( 309) = ( 0.5000000 0.2886751 0.2868561), wk = 0.0027701 k( 310) = ( 0.5000000 0.2886751 0.2753818), wk = 0.0027701 k( 311) = ( 0.5000000 0.2886751 0.2639076), wk = 0.0027701 k( 312) = ( 0.5000000 0.2886751 0.2524334), wk = 0.0027701 k( 313) = ( 0.5000000 0.2886751 0.2409591), wk = 0.0027701 k( 314) = ( 0.5000000 0.2886751 0.2294849), wk = 0.0027701 k( 315) = ( 0.5000000 0.2886751 0.2180106), wk = 0.0027701 k( 316) = ( 0.5000000 0.2886751 0.2065364), wk = 0.0027701 k( 317) = ( 0.5000000 0.2886751 0.1950621), wk = 0.0027701 k( 318) = ( 0.5000000 0.2886751 0.1835879), wk = 0.0027701 k( 319) = ( 0.5000000 0.2886751 0.1721137), wk = 0.0027701 k( 320) = ( 0.5000000 0.2886751 0.1606394), wk = 0.0027701 k( 321) = ( 0.5000000 0.2886751 0.1491652), wk = 0.0027701 k( 322) = ( 0.5000000 0.2886751 0.1376909), wk = 0.0027701 k( 323) = ( 0.5000000 0.2886751 0.1262167), wk = 0.0027701 k( 324) = ( 0.5000000 0.2886751 0.1147424), wk = 0.0027701 k( 325) = ( 0.5000000 0.2886751 0.1032682), wk = 0.0027701 k( 326) = ( 0.5000000 0.2886751 0.0917939), wk = 0.0027701 k( 327) = ( 0.5000000 0.2886751 0.0803197), wk = 0.0027701 k( 328) = ( 0.5000000 0.2886751 0.0688455), wk = 0.0027701 k( 329) = ( 0.5000000 0.2886751 0.0573712), wk = 0.0027701 k( 330) = ( 0.5000000 0.2886751 0.0458970), wk = 0.0027701 k( 331) = ( 0.5000000 0.2886751 0.0344227), wk = 0.0027701 k( 332) = ( 0.5000000 0.2886751 0.0229485), wk = 0.0027701 k( 333) = ( 0.5000000 0.2886751 0.0114742), wk = 0.0027701 k( 334) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0027701 k( 335) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0027701 k( 336) = ( 0.3333333 0.5773503 0.0114742), wk = 0.0027701 k( 337) = ( 0.3333333 0.5773503 0.0229485), wk = 0.0027701 k( 338) = ( 0.3333333 0.5773503 0.0344227), wk = 0.0027701 k( 339) = ( 0.3333333 0.5773503 0.0458970), wk = 0.0027701 k( 340) = ( 0.3333333 0.5773503 0.0573712), wk = 0.0027701 k( 341) = ( 0.3333333 0.5773503 0.0688455), wk = 0.0027701 k( 342) = ( 0.3333333 0.5773503 0.0803197), wk = 0.0027701 k( 343) = ( 0.3333333 0.5773503 0.0917939), wk = 0.0027701 k( 344) = ( 0.3333333 0.5773503 0.1032682), wk = 0.0027701 k( 345) = ( 0.3333333 0.5773503 0.1147424), wk = 0.0027701 k( 346) = ( 0.3333333 0.5773503 0.1262167), wk = 0.0027701 k( 347) = ( 0.3333333 0.5773503 0.1376909), wk = 0.0027701 k( 348) = ( 0.3333333 0.5773503 0.1491652), wk = 0.0027701 k( 349) = ( 0.3333333 0.5773503 0.1606394), wk = 0.0027701 k( 350) = ( 0.3333333 0.5773503 0.1721137), wk = 0.0027701 k( 351) = ( 0.3333333 0.5773503 0.1835879), wk = 0.0027701 k( 352) = ( 0.3333333 0.5773503 0.1950621), wk = 0.0027701 k( 353) = ( 0.3333333 0.5773503 0.2065364), wk = 0.0027701 k( 354) = ( 0.3333333 0.5773503 0.2180106), wk = 0.0027701 k( 355) = ( 0.3333333 0.5773503 0.2294849), wk = 0.0027701 k( 356) = ( 0.3333333 0.5773503 0.2409591), wk = 0.0027701 k( 357) = ( 0.3333333 0.5773503 0.2524334), wk = 0.0027701 k( 358) = ( 0.3333333 0.5773503 0.2639076), wk = 0.0027701 k( 359) = ( 0.3333333 0.5773503 0.2753818), wk = 0.0027701 k( 360) = ( 0.3333333 0.5773503 0.2868561), wk = 0.0027701 k( 361) = ( 0.3333333 0.5773503 0.2983303), wk = 0.0027701 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 2) = ( 0.0100000 0.0000000 0.0000000), wk = 0.0027701 k( 3) = ( 0.0200000 0.0000000 0.0000000), wk = 0.0027701 k( 4) = ( 0.0300000 0.0000000 0.0000000), wk = 0.0027701 k( 5) = ( 0.0400000 0.0000000 0.0000000), wk = 0.0027701 k( 6) = ( 0.0500000 -0.0000000 -0.0000000), wk = 0.0027701 k( 7) = ( 0.0600000 0.0000000 0.0000000), wk = 0.0027701 k( 8) = ( 0.0700000 0.0000000 0.0000000), wk = 0.0027701 k( 9) = ( 0.0800000 0.0000000 0.0000000), wk = 0.0027701 k( 10) = ( 0.0900000 -0.0000000 -0.0000000), wk = 0.0027701 k( 11) = ( 0.1000000 -0.0000000 -0.0000000), wk = 0.0027701 k( 12) = ( 0.1100000 -0.0000000 0.0000000), wk = 0.0027701 k( 13) = ( 0.1200000 0.0000000 0.0000000), wk = 0.0027701 k( 14) = ( 0.1300000 -0.0000000 -0.0000000), wk = 0.0027701 k( 15) = ( 0.1400000 0.0000000 0.0000000), wk = 0.0027701 k( 16) = ( 0.1500000 0.0000000 0.0000000), wk = 0.0027701 k( 17) = ( 0.1600000 0.0000000 0.0000000), wk = 0.0027701 k( 18) = ( 0.1700000 0.0000000 0.0000000), wk = 0.0027701 k( 19) = ( 0.1800000 -0.0000000 -0.0000000), wk = 0.0027701 k( 20) = ( 0.1900000 -0.0000000 -0.0000000), wk = 0.0027701 k( 21) = ( 0.2000000 -0.0000000 -0.0000000), wk = 0.0027701 k( 22) = ( 0.2100000 -0.0000000 0.0000000), wk = 0.0027701 k( 23) = ( 0.2200000 -0.0000000 0.0000000), wk = 0.0027701 k( 24) = ( 0.2300000 -0.0000000 0.0000000), wk = 0.0027701 k( 25) = ( 0.2400000 0.0000000 0.0000000), wk = 0.0027701 k( 26) = ( 0.2500000 0.0000000 0.0000000), wk = 0.0027701 k( 27) = ( 0.2600000 -0.0000000 -0.0000000), wk = 0.0027701 k( 28) = ( 0.2700000 0.0000000 0.0000000), wk = 0.0027701 k( 29) = ( 0.2800000 0.0000000 0.0000000), wk = 0.0027701 k( 30) = ( 0.2900000 0.0000000 0.0000000), wk = 0.0027701 k( 31) = ( 0.3000000 0.0000000 0.0000000), wk = 0.0027701 k( 32) = ( 0.3100000 -0.0000000 -0.0000000), wk = 0.0027701 k( 33) = ( 0.3200000 0.0000000 0.0000000), wk = 0.0027701 k( 34) = ( 0.3300000 -0.0000000 0.0000000), wk = 0.0027701 k( 35) = ( 0.3400000 0.0000000 0.0000000), wk = 0.0027701 k( 36) = ( 0.3500000 0.0000000 0.0000000), wk = 0.0027701 k( 37) = ( 0.3600000 -0.0000000 -0.0000000), wk = 0.0027701 k( 38) = ( 0.3700000 0.0000000 0.0000000), wk = 0.0027701 k( 39) = ( 0.3800000 -0.0000000 -0.0000000), wk = 0.0027701 k( 40) = ( 0.3900000 0.0000000 0.0000000), wk = 0.0027701 k( 41) = ( 0.4000000 -0.0000000 -0.0000000), wk = 0.0027701 k( 42) = ( 0.4100000 -0.0000000 0.0000000), wk = 0.0027701 k( 43) = ( 0.4200000 -0.0000000 0.0000000), wk = 0.0027701 k( 44) = ( 0.4300000 -0.0000000 -0.0000000), wk = 0.0027701 k( 45) = ( 0.4400000 -0.0000000 0.0000000), wk = 0.0027701 k( 46) = ( 0.4500000 0.0000000 0.0000000), wk = 0.0027701 k( 47) = ( 0.4600000 -0.0000000 0.0000000), wk = 0.0027701 k( 48) = ( 0.4700000 -0.0000000 0.0000000), wk = 0.0027701 k( 49) = ( 0.4800000 0.0000000 0.0000000), wk = 0.0027701 k( 50) = ( 0.4900000 -0.0000000 0.0000000), wk = 0.0027701 k( 51) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027701 k( 52) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027701 k( 53) = ( 0.4942529 0.0114943 0.0000000), wk = 0.0027701 k( 54) = ( 0.4885058 0.0229885 -0.0000000), wk = 0.0027701 k( 55) = ( 0.4827586 0.0344828 0.0000000), wk = 0.0027701 k( 56) = ( 0.4770115 0.0459770 0.0000000), wk = 0.0027701 k( 57) = ( 0.4712644 0.0574713 0.0000000), wk = 0.0027701 k( 58) = ( 0.4655172 0.0689655 0.0000000), wk = 0.0027701 k( 59) = ( 0.4597701 0.0804598 -0.0000000), wk = 0.0027701 k( 60) = ( 0.4540230 0.0919540 0.0000000), wk = 0.0027701 k( 61) = ( 0.4482759 0.1034483 0.0000000), wk = 0.0027701 k( 62) = ( 0.4425287 0.1149425 0.0000000), wk = 0.0027701 k( 63) = ( 0.4367816 0.1264368 0.0000000), wk = 0.0027701 k( 64) = ( 0.4310345 0.1379310 0.0000000), wk = 0.0027701 k( 65) = ( 0.4252874 0.1494253 -0.0000000), wk = 0.0027701 k( 66) = ( 0.4195402 0.1609195 0.0000000), wk = 0.0027701 k( 67) = ( 0.4137931 0.1724138 0.0000000), wk = 0.0027701 k( 68) = ( 0.4080460 0.1839080 -0.0000000), wk = 0.0027701 k( 69) = ( 0.4022988 0.1954023 0.0000000), wk = 0.0027701 k( 70) = ( 0.3965517 0.2068965 -0.0000000), wk = 0.0027701 k( 71) = ( 0.3908046 0.2183908 0.0000000), wk = 0.0027701 k( 72) = ( 0.3850575 0.2298851 0.0000000), wk = 0.0027701 k( 73) = ( 0.3793103 0.2413793 0.0000000), wk = 0.0027701 k( 74) = ( 0.3735632 0.2528736 0.0000000), wk = 0.0027701 k( 75) = ( 0.3678161 0.2643678 -0.0000000), wk = 0.0027701 k( 76) = ( 0.3620690 0.2758621 0.0000000), wk = 0.0027701 k( 77) = ( 0.3563218 0.2873563 -0.0000000), wk = 0.0027701 k( 78) = ( 0.3505747 0.2988506 0.0000000), wk = 0.0027701 k( 79) = ( 0.3448276 0.3103448 0.0000000), wk = 0.0027701 k( 80) = ( 0.3390805 0.3218391 0.0000000), wk = 0.0027701 k( 81) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027701 k( 82) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027701 k( 83) = ( 0.3275862 0.3275862 -0.0000000), wk = 0.0027701 k( 84) = ( 0.3218391 0.3218391 0.0000000), wk = 0.0027701 k( 85) = ( 0.3160920 0.3160920 0.0000000), wk = 0.0027701 k( 86) = ( 0.3103448 0.3103448 0.0000000), wk = 0.0027701 k( 87) = ( 0.3045977 0.3045977 0.0000000), wk = 0.0027701 k( 88) = ( 0.2988506 0.2988506 0.0000000), wk = 0.0027701 k( 89) = ( 0.2931034 0.2931034 -0.0000000), wk = 0.0027701 k( 90) = ( 0.2873563 0.2873563 0.0000000), wk = 0.0027701 k( 91) = ( 0.2816092 0.2816092 0.0000000), wk = 0.0027701 k( 92) = ( 0.2758621 0.2758621 -0.0000000), wk = 0.0027701 k( 93) = ( 0.2701149 0.2701149 0.0000000), wk = 0.0027701 k( 94) = ( 0.2643678 0.2643678 0.0000000), wk = 0.0027701 k( 95) = ( 0.2586207 0.2586207 0.0000000), wk = 0.0027701 k( 96) = ( 0.2528736 0.2528736 0.0000000), wk = 0.0027701 k( 97) = ( 0.2471264 0.2471264 0.0000000), wk = 0.0027701 k( 98) = ( 0.2413793 0.2413793 -0.0000000), wk = 0.0027701 k( 99) = ( 0.2356322 0.2356322 -0.0000000), wk = 0.0027701 k( 100) = ( 0.2298851 0.2298851 0.0000000), wk = 0.0027701 k( 101) = ( 0.2241379 0.2241379 -0.0000000), wk = 0.0027701 k( 102) = ( 0.2183908 0.2183908 -0.0000000), wk = 0.0027701 k( 103) = ( 0.2126437 0.2126437 0.0000000), wk = 0.0027701 k( 104) = ( 0.2068966 0.2068966 0.0000000), wk = 0.0027701 k( 105) = ( 0.2011494 0.2011494 0.0000000), wk = 0.0027701 k( 106) = ( 0.1954023 0.1954023 0.0000000), wk = 0.0027701 k( 107) = ( 0.1896552 0.1896552 -0.0000000), wk = 0.0027701 k( 108) = ( 0.1839080 0.1839080 -0.0000000), wk = 0.0027701 k( 109) = ( 0.1781609 0.1781609 0.0000000), wk = 0.0027701 k( 110) = ( 0.1724138 0.1724138 0.0000000), wk = 0.0027701 k( 111) = ( 0.1666667 0.1666667 0.0000000), wk = 0.0027701 k( 112) = ( 0.1609195 0.1609195 0.0000000), wk = 0.0027701 k( 113) = ( 0.1551724 0.1551724 0.0000000), wk = 0.0027701 k( 114) = ( 0.1494253 0.1494253 0.0000000), wk = 0.0027701 k( 115) = ( 0.1436782 0.1436782 0.0000000), wk = 0.0027701 k( 116) = ( 0.1379310 0.1379310 0.0000000), wk = 0.0027701 k( 117) = ( 0.1321839 0.1321839 0.0000000), wk = 0.0027701 k( 118) = ( 0.1264368 0.1264368 0.0000000), wk = 0.0027701 k( 119) = ( 0.1206897 0.1206897 0.0000000), wk = 0.0027701 k( 120) = ( 0.1149425 0.1149425 0.0000000), wk = 0.0027701 k( 121) = ( 0.1091954 0.1091954 -0.0000000), wk = 0.0027701 k( 122) = ( 0.1034483 0.1034483 0.0000000), wk = 0.0027701 k( 123) = ( 0.0977012 0.0977011 0.0000000), wk = 0.0027701 k( 124) = ( 0.0919540 0.0919540 0.0000000), wk = 0.0027701 k( 125) = ( 0.0862069 0.0862069 0.0000000), wk = 0.0027701 k( 126) = ( 0.0804598 0.0804598 0.0000000), wk = 0.0027701 k( 127) = ( 0.0747126 0.0747126 0.0000000), wk = 0.0027701 k( 128) = ( 0.0689655 0.0689655 0.0000000), wk = 0.0027701 k( 129) = ( 0.0632184 0.0632184 0.0000000), wk = 0.0027701 k( 130) = ( 0.0574713 0.0574713 -0.0000000), wk = 0.0027701 k( 131) = ( 0.0517241 0.0517241 0.0000000), wk = 0.0027701 k( 132) = ( 0.0459770 0.0459770 0.0000000), wk = 0.0027701 k( 133) = ( 0.0402299 0.0402299 0.0000000), wk = 0.0027701 k( 134) = ( 0.0344828 0.0344828 0.0000000), wk = 0.0027701 k( 135) = ( 0.0287356 0.0287356 -0.0000000), wk = 0.0027701 k( 136) = ( 0.0229885 0.0229885 0.0000000), wk = 0.0027701 k( 137) = ( 0.0172414 0.0172414 0.0000000), wk = 0.0027701 k( 138) = ( 0.0114942 0.0114943 0.0000000), wk = 0.0027701 k( 139) = ( 0.0057471 0.0057471 0.0000000), wk = 0.0027701 k( 140) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 141) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027701 k( 142) = ( 0.0000000 0.0000000 0.0192308), wk = 0.0027701 k( 143) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0027701 k( 144) = ( 0.0000000 0.0000000 0.0576923), wk = 0.0027701 k( 145) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0027701 k( 146) = ( 0.0000000 0.0000000 0.0961538), wk = 0.0027701 k( 147) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0027701 k( 148) = ( 0.0000000 0.0000000 0.1346154), wk = 0.0027701 k( 149) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0027701 k( 150) = ( 0.0000000 0.0000000 0.1730769), wk = 0.0027701 k( 151) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0027701 k( 152) = ( 0.0000000 0.0000000 0.2115385), wk = 0.0027701 k( 153) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0027701 k( 154) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027701 k( 155) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0027701 k( 156) = ( 0.0000000 0.0000000 0.2884615), wk = 0.0027701 k( 157) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0027701 k( 158) = ( 0.0000000 0.0000000 0.3269231), wk = 0.0027701 k( 159) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0027701 k( 160) = ( 0.0000000 0.0000000 0.3653846), wk = 0.0027701 k( 161) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0027701 k( 162) = ( 0.0000000 0.0000000 0.4038462), wk = 0.0027701 k( 163) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0027701 k( 164) = ( 0.0000000 0.0000000 0.4423077), wk = 0.0027701 k( 165) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0027701 k( 166) = ( 0.0000000 0.0000000 0.4807692), wk = 0.0027701 k( 167) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 168) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 169) = ( 0.0100000 0.0000000 0.5000000), wk = 0.0027701 k( 170) = ( 0.0200000 0.0000000 0.5000000), wk = 0.0027701 k( 171) = ( 0.0300000 0.0000000 0.5000000), wk = 0.0027701 k( 172) = ( 0.0400000 0.0000000 0.5000000), wk = 0.0027701 k( 173) = ( 0.0500000 -0.0000000 0.5000000), wk = 0.0027701 k( 174) = ( 0.0600000 0.0000000 0.5000000), wk = 0.0027701 k( 175) = ( 0.0700000 0.0000000 0.5000000), wk = 0.0027701 k( 176) = ( 0.0800000 0.0000000 0.5000000), wk = 0.0027701 k( 177) = ( 0.0900000 -0.0000000 0.5000000), wk = 0.0027701 k( 178) = ( 0.1000000 -0.0000000 0.5000000), wk = 0.0027701 k( 179) = ( 0.1100000 -0.0000000 0.5000000), wk = 0.0027701 k( 180) = ( 0.1200000 0.0000000 0.5000000), wk = 0.0027701 k( 181) = ( 0.1300000 -0.0000000 0.5000000), wk = 0.0027701 k( 182) = ( 0.1400000 0.0000000 0.5000000), wk = 0.0027701 k( 183) = ( 0.1500000 0.0000000 0.5000000), wk = 0.0027701 k( 184) = ( 0.1600000 0.0000000 0.5000000), wk = 0.0027701 k( 185) = ( 0.1700000 0.0000000 0.5000000), wk = 0.0027701 k( 186) = ( 0.1800000 -0.0000000 0.5000000), wk = 0.0027701 k( 187) = ( 0.1900000 -0.0000000 0.5000000), wk = 0.0027701 k( 188) = ( 0.2000000 -0.0000000 0.5000000), wk = 0.0027701 k( 189) = ( 0.2100000 -0.0000000 0.5000000), wk = 0.0027701 k( 190) = ( 0.2200000 -0.0000000 0.5000000), wk = 0.0027701 k( 191) = ( 0.2300000 -0.0000000 0.5000000), wk = 0.0027701 k( 192) = ( 0.2400000 0.0000000 0.5000000), wk = 0.0027701 k( 193) = ( 0.2500000 0.0000000 0.5000000), wk = 0.0027701 k( 194) = ( 0.2600000 -0.0000000 0.5000000), wk = 0.0027701 k( 195) = ( 0.2700000 0.0000000 0.5000000), wk = 0.0027701 k( 196) = ( 0.2800000 0.0000000 0.5000000), wk = 0.0027701 k( 197) = ( 0.2900000 0.0000000 0.5000000), wk = 0.0027701 k( 198) = ( 0.3000000 0.0000000 0.5000000), wk = 0.0027701 k( 199) = ( 0.3100000 -0.0000000 0.5000000), wk = 0.0027701 k( 200) = ( 0.3200000 0.0000000 0.5000000), wk = 0.0027701 k( 201) = ( 0.3300000 -0.0000000 0.5000000), wk = 0.0027701 k( 202) = ( 0.3400000 0.0000000 0.5000000), wk = 0.0027701 k( 203) = ( 0.3500000 0.0000000 0.5000000), wk = 0.0027701 k( 204) = ( 0.3600000 -0.0000000 0.5000000), wk = 0.0027701 k( 205) = ( 0.3700000 0.0000000 0.5000000), wk = 0.0027701 k( 206) = ( 0.3800000 -0.0000000 0.5000000), wk = 0.0027701 k( 207) = ( 0.3900000 0.0000000 0.5000000), wk = 0.0027701 k( 208) = ( 0.4000000 -0.0000000 0.5000000), wk = 0.0027701 k( 209) = ( 0.4100000 -0.0000000 0.5000000), wk = 0.0027701 k( 210) = ( 0.4200000 -0.0000000 0.5000000), wk = 0.0027701 k( 211) = ( 0.4300000 -0.0000000 0.5000000), wk = 0.0027701 k( 212) = ( 0.4400000 -0.0000000 0.5000000), wk = 0.0027701 k( 213) = ( 0.4500000 0.0000000 0.5000000), wk = 0.0027701 k( 214) = ( 0.4600000 -0.0000000 0.5000000), wk = 0.0027701 k( 215) = ( 0.4700000 -0.0000000 0.5000000), wk = 0.0027701 k( 216) = ( 0.4800000 0.0000000 0.5000000), wk = 0.0027701 k( 217) = ( 0.4900000 -0.0000000 0.5000000), wk = 0.0027701 k( 218) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027701 k( 219) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027701 k( 220) = ( 0.4942529 0.0114943 0.5000000), wk = 0.0027701 k( 221) = ( 0.4885058 0.0229885 0.5000000), wk = 0.0027701 k( 222) = ( 0.4827586 0.0344828 0.5000000), wk = 0.0027701 k( 223) = ( 0.4770115 0.0459770 0.5000000), wk = 0.0027701 k( 224) = ( 0.4712644 0.0574713 0.5000000), wk = 0.0027701 k( 225) = ( 0.4655172 0.0689655 0.5000000), wk = 0.0027701 k( 226) = ( 0.4597701 0.0804598 0.5000000), wk = 0.0027701 k( 227) = ( 0.4540230 0.0919540 0.5000000), wk = 0.0027701 k( 228) = ( 0.4482759 0.1034483 0.5000000), wk = 0.0027701 k( 229) = ( 0.4425287 0.1149425 0.5000000), wk = 0.0027701 k( 230) = ( 0.4367816 0.1264368 0.5000000), wk = 0.0027701 k( 231) = ( 0.4310345 0.1379310 0.5000000), wk = 0.0027701 k( 232) = ( 0.4252874 0.1494253 0.5000000), wk = 0.0027701 k( 233) = ( 0.4195402 0.1609195 0.5000000), wk = 0.0027701 k( 234) = ( 0.4137931 0.1724138 0.5000000), wk = 0.0027701 k( 235) = ( 0.4080460 0.1839080 0.5000000), wk = 0.0027701 k( 236) = ( 0.4022988 0.1954023 0.5000000), wk = 0.0027701 k( 237) = ( 0.3965517 0.2068965 0.5000000), wk = 0.0027701 k( 238) = ( 0.3908046 0.2183908 0.5000000), wk = 0.0027701 k( 239) = ( 0.3850575 0.2298851 0.5000000), wk = 0.0027701 k( 240) = ( 0.3793103 0.2413793 0.5000000), wk = 0.0027701 k( 241) = ( 0.3735632 0.2528736 0.5000000), wk = 0.0027701 k( 242) = ( 0.3678161 0.2643678 0.5000000), wk = 0.0027701 k( 243) = ( 0.3620690 0.2758621 0.5000000), wk = 0.0027701 k( 244) = ( 0.3563218 0.2873563 0.5000000), wk = 0.0027701 k( 245) = ( 0.3505747 0.2988506 0.5000000), wk = 0.0027701 k( 246) = ( 0.3448276 0.3103448 0.5000000), wk = 0.0027701 k( 247) = ( 0.3390805 0.3218391 0.5000000), wk = 0.0027701 k( 248) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027701 k( 249) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027701 k( 250) = ( 0.3275862 0.3275862 0.5000000), wk = 0.0027701 k( 251) = ( 0.3218391 0.3218391 0.5000000), wk = 0.0027701 k( 252) = ( 0.3160920 0.3160920 0.5000000), wk = 0.0027701 k( 253) = ( 0.3103448 0.3103448 0.5000000), wk = 0.0027701 k( 254) = ( 0.3045977 0.3045977 0.5000000), wk = 0.0027701 k( 255) = ( 0.2988506 0.2988506 0.5000000), wk = 0.0027701 k( 256) = ( 0.2931034 0.2931034 0.5000000), wk = 0.0027701 k( 257) = ( 0.2873563 0.2873563 0.5000000), wk = 0.0027701 k( 258) = ( 0.2816092 0.2816092 0.5000000), wk = 0.0027701 k( 259) = ( 0.2758621 0.2758621 0.5000000), wk = 0.0027701 k( 260) = ( 0.2701149 0.2701149 0.5000000), wk = 0.0027701 k( 261) = ( 0.2643678 0.2643678 0.5000000), wk = 0.0027701 k( 262) = ( 0.2586207 0.2586207 0.5000000), wk = 0.0027701 k( 263) = ( 0.2528736 0.2528736 0.5000000), wk = 0.0027701 k( 264) = ( 0.2471264 0.2471264 0.5000000), wk = 0.0027701 k( 265) = ( 0.2413793 0.2413793 0.5000000), wk = 0.0027701 k( 266) = ( 0.2356322 0.2356322 0.5000000), wk = 0.0027701 k( 267) = ( 0.2298851 0.2298851 0.5000000), wk = 0.0027701 k( 268) = ( 0.2241379 0.2241379 0.5000000), wk = 0.0027701 k( 269) = ( 0.2183908 0.2183908 0.5000000), wk = 0.0027701 k( 270) = ( 0.2126437 0.2126437 0.5000000), wk = 0.0027701 k( 271) = ( 0.2068966 0.2068966 0.5000000), wk = 0.0027701 k( 272) = ( 0.2011494 0.2011494 0.5000000), wk = 0.0027701 k( 273) = ( 0.1954023 0.1954023 0.5000000), wk = 0.0027701 k( 274) = ( 0.1896552 0.1896552 0.5000000), wk = 0.0027701 k( 275) = ( 0.1839080 0.1839080 0.5000000), wk = 0.0027701 k( 276) = ( 0.1781609 0.1781609 0.5000000), wk = 0.0027701 k( 277) = ( 0.1724138 0.1724138 0.5000000), wk = 0.0027701 k( 278) = ( 0.1666667 0.1666667 0.5000000), wk = 0.0027701 k( 279) = ( 0.1609195 0.1609195 0.5000000), wk = 0.0027701 k( 280) = ( 0.1551724 0.1551724 0.5000000), wk = 0.0027701 k( 281) = ( 0.1494253 0.1494253 0.5000000), wk = 0.0027701 k( 282) = ( 0.1436782 0.1436782 0.5000000), wk = 0.0027701 k( 283) = ( 0.1379310 0.1379310 0.5000000), wk = 0.0027701 k( 284) = ( 0.1321839 0.1321839 0.5000000), wk = 0.0027701 k( 285) = ( 0.1264368 0.1264368 0.5000000), wk = 0.0027701 k( 286) = ( 0.1206897 0.1206897 0.5000000), wk = 0.0027701 k( 287) = ( 0.1149425 0.1149425 0.5000000), wk = 0.0027701 k( 288) = ( 0.1091954 0.1091954 0.5000000), wk = 0.0027701 k( 289) = ( 0.1034483 0.1034483 0.5000000), wk = 0.0027701 k( 290) = ( 0.0977012 0.0977011 0.5000000), wk = 0.0027701 k( 291) = ( 0.0919540 0.0919540 0.5000000), wk = 0.0027701 k( 292) = ( 0.0862069 0.0862069 0.5000000), wk = 0.0027701 k( 293) = ( 0.0804598 0.0804598 0.5000000), wk = 0.0027701 k( 294) = ( 0.0747126 0.0747126 0.5000000), wk = 0.0027701 k( 295) = ( 0.0689655 0.0689655 0.5000000), wk = 0.0027701 k( 296) = ( 0.0632184 0.0632184 0.5000000), wk = 0.0027701 k( 297) = ( 0.0574713 0.0574713 0.5000000), wk = 0.0027701 k( 298) = ( 0.0517241 0.0517241 0.5000000), wk = 0.0027701 k( 299) = ( 0.0459770 0.0459770 0.5000000), wk = 0.0027701 k( 300) = ( 0.0402299 0.0402299 0.5000000), wk = 0.0027701 k( 301) = ( 0.0344828 0.0344828 0.5000000), wk = 0.0027701 k( 302) = ( 0.0287356 0.0287356 0.5000000), wk = 0.0027701 k( 303) = ( 0.0229885 0.0229885 0.5000000), wk = 0.0027701 k( 304) = ( 0.0172414 0.0172414 0.5000000), wk = 0.0027701 k( 305) = ( 0.0114942 0.0114943 0.5000000), wk = 0.0027701 k( 306) = ( 0.0057471 0.0057471 0.5000000), wk = 0.0027701 k( 307) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027701 k( 308) = ( 0.5000000 0.0000000 0.5000000), wk = 0.0027701 k( 309) = ( 0.5000000 0.0000000 0.4807692), wk = 0.0027701 k( 310) = ( 0.5000000 0.0000000 0.4615385), wk = 0.0027701 k( 311) = ( 0.5000000 0.0000000 0.4423077), wk = 0.0027701 k( 312) = ( 0.5000000 0.0000000 0.4230769), wk = 0.0027701 k( 313) = ( 0.5000000 0.0000000 0.4038462), wk = 0.0027701 k( 314) = ( 0.5000000 0.0000000 0.3846154), wk = 0.0027701 k( 315) = ( 0.5000000 0.0000000 0.3653846), wk = 0.0027701 k( 316) = ( 0.5000000 0.0000000 0.3461538), wk = 0.0027701 k( 317) = ( 0.5000000 0.0000000 0.3269231), wk = 0.0027701 k( 318) = ( 0.5000000 0.0000000 0.3076923), wk = 0.0027701 k( 319) = ( 0.5000000 0.0000000 0.2884615), wk = 0.0027701 k( 320) = ( 0.5000000 0.0000000 0.2692308), wk = 0.0027701 k( 321) = ( 0.5000000 0.0000000 0.2500000), wk = 0.0027701 k( 322) = ( 0.5000000 0.0000000 0.2307692), wk = 0.0027701 k( 323) = ( 0.5000000 0.0000000 0.2115385), wk = 0.0027701 k( 324) = ( 0.5000000 0.0000000 0.1923077), wk = 0.0027701 k( 325) = ( 0.5000000 0.0000000 0.1730769), wk = 0.0027701 k( 326) = ( 0.5000000 0.0000000 0.1538461), wk = 0.0027701 k( 327) = ( 0.5000000 0.0000000 0.1346154), wk = 0.0027701 k( 328) = ( 0.5000000 0.0000000 0.1153846), wk = 0.0027701 k( 329) = ( 0.5000000 0.0000000 0.0961538), wk = 0.0027701 k( 330) = ( 0.5000000 0.0000000 0.0769231), wk = 0.0027701 k( 331) = ( 0.5000000 0.0000000 0.0576923), wk = 0.0027701 k( 332) = ( 0.5000000 0.0000000 0.0384615), wk = 0.0027701 k( 333) = ( 0.5000000 0.0000000 0.0192308), wk = 0.0027701 k( 334) = ( 0.5000000 0.0000000 0.0000000), wk = 0.0027701 k( 335) = ( 0.3333333 0.3333333 -0.0000000), wk = 0.0027701 k( 336) = ( 0.3333333 0.3333333 0.0192308), wk = 0.0027701 k( 337) = ( 0.3333333 0.3333333 0.0384615), wk = 0.0027701 k( 338) = ( 0.3333333 0.3333333 0.0576923), wk = 0.0027701 k( 339) = ( 0.3333333 0.3333333 0.0769231), wk = 0.0027701 k( 340) = ( 0.3333333 0.3333333 0.0961538), wk = 0.0027701 k( 341) = ( 0.3333333 0.3333333 0.1153846), wk = 0.0027701 k( 342) = ( 0.3333333 0.3333333 0.1346154), wk = 0.0027701 k( 343) = ( 0.3333333 0.3333333 0.1538461), wk = 0.0027701 k( 344) = ( 0.3333333 0.3333333 0.1730769), wk = 0.0027701 k( 345) = ( 0.3333333 0.3333333 0.1923077), wk = 0.0027701 k( 346) = ( 0.3333333 0.3333333 0.2115385), wk = 0.0027701 k( 347) = ( 0.3333333 0.3333333 0.2307692), wk = 0.0027701 k( 348) = ( 0.3333333 0.3333333 0.2500000), wk = 0.0027701 k( 349) = ( 0.3333333 0.3333333 0.2692308), wk = 0.0027701 k( 350) = ( 0.3333333 0.3333333 0.2884615), wk = 0.0027701 k( 351) = ( 0.3333333 0.3333333 0.3076923), wk = 0.0027701 k( 352) = ( 0.3333333 0.3333333 0.3269231), wk = 0.0027701 k( 353) = ( 0.3333333 0.3333333 0.3461538), wk = 0.0027701 k( 354) = ( 0.3333333 0.3333333 0.3653846), wk = 0.0027701 k( 355) = ( 0.3333333 0.3333333 0.3846154), wk = 0.0027701 k( 356) = ( 0.3333333 0.3333333 0.4038462), wk = 0.0027701 k( 357) = ( 0.3333333 0.3333333 0.4230769), wk = 0.0027701 k( 358) = ( 0.3333333 0.3333333 0.4423077), wk = 0.0027701 k( 359) = ( 0.3333333 0.3333333 0.4615385), wk = 0.0027701 k( 360) = ( 0.3333333 0.3333333 0.4807692), wk = 0.0027701 k( 361) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0027701 Dense grid: 45911 G-vectors FFT dimensions: ( 40, 40, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 318, 42) NL pseudopotentials 0.23 Mb ( 159, 96) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 1277) G-vector shells 0.00 Mb ( 585) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.82 Mb ( 318, 168) Each subspace H/S matrix 0.03 Mb ( 42, 42) Each matrix 0.12 Mb ( 96, 2, 42) The potential is recalculated from file : ./TiAs.save/charge-density.dat Starting wfc are 16 randomized atomic wfcs + 26 random wfc Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.7 secs Computing kpt #: 2 total cpu time spent up to now is 2.3 secs Computing kpt #: 3 total cpu time spent up to now is 2.8 secs Computing kpt #: 4 total cpu time spent up to now is 3.4 secs Computing kpt #: 5 total cpu time spent up to now is 4.0 secs Computing kpt #: 6 total cpu time spent up to now is 4.5 secs Computing kpt #: 7 total cpu time spent up to now is 5.1 secs Computing kpt #: 8 total cpu time spent up to now is 5.7 secs Computing kpt #: 9 total cpu time spent up to now is 6.2 secs Computing kpt #: 10 total cpu time spent up to now is 6.8 secs Computing kpt #: 11 total cpu time spent up to now is 7.4 secs Computing kpt #: 12 total cpu time spent up to now is 8.0 secs Computing kpt #: 13 total cpu time spent up to now is 8.6 secs Computing kpt #: 14 total cpu time spent up to now is 9.2 secs Computing kpt #: 15 total cpu time spent up to now is 9.8 secs Computing kpt #: 16 total cpu time spent up to now is 10.5 secs Computing kpt #: 17 total cpu time spent up to now is 11.1 secs Computing kpt #: 18 total cpu time spent up to now is 11.7 secs Computing kpt #: 19 total cpu time spent up to now is 12.3 secs Computing kpt #: 20 total cpu time spent up to now is 13.0 secs Computing kpt #: 21 total cpu time spent up to now is 13.6 secs Computing kpt #: 22 total cpu time spent up to now is 14.2 secs Computing kpt #: 23 total cpu time spent up to now is 14.8 secs Computing kpt #: 24 total cpu time spent up to now is 15.4 secs Computing kpt #: 25 total cpu time spent up to now is 15.9 secs Computing kpt #: 26 total cpu time spent up to now is 16.5 secs Computing kpt #: 27 total cpu time spent up to now is 17.1 secs Computing kpt #: 28 total cpu time spent up to now is 17.7 secs Computing kpt #: 29 total cpu time spent up to now is 18.3 secs Computing kpt #: 30 total cpu time spent up to now is 18.9 secs Computing kpt #: 31 total cpu time spent up to now is 19.6 secs Computing kpt #: 32 total cpu time spent up to now is 20.2 secs Computing kpt #: 33 total cpu time spent up to now is 20.8 secs Computing kpt #: 34 total cpu time spent up to now is 21.5 secs Computing kpt #: 35 total cpu time spent up to now is 22.1 secs Computing kpt #: 36 total cpu time spent up to now is 22.7 secs Computing kpt #: 37 total cpu time spent up to now is 23.3 secs Computing kpt #: 38 total cpu time spent up to now is 23.9 secs Computing kpt #: 39 total cpu time spent up to now is 24.5 secs Computing kpt #: 40 total cpu time spent up to now is 25.2 secs Computing kpt #: 41 total cpu time spent up to now is 25.7 secs Computing kpt #: 42 total cpu time spent up to now is 26.3 secs Computing kpt #: 43 total cpu time spent up to now is 26.9 secs Computing kpt #: 44 total cpu time spent up to now is 27.5 secs Computing kpt #: 45 total cpu time spent up to now is 28.1 secs Computing kpt #: 46 total cpu time spent up to now is 28.7 secs Computing kpt #: 47 total cpu time spent up to now is 29.3 secs Computing kpt #: 48 total cpu time spent up to now is 29.9 secs Computing kpt #: 49 total cpu time spent up to now is 30.5 secs Computing kpt #: 50 total cpu time spent up to now is 31.1 secs Computing kpt #: 51 total cpu time spent up to now is 31.6 secs Computing kpt #: 52 total cpu time spent up to now is 32.2 secs Computing kpt #: 53 total cpu time spent up to now is 32.8 secs Computing kpt #: 54 total cpu time spent up to now is 33.4 secs Computing kpt #: 55 total cpu time spent up to now is 34.0 secs Computing kpt #: 56 total cpu time spent up to now is 34.6 secs Computing kpt #: 57 total cpu time spent up to now is 35.1 secs Computing kpt #: 58 total cpu time spent up to now is 35.7 secs Computing kpt #: 59 total cpu time spent up to now is 36.3 secs Computing kpt #: 60 total cpu time spent up to now is 36.9 secs Computing kpt #: 61 total cpu time spent up to now is 37.5 secs Computing kpt #: 62 total cpu time spent up to now is 38.1 secs Computing kpt #: 63 total cpu time spent up to now is 38.6 secs Computing kpt #: 64 total cpu time spent up to now is 39.2 secs Computing kpt #: 65 total cpu time spent up to now is 39.8 secs Computing kpt #: 66 total cpu time spent up to now is 40.4 secs Computing kpt #: 67 total cpu time spent up to now is 40.9 secs Computing kpt #: 68 total cpu time spent up to now is 41.5 secs Computing kpt #: 69 total cpu time spent up to now is 42.1 secs Computing kpt #: 70 total cpu time spent up to now is 42.7 secs Computing kpt #: 71 total cpu time spent up to now is 43.2 secs Computing kpt #: 72 total cpu time spent up to now is 43.8 secs Computing kpt #: 73 total cpu time spent up to now is 44.4 secs Computing kpt #: 74 total cpu time spent up to now is 44.9 secs Computing kpt #: 75 total cpu time spent up to now is 45.5 secs Computing kpt #: 76 total cpu time spent up to now is 46.1 secs Computing kpt #: 77 total cpu time spent up to now is 46.6 secs Computing kpt #: 78 total cpu time spent up to now is 47.2 secs Computing kpt #: 79 total cpu time spent up to now is 47.7 secs Computing kpt #: 80 total cpu time spent up to now is 48.3 secs Computing kpt #: 81 total cpu time spent up to now is 48.9 secs Computing kpt #: 82 total cpu time spent up to now is 49.3 secs Computing kpt #: 83 total cpu time spent up to now is 49.9 secs Computing kpt #: 84 total cpu time spent up to now is 50.5 secs Computing kpt #: 85 total cpu time spent up to now is 50.9 secs Computing kpt #: 86 total cpu time spent up to now is 51.5 secs Computing kpt #: 87 total cpu time spent up to now is 52.0 secs Computing kpt #: 88 total cpu time spent up to now is 52.6 secs Computing kpt #: 89 total cpu time spent up to now is 53.2 secs Computing kpt #: 90 total cpu time spent up to now is 53.7 secs Computing kpt #: 91 total cpu time spent up to now is 54.3 secs Computing kpt #: 92 total cpu time spent up to now is 54.8 secs Computing kpt #: 93 total cpu time spent up to now is 55.4 secs Computing kpt #: 94 total cpu time spent up to now is 55.9 secs Computing kpt #: 95 total cpu time spent up to now is 56.5 secs Computing kpt #: 96 total cpu time spent up to now is 57.0 secs Computing kpt #: 97 total cpu time spent up to now is 57.6 secs Computing kpt #: 98 total cpu time spent up to now is 58.2 secs Computing kpt #: 99 total cpu time spent up to now is 58.8 secs Computing kpt #: 100 total cpu time spent up to now is 59.4 secs Computing kpt #: 101 total cpu time spent up to now is 60.0 secs Computing kpt #: 102 total cpu time spent up to now is 60.6 secs Computing kpt #: 103 total cpu time spent up to now is 61.2 secs Computing kpt #: 104 total cpu time spent up to now is 61.9 secs Computing kpt #: 105 total cpu time spent up to now is 62.5 secs Computing kpt #: 106 total cpu time spent up to now is 63.1 secs Computing kpt #: 107 total cpu time spent up to now is 63.7 secs Computing kpt #: 108 total cpu time spent up to now is 64.3 secs Computing kpt #: 109 total cpu time spent up to now is 64.8 secs Computing kpt #: 110 total cpu time spent up to now is 65.4 secs Computing kpt #: 111 total cpu time spent up to now is 66.0 secs Computing kpt #: 112 total cpu time spent up to now is 66.6 secs Computing kpt #: 113 total cpu time spent up to now is 67.2 secs Computing kpt #: 114 total cpu time spent up to now is 67.8 secs Computing kpt #: 115 total cpu time spent up to now is 68.4 secs Computing kpt #: 116 total cpu time spent up to now is 69.0 secs Computing kpt #: 117 total cpu time spent up to now is 69.5 secs Computing kpt #: 118 total cpu time spent up to now is 70.1 secs Computing kpt #: 119 total cpu time spent up to now is 70.7 secs Computing kpt #: 120 total cpu time spent up to now is 71.2 secs Computing kpt #: 121 total cpu time spent up to now is 71.8 secs Computing kpt #: 122 total cpu time spent up to now is 72.5 secs Computing kpt #: 123 total cpu time spent up to now is 73.1 secs Computing kpt #: 124 total cpu time spent up to now is 73.8 secs Computing kpt #: 125 total cpu time spent up to now is 74.4 secs Computing kpt #: 126 total cpu time spent up to now is 75.1 secs Computing kpt #: 127 total cpu time spent up to now is 75.7 secs Computing kpt #: 128 total cpu time spent up to now is 76.3 secs Computing kpt #: 129 total cpu time spent up to now is 76.8 secs Computing kpt #: 130 total cpu time spent up to now is 77.4 secs Computing kpt #: 131 total cpu time spent up to now is 78.0 secs Computing kpt #: 132 total cpu time spent up to now is 78.5 secs Computing kpt #: 133 total cpu time spent up to now is 79.1 secs Computing kpt #: 134 total cpu time spent up to now is 79.7 secs Computing kpt #: 135 total cpu time spent up to now is 80.3 secs Computing kpt #: 136 total cpu time spent up to now is 80.8 secs Computing kpt #: 137 total cpu time spent up to now is 81.4 secs Computing kpt #: 138 total cpu time spent up to now is 81.9 secs Computing kpt #: 139 total cpu time spent up to now is 82.4 secs Computing kpt #: 140 total cpu time spent up to now is 83.0 secs Computing kpt #: 141 total cpu time spent up to now is 83.5 secs Computing kpt #: 142 total cpu time spent up to now is 84.1 secs Computing kpt #: 143 total cpu time spent up to now is 84.7 secs Computing kpt #: 144 total cpu time spent up to now is 85.2 secs Computing kpt #: 145 total cpu time spent up to now is 85.8 secs Computing kpt #: 146 total cpu time spent up to now is 86.4 secs Computing kpt #: 147 total cpu time spent up to now is 86.9 secs Computing kpt #: 148 total cpu time spent up to now is 87.5 secs Computing kpt #: 149 total cpu time spent up to now is 88.0 secs Computing kpt #: 150 total cpu time spent up to now is 88.5 secs Computing kpt #: 151 total cpu time spent up to now is 89.1 secs Computing kpt #: 152 total cpu time spent up to now is 89.6 secs Computing kpt #: 153 total cpu time spent up to now is 90.1 secs Computing kpt #: 154 total cpu time spent up to now is 90.6 secs Computing kpt #: 155 total cpu time spent up to now is 91.1 secs Computing kpt #: 156 total cpu time spent up to now is 91.7 secs Computing kpt #: 157 total cpu time spent up to now is 92.2 secs Computing kpt #: 158 total cpu time spent up to now is 92.8 secs Computing kpt #: 159 total cpu time spent up to now is 93.3 secs Computing kpt #: 160 total cpu time spent up to now is 93.8 secs Computing kpt #: 161 total cpu time spent up to now is 94.4 secs Computing kpt #: 162 total cpu time spent up to now is 94.9 secs Computing kpt #: 163 total cpu time spent up to now is 95.4 secs Computing kpt #: 164 total cpu time spent up to now is 96.0 secs Computing kpt #: 165 total cpu time spent up to now is 96.5 secs Computing kpt #: 166 total cpu time spent up to now is 97.0 secs Computing kpt #: 167 total cpu time spent up to now is 97.6 secs Computing kpt #: 168 total cpu time spent up to now is 98.1 secs Computing kpt #: 169 total cpu time spent up to now is 98.6 secs Computing kpt #: 170 total cpu time spent up to now is 99.1 secs Computing kpt #: 171 total cpu time spent up to now is 99.6 secs Computing kpt #: 172 total cpu time spent up to now is 100.1 secs Computing kpt #: 173 total cpu time spent up to now is 100.6 secs Computing kpt #: 174 total cpu time spent up to now is 101.2 secs Computing kpt #: 175 total cpu time spent up to now is 101.7 secs Computing kpt #: 176 total cpu time spent up to now is 102.2 secs Computing kpt #: 177 total cpu time spent up to now is 102.7 secs Computing kpt #: 178 total cpu time spent up to now is 103.2 secs Computing kpt #: 179 total cpu time spent up to now is 103.7 secs Computing kpt #: 180 total cpu time spent up to now is 104.2 secs Computing kpt #: 181 total cpu time spent up to now is 104.7 secs Computing kpt #: 182 total cpu time spent up to now is 105.2 secs Computing kpt #: 183 total cpu time spent up to now is 105.7 secs Computing kpt #: 184 total cpu time spent up to now is 106.2 secs Computing kpt #: 185 total cpu time spent up to now is 106.7 secs Computing kpt #: 186 total cpu time spent up to now is 107.2 secs Computing kpt #: 187 total cpu time spent up to now is 107.7 secs Computing kpt #: 188 total cpu time spent up to now is 108.2 secs Computing kpt #: 189 total cpu time spent up to now is 108.7 secs Computing kpt #: 190 total cpu time spent up to now is 109.2 secs Computing kpt #: 191 total cpu time spent up to now is 109.8 secs Computing kpt #: 192 total cpu time spent up to now is 110.5 secs Computing kpt #: 193 total cpu time spent up to now is 111.2 secs Computing kpt #: 194 total cpu time spent up to now is 111.7 secs Computing kpt #: 195 total cpu time spent up to now is 112.2 secs Computing kpt #: 196 total cpu time spent up to now is 112.7 secs Computing kpt #: 197 total cpu time spent up to now is 113.2 secs Computing kpt #: 198 total cpu time spent up to now is 113.7 secs Computing kpt #: 199 total cpu time spent up to now is 114.2 secs Computing kpt #: 200 total cpu time spent up to now is 114.7 secs Computing kpt #: 201 total cpu time spent up to now is 115.3 secs Computing kpt #: 202 total cpu time spent up to now is 115.8 secs Computing kpt #: 203 total cpu time spent up to now is 116.3 secs Computing kpt #: 204 total cpu time spent up to now is 116.8 secs Computing kpt #: 205 total cpu time spent up to now is 117.3 secs Computing kpt #: 206 total cpu time spent up to now is 117.8 secs Computing kpt #: 207 total cpu time spent up to now is 118.7 secs Computing kpt #: 208 total cpu time spent up to now is 119.2 secs Computing kpt #: 209 total cpu time spent up to now is 119.7 secs Computing kpt #: 210 total cpu time spent up to now is 120.3 secs Computing kpt #: 211 total cpu time spent up to now is 120.8 secs Computing kpt #: 212 total cpu time spent up to now is 121.3 secs Computing kpt #: 213 total cpu time spent up to now is 121.8 secs Computing kpt #: 214 total cpu time spent up to now is 122.4 secs Computing kpt #: 215 total cpu time spent up to now is 122.9 secs Computing kpt #: 216 total cpu time spent up to now is 123.5 secs Computing kpt #: 217 total cpu time spent up to now is 124.1 secs Computing kpt #: 218 total cpu time spent up to now is 124.6 secs Computing kpt #: 219 total cpu time spent up to now is 125.2 secs Computing kpt #: 220 total cpu time spent up to now is 125.9 secs Computing kpt #: 221 total cpu time spent up to now is 126.5 secs Computing kpt #: 222 total cpu time spent up to now is 127.2 secs Computing kpt #: 223 total cpu time spent up to now is 127.9 secs Computing kpt #: 224 total cpu time spent up to now is 128.6 secs Computing kpt #: 225 total cpu time spent up to now is 129.2 secs Computing kpt #: 226 total cpu time spent up to now is 129.8 secs Computing kpt #: 227 total cpu time spent up to now is 130.5 secs Computing kpt #: 228 total cpu time spent up to now is 131.1 secs Computing kpt #: 229 total cpu time spent up to now is 131.7 secs Computing kpt #: 230 total cpu time spent up to now is 132.3 secs Computing kpt #: 231 total cpu time spent up to now is 133.0 secs Computing kpt #: 232 total cpu time spent up to now is 133.7 secs Computing kpt #: 233 total cpu time spent up to now is 134.3 secs Computing kpt #: 234 total cpu time spent up to now is 134.9 secs Computing kpt #: 235 total cpu time spent up to now is 135.6 secs Computing kpt #: 236 total cpu time spent up to now is 136.2 secs Computing kpt #: 237 total cpu time spent up to now is 137.0 secs Computing kpt #: 238 total cpu time spent up to now is 137.7 secs Computing kpt #: 239 total cpu time spent up to now is 138.3 secs Computing kpt #: 240 total cpu time spent up to now is 139.0 secs Computing kpt #: 241 total cpu time spent up to now is 139.7 secs Computing kpt #: 242 total cpu time spent up to now is 140.3 secs Computing kpt #: 243 total cpu time spent up to now is 140.9 secs Computing kpt #: 244 total cpu time spent up to now is 141.6 secs Computing kpt #: 245 total cpu time spent up to now is 142.3 secs Computing kpt #: 246 total cpu time spent up to now is 142.8 secs Computing kpt #: 247 total cpu time spent up to now is 143.6 secs Computing kpt #: 248 total cpu time spent up to now is 144.2 secs Computing kpt #: 249 total cpu time spent up to now is 145.0 secs Computing kpt #: 250 total cpu time spent up to now is 145.8 secs Computing kpt #: 251 total cpu time spent up to now is 146.3 secs Computing kpt #: 252 total cpu time spent up to now is 147.1 secs Computing kpt #: 253 total cpu time spent up to now is 147.8 secs Computing kpt #: 254 total cpu time spent up to now is 148.5 secs Computing kpt #: 255 total cpu time spent up to now is 149.1 secs Computing kpt #: 256 total cpu time spent up to now is 149.8 secs Computing kpt #: 257 total cpu time spent up to now is 150.3 secs Computing kpt #: 258 total cpu time spent up to now is 151.1 secs Computing kpt #: 259 total cpu time spent up to now is 151.7 secs Computing kpt #: 260 total cpu time spent up to now is 152.2 secs Computing kpt #: 261 total cpu time spent up to now is 152.8 secs Computing kpt #: 262 total cpu time spent up to now is 153.5 secs Computing kpt #: 263 total cpu time spent up to now is 154.0 secs Computing kpt #: 264 total cpu time spent up to now is 154.6 secs Computing kpt #: 265 total cpu time spent up to now is 155.2 secs Computing kpt #: 266 total cpu time spent up to now is 155.8 secs Computing kpt #: 267 total cpu time spent up to now is 156.4 secs Computing kpt #: 268 total cpu time spent up to now is 157.0 secs Computing kpt #: 269 total cpu time spent up to now is 157.5 secs Computing kpt #: 270 total cpu time spent up to now is 158.1 secs Computing kpt #: 271 total cpu time spent up to now is 158.7 secs Computing kpt #: 272 total cpu time spent up to now is 159.3 secs Computing kpt #: 273 total cpu time spent up to now is 159.9 secs Computing kpt #: 274 total cpu time spent up to now is 160.5 secs Computing kpt #: 275 total cpu time spent up to now is 161.1 secs Computing kpt #: 276 total cpu time spent up to now is 161.8 secs Computing kpt #: 277 total cpu time spent up to now is 162.4 secs Computing kpt #: 278 total cpu time spent up to now is 162.9 secs Computing kpt #: 279 total cpu time spent up to now is 163.6 secs Computing kpt #: 280 total cpu time spent up to now is 164.1 secs Computing kpt #: 281 total cpu time spent up to now is 164.7 secs Computing kpt #: 282 total cpu time spent up to now is 165.4 secs Computing kpt #: 283 total cpu time spent up to now is 165.9 secs Computing kpt #: 284 total cpu time spent up to now is 166.5 secs Computing kpt #: 285 total cpu time spent up to now is 167.1 secs Computing kpt #: 286 total cpu time spent up to now is 167.6 secs Computing kpt #: 287 total cpu time spent up to now is 168.3 secs Computing kpt #: 288 total cpu time spent up to now is 168.9 secs Computing kpt #: 289 total cpu time spent up to now is 169.5 secs Computing kpt #: 290 total cpu time spent up to now is 170.0 secs Computing kpt #: 291 total cpu time spent up to now is 170.6 secs Computing kpt #: 292 total cpu time spent up to now is 171.2 secs Computing kpt #: 293 total cpu time spent up to now is 171.8 secs Computing kpt #: 294 total cpu time spent up to now is 172.5 secs Computing kpt #: 295 total cpu time spent up to now is 173.1 secs Computing kpt #: 296 total cpu time spent up to now is 173.7 secs Computing kpt #: 297 total cpu time spent up to now is 174.3 secs Computing kpt #: 298 total cpu time spent up to now is 175.0 secs Computing kpt #: 299 total cpu time spent up to now is 175.6 secs Computing kpt #: 300 total cpu time spent up to now is 176.2 secs Computing kpt #: 301 total cpu time spent up to now is 176.8 secs Computing kpt #: 302 total cpu time spent up to now is 177.4 secs Computing kpt #: 303 total cpu time spent up to now is 177.9 secs Computing kpt #: 304 total cpu time spent up to now is 178.5 secs Computing kpt #: 305 total cpu time spent up to now is 179.0 secs Computing kpt #: 306 total cpu time spent up to now is 179.5 secs Computing kpt #: 307 total cpu time spent up to now is 180.0 secs Computing kpt #: 308 total cpu time spent up to now is 180.6 secs Computing kpt #: 309 total cpu time spent up to now is 181.2 secs Computing kpt #: 310 total cpu time spent up to now is 181.8 secs Computing kpt #: 311 total cpu time spent up to now is 182.4 secs Computing kpt #: 312 total cpu time spent up to now is 183.0 secs Computing kpt #: 313 total cpu time spent up to now is 183.5 secs Computing kpt #: 314 total cpu time spent up to now is 184.1 secs Computing kpt #: 315 total cpu time spent up to now is 184.7 secs Computing kpt #: 316 total cpu time spent up to now is 185.2 secs Computing kpt #: 317 total cpu time spent up to now is 185.8 secs Computing kpt #: 318 total cpu time spent up to now is 186.3 secs Computing kpt #: 319 total cpu time spent up to now is 186.9 secs Computing kpt #: 320 total cpu time spent up to now is 187.5 secs Computing kpt #: 321 total cpu time spent up to now is 188.0 secs Computing kpt #: 322 total cpu time spent up to now is 188.6 secs Computing kpt #: 323 total cpu time spent up to now is 189.2 secs Computing kpt #: 324 total cpu time spent up to now is 189.8 secs Computing kpt #: 325 total cpu time spent up to now is 190.4 secs Computing kpt #: 326 total cpu time spent up to now is 191.0 secs Computing kpt #: 327 total cpu time spent up to now is 191.6 secs Computing kpt #: 328 total cpu time spent up to now is 192.2 secs Computing kpt #: 329 total cpu time spent up to now is 192.8 secs Computing kpt #: 330 total cpu time spent up to now is 193.4 secs Computing kpt #: 331 total cpu time spent up to now is 193.9 secs Computing kpt #: 332 total cpu time spent up to now is 194.5 secs Computing kpt #: 333 total cpu time spent up to now is 195.1 secs Computing kpt #: 334 total cpu time spent up to now is 195.7 secs Computing kpt #: 335 total cpu time spent up to now is 196.1 secs Computing kpt #: 336 total cpu time spent up to now is 196.7 secs Computing kpt #: 337 total cpu time spent up to now is 197.2 secs Computing kpt #: 338 total cpu time spent up to now is 197.8 secs Computing kpt #: 339 total cpu time spent up to now is 198.3 secs Computing kpt #: 340 total cpu time spent up to now is 198.8 secs Computing kpt #: 341 total cpu time spent up to now is 199.2 secs Computing kpt #: 342 total cpu time spent up to now is 199.7 secs Computing kpt #: 343 total cpu time spent up to now is 200.1 secs Computing kpt #: 344 total cpu time spent up to now is 200.6 secs Computing kpt #: 345 total cpu time spent up to now is 201.0 secs Computing kpt #: 346 total cpu time spent up to now is 201.6 secs Computing kpt #: 347 total cpu time spent up to now is 202.1 secs Computing kpt #: 348 total cpu time spent up to now is 202.7 secs Computing kpt #: 349 total cpu time spent up to now is 203.3 secs Computing kpt #: 350 total cpu time spent up to now is 203.9 secs Computing kpt #: 351 total cpu time spent up to now is 204.5 secs Computing kpt #: 352 total cpu time spent up to now is 205.2 secs Computing kpt #: 353 total cpu time spent up to now is 205.8 secs Computing kpt #: 354 total cpu time spent up to now is 206.5 secs Computing kpt #: 355 total cpu time spent up to now is 207.1 secs Computing kpt #: 356 total cpu time spent up to now is 207.8 secs Computing kpt #: 357 total cpu time spent up to now is 208.5 secs Computing kpt #: 358 total cpu time spent up to now is 209.1 secs Computing kpt #: 359 total cpu time spent up to now is 209.8 secs Computing kpt #: 360 total cpu time spent up to now is 210.4 secs Computing kpt #: 361 total cpu time spent up to now is 211.1 secs ethr = 2.94E-08, avg # of iterations = 35.0 total cpu time spent up to now is 211.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4610 -22.4610 -21.8777 -21.8777 -21.8504 -21.8504 -21.8441 -21.8441 -21.6603 -21.6603 -1.2502 -1.2502 0.7760 0.7760 5.5339 5.5339 8.7600 8.7600 8.8633 8.8633 10.2274 10.2274 11.4231 11.4231 11.4255 11.4255 11.4804 11.4804 11.5063 11.5063 12.0816 12.0816 12.4947 12.4947 12.6421 12.6421 k = 0.0100 0.0058-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4610 -22.4610 -21.8777 -21.8777 -21.8504 -21.8504 -21.8441 -21.8441 -21.6603 -21.6603 -1.2489 -1.2489 0.7762 0.7762 5.5355 5.5355 8.7594 8.7594 8.8627 8.8627 10.2269 10.2269 11.4162 11.4162 11.4200 11.4200 11.4704 11.4704 11.5015 11.5015 12.0944 12.0944 12.4983 12.4983 12.6438 12.6438 k = 0.0200 0.0115-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4611 -22.4611 -21.8778 -21.8778 -21.8505 -21.8505 -21.8441 -21.8441 -21.6603 -21.6603 -1.2450 -1.2450 0.7769 0.7769 5.5403 5.5403 8.7573 8.7573 8.8608 8.8608 10.2251 10.2251 11.3947 11.3947 11.4042 11.4042 11.4323 11.4323 11.4995 11.4995 12.1288 12.1288 12.5081 12.5081 12.6492 12.6492 k = 0.0300 0.0173-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4996 -22.4996 -22.4613 -22.4613 -21.8781 -21.8781 -21.8507 -21.8507 -21.8441 -21.8441 -21.6603 -21.6603 -1.2386 -1.2386 0.7781 0.7781 5.5483 5.5483 8.7535 8.7535 8.8581 8.8581 10.2221 10.2221 11.3561 11.3561 11.3743 11.3743 11.3798 11.3798 11.5026 11.5026 12.1762 12.1762 12.5219 12.5219 12.6597 12.6597 k = 0.0400 0.0231-0.0000 ( 5713 PWs) bands (ev): -45.7909 -45.7909 -45.7671 -45.7671 -22.4997 -22.4997 -22.4615 -22.4615 -21.8784 -21.8784 -21.8510 -21.8510 -21.8441 -21.8441 -21.6603 -21.6603 -1.2296 -1.2296 0.7796 0.7796 5.5595 5.5595 8.7475 8.7475 8.8550 8.8550 10.2174 10.2174 11.2904 11.2904 11.3189 11.3189 11.3460 11.3460 11.5087 11.5087 12.2287 12.2287 12.5366 12.5366 12.6766 12.6766 k = 0.0500 0.0289-0.0000 ( 5717 PWs) bands (ev): -45.7908 -45.7908 -45.7671 -45.7671 -22.4999 -22.4999 -22.4618 -22.4618 -21.8788 -21.8788 -21.8513 -21.8513 -21.8441 -21.8441 -21.6603 -21.6603 -1.2180 -1.2180 0.7817 0.7817 5.5739 5.5739 8.7387 8.7387 8.8521 8.8521 10.2107 10.2107 11.2094 11.2094 11.2596 11.2596 11.3057 11.3057 11.5170 11.5170 12.2806 12.2806 12.5499 12.5499 12.7006 12.7006 k = 0.0600 0.0346-0.0000 ( 5715 PWs) bands (ev): -45.7908 -45.7908 -45.7671 -45.7671 -22.5001 -22.5001 -22.4621 -22.4621 -21.8793 -21.8793 -21.8517 -21.8517 -21.8441 -21.8441 -21.6604 -21.6604 -1.2039 -1.2039 0.7841 0.7841 5.5915 5.5915 8.7267 8.7267 8.8500 8.8500 10.2014 10.2014 11.1226 11.1226 11.1917 11.1917 11.2600 11.2600 11.5275 11.5275 12.3282 12.3282 12.5610 12.5610 12.7309 12.7309 k = 0.0700 0.0404-0.0000 ( 5717 PWs) bands (ev): -45.7907 -45.7907 -45.7670 -45.7670 -22.5003 -22.5003 -22.4625 -22.4625 -21.8798 -21.8798 -21.8522 -21.8522 -21.8441 -21.8441 -21.6604 -21.6604 -1.1873 -1.1873 0.7870 0.7870 5.6122 5.6122 8.7111 8.7111 8.8489 8.8489 10.1884 10.1884 11.0330 11.0330 11.1166 11.1166 11.2103 11.2103 11.5400 11.5400 12.3690 12.3690 12.5706 12.5706 12.7658 12.7658 k = 0.0800 0.0462-0.0000 ( 5713 PWs) bands (ev): -45.7906 -45.7906 -45.7669 -45.7669 -22.5006 -22.5006 -22.4630 -22.4630 -21.8805 -21.8805 -21.8528 -21.8528 -21.8440 -21.8440 -21.6604 -21.6604 -1.1682 -1.1682 0.7903 0.7903 5.6360 5.6360 8.6919 8.6919 8.8490 8.8490 10.1705 10.1705 10.9421 10.9421 11.0362 11.0362 11.1577 11.1577 11.5544 11.5544 12.4021 12.4021 12.5790 12.5790 12.8038 12.8038 k = 0.0900 0.0520-0.0000 ( 5709 PWs) bands (ev): -45.7905 -45.7905 -45.7668 -45.7668 -22.5009 -22.5009 -22.4635 -22.4635 -21.8812 -21.8812 -21.8535 -21.8535 -21.8440 -21.8440 -21.6604 -21.6604 -1.1466 -1.1466 0.7940 0.7940 5.6629 5.6629 8.6692 8.6692 8.8502 8.8502 10.1460 10.1460 10.8511 10.8511 10.9531 10.9531 11.1030 11.1030 11.5707 11.5707 12.4281 12.4281 12.5860 12.5860 12.8440 12.8440 k = 0.1000 0.0577-0.0000 ( 5711 PWs) bands (ev): -45.7904 -45.7904 -45.7668 -45.7668 -22.5012 -22.5012 -22.4641 -22.4641 -21.8820 -21.8820 -21.8542 -21.8542 -21.8439 -21.8439 -21.6605 -21.6605 -1.1226 -1.1226 0.7981 0.7981 5.6928 5.6928 8.6432 8.6432 8.8524 8.8524 10.1124 10.1124 10.7611 10.7611 10.8701 10.8701 11.0473 11.0473 11.5888 11.5888 12.4483 12.4483 12.5911 12.5911 12.8855 12.8855 k = 0.1100 0.0635-0.0000 ( 5709 PWs) bands (ev): -45.7903 -45.7903 -45.7667 -45.7667 -22.5016 -22.5016 -22.4648 -22.4648 -21.8829 -21.8829 -21.8550 -21.8550 -21.8439 -21.8439 -21.6605 -21.6605 -1.0962 -1.0962 0.8026 0.8026 5.7258 5.7258 8.6141 8.6141 8.8554 8.8554 10.0672 10.0672 10.6728 10.6728 10.7909 10.7909 10.9910 10.9910 11.6087 11.6087 12.4643 12.4643 12.5939 12.5939 12.9273 12.9273 k = 0.1200 0.0693-0.0000 ( 5709 PWs) bands (ev): -45.7902 -45.7902 -45.7666 -45.7666 -22.5020 -22.5020 -22.4654 -22.4654 -21.8838 -21.8838 -21.8558 -21.8558 -21.8438 -21.8438 -21.6605 -21.6605 -1.0674 -1.0674 0.8074 0.8074 5.7617 5.7617 8.5821 8.5821 8.8589 8.8589 10.0078 10.0078 10.5864 10.5864 10.7189 10.7189 10.9349 10.9349 11.6303 11.6303 12.4777 12.4777 12.5943 12.5943 12.9685 12.9685 k = 0.1300 0.0751-0.0000 ( 5715 PWs) bands (ev): -45.7901 -45.7901 -45.7665 -45.7665 -22.5024 -22.5024 -22.4662 -22.4662 -21.8848 -21.8848 -21.8567 -21.8567 -21.8437 -21.8437 -21.6606 -21.6606 -1.0363 -1.0363 0.8125 0.8125 5.8006 5.8006 8.5475 8.5475 8.8628 8.8628 9.9329 9.9329 10.5012 10.5012 10.6574 10.6574 10.8793 10.8793 11.6537 11.6537 12.4896 12.4896 12.5925 12.5925 13.0080 13.0080 k = 0.1400 0.0808-0.0000 ( 5719 PWs) bands (ev): -45.7900 -45.7900 -45.7663 -45.7663 -22.5028 -22.5028 -22.4670 -22.4670 -21.8859 -21.8859 -21.8577 -21.8577 -21.8436 -21.8436 -21.6606 -21.6606 -1.0029 -1.0029 0.8180 0.8180 5.8423 5.8423 8.5102 8.5102 8.8670 8.8670 9.8429 9.8429 10.4165 10.4165 10.6078 10.6078 10.8246 10.8246 11.6786 11.6786 12.5004 12.5004 12.5890 12.5890 13.0374 13.0374 k = 0.1500 0.0866-0.0000 ( 5731 PWs) bands (ev): -45.7899 -45.7899 -45.7662 -45.7662 -22.5033 -22.5033 -22.4678 -22.4678 -21.8870 -21.8870 -21.8587 -21.8587 -21.8435 -21.8435 -21.6607 -21.6607 -0.9672 -0.9672 0.8237 0.8237 5.8868 5.8868 8.4704 8.4704 8.8713 8.8713 9.7400 9.7400 10.3323 10.3323 10.5691 10.5691 10.7712 10.7712 11.7052 11.7052 12.5101 12.5101 12.5848 12.5848 13.0362 13.0362 k = 0.1600 0.0924-0.0000 ( 5739 PWs) bands (ev): -45.7897 -45.7897 -45.7661 -45.7661 -22.5038 -22.5038 -22.4686 -22.4686 -21.8881 -21.8881 -21.8598 -21.8598 -21.8434 -21.8434 -21.6607 -21.6607 -0.9294 -0.9294 0.8297 0.8297 5.9340 5.9340 8.4281 8.4281 8.8754 8.8754 9.6270 9.6270 10.2487 10.2487 10.5394 10.5394 10.7195 10.7195 11.7332 11.7332 12.5176 12.5176 12.5816 12.5816 13.0330 13.0330 k = 0.1700 0.0981-0.0000 ( 5731 PWs) bands (ev): -45.7896 -45.7896 -45.7660 -45.7660 -22.5043 -22.5043 -22.4695 -22.4695 -21.8893 -21.8893 -21.8609 -21.8609 -21.8433 -21.8433 -21.6607 -21.6607 -0.8894 -0.8894 0.8360 0.8360 5.9840 5.9840 8.3832 8.3832 8.8794 8.8794 9.5068 9.5068 10.1660 10.1660 10.5162 10.5162 10.6697 10.6697 11.7626 11.7626 12.5208 12.5208 12.5821 12.5821 13.0295 13.0295 k = 0.1800 0.1039-0.0000 ( 5731 PWs) bands (ev): -45.7894 -45.7894 -45.7658 -45.7658 -22.5049 -22.5049 -22.4705 -22.4705 -21.8906 -21.8906 -21.8621 -21.8621 -21.8431 -21.8431 -21.6608 -21.6608 -0.8474 -0.8474 0.8424 0.8424 6.0365 6.0365 8.3354 8.3354 8.8831 8.8831 9.3821 9.3821 10.0846 10.0846 10.4977 10.4977 10.6220 10.6220 11.7934 11.7934 12.5179 12.5179 12.5885 12.5885 13.0260 13.0260 k = 0.1900 0.1097-0.0000 ( 5723 PWs) bands (ev): -45.7893 -45.7893 -45.7657 -45.7657 -22.5054 -22.5054 -22.4714 -22.4714 -21.8919 -21.8919 -21.8633 -21.8633 -21.8430 -21.8430 -21.6608 -21.6608 -0.8034 -0.8034 0.8490 0.8490 6.0915 6.0915 8.2846 8.2846 8.8862 8.8862 9.2551 9.2551 10.0047 10.0047 10.4822 10.4822 10.5767 10.5767 11.8253 11.8253 12.5097 12.5097 12.6001 12.6001 13.0225 13.0225 k = 0.2000 0.1155-0.0000 ( 5733 PWs) bands (ev): -45.7891 -45.7891 -45.7656 -45.7656 -22.5060 -22.5060 -22.4724 -22.4724 -21.8932 -21.8932 -21.8645 -21.8645 -21.8429 -21.8429 -21.6609 -21.6609 -0.7575 -0.7575 0.8558 0.8558 6.1489 6.1489 8.2301 8.2301 8.8888 8.8888 9.1282 9.1282 9.9264 9.9264 10.4685 10.4685 10.5343 10.5343 11.8585 11.8585 12.4981 12.4981 12.6152 12.6152 13.0191 13.0191 k = 0.2100 0.1212-0.0000 ( 5729 PWs) bands (ev): -45.7890 -45.7890 -45.7654 -45.7654 -22.5066 -22.5066 -22.4734 -22.4734 -21.8946 -21.8946 -21.8658 -21.8658 -21.8427 -21.8427 -21.6609 -21.6609 -0.7098 -0.7098 0.8626 0.8626 6.2086 6.2086 8.1713 8.1713 8.8906 8.8906 9.0033 9.0033 9.8499 9.8499 10.4552 10.4552 10.4952 10.4952 11.8927 11.8927 12.4843 12.4843 12.6328 12.6328 13.0157 13.0157 k = 0.2200 0.1270-0.0000 ( 5729 PWs) bands (ev): -45.7888 -45.7888 -45.7653 -45.7653 -22.5072 -22.5072 -22.4745 -22.4745 -21.8959 -21.8959 -21.8670 -21.8670 -21.8426 -21.8426 -21.6609 -21.6609 -0.6604 -0.6604 0.8696 0.8696 6.2705 6.2705 8.1073 8.1073 8.8814 8.8814 8.8925 8.8925 9.7753 9.7753 10.4394 10.4394 10.4621 10.4621 11.9277 11.9277 12.4692 12.4692 12.6521 12.6521 13.0126 13.0126 k = 0.2300 0.1328-0.0000 ( 5737 PWs) bands (ev): -45.7887 -45.7887 -45.7651 -45.7651 -22.5078 -22.5078 -22.4755 -22.4755 -21.8973 -21.8973 -21.8683 -21.8683 -21.8424 -21.8424 -21.6610 -21.6610 -0.6093 -0.6093 0.8765 0.8765 6.3345 6.3345 8.0371 8.0371 8.7671 8.7671 8.8918 8.8918 9.7026 9.7026 10.4146 10.4146 10.4411 10.4411 11.9636 11.9636 12.4529 12.4529 12.6726 12.6726 13.0096 13.0096 k = 0.2400 0.1386-0.0000 ( 5727 PWs) bands (ev): -45.7885 -45.7885 -45.7650 -45.7650 -22.5084 -22.5084 -22.4766 -22.4766 -21.8987 -21.8987 -21.8696 -21.8696 -21.8423 -21.8423 -21.6610 -21.6610 -0.5567 -0.5567 0.8834 0.8834 6.4004 6.4004 7.9596 7.9596 8.6598 8.6598 8.8909 8.8909 9.6320 9.6320 10.3855 10.3855 10.4272 10.4272 12.0001 12.0001 12.4359 12.4359 12.6942 12.6942 13.0069 13.0069 k = 0.2500 0.1443-0.0000 ( 5713 PWs) bands (ev): -45.7883 -45.7883 -45.7648 -45.7648 -22.5090 -22.5090 -22.4776 -22.4776 -21.9001 -21.9001 -21.8709 -21.8709 -21.8421 -21.8421 -21.6610 -21.6610 -0.5027 -0.5027 0.8903 0.8903 6.4681 6.4681 7.8741 7.8741 8.5617 8.5617 8.8889 8.8889 9.5633 9.5633 10.3579 10.3579 10.4144 10.4144 12.0370 12.0370 12.4183 12.4183 12.7164 12.7164 13.0045 13.0045 k = 0.2600 0.1501-0.0000 ( 5717 PWs) bands (ev): -45.7882 -45.7882 -45.7647 -45.7647 -22.5096 -22.5096 -22.4787 -22.4787 -21.9015 -21.9015 -21.8722 -21.8722 -21.8419 -21.8419 -21.6610 -21.6610 -0.4474 -0.4474 0.8970 0.8970 6.5375 6.5375 7.7807 7.7807 8.4734 8.4734 8.8858 8.8858 9.4967 9.4967 10.3330 10.3330 10.4014 10.4014 12.0743 12.0743 12.4002 12.4002 12.7391 12.7391 13.0025 13.0025 k = 0.2700 0.1559-0.0000 ( 5731 PWs) bands (ev): -45.7880 -45.7880 -45.7645 -45.7645 -22.5103 -22.5103 -22.4798 -22.4798 -21.9029 -21.9029 -21.8735 -21.8735 -21.8418 -21.8418 -21.6611 -21.6611 -0.3909 -0.3909 0.9035 0.9035 6.6083 6.6083 7.6798 7.6798 8.3950 8.3950 8.8816 8.8816 9.4322 9.4322 10.3109 10.3109 10.3878 10.3878 12.1117 12.1117 12.3817 12.3817 12.7620 12.7620 13.0009 13.0009 k = 0.2800 0.1617-0.0000 ( 5727 PWs) bands (ev): -45.7878 -45.7878 -45.7644 -45.7644 -22.5109 -22.5109 -22.4808 -22.4808 -21.9043 -21.9043 -21.8747 -21.8747 -21.8416 -21.8416 -21.6611 -21.6611 -0.3335 -0.3335 0.9098 0.9098 6.6803 6.6803 7.5729 7.5729 8.3256 8.3256 8.8763 8.8763 9.3697 9.3697 10.2918 10.2918 10.3735 10.3735 12.1490 12.1490 12.3629 12.3629 12.7848 12.7848 12.9999 12.9999 k = 0.2900 0.1674-0.0000 ( 5737 PWs) bands (ev): -45.7877 -45.7877 -45.7642 -45.7642 -22.5115 -22.5115 -22.4819 -22.4819 -21.9056 -21.9056 -21.8760 -21.8760 -21.8415 -21.8415 -21.6611 -21.6611 -0.2751 -0.2751 0.9159 0.9159 6.7534 6.7534 7.4615 7.4615 8.2643 8.2643 8.8699 8.8699 9.3094 9.3094 10.2756 10.2756 10.3584 10.3584 12.1860 12.1860 12.3440 12.3440 12.8072 12.8072 12.9994 12.9994 k = 0.3000 0.1732-0.0000 ( 5729 PWs) bands (ev): -45.7875 -45.7875 -45.7641 -45.7641 -22.5121 -22.5121 -22.4829 -22.4829 -21.9070 -21.9070 -21.8772 -21.8772 -21.8413 -21.8413 -21.6611 -21.6611 -0.2161 -0.2161 0.9215 0.9215 6.8271 6.8271 7.3476 7.3476 8.2097 8.2097 8.8625 8.8625 9.2512 9.2512 10.2622 10.2622 10.3425 10.3425 12.2223 12.2223 12.3251 12.3251 12.8290 12.8290 12.9996 12.9996 k = 0.3100 0.1790-0.0000 ( 5731 PWs) bands (ev): -45.7874 -45.7874 -45.7639 -45.7639 -22.5127 -22.5127 -22.4839 -22.4839 -21.9083 -21.9083 -21.8784 -21.8784 -21.8411 -21.8411 -21.6612 -21.6612 -0.1566 -0.1566 0.9268 0.9268 6.9006 6.9006 7.2332 7.2332 8.1608 8.1608 8.8542 8.8542 9.1951 9.1951 10.2514 10.2514 10.3259 10.3259 12.2569 12.2569 12.3070 12.3070 12.8498 12.8498 13.0005 13.0005 k = 0.3200 0.1848-0.0000 ( 5735 PWs) bands (ev): -45.7872 -45.7872 -45.7638 -45.7638 -22.5133 -22.5133 -22.4849 -22.4849 -21.9095 -21.9095 -21.8796 -21.8796 -21.8410 -21.8410 -21.6612 -21.6612 -0.0968 -0.0968 0.9316 0.9316 6.9707 6.9707 7.1228 7.1228 8.1167 8.1167 8.8451 8.8451 9.1411 9.1411 10.2431 10.2431 10.3085 10.3085 12.2777 12.2777 12.3017 12.3017 12.8696 12.8696 13.0020 13.0020 k = 0.3300 0.1905-0.0000 ( 5731 PWs) bands (ev): -45.7871 -45.7871 -45.7636 -45.7636 -22.5139 -22.5139 -22.4859 -22.4859 -21.9108 -21.9108 -21.8807 -21.8807 -21.8408 -21.8408 -21.6612 -21.6612 -0.0368 -0.0368 0.9358 0.9358 6.9796 6.9796 7.0748 7.0748 8.0767 8.0767 8.8353 8.8353 9.0891 9.0891 10.2370 10.2370 10.2907 10.2907 12.2633 12.2633 12.3303 12.3303 12.8879 12.8879 13.0035 13.0035 k = 0.3400 0.1963-0.0000 ( 5735 PWs) bands (ev): -45.7869 -45.7869 -45.7635 -45.7635 -22.5144 -22.5144 -22.4868 -22.4868 -21.9119 -21.9119 -21.8818 -21.8818 -21.8407 -21.8407 -21.6612 -21.6612 0.0230 0.0230 0.9393 0.9393 6.8795 6.8795 7.1378 7.1378 8.0403 8.0403 8.8250 8.8250 9.0393 9.0393 10.2327 10.2327 10.2726 10.2726 12.2445 12.2445 12.3619 12.3619 12.9046 12.9046 12.9956 12.9956 k = 0.3500 0.2021-0.0000 ( 5745 PWs) bands (ev): -45.7868 -45.7868 -45.7634 -45.7634 -22.5150 -22.5150 -22.4877 -22.4877 -21.9131 -21.9131 -21.8829 -21.8829 -21.8405 -21.8405 -21.6612 -21.6612 0.0825 0.0825 0.9421 0.9421 6.7718 6.7718 7.2109 7.2109 8.0072 8.0072 8.8142 8.8142 8.9916 8.9916 10.2297 10.2297 10.2549 10.2549 12.2253 12.2253 12.3923 12.3923 12.9191 12.9191 12.9725 12.9725 k = 0.3600 0.2078-0.0000 ( 5741 PWs) bands (ev): -45.7867 -45.7867 -45.7633 -45.7633 -22.5155 -22.5155 -22.4886 -22.4886 -21.9142 -21.9142 -21.8839 -21.8839 -21.8404 -21.8404 -21.6612 -21.6612 0.1415 0.1415 0.9441 0.9441 6.6662 6.6662 7.2848 7.2848 7.9769 7.9769 8.8029 8.8029 8.9460 8.9460 10.2248 10.2248 10.2405 10.2405 12.2060 12.2060 12.4210 12.4210 12.9275 12.9275 12.9523 12.9523 k = 0.3700 0.2136-0.0000 ( 5741 PWs) bands (ev): -45.7865 -45.7865 -45.7631 -45.7631 -22.5160 -22.5160 -22.4894 -22.4894 -21.9152 -21.9152 -21.8848 -21.8848 -21.8403 -21.8403 -21.6612 -21.6612 0.1996 0.1996 0.9451 0.9451 6.5645 6.5645 7.3581 7.3581 7.9494 7.9494 8.7913 8.7913 8.9027 8.9027 10.2116 10.2116 10.2359 10.2359 12.1868 12.1868 12.4477 12.4477 12.9141 12.9141 12.9525 12.9525 k = 0.3800 0.2194-0.0000 ( 5745 PWs) bands (ev): -45.7864 -45.7864 -45.7630 -45.7630 -22.5164 -22.5164 -22.4902 -22.4902 -21.9162 -21.9162 -21.8857 -21.8857 -21.8402 -21.8402 -21.6612 -21.6612 0.2566 0.2566 0.9451 0.9451 6.4673 6.4673 7.4302 7.4302 7.9244 7.9244 8.7789 8.7789 8.8621 8.8621 10.1944 10.1944 10.2366 10.2366 12.1679 12.1679 12.4722 12.4722 12.8910 12.8910 12.9615 12.9615 k = 0.3900 0.2252-0.0000 ( 5745 PWs) bands (ev): -45.7863 -45.7863 -45.7629 -45.7629 -22.5169 -22.5169 -22.4909 -22.4909 -21.9171 -21.9171 -21.8866 -21.8866 -21.8400 -21.8400 -21.6612 -21.6612 0.3122 0.3122 0.9439 0.9439 6.3754 6.3754 7.5006 7.5006 7.9018 7.9018 8.7649 8.7649 8.8251 8.8251 10.1768 10.1768 10.2391 10.2391 12.1495 12.1495 12.4944 12.4944 12.8675 12.8675 12.9705 12.9705 k = 0.4000 0.2309-0.0000 ( 5741 PWs) bands (ev): -45.7862 -45.7862 -45.7628 -45.7628 -22.5173 -22.5173 -22.4916 -22.4916 -21.9179 -21.9179 -21.8873 -21.8873 -21.8399 -21.8399 -21.6612 -21.6612 0.3662 0.3662 0.9415 0.9415 6.2893 6.2893 7.5688 7.5688 7.8817 7.8817 8.7469 8.7469 8.7943 8.7943 10.1596 10.1596 10.2425 10.2425 12.1316 12.1316 12.5142 12.5142 12.8449 12.8449 12.9785 12.9785 k = 0.4100 0.2367-0.0000 ( 5745 PWs) bands (ev): -45.7861 -45.7861 -45.7628 -45.7628 -22.5176 -22.5176 -22.4922 -22.4922 -21.9187 -21.9187 -21.8880 -21.8880 -21.8398 -21.8398 -21.6612 -21.6612 0.4183 0.4183 0.9378 0.9378 6.2096 6.2096 7.6341 7.6341 7.8640 7.8640 8.7219 8.7219 8.7727 8.7727 10.1433 10.1433 10.2464 10.2464 12.1144 12.1144 12.5317 12.5317 12.8237 12.8237 12.9854 12.9854 k = 0.4200 0.2425-0.0000 ( 5749 PWs) bands (ev): -45.7860 -45.7860 -45.7627 -45.7627 -22.5180 -22.5180 -22.4927 -22.4927 -21.9194 -21.9194 -21.8887 -21.8887 -21.8397 -21.8397 -21.6612 -21.6612 0.4681 0.4681 0.9326 0.9326 6.1367 6.1367 7.6958 7.6958 7.8491 7.8491 8.6920 8.6920 8.7585 8.7585 10.1280 10.1280 10.2506 10.2506 12.0981 12.0981 12.5468 12.5468 12.8041 12.8041 12.9912 12.9912 k = 0.4300 0.2483-0.0000 ( 5755 PWs) bands (ev): -45.7860 -45.7860 -45.7626 -45.7626 -22.5183 -22.5183 -22.4932 -22.4932 -21.9200 -21.9200 -21.8893 -21.8893 -21.8397 -21.8397 -21.6612 -21.6612 0.5153 0.5153 0.9258 0.9258 6.0712 6.0712 7.7515 7.7515 7.8385 7.8385 8.6608 8.6608 8.7480 8.7480 10.1141 10.1141 10.2548 10.2548 12.0829 12.0829 12.5598 12.5598 12.7864 12.7864 12.9961 12.9961 k = 0.4400 0.2540-0.0000 ( 5755 PWs) bands (ev): -45.7859 -45.7859 -45.7626 -45.7626 -22.5185 -22.5185 -22.4937 -22.4937 -21.9205 -21.9205 -21.8898 -21.8898 -21.8396 -21.8396 -21.6612 -21.6612 0.5596 0.5596 0.9175 0.9175 6.0133 6.0133 7.7915 7.7915 7.8413 7.8413 8.6305 8.6305 8.7396 8.7396 10.1016 10.1016 10.2588 10.2588 12.0691 12.0691 12.5706 12.5706 12.7706 12.7706 13.0002 13.0002 k = 0.4500 0.2598-0.0000 ( 5751 PWs) bands (ev): -45.7858 -45.7858 -45.7625 -45.7625 -22.5187 -22.5187 -22.4941 -22.4941 -21.9210 -21.9210 -21.8902 -21.8902 -21.8395 -21.8395 -21.6613 -21.6613 0.6007 0.6007 0.9076 0.9076 5.9637 5.9637 7.7987 7.7987 7.8738 7.8738 8.6020 8.6020 8.7328 8.7328 10.0907 10.0907 10.2625 10.2625 12.0570 12.0570 12.5795 12.5795 12.7570 12.7570 13.0035 13.0035 k = 0.4600 0.2656-0.0000 ( 5751 PWs) bands (ev): -45.7858 -45.7858 -45.7625 -45.7625 -22.5189 -22.5189 -22.4944 -22.4944 -21.9214 -21.9214 -21.8905 -21.8905 -21.8395 -21.8395 -21.6613 -21.6613 0.6379 0.6379 0.8963 0.8963 5.9225 5.9225 7.7942 7.7942 7.9136 7.9136 8.5762 8.5762 8.7273 8.7273 10.0816 10.0816 10.2658 10.2658 12.0466 12.0466 12.5866 12.5866 12.7458 12.7458 13.0061 13.0061 k = 0.4700 0.2714-0.0000 ( 5757 PWs) bands (ev): -45.7858 -45.7858 -45.7624 -45.7624 -22.5191 -22.5191 -22.4946 -22.4946 -21.9217 -21.9217 -21.8908 -21.8908 -21.8394 -21.8394 -21.6613 -21.6613 0.6704 0.6704 0.8843 0.8843 5.8901 5.8901 7.7891 7.7891 7.9487 7.9487 8.5541 8.5541 8.7230 8.7230 10.0744 10.0744 10.2684 10.2684 12.0383 12.0383 12.5919 12.5919 12.7369 12.7369 13.0080 13.0080 k = 0.4800 0.2771-0.0000 ( 5755 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5192 -22.5192 -22.4948 -22.4948 -21.9219 -21.9219 -21.8910 -21.8910 -21.8394 -21.8394 -21.6613 -21.6613 0.6970 0.6970 0.8725 0.8725 5.8668 5.8668 7.7852 7.7852 7.9757 7.9757 8.5368 8.5368 8.7199 8.7199 10.0692 10.0692 10.2704 10.2704 12.0322 12.0322 12.5957 12.5957 12.7305 12.7305 13.0094 13.0094 k = 0.4900 0.2829-0.0000 ( 5763 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5192 -22.5192 -22.4949 -22.4949 -21.9220 -21.9220 -21.8911 -21.8911 -21.8394 -21.8394 -21.6613 -21.6613 0.7153 0.7153 0.8632 0.8632 5.8528 5.8528 7.7827 7.7827 7.9928 7.9928 8.5257 8.5257 8.7181 8.7181 10.0660 10.0660 10.2716 10.2716 12.0284 12.0284 12.5979 12.5979 12.7266 12.7266 13.0102 13.0102 k = 0.5000 0.2887-0.0000 ( 5762 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4949 -22.4949 -21.9221 -21.9221 -21.8912 -21.8912 -21.8394 -21.8394 -21.6613 -21.6613 0.7220 0.7220 0.8596 0.8596 5.8481 5.8481 7.7819 7.7819 7.9987 7.9987 8.5219 8.5219 8.7175 8.7175 10.0649 10.0649 10.2720 10.2720 12.0272 12.0272 12.5986 12.5986 12.7253 12.7253 13.0104 13.0105 k = 0.5000 0.2887-0.0000 ( 5762 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4949 -22.4949 -21.9221 -21.9221 -21.8912 -21.8912 -21.8394 -21.8394 -21.6613 -21.6613 0.7220 0.7220 0.8596 0.8596 5.8481 5.8481 7.7819 7.7819 7.9987 7.9987 8.5219 8.5219 8.7175 8.7175 10.0649 10.0649 10.2720 10.2720 12.0272 12.0272 12.5986 12.5986 12.7253 12.7253 13.0104 13.0104 k = 0.4943 0.2986-0.0000 ( 5758 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4949 -22.4949 -21.9221 -21.9221 -21.8912 -21.8912 -21.8394 -21.8394 -21.6613 -21.6613 0.7226 0.7226 0.8598 0.8598 5.8494 5.8494 7.7793 7.7793 7.9998 7.9998 8.5214 8.5214 8.7199 8.7199 10.0137 10.0137 10.3199 10.3199 12.0279 12.0279 12.6000 12.6000 12.7248 12.7248 13.0099 13.0099 k = 0.4885 0.3086-0.0000 ( 5754 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4949 -22.4949 -21.9221 -21.9221 -21.8912 -21.8912 -21.8394 -21.8394 -21.6613 -21.6613 0.7246 0.7246 0.8604 0.8604 5.8533 5.8533 7.7717 7.7717 8.0031 8.0031 8.5199 8.5199 8.7270 8.7270 9.9139 9.9139 10.4100 10.4100 12.0300 12.0300 12.6039 12.6039 12.7231 12.7231 13.0080 13.0080 k = 0.4828 0.3185-0.0000 ( 5762 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4950 -22.4950 -21.9222 -21.9222 -21.8912 -21.8912 -21.8395 -21.8395 -21.6613 -21.6613 0.7280 0.7280 0.8615 0.8615 5.8597 5.8597 7.7594 7.7594 8.0085 8.0085 8.5174 8.5174 8.7385 8.7385 9.8008 9.8008 10.5069 10.5069 12.0334 12.0334 12.6104 12.6104 12.7203 12.7203 13.0050 13.0050 k = 0.4770 0.3285-0.0000 ( 5762 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4950 -22.4950 -21.9223 -21.9223 -21.8912 -21.8912 -21.8396 -21.8396 -21.6613 -21.6613 0.7326 0.7326 0.8629 0.8629 5.8687 5.8687 7.7428 7.7428 8.0159 8.0159 8.5141 8.5141 8.7539 8.7539 9.6820 9.6820 10.6033 10.6033 12.0383 12.0383 12.6192 12.6192 12.7164 12.7164 13.0006 13.0006 k = 0.4713 0.3384-0.0000 ( 5746 PWs) bands (ev): -45.7857 -45.7857 -45.7623 -45.7623 -22.5194 -22.5194 -22.4951 -22.4951 -21.9225 -21.9225 -21.8912 -21.8912 -21.8396 -21.8396 -21.6613 -21.6613 0.7385 0.7385 0.8648 0.8648 5.8803 5.8803 7.7225 7.7225 8.0254 8.0254 8.5099 8.5099 8.7727 8.7727 9.5598 9.5598 10.6974 10.6974 12.0445 12.0445 12.6300 12.6300 12.7114 12.7114 12.9949 12.9949 k = 0.4655 0.3484-0.0000 ( 5736 PWs) bands (ev): -45.7857 -45.7857 -45.7623 -45.7623 -22.5194 -22.5194 -22.4952 -22.4952 -21.9226 -21.9226 -21.8913 -21.8913 -21.8398 -21.8398 -21.6613 -21.6613 0.7456 0.7456 0.8671 0.8671 5.8944 5.8944 7.6991 7.6991 8.0367 8.0367 8.5049 8.5049 8.7941 8.7941 9.4352 9.4352 10.7883 10.7883 12.0521 12.0521 12.6422 12.6422 12.7056 12.7056 12.9877 12.9877 k = 0.4598 0.3584-0.0000 ( 5740 PWs) bands (ev): -45.7856 -45.7856 -45.7623 -45.7623 -22.5195 -22.5195 -22.4953 -22.4953 -21.9228 -21.9228 -21.8913 -21.8913 -21.8399 -21.8399 -21.6613 -21.6613 0.7539 0.7539 0.8698 0.8698 5.9111 5.9111 7.6732 7.6732 8.0499 8.0499 8.4991 8.4991 8.8175 8.8175 9.3092 9.3092 10.8759 10.8759 12.0610 12.0610 12.6552 12.6552 12.6990 12.6990 12.9791 12.9791 k = 0.4540 0.3683-0.0000 ( 5748 PWs) bands (ev): -45.7856 -45.7856 -45.7623 -45.7623 -22.5196 -22.5196 -22.4954 -22.4954 -21.9231 -21.9231 -21.8914 -21.8914 -21.8400 -21.8400 -21.6614 -21.6614 0.7633 0.7633 0.8728 0.8728 5.9302 5.9302 7.6452 7.6452 8.0647 8.0647 8.4927 8.4927 8.8423 8.8423 9.1824 9.1824 10.9599 10.9599 12.0712 12.0712 12.6674 12.6674 12.6926 12.6926 12.9688 12.9688 k = 0.4483 0.3783-0.0000 ( 5752 PWs) bands (ev): -45.7856 -45.7856 -45.7623 -45.7623 -22.5196 -22.5196 -22.4955 -22.4955 -21.9233 -21.9233 -21.8914 -21.8914 -21.8402 -21.8402 -21.6614 -21.6614 0.7737 0.7737 0.8762 0.8762 5.9518 5.9518 7.6158 7.6158 8.0811 8.0811 8.4854 8.4854 8.8671 8.8671 9.0562 9.0562 11.0404 11.0404 12.0828 12.0828 12.6729 12.6729 12.6914 12.6914 12.9569 12.9569 k = 0.4425 0.3882-0.0000 ( 5752 PWs) bands (ev): -45.7856 -45.7856 -45.7622 -45.7622 -22.5197 -22.5197 -22.4956 -22.4956 -21.9236 -21.9236 -21.8915 -21.8915 -21.8403 -21.8403 -21.6614 -21.6614 0.7850 0.7850 0.8799 0.8799 5.9758 5.9758 7.5853 7.5853 8.0990 8.0990 8.4772 8.4772 8.8828 8.8828 8.9401 8.9401 11.1175 11.1175 12.0956 12.0956 12.6670 12.6670 12.6995 12.6995 12.9432 12.9432 k = 0.4368 0.3982-0.0000 ( 5744 PWs) bands (ev): -45.7855 -45.7855 -45.7622 -45.7622 -22.5198 -22.5198 -22.4958 -22.4958 -21.9239 -21.9239 -21.8915 -21.8915 -21.8405 -21.8405 -21.6615 -21.6615 0.7972 0.7972 0.8840 0.8840 6.0021 6.0021 7.5541 7.5541 8.1182 8.1182 8.4676 8.4676 8.7947 8.7947 8.9293 8.9293 11.1914 11.1914 12.1097 12.1097 12.6572 12.6572 12.7083 12.7083 12.9278 12.9278 k = 0.4310 0.4081-0.0000 ( 5738 PWs) bands (ev): -45.7855 -45.7855 -45.7622 -45.7622 -22.5199 -22.5199 -22.4959 -22.4959 -21.9242 -21.9242 -21.8916 -21.8916 -21.8407 -21.8407 -21.6615 -21.6615 0.8100 0.8100 0.8883 0.8883 6.0308 6.0308 7.5227 7.5227 8.1386 8.1386 8.4549 8.4549 8.6748 8.6748 8.9537 8.9537 11.2621 11.2621 12.1249 12.1249 12.6461 12.6461 12.7145 12.7145 12.9107 12.9107 k = 0.4253 0.4181-0.0000 ( 5746 PWs) bands (ev): -45.7855 -45.7855 -45.7622 -45.7622 -22.5200 -22.5200 -22.4961 -22.4961 -21.9245 -21.9245 -21.8917 -21.8917 -21.8408 -21.8408 -21.6615 -21.6615 0.8235 0.8235 0.8929 0.8929 6.0618 6.0618 7.4912 7.4912 8.1599 8.1599 8.4318 8.4318 8.5645 8.5645 8.9792 8.9792 11.3299 11.3299 12.1414 12.1414 12.6342 12.6342 12.7174 12.7174 12.8918 12.8918 k = 0.4195 0.4280-0.0000 ( 5746 PWs) bands (ev): -45.7854 -45.7854 -45.7621 -45.7621 -22.5201 -22.5201 -22.4962 -22.4962 -21.9248 -21.9248 -21.8918 -21.8918 -21.8410 -21.8410 -21.6616 -21.6616 0.8375 0.8375 0.8977 0.8977 6.0949 6.0949 7.4600 7.4600 8.1820 8.1820 8.3707 8.3707 8.4934 8.4934 9.0043 9.0043 11.3950 11.3950 12.1590 12.1590 12.6217 12.6217 12.7164 12.7164 12.8711 12.8711 k = 0.4138 0.4380-0.0000 ( 5754 PWs) bands (ev): -45.7854 -45.7854 -45.7621 -45.7621 -22.5202 -22.5202 -22.4964 -22.4964 -21.9251 -21.9251 -21.8919 -21.8919 -21.8412 -21.8412 -21.6616 -21.6616 0.8517 0.8517 0.9028 0.9028 6.1301 6.1301 7.4292 7.4292 8.2046 8.2046 8.2675 8.2675 8.4664 8.4664 9.0284 9.0284 11.4574 11.4574 12.1776 12.1776 12.6089 12.6089 12.7119 12.7119 12.8488 12.8488 k = 0.4080 0.4479-0.0000 ( 5748 PWs) bands (ev): -45.7854 -45.7854 -45.7621 -45.7621 -22.5203 -22.5203 -22.4966 -22.4966 -21.9255 -21.9255 -21.8920 -21.8920 -21.8414 -21.8414 -21.6616 -21.6616 0.8661 0.8661 0.9081 0.9081 6.1673 6.1673 7.3992 7.3992 8.1532 8.1532 8.2277 8.2277 8.4529 8.4529 9.0513 9.0513 11.5173 11.5173 12.1972 12.1972 12.5959 12.5959 12.7041 12.7041 12.8249 12.8249 k = 0.4023 0.4579-0.0000 ( 5736 PWs) bands (ev): -45.7853 -45.7853 -45.7620 -45.7620 -22.5204 -22.5204 -22.4967 -22.4967 -21.9258 -21.9258 -21.8921 -21.8921 -21.8415 -21.8415 -21.6617 -21.6617 0.8805 0.8805 0.9135 0.9135 6.2064 6.2064 7.3701 7.3701 8.0385 8.0385 8.2506 8.2506 8.4432 8.4432 9.0728 9.0728 11.5749 11.5749 12.2178 12.2178 12.5830 12.5830 12.6934 12.6934 12.7995 12.7995 k = 0.3966 0.4679-0.0000 ( 5736 PWs) bands (ev): -45.7853 -45.7853 -45.7620 -45.7620 -22.5205 -22.5205 -22.4969 -22.4969 -21.9261 -21.9261 -21.8922 -21.8922 -21.8417 -21.8417 -21.6617 -21.6617 0.8946 0.8946 0.9191 0.9191 6.2471 6.2471 7.3420 7.3420 7.9260 7.9260 8.2733 8.2733 8.4352 8.4352 9.0926 9.0926 11.6303 11.6303 12.2391 12.2391 12.5702 12.5702 12.6805 12.6805 12.7727 12.7727 k = 0.3908 0.4778-0.0000 ( 5734 PWs) bands (ev): -45.7853 -45.7853 -45.7620 -45.7620 -22.5206 -22.5206 -22.4971 -22.4971 -21.9264 -21.9264 -21.8923 -21.8923 -21.8418 -21.8418 -21.6617 -21.6617 0.9081 0.9081 0.9250 0.9250 6.2894 6.2894 7.3151 7.3151 7.8168 7.8168 8.2955 8.2955 8.4283 8.4283 9.1107 9.1107 11.6833 11.6833 12.2612 12.2612 12.5578 12.5578 12.6658 12.6658 12.7447 12.7447 k = 0.3851 0.4878-0.0000 ( 5726 PWs) bands (ev): -45.7852 -45.7852 -45.7619 -45.7619 -22.5207 -22.5207 -22.4972 -22.4972 -21.9267 -21.9267 -21.8925 -21.8925 -21.8419 -21.8419 -21.6618 -21.6618 0.9206 0.9206 0.9313 0.9313 6.3329 6.3329 7.2894 7.2894 7.7121 7.7121 8.3167 8.3167 8.4225 8.4225 9.1269 9.1269 11.7342 11.7342 12.2839 12.2839 12.5459 12.5459 12.6496 12.6496 12.7159 12.7159 k = 0.3793 0.4977-0.0000 ( 5730 PWs) bands (ev): -45.7852 -45.7852 -45.7619 -45.7619 -22.5208 -22.5208 -22.4974 -22.4974 -21.9270 -21.9270 -21.8926 -21.8926 -21.8421 -21.8421 -21.6618 -21.6618 0.9310 0.9310 0.9389 0.9389 6.3772 6.3772 7.2651 7.2651 7.6126 7.6126 8.3367 8.3367 8.4175 8.4175 9.1411 9.1411 11.7826 11.7826 12.3070 12.3070 12.5348 12.5348 12.6324 12.6324 12.6864 12.6864 k = 0.3736 0.5077-0.0000 ( 5730 PWs) bands (ev): -45.7852 -45.7852 -45.7619 -45.7619 -22.5209 -22.5209 -22.4975 -22.4975 -21.9273 -21.9273 -21.8927 -21.8927 -21.8422 -21.8422 -21.6618 -21.6618 0.9386 0.9386 0.9482 0.9482 6.4219 6.4219 7.2419 7.2419 7.5195 7.5195 8.3550 8.3550 8.4136 8.4136 9.1535 9.1535 11.8284 11.8284 12.3303 12.3303 12.5244 12.5244 12.6145 12.6145 12.6567 12.6567 k = 0.3678 0.5176-0.0000 ( 5734 PWs) bands (ev): -45.7851 -45.7851 -45.7619 -45.7619 -22.5210 -22.5210 -22.4977 -22.4977 -21.9275 -21.9275 -21.8928 -21.8928 -21.8423 -21.8423 -21.6618 -21.6618 0.9448 0.9448 0.9576 0.9576 6.4663 6.4663 7.2197 7.2197 7.4340 7.4340 8.3711 8.3711 8.4109 8.4109 9.1639 9.1639 11.8713 11.8713 12.3535 12.3535 12.5150 12.5150 12.5961 12.5961 12.6276 12.6276 k = 0.3621 0.5276-0.0000 ( 5730 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5210 -22.5210 -22.4978 -22.4978 -21.9277 -21.9277 -21.8929 -21.8929 -21.8423 -21.8423 -21.6619 -21.6619 0.9504 0.9504 0.9659 0.9659 6.5094 6.5094 7.1979 7.1979 7.3584 7.3584 8.3843 8.3843 8.4099 8.4099 9.1725 9.1725 11.9108 11.9108 12.3765 12.3765 12.5065 12.5065 12.5776 12.5776 12.5997 12.5997 k = 0.3563 0.5375-0.0000 ( 5728 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5211 -22.5211 -22.4979 -22.4979 -21.9279 -21.9279 -21.8930 -21.8930 -21.8424 -21.8424 -21.6619 -21.6619 0.9557 0.9557 0.9726 0.9726 6.5497 6.5497 7.1754 7.1754 7.2953 7.2953 8.3934 8.3934 8.4114 8.4114 9.1792 9.1792 11.9459 11.9459 12.3988 12.3988 12.4988 12.4988 12.5592 12.5592 12.5743 12.5743 k = 0.3506 0.5475-0.0000 ( 5726 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4980 -22.4980 -21.9280 -21.9280 -21.8930 -21.8930 -21.8424 -21.8424 -21.6619 -21.6619 0.9607 0.9607 0.9774 0.9774 6.5851 6.5851 7.1512 7.1512 7.2484 7.2484 8.3982 8.3982 8.4153 8.4153 9.1842 9.1842 11.9758 11.9758 12.4200 12.4200 12.4916 12.4916 12.5415 12.5415 12.5529 12.5529 k = 0.3448 0.5574-0.0000 ( 5726 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4980 -22.4980 -21.9281 -21.9281 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9654 0.9654 0.9800 0.9800 6.6130 6.6130 7.1273 7.1273 7.2185 7.2185 8.4009 8.4009 8.4192 8.4192 9.1875 9.1875 11.9988 11.9988 12.4392 12.4392 12.4847 12.4847 12.5251 12.5251 12.5371 12.5371 k = 0.3391 0.5674-0.0000 ( 5732 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9694 0.9694 0.9806 0.9806 6.6306 6.6306 7.1102 7.1102 7.2024 7.2024 8.4031 8.4031 8.4211 8.4211 9.1894 9.1894 12.0136 12.0136 12.4545 12.4545 12.4794 12.4794 12.5115 12.5115 12.5279 12.5279 k = 0.3333 0.5774-0.0000 ( 5736 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9714 0.9714 0.9802 0.9802 6.6363 6.6363 7.1045 7.1045 7.1971 7.1971 8.4043 8.4043 8.4213 8.4213 9.1900 9.1900 12.0188 12.0188 12.4609 12.4609 12.4774 12.4774 12.5053 12.5053 12.5251 12.5251 k = 0.3333 0.5774-0.0000 ( 5736 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9714 0.9714 0.9802 0.9802 6.6363 6.6363 7.1045 7.1045 7.1971 7.1971 8.4043 8.4043 8.4213 8.4213 9.1900 9.1900 12.0188 12.0188 12.4609 12.4609 12.4774 12.4774 12.5053 12.5053 12.5251 12.5251 k = 0.3276 0.5674-0.0000 ( 5730 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9684 0.9684 0.9815 0.9815 6.6314 6.6314 7.1087 7.1087 7.2031 7.2031 8.4017 8.4017 8.4224 8.4224 9.1895 9.1895 12.0136 12.0136 12.4553 12.4553 12.4796 12.4796 12.5108 12.5108 12.5277 12.5277 k = 0.3218 0.5574-0.0000 ( 5730 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4980 -22.4980 -21.9281 -21.9281 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9605 0.9605 0.9844 0.9844 6.6194 6.6194 7.1172 7.1172 7.2228 7.2228 8.3927 8.3927 8.4268 8.4268 9.1880 9.1880 11.9985 11.9985 12.4433 12.4433 12.4866 12.4866 12.5216 12.5216 12.5350 12.5350 k = 0.3161 0.5475-0.0000 ( 5730 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5211 -22.5211 -22.4979 -22.4979 -21.9280 -21.9280 -21.8930 -21.8930 -21.8424 -21.8424 -21.6619 -21.6619 0.9487 0.9487 0.9874 0.9874 6.6044 6.6044 7.1253 7.1253 7.2567 7.2567 8.3778 8.3778 8.4340 8.4340 9.1859 9.1859 11.9749 11.9749 12.4297 12.4297 12.4973 12.4973 12.5331 12.5331 12.5473 12.5473 k = 0.3103 0.5375-0.0000 ( 5738 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5211 -22.5211 -22.4978 -22.4978 -21.9278 -21.9278 -21.8929 -21.8929 -21.8424 -21.8424 -21.6619 -21.6619 0.9335 0.9335 0.9902 0.9902 6.5897 6.5897 7.1327 7.1327 7.3020 7.3020 8.3576 8.3576 8.4432 8.4432 9.1832 9.1832 11.9443 11.9443 12.4160 12.4160 12.5096 12.5096 12.5439 12.5439 12.5649 12.5649 k = 0.3046 0.5276-0.0000 ( 5730 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5210 -22.5210 -22.4977 -22.4977 -21.9276 -21.9276 -21.8928 -21.8928 -21.8424 -21.8424 -21.6619 -21.6619 0.9146 0.9146 0.9926 0.9926 6.5779 6.5779 7.1405 7.1405 7.3549 7.3549 8.3322 8.3322 8.4543 8.4543 9.1803 9.1803 11.9082 11.9082 12.4029 12.4029 12.5226 12.5226 12.5538 12.5538 12.5873 12.5873 k = 0.2989 0.5176-0.0000 ( 5730 PWs) bands (ev): -45.7852 -45.7852 -45.7619 -45.7619 -22.5209 -22.5209 -22.4975 -22.4975 -21.9273 -21.9273 -21.8926 -21.8926 -21.8423 -21.8423 -21.6618 -21.6618 0.8923 0.8923 0.9947 0.9947 6.5704 6.5704 7.1496 7.1496 7.4131 7.4131 8.3019 8.3019 8.4671 8.4671 9.1774 9.1774 11.8682 11.8682 12.3905 12.3905 12.5359 12.5359 12.5632 12.5632 12.6130 12.6130 k = 0.2931 0.5077-0.0000 ( 5730 PWs) bands (ev): -45.7852 -45.7852 -45.7619 -45.7619 -22.5207 -22.5207 -22.4973 -22.4973 -21.9270 -21.9270 -21.8923 -21.8923 -21.8423 -21.8423 -21.6618 -21.6618 0.8663 0.8663 0.9963 0.9963 6.5684 6.5684 7.1605 7.1605 7.4747 7.4747 8.2667 8.2667 8.4818 8.4818 9.1747 9.1747 11.8250 11.8250 12.3790 12.3790 12.5492 12.5492 12.5730 12.5730 12.6410 12.6410 k = 0.2874 0.4977-0.0000 ( 5730 PWs) bands (ev): -45.7853 -45.7853 -45.7620 -45.7620 -22.5206 -22.5206 -22.4970 -22.4970 -21.9266 -21.9266 -21.8921 -21.8921 -21.8422 -21.8422 -21.6618 -21.6618 0.8369 0.8369 0.9975 0.9975 6.5725 6.5725 7.1734 7.1734 7.5388 7.5388 8.2268 8.2268 8.4982 8.4982 9.1724 9.1724 11.7796 11.7796 12.3685 12.3685 12.5614 12.5614 12.5844 12.5844 12.6701 12.6701 k = 0.2816 0.4878-0.0000 ( 5736 PWs) bands (ev): -45.7853 -45.7853 -45.7620 -45.7620 -22.5204 -22.5204 -22.4967 -22.4967 -21.9261 -21.9261 -21.8918 -21.8918 -21.8422 -21.8422 -21.6618 -21.6618 0.8040 0.8040 0.9982 0.9982 6.5832 6.5832 7.1885 7.1885 7.6043 7.6043 8.1825 8.1825 8.5165 8.5165 9.1707 9.1707 11.7325 11.7325 12.3590 12.3590 12.5719 12.5719 12.5988 12.5988 12.6996 12.6996 k = 0.2759 0.4778-0.0000 ( 5728 PWs) bands (ev): -45.7854 -45.7854 -45.7621 -45.7621 -22.5202 -22.5202 -22.4963 -22.4963 -21.9256 -21.9256 -21.8914 -21.8914 -21.8421 -21.8421 -21.6618 -21.6618 0.7678 0.7678 0.9985 0.9985 6.6005 6.6005 7.2057 7.2057 7.6706 7.6706 8.1343 8.1343 8.5366 8.5366 9.1700 9.1700 11.6842 11.6842 12.3507 12.3507 12.5806 12.5806 12.6162 12.6162 12.7289 12.7289 k = 0.2701 0.4679-0.0000 ( 5728 PWs) bands (ev): -45.7854 -45.7854 -45.7621 -45.7621 -22.5199 -22.5199 -22.4959 -22.4959 -21.9250 -21.9250 -21.8910 -21.8910 -21.8421 -21.8421 -21.6617 -21.6617 0.7284 0.7284 0.9982 0.9982 6.6248 6.6248 7.2252 7.2252 7.7367 7.7367 8.0828 8.0828 8.5586 8.5586 9.1703 9.1703 11.6351 11.6351 12.3434 12.3434 12.5882 12.5882 12.6358 12.6358 12.7576 12.7576 k = 0.2644 0.4579-0.0000 ( 5728 PWs) bands (ev): -45.7855 -45.7855 -45.7622 -45.7622 -22.5196 -22.5196 -22.4955 -22.4955 -21.9244 -21.9244 -21.8905 -21.8905 -21.8420 -21.8420 -21.6617 -21.6617 0.6860 0.6860 0.9975 0.9975 6.6558 6.6558 7.2469 7.2469 7.8007 7.8007 8.0299 8.0299 8.5825 8.5825 9.1719 9.1719 11.5855 11.5855 12.3373 12.3373 12.5953 12.5953 12.6572 12.6572 12.7853 12.7853 k = 0.2586 0.4479-0.0000 ( 5724 PWs) bands (ev): -45.7856 -45.7856 -45.7623 -45.7623 -22.5193 -22.5193 -22.4950 -22.4950 -21.9237 -21.9237 -21.8900 -21.8900 -21.8420 -21.8420 -21.6617 -21.6617 0.6407 0.6407 0.9963 0.9963 6.6936 6.6936 7.2707 7.2707 7.8549 7.8549 7.9833 7.9833 8.6083 8.6083 9.1751 9.1751 11.5356 11.5356 12.3324 12.3324 12.6017 12.6017 12.6802 12.6802 12.8117 12.8117 k = 0.2529 0.4380-0.0000 ( 5728 PWs) bands (ev): -45.7857 -45.7857 -45.7623 -45.7623 -22.5190 -22.5190 -22.4945 -22.4945 -21.9229 -21.9229 -21.8894 -21.8894 -21.8419 -21.8419 -21.6617 -21.6617 0.5928 0.5928 0.9945 0.9945 6.7381 6.7381 7.2965 7.2965 7.8615 7.8615 7.9809 7.9809 8.6362 8.6362 9.1800 9.1800 11.4858 11.4858 12.3286 12.3286 12.6073 12.6073 12.7045 12.7045 12.8365 12.8365 k = 0.2471 0.4280-0.0000 ( 5732 PWs) bands (ev): -45.7858 -45.7858 -45.7624 -45.7624 -22.5187 -22.5187 -22.4939 -22.4939 -21.9221 -21.9221 -21.8888 -21.8888 -21.8419 -21.8419 -21.6616 -21.6616 0.5425 0.5425 0.9923 0.9923 6.7890 6.7890 7.3242 7.3242 7.8124 7.8124 8.0309 8.0309 8.6660 8.6660 9.1868 9.1868 11.4361 11.4361 12.3260 12.3260 12.6117 12.6117 12.7299 12.7299 12.8594 12.8594 k = 0.2414 0.4181-0.0000 ( 5738 PWs) bands (ev): -45.7859 -45.7859 -45.7625 -45.7625 -22.5183 -22.5183 -22.4933 -22.4933 -21.9212 -21.9212 -21.8882 -21.8882 -21.8419 -21.8419 -21.6616 -21.6616 0.4900 0.4900 0.9897 0.9897 6.8461 6.8461 7.3534 7.3534 7.7487 7.7487 8.0925 8.0925 8.6978 8.6978 9.1957 9.1957 11.3869 11.3869 12.3246 12.3246 12.6141 12.6141 12.7563 12.7563 12.8801 12.8801 k = 0.2356 0.4081-0.0000 ( 5734 PWs) bands (ev): -45.7860 -45.7860 -45.7626 -45.7626 -22.5179 -22.5179 -22.4926 -22.4926 -21.9203 -21.9203 -21.8874 -21.8874 -21.8418 -21.8418 -21.6616 -21.6616 0.4357 0.4357 0.9865 0.9865 6.9093 6.9093 7.3838 7.3838 7.6809 7.6809 8.1558 8.1558 8.7316 8.7316 9.2068 9.2068 11.3382 11.3382 12.3243 12.3243 12.6136 12.6136 12.7835 12.7835 12.8984 12.8984 k = 0.2299 0.3982-0.0000 ( 5734 PWs) bands (ev): -45.7861 -45.7861 -45.7627 -45.7627 -22.5175 -22.5175 -22.4919 -22.4919 -21.9193 -21.9193 -21.8867 -21.8867 -21.8418 -21.8418 -21.6615 -21.6615 0.3796 0.3796 0.9830 0.9830 6.9783 6.9783 7.4138 7.4138 7.6124 7.6124 8.2187 8.2187 8.7675 8.7675 9.2204 9.2204 11.2903 11.2903 12.3252 12.3252 12.6089 12.6089 12.8114 12.8114 12.9139 12.9139 k = 0.2241 0.3882-0.0000 ( 5720 PWs) bands (ev): -45.7862 -45.7862 -45.7628 -45.7628 -22.5170 -22.5170 -22.4911 -22.4911 -21.9183 -21.9183 -21.8859 -21.8859 -21.8418 -21.8418 -21.6615 -21.6615 0.3221 0.3221 0.9790 0.9790 7.0527 7.0527 7.4368 7.4368 7.5506 7.5506 8.2805 8.2805 8.8055 8.8055 9.2365 9.2365 11.2433 11.2433 12.3272 12.3272 12.5986 12.5986 12.8396 12.8396 12.9251 12.9251 k = 0.2184 0.3783-0.0000 ( 5720 PWs) bands (ev): -45.7863 -45.7863 -45.7630 -45.7630 -22.5165 -22.5165 -22.4903 -22.4903 -21.9172 -21.9172 -21.8850 -21.8850 -21.8418 -21.8418 -21.6615 -21.6615 0.2635 0.2635 0.9746 0.9746 7.1324 7.1324 7.4213 7.4213 7.5274 7.5274 8.3407 8.3407 8.8455 8.8455 9.2553 9.2553 11.1975 11.1975 12.3302 12.3302 12.5817 12.5817 12.8674 12.8674 12.9153 12.9153 k = 0.2126 0.3683-0.0000 ( 5712 PWs) bands (ev): -45.7865 -45.7865 -45.7631 -45.7631 -22.5160 -22.5160 -22.4895 -22.4895 -21.9161 -21.9161 -21.8841 -21.8841 -21.8418 -21.8418 -21.6615 -21.6615 0.2039 0.2039 0.9698 0.9698 7.2169 7.2169 7.3601 7.3601 7.5504 7.5504 8.3990 8.3990 8.8876 8.8876 9.2770 9.2770 11.1528 11.1528 12.3344 12.3344 12.5577 12.5577 12.8892 12.8892 12.9056 12.9056 k = 0.2069 0.3584-0.0000 ( 5716 PWs) bands (ev): -45.7866 -45.7866 -45.7632 -45.7632 -22.5155 -22.5155 -22.4886 -22.4886 -21.9149 -21.9149 -21.8831 -21.8831 -21.8418 -21.8418 -21.6614 -21.6614 0.1437 0.1437 0.9646 0.9646 7.2870 7.2870 7.3061 7.3061 7.5860 7.5860 8.4552 8.4552 8.9319 8.9319 9.3016 9.3016 11.1095 11.1095 12.3395 12.3395 12.5274 12.5274 12.8874 12.8874 12.9219 12.9219 k = 0.2011 0.3484-0.0000 ( 5720 PWs) bands (ev): -45.7867 -45.7867 -45.7633 -45.7633 -22.5150 -22.5150 -22.4877 -22.4877 -21.9137 -21.9137 -21.8821 -21.8821 -21.8418 -21.8418 -21.6614 -21.6614 0.0830 0.0830 0.9591 0.9591 7.2108 7.2108 7.3995 7.3995 7.6254 7.6254 8.5090 8.5090 8.9782 8.9782 9.3294 9.3294 11.0677 11.0677 12.3455 12.3455 12.4920 12.4920 12.8848 12.8848 12.9337 12.9337 k = 0.1954 0.3384-0.0000 ( 5718 PWs) bands (ev): -45.7869 -45.7869 -45.7635 -45.7635 -22.5144 -22.5144 -22.4868 -22.4868 -21.9124 -21.9124 -21.8811 -21.8811 -21.8419 -21.8419 -21.6614 -21.6614 0.0220 0.0220 0.9533 0.9533 7.1336 7.1336 7.4968 7.4968 7.6670 7.6670 8.5604 8.5604 9.0266 9.0266 9.3602 9.3602 11.0275 11.0275 12.3523 12.3523 12.4530 12.4530 12.8859 12.8859 12.9347 12.9347 k = 0.1897 0.3285-0.0000 ( 5718 PWs) bands (ev): -45.7870 -45.7870 -45.7636 -45.7636 -22.5138 -22.5138 -22.4858 -22.4858 -21.9111 -21.9111 -21.8800 -21.8800 -21.8419 -21.8419 -21.6613 -21.6613 -0.0391 -0.0391 0.9472 0.9472 7.0561 7.0561 7.5972 7.5972 7.7105 7.7105 8.6092 8.6092 9.0772 9.0772 9.3943 9.3943 10.9891 10.9891 12.3591 12.3591 12.4124 12.4124 12.8900 12.8900 12.9299 12.9299 k = 0.1839 0.3185-0.0000 ( 5720 PWs) bands (ev): -45.7872 -45.7872 -45.7638 -45.7638 -22.5132 -22.5132 -22.4848 -22.4848 -21.9098 -21.9098 -21.8789 -21.8789 -21.8420 -21.8420 -21.6613 -21.6613 -0.1000 -0.1000 0.9408 0.9408 6.9788 6.9788 7.6991 7.6991 7.7567 7.7567 8.6554 8.6554 9.1298 9.1298 9.4317 9.4317 10.9526 10.9526 12.3567 12.3567 12.3804 12.3804 12.8960 12.8960 12.9213 12.9213 k = 0.1782 0.3086-0.0000 ( 5714 PWs) bands (ev): -45.7874 -45.7874 -45.7639 -45.7639 -22.5127 -22.5127 -22.4838 -22.4838 -21.9085 -21.9085 -21.8777 -21.8777 -21.8420 -21.8420 -21.6613 -21.6613 -0.1605 -0.1605 0.9342 0.9342 6.9019 6.9019 7.7858 7.7858 7.8216 7.8216 8.6990 8.6990 9.1846 9.1846 9.4725 9.4725 10.9180 10.9180 12.3198 12.3198 12.3827 12.3827 12.9026 12.9026 12.9104 12.9104 k = 0.1724 0.2986-0.0000 ( 5718 PWs) bands (ev): -45.7875 -45.7875 -45.7641 -45.7641 -22.5120 -22.5120 -22.4828 -22.4828 -21.9071 -21.9071 -21.8766 -21.8766 -21.8421 -21.8421 -21.6612 -21.6612 -0.2206 -0.2206 0.9274 0.9274 6.8257 6.8257 7.8378 7.8378 7.9241 7.9241 8.7402 8.7402 9.2415 9.2415 9.5165 9.5165 10.8855 10.8855 12.2762 12.2762 12.3921 12.3921 12.8943 12.8943 12.9127 12.9127 k = 0.1667 0.2887-0.0000 ( 5710 PWs) bands (ev): -45.7877 -45.7877 -45.7642 -45.7642 -22.5114 -22.5114 -22.4818 -22.4818 -21.9057 -21.9057 -21.8754 -21.8754 -21.8422 -21.8422 -21.6612 -21.6612 -0.2799 -0.2799 0.9205 0.9205 6.7505 6.7505 7.8845 7.8845 8.0339 8.0339 8.7793 8.7793 9.3006 9.3006 9.5640 9.5640 10.8551 10.8551 12.2320 12.2320 12.4028 12.4028 12.8780 12.8780 12.9213 12.9213 k = 0.1609 0.2787-0.0000 ( 5714 PWs) bands (ev): -45.7878 -45.7878 -45.7644 -45.7644 -22.5108 -22.5108 -22.4807 -22.4807 -21.9043 -21.9043 -21.8742 -21.8742 -21.8423 -21.8423 -21.6612 -21.6612 -0.3385 -0.3385 0.9134 0.9134 6.6765 6.6765 7.9306 7.9306 8.1453 8.1453 8.8168 8.8168 9.3617 9.3617 9.6147 9.6147 10.8269 10.8269 12.1879 12.1879 12.4143 12.4143 12.8596 12.8596 12.9305 12.9305 k = 0.1552 0.2688-0.0000 ( 5718 PWs) bands (ev): -45.7880 -45.7880 -45.7645 -45.7645 -22.5102 -22.5102 -22.4797 -22.4797 -21.9029 -21.9029 -21.8729 -21.8729 -21.8423 -21.8423 -21.6611 -21.6611 -0.3961 -0.3961 0.9062 0.9062 6.6037 6.6037 7.9766 7.9766 8.2564 8.2564 8.8536 8.8536 9.4250 9.4250 9.6687 9.6687 10.8010 10.8010 12.1443 12.1443 12.4263 12.4263 12.8397 12.8397 12.9398 12.9398 k = 0.1494 0.2588-0.0000 ( 5710 PWs) bands (ev): -45.7882 -45.7882 -45.7647 -45.7647 -22.5096 -22.5096 -22.4786 -22.4786 -21.9015 -21.9015 -21.8717 -21.8717 -21.8424 -21.8424 -21.6611 -21.6611 -0.4525 -0.4525 0.8989 0.8989 6.5325 6.5325 8.0224 8.0224 8.3655 8.3655 8.8912 8.8912 9.4903 9.4903 9.7259 9.7259 10.7776 10.7776 12.1014 12.1014 12.4387 12.4387 12.8186 12.8186 12.9490 12.9490 k = 0.1437 0.2489-0.0000 ( 5718 PWs) bands (ev): -45.7883 -45.7883 -45.7648 -45.7648 -22.5089 -22.5089 -22.4775 -22.4775 -21.9001 -21.9001 -21.8704 -21.8704 -21.8425 -21.8425 -21.6611 -21.6611 -0.5078 -0.5078 0.8916 0.8916 6.4629 6.4629 8.0680 8.0680 8.4697 8.4697 8.9319 8.9319 9.5577 9.5577 9.7862 9.7862 10.7566 10.7566 12.0593 12.0593 12.4513 12.4513 12.7967 12.7967 12.9581 12.9581 k = 0.1379 0.2389-0.0000 ( 5710 PWs) bands (ev): -45.7885 -45.7885 -45.7650 -45.7650 -22.5083 -22.5083 -22.4765 -22.4765 -21.8987 -21.8987 -21.8692 -21.8692 -21.8426 -21.8426 -21.6610 -21.6610 -0.5616 -0.5616 0.8843 0.8843 6.3951 6.3951 8.1133 8.1133 8.5650 8.5650 8.9795 8.9795 9.6272 9.6272 9.8494 9.8494 10.7381 10.7381 12.0182 12.0182 12.4642 12.4642 12.7742 12.7742 12.9670 12.9670 k = 0.1322 0.2289-0.0000 ( 5704 PWs) bands (ev): -45.7887 -45.7887 -45.7651 -45.7651 -22.5077 -22.5077 -22.4754 -22.4754 -21.8973 -21.8973 -21.8679 -21.8679 -21.8427 -21.8427 -21.6610 -21.6610 -0.6141 -0.6141 0.8771 0.8771 6.3292 6.3292 8.1581 8.1581 8.6467 8.6467 9.0383 9.0383 9.6986 9.6986 9.9155 9.9155 10.7224 10.7224 11.9781 11.9781 12.4770 12.4770 12.7515 12.7515 12.9755 12.9755 k = 0.1264 0.2190-0.0000 ( 5722 PWs) bands (ev): -45.7888 -45.7888 -45.7653 -45.7653 -22.5071 -22.5071 -22.4744 -22.4744 -21.8959 -21.8959 -21.8667 -21.8667 -21.8428 -21.8428 -21.6609 -21.6609 -0.6649 -0.6649 0.8699 0.8699 6.2654 6.2654 8.2025 8.2025 8.7111 8.7111 9.1118 9.1118 9.7720 9.7720 9.9842 9.9842 10.7096 10.7096 11.9393 11.9393 12.4896 12.4896 12.7289 12.7289 12.9837 12.9837 k = 0.1207 0.2090-0.0000 ( 5734 PWs) bands (ev): -45.7890 -45.7890 -45.7654 -45.7654 -22.5065 -22.5065 -22.4733 -22.4733 -21.8945 -21.8945 -21.8655 -21.8655 -21.8429 -21.8429 -21.6609 -21.6609 -0.7141 -0.7141 0.8627 0.8627 6.2037 6.2037 8.2462 8.2462 8.7579 8.7579 9.1996 9.1996 9.8473 9.8473 10.0554 10.0554 10.7000 10.7000 11.9017 11.9017 12.5018 12.5018 12.7066 12.7066 12.9916 12.9916 k = 0.1149 0.1991-0.0000 ( 5736 PWs) bands (ev): -45.7892 -45.7892 -45.7656 -45.7656 -22.5059 -22.5059 -22.4723 -22.4723 -21.8931 -21.8931 -21.8643 -21.8643 -21.8430 -21.8430 -21.6609 -21.6609 -0.7615 -0.7615 0.8557 0.8557 6.1442 6.1442 8.2891 8.2891 8.7904 8.7904 9.2979 9.2979 9.9243 9.9243 10.1288 10.1288 10.6939 10.6939 11.8654 11.8654 12.5134 12.5134 12.6850 12.6850 12.9990 12.9990 k = 0.1092 0.1891-0.0000 ( 5734 PWs) bands (ev): -45.7893 -45.7893 -45.7657 -45.7657 -22.5054 -22.5054 -22.4714 -22.4714 -21.8918 -21.8918 -21.8631 -21.8631 -21.8431 -21.8431 -21.6608 -21.6608 -0.8071 -0.8071 0.8489 0.8489 6.0871 6.0871 8.3312 8.3312 8.8127 8.8127 9.4021 9.4021 10.0031 10.0031 10.2042 10.2042 10.6918 10.6918 11.8305 11.8305 12.5239 12.5239 12.6644 12.6644 13.0061 13.0061 k = 0.1034 0.1792-0.0000 ( 5728 PWs) bands (ev): -45.7895 -45.7895 -45.7658 -45.7658 -22.5048 -22.5048 -22.4704 -22.4704 -21.8905 -21.8905 -21.8619 -21.8619 -21.8433 -21.8433 -21.6608 -21.6608 -0.8508 -0.8508 0.8422 0.8422 6.0324 6.0324 8.3723 8.3723 8.8278 8.8278 9.5082 9.5082 10.0834 10.0834 10.2813 10.2813 10.6944 10.6944 11.7971 11.7971 12.5328 12.5328 12.6453 12.6453 13.0127 13.0127 k = 0.0977 0.1692-0.0000 ( 5738 PWs) bands (ev): -45.7896 -45.7896 -45.7660 -45.7660 -22.5043 -22.5043 -22.4695 -22.4695 -21.8893 -21.8893 -21.8608 -21.8608 -21.8434 -21.8434 -21.6607 -21.6607 -0.8925 -0.8925 0.8357 0.8357 5.9802 5.9802 8.4123 8.4123 8.8379 8.8379 9.6129 9.6129 10.1651 10.1651 10.3598 10.3598 10.7027 10.7027 11.7653 11.7653 12.5390 12.5390 12.6287 12.6287 13.0188 13.0188 k = 0.0920 0.1593-0.0000 ( 5741 PWs) bands (ev): -45.7897 -45.7897 -45.7661 -45.7661 -22.5038 -22.5038 -22.4686 -22.4686 -21.8881 -21.8881 -21.8597 -21.8597 -21.8435 -21.8435 -21.6607 -21.6607 -0.9321 -0.9321 0.8294 0.8294 5.9307 5.9307 8.4510 8.4510 8.8444 8.8444 9.7135 9.7135 10.2481 10.2481 10.4392 10.4392 10.7176 10.7176 11.7349 11.7349 12.5410 12.5410 12.6158 12.6158 13.0245 13.0245 k = 0.0862 0.1493-0.0000 ( 5741 PWs) bands (ev): -45.7899 -45.7899 -45.7662 -45.7662 -22.5033 -22.5033 -22.4677 -22.4677 -21.8869 -21.8869 -21.8586 -21.8586 -21.8435 -21.8435 -21.6607 -21.6607 -0.9697 -0.9697 0.8234 0.8234 5.8838 5.8838 8.4884 8.4884 8.8482 8.8482 9.8075 9.8075 10.3321 10.3321 10.5194 10.5194 10.7405 10.7405 11.7062 11.7062 12.5374 12.5374 12.6079 12.6079 13.0296 13.0296 k = 0.0805 0.1394-0.0000 ( 5729 PWs) bands (ev): -45.7900 -45.7900 -45.7664 -45.7664 -22.5028 -22.5028 -22.4669 -22.4669 -21.8858 -21.8858 -21.8576 -21.8576 -21.8436 -21.8436 -21.6606 -21.6606 -1.0050 -1.0050 0.8177 0.8177 5.8396 5.8396 8.5241 8.5241 8.8502 8.8502 9.8926 9.8926 10.4171 10.4171 10.5997 10.5997 10.7725 10.7725 11.6792 11.6792 12.5280 12.5280 12.6045 12.6045 13.0306 13.0306 k = 0.0747 0.1294-0.0000 ( 5725 PWs) bands (ev): -45.7901 -45.7901 -45.7665 -45.7665 -22.5024 -22.5024 -22.4661 -22.4661 -21.8847 -21.8847 -21.8567 -21.8567 -21.8437 -21.8437 -21.6606 -21.6606 -1.0382 -1.0382 0.8122 0.8122 5.7982 5.7982 8.5581 8.5581 8.8508 8.8508 9.9669 9.9669 10.5030 10.5030 10.6799 10.6799 10.8144 10.8144 11.6539 11.6539 12.5147 12.5147 12.6034 12.6034 12.9980 12.9980 k = 0.0690 0.1195-0.0000 ( 5721 PWs) bands (ev): -45.7902 -45.7902 -45.7666 -45.7666 -22.5020 -22.5020 -22.4654 -22.4654 -21.8837 -21.8837 -21.8558 -21.8558 -21.8438 -21.8438 -21.6605 -21.6605 -1.0690 -1.0690 0.8071 0.8071 5.7597 5.7597 8.5901 8.5901 8.8504 8.8504 10.0293 10.0293 10.5900 10.5900 10.7595 10.7595 10.8658 10.8658 11.6303 11.6303 12.4987 12.4987 12.6025 12.6025 12.9588 12.9588 k = 0.0632 0.1095-0.0000 ( 5717 PWs) bands (ev): -45.7904 -45.7904 -45.7667 -45.7667 -22.5016 -22.5016 -22.4647 -22.4647 -21.8828 -21.8828 -21.8549 -21.8549 -21.8439 -21.8439 -21.6605 -21.6605 -1.0976 -1.0976 0.8023 0.8023 5.7241 5.7241 8.6199 8.6199 8.8496 8.8496 10.0798 10.0798 10.6781 10.6781 10.8384 10.8384 10.9251 10.9251 11.6085 11.6085 12.4806 12.4806 12.6003 12.6003 12.9183 12.9183 k = 0.0575 0.0995-0.0000 ( 5717 PWs) bands (ev): -45.7905 -45.7905 -45.7668 -45.7668 -22.5012 -22.5012 -22.4641 -22.4641 -21.8819 -21.8819 -21.8541 -21.8541 -21.8439 -21.8439 -21.6605 -21.6605 -1.1238 -1.1238 0.7979 0.7979 5.6914 5.6914 8.6473 8.6473 8.8487 8.8487 10.1193 10.1193 10.7673 10.7673 10.9164 10.9164 10.9898 10.9898 11.5885 11.5885 12.4598 12.4598 12.5963 12.5963 12.8776 12.8776 k = 0.0517 0.0896-0.0000 ( 5717 PWs) bands (ev): -45.7905 -45.7905 -45.7669 -45.7669 -22.5009 -22.5009 -22.4635 -22.4635 -21.8812 -21.8812 -21.8534 -21.8534 -21.8440 -21.8440 -21.6604 -21.6604 -1.1476 -1.1476 0.7939 0.7939 5.6617 5.6617 8.6720 8.6720 8.8479 8.8479 10.1496 10.1496 10.8573 10.8573 10.9931 10.9931 11.0568 11.0568 11.5703 11.5703 12.4354 12.4354 12.5902 12.5902 12.8375 12.8375 k = 0.0460 0.0796-0.0000 ( 5717 PWs) bands (ev): -45.7906 -45.7906 -45.7669 -45.7669 -22.5006 -22.5006 -22.4630 -22.4630 -21.8804 -21.8804 -21.8528 -21.8528 -21.8440 -21.8440 -21.6604 -21.6604 -1.1690 -1.1690 0.7902 0.7902 5.6351 5.6351 8.6937 8.6937 8.8477 8.8477 10.1724 10.1724 10.9477 10.9477 11.0677 11.0677 11.1234 11.1234 11.5540 11.5540 12.4059 12.4059 12.5823 12.5823 12.7988 12.7988 k = 0.0402 0.0697-0.0000 ( 5709 PWs) bands (ev): -45.7907 -45.7907 -45.7670 -45.7670 -22.5003 -22.5003 -22.4625 -22.4625 -21.8798 -21.8798 -21.8522 -21.8522 -21.8441 -21.8441 -21.6604 -21.6604 -1.1879 -1.1879 0.7869 0.7869 5.6115 5.6115 8.7122 8.7122 8.8483 8.8483 10.1893 10.1893 11.0377 11.0377 11.1391 11.1391 11.1871 11.1871 11.5396 11.5396 12.3703 12.3703 12.5730 12.5730 12.7622 12.7622 k = 0.0345 0.0597-0.0000 ( 5715 PWs) bands (ev): -45.7908 -45.7908 -45.7671 -45.7671 -22.5001 -22.5001 -22.4621 -22.4621 -21.8792 -21.8792 -21.8517 -21.8517 -21.8441 -21.8441 -21.6604 -21.6604 -1.2044 -1.2044 0.7841 0.7841 5.5910 5.5910 8.7273 8.7273 8.8497 8.8497 10.2018 10.2018 11.1264 11.1264 11.2062 11.2062 11.2461 11.2461 11.5272 11.5272 12.3281 12.3281 12.5624 12.5624 12.7286 12.7286 k = 0.0287 0.0498-0.0000 ( 5717 PWs) bands (ev): -45.7908 -45.7908 -45.7671 -45.7671 -22.4999 -22.4999 -22.4618 -22.4618 -21.8788 -21.8788 -21.8513 -21.8513 -21.8441 -21.8441 -21.6603 -21.6603 -1.2183 -1.2183 0.7816 0.7816 5.5736 5.5736 8.7390 8.7390 8.8521 8.8521 10.2110 10.2110 11.2123 11.2123 11.2676 11.2676 11.2985 11.2985 11.5168 11.5168 12.2799 12.2799 12.5504 12.5504 12.6993 12.6993 k = 0.0230 0.0398-0.0000 ( 5713 PWs) bands (ev): -45.7909 -45.7909 -45.7671 -45.7671 -22.4997 -22.4997 -22.4615 -22.4615 -21.8784 -21.8784 -21.8510 -21.8510 -21.8441 -21.8441 -21.6603 -21.6603 -1.2298 -1.2298 0.7796 0.7796 5.5593 5.5593 8.7476 8.7476 8.8550 8.8550 10.2175 10.2175 11.2927 11.2927 11.3224 11.3224 11.3430 11.3430 11.5085 11.5085 12.2278 12.2278 12.5366 12.5366 12.6760 12.6760 k = 0.0172 0.0299-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4996 -22.4996 -22.4613 -22.4613 -21.8781 -21.8781 -21.8507 -21.8507 -21.8441 -21.8441 -21.6603 -21.6603 -1.2387 -1.2387 0.7780 0.7780 5.5482 5.5482 8.7535 8.7535 8.8582 8.8582 10.2221 10.2221 11.3578 11.3578 11.3748 11.3748 11.3795 11.3795 11.5026 11.5026 12.1755 12.1755 12.5218 12.5218 12.6594 12.6594 k = 0.0115 0.0199-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4611 -22.4611 -21.8778 -21.8778 -21.8505 -21.8505 -21.8441 -21.8441 -21.6603 -21.6603 -1.2451 -1.2451 0.7769 0.7769 5.5402 5.5402 8.7573 8.7573 8.8609 8.8609 10.2252 10.2252 11.3952 11.3952 11.4042 11.4042 11.4327 11.4327 11.4995 11.4995 12.1284 12.1284 12.5080 12.5080 12.6491 12.6491 k = 0.0057 0.0100-0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4610 -22.4610 -21.8777 -21.8777 -21.8504 -21.8504 -21.8441 -21.8441 -21.6603 -21.6603 -1.2489 -1.2489 0.7762 0.7762 5.5355 5.5355 8.7594 8.7594 8.8627 8.8627 10.2269 10.2269 11.4163 11.4163 11.4201 11.4201 11.4705 11.4705 11.5015 11.5015 12.0943 12.0943 12.4982 12.4982 12.6437 12.6437 k = 0.0000 0.0000 0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4610 -22.4610 -21.8777 -21.8777 -21.8504 -21.8504 -21.8441 -21.8441 -21.6603 -21.6603 -1.2502 -1.2502 0.7760 0.7760 5.5339 5.5339 8.7600 8.7600 8.8633 8.8633 10.2274 10.2274 11.4231 11.4231 11.4255 11.4255 11.4804 11.4804 11.5063 11.5063 12.0816 12.0816 12.4947 12.4947 12.6421 12.6421 k = 0.0000 0.0000 0.0000 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4995 -22.4995 -22.4610 -22.4610 -21.8777 -21.8777 -21.8504 -21.8504 -21.8441 -21.8441 -21.6603 -21.6603 -1.2502 -1.2502 0.7760 0.7760 5.5339 5.5339 8.7600 8.7600 8.8633 8.8633 10.2274 10.2274 11.4231 11.4231 11.4255 11.4255 11.4804 11.4804 11.5063 11.5063 12.0816 12.0816 12.4947 12.4947 12.6421 12.6421 k = 0.0000 0.0000 0.0115 ( 5709 PWs) bands (ev): -45.7909 -45.7909 -45.7672 -45.7672 -22.4994 -22.4994 -22.4610 -22.4610 -21.8776 -21.8776 -21.8504 -21.8504 -21.8440 -21.8440 -21.6605 -21.6605 -1.2489 -1.2489 0.7729 0.7729 5.5389 5.5389 8.7613 8.7613 8.8646 8.8646 10.2248 10.2248 11.4234 11.4234 11.4265 11.4265 11.4728 11.4728 11.4944 11.4944 12.0839 12.0839 12.4972 12.4972 12.6435 12.6435 k = 0.0000 0.0000 0.0229 ( 5715 PWs) bands (ev): -45.7909 -45.7909 -45.7673 -45.7673 -22.4992 -22.4992 -22.4611 -22.4611 -21.8776 -21.8776 -21.8505 -21.8505 -21.8435 -21.8435 -21.6610 -21.6610 -1.2450 -1.2450 0.7637 0.7637 5.5540 5.5540 8.7652 8.7652 8.8685 8.8685 10.2169 10.2169 11.4219 11.4219 11.4293 11.4293 11.4530 11.4530 11.4604 11.4604 12.0889 12.0889 12.5044 12.5044 12.6468 12.6468 k = 0.0000 0.0000 0.0344 ( 5715 PWs) bands (ev): -45.7908 -45.7908 -45.7674 -45.7674 -22.4990 -22.4990 -22.4612 -22.4612 -21.8774 -21.8774 -21.8506 -21.8506 -21.8428 -21.8428 -21.6620 -21.6620 -1.2386 -1.2386 0.7484 0.7484 5.5789 5.5789 8.7717 8.7717 8.8749 8.8749 10.2034 10.2034 11.4005 11.4005 11.4090 11.4090 11.4341 11.4341 11.4409 11.4409 12.0926 12.0926 12.5156 12.5156 12.6500 12.6500 k = 0.0000 0.0000 0.0459 ( 5715 PWs) bands (ev): -45.7906 -45.7906 -45.7676 -45.7676 -22.4986 -22.4986 -22.4613 -22.4613 -21.8773 -21.8773 -21.8508 -21.8508 -21.8418 -21.8418 -21.6633 -21.6633 -1.2297 -1.2297 0.7274 0.7274 5.6136 5.6136 8.7807 8.7807 8.8839 8.8839 10.1840 10.1840 11.3450 11.3450 11.3537 11.3537 11.4407 11.4407 11.4441 11.4441 12.0915 12.0915 12.5288 12.5288 12.6511 12.6511 k = 0.0000 0.0000 0.0574 ( 5709 PWs) bands (ev): -45.7904 -45.7904 -45.7678 -45.7678 -22.4982 -22.4982 -22.4615 -22.4615 -21.8770 -21.8770 -21.8510 -21.8510 -21.8405 -21.8405 -21.6649 -21.6649 -1.2182 -1.2182 0.7008 0.7008 5.6576 5.6576 8.7924 8.7924 8.8955 8.8955 10.1580 10.1580 11.2725 11.2725 11.2950 11.2950 11.4492 11.4492 11.4517 11.4517 12.0847 12.0847 12.5414 12.5414 12.6485 12.6485 k = 0.0000 0.0000 0.0688 ( 5697 PWs) bands (ev): -45.7902 -45.7902 -45.7680 -45.7680 -22.4976 -22.4976 -22.4617 -22.4617 -21.8768 -21.8768 -21.8513 -21.8513 -21.8389 -21.8389 -21.6669 -21.6669 -1.2042 -1.2042 0.6691 0.6691 5.7106 5.7106 8.8066 8.8066 8.9096 8.9096 10.1250 10.1250 11.1943 11.1943 11.2286 11.2286 11.4595 11.4595 11.4617 11.4617 12.0729 12.0729 12.5506 12.5506 12.6414 12.6414 k = 0.0000 0.0000 0.0803 ( 5709 PWs) bands (ev): -45.7899 -45.7899 -45.7683 -45.7683 -22.4970 -22.4970 -22.4620 -22.4620 -21.8765 -21.8765 -21.8516 -21.8516 -21.8370 -21.8370 -21.6693 -21.6693 -1.1876 -1.1876 0.6326 0.6326 5.7722 5.7722 8.8234 8.8234 8.9263 8.9263 10.0842 10.0842 11.1124 11.1124 11.1565 11.1565 11.4717 11.4717 11.4737 11.4737 12.0581 12.0581 12.5545 12.5545 12.6299 12.6299 k = 0.0000 0.0000 0.0918 ( 5709 PWs) bands (ev): -45.7896 -45.7896 -45.7686 -45.7686 -22.4962 -22.4962 -22.4623 -22.4623 -21.8761 -21.8761 -21.8519 -21.8519 -21.8349 -21.8349 -21.6720 -21.6720 -1.1686 -1.1686 0.5918 0.5918 5.8419 5.8419 8.8427 8.8427 8.9455 8.9455 10.0352 10.0352 11.0283 11.0283 11.0804 11.0804 11.4857 11.4857 11.4876 11.4876 12.0425 12.0425 12.5523 12.5523 12.6143 12.6143 k = 0.0000 0.0000 0.1033 ( 5733 PWs) bands (ev): -45.7892 -45.7892 -45.7689 -45.7689 -22.4954 -22.4954 -22.4627 -22.4627 -21.8757 -21.8757 -21.8523 -21.8523 -21.8325 -21.8325 -21.6750 -21.6750 -1.1471 -1.1471 0.5470 0.5470 5.9193 5.9193 8.8646 8.8646 8.9673 8.9673 9.9774 9.9774 10.9429 10.9429 11.0016 11.0016 11.5015 11.5015 11.5033 11.5033 12.0281 12.0281 12.5443 12.5443 12.5950 12.5950 k = 0.0000 0.0000 0.1147 ( 5733 PWs) bands (ev): -45.7889 -45.7889 -45.7693 -45.7693 -22.4945 -22.4945 -22.4631 -22.4631 -21.8753 -21.8753 -21.8528 -21.8528 -21.8298 -21.8298 -21.6783 -21.6783 -1.1232 -1.1232 0.4988 0.4988 6.0039 6.0039 8.8890 8.8890 8.9916 8.9916 9.9106 9.9106 10.8569 10.8569 10.9210 10.9210 11.5191 11.5191 11.5209 11.5209 12.0169 12.0169 12.5308 12.5308 12.5723 12.5723 k = 0.0000 0.0000 0.1262 ( 5733 PWs) bands (ev): -45.7884 -45.7884 -45.7698 -45.7698 -22.4936 -22.4936 -22.4635 -22.4635 -21.8748 -21.8748 -21.8533 -21.8533 -21.8268 -21.8268 -21.6819 -21.6819 -1.0968 -1.0968 0.4476 0.4476 6.0953 6.0953 8.9160 8.9160 9.0184 9.0184 9.8346 9.8346 10.7708 10.7708 10.8393 10.8393 11.5383 11.5383 11.5401 11.5401 12.0101 12.0101 12.5127 12.5127 12.5468 12.5468 k = 0.0000 0.0000 0.1377 ( 5733 PWs) bands (ev): -45.7880 -45.7880 -45.7702 -45.7702 -22.4925 -22.4925 -22.4640 -22.4640 -21.8742 -21.8742 -21.8538 -21.8538 -21.8236 -21.8236 -21.6858 -21.6858 -1.0681 -1.0681 0.3937 0.3937 6.1928 6.1928 8.9455 8.9455 9.0476 9.0476 9.7498 9.7498 10.6849 10.6849 10.7571 10.7571 11.5593 11.5593 11.5611 11.5611 12.0089 12.0089 12.4907 12.4907 12.5187 12.5187 k = 0.0000 0.0000 0.1492 ( 5733 PWs) bands (ev): -45.7875 -45.7875 -45.7707 -45.7707 -22.4915 -22.4915 -22.4646 -22.4646 -21.8737 -21.8737 -21.8544 -21.8544 -21.8201 -21.8201 -21.6899 -21.6899 -1.0370 -1.0370 0.3377 0.3377 6.2962 6.2962 8.9775 8.9775 9.0794 9.0794 9.6564 9.6564 10.5997 10.5997 10.6748 10.6748 11.5819 11.5819 11.5838 11.5838 12.0139 12.0139 12.4653 12.4653 12.4883 12.4883 k = 0.0000 0.0000 0.1606 ( 5733 PWs) bands (ev): -45.7870 -45.7870 -45.7712 -45.7712 -22.4904 -22.4904 -22.4652 -22.4652 -21.8731 -21.8731 -21.8550 -21.8550 -21.8164 -21.8164 -21.6943 -21.6943 -1.0036 -1.0036 0.2798 0.2798 6.4049 6.4049 9.0120 9.0120 9.1137 9.1137 9.5550 9.5550 10.5151 10.5151 10.5929 10.5929 11.6061 11.6061 11.6080 11.6080 12.0253 12.0253 12.4372 12.4372 12.4561 12.4561 k = 0.0000 0.0000 0.1721 ( 5727 PWs) bands (ev): -45.7864 -45.7864 -45.7718 -45.7718 -22.4892 -22.4892 -22.4658 -22.4658 -21.8724 -21.8724 -21.8556 -21.8556 -21.8125 -21.8125 -21.6989 -21.6989 -0.9680 -0.9680 0.2205 0.2205 6.5184 6.5184 9.0490 9.0490 9.1504 9.1504 9.4463 9.4463 10.4316 10.4316 10.5117 10.5117 11.6318 11.6318 11.6339 11.6339 12.0432 12.0432 12.4067 12.4067 12.4222 12.4222 k = 0.0000 0.0000 0.1836 ( 5709 PWs) bands (ev): -45.7858 -45.7858 -45.7724 -45.7724 -22.4880 -22.4880 -22.4665 -22.4665 -21.8718 -21.8718 -21.8563 -21.8563 -21.8084 -21.8084 -21.7036 -21.7036 -0.9301 -0.9301 0.1601 0.1601 6.6365 6.6365 9.0885 9.0885 9.1895 9.1895 9.3310 9.3310 10.3491 10.3491 10.4313 10.4313 11.6590 11.6590 11.6612 11.6612 12.0676 12.0676 12.3745 12.3745 12.3869 12.3869 k = 0.0000 0.0000 0.1951 ( 5715 PWs) bands (ev): -45.7852 -45.7852 -45.7730 -45.7730 -22.4868 -22.4868 -22.4672 -22.4672 -21.8711 -21.8711 -21.8570 -21.8570 -21.8040 -21.8040 -21.7086 -21.7086 -0.8901 -0.8901 0.0990 0.0990 6.7586 6.7586 9.1304 9.1304 9.2100 9.2100 9.2311 9.2311 10.2680 10.2680 10.3520 10.3520 11.6876 11.6876 11.6899 11.6899 12.0979 12.0979 12.3409 12.3409 12.3504 12.3504 k = 0.0000 0.0000 0.2065 ( 5715 PWs) bands (ev): -45.7846 -45.7846 -45.7736 -45.7736 -22.4856 -22.4856 -22.4680 -22.4680 -21.8704 -21.8704 -21.8577 -21.8577 -21.7995 -21.7995 -21.7137 -21.7137 -0.8480 -0.8480 0.0374 0.0374 6.8844 6.8844 9.0840 9.0840 9.1747 9.1747 9.2750 9.2750 10.1882 10.1882 10.2740 10.2740 11.7176 11.7176 11.7201 11.7201 12.1335 12.1335 12.3067 12.3067 12.3129 12.3129 k = 0.0000 0.0000 0.2180 ( 5715 PWs) bands (ev): -45.7840 -45.7840 -45.7742 -45.7742 -22.4843 -22.4843 -22.4688 -22.4688 -21.8696 -21.8696 -21.8584 -21.8584 -21.7947 -21.7947 -21.7190 -21.7190 -0.8039 -0.8039 -0.0245 -0.0245 7.0134 7.0134 8.9538 8.9538 9.2215 9.2215 9.3213 9.3213 10.1100 10.1100 10.1973 10.1973 11.7488 11.7488 11.7515 11.7515 12.1723 12.1723 12.2740 12.2740 12.2747 12.2747 k = 0.0000 0.0000 0.2295 ( 5715 PWs) bands (ev): -45.7833 -45.7833 -45.7749 -45.7749 -22.4831 -22.4831 -22.4697 -22.4697 -21.8689 -21.8689 -21.8592 -21.8592 -21.7898 -21.7898 -21.7244 -21.7244 -0.7578 -0.7578 -0.0862 -0.0862 7.1455 7.1455 8.8200 8.8200 9.2706 9.2706 9.3699 9.3699 10.0335 10.0335 10.1222 10.1222 11.7813 11.7813 11.7842 11.7842 12.1996 12.1996 12.2360 12.2360 12.2573 12.2573 k = 0.0000 0.0000 0.2410 ( 5715 PWs) bands (ev): -45.7826 -45.7826 -45.7756 -45.7756 -22.4818 -22.4818 -22.4706 -22.4706 -21.8681 -21.8681 -21.8600 -21.8600 -21.7848 -21.7848 -21.7299 -21.7299 -0.7098 -0.7098 -0.1478 -0.1478 7.2800 7.2800 8.6835 8.6835 9.3220 9.3220 9.4209 9.4209 9.9587 9.9587 10.0488 10.0488 11.8149 11.8149 11.8180 11.8180 12.1812 12.1812 12.1968 12.1968 12.2905 12.2905 k = 0.0000 0.0000 0.2524 ( 5703 PWs) bands (ev): -45.7819 -45.7819 -45.7763 -45.7763 -22.4806 -22.4806 -22.4716 -22.4716 -21.8673 -21.8673 -21.8608 -21.8608 -21.7796 -21.7796 -21.7354 -21.7354 -0.6600 -0.6600 -0.2088 -0.2088 7.4168 7.4168 8.5447 8.5447 9.3758 9.3758 9.4741 9.4741 9.8857 9.8857 9.9771 9.9771 11.8494 11.8494 11.8529 11.8529 12.1467 12.1467 12.1574 12.1574 12.3442 12.3442 k = 0.0000 0.0000 0.2639 ( 5690 PWs) bands (ev): -45.7812 -45.7812 -45.7770 -45.7770 -22.4794 -22.4794 -22.4726 -22.4726 -21.8665 -21.8665 -21.8616 -21.8616 -21.7743 -21.7743 -21.7410 -21.7410 -0.6085 -0.6085 -0.2692 -0.2692 7.5554 7.5554 8.4043 8.4043 9.4319 9.4319 9.5296 9.5296 9.8147 9.8147 9.9072 9.9072 11.8849 11.8849 11.8888 11.8888 12.1095 12.1095 12.1180 12.1180 12.4046 12.4046 k = 0.0000 0.0000 0.2754 ( 5678 PWs) bands (ev): -45.7805 -45.7805 -45.7777 -45.7777 -22.4782 -22.4782 -22.4736 -22.4736 -21.8657 -21.8657 -21.8624 -21.8624 -21.7689 -21.7689 -21.7466 -21.7466 -0.5553 -0.5553 -0.3287 -0.3287 7.6955 7.6955 8.2629 8.2629 9.4903 9.4903 9.5873 9.5873 9.7456 9.7456 9.8392 9.8392 11.9212 11.9212 11.9255 11.9255 12.0716 12.0716 12.0788 12.0788 12.4697 12.4697 k = 0.0000 0.0000 0.2869 ( 5678 PWs) bands (ev): -45.7798 -45.7798 -45.7784 -45.7784 -22.4770 -22.4770 -22.4747 -22.4747 -21.8649 -21.8649 -21.8632 -21.8632 -21.7634 -21.7634 -21.7522 -21.7522 -0.5007 -0.5007 -0.3872 -0.3872 7.8367 7.8367 8.1208 8.1208 9.5509 9.5509 9.6471 9.6471 9.6786 9.6786 9.7731 9.7731 11.9582 11.9582 11.9629 11.9629 12.0336 12.0336 12.0397 12.0397 12.5386 12.5386 k = 0.0000 0.0000 0.2983 ( 5684 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4758 -22.4758 -22.4758 -22.4758 -21.8640 -21.8640 -21.8640 -21.8640 -21.7578 -21.7578 -21.7578 -21.7578 -0.4446 -0.4446 -0.4446 -0.4446 7.9786 7.9786 7.9786 7.9786 9.6137 9.6137 9.6137 9.6137 9.7091 9.7091 9.7091 9.7091 11.9957 11.9957 11.9957 11.9957 12.0011 12.0011 12.0011 12.0011 12.6111 12.6111 k = 0.0000 0.0000 0.2983 ( 5684 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4758 -22.4758 -22.4758 -22.4758 -21.8640 -21.8640 -21.8640 -21.8640 -21.7578 -21.7578 -21.7578 -21.7578 -0.4446 -0.4446 -0.4446 -0.4446 7.9786 7.9786 7.9786 7.9786 9.6137 9.6137 9.6137 9.6137 9.7091 9.7091 9.7091 9.7091 11.9957 11.9957 11.9957 11.9957 12.0011 12.0011 12.0011 12.0011 12.6111 12.6111 k = 0.0100 0.0058 0.2983 ( 5672 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4758 -22.4758 -22.4758 -22.4758 -21.8641 -21.8641 -21.8641 -21.8641 -21.7578 -21.7578 -21.7578 -21.7578 -0.4436 -0.4436 -0.4436 -0.4436 7.9781 7.9781 7.9781 7.9781 9.6124 9.6124 9.6124 9.6124 9.7078 9.7078 9.7078 9.7078 11.9948 11.9948 11.9948 11.9948 12.0005 12.0005 12.0005 12.0005 12.6140 12.6140 k = 0.0200 0.0115 0.2983 ( 5684 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4759 -22.4759 -22.4759 -22.4759 -21.8642 -21.8642 -21.8642 -21.8642 -21.7578 -21.7578 -21.7578 -21.7578 -0.4406 -0.4406 -0.4406 -0.4406 7.9764 7.9764 7.9764 7.9764 9.6083 9.6083 9.6083 9.6083 9.7042 9.7042 9.7042 9.7042 11.9915 11.9915 11.9915 11.9915 11.9995 11.9995 11.9995 11.9995 12.6226 12.6226 k = 0.0300 0.0173 0.2983 ( 5696 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4761 -22.4761 -22.4761 -22.4761 -21.8644 -21.8644 -21.8644 -21.8644 -21.7578 -21.7578 -21.7578 -21.7578 -0.4357 -0.4357 -0.4357 -0.4357 7.9737 7.9737 7.9737 7.9737 9.6011 9.6011 9.6011 9.6011 9.6988 9.6988 9.6988 9.6988 11.9851 11.9851 11.9851 11.9851 11.9988 11.9988 11.9988 11.9988 12.6368 12.6368 k = 0.0400 0.0231 0.2983 ( 5696 PWs) bands (ev): -45.7790 -45.7790 -45.7790 -45.7790 -22.4762 -22.4762 -22.4762 -22.4762 -21.8647 -21.8647 -21.8647 -21.8647 -21.7578 -21.7578 -21.7578 -21.7578 -0.4288 -0.4288 -0.4288 -0.4288 7.9696 7.9696 7.9696 7.9696 9.5903 9.5903 9.5903 9.5903 9.6923 9.6923 9.6923 9.6923 11.9757 11.9757 11.9757 11.9757 11.9983 11.9983 11.9983 11.9983 12.6564 12.6564 k = 0.0500 0.0289 0.2983 ( 5700 PWs) bands (ev): -45.7790 -45.7790 -45.7790 -45.7790 -22.4765 -22.4765 -22.4765 -22.4765 -21.8651 -21.8651 -21.8651 -21.8651 -21.7578 -21.7578 -21.7578 -21.7578 -0.4200 -0.4200 -0.4200 -0.4200 7.9643 7.9643 7.9643 7.9643 9.5755 9.5755 9.5755 9.5755 9.6856 9.6856 9.6856 9.6856 11.9634 11.9634 11.9634 11.9634 11.9979 11.9979 11.9979 11.9979 12.6811 12.6811 k = 0.0600 0.0346 0.2983 ( 5704 PWs) bands (ev): -45.7789 -45.7789 -45.7789 -45.7789 -22.4767 -22.4767 -22.4767 -22.4767 -21.8655 -21.8655 -21.8655 -21.8655 -21.7578 -21.7578 -21.7578 -21.7578 -0.4092 -0.4092 -0.4092 -0.4092 7.9574 7.9574 7.9574 7.9574 9.5565 9.5565 9.5565 9.5565 9.6792 9.6792 9.6792 9.6792 11.9484 11.9484 11.9484 11.9484 11.9977 11.9977 11.9977 11.9977 12.7105 12.7105 k = 0.0700 0.0404 0.2983 ( 5706 PWs) bands (ev): -45.7789 -45.7789 -45.7789 -45.7789 -22.4771 -22.4771 -22.4771 -22.4771 -21.8660 -21.8660 -21.8660 -21.8660 -21.7578 -21.7578 -21.7578 -21.7578 -0.3966 -0.3966 -0.3966 -0.3966 7.9489 7.9489 7.9489 7.9489 9.5338 9.5338 9.5338 9.5338 9.6733 9.6733 9.6733 9.6733 11.9308 11.9308 11.9308 11.9308 11.9978 11.9978 11.9978 11.9978 12.7442 12.7442 k = 0.0800 0.0462 0.2983 ( 5712 PWs) bands (ev): -45.7788 -45.7788 -45.7788 -45.7788 -22.4774 -22.4774 -22.4774 -22.4774 -21.8666 -21.8666 -21.8666 -21.8666 -21.7578 -21.7578 -21.7578 -21.7578 -0.3820 -0.3820 -0.3820 -0.3820 7.9386 7.9386 7.9386 7.9386 9.5078 9.5078 9.5078 9.5078 9.6678 9.6678 9.6678 9.6678 11.9106 11.9106 11.9106 11.9106 11.9982 11.9982 11.9982 11.9982 12.7817 12.7817 k = 0.0900 0.0520 0.2983 ( 5712 PWs) bands (ev): -45.7787 -45.7787 -45.7787 -45.7787 -22.4779 -22.4779 -22.4779 -22.4779 -21.8673 -21.8673 -21.8673 -21.8673 -21.7578 -21.7578 -21.7578 -21.7578 -0.3656 -0.3656 -0.3656 -0.3656 7.9261 7.9261 7.9261 7.9261 9.4793 9.4793 9.4793 9.4793 9.6627 9.6627 9.6627 9.6627 11.8879 11.8879 11.8879 11.8879 11.9991 11.9991 11.9991 11.9991 12.8226 12.8226 k = 0.1000 0.0577 0.2983 ( 5720 PWs) bands (ev): -45.7786 -45.7786 -45.7786 -45.7786 -22.4783 -22.4783 -22.4783 -22.4783 -21.8680 -21.8680 -21.8680 -21.8680 -21.7578 -21.7578 -21.7578 -21.7578 -0.3474 -0.3474 -0.3474 -0.3474 7.9114 7.9114 7.9114 7.9114 9.4490 9.4490 9.4490 9.4490 9.6576 9.6576 9.6576 9.6576 11.8628 11.8628 11.8628 11.8628 12.0006 12.0006 12.0006 12.0006 12.8661 12.8661 k = 0.1100 0.0635 0.2983 ( 5716 PWs) bands (ev): -45.7785 -45.7785 -45.7785 -45.7785 -22.4788 -22.4788 -22.4788 -22.4788 -21.8689 -21.8689 -21.8689 -21.8689 -21.7578 -21.7578 -21.7578 -21.7578 -0.3275 -0.3275 -0.3275 -0.3275 7.8941 7.8941 7.8941 7.8941 9.4178 9.4178 9.4178 9.4178 9.6525 9.6525 9.6525 9.6525 11.8356 11.8356 11.8356 11.8356 12.0028 12.0028 12.0028 12.0028 12.9119 12.9119 k = 0.1200 0.0693 0.2983 ( 5712 PWs) bands (ev): -45.7784 -45.7784 -45.7784 -45.7784 -22.4794 -22.4794 -22.4794 -22.4794 -21.8697 -21.8697 -21.8697 -21.8697 -21.7578 -21.7578 -21.7578 -21.7578 -0.3057 -0.3057 -0.3057 -0.3057 7.8739 7.8739 7.8739 7.8739 9.3863 9.3863 9.3863 9.3863 9.6472 9.6472 9.6472 9.6472 11.8064 11.8064 11.8064 11.8064 12.0058 12.0058 12.0058 12.0058 12.9592 12.9592 k = 0.1300 0.0751 0.2983 ( 5712 PWs) bands (ev): -45.7783 -45.7783 -45.7783 -45.7783 -22.4800 -22.4800 -22.4800 -22.4800 -21.8707 -21.8707 -21.8707 -21.8707 -21.7577 -21.7577 -21.7577 -21.7577 -0.2823 -0.2823 -0.2823 -0.2823 7.8508 7.8508 7.8508 7.8508 9.3550 9.3550 9.3550 9.3550 9.6416 9.6416 9.6416 9.6416 11.7753 11.7753 11.7753 11.7753 12.0099 12.0099 12.0099 12.0099 13.0075 13.0075 k = 0.1400 0.0808 0.2983 ( 5712 PWs) bands (ev): -45.7782 -45.7782 -45.7782 -45.7782 -22.4806 -22.4806 -22.4806 -22.4806 -21.8716 -21.8716 -21.8716 -21.8716 -21.7577 -21.7577 -21.7577 -21.7577 -0.2573 -0.2573 -0.2573 -0.2573 7.8244 7.8244 7.8244 7.8244 9.3246 9.3246 9.3246 9.3246 9.6356 9.6356 9.6356 9.6356 11.7427 11.7427 11.7427 11.7427 12.0151 12.0151 12.0151 12.0151 13.0560 13.0560 k = 0.1500 0.0866 0.2983 ( 5720 PWs) bands (ev): -45.7781 -45.7781 -45.7781 -45.7781 -22.4813 -22.4813 -22.4813 -22.4813 -21.8727 -21.8727 -21.8727 -21.8727 -21.7577 -21.7577 -21.7577 -21.7577 -0.2307 -0.2307 -0.2307 -0.2307 7.7946 7.7946 7.7946 7.7946 9.2955 9.2955 9.2955 9.2955 9.6292 9.6292 9.6292 9.6292 11.7086 11.7086 11.7086 11.7086 12.0216 12.0216 12.0216 12.0216 13.1042 13.1042 k = 0.1600 0.0924 0.2983 ( 5734 PWs) bands (ev): -45.7779 -45.7779 -45.7779 -45.7779 -22.4820 -22.4820 -22.4820 -22.4820 -21.8738 -21.8738 -21.8738 -21.8738 -21.7577 -21.7577 -21.7577 -21.7577 -0.2025 -0.2025 -0.2025 -0.2025 7.7613 7.7613 7.7613 7.7613 9.2679 9.2679 9.2679 9.2679 9.6223 9.6223 9.6223 9.6223 11.6735 11.6735 11.6735 11.6735 12.0294 12.0294 12.0294 12.0294 13.1512 13.1512 k = 0.1700 0.0981 0.2983 ( 5728 PWs) bands (ev): -45.7778 -45.7778 -45.7778 -45.7778 -22.4827 -22.4827 -22.4827 -22.4827 -21.8749 -21.8749 -21.8749 -21.8749 -21.7577 -21.7577 -21.7577 -21.7577 -0.1729 -0.1729 -0.1729 -0.1729 7.7245 7.7245 7.7245 7.7245 9.2423 9.2423 9.2423 9.2423 9.6149 9.6149 9.6149 9.6149 11.6376 11.6376 11.6376 11.6376 12.0387 12.0387 12.0387 12.0387 13.1962 13.1962 k = 0.1800 0.1039 0.2983 ( 5730 PWs) bands (ev): -45.7777 -45.7777 -45.7777 -45.7777 -22.4834 -22.4834 -22.4834 -22.4834 -21.8761 -21.8761 -21.8761 -21.8761 -21.7576 -21.7576 -21.7576 -21.7576 -0.1419 -0.1419 -0.1419 -0.1419 7.6841 7.6841 7.6841 7.6841 9.2187 9.2187 9.2187 9.2187 9.6070 9.6070 9.6070 9.6070 11.6012 11.6012 11.6012 11.6012 12.0495 12.0495 12.0495 12.0495 13.2384 13.2384 k = 0.1900 0.1097 0.2983 ( 5738 PWs) bands (ev): -45.7775 -45.7775 -45.7775 -45.7775 -22.4842 -22.4842 -22.4842 -22.4842 -21.8773 -21.8773 -21.8773 -21.8773 -21.7576 -21.7576 -21.7576 -21.7576 -0.1096 -0.1096 -0.1096 -0.1096 7.6404 7.6404 7.6404 7.6404 9.1971 9.1971 9.1971 9.1971 9.5986 9.5986 9.5986 9.5986 11.5645 11.5645 11.5645 11.5645 12.0620 12.0620 12.0620 12.0620 13.2770 13.2770 k = 0.2000 0.1155 0.2983 ( 5738 PWs) bands (ev): -45.7774 -45.7774 -45.7774 -45.7774 -22.4850 -22.4850 -22.4850 -22.4850 -21.8785 -21.8785 -21.8785 -21.8785 -21.7576 -21.7576 -21.7576 -21.7576 -0.0761 -0.0761 -0.0761 -0.0761 7.5933 7.5933 7.5933 7.5933 9.1777 9.1777 9.1777 9.1777 9.5897 9.5897 9.5897 9.5897 11.5280 11.5280 11.5280 11.5280 12.0762 12.0762 12.0762 12.0762 13.3110 13.3110 k = 0.2100 0.1212 0.2983 ( 5740 PWs) bands (ev): -45.7772 -45.7772 -45.7772 -45.7772 -22.4858 -22.4858 -22.4858 -22.4858 -21.8798 -21.8798 -21.8798 -21.8798 -21.7575 -21.7575 -21.7575 -21.7575 -0.0415 -0.0415 -0.0415 -0.0415 7.5433 7.5433 7.5433 7.5433 9.1602 9.1602 9.1602 9.1602 9.5803 9.5803 9.5803 9.5803 11.4919 11.4919 11.4919 11.4919 12.0921 12.0921 12.0921 12.0921 13.3398 13.3398 k = 0.2200 0.1270 0.2983 ( 5732 PWs) bands (ev): -45.7771 -45.7771 -45.7771 -45.7771 -22.4867 -22.4867 -22.4867 -22.4867 -21.8811 -21.8811 -21.8811 -21.8811 -21.7575 -21.7575 -21.7575 -21.7575 -0.0058 -0.0058 -0.0058 -0.0058 7.4904 7.4904 7.4904 7.4904 9.1444 9.1444 9.1444 9.1444 9.5704 9.5704 9.5704 9.5704 11.4566 11.4566 11.4566 11.4566 12.1098 12.1098 12.1098 12.1098 13.3628 13.3628 k = 0.2300 0.1328 0.2983 ( 5732 PWs) bands (ev): -45.7769 -45.7769 -45.7769 -45.7769 -22.4875 -22.4875 -22.4875 -22.4875 -21.8824 -21.8824 -21.8824 -21.8824 -21.7574 -21.7574 -21.7574 -21.7574 0.0308 0.0308 0.0308 0.0308 7.4350 7.4350 7.4350 7.4350 9.1303 9.1303 9.1303 9.1303 9.5601 9.5601 9.5601 9.5601 11.4223 11.4223 11.4223 11.4223 12.1293 12.1293 12.1293 12.1293 13.3797 13.3797 k = 0.2400 0.1386 0.2983 ( 5732 PWs) bands (ev): -45.7767 -45.7767 -45.7767 -45.7767 -22.4884 -22.4884 -22.4884 -22.4884 -21.8837 -21.8837 -21.8837 -21.8837 -21.7574 -21.7574 -21.7574 -21.7574 0.0682 0.0682 0.0682 0.0682 7.3775 7.3775 7.3775 7.3775 9.1176 9.1176 9.1176 9.1176 9.5494 9.5494 9.5494 9.5494 11.3895 11.3895 11.3895 11.3895 12.1506 12.1506 12.1506 12.1506 13.3908 13.3908 k = 0.2500 0.1443 0.2983 ( 5732 PWs) bands (ev): -45.7766 -45.7766 -45.7766 -45.7766 -22.4892 -22.4892 -22.4892 -22.4892 -21.8850 -21.8850 -21.8850 -21.8850 -21.7573 -21.7573 -21.7573 -21.7573 0.1064 0.1064 0.1064 0.1064 7.3182 7.3182 7.3182 7.3182 9.1059 9.1059 9.1059 9.1059 9.5383 9.5383 9.5383 9.5383 11.3583 11.3583 11.3583 11.3583 12.1736 12.1736 12.1736 12.1736 13.3963 13.3963 k = 0.2600 0.1501 0.2983 ( 5736 PWs) bands (ev): -45.7764 -45.7764 -45.7764 -45.7764 -22.4901 -22.4901 -22.4901 -22.4901 -21.8863 -21.8863 -21.8863 -21.8863 -21.7573 -21.7573 -21.7573 -21.7573 0.1451 0.1451 0.1451 0.1451 7.2574 7.2574 7.2574 7.2574 9.0951 9.0951 9.0951 9.0951 9.5270 9.5270 9.5270 9.5270 11.3291 11.3291 11.3291 11.3291 12.1982 12.1982 12.1982 12.1982 13.3971 13.3971 k = 0.2700 0.1559 0.2983 ( 5734 PWs) bands (ev): -45.7763 -45.7763 -45.7763 -45.7763 -22.4909 -22.4909 -22.4909 -22.4909 -21.8876 -21.8876 -21.8876 -21.8876 -21.7572 -21.7572 -21.7572 -21.7572 0.1843 0.1843 0.1843 0.1843 7.1956 7.1956 7.1956 7.1956 9.0849 9.0849 9.0849 9.0849 9.5154 9.5154 9.5154 9.5154 11.3021 11.3021 11.3021 11.3021 12.2246 12.2246 12.2246 12.2246 13.3937 13.3937 k = 0.2800 0.1617 0.2983 ( 5734 PWs) bands (ev): -45.7761 -45.7761 -45.7761 -45.7761 -22.4918 -22.4918 -22.4918 -22.4918 -21.8889 -21.8889 -21.8889 -21.8889 -21.7571 -21.7571 -21.7571 -21.7571 0.2237 0.2237 0.2237 0.2237 7.1330 7.1330 7.1330 7.1330 9.0751 9.0751 9.0751 9.0751 9.5037 9.5037 9.5037 9.5037 11.2775 11.2775 11.2775 11.2775 12.2525 12.2525 12.2525 12.2525 13.3872 13.3872 k = 0.2900 0.1674 0.2983 ( 5746 PWs) bands (ev): -45.7760 -45.7760 -45.7760 -45.7760 -22.4926 -22.4926 -22.4926 -22.4926 -21.8902 -21.8902 -21.8902 -21.8902 -21.7571 -21.7571 -21.7571 -21.7571 0.2634 0.2634 0.2634 0.2634 7.0700 7.0700 7.0700 7.0700 9.0656 9.0656 9.0656 9.0656 9.4918 9.4918 9.4918 9.4918 11.2554 11.2554 11.2554 11.2554 12.2818 12.2818 12.2818 12.2818 13.3784 13.3784 k = 0.3000 0.1732 0.2983 ( 5744 PWs) bands (ev): -45.7758 -45.7758 -45.7758 -45.7758 -22.4935 -22.4935 -22.4935 -22.4935 -21.8914 -21.8914 -21.8914 -21.8914 -21.7570 -21.7570 -21.7570 -21.7570 0.3030 0.3030 0.3030 0.3030 7.0070 7.0070 7.0070 7.0070 9.0560 9.0560 9.0560 9.0560 9.4799 9.4799 9.4799 9.4799 11.2360 11.2360 11.2360 11.2360 12.3126 12.3126 12.3126 12.3126 13.3678 13.3678 k = 0.3100 0.1790 0.2983 ( 5736 PWs) bands (ev): -45.7757 -45.7757 -45.7757 -45.7757 -22.4943 -22.4943 -22.4943 -22.4943 -21.8927 -21.8927 -21.8927 -21.8927 -21.7570 -21.7570 -21.7570 -21.7570 0.3426 0.3426 0.3426 0.3426 6.9443 6.9443 6.9443 6.9443 9.0465 9.0465 9.0465 9.0465 9.4681 9.4681 9.4681 9.4681 11.2193 11.2193 11.2193 11.2193 12.3445 12.3445 12.3445 12.3445 13.3562 13.3562 k = 0.3200 0.1848 0.2983 ( 5736 PWs) bands (ev): -45.7755 -45.7755 -45.7755 -45.7755 -22.4951 -22.4951 -22.4951 -22.4951 -21.8939 -21.8939 -21.8939 -21.8939 -21.7569 -21.7569 -21.7569 -21.7569 0.3817 0.3817 0.3817 0.3817 6.8823 6.8823 6.8823 6.8823 9.0368 9.0368 9.0368 9.0368 9.4563 9.4563 9.4563 9.4563 11.2053 11.2053 11.2053 11.2053 12.3775 12.3775 12.3775 12.3775 13.3440 13.3440 k = 0.3300 0.1905 0.2983 ( 5736 PWs) bands (ev): -45.7754 -45.7754 -45.7754 -45.7754 -22.4959 -22.4959 -22.4959 -22.4959 -21.8950 -21.8950 -21.8950 -21.8950 -21.7568 -21.7568 -21.7568 -21.7568 0.4204 0.4204 0.4204 0.4204 6.8212 6.8212 6.8212 6.8212 9.0269 9.0269 9.0269 9.0269 9.4447 9.4447 9.4447 9.4447 11.1939 11.1939 11.1939 11.1939 12.4115 12.4115 12.4115 12.4115 13.3317 13.3317 k = 0.3400 0.1963 0.2983 ( 5736 PWs) bands (ev): -45.7752 -45.7752 -45.7752 -45.7752 -22.4967 -22.4967 -22.4967 -22.4967 -21.8961 -21.8961 -21.8961 -21.8961 -21.7568 -21.7568 -21.7568 -21.7568 0.4584 0.4584 0.4584 0.4584 6.7615 6.7615 6.7615 6.7615 9.0168 9.0168 9.0168 9.0168 9.4334 9.4334 9.4334 9.4334 11.1852 11.1852 11.1852 11.1852 12.4461 12.4461 12.4461 12.4461 13.3194 13.3194 k = 0.3500 0.2021 0.2983 ( 5732 PWs) bands (ev): -45.7751 -45.7751 -45.7751 -45.7751 -22.4974 -22.4974 -22.4974 -22.4974 -21.8972 -21.8972 -21.8972 -21.8972 -21.7567 -21.7567 -21.7567 -21.7567 0.4955 0.4955 0.4955 0.4955 6.7034 6.7034 6.7034 6.7034 9.0066 9.0066 9.0066 9.0066 9.4223 9.4223 9.4223 9.4223 11.1788 11.1788 11.1788 11.1788 12.4813 12.4813 12.4813 12.4813 13.3075 13.3075 k = 0.3600 0.2078 0.2983 ( 5732 PWs) bands (ev): -45.7750 -45.7750 -45.7750 -45.7750 -22.4981 -22.4981 -22.4981 -22.4981 -21.8982 -21.8982 -21.8982 -21.8982 -21.7566 -21.7566 -21.7566 -21.7566 0.5316 0.5316 0.5316 0.5316 6.6472 6.6472 6.6472 6.6472 8.9964 8.9964 8.9964 8.9964 9.4116 9.4116 9.4116 9.4116 11.1747 11.1747 11.1747 11.1747 12.5167 12.5167 12.5167 12.5167 13.2960 13.2960 k = 0.3700 0.2136 0.2983 ( 5728 PWs) bands (ev): -45.7749 -45.7749 -45.7749 -45.7749 -22.4988 -22.4988 -22.4988 -22.4988 -21.8992 -21.8992 -21.8992 -21.8992 -21.7566 -21.7566 -21.7566 -21.7566 0.5663 0.5663 0.5663 0.5663 6.5933 6.5933 6.5933 6.5933 8.9861 8.9861 8.9861 8.9861 9.4013 9.4013 9.4013 9.4013 11.1726 11.1726 11.1726 11.1726 12.5522 12.5522 12.5522 12.5522 13.2853 13.2853 k = 0.3800 0.2194 0.2983 ( 5724 PWs) bands (ev): -45.7748 -45.7748 -45.7748 -45.7748 -22.4994 -22.4994 -22.4994 -22.4994 -21.9001 -21.9001 -21.9001 -21.9001 -21.7565 -21.7565 -21.7565 -21.7565 0.5996 0.5996 0.5996 0.5996 6.5419 6.5419 6.5419 6.5419 8.9759 8.9759 8.9759 8.9759 9.3916 9.3916 9.3916 9.3916 11.1722 11.1722 11.1722 11.1722 12.5874 12.5874 12.5874 12.5874 13.2752 13.2752 k = 0.3900 0.2252 0.2983 ( 5720 PWs) bands (ev): -45.7746 -45.7746 -45.7746 -45.7746 -22.5000 -22.5000 -22.5000 -22.5000 -21.9010 -21.9010 -21.9010 -21.9010 -21.7565 -21.7565 -21.7565 -21.7565 0.6312 0.6312 0.6312 0.6312 6.4934 6.4934 6.4934 6.4934 8.9659 8.9659 8.9659 8.9659 9.3823 9.3823 9.3823 9.3823 11.1734 11.1734 11.1734 11.1734 12.6221 12.6221 12.6221 12.6221 13.2659 13.2659 k = 0.4000 0.2309 0.2983 ( 5718 PWs) bands (ev): -45.7746 -45.7746 -45.7746 -45.7746 -22.5005 -22.5005 -22.5005 -22.5005 -21.9018 -21.9018 -21.9018 -21.9018 -21.7564 -21.7564 -21.7564 -21.7564 0.6609 0.6609 0.6609 0.6609 6.4480 6.4480 6.4480 6.4480 8.9563 8.9563 8.9563 8.9563 9.3737 9.3737 9.3737 9.3737 11.1757 11.1757 11.1757 11.1757 12.6558 12.6558 12.6558 12.6558 13.2574 13.2574 k = 0.4100 0.2367 0.2983 ( 5718 PWs) bands (ev): -45.7745 -45.7745 -45.7745 -45.7745 -22.5010 -22.5010 -22.5010 -22.5010 -21.9025 -21.9025 -21.9025 -21.9025 -21.7564 -21.7564 -21.7564 -21.7564 0.6885 0.6885 0.6885 0.6885 6.4060 6.4060 6.4060 6.4060 8.9471 8.9471 8.9471 8.9471 9.3658 9.3658 9.3658 9.3658 11.1789 11.1789 11.1789 11.1789 12.6883 12.6883 12.6883 12.6883 13.2498 13.2498 k = 0.4200 0.2425 0.2983 ( 5734 PWs) bands (ev): -45.7744 -45.7744 -45.7744 -45.7744 -22.5015 -22.5015 -22.5015 -22.5015 -21.9032 -21.9032 -21.9032 -21.9032 -21.7563 -21.7563 -21.7563 -21.7563 0.7138 0.7138 0.7138 0.7138 6.3676 6.3676 6.3676 6.3676 8.9385 8.9385 8.9385 8.9385 9.3585 9.3585 9.3585 9.3585 11.1828 11.1828 11.1828 11.1828 12.7191 12.7191 12.7191 12.7191 13.2431 13.2431 k = 0.4300 0.2483 0.2983 ( 5734 PWs) bands (ev): -45.7743 -45.7743 -45.7743 -45.7743 -22.5019 -22.5019 -22.5019 -22.5019 -21.9038 -21.9038 -21.9038 -21.9038 -21.7563 -21.7563 -21.7563 -21.7563 0.7366 0.7366 0.7366 0.7366 6.3332 6.3332 6.3332 6.3332 8.9306 8.9306 8.9306 8.9306 9.3520 9.3520 9.3520 9.3520 11.1869 11.1869 11.1869 11.1869 12.7478 12.7478 12.7478 12.7478 13.2371 13.2371 k = 0.4400 0.2540 0.2983 ( 5738 PWs) bands (ev): -45.7742 -45.7742 -45.7742 -45.7742 -22.5022 -22.5022 -22.5022 -22.5022 -21.9043 -21.9043 -21.9043 -21.9043 -21.7562 -21.7562 -21.7562 -21.7562 0.7568 0.7568 0.7568 0.7568 6.3028 6.3028 6.3028 6.3028 8.9235 8.9235 8.9235 8.9235 9.3463 9.3463 9.3463 9.3463 11.1912 11.1912 11.1912 11.1912 12.7739 12.7739 12.7739 12.7739 13.2320 13.2320 k = 0.4500 0.2598 0.2983 ( 5736 PWs) bands (ev): -45.7742 -45.7742 -45.7742 -45.7742 -22.5026 -22.5026 -22.5026 -22.5026 -21.9047 -21.9047 -21.9047 -21.9047 -21.7562 -21.7562 -21.7562 -21.7562 0.7742 0.7742 0.7742 0.7742 6.2768 6.2768 6.2768 6.2768 8.9173 8.9173 8.9173 8.9173 9.3414 9.3414 9.3414 9.3414 11.1952 11.1952 11.1952 11.1952 12.7970 12.7970 12.7970 12.7970 13.2278 13.2278 k = 0.4600 0.2656 0.2983 ( 5734 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5028 -22.5028 -22.5028 -22.5028 -21.9051 -21.9051 -21.9051 -21.9051 -21.7562 -21.7562 -21.7562 -21.7562 0.7886 0.7886 0.7886 0.7886 6.2552 6.2552 6.2552 6.2552 8.9121 8.9121 8.9121 8.9121 9.3374 9.3374 9.3374 9.3374 11.1988 11.1988 11.1988 11.1988 12.8167 12.8167 12.8167 12.8167 13.2243 13.2243 k = 0.4700 0.2714 0.2983 ( 5744 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5030 -22.5030 -22.5030 -22.5030 -21.9054 -21.9054 -21.9054 -21.9054 -21.7562 -21.7562 -21.7562 -21.7562 0.8000 0.8000 0.8000 0.8000 6.2382 6.2382 6.2382 6.2382 8.9080 8.9080 8.9080 8.9080 9.3342 9.3342 9.3342 9.3342 11.2019 11.2019 11.2019 11.2019 12.8325 12.8325 12.8325 12.8325 13.2216 13.2216 k = 0.4800 0.2771 0.2983 ( 5748 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5031 -22.5031 -22.5031 -22.5031 -21.9056 -21.9056 -21.9056 -21.9056 -21.7562 -21.7562 -21.7562 -21.7562 0.8082 0.8082 0.8082 0.8082 6.2261 6.2261 6.2261 6.2261 8.9050 8.9050 8.9050 8.9050 9.3320 9.3320 9.3320 9.3320 11.2041 11.2041 11.2041 11.2041 12.8440 12.8440 12.8440 12.8440 13.2197 13.2197 k = 0.4900 0.2829 0.2983 ( 5740 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5032 -22.5032 -22.5032 -22.5032 -21.9057 -21.9057 -21.9057 -21.9057 -21.7562 -21.7562 -21.7562 -21.7562 0.8131 0.8131 0.8131 0.8131 6.2187 6.2187 6.2187 6.2187 8.9032 8.9032 8.9032 8.9032 9.3306 9.3306 9.3306 9.3306 11.2055 11.2055 11.2055 11.2055 12.8511 12.8511 12.8511 12.8511 13.2186 13.2186 k = 0.5000 0.2887 0.2983 ( 5744 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5033 -22.5033 -22.5033 -22.5033 -21.9057 -21.9057 -21.9057 -21.9057 -21.7561 -21.7561 -21.7561 -21.7561 0.8148 0.8148 0.8148 0.8148 6.2163 6.2163 6.2163 6.2163 8.9026 8.9026 8.9026 8.9026 9.3301 9.3301 9.3301 9.3301 11.2060 11.2060 11.2060 11.2060 12.8535 12.8535 12.8535 12.8535 13.2182 13.2182 k = 0.5000 0.2887 0.2983 ( 5744 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5033 -22.5033 -22.5033 -22.5033 -21.9057 -21.9057 -21.9057 -21.9057 -21.7561 -21.7561 -21.7561 -21.7561 0.8148 0.8148 0.8148 0.8148 6.2163 6.2163 6.2163 6.2163 8.9026 8.9026 8.9026 8.9026 9.3301 9.3301 9.3301 9.3301 11.2060 11.2060 11.2060 11.2060 12.8535 12.8535 12.8535 12.8535 13.2182 13.2182 k = 0.4943 0.2986 0.2983 ( 5736 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5033 -22.5033 -22.5032 -22.5032 -21.9058 -21.9058 -21.9057 -21.9057 -21.7562 -21.7562 -21.7561 -21.7561 0.8149 0.8149 0.8154 0.8154 6.2173 6.2173 6.2177 6.2177 8.9007 8.9007 8.9032 8.9032 9.3257 9.3257 9.3258 9.3258 11.2080 11.2080 11.2087 11.2087 12.8529 12.8529 12.8540 12.8540 13.2168 13.2168 k = 0.4885 0.3086 0.2983 ( 5748 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5033 -22.5033 -22.5032 -22.5032 -21.9059 -21.9059 -21.9057 -21.9057 -21.7562 -21.7562 -21.7561 -21.7561 0.8159 0.8159 0.8168 0.8168 6.2209 6.2209 6.2216 6.2216 8.8976 8.8976 8.9027 8.9027 9.3127 9.3127 9.3128 9.3128 11.2145 11.2145 11.2159 11.2159 12.8525 12.8525 12.8546 12.8546 13.2129 13.2129 k = 0.4828 0.3185 0.2983 ( 5744 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5034 -22.5034 -22.5032 -22.5032 -21.9060 -21.9060 -21.9057 -21.9057 -21.7562 -21.7562 -21.7562 -21.7562 0.8178 0.8178 0.8191 0.8191 6.2268 6.2268 6.2280 6.2280 8.8930 8.8930 8.9011 8.9011 9.2913 9.2913 9.2916 9.2916 11.2254 11.2254 11.2274 11.2274 12.8522 12.8522 12.8554 12.8554 13.2065 13.2066 k = 0.4770 0.3285 0.2983 ( 5744 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5035 -22.5035 -22.5032 -22.5032 -21.9061 -21.9061 -21.9057 -21.9057 -21.7562 -21.7562 -21.7562 -21.7562 0.8204 0.8204 0.8222 0.8222 6.2353 6.2353 6.2368 6.2368 8.8867 8.8867 8.8982 8.8982 9.2619 9.2619 9.2630 9.2630 11.2403 11.2403 11.2428 11.2428 12.8523 12.8523 12.8564 12.8564 13.1975 13.1975 k = 0.4713 0.3384 0.2983 ( 5732 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5036 -22.5036 -22.5032 -22.5032 -21.9063 -21.9063 -21.9058 -21.9058 -21.7563 -21.7563 -21.7562 -21.7562 0.8238 0.8238 0.8260 0.8260 6.2461 6.2461 6.2481 6.2481 8.8784 8.8784 8.8941 8.8941 9.2252 9.2252 9.2281 9.2281 11.2588 11.2588 11.2617 11.2617 12.8528 12.8528 12.8580 12.8580 13.1860 13.1860 k = 0.4655 0.3484 0.2983 ( 5740 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5037 -22.5037 -22.5033 -22.5033 -21.9065 -21.9065 -21.9059 -21.9059 -21.7563 -21.7563 -21.7562 -21.7562 0.8279 0.8279 0.8306 0.8306 6.2593 6.2593 6.2618 6.2618 8.8673 8.8673 8.8884 8.8884 9.1822 9.1822 9.1881 9.1881 11.2803 11.2803 11.2836 11.2836 12.8540 12.8540 12.8601 12.8601 13.1719 13.1720 k = 0.4598 0.3584 0.2983 ( 5740 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5038 -22.5038 -22.5033 -22.5033 -21.9067 -21.9067 -21.9060 -21.9060 -21.7563 -21.7563 -21.7562 -21.7562 0.8328 0.8328 0.8359 0.8359 6.2749 6.2749 6.2779 6.2779 8.8525 8.8525 8.8806 8.8806 9.1342 9.1342 9.1448 9.1448 11.3044 11.3044 11.3079 11.3079 12.8561 12.8561 12.8632 12.8632 13.1555 13.1556 k = 0.4540 0.3683 0.2983 ( 5744 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5039 -22.5039 -22.5034 -22.5034 -21.9069 -21.9069 -21.9061 -21.9061 -21.7564 -21.7564 -21.7563 -21.7563 0.8383 0.8383 0.8418 0.8418 6.2927 6.2927 6.2964 6.2964 8.8325 8.8325 8.8698 8.8698 9.0829 9.0829 9.1004 9.1004 11.3305 11.3305 11.3341 11.3341 12.8593 12.8593 12.8675 12.8675 13.1367 13.1367 k = 0.4483 0.3783 0.2983 ( 5736 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5041 -22.5041 -22.5034 -22.5034 -21.9071 -21.9071 -21.9063 -21.9063 -21.7564 -21.7564 -21.7563 -21.7563 0.8445 0.8445 0.8484 0.8484 6.3128 6.3128 6.3171 6.3171 8.8051 8.8051 8.8537 8.8537 9.0312 9.0312 9.0578 9.0578 11.3581 11.3581 11.3617 11.3617 12.8637 12.8637 12.8730 12.8730 13.1160 13.1164 k = 0.4425 0.3882 0.2983 ( 5736 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5042 -22.5042 -22.5035 -22.5035 -21.9074 -21.9074 -21.9064 -21.9064 -21.7565 -21.7565 -21.7563 -21.7563 0.8513 0.8513 0.8556 0.8556 6.3350 6.3350 6.3402 6.3402 8.7682 8.7682 8.8285 8.8285 8.9839 8.9839 9.0199 9.0199 11.3867 11.3867 11.3903 11.3903 12.8693 12.8693 12.8799 12.8799 13.0935 13.0936 k = 0.4368 0.3982 0.2983 ( 5740 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5043 -22.5043 -22.5036 -22.5036 -21.9076 -21.9076 -21.9066 -21.9066 -21.7565 -21.7565 -21.7564 -21.7564 0.8585 0.8585 0.8632 0.8632 6.3593 6.3593 6.3654 6.3654 8.7209 8.7209 8.7892 8.7892 8.9467 8.9467 8.9885 8.9885 11.4161 11.4161 11.4195 11.4195 12.8758 12.8758 12.8882 12.8882 13.0689 13.0693 k = 0.4310 0.4081 0.2983 ( 5740 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5045 -22.5045 -22.5037 -22.5037 -21.9079 -21.9079 -21.9068 -21.9068 -21.7566 -21.7566 -21.7564 -21.7564 0.8663 0.8663 0.8714 0.8714 6.3856 6.3856 6.3927 6.3927 8.6637 8.6637 8.7351 8.7351 8.9211 8.9211 8.9635 8.9635 11.4457 11.4457 11.4489 11.4489 12.8825 12.8825 12.8974 12.8974 13.0437 13.0437 k = 0.4253 0.4181 0.2983 ( 5740 PWs) bands (ev): -45.7738 -45.7738 -45.7738 -45.7738 -22.5046 -22.5046 -22.5038 -22.5038 -21.9082 -21.9082 -21.9070 -21.9070 -21.7566 -21.7566 -21.7565 -21.7565 0.8745 0.8745 0.8799 0.8799 6.4138 6.4138 6.4221 6.4221 8.5988 8.5988 8.6704 8.6704 8.9035 8.9035 8.9438 8.9438 11.4754 11.4754 11.4783 11.4783 12.8878 12.8878 12.9063 12.9063 13.0197 13.0197 k = 0.4195 0.4280 0.2983 ( 5736 PWs) bands (ev): -45.7738 -45.7738 -45.7738 -45.7738 -22.5048 -22.5048 -22.5039 -22.5039 -21.9085 -21.9085 -21.9073 -21.9073 -21.7567 -21.7567 -21.7565 -21.7565 0.8829 0.8829 0.8887 0.8887 6.4437 6.4437 6.4534 6.4534 8.5282 8.5282 8.5995 8.5995 8.8904 8.8904 8.9279 8.9279 11.5048 11.5048 11.5073 11.5073 12.8886 12.8886 12.9113 12.9113 13.0008 13.0008 k = 0.4138 0.4380 0.2983 ( 5724 PWs) bands (ev): -45.7738 -45.7738 -45.7738 -45.7738 -22.5050 -22.5050 -22.5040 -22.5040 -21.9088 -21.9088 -21.9075 -21.9075 -21.7568 -21.7568 -21.7565 -21.7565 0.8916 0.8916 0.8978 0.8978 6.4751 6.4751 6.4864 6.4864 8.4539 8.4539 8.5251 8.5251 8.8796 8.8796 8.9145 8.9145 11.5337 11.5337 11.5358 11.5358 12.8811 12.8811 12.9055 12.9055 12.9943 12.9943 k = 0.4080 0.4479 0.2983 ( 5716 PWs) bands (ev): -45.7737 -45.7737 -45.7737 -45.7737 -22.5051 -22.5051 -22.5041 -22.5041 -21.9091 -21.9091 -21.9077 -21.9077 -21.7568 -21.7568 -21.7566 -21.7566 0.9005 0.9005 0.9070 0.9070 6.5080 6.5080 6.5212 6.5212 8.3772 8.3772 8.4490 8.4490 8.8702 8.8702 8.9029 8.9029 11.5619 11.5619 11.5636 11.5636 12.8646 12.8646 12.8870 12.8870 13.0027 13.0027 k = 0.4023 0.4579 0.2983 ( 5720 PWs) bands (ev): -45.7737 -45.7737 -45.7737 -45.7737 -22.5053 -22.5053 -22.5043 -22.5043 -21.9094 -21.9094 -21.9080 -21.9080 -21.7568 -21.7568 -21.7566 -21.7566 0.9094 0.9094 0.9162 0.9162 6.5420 6.5420 6.5574 6.5574 8.2994 8.2994 8.3725 8.3725 8.8616 8.8616 8.8926 8.8926 11.5893 11.5893 11.5905 11.5905 12.8417 12.8417 12.8613 12.8613 13.0204 13.0204 k = 0.3966 0.4679 0.2983 ( 5720 PWs) bands (ev): -45.7737 -45.7737 -45.7737 -45.7737 -22.5055 -22.5055 -22.5044 -22.5044 -21.9097 -21.9097 -21.9082 -21.9082 -21.7569 -21.7569 -21.7567 -21.7567 0.9183 0.9183 0.9254 0.9254 6.5769 6.5769 6.5948 6.5948 8.2214 8.2214 8.2964 8.2964 8.8537 8.8537 8.8834 8.8834 11.6157 11.6157 11.6164 11.6164 12.8157 12.8157 12.8330 12.8330 13.0435 13.0435 k = 0.3908 0.4778 0.2983 ( 5712 PWs) bands (ev): -45.7736 -45.7736 -45.7736 -45.7736 -22.5056 -22.5056 -22.5045 -22.5045 -21.9100 -21.9100 -21.9084 -21.9084 -21.7569 -21.7569 -21.7567 -21.7567 0.9271 0.9271 0.9344 0.9344 6.6124 6.6124 6.6332 6.6332 8.1441 8.1441 8.2216 8.2216 8.8464 8.8464 8.8750 8.8750 11.6409 11.6409 11.6411 11.6411 12.7885 12.7885 12.8040 12.8040 13.0701 13.0701 k = 0.3851 0.4878 0.2983 ( 5716 PWs) bands (ev): -45.7736 -45.7736 -45.7736 -45.7736 -22.5058 -22.5058 -22.5046 -22.5046 -21.9102 -21.9102 -21.9087 -21.9087 -21.7570 -21.7570 -21.7567 -21.7567 0.9356 0.9356 0.9431 0.9431 6.6480 6.6480 6.6722 6.6722 8.0683 8.0683 8.1491 8.1491 8.8395 8.8395 8.8674 8.8674 11.6644 11.6644 11.6647 11.6647 12.7612 12.7612 12.7755 12.7755 13.0994 13.0994 k = 0.3793 0.4977 0.2983 ( 5710 PWs) bands (ev): -45.7736 -45.7736 -45.7736 -45.7736 -22.5059 -22.5059 -22.5047 -22.5047 -21.9105 -21.9105 -21.9089 -21.9089 -21.7570 -21.7570 -21.7568 -21.7568 0.9437 0.9437 0.9515 0.9515 6.6833 6.6833 6.7113 6.7113 7.9951 7.9951 8.0797 8.0797 8.8332 8.8332 8.8605 8.8605 11.6863 11.6863 11.6870 11.6870 12.7349 12.7349 12.7481 12.7481 13.1309 13.1310 k = 0.3736 0.5077 0.2983 ( 5714 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5060 -22.5060 -22.5048 -22.5048 -21.9107 -21.9107 -21.9091 -21.9091 -21.7570 -21.7570 -21.7568 -21.7568 0.9513 0.9513 0.9593 0.9593 6.7177 6.7177 6.7501 6.7501 7.9253 7.9253 8.0143 8.0143 8.8275 8.8275 8.8543 8.8543 11.7064 11.7064 11.7075 11.7075 12.7099 12.7099 12.7223 12.7223 13.1643 13.1643 k = 0.3678 0.5176 0.2983 ( 5712 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5062 -22.5062 -22.5049 -22.5049 -21.9109 -21.9109 -21.9093 -21.9093 -21.7571 -21.7571 -21.7568 -21.7568 0.9584 0.9584 0.9665 0.9665 6.7503 6.7503 6.7877 6.7877 7.8599 7.8599 7.9540 7.9540 8.8223 8.8223 8.8489 8.8489 11.7246 11.7246 11.7261 11.7261 12.6870 12.6870 12.6987 12.6987 13.1992 13.1992 k = 0.3621 0.5276 0.2983 ( 5714 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5063 -22.5063 -22.5050 -22.5050 -21.9111 -21.9111 -21.9094 -21.9094 -21.7571 -21.7571 -21.7568 -21.7568 0.9647 0.9647 0.9729 0.9729 6.7804 6.7804 6.8231 6.8231 7.8004 7.8004 7.8999 7.8999 8.8178 8.8178 8.8442 8.8442 11.7406 11.7406 11.7425 11.7425 12.6665 12.6665 12.6778 12.6778 13.2353 13.2353 k = 0.3563 0.5375 0.2983 ( 5710 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5064 -22.5064 -22.5051 -22.5051 -21.9113 -21.9113 -21.9096 -21.9096 -21.7571 -21.7571 -21.7568 -21.7568 0.9701 0.9701 0.9785 0.9785 6.8070 6.8070 6.8553 6.8553 7.7481 7.7481 7.8533 7.8533 8.8140 8.8140 8.8402 8.8402 11.7541 11.7541 11.7563 11.7563 12.6491 12.6491 12.6599 12.6599 13.2724 13.2724 k = 0.3506 0.5475 0.2983 ( 5714 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5064 -22.5064 -22.5052 -22.5052 -21.9114 -21.9114 -21.9097 -21.9097 -21.7571 -21.7571 -21.7568 -21.7568 0.9745 0.9745 0.9830 0.9830 6.8289 6.8289 6.8826 6.8826 7.7048 7.7048 7.8155 7.8155 8.8109 8.8109 8.8371 8.8371 11.7650 11.7650 11.7674 11.7674 12.6350 12.6350 12.6455 12.6455 13.3101 13.3102 k = 0.3448 0.5574 0.2983 ( 5702 PWs) bands (ev): -45.7735 -45.7735 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9115 -21.9115 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9779 0.9779 0.9864 0.9864 6.8452 6.8452 6.9035 6.9035 7.6722 7.6722 7.7877 7.7877 8.8086 8.8086 8.8348 8.8348 11.7729 11.7729 11.7755 11.7755 12.6246 12.6246 12.6349 12.6349 13.3475 13.3475 k = 0.3391 0.5674 0.2983 ( 5706 PWs) bands (ev): -45.7734 -45.7734 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9116 -21.9116 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9799 0.9799 0.9886 0.9886 6.8551 6.8551 6.9165 6.9165 7.6520 7.6520 7.7707 7.7707 8.8073 8.8073 8.8334 8.8334 11.7778 11.7778 11.7805 11.7805 12.6183 12.6183 12.6284 12.6284 13.3775 13.3776 k = 0.3333 0.5774 0.2983 ( 5718 PWs) bands (ev): -45.7734 -45.7734 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9116 -21.9116 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9807 0.9807 0.9893 0.9893 6.8584 6.8584 6.9209 6.9209 7.6453 7.6453 7.7651 7.7651 8.8068 8.8068 8.8329 8.8329 11.7794 11.7794 11.7821 11.7821 12.6161 12.6161 12.6263 12.6263 13.3915 13.3915 k = 0.3333 0.5774 0.2983 ( 5718 PWs) bands (ev): -45.7734 -45.7734 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9116 -21.9116 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9807 0.9807 0.9893 0.9893 6.8584 6.8584 6.9209 6.9209 7.6453 7.6453 7.7651 7.7651 8.8068 8.8068 8.8329 8.8329 11.7794 11.7794 11.7821 11.7821 12.6161 12.6161 12.6263 12.6263 13.3915 13.3915 k = 0.3276 0.5674 0.2983 ( 5710 PWs) bands (ev): -45.7734 -45.7734 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9116 -21.9116 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9799 0.9799 0.9885 0.9885 6.8553 6.8553 6.9168 6.9168 7.6518 7.6518 7.7706 7.7706 8.8073 8.8073 8.8334 8.8334 11.7778 11.7778 11.7805 11.7805 12.6183 12.6183 12.6284 12.6284 13.3772 13.3772 k = 0.3218 0.5574 0.2983 ( 5714 PWs) bands (ev): -45.7735 -45.7735 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9115 -21.9115 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9776 0.9776 0.9861 0.9861 6.8467 6.8467 6.9053 6.9053 7.6707 7.6707 7.7864 7.7864 8.8088 8.8088 8.8349 8.8349 11.7731 11.7731 11.7757 11.7757 12.6245 12.6245 12.6348 12.6348 13.3457 13.3458 k = 0.3161 0.5475 0.2983 ( 5714 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5064 -22.5064 -22.5051 -22.5051 -21.9114 -21.9114 -21.9097 -21.9097 -21.7571 -21.7571 -21.7568 -21.7568 0.9735 0.9735 0.9820 0.9820 6.8339 6.8339 6.8884 6.8884 7.7000 7.7000 7.8115 7.8115 8.8114 8.8114 8.8374 8.8374 11.7654 11.7654 11.7679 11.7679 12.6347 12.6347 12.6451 12.6451 13.3057 13.3057 k = 0.3103 0.5375 0.2983 ( 5706 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5063 -22.5063 -22.5050 -22.5050 -21.9112 -21.9112 -21.9095 -21.9095 -21.7571 -21.7571 -21.7568 -21.7568 0.9677 0.9677 0.9761 0.9761 6.8182 6.8182 6.8680 6.8680 7.7379 7.7379 7.8443 7.8443 8.8151 8.8151 8.8409 8.8409 11.7552 11.7552 11.7575 11.7575 12.6485 12.6485 12.6591 12.6591 13.2643 13.2643 k = 0.3046 0.5276 0.2983 ( 5712 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5062 -22.5062 -22.5049 -22.5049 -21.9110 -21.9110 -21.9093 -21.9093 -21.7571 -21.7571 -21.7568 -21.7568 0.9599 0.9599 0.9682 0.9682 6.8011 6.8011 6.8461 6.8461 7.7825 7.7825 7.8836 7.8836 8.8199 8.8199 8.8455 8.8455 11.7427 11.7427 11.7447 11.7447 12.6653 12.6653 12.6760 12.6760 13.2223 13.2223 k = 0.2989 0.5176 0.2983 ( 5716 PWs) bands (ev): -45.7735 -45.7735 -45.7735 -45.7735 -22.5060 -22.5060 -22.5048 -22.5048 -21.9108 -21.9108 -21.9091 -21.9091 -21.7571 -21.7571 -21.7568 -21.7568 0.9503 0.9503 0.9584 0.9584 6.7837 6.7837 6.8241 6.8241 7.8322 7.8322 7.9280 7.9280 8.8260 8.8260 8.8512 8.8512 11.7283 11.7283 11.7300 11.7300 12.6844 12.6844 12.6953 12.6953 13.1804 13.1804 k = 0.2931 0.5077 0.2983 ( 5712 PWs) bands (ev): -45.7736 -45.7736 -45.7736 -45.7736 -22.5058 -22.5058 -22.5046 -22.5046 -21.9104 -21.9104 -21.9088 -21.9088 -21.7571 -21.7571 -21.7568 -21.7568 0.9386 0.9386 0.9466 0.9466 6.7671 6.7671 6.8032 6.8032 7.8858 7.8858 7.9765 7.9765 8.8333 8.8333 8.8579 8.8579 11.7123 11.7123 11.7138 11.7138 12.7049 12.7049 12.7158 12.7158 13.1393 13.1393 k = 0.2874 0.4977 0.2983 ( 5712 PWs) bands (ev): -45.7736 -45.7736 -45.7736 -45.7736 -22.5056 -22.5056 -22.5044 -22.5044 -21.9101 -21.9101 -21.9084 -21.9084 -21.7571 -21.7571 -21.7568 -21.7568 0.9249 0.9249 0.9327 0.9327 6.7522 6.7522 6.7845 6.7845 7.9424 7.9424 8.0281 8.0281 8.8419 8.8419 8.8658 8.8658 11.6952 11.6952 11.6963 11.6963 12.7255 12.7255 12.7362 12.7362 13.1002 13.1008 k = 0.2816 0.4878 0.2983 ( 5710 PWs) bands (ev): -45.7737 -45.7737 -45.7737 -45.7737 -22.5053 -22.5053 -22.5042 -22.5042 -21.9096 -21.9096 -21.9080 -21.9080 -21.7571 -21.7571 -21.7568 -21.7568 0.9092 0.9092 0.9167 0.9167 6.7396 6.7396 6.7684 6.7684 8.0011 8.0011 8.0820 8.0820 8.8518 8.8518 8.8747 8.8747 11.6774 11.6774 11.6781 11.6781 12.7441 12.7441 12.7541 12.7541 13.0652 13.0652 k = 0.2759 0.4778 0.2983 ( 5714 PWs) bands (ev): -45.7737 -45.7737 -45.7737 -45.7737 -22.5050 -22.5050 -22.5039 -22.5039 -21.9092 -21.9092 -21.9076 -21.9076 -21.7570 -21.7570 -21.7568 -21.7568 0.8914 0.8914 0.8987 0.8987 6.7299 6.7299 6.7555 6.7555 8.0614 8.0614 8.1375 8.1375 8.8631 8.8631 8.8847 8.8847 11.6590 11.6590 11.6594 11.6594 12.7573 12.7573 12.7659 12.7659 13.0364 13.0364 k = 0.2701 0.4679 0.2983 ( 5710 PWs) bands (ev): -45.7738 -45.7738 -45.7738 -45.7738 -22.5047 -22.5047 -22.5036 -22.5036 -21.9086 -21.9086 -21.9071 -21.9071 -21.7570 -21.7570 -21.7568 -21.7568 0.8715 0.8715 0.8786 0.8786 6.7233 6.7233 6.7462 6.7462 8.1228 8.1228 8.1941 8.1941 8.8758 8.8758 8.8958 8.8958 11.6405 11.6405 11.6406 11.6406 12.7606 12.7606 12.7668 12.7668 13.0178 13.0181 k = 0.2644 0.4579 0.2983 ( 5714 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5043 -22.5043 -22.5032 -22.5032 -21.9080 -21.9080 -21.9065 -21.9065 -21.7570 -21.7570 -21.7568 -21.7568 0.8496 0.8496 0.8564 0.8564 6.7202 6.7202 6.7407 6.7407 8.1848 8.1848 8.2511 8.2511 8.8900 8.8900 8.9079 8.9079 11.6217 11.6217 11.6223 11.6223 12.7500 12.7500 12.7535 12.7535 13.0138 13.0138 k = 0.2586 0.4479 0.2983 ( 5718 PWs) bands (ev): -45.7739 -45.7739 -45.7739 -45.7739 -22.5039 -22.5039 -22.5028 -22.5028 -21.9074 -21.9074 -21.9059 -21.9059 -21.7570 -21.7570 -21.7568 -21.7568 0.8257 0.8257 0.8323 0.8323 6.7207 6.7207 6.7390 6.7390 8.2470 8.2470 8.3082 8.3082 8.9056 8.9056 8.9210 8.9210 11.6033 11.6033 11.6043 11.6043 12.7258 12.7258 12.7272 12.7272 13.0245 13.0246 k = 0.2529 0.4380 0.2983 ( 5718 PWs) bands (ev): -45.7740 -45.7740 -45.7740 -45.7740 -22.5034 -22.5034 -22.5024 -22.5024 -21.9067 -21.9067 -21.9053 -21.9053 -21.7570 -21.7570 -21.7568 -21.7568 0.8000 0.8000 0.8062 0.8062 6.7250 6.7250 6.7414 6.7414 8.3092 8.3092 8.3648 8.3648 8.9229 8.9229 8.9351 8.9351 11.5855 11.5855 11.5871 11.5871 12.6915 12.6915 12.6918 12.6918 13.0462 13.0462 k = 0.2471 0.4280 0.2983 ( 5718 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5029 -22.5029 -22.5019 -22.5019 -21.9059 -21.9059 -21.9046 -21.9046 -21.7570 -21.7570 -21.7568 -21.7568 0.7723 0.7723 0.7783 0.7783 6.7331 6.7331 6.7478 6.7478 8.3709 8.3709 8.4204 8.4204 8.9418 8.9418 8.9502 8.9502 11.5685 11.5685 11.5707 11.5707 12.6509 12.6509 12.6511 12.6511 13.0748 13.0748 k = 0.2414 0.4181 0.2983 ( 5714 PWs) bands (ev): -45.7742 -45.7742 -45.7742 -45.7742 -22.5024 -22.5024 -22.5015 -22.5015 -21.9051 -21.9051 -21.9038 -21.9038 -21.7570 -21.7570 -21.7568 -21.7568 0.7430 0.7430 0.7486 0.7486 6.7451 6.7451 6.7581 6.7581 8.4320 8.4320 8.4748 8.4748 8.9624 8.9624 8.9662 8.9662 11.5526 11.5526 11.5553 11.5553 12.6070 12.6070 12.6073 12.6073 13.1076 13.1076 k = 0.2356 0.4081 0.2983 ( 5710 PWs) bands (ev): -45.7743 -45.7743 -45.7743 -45.7743 -22.5018 -22.5018 -22.5009 -22.5009 -21.9042 -21.9042 -21.9030 -21.9030 -21.7570 -21.7570 -21.7568 -21.7568 0.7120 0.7120 0.7173 0.7173 6.7608 6.7608 6.7724 6.7724 8.4920 8.4920 8.5273 8.5273 8.9832 8.9832 8.9848 8.9848 11.5379 11.5379 11.5413 11.5413 12.5615 12.5615 12.5617 12.5617 13.1429 13.1429 k = 0.2299 0.3982 0.2983 ( 5718 PWs) bands (ev): -45.7744 -45.7744 -45.7744 -45.7744 -22.5012 -22.5012 -22.5004 -22.5004 -21.9033 -21.9033 -21.9021 -21.9021 -21.7570 -21.7570 -21.7568 -21.7568 0.6794 0.6794 0.6844 0.6844 6.7802 6.7802 6.7906 6.7906 8.5506 8.5506 8.5778 8.5778 9.0011 9.0011 9.0090 9.0090 11.5246 11.5246 11.5287 11.5287 12.5153 12.5153 12.5155 12.5155 13.1797 13.1798 k = 0.2241 0.3882 0.2983 ( 5708 PWs) bands (ev): -45.7745 -45.7745 -45.7745 -45.7745 -22.5006 -22.5006 -22.4998 -22.4998 -21.9023 -21.9023 -21.9012 -21.9012 -21.7570 -21.7570 -21.7568 -21.7568 0.6455 0.6455 0.6502 0.6502 6.8033 6.8033 6.8124 6.8124 8.6077 8.6077 8.6259 8.6259 9.0199 9.0199 9.0351 9.0351 11.5129 11.5129 11.5177 11.5177 12.4688 12.4688 12.4694 12.4694 13.2173 13.2173 k = 0.2184 0.3783 0.2983 ( 5708 PWs) bands (ev): -45.7747 -45.7747 -45.7747 -45.7747 -22.4999 -22.4999 -22.4991 -22.4991 -21.9013 -21.9013 -21.9002 -21.9002 -21.7571 -21.7571 -21.7569 -21.7569 0.6103 0.6103 0.6147 0.6147 6.8298 6.8298 6.8378 6.8378 8.6628 8.6628 8.6712 8.6712 9.0397 9.0397 9.0629 9.0629 11.5029 11.5029 11.5085 11.5085 12.4228 12.4228 12.4239 12.4239 13.2551 13.2551 k = 0.2126 0.3683 0.2983 ( 5708 PWs) bands (ev): -45.7748 -45.7748 -45.7748 -45.7748 -22.4992 -22.4992 -22.4985 -22.4985 -21.9002 -21.9002 -21.8992 -21.8992 -21.7571 -21.7571 -21.7569 -21.7569 0.5740 0.5740 0.5781 0.5781 6.8595 6.8595 6.8665 6.8665 8.7136 8.7136 8.7156 8.7156 9.0605 9.0605 9.0925 9.0925 11.4948 11.4948 11.5011 11.5011 12.3777 12.3777 12.3793 12.3793 13.2925 13.2925 k = 0.2069 0.3584 0.2983 ( 5710 PWs) bands (ev): -45.7749 -45.7749 -45.7749 -45.7749 -22.4985 -22.4985 -22.4978 -22.4978 -21.8991 -21.8991 -21.8982 -21.8982 -21.7571 -21.7571 -21.7569 -21.7569 0.5366 0.5366 0.5405 0.5405 6.8924 6.8924 6.8984 6.8984 8.7531 8.7531 8.7658 8.7658 9.0824 9.0824 9.1236 9.1236 11.4886 11.4886 11.4958 11.4958 12.3338 12.3338 12.3359 12.3359 13.3292 13.3292 k = 0.2011 0.3484 0.2983 ( 5708 PWs) bands (ev): -45.7751 -45.7751 -45.7751 -45.7751 -22.4977 -22.4977 -22.4971 -22.4971 -21.8980 -21.8980 -21.8971 -21.8971 -21.7571 -21.7571 -21.7570 -21.7570 0.4985 0.4985 0.5020 0.5020 6.9282 6.9282 6.9332 6.9332 8.7896 8.7896 8.8130 8.8130 9.1056 9.1056 9.1558 9.1558 11.4845 11.4845 11.4925 11.4925 12.2913 12.2913 12.2941 12.2941 13.3646 13.3646 k = 0.1954 0.3384 0.2983 ( 5718 PWs) bands (ev): -45.7752 -45.7752 -45.7752 -45.7752 -22.4970 -22.4970 -22.4963 -22.4963 -21.8968 -21.8968 -21.8959 -21.8959 -21.7572 -21.7572 -21.7570 -21.7570 0.4596 0.4596 0.4629 0.4629 6.9666 6.9666 6.9708 6.9708 8.8234 8.8234 8.8570 8.8570 9.1301 9.1301 9.1890 9.1890 11.4824 11.4824 11.4914 11.4914 12.2507 12.2507 12.2541 12.2541 13.3984 13.3984 k = 0.1897 0.3285 0.2983 ( 5730 PWs) bands (ev): -45.7753 -45.7753 -45.7753 -45.7753 -22.4962 -22.4962 -22.4956 -22.4956 -21.8956 -21.8956 -21.8948 -21.8948 -21.7572 -21.7572 -21.7570 -21.7570 0.4202 0.4202 0.4232 0.4232 7.0074 7.0074 7.0108 7.0108 8.8545 8.8545 8.8974 8.8974 9.1560 9.1560 9.2226 9.2226 11.4825 11.4825 11.4924 11.4924 12.2121 12.2121 12.2161 12.2161 13.4299 13.4299 k = 0.1839 0.3185 0.2983 ( 5726 PWs) bands (ev): -45.7755 -45.7755 -45.7755 -45.7755 -22.4953 -22.4953 -22.4948 -22.4948 -21.8943 -21.8943 -21.8936 -21.8936 -21.7572 -21.7572 -21.7571 -21.7571 0.3804 0.3804 0.3832 0.3832 7.0505 7.0505 7.0531 7.0531 8.8834 8.8834 8.9341 8.9341 9.1834 9.1834 9.2563 9.2563 11.4848 11.4848 11.4956 11.4956 12.1757 12.1757 12.1804 12.1804 13.4583 13.4584 k = 0.1782 0.3086 0.2983 ( 5728 PWs) bands (ev): -45.7756 -45.7756 -45.7756 -45.7756 -22.4945 -22.4945 -22.4940 -22.4940 -21.8931 -21.8931 -21.8924 -21.8924 -21.7572 -21.7572 -21.7571 -21.7571 0.3404 0.3404 0.3429 0.3429 7.0954 7.0954 7.0973 7.0973 8.9102 8.9102 8.9672 8.9672 9.2120 9.2120 9.2897 9.2897 11.4892 11.4892 11.5009 11.5009 12.1417 12.1417 12.1471 12.1471 13.4831 13.4831 k = 0.1724 0.2986 0.2983 ( 5732 PWs) bands (ev): -45.7758 -45.7758 -45.7758 -45.7758 -22.4936 -22.4936 -22.4932 -22.4932 -21.8918 -21.8918 -21.8911 -21.8911 -21.7573 -21.7573 -21.7571 -21.7571 0.3002 0.3002 0.3025 0.3025 7.1418 7.1418 7.1431 7.1431 8.9352 8.9352 8.9968 8.9968 9.2417 9.2417 9.3224 9.3224 11.4957 11.4957 11.5083 11.5083 12.1103 12.1103 12.1164 12.1164 13.5031 13.5031 k = 0.1667 0.2887 0.2983 ( 5732 PWs) bands (ev): -45.7760 -45.7760 -45.7760 -45.7760 -22.4928 -22.4928 -22.4923 -22.4923 -21.8905 -21.8905 -21.8898 -21.8898 -21.7573 -21.7573 -21.7572 -21.7572 0.2601 0.2601 0.2622 0.2622 7.1896 7.1896 7.1902 7.1902 8.9587 8.9587 9.0233 9.0233 9.2720 9.2720 9.3542 9.3542 11.5042 11.5042 11.5177 11.5177 12.0817 12.0817 12.0885 12.0885 13.5175 13.5175 k = 0.1609 0.2787 0.2983 ( 5736 PWs) bands (ev): -45.7761 -45.7761 -45.7761 -45.7761 -22.4919 -22.4919 -22.4915 -22.4915 -21.8891 -21.8891 -21.8886 -21.8886 -21.7573 -21.7573 -21.7572 -21.7572 0.2201 0.2201 0.2220 0.2220 7.2383 7.2383 7.2383 7.2383 8.9810 8.9810 9.0472 9.0472 9.3025 9.3025 9.3847 9.3847 11.5145 11.5145 11.5289 11.5289 12.0559 12.0559 12.0634 12.0634 13.5254 13.5254 k = 0.1552 0.2688 0.2983 ( 5748 PWs) bands (ev): -45.7763 -45.7763 -45.7763 -45.7763 -22.4910 -22.4910 -22.4907 -22.4907 -21.8878 -21.8878 -21.8873 -21.8873 -21.7574 -21.7574 -21.7573 -21.7573 0.1804 0.1804 0.1821 0.1821 7.2872 7.2872 7.2877 7.2877 9.0025 9.0025 9.0690 9.0690 9.3328 9.3328 9.4138 9.4138 11.5267 11.5267 11.5418 11.5418 12.0331 12.0331 12.0412 12.0412 13.5260 13.5260 k = 0.1494 0.2588 0.2983 ( 5738 PWs) bands (ev): -45.7764 -45.7764 -45.7764 -45.7764 -22.4902 -22.4902 -22.4898 -22.4898 -21.8865 -21.8865 -21.8860 -21.8860 -21.7574 -21.7574 -21.7573 -21.7573 0.1412 0.1412 0.1427 0.1427 7.3363 7.3363 7.3374 7.3374 9.0232 9.0232 9.0891 9.0891 9.3625 9.3625 9.4414 9.4414 11.5405 11.5405 11.5563 11.5563 12.0133 12.0133 12.0220 12.0220 13.5190 13.5190 k = 0.1437 0.2489 0.2983 ( 5734 PWs) bands (ev): -45.7766 -45.7766 -45.7766 -45.7766 -22.4893 -22.4893 -22.4890 -22.4890 -21.8851 -21.8851 -21.8847 -21.8847 -21.7575 -21.7575 -21.7574 -21.7574 0.1024 0.1024 0.1038 0.1038 7.3855 7.3855 7.3869 7.3869 9.0436 9.0436 9.1081 9.1081 9.3913 9.3913 9.4673 9.4673 11.5558 11.5558 11.5721 11.5721 11.9964 11.9964 12.0057 12.0057 13.5046 13.5046 k = 0.1379 0.2389 0.2983 ( 5734 PWs) bands (ev): -45.7768 -45.7768 -45.7768 -45.7768 -22.4884 -22.4884 -22.4881 -22.4881 -21.8838 -21.8838 -21.8834 -21.8834 -21.7575 -21.7575 -21.7574 -21.7574 0.0644 0.0644 0.0656 0.0656 7.4342 7.4342 7.4361 7.4361 9.0639 9.0639 9.1265 9.1265 9.4188 9.4188 9.4915 9.4915 11.5725 11.5725 11.5893 11.5893 11.9825 11.9825 11.9923 11.9923 13.4832 13.4832 k = 0.1322 0.2289 0.2983 ( 5730 PWs) bands (ev): -45.7769 -45.7769 -45.7769 -45.7769 -22.4875 -22.4875 -22.4873 -22.4873 -21.8824 -21.8824 -21.8821 -21.8821 -21.7575 -21.7575 -21.7574 -21.7574 0.0271 0.0271 0.0281 0.0281 7.4822 7.4822 7.4844 7.4844 9.0844 9.0844 9.1446 9.1446 9.4450 9.4450 9.5139 9.5139 11.5904 11.5904 11.6075 11.6075 11.9715 11.9715 11.9816 11.9816 13.4556 13.4556 k = 0.1264 0.2190 0.2983 ( 5738 PWs) bands (ev): -45.7771 -45.7771 -45.7771 -45.7771 -22.4867 -22.4867 -22.4865 -22.4865 -21.8811 -21.8811 -21.8808 -21.8808 -21.7576 -21.7576 -21.7575 -21.7575 -0.0094 -0.0094 -0.0085 -0.0085 7.5292 7.5292 7.5315 7.5315 9.1054 9.1054 9.1628 9.1628 9.4696 9.4696 9.5345 9.5345 11.6093 11.6093 11.6266 11.6266 11.9631 11.9631 11.9735 11.9735 13.4226 13.4226 k = 0.1207 0.2090 0.2983 ( 5734 PWs) bands (ev): -45.7772 -45.7772 -45.7772 -45.7772 -22.4858 -22.4858 -22.4857 -22.4857 -21.8798 -21.8798 -21.8795 -21.8795 -21.7576 -21.7576 -21.7575 -21.7575 -0.0449 -0.0449 -0.0441 -0.0441 7.5746 7.5746 7.5772 7.5772 9.1271 9.1271 9.1816 9.1816 9.4925 9.4925 9.5533 9.5533 11.6292 11.6292 11.6465 11.6465 11.9573 11.9573 11.9678 11.9678 13.3851 13.3851 k = 0.1149 0.1991 0.2983 ( 5728 PWs) bands (ev): -45.7774 -45.7774 -45.7774 -45.7774 -22.4850 -22.4850 -22.4849 -22.4849 -21.8785 -21.8785 -21.8783 -21.8783 -21.7576 -21.7576 -21.7576 -21.7576 -0.0793 -0.0793 -0.0786 -0.0786 7.6183 7.6183 7.6209 7.6209 9.1498 9.1498 9.2012 9.2012 9.5138 9.5138 9.5704 9.5704 11.6500 11.6500 11.6672 11.6672 11.9537 11.9537 11.9643 11.9643 13.3439 13.3439 k = 0.1092 0.1891 0.2983 ( 5732 PWs) bands (ev): -45.7775 -45.7775 -45.7775 -45.7775 -22.4842 -22.4842 -22.4841 -22.4841 -21.8773 -21.8773 -21.8771 -21.8771 -21.7576 -21.7576 -21.7576 -21.7576 -0.1126 -0.1126 -0.1120 -0.1120 7.6599 7.6599 7.6625 7.6625 9.1737 9.1737 9.2218 9.2218 9.5334 9.5334 9.5858 9.5858 11.6715 11.6715 11.6883 11.6883 11.9521 11.9521 11.9627 11.9627 13.2996 13.2997 k = 0.1034 0.1792 0.2983 ( 5720 PWs) bands (ev): -45.7777 -45.7777 -45.7777 -45.7777 -22.4834 -22.4834 -22.4833 -22.4833 -21.8761 -21.8761 -21.8759 -21.8759 -21.7577 -21.7577 -21.7576 -21.7576 -0.1446 -0.1446 -0.1441 -0.1441 7.6991 7.6991 7.7017 7.7017 9.1990 9.1990 9.2438 9.2438 9.5513 9.5513 9.5996 9.5996 11.6936 11.6936 11.7100 11.7100 11.9523 11.9523 11.9627 11.9627 13.2530 13.2530 k = 0.0977 0.1692 0.2983 ( 5726 PWs) bands (ev): -45.7778 -45.7778 -45.7778 -45.7778 -22.4827 -22.4827 -22.4826 -22.4826 -21.8749 -21.8749 -21.8747 -21.8747 -21.7577 -21.7577 -21.7577 -21.7577 -0.1754 -0.1754 -0.1749 -0.1749 7.7357 7.7357 7.7381 7.7381 9.2256 9.2256 9.2672 9.2672 9.5676 9.5676 9.6118 9.6118 11.7162 11.7162 11.7320 11.7320 11.9539 11.9539 11.9640 11.9640 13.2047 13.2047 k = 0.0920 0.1593 0.2983 ( 5722 PWs) bands (ev): -45.7779 -45.7779 -45.7779 -45.7779 -22.4820 -22.4820 -22.4819 -22.4819 -21.8738 -21.8738 -21.8736 -21.8736 -21.7577 -21.7577 -21.7577 -21.7577 -0.2047 -0.2047 -0.2044 -0.2044 7.7695 7.7695 7.7718 7.7718 9.2538 9.2538 9.2920 9.2920 9.5823 9.5823 9.6227 9.6227 11.7392 11.7392 11.7543 11.7543 11.9566 11.9566 11.9663 11.9663 13.1553 13.1553 k = 0.0862 0.1493 0.2983 ( 5726 PWs) bands (ev): -45.7781 -45.7781 -45.7781 -45.7781 -22.4813 -22.4813 -22.4812 -22.4812 -21.8727 -21.8727 -21.8726 -21.8726 -21.7577 -21.7577 -21.7577 -21.7577 -0.2326 -0.2326 -0.2323 -0.2323 7.8005 7.8005 7.8025 7.8025 9.2833 9.2833 9.3183 9.3183 9.5955 9.5955 9.6322 9.6322 11.7623 11.7623 11.7767 11.7767 11.9601 11.9601 11.9694 11.9694 13.1052 13.1052 k = 0.0805 0.1394 0.2983 ( 5722 PWs) bands (ev): -45.7782 -45.7782 -45.7782 -45.7782 -22.4806 -22.4806 -22.4805 -22.4805 -21.8716 -21.8716 -21.8715 -21.8715 -21.7577 -21.7577 -21.7577 -21.7577 -0.2590 -0.2590 -0.2588 -0.2588 7.8285 7.8285 7.8303 7.8303 9.3141 9.3141 9.3458 9.3458 9.6075 9.6075 9.6405 9.6405 11.7856 11.7856 11.7991 11.7991 11.9641 11.9641 11.9730 11.9730 13.0550 13.0550 k = 0.0747 0.1294 0.2983 ( 5722 PWs) bands (ev): -45.7783 -45.7783 -45.7783 -45.7783 -22.4800 -22.4800 -22.4799 -22.4799 -21.8706 -21.8706 -21.8706 -21.8706 -21.7578 -21.7578 -21.7577 -21.7577 -0.2838 -0.2838 -0.2837 -0.2837 7.8536 7.8536 7.8551 7.8551 9.3458 9.3458 9.3744 9.3744 9.6182 9.6182 9.6477 9.6477 11.8087 11.8087 11.8213 11.8213 11.9684 11.9684 11.9769 11.9769 13.0052 13.0052 k = 0.0690 0.1195 0.2983 ( 5722 PWs) bands (ev): -45.7784 -45.7784 -45.7784 -45.7784 -22.4794 -22.4794 -22.4793 -22.4793 -21.8697 -21.8697 -21.8696 -21.8696 -21.7578 -21.7578 -21.7578 -21.7578 -0.3070 -0.3070 -0.3069 -0.3069 7.8758 7.8758 7.8771 7.8771 9.3781 9.3781 9.4036 9.4036 9.6278 9.6278 9.6540 9.6540 11.8315 11.8315 11.8431 11.8431 11.9728 11.9728 11.9807 11.9807 12.9563 12.9563 k = 0.0632 0.1095 0.2983 ( 5722 PWs) bands (ev): -45.7785 -45.7785 -45.7785 -45.7785 -22.4788 -22.4788 -22.4788 -22.4788 -21.8688 -21.8688 -21.8688 -21.8688 -21.7578 -21.7578 -21.7578 -21.7578 -0.3286 -0.3286 -0.3284 -0.3284 7.8953 7.8953 7.8963 7.8963 9.4105 9.4105 9.4329 9.4329 9.6366 9.6366 9.6596 9.6596 11.8537 11.8537 11.8644 11.8644 11.9770 11.9770 11.9845 11.9845 12.9087 12.9087 k = 0.0575 0.0995 0.2983 ( 5718 PWs) bands (ev): -45.7786 -45.7786 -45.7786 -45.7786 -22.4783 -22.4783 -22.4783 -22.4783 -21.8680 -21.8680 -21.8680 -21.8680 -21.7578 -21.7578 -21.7578 -21.7578 -0.3484 -0.3484 -0.3483 -0.3483 7.9122 7.9122 7.9130 7.9130 9.4426 9.4426 9.4620 9.4620 9.6448 9.6448 9.6646 9.6646 11.8752 11.8752 11.8848 11.8848 11.9810 11.9810 11.9880 11.9880 12.8631 12.8631 k = 0.0517 0.0896 0.2983 ( 5718 PWs) bands (ev): -45.7787 -45.7787 -45.7787 -45.7787 -22.4779 -22.4779 -22.4778 -22.4778 -21.8673 -21.8673 -21.8673 -21.8673 -21.7578 -21.7578 -21.7578 -21.7578 -0.3664 -0.3664 -0.3663 -0.3663 7.9266 7.9266 7.9272 7.9272 9.4736 9.4736 9.4900 9.4900 9.6524 9.6524 9.6692 9.6692 11.8957 11.8957 11.9043 11.9043 11.9846 11.9846 11.9910 11.9910 12.8198 12.8198 k = 0.0460 0.0796 0.2983 ( 5710 PWs) bands (ev): -45.7788 -45.7788 -45.7788 -45.7788 -22.4774 -22.4774 -22.4774 -22.4774 -21.8666 -21.8666 -21.8666 -21.8666 -21.7578 -21.7578 -21.7578 -21.7578 -0.3826 -0.3826 -0.3826 -0.3826 7.9389 7.9389 7.9393 7.9393 9.5029 9.5029 9.5164 9.5164 9.6599 9.6599 9.6736 9.6736 11.9150 11.9150 11.9225 11.9225 11.9878 11.9878 11.9937 11.9937 12.7794 12.7794 k = 0.0402 0.0697 0.2983 ( 5710 PWs) bands (ev): -45.7789 -45.7789 -45.7789 -45.7789 -22.4771 -22.4771 -22.4771 -22.4771 -21.8660 -21.8660 -21.8660 -21.8660 -21.7578 -21.7578 -21.7578 -21.7578 -0.3970 -0.3970 -0.3970 -0.3970 7.9491 7.9491 7.9494 7.9494 9.5299 9.5299 9.5404 9.5404 9.6674 9.6674 9.6781 9.6781 11.9328 11.9328 11.9393 11.9393 11.9905 11.9905 11.9958 11.9958 12.7424 12.7424 k = 0.0345 0.0597 0.2983 ( 5706 PWs) bands (ev): -45.7789 -45.7789 -45.7789 -45.7789 -22.4767 -22.4767 -22.4767 -22.4767 -21.8655 -21.8655 -21.8655 -21.8655 -21.7578 -21.7578 -21.7578 -21.7578 -0.4096 -0.4096 -0.4095 -0.4095 7.9576 7.9576 7.9578 7.9578 9.5536 9.5536 9.5612 9.5612 9.6752 9.6752 9.6829 9.6829 11.9488 11.9488 11.9543 11.9543 11.9927 11.9927 11.9974 11.9974 12.7092 12.7092 k = 0.0287 0.0498 0.2983 ( 5710 PWs) bands (ev): -45.7790 -45.7790 -45.7790 -45.7790 -22.4765 -22.4765 -22.4765 -22.4765 -21.8651 -21.8651 -21.8651 -21.8651 -21.7578 -21.7578 -21.7578 -21.7578 -0.4202 -0.4202 -0.4202 -0.4202 7.9644 7.9644 7.9645 7.9645 9.5735 9.5735 9.5785 9.5785 9.6831 9.6831 9.6881 9.6881 11.9629 11.9629 11.9674 11.9674 11.9946 11.9946 11.9985 11.9985 12.6802 12.6802 k = 0.0230 0.0398 0.2983 ( 5710 PWs) bands (ev): -45.7790 -45.7790 -45.7790 -45.7790 -22.4762 -22.4762 -22.4762 -22.4762 -21.8647 -21.8647 -21.8647 -21.8647 -21.7578 -21.7578 -21.7578 -21.7578 -0.4290 -0.4290 -0.4290 -0.4290 7.9697 7.9697 7.9698 7.9698 9.5892 9.5892 9.5920 9.5920 9.6910 9.6910 9.6938 9.6938 11.9748 11.9748 11.9782 11.9782 11.9961 11.9961 11.9992 11.9992 12.6559 12.6560 k = 0.0172 0.0299 0.2983 ( 5702 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4761 -22.4761 -22.4761 -22.4761 -21.8644 -21.8644 -21.8644 -21.8644 -21.7578 -21.7578 -21.7578 -21.7578 -0.4358 -0.4358 -0.4358 -0.4358 7.9737 7.9737 7.9737 7.9737 9.6006 9.6006 9.6019 9.6019 9.6982 9.6982 9.6994 9.6994 11.9843 11.9843 11.9866 11.9866 11.9974 11.9974 11.9997 11.9997 12.6365 12.6367 k = 0.0115 0.0199 0.2983 ( 5682 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4759 -22.4759 -22.4759 -22.4759 -21.8642 -21.8642 -21.8642 -21.8642 -21.7578 -21.7578 -21.7578 -21.7578 -0.4407 -0.4407 -0.4407 -0.4407 7.9765 7.9765 7.9765 7.9765 9.6082 9.6082 9.6085 9.6085 9.7040 9.7040 9.7044 9.7044 11.9910 11.9910 11.9922 11.9922 11.9989 11.9989 12.0000 12.0000 12.6225 12.6225 k = 0.0057 0.0100 0.2983 ( 5670 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4758 -22.4758 -22.4758 -22.4758 -21.8641 -21.8641 -21.8641 -21.8641 -21.7578 -21.7578 -21.7578 -21.7578 -0.4436 -0.4436 -0.4436 -0.4436 7.9781 7.9781 7.9781 7.9781 9.6123 9.6123 9.6124 9.6124 9.7078 9.7078 9.7078 9.7078 11.9947 11.9947 11.9949 11.9949 12.0004 12.0004 12.0006 12.0006 12.6140 12.6140 k = 0.0000 0.0000 0.2983 ( 5684 PWs) bands (ev): -45.7791 -45.7791 -45.7791 -45.7791 -22.4758 -22.4758 -22.4758 -22.4758 -21.8640 -21.8640 -21.8640 -21.8640 -21.7578 -21.7578 -21.7578 -21.7578 -0.4446 -0.4446 -0.4446 -0.4446 7.9786 7.9786 7.9786 7.9786 9.6137 9.6137 9.6137 9.6137 9.7091 9.7091 9.7091 9.7091 11.9957 11.9957 11.9957 11.9957 12.0011 12.0011 12.0011 12.0011 12.6111 12.6111 k = 0.5000 0.2887 0.2983 ( 5744 PWs) bands (ev): -45.7741 -45.7741 -45.7741 -45.7741 -22.5033 -22.5033 -22.5033 -22.5033 -21.9057 -21.9057 -21.9057 -21.9057 -21.7561 -21.7561 -21.7561 -21.7561 0.8148 0.8148 0.8148 0.8148 6.2163 6.2163 6.2163 6.2163 8.9026 8.9026 8.9026 8.9026 9.3301 9.3301 9.3301 9.3301 11.2060 11.2060 11.2060 11.2060 12.8535 12.8535 12.8535 12.8535 13.2182 13.2182 k = 0.5000 0.2887 0.2869 ( 5738 PWs) bands (ev): -45.7748 -45.7748 -45.7734 -45.7734 -22.5040 -22.5040 -22.5026 -22.5026 -21.9067 -21.9067 -21.9047 -21.9047 -21.7616 -21.7616 -21.7507 -21.7507 0.8105 0.8105 0.8188 0.8188 6.1800 6.1800 6.2549 6.2549 8.8900 8.8900 8.9125 8.9125 9.2888 9.2888 9.3726 9.3726 11.1426 11.1426 11.2684 11.2684 12.8463 12.8463 12.8604 12.8604 13.2039 13.2039 k = 0.5000 0.2887 0.2754 ( 5722 PWs) bands (ev): -45.7755 -45.7755 -45.7727 -45.7727 -22.5047 -22.5047 -22.5019 -22.5019 -21.9077 -21.9077 -21.9038 -21.9038 -21.7669 -21.7669 -21.7452 -21.7452 0.8062 0.8062 0.8226 0.8226 6.1461 6.1461 6.2959 6.2959 8.8751 8.8751 8.9193 8.9193 9.2487 9.2487 9.4161 9.4161 11.0786 11.0786 11.3294 11.3294 12.8390 12.8390 12.8671 12.8671 13.1902 13.1902 k = 0.5000 0.2887 0.2639 ( 5730 PWs) bands (ev): -45.7762 -45.7762 -45.7720 -45.7720 -22.5055 -22.5055 -22.5012 -22.5012 -21.9086 -21.9086 -21.9028 -21.9028 -21.7722 -21.7722 -21.7397 -21.7397 0.8017 0.8017 0.8263 0.8263 6.1145 6.1145 6.3394 6.3394 8.8583 8.8583 8.9227 8.9227 9.2099 9.2099 9.4604 9.4604 11.0142 11.0142 11.3888 11.3888 12.8316 12.8316 12.8734 12.8734 13.1769 13.1769 k = 0.5000 0.2887 0.2524 ( 5724 PWs) bands (ev): -45.7769 -45.7769 -45.7713 -45.7713 -22.5063 -22.5063 -22.5006 -22.5006 -21.9096 -21.9096 -21.9019 -21.9019 -21.7774 -21.7774 -21.7343 -21.7343 0.7970 0.7970 0.8297 0.8297 6.0852 6.0852 6.3853 6.3853 8.8398 8.8398 8.9224 8.9224 9.1725 9.1725 9.5056 9.5056 10.9498 10.9498 11.4463 11.4463 12.8241 12.8241 12.8793 12.8793 13.1640 13.1640 k = 0.5000 0.2887 0.2410 ( 5722 PWs) bands (ev): -45.7775 -45.7775 -45.7706 -45.7706 -22.5071 -22.5071 -22.5001 -22.5001 -21.9105 -21.9105 -21.9010 -21.9010 -21.7824 -21.7824 -21.7289 -21.7289 0.7923 0.7923 0.8329 0.8329 6.0581 6.0581 6.4336 6.4336 8.8202 8.8202 8.9180 8.9180 9.1366 9.1366 9.5513 9.5513 10.8857 10.8857 11.5015 11.5015 12.8167 12.8167 12.8845 12.8845 13.1516 13.1516 k = 0.5000 0.2887 0.2295 ( 5722 PWs) bands (ev): -45.7782 -45.7782 -45.7699 -45.7699 -22.5079 -22.5079 -22.4995 -22.4995 -21.9115 -21.9115 -21.9001 -21.9001 -21.7874 -21.7874 -21.7236 -21.7236 0.7875 0.7875 0.8359 0.8359 6.0331 6.0331 6.4843 6.4843 8.7995 8.7995 8.9093 8.9093 9.1022 9.1022 9.5976 9.5976 10.8221 10.8221 11.5543 11.5543 12.8094 12.8094 12.8889 12.8889 13.1395 13.1395 k = 0.5000 0.2887 0.2180 ( 5722 PWs) bands (ev): -45.7789 -45.7789 -45.7693 -45.7693 -22.5088 -22.5088 -22.4990 -22.4990 -21.9124 -21.9124 -21.8992 -21.8992 -21.7921 -21.7921 -21.7183 -21.7183 0.7826 0.7826 0.8387 0.8387 6.0102 6.0102 6.5373 6.5373 8.7783 8.7783 8.8963 8.8963 9.0692 9.0692 9.6442 9.6442 10.7595 10.7595 11.6044 11.6044 12.8022 12.8022 12.8924 12.8924 13.1280 13.1280 k = 0.5000 0.2887 0.2065 ( 5718 PWs) bands (ev): -45.7795 -45.7795 -45.7686 -45.7686 -22.5096 -22.5096 -22.4986 -22.4986 -21.9133 -21.9133 -21.8984 -21.8984 -21.7967 -21.7967 -21.7132 -21.7132 0.7778 0.7778 0.8413 0.8413 5.9893 5.9893 6.5927 6.5927 8.7567 8.7567 8.8790 8.8790 9.0373 9.0373 9.6910 9.6910 10.6980 10.6980 11.6516 11.6516 12.7952 12.7952 12.8946 12.8946 13.1168 13.1168 k = 0.5000 0.2887 0.1951 ( 5718 PWs) bands (ev): -45.7801 -45.7801 -45.7680 -45.7680 -22.5104 -22.5104 -22.4981 -22.4981 -21.9141 -21.9141 -21.8976 -21.8976 -21.8011 -21.8011 -21.7082 -21.7082 0.7729 0.7729 0.8437 0.8437 5.9703 5.9703 6.6504 6.6504 8.7350 8.7350 8.8576 8.8576 9.0065 9.0065 9.7377 9.7377 10.6380 10.6380 11.6958 11.6958 12.7883 12.7883 12.8953 12.8953 13.1061 13.1061 k = 0.5000 0.2887 0.1836 ( 5718 PWs) bands (ev): -45.7807 -45.7807 -45.7674 -45.7674 -22.5113 -22.5113 -22.4977 -22.4977 -21.9150 -21.9150 -21.8969 -21.8969 -21.8054 -21.8054 -21.7034 -21.7034 0.7681 0.7681 0.8458 0.8458 5.9531 5.9531 6.7103 6.7103 8.7134 8.7134 8.8321 8.8321 8.9765 8.9765 9.7844 9.7844 10.5798 10.5798 11.7370 11.7370 12.7816 12.7816 12.8940 12.8940 13.0959 13.0959 k = 0.5000 0.2887 0.1721 ( 5722 PWs) bands (ev): -45.7813 -45.7813 -45.7669 -45.7669 -22.5121 -22.5121 -22.4973 -22.4973 -21.9158 -21.9158 -21.8961 -21.8961 -21.8094 -21.8094 -21.6987 -21.6987 0.7633 0.7633 0.8478 0.8478 5.9376 5.9376 6.7723 6.7723 8.6920 8.6920 8.8028 8.8028 8.9473 8.9473 9.8306 9.8306 10.5235 10.5235 11.7751 11.7751 12.7752 12.7752 12.8902 12.8902 13.0861 13.0861 k = 0.5000 0.2887 0.1606 ( 5726 PWs) bands (ev): -45.7818 -45.7818 -45.7663 -45.7663 -22.5129 -22.5129 -22.4970 -22.4970 -21.9165 -21.9165 -21.8955 -21.8955 -21.8132 -21.8132 -21.6942 -21.6942 0.7587 0.7587 0.8496 0.8496 5.9237 5.9237 6.8364 6.8364 8.6712 8.6712 8.7696 8.7696 8.9189 8.9189 9.8762 9.8762 10.4695 10.4695 11.8101 11.8101 12.7691 12.7691 12.8833 12.8833 13.0769 13.0769 k = 0.5000 0.2887 0.1492 ( 5730 PWs) bands (ev): -45.7823 -45.7823 -45.7658 -45.7658 -22.5136 -22.5136 -22.4967 -22.4967 -21.9172 -21.9172 -21.8948 -21.8948 -21.8167 -21.8167 -21.6900 -21.6900 0.7542 0.7542 0.8512 0.8512 5.9114 5.9114 6.9024 6.9024 8.6507 8.6507 8.7327 8.7327 8.8917 8.8917 9.9209 9.9209 10.4180 10.4180 11.8421 11.8421 12.7632 12.7632 12.8726 12.8726 13.0681 13.0681 k = 0.5000 0.2887 0.1377 ( 5742 PWs) bands (ev): -45.7828 -45.7828 -45.7653 -45.7653 -22.5144 -22.5144 -22.4964 -22.4964 -21.9179 -21.9179 -21.8943 -21.8943 -21.8200 -21.8200 -21.6860 -21.6860 0.7499 0.7499 0.8526 0.8526 5.9005 5.9005 6.9703 6.9703 8.6302 8.6302 8.6923 8.6923 8.8661 8.8661 9.9644 9.9644 10.3692 10.3692 11.8711 11.8711 12.7577 12.7577 12.8575 12.8575 13.0599 13.0599 k = 0.5000 0.2887 0.1262 ( 5754 PWs) bands (ev): -45.7832 -45.7832 -45.7649 -45.7649 -22.5151 -22.5151 -22.4962 -22.4962 -21.9186 -21.9186 -21.8937 -21.8937 -21.8231 -21.8231 -21.6822 -21.6822 0.7458 0.7458 0.8538 0.8538 5.8909 5.8909 7.0398 7.0398 8.6077 8.6077 8.6506 8.6506 8.8422 8.8422 10.0065 10.0065 10.3234 10.3234 11.8974 11.8974 12.7525 12.7525 12.8377 12.8377 13.0522 13.0522 k = 0.5000 0.2887 0.1147 ( 5750 PWs) bands (ev): -45.7837 -45.7837 -45.7645 -45.7645 -22.5158 -22.5158 -22.4959 -22.4959 -21.9191 -21.9191 -21.8933 -21.8933 -21.8259 -21.8259 -21.6787 -21.6787 0.7420 0.7420 0.8549 0.8549 5.8825 5.8825 7.1110 7.1110 8.5753 8.5753 8.6157 8.6157 8.8204 8.8204 10.0467 10.0467 10.2809 10.2809 11.9209 11.9209 12.7476 12.7476 12.8134 12.8134 13.0452 13.0452 k = 0.5000 0.2887 0.1033 ( 5760 PWs) bands (ev): -45.7840 -45.7840 -45.7641 -45.7641 -22.5164 -22.5164 -22.4957 -22.4957 -21.9197 -21.9197 -21.8928 -21.8928 -21.8285 -21.8285 -21.6755 -21.6755 0.7384 0.7384 0.8559 0.8559 5.8752 5.8752 7.1835 7.1835 8.5274 8.5274 8.5935 8.5935 8.8007 8.8007 10.0846 10.0846 10.2418 10.2418 11.9418 11.9418 12.7427 12.7427 12.7859 12.7859 13.0387 13.0387 k = 0.5000 0.2887 0.0918 ( 5752 PWs) bands (ev): -45.7844 -45.7844 -45.7637 -45.7637 -22.5170 -22.5170 -22.4956 -22.4956 -21.9202 -21.9202 -21.8925 -21.8925 -21.8308 -21.8308 -21.6726 -21.6726 0.7351 0.7351 0.8567 0.8567 5.8690 5.8690 7.2571 7.2571 8.4712 8.4712 8.5774 8.5774 8.7831 8.7831 10.1196 10.1196 10.2068 10.2068 11.9602 11.9602 12.7370 12.7370 12.7576 12.7576 13.0329 13.0329 k = 0.5000 0.2887 0.0803 ( 5758 PWs) bands (ev): -45.7847 -45.7847 -45.7634 -45.7634 -22.5175 -22.5175 -22.4954 -22.4954 -21.9206 -21.9206 -21.8921 -21.8921 -21.8328 -21.8328 -21.6700 -21.6700 0.7321 0.7321 0.8574 0.8574 5.8638 5.8638 7.3317 7.3317 8.4103 8.4103 8.5640 8.5640 8.7676 8.7676 10.1486 10.1486 10.1786 10.1786 11.9762 11.9762 12.7206 12.7206 12.7400 12.7400 13.0277 13.0277 k = 0.5000 0.2887 0.0688 ( 5754 PWs) bands (ev): -45.7850 -45.7850 -45.7631 -45.7631 -22.5179 -22.5179 -22.4953 -22.4953 -21.9210 -21.9210 -21.8919 -21.8919 -21.8345 -21.8345 -21.6677 -21.6677 0.7295 0.7295 0.8580 0.8580 5.8594 5.8594 7.4069 7.4069 8.3462 8.3462 8.5528 8.5528 8.7543 8.7543 10.1420 10.1420 10.1867 10.1867 11.9899 11.9899 12.6932 12.6932 12.7349 12.7349 13.0232 13.0232 k = 0.5000 0.2887 0.0574 ( 5750 PWs) bands (ev): -45.7852 -45.7852 -45.7629 -45.7629 -22.5183 -22.5183 -22.4952 -22.4952 -21.9213 -21.9213 -21.8916 -21.8916 -21.8360 -21.8360 -21.6657 -21.6657 0.7272 0.7272 0.8585 0.8585 5.8558 5.8558 7.4823 7.4823 8.2797 8.2797 8.5433 8.5433 8.7430 8.7430 10.1196 10.1196 10.2109 10.2109 12.0014 12.0014 12.6666 12.6666 12.7317 12.7317 13.0193 13.0193 k = 0.5000 0.2887 0.0459 ( 5754 PWs) bands (ev): -45.7854 -45.7854 -45.7627 -45.7627 -22.5187 -22.5187 -22.4951 -22.4951 -21.9216 -21.9216 -21.8915 -21.8915 -21.8372 -21.8372 -21.6641 -21.6641 0.7254 0.7254 0.8589 0.8589 5.8529 5.8529 7.5572 7.5572 8.2117 8.2117 8.5356 8.5356 8.7338 8.7338 10.1003 10.1003 10.2322 10.2322 12.0108 12.0108 12.6433 12.6433 12.7294 12.7294 13.0161 13.0161 k = 0.5000 0.2887 0.0344 ( 5760 PWs) bands (ev): -45.7855 -45.7855 -45.7626 -45.7626 -22.5189 -22.5189 -22.4950 -22.4950 -21.9218 -21.9218 -21.8913 -21.8913 -21.8382 -21.8382 -21.6629 -21.6629 0.7239 0.7239 0.8592 0.8592 5.8508 5.8508 7.6303 7.6303 8.1437 8.1437 8.5296 8.5296 8.7267 8.7267 10.0849 10.0849 10.2493 10.2493 12.0180 12.0180 12.6242 12.6242 12.7276 12.7276 13.0137 13.0137 k = 0.5000 0.2887 0.0229 ( 5768 PWs) bands (ev): -45.7856 -45.7856 -45.7625 -45.7625 -22.5191 -22.5191 -22.4950 -22.4950 -21.9220 -21.9220 -21.8912 -21.8912 -21.8388 -21.8388 -21.6620 -21.6620 0.7228 0.7228 0.8594 0.8594 5.8493 5.8493 7.6992 7.6992 8.0785 8.0785 8.5253 8.5253 8.7215 8.7215 10.0739 10.0739 10.2618 10.2618 12.0231 12.0231 12.6102 12.6102 12.7263 12.7263 13.0119 13.0119 k = 0.5000 0.2887 0.0115 ( 5758 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5192 -22.5192 -22.4949 -22.4949 -21.9220 -21.9220 -21.8912 -21.8912 -21.8392 -21.8392 -21.6614 -21.6614 0.7222 0.7222 0.8595 0.8595 5.8484 5.8484 7.7564 7.7564 8.0235 8.0235 8.5228 8.5228 8.7185 8.7185 10.0672 10.0672 10.2694 10.2694 12.0262 12.0262 12.6015 12.6015 12.7256 12.7256 13.0108 13.0108 k = 0.5000 0.2887-0.0000 ( 5762 PWs) bands (ev): -45.7857 -45.7857 -45.7624 -45.7624 -22.5193 -22.5193 -22.4949 -22.4949 -21.9221 -21.9221 -21.8912 -21.8912 -21.8394 -21.8394 -21.6613 -21.6613 0.7220 0.7220 0.8596 0.8596 5.8481 5.8481 7.7819 7.7819 7.9987 7.9987 8.5219 8.5219 8.7175 8.7175 10.0649 10.0649 10.2720 10.2720 12.0272 12.0272 12.5986 12.5986 12.7253 12.7253 13.0104 13.0104 k = 0.3333 0.5774-0.0000 ( 5736 PWs) bands (ev): -45.7851 -45.7851 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8931 -21.8931 -21.8425 -21.8425 -21.6619 -21.6619 0.9714 0.9714 0.9802 0.9802 6.6363 6.6363 7.1045 7.1045 7.1971 7.1971 8.4043 8.4043 8.4213 8.4213 9.1900 9.1900 12.0188 12.0188 12.4609 12.4609 12.4774 12.4774 12.5053 12.5053 12.5251 12.5251 k = 0.3333 0.5774 0.0115 ( 5736 PWs) bands (ev): -45.7850 -45.7850 -45.7618 -45.7618 -22.5212 -22.5212 -22.4981 -22.4981 -21.9282 -21.9282 -21.8932 -21.8932 -21.8423 -21.8423 -21.6621 -21.6621 0.9714 0.9714 0.9802 0.9802 6.6381 6.6381 7.1034 7.1034 7.1958 7.1958 8.4060 8.4060 8.4229 8.4229 9.1866 9.1866 12.0198 12.0198 12.4397 12.4397 12.4565 12.4565 12.5264 12.5264 12.5459 12.5459 k = 0.3333 0.5774 0.0229 ( 5727 PWs) bands (ev): -45.7850 -45.7850 -45.7619 -45.7619 -22.5211 -22.5211 -22.4981 -22.4981 -21.9281 -21.9281 -21.8933 -21.8933 -21.8419 -21.8419 -21.6626 -21.6626 0.9715 0.9715 0.9803 0.9803 6.6433 6.6433 7.1001 7.1001 7.1920 7.1920 8.4113 8.4113 8.4275 8.4275 9.1763 9.1763 12.0228 12.0228 12.4052 12.4052 12.4218 12.4218 12.5606 12.5606 12.5803 12.5803 k = 0.3333 0.5774 0.0344 ( 5724 PWs) bands (ev): -45.7849 -45.7849 -45.7620 -45.7620 -22.5209 -22.5209 -22.4982 -22.4982 -21.9279 -21.9279 -21.8934 -21.8934 -21.8412 -21.8412 -21.6635 -21.6635 0.9717 0.9717 0.9805 0.9805 6.6519 6.6519 7.0947 7.0947 7.1857 7.1857 8.4198 8.4198 8.4352 8.4352 9.1593 9.1593 12.0279 12.0279 12.3688 12.3688 12.3850 12.3850 12.5965 12.5965 12.6165 12.6165 k = 0.3333 0.5774 0.0459 ( 5736 PWs) bands (ev): -45.7847 -45.7847 -45.7621 -45.7621 -22.5207 -22.5207 -22.4982 -22.4982 -21.9277 -21.9277 -21.8937 -21.8937 -21.8402 -21.8402 -21.6648 -21.6648 0.9719 0.9719 0.9807 0.9807 6.6641 6.6641 7.0873 7.0873 7.1772 7.1772 8.4315 8.4315 8.4457 8.4457 9.1358 9.1358 12.0350 12.0350 12.3319 12.3319 12.3476 12.3476 12.6328 12.6328 12.6532 12.6532 k = 0.3333 0.5774 0.0574 ( 5733 PWs) bands (ev): -45.7845 -45.7845 -45.7623 -45.7623 -22.5203 -22.5203 -22.4983 -22.4983 -21.9274 -21.9274 -21.8939 -21.8939 -21.8389 -21.8389 -21.6664 -21.6664 0.9722 0.9722 0.9810 0.9810 6.6796 6.6796 7.0781 7.0781 7.1667 7.1667 8.4461 8.4461 8.4588 8.4588 9.1060 9.1060 12.0440 12.0440 12.2949 12.2949 12.3101 12.3101 12.6691 12.6691 12.6899 12.6899 k = 0.3333 0.5774 0.0688 ( 5739 PWs) bands (ev): -45.7843 -45.7843 -45.7625 -45.7625 -22.5200 -22.5200 -22.4984 -22.4984 -21.9271 -21.9271 -21.8943 -21.8943 -21.8373 -21.8373 -21.6683 -21.6683 0.9726 0.9726 0.9813 0.9813 6.6986 6.6986 7.0674 7.0674 7.1544 7.1544 8.4631 8.4631 8.4742 8.4742 9.0703 9.0703 12.0550 12.0550 12.2580 12.2580 12.2727 12.2727 12.7055 12.7055 12.7266 12.7266 k = 0.3333 0.5774 0.0803 ( 5739 PWs) bands (ev): -45.7840 -45.7840 -45.7628 -45.7628 -22.5195 -22.5195 -22.4985 -22.4985 -21.9267 -21.9267 -21.8947 -21.8947 -21.8354 -21.8354 -21.6706 -21.6706 0.9730 0.9730 0.9817 0.9817 6.7209 6.7209 7.0554 7.0554 7.1407 7.1407 8.4823 8.4823 8.4918 8.4918 9.0291 9.0291 12.0678 12.0678 12.2212 12.2212 12.2356 12.2356 12.7418 12.7418 12.7633 12.7633 k = 0.3333 0.5774 0.0918 ( 5739 PWs) bands (ev): -45.7837 -45.7837 -45.7631 -45.7631 -22.5190 -22.5190 -22.4987 -22.4987 -21.9262 -21.9262 -21.8952 -21.8952 -21.8333 -21.8333 -21.6732 -21.6732 0.9734 0.9734 0.9821 0.9821 6.7465 6.7465 7.0423 7.0423 7.1259 7.1259 8.5032 8.5032 8.5110 8.5110 8.9829 8.9829 12.0822 12.0822 12.1848 12.1848 12.1991 12.1991 12.7781 12.7781 12.7999 12.7999 k = 0.3333 0.5774 0.1033 ( 5727 PWs) bands (ev): -45.7834 -45.7834 -45.7635 -45.7635 -22.5185 -22.5185 -22.4988 -22.4988 -21.9257 -21.9257 -21.8957 -21.8957 -21.8308 -21.8308 -21.6761 -21.6761 0.9739 0.9739 0.9826 0.9826 6.7754 6.7754 7.0283 7.0283 7.1102 7.1102 8.5253 8.5253 8.5317 8.5317 8.9320 8.9320 12.0975 12.0975 12.1489 12.1489 12.1642 12.1642 12.8143 12.8143 12.8365 12.8365 k = 0.3333 0.5774 0.1147 ( 5730 PWs) bands (ev): -45.7830 -45.7830 -45.7638 -45.7638 -22.5179 -22.5179 -22.4990 -22.4990 -21.9251 -21.9251 -21.8962 -21.8962 -21.8282 -21.8282 -21.6793 -21.6793 0.9744 0.9744 0.9831 0.9831 6.8075 6.8075 7.0138 7.0138 7.0940 7.0940 8.5481 8.5481 8.5535 8.5535 8.8773 8.8773 12.1067 12.1067 12.1136 12.1136 12.1378 12.1378 12.8505 12.8505 12.8730 12.8730 k = 0.3333 0.5774 0.1262 ( 5709 PWs) bands (ev): -45.7826 -45.7826 -45.7643 -45.7643 -22.5172 -22.5172 -22.4992 -22.4992 -21.9245 -21.9245 -21.8969 -21.8969 -21.8252 -21.8252 -21.6828 -21.6828 0.9749 0.9749 0.9836 0.9836 6.8427 6.8427 6.9990 6.9990 7.0776 7.0776 8.5706 8.5706 8.5760 8.5760 8.8196 8.8196 12.0791 12.0791 12.0850 12.0850 12.1450 12.1450 12.8867 12.8867 12.9094 12.9094 k = 0.3333 0.5774 0.1377 ( 5703 PWs) bands (ev): -45.7821 -45.7821 -45.7647 -45.7647 -22.5165 -22.5165 -22.4994 -22.4994 -21.9238 -21.9238 -21.8976 -21.8976 -21.8220 -21.8220 -21.6866 -21.6866 0.9755 0.9755 0.9842 0.9842 6.8809 6.8809 6.9842 6.9842 7.0614 7.0614 8.5910 8.5910 8.5990 8.5990 8.7610 8.7610 12.0455 12.0455 12.0528 12.0528 12.1654 12.1654 12.9228 12.9228 12.9457 12.9457 k = 0.3333 0.5774 0.1492 ( 5691 PWs) bands (ev): -45.7817 -45.7817 -45.7652 -45.7652 -22.5158 -22.5158 -22.4997 -22.4997 -21.9231 -21.9231 -21.8983 -21.8983 -21.8186 -21.8186 -21.6906 -21.6906 0.9760 0.9760 0.9847 0.9847 6.9218 6.9218 6.9694 6.9694 7.0457 7.0457 8.6025 8.6025 8.6220 8.6220 8.7082 8.7082 12.0131 12.0131 12.0204 12.0204 12.1888 12.1888 12.9589 12.9589 12.9820 12.9820 k = 0.3333 0.5774 0.1606 ( 5697 PWs) bands (ev): -45.7812 -45.7812 -45.7657 -45.7657 -22.5151 -22.5151 -22.5000 -22.5000 -21.9223 -21.9223 -21.8991 -21.8991 -21.8149 -21.8149 -21.6949 -21.6949 0.9766 0.9766 0.9853 0.9853 6.9550 6.9550 6.9642 6.9642 7.0319 7.0319 8.5822 8.5822 8.6448 8.6448 8.6844 8.6844 11.9821 11.9821 11.9890 11.9890 12.2143 12.2143 12.9950 12.9950 13.0182 13.0182 k = 0.3333 0.5774 0.1721 ( 5694 PWs) bands (ev): -45.7806 -45.7806 -45.7663 -45.7663 -22.5143 -22.5143 -22.5003 -22.5003 -21.9215 -21.9215 -21.8999 -21.8999 -21.8110 -21.8110 -21.6994 -21.6994 0.9771 0.9771 0.9858 0.9858 6.9411 6.9411 6.9970 6.9970 7.0312 7.0312 8.5264 8.5264 8.6671 8.6671 8.6933 8.6933 11.9525 11.9525 11.9590 11.9590 12.2415 12.2415 13.0231 13.0231 13.0310 13.0311 k = 0.3333 0.5774 0.1836 ( 5706 PWs) bands (ev): -45.7800 -45.7800 -45.7668 -45.7668 -22.5136 -22.5136 -22.5006 -22.5006 -21.9207 -21.9207 -21.9007 -21.9007 -21.8069 -21.8069 -21.7040 -21.7040 0.9777 0.9777 0.9863 0.9863 6.9279 6.9279 6.9935 6.9935 7.0704 7.0704 8.4587 8.4587 8.6886 8.6886 8.7114 8.7114 11.9247 11.9247 11.9307 11.9307 12.2702 12.2702 12.9915 12.9915 13.0670 13.0670 k = 0.3333 0.5774 0.1951 ( 5709 PWs) bands (ev): -45.7795 -45.7795 -45.7674 -45.7674 -22.5128 -22.5128 -22.5010 -22.5010 -21.9198 -21.9198 -21.9016 -21.9016 -21.8026 -21.8026 -21.7089 -21.7089 0.9782 0.9782 0.9868 0.9868 6.9155 6.9155 6.9818 6.9818 7.1215 7.1215 8.3868 8.3868 8.7090 8.7090 8.7311 8.7311 11.8988 11.8988 11.9042 11.9042 12.3005 12.3005 12.9583 12.9583 13.1029 13.1029 k = 0.3333 0.5774 0.2065 ( 5703 PWs) bands (ev): -45.7788 -45.7788 -45.7680 -45.7680 -22.5120 -22.5120 -22.5014 -22.5014 -21.9189 -21.9189 -21.9025 -21.9025 -21.7981 -21.7981 -21.7139 -21.7139 0.9787 0.9787 0.9873 0.9873 6.9041 6.9041 6.9699 6.9699 7.1764 7.1764 8.3128 8.3128 8.7280 8.7280 8.7504 8.7504 11.8749 11.8749 11.8799 11.8799 12.3321 12.3321 12.9238 12.9238 13.1386 13.1386 k = 0.3333 0.5774 0.2180 ( 5721 PWs) bands (ev): -45.7782 -45.7782 -45.7687 -45.7687 -22.5112 -22.5112 -22.5019 -22.5019 -21.9180 -21.9180 -21.9035 -21.9035 -21.7934 -21.7934 -21.7190 -21.7190 0.9791 0.9791 0.9878 0.9878 6.8938 6.8938 6.9590 6.9590 7.2340 7.2340 8.2376 8.2376 8.7455 8.7455 8.7684 8.7684 11.8534 11.8534 11.8579 11.8579 12.3650 12.3650 12.8882 12.8882 13.1742 13.1742 k = 0.3333 0.5774 0.2295 ( 5715 PWs) bands (ev): -45.7776 -45.7776 -45.7693 -45.7693 -22.5104 -22.5104 -22.5023 -22.5023 -21.9170 -21.9170 -21.9044 -21.9044 -21.7885 -21.7885 -21.7243 -21.7243 0.9795 0.9795 0.9881 0.9881 6.8847 6.8847 6.9492 6.9492 7.2940 7.2940 8.1620 8.1620 8.7611 8.7611 8.7847 8.7847 11.8343 11.8343 11.8384 11.8384 12.3990 12.3990 12.8515 12.8515 13.2096 13.2096 k = 0.3333 0.5774 0.2410 ( 5712 PWs) bands (ev): -45.7769 -45.7769 -45.7700 -45.7700 -22.5096 -22.5096 -22.5028 -22.5028 -21.9160 -21.9160 -21.9054 -21.9054 -21.7835 -21.7835 -21.7296 -21.7296 0.9798 0.9798 0.9885 0.9885 6.8768 6.8768 6.9407 6.9407 7.3561 7.3561 8.0862 8.0862 8.7746 8.7746 8.7990 8.7990 11.8179 11.8179 11.8215 11.8215 12.4341 12.4341 12.8141 12.8141 13.2448 13.2448 k = 0.3333 0.5774 0.2524 ( 5712 PWs) bands (ev): -45.7762 -45.7762 -45.7707 -45.7707 -22.5089 -22.5089 -22.5033 -22.5033 -21.9150 -21.9150 -21.9064 -21.9064 -21.7784 -21.7784 -21.7350 -21.7350 0.9801 0.9801 0.9888 0.9888 6.8702 6.8702 6.9337 6.9337 7.4200 7.4200 8.0110 8.0110 8.7860 8.7860 8.8109 8.8109 11.8042 11.8042 11.8075 11.8075 12.4701 12.4701 12.7760 12.7760 13.2795 13.2795 k = 0.3333 0.5774 0.2639 ( 5718 PWs) bands (ev): -45.7755 -45.7755 -45.7713 -45.7713 -22.5081 -22.5081 -22.5039 -22.5039 -21.9140 -21.9140 -21.9074 -21.9074 -21.7732 -21.7732 -21.7405 -21.7405 0.9804 0.9804 0.9890 0.9890 6.8651 6.8651 6.9281 6.9281 7.4852 7.4852 7.9368 7.9368 8.7950 8.7950 8.8205 8.8205 11.7934 11.7934 11.7965 11.7965 12.5070 12.5070 12.7376 12.7376 13.3136 13.3136 k = 0.3333 0.5774 0.2754 ( 5706 PWs) bands (ev): -45.7748 -45.7748 -45.7720 -45.7720 -22.5074 -22.5074 -22.5044 -22.5044 -21.9130 -21.9130 -21.9084 -21.9084 -21.7679 -21.7679 -21.7460 -21.7460 0.9805 0.9805 0.9892 0.9892 6.8614 6.8614 6.9241 6.9241 7.5504 7.5504 7.8651 7.8651 8.8015 8.8015 8.8274 8.8274 11.7856 11.7856 11.7885 11.7885 12.5445 12.5445 12.6989 12.6989 13.3465 13.3466 k = 0.3333 0.5774 0.2869 ( 5706 PWs) bands (ev): -45.7741 -45.7741 -45.7727 -45.7727 -22.5068 -22.5068 -22.5050 -22.5050 -21.9121 -21.9121 -21.9093 -21.9093 -21.7625 -21.7625 -21.7515 -21.7515 0.9806 0.9806 0.9893 0.9893 6.8591 6.8591 6.9217 6.9217 7.6115 7.6115 7.8001 7.8001 8.8055 8.8055 8.8315 8.8315 11.7809 11.7809 11.7837 11.7837 12.5824 12.5824 12.6603 12.6603 13.3761 13.3761 k = 0.3333 0.5774 0.2983 ( 5718 PWs) bands (ev): -45.7734 -45.7734 -45.7734 -45.7734 -22.5065 -22.5065 -22.5052 -22.5052 -21.9116 -21.9116 -21.9098 -21.9098 -21.7571 -21.7571 -21.7569 -21.7569 0.9807 0.9807 0.9893 0.9893 6.8584 6.8584 6.9209 6.9209 7.6453 7.6453 7.7651 7.7651 8.8068 8.8068 8.8329 8.8329 11.7794 11.7794 11.7821 11.7821 12.6161 12.6161 12.6263 12.6263 13.3915 13.3915 Writing output data file TiAs.save init_run : 0.10s CPU 0.19s WALL ( 1 calls) electrons : 206.57s CPU 209.91s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.02s WALL ( 1 calls) Called by electrons: c_bands : 206.56s CPU 209.89s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.02s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.06s WALL ( 361 calls) cegterg : 197.17s CPU 199.85s WALL ( 789 calls) Called by sum_band: Called by *egterg: h_psi : 108.63s CPU 110.47s WALL ( 13772 calls) s_psi : 2.74s CPU 2.89s WALL ( 13772 calls) g_psi : 0.45s CPU 0.46s WALL ( 12622 calls) cdiaghg : 65.44s CPU 66.29s WALL ( 12983 calls) cegterg:over : 9.04s CPU 9.19s WALL ( 12622 calls) cegterg:upda : 8.68s CPU 8.60s WALL ( 12622 calls) cegterg:last : 4.77s CPU 4.79s WALL ( 2233 calls) cdiaghg:chol : 3.78s CPU 3.69s WALL ( 12983 calls) cdiaghg:inve : 1.98s CPU 2.03s WALL ( 12983 calls) cdiaghg:para : 3.75s CPU 3.77s WALL ( 25966 calls) Called by h_psi: h_psi:vloc : 96.24s CPU 97.95s WALL ( 13772 calls) h_psi:vnl : 11.93s CPU 12.08s WALL ( 13772 calls) add_vuspsi : 5.79s CPU 5.90s WALL ( 13772 calls) General routines calbec : 6.08s CPU 6.15s WALL ( 13772 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 91.32s CPU 92.78s WALL ( 1106032 calls) davcio : 0.22s CPU 0.32s WALL ( 722 calls) Parallel routines fft_scatter : 34.52s CPU 35.18s WALL ( 1106047 calls) PWSCF : 3m42.86s CPU 3m56.92s WALL This run was terminated on: 13:26:25 3Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=