Program PWSCF v.5.3.0 (svn rev. 11974) starts on 1Feb2017 at 7:53: 2 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 72 processors R & G space division: proc/nbgrp/npool/nimage = 72 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./NaSe.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: 6* 6 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 24 20 5 1844 1372 201 Max 25 21 6 1857 1400 218 Sum 1759 1453 421 133081 99955 14911 bravais-lattice index = 14 lattice parameter (alat) = 8.8534 a.u. unit-cell volume = 1350.7491 (a.u.)^3 number of atoms/cell = 8 number of atomic types = 2 number of electrons = 60.00 number of Kohn-Sham states= 72 kinetic-energy cutoff = 67.0000 Ry charge density cutoff = 324.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 8.853366 celldm(2)= 1.000000 celldm(3)= 2.247599 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 2.247599 ) 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 0.444919 ) PseudoPot. # 1 for Se read from file: /users/gautes/Pseudo/Se.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 38611c150961c07dbd63be353364166d Pseudo is Ultrasoft + core correction, Zval = 6.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1211 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 Na read from file: /users/gautes/Pseudo/Na.rel-pbe-spnl-rrkjus_psl.1.0.0.UPF MD5 check sum: 13bcaa2858b974004ed12db349b14e76 Pseudo is Ultrasoft + core correction, Zval = 9.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1121 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 atomic species valence mass pseudopotential Se 6.00 78.96000 Se( 1.00) Na 9.00 22.98980 Na( 1.00) 24 Sym. Ops., with inversion, found (12 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 3) = ( -1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( -1 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 60 deg rotation - cryst. axis [0,0,1] cryst. s( 5) = ( 1 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 5) = ( 0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) isym = 6 60 deg rotation - cryst. axis [0,0,-1] cryst. s( 6) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 6) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) isym = 7 120 deg rotation - cryst. axis [0,0,1] cryst. s( 7) = ( 0 1 0 ) ( -1 -1 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 120 deg rotation - cryst. axis [0,0,-1] cryst. s( 8) = ( -1 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( -0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 9 180 deg rotation - cryst. axis [1,-1,0] cryst. s( 9) = ( 0 -1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s( 9) = ( 0.5000000 -0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 10 180 deg rotation - cryst. axis [2,1,0] cryst. s(10) = ( 1 1 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(10) = ( 0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 11 180 deg rotation - cryst. axis [0,1,0] cryst. s(11) = ( -1 -1 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(11) = ( -0.5000000 -0.8660254 0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 12 180 deg rotation - cryst. axis [1,1,0] cryst. s(12) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(12) = ( -0.5000000 0.8660254 -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 13 inversion cryst. s(13) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s(13) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(14) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(14) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 15 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(15) = ( 1 0 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(15) = ( 1.0000000 0.0000000 -0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) isym = 16 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 1 1 0 ) ( 0 0 1 ) cart. s(16) = ( -1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 17 inv. 60 deg rotation - cryst. axis [0,0,1] cryst. s(17) = ( -1 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(17) = ( -0.5000000 0.8660254 -0.0000000 ) f =( -0.0000000 ) ( -0.8660254 -0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 18 inv. 60 deg rotation - cryst. axis [0,0,-1] cryst. s(18) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( -0.5000000 ) cart. s(18) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 -0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( -1.1237994 ) isym = 19 inv. 120 deg rotation - cryst. axis [0,0,1] cryst. s(19) = ( 0 -1 0 ) ( 1 1 0 ) ( 0 0 -1 ) cart. s(19) = ( 0.5000000 0.8660254 -0.0000000 ) ( -0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 20 inv. 120 deg rotation - cryst. axis [0,0,-1] cryst. s(20) = ( 1 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(20) = ( 0.5000000 -0.8660254 0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 21 inv. 180 deg rotation - cryst. axis [1,-1,0] cryst. s(21) = ( 0 1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(21) = ( -0.5000000 0.8660254 0.0000000 ) f =( -0.0000000 ) ( 0.8660254 0.5000000 -0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) isym = 22 inv. 180 deg rotation - cryst. axis [2,1,0] cryst. s(22) = ( -1 -1 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s(22) = ( -0.5000000 -0.8660254 0.0000000 ) f =( -0.0000000 ) ( -0.8660254 0.5000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -1.1237994 ) 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= 268 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 2) = ( 0.0128205 0.0074019 -0.0000000), wk = 0.0037313 k( 3) = ( 0.0256410 0.0148039 -0.0000000), wk = 0.0037313 k( 4) = ( 0.0384615 0.0222058 -0.0000000), wk = 0.0037313 k( 5) = ( 0.0512821 0.0296077 -0.0000000), wk = 0.0037313 k( 6) = ( 0.0641026 0.0370096 -0.0000000), wk = 0.0037313 k( 7) = ( 0.0769231 0.0444116 -0.0000000), wk = 0.0037313 k( 8) = ( 0.0897436 0.0518135 -0.0000000), wk = 0.0037313 k( 9) = ( 0.1025641 0.0592154 -0.0000000), wk = 0.0037313 k( 10) = ( 0.1153846 0.0666173 -0.0000000), wk = 0.0037313 k( 11) = ( 0.1282051 0.0740193 -0.0000000), wk = 0.0037313 k( 12) = ( 0.1410256 0.0814212 -0.0000000), wk = 0.0037313 k( 13) = ( 0.1538461 0.0888231 -0.0000000), wk = 0.0037313 k( 14) = ( 0.1666667 0.0962250 -0.0000000), wk = 0.0037313 k( 15) = ( 0.1794872 0.1036270 -0.0000000), wk = 0.0037313 k( 16) = ( 0.1923077 0.1110289 -0.0000000), wk = 0.0037313 k( 17) = ( 0.2051282 0.1184308 -0.0000000), wk = 0.0037313 k( 18) = ( 0.2179487 0.1258328 -0.0000000), wk = 0.0037313 k( 19) = ( 0.2307692 0.1332347 -0.0000000), wk = 0.0037313 k( 20) = ( 0.2435897 0.1406366 -0.0000000), wk = 0.0037313 k( 21) = ( 0.2564103 0.1480385 -0.0000000), wk = 0.0037313 k( 22) = ( 0.2692308 0.1554405 -0.0000000), wk = 0.0037313 k( 23) = ( 0.2820513 0.1628424 -0.0000000), wk = 0.0037313 k( 24) = ( 0.2948718 0.1702443 -0.0000000), wk = 0.0037313 k( 25) = ( 0.3076923 0.1776462 -0.0000000), wk = 0.0037313 k( 26) = ( 0.3205128 0.1850482 -0.0000000), wk = 0.0037313 k( 27) = ( 0.3333333 0.1924501 -0.0000000), wk = 0.0037313 k( 28) = ( 0.3461538 0.1998520 -0.0000000), wk = 0.0037313 k( 29) = ( 0.3589744 0.2072539 -0.0000000), wk = 0.0037313 k( 30) = ( 0.3717949 0.2146559 -0.0000000), wk = 0.0037313 k( 31) = ( 0.3846154 0.2220578 -0.0000000), wk = 0.0037313 k( 32) = ( 0.3974359 0.2294597 -0.0000000), wk = 0.0037313 k( 33) = ( 0.4102564 0.2368616 -0.0000000), wk = 0.0037313 k( 34) = ( 0.4230769 0.2442636 -0.0000000), wk = 0.0037313 k( 35) = ( 0.4358974 0.2516655 -0.0000000), wk = 0.0037313 k( 36) = ( 0.4487179 0.2590674 -0.0000000), wk = 0.0037313 k( 37) = ( 0.4615385 0.2664694 -0.0000000), wk = 0.0037313 k( 38) = ( 0.4743590 0.2738713 -0.0000000), wk = 0.0037313 k( 39) = ( 0.4871795 0.2812732 -0.0000000), wk = 0.0037313 k( 40) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037313 k( 41) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037313 k( 42) = ( 0.4927536 0.3012262 -0.0000000), wk = 0.0037313 k( 43) = ( 0.4855073 0.3137773 -0.0000000), wk = 0.0037313 k( 44) = ( 0.4782609 0.3263284 -0.0000000), wk = 0.0037313 k( 45) = ( 0.4710145 0.3388795 -0.0000000), wk = 0.0037313 k( 46) = ( 0.4637681 0.3514306 -0.0000000), wk = 0.0037313 k( 47) = ( 0.4565217 0.3639817 -0.0000000), wk = 0.0037313 k( 48) = ( 0.4492754 0.3765328 -0.0000000), wk = 0.0037313 k( 49) = ( 0.4420290 0.3890839 -0.0000000), wk = 0.0037313 k( 50) = ( 0.4347826 0.4016350 -0.0000000), wk = 0.0037313 k( 51) = ( 0.4275362 0.4141861 -0.0000000), wk = 0.0037313 k( 52) = ( 0.4202899 0.4267372 -0.0000000), wk = 0.0037313 k( 53) = ( 0.4130435 0.4392882 -0.0000000), wk = 0.0037313 k( 54) = ( 0.4057971 0.4518393 -0.0000000), wk = 0.0037313 k( 55) = ( 0.3985507 0.4643904 -0.0000000), wk = 0.0037313 k( 56) = ( 0.3913044 0.4769415 -0.0000000), wk = 0.0037313 k( 57) = ( 0.3840580 0.4894926 -0.0000000), wk = 0.0037313 k( 58) = ( 0.3768116 0.5020437 -0.0000000), wk = 0.0037313 k( 59) = ( 0.3695652 0.5145948 -0.0000000), wk = 0.0037313 k( 60) = ( 0.3623188 0.5271459 -0.0000000), wk = 0.0037313 k( 61) = ( 0.3550725 0.5396970 -0.0000000), wk = 0.0037313 k( 62) = ( 0.3478261 0.5522481 -0.0000000), wk = 0.0037313 k( 63) = ( 0.3405797 0.5647992 -0.0000000), wk = 0.0037313 k( 64) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037313 k( 65) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037313 k( 66) = ( 0.3259259 0.5645203 -0.0000000), wk = 0.0037313 k( 67) = ( 0.3185185 0.5516903 -0.0000000), wk = 0.0037313 k( 68) = ( 0.3111111 0.5388602 -0.0000000), wk = 0.0037313 k( 69) = ( 0.3037037 0.5260302 -0.0000000), wk = 0.0037313 k( 70) = ( 0.2962963 0.5132002 -0.0000000), wk = 0.0037313 k( 71) = ( 0.2888889 0.5003702 -0.0000000), wk = 0.0037313 k( 72) = ( 0.2814815 0.4875402 -0.0000000), wk = 0.0037313 k( 73) = ( 0.2740741 0.4747102 -0.0000000), wk = 0.0037313 k( 74) = ( 0.2666667 0.4618802 -0.0000000), wk = 0.0037313 k( 75) = ( 0.2592593 0.4490502 -0.0000000), wk = 0.0037313 k( 76) = ( 0.2518518 0.4362202 -0.0000000), wk = 0.0037313 k( 77) = ( 0.2444444 0.4233902 -0.0000000), wk = 0.0037313 k( 78) = ( 0.2370370 0.4105602 -0.0000000), wk = 0.0037313 k( 79) = ( 0.2296296 0.3977302 -0.0000000), wk = 0.0037313 k( 80) = ( 0.2222222 0.3849002 -0.0000000), wk = 0.0037313 k( 81) = ( 0.2148148 0.3720702 -0.0000000), wk = 0.0037313 k( 82) = ( 0.2074074 0.3592402 -0.0000000), wk = 0.0037313 k( 83) = ( 0.2000000 0.3464102 -0.0000000), wk = 0.0037313 k( 84) = ( 0.1925926 0.3335802 -0.0000000), wk = 0.0037313 k( 85) = ( 0.1851852 0.3207502 -0.0000000), wk = 0.0037313 k( 86) = ( 0.1777778 0.3079201 -0.0000000), wk = 0.0037313 k( 87) = ( 0.1703704 0.2950901 -0.0000000), wk = 0.0037313 k( 88) = ( 0.1629630 0.2822601 -0.0000000), wk = 0.0037313 k( 89) = ( 0.1555556 0.2694301 -0.0000000), wk = 0.0037313 k( 90) = ( 0.1481482 0.2566001 -0.0000000), wk = 0.0037313 k( 91) = ( 0.1407407 0.2437701 -0.0000000), wk = 0.0037313 k( 92) = ( 0.1333333 0.2309401 -0.0000000), wk = 0.0037313 k( 93) = ( 0.1259259 0.2181101 -0.0000000), wk = 0.0037313 k( 94) = ( 0.1185185 0.2052801 -0.0000000), wk = 0.0037313 k( 95) = ( 0.1111111 0.1924501 -0.0000000), wk = 0.0037313 k( 96) = ( 0.1037037 0.1796201 -0.0000000), wk = 0.0037313 k( 97) = ( 0.0962963 0.1667901 -0.0000000), wk = 0.0037313 k( 98) = ( 0.0888889 0.1539601 -0.0000000), wk = 0.0037313 k( 99) = ( 0.0814815 0.1411301 -0.0000000), wk = 0.0037313 k( 100) = ( 0.0740741 0.1283001 -0.0000000), wk = 0.0037313 k( 101) = ( 0.0666667 0.1154701 -0.0000000), wk = 0.0037313 k( 102) = ( 0.0592593 0.1026400 -0.0000000), wk = 0.0037313 k( 103) = ( 0.0518518 0.0898100 -0.0000000), wk = 0.0037313 k( 104) = ( 0.0444444 0.0769800 -0.0000000), wk = 0.0037313 k( 105) = ( 0.0370370 0.0641500 -0.0000000), wk = 0.0037313 k( 106) = ( 0.0296296 0.0513200 -0.0000000), wk = 0.0037313 k( 107) = ( 0.0222222 0.0384900 -0.0000000), wk = 0.0037313 k( 108) = ( 0.0148148 0.0256600 -0.0000000), wk = 0.0037313 k( 109) = ( 0.0074074 0.0128300 -0.0000000), wk = 0.0037313 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 112) = ( 0.0000000 0.0000000 0.0148306), wk = 0.0037313 k( 113) = ( 0.0000000 0.0000000 0.0296613), wk = 0.0037313 k( 114) = ( 0.0000000 0.0000000 0.0444919), wk = 0.0037313 k( 115) = ( 0.0000000 0.0000000 0.0593226), wk = 0.0037313 k( 116) = ( 0.0000000 0.0000000 0.0741532), wk = 0.0037313 k( 117) = ( 0.0000000 0.0000000 0.0889839), wk = 0.0037313 k( 118) = ( 0.0000000 0.0000000 0.1038145), wk = 0.0037313 k( 119) = ( 0.0000000 0.0000000 0.1186451), wk = 0.0037313 k( 120) = ( 0.0000000 0.0000000 0.1334758), wk = 0.0037313 k( 121) = ( 0.0000000 0.0000000 0.1483064), wk = 0.0037313 k( 122) = ( 0.0000000 0.0000000 0.1631371), wk = 0.0037313 k( 123) = ( 0.0000000 0.0000000 0.1779677), wk = 0.0037313 k( 124) = ( 0.0000000 0.0000000 0.1927984), wk = 0.0037313 k( 125) = ( 0.0000000 0.0000000 0.2076290), wk = 0.0037313 k( 126) = ( 0.0000000 0.0000000 0.2224596), wk = 0.0037313 k( 127) = ( 0.0000000 0.0000000 0.2224596), wk = 0.0037313 k( 128) = ( 0.0128205 0.0074019 0.2224596), wk = 0.0037313 k( 129) = ( 0.0256410 0.0148039 0.2224596), wk = 0.0037313 k( 130) = ( 0.0384615 0.0222058 0.2224596), wk = 0.0037313 k( 131) = ( 0.0512821 0.0296077 0.2224596), wk = 0.0037313 k( 132) = ( 0.0641026 0.0370096 0.2224596), wk = 0.0037313 k( 133) = ( 0.0769231 0.0444116 0.2224596), wk = 0.0037313 k( 134) = ( 0.0897436 0.0518135 0.2224596), wk = 0.0037313 k( 135) = ( 0.1025641 0.0592154 0.2224596), wk = 0.0037313 k( 136) = ( 0.1153846 0.0666173 0.2224596), wk = 0.0037313 k( 137) = ( 0.1282051 0.0740193 0.2224596), wk = 0.0037313 k( 138) = ( 0.1410256 0.0814212 0.2224596), wk = 0.0037313 k( 139) = ( 0.1538461 0.0888231 0.2224596), wk = 0.0037313 k( 140) = ( 0.1666667 0.0962250 0.2224596), wk = 0.0037313 k( 141) = ( 0.1794872 0.1036270 0.2224596), wk = 0.0037313 k( 142) = ( 0.1923077 0.1110289 0.2224596), wk = 0.0037313 k( 143) = ( 0.2051282 0.1184308 0.2224596), wk = 0.0037313 k( 144) = ( 0.2179487 0.1258328 0.2224596), wk = 0.0037313 k( 145) = ( 0.2307692 0.1332347 0.2224596), wk = 0.0037313 k( 146) = ( 0.2435897 0.1406366 0.2224596), wk = 0.0037313 k( 147) = ( 0.2564103 0.1480385 0.2224596), wk = 0.0037313 k( 148) = ( 0.2692308 0.1554405 0.2224596), wk = 0.0037313 k( 149) = ( 0.2820513 0.1628424 0.2224596), wk = 0.0037313 k( 150) = ( 0.2948718 0.1702443 0.2224596), wk = 0.0037313 k( 151) = ( 0.3076923 0.1776462 0.2224596), wk = 0.0037313 k( 152) = ( 0.3205128 0.1850482 0.2224596), wk = 0.0037313 k( 153) = ( 0.3333333 0.1924501 0.2224596), wk = 0.0037313 k( 154) = ( 0.3461538 0.1998520 0.2224596), wk = 0.0037313 k( 155) = ( 0.3589744 0.2072539 0.2224596), wk = 0.0037313 k( 156) = ( 0.3717949 0.2146559 0.2224596), wk = 0.0037313 k( 157) = ( 0.3846154 0.2220578 0.2224596), wk = 0.0037313 k( 158) = ( 0.3974359 0.2294597 0.2224596), wk = 0.0037313 k( 159) = ( 0.4102564 0.2368616 0.2224596), wk = 0.0037313 k( 160) = ( 0.4230769 0.2442636 0.2224596), wk = 0.0037313 k( 161) = ( 0.4358974 0.2516655 0.2224596), wk = 0.0037313 k( 162) = ( 0.4487179 0.2590674 0.2224596), wk = 0.0037313 k( 163) = ( 0.4615385 0.2664694 0.2224596), wk = 0.0037313 k( 164) = ( 0.4743590 0.2738713 0.2224596), wk = 0.0037313 k( 165) = ( 0.4871795 0.2812732 0.2224596), wk = 0.0037313 k( 166) = ( 0.5000000 0.2886751 0.2224596), wk = 0.0037313 k( 167) = ( 0.5000000 0.2886751 0.2224596), wk = 0.0037313 k( 168) = ( 0.4927536 0.3012262 0.2224596), wk = 0.0037313 k( 169) = ( 0.4855073 0.3137773 0.2224596), wk = 0.0037313 k( 170) = ( 0.4782609 0.3263284 0.2224596), wk = 0.0037313 k( 171) = ( 0.4710145 0.3388795 0.2224596), wk = 0.0037313 k( 172) = ( 0.4637681 0.3514306 0.2224596), wk = 0.0037313 k( 173) = ( 0.4565217 0.3639817 0.2224596), wk = 0.0037313 k( 174) = ( 0.4492754 0.3765328 0.2224596), wk = 0.0037313 k( 175) = ( 0.4420290 0.3890839 0.2224596), wk = 0.0037313 k( 176) = ( 0.4347826 0.4016350 0.2224596), wk = 0.0037313 k( 177) = ( 0.4275362 0.4141861 0.2224596), wk = 0.0037313 k( 178) = ( 0.4202899 0.4267372 0.2224596), wk = 0.0037313 k( 179) = ( 0.4130435 0.4392882 0.2224596), wk = 0.0037313 k( 180) = ( 0.4057971 0.4518393 0.2224596), wk = 0.0037313 k( 181) = ( 0.3985507 0.4643904 0.2224596), wk = 0.0037313 k( 182) = ( 0.3913044 0.4769415 0.2224596), wk = 0.0037313 k( 183) = ( 0.3840580 0.4894926 0.2224596), wk = 0.0037313 k( 184) = ( 0.3768116 0.5020437 0.2224596), wk = 0.0037313 k( 185) = ( 0.3695652 0.5145948 0.2224596), wk = 0.0037313 k( 186) = ( 0.3623188 0.5271459 0.2224596), wk = 0.0037313 k( 187) = ( 0.3550725 0.5396970 0.2224596), wk = 0.0037313 k( 188) = ( 0.3478261 0.5522481 0.2224596), wk = 0.0037313 k( 189) = ( 0.3405797 0.5647992 0.2224596), wk = 0.0037313 k( 190) = ( 0.3333333 0.5773503 0.2224596), wk = 0.0037313 k( 191) = ( 0.3333333 0.5773503 0.2224596), wk = 0.0037313 k( 192) = ( 0.3259259 0.5645203 0.2224596), wk = 0.0037313 k( 193) = ( 0.3185185 0.5516903 0.2224596), wk = 0.0037313 k( 194) = ( 0.3111111 0.5388602 0.2224596), wk = 0.0037313 k( 195) = ( 0.3037037 0.5260302 0.2224596), wk = 0.0037313 k( 196) = ( 0.2962963 0.5132002 0.2224596), wk = 0.0037313 k( 197) = ( 0.2888889 0.5003702 0.2224596), wk = 0.0037313 k( 198) = ( 0.2814815 0.4875402 0.2224596), wk = 0.0037313 k( 199) = ( 0.2740741 0.4747102 0.2224596), wk = 0.0037313 k( 200) = ( 0.2666667 0.4618802 0.2224596), wk = 0.0037313 k( 201) = ( 0.2592593 0.4490502 0.2224596), wk = 0.0037313 k( 202) = ( 0.2518518 0.4362202 0.2224596), wk = 0.0037313 k( 203) = ( 0.2444444 0.4233902 0.2224596), wk = 0.0037313 k( 204) = ( 0.2370370 0.4105602 0.2224596), wk = 0.0037313 k( 205) = ( 0.2296296 0.3977302 0.2224596), wk = 0.0037313 k( 206) = ( 0.2222222 0.3849002 0.2224596), wk = 0.0037313 k( 207) = ( 0.2148148 0.3720702 0.2224596), wk = 0.0037313 k( 208) = ( 0.2074074 0.3592402 0.2224596), wk = 0.0037313 k( 209) = ( 0.2000000 0.3464102 0.2224596), wk = 0.0037313 k( 210) = ( 0.1925926 0.3335802 0.2224596), wk = 0.0037313 k( 211) = ( 0.1851852 0.3207502 0.2224596), wk = 0.0037313 k( 212) = ( 0.1777778 0.3079201 0.2224596), wk = 0.0037313 k( 213) = ( 0.1703704 0.2950901 0.2224596), wk = 0.0037313 k( 214) = ( 0.1629630 0.2822601 0.2224596), wk = 0.0037313 k( 215) = ( 0.1555556 0.2694301 0.2224596), wk = 0.0037313 k( 216) = ( 0.1481482 0.2566001 0.2224596), wk = 0.0037313 k( 217) = ( 0.1407407 0.2437701 0.2224596), wk = 0.0037313 k( 218) = ( 0.1333333 0.2309401 0.2224596), wk = 0.0037313 k( 219) = ( 0.1259259 0.2181101 0.2224596), wk = 0.0037313 k( 220) = ( 0.1185185 0.2052801 0.2224596), wk = 0.0037313 k( 221) = ( 0.1111111 0.1924501 0.2224596), wk = 0.0037313 k( 222) = ( 0.1037037 0.1796201 0.2224596), wk = 0.0037313 k( 223) = ( 0.0962963 0.1667901 0.2224596), wk = 0.0037313 k( 224) = ( 0.0888889 0.1539601 0.2224596), wk = 0.0037313 k( 225) = ( 0.0814815 0.1411301 0.2224596), wk = 0.0037313 k( 226) = ( 0.0740741 0.1283001 0.2224596), wk = 0.0037313 k( 227) = ( 0.0666667 0.1154701 0.2224596), wk = 0.0037313 k( 228) = ( 0.0592593 0.1026400 0.2224596), wk = 0.0037313 k( 229) = ( 0.0518518 0.0898100 0.2224596), wk = 0.0037313 k( 230) = ( 0.0444444 0.0769800 0.2224596), wk = 0.0037313 k( 231) = ( 0.0370370 0.0641500 0.2224596), wk = 0.0037313 k( 232) = ( 0.0296296 0.0513200 0.2224596), wk = 0.0037313 k( 233) = ( 0.0222222 0.0384900 0.2224596), wk = 0.0037313 k( 234) = ( 0.0148148 0.0256600 0.2224596), wk = 0.0037313 k( 235) = ( 0.0074074 0.0128300 0.2224596), wk = 0.0037313 k( 236) = ( 0.0000000 0.0000000 0.2224596), wk = 0.0037313 k( 237) = ( 0.5000000 0.2886751 0.2224596), wk = 0.0037313 k( 238) = ( 0.5000000 0.2886751 0.2076290), wk = 0.0037313 k( 239) = ( 0.5000000 0.2886751 0.1927984), wk = 0.0037313 k( 240) = ( 0.5000000 0.2886751 0.1779677), wk = 0.0037313 k( 241) = ( 0.5000000 0.2886751 0.1631371), wk = 0.0037313 k( 242) = ( 0.5000000 0.2886751 0.1483064), wk = 0.0037313 k( 243) = ( 0.5000000 0.2886751 0.1334758), wk = 0.0037313 k( 244) = ( 0.5000000 0.2886751 0.1186451), wk = 0.0037313 k( 245) = ( 0.5000000 0.2886751 0.1038145), wk = 0.0037313 k( 246) = ( 0.5000000 0.2886751 0.0889839), wk = 0.0037313 k( 247) = ( 0.5000000 0.2886751 0.0741532), wk = 0.0037313 k( 248) = ( 0.5000000 0.2886751 0.0593226), wk = 0.0037313 k( 249) = ( 0.5000000 0.2886751 0.0444919), wk = 0.0037313 k( 250) = ( 0.5000000 0.2886751 0.0296613), wk = 0.0037313 k( 251) = ( 0.5000000 0.2886751 0.0148306), wk = 0.0037313 k( 252) = ( 0.5000000 0.2886751 -0.0000000), wk = 0.0037313 k( 253) = ( 0.3333333 0.5773503 -0.0000000), wk = 0.0037313 k( 254) = ( 0.3333333 0.5773503 0.0148306), wk = 0.0037313 k( 255) = ( 0.3333333 0.5773503 0.0296613), wk = 0.0037313 k( 256) = ( 0.3333333 0.5773503 0.0444919), wk = 0.0037313 k( 257) = ( 0.3333333 0.5773503 0.0593226), wk = 0.0037313 k( 258) = ( 0.3333333 0.5773503 0.0741532), wk = 0.0037313 k( 259) = ( 0.3333333 0.5773503 0.0889839), wk = 0.0037313 k( 260) = ( 0.3333333 0.5773503 0.1038145), wk = 0.0037313 k( 261) = ( 0.3333333 0.5773503 0.1186451), wk = 0.0037313 k( 262) = ( 0.3333333 0.5773503 0.1334758), wk = 0.0037313 k( 263) = ( 0.3333333 0.5773503 0.1483064), wk = 0.0037313 k( 264) = ( 0.3333333 0.5773503 0.1631371), wk = 0.0037313 k( 265) = ( 0.3333333 0.5773503 0.1779677), wk = 0.0037313 k( 266) = ( 0.3333333 0.5773503 0.1927984), wk = 0.0037313 k( 267) = ( 0.3333333 0.5773503 0.2076290), wk = 0.0037313 k( 268) = ( 0.3333333 0.5773503 0.2224596), wk = 0.0037313 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 2) = ( 0.0128205 -0.0000000 -0.0000000), wk = 0.0037313 k( 3) = ( 0.0256410 -0.0000000 -0.0000000), wk = 0.0037313 k( 4) = ( 0.0384615 -0.0000000 -0.0000000), wk = 0.0037313 k( 5) = ( 0.0512821 -0.0000000 -0.0000000), wk = 0.0037313 k( 6) = ( 0.0641026 -0.0000000 0.0000000), wk = 0.0037313 k( 7) = ( 0.0769231 -0.0000000 -0.0000000), wk = 0.0037313 k( 8) = ( 0.0897436 -0.0000000 -0.0000000), wk = 0.0037313 k( 9) = ( 0.1025641 -0.0000000 -0.0000000), wk = 0.0037313 k( 10) = ( 0.1153846 -0.0000000 -0.0000000), wk = 0.0037313 k( 11) = ( 0.1282051 -0.0000000 -0.0000000), wk = 0.0037313 k( 12) = ( 0.1410256 -0.0000000 0.0000000), wk = 0.0037313 k( 13) = ( 0.1538461 -0.0000000 -0.0000000), wk = 0.0037313 k( 14) = ( 0.1666667 -0.0000000 -0.0000000), wk = 0.0037313 k( 15) = ( 0.1794872 -0.0000000 -0.0000000), wk = 0.0037313 k( 16) = ( 0.1923077 -0.0000000 -0.0000000), wk = 0.0037313 k( 17) = ( 0.2051282 -0.0000000 -0.0000000), wk = 0.0037313 k( 18) = ( 0.2179487 -0.0000000 -0.0000000), wk = 0.0037313 k( 19) = ( 0.2307692 -0.0000000 0.0000000), wk = 0.0037313 k( 20) = ( 0.2435897 -0.0000000 -0.0000000), wk = 0.0037313 k( 21) = ( 0.2564103 -0.0000000 -0.0000000), wk = 0.0037313 k( 22) = ( 0.2692308 -0.0000000 -0.0000000), wk = 0.0037313 k( 23) = ( 0.2820513 -0.0000000 0.0000000), wk = 0.0037313 k( 24) = ( 0.2948718 -0.0000000 -0.0000000), wk = 0.0037313 k( 25) = ( 0.3076923 -0.0000000 -0.0000000), wk = 0.0037313 k( 26) = ( 0.3205128 -0.0000000 -0.0000000), wk = 0.0037313 k( 27) = ( 0.3333333 -0.0000000 -0.0000000), wk = 0.0037313 k( 28) = ( 0.3461538 -0.0000000 -0.0000000), wk = 0.0037313 k( 29) = ( 0.3589744 -0.0000000 -0.0000000), wk = 0.0037313 k( 30) = ( 0.3717949 -0.0000000 -0.0000000), wk = 0.0037313 k( 31) = ( 0.3846154 -0.0000000 -0.0000000), wk = 0.0037313 k( 32) = ( 0.3974359 -0.0000000 -0.0000000), wk = 0.0037313 k( 33) = ( 0.4102564 -0.0000000 -0.0000000), wk = 0.0037313 k( 34) = ( 0.4230769 -0.0000000 0.0000000), wk = 0.0037313 k( 35) = ( 0.4358974 -0.0000000 -0.0000000), wk = 0.0037313 k( 36) = ( 0.4487179 -0.0000000 -0.0000000), wk = 0.0037313 k( 37) = ( 0.4615385 -0.0000000 0.0000000), wk = 0.0037313 k( 38) = ( 0.4743590 -0.0000000 0.0000000), wk = 0.0037313 k( 39) = ( 0.4871795 -0.0000000 -0.0000000), wk = 0.0037313 k( 40) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0037313 k( 41) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0037313 k( 42) = ( 0.4927536 0.0144927 -0.0000000), wk = 0.0037313 k( 43) = ( 0.4855073 0.0289855 -0.0000000), wk = 0.0037313 k( 44) = ( 0.4782609 0.0434783 -0.0000000), wk = 0.0037313 k( 45) = ( 0.4710145 0.0579710 -0.0000000), wk = 0.0037313 k( 46) = ( 0.4637681 0.0724638 -0.0000000), wk = 0.0037313 k( 47) = ( 0.4565217 0.0869565 -0.0000000), wk = 0.0037313 k( 48) = ( 0.4492754 0.1014493 0.0000000), wk = 0.0037313 k( 49) = ( 0.4420290 0.1159420 0.0000000), wk = 0.0037313 k( 50) = ( 0.4347826 0.1304348 -0.0000000), wk = 0.0037313 k( 51) = ( 0.4275362 0.1449275 -0.0000000), wk = 0.0037313 k( 52) = ( 0.4202899 0.1594203 -0.0000000), wk = 0.0037313 k( 53) = ( 0.4130435 0.1739130 -0.0000000), wk = 0.0037313 k( 54) = ( 0.4057971 0.1884058 -0.0000000), wk = 0.0037313 k( 55) = ( 0.3985507 0.2028985 0.0000000), wk = 0.0037313 k( 56) = ( 0.3913044 0.2173913 0.0000000), wk = 0.0037313 k( 57) = ( 0.3840580 0.2318841 0.0000000), wk = 0.0037313 k( 58) = ( 0.3768116 0.2463768 -0.0000000), wk = 0.0037313 k( 59) = ( 0.3695652 0.2608696 0.0000000), wk = 0.0037313 k( 60) = ( 0.3623188 0.2753623 -0.0000000), wk = 0.0037313 k( 61) = ( 0.3550725 0.2898551 -0.0000000), wk = 0.0037313 k( 62) = ( 0.3478261 0.3043478 -0.0000000), wk = 0.0037313 k( 63) = ( 0.3405797 0.3188406 -0.0000000), wk = 0.0037313 k( 64) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037313 k( 65) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037313 k( 66) = ( 0.3259259 0.3259259 -0.0000000), wk = 0.0037313 k( 67) = ( 0.3185185 0.3185185 0.0000000), wk = 0.0037313 k( 68) = ( 0.3111111 0.3111111 -0.0000000), wk = 0.0037313 k( 69) = ( 0.3037037 0.3037037 0.0000000), wk = 0.0037313 k( 70) = ( 0.2962963 0.2962963 -0.0000000), wk = 0.0037313 k( 71) = ( 0.2888889 0.2888889 0.0000000), wk = 0.0037313 k( 72) = ( 0.2814815 0.2814815 -0.0000000), wk = 0.0037313 k( 73) = ( 0.2740741 0.2740741 -0.0000000), wk = 0.0037313 k( 74) = ( 0.2666667 0.2666667 -0.0000000), wk = 0.0037313 k( 75) = ( 0.2592593 0.2592593 -0.0000000), wk = 0.0037313 k( 76) = ( 0.2518518 0.2518518 -0.0000000), wk = 0.0037313 k( 77) = ( 0.2444444 0.2444444 -0.0000000), wk = 0.0037313 k( 78) = ( 0.2370370 0.2370370 -0.0000000), wk = 0.0037313 k( 79) = ( 0.2296296 0.2296296 -0.0000000), wk = 0.0037313 k( 80) = ( 0.2222222 0.2222222 -0.0000000), wk = 0.0037313 k( 81) = ( 0.2148148 0.2148148 0.0000000), wk = 0.0037313 k( 82) = ( 0.2074074 0.2074074 0.0000000), wk = 0.0037313 k( 83) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0037313 k( 84) = ( 0.1925926 0.1925926 -0.0000000), wk = 0.0037313 k( 85) = ( 0.1851852 0.1851852 0.0000000), wk = 0.0037313 k( 86) = ( 0.1777778 0.1777778 -0.0000000), wk = 0.0037313 k( 87) = ( 0.1703704 0.1703704 0.0000000), wk = 0.0037313 k( 88) = ( 0.1629630 0.1629630 -0.0000000), wk = 0.0037313 k( 89) = ( 0.1555556 0.1555556 0.0000000), wk = 0.0037313 k( 90) = ( 0.1481482 0.1481481 -0.0000000), wk = 0.0037313 k( 91) = ( 0.1407407 0.1407407 -0.0000000), wk = 0.0037313 k( 92) = ( 0.1333333 0.1333333 -0.0000000), wk = 0.0037313 k( 93) = ( 0.1259259 0.1259259 0.0000000), wk = 0.0037313 k( 94) = ( 0.1185185 0.1185185 -0.0000000), wk = 0.0037313 k( 95) = ( 0.1111111 0.1111111 -0.0000000), wk = 0.0037313 k( 96) = ( 0.1037037 0.1037037 0.0000000), wk = 0.0037313 k( 97) = ( 0.0962963 0.0962963 -0.0000000), wk = 0.0037313 k( 98) = ( 0.0888889 0.0888889 -0.0000000), wk = 0.0037313 k( 99) = ( 0.0814815 0.0814815 -0.0000000), wk = 0.0037313 k( 100) = ( 0.0740741 0.0740741 0.0000000), wk = 0.0037313 k( 101) = ( 0.0666667 0.0666667 0.0000000), wk = 0.0037313 k( 102) = ( 0.0592593 0.0592593 -0.0000000), wk = 0.0037313 k( 103) = ( 0.0518518 0.0518518 0.0000000), wk = 0.0037313 k( 104) = ( 0.0444444 0.0444444 -0.0000000), wk = 0.0037313 k( 105) = ( 0.0370370 0.0370370 -0.0000000), wk = 0.0037313 k( 106) = ( 0.0296296 0.0296296 -0.0000000), wk = 0.0037313 k( 107) = ( 0.0222222 0.0222222 -0.0000000), wk = 0.0037313 k( 108) = ( 0.0148148 0.0148148 -0.0000000), wk = 0.0037313 k( 109) = ( 0.0074074 0.0074074 -0.0000000), wk = 0.0037313 k( 110) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 111) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0037313 k( 112) = ( 0.0000000 0.0000000 0.0333333), wk = 0.0037313 k( 113) = ( 0.0000000 0.0000000 0.0666667), wk = 0.0037313 k( 114) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0037313 k( 115) = ( 0.0000000 0.0000000 0.1333333), wk = 0.0037313 k( 116) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0037313 k( 117) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0037313 k( 118) = ( 0.0000000 0.0000000 0.2333333), wk = 0.0037313 k( 119) = ( 0.0000000 0.0000000 0.2666667), wk = 0.0037313 k( 120) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0037313 k( 121) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0037313 k( 122) = ( 0.0000000 0.0000000 0.3666667), wk = 0.0037313 k( 123) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0037313 k( 124) = ( 0.0000000 0.0000000 0.4333333), wk = 0.0037313 k( 125) = ( 0.0000000 0.0000000 0.4666667), wk = 0.0037313 k( 126) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313 k( 127) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313 k( 128) = ( 0.0128205 -0.0000000 0.5000000), wk = 0.0037313 k( 129) = ( 0.0256410 -0.0000000 0.5000000), wk = 0.0037313 k( 130) = ( 0.0384615 -0.0000000 0.5000000), wk = 0.0037313 k( 131) = ( 0.0512821 -0.0000000 0.5000000), wk = 0.0037313 k( 132) = ( 0.0641026 -0.0000000 0.5000000), wk = 0.0037313 k( 133) = ( 0.0769231 -0.0000000 0.5000000), wk = 0.0037313 k( 134) = ( 0.0897436 -0.0000000 0.5000000), wk = 0.0037313 k( 135) = ( 0.1025641 -0.0000000 0.5000000), wk = 0.0037313 k( 136) = ( 0.1153846 -0.0000000 0.5000000), wk = 0.0037313 k( 137) = ( 0.1282051 -0.0000000 0.5000000), wk = 0.0037313 k( 138) = ( 0.1410256 -0.0000000 0.5000000), wk = 0.0037313 k( 139) = ( 0.1538461 -0.0000000 0.5000000), wk = 0.0037313 k( 140) = ( 0.1666667 -0.0000000 0.5000000), wk = 0.0037313 k( 141) = ( 0.1794872 -0.0000000 0.5000000), wk = 0.0037313 k( 142) = ( 0.1923077 -0.0000000 0.5000000), wk = 0.0037313 k( 143) = ( 0.2051282 -0.0000000 0.5000000), wk = 0.0037313 k( 144) = ( 0.2179487 -0.0000000 0.5000000), wk = 0.0037313 k( 145) = ( 0.2307692 -0.0000000 0.5000000), wk = 0.0037313 k( 146) = ( 0.2435897 -0.0000000 0.5000000), wk = 0.0037313 k( 147) = ( 0.2564103 -0.0000000 0.5000000), wk = 0.0037313 k( 148) = ( 0.2692308 -0.0000000 0.5000000), wk = 0.0037313 k( 149) = ( 0.2820513 -0.0000000 0.5000000), wk = 0.0037313 k( 150) = ( 0.2948718 -0.0000000 0.5000000), wk = 0.0037313 k( 151) = ( 0.3076923 -0.0000000 0.5000000), wk = 0.0037313 k( 152) = ( 0.3205128 -0.0000000 0.5000000), wk = 0.0037313 k( 153) = ( 0.3333333 -0.0000000 0.5000000), wk = 0.0037313 k( 154) = ( 0.3461538 -0.0000000 0.5000000), wk = 0.0037313 k( 155) = ( 0.3589744 -0.0000000 0.5000000), wk = 0.0037313 k( 156) = ( 0.3717949 -0.0000000 0.5000000), wk = 0.0037313 k( 157) = ( 0.3846154 -0.0000000 0.5000000), wk = 0.0037313 k( 158) = ( 0.3974359 -0.0000000 0.5000000), wk = 0.0037313 k( 159) = ( 0.4102564 -0.0000000 0.5000000), wk = 0.0037313 k( 160) = ( 0.4230769 -0.0000000 0.5000000), wk = 0.0037313 k( 161) = ( 0.4358974 -0.0000000 0.5000000), wk = 0.0037313 k( 162) = ( 0.4487179 -0.0000000 0.5000000), wk = 0.0037313 k( 163) = ( 0.4615385 -0.0000000 0.5000000), wk = 0.0037313 k( 164) = ( 0.4743590 -0.0000000 0.5000000), wk = 0.0037313 k( 165) = ( 0.4871795 -0.0000000 0.5000000), wk = 0.0037313 k( 166) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037313 k( 167) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037313 k( 168) = ( 0.4927536 0.0144927 0.5000000), wk = 0.0037313 k( 169) = ( 0.4855073 0.0289855 0.5000000), wk = 0.0037313 k( 170) = ( 0.4782609 0.0434783 0.5000000), wk = 0.0037313 k( 171) = ( 0.4710145 0.0579710 0.5000000), wk = 0.0037313 k( 172) = ( 0.4637681 0.0724638 0.5000000), wk = 0.0037313 k( 173) = ( 0.4565217 0.0869565 0.5000000), wk = 0.0037313 k( 174) = ( 0.4492754 0.1014493 0.5000000), wk = 0.0037313 k( 175) = ( 0.4420290 0.1159420 0.5000000), wk = 0.0037313 k( 176) = ( 0.4347826 0.1304348 0.5000000), wk = 0.0037313 k( 177) = ( 0.4275362 0.1449275 0.5000000), wk = 0.0037313 k( 178) = ( 0.4202899 0.1594203 0.5000000), wk = 0.0037313 k( 179) = ( 0.4130435 0.1739130 0.5000000), wk = 0.0037313 k( 180) = ( 0.4057971 0.1884058 0.5000000), wk = 0.0037313 k( 181) = ( 0.3985507 0.2028985 0.5000000), wk = 0.0037313 k( 182) = ( 0.3913044 0.2173913 0.5000000), wk = 0.0037313 k( 183) = ( 0.3840580 0.2318841 0.5000000), wk = 0.0037313 k( 184) = ( 0.3768116 0.2463768 0.5000000), wk = 0.0037313 k( 185) = ( 0.3695652 0.2608696 0.5000000), wk = 0.0037313 k( 186) = ( 0.3623188 0.2753623 0.5000000), wk = 0.0037313 k( 187) = ( 0.3550725 0.2898551 0.5000000), wk = 0.0037313 k( 188) = ( 0.3478261 0.3043478 0.5000000), wk = 0.0037313 k( 189) = ( 0.3405797 0.3188406 0.5000000), wk = 0.0037313 k( 190) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037313 k( 191) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037313 k( 192) = ( 0.3259259 0.3259259 0.5000000), wk = 0.0037313 k( 193) = ( 0.3185185 0.3185185 0.5000000), wk = 0.0037313 k( 194) = ( 0.3111111 0.3111111 0.5000000), wk = 0.0037313 k( 195) = ( 0.3037037 0.3037037 0.5000000), wk = 0.0037313 k( 196) = ( 0.2962963 0.2962963 0.5000000), wk = 0.0037313 k( 197) = ( 0.2888889 0.2888889 0.5000000), wk = 0.0037313 k( 198) = ( 0.2814815 0.2814815 0.5000000), wk = 0.0037313 k( 199) = ( 0.2740741 0.2740741 0.5000000), wk = 0.0037313 k( 200) = ( 0.2666667 0.2666667 0.5000000), wk = 0.0037313 k( 201) = ( 0.2592593 0.2592593 0.5000000), wk = 0.0037313 k( 202) = ( 0.2518518 0.2518518 0.5000000), wk = 0.0037313 k( 203) = ( 0.2444444 0.2444444 0.5000000), wk = 0.0037313 k( 204) = ( 0.2370370 0.2370370 0.5000000), wk = 0.0037313 k( 205) = ( 0.2296296 0.2296296 0.5000000), wk = 0.0037313 k( 206) = ( 0.2222222 0.2222222 0.5000000), wk = 0.0037313 k( 207) = ( 0.2148148 0.2148148 0.5000000), wk = 0.0037313 k( 208) = ( 0.2074074 0.2074074 0.5000000), wk = 0.0037313 k( 209) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0037313 k( 210) = ( 0.1925926 0.1925926 0.5000000), wk = 0.0037313 k( 211) = ( 0.1851852 0.1851852 0.5000000), wk = 0.0037313 k( 212) = ( 0.1777778 0.1777778 0.5000000), wk = 0.0037313 k( 213) = ( 0.1703704 0.1703704 0.5000000), wk = 0.0037313 k( 214) = ( 0.1629630 0.1629630 0.5000000), wk = 0.0037313 k( 215) = ( 0.1555556 0.1555556 0.5000000), wk = 0.0037313 k( 216) = ( 0.1481482 0.1481481 0.5000000), wk = 0.0037313 k( 217) = ( 0.1407407 0.1407407 0.5000000), wk = 0.0037313 k( 218) = ( 0.1333333 0.1333333 0.5000000), wk = 0.0037313 k( 219) = ( 0.1259259 0.1259259 0.5000000), wk = 0.0037313 k( 220) = ( 0.1185185 0.1185185 0.5000000), wk = 0.0037313 k( 221) = ( 0.1111111 0.1111111 0.5000000), wk = 0.0037313 k( 222) = ( 0.1037037 0.1037037 0.5000000), wk = 0.0037313 k( 223) = ( 0.0962963 0.0962963 0.5000000), wk = 0.0037313 k( 224) = ( 0.0888889 0.0888889 0.5000000), wk = 0.0037313 k( 225) = ( 0.0814815 0.0814815 0.5000000), wk = 0.0037313 k( 226) = ( 0.0740741 0.0740741 0.5000000), wk = 0.0037313 k( 227) = ( 0.0666667 0.0666667 0.5000000), wk = 0.0037313 k( 228) = ( 0.0592593 0.0592593 0.5000000), wk = 0.0037313 k( 229) = ( 0.0518518 0.0518518 0.5000000), wk = 0.0037313 k( 230) = ( 0.0444444 0.0444444 0.5000000), wk = 0.0037313 k( 231) = ( 0.0370370 0.0370370 0.5000000), wk = 0.0037313 k( 232) = ( 0.0296296 0.0296296 0.5000000), wk = 0.0037313 k( 233) = ( 0.0222222 0.0222222 0.5000000), wk = 0.0037313 k( 234) = ( 0.0148148 0.0148148 0.5000000), wk = 0.0037313 k( 235) = ( 0.0074074 0.0074074 0.5000000), wk = 0.0037313 k( 236) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0037313 k( 237) = ( 0.5000000 -0.0000000 0.5000000), wk = 0.0037313 k( 238) = ( 0.5000000 -0.0000000 0.4666667), wk = 0.0037313 k( 239) = ( 0.5000000 -0.0000000 0.4333333), wk = 0.0037313 k( 240) = ( 0.5000000 -0.0000000 0.4000000), wk = 0.0037313 k( 241) = ( 0.5000000 -0.0000000 0.3666667), wk = 0.0037313 k( 242) = ( 0.5000000 -0.0000000 0.3333333), wk = 0.0037313 k( 243) = ( 0.5000000 -0.0000000 0.3000000), wk = 0.0037313 k( 244) = ( 0.5000000 -0.0000000 0.2666667), wk = 0.0037313 k( 245) = ( 0.5000000 -0.0000000 0.2333333), wk = 0.0037313 k( 246) = ( 0.5000000 -0.0000000 0.2000000), wk = 0.0037313 k( 247) = ( 0.5000000 -0.0000000 0.1666667), wk = 0.0037313 k( 248) = ( 0.5000000 -0.0000000 0.1333333), wk = 0.0037313 k( 249) = ( 0.5000000 -0.0000000 0.1000000), wk = 0.0037313 k( 250) = ( 0.5000000 -0.0000000 0.0666667), wk = 0.0037313 k( 251) = ( 0.5000000 -0.0000000 0.0333333), wk = 0.0037313 k( 252) = ( 0.5000000 -0.0000000 -0.0000000), wk = 0.0037313 k( 253) = ( 0.3333333 0.3333333 0.0000000), wk = 0.0037313 k( 254) = ( 0.3333333 0.3333333 0.0333333), wk = 0.0037313 k( 255) = ( 0.3333333 0.3333333 0.0666667), wk = 0.0037313 k( 256) = ( 0.3333333 0.3333333 0.1000000), wk = 0.0037313 k( 257) = ( 0.3333333 0.3333333 0.1333333), wk = 0.0037313 k( 258) = ( 0.3333333 0.3333333 0.1666667), wk = 0.0037313 k( 259) = ( 0.3333333 0.3333333 0.2000000), wk = 0.0037313 k( 260) = ( 0.3333333 0.3333333 0.2333333), wk = 0.0037313 k( 261) = ( 0.3333333 0.3333333 0.2666667), wk = 0.0037313 k( 262) = ( 0.3333333 0.3333333 0.3000000), wk = 0.0037313 k( 263) = ( 0.3333333 0.3333333 0.3333333), wk = 0.0037313 k( 264) = ( 0.3333333 0.3333333 0.3666667), wk = 0.0037313 k( 265) = ( 0.3333333 0.3333333 0.4000000), wk = 0.0037313 k( 266) = ( 0.3333333 0.3333333 0.4333333), wk = 0.0037313 k( 267) = ( 0.3333333 0.3333333 0.4666667), wk = 0.0037313 k( 268) = ( 0.3333333 0.3333333 0.5000000), wk = 0.0037313 Dense grid: 133081 G-vectors FFT dimensions: ( 54, 54, 120) Smooth grid: 99955 G-vectors FFT dimensions: ( 48, 48, 108) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.42 Mb ( 384, 72) NL pseudopotentials 0.33 Mb ( 192, 112) Each V/rho on FFT grid 0.09 Mb ( 5832) Each G-vector array 0.01 Mb ( 1848) G-vector shells 0.01 Mb ( 897) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 1.69 Mb ( 384, 288) Each subspace H/S matrix 0.04 Mb ( 48, 48) Each matrix 0.25 Mb ( 112, 2, 72) The potential is recalculated from file : ./NaSe.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 6.6 secs Computing kpt #: 2 total cpu time spent up to now is 9.7 secs Computing kpt #: 3 total cpu time spent up to now is 13.0 secs Computing kpt #: 4 total cpu time spent up to now is 16.0 secs Computing kpt #: 5 total cpu time spent up to now is 19.1 secs Computing kpt #: 6 total cpu time spent up to now is 21.8 secs Computing kpt #: 7 total cpu time spent up to now is 24.2 secs Computing kpt #: 8 total cpu time spent up to now is 26.2 secs Computing kpt #: 9 total cpu time spent up to now is 28.5 secs Computing kpt #: 10 total cpu time spent up to now is 30.6 secs Computing kpt #: 11 total cpu time spent up to now is 32.4 secs Computing kpt #: 12 total cpu time spent up to now is 35.5 secs Computing kpt #: 13 total cpu time spent up to now is 37.4 secs Computing kpt #: 14 total cpu time spent up to now is 39.2 secs Computing kpt #: 15 total cpu time spent up to now is 41.6 secs Computing kpt #: 16 total cpu time spent up to now is 43.9 secs Computing kpt #: 17 total cpu time spent up to now is 46.2 secs Computing kpt #: 18 total cpu time spent up to now is 48.4 secs Computing kpt #: 19 total cpu time spent up to now is 50.7 secs Computing kpt #: 20 total cpu time spent up to now is 52.8 secs Computing kpt #: 21 total cpu time spent up to now is 55.0 secs Computing kpt #: 22 total cpu time spent up to now is 57.3 secs Computing kpt #: 23 total cpu time spent up to now is 59.3 secs Computing kpt #: 24 total cpu time spent up to now is 61.2 secs Computing kpt #: 25 total cpu time spent up to now is 63.2 secs Computing kpt #: 26 total cpu time spent up to now is 65.1 secs Computing kpt #: 27 total cpu time spent up to now is 67.0 secs Computing kpt #: 28 total cpu time spent up to now is 69.0 secs Computing kpt #: 29 total cpu time spent up to now is 71.0 secs Computing kpt #: 30 total cpu time spent up to now is 73.0 secs Computing kpt #: 31 total cpu time spent up to now is 74.9 secs Computing kpt #: 32 total cpu time spent up to now is 76.9 secs Computing kpt #: 33 total cpu time spent up to now is 78.7 secs Computing kpt #: 34 total cpu time spent up to now is 80.5 secs Computing kpt #: 35 total cpu time spent up to now is 82.5 secs Computing kpt #: 36 total cpu time spent up to now is 84.3 secs Computing kpt #: 37 total cpu time spent up to now is 86.0 secs Computing kpt #: 38 total cpu time spent up to now is 87.9 secs Computing kpt #: 39 total cpu time spent up to now is 89.6 secs Computing kpt #: 40 total cpu time spent up to now is 91.4 secs Computing kpt #: 41 total cpu time spent up to now is 93.0 secs Computing kpt #: 42 total cpu time spent up to now is 94.7 secs Computing kpt #: 43 total cpu time spent up to now is 96.3 secs Computing kpt #: 44 total cpu time spent up to now is 97.8 secs Computing kpt #: 45 total cpu time spent up to now is 99.4 secs Computing kpt #: 46 total cpu time spent up to now is 101.0 secs Computing kpt #: 47 total cpu time spent up to now is 102.6 secs Computing kpt #: 48 total cpu time spent up to now is 104.2 secs Computing kpt #: 49 total cpu time spent up to now is 105.8 secs Computing kpt #: 50 total cpu time spent up to now is 107.4 secs Computing kpt #: 51 total cpu time spent up to now is 109.3 secs Computing kpt #: 52 total cpu time spent up to now is 111.0 secs Computing kpt #: 53 total cpu time spent up to now is 112.8 secs Computing kpt #: 54 total cpu time spent up to now is 114.6 secs Computing kpt #: 55 total cpu time spent up to now is 116.9 secs Computing kpt #: 56 total cpu time spent up to now is 119.0 secs Computing kpt #: 57 total cpu time spent up to now is 121.2 secs Computing kpt #: 58 total cpu time spent up to now is 123.4 secs Computing kpt #: 59 total cpu time spent up to now is 125.4 secs Computing kpt #: 60 total cpu time spent up to now is 127.7 secs Computing kpt #: 61 total cpu time spent up to now is 130.0 secs Computing kpt #: 62 total cpu time spent up to now is 132.1 secs Computing kpt #: 63 total cpu time spent up to now is 134.6 secs Computing kpt #: 64 total cpu time spent up to now is 137.0 secs Computing kpt #: 65 total cpu time spent up to now is 139.4 secs Computing kpt #: 66 total cpu time spent up to now is 141.6 secs Computing kpt #: 67 total cpu time spent up to now is 144.0 secs Computing kpt #: 68 total cpu time spent up to now is 146.3 secs Computing kpt #: 69 total cpu time spent up to now is 148.6 secs Computing kpt #: 70 total cpu time spent up to now is 150.9 secs Computing kpt #: 71 total cpu time spent up to now is 152.9 secs Computing kpt #: 72 total cpu time spent up to now is 154.9 secs Computing kpt #: 73 total cpu time spent up to now is 157.0 secs Computing kpt #: 74 total cpu time spent up to now is 159.2 secs Computing kpt #: 75 total cpu time spent up to now is 161.2 secs Computing kpt #: 76 total cpu time spent up to now is 163.2 secs Computing kpt #: 77 total cpu time spent up to now is 165.0 secs Computing kpt #: 78 total cpu time spent up to now is 167.0 secs Computing kpt #: 79 total cpu time spent up to now is 169.3 secs Computing kpt #: 80 total cpu time spent up to now is 171.5 secs Computing kpt #: 81 total cpu time spent up to now is 173.8 secs Computing kpt #: 82 total cpu time spent up to now is 175.9 secs Computing kpt #: 83 total cpu time spent up to now is 178.0 secs Computing kpt #: 84 total cpu time spent up to now is 180.4 secs Computing kpt #: 85 total cpu time spent up to now is 183.8 secs Computing kpt #: 86 total cpu time spent up to now is 186.5 secs Computing kpt #: 87 total cpu time spent up to now is 189.9 secs Computing kpt #: 88 total cpu time spent up to now is 193.5 secs Computing kpt #: 89 total cpu time spent up to now is 196.8 secs Computing kpt #: 90 total cpu time spent up to now is 199.1 secs Computing kpt #: 91 total cpu time spent up to now is 201.4 secs Computing kpt #: 92 total cpu time spent up to now is 204.0 secs Computing kpt #: 93 total cpu time spent up to now is 206.4 secs Computing kpt #: 94 total cpu time spent up to now is 208.8 secs Computing kpt #: 95 total cpu time spent up to now is 211.3 secs Computing kpt #: 96 total cpu time spent up to now is 213.7 secs Computing kpt #: 97 total cpu time spent up to now is 215.6 secs Computing kpt #: 98 total cpu time spent up to now is 217.4 secs Computing kpt #: 99 total cpu time spent up to now is 219.1 secs Computing kpt #: 100 total cpu time spent up to now is 221.1 secs Computing kpt #: 101 total cpu time spent up to now is 223.0 secs Computing kpt #: 102 total cpu time spent up to now is 225.2 secs Computing kpt #: 103 total cpu time spent up to now is 227.4 secs Computing kpt #: 104 total cpu time spent up to now is 229.7 secs Computing kpt #: 105 total cpu time spent up to now is 232.4 secs Computing kpt #: 106 total cpu time spent up to now is 235.1 secs Computing kpt #: 107 total cpu time spent up to now is 238.4 secs Computing kpt #: 108 total cpu time spent up to now is 242.0 secs Computing kpt #: 109 total cpu time spent up to now is 246.1 secs Computing kpt #: 110 total cpu time spent up to now is 249.5 secs Computing kpt #: 111 total cpu time spent up to now is 252.8 secs Computing kpt #: 112 total cpu time spent up to now is 256.5 secs Computing kpt #: 113 total cpu time spent up to now is 260.1 secs Computing kpt #: 114 total cpu time spent up to now is 264.6 secs Computing kpt #: 115 total cpu time spent up to now is 268.7 secs Computing kpt #: 116 total cpu time spent up to now is 271.3 secs Computing kpt #: 117 total cpu time spent up to now is 273.6 secs Computing kpt #: 118 total cpu time spent up to now is 275.8 secs Computing kpt #: 119 total cpu time spent up to now is 277.6 secs Computing kpt #: 120 total cpu time spent up to now is 279.3 secs Computing kpt #: 121 total cpu time spent up to now is 281.1 secs Computing kpt #: 122 total cpu time spent up to now is 282.7 secs Computing kpt #: 123 total cpu time spent up to now is 284.3 secs Computing kpt #: 124 total cpu time spent up to now is 286.0 secs Computing kpt #: 125 total cpu time spent up to now is 287.6 secs Computing kpt #: 126 total cpu time spent up to now is 289.1 secs Computing kpt #: 127 total cpu time spent up to now is 290.7 secs Computing kpt #: 128 total cpu time spent up to now is 292.2 secs Computing kpt #: 129 total cpu time spent up to now is 293.9 secs Computing kpt #: 130 total cpu time spent up to now is 295.5 secs Computing kpt #: 131 total cpu time spent up to now is 297.2 secs Computing kpt #: 132 total cpu time spent up to now is 298.8 secs Computing kpt #: 133 total cpu time spent up to now is 300.4 secs Computing kpt #: 134 total cpu time spent up to now is 302.1 secs Computing kpt #: 135 total cpu time spent up to now is 303.7 secs Computing kpt #: 136 total cpu time spent up to now is 305.4 secs Computing kpt #: 137 total cpu time spent up to now is 307.1 secs Computing kpt #: 138 total cpu time spent up to now is 308.7 secs Computing kpt #: 139 total cpu time spent up to now is 310.2 secs Computing kpt #: 140 total cpu time spent up to now is 311.9 secs Computing kpt #: 141 total cpu time spent up to now is 313.7 secs Computing kpt #: 142 total cpu time spent up to now is 315.5 secs Computing kpt #: 143 total cpu time spent up to now is 317.5 secs Computing kpt #: 144 total cpu time spent up to now is 319.3 secs Computing kpt #: 145 total cpu time spent up to now is 321.2 secs Computing kpt #: 146 total cpu time spent up to now is 322.9 secs Computing kpt #: 147 total cpu time spent up to now is 324.7 secs Computing kpt #: 148 total cpu time spent up to now is 326.5 secs Computing kpt #: 149 total cpu time spent up to now is 328.5 secs Computing kpt #: 150 total cpu time spent up to now is 330.3 secs Computing kpt #: 151 total cpu time spent up to now is 332.3 secs Computing kpt #: 152 total cpu time spent up to now is 334.3 secs Computing kpt #: 153 total cpu time spent up to now is 336.1 secs Computing kpt #: 154 total cpu time spent up to now is 337.9 secs Computing kpt #: 155 total cpu time spent up to now is 339.8 secs Computing kpt #: 156 total cpu time spent up to now is 341.7 secs Computing kpt #: 157 total cpu time spent up to now is 343.7 secs Computing kpt #: 158 total cpu time spent up to now is 345.5 secs Computing kpt #: 159 total cpu time spent up to now is 347.3 secs Computing kpt #: 160 total cpu time spent up to now is 349.0 secs Computing kpt #: 161 total cpu time spent up to now is 350.8 secs Computing kpt #: 162 total cpu time spent up to now is 352.7 secs Computing kpt #: 163 total cpu time spent up to now is 354.5 secs Computing kpt #: 164 total cpu time spent up to now is 356.1 secs Computing kpt #: 165 total cpu time spent up to now is 358.0 secs Computing kpt #: 166 total cpu time spent up to now is 359.8 secs Computing kpt #: 167 total cpu time spent up to now is 361.5 secs Computing kpt #: 168 total cpu time spent up to now is 363.2 secs Computing kpt #: 169 total cpu time spent up to now is 365.0 secs Computing kpt #: 170 total cpu time spent up to now is 366.8 secs Computing kpt #: 171 total cpu time spent up to now is 368.6 secs Computing kpt #: 172 total cpu time spent up to now is 370.3 secs Computing kpt #: 173 total cpu time spent up to now is 372.2 secs Computing kpt #: 174 total cpu time spent up to now is 374.2 secs Computing kpt #: 175 total cpu time spent up to now is 376.0 secs Computing kpt #: 176 total cpu time spent up to now is 378.0 secs Computing kpt #: 177 total cpu time spent up to now is 379.8 secs Computing kpt #: 178 total cpu time spent up to now is 381.7 secs Computing kpt #: 179 total cpu time spent up to now is 383.7 secs Computing kpt #: 180 total cpu time spent up to now is 385.7 secs Computing kpt #: 181 total cpu time spent up to now is 388.1 secs Computing kpt #: 182 total cpu time spent up to now is 390.3 secs Computing kpt #: 183 total cpu time spent up to now is 392.5 secs Computing kpt #: 184 total cpu time spent up to now is 394.6 secs Computing kpt #: 185 total cpu time spent up to now is 396.9 secs Computing kpt #: 186 total cpu time spent up to now is 399.0 secs Computing kpt #: 187 total cpu time spent up to now is 401.0 secs Computing kpt #: 188 total cpu time spent up to now is 402.9 secs Computing kpt #: 189 total cpu time spent up to now is 405.0 secs Computing kpt #: 190 total cpu time spent up to now is 406.9 secs Computing kpt #: 191 total cpu time spent up to now is 408.9 secs Computing kpt #: 192 total cpu time spent up to now is 410.9 secs Computing kpt #: 193 total cpu time spent up to now is 412.9 secs Computing kpt #: 194 total cpu time spent up to now is 414.8 secs Computing kpt #: 195 total cpu time spent up to now is 416.5 secs Computing kpt #: 196 total cpu time spent up to now is 418.5 secs Computing kpt #: 197 total cpu time spent up to now is 420.2 secs Computing kpt #: 198 total cpu time spent up to now is 422.1 secs Computing kpt #: 199 total cpu time spent up to now is 423.9 secs Computing kpt #: 200 total cpu time spent up to now is 425.7 secs Computing kpt #: 201 total cpu time spent up to now is 427.6 secs Computing kpt #: 202 total cpu time spent up to now is 429.7 secs Computing kpt #: 203 total cpu time spent up to now is 432.1 secs Computing kpt #: 204 total cpu time spent up to now is 434.1 secs Computing kpt #: 205 total cpu time spent up to now is 436.0 secs Computing kpt #: 206 total cpu time spent up to now is 437.8 secs Computing kpt #: 207 total cpu time spent up to now is 439.7 secs Computing kpt #: 208 total cpu time spent up to now is 441.6 secs Computing kpt #: 209 total cpu time spent up to now is 444.5 secs Computing kpt #: 210 total cpu time spent up to now is 446.6 secs Computing kpt #: 211 total cpu time spent up to now is 448.9 secs Computing kpt #: 212 total cpu time spent up to now is 451.8 secs Computing kpt #: 213 total cpu time spent up to now is 454.2 secs Computing kpt #: 214 total cpu time spent up to now is 457.8 secs Computing kpt #: 215 total cpu time spent up to now is 459.7 secs Computing kpt #: 216 total cpu time spent up to now is 461.5 secs Computing kpt #: 217 total cpu time spent up to now is 463.4 secs Computing kpt #: 218 total cpu time spent up to now is 465.5 secs Computing kpt #: 219 total cpu time spent up to now is 467.6 secs Computing kpt #: 220 total cpu time spent up to now is 469.6 secs Computing kpt #: 221 total cpu time spent up to now is 471.4 secs Computing kpt #: 222 total cpu time spent up to now is 473.2 secs Computing kpt #: 223 total cpu time spent up to now is 475.1 secs Computing kpt #: 224 total cpu time spent up to now is 476.9 secs Computing kpt #: 225 total cpu time spent up to now is 478.6 secs Computing kpt #: 226 total cpu time spent up to now is 480.2 secs Computing kpt #: 227 total cpu time spent up to now is 481.8 secs Computing kpt #: 228 total cpu time spent up to now is 483.4 secs Computing kpt #: 229 total cpu time spent up to now is 485.0 secs Computing kpt #: 230 total cpu time spent up to now is 486.5 secs Computing kpt #: 231 total cpu time spent up to now is 488.2 secs Computing kpt #: 232 total cpu time spent up to now is 489.6 secs Computing kpt #: 233 total cpu time spent up to now is 491.2 secs Computing kpt #: 234 total cpu time spent up to now is 493.0 secs Computing kpt #: 235 total cpu time spent up to now is 494.6 secs Computing kpt #: 236 total cpu time spent up to now is 496.3 secs Computing kpt #: 237 total cpu time spent up to now is 498.1 secs Computing kpt #: 238 total cpu time spent up to now is 499.9 secs Computing kpt #: 239 total cpu time spent up to now is 501.8 secs Computing kpt #: 240 total cpu time spent up to now is 503.6 secs Computing kpt #: 241 total cpu time spent up to now is 505.5 secs Computing kpt #: 242 total cpu time spent up to now is 507.3 secs Computing kpt #: 243 total cpu time spent up to now is 509.2 secs Computing kpt #: 244 total cpu time spent up to now is 511.1 secs Computing kpt #: 245 total cpu time spent up to now is 512.7 secs Computing kpt #: 246 total cpu time spent up to now is 514.5 secs Computing kpt #: 247 total cpu time spent up to now is 516.3 secs Computing kpt #: 248 total cpu time spent up to now is 518.0 secs Computing kpt #: 249 total cpu time spent up to now is 519.9 secs Computing kpt #: 250 total cpu time spent up to now is 521.5 secs Computing kpt #: 251 total cpu time spent up to now is 523.2 secs Computing kpt #: 252 total cpu time spent up to now is 524.9 secs Computing kpt #: 253 total cpu time spent up to now is 527.1 secs Computing kpt #: 254 total cpu time spent up to now is 529.4 secs Computing kpt #: 255 total cpu time spent up to now is 531.7 secs Computing kpt #: 256 total cpu time spent up to now is 533.9 secs Computing kpt #: 257 total cpu time spent up to now is 536.3 secs Computing kpt #: 258 total cpu time spent up to now is 538.7 secs Computing kpt #: 259 total cpu time spent up to now is 541.2 secs Computing kpt #: 260 total cpu time spent up to now is 543.3 secs Computing kpt #: 261 total cpu time spent up to now is 545.8 secs Computing kpt #: 262 total cpu time spent up to now is 548.3 secs Computing kpt #: 263 total cpu time spent up to now is 550.6 secs Computing kpt #: 264 total cpu time spent up to now is 553.0 secs Computing kpt #: 265 total cpu time spent up to now is 555.5 secs Computing kpt #: 266 total cpu time spent up to now is 558.0 secs Computing kpt #: 267 total cpu time spent up to now is 560.3 secs Computing kpt #: 268 total cpu time spent up to now is 562.2 secs ethr = 1.67E-08, avg # of iterations = 20.1 total cpu time spent up to now is 562.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 12483 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9222 -19.9222 -19.9216 -19.9216 -19.8291 -19.8291 -19.8286 -19.8286 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6532 -19.6532 -19.6462 -19.6462 -19.6461 -19.6461 -10.0705 -10.0705 -9.8751 -9.8751 -7.4548 -7.4548 -6.9052 -6.9052 -0.8736 -0.8736 0.6160 0.6160 1.1798 1.1798 1.4077 1.4077 1.4455 1.4455 1.6809 1.6809 3.0780 3.0780 3.3217 3.3217 3.6174 3.6174 3.8822 3.8822 4.4681 4.4681 5.7990 5.7990 5.9190 5.9190 6.3910 6.3910 8.6751 8.6751 9.3116 9.3116 k = 0.0128 0.0074-0.0000 ( 12504 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9216 -19.9216 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0702 -10.0702 -9.8750 -9.8750 -7.4544 -7.4544 -6.9052 -6.9052 -0.8731 -0.8731 0.6150 0.6150 1.1786 1.1786 1.4049 1.4049 1.4454 1.4454 1.6792 1.6792 3.0765 3.0765 3.3195 3.3195 3.6151 3.6151 3.8783 3.8783 4.4737 4.4737 5.8040 5.8040 5.9235 5.9235 6.3922 6.3922 8.6780 8.6780 9.3092 9.3092 k = 0.0256 0.0148-0.0000 ( 12520 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7464 -19.7464 -19.7461 -19.7461 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0694 -10.0694 -9.8746 -9.8746 -7.4533 -7.4533 -6.9053 -6.9053 -0.8718 -0.8718 0.6121 0.6121 1.1752 1.1752 1.3970 1.3970 1.4445 1.4445 1.6742 1.6742 3.0720 3.0720 3.3129 3.3129 3.6079 3.6079 3.8675 3.8675 4.4899 4.4899 5.8189 5.8189 5.9369 5.9369 6.3956 6.3956 8.6868 8.6868 9.2968 9.2968 k = 0.0385 0.0222-0.0000 ( 12532 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9217 -19.9217 -19.8292 -19.8292 -19.8287 -19.8287 -19.7464 -19.7464 -19.7461 -19.7461 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6463 -19.6463 -19.6461 -19.6461 -10.0680 -10.0680 -9.8740 -9.8740 -7.4515 -7.4515 -6.9056 -6.9056 -0.8696 -0.8696 0.6072 0.6072 1.1694 1.1694 1.3851 1.3851 1.4420 1.4420 1.6663 1.6663 3.0644 3.0644 3.3021 3.3021 3.5953 3.5953 3.8520 3.8520 4.5150 4.5150 5.8434 5.8434 5.9590 5.9590 6.4012 6.4012 8.7013 8.7013 9.2750 9.2750 k = 0.0513 0.0296-0.0000 ( 12556 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9218 -19.9218 -19.8292 -19.8292 -19.8288 -19.8288 -19.7465 -19.7465 -19.7462 -19.7462 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6463 -19.6463 -19.6462 -19.6462 -10.0662 -10.0662 -9.8732 -9.8732 -7.4490 -7.4490 -6.9059 -6.9059 -0.8666 -0.8666 0.6002 0.6002 1.1613 1.1613 1.3698 1.3698 1.4369 1.4369 1.6560 1.6560 3.0537 3.0537 3.2873 3.2873 3.5767 3.5767 3.8349 3.8349 4.5468 4.5468 5.8773 5.8773 5.9896 5.9896 6.4088 6.4088 8.7214 8.7214 9.2453 9.2453 k = 0.0641 0.0370-0.0000 ( 12552 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9218 -19.9218 -19.8292 -19.8292 -19.8288 -19.8288 -19.7465 -19.7465 -19.7463 -19.7463 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6462 -19.6462 -10.0638 -10.0638 -9.8721 -9.8721 -7.4457 -7.4457 -6.9063 -6.9063 -0.8627 -0.8627 0.5912 0.5912 1.1510 1.1510 1.3516 1.3516 1.4290 1.4290 1.6440 1.6440 3.0397 3.0397 3.2689 3.2689 3.5516 3.5516 3.8185 3.8185 4.5835 4.5835 5.9200 5.9200 6.0284 6.0284 6.4180 6.4180 8.7466 8.7466 9.2090 9.2090 k = 0.0769 0.0444-0.0000 ( 12548 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9219 -19.9219 -19.8293 -19.8293 -19.8288 -19.8288 -19.7466 -19.7466 -19.7463 -19.7463 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6463 -19.6463 -10.0609 -10.0609 -9.8709 -9.8709 -7.4418 -7.4418 -6.9068 -6.9068 -0.8580 -0.8580 0.5800 0.5800 1.1383 1.1383 1.3308 1.3308 1.4179 1.4179 1.6311 1.6311 3.0222 3.0222 3.2471 3.2471 3.5206 3.5206 3.8044 3.8044 4.6235 4.6235 5.9709 5.9709 6.0749 6.0749 6.4287 6.4287 8.7768 8.7768 9.1674 9.1674 k = 0.0897 0.0518-0.0000 ( 12546 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9219 -19.9219 -19.8293 -19.8293 -19.8289 -19.8289 -19.7466 -19.7466 -19.7464 -19.7464 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6463 -19.6463 -10.0575 -10.0575 -9.8694 -9.8694 -7.4372 -7.4372 -6.9074 -6.9074 -0.8524 -0.8524 0.5666 0.5666 1.1235 1.1235 1.3078 1.3078 1.4037 1.4037 1.6179 1.6179 3.0011 3.0011 3.2225 3.2225 3.4846 3.4846 3.7929 3.7929 4.6654 4.6654 6.0294 6.0294 6.1285 6.1285 6.4403 6.4403 8.8115 8.8115 9.1219 9.1219 k = 0.1026 0.0592-0.0000 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9220 -19.9220 -19.8293 -19.8293 -19.8289 -19.8289 -19.7467 -19.7467 -19.7465 -19.7465 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6464 -19.6464 -19.6464 -19.6464 -10.0537 -10.0537 -9.8678 -9.8678 -7.4319 -7.4319 -6.9081 -6.9081 -0.8461 -0.8461 0.5509 0.5509 1.1064 1.1064 1.2826 1.2826 1.3865 1.3865 1.6050 1.6050 2.9760 2.9760 3.1957 3.1957 3.4452 3.4452 3.7838 3.7838 4.7085 4.7085 6.0944 6.0944 6.1886 6.1886 6.4527 6.4527 8.8500 8.8500 9.0739 9.0739 k = 0.1154 0.0666-0.0000 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9220 -19.9220 -19.8294 -19.8294 -19.8289 -19.8289 -19.7468 -19.7468 -19.7466 -19.7466 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6465 -19.6465 -19.6464 -19.6464 -10.0494 -10.0494 -9.8659 -9.8659 -7.4259 -7.4259 -6.9090 -6.9090 -0.8391 -0.8391 0.5328 0.5328 1.0875 1.0875 1.2553 1.2553 1.3670 1.3670 1.5928 1.5928 2.9468 2.9468 3.1671 3.1671 3.4038 3.4038 3.7765 3.7765 4.7522 4.7522 6.1650 6.1650 6.2547 6.2547 6.4656 6.4656 8.8918 8.8918 9.0249 9.0249 k = 0.1282 0.0740-0.0000 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9221 -19.9221 -19.8295 -19.8295 -19.8290 -19.8290 -19.7469 -19.7469 -19.7467 -19.7467 -19.7414 -19.7414 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6466 -19.6466 -19.6465 -19.6465 -10.0446 -10.0446 -9.8639 -9.8639 -7.4193 -7.4193 -6.9100 -6.9100 -0.8313 -0.8313 0.5123 0.5123 1.0667 1.0667 1.2260 1.2260 1.3459 1.3459 1.5814 1.5814 2.9132 2.9132 3.1373 3.1373 3.3617 3.3617 3.7706 3.7706 4.7959 4.7959 6.2398 6.2398 6.3258 6.3258 6.4788 6.4788 8.9350 8.9350 8.9777 8.9777 k = 0.1410 0.0814-0.0000 ( 12540 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9222 -19.9222 -19.8295 -19.8295 -19.8290 -19.8290 -19.7470 -19.7470 -19.7468 -19.7468 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6536 -19.6536 -19.6466 -19.6466 -19.6466 -19.6466 -10.0395 -10.0395 -9.8618 -9.8618 -7.4122 -7.4122 -6.9111 -6.9111 -0.8228 -0.8228 0.4893 0.4893 1.0444 1.0444 1.1947 1.1947 1.3238 1.3238 1.5708 1.5708 2.8754 2.8754 3.1068 3.1068 3.3199 3.3199 3.7655 3.7655 4.8395 4.8395 6.3168 6.3168 6.4013 6.4013 6.4930 6.4930 8.9264 8.9264 8.9858 8.9858 k = 0.1538 0.0888-0.0000 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9226 -19.9226 -19.9223 -19.9223 -19.8296 -19.8296 -19.8291 -19.8291 -19.7471 -19.7471 -19.7469 -19.7469 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6536 -19.6536 -19.6467 -19.6467 -19.6466 -19.6466 -10.0339 -10.0339 -9.8595 -9.8595 -7.4044 -7.4044 -6.9123 -6.9123 -0.8137 -0.8137 0.4638 0.4638 1.0208 1.0208 1.1617 1.1617 1.3016 1.3016 1.5607 1.5607 2.8334 2.8334 3.0758 3.0758 3.2791 3.2791 3.7609 3.7609 4.8826 4.8826 6.3917 6.3917 6.4795 6.4795 6.5116 6.5116 8.8833 8.8833 9.0326 9.0326 k = 0.1667 0.0962-0.0000 ( 12536 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9226 -19.9226 -19.9224 -19.9224 -19.8296 -19.8296 -19.8292 -19.8292 -19.7472 -19.7472 -19.7471 -19.7471 -19.7414 -19.7414 -19.7409 -19.7409 -19.6546 -19.6546 -19.6537 -19.6537 -19.6468 -19.6468 -19.6467 -19.6467 -10.0281 -10.0281 -9.8572 -9.8572 -7.3962 -7.3962 -6.9138 -6.9138 -0.8040 -0.8040 0.4359 0.4359 0.9963 0.9963 1.1273 1.1273 1.2797 1.2797 1.5512 1.5512 2.7877 2.7877 3.0446 3.0446 3.2400 3.2400 3.7566 3.7566 4.9252 4.9252 6.4523 6.4523 6.5382 6.5382 6.5666 6.5666 8.8441 8.8441 9.0803 9.0803 k = 0.1795 0.1036-0.0000 ( 12528 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9227 -19.9227 -19.9224 -19.9224 -19.8297 -19.8297 -19.8292 -19.8292 -19.7473 -19.7473 -19.7472 -19.7472 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6537 -19.6537 -19.6469 -19.6469 -19.6468 -19.6468 -10.0218 -10.0218 -9.8547 -9.8547 -7.3874 -7.3874 -6.9154 -6.9154 -0.7938 -0.7938 0.4057 0.4057 0.9710 0.9710 1.0920 1.0920 1.2584 1.2584 1.5420 1.5420 2.7390 2.7390 3.0130 3.0130 3.2027 3.2027 3.7525 3.7525 4.9672 4.9672 6.4833 6.4833 6.5969 6.5969 6.6508 6.6508 8.8109 8.8109 9.0970 9.0970 k = 0.1923 0.1110-0.0000 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9227 -19.9227 -19.9225 -19.9225 -19.8298 -19.8298 -19.8293 -19.8293 -19.7475 -19.7475 -19.7474 -19.7474 -19.7414 -19.7414 -19.7409 -19.7409 -19.6546 -19.6546 -19.6537 -19.6537 -19.6470 -19.6470 -19.6468 -19.6468 -10.0153 -10.0153 -9.8522 -9.8522 -7.3781 -7.3781 -6.9171 -6.9171 -0.7830 -0.7830 0.3732 0.3732 0.9452 0.9452 1.0562 1.0562 1.2379 1.2379 1.5331 1.5331 2.6878 2.6878 2.9812 2.9812 3.1675 3.1675 3.7483 3.7483 5.0085 5.0085 6.4961 6.4961 6.6677 6.6677 6.7378 6.7378 8.7853 8.7853 9.0601 9.0601 k = 0.2051 0.1184-0.0000 ( 12540 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9228 -19.9228 -19.9226 -19.9226 -19.8299 -19.8299 -19.8293 -19.8293 -19.7476 -19.7476 -19.7475 -19.7475 -19.7414 -19.7414 -19.7409 -19.7409 -19.6546 -19.6546 -19.6538 -19.6538 -19.6470 -19.6470 -19.6469 -19.6469 -10.0085 -10.0085 -9.8497 -9.8497 -7.3684 -7.3684 -6.9191 -6.9191 -0.7718 -0.7718 0.3388 0.3388 0.9189 0.9189 1.0206 1.0206 1.2182 1.2182 1.5243 1.5243 2.6350 2.6350 2.9492 2.9492 3.1344 3.1344 3.7441 3.7441 5.0492 5.0492 6.5017 6.5017 6.7382 6.7382 6.8258 6.8258 8.7688 8.7688 9.0303 9.0303 k = 0.2179 0.1258-0.0000 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9229 -19.9229 -19.9227 -19.9227 -19.8300 -19.8300 -19.8294 -19.8294 -19.7478 -19.7478 -19.7476 -19.7476 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6538 -19.6538 -19.6471 -19.6471 -19.6470 -19.6470 -10.0016 -10.0016 -9.8471 -9.8471 -7.3583 -7.3583 -6.9212 -6.9212 -0.7602 -0.7602 0.3026 0.3026 0.8922 0.8922 0.9858 0.9858 1.1993 1.1993 1.5157 1.5157 2.5811 2.5811 2.9169 2.9169 3.1034 3.1034 3.7397 3.7397 5.0892 5.0892 6.5034 6.5034 6.8039 6.8039 6.9131 6.9131 8.7627 8.7627 9.0094 9.0094 k = 0.2308 0.1332-0.0000 ( 12524 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9230 -19.9230 -19.9228 -19.9228 -19.8301 -19.8301 -19.8294 -19.8294 -19.7479 -19.7479 -19.7478 -19.7478 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6539 -19.6539 -19.6472 -19.6472 -19.6470 -19.6470 -9.9944 -9.9944 -9.8446 -9.8446 -7.3478 -7.3478 -6.9236 -6.9236 -0.7482 -0.7482 0.2649 0.2649 0.8650 0.8650 0.9524 0.9524 1.1812 1.1812 1.5073 1.5073 2.5267 2.5267 2.8845 2.8845 3.0745 3.0745 3.7352 3.7352 5.1285 5.1285 6.5020 6.5020 6.8624 6.8624 6.9980 6.9980 8.7681 8.7681 8.9988 8.9988 k = 0.2436 0.1406-0.0000 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9230 -19.9230 -19.9229 -19.9229 -19.8302 -19.8302 -19.8295 -19.8295 -19.7480 -19.7480 -19.7479 -19.7479 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6539 -19.6539 -19.6473 -19.6473 -19.6471 -19.6471 -9.9870 -9.9870 -9.8421 -9.8421 -7.3370 -7.3370 -6.9261 -6.9261 -0.7359 -0.7359 0.2261 0.2261 0.8374 0.8374 0.9207 0.9207 1.1638 1.1638 1.4989 1.4989 2.4725 2.4725 2.8522 2.8522 3.0475 3.0475 3.7306 3.7306 5.1671 5.1671 6.4978 6.4978 6.9123 6.9123 7.0789 7.0789 8.7854 8.7854 9.0003 9.0003 k = 0.2564 0.1480-0.0000 ( 12522 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9231 -19.9231 -19.9229 -19.9229 -19.8303 -19.8303 -19.8295 -19.8295 -19.7482 -19.7482 -19.7481 -19.7481 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6539 -19.6539 -19.6474 -19.6474 -19.6472 -19.6472 -9.9796 -9.9796 -9.8396 -9.8396 -7.3260 -7.3260 -6.9289 -6.9289 -0.7234 -0.7234 0.1865 0.1865 0.8095 0.8095 0.8912 0.8912 1.1471 1.1471 1.4907 1.4907 2.4188 2.4188 2.8202 2.8202 3.0222 3.0222 3.7259 3.7259 5.2051 5.2051 6.4912 6.4912 6.9527 6.9527 7.1539 7.1539 8.8146 8.8146 9.0156 9.0156 k = 0.2692 0.1554-0.0000 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9232 -19.9232 -19.9230 -19.9230 -19.8304 -19.8304 -19.8296 -19.8296 -19.7484 -19.7484 -19.7482 -19.7482 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6540 -19.6540 -19.6475 -19.6475 -19.6473 -19.6473 -9.9720 -9.9720 -9.8373 -9.8373 -7.3147 -7.3147 -6.9320 -6.9320 -0.7107 -0.7107 0.1463 0.1463 0.7814 0.7814 0.8637 0.8637 1.1312 1.1312 1.4826 1.4826 2.3661 2.3661 2.7886 2.7886 2.9986 2.9986 3.7211 3.7211 5.2424 5.2424 6.4821 6.4821 6.9834 6.9834 7.2217 7.2217 8.8547 8.8547 9.0461 9.0461 k = 0.2821 0.1628-0.0000 ( 12526 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9233 -19.9233 -19.9231 -19.9231 -19.8304 -19.8304 -19.8297 -19.8297 -19.7485 -19.7485 -19.7484 -19.7484 -19.7413 -19.7413 -19.7409 -19.7409 -19.6546 -19.6546 -19.6540 -19.6540 -19.6476 -19.6476 -19.6473 -19.6473 -9.9645 -9.9645 -9.8350 -9.8350 -7.3032 -7.3032 -6.9352 -6.9352 -0.6978 -0.6978 0.1059 0.1059 0.7537 0.7537 0.8382 0.8382 1.1159 1.1159 1.4747 1.4747 2.3148 2.3148 2.7578 2.7578 2.9765 2.9765 3.7163 3.7163 5.2791 5.2791 6.4709 6.4709 7.0048 7.0048 7.2811 7.2811 8.9038 8.9038 9.0927 9.0927 k = 0.2949 0.1702-0.0000 ( 12526 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9234 -19.9234 -19.9232 -19.9232 -19.8305 -19.8305 -19.8298 -19.8298 -19.7486 -19.7486 -19.7485 -19.7485 -19.7412 -19.7412 -19.7409 -19.7409 -19.6546 -19.6546 -19.6541 -19.6541 -19.6477 -19.6477 -19.6474 -19.6474 -9.9569 -9.9569 -9.8329 -9.8329 -7.2916 -7.2916 -6.9387 -6.9387 -0.6848 -0.6848 0.0656 0.0656 0.7267 0.7267 0.8143 0.8143 1.1013 1.1013 1.4670 1.4670 2.2650 2.2650 2.7278 2.7278 2.9559 2.9559 3.7114 3.7114 5.3151 5.3151 6.4577 6.4577 7.0177 7.0177 7.3315 7.3315 8.9602 8.9602 9.1547 9.1547 k = 0.3077 0.1776-0.0000 ( 12526 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9233 -19.9233 -19.8306 -19.8306 -19.8298 -19.8298 -19.7488 -19.7488 -19.7487 -19.7487 -19.7412 -19.7412 -19.7409 -19.7409 -19.6546 -19.6546 -19.6541 -19.6541 -19.6478 -19.6478 -19.6474 -19.6474 -9.9494 -9.9494 -9.8309 -9.8309 -7.2800 -7.2800 -6.9424 -6.9424 -0.6717 -0.6717 0.0256 0.0256 0.7009 0.7009 0.7919 0.7919 1.0875 1.0875 1.4595 1.4595 2.2172 2.2172 2.6989 2.6989 2.9365 2.9365 3.7065 3.7065 5.3505 5.3505 6.4426 6.4426 7.0231 7.0231 7.3727 7.3727 9.0210 9.0210 9.2293 9.2293 k = 0.3205 0.1850-0.0000 ( 12518 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9233 -19.9233 -19.8307 -19.8307 -19.8299 -19.8299 -19.7489 -19.7489 -19.7488 -19.7488 -19.7412 -19.7412 -19.7409 -19.7409 -19.6546 -19.6546 -19.6542 -19.6542 -19.6478 -19.6478 -19.6475 -19.6475 -9.9420 -9.9420 -9.8291 -9.8291 -7.2683 -7.2683 -6.9464 -6.9464 -0.6586 -0.6586 -0.0137 -0.0137 0.6766 0.6766 0.7707 0.7707 1.0744 1.0744 1.4523 1.4523 2.1715 2.1715 2.6712 2.6712 2.9185 2.9185 3.7017 3.7017 5.3852 5.3852 6.4259 6.4259 7.0225 7.0225 7.4052 7.4052 9.0825 9.0825 9.2968 9.2968 k = 0.3333 0.1925-0.0000 ( 12518 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9236 -19.9236 -19.9234 -19.9234 -19.8308 -19.8308 -19.8299 -19.8299 -19.7491 -19.7491 -19.7489 -19.7489 -19.7412 -19.7412 -19.7409 -19.7409 -19.6547 -19.6547 -19.6542 -19.6542 -19.6479 -19.6479 -19.6476 -19.6476 -9.9347 -9.9347 -9.8275 -9.8275 -7.2567 -7.2567 -6.9506 -6.9506 -0.6453 -0.6453 -0.0522 -0.0522 0.6542 0.6542 0.7505 0.7505 1.0620 1.0620 1.4453 1.4453 2.1281 2.1281 2.6450 2.6450 2.9018 2.9018 3.6970 3.6970 5.4192 5.4192 6.4079 6.4079 7.0171 7.0171 7.4299 7.4299 9.1388 9.1388 9.3006 9.3006 k = 0.3462 0.1999-0.0000 ( 12518 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9237 -19.9237 -19.9234 -19.9234 -19.8309 -19.8309 -19.8300 -19.8300 -19.7492 -19.7492 -19.7490 -19.7490 -19.7412 -19.7412 -19.7409 -19.7409 -19.6547 -19.6547 -19.6542 -19.6542 -19.6480 -19.6480 -19.6476 -19.6476 -9.9276 -9.9276 -9.8261 -9.8261 -7.2452 -7.2452 -6.9549 -6.9549 -0.6321 -0.6321 -0.0897 -0.0897 0.6338 0.6338 0.7313 0.7313 1.0505 1.0505 1.4387 1.4387 2.0873 2.0873 2.6202 2.6202 2.8862 2.8862 3.6925 3.6925 5.4523 5.4523 6.3887 6.3887 7.0082 7.0082 7.4477 7.4477 9.1822 9.1822 9.2901 9.2901 k = 0.3590 0.2073-0.0000 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9238 -19.9238 -19.9235 -19.9235 -19.8309 -19.8309 -19.8300 -19.8300 -19.7493 -19.7493 -19.7492 -19.7492 -19.7411 -19.7411 -19.7409 -19.7409 -19.6547 -19.6547 -19.6542 -19.6542 -19.6480 -19.6480 -19.6477 -19.6477 -9.9208 -9.9208 -9.8250 -9.8250 -7.2339 -7.2339 -6.9595 -6.9595 -0.6187 -0.6187 -0.1260 -0.1260 0.6155 0.6155 0.7130 0.7130 1.0397 1.0397 1.4325 1.4325 2.0492 2.0492 2.5970 2.5970 2.8719 2.8719 3.6881 3.6881 5.4846 5.4846 6.3686 6.3686 6.9969 6.9969 7.4599 7.4599 9.2066 9.2066 9.2782 9.2782 k = 0.3718 0.2147-0.0000 ( 12520 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9236 -19.9236 -19.8310 -19.8310 -19.8301 -19.8301 -19.7494 -19.7494 -19.7493 -19.7493 -19.7412 -19.7412 -19.7409 -19.7409 -19.6548 -19.6548 -19.6542 -19.6542 -19.6481 -19.6481 -19.6477 -19.6477 -9.9142 -9.9142 -9.8240 -9.8240 -7.2228 -7.2228 -6.9642 -6.9642 -0.6053 -0.6053 -0.1610 -0.1610 0.5996 0.5996 0.6954 0.6954 1.0298 1.0298 1.4267 1.4267 2.0140 2.0140 2.5756 2.5756 2.8588 2.8588 3.6840 3.6840 5.5159 5.5159 6.3478 6.3478 6.9841 6.9841 7.4677 7.4677 9.2124 9.2124 9.2657 9.2657 k = 0.3846 0.2221-0.0000 ( 12510 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9236 -19.9236 -19.8310 -19.8310 -19.8301 -19.8301 -19.7495 -19.7495 -19.7494 -19.7494 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6542 -19.6542 -19.6482 -19.6482 -19.6478 -19.6478 -9.9079 -9.9079 -9.8233 -9.8233 -7.2122 -7.2122 -6.9690 -6.9690 -0.5918 -0.5918 -0.1945 -0.1945 0.5859 0.5859 0.6787 0.6787 1.0208 1.0208 1.4214 1.4214 1.9817 1.9817 2.5560 2.5560 2.8469 2.8469 3.6801 3.6801 5.5461 5.5461 6.3268 6.3268 6.9706 6.9706 7.4722 7.4722 9.2054 9.2054 9.2522 9.2522 k = 0.3974 0.2295-0.0000 ( 12520 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9236 -19.9236 -19.8311 -19.8311 -19.8301 -19.8301 -19.7496 -19.7496 -19.7495 -19.7495 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6543 -19.6543 -19.6482 -19.6482 -19.6478 -19.6478 -9.9020 -9.9020 -9.8228 -9.8228 -7.2020 -7.2020 -6.9738 -6.9738 -0.5782 -0.5782 -0.2265 -0.2265 0.5745 0.5745 0.6629 0.6629 1.0126 1.0126 1.4165 1.4165 1.9526 1.9526 2.5382 2.5382 2.8363 2.8363 3.6766 3.6766 5.5748 5.5748 6.3059 6.3059 6.9571 6.9571 7.4741 7.4741 9.1916 9.1916 9.2377 9.2377 k = 0.4103 0.2369-0.0000 ( 12502 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9237 -19.9237 -19.8312 -19.8312 -19.8301 -19.8301 -19.7497 -19.7497 -19.7495 -19.7495 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6543 -19.6543 -19.6482 -19.6482 -19.6478 -19.6478 -9.8965 -9.8965 -9.8225 -9.8225 -7.1924 -7.1924 -6.9786 -6.9786 -0.5644 -0.5644 -0.2568 -0.2568 0.5654 0.5654 0.6480 0.6480 1.0054 1.0054 1.4121 1.4121 1.9266 1.9266 2.5224 2.5224 2.8269 2.8269 3.6734 3.6734 5.6020 5.6020 6.2853 6.2853 6.9441 6.9441 7.4744 7.4744 9.1747 9.1747 9.2235 9.2235 k = 0.4231 0.2443-0.0000 ( 12498 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9237 -19.9237 -19.8312 -19.8312 -19.8302 -19.8302 -19.7497 -19.7497 -19.7496 -19.7496 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8915 -9.8915 -9.8224 -9.8224 -7.1835 -7.1835 -6.9832 -6.9832 -0.5505 -0.5505 -0.2853 -0.2853 0.5585 0.5585 0.6340 0.6340 0.9990 0.9990 1.4083 1.4083 1.9040 1.9040 2.5087 2.5087 2.8187 2.8187 3.6705 3.6705 5.6271 5.6271 6.2657 6.2657 6.9321 6.9321 7.4735 7.4735 9.1568 9.1568 9.2105 9.2105 k = 0.4359 0.2517-0.0000 ( 12502 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8302 -19.8302 -19.7498 -19.7498 -19.7497 -19.7497 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8871 -9.8871 -9.8225 -9.8225 -7.1754 -7.1754 -6.9876 -6.9876 -0.5363 -0.5363 -0.3119 -0.3119 0.5537 0.5537 0.6213 0.6213 0.9936 0.9936 1.4050 1.4050 1.8847 1.8847 2.4969 2.4969 2.8117 2.8117 3.6681 3.6681 5.6498 5.6498 6.2474 6.2474 6.9214 6.9214 7.4721 7.4721 9.1397 9.1397 9.1993 9.1993 k = 0.4487 0.2591-0.0000 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8302 -19.8302 -19.7498 -19.7498 -19.7497 -19.7497 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8834 -9.8834 -9.8227 -9.8227 -7.1685 -7.1685 -6.9915 -6.9915 -0.5222 -0.5222 -0.3364 -0.3364 0.5507 0.5507 0.6098 0.6098 0.9892 0.9892 1.4023 1.4023 1.8688 1.8688 2.4872 2.4872 2.8060 2.8060 3.6660 3.6660 5.6697 5.6697 6.2312 6.2312 6.9123 6.9123 7.4705 7.4705 9.1245 9.1245 9.1901 9.1901 k = 0.4615 0.2665-0.0000 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8302 -19.8302 -19.7499 -19.7499 -19.7497 -19.7497 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8803 -9.8803 -9.8229 -9.8229 -7.1628 -7.1628 -6.9948 -6.9948 -0.5083 -0.5083 -0.3584 -0.3584 0.5494 0.5494 0.5999 0.5999 0.9858 0.9858 1.4001 1.4001 1.8564 1.8564 2.4797 2.4797 2.8016 2.8016 3.6644 3.6644 5.6860 5.6860 6.2175 6.2175 6.9050 6.9050 7.4690 7.4690 9.1120 9.1120 9.1828 9.1828 k = 0.4744 0.2739-0.0000 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8302 -19.8302 -19.7499 -19.7499 -19.7497 -19.7497 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8780 -9.8780 -9.8231 -9.8231 -7.1585 -7.1585 -6.9974 -6.9974 -0.4955 -0.4955 -0.3771 -0.3771 0.5494 0.5494 0.5920 0.5920 0.9833 0.9833 1.3986 1.3986 1.8475 1.8475 2.4743 2.4743 2.7984 2.7984 3.6632 3.6632 5.6983 5.6983 6.2071 6.2071 6.8997 6.8997 7.4677 7.4677 9.1027 9.1027 9.1776 9.1776 k = 0.4872 0.2813-0.0000 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8302 -19.8302 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8767 -9.8767 -9.8233 -9.8233 -7.1559 -7.1559 -6.9990 -6.9990 -0.4856 -0.4856 -0.3906 -0.3906 0.5499 0.5499 0.5867 0.5867 0.9818 0.9818 1.3977 1.3977 1.8422 1.8422 2.4710 2.4710 2.7965 2.7965 3.6625 3.6625 5.7059 5.7059 6.2006 6.2006 6.8965 6.8965 7.4669 7.4669 9.0970 9.0970 9.1745 9.1745 k = 0.5000 0.2887-0.0000 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8762 -9.8762 -9.8233 -9.8233 -7.1550 -7.1550 -6.9995 -6.9995 -0.4816 -0.4816 -0.3957 -0.3957 0.5502 0.5502 0.5848 0.5848 0.9813 0.9813 1.3974 1.3974 1.8404 1.8404 2.4699 2.4699 2.7959 2.7959 3.6623 3.6623 5.7085 5.7085 6.1984 6.1984 6.8954 6.8954 7.4666 7.4666 9.0951 9.0951 9.1734 9.1734 k = 0.5000 0.2887-0.0000 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8762 -9.8762 -9.8233 -9.8233 -7.1550 -7.1550 -6.9995 -6.9995 -0.4816 -0.4816 -0.3957 -0.3957 0.5502 0.5502 0.5848 0.5848 0.9813 0.9813 1.3974 1.3974 1.8404 1.8404 2.4699 2.4699 2.7959 2.7959 3.6623 3.6623 5.7085 5.7085 6.1984 6.1984 6.8954 6.8954 7.4666 7.4666 9.0951 9.0951 9.1734 9.1734 k = 0.4928 0.3012-0.0000 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8302 -19.8302 -19.7500 -19.7500 -19.7497 -19.7497 -19.7411 -19.7411 -19.7408 -19.7408 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8761 -9.8761 -9.8233 -9.8233 -7.1548 -7.1548 -6.9996 -6.9996 -0.4812 -0.4812 -0.3952 -0.3952 0.5502 0.5502 0.5841 0.5841 0.9803 0.9803 1.3954 1.3954 1.8409 1.8409 2.4700 2.4700 2.7943 2.7943 3.6603 3.6603 5.7098 5.7098 6.1989 6.1989 6.9008 6.9008 7.4720 7.4720 9.0952 9.0952 9.1772 9.1772 k = 0.4855 0.3138-0.0000 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9243 -19.9243 -19.9237 -19.9237 -19.8313 -19.8313 -19.8303 -19.8303 -19.7501 -19.7501 -19.7496 -19.7496 -19.7412 -19.7412 -19.7408 -19.7408 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8757 -9.8757 -9.8233 -9.8233 -7.1542 -7.1542 -6.9999 -6.9999 -0.4799 -0.4799 -0.3934 -0.3934 0.5499 0.5499 0.5823 0.5823 0.9773 0.9773 1.3894 1.3894 1.8424 1.8424 2.4703 2.4703 2.7898 2.7898 3.6543 3.6543 5.7135 5.7135 6.2003 6.2003 6.9171 6.9171 7.4880 7.4880 9.0955 9.0955 9.1885 9.1885 k = 0.4783 0.3263-0.0000 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9243 -19.9243 -19.9237 -19.9237 -19.8313 -19.8313 -19.8303 -19.8303 -19.7502 -19.7502 -19.7495 -19.7495 -19.7413 -19.7413 -19.7407 -19.7407 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8752 -9.8752 -9.8232 -9.8232 -7.1531 -7.1531 -7.0004 -7.0004 -0.4778 -0.4778 -0.3905 -0.3905 0.5484 0.5484 0.5802 0.5802 0.9725 0.9725 1.3797 1.3797 1.8449 1.8449 2.4708 2.4708 2.7823 2.7823 3.6444 3.6444 5.7195 5.7195 6.2024 6.2024 6.9440 6.9440 7.5146 7.5146 9.0957 9.0957 9.2076 9.2076 k = 0.4710 0.3389-0.0000 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9244 -19.9244 -19.9236 -19.9236 -19.8313 -19.8313 -19.8303 -19.8303 -19.7503 -19.7503 -19.7494 -19.7494 -19.7413 -19.7413 -19.7407 -19.7407 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8744 -9.8744 -9.8231 -9.8231 -7.1517 -7.1517 -7.0010 -7.0010 -0.4748 -0.4748 -0.3865 -0.3865 0.5443 0.5443 0.5791 0.5791 0.9660 0.9660 1.3662 1.3662 1.8484 1.8484 2.4713 2.4713 2.7722 2.7722 3.6309 3.6309 5.7279 5.7279 6.2052 6.2052 6.9813 6.9813 7.5515 7.5515 9.0958 9.0958 9.2344 9.2344 k = 0.4638 0.3514-0.0000 ( 12482 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9245 -19.9245 -19.9236 -19.9236 -19.8313 -19.8313 -19.8303 -19.8303 -19.7504 -19.7504 -19.7493 -19.7493 -19.7414 -19.7414 -19.7406 -19.7406 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8734 -9.8734 -9.8230 -9.8230 -7.1499 -7.1499 -7.0019 -7.0019 -0.4710 -0.4710 -0.3814 -0.3814 0.5366 0.5366 0.5803 0.5803 0.9582 0.9582 1.3493 1.3493 1.8528 1.8528 2.4717 2.4717 2.7597 2.7597 3.6141 3.6141 5.7383 5.7383 6.2084 6.2084 7.0289 7.0289 7.5985 7.5985 9.0955 9.0955 9.2689 9.2689 k = 0.4565 0.3640-0.0000 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9245 -19.9245 -19.9235 -19.9235 -19.8313 -19.8313 -19.8303 -19.8303 -19.7505 -19.7505 -19.7493 -19.7493 -19.7415 -19.7415 -19.7405 -19.7405 -19.6548 -19.6548 -19.6543 -19.6543 -19.6485 -19.6485 -19.6480 -19.6480 -9.8722 -9.8722 -9.8229 -9.8229 -7.1476 -7.1476 -7.0029 -7.0029 -0.4664 -0.4664 -0.3753 -0.3753 0.5250 0.5250 0.5838 0.5838 0.9494 0.9494 1.3292 1.3292 1.8580 1.8580 2.4720 2.4720 2.7453 2.7453 3.5943 3.5943 5.7507 5.7507 6.2118 6.2118 7.0862 7.0862 7.6553 7.6553 9.0949 9.0949 9.3109 9.3109 k = 0.4493 0.3765-0.0000 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9246 -19.9246 -19.9235 -19.9235 -19.8313 -19.8313 -19.8304 -19.8304 -19.7507 -19.7507 -19.7492 -19.7492 -19.7416 -19.7416 -19.7405 -19.7405 -19.6548 -19.6548 -19.6543 -19.6543 -19.6485 -19.6485 -19.6480 -19.6480 -9.8708 -9.8708 -9.8229 -9.8229 -7.1450 -7.1450 -7.0042 -7.0042 -0.4610 -0.4610 -0.3682 -0.3682 0.5101 0.5101 0.5891 0.5891 0.9399 0.9399 1.3062 1.3062 1.8641 1.8641 2.4720 2.4720 2.7294 2.7294 3.5719 3.5719 5.7648 5.7648 6.2152 6.2152 7.1529 7.1529 7.7213 7.7213 9.0939 9.0939 9.3601 9.3601 k = 0.4420 0.3891-0.0000 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9247 -19.9247 -19.9234 -19.9234 -19.8313 -19.8313 -19.8304 -19.8304 -19.7508 -19.7508 -19.7491 -19.7491 -19.7416 -19.7416 -19.7404 -19.7404 -19.6548 -19.6548 -19.6543 -19.6543 -19.6485 -19.6485 -19.6480 -19.6480 -9.8692 -9.8692 -9.8228 -9.8228 -7.1421 -7.1421 -7.0057 -7.0057 -0.4549 -0.4549 -0.3603 -0.3603 0.4922 0.4922 0.5958 0.5958 0.9299 0.9299 1.2807 1.2807 1.8709 1.8709 2.4714 2.4714 2.7126 2.7126 3.5475 3.5475 5.7804 5.7804 6.2182 6.2182 7.2284 7.2284 7.7962 7.7962 9.0925 9.0925 9.4161 9.4161 k = 0.4348 0.4016-0.0000 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9248 -19.9248 -19.9233 -19.9233 -19.8313 -19.8313 -19.8304 -19.8304 -19.7509 -19.7509 -19.7490 -19.7490 -19.7417 -19.7417 -19.7403 -19.7403 -19.6548 -19.6548 -19.6543 -19.6543 -19.6485 -19.6485 -19.6480 -19.6480 -9.8674 -9.8674 -9.8227 -9.8227 -7.1387 -7.1387 -7.0074 -7.0074 -0.4481 -0.4481 -0.3517 -0.3517 0.4719 0.4719 0.6037 0.6037 0.9199 0.9199 1.2531 1.2531 1.8782 1.8782 2.4699 2.4699 2.6954 2.6954 3.5216 3.5216 5.7974 5.7974 6.2206 6.2206 7.3121 7.3121 7.8794 7.8794 9.0906 9.0906 9.4786 9.4786 k = 0.4275 0.4142-0.0000 ( 12476 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9248 -19.9248 -19.9233 -19.9233 -19.8313 -19.8313 -19.8304 -19.8304 -19.7510 -19.7510 -19.7490 -19.7490 -19.7418 -19.7418 -19.7403 -19.7403 -19.6548 -19.6548 -19.6543 -19.6543 -19.6485 -19.6485 -19.6481 -19.6481 -9.8655 -9.8655 -9.8227 -9.8227 -7.1350 -7.1350 -7.0094 -7.0094 -0.4406 -0.4406 -0.3424 -0.3424 0.4494 0.4494 0.6127 0.6127 0.9101 0.9101 1.2237 1.2237 1.8860 1.8860 2.4674 2.4674 2.6785 2.6785 3.4945 3.4945 5.8154 5.8154 6.2220 6.2220 7.4033 7.4033 7.9704 7.9704 9.0884 9.0884 9.5470 9.5470 k = 0.4203 0.4267-0.0000 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9249 -19.9249 -19.9233 -19.9233 -19.8313 -19.8313 -19.8304 -19.8304 -19.7511 -19.7511 -19.7489 -19.7489 -19.7419 -19.7419 -19.7403 -19.7403 -19.6547 -19.6547 -19.6543 -19.6543 -19.6486 -19.6486 -19.6481 -19.6481 -9.8635 -9.8635 -9.8228 -9.8228 -7.1310 -7.1310 -7.0117 -7.0117 -0.4326 -0.4326 -0.3327 -0.3327 0.4251 0.4251 0.6227 0.6227 0.9006 0.9006 1.1931 1.1931 1.8942 1.8942 2.4636 2.4636 2.6624 2.6624 3.4669 3.4669 5.8343 5.8343 6.2224 6.2224 7.5012 7.5012 8.0685 8.0685 9.0858 9.0858 9.6205 9.6205 k = 0.4130 0.4393-0.0000 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9250 -19.9250 -19.9232 -19.9232 -19.8313 -19.8313 -19.8305 -19.8305 -19.7512 -19.7512 -19.7489 -19.7489 -19.7419 -19.7419 -19.7402 -19.7402 -19.6547 -19.6547 -19.6543 -19.6543 -19.6486 -19.6486 -19.6481 -19.6481 -9.8613 -9.8613 -9.8229 -9.8229 -7.1267 -7.1267 -7.0142 -7.0142 -0.4239 -0.4239 -0.3228 -0.3228 0.3995 0.3995 0.6336 0.6336 0.8915 0.8915 1.1615 1.1615 1.9024 1.9024 2.4583 2.4583 2.6477 2.6477 3.4393 3.4393 5.8540 5.8540 6.2215 6.2215 7.6050 7.6050 8.1731 8.1731 9.0831 9.0831 9.6981 9.6981 k = 0.4058 0.4518-0.0000 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9232 -19.9232 -19.8313 -19.8313 -19.8305 -19.8305 -19.7513 -19.7513 -19.7488 -19.7488 -19.7420 -19.7420 -19.7402 -19.7402 -19.6547 -19.6547 -19.6544 -19.6544 -19.6486 -19.6486 -19.6482 -19.6482 -9.8590 -9.8590 -9.8231 -9.8231 -7.1220 -7.1220 -7.0170 -7.0170 -0.4147 -0.4147 -0.3129 -0.3129 0.3731 0.3731 0.6452 0.6452 0.8831 0.8831 1.1295 1.1295 1.9106 1.9106 2.4516 2.4516 2.6347 2.6347 3.4122 3.4122 5.8743 5.8743 6.2190 6.2190 7.7134 7.7134 8.2832 8.2832 9.0805 9.0805 9.7780 9.7780 k = 0.3986 0.4644-0.0000 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9232 -19.9232 -19.8313 -19.8313 -19.8305 -19.8305 -19.7514 -19.7514 -19.7488 -19.7488 -19.7421 -19.7421 -19.7402 -19.7402 -19.6547 -19.6547 -19.6544 -19.6544 -19.6486 -19.6486 -19.6482 -19.6482 -9.8566 -9.8566 -9.8235 -9.8235 -7.1171 -7.1171 -7.0201 -7.0201 -0.4051 -0.4051 -0.3032 -0.3032 0.3464 0.3464 0.6576 0.6576 0.8753 0.8753 1.0974 1.0974 1.9186 1.9186 2.4437 2.4437 2.6235 2.6235 3.3862 3.3862 5.8950 5.8950 6.2149 6.2149 7.8252 7.8252 8.3980 8.3980 9.0786 9.0786 9.8244 9.8244 k = 0.3913 0.4769-0.0000 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9232 -19.9232 -19.8313 -19.8313 -19.8305 -19.8305 -19.7514 -19.7514 -19.7487 -19.7487 -19.7421 -19.7421 -19.7401 -19.7401 -19.6547 -19.6547 -19.6544 -19.6544 -19.6487 -19.6487 -19.6482 -19.6482 -9.8541 -9.8541 -9.8239 -9.8239 -7.1119 -7.1119 -7.0235 -7.0235 -0.3951 -0.3951 -0.2942 -0.2942 0.3200 0.3200 0.6705 0.6705 0.8683 0.8683 1.0657 1.0657 1.9260 1.9260 2.4352 2.4352 2.6140 2.6140 3.3617 3.3617 5.9161 5.9161 6.2091 6.2091 7.9384 7.9384 8.5164 8.5164 9.0779 9.0779 9.7592 9.7592 k = 0.3841 0.4895-0.0000 ( 12494 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7515 -19.7515 -19.7487 -19.7487 -19.7422 -19.7422 -19.7401 -19.7401 -19.6547 -19.6547 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8516 -9.8516 -9.8245 -9.8245 -7.1065 -7.1065 -7.0272 -7.0272 -0.3848 -0.3848 -0.2862 -0.2862 0.2947 0.2947 0.6840 0.6840 0.8620 0.8620 1.0348 1.0348 1.9328 1.9328 2.4265 2.4265 2.6058 2.6058 3.3391 3.3391 5.9373 5.9373 6.2015 6.2015 8.0509 8.0509 8.6372 8.6372 9.0795 9.0795 9.6915 9.6915 k = 0.3768 0.5020-0.0000 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7487 -19.7487 -19.7422 -19.7422 -19.7401 -19.7401 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8491 -9.8491 -9.8253 -9.8253 -7.1009 -7.1009 -7.0313 -7.0313 -0.3742 -0.3742 -0.2796 -0.2796 0.2711 0.2711 0.6976 0.6976 0.8565 0.8565 1.0052 1.0052 1.9385 1.9385 2.4185 2.4185 2.5986 2.5986 3.3190 3.3190 5.9587 5.9587 6.1920 6.1920 8.1594 8.1594 8.7586 8.7586 9.0847 9.0847 9.6273 9.6273 k = 0.3696 0.5146-0.0000 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8465 -9.8465 -9.8262 -9.8262 -7.0950 -7.0950 -7.0357 -7.0357 -0.3635 -0.3635 -0.2749 -0.2749 0.2500 0.2500 0.7113 0.7113 0.8518 0.8518 0.9773 0.9773 1.9433 1.9433 2.4117 2.4117 2.5922 2.5922 3.3015 3.3015 5.9801 5.9801 6.1808 6.1808 8.2599 8.2599 8.8786 8.8786 9.0953 9.0953 9.5686 9.5686 k = 0.3623 0.5271-0.0000 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8440 -9.8440 -9.8274 -9.8274 -7.0890 -7.0890 -7.0405 -7.0405 -0.3528 -0.3528 -0.2725 -0.2725 0.2319 0.2319 0.7244 0.7244 0.8482 0.8482 0.9519 0.9519 1.9468 1.9468 2.4064 2.4064 2.5864 2.5864 3.2871 3.2871 6.0013 6.0013 6.1678 6.1678 8.3476 8.3476 8.9943 8.9943 9.1127 9.1127 9.5175 9.5175 k = 0.3551 0.5397-0.0000 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8415 -9.8415 -9.8287 -9.8287 -7.0828 -7.0828 -7.0457 -7.0457 -0.3423 -0.3423 -0.2725 -0.2725 0.2175 0.2175 0.7364 0.7364 0.8456 0.8456 0.9298 0.9298 1.9492 1.9492 2.4028 2.4028 2.5812 2.5812 3.2759 3.2759 6.0223 6.0223 6.1533 6.1533 8.4175 8.4175 9.1013 9.1013 9.1365 9.1365 9.4770 9.4770 k = 0.3478 0.5522-0.0000 ( 12466 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8390 -9.8390 -9.8303 -9.8303 -7.0765 -7.0765 -7.0512 -7.0512 -0.3325 -0.3325 -0.2749 -0.2749 0.2071 0.2071 0.7463 0.7463 0.8440 0.8440 0.9121 0.9121 1.9505 1.9505 2.4008 2.4008 2.5768 2.5768 3.2680 3.2680 6.0423 6.0423 6.1378 6.1378 8.4663 8.4663 9.1602 9.1602 9.1956 9.1956 9.4504 9.4504 k = 0.3406 0.5648-0.0000 ( 12464 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8366 -9.8366 -9.8322 -9.8322 -7.0700 -7.0700 -7.0572 -7.0572 -0.3244 -0.3244 -0.2787 -0.2787 0.2010 0.2010 0.7529 0.7529 0.8434 0.8434 0.9005 0.9005 1.9511 1.9511 2.4001 2.4001 2.5737 2.5737 3.2633 3.2633 6.0599 6.0599 6.1229 6.1229 8.4937 8.4937 9.1784 9.1784 9.2636 9.2636 9.4376 9.4376 k = 0.3333 0.5774-0.0000 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0636 -7.0636 -7.0635 -7.0635 -0.3208 -0.3208 -0.2809 -0.2809 0.1990 0.1990 0.7551 0.7551 0.8432 0.8432 0.8964 0.8964 1.9512 1.9512 2.4000 2.4000 2.5726 2.5726 3.2617 3.2617 6.0686 6.0686 6.1150 6.1150 8.5020 8.5020 9.1840 9.1840 9.2899 9.2899 9.4333 9.4333 k = 0.3333 0.5774-0.0000 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0636 -7.0636 -7.0635 -7.0635 -0.3208 -0.3208 -0.2809 -0.2809 0.1990 0.1990 0.7551 0.7551 0.8432 0.8432 0.8964 0.8964 1.9512 1.9512 2.4000 2.4000 2.5726 2.5726 3.2617 3.2617 6.0686 6.0686 6.1150 6.1150 8.5020 8.5020 9.1840 9.1840 9.2899 9.2899 9.4333 9.4333 k = 0.3259 0.5645-0.0000 ( 12468 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8367 -9.8367 -9.8320 -9.8320 -7.0704 -7.0704 -7.0568 -7.0568 -0.3252 -0.3252 -0.2777 -0.2777 0.2009 0.2009 0.7530 0.7530 0.8435 0.8435 0.9004 0.9004 1.9513 1.9513 2.3999 2.3999 2.5740 2.5740 3.2633 3.2633 6.0590 6.0590 6.1237 6.1237 8.4947 8.4947 9.1803 9.1803 9.2680 9.2680 9.4337 9.4337 k = 0.3185 0.5517-0.0000 ( 12470 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8395 -9.8395 -9.8299 -9.8299 -7.0778 -7.0778 -7.0501 -7.0501 -0.3368 -0.3368 -0.2696 -0.2696 0.2064 0.2064 0.7477 0.7477 0.8447 0.8447 0.9109 0.9109 1.9516 1.9516 2.3990 2.3990 2.5788 2.5788 3.2677 3.2677 6.0387 6.0387 6.1414 6.1414 8.4755 8.4755 9.1729 9.1729 9.2227 9.2227 9.4185 9.4185 k = 0.3111 0.5389-0.0000 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8426 -9.8426 -9.8280 -9.8280 -7.0855 -7.0855 -7.0433 -7.0433 -0.3525 -0.3525 -0.2591 -0.2591 0.2149 0.2149 0.7408 0.7408 0.8473 0.8473 0.9257 0.9257 1.9527 1.9527 2.3971 2.3971 2.5873 2.5873 3.2748 3.2748 6.0143 6.0143 6.1614 6.1614 8.4476 8.4476 9.1602 9.1602 9.1772 9.1772 9.3783 9.3783 k = 0.3037 0.5260-0.0000 ( 12482 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8459 -9.8459 -9.8262 -9.8262 -7.0936 -7.0936 -7.0365 -7.0365 -0.3703 -0.3703 -0.2474 -0.2474 0.2259 0.2259 0.7338 0.7338 0.8516 0.8516 0.9435 0.9435 1.9549 1.9549 2.3941 2.3941 2.5994 2.5994 3.2843 3.2843 5.9876 5.9876 6.1821 6.1821 8.4138 8.4138 9.1133 9.1133 9.1678 9.1678 9.3177 9.3177 k = 0.2963 0.5132-0.0000 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8497 -9.8497 -9.8246 -9.8246 -7.1022 -7.1022 -7.0298 -7.0298 -0.3893 -0.3893 -0.2350 -0.2350 0.2389 0.2389 0.7277 0.7277 0.8575 0.8575 0.9631 0.9631 1.9586 1.9586 2.3904 2.3904 2.6150 2.6150 3.2958 3.2958 5.9592 5.9592 6.2030 6.2030 8.3760 8.3760 9.0609 9.0609 9.1682 9.1682 9.2439 9.2439 k = 0.2889 0.5004-0.0000 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7515 -19.7515 -19.7486 -19.7486 -19.7422 -19.7422 -19.7401 -19.7401 -19.6546 -19.6546 -19.6544 -19.6544 -19.6487 -19.6487 -19.6483 -19.6483 -9.8537 -9.8537 -9.8232 -9.8232 -7.1112 -7.1112 -7.0231 -7.0231 -0.4090 -0.4090 -0.2220 -0.2220 0.2535 0.2535 0.7229 0.7229 0.8650 0.8650 0.9840 0.9840 1.9641 1.9641 2.3862 2.3862 2.6335 2.6335 3.3092 3.3092 5.9293 5.9293 6.2239 6.2239 8.3358 8.3358 9.0091 9.0091 9.1560 9.1560 9.1794 9.1794 k = 0.2815 0.4875-0.0000 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7515 -19.7515 -19.7486 -19.7486 -19.7422 -19.7422 -19.7401 -19.7401 -19.6546 -19.6546 -19.6544 -19.6544 -19.6486 -19.6486 -19.6482 -19.6482 -9.8581 -9.8581 -9.8221 -9.8221 -7.1205 -7.1205 -7.0166 -7.0166 -0.4289 -0.4289 -0.2083 -0.2083 0.2694 0.2694 0.7198 0.7198 0.8741 0.8741 1.0059 1.0059 1.9717 1.9717 2.3823 2.3823 2.6544 2.6544 3.3241 3.3241 5.8982 5.8982 6.2446 6.2446 8.2941 8.2941 8.9576 8.9576 9.0737 9.0737 9.1855 9.1855 k = 0.2741 0.4747-0.0000 ( 12494 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7514 -19.7514 -19.7486 -19.7486 -19.7422 -19.7422 -19.7401 -19.7401 -19.6546 -19.6546 -19.6544 -19.6544 -19.6486 -19.6486 -19.6482 -19.6482 -9.8628 -9.8628 -9.8211 -9.8211 -7.1302 -7.1302 -7.0101 -7.0101 -0.4487 -0.4487 -0.1939 -0.1939 0.2864 0.2864 0.7184 0.7184 0.8848 0.8848 1.0285 1.0285 1.9815 1.9815 2.3789 2.3789 2.6773 2.6773 3.3403 3.3403 5.8660 5.8660 6.2651 6.2651 8.2517 8.2517 8.9027 8.9027 8.9908 8.9908 9.1962 9.1962 k = 0.2667 0.4619-0.0000 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7513 -19.7513 -19.7486 -19.7486 -19.7421 -19.7421 -19.7402 -19.7402 -19.6546 -19.6546 -19.6544 -19.6544 -19.6486 -19.6486 -19.6482 -19.6482 -9.8678 -9.8678 -9.8204 -9.8204 -7.1403 -7.1403 -7.0037 -7.0037 -0.4683 -0.4683 -0.1787 -0.1787 0.3043 0.3043 0.7188 0.7188 0.8971 0.8971 1.0516 1.0516 1.9938 1.9938 2.3766 2.3766 2.7017 2.7017 3.3575 3.3575 5.8327 5.8327 6.2853 6.2853 8.2091 8.2091 8.8348 8.8348 8.9214 8.9214 9.1725 9.1725 k = 0.2593 0.4491-0.0000 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9250 -19.9250 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7512 -19.7512 -19.7486 -19.7486 -19.7421 -19.7421 -19.7402 -19.7402 -19.6546 -19.6546 -19.6544 -19.6544 -19.6485 -19.6485 -19.6481 -19.6481 -9.8732 -9.8732 -9.8199 -9.8199 -7.1507 -7.1507 -6.9975 -6.9975 -0.4874 -0.4874 -0.1626 -0.1626 0.3232 0.3232 0.7210 0.7210 0.9107 0.9107 1.0750 1.0750 2.0086 2.0086 2.3757 2.3757 2.7273 2.7273 3.3757 3.3757 5.7985 5.7985 6.3052 6.3052 8.1664 8.1664 8.7499 8.7499 8.8708 8.8708 9.1040 9.1040 k = 0.2519 0.4362-0.0000 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9249 -19.9249 -19.9231 -19.9231 -19.8312 -19.8312 -19.8304 -19.8304 -19.7510 -19.7510 -19.7486 -19.7486 -19.7420 -19.7420 -19.7402 -19.7402 -19.6546 -19.6546 -19.6544 -19.6544 -19.6485 -19.6485 -19.6481 -19.6481 -9.8788 -9.8788 -9.8197 -9.8197 -7.1614 -7.1614 -6.9914 -6.9914 -0.5061 -0.5061 -0.1455 -0.1455 0.3429 0.3429 0.7248 0.7248 0.9257 0.9257 1.0987 1.0987 2.0262 2.0262 2.3764 2.3764 2.7539 2.7539 3.3945 3.3945 5.7636 5.7636 6.3248 6.3248 8.1236 8.1236 8.6560 8.6560 8.8319 8.8319 9.0305 9.0305 k = 0.2444 0.4234-0.0000 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9248 -19.9248 -19.9231 -19.9231 -19.8311 -19.8311 -19.8303 -19.8303 -19.7509 -19.7509 -19.7486 -19.7486 -19.7420 -19.7420 -19.7402 -19.7402 -19.6546 -19.6546 -19.6543 -19.6543 -19.6484 -19.6484 -19.6480 -19.6480 -9.8848 -9.8848 -9.8197 -9.8197 -7.1724 -7.1724 -6.9855 -6.9855 -0.5243 -0.5243 -0.1274 -0.1274 0.3636 0.3636 0.7302 0.7302 0.9418 0.9418 1.1226 1.1226 2.0465 2.0465 2.3789 2.3789 2.7811 2.7811 3.4137 3.4137 5.7279 5.7279 6.3439 6.3439 8.0803 8.0803 8.5584 8.5584 8.7997 8.7997 8.9568 8.9568 k = 0.2370 0.4106-0.0000 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9247 -19.9247 -19.9231 -19.9231 -19.8311 -19.8311 -19.8303 -19.8303 -19.7507 -19.7507 -19.7485 -19.7485 -19.7419 -19.7419 -19.7403 -19.7403 -19.6546 -19.6546 -19.6543 -19.6543 -19.6484 -19.6484 -19.6480 -19.6480 -9.8910 -9.8910 -9.8200 -9.8200 -7.1837 -7.1837 -6.9798 -6.9798 -0.5419 -0.5419 -0.1080 -0.1080 0.3853 0.3853 0.7371 0.7371 0.9591 0.9591 1.1465 1.1465 2.0696 2.0696 2.3834 2.3834 2.8087 2.8087 3.4334 3.4334 5.6915 5.6915 6.3624 6.3624 8.0361 8.0361 8.4590 8.4590 8.7726 8.7726 8.8849 8.8849 k = 0.2296 0.3977-0.0000 ( 12487 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9246 -19.9246 -19.9231 -19.9231 -19.8310 -19.8310 -19.8302 -19.8302 -19.7506 -19.7506 -19.7485 -19.7485 -19.7418 -19.7418 -19.7403 -19.7403 -19.6546 -19.6546 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8975 -9.8975 -9.8205 -9.8205 -7.1952 -7.1952 -6.9743 -6.9743 -0.5590 -0.5590 -0.0874 -0.0874 0.4082 0.4082 0.7453 0.7453 0.9772 0.9772 1.1704 1.1704 2.0955 2.0955 2.3901 2.3901 2.8366 2.8366 3.4532 3.4532 5.6546 5.6546 6.3805 6.3805 7.9903 7.9903 8.3587 8.3587 8.7494 8.7494 8.8168 8.8168 k = 0.2222 0.3849-0.0000 ( 12483 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9245 -19.9245 -19.9230 -19.9230 -19.8310 -19.8310 -19.8302 -19.8302 -19.7504 -19.7504 -19.7485 -19.7485 -19.7418 -19.7418 -19.7403 -19.7403 -19.6546 -19.6546 -19.6543 -19.6543 -19.6482 -19.6482 -19.6479 -19.6479 -9.9043 -9.9043 -9.8212 -9.8212 -7.2068 -7.2068 -6.9690 -6.9690 -0.5756 -0.5756 -0.0655 -0.0655 0.4324 0.4324 0.7547 0.7547 0.9962 0.9962 1.1941 1.1941 2.1242 2.1242 2.3990 2.3990 2.8646 2.8646 3.4730 3.4730 5.6172 5.6172 6.3978 6.3978 7.9418 7.9418 8.2578 8.2578 8.7268 8.7268 8.7574 8.7574 k = 0.2148 0.3721-0.0000 ( 12501 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9244 -19.9244 -19.9230 -19.9230 -19.8309 -19.8309 -19.8301 -19.8301 -19.7503 -19.7503 -19.7484 -19.7484 -19.7417 -19.7417 -19.7404 -19.7404 -19.6546 -19.6546 -19.6543 -19.6543 -19.6482 -19.6482 -19.6478 -19.6478 -9.9112 -9.9112 -9.8222 -9.8222 -7.2187 -7.2187 -6.9639 -6.9639 -0.5918 -0.5918 -0.0422 -0.0422 0.4580 0.4580 0.7651 0.7651 1.0157 1.0157 1.2177 1.2177 2.1558 2.1558 2.4102 2.4102 2.8925 2.8925 3.4928 3.4928 5.5793 5.5793 6.4144 6.4144 7.8898 7.8898 8.1566 8.1566 8.6857 8.6857 8.7270 8.7270 k = 0.2074 0.3592-0.0000 ( 12497 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9243 -19.9243 -19.9230 -19.9230 -19.8308 -19.8308 -19.8301 -19.8301 -19.7501 -19.7501 -19.7484 -19.7484 -19.7417 -19.7417 -19.7404 -19.7404 -19.6546 -19.6546 -19.6542 -19.6542 -19.6481 -19.6481 -19.6478 -19.6478 -9.9184 -9.9184 -9.8234 -9.8234 -7.2306 -7.2306 -6.9591 -6.9591 -0.6075 -0.6075 -0.0176 -0.0176 0.4851 0.4851 0.7766 0.7766 1.0356 1.0356 1.2411 1.2411 2.1901 2.1901 2.4237 2.4237 2.9202 2.9202 3.5123 3.5123 5.5410 5.5410 6.4301 6.4301 7.8332 7.8332 8.0551 8.0551 8.6372 8.6372 8.7159 8.7159 k = 0.2000 0.3464-0.0000 ( 12503 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9230 -19.9230 -19.8308 -19.8308 -19.8300 -19.8300 -19.7499 -19.7499 -19.7483 -19.7483 -19.7416 -19.7416 -19.7405 -19.7405 -19.6546 -19.6546 -19.6542 -19.6542 -19.6480 -19.6480 -19.6477 -19.6477 -9.9257 -9.9257 -9.8248 -9.8248 -7.2426 -7.2426 -6.9544 -6.9544 -0.6229 -0.6229 0.0084 0.0084 0.5139 0.5139 0.7889 0.7889 1.0558 1.0558 1.2641 1.2641 2.2271 2.2271 2.4396 2.4396 2.9477 2.9477 3.5316 3.5316 5.5024 5.5024 6.4449 6.4449 7.7712 7.7712 7.9535 7.9535 8.5955 8.5955 8.7112 8.7112 k = 0.1926 0.3336-0.0000 ( 12519 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9230 -19.9230 -19.8307 -19.8307 -19.8300 -19.8300 -19.7497 -19.7497 -19.7483 -19.7483 -19.7416 -19.7416 -19.7405 -19.7405 -19.6546 -19.6546 -19.6542 -19.6542 -19.6480 -19.6480 -19.6476 -19.6476 -9.9332 -9.9332 -9.8264 -9.8264 -7.2547 -7.2547 -6.9501 -6.9501 -0.6379 -0.6379 0.0357 0.0357 0.5443 0.5443 0.8020 0.8020 1.0762 1.0762 1.2868 1.2868 2.2667 2.2667 2.4578 2.4578 2.9749 2.9749 3.5505 3.5505 5.4635 5.4635 6.4587 6.4587 7.7034 7.7034 7.8518 7.8518 8.5625 8.5625 8.7114 8.7114 k = 0.1852 0.3208-0.0000 ( 12515 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9229 -19.9229 -19.8306 -19.8306 -19.8299 -19.8299 -19.7495 -19.7495 -19.7482 -19.7482 -19.7416 -19.7416 -19.7406 -19.7406 -19.6546 -19.6546 -19.6542 -19.6542 -19.6479 -19.6479 -19.6476 -19.6476 -9.9408 -9.9408 -9.8282 -9.8282 -7.2667 -7.2667 -6.9459 -6.9459 -0.6526 -0.6526 0.0643 0.0643 0.5766 0.5766 0.8158 0.8158 1.0965 1.0965 1.3091 1.3091 2.3087 2.3087 2.4783 2.4783 3.0016 3.0016 3.5689 3.5689 5.4242 5.4242 6.4712 6.4712 7.6298 7.6298 7.7500 7.7500 8.5387 8.5387 8.7163 8.7163 k = 0.1778 0.3079-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9238 -19.9238 -19.9229 -19.9229 -19.8306 -19.8306 -19.8299 -19.8299 -19.7493 -19.7493 -19.7481 -19.7481 -19.7415 -19.7415 -19.7406 -19.7406 -19.6546 -19.6546 -19.6542 -19.6542 -19.6478 -19.6478 -19.6475 -19.6475 -9.9485 -9.9485 -9.8302 -9.8302 -7.2787 -7.2787 -6.9420 -6.9420 -0.6670 -0.6670 0.0940 0.0940 0.6106 0.6106 0.8304 0.8304 1.1168 1.1168 1.3309 1.3309 2.3531 2.3531 2.5012 2.5012 3.0278 3.0278 3.5868 3.5868 5.3847 5.3847 6.4825 6.4825 7.5508 7.5508 7.6482 7.6482 8.5242 8.5242 8.7258 8.7258 k = 0.1704 0.2951-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9237 -19.9237 -19.9229 -19.9229 -19.8305 -19.8305 -19.8298 -19.8298 -19.7491 -19.7491 -19.7481 -19.7481 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6541 -19.6541 -19.6477 -19.6477 -19.6474 -19.6474 -9.9562 -9.9562 -9.8323 -9.8323 -7.2907 -7.2907 -6.9383 -6.9383 -0.6811 -0.6811 0.1247 0.1247 0.6464 0.6464 0.8456 0.8456 1.1368 1.1368 1.3521 1.3521 2.3995 2.3995 2.5263 2.5263 3.0535 3.0535 3.6040 3.6040 5.3449 5.3449 6.4923 6.4923 7.4668 7.4668 7.5465 7.5465 8.5184 8.5184 8.7399 8.7399 k = 0.1630 0.2823-0.0000 ( 12537 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9236 -19.9236 -19.9229 -19.9229 -19.8304 -19.8304 -19.8297 -19.8297 -19.7489 -19.7489 -19.7480 -19.7480 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6541 -19.6541 -19.6476 -19.6476 -19.6474 -19.6474 -9.9639 -9.9639 -9.8345 -9.8345 -7.3025 -7.3025 -6.9349 -6.9349 -0.6949 -0.6949 0.1563 0.1563 0.6838 0.6838 0.8615 0.8615 1.1565 1.1565 1.3728 1.3728 2.4476 2.4476 2.5539 2.5539 3.0787 3.0787 3.6206 3.6206 5.3048 5.3048 6.5006 6.5006 7.3788 7.3788 7.4450 7.4450 8.5208 8.5208 8.7585 8.7585 k = 0.1556 0.2694-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9228 -19.9228 -19.8303 -19.8303 -19.8297 -19.8297 -19.7487 -19.7487 -19.7479 -19.7479 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6540 -19.6540 -19.6475 -19.6475 -19.6473 -19.6473 -9.9716 -9.9716 -9.8369 -9.8369 -7.3141 -7.3141 -6.9317 -6.9317 -0.7085 -0.7085 0.1886 0.1886 0.7227 0.7227 0.8781 0.8781 1.1759 1.1759 1.3929 1.3929 2.4970 2.4970 2.5839 2.5839 3.1034 3.1034 3.6365 3.6365 5.2645 5.2645 6.5072 6.5072 7.2873 7.2873 7.3438 7.3438 8.5307 8.5307 8.7815 8.7815 k = 0.1481 0.2566-0.0000 ( 12539 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9233 -19.9233 -19.9228 -19.9228 -19.8303 -19.8303 -19.8296 -19.8296 -19.7485 -19.7485 -19.7478 -19.7478 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6540 -19.6540 -19.6474 -19.6474 -19.6472 -19.6472 -9.9792 -9.9792 -9.8393 -9.8393 -7.3255 -7.3255 -6.9287 -6.9287 -0.7217 -0.7217 0.2214 0.2214 0.7628 0.7628 0.8956 0.8956 1.1948 1.1948 1.4123 1.4123 2.5468 2.5468 2.6169 2.6169 3.1277 3.1277 3.6515 3.6515 5.2238 5.2238 6.5120 6.5120 7.1934 7.1934 7.2430 7.2430 8.5476 8.5476 8.8089 8.8089 k = 0.1407 0.2438-0.0000 ( 12545 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9232 -19.9232 -19.9227 -19.9227 -19.8302 -19.8302 -19.8295 -19.8295 -19.7484 -19.7484 -19.7477 -19.7477 -19.7414 -19.7414 -19.7408 -19.7408 -19.6547 -19.6547 -19.6539 -19.6539 -19.6473 -19.6473 -19.6472 -19.6472 -9.9867 -9.9867 -9.8418 -9.8418 -7.3367 -7.3367 -6.9260 -6.9260 -0.7347 -0.7347 0.2543 0.2543 0.8038 0.8038 0.9141 0.9141 1.2133 1.2133 1.4311 1.4311 2.5955 2.5955 2.6540 2.6540 3.1515 3.1515 3.6658 3.6658 5.1829 5.1829 6.5149 6.5149 7.0976 7.0976 7.1430 7.1430 8.5707 8.5707 8.8405 8.8405 k = 0.1333 0.2309-0.0000 ( 12537 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9231 -19.9231 -19.9227 -19.9227 -19.8301 -19.8301 -19.8294 -19.8294 -19.7481 -19.7481 -19.7476 -19.7476 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6538 -19.6538 -19.6472 -19.6472 -19.6471 -19.6471 -9.9941 -9.9941 -9.8444 -9.8444 -7.3475 -7.3475 -6.9235 -6.9235 -0.7473 -0.7473 0.2872 0.2872 0.8450 0.8450 0.9342 0.9342 1.2314 1.2314 1.4492 1.4492 2.6412 2.6412 2.6965 2.6965 3.1751 3.1751 3.6793 3.6793 5.1416 5.1416 6.5157 6.5157 7.0009 7.0009 7.0438 7.0438 8.5994 8.5994 8.8763 8.8763 k = 0.1259 0.2181-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9230 -19.9230 -19.9226 -19.9226 -19.8300 -19.8300 -19.8294 -19.8294 -19.7479 -19.7479 -19.7475 -19.7475 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6538 -19.6538 -19.6471 -19.6471 -19.6470 -19.6470 -10.0014 -10.0014 -9.8470 -9.8470 -7.3581 -7.3581 -6.9211 -6.9211 -0.7595 -0.7595 0.3197 0.3197 0.8853 0.8853 0.9566 0.9566 1.2490 1.2490 1.4667 1.4667 2.6828 2.6828 2.7448 2.7448 3.1985 3.1985 3.6920 3.6920 5.0999 5.0999 6.5143 6.5143 6.9040 6.9040 6.9459 6.9459 8.6333 8.6333 8.9161 8.9161 k = 0.1185 0.2053-0.0000 ( 12539 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9229 -19.9229 -19.9225 -19.9225 -19.8299 -19.8299 -19.8293 -19.8293 -19.7478 -19.7478 -19.7474 -19.7474 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6538 -19.6538 -19.6471 -19.6471 -19.6469 -19.6469 -10.0084 -10.0084 -9.8496 -9.8496 -7.3682 -7.3682 -6.9190 -6.9190 -0.7713 -0.7713 0.3516 0.3516 0.9227 0.9227 0.9828 0.9828 1.2663 1.2663 1.4835 1.4835 2.7215 2.7215 2.7973 2.7973 3.2220 3.2220 3.7039 3.7039 5.0579 5.0579 6.5103 6.5103 6.8078 6.8078 6.8496 6.8496 8.6717 8.6717 8.9597 8.9597 k = 0.1111 0.1925-0.0000 ( 12539 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9228 -19.9228 -19.9225 -19.9225 -19.8298 -19.8298 -19.8293 -19.8293 -19.7476 -19.7476 -19.7473 -19.7473 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6537 -19.6537 -19.6470 -19.6470 -19.6468 -19.6468 -10.0152 -10.0152 -9.8521 -9.8521 -7.3780 -7.3780 -6.9171 -6.9171 -0.7826 -0.7826 0.3825 0.3825 0.9551 0.9551 1.0147 1.0147 1.2831 1.2831 1.4997 1.4997 2.7584 2.7584 2.8518 2.8518 3.2459 3.2459 3.7149 3.7149 5.0155 5.0155 6.5030 6.5030 6.7139 6.7139 6.7552 6.7552 8.7141 8.7141 9.0068 9.0068 k = 0.1037 0.1796-0.0000 ( 12535 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9227 -19.9227 -19.9224 -19.9224 -19.8297 -19.8297 -19.8292 -19.8292 -19.7474 -19.7474 -19.7471 -19.7471 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6537 -19.6537 -19.6469 -19.6469 -19.6468 -19.6468 -10.0217 -10.0217 -9.8547 -9.8547 -7.3872 -7.3872 -6.9153 -6.9153 -0.7935 -0.7935 0.4121 0.4121 0.9824 0.9824 1.0518 1.0518 1.2997 1.2997 1.5153 1.5153 2.7943 2.7943 2.9068 2.9068 3.2704 3.2704 3.7253 3.7253 4.9726 4.9726 6.4898 6.4898 6.6256 6.6256 6.6632 6.6632 8.7600 8.7600 9.0571 9.0571 k = 0.0963 0.1668-0.0000 ( 12537 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9226 -19.9226 -19.9223 -19.9223 -19.8297 -19.8297 -19.8292 -19.8292 -19.7473 -19.7473 -19.7470 -19.7470 -19.7414 -19.7414 -19.7409 -19.7409 -19.6546 -19.6546 -19.6537 -19.6537 -19.6468 -19.6468 -19.6467 -19.6467 -10.0280 -10.0280 -9.8571 -9.8571 -7.3961 -7.3961 -6.9138 -6.9138 -0.8038 -0.8038 0.4402 0.4402 1.0066 1.0066 1.0916 1.0916 1.3161 1.3161 1.5304 1.5304 2.8291 2.8291 2.9609 2.9609 3.2961 3.2961 3.7349 3.7349 4.9294 4.9294 6.4606 6.4606 6.5537 6.5537 6.5741 6.5741 8.8086 8.8086 9.0885 9.0885 k = 0.0889 0.1540-0.0000 ( 12541 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9226 -19.9226 -19.9223 -19.9223 -19.8296 -19.8296 -19.8291 -19.8291 -19.7471 -19.7471 -19.7469 -19.7469 -19.7414 -19.7414 -19.7408 -19.7408 -19.6546 -19.6546 -19.6536 -19.6536 -19.6467 -19.6467 -19.6466 -19.6466 -10.0339 -10.0339 -9.8595 -9.8595 -7.4044 -7.4044 -6.9123 -6.9123 -0.8136 -0.8136 0.4665 0.4665 1.0290 1.0290 1.1319 1.1319 1.3323 1.3323 1.5451 1.5451 2.8628 2.8628 3.0133 3.0133 3.3234 3.3234 3.7441 3.7441 4.8857 4.8857 6.4000 6.4000 6.4883 6.4883 6.5147 6.5147 8.8593 8.8593 9.0376 9.0376 k = 0.0815 0.1411-0.0000 ( 12535 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9222 -19.9222 -19.8295 -19.8295 -19.8290 -19.8290 -19.7470 -19.7470 -19.7468 -19.7468 -19.7414 -19.7414 -19.7408 -19.7408 -19.6547 -19.6547 -19.6536 -19.6536 -19.6466 -19.6466 -19.6466 -19.6466 -10.0394 -10.0394 -9.8618 -9.8618 -7.4121 -7.4121 -6.9111 -6.9111 -0.8227 -0.8227 0.4909 0.4909 1.0503 1.0503 1.1712 1.1712 1.3483 1.3483 1.5596 1.5596 2.8951 2.8951 3.0628 3.0628 3.3528 3.3528 3.7528 3.7528 4.8417 4.8417 6.3224 6.3224 6.4064 6.4064 6.4948 6.4948 8.9111 8.9111 8.9883 8.9883 k = 0.0741 0.1283-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9221 -19.9221 -19.8295 -19.8295 -19.8290 -19.8290 -19.7469 -19.7469 -19.7467 -19.7467 -19.7414 -19.7414 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6466 -19.6466 -19.6465 -19.6465 -10.0446 -10.0446 -9.8639 -9.8639 -7.4193 -7.4193 -6.9100 -6.9100 -0.8312 -0.8312 0.5132 0.5132 1.0706 1.0706 1.2086 1.2086 1.3642 1.3642 1.5738 1.5738 2.9256 2.9256 3.1085 3.1085 3.3845 3.3845 3.7615 3.7615 4.7975 4.7975 6.2432 6.2432 6.3289 6.3289 6.4798 6.4798 8.9363 8.9363 8.9681 8.9681 k = 0.0667 0.1155-0.0000 ( 12533 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9220 -19.9220 -19.8294 -19.8294 -19.8289 -19.8289 -19.7468 -19.7468 -19.7466 -19.7466 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6465 -19.6465 -19.6464 -19.6464 -10.0493 -10.0493 -9.8659 -9.8659 -7.4259 -7.4259 -6.9090 -6.9090 -0.8390 -0.8390 0.5333 0.5333 1.0898 1.0898 1.2434 1.2434 1.3796 1.3796 1.5880 1.5880 2.9539 2.9539 3.1497 3.1497 3.4184 3.4184 3.7703 3.7703 4.7533 4.7533 6.1669 6.1669 6.2565 6.2565 6.4661 6.4661 8.8929 8.8929 9.0189 9.0189 k = 0.0593 0.1026-0.0000 ( 12549 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9220 -19.9220 -19.8294 -19.8294 -19.8289 -19.8289 -19.7467 -19.7467 -19.7465 -19.7465 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6535 -19.6535 -19.6465 -19.6465 -19.6464 -19.6464 -10.0537 -10.0537 -9.8677 -9.8677 -7.4318 -7.4318 -6.9081 -6.9081 -0.8461 -0.8461 0.5511 0.5511 1.1077 1.1077 1.2751 1.2751 1.3944 1.3944 1.6023 1.6023 2.9797 2.9797 3.1862 3.1862 3.4537 3.4537 3.7798 3.7798 4.7093 4.7093 6.0955 6.0955 6.1897 6.1897 6.4531 6.4531 8.8507 8.8507 9.0704 9.0704 k = 0.0519 0.0898-0.0000 ( 12549 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9219 -19.9219 -19.8293 -19.8293 -19.8288 -19.8288 -19.7466 -19.7466 -19.7464 -19.7464 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6463 -19.6463 -10.0575 -10.0575 -9.8694 -9.8694 -7.4371 -7.4371 -6.9074 -6.9074 -0.8524 -0.8524 0.5667 0.5667 1.1241 1.1241 1.3036 1.3036 1.4081 1.4081 1.6165 1.6165 3.0028 3.0028 3.2179 3.2179 3.4890 3.4890 3.7906 3.7906 4.6659 4.6659 6.0300 6.0300 6.1291 6.1291 6.4405 6.4405 8.8118 8.8118 9.1200 9.1200 k = 0.0444 0.0770-0.0000 ( 12551 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9219 -19.9219 -19.8293 -19.8293 -19.8288 -19.8288 -19.7465 -19.7465 -19.7464 -19.7464 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6463 -19.6463 -10.0609 -10.0609 -9.8709 -9.8709 -7.4418 -7.4418 -6.9068 -6.9068 -0.8579 -0.8579 0.5800 0.5800 1.1386 1.1386 1.3288 1.3288 1.4201 1.4201 1.6304 1.6304 3.0229 3.0229 3.2451 3.2451 3.5225 3.5225 3.8032 3.8032 4.6238 4.6238 5.9713 5.9713 6.0752 6.0752 6.4288 6.4288 8.7770 8.7770 9.1665 9.1665 k = 0.0370 0.0642-0.0000 ( 12551 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9218 -19.9218 -19.8292 -19.8292 -19.8288 -19.8288 -19.7465 -19.7465 -19.7463 -19.7463 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6464 -19.6464 -19.6462 -19.6462 -10.0638 -10.0638 -9.8721 -9.8721 -7.4457 -7.4457 -6.9063 -6.9063 -0.8627 -0.8627 0.5912 0.5912 1.1510 1.1510 1.3507 1.3507 1.4299 1.4299 1.6438 1.6438 3.0399 3.0399 3.2681 3.2681 3.5523 3.5523 3.8180 3.8180 4.5837 4.5837 5.9202 5.9202 6.0286 6.0286 6.4181 6.4181 8.7468 8.7468 9.2086 9.2086 k = 0.0296 0.0513-0.0000 ( 12555 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9218 -19.9218 -19.8292 -19.8292 -19.8288 -19.8288 -19.7465 -19.7465 -19.7462 -19.7462 -19.7415 -19.7415 -19.7408 -19.7408 -19.6547 -19.6547 -19.6534 -19.6534 -19.6463 -19.6463 -19.6462 -19.6462 -10.0662 -10.0662 -9.8732 -9.8732 -7.4490 -7.4490 -6.9059 -6.9059 -0.8666 -0.8666 0.6002 0.6002 1.1614 1.1614 1.3694 1.3694 1.4372 1.4372 1.6559 1.6559 3.0537 3.0537 3.2871 3.2871 3.5768 3.5768 3.8347 3.8347 4.5470 4.5470 5.8774 5.8774 5.9898 5.9898 6.4088 6.4088 8.7214 8.7214 9.2451 9.2451 k = 0.0222 0.0385-0.0000 ( 12527 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7464 -19.7464 -19.7461 -19.7461 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6463 -19.6463 -19.6461 -19.6461 -10.0680 -10.0680 -9.8740 -9.8740 -7.4515 -7.4515 -6.9056 -6.9056 -0.8696 -0.8696 0.6072 0.6072 1.1694 1.1694 1.3850 1.3850 1.4420 1.4420 1.6663 1.6663 3.0644 3.0644 3.3020 3.3020 3.5953 3.5953 3.8520 3.8520 4.5150 4.5150 5.8435 5.8435 5.9591 5.9591 6.4012 6.4012 8.7014 8.7014 9.2749 9.2749 k = 0.0148 0.0257-0.0000 ( 12519 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7464 -19.7464 -19.7461 -19.7461 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0694 -10.0694 -9.8746 -9.8746 -7.4533 -7.4533 -6.9053 -6.9053 -0.8718 -0.8718 0.6121 0.6121 1.1752 1.1752 1.3970 1.3970 1.4445 1.4445 1.6742 1.6742 3.0720 3.0720 3.3129 3.3129 3.6079 3.6079 3.8674 3.8674 4.4899 4.4899 5.8189 5.8189 5.9369 5.9369 6.3956 6.3956 8.6868 8.6868 9.2968 9.2968 k = 0.0074 0.0128-0.0000 ( 12507 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0702 -10.0702 -9.8750 -9.8750 -7.4544 -7.4544 -6.9052 -6.9052 -0.8731 -0.8731 0.6150 0.6150 1.1786 1.1786 1.4049 1.4049 1.4454 1.4454 1.6792 1.6792 3.0765 3.0765 3.3195 3.3195 3.6151 3.6151 3.8783 3.8783 4.4737 4.4737 5.8040 5.8040 5.9235 5.9235 6.3922 6.3922 8.6780 8.6780 9.3092 9.3092 k = 0.0000 0.0000 0.0000 ( 12483 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9222 -19.9222 -19.9216 -19.9216 -19.8291 -19.8291 -19.8286 -19.8286 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6532 -19.6532 -19.6462 -19.6462 -19.6461 -19.6461 -10.0705 -10.0705 -9.8751 -9.8751 -7.4548 -7.4548 -6.9052 -6.9052 -0.8736 -0.8736 0.6160 0.6160 1.1798 1.1798 1.4077 1.4077 1.4455 1.4455 1.6809 1.6809 3.0780 3.0780 3.3217 3.3217 3.6174 3.6174 3.8822 3.8822 4.4681 4.4681 5.7990 5.7990 5.9190 5.9190 6.3910 6.3910 8.6751 8.6751 9.3116 9.3116 k = 0.0000 0.0000 0.0000 ( 12483 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7826 -47.7826 -19.9222 -19.9222 -19.9216 -19.9216 -19.8291 -19.8291 -19.8286 -19.8286 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6546 -19.6546 -19.6532 -19.6532 -19.6462 -19.6462 -19.6461 -19.6461 -10.0705 -10.0705 -9.8751 -9.8751 -7.4548 -7.4548 -6.9052 -6.9052 -0.8736 -0.8736 0.6160 0.6160 1.1798 1.1798 1.4077 1.4077 1.4455 1.4455 1.6809 1.6809 3.0780 3.0780 3.3217 3.3217 3.6174 3.6174 3.8822 3.8822 4.4681 4.4681 5.7990 5.7990 5.9190 5.9190 6.3910 6.3910 8.6751 8.6751 9.3116 9.3116 k = 0.0000 0.0000 0.0148 ( 12519 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0700 -10.0700 -9.8757 -9.8757 -7.4533 -7.4533 -6.9067 -6.9067 -0.8702 -0.8702 0.6106 0.6106 1.1804 1.1804 1.4083 1.4083 1.4446 1.4446 1.6800 1.6800 3.0796 3.0796 3.3234 3.3234 3.6159 3.6159 3.8807 3.8807 4.4724 4.4724 5.7907 5.7907 5.9237 5.9237 6.3995 6.3995 8.6708 8.6708 9.3131 9.3131 k = 0.0000 0.0000 0.0297 ( 12519 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7460 -19.7460 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6533 -19.6533 -19.6462 -19.6462 -19.6461 -19.6461 -10.0686 -10.0686 -9.8775 -9.8775 -7.4489 -7.4489 -6.9114 -6.9114 -0.8600 -0.8600 0.5946 0.5946 1.1823 1.1823 1.4101 1.4101 1.4418 1.4418 1.6771 1.6771 3.0843 3.0843 3.3283 3.3283 3.6115 3.6115 3.8763 3.8763 4.4852 4.4852 5.7671 5.7671 5.9379 5.9379 6.4233 6.4233 8.6581 8.6581 9.3175 9.3175 k = 0.0000 0.0000 0.0445 ( 12526 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7461 -19.7461 -19.7415 -19.7415 -19.7407 -19.7407 -19.6547 -19.6547 -19.6534 -19.6534 -19.6462 -19.6462 -19.6461 -19.6461 -10.0663 -10.0663 -9.8806 -9.8806 -7.4416 -7.4416 -6.9192 -6.9192 -0.8431 -0.8431 0.5683 0.5683 1.1853 1.1853 1.4131 1.4131 1.4374 1.4374 1.6725 1.6725 3.0922 3.0922 3.3366 3.3366 3.6042 3.6042 3.8690 3.8690 4.5061 4.5061 5.7316 5.7316 5.9614 5.9614 6.4592 6.4592 8.6374 8.6374 9.3249 9.3250 k = 0.0000 0.0000 0.0593 ( 12526 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7461 -19.7461 -19.7415 -19.7415 -19.7408 -19.7408 -19.6546 -19.6546 -19.6534 -19.6534 -19.6462 -19.6462 -19.6461 -19.6461 -10.0630 -10.0630 -9.8847 -9.8847 -7.4314 -7.4314 -6.9299 -6.9299 -0.8196 -0.8196 0.5325 0.5325 1.1895 1.1895 1.4173 1.4173 1.4312 1.4312 1.6661 1.6661 3.1030 3.1030 3.3479 3.3479 3.5941 3.5941 3.8589 3.8589 4.5342 4.5342 5.6875 5.6875 5.9943 5.9943 6.5031 6.5031 8.6094 8.6094 9.3352 9.3353 k = 0.0000 0.0000 0.0742 ( 12520 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7461 -19.7461 -19.7415 -19.7415 -19.7408 -19.7408 -19.6546 -19.6546 -19.6534 -19.6534 -19.6462 -19.6462 -19.6461 -19.6461 -10.0589 -10.0589 -9.8900 -9.8900 -7.4186 -7.4186 -6.9434 -6.9434 -0.7897 -0.7897 0.4880 0.4880 1.1949 1.1949 1.4227 1.4227 1.4236 1.4236 1.6581 1.6581 3.1166 3.1166 3.3622 3.3622 3.5815 3.5815 3.8461 3.8461 4.5687 4.5687 5.6378 5.6378 6.0362 6.0362 6.5518 6.5518 8.5752 8.5752 9.3159 9.3160 k = 0.0000 0.0000 0.0890 ( 12520 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7461 -19.7461 -19.7414 -19.7414 -19.7407 -19.7407 -19.6546 -19.6546 -19.6534 -19.6534 -19.6462 -19.6462 -19.6461 -19.6461 -10.0539 -10.0539 -9.8962 -9.8962 -7.4032 -7.4032 -6.9595 -6.9595 -0.7537 -0.7537 0.4357 0.4357 1.2014 1.2014 1.4145 1.4145 1.4292 1.4292 1.6487 1.6487 3.1328 3.1328 3.3792 3.3792 3.5664 3.5664 3.8307 3.8307 4.6085 4.6085 5.5846 5.5846 6.0870 6.0870 6.6023 6.6023 8.5358 8.5358 9.1700 9.1700 k = 0.0000 0.0000 0.1038 ( 12514 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9217 -19.9217 -19.8291 -19.8291 -19.8287 -19.8287 -19.7463 -19.7463 -19.7461 -19.7461 -19.7414 -19.7414 -19.7408 -19.7408 -19.6545 -19.6545 -19.6534 -19.6534 -19.6462 -19.6462 -19.6461 -19.6461 -10.0481 -10.0481 -9.9034 -9.9034 -7.3854 -7.3854 -6.9781 -6.9781 -0.7118 -0.7118 0.3768 0.3768 1.2089 1.2089 1.4042 1.4042 1.4368 1.4368 1.6380 1.6380 3.1514 3.1514 3.3987 3.3987 3.5490 3.5490 3.8130 3.8130 4.6525 4.6525 5.5291 5.5291 6.1459 6.1459 6.6522 6.6522 8.4927 8.4927 9.0227 9.0227 k = 0.0000 0.0000 0.1186 ( 12538 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9218 -19.9218 -19.8291 -19.8291 -19.8288 -19.8288 -19.7463 -19.7463 -19.7461 -19.7461 -19.7414 -19.7414 -19.7408 -19.7408 -19.6545 -19.6545 -19.6535 -19.6535 -19.6462 -19.6462 -19.6462 -19.6462 -10.0415 -10.0415 -9.9113 -9.9113 -7.3654 -7.3654 -6.9990 -6.9990 -0.6643 -0.6643 0.3123 0.3123 1.2174 1.2174 1.3928 1.3928 1.4454 1.4454 1.6262 1.6262 3.1721 3.1721 3.4204 3.4204 3.5295 3.5295 3.7930 3.7930 4.6999 4.6999 5.4724 5.4724 6.2124 6.2124 6.6991 6.6991 8.4473 8.4473 8.8784 8.8784 k = 0.0000 0.0000 0.1335 ( 12550 PWs) bands (ev): -47.8704 -47.8704 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9218 -19.9218 -19.8291 -19.8291 -19.8288 -19.8288 -19.7463 -19.7463 -19.7461 -19.7461 -19.7414 -19.7414 -19.7409 -19.7409 -19.6545 -19.6545 -19.6536 -19.6536 -19.6462 -19.6462 -19.6462 -19.6462 -10.0342 -10.0342 -9.9200 -9.9200 -7.3435 -7.3435 -7.0217 -7.0217 -0.6115 -0.6115 0.2433 0.2433 1.2268 1.2268 1.3806 1.3806 1.4551 1.4551 1.6135 1.6135 3.1948 3.1948 3.4441 3.4441 3.5081 3.5081 3.7710 3.7710 4.7498 4.7498 5.4152 5.4152 6.2851 6.2851 6.7407 6.7407 8.4015 8.4015 8.7409 8.7409 k = 0.0000 0.0000 0.1483 ( 12538 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9219 -19.9219 -19.8290 -19.8290 -19.8288 -19.8288 -19.7463 -19.7463 -19.7462 -19.7462 -19.7413 -19.7413 -19.7410 -19.7410 -19.6544 -19.6544 -19.6536 -19.6536 -19.6462 -19.6462 -19.6462 -19.6462 -10.0263 -10.0263 -9.9292 -9.9292 -7.3197 -7.3197 -7.0462 -7.0462 -0.5540 -0.5540 0.1708 0.1708 1.2372 1.2372 1.3677 1.3677 1.4656 1.4656 1.6001 1.6001 3.2189 3.2189 3.4694 3.4694 3.4851 3.4851 3.7472 3.7472 4.8014 4.8014 5.3577 5.3577 6.3626 6.3626 6.7742 6.7742 8.3571 8.3571 8.6140 8.6140 k = 0.0000 0.0000 0.1631 ( 12550 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9219 -19.9219 -19.8290 -19.8290 -19.8288 -19.8288 -19.7463 -19.7463 -19.7462 -19.7462 -19.7413 -19.7413 -19.7410 -19.7410 -19.6543 -19.6543 -19.6537 -19.6537 -19.6463 -19.6463 -19.6462 -19.6462 -10.0178 -10.0178 -9.9388 -9.9388 -7.2945 -7.2945 -7.0721 -7.0721 -0.4920 -0.4920 0.0960 0.0960 1.2483 1.2483 1.3543 1.3543 1.4770 1.4770 1.5862 1.5862 3.2444 3.2444 3.4607 3.4607 3.4961 3.4961 3.7218 3.7218 4.8544 4.8544 5.3003 5.3003 6.4427 6.4427 6.7966 6.7966 8.3165 8.3165 8.5014 8.5014 k = 0.0000 0.0000 0.1780 ( 12544 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9219 -19.9219 -19.8290 -19.8290 -19.8288 -19.8288 -19.7463 -19.7463 -19.7462 -19.7462 -19.7412 -19.7412 -19.7410 -19.7410 -19.6542 -19.6542 -19.6538 -19.6538 -19.6463 -19.6463 -19.6462 -19.6462 -10.0087 -10.0087 -9.9488 -9.9488 -7.2680 -7.2680 -7.0992 -7.0992 -0.4262 -0.4262 0.0195 0.0195 1.2602 1.2602 1.3406 1.3406 1.4892 1.4892 1.5720 1.5720 3.2709 3.2709 3.4351 3.4351 3.5239 3.5239 3.6952 3.6952 4.9083 4.9083 5.2431 5.2431 6.5228 6.5228 6.8050 6.8050 8.2826 8.2826 8.4069 8.4069 k = 0.0000 0.0000 0.1928 ( 12532 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9219 -19.9219 -19.8290 -19.8290 -19.8289 -19.8289 -19.7462 -19.7462 -19.7462 -19.7462 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6538 -19.6538 -19.6462 -19.6462 -19.6462 -19.6462 -9.9992 -9.9992 -9.9589 -9.9589 -7.2406 -7.2406 -7.1270 -7.1270 -0.3569 -0.3569 -0.0575 -0.0575 1.2726 1.2726 1.3267 1.3267 1.5020 1.5020 1.5577 1.5577 3.2982 3.2982 3.4085 3.4085 3.5523 3.5523 3.6675 3.6675 4.9629 4.9629 5.1862 5.1862 6.5996 6.5996 6.7969 6.7969 8.2586 8.2586 8.3335 8.3335 k = 0.0000 0.0000 0.2076 ( 12550 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8289 -19.8289 -19.7463 -19.7463 -19.7462 -19.7462 -19.7412 -19.7412 -19.7411 -19.7411 -19.6541 -19.6541 -19.6539 -19.6539 -19.6462 -19.6462 -19.6462 -19.6462 -9.9894 -9.9894 -9.9692 -9.9692 -7.2125 -7.2125 -7.1554 -7.1554 -0.2848 -0.2848 -0.1344 -0.1344 1.2857 1.2857 1.3128 1.3128 1.5154 1.5154 1.5434 1.5434 3.3258 3.3258 3.3813 3.3813 3.5812 3.5812 3.6391 3.6391 5.0181 5.0181 5.1298 5.1298 6.6692 6.6692 6.7708 6.7708 8.2481 8.2481 8.2829 8.2829 k = 0.0000 0.0000 0.2225 ( 12556 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8289 -19.8289 -19.8289 -19.8289 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9794 -9.9794 -9.9794 -9.9794 -7.1840 -7.1840 -7.1840 -7.1840 -0.2104 -0.2104 -0.2104 -0.2104 1.2991 1.2991 1.2991 1.2991 1.5292 1.5292 1.5292 1.5292 3.3536 3.3536 3.3536 3.3536 3.6103 3.6103 3.6103 3.6103 5.0737 5.0737 5.0737 5.0737 6.7275 6.7275 6.7275 6.7275 8.2551 8.2551 8.2551 8.2551 k = 0.0000 0.0000 0.2225 ( 12556 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8289 -19.8289 -19.8289 -19.8289 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9794 -9.9794 -9.9794 -9.9794 -7.1840 -7.1840 -7.1840 -7.1840 -0.2104 -0.2104 -0.2104 -0.2104 1.2991 1.2991 1.2991 1.2991 1.5292 1.5292 1.5292 1.5292 3.3536 3.3536 3.3536 3.3536 3.6103 3.6103 3.6103 3.6103 5.0737 5.0737 5.0737 5.0737 6.7275 6.7275 6.7275 6.7275 8.2551 8.2551 8.2551 8.2551 k = 0.0128 0.0074 0.2225 ( 12564 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8289 -19.8289 -19.8289 -19.8289 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9792 -9.9792 -9.9792 -9.9792 -7.1838 -7.1838 -7.1838 -7.1838 -0.2103 -0.2103 -0.2103 -0.2103 1.2974 1.2974 1.2974 1.2974 1.5274 1.5274 1.5274 1.5274 3.3523 3.3523 3.3523 3.3523 3.6089 3.6089 3.6089 3.6089 5.0769 5.0769 5.0769 5.0769 6.7289 6.7289 6.7289 6.7289 8.2587 8.2587 8.2587 8.2587 k = 0.0256 0.0148 0.2225 ( 12562 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9785 -9.9785 -9.9785 -9.9785 -7.1833 -7.1833 -7.1833 -7.1833 -0.2101 -0.2101 -0.2101 -0.2101 1.2922 1.2922 1.2922 1.2922 1.5219 1.5219 1.5219 1.5219 3.3485 3.3485 3.3485 3.3485 3.6047 3.6047 3.6047 3.6047 5.0865 5.0865 5.0865 5.0865 6.7332 6.7332 6.7332 6.7332 8.2692 8.2692 8.2692 8.2692 k = 0.0385 0.0222 0.2225 ( 12544 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8289 -19.8289 -19.8289 -19.8289 -19.7463 -19.7463 -19.7463 -19.7463 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9775 -9.9775 -9.9775 -9.9775 -7.1825 -7.1825 -7.1825 -7.1825 -0.2097 -0.2097 -0.2097 -0.2097 1.2834 1.2834 1.2834 1.2834 1.5132 1.5132 1.5132 1.5132 3.3421 3.3421 3.3421 3.3421 3.5979 3.5979 3.5979 3.5979 5.1021 5.1021 5.1021 5.1021 6.7405 6.7405 6.7405 6.7405 8.2867 8.2867 8.2867 8.2867 k = 0.0513 0.0296 0.2225 ( 12548 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9761 -9.9761 -9.9761 -9.9761 -7.1813 -7.1813 -7.1813 -7.1813 -0.2091 -0.2091 -0.2091 -0.2091 1.2706 1.2706 1.2706 1.2706 1.5018 1.5018 1.5018 1.5018 3.3329 3.3329 3.3329 3.3329 3.5889 3.5889 3.5889 3.5889 5.1232 5.1232 5.1232 5.1232 6.7508 6.7508 6.7508 6.7508 8.3106 8.3106 8.3106 8.3106 k = 0.0641 0.0370 0.2225 ( 12546 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8290 -19.8290 -19.8290 -19.8290 -19.7464 -19.7464 -19.7464 -19.7464 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9743 -9.9743 -9.9743 -9.9743 -7.1799 -7.1799 -7.1799 -7.1799 -0.2083 -0.2083 -0.2083 -0.2083 1.2537 1.2537 1.2537 1.2537 1.4883 1.4883 1.4883 1.4883 3.3210 3.3210 3.3210 3.3210 3.5779 3.5779 3.5779 3.5779 5.1491 5.1491 5.1491 5.1491 6.7644 6.7644 6.7644 6.7644 8.3406 8.3406 8.3406 8.3406 k = 0.0769 0.0444 0.2225 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8290 -19.8290 -19.8290 -19.8290 -19.7464 -19.7464 -19.7464 -19.7464 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9721 -9.9721 -9.9721 -9.9721 -7.1781 -7.1781 -7.1781 -7.1781 -0.2075 -0.2075 -0.2075 -0.2075 1.2324 1.2324 1.2324 1.2324 1.4736 1.4736 1.4736 1.4736 3.3061 3.3061 3.3061 3.3061 3.5655 3.5655 3.5655 3.5655 5.1790 5.1790 5.1790 5.1790 6.7815 6.7815 6.7815 6.7815 8.3761 8.3761 8.3761 8.3761 k = 0.0897 0.0518 0.2225 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8291 -19.8291 -19.8291 -19.8291 -19.7465 -19.7465 -19.7465 -19.7465 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6464 -19.6464 -19.6464 -19.6464 -9.9696 -9.9696 -9.9696 -9.9696 -7.1760 -7.1760 -7.1760 -7.1760 -0.2065 -0.2065 -0.2065 -0.2065 1.2064 1.2064 1.2064 1.2064 1.4582 1.4582 1.4582 1.4582 3.2884 3.2884 3.2884 3.2884 3.5519 3.5519 3.5519 3.5519 5.2121 5.2121 5.2121 5.2121 6.8023 6.8023 6.8023 6.8023 8.4164 8.4164 8.4164 8.4164 k = 0.1026 0.0592 0.2225 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9222 -19.9222 -19.8291 -19.8291 -19.8291 -19.8291 -19.7466 -19.7466 -19.7466 -19.7466 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6464 -19.6464 -19.6464 -19.6464 -9.9667 -9.9667 -9.9667 -9.9667 -7.1737 -7.1737 -7.1737 -7.1737 -0.2053 -0.2053 -0.2053 -0.2053 1.1759 1.1759 1.1759 1.1759 1.4427 1.4427 1.4427 1.4427 3.2676 3.2676 3.2676 3.2676 3.5377 3.5377 3.5377 3.5377 5.2473 5.2473 5.2473 5.2473 6.8270 6.8270 6.8270 6.8270 8.4606 8.4606 8.4606 8.4606 k = 0.1154 0.0666 0.2225 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9222 -19.9222 -19.8292 -19.8292 -19.8292 -19.8292 -19.7467 -19.7467 -19.7467 -19.7467 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6465 -19.6465 -19.6465 -19.6465 -9.9635 -9.9635 -9.9635 -9.9635 -7.1711 -7.1711 -7.1711 -7.1711 -0.2040 -0.2040 -0.2040 -0.2040 1.1411 1.1411 1.1411 1.1411 1.4274 1.4274 1.4274 1.4274 3.2441 3.2441 3.2441 3.2441 3.5232 3.5232 3.5232 3.5232 5.2836 5.2836 5.2836 5.2836 6.8558 6.8558 6.8558 6.8558 8.5074 8.5074 8.5074 8.5074 k = 0.1282 0.0740 0.2225 ( 12546 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9223 -19.9223 -19.8292 -19.8292 -19.8292 -19.8292 -19.7468 -19.7468 -19.7468 -19.7468 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6541 -19.6541 -19.6466 -19.6466 -19.6466 -19.6466 -9.9599 -9.9599 -9.9599 -9.9599 -7.1682 -7.1682 -7.1682 -7.1682 -0.2027 -0.2027 -0.2027 -0.2027 1.1023 1.1023 1.1023 1.1023 1.4124 1.4124 1.4124 1.4124 3.2178 3.2178 3.2178 3.2178 3.5086 3.5086 3.5086 3.5086 5.3202 5.3202 5.3202 5.3202 6.8889 6.8889 6.8889 6.8889 8.5555 8.5555 8.5555 8.5555 k = 0.1410 0.0814 0.2225 ( 12536 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9224 -19.9224 -19.8293 -19.8293 -19.8293 -19.8293 -19.7469 -19.7469 -19.7469 -19.7469 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6541 -19.6541 -19.6466 -19.6466 -19.6466 -19.6466 -9.9561 -9.9561 -9.9561 -9.9561 -7.1651 -7.1651 -7.1651 -7.1651 -0.2012 -0.2012 -0.2012 -0.2012 1.0603 1.0603 1.0603 1.0603 1.3979 1.3979 1.3979 1.3979 3.1890 3.1890 3.1890 3.1890 3.4941 3.4941 3.4941 3.4941 5.3560 5.3560 5.3560 5.3560 6.9261 6.9261 6.9261 6.9261 8.6031 8.6031 8.6031 8.6031 k = 0.1538 0.0888 0.2225 ( 12528 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9224 -19.9224 -19.8293 -19.8293 -19.8293 -19.8293 -19.7470 -19.7470 -19.7470 -19.7470 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6541 -19.6541 -19.6467 -19.6467 -19.6467 -19.6467 -9.9520 -9.9520 -9.9520 -9.9520 -7.1617 -7.1617 -7.1617 -7.1617 -0.1997 -0.1997 -0.1997 -0.1997 1.0154 1.0154 1.0154 1.0154 1.3837 1.3837 1.3837 1.3837 3.1581 3.1581 3.1581 3.1581 3.4797 3.4797 3.4797 3.4797 5.3903 5.3903 5.3903 5.3903 6.9672 6.9672 6.9672 6.9672 8.6484 8.6484 8.6484 8.6484 k = 0.1667 0.0962 0.2225 ( 12526 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9225 -19.9225 -19.8294 -19.8294 -19.8294 -19.8294 -19.7471 -19.7471 -19.7471 -19.7471 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6541 -19.6541 -19.6467 -19.6467 -19.6467 -19.6467 -9.9477 -9.9477 -9.9477 -9.9477 -7.1582 -7.1582 -7.1582 -7.1582 -0.1981 -0.1981 -0.1981 -0.1981 0.9684 0.9684 0.9684 0.9684 1.3699 1.3699 1.3699 1.3699 3.1253 3.1253 3.1253 3.1253 3.4657 3.4657 3.4657 3.4657 5.4224 5.4224 5.4224 5.4224 7.0120 7.0120 7.0120 7.0120 8.6892 8.6892 8.6892 8.6892 k = 0.1795 0.1036 0.2225 ( 12526 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9225 -19.9225 -19.9225 -19.9225 -19.8295 -19.8295 -19.8295 -19.8295 -19.7473 -19.7473 -19.7473 -19.7473 -19.7411 -19.7411 -19.7411 -19.7411 -19.6541 -19.6541 -19.6541 -19.6541 -19.6468 -19.6468 -19.6468 -19.6468 -9.9431 -9.9431 -9.9431 -9.9431 -7.1545 -7.1545 -7.1545 -7.1545 -0.1964 -0.1964 -0.1964 -0.1964 0.9198 0.9198 0.9198 0.9198 1.3563 1.3563 1.3563 1.3563 3.0911 3.0911 3.0911 3.0911 3.4519 3.4519 3.4519 3.4519 5.4518 5.4518 5.4518 5.4518 7.0597 7.0597 7.0597 7.0597 8.7241 8.7241 8.7241 8.7241 k = 0.1923 0.1110 0.2225 ( 12550 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9227 -19.9227 -19.9227 -19.9227 -19.8296 -19.8296 -19.8296 -19.8296 -19.7474 -19.7474 -19.7474 -19.7474 -19.7411 -19.7411 -19.7411 -19.7411 -19.6542 -19.6542 -19.6542 -19.6542 -19.6469 -19.6469 -19.6469 -19.6469 -9.9384 -9.9384 -9.9384 -9.9384 -7.1506 -7.1506 -7.1506 -7.1506 -0.1947 -0.1947 -0.1947 -0.1947 0.8700 0.8700 0.8700 0.8700 1.3429 1.3429 1.3429 1.3429 3.0558 3.0558 3.0558 3.0558 3.4384 3.4384 3.4384 3.4384 5.4781 5.4781 5.4781 5.4781 7.1094 7.1094 7.1094 7.1094 8.7525 8.7525 8.7525 8.7525 k = 0.2051 0.1184 0.2225 ( 12544 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9227 -19.9227 -19.9227 -19.9227 -19.8296 -19.8296 -19.8296 -19.8296 -19.7476 -19.7476 -19.7476 -19.7476 -19.7411 -19.7411 -19.7411 -19.7411 -19.6542 -19.6542 -19.6542 -19.6542 -19.6470 -19.6470 -19.6470 -19.6470 -9.9335 -9.9335 -9.9335 -9.9335 -7.1466 -7.1466 -7.1466 -7.1466 -0.1930 -0.1930 -0.1930 -0.1930 0.8197 0.8197 0.8197 0.8197 1.3297 1.3297 1.3297 1.3297 3.0198 3.0198 3.0198 3.0198 3.4252 3.4252 3.4252 3.4252 5.5012 5.5012 5.5012 5.5012 7.1599 7.1599 7.1599 7.1599 8.7754 8.7754 8.7754 8.7754 k = 0.2179 0.1258 0.2225 ( 12550 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9228 -19.9228 -19.9228 -19.9228 -19.8297 -19.8297 -19.8297 -19.8297 -19.7477 -19.7477 -19.7477 -19.7477 -19.7411 -19.7411 -19.7411 -19.7411 -19.6542 -19.6542 -19.6542 -19.6542 -19.6471 -19.6471 -19.6471 -19.6471 -9.9285 -9.9285 -9.9285 -9.9285 -7.1425 -7.1425 -7.1425 -7.1425 -0.1913 -0.1913 -0.1913 -0.1913 0.7692 0.7692 0.7692 0.7692 1.3168 1.3168 1.3168 1.3168 2.9834 2.9834 2.9834 2.9834 3.4123 3.4123 3.4123 3.4123 5.5210 5.5210 5.5210 5.5210 7.2100 7.2100 7.2100 7.2100 8.7954 8.7954 8.7954 8.7954 k = 0.2308 0.1332 0.2225 ( 12538 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9229 -19.9229 -19.9229 -19.9229 -19.8298 -19.8298 -19.8298 -19.8298 -19.7479 -19.7479 -19.7479 -19.7479 -19.7411 -19.7411 -19.7411 -19.7411 -19.6543 -19.6543 -19.6543 -19.6543 -19.6471 -19.6471 -19.6471 -19.6471 -9.9234 -9.9234 -9.9234 -9.9234 -7.1383 -7.1383 -7.1383 -7.1383 -0.1895 -0.1895 -0.1895 -0.1895 0.7188 0.7188 0.7188 0.7188 1.3040 1.3040 1.3040 1.3040 2.9470 2.9470 2.9470 2.9470 3.3997 3.3997 3.3997 3.3997 5.5377 5.5377 5.5377 5.5377 7.2581 7.2581 7.2581 7.2581 8.8155 8.8155 8.8155 8.8155 k = 0.2436 0.1406 0.2225 ( 12544 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9230 -19.9230 -19.9230 -19.9230 -19.8299 -19.8299 -19.8299 -19.8299 -19.7480 -19.7480 -19.7480 -19.7480 -19.7411 -19.7411 -19.7411 -19.7411 -19.6543 -19.6543 -19.6543 -19.6543 -19.6472 -19.6472 -19.6472 -19.6472 -9.9182 -9.9182 -9.9182 -9.9182 -7.1341 -7.1341 -7.1341 -7.1341 -0.1878 -0.1878 -0.1878 -0.1878 0.6691 0.6691 0.6691 0.6691 1.2915 1.2915 1.2915 1.2915 2.9107 2.9107 2.9107 2.9107 3.3873 3.3873 3.3873 3.3873 5.5512 5.5512 5.5512 5.5512 7.3027 7.3027 7.3027 7.3027 8.8383 8.8383 8.8383 8.8383 k = 0.2564 0.1480 0.2225 ( 12542 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9231 -19.9231 -19.9231 -19.9231 -19.8299 -19.8299 -19.8299 -19.8299 -19.7482 -19.7482 -19.7482 -19.7482 -19.7411 -19.7411 -19.7411 -19.7411 -19.6543 -19.6543 -19.6543 -19.6543 -19.6473 -19.6473 -19.6473 -19.6473 -9.9130 -9.9130 -9.9130 -9.9130 -7.1299 -7.1299 -7.1299 -7.1299 -0.1862 -0.1862 -0.1862 -0.1862 0.6201 0.6201 0.6201 0.6201 1.2792 1.2792 1.2792 1.2792 2.8750 2.8750 2.8750 2.8750 3.3753 3.3753 3.3753 3.3753 5.5620 5.5620 5.5620 5.5620 7.3425 7.3425 7.3425 7.3425 8.8658 8.8658 8.8658 8.8658 k = 0.2692 0.1554 0.2225 ( 12540 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9231 -19.9231 -19.9231 -19.9231 -19.8300 -19.8300 -19.8300 -19.8300 -19.7483 -19.7483 -19.7483 -19.7483 -19.7411 -19.7411 -19.7411 -19.7411 -19.6543 -19.6543 -19.6543 -19.6543 -19.6474 -19.6474 -19.6474 -19.6474 -9.9078 -9.9078 -9.9078 -9.9078 -7.1256 -7.1256 -7.1256 -7.1256 -0.1845 -0.1845 -0.1845 -0.1845 0.5723 0.5723 0.5723 0.5723 1.2672 1.2672 1.2672 1.2672 2.8399 2.8399 2.8399 2.8399 3.3636 3.3636 3.3636 3.3636 5.5702 5.5702 5.5702 5.5702 7.3764 7.3764 7.3764 7.3764 8.8988 8.8988 8.8988 8.8988 k = 0.2821 0.1628 0.2225 ( 12546 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9232 -19.9232 -19.9232 -19.9232 -19.8301 -19.8301 -19.8301 -19.8301 -19.7485 -19.7485 -19.7485 -19.7485 -19.7411 -19.7411 -19.7411 -19.7411 -19.6544 -19.6544 -19.6544 -19.6544 -19.6475 -19.6475 -19.6475 -19.6475 -9.9026 -9.9026 -9.9026 -9.9026 -7.1214 -7.1214 -7.1214 -7.1214 -0.1830 -0.1830 -0.1830 -0.1830 0.5259 0.5259 0.5259 0.5259 1.2556 1.2556 1.2556 1.2556 2.8059 2.8059 2.8059 2.8059 3.3522 3.3522 3.3522 3.3522 5.5761 5.5761 5.5761 5.5761 7.4039 7.4039 7.4039 7.4039 8.9370 8.9370 8.9370 8.9370 k = 0.2949 0.1702 0.2225 ( 12536 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9233 -19.9233 -19.9233 -19.9233 -19.8301 -19.8301 -19.8301 -19.8301 -19.7486 -19.7486 -19.7486 -19.7486 -19.7411 -19.7411 -19.7411 -19.7411 -19.6544 -19.6544 -19.6544 -19.6544 -19.6475 -19.6475 -19.6475 -19.6475 -9.8976 -9.8976 -9.8976 -9.8976 -7.1172 -7.1172 -7.1172 -7.1172 -0.1815 -0.1815 -0.1815 -0.1815 0.4811 0.4811 0.4811 0.4811 1.2443 1.2443 1.2443 1.2443 2.7729 2.7729 2.7729 2.7729 3.3413 3.3413 3.3413 3.3413 5.5800 5.5800 5.5800 5.5800 7.4249 7.4249 7.4249 7.4249 8.9788 8.9788 8.9788 8.9788 k = 0.3077 0.1776 0.2225 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9234 -19.9234 -19.9234 -19.9234 -19.8302 -19.8302 -19.8302 -19.8302 -19.7487 -19.7487 -19.7487 -19.7487 -19.7411 -19.7411 -19.7411 -19.7411 -19.6544 -19.6544 -19.6544 -19.6544 -19.6476 -19.6476 -19.6476 -19.6476 -9.8926 -9.8926 -9.8926 -9.8926 -7.1131 -7.1131 -7.1131 -7.1131 -0.1800 -0.1800 -0.1800 -0.1800 0.4381 0.4381 0.4381 0.4381 1.2334 1.2334 1.2334 1.2334 2.7412 2.7412 2.7412 2.7412 3.3308 3.3308 3.3308 3.3308 5.5823 5.5823 5.5823 5.5823 7.4396 7.4396 7.4396 7.4396 9.0217 9.0217 9.0217 9.0217 k = 0.3205 0.1850 0.2225 ( 12538 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9235 -19.9235 -19.8303 -19.8303 -19.8303 -19.8303 -19.7489 -19.7489 -19.7489 -19.7489 -19.7411 -19.7411 -19.7411 -19.7411 -19.6544 -19.6544 -19.6544 -19.6544 -19.6477 -19.6477 -19.6477 -19.6477 -9.8878 -9.8878 -9.8878 -9.8878 -7.1091 -7.1091 -7.1091 -7.1091 -0.1787 -0.1787 -0.1787 -0.1787 0.3971 0.3971 0.3971 0.3971 1.2230 1.2230 1.2230 1.2230 2.7110 2.7110 2.7110 2.7110 3.3207 3.3207 3.3207 3.3207 5.5831 5.5831 5.5831 5.5831 7.4487 7.4487 7.4487 7.4487 9.0625 9.0625 9.0625 9.0625 k = 0.3333 0.1925 0.2225 ( 12532 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9235 -19.9235 -19.8304 -19.8304 -19.8304 -19.8304 -19.7490 -19.7490 -19.7490 -19.7490 -19.7411 -19.7411 -19.7411 -19.7411 -19.6545 -19.6545 -19.6545 -19.6545 -19.6477 -19.6477 -19.6477 -19.6477 -9.8831 -9.8831 -9.8831 -9.8831 -7.1053 -7.1053 -7.1053 -7.1053 -0.1774 -0.1774 -0.1774 -0.1774 0.3582 0.3582 0.3582 0.3582 1.2131 1.2131 1.2131 1.2131 2.6824 2.6824 2.6824 2.6824 3.3112 3.3112 3.3112 3.3112 5.5828 5.5828 5.5828 5.5828 7.4530 7.4530 7.4530 7.4530 9.0985 9.0985 9.0985 9.0985 k = 0.3462 0.1999 0.2225 ( 12524 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9236 -19.9236 -19.9236 -19.9236 -19.8304 -19.8304 -19.8304 -19.8304 -19.7491 -19.7491 -19.7491 -19.7491 -19.7411 -19.7411 -19.7411 -19.7411 -19.6545 -19.6545 -19.6545 -19.6545 -19.6478 -19.6478 -19.6478 -19.6478 -9.8786 -9.8786 -9.8786 -9.8786 -7.1016 -7.1016 -7.1016 -7.1016 -0.1762 -0.1762 -0.1762 -0.1762 0.3217 0.3217 0.3217 0.3217 1.2037 1.2037 1.2037 1.2037 2.6555 2.6555 2.6555 2.6555 3.3021 3.3021 3.3021 3.3021 5.5816 5.5816 5.5816 5.5816 7.4535 7.4535 7.4535 7.4535 9.1278 9.1278 9.1278 9.1278 k = 0.3590 0.2073 0.2225 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9236 -19.9236 -19.9236 -19.9236 -19.8305 -19.8305 -19.8305 -19.8305 -19.7492 -19.7492 -19.7492 -19.7492 -19.7410 -19.7410 -19.7410 -19.7410 -19.6545 -19.6545 -19.6545 -19.6545 -19.6478 -19.6478 -19.6478 -19.6478 -9.8744 -9.8744 -9.8744 -9.8744 -7.0981 -7.0981 -7.0981 -7.0981 -0.1751 -0.1751 -0.1751 -0.1751 0.2877 0.2877 0.2877 0.2877 1.1950 1.1950 1.1950 1.1950 2.6304 2.6304 2.6304 2.6304 3.2937 3.2937 3.2937 3.2937 5.5796 5.5796 5.5796 5.5796 7.4511 7.4511 7.4511 7.4511 9.1500 9.1500 9.1500 9.1500 k = 0.3718 0.2147 0.2225 ( 12498 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9237 -19.9237 -19.9237 -19.9237 -19.8305 -19.8305 -19.8305 -19.8305 -19.7493 -19.7493 -19.7493 -19.7493 -19.7410 -19.7410 -19.7410 -19.7410 -19.6545 -19.6545 -19.6545 -19.6545 -19.6479 -19.6479 -19.6479 -19.6479 -9.8705 -9.8705 -9.8705 -9.8705 -7.0949 -7.0949 -7.0949 -7.0949 -0.1741 -0.1741 -0.1741 -0.1741 0.2562 0.2562 0.2562 0.2562 1.1868 1.1868 1.1868 1.1868 2.6072 2.6072 2.6072 2.6072 3.2859 3.2859 3.2859 3.2859 5.5772 5.5772 5.5772 5.5772 7.4465 7.4465 7.4465 7.4465 9.1657 9.1657 9.1657 9.1657 k = 0.3846 0.2221 0.2225 ( 12494 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9237 -19.9237 -19.9237 -19.9237 -19.8306 -19.8306 -19.8306 -19.8306 -19.7494 -19.7494 -19.7494 -19.7494 -19.7410 -19.7410 -19.7410 -19.7410 -19.6545 -19.6545 -19.6545 -19.6545 -19.6479 -19.6479 -19.6479 -19.6479 -9.8668 -9.8668 -9.8668 -9.8668 -7.0918 -7.0918 -7.0918 -7.0918 -0.1732 -0.1732 -0.1732 -0.1732 0.2273 0.2273 0.2273 0.2273 1.1794 1.1794 1.1794 1.1794 2.5860 2.5860 2.5860 2.5860 3.2787 3.2787 3.2787 3.2787 5.5745 5.5745 5.5745 5.5745 7.4406 7.4406 7.4406 7.4406 9.1761 9.1761 9.1761 9.1761 k = 0.3974 0.2295 0.2225 ( 12494 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9238 -19.9238 -19.9238 -19.9238 -19.8306 -19.8306 -19.8306 -19.8306 -19.7495 -19.7495 -19.7495 -19.7495 -19.7410 -19.7410 -19.7410 -19.7410 -19.6545 -19.6545 -19.6545 -19.6545 -19.6480 -19.6480 -19.6480 -19.6480 -9.8634 -9.8634 -9.8634 -9.8634 -7.0891 -7.0891 -7.0891 -7.0891 -0.1724 -0.1724 -0.1724 -0.1724 0.2013 0.2013 0.2013 0.2013 1.1726 1.1726 1.1726 1.1726 2.5669 2.5669 2.5669 2.5669 3.2722 3.2722 3.2722 3.2722 5.5716 5.5716 5.5716 5.5716 7.4339 7.4339 7.4339 7.4339 9.1825 9.1825 9.1825 9.1825 k = 0.4103 0.2369 0.2225 ( 12482 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9238 -19.9238 -19.9238 -19.9238 -19.8306 -19.8306 -19.8306 -19.8306 -19.7496 -19.7496 -19.7496 -19.7496 -19.7410 -19.7410 -19.7410 -19.7410 -19.6545 -19.6545 -19.6545 -19.6545 -19.6480 -19.6480 -19.6480 -19.6480 -9.8604 -9.8604 -9.8604 -9.8604 -7.0866 -7.0866 -7.0866 -7.0866 -0.1717 -0.1717 -0.1717 -0.1717 0.1781 0.1781 0.1781 0.1781 1.1665 1.1665 1.1665 1.1665 2.5499 2.5499 2.5499 2.5499 3.2663 3.2663 3.2663 3.2663 5.5688 5.5688 5.5688 5.5688 7.4269 7.4269 7.4269 7.4269 9.1860 9.1860 9.1860 9.1860 k = 0.4231 0.2443 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9239 -19.9239 -19.8307 -19.8307 -19.8307 -19.8307 -19.7496 -19.7496 -19.7496 -19.7496 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6480 -19.6480 -19.6480 -19.6480 -9.8578 -9.8578 -9.8578 -9.8578 -7.0844 -7.0844 -7.0844 -7.0844 -0.1711 -0.1711 -0.1711 -0.1711 0.1579 0.1579 0.1579 0.1579 1.1612 1.1612 1.1612 1.1612 2.5350 2.5350 2.5350 2.5350 3.2612 3.2612 3.2612 3.2612 5.5660 5.5660 5.5660 5.5660 7.4202 7.4202 7.4202 7.4202 9.1875 9.1875 9.1875 9.1875 k = 0.4359 0.2517 0.2225 ( 12482 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9239 -19.9239 -19.8307 -19.8307 -19.8307 -19.8307 -19.7497 -19.7497 -19.7497 -19.7497 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8555 -9.8555 -9.8555 -9.8555 -7.0825 -7.0825 -7.0825 -7.0825 -0.1706 -0.1706 -0.1706 -0.1706 0.1407 0.1407 0.1407 0.1407 1.1567 1.1567 1.1567 1.1567 2.5224 2.5224 2.5224 2.5224 3.2569 3.2569 3.2569 3.2569 5.5635 5.5635 5.5635 5.5635 7.4140 7.4140 7.4140 7.4140 9.1878 9.1878 9.1878 9.1878 k = 0.4487 0.2591 0.2225 ( 12474 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9239 -19.9239 -19.8307 -19.8307 -19.8307 -19.8307 -19.7497 -19.7497 -19.7497 -19.7497 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8536 -9.8536 -9.8536 -9.8536 -7.0809 -7.0809 -7.0809 -7.0809 -0.1702 -0.1702 -0.1702 -0.1702 0.1265 0.1265 0.1265 0.1265 1.1530 1.1530 1.1530 1.1530 2.5120 2.5120 2.5120 2.5120 3.2533 3.2533 3.2533 3.2533 5.5614 5.5614 5.5614 5.5614 7.4085 7.4085 7.4085 7.4085 9.1874 9.1874 9.1874 9.1874 k = 0.4615 0.2665 0.2225 ( 12470 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9239 -19.9239 -19.9239 -19.9239 -19.8307 -19.8307 -19.8307 -19.8307 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8521 -9.8521 -9.8521 -9.8521 -7.0797 -7.0797 -7.0797 -7.0797 -0.1699 -0.1699 -0.1699 -0.1699 0.1155 0.1155 0.1155 0.1155 1.1501 1.1501 1.1501 1.1501 2.5039 2.5039 2.5039 2.5039 3.2505 3.2505 3.2505 3.2505 5.5596 5.5596 5.5596 5.5596 7.4041 7.4041 7.4041 7.4041 9.1867 9.1867 9.1867 9.1867 k = 0.4744 0.2739 0.2225 ( 12476 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8308 -19.8308 -19.8308 -19.8308 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8511 -9.8511 -9.8511 -9.8511 -7.0788 -7.0788 -7.0788 -7.0788 -0.1696 -0.1696 -0.1696 -0.1696 0.1075 0.1075 0.1075 0.1075 1.1480 1.1480 1.1480 1.1480 2.4981 2.4981 2.4981 2.4981 3.2485 3.2485 3.2485 3.2485 5.5583 5.5583 5.5583 5.5583 7.4009 7.4009 7.4009 7.4009 9.1860 9.1860 9.1860 9.1860 k = 0.4872 0.2813 0.2225 ( 12464 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8307 -19.8307 -19.8307 -19.8307 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8504 -9.8504 -9.8504 -9.8504 -7.0783 -7.0783 -7.0783 -7.0783 -0.1695 -0.1695 -0.1695 -0.1695 0.1028 0.1028 0.1028 0.1028 1.1467 1.1467 1.1467 1.1467 2.4947 2.4947 2.4947 2.4947 3.2473 3.2473 3.2473 3.2473 5.5575 5.5575 5.5575 5.5575 7.3989 7.3989 7.3989 7.3989 9.1856 9.1856 9.1856 9.1856 k = 0.5000 0.2887 0.2225 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8308 -19.8308 -19.8308 -19.8308 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8502 -9.8502 -9.8502 -9.8502 -7.0781 -7.0781 -7.0781 -7.0781 -0.1695 -0.1695 -0.1695 -0.1695 0.1012 0.1012 0.1012 0.1012 1.1463 1.1463 1.1463 1.1463 2.4935 2.4935 2.4935 2.4935 3.2469 3.2469 3.2469 3.2469 5.5573 5.5573 5.5573 5.5573 7.3982 7.3982 7.3982 7.3982 9.1854 9.1854 9.1854 9.1854 k = 0.5000 0.2887 0.2225 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8308 -19.8308 -19.8308 -19.8308 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8502 -9.8502 -9.8502 -9.8502 -7.0781 -7.0781 -7.0781 -7.0781 -0.1695 -0.1695 -0.1695 -0.1695 0.1012 0.1012 0.1012 0.1012 1.1463 1.1463 1.1463 1.1463 2.4935 2.4935 2.4935 2.4935 3.2469 3.2469 3.2469 3.2469 5.5573 5.5573 5.5573 5.5573 7.3982 7.3982 7.3982 7.3982 9.1854 9.1854 9.1854 9.1854 k = 0.4928 0.3012 0.2225 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9239 -19.9239 -19.8308 -19.8308 -19.8307 -19.8307 -19.7500 -19.7500 -19.7497 -19.7497 -19.7411 -19.7411 -19.7409 -19.7409 -19.6546 -19.6546 -19.6546 -19.6546 -19.6482 -19.6482 -19.6481 -19.6481 -9.8502 -9.8502 -9.8501 -9.8501 -7.0780 -7.0780 -7.0780 -7.0780 -0.1695 -0.1695 -0.1691 -0.1691 0.1017 0.1017 0.1019 0.1019 1.1434 1.1434 1.1445 1.1445 2.4925 2.4925 2.4954 2.4954 3.2429 3.2429 3.2477 3.2477 5.5576 5.5576 5.5588 5.5588 7.4021 7.4021 7.4033 7.4033 9.1888 9.1888 9.1898 9.1898 k = 0.4855 0.3138 0.2225 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8308 -19.8308 -19.8307 -19.8307 -19.7501 -19.7501 -19.7496 -19.7496 -19.7412 -19.7412 -19.7409 -19.7409 -19.6546 -19.6546 -19.6546 -19.6546 -19.6482 -19.6482 -19.6481 -19.6481 -9.8500 -9.8500 -9.8499 -9.8499 -7.0779 -7.0779 -7.0779 -7.0779 -0.1692 -0.1692 -0.1683 -0.1683 0.1036 0.1036 0.1040 0.1040 1.1358 1.1358 1.1379 1.1379 2.4925 2.4925 2.4984 2.4984 3.2357 3.2357 3.2454 3.2454 5.5600 5.5600 5.5624 5.5624 7.4150 7.4150 7.4174 7.4174 9.2000 9.2000 9.2019 9.2019 k = 0.4783 0.3263 0.2225 ( 12482 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8309 -19.8309 -19.8307 -19.8307 -19.7502 -19.7502 -19.7495 -19.7495 -19.7412 -19.7412 -19.7408 -19.7408 -19.6546 -19.6546 -19.6546 -19.6546 -19.6482 -19.6482 -19.6481 -19.6481 -9.8497 -9.8497 -9.8496 -9.8496 -7.0776 -7.0776 -7.0776 -7.0776 -0.1685 -0.1685 -0.1672 -0.1672 0.1068 0.1068 0.1073 0.1073 1.1236 1.1236 1.1268 1.1268 2.4933 2.4933 2.5023 2.5023 3.2256 3.2256 3.2402 3.2402 5.5642 5.5642 5.5677 5.5677 7.4368 7.4368 7.4404 7.4404 9.2186 9.2186 9.2216 9.2216 k = 0.4710 0.3389 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9243 -19.9243 -19.9237 -19.9237 -19.8309 -19.8309 -19.8307 -19.8307 -19.7503 -19.7503 -19.7494 -19.7494 -19.7413 -19.7413 -19.7407 -19.7407 -19.6546 -19.6546 -19.6546 -19.6546 -19.6483 -19.6483 -19.6481 -19.6481 -9.8492 -9.8492 -9.8491 -9.8491 -7.0772 -7.0772 -7.0772 -7.0772 -0.1674 -0.1674 -0.1657 -0.1657 0.1112 0.1112 0.1120 0.1120 1.1071 1.1071 1.1113 1.1113 2.4949 2.4949 2.5073 2.5073 3.2124 3.2124 3.2321 3.2321 5.5700 5.5700 5.5746 5.5746 7.4676 7.4676 7.4724 7.4724 9.2445 9.2445 9.2486 9.2486 k = 0.4638 0.3514 0.2225 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9244 -19.9244 -19.9236 -19.9236 -19.8309 -19.8309 -19.8307 -19.8307 -19.7504 -19.7504 -19.7493 -19.7493 -19.7414 -19.7414 -19.7406 -19.7406 -19.6546 -19.6546 -19.6546 -19.6546 -19.6483 -19.6483 -19.6481 -19.6481 -9.8487 -9.8487 -9.8485 -9.8485 -7.0767 -7.0767 -7.0767 -7.0767 -0.1661 -0.1661 -0.1640 -0.1640 0.1170 0.1170 0.1179 0.1179 1.0866 1.0866 1.0916 1.0916 2.4972 2.4972 2.5132 2.5132 3.1965 3.1965 3.2214 3.2214 5.5772 5.5772 5.5829 5.5829 7.5071 7.5071 7.5132 7.5132 9.2772 9.2772 9.2825 9.2825 k = 0.4565 0.3640 0.2225 ( 12496 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9245 -19.9245 -19.9236 -19.9236 -19.8310 -19.8310 -19.8307 -19.8307 -19.7505 -19.7505 -19.7493 -19.7493 -19.7415 -19.7415 -19.7406 -19.7406 -19.6546 -19.6546 -19.6546 -19.6546 -19.6484 -19.6484 -19.6481 -19.6481 -9.8480 -9.8480 -9.8479 -9.8479 -7.0761 -7.0761 -7.0761 -7.0761 -0.1644 -0.1644 -0.1620 -0.1620 0.1241 0.1241 0.1251 0.1251 1.0623 1.0623 1.0683 1.0683 2.5002 2.5002 2.5200 2.5200 3.1781 3.1781 3.2084 3.2084 5.5855 5.5855 5.5922 5.5922 7.5554 7.5554 7.5628 7.5628 9.3160 9.3160 9.3227 9.3227 k = 0.4493 0.3765 0.2225 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9246 -19.9246 -19.9235 -19.9235 -19.8310 -19.8310 -19.8306 -19.8306 -19.7506 -19.7506 -19.7492 -19.7492 -19.7416 -19.7416 -19.7405 -19.7405 -19.6546 -19.6546 -19.6546 -19.6546 -19.6484 -19.6484 -19.6481 -19.6481 -9.8473 -9.8473 -9.8471 -9.8471 -7.0754 -7.0754 -7.0754 -7.0754 -0.1626 -0.1626 -0.1597 -0.1597 0.1326 0.1326 0.1336 0.1336 1.0347 1.0347 1.0415 1.0415 2.5037 2.5037 2.5277 2.5277 3.1573 3.1573 3.1933 3.1933 5.5947 5.5947 5.6023 5.6023 7.6121 7.6121 7.6209 7.6209 9.3603 9.3603 9.3686 9.3686 k = 0.4420 0.3891 0.2225 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9247 -19.9247 -19.9235 -19.9235 -19.8311 -19.8311 -19.8306 -19.8306 -19.7508 -19.7508 -19.7491 -19.7491 -19.7417 -19.7417 -19.7405 -19.7405 -19.6546 -19.6546 -19.6546 -19.6546 -19.6485 -19.6485 -19.6481 -19.6481 -9.8464 -9.8464 -9.8462 -9.8462 -7.0747 -7.0747 -7.0746 -7.0746 -0.1605 -0.1605 -0.1573 -0.1573 0.1424 0.1424 0.1434 0.1434 1.0042 1.0042 1.0118 1.0118 2.5076 2.5076 2.5363 2.5363 3.1346 3.1346 3.1764 3.1764 5.6044 5.6044 5.6129 5.6129 7.6770 7.6770 7.6873 7.6873 9.4092 9.4092 9.4194 9.4194 k = 0.4348 0.4016 0.2225 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9248 -19.9248 -19.9234 -19.9234 -19.8311 -19.8311 -19.8306 -19.8306 -19.7509 -19.7509 -19.7490 -19.7490 -19.7417 -19.7417 -19.7404 -19.7404 -19.6546 -19.6546 -19.6546 -19.6546 -19.6485 -19.6485 -19.6481 -19.6481 -9.8455 -9.8455 -9.8453 -9.8453 -7.0739 -7.0739 -7.0738 -7.0738 -0.1583 -0.1583 -0.1548 -0.1548 0.1534 0.1534 0.1545 0.1545 0.9712 0.9712 0.9795 0.9795 2.5119 2.5119 2.5457 2.5457 3.1101 3.1101 3.1582 3.1582 5.6143 5.6143 5.6235 5.6235 7.7499 7.7499 7.7616 7.7616 9.4616 9.4616 9.4740 9.4740 k = 0.4275 0.4142 0.2225 ( 12510 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9249 -19.9249 -19.9234 -19.9234 -19.8311 -19.8311 -19.8306 -19.8306 -19.7510 -19.7510 -19.7490 -19.7490 -19.7418 -19.7418 -19.7404 -19.7404 -19.6546 -19.6546 -19.6546 -19.6546 -19.6486 -19.6486 -19.6481 -19.6481 -9.8445 -9.8445 -9.8443 -9.8443 -7.0730 -7.0730 -7.0729 -7.0729 -0.1560 -0.1560 -0.1522 -0.1522 0.1658 0.1658 0.1668 0.1668 0.9362 0.9362 0.9452 0.9452 2.5163 2.5163 2.5558 2.5558 3.0842 3.0842 3.1390 3.1390 5.6241 5.6241 5.6341 5.6341 7.8301 7.8301 7.8435 7.8435 9.5164 9.5164 9.5312 9.5312 k = 0.4203 0.4267 0.2225 ( 12502 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9249 -19.9249 -19.9233 -19.9233 -19.8312 -19.8312 -19.8306 -19.8306 -19.7511 -19.7511 -19.7489 -19.7489 -19.7419 -19.7419 -19.7403 -19.7403 -19.6546 -19.6546 -19.6546 -19.6546 -19.6486 -19.6486 -19.6481 -19.6481 -9.8435 -9.8435 -9.8432 -9.8432 -7.0721 -7.0721 -7.0720 -7.0720 -0.1536 -0.1536 -0.1496 -0.1496 0.1795 0.1795 0.1803 0.1803 0.8996 0.8996 0.9093 0.9093 2.5209 2.5209 2.5667 2.5667 3.0572 3.0572 3.1192 3.1192 5.6337 5.6337 5.6443 5.6443 7.9171 7.9171 7.9324 7.9324 9.5720 9.5720 9.5897 9.5897 k = 0.4130 0.4393 0.2225 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9250 -19.9250 -19.9233 -19.9233 -19.8312 -19.8312 -19.8306 -19.8306 -19.7512 -19.7512 -19.7488 -19.7488 -19.7420 -19.7420 -19.7403 -19.7403 -19.6546 -19.6546 -19.6546 -19.6546 -19.6487 -19.6487 -19.6481 -19.6481 -9.8425 -9.8425 -9.8421 -9.8421 -7.0711 -7.0711 -7.0710 -7.0710 -0.1512 -0.1512 -0.1469 -0.1469 0.1944 0.1944 0.1949 0.1949 0.8618 0.8618 0.8723 0.8723 2.5255 2.5255 2.5783 2.5783 3.0294 3.0294 3.0992 3.0992 5.6429 5.6429 5.6539 5.6539 8.0102 8.0102 8.0275 8.0275 9.6269 9.6269 9.6478 9.6478 k = 0.4058 0.4518 0.2225 ( 12508 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9232 -19.9232 -19.8312 -19.8312 -19.8306 -19.8306 -19.7513 -19.7513 -19.7488 -19.7488 -19.7420 -19.7420 -19.7402 -19.7402 -19.6546 -19.6546 -19.6546 -19.6546 -19.6487 -19.6487 -19.6481 -19.6481 -9.8414 -9.8414 -9.8411 -9.8411 -7.0702 -7.0702 -7.0701 -7.0701 -0.1488 -0.1488 -0.1444 -0.1444 0.2105 0.2105 0.2106 0.2106 0.8233 0.8233 0.8346 0.8346 2.5300 2.5300 2.5906 2.5906 3.0011 3.0011 3.0794 3.0794 5.6514 5.6514 5.6629 5.6629 8.1083 8.1083 8.1280 8.1280 9.6794 9.6794 9.7039 9.7039 k = 0.3986 0.4644 0.2225 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9232 -19.9232 -19.8312 -19.8312 -19.8306 -19.8306 -19.7514 -19.7514 -19.7487 -19.7487 -19.7421 -19.7421 -19.7402 -19.7402 -19.6546 -19.6546 -19.6545 -19.6545 -19.6487 -19.6487 -19.6481 -19.6481 -9.8403 -9.8403 -9.8400 -9.8400 -7.0693 -7.0693 -7.0691 -7.0691 -0.1466 -0.1466 -0.1419 -0.1419 0.2273 0.2273 0.2278 0.2278 0.7846 0.7846 0.7968 0.7968 2.5343 2.5343 2.6035 2.6035 2.9727 2.9727 3.0602 3.0602 5.6591 5.6591 5.6710 5.6710 8.2103 8.2103 8.2328 8.2328 9.7280 9.7280 9.7559 9.7559 k = 0.3913 0.4769 0.2225 ( 12496 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9232 -19.9232 -19.8313 -19.8313 -19.8306 -19.8306 -19.7515 -19.7515 -19.7487 -19.7487 -19.7422 -19.7422 -19.7402 -19.7402 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8393 -9.8393 -9.8389 -9.8389 -7.0683 -7.0683 -7.0682 -7.0682 -0.1444 -0.1444 -0.1396 -0.1396 0.2449 0.2449 0.2460 0.2460 0.7461 0.7461 0.7592 0.7592 2.5383 2.5383 2.6171 2.6171 2.9444 2.9444 3.0420 3.0420 5.6661 5.6661 5.6783 5.6783 8.3145 8.3145 8.3403 8.3403 9.7710 9.7710 9.8019 9.8019 k = 0.3841 0.4895 0.2225 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7515 -19.7515 -19.7487 -19.7487 -19.7422 -19.7422 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8383 -9.8383 -9.8379 -9.8379 -7.0675 -7.0675 -7.0674 -7.0674 -0.1424 -0.1424 -0.1375 -0.1375 0.2632 0.2632 0.2652 0.2652 0.7081 0.7081 0.7224 0.7224 2.5419 2.5419 2.6313 2.6313 2.9165 2.9165 3.0250 3.0250 5.6721 5.6721 5.6846 5.6846 8.4189 8.4189 8.4486 8.4486 9.8073 9.8073 9.8398 9.8398 k = 0.3768 0.5020 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7486 -19.7486 -19.7422 -19.7422 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8374 -9.8374 -9.8370 -9.8370 -7.0667 -7.0667 -7.0665 -7.0665 -0.1406 -0.1406 -0.1356 -0.1356 0.2819 0.2819 0.2851 0.2851 0.6713 0.6713 0.6869 0.6869 2.5450 2.5450 2.6460 2.6460 2.8893 2.8893 3.0098 3.0098 5.6773 5.6773 5.6900 5.6900 8.5206 8.5206 8.5551 8.5551 9.8354 9.8354 9.8669 9.8669 k = 0.3696 0.5146 0.2225 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7486 -19.7486 -19.7423 -19.7423 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8366 -9.8366 -9.8362 -9.8362 -7.0659 -7.0659 -7.0658 -7.0658 -0.1390 -0.1390 -0.1339 -0.1339 0.3007 0.3007 0.3055 0.3055 0.6361 0.6361 0.6533 0.6533 2.5476 2.5476 2.6613 2.6613 2.8629 2.8629 2.9965 2.9965 5.6816 5.6816 5.6945 5.6945 8.6163 8.6163 8.6563 8.6563 9.8498 9.8498 9.8777 9.8777 k = 0.3623 0.5271 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8359 -9.8359 -9.8355 -9.8355 -7.0653 -7.0653 -7.0652 -7.0652 -0.1377 -0.1377 -0.1325 -0.1325 0.3191 0.3191 0.3258 0.3258 0.6032 0.6032 0.6226 0.6226 2.5495 2.5495 2.6772 2.6772 2.8377 2.8377 2.9854 2.9854 5.6850 5.6850 5.6980 5.6980 8.7015 8.7015 8.7477 8.7477 9.8351 9.8351 9.8719 9.8719 k = 0.3551 0.5397 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8353 -9.8353 -9.8348 -9.8348 -7.0648 -7.0648 -7.0647 -7.0647 -0.1366 -0.1366 -0.1314 -0.1314 0.3360 0.3360 0.3453 0.3453 0.5736 0.5736 0.5957 0.5957 2.5509 2.5509 2.6934 2.6934 2.8139 2.8139 2.9766 2.9766 5.6876 5.6876 5.7006 5.7006 8.7717 8.7717 8.8241 8.8241 9.8140 9.8140 9.8643 9.8643 k = 0.3478 0.5522 0.2225 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8348 -9.8348 -9.8344 -9.8344 -7.0644 -7.0644 -7.0643 -7.0643 -0.1358 -0.1358 -0.1306 -0.1306 0.3502 0.3502 0.3626 0.3626 0.5490 0.5490 0.5742 0.5742 2.5517 2.5517 2.7099 2.7099 2.7919 2.7919 2.9704 2.9704 5.6893 5.6893 5.7025 5.7025 8.8226 8.8226 8.8803 8.8803 9.8038 9.8038 9.8645 9.8645 k = 0.3406 0.5648 0.2225 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8345 -9.8345 -9.8341 -9.8341 -7.0641 -7.0641 -7.0640 -7.0640 -0.1353 -0.1353 -0.1301 -0.1301 0.3598 0.3598 0.3751 0.3751 0.5320 0.5320 0.5600 0.5600 2.5521 2.5521 2.7256 2.7256 2.7728 2.7728 2.9666 2.9666 5.6903 5.6903 5.7035 5.7035 8.8523 8.8523 8.9134 8.9134 9.8036 9.8036 9.8715 9.8715 k = 0.3333 0.5774 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7518 -19.7518 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8344 -9.8344 -9.8340 -9.8340 -7.0641 -7.0641 -7.0639 -7.0639 -0.1352 -0.1352 -0.1299 -0.1299 0.3632 0.3632 0.3797 0.3797 0.5258 0.5258 0.5551 0.5551 2.5522 2.5522 2.7346 2.7346 2.7626 2.7626 2.9654 2.9654 5.6907 5.6907 5.7038 5.7038 8.8616 8.8616 8.9237 8.9237 9.8060 9.8060 9.8765 9.8765 k = 0.3333 0.5774 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7518 -19.7518 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8344 -9.8344 -9.8340 -9.8340 -7.0641 -7.0641 -7.0639 -7.0639 -0.1352 -0.1352 -0.1299 -0.1299 0.3632 0.3632 0.3797 0.3797 0.5258 0.5258 0.5551 0.5551 2.5522 2.5522 2.7346 2.7346 2.7626 2.7626 2.9654 2.9654 5.6907 5.6907 5.7038 5.7038 8.8616 8.8616 8.9237 8.9237 9.8060 9.8060 9.8765 9.8765 k = 0.3259 0.5645 0.2225 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8345 -9.8345 -9.8341 -9.8341 -7.0642 -7.0642 -7.0640 -7.0640 -0.1353 -0.1353 -0.1301 -0.1301 0.3599 0.3599 0.3752 0.3752 0.5320 0.5320 0.5600 0.5600 2.5522 2.5522 2.7258 2.7258 2.7727 2.7727 2.9667 2.9667 5.6903 5.6903 5.7035 5.7035 8.8533 8.8533 8.9145 8.9145 9.7995 9.7995 9.8674 9.8674 k = 0.3185 0.5517 0.2225 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8349 -9.8349 -9.8345 -9.8345 -7.0644 -7.0644 -7.0643 -7.0643 -0.1358 -0.1358 -0.1306 -0.1306 0.3515 0.3515 0.3640 0.3640 0.5481 0.5481 0.5734 0.5734 2.5522 2.5522 2.7117 2.7117 2.7905 2.7905 2.9703 2.9703 5.6895 5.6895 5.7026 5.7026 8.8311 8.8311 8.8905 8.8905 9.7751 9.7751 9.8375 9.8375 k = 0.3111 0.5389 0.2225 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8355 -9.8355 -9.8350 -9.8350 -7.0649 -7.0649 -7.0648 -7.0648 -0.1367 -0.1367 -0.1315 -0.1315 0.3403 0.3403 0.3501 0.3501 0.5704 0.5704 0.5929 0.5929 2.5527 2.5527 2.6983 2.6983 2.8102 2.8102 2.9761 2.9761 5.6881 5.6881 5.7012 5.7012 8.7991 8.7991 8.8562 8.8562 9.7317 9.7317 9.7886 9.7886 k = 0.3037 0.5260 0.2225 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8363 -9.8363 -9.8359 -9.8359 -7.0657 -7.0657 -7.0655 -7.0655 -0.1379 -0.1379 -0.1327 -0.1327 0.3286 0.3286 0.3361 0.3361 0.5963 0.5963 0.6164 0.6164 2.5536 2.5536 2.6867 2.6867 2.8309 2.8309 2.9840 2.9840 5.6863 5.6863 5.6993 5.6993 8.7604 8.7604 8.8154 8.8154 9.6733 9.6733 9.7259 9.7259 k = 0.2963 0.5132 0.2225 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9253 -19.9253 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7516 -19.7516 -19.7486 -19.7486 -19.7423 -19.7423 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8374 -9.8374 -9.8370 -9.8370 -7.0666 -7.0666 -7.0665 -7.0665 -0.1393 -0.1393 -0.1342 -0.1342 0.3177 0.3177 0.3233 0.3233 0.6244 0.6244 0.6425 0.6425 2.5554 2.5554 2.6770 2.6770 2.8521 2.8521 2.9936 2.9936 5.6841 5.6841 5.6970 5.6970 8.7173 8.7173 8.7704 8.7704 9.6048 9.6048 9.6541 9.6541 k = 0.2889 0.5004 0.2225 ( 12464 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8313 -19.8313 -19.8305 -19.8305 -19.7515 -19.7515 -19.7485 -19.7485 -19.7422 -19.7422 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8388 -9.8388 -9.8384 -9.8384 -7.0678 -7.0678 -7.0677 -7.0677 -0.1411 -0.1411 -0.1361 -0.1361 0.3085 0.3085 0.3125 0.3125 0.6540 0.6540 0.6705 0.6705 2.5581 2.5581 2.6695 2.6695 2.8739 2.8739 3.0049 3.0049 5.6816 5.6816 5.6945 5.6945 8.6714 8.6714 8.7228 8.7228 9.5300 9.5300 9.5769 9.5769 k = 0.2815 0.4875 0.2225 ( 12474 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9252 -19.9252 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7515 -19.7515 -19.7486 -19.7486 -19.7422 -19.7422 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6481 -19.6481 -9.8404 -9.8404 -9.8400 -9.8400 -7.0692 -7.0692 -7.0691 -7.0691 -0.1431 -0.1431 -0.1381 -0.1381 0.3014 0.3014 0.3043 0.3043 0.6845 0.6845 0.6997 0.6997 2.5620 2.5620 2.6641 2.6641 2.8963 2.8963 3.0176 3.0176 5.6790 5.6790 5.6917 5.6917 8.6235 8.6235 8.6736 8.6736 9.4519 9.4519 9.4971 9.4971 k = 0.2741 0.4747 0.2225 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7514 -19.7514 -19.7486 -19.7486 -19.7421 -19.7421 -19.7401 -19.7401 -19.6545 -19.6545 -19.6545 -19.6545 -19.6487 -19.6487 -19.6481 -19.6481 -9.8424 -9.8424 -9.8420 -9.8420 -7.0709 -7.0709 -7.0708 -7.0708 -0.1453 -0.1453 -0.1405 -0.1405 0.2969 0.2969 0.2989 0.2989 0.7157 0.7157 0.7298 0.7298 2.5672 2.5672 2.6608 2.6608 2.9190 2.9190 3.0316 3.0316 5.6761 5.6761 5.6887 5.6887 8.5744 8.5744 8.6233 8.6233 9.3727 9.3727 9.4167 9.4167 k = 0.2667 0.4619 0.2225 ( 12496 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9251 -19.9251 -19.9231 -19.9231 -19.8312 -19.8312 -19.8305 -19.8305 -19.7513 -19.7513 -19.7486 -19.7486 -19.7421 -19.7421 -19.7402 -19.7402 -19.6545 -19.6545 -19.6545 -19.6545 -19.6487 -19.6487 -19.6481 -19.6481 -9.8446 -9.8446 -9.8443 -9.8443 -7.0728 -7.0728 -7.0727 -7.0727 -0.1477 -0.1477 -0.1430 -0.1430 0.2951 0.2951 0.2964 0.2964 0.7473 0.7473 0.7604 0.7604 2.5737 2.5737 2.6597 2.6597 2.9421 2.9421 3.0468 3.0468 5.6732 5.6732 5.6856 5.6856 8.5242 8.5242 8.5722 8.5722 9.2941 9.2941 9.3371 9.3371 k = 0.2593 0.4491 0.2225 ( 12490 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9250 -19.9250 -19.9231 -19.9231 -19.8311 -19.8311 -19.8305 -19.8305 -19.7512 -19.7512 -19.7486 -19.7486 -19.7421 -19.7421 -19.7402 -19.7402 -19.6545 -19.6545 -19.6545 -19.6545 -19.6486 -19.6486 -19.6480 -19.6480 -9.8472 -9.8472 -9.8468 -9.8468 -7.0749 -7.0749 -7.0748 -7.0748 -0.1503 -0.1503 -0.1456 -0.1456 0.2963 0.2963 0.2970 0.2970 0.7791 0.7791 0.7915 0.7915 2.5818 2.5818 2.6608 2.6608 2.9656 2.9656 3.0628 3.0628 5.6701 5.6701 5.6824 5.6824 8.4730 8.4730 8.5201 8.5201 9.2174 9.2174 9.2598 9.2598 k = 0.2519 0.4362 0.2225 ( 12488 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9249 -19.9249 -19.9231 -19.9231 -19.8311 -19.8311 -19.8305 -19.8305 -19.7510 -19.7510 -19.7486 -19.7486 -19.7420 -19.7420 -19.7402 -19.7402 -19.6545 -19.6545 -19.6545 -19.6545 -19.6486 -19.6486 -19.6480 -19.6480 -9.8500 -9.8500 -9.8497 -9.8497 -7.0773 -7.0773 -7.0772 -7.0772 -0.1529 -0.1529 -0.1484 -0.1484 0.3004 0.3004 0.3006 0.3006 0.8111 0.8111 0.8227 0.8227 2.5914 2.5914 2.6641 2.6641 2.9893 2.9893 3.0798 3.0798 5.6670 5.6670 5.6791 5.6791 8.4206 8.4206 8.4668 8.4668 9.1440 9.1440 9.1857 9.1857 k = 0.2444 0.4234 0.2225 ( 12500 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9248 -19.9248 -19.9231 -19.9231 -19.8310 -19.8310 -19.8304 -19.8304 -19.7509 -19.7509 -19.7486 -19.7486 -19.7420 -19.7420 -19.7403 -19.7403 -19.6545 -19.6545 -19.6545 -19.6545 -19.6485 -19.6485 -19.6480 -19.6480 -9.8531 -9.8531 -9.8528 -9.8528 -7.0800 -7.0800 -7.0799 -7.0799 -0.1555 -0.1555 -0.1512 -0.1512 0.3074 0.3074 0.3075 0.3075 0.8431 0.8431 0.8539 0.8539 2.6026 2.6026 2.6696 2.6696 3.0132 3.0132 3.0974 3.0974 5.6639 5.6639 5.6757 5.6757 8.3666 8.3666 8.4118 8.4118 9.0750 9.0750 9.1158 9.1158 k = 0.2370 0.4106 0.2225 ( 12502 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9247 -19.9247 -19.9231 -19.9231 -19.8310 -19.8310 -19.8304 -19.8304 -19.7508 -19.7508 -19.7485 -19.7485 -19.7419 -19.7419 -19.7403 -19.7403 -19.6545 -19.6545 -19.6545 -19.6545 -19.6485 -19.6485 -19.6479 -19.6479 -9.8565 -9.8565 -9.8562 -9.8562 -7.0828 -7.0828 -7.0827 -7.0827 -0.1581 -0.1581 -0.1541 -0.1541 0.3173 0.3173 0.3177 0.3177 0.8749 0.8749 0.8851 0.8851 2.6155 2.6155 2.6771 2.6771 3.0373 3.0373 3.1156 3.1156 5.6606 5.6606 5.6722 5.6722 8.3108 8.3108 8.3546 8.3546 9.0114 9.0114 9.0511 9.0511 k = 0.2296 0.3977 0.2225 ( 12504 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9246 -19.9246 -19.9231 -19.9231 -19.8309 -19.8309 -19.8304 -19.8304 -19.7506 -19.7506 -19.7485 -19.7485 -19.7419 -19.7419 -19.7404 -19.7404 -19.6545 -19.6545 -19.6545 -19.6545 -19.6484 -19.6484 -19.6479 -19.6479 -9.8601 -9.8601 -9.8599 -9.8599 -7.0859 -7.0859 -7.0858 -7.0858 -0.1608 -0.1608 -0.1569 -0.1569 0.3302 0.3302 0.3309 0.3309 0.9065 0.9065 0.9161 0.9161 2.6301 2.6301 2.6868 2.6868 3.0616 3.0616 3.1343 3.1343 5.6573 5.6573 5.6686 5.6686 8.2526 8.2526 8.2946 8.2946 8.9541 8.9541 8.9924 8.9924 k = 0.2222 0.3849 0.2225 ( 12512 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9245 -19.9245 -19.9231 -19.9231 -19.8308 -19.8308 -19.8304 -19.8304 -19.7504 -19.7504 -19.7485 -19.7485 -19.7418 -19.7418 -19.7404 -19.7404 -19.6545 -19.6545 -19.6545 -19.6545 -19.6483 -19.6483 -19.6478 -19.6478 -9.8640 -9.8640 -9.8638 -9.8638 -7.0892 -7.0892 -7.0891 -7.0891 -0.1633 -0.1633 -0.1597 -0.1597 0.3463 0.3463 0.3471 0.3471 0.9378 0.9378 0.9468 0.9468 2.6464 2.6464 2.6985 2.6985 3.0858 3.0858 3.1534 3.1534 5.6538 5.6538 5.6649 5.6649 8.1917 8.1917 8.2316 8.2316 8.9037 8.9037 8.9402 8.9402 k = 0.2148 0.3721 0.2225 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9244 -19.9244 -19.9231 -19.9231 -19.8308 -19.8308 -19.8303 -19.8303 -19.7503 -19.7503 -19.7484 -19.7484 -19.7418 -19.7418 -19.7404 -19.7404 -19.6545 -19.6545 -19.6544 -19.6544 -19.6482 -19.6482 -19.6478 -19.6478 -9.8682 -9.8682 -9.8679 -9.8679 -7.0926 -7.0926 -7.0926 -7.0926 -0.1658 -0.1658 -0.1624 -0.1624 0.3654 0.3654 0.3662 0.3662 0.9686 0.9686 0.9771 0.9771 2.6643 2.6643 2.7123 2.7123 3.1100 3.1100 3.1728 3.1728 5.6502 5.6502 5.6609 5.6609 8.1278 8.1278 8.1653 8.1653 8.8607 8.8607 8.8951 8.8951 k = 0.2074 0.3592 0.2225 ( 12512 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9243 -19.9243 -19.9230 -19.9230 -19.8307 -19.8307 -19.8303 -19.8303 -19.7501 -19.7501 -19.7484 -19.7484 -19.7417 -19.7417 -19.7405 -19.7405 -19.6544 -19.6544 -19.6544 -19.6544 -19.6481 -19.6481 -19.6477 -19.6477 -9.8725 -9.8725 -9.8723 -9.8723 -7.0963 -7.0963 -7.0962 -7.0962 -0.1683 -0.1683 -0.1651 -0.1651 0.3874 0.3874 0.3883 0.3883 0.9990 0.9990 1.0069 1.0069 2.6840 2.6840 2.7280 2.7280 3.1342 3.1342 3.1923 3.1923 5.6462 5.6462 5.6566 5.6566 8.0611 8.0611 8.0958 8.0958 8.8251 8.8251 8.8572 8.8572 k = 0.2000 0.3464 0.2225 ( 12522 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9230 -19.9230 -19.8306 -19.8306 -19.8302 -19.8302 -19.7499 -19.7499 -19.7483 -19.7483 -19.7417 -19.7417 -19.7405 -19.7405 -19.6544 -19.6544 -19.6544 -19.6544 -19.6481 -19.6481 -19.6477 -19.6477 -9.8771 -9.8771 -9.8769 -9.8769 -7.1001 -7.1001 -7.1000 -7.1000 -0.1706 -0.1706 -0.1677 -0.1677 0.4123 0.4123 0.4132 0.4132 1.0287 1.0287 1.0361 1.0361 2.7053 2.7053 2.7457 2.7457 3.1582 3.1582 3.2119 3.2119 5.6418 5.6418 5.6518 5.6518 7.9916 7.9916 8.0234 8.0234 8.7969 8.7969 8.8264 8.8264 k = 0.1926 0.3336 0.2225 ( 12522 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9230 -19.9230 -19.8305 -19.8305 -19.8302 -19.8302 -19.7497 -19.7497 -19.7483 -19.7483 -19.7416 -19.7416 -19.7406 -19.7406 -19.6544 -19.6544 -19.6544 -19.6544 -19.6480 -19.6480 -19.6476 -19.6476 -9.8819 -9.8819 -9.8817 -9.8817 -7.1040 -7.1040 -7.1040 -7.1040 -0.1729 -0.1729 -0.1703 -0.1703 0.4400 0.4400 0.4409 0.4409 1.0578 1.0578 1.0647 1.0647 2.7282 2.7282 2.7653 2.7653 3.1820 3.1820 3.2316 3.2316 5.6368 5.6368 5.6465 5.6465 7.9197 7.9197 7.9486 7.9486 8.7755 8.7755 8.8026 8.8026 k = 0.1852 0.3208 0.2225 ( 12522 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9230 -19.9230 -19.8305 -19.8305 -19.8301 -19.8301 -19.7495 -19.7495 -19.7482 -19.7482 -19.7416 -19.7416 -19.7406 -19.7406 -19.6544 -19.6544 -19.6544 -19.6544 -19.6479 -19.6479 -19.6475 -19.6475 -9.8868 -9.8868 -9.8866 -9.8866 -7.1081 -7.1081 -7.1081 -7.1081 -0.1751 -0.1751 -0.1727 -0.1727 0.4703 0.4703 0.4712 0.4712 1.0862 1.0862 1.0926 1.0926 2.7527 2.7527 2.7866 2.7866 3.2055 3.2055 3.2511 3.2511 5.6312 5.6312 5.6404 5.6404 7.8458 7.8458 7.8719 7.8719 8.7606 8.7606 8.7853 8.7853 k = 0.1778 0.3079 0.2225 ( 12530 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9238 -19.9238 -19.9229 -19.9229 -19.8304 -19.8304 -19.8301 -19.8301 -19.7493 -19.7493 -19.7481 -19.7481 -19.7415 -19.7415 -19.7407 -19.7407 -19.6544 -19.6544 -19.6544 -19.6544 -19.6478 -19.6478 -19.6475 -19.6475 -9.8918 -9.8918 -9.8916 -9.8916 -7.1123 -7.1123 -7.1122 -7.1122 -0.1773 -0.1773 -0.1751 -0.1751 0.5033 0.5033 0.5041 0.5041 1.1138 1.1138 1.1197 1.1197 2.7788 2.7788 2.8097 2.8097 3.2286 3.2286 3.2706 3.2706 5.6246 5.6246 5.6334 5.6334 7.7705 7.7705 7.7940 7.7940 8.7515 8.7515 8.7740 8.7740 k = 0.1704 0.2951 0.2225 ( 12534 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9237 -19.9237 -19.9229 -19.9229 -19.8303 -19.8303 -19.8300 -19.8300 -19.7491 -19.7491 -19.7481 -19.7481 -19.7415 -19.7415 -19.7407 -19.7407 -19.6544 -19.6544 -19.6543 -19.6543 -19.6477 -19.6477 -19.6474 -19.6474 -9.8969 -9.8969 -9.8968 -9.8968 -7.1165 -7.1165 -7.1165 -7.1165 -0.1794 -0.1794 -0.1774 -0.1774 0.5386 0.5386 0.5394 0.5394 1.1405 1.1405 1.1459 1.1459 2.8063 2.8063 2.8344 2.8344 3.2514 3.2514 3.2898 3.2898 5.6169 5.6169 5.6252 5.6252 7.6944 7.6944 7.7153 7.7153 8.7476 8.7476 8.7680 8.7680 k = 0.1630 0.2823 0.2225 ( 12532 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9236 -19.9236 -19.9229 -19.9229 -19.8302 -19.8302 -19.8299 -19.8299 -19.7489 -19.7489 -19.7480 -19.7480 -19.7414 -19.7414 -19.7408 -19.7408 -19.6543 -19.6543 -19.6543 -19.6543 -19.6476 -19.6476 -19.6474 -19.6474 -9.9021 -9.9021 -9.9020 -9.9020 -7.1208 -7.1208 -7.1208 -7.1208 -0.1814 -0.1814 -0.1797 -0.1797 0.5763 0.5763 0.5770 0.5770 1.1663 1.1663 1.1713 1.1713 2.8351 2.8351 2.8606 2.8606 3.2738 3.2738 3.3087 3.3087 5.6078 5.6078 5.6156 5.6156 7.6181 7.6181 7.6367 7.6367 8.7481 8.7481 8.7667 8.7667 k = 0.1556 0.2694 0.2225 ( 12524 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9235 -19.9235 -19.9228 -19.9228 -19.8301 -19.8301 -19.8299 -19.8299 -19.7487 -19.7487 -19.7479 -19.7479 -19.7414 -19.7414 -19.7408 -19.7408 -19.6543 -19.6543 -19.6543 -19.6543 -19.6475 -19.6475 -19.6473 -19.6473 -9.9074 -9.9074 -9.9073 -9.9073 -7.1252 -7.1252 -7.1252 -7.1252 -0.1834 -0.1834 -0.1819 -0.1819 0.6160 0.6160 0.6166 0.6166 1.1912 1.1912 1.1958 1.1958 2.8652 2.8652 2.8883 2.8883 3.2957 3.2957 3.3274 3.3274 5.5971 5.5971 5.6043 5.6043 7.5421 7.5421 7.5586 7.5586 8.7521 8.7521 8.7690 8.7690 k = 0.1481 0.2566 0.2225 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9233 -19.9233 -19.9227 -19.9227 -19.8300 -19.8300 -19.8298 -19.8298 -19.7485 -19.7485 -19.7477 -19.7477 -19.7414 -19.7414 -19.7408 -19.7408 -19.6543 -19.6543 -19.6543 -19.6543 -19.6474 -19.6474 -19.6472 -19.6472 -9.9127 -9.9127 -9.9126 -9.9126 -7.1295 -7.1295 -7.1295 -7.1295 -0.1854 -0.1854 -0.1841 -0.1841 0.6576 0.6576 0.6581 0.6581 1.2152 1.2152 1.2193 1.2193 2.8963 2.8963 2.9171 2.9171 3.3171 3.3171 3.3456 3.3456 5.5845 5.5845 5.5912 5.5912 7.4672 7.4672 7.4817 7.4817 8.7585 8.7585 8.7739 8.7739 k = 0.1407 0.2438 0.2225 ( 12516 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9232 -19.9232 -19.9227 -19.9227 -19.8299 -19.8299 -19.8297 -19.8297 -19.7483 -19.7483 -19.7476 -19.7476 -19.7413 -19.7413 -19.7408 -19.7408 -19.6543 -19.6543 -19.6542 -19.6542 -19.6473 -19.6473 -19.6471 -19.6471 -9.9180 -9.9180 -9.9179 -9.9179 -7.1339 -7.1339 -7.1338 -7.1338 -0.1873 -0.1873 -0.1862 -0.1862 0.7008 0.7008 0.7012 0.7012 1.2382 1.2382 1.2419 1.2419 2.9285 2.9285 2.9471 2.9471 3.3379 3.3379 3.3635 3.3635 5.5697 5.5697 5.5758 5.5758 7.3939 7.3939 7.4066 7.4066 8.7658 8.7658 8.7799 8.7799 k = 0.1333 0.2309 0.2225 ( 12506 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9231 -19.9231 -19.9226 -19.9226 -19.8298 -19.8298 -19.8297 -19.8297 -19.7481 -19.7481 -19.7475 -19.7475 -19.7413 -19.7413 -19.7409 -19.7409 -19.6542 -19.6542 -19.6542 -19.6542 -19.6472 -19.6472 -19.6470 -19.6470 -9.9232 -9.9232 -9.9231 -9.9231 -7.1382 -7.1382 -7.1381 -7.1381 -0.1892 -0.1892 -0.1883 -0.1883 0.7454 0.7454 0.7457 0.7457 1.2602 1.2602 1.2636 1.2636 2.9613 2.9613 2.9779 2.9779 3.3583 3.3583 3.3810 3.3810 5.5525 5.5525 5.5581 5.5581 7.3227 7.3227 7.3338 7.3338 8.7720 8.7720 8.7848 8.7848 k = 0.1259 0.2181 0.2225 ( 12498 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9229 -19.9229 -19.9226 -19.9226 -19.8297 -19.8297 -19.8296 -19.8296 -19.7479 -19.7479 -19.7474 -19.7474 -19.7412 -19.7412 -19.7409 -19.7409 -19.6542 -19.6542 -19.6542 -19.6542 -19.6471 -19.6471 -19.6469 -19.6469 -9.9283 -9.9283 -9.9283 -9.9283 -7.1424 -7.1424 -7.1424 -7.1424 -0.1911 -0.1911 -0.1903 -0.1903 0.7910 0.7910 0.7913 0.7913 1.2813 1.2813 1.2843 1.2843 2.9947 2.9947 3.0093 3.0093 3.3780 3.3780 3.3981 3.3981 5.5327 5.5327 5.5377 5.5377 7.2544 7.2544 7.2639 7.2639 8.7746 8.7746 8.7861 8.7861 k = 0.1185 0.2053 0.2225 ( 12502 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9228 -19.9228 -19.9225 -19.9225 -19.8296 -19.8296 -19.8295 -19.8295 -19.7477 -19.7477 -19.7473 -19.7473 -19.7412 -19.7412 -19.7409 -19.7409 -19.6542 -19.6542 -19.6541 -19.6541 -19.6470 -19.6470 -19.6469 -19.6469 -9.9334 -9.9334 -9.9333 -9.9333 -7.1465 -7.1465 -7.1465 -7.1465 -0.1929 -0.1929 -0.1922 -0.1922 0.8374 0.8374 0.8375 0.8375 1.3015 1.3015 1.3042 1.3042 3.0284 3.0284 3.0411 3.0411 3.3973 3.3973 3.4148 3.4148 5.5102 5.5102 5.5145 5.5145 7.1894 7.1894 7.1974 7.1974 8.7704 8.7704 8.7805 8.7805 k = 0.1111 0.1925 0.2225 ( 12504 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9227 -19.9227 -19.9225 -19.9225 -19.8295 -19.8295 -19.8295 -19.8295 -19.7476 -19.7476 -19.7472 -19.7472 -19.7412 -19.7412 -19.7409 -19.7409 -19.6541 -19.6541 -19.6541 -19.6541 -19.6469 -19.6469 -19.6468 -19.6468 -9.9383 -9.9383 -9.9383 -9.9383 -7.1505 -7.1505 -7.1505 -7.1505 -0.1947 -0.1947 -0.1941 -0.1941 0.8840 0.8840 0.8841 0.8841 1.3208 1.3208 1.3232 1.3232 3.0620 3.0620 3.0730 3.0730 3.4161 3.4161 3.4311 3.4311 5.4848 5.4848 5.4885 5.4885 7.1281 7.1281 7.1349 7.1349 8.7566 8.7566 8.7650 8.7650 k = 0.1037 0.1796 0.2225 ( 12476 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9226 -19.9226 -19.9224 -19.9224 -19.8294 -19.8294 -19.8294 -19.8294 -19.7473 -19.7473 -19.7471 -19.7471 -19.7411 -19.7411 -19.7409 -19.7409 -19.6541 -19.6541 -19.6541 -19.6541 -19.6468 -19.6468 -19.6467 -19.6467 -9.9431 -9.9431 -9.9430 -9.9430 -7.1544 -7.1544 -7.1544 -7.1544 -0.1964 -0.1964 -0.1960 -0.1960 0.9305 0.9305 0.9306 0.9306 1.3394 1.3394 1.3415 1.3415 3.0954 3.0954 3.1046 3.1046 3.4344 3.4344 3.4471 3.4471 5.4566 5.4566 5.4597 5.4597 7.0711 7.0711 7.0767 7.0767 8.7318 8.7318 8.7385 8.7385 k = 0.0963 0.1668 0.2225 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9225 -19.9225 -19.9223 -19.9223 -19.8294 -19.8294 -19.8293 -19.8293 -19.7472 -19.7472 -19.7470 -19.7470 -19.7411 -19.7411 -19.7410 -19.7410 -19.6541 -19.6541 -19.6541 -19.6541 -19.6467 -19.6467 -19.6467 -19.6467 -9.9476 -9.9476 -9.9476 -9.9476 -7.1582 -7.1582 -7.1581 -7.1581 -0.1981 -0.1981 -0.1977 -0.1977 0.9764 0.9764 0.9765 0.9765 1.3573 1.3573 1.3591 1.3591 3.1280 3.1280 3.1357 3.1357 3.4522 3.4522 3.4628 3.4628 5.4257 5.4257 5.4283 5.4283 7.0186 7.0186 7.0231 7.0231 8.6968 8.6968 8.7020 8.7020 k = 0.0889 0.1540 0.2225 ( 12504 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9224 -19.9224 -19.9223 -19.9223 -19.8293 -19.8293 -19.8293 -19.8293 -19.7471 -19.7471 -19.7469 -19.7469 -19.7411 -19.7411 -19.7410 -19.7410 -19.6541 -19.6541 -19.6541 -19.6541 -19.6467 -19.6467 -19.6466 -19.6466 -9.9520 -9.9520 -9.9519 -9.9519 -7.1617 -7.1617 -7.1617 -7.1617 -0.1997 -0.1997 -0.1994 -0.1994 1.0211 1.0211 1.0212 1.0212 1.3746 1.3746 1.3762 1.3762 3.1595 3.1595 3.1657 3.1657 3.4697 3.4697 3.4783 3.4783 5.3925 5.3925 5.3945 5.3945 6.9708 6.9708 6.9744 6.9744 8.6543 8.6543 8.6582 8.6582 k = 0.0815 0.1411 0.2225 ( 12508 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9224 -19.9224 -19.9223 -19.9223 -19.8293 -19.8293 -19.8292 -19.8292 -19.7470 -19.7470 -19.7468 -19.7468 -19.7411 -19.7411 -19.7410 -19.7410 -19.6541 -19.6541 -19.6540 -19.6540 -19.6466 -19.6466 -19.6466 -19.6466 -9.9561 -9.9561 -9.9560 -9.9560 -7.1650 -7.1650 -7.1650 -7.1650 -0.2013 -0.2013 -0.2010 -0.2010 1.0641 1.0641 1.0643 1.0643 1.3915 1.3915 1.3928 1.3928 3.1896 3.1896 3.1945 3.1945 3.4868 3.4868 3.4936 3.4936 5.3574 5.3574 5.3590 5.3590 6.9278 6.9278 6.9306 6.9306 8.6070 8.6070 8.6099 8.6099 k = 0.0741 0.1283 0.2225 ( 12518 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9223 -19.9223 -19.9222 -19.9222 -19.8292 -19.8292 -19.8292 -19.8292 -19.7468 -19.7468 -19.7467 -19.7467 -19.7411 -19.7411 -19.7410 -19.7410 -19.6540 -19.6540 -19.6540 -19.6540 -19.6465 -19.6465 -19.6465 -19.6465 -9.9599 -9.9599 -9.9599 -9.9599 -7.1682 -7.1682 -7.1682 -7.1682 -0.2027 -0.2027 -0.2026 -0.2026 1.1048 1.1048 1.1049 1.1049 1.4082 1.4082 1.4093 1.4093 3.2178 3.2178 3.2215 3.2215 3.5035 3.5035 3.5087 3.5087 5.3210 5.3210 5.3222 5.3222 6.8896 6.8896 6.8917 6.8917 8.5578 8.5578 8.5599 8.5599 k = 0.0667 0.1155 0.2225 ( 12522 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9222 -19.9222 -19.8291 -19.8291 -19.8291 -19.8291 -19.7467 -19.7467 -19.7466 -19.7466 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6465 -19.6465 -19.6465 -19.6465 -9.9634 -9.9634 -9.9634 -9.9634 -7.1710 -7.1710 -7.1710 -7.1710 -0.2041 -0.2041 -0.2040 -0.2040 1.1424 1.1424 1.1426 1.1426 1.4247 1.4247 1.4255 1.4255 3.2438 3.2438 3.2465 3.2465 3.5198 3.5198 3.5236 3.5236 5.2841 5.2841 5.2850 5.2850 6.8560 6.8560 6.8576 6.8576 8.5086 8.5086 8.5101 8.5101 k = 0.0593 0.1026 0.2225 ( 12514 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9222 -19.9222 -19.9221 -19.9221 -19.8291 -19.8291 -19.8291 -19.8291 -19.7466 -19.7466 -19.7465 -19.7465 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6464 -19.6464 -19.6464 -19.6464 -9.9667 -9.9667 -9.9667 -9.9667 -7.1737 -7.1737 -7.1737 -7.1737 -0.2053 -0.2053 -0.2053 -0.2053 1.1766 1.1766 1.1767 1.1767 1.4411 1.4411 1.4417 1.4417 3.2672 3.2672 3.2691 3.2691 3.5356 3.5356 3.5382 3.5382 5.2475 5.2475 5.2482 5.2482 6.8270 6.8270 6.8281 6.8281 8.4612 8.4612 8.4622 8.4622 k = 0.0519 0.0898 0.2225 ( 12524 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8291 -19.8291 -19.8290 -19.8290 -19.7465 -19.7465 -19.7465 -19.7465 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6464 -19.6464 -19.6464 -19.6464 -9.9696 -9.9696 -9.9696 -9.9696 -7.1760 -7.1760 -7.1760 -7.1760 -0.2065 -0.2065 -0.2064 -0.2064 1.2067 1.2067 1.2068 1.2068 1.4573 1.4573 1.4577 1.4577 3.2880 3.2880 3.2892 3.2892 3.5506 3.5506 3.5524 3.5524 5.2122 5.2122 5.2126 5.2126 6.8022 6.8022 6.8030 6.8030 8.4167 8.4167 8.4174 8.4174 k = 0.0444 0.0770 0.2225 ( 12528 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8290 -19.8290 -19.8290 -19.8290 -19.7464 -19.7464 -19.7464 -19.7464 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9721 -9.9721 -9.9721 -9.9721 -7.1781 -7.1781 -7.1781 -7.1781 -0.2075 -0.2075 -0.2074 -0.2074 1.2324 1.2324 1.2325 1.2325 1.4731 1.4731 1.4734 1.4734 3.3058 3.3058 3.3066 3.3066 3.5647 3.5647 3.5658 3.5658 5.1791 5.1791 5.1794 5.1794 6.7814 6.7814 6.7819 6.7819 8.3763 8.3763 8.3767 8.3767 k = 0.0370 0.0642 0.2225 ( 12548 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9221 -19.9221 -19.8290 -19.8290 -19.8290 -19.8290 -19.7464 -19.7464 -19.7464 -19.7464 -19.7411 -19.7411 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9743 -9.9743 -9.9743 -9.9743 -7.1799 -7.1799 -7.1799 -7.1799 -0.2084 -0.2084 -0.2083 -0.2083 1.2537 1.2537 1.2538 1.2538 1.4881 1.4881 1.4883 1.4883 3.3208 3.3208 3.3212 3.3212 3.5775 3.5775 3.5781 3.5781 5.1491 5.1491 5.1493 5.1493 6.7644 6.7644 6.7646 6.7646 8.3407 8.3407 8.3409 8.3409 k = 0.0296 0.0513 0.2225 ( 12552 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9221 -19.9221 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9761 -9.9761 -9.9761 -9.9761 -7.1813 -7.1813 -7.1813 -7.1813 -0.2091 -0.2091 -0.2091 -0.2091 1.2706 1.2706 1.2706 1.2706 1.5017 1.5017 1.5018 1.5018 3.3328 3.3328 3.3330 3.3330 3.5887 3.5887 3.5890 3.5890 5.1232 5.1232 5.1233 5.1233 6.7508 6.7508 6.7509 6.7509 8.3106 8.3106 8.3107 8.3107 k = 0.0222 0.0385 0.2225 ( 12556 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7411 -19.7411 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9775 -9.9775 -9.9775 -9.9775 -7.1825 -7.1825 -7.1825 -7.1825 -0.2097 -0.2097 -0.2097 -0.2097 1.2833 1.2833 1.2834 1.2834 1.5131 1.5131 1.5132 1.5132 3.3420 3.3420 3.3421 3.3421 3.5978 3.5978 3.5980 3.5980 5.1021 5.1021 5.1021 5.1021 6.7405 6.7405 6.7405 6.7405 8.2867 8.2867 8.2867 8.2867 k = 0.0148 0.0257 0.2225 ( 12572 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6463 -19.6463 -19.6463 -19.6463 -9.9785 -9.9785 -9.9785 -9.9785 -7.1833 -7.1833 -7.1833 -7.1833 -0.2101 -0.2101 -0.2101 -0.2101 1.2922 1.2922 1.2922 1.2922 1.5219 1.5219 1.5219 1.5219 3.3485 3.3485 3.3485 3.3485 3.6047 3.6047 3.6047 3.6047 5.0865 5.0865 5.0865 5.0865 6.7332 6.7332 6.7332 6.7332 8.2693 8.2693 8.2693 8.2693 k = 0.0074 0.0128 0.2225 ( 12572 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8290 -19.8290 -19.8290 -19.8290 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9792 -9.9792 -9.9792 -9.9792 -7.1838 -7.1838 -7.1838 -7.1838 -0.2103 -0.2103 -0.2103 -0.2103 1.2974 1.2974 1.2974 1.2974 1.5273 1.5273 1.5274 1.5274 3.3523 3.3523 3.3523 3.3523 3.6089 3.6089 3.6089 3.6089 5.0769 5.0769 5.0769 5.0769 6.7289 6.7289 6.7289 6.7289 8.2587 8.2587 8.2587 8.2587 k = 0.0000 0.0000 0.2225 ( 12556 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7827 -47.7827 -47.7827 -47.7827 -19.9220 -19.9220 -19.9220 -19.9220 -19.8289 -19.8289 -19.8289 -19.8289 -19.7463 -19.7463 -19.7463 -19.7463 -19.7412 -19.7412 -19.7412 -19.7412 -19.6540 -19.6540 -19.6540 -19.6540 -19.6462 -19.6462 -19.6462 -19.6462 -9.9794 -9.9794 -9.9794 -9.9794 -7.1840 -7.1840 -7.1840 -7.1840 -0.2104 -0.2104 -0.2104 -0.2104 1.2991 1.2991 1.2991 1.2991 1.5292 1.5292 1.5292 1.5292 3.3536 3.3536 3.3536 3.3536 3.6103 3.6103 3.6103 3.6103 5.0737 5.0737 5.0737 5.0737 6.7275 6.7275 6.7275 6.7275 8.2551 8.2551 8.2551 8.2551 k = 0.5000 0.2887 0.2225 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8308 -19.8308 -19.8308 -19.8308 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8502 -9.8502 -9.8502 -9.8502 -7.0781 -7.0781 -7.0781 -7.0781 -0.1695 -0.1695 -0.1695 -0.1695 0.1012 0.1012 0.1012 0.1012 1.1463 1.1463 1.1463 1.1463 2.4935 2.4935 2.4935 2.4935 3.2469 3.2469 3.2469 3.2469 5.5573 5.5573 5.5573 5.5573 7.3982 7.3982 7.3982 7.3982 9.1854 9.1854 9.1854 9.1854 k = 0.5000 0.2887 0.2076 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9240 -19.9240 -19.8308 -19.8308 -19.8307 -19.8307 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6546 -19.6546 -19.6546 -19.6546 -19.6481 -19.6481 -19.6481 -19.6481 -9.8530 -9.8530 -9.8474 -9.8474 -7.0862 -7.0862 -7.0700 -7.0700 -0.1805 -0.1805 -0.1723 -0.1723 0.1050 0.1050 0.1149 0.1149 1.1257 1.1257 1.1677 1.1677 2.4552 2.4552 2.5250 2.5250 3.2029 3.2029 3.2906 3.2906 5.5331 5.5331 5.5890 5.5890 7.3442 7.3442 7.4509 7.4509 9.1136 9.1136 9.2602 9.2602 k = 0.5000 0.2887 0.1928 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9240 -19.9240 -19.9239 -19.9239 -19.8309 -19.8309 -19.8307 -19.8307 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6547 -19.6547 -19.6545 -19.6545 -19.6482 -19.6482 -19.6481 -19.6481 -9.8557 -9.8557 -9.8447 -9.8447 -7.0942 -7.0942 -7.0619 -7.0619 -0.2031 -0.2031 -0.1867 -0.1867 0.1243 0.1243 0.1432 0.1432 1.1061 1.1061 1.1897 1.1897 2.4109 2.4109 2.5493 2.5493 3.1591 3.1591 3.3337 3.3337 5.5169 5.5169 5.6277 5.6277 7.2906 7.2906 7.5007 7.5007 9.0478 9.0478 9.3346 9.3346 k = 0.5000 0.2887 0.1780 ( 12476 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9239 -19.9239 -19.8309 -19.8309 -19.8306 -19.8306 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7410 -19.7410 -19.6547 -19.6547 -19.6545 -19.6545 -19.6482 -19.6482 -19.6480 -19.6480 -9.8583 -9.8583 -9.8420 -9.8420 -7.1020 -7.1020 -7.0540 -7.0540 -0.2326 -0.2326 -0.2079 -0.2079 0.1546 0.1546 0.1811 0.1811 1.0875 1.0875 1.2121 1.2121 2.3616 2.3616 2.5661 2.5661 3.1159 3.1159 3.3757 3.3757 5.5091 5.5091 5.6723 5.6723 7.2383 7.2383 7.5452 7.5452 8.9911 8.9911 9.4040 9.4040 k = 0.5000 0.2887 0.1631 ( 12454 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9239 -19.9239 -19.8309 -19.8309 -19.8305 -19.8305 -19.7498 -19.7498 -19.7498 -19.7498 -19.7410 -19.7410 -19.7409 -19.7409 -19.6547 -19.6547 -19.6544 -19.6544 -19.6482 -19.6482 -19.6480 -19.6480 -9.8609 -9.8609 -9.8394 -9.8394 -7.1096 -7.1096 -7.0464 -7.0464 -0.2650 -0.2650 -0.2322 -0.2322 0.1916 0.1916 0.2245 0.2245 1.0702 1.0702 1.2346 1.2346 2.3083 2.3083 2.5754 2.5754 3.0737 3.0737 3.4163 3.4163 5.5093 5.5093 5.7219 5.7219 7.1882 7.1882 7.5819 7.5819 8.9465 8.9465 9.4620 9.4620 k = 0.5000 0.2887 0.1483 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9239 -19.9239 -19.8310 -19.8310 -19.8305 -19.8305 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6547 -19.6547 -19.6544 -19.6544 -19.6483 -19.6483 -19.6480 -19.6480 -9.8633 -9.8633 -9.8369 -9.8369 -7.1167 -7.1167 -7.0390 -7.0390 -0.2979 -0.2979 -0.2571 -0.2571 0.2327 0.2327 0.2708 0.2708 1.0542 1.0542 1.2570 1.2570 2.2521 2.2521 2.5777 2.5777 3.0329 3.0329 3.4549 3.4549 5.5172 5.5172 5.7753 5.7753 7.1409 7.1409 7.6083 7.6083 8.9169 8.9169 9.4989 9.4989 k = 0.5000 0.2887 0.1335 ( 12476 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9241 -19.9241 -19.9238 -19.9238 -19.8311 -19.8311 -19.8305 -19.8305 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6544 -19.6544 -19.6483 -19.6483 -19.6480 -19.6480 -9.8656 -9.8656 -9.8345 -9.8345 -7.1235 -7.1235 -7.0321 -7.0321 -0.3298 -0.3298 -0.2813 -0.2813 0.2760 0.2760 0.3181 0.3181 1.0397 1.0397 1.2790 1.2790 2.1944 2.1944 2.5738 2.5738 2.9938 2.9938 3.4912 3.4912 5.5317 5.5317 5.8314 5.8314 7.0969 7.0969 7.6225 7.6225 8.9040 8.9040 9.5040 9.5040 k = 0.5000 0.2887 0.1186 ( 12470 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8311 -19.8311 -19.8304 -19.8304 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6544 -19.6544 -19.6483 -19.6483 -19.6480 -19.6480 -9.8677 -9.8677 -9.8323 -9.8323 -7.1297 -7.1297 -7.0257 -7.0257 -0.3598 -0.3598 -0.3041 -0.3041 0.3202 0.3202 0.3648 0.3648 1.0268 1.0268 1.3003 1.3003 2.1363 2.1363 2.5647 2.5647 2.9570 2.9570 3.5249 3.5249 5.5518 5.5518 5.8888 5.8888 7.0566 7.0566 7.6238 7.6238 8.9087 8.9087 9.4740 9.4740 k = 0.5000 0.2887 0.1038 ( 12474 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8311 -19.8311 -19.8304 -19.8304 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8696 -9.8696 -9.8303 -9.8303 -7.1354 -7.1354 -7.0199 -7.0199 -0.3871 -0.3871 -0.3248 -0.3248 0.3639 0.3639 0.4097 0.4097 1.0154 1.0154 1.3204 1.3204 2.0792 2.0792 2.5517 2.5517 2.9227 2.9227 3.5556 3.5556 5.5760 5.5760 5.9462 5.9462 7.0203 7.0203 7.6131 7.6131 8.9294 8.9294 9.4184 9.4184 k = 0.5000 0.2887 0.0890 ( 12474 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8312 -19.8312 -19.8304 -19.8304 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6548 -19.6548 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8713 -9.8713 -9.8285 -9.8285 -7.1404 -7.1404 -7.0147 -7.0147 -0.4115 -0.4115 -0.3432 -0.3432 0.4060 0.4060 0.4516 0.4516 1.0057 1.0057 1.3390 1.3390 2.0247 2.0247 2.5363 2.5363 2.8915 2.8915 3.5829 3.5829 5.6024 5.6024 6.0020 6.0020 6.9882 6.9882 7.5927 7.5927 8.9634 8.9634 9.3514 9.3514 k = 0.5000 0.2887 0.0742 ( 12484 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8312 -19.8312 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8728 -9.8728 -9.8270 -9.8270 -7.1448 -7.1448 -7.0102 -7.0102 -0.4325 -0.4325 -0.3590 -0.3590 0.4452 0.4452 0.4895 0.4895 0.9977 0.9977 1.3557 1.3557 1.9742 1.9742 2.5199 2.5199 2.8638 2.8638 3.6065 3.6065 5.6293 5.6293 6.0546 6.0546 6.9605 6.9605 7.5661 7.5661 9.0061 9.0061 9.2838 9.2838 k = 0.5000 0.2887 0.0593 ( 12478 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8312 -19.8312 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7408 -19.7408 -19.6549 -19.6549 -19.6543 -19.6543 -19.6483 -19.6483 -19.6479 -19.6479 -9.8740 -9.8740 -9.8257 -9.8257 -7.1484 -7.1484 -7.0064 -7.0064 -0.4500 -0.4500 -0.3721 -0.3721 0.4801 0.4801 0.5223 0.5223 0.9915 0.9915 1.3701 1.3701 1.9294 1.9294 2.5041 2.5041 2.8402 2.8402 3.6263 3.6263 5.6547 5.6547 6.1019 6.1019 6.9375 6.9375 7.5371 7.5371 9.0523 9.0523 9.2223 9.2223 k = 0.5000 0.2887 0.0445 ( 12474 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7408 -19.7408 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8749 -9.8749 -9.8247 -9.8247 -7.1513 -7.1513 -7.0034 -7.0034 -0.4637 -0.4637 -0.3824 -0.3824 0.5094 0.5094 0.5490 0.5490 0.9868 0.9868 1.3817 1.3817 1.8921 1.8921 2.4902 2.4902 2.8212 2.8212 3.6419 3.6419 5.6768 5.6768 6.1419 6.1419 6.9192 6.9192 7.5095 7.5095 9.0955 9.0955 9.1724 9.1724 k = 0.5000 0.2887 0.0297 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8756 -9.8756 -9.8239 -9.8239 -7.1533 -7.1533 -7.0013 -7.0013 -0.4736 -0.4736 -0.3898 -0.3898 0.5316 0.5316 0.5686 0.5686 0.9837 0.9837 1.3903 1.3903 1.8639 1.8639 2.4793 2.4793 2.8073 2.8073 3.6532 3.6532 5.6939 5.6939 6.1725 6.1725 6.9061 6.9061 7.4868 7.4868 9.1176 9.1176 9.1491 9.1491 k = 0.5000 0.2887 0.0148 ( 12472 PWs) bands (ev): -47.8703 -47.8703 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9237 -19.9237 -19.8313 -19.8313 -19.8302 -19.8302 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7408 -19.7408 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8761 -9.8761 -9.8235 -9.8235 -7.1546 -7.1546 -7.0000 -7.0000 -0.4796 -0.4796 -0.3943 -0.3943 0.5455 0.5455 0.5807 0.5807 0.9819 0.9819 1.3956 1.3956 1.8464 1.8464 2.4723 2.4723 2.7987 2.7987 3.6600 3.6600 5.7048 5.7048 6.1918 6.1918 6.8981 6.8981 7.4718 7.4718 9.1023 9.1023 9.1655 9.1655 k = 0.5000 0.2887-0.0000 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9242 -19.9242 -19.9238 -19.9238 -19.8313 -19.8313 -19.8303 -19.8303 -19.7499 -19.7499 -19.7498 -19.7498 -19.7411 -19.7411 -19.7409 -19.7409 -19.6549 -19.6549 -19.6543 -19.6543 -19.6484 -19.6484 -19.6479 -19.6479 -9.8762 -9.8762 -9.8233 -9.8233 -7.1550 -7.1550 -6.9995 -6.9995 -0.4816 -0.4816 -0.3957 -0.3957 0.5502 0.5502 0.5848 0.5848 0.9813 0.9813 1.3974 1.3974 1.8404 1.8404 2.4699 2.4699 2.7959 2.7959 3.6623 3.6623 5.7085 5.7085 6.1984 6.1984 6.8954 6.8954 7.4666 7.4666 9.0951 9.0951 9.1734 9.1734 k = 0.3333 0.5774-0.0000 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0636 -7.0636 -7.0635 -7.0635 -0.3208 -0.3208 -0.2809 -0.2809 0.1990 0.1990 0.7551 0.7551 0.8432 0.8432 0.8964 0.8964 1.9512 1.9512 2.4000 2.4000 2.5726 2.5726 3.2617 3.2617 6.0686 6.0686 6.1150 6.1150 8.5020 8.5020 9.1840 9.1840 9.2899 9.2899 9.4333 9.4333 k = 0.3333 0.5774 0.0148 ( 12492 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8307 -19.8307 -19.7518 -19.7518 -19.7486 -19.7486 -19.7424 -19.7424 -19.7400 -19.7400 -19.6546 -19.6546 -19.6545 -19.6545 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0636 -7.0636 -7.0635 -7.0635 -0.3193 -0.3193 -0.2796 -0.2796 0.2000 0.2000 0.7512 0.7512 0.8400 0.8400 0.8927 0.8927 1.9559 1.9559 2.4042 2.4042 2.5770 2.5770 3.2584 3.2584 6.0644 6.0644 6.1105 6.1105 8.5048 8.5048 9.1874 9.1874 9.2873 9.2873 9.4377 9.4377 k = 0.3333 0.5774 0.0297 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0636 -7.0636 -7.0635 -7.0635 -0.3150 -0.3150 -0.2758 -0.2758 0.2031 0.2031 0.7395 0.7395 0.8306 0.8306 0.8816 0.8816 1.9697 1.9697 2.4166 2.4166 2.5900 2.5900 3.2483 3.2483 6.0520 6.0520 6.0971 6.0971 8.5130 8.5130 9.1973 9.1973 9.2797 9.2797 9.4507 9.4507 k = 0.3333 0.5774 0.0445 ( 12462 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0637 -7.0637 -7.0635 -7.0635 -0.3079 -0.3079 -0.2695 -0.2695 0.2082 0.2082 0.7207 0.7207 0.8155 0.8155 0.8639 0.8639 1.9921 1.9921 2.4365 2.4365 2.6110 2.6110 3.2317 3.2317 6.0320 6.0320 6.0754 6.0754 8.5264 8.5264 9.2129 9.2129 9.2684 9.2684 9.4716 9.4716 k = 0.3333 0.5774 0.0593 ( 12456 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8312 -19.8312 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0637 -7.0637 -7.0635 -7.0635 -0.2980 -0.2980 -0.2609 -0.2609 0.2153 0.2153 0.6957 0.6957 0.7956 0.7956 0.8403 0.8403 2.0223 2.0223 2.4628 2.4628 2.6387 2.6387 3.2089 3.2089 6.0052 6.0052 6.0465 6.0465 8.5444 8.5444 9.2271 9.2271 9.2614 9.2614 9.4992 9.4992 k = 0.3333 0.5774 0.0742 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0637 -7.0637 -7.0636 -7.0636 -0.2857 -0.2857 -0.2502 -0.2502 0.2244 0.2244 0.6656 0.6656 0.7717 0.7717 0.8119 0.8119 2.0594 2.0594 2.4943 2.4943 2.6718 2.6718 3.1801 3.1801 5.9731 5.9731 6.0117 6.0117 8.5665 8.5665 9.2174 9.2174 9.2815 9.2815 9.5321 9.5321 k = 0.3333 0.5774 0.0890 ( 12480 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8313 -19.8313 -19.8306 -19.8306 -19.7518 -19.7518 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6546 -19.6546 -19.6544 -19.6544 -19.6488 -19.6488 -19.6483 -19.6483 -9.8345 -9.8345 -9.8341 -9.8341 -7.0638 -7.0638 -7.0636 -7.0636 -0.2710 -0.2710 -0.2375 -0.2375 0.2354 0.2354 0.6316 0.6316 0.7448 0.7448 0.7801 0.7801 2.1025 2.1025 2.5293 2.5293 2.7088 2.7088 3.1459 3.1459 5.9369 5.9369 5.9725 5.9725 8.5920 8.5920 9.1945 9.1945 9.3190 9.3190 9.5686 9.5686 k = 0.3333 0.5774 0.1038 ( 12468 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7486 -19.7486 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6482 -19.6482 -9.8345 -9.8345 -9.8340 -9.8340 -7.0638 -7.0638 -7.0637 -7.0637 -0.2543 -0.2543 -0.2234 -0.2234 0.2482 0.2482 0.5951 0.5951 0.7158 0.7158 0.7460 0.7460 2.1504 2.1504 2.5664 2.5664 2.7479 2.7479 3.1068 3.1068 5.8984 5.8984 5.9307 5.9307 8.6203 8.6203 9.1671 9.1671 9.3655 9.3655 9.6069 9.6069 k = 0.3333 0.5774 0.1186 ( 12459 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6488 -19.6488 -19.6482 -19.6482 -9.8345 -9.8345 -9.8340 -9.8340 -7.0639 -7.0639 -7.0637 -7.0637 -0.2360 -0.2360 -0.2081 -0.2081 0.2627 0.2627 0.5572 0.5572 0.6857 0.6857 0.7111 0.7111 2.2024 2.2024 2.6040 2.6040 2.7874 2.7874 3.0634 3.0634 5.8591 5.8591 5.8880 5.8880 8.6506 8.6506 9.1371 9.1371 9.4197 9.4197 9.6454 9.6454 k = 0.3333 0.5774 0.1335 ( 12462 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6488 -19.6488 -19.6482 -19.6482 -9.8345 -9.8345 -9.8340 -9.8340 -7.0639 -7.0639 -7.0638 -7.0638 -0.2167 -0.2167 -0.1922 -0.1922 0.2786 0.2786 0.5194 0.5194 0.6552 0.6552 0.6766 0.6766 2.2574 2.2574 2.6404 2.6404 2.8252 2.8252 3.0168 3.0168 5.8207 5.8207 5.8461 5.8461 8.6824 8.6824 9.1052 9.1052 9.4808 9.4808 9.6825 9.6825 k = 0.3333 0.5774 0.1483 ( 12456 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6489 -19.6489 -19.6482 -19.6482 -9.8345 -9.8345 -9.8340 -9.8340 -7.0639 -7.0639 -7.0638 -7.0638 -0.1971 -0.1971 -0.1765 -0.1765 0.2957 0.2957 0.4831 0.4831 0.6251 0.6251 0.6440 0.6440 2.3146 2.3146 2.6743 2.6743 2.8583 2.8583 2.9692 2.9692 5.7848 5.7848 5.8070 5.8070 8.7152 8.7152 9.0721 9.0721 9.5481 9.5481 9.7167 9.7167 k = 0.3333 0.5774 0.1631 ( 12450 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8305 -19.8305 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6489 -19.6489 -19.6482 -19.6482 -9.8344 -9.8344 -9.8340 -9.8340 -7.0640 -7.0640 -7.0638 -7.0638 -0.1782 -0.1782 -0.1618 -0.1618 0.3135 0.3135 0.4498 0.4498 0.5963 0.5963 0.6145 0.6145 2.3730 2.3730 2.7042 2.7042 2.8749 2.8749 2.9318 2.9318 5.7530 5.7530 5.7722 5.7722 8.7486 8.7486 9.0382 9.0382 9.6206 9.6206 9.7469 9.7469 k = 0.3333 0.5774 0.1780 ( 12456 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8305 -19.8305 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6544 -19.6544 -19.6489 -19.6489 -19.6481 -19.6481 -9.8344 -9.8344 -9.8340 -9.8340 -7.0640 -7.0640 -7.0639 -7.0639 -0.1611 -0.1611 -0.1488 -0.1488 0.3310 0.3310 0.4211 0.4211 0.5699 0.5699 0.5897 0.5897 2.4310 2.4310 2.7289 2.7289 2.8446 2.8446 2.9348 2.9348 5.7267 5.7267 5.7434 5.7434 8.7822 8.7822 9.0041 9.0041 9.6969 9.6969 9.7718 9.7718 k = 0.3333 0.5774 0.1928 ( 12462 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9230 -19.9230 -19.8313 -19.8313 -19.8305 -19.8305 -19.7517 -19.7517 -19.7485 -19.7485 -19.7423 -19.7423 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8344 -9.8344 -9.8340 -9.8340 -7.0640 -7.0640 -7.0639 -7.0639 -0.1474 -0.1474 -0.1387 -0.1387 0.3470 0.3470 0.3988 0.3988 0.5474 0.5474 0.5709 0.5709 2.4861 2.4861 2.7474 2.7474 2.7968 2.7968 2.9505 2.9505 5.7070 5.7070 5.7218 5.7218 8.8152 8.8152 8.9705 8.9705 9.7754 9.7754 9.7905 9.7905 k = 0.3333 0.5774 0.2076 ( 12474 PWs) bands (ev): -47.8702 -47.8702 -47.8702 -47.8702 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7517 -19.7517 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6481 -19.6481 -9.8344 -9.8344 -9.8340 -9.8340 -7.0641 -7.0641 -7.0639 -7.0639 -0.1383 -0.1383 -0.1322 -0.1322 0.3587 0.3587 0.3846 0.3846 0.5317 0.5317 0.5591 0.5591 2.5319 2.5319 2.7540 2.7540 2.7588 2.7588 2.9616 2.9616 5.6948 5.6948 5.7084 5.7084 8.8454 8.8454 8.9400 8.9400 9.8021 9.8021 9.8528 9.8528 k = 0.3333 0.5774 0.2225 ( 12486 PWs) bands (ev): -47.8703 -47.8703 -47.8703 -47.8703 -47.7826 -47.7826 -47.7826 -47.7826 -19.9254 -19.9254 -19.9231 -19.9231 -19.8314 -19.8314 -19.8306 -19.8306 -19.7518 -19.7518 -19.7485 -19.7485 -19.7424 -19.7424 -19.7400 -19.7400 -19.6545 -19.6545 -19.6545 -19.6545 -19.6489 -19.6489 -19.6482 -19.6482 -9.8344 -9.8344 -9.8340 -9.8340 -7.0641 -7.0641 -7.0639 -7.0639 -0.1352 -0.1352 -0.1299 -0.1299 0.3632 0.3632 0.3797 0.3797 0.5258 0.5258 0.5551 0.5551 2.5522 2.5522 2.7346 2.7346 2.7626 2.7626 2.9654 2.9654 5.6907 5.6907 5.7038 5.7038 8.8616 8.8616 8.9237 8.9237 9.8060 9.8060 9.8765 9.8765 Writing output data file NaSe.save init_run : 2.56s CPU 2.69s WALL ( 1 calls) electrons : 554.68s CPU 558.77s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.04s CPU 0.08s WALL ( 1 calls) Called by electrons: c_bands : 554.68s CPU 558.76s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.01s CPU 0.01s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.08s CPU 0.07s WALL ( 268 calls) cegterg : 514.69s CPU 518.03s WALL ( 369 calls) Called by sum_band: Called by *egterg: h_psi : 323.14s CPU 326.17s WALL ( 6032 calls) s_psi : 3.88s CPU 3.97s WALL ( 6032 calls) g_psi : 0.31s CPU 0.35s WALL ( 5395 calls) cdiaghg : 177.42s CPU 177.82s WALL ( 5663 calls) cegterg:over : 19.00s CPU 19.34s WALL ( 5395 calls) cegterg:upda : 11.91s CPU 11.95s WALL ( 5395 calls) cegterg:last : 7.92s CPU 7.93s WALL ( 905 calls) cdiaghg:chol : 5.97s CPU 6.11s WALL ( 5663 calls) cdiaghg:inve : 4.88s CPU 4.75s WALL ( 5663 calls) cdiaghg:para : 16.32s CPU 16.41s WALL ( 11326 calls) Called by h_psi: h_psi:vloc : 312.40s CPU 315.21s WALL ( 6032 calls) h_psi:vnl : 10.40s CPU 10.59s WALL ( 6032 calls) add_vuspsi : 3.59s CPU 3.68s WALL ( 6032 calls) General routines calbec : 6.79s CPU 6.89s WALL ( 6032 calls) fft : 0.00s CPU 0.02s WALL ( 19 calls) ffts : 0.01s CPU 0.00s WALL ( 4 calls) fftw : 306.82s CPU 309.66s WALL ( 780576 calls) interpolate : 0.01s CPU 0.01s WALL ( 4 calls) davcio : 0.22s CPU 0.31s WALL ( 536 calls) Parallel routines fft_scatter : 249.84s CPU 251.79s WALL ( 780599 calls) PWSCF : 10m41.98s CPU 11m 7.12s WALL This run was terminated on: 8: 4: 9 1Feb2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=