Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19: 7:17 This program is part of the open-source Quantum ESPRESSO suite for quantum simulation of materials; please cite "P. Giannozzi et al., J. Phys.:Condens. Matter 21 395502 (2009); URL http://www.quantum-espresso.org", in publications or presentations arising from this work. More details at http://www.quantum-espresso.org/quote Parallel version (MPI), running on 36 processors R & G space division: proc/nbgrp/npool/nimage = 36 Waiting for input... Reading input from standard input Current dimensions of program PWSCF are: Max number of different atomic species (ntypx) = 10 Max number of k-points (npk) = 40000 Max angular momentum in pseudopotentials (lmaxx) = 3 Atomic positions and unit cell read from directory: ./HfGeSe.save/ Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 28 20 6 1530 933 154 Max 30 21 7 1536 955 159 Sum 1033 749 221 55177 33905 5601 bravais-lattice index = 14 lattice parameter (alat) = 6.9731 a.u. unit-cell volume = 753.4650 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 48.0000 Ry charge density cutoff = 266.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.973089 celldm(2)= 1.000000 celldm(3)= 2.222222 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= 0.000000 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( 0.000000 1.000000 0.000000 ) a(3) = ( 0.000000 0.000000 2.222222 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 -0.000000 -0.000000 ) b(2) = ( 0.000000 1.000000 -0.000000 ) b(3) = ( 0.000000 0.000000 0.450000 ) PseudoPot. # 1 for Ge read from file: /users/gautes/Pseudo/Ge.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 069ab8842bb693aa9ce6e533f48e0b78 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1207 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 Hf read from file: /users/gautes/Pseudo/Hf.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: fb4a78a955dff820df95c575f14a6778 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1271 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for 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 atomic species valence mass pseudopotential Ge 4.00 72.64000 Ge( 1.00) Hf 12.00 178.49000 Hf( 1.00) Se 6.00 78.96000 Se( 1.00) 16 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 =( 0.5000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 3) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 5 180 deg rotation - cart. axis [1,1,0] cryst. s( 5) = ( 0 1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s( 5) = ( 0.0000000 1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 6 180 deg rotation - cart. axis [1,-1,0] cryst. s( 6) = ( 0 -1 0 ) f =( -0.5000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s( 6) = ( -0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) f =( 0.5000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) f =( 0.0000000 ) ( -1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(10) = ( 1.0000000 -0.0000000 -0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) f =( 0.5000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) f =( 0.5000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 13 inv. 180 deg rotation - cart. axis [1,1,0] cryst. s(13) = ( 0 -1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s(13) = ( -0.0000000 -1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [1,-1,0] cryst. s(14) = ( 0 1 0 ) f =( 0.5000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 1 ) ( 0.0000000 ) cart. s(14) = ( 0.0000000 1.0000000 -0.0000000 ) f =( 0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) f =( -0.5000000 ) ( -1 0 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(15) = ( 0.0000000 -1.0000000 0.0000000 ) f =( -0.5000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) f =( 0.0000000 ) ( 1 0 0 ) ( -0.5000000 ) ( 0 0 -1 ) ( 0.0000000 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) f =( -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( -0.5000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [0,0,-1] -2C4 -7 -8 90 deg rotation - cart. axis [0,0,-1] E C2 -C2 2 -2 180 deg rotation - cart. axis [0,0,1] 2C2'-2C2' 3 -3 4 -4 180 deg rotation - cart. axis [0,1,0] 2C2''-2C2' 5 -5 6 -6 180 deg rotation - cart. axis [1,1,0] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [0,0,-1] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [0,0,-1] E s_h -s_h 10 -10 inv. 180 deg rotation - cart. axis [0,0,1] 2s_v-2s_v 11 -11 12 -12 inv. 180 deg rotation - cart. axis [0,1,0] 2s_d-2s_d 13 -13 14 -14 inv. 180 deg rotation - cart. axis [1,1,0] Cartesian axes number of k points= 363 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 2) = ( 0.0000000 0.0116279 -0.0000000), wk = 0.0027548 k( 3) = ( 0.0000000 0.0232558 -0.0000000), wk = 0.0027548 k( 4) = ( 0.0000000 0.0348837 -0.0000000), wk = 0.0027548 k( 5) = ( 0.0000000 0.0465116 -0.0000000), wk = 0.0027548 k( 6) = ( 0.0000000 0.0581395 -0.0000000), wk = 0.0027548 k( 7) = ( 0.0000000 0.0697674 -0.0000000), wk = 0.0027548 k( 8) = ( 0.0000000 0.0813954 -0.0000000), wk = 0.0027548 k( 9) = ( 0.0000000 0.0930233 -0.0000000), wk = 0.0027548 k( 10) = ( 0.0000000 0.1046512 -0.0000000), wk = 0.0027548 k( 11) = ( 0.0000000 0.1162791 -0.0000000), wk = 0.0027548 k( 12) = ( 0.0000000 0.1279070 -0.0000000), wk = 0.0027548 k( 13) = ( 0.0000000 0.1395349 -0.0000000), wk = 0.0027548 k( 14) = ( 0.0000000 0.1511628 -0.0000000), wk = 0.0027548 k( 15) = ( 0.0000000 0.1627907 -0.0000000), wk = 0.0027548 k( 16) = ( 0.0000000 0.1744186 -0.0000000), wk = 0.0027548 k( 17) = ( 0.0000000 0.1860465 -0.0000000), wk = 0.0027548 k( 18) = ( 0.0000000 0.1976744 -0.0000000), wk = 0.0027548 k( 19) = ( 0.0000000 0.2093023 -0.0000000), wk = 0.0027548 k( 20) = ( 0.0000000 0.2209302 -0.0000000), wk = 0.0027548 k( 21) = ( 0.0000000 0.2325581 -0.0000000), wk = 0.0027548 k( 22) = ( 0.0000000 0.2441860 -0.0000000), wk = 0.0027548 k( 23) = ( 0.0000000 0.2558140 -0.0000000), wk = 0.0027548 k( 24) = ( 0.0000000 0.2674419 -0.0000000), wk = 0.0027548 k( 25) = ( 0.0000000 0.2790698 -0.0000000), wk = 0.0027548 k( 26) = ( 0.0000000 0.2906977 -0.0000000), wk = 0.0027548 k( 27) = ( 0.0000000 0.3023256 -0.0000000), wk = 0.0027548 k( 28) = ( 0.0000000 0.3139535 -0.0000000), wk = 0.0027548 k( 29) = ( 0.0000000 0.3255814 -0.0000000), wk = 0.0027548 k( 30) = ( 0.0000000 0.3372093 -0.0000000), wk = 0.0027548 k( 31) = ( 0.0000000 0.3488372 -0.0000000), wk = 0.0027548 k( 32) = ( 0.0000000 0.3604651 -0.0000000), wk = 0.0027548 k( 33) = ( 0.0000000 0.3720930 -0.0000000), wk = 0.0027548 k( 34) = ( 0.0000000 0.3837209 -0.0000000), wk = 0.0027548 k( 35) = ( 0.0000000 0.3953488 -0.0000000), wk = 0.0027548 k( 36) = ( 0.0000000 0.4069767 -0.0000000), wk = 0.0027548 k( 37) = ( 0.0000000 0.4186047 -0.0000000), wk = 0.0027548 k( 38) = ( 0.0000000 0.4302326 -0.0000000), wk = 0.0027548 k( 39) = ( 0.0000000 0.4418605 -0.0000000), wk = 0.0027548 k( 40) = ( 0.0000000 0.4534884 -0.0000000), wk = 0.0027548 k( 41) = ( 0.0000000 0.4651163 -0.0000000), wk = 0.0027548 k( 42) = ( 0.0000000 0.4767442 -0.0000000), wk = 0.0027548 k( 43) = ( 0.0000000 0.4883721 -0.0000000), wk = 0.0027548 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 46) = ( 0.0116279 0.5000000 -0.0000000), wk = 0.0027548 k( 47) = ( 0.0232558 0.5000000 -0.0000000), wk = 0.0027548 k( 48) = ( 0.0348837 0.5000000 -0.0000000), wk = 0.0027548 k( 49) = ( 0.0465116 0.5000000 -0.0000000), wk = 0.0027548 k( 50) = ( 0.0581395 0.5000000 -0.0000000), wk = 0.0027548 k( 51) = ( 0.0697674 0.5000000 -0.0000000), wk = 0.0027548 k( 52) = ( 0.0813954 0.5000000 -0.0000000), wk = 0.0027548 k( 53) = ( 0.0930233 0.5000000 -0.0000000), wk = 0.0027548 k( 54) = ( 0.1046512 0.5000000 -0.0000000), wk = 0.0027548 k( 55) = ( 0.1162791 0.5000000 -0.0000000), wk = 0.0027548 k( 56) = ( 0.1279070 0.5000000 -0.0000000), wk = 0.0027548 k( 57) = ( 0.1395349 0.5000000 -0.0000000), wk = 0.0027548 k( 58) = ( 0.1511628 0.5000000 -0.0000000), wk = 0.0027548 k( 59) = ( 0.1627907 0.5000000 -0.0000000), wk = 0.0027548 k( 60) = ( 0.1744186 0.5000000 -0.0000000), wk = 0.0027548 k( 61) = ( 0.1860465 0.5000000 -0.0000000), wk = 0.0027548 k( 62) = ( 0.1976744 0.5000000 -0.0000000), wk = 0.0027548 k( 63) = ( 0.2093023 0.5000000 -0.0000000), wk = 0.0027548 k( 64) = ( 0.2209302 0.5000000 -0.0000000), wk = 0.0027548 k( 65) = ( 0.2325581 0.5000000 -0.0000000), wk = 0.0027548 k( 66) = ( 0.2441860 0.5000000 -0.0000000), wk = 0.0027548 k( 67) = ( 0.2558140 0.5000000 -0.0000000), wk = 0.0027548 k( 68) = ( 0.2674419 0.5000000 -0.0000000), wk = 0.0027548 k( 69) = ( 0.2790698 0.5000000 -0.0000000), wk = 0.0027548 k( 70) = ( 0.2906977 0.5000000 -0.0000000), wk = 0.0027548 k( 71) = ( 0.3023256 0.5000000 -0.0000000), wk = 0.0027548 k( 72) = ( 0.3139535 0.5000000 -0.0000000), wk = 0.0027548 k( 73) = ( 0.3255814 0.5000000 -0.0000000), wk = 0.0027548 k( 74) = ( 0.3372093 0.5000000 -0.0000000), wk = 0.0027548 k( 75) = ( 0.3488372 0.5000000 -0.0000000), wk = 0.0027548 k( 76) = ( 0.3604651 0.5000000 -0.0000000), wk = 0.0027548 k( 77) = ( 0.3720930 0.5000000 -0.0000000), wk = 0.0027548 k( 78) = ( 0.3837209 0.5000000 -0.0000000), wk = 0.0027548 k( 79) = ( 0.3953488 0.5000000 -0.0000000), wk = 0.0027548 k( 80) = ( 0.4069767 0.5000000 -0.0000000), wk = 0.0027548 k( 81) = ( 0.4186047 0.5000000 -0.0000000), wk = 0.0027548 k( 82) = ( 0.4302326 0.5000000 -0.0000000), wk = 0.0027548 k( 83) = ( 0.4418605 0.5000000 -0.0000000), wk = 0.0027548 k( 84) = ( 0.4534884 0.5000000 -0.0000000), wk = 0.0027548 k( 85) = ( 0.4651163 0.5000000 -0.0000000), wk = 0.0027548 k( 86) = ( 0.4767442 0.5000000 -0.0000000), wk = 0.0027548 k( 87) = ( 0.4883721 0.5000000 -0.0000000), wk = 0.0027548 k( 88) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 90) = ( 0.4918033 0.4918033 -0.0000000), wk = 0.0027548 k( 91) = ( 0.4836066 0.4836066 -0.0000000), wk = 0.0027548 k( 92) = ( 0.4754098 0.4754098 -0.0000000), wk = 0.0027548 k( 93) = ( 0.4672131 0.4672131 -0.0000000), wk = 0.0027548 k( 94) = ( 0.4590164 0.4590164 -0.0000000), wk = 0.0027548 k( 95) = ( 0.4508197 0.4508197 -0.0000000), wk = 0.0027548 k( 96) = ( 0.4426230 0.4426229 -0.0000000), wk = 0.0027548 k( 97) = ( 0.4344262 0.4344262 -0.0000000), wk = 0.0027548 k( 98) = ( 0.4262295 0.4262295 -0.0000000), wk = 0.0027548 k( 99) = ( 0.4180328 0.4180328 -0.0000000), wk = 0.0027548 k( 100) = ( 0.4098361 0.4098361 -0.0000000), wk = 0.0027548 k( 101) = ( 0.4016393 0.4016393 -0.0000000), wk = 0.0027548 k( 102) = ( 0.3934426 0.3934426 -0.0000000), wk = 0.0027548 k( 103) = ( 0.3852459 0.3852459 -0.0000000), wk = 0.0027548 k( 104) = ( 0.3770492 0.3770492 -0.0000000), wk = 0.0027548 k( 105) = ( 0.3688525 0.3688525 -0.0000000), wk = 0.0027548 k( 106) = ( 0.3606557 0.3606557 -0.0000000), wk = 0.0027548 k( 107) = ( 0.3524590 0.3524590 -0.0000000), wk = 0.0027548 k( 108) = ( 0.3442623 0.3442623 -0.0000000), wk = 0.0027548 k( 109) = ( 0.3360656 0.3360656 -0.0000000), wk = 0.0027548 k( 110) = ( 0.3278688 0.3278688 -0.0000000), wk = 0.0027548 k( 111) = ( 0.3196721 0.3196721 -0.0000000), wk = 0.0027548 k( 112) = ( 0.3114754 0.3114754 -0.0000000), wk = 0.0027548 k( 113) = ( 0.3032787 0.3032787 -0.0000000), wk = 0.0027548 k( 114) = ( 0.2950820 0.2950820 -0.0000000), wk = 0.0027548 k( 115) = ( 0.2868852 0.2868852 -0.0000000), wk = 0.0027548 k( 116) = ( 0.2786885 0.2786885 -0.0000000), wk = 0.0027548 k( 117) = ( 0.2704918 0.2704918 -0.0000000), wk = 0.0027548 k( 118) = ( 0.2622951 0.2622951 -0.0000000), wk = 0.0027548 k( 119) = ( 0.2540984 0.2540984 -0.0000000), wk = 0.0027548 k( 120) = ( 0.2459016 0.2459016 -0.0000000), wk = 0.0027548 k( 121) = ( 0.2377049 0.2377049 -0.0000000), wk = 0.0027548 k( 122) = ( 0.2295082 0.2295082 -0.0000000), wk = 0.0027548 k( 123) = ( 0.2213115 0.2213115 -0.0000000), wk = 0.0027548 k( 124) = ( 0.2131147 0.2131147 -0.0000000), wk = 0.0027548 k( 125) = ( 0.2049180 0.2049180 -0.0000000), wk = 0.0027548 k( 126) = ( 0.1967213 0.1967213 -0.0000000), wk = 0.0027548 k( 127) = ( 0.1885246 0.1885246 -0.0000000), wk = 0.0027548 k( 128) = ( 0.1803279 0.1803279 -0.0000000), wk = 0.0027548 k( 129) = ( 0.1721312 0.1721311 -0.0000000), wk = 0.0027548 k( 130) = ( 0.1639344 0.1639344 -0.0000000), wk = 0.0027548 k( 131) = ( 0.1557377 0.1557377 -0.0000000), wk = 0.0027548 k( 132) = ( 0.1475410 0.1475410 -0.0000000), wk = 0.0027548 k( 133) = ( 0.1393443 0.1393443 -0.0000000), wk = 0.0027548 k( 134) = ( 0.1311475 0.1311475 -0.0000000), wk = 0.0027548 k( 135) = ( 0.1229508 0.1229508 -0.0000000), wk = 0.0027548 k( 136) = ( 0.1147541 0.1147541 -0.0000000), wk = 0.0027548 k( 137) = ( 0.1065574 0.1065574 -0.0000000), wk = 0.0027548 k( 138) = ( 0.0983607 0.0983607 -0.0000000), wk = 0.0027548 k( 139) = ( 0.0901639 0.0901639 -0.0000000), wk = 0.0027548 k( 140) = ( 0.0819672 0.0819672 -0.0000000), wk = 0.0027548 k( 141) = ( 0.0737705 0.0737705 -0.0000000), wk = 0.0027548 k( 142) = ( 0.0655738 0.0655738 -0.0000000), wk = 0.0027548 k( 143) = ( 0.0573770 0.0573770 -0.0000000), wk = 0.0027548 k( 144) = ( 0.0491803 0.0491803 -0.0000000), wk = 0.0027548 k( 145) = ( 0.0409836 0.0409836 -0.0000000), wk = 0.0027548 k( 146) = ( 0.0327869 0.0327869 -0.0000000), wk = 0.0027548 k( 147) = ( 0.0245902 0.0245902 -0.0000000), wk = 0.0027548 k( 148) = ( 0.0163934 0.0163934 -0.0000000), wk = 0.0027548 k( 149) = ( 0.0081967 0.0081967 -0.0000000), wk = 0.0027548 k( 150) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 152) = ( 0.0000000 0.0000000 0.0112500), wk = 0.0027548 k( 153) = ( 0.0000000 0.0000000 0.0225000), wk = 0.0027548 k( 154) = ( 0.0000000 0.0000000 0.0337500), wk = 0.0027548 k( 155) = ( 0.0000000 0.0000000 0.0450000), wk = 0.0027548 k( 156) = ( 0.0000000 0.0000000 0.0562500), wk = 0.0027548 k( 157) = ( 0.0000000 0.0000000 0.0675000), wk = 0.0027548 k( 158) = ( 0.0000000 0.0000000 0.0787500), wk = 0.0027548 k( 159) = ( 0.0000000 0.0000000 0.0900000), wk = 0.0027548 k( 160) = ( 0.0000000 0.0000000 0.1012500), wk = 0.0027548 k( 161) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0027548 k( 162) = ( 0.0000000 0.0000000 0.1237500), wk = 0.0027548 k( 163) = ( 0.0000000 0.0000000 0.1350000), wk = 0.0027548 k( 164) = ( 0.0000000 0.0000000 0.1462500), wk = 0.0027548 k( 165) = ( 0.0000000 0.0000000 0.1575000), wk = 0.0027548 k( 166) = ( 0.0000000 0.0000000 0.1687500), wk = 0.0027548 k( 167) = ( 0.0000000 0.0000000 0.1800000), wk = 0.0027548 k( 168) = ( 0.0000000 0.0000000 0.1912500), wk = 0.0027548 k( 169) = ( 0.0000000 0.0000000 0.2025000), wk = 0.0027548 k( 170) = ( 0.0000000 0.0000000 0.2137500), wk = 0.0027548 k( 171) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0027548 k( 172) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0027548 k( 173) = ( 0.0000000 0.0116279 0.2250000), wk = 0.0027548 k( 174) = ( 0.0000000 0.0232558 0.2250000), wk = 0.0027548 k( 175) = ( 0.0000000 0.0348837 0.2250000), wk = 0.0027548 k( 176) = ( 0.0000000 0.0465116 0.2250000), wk = 0.0027548 k( 177) = ( 0.0000000 0.0581395 0.2250000), wk = 0.0027548 k( 178) = ( 0.0000000 0.0697674 0.2250000), wk = 0.0027548 k( 179) = ( 0.0000000 0.0813954 0.2250000), wk = 0.0027548 k( 180) = ( 0.0000000 0.0930233 0.2250000), wk = 0.0027548 k( 181) = ( 0.0000000 0.1046512 0.2250000), wk = 0.0027548 k( 182) = ( 0.0000000 0.1162791 0.2250000), wk = 0.0027548 k( 183) = ( 0.0000000 0.1279070 0.2250000), wk = 0.0027548 k( 184) = ( 0.0000000 0.1395349 0.2250000), wk = 0.0027548 k( 185) = ( 0.0000000 0.1511628 0.2250000), wk = 0.0027548 k( 186) = ( 0.0000000 0.1627907 0.2250000), wk = 0.0027548 k( 187) = ( 0.0000000 0.1744186 0.2250000), wk = 0.0027548 k( 188) = ( 0.0000000 0.1860465 0.2250000), wk = 0.0027548 k( 189) = ( 0.0000000 0.1976744 0.2250000), wk = 0.0027548 k( 190) = ( 0.0000000 0.2093023 0.2250000), wk = 0.0027548 k( 191) = ( 0.0000000 0.2209302 0.2250000), wk = 0.0027548 k( 192) = ( 0.0000000 0.2325581 0.2250000), wk = 0.0027548 k( 193) = ( 0.0000000 0.2441860 0.2250000), wk = 0.0027548 k( 194) = ( 0.0000000 0.2558140 0.2250000), wk = 0.0027548 k( 195) = ( 0.0000000 0.2674419 0.2250000), wk = 0.0027548 k( 196) = ( 0.0000000 0.2790698 0.2250000), wk = 0.0027548 k( 197) = ( 0.0000000 0.2906977 0.2250000), wk = 0.0027548 k( 198) = ( 0.0000000 0.3023256 0.2250000), wk = 0.0027548 k( 199) = ( 0.0000000 0.3139535 0.2250000), wk = 0.0027548 k( 200) = ( 0.0000000 0.3255814 0.2250000), wk = 0.0027548 k( 201) = ( 0.0000000 0.3372093 0.2250000), wk = 0.0027548 k( 202) = ( 0.0000000 0.3488372 0.2250000), wk = 0.0027548 k( 203) = ( 0.0000000 0.3604651 0.2250000), wk = 0.0027548 k( 204) = ( 0.0000000 0.3720930 0.2250000), wk = 0.0027548 k( 205) = ( 0.0000000 0.3837209 0.2250000), wk = 0.0027548 k( 206) = ( 0.0000000 0.3953488 0.2250000), wk = 0.0027548 k( 207) = ( 0.0000000 0.4069767 0.2250000), wk = 0.0027548 k( 208) = ( 0.0000000 0.4186047 0.2250000), wk = 0.0027548 k( 209) = ( 0.0000000 0.4302326 0.2250000), wk = 0.0027548 k( 210) = ( 0.0000000 0.4418605 0.2250000), wk = 0.0027548 k( 211) = ( 0.0000000 0.4534884 0.2250000), wk = 0.0027548 k( 212) = ( 0.0000000 0.4651163 0.2250000), wk = 0.0027548 k( 213) = ( 0.0000000 0.4767442 0.2250000), wk = 0.0027548 k( 214) = ( 0.0000000 0.4883721 0.2250000), wk = 0.0027548 k( 215) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0027548 k( 216) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0027548 k( 217) = ( 0.0116279 0.5000000 0.2250000), wk = 0.0027548 k( 218) = ( 0.0232558 0.5000000 0.2250000), wk = 0.0027548 k( 219) = ( 0.0348837 0.5000000 0.2250000), wk = 0.0027548 k( 220) = ( 0.0465116 0.5000000 0.2250000), wk = 0.0027548 k( 221) = ( 0.0581395 0.5000000 0.2250000), wk = 0.0027548 k( 222) = ( 0.0697674 0.5000000 0.2250000), wk = 0.0027548 k( 223) = ( 0.0813954 0.5000000 0.2250000), wk = 0.0027548 k( 224) = ( 0.0930233 0.5000000 0.2250000), wk = 0.0027548 k( 225) = ( 0.1046512 0.5000000 0.2250000), wk = 0.0027548 k( 226) = ( 0.1162791 0.5000000 0.2250000), wk = 0.0027548 k( 227) = ( 0.1279070 0.5000000 0.2250000), wk = 0.0027548 k( 228) = ( 0.1395349 0.5000000 0.2250000), wk = 0.0027548 k( 229) = ( 0.1511628 0.5000000 0.2250000), wk = 0.0027548 k( 230) = ( 0.1627907 0.5000000 0.2250000), wk = 0.0027548 k( 231) = ( 0.1744186 0.5000000 0.2250000), wk = 0.0027548 k( 232) = ( 0.1860465 0.5000000 0.2250000), wk = 0.0027548 k( 233) = ( 0.1976744 0.5000000 0.2250000), wk = 0.0027548 k( 234) = ( 0.2093023 0.5000000 0.2250000), wk = 0.0027548 k( 235) = ( 0.2209302 0.5000000 0.2250000), wk = 0.0027548 k( 236) = ( 0.2325581 0.5000000 0.2250000), wk = 0.0027548 k( 237) = ( 0.2441860 0.5000000 0.2250000), wk = 0.0027548 k( 238) = ( 0.2558140 0.5000000 0.2250000), wk = 0.0027548 k( 239) = ( 0.2674419 0.5000000 0.2250000), wk = 0.0027548 k( 240) = ( 0.2790698 0.5000000 0.2250000), wk = 0.0027548 k( 241) = ( 0.2906977 0.5000000 0.2250000), wk = 0.0027548 k( 242) = ( 0.3023256 0.5000000 0.2250000), wk = 0.0027548 k( 243) = ( 0.3139535 0.5000000 0.2250000), wk = 0.0027548 k( 244) = ( 0.3255814 0.5000000 0.2250000), wk = 0.0027548 k( 245) = ( 0.3372093 0.5000000 0.2250000), wk = 0.0027548 k( 246) = ( 0.3488372 0.5000000 0.2250000), wk = 0.0027548 k( 247) = ( 0.3604651 0.5000000 0.2250000), wk = 0.0027548 k( 248) = ( 0.3720930 0.5000000 0.2250000), wk = 0.0027548 k( 249) = ( 0.3837209 0.5000000 0.2250000), wk = 0.0027548 k( 250) = ( 0.3953488 0.5000000 0.2250000), wk = 0.0027548 k( 251) = ( 0.4069767 0.5000000 0.2250000), wk = 0.0027548 k( 252) = ( 0.4186047 0.5000000 0.2250000), wk = 0.0027548 k( 253) = ( 0.4302326 0.5000000 0.2250000), wk = 0.0027548 k( 254) = ( 0.4418605 0.5000000 0.2250000), wk = 0.0027548 k( 255) = ( 0.4534884 0.5000000 0.2250000), wk = 0.0027548 k( 256) = ( 0.4651163 0.5000000 0.2250000), wk = 0.0027548 k( 257) = ( 0.4767442 0.5000000 0.2250000), wk = 0.0027548 k( 258) = ( 0.4883721 0.5000000 0.2250000), wk = 0.0027548 k( 259) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0027548 k( 260) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0027548 k( 261) = ( 0.4918033 0.4918033 0.2250000), wk = 0.0027548 k( 262) = ( 0.4836066 0.4836066 0.2250000), wk = 0.0027548 k( 263) = ( 0.4754098 0.4754098 0.2250000), wk = 0.0027548 k( 264) = ( 0.4672131 0.4672131 0.2250000), wk = 0.0027548 k( 265) = ( 0.4590164 0.4590164 0.2250000), wk = 0.0027548 k( 266) = ( 0.4508197 0.4508197 0.2250000), wk = 0.0027548 k( 267) = ( 0.4426230 0.4426229 0.2250000), wk = 0.0027548 k( 268) = ( 0.4344262 0.4344262 0.2250000), wk = 0.0027548 k( 269) = ( 0.4262295 0.4262295 0.2250000), wk = 0.0027548 k( 270) = ( 0.4180328 0.4180328 0.2250000), wk = 0.0027548 k( 271) = ( 0.4098361 0.4098361 0.2250000), wk = 0.0027548 k( 272) = ( 0.4016393 0.4016393 0.2250000), wk = 0.0027548 k( 273) = ( 0.3934426 0.3934426 0.2250000), wk = 0.0027548 k( 274) = ( 0.3852459 0.3852459 0.2250000), wk = 0.0027548 k( 275) = ( 0.3770492 0.3770492 0.2250000), wk = 0.0027548 k( 276) = ( 0.3688525 0.3688525 0.2250000), wk = 0.0027548 k( 277) = ( 0.3606557 0.3606557 0.2250000), wk = 0.0027548 k( 278) = ( 0.3524590 0.3524590 0.2250000), wk = 0.0027548 k( 279) = ( 0.3442623 0.3442623 0.2250000), wk = 0.0027548 k( 280) = ( 0.3360656 0.3360656 0.2250000), wk = 0.0027548 k( 281) = ( 0.3278688 0.3278688 0.2250000), wk = 0.0027548 k( 282) = ( 0.3196721 0.3196721 0.2250000), wk = 0.0027548 k( 283) = ( 0.3114754 0.3114754 0.2250000), wk = 0.0027548 k( 284) = ( 0.3032787 0.3032787 0.2250000), wk = 0.0027548 k( 285) = ( 0.2950820 0.2950820 0.2250000), wk = 0.0027548 k( 286) = ( 0.2868852 0.2868852 0.2250000), wk = 0.0027548 k( 287) = ( 0.2786885 0.2786885 0.2250000), wk = 0.0027548 k( 288) = ( 0.2704918 0.2704918 0.2250000), wk = 0.0027548 k( 289) = ( 0.2622951 0.2622951 0.2250000), wk = 0.0027548 k( 290) = ( 0.2540984 0.2540984 0.2250000), wk = 0.0027548 k( 291) = ( 0.2459016 0.2459016 0.2250000), wk = 0.0027548 k( 292) = ( 0.2377049 0.2377049 0.2250000), wk = 0.0027548 k( 293) = ( 0.2295082 0.2295082 0.2250000), wk = 0.0027548 k( 294) = ( 0.2213115 0.2213115 0.2250000), wk = 0.0027548 k( 295) = ( 0.2131147 0.2131147 0.2250000), wk = 0.0027548 k( 296) = ( 0.2049180 0.2049180 0.2250000), wk = 0.0027548 k( 297) = ( 0.1967213 0.1967213 0.2250000), wk = 0.0027548 k( 298) = ( 0.1885246 0.1885246 0.2250000), wk = 0.0027548 k( 299) = ( 0.1803279 0.1803279 0.2250000), wk = 0.0027548 k( 300) = ( 0.1721312 0.1721311 0.2250000), wk = 0.0027548 k( 301) = ( 0.1639344 0.1639344 0.2250000), wk = 0.0027548 k( 302) = ( 0.1557377 0.1557377 0.2250000), wk = 0.0027548 k( 303) = ( 0.1475410 0.1475410 0.2250000), wk = 0.0027548 k( 304) = ( 0.1393443 0.1393443 0.2250000), wk = 0.0027548 k( 305) = ( 0.1311475 0.1311475 0.2250000), wk = 0.0027548 k( 306) = ( 0.1229508 0.1229508 0.2250000), wk = 0.0027548 k( 307) = ( 0.1147541 0.1147541 0.2250000), wk = 0.0027548 k( 308) = ( 0.1065574 0.1065574 0.2250000), wk = 0.0027548 k( 309) = ( 0.0983607 0.0983607 0.2250000), wk = 0.0027548 k( 310) = ( 0.0901639 0.0901639 0.2250000), wk = 0.0027548 k( 311) = ( 0.0819672 0.0819672 0.2250000), wk = 0.0027548 k( 312) = ( 0.0737705 0.0737705 0.2250000), wk = 0.0027548 k( 313) = ( 0.0655738 0.0655738 0.2250000), wk = 0.0027548 k( 314) = ( 0.0573770 0.0573770 0.2250000), wk = 0.0027548 k( 315) = ( 0.0491803 0.0491803 0.2250000), wk = 0.0027548 k( 316) = ( 0.0409836 0.0409836 0.2250000), wk = 0.0027548 k( 317) = ( 0.0327869 0.0327869 0.2250000), wk = 0.0027548 k( 318) = ( 0.0245902 0.0245902 0.2250000), wk = 0.0027548 k( 319) = ( 0.0163934 0.0163934 0.2250000), wk = 0.0027548 k( 320) = ( 0.0081967 0.0081967 0.2250000), wk = 0.0027548 k( 321) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0027548 k( 322) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 323) = ( 0.0000000 0.5000000 0.0112500), wk = 0.0027548 k( 324) = ( 0.0000000 0.5000000 0.0225000), wk = 0.0027548 k( 325) = ( 0.0000000 0.5000000 0.0337500), wk = 0.0027548 k( 326) = ( 0.0000000 0.5000000 0.0450000), wk = 0.0027548 k( 327) = ( 0.0000000 0.5000000 0.0562500), wk = 0.0027548 k( 328) = ( 0.0000000 0.5000000 0.0675000), wk = 0.0027548 k( 329) = ( 0.0000000 0.5000000 0.0787500), wk = 0.0027548 k( 330) = ( 0.0000000 0.5000000 0.0900000), wk = 0.0027548 k( 331) = ( 0.0000000 0.5000000 0.1012500), wk = 0.0027548 k( 332) = ( 0.0000000 0.5000000 0.1125000), wk = 0.0027548 k( 333) = ( 0.0000000 0.5000000 0.1237500), wk = 0.0027548 k( 334) = ( 0.0000000 0.5000000 0.1350000), wk = 0.0027548 k( 335) = ( 0.0000000 0.5000000 0.1462500), wk = 0.0027548 k( 336) = ( 0.0000000 0.5000000 0.1575000), wk = 0.0027548 k( 337) = ( 0.0000000 0.5000000 0.1687500), wk = 0.0027548 k( 338) = ( 0.0000000 0.5000000 0.1800000), wk = 0.0027548 k( 339) = ( 0.0000000 0.5000000 0.1912500), wk = 0.0027548 k( 340) = ( 0.0000000 0.5000000 0.2025000), wk = 0.0027548 k( 341) = ( 0.0000000 0.5000000 0.2137500), wk = 0.0027548 k( 342) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0027548 k( 343) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 344) = ( 0.5000000 0.5000000 0.0112500), wk = 0.0027548 k( 345) = ( 0.5000000 0.5000000 0.0225000), wk = 0.0027548 k( 346) = ( 0.5000000 0.5000000 0.0337500), wk = 0.0027548 k( 347) = ( 0.5000000 0.5000000 0.0450000), wk = 0.0027548 k( 348) = ( 0.5000000 0.5000000 0.0562500), wk = 0.0027548 k( 349) = ( 0.5000000 0.5000000 0.0675000), wk = 0.0027548 k( 350) = ( 0.5000000 0.5000000 0.0787500), wk = 0.0027548 k( 351) = ( 0.5000000 0.5000000 0.0900000), wk = 0.0027548 k( 352) = ( 0.5000000 0.5000000 0.1012500), wk = 0.0027548 k( 353) = ( 0.5000000 0.5000000 0.1125000), wk = 0.0027548 k( 354) = ( 0.5000000 0.5000000 0.1237500), wk = 0.0027548 k( 355) = ( 0.5000000 0.5000000 0.1350000), wk = 0.0027548 k( 356) = ( 0.5000000 0.5000000 0.1462500), wk = 0.0027548 k( 357) = ( 0.5000000 0.5000000 0.1575000), wk = 0.0027548 k( 358) = ( 0.5000000 0.5000000 0.1687500), wk = 0.0027548 k( 359) = ( 0.5000000 0.5000000 0.1800000), wk = 0.0027548 k( 360) = ( 0.5000000 0.5000000 0.1912500), wk = 0.0027548 k( 361) = ( 0.5000000 0.5000000 0.2025000), wk = 0.0027548 k( 362) = ( 0.5000000 0.5000000 0.2137500), wk = 0.0027548 k( 363) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0027548 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 2) = ( 0.0000000 0.0116279 -0.0000000), wk = 0.0027548 k( 3) = ( 0.0000000 0.0232558 0.0000000), wk = 0.0027548 k( 4) = ( 0.0000000 0.0348837 -0.0000000), wk = 0.0027548 k( 5) = ( 0.0000000 0.0465116 -0.0000000), wk = 0.0027548 k( 6) = ( 0.0000000 0.0581395 -0.0000000), wk = 0.0027548 k( 7) = ( 0.0000000 0.0697674 -0.0000000), wk = 0.0027548 k( 8) = ( 0.0000000 0.0813954 0.0000000), wk = 0.0027548 k( 9) = ( 0.0000000 0.0930233 -0.0000000), wk = 0.0027548 k( 10) = ( 0.0000000 0.1046512 -0.0000000), wk = 0.0027548 k( 11) = ( 0.0000000 0.1162791 -0.0000000), wk = 0.0027548 k( 12) = ( 0.0000000 0.1279070 -0.0000000), wk = 0.0027548 k( 13) = ( 0.0000000 0.1395349 -0.0000000), wk = 0.0027548 k( 14) = ( 0.0000000 0.1511628 0.0000000), wk = 0.0027548 k( 15) = ( 0.0000000 0.1627907 0.0000000), wk = 0.0027548 k( 16) = ( 0.0000000 0.1744186 0.0000000), wk = 0.0027548 k( 17) = ( 0.0000000 0.1860465 -0.0000000), wk = 0.0027548 k( 18) = ( 0.0000000 0.1976744 -0.0000000), wk = 0.0027548 k( 19) = ( 0.0000000 0.2093023 -0.0000000), wk = 0.0027548 k( 20) = ( 0.0000000 0.2209302 -0.0000000), wk = 0.0027548 k( 21) = ( 0.0000000 0.2325581 -0.0000000), wk = 0.0027548 k( 22) = ( 0.0000000 0.2441860 -0.0000000), wk = 0.0027548 k( 23) = ( 0.0000000 0.2558140 -0.0000000), wk = 0.0027548 k( 24) = ( 0.0000000 0.2674419 -0.0000000), wk = 0.0027548 k( 25) = ( 0.0000000 0.2790698 -0.0000000), wk = 0.0027548 k( 26) = ( 0.0000000 0.2906977 -0.0000000), wk = 0.0027548 k( 27) = ( 0.0000000 0.3023256 0.0000000), wk = 0.0027548 k( 28) = ( 0.0000000 0.3139535 -0.0000000), wk = 0.0027548 k( 29) = ( 0.0000000 0.3255814 0.0000000), wk = 0.0027548 k( 30) = ( 0.0000000 0.3372093 -0.0000000), wk = 0.0027548 k( 31) = ( 0.0000000 0.3488372 -0.0000000), wk = 0.0027548 k( 32) = ( 0.0000000 0.3604651 -0.0000000), wk = 0.0027548 k( 33) = ( 0.0000000 0.3720930 -0.0000000), wk = 0.0027548 k( 34) = ( 0.0000000 0.3837209 -0.0000000), wk = 0.0027548 k( 35) = ( 0.0000000 0.3953488 -0.0000000), wk = 0.0027548 k( 36) = ( 0.0000000 0.4069767 -0.0000000), wk = 0.0027548 k( 37) = ( 0.0000000 0.4186047 0.0000000), wk = 0.0027548 k( 38) = ( 0.0000000 0.4302326 -0.0000000), wk = 0.0027548 k( 39) = ( 0.0000000 0.4418605 -0.0000000), wk = 0.0027548 k( 40) = ( 0.0000000 0.4534884 0.0000000), wk = 0.0027548 k( 41) = ( 0.0000000 0.4651163 -0.0000000), wk = 0.0027548 k( 42) = ( 0.0000000 0.4767442 0.0000000), wk = 0.0027548 k( 43) = ( 0.0000000 0.4883721 -0.0000000), wk = 0.0027548 k( 44) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 46) = ( 0.0116279 0.5000000 0.0000000), wk = 0.0027548 k( 47) = ( 0.0232558 0.5000000 0.0000000), wk = 0.0027548 k( 48) = ( 0.0348837 0.5000000 -0.0000000), wk = 0.0027548 k( 49) = ( 0.0465116 0.5000000 0.0000000), wk = 0.0027548 k( 50) = ( 0.0581395 0.5000000 -0.0000000), wk = 0.0027548 k( 51) = ( 0.0697674 0.5000000 0.0000000), wk = 0.0027548 k( 52) = ( 0.0813954 0.5000000 -0.0000000), wk = 0.0027548 k( 53) = ( 0.0930233 0.5000000 -0.0000000), wk = 0.0027548 k( 54) = ( 0.1046512 0.5000000 0.0000000), wk = 0.0027548 k( 55) = ( 0.1162791 0.5000000 0.0000000), wk = 0.0027548 k( 56) = ( 0.1279070 0.5000000 -0.0000000), wk = 0.0027548 k( 57) = ( 0.1395349 0.5000000 -0.0000000), wk = 0.0027548 k( 58) = ( 0.1511628 0.5000000 -0.0000000), wk = 0.0027548 k( 59) = ( 0.1627907 0.5000000 -0.0000000), wk = 0.0027548 k( 60) = ( 0.1744186 0.5000000 0.0000000), wk = 0.0027548 k( 61) = ( 0.1860465 0.5000000 -0.0000000), wk = 0.0027548 k( 62) = ( 0.1976744 0.5000000 -0.0000000), wk = 0.0027548 k( 63) = ( 0.2093023 0.5000000 -0.0000000), wk = 0.0027548 k( 64) = ( 0.2209302 0.5000000 0.0000000), wk = 0.0027548 k( 65) = ( 0.2325581 0.5000000 -0.0000000), wk = 0.0027548 k( 66) = ( 0.2441860 0.5000000 -0.0000000), wk = 0.0027548 k( 67) = ( 0.2558140 0.5000000 -0.0000000), wk = 0.0027548 k( 68) = ( 0.2674419 0.5000000 -0.0000000), wk = 0.0027548 k( 69) = ( 0.2790698 0.5000000 -0.0000000), wk = 0.0027548 k( 70) = ( 0.2906977 0.5000000 -0.0000000), wk = 0.0027548 k( 71) = ( 0.3023256 0.5000000 -0.0000000), wk = 0.0027548 k( 72) = ( 0.3139535 0.5000000 -0.0000000), wk = 0.0027548 k( 73) = ( 0.3255814 0.5000000 -0.0000000), wk = 0.0027548 k( 74) = ( 0.3372093 0.5000000 -0.0000000), wk = 0.0027548 k( 75) = ( 0.3488372 0.5000000 -0.0000000), wk = 0.0027548 k( 76) = ( 0.3604651 0.5000000 -0.0000000), wk = 0.0027548 k( 77) = ( 0.3720930 0.5000000 -0.0000000), wk = 0.0027548 k( 78) = ( 0.3837209 0.5000000 -0.0000000), wk = 0.0027548 k( 79) = ( 0.3953488 0.5000000 -0.0000000), wk = 0.0027548 k( 80) = ( 0.4069767 0.5000000 -0.0000000), wk = 0.0027548 k( 81) = ( 0.4186047 0.5000000 -0.0000000), wk = 0.0027548 k( 82) = ( 0.4302326 0.5000000 -0.0000000), wk = 0.0027548 k( 83) = ( 0.4418605 0.5000000 -0.0000000), wk = 0.0027548 k( 84) = ( 0.4534884 0.5000000 -0.0000000), wk = 0.0027548 k( 85) = ( 0.4651163 0.5000000 -0.0000000), wk = 0.0027548 k( 86) = ( 0.4767442 0.5000000 -0.0000000), wk = 0.0027548 k( 87) = ( 0.4883721 0.5000000 -0.0000000), wk = 0.0027548 k( 88) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 89) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 90) = ( 0.4918033 0.4918033 -0.0000000), wk = 0.0027548 k( 91) = ( 0.4836066 0.4836066 -0.0000000), wk = 0.0027548 k( 92) = ( 0.4754098 0.4754098 -0.0000000), wk = 0.0027548 k( 93) = ( 0.4672131 0.4672131 -0.0000000), wk = 0.0027548 k( 94) = ( 0.4590164 0.4590164 -0.0000000), wk = 0.0027548 k( 95) = ( 0.4508197 0.4508197 -0.0000000), wk = 0.0027548 k( 96) = ( 0.4426230 0.4426230 -0.0000000), wk = 0.0027548 k( 97) = ( 0.4344262 0.4344262 -0.0000000), wk = 0.0027548 k( 98) = ( 0.4262295 0.4262295 -0.0000000), wk = 0.0027548 k( 99) = ( 0.4180328 0.4180328 -0.0000000), wk = 0.0027548 k( 100) = ( 0.4098361 0.4098361 -0.0000000), wk = 0.0027548 k( 101) = ( 0.4016393 0.4016393 -0.0000000), wk = 0.0027548 k( 102) = ( 0.3934426 0.3934426 -0.0000000), wk = 0.0027548 k( 103) = ( 0.3852459 0.3852459 -0.0000000), wk = 0.0027548 k( 104) = ( 0.3770492 0.3770492 -0.0000000), wk = 0.0027548 k( 105) = ( 0.3688525 0.3688525 -0.0000000), wk = 0.0027548 k( 106) = ( 0.3606557 0.3606557 -0.0000000), wk = 0.0027548 k( 107) = ( 0.3524590 0.3524590 -0.0000000), wk = 0.0027548 k( 108) = ( 0.3442623 0.3442623 -0.0000000), wk = 0.0027548 k( 109) = ( 0.3360656 0.3360656 -0.0000000), wk = 0.0027548 k( 110) = ( 0.3278688 0.3278688 -0.0000000), wk = 0.0027548 k( 111) = ( 0.3196721 0.3196721 -0.0000000), wk = 0.0027548 k( 112) = ( 0.3114754 0.3114754 -0.0000000), wk = 0.0027548 k( 113) = ( 0.3032787 0.3032787 -0.0000000), wk = 0.0027548 k( 114) = ( 0.2950820 0.2950820 -0.0000000), wk = 0.0027548 k( 115) = ( 0.2868852 0.2868852 -0.0000000), wk = 0.0027548 k( 116) = ( 0.2786885 0.2786885 -0.0000000), wk = 0.0027548 k( 117) = ( 0.2704918 0.2704918 -0.0000000), wk = 0.0027548 k( 118) = ( 0.2622951 0.2622951 -0.0000000), wk = 0.0027548 k( 119) = ( 0.2540984 0.2540984 -0.0000000), wk = 0.0027548 k( 120) = ( 0.2459016 0.2459016 -0.0000000), wk = 0.0027548 k( 121) = ( 0.2377049 0.2377049 -0.0000000), wk = 0.0027548 k( 122) = ( 0.2295082 0.2295082 -0.0000000), wk = 0.0027548 k( 123) = ( 0.2213115 0.2213115 -0.0000000), wk = 0.0027548 k( 124) = ( 0.2131147 0.2131147 -0.0000000), wk = 0.0027548 k( 125) = ( 0.2049180 0.2049180 -0.0000000), wk = 0.0027548 k( 126) = ( 0.1967213 0.1967213 -0.0000000), wk = 0.0027548 k( 127) = ( 0.1885246 0.1885246 -0.0000000), wk = 0.0027548 k( 128) = ( 0.1803279 0.1803279 -0.0000000), wk = 0.0027548 k( 129) = ( 0.1721312 0.1721312 -0.0000000), wk = 0.0027548 k( 130) = ( 0.1639344 0.1639344 -0.0000000), wk = 0.0027548 k( 131) = ( 0.1557377 0.1557377 -0.0000000), wk = 0.0027548 k( 132) = ( 0.1475410 0.1475410 -0.0000000), wk = 0.0027548 k( 133) = ( 0.1393443 0.1393443 -0.0000000), wk = 0.0027548 k( 134) = ( 0.1311475 0.1311475 -0.0000000), wk = 0.0027548 k( 135) = ( 0.1229508 0.1229508 -0.0000000), wk = 0.0027548 k( 136) = ( 0.1147541 0.1147541 -0.0000000), wk = 0.0027548 k( 137) = ( 0.1065574 0.1065574 -0.0000000), wk = 0.0027548 k( 138) = ( 0.0983607 0.0983607 -0.0000000), wk = 0.0027548 k( 139) = ( 0.0901639 0.0901639 -0.0000000), wk = 0.0027548 k( 140) = ( 0.0819672 0.0819672 -0.0000000), wk = 0.0027548 k( 141) = ( 0.0737705 0.0737705 -0.0000000), wk = 0.0027548 k( 142) = ( 0.0655738 0.0655738 -0.0000000), wk = 0.0027548 k( 143) = ( 0.0573770 0.0573770 -0.0000000), wk = 0.0027548 k( 144) = ( 0.0491803 0.0491803 -0.0000000), wk = 0.0027548 k( 145) = ( 0.0409836 0.0409836 -0.0000000), wk = 0.0027548 k( 146) = ( 0.0327869 0.0327869 -0.0000000), wk = 0.0027548 k( 147) = ( 0.0245902 0.0245902 -0.0000000), wk = 0.0027548 k( 148) = ( 0.0163934 0.0163934 -0.0000000), wk = 0.0027548 k( 149) = ( 0.0081967 0.0081967 -0.0000000), wk = 0.0027548 k( 150) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 151) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0027548 k( 152) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0027548 k( 153) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0027548 k( 154) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0027548 k( 155) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0027548 k( 156) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0027548 k( 157) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0027548 k( 158) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0027548 k( 159) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0027548 k( 160) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0027548 k( 161) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0027548 k( 162) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0027548 k( 163) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0027548 k( 164) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0027548 k( 165) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0027548 k( 166) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0027548 k( 167) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0027548 k( 168) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0027548 k( 169) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0027548 k( 170) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0027548 k( 171) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 172) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 173) = ( 0.0000000 0.0116279 0.5000000), wk = 0.0027548 k( 174) = ( 0.0000000 0.0232558 0.5000000), wk = 0.0027548 k( 175) = ( 0.0000000 0.0348837 0.5000000), wk = 0.0027548 k( 176) = ( 0.0000000 0.0465116 0.5000000), wk = 0.0027548 k( 177) = ( 0.0000000 0.0581395 0.5000000), wk = 0.0027548 k( 178) = ( 0.0000000 0.0697674 0.5000000), wk = 0.0027548 k( 179) = ( 0.0000000 0.0813954 0.5000000), wk = 0.0027548 k( 180) = ( 0.0000000 0.0930233 0.5000000), wk = 0.0027548 k( 181) = ( 0.0000000 0.1046512 0.5000000), wk = 0.0027548 k( 182) = ( 0.0000000 0.1162791 0.5000000), wk = 0.0027548 k( 183) = ( 0.0000000 0.1279070 0.5000000), wk = 0.0027548 k( 184) = ( 0.0000000 0.1395349 0.5000000), wk = 0.0027548 k( 185) = ( 0.0000000 0.1511628 0.5000000), wk = 0.0027548 k( 186) = ( 0.0000000 0.1627907 0.5000000), wk = 0.0027548 k( 187) = ( 0.0000000 0.1744186 0.5000000), wk = 0.0027548 k( 188) = ( 0.0000000 0.1860465 0.5000000), wk = 0.0027548 k( 189) = ( 0.0000000 0.1976744 0.5000000), wk = 0.0027548 k( 190) = ( 0.0000000 0.2093023 0.5000000), wk = 0.0027548 k( 191) = ( 0.0000000 0.2209302 0.5000000), wk = 0.0027548 k( 192) = ( 0.0000000 0.2325581 0.5000000), wk = 0.0027548 k( 193) = ( 0.0000000 0.2441860 0.5000000), wk = 0.0027548 k( 194) = ( 0.0000000 0.2558140 0.5000000), wk = 0.0027548 k( 195) = ( 0.0000000 0.2674419 0.5000000), wk = 0.0027548 k( 196) = ( 0.0000000 0.2790698 0.5000000), wk = 0.0027548 k( 197) = ( 0.0000000 0.2906977 0.5000000), wk = 0.0027548 k( 198) = ( 0.0000000 0.3023256 0.5000000), wk = 0.0027548 k( 199) = ( 0.0000000 0.3139535 0.5000000), wk = 0.0027548 k( 200) = ( 0.0000000 0.3255814 0.5000000), wk = 0.0027548 k( 201) = ( 0.0000000 0.3372093 0.5000000), wk = 0.0027548 k( 202) = ( 0.0000000 0.3488372 0.5000000), wk = 0.0027548 k( 203) = ( 0.0000000 0.3604651 0.5000000), wk = 0.0027548 k( 204) = ( 0.0000000 0.3720930 0.5000000), wk = 0.0027548 k( 205) = ( 0.0000000 0.3837209 0.5000000), wk = 0.0027548 k( 206) = ( 0.0000000 0.3953488 0.5000000), wk = 0.0027548 k( 207) = ( 0.0000000 0.4069767 0.5000000), wk = 0.0027548 k( 208) = ( 0.0000000 0.4186047 0.5000000), wk = 0.0027548 k( 209) = ( 0.0000000 0.4302326 0.5000000), wk = 0.0027548 k( 210) = ( 0.0000000 0.4418605 0.5000000), wk = 0.0027548 k( 211) = ( 0.0000000 0.4534884 0.5000000), wk = 0.0027548 k( 212) = ( 0.0000000 0.4651163 0.5000000), wk = 0.0027548 k( 213) = ( 0.0000000 0.4767442 0.5000000), wk = 0.0027548 k( 214) = ( 0.0000000 0.4883721 0.5000000), wk = 0.0027548 k( 215) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 216) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 217) = ( 0.0116279 0.5000000 0.5000000), wk = 0.0027548 k( 218) = ( 0.0232558 0.5000000 0.5000000), wk = 0.0027548 k( 219) = ( 0.0348837 0.5000000 0.5000000), wk = 0.0027548 k( 220) = ( 0.0465116 0.5000000 0.5000000), wk = 0.0027548 k( 221) = ( 0.0581395 0.5000000 0.5000000), wk = 0.0027548 k( 222) = ( 0.0697674 0.5000000 0.5000000), wk = 0.0027548 k( 223) = ( 0.0813954 0.5000000 0.5000000), wk = 0.0027548 k( 224) = ( 0.0930233 0.5000000 0.5000000), wk = 0.0027548 k( 225) = ( 0.1046512 0.5000000 0.5000000), wk = 0.0027548 k( 226) = ( 0.1162791 0.5000000 0.5000000), wk = 0.0027548 k( 227) = ( 0.1279070 0.5000000 0.5000000), wk = 0.0027548 k( 228) = ( 0.1395349 0.5000000 0.5000000), wk = 0.0027548 k( 229) = ( 0.1511628 0.5000000 0.5000000), wk = 0.0027548 k( 230) = ( 0.1627907 0.5000000 0.5000000), wk = 0.0027548 k( 231) = ( 0.1744186 0.5000000 0.5000000), wk = 0.0027548 k( 232) = ( 0.1860465 0.5000000 0.5000000), wk = 0.0027548 k( 233) = ( 0.1976744 0.5000000 0.5000000), wk = 0.0027548 k( 234) = ( 0.2093023 0.5000000 0.5000000), wk = 0.0027548 k( 235) = ( 0.2209302 0.5000000 0.5000000), wk = 0.0027548 k( 236) = ( 0.2325581 0.5000000 0.5000000), wk = 0.0027548 k( 237) = ( 0.2441860 0.5000000 0.5000000), wk = 0.0027548 k( 238) = ( 0.2558140 0.5000000 0.5000000), wk = 0.0027548 k( 239) = ( 0.2674419 0.5000000 0.5000000), wk = 0.0027548 k( 240) = ( 0.2790698 0.5000000 0.5000000), wk = 0.0027548 k( 241) = ( 0.2906977 0.5000000 0.5000000), wk = 0.0027548 k( 242) = ( 0.3023256 0.5000000 0.5000000), wk = 0.0027548 k( 243) = ( 0.3139535 0.5000000 0.5000000), wk = 0.0027548 k( 244) = ( 0.3255814 0.5000000 0.5000000), wk = 0.0027548 k( 245) = ( 0.3372093 0.5000000 0.5000000), wk = 0.0027548 k( 246) = ( 0.3488372 0.5000000 0.5000000), wk = 0.0027548 k( 247) = ( 0.3604651 0.5000000 0.5000000), wk = 0.0027548 k( 248) = ( 0.3720930 0.5000000 0.5000000), wk = 0.0027548 k( 249) = ( 0.3837209 0.5000000 0.5000000), wk = 0.0027548 k( 250) = ( 0.3953488 0.5000000 0.5000000), wk = 0.0027548 k( 251) = ( 0.4069767 0.5000000 0.5000000), wk = 0.0027548 k( 252) = ( 0.4186047 0.5000000 0.5000000), wk = 0.0027548 k( 253) = ( 0.4302326 0.5000000 0.5000000), wk = 0.0027548 k( 254) = ( 0.4418605 0.5000000 0.5000000), wk = 0.0027548 k( 255) = ( 0.4534884 0.5000000 0.5000000), wk = 0.0027548 k( 256) = ( 0.4651163 0.5000000 0.5000000), wk = 0.0027548 k( 257) = ( 0.4767442 0.5000000 0.5000000), wk = 0.0027548 k( 258) = ( 0.4883721 0.5000000 0.5000000), wk = 0.0027548 k( 259) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 k( 260) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 k( 261) = ( 0.4918033 0.4918033 0.5000000), wk = 0.0027548 k( 262) = ( 0.4836066 0.4836066 0.5000000), wk = 0.0027548 k( 263) = ( 0.4754098 0.4754098 0.5000000), wk = 0.0027548 k( 264) = ( 0.4672131 0.4672131 0.5000000), wk = 0.0027548 k( 265) = ( 0.4590164 0.4590164 0.5000000), wk = 0.0027548 k( 266) = ( 0.4508197 0.4508197 0.5000000), wk = 0.0027548 k( 267) = ( 0.4426230 0.4426230 0.5000000), wk = 0.0027548 k( 268) = ( 0.4344262 0.4344262 0.5000000), wk = 0.0027548 k( 269) = ( 0.4262295 0.4262295 0.5000000), wk = 0.0027548 k( 270) = ( 0.4180328 0.4180328 0.5000000), wk = 0.0027548 k( 271) = ( 0.4098361 0.4098361 0.5000000), wk = 0.0027548 k( 272) = ( 0.4016393 0.4016393 0.5000000), wk = 0.0027548 k( 273) = ( 0.3934426 0.3934426 0.5000000), wk = 0.0027548 k( 274) = ( 0.3852459 0.3852459 0.5000000), wk = 0.0027548 k( 275) = ( 0.3770492 0.3770492 0.5000000), wk = 0.0027548 k( 276) = ( 0.3688525 0.3688525 0.5000000), wk = 0.0027548 k( 277) = ( 0.3606557 0.3606557 0.5000000), wk = 0.0027548 k( 278) = ( 0.3524590 0.3524590 0.5000000), wk = 0.0027548 k( 279) = ( 0.3442623 0.3442623 0.5000000), wk = 0.0027548 k( 280) = ( 0.3360656 0.3360656 0.5000000), wk = 0.0027548 k( 281) = ( 0.3278688 0.3278688 0.5000000), wk = 0.0027548 k( 282) = ( 0.3196721 0.3196721 0.5000000), wk = 0.0027548 k( 283) = ( 0.3114754 0.3114754 0.5000000), wk = 0.0027548 k( 284) = ( 0.3032787 0.3032787 0.5000000), wk = 0.0027548 k( 285) = ( 0.2950820 0.2950820 0.5000000), wk = 0.0027548 k( 286) = ( 0.2868852 0.2868852 0.5000000), wk = 0.0027548 k( 287) = ( 0.2786885 0.2786885 0.5000000), wk = 0.0027548 k( 288) = ( 0.2704918 0.2704918 0.5000000), wk = 0.0027548 k( 289) = ( 0.2622951 0.2622951 0.5000000), wk = 0.0027548 k( 290) = ( 0.2540984 0.2540984 0.5000000), wk = 0.0027548 k( 291) = ( 0.2459016 0.2459016 0.5000000), wk = 0.0027548 k( 292) = ( 0.2377049 0.2377049 0.5000000), wk = 0.0027548 k( 293) = ( 0.2295082 0.2295082 0.5000000), wk = 0.0027548 k( 294) = ( 0.2213115 0.2213115 0.5000000), wk = 0.0027548 k( 295) = ( 0.2131147 0.2131147 0.5000000), wk = 0.0027548 k( 296) = ( 0.2049180 0.2049180 0.5000000), wk = 0.0027548 k( 297) = ( 0.1967213 0.1967213 0.5000000), wk = 0.0027548 k( 298) = ( 0.1885246 0.1885246 0.5000000), wk = 0.0027548 k( 299) = ( 0.1803279 0.1803279 0.5000000), wk = 0.0027548 k( 300) = ( 0.1721312 0.1721312 0.5000000), wk = 0.0027548 k( 301) = ( 0.1639344 0.1639344 0.5000000), wk = 0.0027548 k( 302) = ( 0.1557377 0.1557377 0.5000000), wk = 0.0027548 k( 303) = ( 0.1475410 0.1475410 0.5000000), wk = 0.0027548 k( 304) = ( 0.1393443 0.1393443 0.5000000), wk = 0.0027548 k( 305) = ( 0.1311475 0.1311475 0.5000000), wk = 0.0027548 k( 306) = ( 0.1229508 0.1229508 0.5000000), wk = 0.0027548 k( 307) = ( 0.1147541 0.1147541 0.5000000), wk = 0.0027548 k( 308) = ( 0.1065574 0.1065574 0.5000000), wk = 0.0027548 k( 309) = ( 0.0983607 0.0983607 0.5000000), wk = 0.0027548 k( 310) = ( 0.0901639 0.0901639 0.5000000), wk = 0.0027548 k( 311) = ( 0.0819672 0.0819672 0.5000000), wk = 0.0027548 k( 312) = ( 0.0737705 0.0737705 0.5000000), wk = 0.0027548 k( 313) = ( 0.0655738 0.0655738 0.5000000), wk = 0.0027548 k( 314) = ( 0.0573770 0.0573770 0.5000000), wk = 0.0027548 k( 315) = ( 0.0491803 0.0491803 0.5000000), wk = 0.0027548 k( 316) = ( 0.0409836 0.0409836 0.5000000), wk = 0.0027548 k( 317) = ( 0.0327869 0.0327869 0.5000000), wk = 0.0027548 k( 318) = ( 0.0245902 0.0245902 0.5000000), wk = 0.0027548 k( 319) = ( 0.0163934 0.0163934 0.5000000), wk = 0.0027548 k( 320) = ( 0.0081967 0.0081967 0.5000000), wk = 0.0027548 k( 321) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0027548 k( 322) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0027548 k( 323) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0027548 k( 324) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0027548 k( 325) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0027548 k( 326) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0027548 k( 327) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0027548 k( 328) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0027548 k( 329) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0027548 k( 330) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0027548 k( 331) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0027548 k( 332) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0027548 k( 333) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0027548 k( 334) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0027548 k( 335) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0027548 k( 336) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0027548 k( 337) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0027548 k( 338) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0027548 k( 339) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0027548 k( 340) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0027548 k( 341) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0027548 k( 342) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0027548 k( 343) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0027548 k( 344) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0027548 k( 345) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0027548 k( 346) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0027548 k( 347) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0027548 k( 348) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0027548 k( 349) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0027548 k( 350) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0027548 k( 351) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0027548 k( 352) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0027548 k( 353) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0027548 k( 354) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0027548 k( 355) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0027548 k( 356) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0027548 k( 357) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0027548 k( 358) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0027548 k( 359) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0027548 k( 360) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0027548 k( 361) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0027548 k( 362) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0027548 k( 363) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0027548 Dense grid: 55177 G-vectors FFT dimensions: ( 40, 40, 81) Smooth grid: 33905 G-vectors FFT dimensions: ( 32, 32, 72) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.20 Mb ( 246, 52) NL pseudopotentials 0.23 Mb ( 123, 124) Each V/rho on FFT grid 0.07 Mb ( 4800) Each G-vector array 0.01 Mb ( 1530) G-vector shells 0.01 Mb ( 731) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.78 Mb ( 246, 208) Each subspace H/S matrix 0.04 Mb ( 52, 52) Each matrix 0.20 Mb ( 124, 2, 52) The potential is recalculated from file : ./HfGeSe.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 2.3 secs Computing kpt #: 2 total cpu time spent up to now is 2.8 secs Computing kpt #: 3 total cpu time spent up to now is 3.2 secs Computing kpt #: 4 total cpu time spent up to now is 3.6 secs Computing kpt #: 5 total cpu time spent up to now is 4.1 secs Computing kpt #: 6 total cpu time spent up to now is 4.4 secs Computing kpt #: 7 total cpu time spent up to now is 4.8 secs Computing kpt #: 8 total cpu time spent up to now is 5.2 secs Computing kpt #: 9 total cpu time spent up to now is 5.5 secs Computing kpt #: 10 total cpu time spent up to now is 5.9 secs Computing kpt #: 11 total cpu time spent up to now is 6.2 secs Computing kpt #: 12 total cpu time spent up to now is 6.5 secs Computing kpt #: 13 total cpu time spent up to now is 6.9 secs Computing kpt #: 14 total cpu time spent up to now is 7.2 secs Computing kpt #: 15 total cpu time spent up to now is 7.5 secs Computing kpt #: 16 total cpu time spent up to now is 7.9 secs Computing kpt #: 17 total cpu time spent up to now is 8.2 secs Computing kpt #: 18 total cpu time spent up to now is 8.6 secs Computing kpt #: 19 total cpu time spent up to now is 8.9 secs Computing kpt #: 20 total cpu time spent up to now is 9.3 secs Computing kpt #: 21 total cpu time spent up to now is 9.6 secs Computing kpt #: 22 total cpu time spent up to now is 10.0 secs Computing kpt #: 23 total cpu time spent up to now is 10.3 secs Computing kpt #: 24 total cpu time spent up to now is 10.7 secs Computing kpt #: 25 total cpu time spent up to now is 11.0 secs Computing kpt #: 26 total cpu time spent up to now is 11.4 secs Computing kpt #: 27 total cpu time spent up to now is 11.7 secs Computing kpt #: 28 total cpu time spent up to now is 12.1 secs Computing kpt #: 29 total cpu time spent up to now is 12.4 secs Computing kpt #: 30 total cpu time spent up to now is 12.8 secs Computing kpt #: 31 total cpu time spent up to now is 13.2 secs Computing kpt #: 32 total cpu time spent up to now is 13.5 secs Computing kpt #: 33 total cpu time spent up to now is 13.9 secs Computing kpt #: 34 total cpu time spent up to now is 14.3 secs Computing kpt #: 35 total cpu time spent up to now is 14.7 secs Computing kpt #: 36 total cpu time spent up to now is 15.2 secs Computing kpt #: 37 total cpu time spent up to now is 15.7 secs Computing kpt #: 38 total cpu time spent up to now is 16.2 secs Computing kpt #: 39 total cpu time spent up to now is 16.6 secs Computing kpt #: 40 total cpu time spent up to now is 17.0 secs Computing kpt #: 41 total cpu time spent up to now is 17.4 secs Computing kpt #: 42 total cpu time spent up to now is 17.8 secs Computing kpt #: 43 total cpu time spent up to now is 18.2 secs Computing kpt #: 44 total cpu time spent up to now is 18.5 secs Computing kpt #: 45 total cpu time spent up to now is 18.9 secs Computing kpt #: 46 total cpu time spent up to now is 19.3 secs Computing kpt #: 47 total cpu time spent up to now is 19.6 secs Computing kpt #: 48 total cpu time spent up to now is 20.0 secs Computing kpt #: 49 total cpu time spent up to now is 20.3 secs Computing kpt #: 50 total cpu time spent up to now is 20.7 secs Computing kpt #: 51 total cpu time spent up to now is 21.1 secs Computing kpt #: 52 total cpu time spent up to now is 21.4 secs Computing kpt #: 53 total cpu time spent up to now is 21.8 secs Computing kpt #: 54 total cpu time spent up to now is 22.2 secs Computing kpt #: 55 total cpu time spent up to now is 22.5 secs Computing kpt #: 56 total cpu time spent up to now is 22.9 secs Computing kpt #: 57 total cpu time spent up to now is 23.3 secs Computing kpt #: 58 total cpu time spent up to now is 23.7 secs Computing kpt #: 59 total cpu time spent up to now is 24.0 secs Computing kpt #: 60 total cpu time spent up to now is 24.4 secs Computing kpt #: 61 total cpu time spent up to now is 24.8 secs Computing kpt #: 62 total cpu time spent up to now is 25.2 secs Computing kpt #: 63 total cpu time spent up to now is 25.6 secs Computing kpt #: 64 total cpu time spent up to now is 26.0 secs Computing kpt #: 65 total cpu time spent up to now is 26.4 secs Computing kpt #: 66 total cpu time spent up to now is 26.8 secs Computing kpt #: 67 total cpu time spent up to now is 27.2 secs Computing kpt #: 68 total cpu time spent up to now is 27.6 secs Computing kpt #: 69 total cpu time spent up to now is 28.0 secs Computing kpt #: 70 total cpu time spent up to now is 28.5 secs Computing kpt #: 71 total cpu time spent up to now is 28.9 secs Computing kpt #: 72 total cpu time spent up to now is 29.3 secs Computing kpt #: 73 total cpu time spent up to now is 29.6 secs Computing kpt #: 74 total cpu time spent up to now is 30.1 secs Computing kpt #: 75 total cpu time spent up to now is 30.5 secs Computing kpt #: 76 total cpu time spent up to now is 30.9 secs Computing kpt #: 77 total cpu time spent up to now is 31.4 secs Computing kpt #: 78 total cpu time spent up to now is 31.8 secs Computing kpt #: 79 total cpu time spent up to now is 32.2 secs Computing kpt #: 80 total cpu time spent up to now is 32.7 secs Computing kpt #: 81 total cpu time spent up to now is 33.1 secs Computing kpt #: 82 total cpu time spent up to now is 33.5 secs Computing kpt #: 83 total cpu time spent up to now is 34.0 secs Computing kpt #: 84 total cpu 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Computing kpt #: 100 total cpu time spent up to now is 41.6 secs Computing kpt #: 101 total cpu time spent up to now is 42.0 secs Computing kpt #: 102 total cpu time spent up to now is 42.5 secs Computing kpt #: 103 total cpu time spent up to now is 42.9 secs Computing kpt #: 104 total cpu time spent up to now is 43.3 secs Computing kpt #: 105 total cpu time spent up to now is 43.8 secs Computing kpt #: 106 total cpu time spent up to now is 44.2 secs Computing kpt #: 107 total cpu time spent up to now is 44.7 secs Computing kpt #: 108 total cpu time spent up to now is 45.1 secs Computing kpt #: 109 total cpu time spent up to now is 45.5 secs Computing kpt #: 110 total cpu time spent up to now is 45.9 secs Computing kpt #: 111 total cpu time spent up to now is 46.4 secs Computing kpt #: 112 total cpu time spent up to now is 46.8 secs Computing kpt #: 113 total cpu time spent up to now is 47.2 secs Computing kpt #: 114 total cpu time spent up to now is 47.7 secs Computing kpt #: 115 total cpu time spent up to now is 48.1 secs Computing kpt #: 116 total cpu time spent up to now is 48.5 secs Computing kpt #: 117 total cpu time spent up to now is 48.9 secs Computing kpt #: 118 total cpu time spent up to now is 49.4 secs Computing kpt #: 119 total cpu time spent up to now is 49.8 secs Computing kpt #: 120 total cpu time spent up to now is 50.2 secs Computing kpt #: 121 total cpu time spent up to now is 50.5 secs Computing kpt #: 122 total cpu time spent up to now is 50.9 secs Computing kpt #: 123 total cpu time spent up to now is 51.3 secs Computing kpt #: 124 total cpu time spent up to now is 51.6 secs Computing kpt #: 125 total cpu time spent up to now is 52.0 secs Computing kpt #: 126 total cpu time spent up to now is 52.4 secs Computing kpt #: 127 total cpu time spent up to now is 52.7 secs Computing kpt #: 128 total cpu time spent up to now is 53.1 secs Computing kpt #: 129 total cpu time spent up to now is 53.4 secs Computing kpt #: 130 total cpu time spent up to now is 53.9 secs Computing kpt #: 131 total cpu time spent up to now is 54.2 secs Computing kpt #: 132 total cpu time spent up to now is 54.6 secs Computing kpt #: 133 total cpu time spent up to now is 55.0 secs Computing kpt #: 134 total cpu time spent up to now is 55.3 secs Computing kpt #: 135 total cpu time spent up to now is 55.7 secs Computing kpt #: 136 total cpu time spent up to now is 56.0 secs Computing kpt #: 137 total cpu time spent up to now is 56.4 secs Computing kpt #: 138 total cpu time spent up to now is 56.7 secs Computing kpt #: 139 total cpu time spent up to now is 57.1 secs Computing kpt #: 140 total cpu time spent up to now is 57.5 secs Computing kpt #: 141 total cpu time spent up to now is 57.9 secs Computing kpt #: 142 total cpu time spent up to now is 58.2 secs Computing kpt #: 143 total cpu time spent up to now is 58.6 secs Computing kpt #: 144 total cpu time spent up to now is 59.0 secs Computing kpt #: 145 total cpu time spent up to now is 59.5 secs Computing kpt #: 146 total cpu time spent up to now is 59.9 secs Computing kpt #: 147 total cpu time spent up to now is 60.3 secs Computing kpt #: 148 total cpu time spent up to now is 60.8 secs Computing kpt #: 149 total cpu time spent up to now is 61.2 secs Computing kpt #: 150 total cpu time spent up to now is 61.7 secs Computing kpt #: 151 total cpu time spent up to now is 62.1 secs Computing kpt #: 152 total cpu time spent up to now is 62.6 secs Computing kpt #: 153 total cpu time spent up to now is 63.0 secs Computing kpt #: 154 total cpu time spent up to now is 63.5 secs Computing kpt #: 155 total cpu time spent up to now is 63.9 secs Computing kpt #: 156 total cpu time spent up to now is 64.4 secs Computing kpt #: 157 total cpu time spent up to now is 64.8 secs Computing kpt #: 158 total cpu time spent up to now is 65.2 secs Computing kpt #: 159 total cpu time spent up to now is 65.7 secs Computing kpt #: 160 total cpu time spent up to now is 66.1 secs Computing kpt #: 161 total cpu time spent up to now is 66.6 secs Computing kpt #: 162 total cpu time spent up to now is 67.0 secs Computing kpt #: 163 total cpu time spent up to now is 67.4 secs Computing kpt #: 164 total cpu time spent up to now is 67.9 secs Computing kpt #: 165 total cpu time spent up to now is 68.3 secs Computing kpt #: 166 total cpu time spent up to now is 68.7 secs Computing kpt #: 167 total cpu time spent up to now is 69.1 secs Computing kpt #: 168 total cpu time spent up to now is 69.4 secs Computing kpt #: 169 total cpu time spent up to now is 69.9 secs Computing kpt #: 170 total cpu time spent up to now is 70.3 secs Computing kpt #: 171 total cpu time spent up to now is 70.7 secs Computing kpt #: 172 total cpu time spent up to now is 71.1 secs Computing kpt #: 173 total cpu time spent up to now is 71.5 secs Computing kpt #: 174 total cpu time spent up to now is 71.9 secs Computing kpt #: 175 total cpu time spent up to now is 72.4 secs Computing kpt #: 176 total cpu time spent up to now is 72.8 secs Computing kpt #: 177 total cpu time spent up to now is 73.2 secs Computing kpt #: 178 total cpu time spent up to now is 73.6 secs Computing kpt #: 179 total cpu time spent up to now is 74.0 secs Computing kpt #: 180 total cpu time spent up to now is 74.5 secs Computing kpt #: 181 total cpu time spent up to now is 74.9 secs Computing kpt #: 182 total cpu time spent up to now is 75.2 secs Computing kpt #: 183 total cpu time spent up to now is 75.6 secs Computing kpt #: 184 total cpu time spent up to now is 75.9 secs Computing kpt #: 185 total cpu time spent up to now is 76.3 secs Computing kpt #: 186 total cpu time spent up to now is 76.6 secs Computing kpt #: 187 total cpu time spent up to now is 76.9 secs Computing kpt #: 188 total cpu time spent up to now is 77.3 secs Computing kpt #: 189 total cpu time spent up to now is 77.6 secs Computing kpt #: 190 total cpu time spent up to now is 78.0 secs Computing kpt #: 191 total cpu time spent up to now is 78.3 secs Computing kpt #: 192 total cpu time spent up to now is 78.7 secs Computing kpt #: 193 total cpu time spent up to now is 79.1 secs Computing kpt #: 194 total cpu time spent up to now is 79.4 secs Computing kpt #: 195 total cpu time spent up to now is 79.8 secs Computing kpt #: 196 total cpu time spent up to now is 80.2 secs Computing kpt #: 197 total cpu time spent up to now is 80.5 secs Computing kpt #: 198 total cpu time spent up to now is 80.9 secs Computing kpt #: 199 total cpu time spent up to now is 81.3 secs Computing kpt #: 200 total cpu time spent up to now is 81.7 secs Computing kpt #: 201 total cpu time spent up to now is 82.2 secs Computing kpt #: 202 total cpu time spent up to now is 82.5 secs Computing kpt #: 203 total cpu time spent up to now is 82.9 secs Computing kpt #: 204 total cpu time spent up to now is 83.2 secs Computing kpt #: 205 total cpu time spent up to now is 83.6 secs Computing kpt #: 206 total cpu time spent up to now is 84.0 secs Computing kpt #: 207 total cpu time spent up to now is 84.4 secs Computing kpt #: 208 total cpu time spent up to now is 84.7 secs Computing kpt #: 209 total cpu time spent up to now is 85.2 secs Computing kpt #: 210 total cpu time spent up to now is 85.6 secs Computing kpt #: 211 total cpu time spent up to now is 86.1 secs Computing kpt #: 212 total cpu time spent up to now is 86.5 secs Computing kpt #: 213 total cpu time spent up to now is 86.8 secs Computing kpt #: 214 total cpu time spent up to now is 87.2 secs Computing kpt #: 215 total cpu time spent up to now is 87.6 secs Computing kpt #: 216 total cpu time spent up to now is 88.0 secs Computing kpt #: 217 total cpu time spent up to now is 88.3 secs Computing kpt #: 218 total cpu time spent up to now is 88.7 secs Computing kpt #: 219 total cpu time spent up to now is 89.1 secs Computing kpt #: 220 total cpu time spent up to now is 89.5 secs Computing kpt #: 221 total cpu time spent up to now is 89.8 secs Computing kpt #: 222 total cpu time spent up to now is 90.2 secs Computing kpt #: 223 total cpu time spent up to now is 90.6 secs Computing kpt #: 224 total cpu time spent up to now is 91.0 secs Computing kpt #: 225 total cpu time spent up to now is 91.4 secs Computing kpt #: 226 total cpu time spent up to now is 91.7 secs Computing kpt #: 227 total cpu time spent up to now is 92.1 secs Computing kpt #: 228 total cpu time spent up to now is 92.5 secs Computing kpt #: 229 total cpu time spent up to now is 92.9 secs Computing kpt #: 230 total cpu time spent up to now is 93.4 secs Computing kpt #: 231 total cpu time spent up to now is 93.8 secs Computing kpt #: 232 total cpu time spent up to now is 94.2 secs Computing kpt #: 233 total cpu time spent up to now is 94.6 secs Computing kpt #: 234 total cpu time spent up to now is 95.1 secs Computing kpt #: 235 total cpu time spent up to now is 95.5 secs Computing kpt #: 236 total cpu time spent up to now is 96.0 secs Computing kpt #: 237 total cpu time spent up to now is 96.4 secs Computing kpt #: 238 total cpu time spent up to now is 96.8 secs Computing kpt #: 239 total cpu time spent up to now is 97.3 secs Computing kpt #: 240 total cpu time spent up to now is 97.7 secs Computing kpt #: 241 total cpu time spent up to now is 98.1 secs Computing kpt #: 242 total cpu time spent up to now is 98.6 secs Computing kpt #: 243 total cpu time spent up to now is 99.0 secs Computing kpt #: 244 total cpu time spent up to now is 99.4 secs Computing kpt #: 245 total cpu time spent up to now is 99.8 secs Computing kpt #: 246 total cpu time spent up to now is 100.1 secs Computing kpt #: 247 total cpu time spent up to now is 100.5 secs Computing kpt #: 248 total cpu time spent up to now is 100.9 secs Computing kpt #: 249 total cpu time spent up to now is 101.3 secs Computing kpt #: 250 total cpu time spent up to now is 101.7 secs Computing kpt #: 251 total cpu time spent up to now is 102.1 secs Computing kpt #: 252 total cpu time spent up to now is 102.4 secs Computing kpt #: 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cpu time spent up to now is 109.5 secs Computing kpt #: 269 total cpu time spent up to now is 110.0 secs Computing kpt #: 270 total cpu time spent up to now is 110.4 secs Computing kpt #: 271 total cpu time spent up to now is 110.8 secs Computing kpt #: 272 total cpu time spent up to now is 111.3 secs Computing kpt #: 273 total cpu time spent up to now is 111.7 secs Computing kpt #: 274 total cpu time spent up to now is 112.2 secs Computing kpt #: 275 total cpu time spent up to now is 112.6 secs Computing kpt #: 276 total cpu time spent up to now is 113.1 secs Computing kpt #: 277 total cpu time spent up to now is 113.5 secs Computing kpt #: 278 total cpu time spent up to now is 113.9 secs Computing kpt #: 279 total cpu time spent up to now is 114.4 secs Computing kpt #: 280 total cpu time spent up to now is 114.8 secs Computing kpt #: 281 total cpu time spent up to now is 115.2 secs Computing kpt #: 282 total cpu time spent up to now is 115.6 secs Computing kpt #: 283 total cpu time spent up to now is 115.9 secs Computing kpt #: 284 total cpu time spent up to now is 116.3 secs Computing kpt #: 285 total cpu time spent up to now is 116.6 secs Computing kpt #: 286 total cpu time spent up to now is 117.0 secs Computing kpt #: 287 total cpu time spent up to now is 117.4 secs Computing kpt #: 288 total cpu time spent up to now is 117.8 secs Computing kpt #: 289 total cpu time spent up to now is 118.2 secs Computing kpt #: 290 total cpu time spent up to now is 118.6 secs Computing kpt #: 291 total cpu time spent up to now is 119.0 secs Computing kpt #: 292 total cpu time spent up to now is 119.4 secs Computing kpt #: 293 total cpu time spent up to now is 119.8 secs Computing kpt #: 294 total cpu time spent up to now is 120.3 secs Computing kpt #: 295 total cpu time spent up to now is 120.7 secs Computing kpt #: 296 total cpu time spent up to now is 121.1 secs Computing kpt #: 297 total cpu time spent up to now is 121.6 secs Computing kpt #: 298 total cpu time spent up to now is 122.0 secs Computing kpt #: 299 total cpu time spent up to now is 122.4 secs Computing kpt #: 300 total cpu time spent up to now is 122.8 secs Computing kpt #: 301 total cpu time spent up to now is 123.2 secs Computing kpt #: 302 total cpu time spent up to now is 123.5 secs Computing kpt #: 303 total cpu time spent up to now is 123.9 secs Computing kpt #: 304 total cpu time spent up to now is 124.3 secs Computing kpt #: 305 total cpu time spent up to now is 124.6 secs Computing kpt #: 306 total cpu time spent up to now is 125.0 secs Computing kpt #: 307 total cpu time spent up to now is 125.4 secs Computing kpt #: 308 total cpu time spent up to now is 125.8 secs Computing kpt #: 309 total cpu time spent up to now is 126.2 secs Computing kpt #: 310 total cpu time spent up to now is 126.6 secs Computing kpt #: 311 total cpu time spent up to now is 127.1 secs Computing kpt #: 312 total cpu time spent up to now is 127.5 secs Computing kpt #: 313 total cpu time spent up to now is 127.9 secs Computing kpt #: 314 total cpu time spent up to now is 128.3 secs Computing kpt #: 315 total cpu time spent up to now is 128.8 secs Computing kpt #: 316 total cpu time spent up to now is 129.2 secs Computing kpt #: 317 total cpu time spent up to now is 129.6 secs Computing kpt #: 318 total cpu time spent up to now is 130.0 secs Computing kpt #: 319 total cpu time spent up to now is 130.4 secs Computing kpt #: 320 total cpu time spent up to now is 130.9 secs Computing kpt #: 321 total cpu time spent up to now is 131.2 secs Computing kpt #: 322 total cpu time spent up to now is 131.6 secs Computing kpt #: 323 total cpu time spent up to now is 131.9 secs Computing kpt #: 324 total cpu time spent up to now is 132.3 secs Computing kpt #: 325 total cpu time spent up to now is 132.7 secs Computing kpt #: 326 total cpu time spent up to now is 133.0 secs Computing kpt #: 327 total cpu time spent up to now is 133.4 secs Computing kpt #: 328 total cpu time spent up to now is 133.8 secs Computing kpt #: 329 total cpu time spent up to now is 134.2 secs Computing kpt #: 330 total cpu time spent up to now is 134.6 secs Computing kpt #: 331 total cpu time spent up to now is 135.0 secs Computing kpt #: 332 total cpu time spent up to now is 135.5 secs Computing kpt #: 333 total cpu time spent up to now is 135.9 secs Computing kpt #: 334 total cpu time spent up to now is 136.3 secs Computing kpt #: 335 total cpu time spent up to now is 136.7 secs Computing kpt #: 336 total cpu time spent up to now is 137.1 secs Computing kpt #: 337 total cpu time spent up to now is 137.4 secs Computing kpt #: 338 total cpu time spent up to now is 137.8 secs Computing kpt #: 339 total cpu time spent up to now is 138.2 secs Computing kpt #: 340 total cpu time spent up to now is 138.6 secs Computing kpt #: 341 total cpu time spent up to now is 138.9 secs Computing kpt #: 342 total cpu time spent up to now is 139.3 secs Computing kpt #: 343 total cpu time spent up to now is 139.7 secs Computing kpt #: 344 total cpu time spent up to now is 143.0 secs Computing kpt #: 345 total cpu time spent up to now is 143.5 secs Computing kpt #: 346 total cpu time spent up to now is 143.9 secs Computing kpt #: 347 total cpu time spent up to now is 144.4 secs Computing kpt #: 348 total cpu time spent up to now is 144.8 secs Computing kpt #: 349 total cpu time spent up to now is 145.2 secs Computing kpt #: 350 total cpu time spent up to now is 145.6 secs Computing kpt #: 351 total cpu time spent up to now is 146.0 secs Computing kpt #: 352 total cpu time spent up to now is 146.4 secs Computing kpt #: 353 total cpu time spent up to now is 146.8 secs Computing kpt #: 354 total cpu time spent up to now is 147.2 secs Computing kpt #: 355 total cpu time spent up to now is 147.6 secs Computing kpt #: 356 total cpu time spent up to now is 147.9 secs Computing kpt #: 357 total cpu time spent up to now is 148.3 secs Computing kpt #: 358 total cpu time spent up to now is 148.7 secs Computing kpt #: 359 total cpu time spent up to now is 149.1 secs Computing kpt #: 360 total cpu time spent up to now is 149.5 secs Computing kpt #: 361 total cpu time spent up to now is 149.9 secs Computing kpt #: 362 total cpu time spent up to now is 150.4 secs Computing kpt #: 363 total cpu time spent up to now is 150.8 secs ethr = 2.27E-08, avg # of iterations = 20.4 total cpu time spent up to now is 150.8 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 4219 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7084 -24.7084 -24.7055 -24.7055 -16.9974 -16.9974 -16.9721 -16.9721 -16.9713 -16.9713 -16.9681 -16.9681 -3.1220 -3.1220 -1.4543 -1.4543 0.1085 0.1085 6.6203 6.6203 6.7111 6.7111 8.1848 8.1848 8.4129 8.4129 8.4981 8.4981 9.7362 9.7362 9.7675 9.7675 10.2326 10.2326 10.2416 10.2416 10.7013 10.7013 11.3878 11.3878 12.1009 12.1009 12.6905 12.6905 13.8101 13.8101 13.8183 13.8183 k = 0.0000 0.0116-0.0000 ( 4221 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7055 -24.7055 -16.9974 -16.9974 -16.9722 -16.9722 -16.9713 -16.9713 -16.9682 -16.9682 -3.1209 -3.1209 -1.4537 -1.4537 0.1098 0.1098 6.6214 6.6214 6.7073 6.7073 8.1841 8.1841 8.3989 8.3989 8.4989 8.4989 9.7405 9.7405 9.7720 9.7720 10.1855 10.1855 10.2795 10.2795 10.7018 10.7018 11.3879 11.3879 12.1086 12.1086 12.6946 12.6946 13.7655 13.7655 13.8486 13.8486 k = 0.0000 0.0233-0.0000 ( 4231 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7086 -24.7086 -24.7056 -24.7056 -16.9976 -16.9976 -16.9725 -16.9725 -16.9714 -16.9714 -16.9685 -16.9685 -3.1175 -3.1175 -1.4521 -1.4521 0.1136 0.1136 6.6244 6.6244 6.6962 6.6962 8.1810 8.1810 8.3602 8.3602 8.5002 8.5002 9.7491 9.7491 9.7889 9.7889 10.1256 10.1256 10.3115 10.3115 10.7036 10.7036 11.3880 11.3880 12.1314 12.1314 12.7068 12.7068 13.7165 13.7165 13.8506 13.8506 k = 0.0000 0.0349-0.0000 ( 4231 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7087 -24.7087 -24.7057 -24.7057 -16.9976 -16.9976 -16.9729 -16.9729 -16.9716 -16.9716 -16.9688 -16.9688 -3.1117 -3.1117 -1.4493 -1.4493 0.1200 0.1200 6.6286 6.6286 6.6785 6.6785 8.1714 8.1714 8.3052 8.3052 8.5005 8.5005 9.7570 9.7570 9.8213 9.8213 10.0574 10.0574 10.3324 10.3324 10.7079 10.7079 11.3880 11.3880 12.1681 12.1681 12.7273 12.7273 13.6702 13.6702 13.8329 13.8329 k = 0.0000 0.0465-0.0000 ( 4231 PWs) bands (ev): -50.4028 -50.4028 -50.4025 -50.4025 -24.7088 -24.7088 -24.7058 -24.7058 -16.9977 -16.9977 -16.9735 -16.9735 -16.9720 -16.9720 -16.9692 -16.9692 -3.1037 -3.1037 -1.4455 -1.4455 0.1289 0.1289 6.6289 6.6289 6.6597 6.6597 8.1388 8.1388 8.2541 8.2541 8.5000 8.5000 9.7648 9.7648 9.8655 9.8655 9.9816 9.9816 10.3413 10.3413 10.7162 10.7162 11.3878 11.3878 12.2170 12.2170 12.7565 12.7565 13.6276 13.6276 13.8052 13.8052 k = 0.0000 0.0581-0.0000 ( 4235 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7091 -24.7091 -24.7060 -24.7060 -16.9979 -16.9979 -16.9743 -16.9743 -16.9728 -16.9728 -16.9693 -16.9693 -3.0934 -3.0934 -1.4407 -1.4407 0.1404 0.1404 6.6072 6.6072 6.6580 6.6580 8.0624 8.0624 8.2312 8.2312 8.4993 8.4993 9.7736 9.7736 9.8931 9.8931 9.9232 9.9232 10.3380 10.3380 10.7294 10.7294 11.3872 11.3872 12.2757 12.2757 12.7945 12.7945 13.5894 13.5894 13.7708 13.7708 k = 0.0000 0.0698-0.0000 ( 4227 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7092 -24.7092 -24.7062 -24.7062 -16.9980 -16.9980 -16.9751 -16.9751 -16.9739 -16.9739 -16.9694 -16.9694 -3.0809 -3.0809 -1.4349 -1.4349 0.1544 0.1544 6.5690 6.5690 6.6683 6.6683 7.9558 7.9558 8.2261 8.2261 8.4988 8.4988 9.7841 9.7841 9.8053 9.8053 9.9790 9.9790 10.3232 10.3232 10.7476 10.7476 11.3861 11.3861 12.3415 12.3415 12.8417 12.8417 13.5556 13.5556 13.7317 13.7317 k = 0.0000 0.0814-0.0000 ( 4229 PWs) bands (ev): -50.4026 -50.4026 -50.4024 -50.4024 -24.7095 -24.7095 -24.7064 -24.7064 -16.9984 -16.9984 -16.9761 -16.9761 -16.9752 -16.9752 -16.9693 -16.9693 -3.0662 -3.0662 -1.4281 -1.4281 0.1710 0.1710 6.5228 6.5228 6.6825 6.6825 7.8331 7.8331 8.2274 8.2274 8.4989 8.4989 9.7081 9.7081 9.7965 9.7965 10.0416 10.0416 10.2984 10.2984 10.7702 10.7702 11.3845 11.3845 12.4115 12.4115 12.8978 12.8978 13.5265 13.5265 13.6897 13.6897 k = 0.0000 0.0930-0.0000 ( 4229 PWs) bands (ev): -50.4026 -50.4026 -50.4024 -50.4024 -24.7098 -24.7098 -24.7067 -24.7067 -16.9988 -16.9988 -16.9774 -16.9774 -16.9766 -16.9766 -16.9692 -16.9692 -3.0492 -3.0492 -1.4205 -1.4205 0.1902 0.1902 6.4703 6.4703 6.6994 6.6994 7.6999 7.6999 8.2318 8.2318 8.4999 8.4999 9.6048 9.6048 9.8109 9.8109 10.1069 10.1069 10.2656 10.2656 10.7962 10.7962 11.3823 11.3823 12.4833 12.4833 12.9619 12.9619 13.5025 13.5025 13.6465 13.6465 k = 0.0000 0.1047-0.0000 ( 4221 PWs) bands (ev): -50.4025 -50.4025 -50.4023 -50.4023 -24.7101 -24.7101 -24.7069 -24.7069 -16.9994 -16.9994 -16.9792 -16.9792 -16.9776 -16.9776 -16.9689 -16.9689 -3.0301 -3.0301 -1.4122 -1.4122 0.2119 0.2119 6.4124 6.4124 6.7186 6.7186 7.5590 7.5590 8.2382 8.2382 8.5024 8.5024 9.4963 9.4963 9.8274 9.8274 10.1713 10.1713 10.2287 10.2287 10.8248 10.8248 11.3797 11.3797 12.5548 12.5548 13.0313 13.0313 13.4848 13.4848 13.6041 13.6041 k = 0.0000 0.1163-0.0000 ( 4225 PWs) bands (ev): -50.4025 -50.4025 -50.4023 -50.4023 -24.7104 -24.7104 -24.7073 -24.7073 -17.0002 -17.0002 -16.9814 -16.9814 -16.9784 -16.9784 -16.9687 -16.9687 -3.0089 -3.0089 -1.4031 -1.4031 0.2362 0.2362 6.3498 6.3498 6.7397 6.7397 7.4125 7.4125 8.2459 8.2459 8.5064 8.5064 9.3834 9.3834 9.8462 9.8462 10.1740 10.1740 10.2493 10.2493 10.8552 10.8552 11.3765 11.3765 12.6248 12.6248 13.1008 13.1008 13.4752 13.4752 13.5654 13.5654 k = 0.0000 0.1279-0.0000 ( 4231 PWs) bands (ev): -50.4024 -50.4024 -50.4022 -50.4022 -24.7108 -24.7108 -24.7077 -24.7077 -17.0013 -17.0013 -16.9838 -16.9838 -16.9792 -16.9792 -16.9684 -16.9684 -2.9855 -2.9855 -1.3935 -1.3935 0.2630 0.2630 6.2833 6.2833 6.7626 6.7626 7.2617 7.2617 8.2546 8.2546 8.5124 8.5124 9.2670 9.2670 9.8672 9.8672 10.1262 10.1262 10.3165 10.3165 10.8865 10.8865 11.3729 11.3729 12.6928 12.6928 13.1613 13.1613 13.4743 13.4743 13.5374 13.5374 k = 0.0000 0.1395-0.0000 ( 4223 PWs) bands (ev): -50.4023 -50.4023 -50.4021 -50.4021 -24.7111 -24.7111 -24.7081 -24.7081 -17.0027 -17.0027 -16.9863 -16.9863 -16.9797 -16.9797 -16.9681 -16.9681 -2.9602 -2.9602 -1.3834 -1.3834 0.2925 0.2925 6.2132 6.2132 6.7871 6.7871 7.1081 7.1081 8.2639 8.2639 8.5205 8.5205 9.1480 9.1480 9.8906 9.8906 10.0733 10.0733 10.3856 10.3856 10.9183 10.9183 11.3690 11.3690 12.7583 12.7583 13.2020 13.2020 13.4672 13.4672 13.5448 13.5448 k = 0.0000 0.1512-0.0000 ( 4223 PWs) bands (ev): -50.4023 -50.4023 -50.4021 -50.4021 -24.7115 -24.7115 -24.7085 -24.7085 -17.0044 -17.0044 -16.9891 -16.9891 -16.9800 -16.9800 -16.9677 -16.9677 -2.9328 -2.9328 -1.3729 -1.3729 0.3245 0.3245 6.1403 6.1403 6.8129 6.8129 6.9525 6.9525 8.2733 8.2733 8.5311 8.5311 9.0273 9.0273 9.9162 9.9162 10.0175 10.0175 10.4545 10.4545 10.9498 10.9498 11.3650 11.3650 12.8209 12.8209 13.2191 13.2191 13.4473 13.4473 13.5960 13.5960 k = 0.0000 0.1628-0.0000 ( 4225 PWs) bands (ev): -50.4022 -50.4022 -50.4020 -50.4020 -24.7119 -24.7119 -24.7090 -24.7090 -17.0063 -17.0063 -16.9920 -16.9920 -16.9801 -16.9801 -16.9674 -16.9674 -2.9035 -2.9035 -1.3622 -1.3622 0.3590 0.3590 6.0649 6.0649 6.7962 6.7962 6.8397 6.8397 8.2826 8.2826 8.5442 8.5442 8.9060 8.9060 9.9400 9.9400 9.9639 9.9639 10.5224 10.5224 10.9805 10.9805 11.3611 11.3611 12.8792 12.8792 13.2209 13.2209 13.4276 13.4276 13.6692 13.6692 k = 0.0000 0.1744-0.0000 ( 4217 PWs) bands (ev): -50.4021 -50.4021 -50.4019 -50.4019 -24.7123 -24.7123 -24.7095 -24.7095 -17.0085 -17.0085 -16.9950 -16.9950 -16.9801 -16.9801 -16.9670 -16.9670 -2.8723 -2.8723 -1.3514 -1.3514 0.3962 0.3962 5.9872 5.9872 6.6400 6.6400 6.8670 6.8670 8.2912 8.2912 8.5596 8.5596 8.7856 8.7856 9.8966 9.8966 9.9785 9.9785 10.5885 10.5885 11.0098 11.0098 11.3579 11.3579 12.9309 12.9309 13.2190 13.2190 13.4110 13.4110 13.7495 13.7495 k = 0.0000 0.1860-0.0000 ( 4215 PWs) bands (ev): -50.4020 -50.4020 -50.4018 -50.4018 -24.7127 -24.7127 -24.7100 -24.7100 -17.0109 -17.0109 -16.9982 -16.9982 -16.9799 -16.9799 -16.9666 -16.9666 -2.8393 -2.8393 -1.3407 -1.3407 0.4359 0.4359 5.9072 5.9072 6.4851 6.4851 6.8942 6.8942 8.2991 8.2991 8.5741 8.5741 8.6702 8.6702 9.8360 9.8360 10.0117 10.0117 10.6518 10.6518 11.0368 11.0368 11.3561 11.3561 12.9716 12.9716 13.2242 13.2242 13.3972 13.3972 13.8281 13.8281 k = 0.0000 0.1977-0.0000 ( 4221 PWs) bands (ev): -50.4019 -50.4019 -50.4017 -50.4017 -24.7133 -24.7133 -24.7105 -24.7105 -17.0136 -17.0136 -17.0015 -17.0015 -16.9796 -16.9796 -16.9662 -16.9662 -2.8045 -2.8045 -1.3302 -1.3302 0.4783 0.4783 5.8246 5.8246 6.3329 6.3329 6.9206 6.9206 8.3059 8.3059 8.5333 8.5333 8.6158 8.6158 9.7742 9.7742 10.0482 10.0482 10.7110 10.7110 11.0609 11.0609 11.3569 11.3569 12.9974 12.9974 13.2445 13.2445 13.3854 13.3854 13.8984 13.8984 k = 0.0000 0.2093-0.0000 ( 4217 PWs) bands (ev): -50.4018 -50.4018 -50.4017 -50.4017 -24.7137 -24.7137 -24.7110 -24.7110 -17.0163 -17.0163 -17.0048 -17.0048 -16.9792 -16.9792 -16.9658 -16.9658 -2.7680 -2.7680 -1.3201 -1.3201 0.5232 0.5232 5.7384 5.7384 6.1855 6.1855 6.9452 6.9452 8.3112 8.3112 8.4264 8.4264 8.6345 8.6345 9.7118 9.7118 10.0877 10.0877 10.7641 10.7641 11.0814 11.0814 11.3619 11.3619 13.0096 13.0096 13.2810 13.2810 13.3746 13.3746 13.9560 13.9560 k = 0.0000 0.2209-0.0000 ( 4225 PWs) bands (ev): -50.4018 -50.4018 -50.4016 -50.4016 -24.7142 -24.7142 -24.7117 -24.7117 -17.0192 -17.0192 -17.0083 -17.0083 -16.9787 -16.9787 -16.9655 -16.9655 -2.7299 -2.7299 -1.3105 -1.3105 0.5708 0.5708 5.6467 5.6467 6.0454 6.0454 6.9664 6.9664 8.3043 8.3043 8.3313 8.3313 8.6612 8.6612 9.6494 9.6494 10.1299 10.1299 10.8089 10.8089 11.0975 11.0975 11.3734 11.3734 13.0142 13.0142 13.3277 13.3277 13.3653 13.3653 13.9980 13.9980 k = 0.0000 0.2326-0.0000 ( 4219 PWs) bands (ev): -50.4016 -50.4016 -50.4015 -50.4015 -24.7147 -24.7147 -24.7122 -24.7122 -17.0222 -17.0222 -17.0117 -17.0117 -16.9781 -16.9781 -16.9650 -16.9650 -2.6903 -2.6903 -1.3016 -1.3016 0.6210 0.6210 5.5470 5.5470 5.9160 5.9160 6.9824 6.9824 8.2154 8.2154 8.3243 8.3243 8.6910 8.6910 9.5871 9.5871 10.1751 10.1751 10.8429 10.8429 11.1086 11.1086 11.3935 11.3935 13.0174 13.0174 13.3486 13.3486 13.3874 13.3874 14.0243 14.0243 k = 0.0000 0.2442-0.0000 ( 4221 PWs) bands (ev): -50.4016 -50.4016 -50.4014 -50.4014 -24.7152 -24.7152 -24.7127 -24.7127 -17.0252 -17.0252 -17.0153 -17.0153 -16.9774 -16.9774 -16.9646 -16.9646 -2.6493 -2.6493 -1.2937 -1.2937 0.6737 0.6737 5.4367 5.4367 5.8006 5.8006 6.9907 6.9907 8.1261 8.1261 8.3275 8.3275 8.7229 8.7229 9.5253 9.5253 10.2230 10.2230 10.8643 10.8643 11.1142 11.1142 11.4241 11.4241 13.0230 13.0230 13.3377 13.3377 13.4421 13.4421 14.0374 14.0374 k = 0.0000 0.2558-0.0000 ( 4213 PWs) bands (ev): -50.4015 -50.4015 -50.4013 -50.4013 -24.7156 -24.7156 -24.7133 -24.7133 -17.0283 -17.0283 -17.0188 -17.0188 -16.9767 -16.9767 -16.9642 -16.9642 -2.6069 -2.6069 -1.2868 -1.2868 0.7292 0.7292 5.3150 5.3150 5.7007 5.7007 6.9886 6.9886 8.0498 8.0498 8.3307 8.3307 8.7566 8.7566 9.4641 9.4641 10.2738 10.2738 10.8725 10.8725 11.1141 11.1141 11.4658 11.4658 13.0326 13.0326 13.3238 13.3238 13.4970 13.4970 14.0424 14.0424 k = 0.0000 0.2674-0.0000 ( 4217 PWs) bands (ev): -50.4014 -50.4014 -50.4012 -50.4012 -24.7161 -24.7161 -24.7139 -24.7139 -17.0314 -17.0314 -17.0223 -17.0223 -16.9760 -16.9760 -16.9638 -16.9638 -2.5632 -2.5632 -1.2811 -1.2811 0.7872 0.7872 5.1836 5.1836 5.6151 5.6151 6.9731 6.9731 7.9900 7.9900 8.3339 8.3339 8.7914 8.7914 9.4039 9.4039 10.3274 10.3274 10.8682 10.8682 11.1082 11.1082 11.5177 11.5177 13.0468 13.0468 13.3080 13.3080 13.5481 13.5481 14.0454 14.0454 k = 0.0000 0.2791-0.0000 ( 4229 PWs) bands (ev): -50.4013 -50.4013 -50.4011 -50.4011 -24.7167 -24.7167 -24.7145 -24.7145 -17.0345 -17.0345 -17.0258 -17.0258 -16.9753 -16.9753 -16.9635 -16.9635 -2.5183 -2.5183 -1.2769 -1.2769 0.8479 0.8479 5.0452 5.0452 5.5416 5.5416 6.9421 6.9421 7.9492 7.9492 8.3370 8.3370 8.8270 8.8270 9.3448 9.3448 10.3838 10.3838 10.8533 10.8533 11.0966 11.0966 11.5782 11.5782 13.0646 13.0646 13.2907 13.2907 13.5922 13.5922 14.0529 14.0529 k = 0.0000 0.2907-0.0000 ( 4233 PWs) bands (ev): -50.4012 -50.4012 -50.4010 -50.4010 -24.7172 -24.7172 -24.7151 -24.7151 -17.0376 -17.0376 -17.0293 -17.0293 -16.9745 -16.9745 -16.9632 -16.9632 -2.4724 -2.4724 -1.2743 -1.2743 0.9112 0.9112 4.9028 4.9028 5.4780 5.4780 6.8952 6.8952 7.9280 7.9280 8.3403 8.3403 8.8628 8.8628 9.2871 9.2871 10.4428 10.4428 10.8297 10.8297 11.0795 11.0795 11.6454 11.6454 13.0832 13.0832 13.2737 13.2737 13.6267 13.6267 14.0704 14.0704 k = 0.0000 0.3023-0.0000 ( 4227 PWs) bands (ev): -50.4011 -50.4011 -50.4010 -50.4010 -24.7177 -24.7177 -24.7156 -24.7156 -17.0406 -17.0406 -17.0326 -17.0326 -16.9737 -16.9737 -16.9628 -16.9628 -2.4256 -2.4256 -1.2734 -1.2734 0.9772 0.9772 4.7582 4.7582 5.4226 5.4226 6.8338 6.8338 7.9252 7.9252 8.3439 8.3439 8.8982 8.8982 9.2310 9.2310 10.5045 10.5045 10.7991 10.7991 11.0576 11.0576 11.7178 11.7178 13.0966 13.0966 13.2617 13.2617 13.6505 13.6505 14.1013 14.1013 k = 0.0000 0.3140-0.0000 ( 4232 PWs) bands (ev): -50.4010 -50.4010 -50.4009 -50.4009 -24.7181 -24.7181 -24.7162 -24.7162 -17.0435 -17.0435 -17.0360 -17.0360 -16.9729 -16.9729 -16.9625 -16.9625 -2.3779 -2.3779 -1.2745 -1.2745 1.0459 1.0459 4.6130 4.6130 5.3744 5.3744 6.7605 6.7605 7.9381 7.9381 8.3480 8.3480 8.9324 8.9324 9.1770 9.1770 10.5686 10.5686 10.7631 10.7631 11.0315 11.0315 11.7942 11.7942 13.0956 13.0956 13.2622 13.2622 13.6652 13.6652 14.1456 14.1456 k = 0.0000 0.3256-0.0000 ( 4236 PWs) bands (ev): -50.4009 -50.4009 -50.4008 -50.4008 -24.7186 -24.7186 -24.7167 -24.7167 -17.0463 -17.0463 -17.0392 -17.0392 -16.9721 -16.9721 -16.9623 -16.9623 -2.3295 -2.3295 -1.2777 -1.2777 1.1172 1.1172 4.4678 4.4678 5.3331 5.3331 6.6786 6.6786 7.9638 7.9638 8.3528 8.3528 8.9639 8.9639 9.1261 9.1261 10.6348 10.6348 10.7232 10.7232 11.0019 11.0019 11.8736 11.8736 13.0747 13.0747 13.2792 13.2792 13.6737 13.6737 14.2013 14.2013 k = 0.0000 0.3372-0.0000 ( 4236 PWs) bands (ev): -50.4008 -50.4008 -50.4007 -50.4007 -24.7190 -24.7190 -24.7172 -24.7172 -17.0490 -17.0490 -17.0423 -17.0423 -16.9713 -16.9713 -16.9620 -16.9620 -2.2806 -2.2806 -1.2831 -1.2831 1.1911 1.1911 4.3235 4.3235 5.2982 5.2982 6.5907 6.5907 7.9994 7.9994 8.3585 8.3585 8.9881 8.9881 9.0824 9.0824 10.6799 10.6799 10.7031 10.7031 10.9702 10.9702 11.9552 11.9552 13.0377 13.0377 13.3074 13.3074 13.6795 13.6795 14.2657 14.2657 k = 0.0000 0.3488-0.0000 ( 4232 PWs) bands (ev): -50.4007 -50.4007 -50.4006 -50.4006 -24.7194 -24.7194 -24.7177 -24.7177 -17.0515 -17.0515 -17.0453 -17.0453 -16.9705 -16.9705 -16.9618 -16.9618 -2.2312 -2.2312 -1.2908 -1.2908 1.2678 1.2678 4.1804 4.1804 5.2697 5.2697 6.4994 6.4994 8.0426 8.0426 8.3653 8.3653 8.9871 8.9871 9.0633 9.0633 10.6359 10.6359 10.7698 10.7698 10.9391 10.9391 12.0384 12.0384 12.9894 12.9894 13.3403 13.3403 13.6850 13.6850 14.3362 14.3362 k = 0.0000 0.3605-0.0000 ( 4230 PWs) bands (ev): -50.4007 -50.4007 -50.4006 -50.4006 -24.7197 -24.7197 -24.7182 -24.7182 -17.0539 -17.0539 -17.0481 -17.0481 -16.9697 -16.9697 -16.9616 -16.9616 -2.1815 -2.1815 -1.3009 -1.3009 1.3471 1.3471 4.0388 4.0388 5.2476 5.2476 6.4063 6.4063 8.0913 8.0913 8.3736 8.3736 8.9533 8.9533 9.0755 9.0755 10.5913 10.5913 10.8237 10.8237 10.9213 10.9213 12.1227 12.1227 12.9329 12.9329 13.3735 13.3735 13.6920 13.6920 14.4112 14.4112 k = 0.0000 0.3721-0.0000 ( 4232 PWs) bands (ev): -50.4006 -50.4006 -50.4005 -50.4005 -24.7201 -24.7201 -24.7187 -24.7187 -17.0561 -17.0561 -17.0509 -17.0509 -16.9689 -16.9689 -16.9615 -16.9615 -2.1316 -2.1316 -1.3135 -1.3135 1.4291 1.4291 3.8989 3.8989 5.2317 5.2317 6.3129 6.3129 8.1438 8.1438 8.3839 8.3839 8.9108 8.9108 9.0944 9.0944 10.5476 10.5476 10.8256 10.8256 10.9563 10.9563 12.2073 12.2073 12.8702 12.8702 13.4040 13.4040 13.7017 13.7017 14.4889 14.4889 k = 0.0000 0.3837-0.0000 ( 4234 PWs) bands (ev): -50.4005 -50.4005 -50.4004 -50.4004 -24.7204 -24.7204 -24.7191 -24.7191 -17.0582 -17.0582 -17.0534 -17.0534 -16.9682 -16.9682 -16.9614 -16.9614 -2.0817 -2.0817 -1.3287 -1.3287 1.5138 1.5138 3.7610 3.7610 5.2220 5.2220 6.2203 6.2203 8.1983 8.1983 8.3970 8.3970 8.8677 8.8677 9.1108 9.1108 10.5061 10.5061 10.7939 10.7939 11.0260 11.0260 12.2913 12.2913 12.8029 12.8029 13.4291 13.4291 13.7147 13.7147 14.5677 14.5677 k = 0.0000 0.3953-0.0000 ( 4238 PWs) bands (ev): -50.4005 -50.4005 -50.4004 -50.4004 -24.7206 -24.7206 -24.7196 -24.7196 -17.0601 -17.0601 -17.0558 -17.0558 -16.9674 -16.9674 -16.9614 -16.9614 -2.0320 -2.0320 -1.3465 -1.3465 1.6012 1.6012 3.6251 3.6251 5.2187 5.2187 6.1293 6.1293 8.2525 8.2525 8.4145 8.4145 8.8256 8.8256 9.1222 9.1222 10.4683 10.4683 10.7552 10.7552 11.1044 11.1044 12.3725 12.3725 12.7336 12.7336 13.4466 13.4466 13.7321 13.7321 14.6426 14.6426 k = 0.0000 0.4070-0.0000 ( 4242 PWs) bands (ev): -50.4004 -50.4004 -50.4003 -50.4003 -24.7209 -24.7209 -24.7200 -24.7200 -17.0618 -17.0618 -17.0580 -17.0580 -16.9668 -16.9668 -16.9613 -16.9613 -1.9826 -1.9826 -1.3669 -1.3669 1.6913 1.6913 3.4914 3.4914 5.2217 5.2217 6.0406 6.0406 8.3029 8.3029 8.4391 8.4391 8.7851 8.7851 9.1272 9.1272 10.4354 10.4354 10.7145 10.7145 11.1865 11.1865 12.4442 12.4442 12.6696 12.6696 13.4542 13.4542 13.7546 13.7546 14.6750 14.6750 k = 0.0000 0.4186-0.0000 ( 4236 PWs) bands (ev): -50.4004 -50.4004 -50.4003 -50.4003 -24.7211 -24.7211 -24.7203 -24.7203 -17.0633 -17.0633 -17.0599 -17.0599 -16.9661 -16.9661 -16.9614 -16.9614 -1.9336 -1.9336 -1.3899 -1.3899 1.7841 1.7841 3.3600 3.3600 5.2310 5.2310 5.9547 5.9547 8.3454 8.3454 8.4745 8.4745 8.7465 8.7465 9.1247 9.1247 10.4086 10.4086 10.6733 10.6733 11.2711 11.2711 12.4761 12.4761 12.6415 12.6415 13.4505 13.4505 13.7831 13.7831 14.6211 14.6211 k = 0.0000 0.4302-0.0000 ( 4242 PWs) bands (ev): -50.4003 -50.4003 -50.4003 -50.4003 -24.7213 -24.7213 -24.7206 -24.7206 -17.0646 -17.0646 -17.0617 -17.0617 -16.9655 -16.9655 -16.9614 -16.9614 -1.8853 -1.8853 -1.4154 -1.4154 1.8795 1.8795 3.2309 3.2309 5.2464 5.2464 5.8721 5.8721 8.3783 8.3783 8.5213 8.5213 8.7102 8.7102 9.1140 9.1140 10.3889 10.3889 10.6324 10.6324 11.3579 11.3579 12.4332 12.4332 12.6843 12.6843 13.4349 13.4349 13.8177 13.8177 14.5501 14.5501 k = 0.0000 0.4419-0.0000 ( 4246 PWs) bands (ev): -50.4003 -50.4003 -50.4002 -50.4002 -24.7215 -24.7215 -24.7209 -24.7209 -17.0657 -17.0657 -17.0632 -17.0632 -16.9650 -16.9650 -16.9615 -16.9615 -1.8378 -1.8378 -1.4435 -1.4435 1.9777 1.9777 3.1042 3.1042 5.2680 5.2680 5.7932 5.7932 8.4046 8.4046 8.5750 8.5750 8.6775 8.6775 9.0947 9.0947 10.3767 10.3767 10.5924 10.5924 11.4463 11.4463 12.3573 12.3573 12.7567 12.7567 13.4077 13.4077 13.8583 13.8583 14.4774 14.4774 k = 0.0000 0.4535-0.0000 ( 4250 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7211 -24.7211 -17.0666 -17.0666 -17.0646 -17.0646 -16.9644 -16.9644 -16.9617 -16.9617 -1.7912 -1.7912 -1.4740 -1.4740 2.0785 2.0785 2.9800 2.9800 5.2957 5.2957 5.7183 5.7183 8.4278 8.4278 8.6168 8.6168 8.6630 8.6630 9.0671 9.0671 10.3724 10.3724 10.5538 10.5538 11.5363 11.5363 12.2719 12.2719 12.8352 12.8352 13.3700 13.3700 13.9043 13.9043 14.4052 14.4052 k = 0.0000 0.4651-0.0000 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7213 -24.7213 -17.0672 -17.0672 -17.0657 -17.0657 -16.9639 -16.9639 -16.9618 -16.9618 -1.7458 -1.7458 -1.5068 -1.5068 2.1820 2.1820 2.8582 2.8582 5.3294 5.3294 5.6477 5.6477 8.4501 8.4501 8.6016 8.6016 8.7089 8.7089 9.0314 9.0314 10.3758 10.3758 10.5172 10.5172 11.6275 11.6275 12.1825 12.1825 12.9142 12.9142 13.3229 13.3229 13.9551 13.9551 14.3341 14.3341 k = 0.0000 0.4767-0.0000 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7215 -24.7215 -17.0675 -17.0675 -17.0665 -17.0665 -16.9634 -16.9634 -16.9621 -16.9621 -1.7017 -1.7017 -1.5419 -1.5419 2.2881 2.2881 2.7390 2.7390 5.3688 5.3688 5.5817 5.5817 8.4727 8.4727 8.5742 8.5742 8.7687 8.7687 8.9887 8.9887 10.3862 10.3862 10.4831 10.4831 11.7196 11.7196 12.0911 12.0911 12.9919 12.9919 13.2678 13.2678 14.0103 14.0103 14.2646 14.2646 k = 0.0000 0.4884-0.0000 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7216 -24.7216 -17.0676 -17.0676 -17.0671 -17.0671 -16.9630 -16.9630 -16.9623 -16.9623 -1.6591 -1.6591 -1.5791 -1.5791 2.3969 2.3969 2.6224 2.6224 5.4140 5.4140 5.5206 5.5206 8.4962 8.4962 8.5469 8.5469 8.8286 8.8286 8.9399 8.9399 10.4029 10.4029 10.4522 10.4522 11.8123 11.8123 11.9985 11.9985 13.0671 13.0671 13.2061 13.2061 14.0694 14.0694 14.1970 14.1970 k = 0.0000 0.5000-0.0000 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6182 -1.6182 -1.6182 -1.6182 2.5083 2.5083 2.5083 2.5083 5.4647 5.4647 5.4647 5.4647 8.5209 8.5209 8.5209 8.5209 8.8861 8.8861 8.8861 8.8861 10.4252 10.4252 10.4252 10.4252 11.9055 11.9055 11.9055 11.9055 13.1388 13.1388 13.1388 13.1388 14.1317 14.1317 14.1317 14.1317 k = 0.0000 0.5000-0.0000 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6182 -1.6182 -1.6182 -1.6182 2.5083 2.5083 2.5083 2.5083 5.4647 5.4647 5.4647 5.4647 8.5209 8.5209 8.5209 8.5209 8.8861 8.8861 8.8861 8.8861 10.4252 10.4252 10.4252 10.4252 11.9055 11.9055 11.9055 11.9055 13.1388 13.1388 13.1388 13.1388 14.1317 14.1317 14.1317 14.1317 k = 0.0116 0.5000-0.0000 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7218 -24.7218 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9629 -16.9629 -16.9627 -16.9627 -1.6180 -1.6180 -1.6179 -1.6179 2.5085 2.5085 2.5109 2.5109 5.4640 5.4640 5.4671 5.4671 8.5183 8.5183 8.5189 8.5189 8.8849 8.8849 8.8865 8.8865 10.4246 10.4246 10.4252 10.4252 11.8679 11.8679 11.9009 11.9009 13.1359 13.1359 13.1776 13.1776 14.1219 14.1219 14.1422 14.1422 k = 0.0233 0.5000-0.0000 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7218 -24.7218 -24.7218 -24.7218 -17.0676 -17.0676 -17.0674 -17.0674 -16.9632 -16.9632 -16.9628 -16.9628 -1.6174 -1.6174 -1.6172 -1.6172 2.5115 2.5115 2.5162 2.5162 5.4653 5.4653 5.4714 5.4714 8.5111 8.5111 8.5125 8.5125 8.8831 8.8831 8.8859 8.8859 10.4234 10.4234 10.4246 10.4246 11.7943 11.7943 11.8546 11.8546 13.1685 13.1685 13.2457 13.2457 14.1129 14.1129 14.1532 14.1532 k = 0.0349 0.5000-0.0000 ( 4256 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7219 -24.7219 -24.7218 -24.7218 -17.0676 -17.0676 -17.0674 -17.0674 -16.9637 -16.9637 -16.9632 -16.9632 -1.6164 -1.6164 -1.6160 -1.6160 2.5172 2.5172 2.5242 2.5242 5.4683 5.4683 5.4774 5.4774 8.4992 8.4992 8.5020 8.5020 8.8807 8.8807 8.8843 8.8843 10.4213 10.4213 10.4234 10.4234 11.6937 11.6937 11.7737 11.7737 13.2296 13.2296 13.3343 13.3343 14.1049 14.1049 14.1643 14.1643 k = 0.0465 0.5000-0.0000 ( 4248 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7220 -24.7220 -24.7219 -24.7219 -17.0675 -17.0675 -17.0673 -17.0673 -16.9643 -16.9643 -16.9636 -16.9636 -1.6149 -1.6149 -1.6144 -1.6144 2.5256 2.5256 2.5349 2.5349 5.4731 5.4731 5.4852 5.4852 8.4828 8.4828 8.4876 8.4876 8.8779 8.8779 8.8814 8.8814 10.4183 10.4183 10.4216 10.4216 11.5740 11.5740 11.6672 11.6672 13.3101 13.3101 13.4348 13.4348 14.0981 14.0981 14.1756 14.1756 k = 0.0581 0.5000-0.0000 ( 4244 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7222 -24.7222 -24.7220 -24.7220 -17.0675 -17.0675 -17.0672 -17.0672 -16.9651 -16.9651 -16.9643 -16.9643 -1.6129 -1.6129 -1.6124 -1.6124 2.5367 2.5367 2.5483 2.5483 5.4797 5.4797 5.4947 5.4947 8.4621 8.4621 8.4698 8.4698 8.8745 8.8745 8.8771 8.8771 10.4140 10.4140 10.4192 10.4192 11.4411 11.4411 11.5433 11.5433 13.4019 13.4019 13.5408 13.5408 14.0929 14.0929 14.1871 14.1871 k = 0.0698 0.5000-0.0000 ( 4244 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7224 -24.7224 -24.7222 -24.7222 -17.0675 -17.0675 -17.0671 -17.0671 -16.9661 -16.9661 -16.9651 -16.9651 -1.6106 -1.6106 -1.6099 -1.6099 2.5506 2.5506 2.5645 2.5645 5.4880 5.4880 5.5057 5.5057 8.4376 8.4376 8.4488 8.4488 8.8706 8.8706 8.8713 8.8713 10.4082 10.4082 10.4159 10.4159 11.2990 11.2990 11.4078 11.4078 13.4988 13.4988 13.6473 13.6473 14.0897 14.0897 14.1992 14.1992 k = 0.0814 0.5000-0.0000 ( 4240 PWs) bands (ev): -50.4000 -50.4000 -50.4000 -50.4000 -24.7226 -24.7226 -24.7223 -24.7223 -17.0675 -17.0675 -17.0670 -17.0670 -16.9672 -16.9672 -16.9660 -16.9660 -1.6078 -1.6078 -1.6070 -1.6070 2.5672 2.5672 2.5833 2.5833 5.4979 5.4979 5.5182 5.5182 8.4095 8.4095 8.4251 8.4251 8.8640 8.8640 8.8661 8.8661 10.4004 10.4004 10.4116 10.4116 11.1507 11.1507 11.2652 11.2652 13.5963 13.5963 13.7498 13.7498 14.0894 14.0894 14.2132 14.2132 k = 0.0930 0.5000-0.0000 ( 4228 PWs) bands (ev): -50.4000 -50.4000 -50.4000 -50.4000 -24.7227 -24.7227 -24.7225 -24.7225 -17.0674 -17.0674 -17.0669 -17.0669 -16.9684 -16.9684 -16.9671 -16.9671 -1.6046 -1.6046 -1.6038 -1.6038 2.5865 2.5865 2.6048 2.6048 5.5093 5.5093 5.5321 5.5321 8.3783 8.3783 8.3991 8.3991 8.8550 8.8550 8.8609 8.8609 10.3898 10.3898 10.4059 10.4059 10.9986 10.9986 11.1187 11.1187 13.6900 13.6900 13.8435 13.8435 14.0936 14.0936 14.2318 14.2318 k = 0.1047 0.5000-0.0000 ( 4224 PWs) bands (ev): -50.3999 -50.3999 -50.3999 -50.3999 -24.7230 -24.7230 -24.7227 -24.7227 -17.0674 -17.0674 -17.0668 -17.0668 -16.9697 -16.9697 -16.9683 -16.9683 -1.6011 -1.6011 -1.6001 -1.6001 2.6085 2.6085 2.6289 2.6289 5.5222 5.5222 5.5472 5.5472 8.3445 8.3445 8.3711 8.3711 8.8445 8.8445 8.8548 8.8548 10.3749 10.3749 10.3978 10.3978 10.8448 10.8448 10.9717 10.9717 13.7754 13.7754 13.9223 13.9223 14.1055 14.1055 14.2596 14.2596 k = 0.1163 0.5000-0.0000 ( 4218 PWs) bands (ev): -50.3998 -50.3998 -50.3998 -50.3998 -24.7233 -24.7233 -24.7230 -24.7230 -17.0674 -17.0674 -17.0668 -17.0668 -16.9712 -16.9712 -16.9695 -16.9695 -1.5971 -1.5971 -1.5961 -1.5961 2.6331 2.6331 2.6556 2.6556 5.5363 5.5363 5.5634 5.5634 8.3087 8.3087 8.3416 8.3416 8.8322 8.8322 8.8479 8.8479 10.3529 10.3529 10.3849 10.3849 10.6928 10.6928 10.8282 10.8282 13.8463 13.8463 13.9803 13.9803 14.1300 14.1300 14.3017 14.3017 k = 0.1279 0.5000-0.0000 ( 4226 PWs) bands (ev): -50.3998 -50.3998 -50.3998 -50.3998 -24.7236 -24.7236 -24.7233 -24.7233 -17.0675 -17.0675 -17.0668 -17.0668 -16.9727 -16.9727 -16.9710 -16.9710 -1.5929 -1.5929 -1.5918 -1.5918 2.6603 2.6603 2.6849 2.6849 5.5516 5.5516 5.5805 5.5805 8.2712 8.2712 8.3109 8.3109 8.8183 8.8183 8.8399 8.8399 10.3178 10.3178 10.3580 10.3580 10.5528 10.5528 10.6954 10.6954 13.8973 13.8973 14.0159 14.0159 14.1718 14.1718 14.3592 14.3592 k = 0.1395 0.5000-0.0000 ( 4234 PWs) bands (ev): -50.3997 -50.3997 -50.3997 -50.3997 -24.7241 -24.7241 -24.7237 -24.7237 -17.0676 -17.0676 -17.0669 -17.0669 -16.9744 -16.9744 -16.9725 -16.9725 -1.5883 -1.5883 -1.5871 -1.5871 2.6902 2.6902 2.7167 2.7167 5.5680 5.5680 5.5984 5.5984 8.2325 8.2325 8.2795 8.2795 8.8025 8.8025 8.8308 8.8308 10.2587 10.2587 10.2849 10.2849 10.4575 10.4575 10.5849 10.5849 13.9288 13.9288 14.0339 14.0339 14.2304 14.2304 14.4277 14.4277 k = 0.1512 0.5000-0.0000 ( 4226 PWs) bands (ev): -50.3996 -50.3996 -50.3996 -50.3996 -24.7244 -24.7244 -24.7240 -24.7240 -17.0677 -17.0677 -17.0670 -17.0670 -16.9760 -16.9760 -16.9740 -16.9740 -1.5834 -1.5834 -1.5822 -1.5822 2.7226 2.7226 2.7511 2.7511 5.5852 5.5852 5.6169 5.6169 8.1932 8.1932 8.2478 8.2478 8.7850 8.7850 8.8204 8.8204 10.1543 10.1543 10.1655 10.1655 10.4191 10.4191 10.5077 10.5077 13.9471 13.9471 14.0408 14.0408 14.2994 14.2994 14.5010 14.5010 k = 0.1628 0.5000-0.0000 ( 4220 PWs) bands (ev): -50.3996 -50.3996 -50.3996 -50.3996 -24.7247 -24.7247 -24.7243 -24.7243 -17.0678 -17.0678 -17.0671 -17.0671 -16.9776 -16.9776 -16.9756 -16.9756 -1.5782 -1.5782 -1.5770 -1.5770 2.7576 2.7576 2.7879 2.7879 5.6030 5.6030 5.6358 5.6358 8.1536 8.1536 8.2160 8.2160 8.7655 8.7655 8.8086 8.8086 10.0035 10.0035 10.0433 10.0433 10.4007 10.4007 10.4594 10.4594 13.9585 13.9585 14.0416 14.0416 14.3727 14.3727 14.5747 14.5747 k = 0.1744 0.5000-0.0000 ( 4220 PWs) bands (ev): -50.3995 -50.3995 -50.3995 -50.3995 -24.7252 -24.7252 -24.7247 -24.7247 -17.0680 -17.0680 -17.0673 -17.0673 -16.9794 -16.9794 -16.9772 -16.9772 -1.5728 -1.5728 -1.5715 -1.5715 2.7950 2.7950 2.8271 2.8271 5.6214 5.6214 5.6549 5.6549 8.1142 8.1142 8.1846 8.1846 8.7438 8.7438 8.7950 8.7950 9.8481 9.8481 9.9053 9.9053 10.3875 10.3875 10.4274 10.4274 13.9669 13.9669 14.0396 14.0396 14.4465 14.4465 14.6464 14.6464 k = 0.1860 0.5000-0.0000 ( 4224 PWs) bands (ev): -50.3994 -50.3994 -50.3994 -50.3994 -24.7256 -24.7256 -24.7252 -24.7252 -17.0683 -17.0683 -17.0676 -17.0676 -16.9811 -16.9811 -16.9789 -16.9789 -1.5672 -1.5672 -1.5659 -1.5659 2.8349 2.8349 2.8686 2.8686 5.6401 5.6401 5.6740 5.6740 8.0753 8.0753 8.1538 8.1538 8.7196 8.7196 8.7794 8.7794 9.6925 9.6925 9.7610 9.7610 10.3759 10.3759 10.4032 10.4032 13.9748 13.9748 14.0367 14.0367 14.5188 14.5188 14.7149 14.7149 k = 0.1977 0.5000-0.0000 ( 4224 PWs) bands (ev): -50.3993 -50.3993 -50.3993 -50.3993 -24.7260 -24.7260 -24.7256 -24.7256 -17.0687 -17.0687 -17.0679 -17.0679 -16.9828 -16.9828 -16.9805 -16.9805 -1.5613 -1.5613 -1.5600 -1.5600 2.8772 2.8772 2.9125 2.9125 5.6589 5.6589 5.6928 5.6928 8.0373 8.0373 8.1240 8.1240 8.6924 8.6924 8.7610 8.7610 9.5388 9.5388 9.6155 9.6155 10.3648 10.3648 10.3828 10.3828 13.9836 13.9836 14.0344 14.0344 14.5886 14.5886 14.7798 14.7798 k = 0.2093 0.5000-0.0000 ( 4212 PWs) bands (ev): -50.3992 -50.3992 -50.3992 -50.3992 -24.7264 -24.7264 -24.7260 -24.7260 -17.0690 -17.0690 -17.0683 -17.0683 -16.9843 -16.9843 -16.9821 -16.9821 -1.5553 -1.5553 -1.5540 -1.5540 2.9218 2.9218 2.9586 2.9586 5.6776 5.6776 5.7112 5.7112 8.0006 8.0006 8.0955 8.0955 8.6615 8.6615 8.7387 8.7387 9.3891 9.3891 9.4718 9.4718 10.3537 10.3537 10.3643 10.3643 13.9942 13.9942 14.0337 14.0337 14.6555 14.6555 14.8409 14.8409 k = 0.2209 0.5000-0.0000 ( 4208 PWs) bands (ev): -50.3991 -50.3991 -50.3991 -50.3991 -24.7269 -24.7269 -24.7264 -24.7264 -17.0695 -17.0695 -17.0688 -17.0688 -16.9859 -16.9859 -16.9836 -16.9836 -1.5492 -1.5492 -1.5478 -1.5478 2.9686 2.9686 3.0069 3.0069 5.6960 5.6960 5.7290 5.7290 7.9654 7.9654 8.0683 8.0683 8.6255 8.6255 8.7104 8.7104 9.2460 9.2460 9.3326 9.3326 10.3426 10.3426 10.3468 10.3468 14.0072 14.0072 14.0354 14.0354 14.7194 14.7194 14.8982 14.8982 k = 0.2326 0.5000-0.0000 ( 4212 PWs) bands (ev): -50.3990 -50.3990 -50.3990 -50.3990 -24.7273 -24.7273 -24.7269 -24.7269 -17.0701 -17.0701 -17.0694 -17.0694 -16.9875 -16.9875 -16.9852 -16.9852 -1.5430 -1.5430 -1.5416 -1.5416 3.0177 3.0177 3.0573 3.0573 5.7138 5.7138 5.7460 5.7460 7.9319 7.9319 8.0427 8.0427 8.5825 8.5825 8.6722 8.6722 9.1139 9.1139 9.2009 9.2009 10.3300 10.3300 10.3313 10.3313 14.0232 14.0232 14.0399 14.0399 14.7802 14.7802 14.9520 14.9520 k = 0.2442 0.5000-0.0000 ( 4210 PWs) bands (ev): -50.3989 -50.3989 -50.3989 -50.3989 -24.7278 -24.7278 -24.7273 -24.7273 -17.0707 -17.0707 -17.0700 -17.0700 -16.9889 -16.9889 -16.9867 -16.9867 -1.5367 -1.5367 -1.5353 -1.5353 3.0689 3.0689 3.1097 3.1097 5.7310 5.7310 5.7620 5.7620 7.9005 7.9005 8.0187 8.0187 8.5298 8.5298 8.6175 8.6175 8.9996 8.9996 9.0800 9.0800 10.3137 10.3137 10.3199 10.3199 14.0424 14.0424 14.0477 14.0477 14.8381 14.8381 15.0023 15.0023 k = 0.2558 0.5000-0.0000 ( 4214 PWs) bands (ev): -50.3989 -50.3989 -50.3989 -50.3989 -24.7283 -24.7283 -24.7278 -24.7278 -17.0715 -17.0715 -17.0708 -17.0708 -16.9902 -16.9902 -16.9881 -16.9881 -1.5304 -1.5304 -1.5290 -1.5290 3.1221 3.1221 3.1639 3.1639 5.7474 5.7474 5.7769 5.7769 7.8711 7.8711 7.9962 7.9962 8.4646 8.4646 8.5399 8.5399 8.9103 8.9103 8.9739 8.9739 10.2977 10.2977 10.3085 10.3085 14.0592 14.0592 14.0653 14.0653 14.8931 14.8931 15.0494 15.0494 k = 0.2674 0.5000-0.0000 ( 4210 PWs) bands (ev): -50.3988 -50.3988 -50.3988 -50.3988 -24.7287 -24.7287 -24.7283 -24.7283 -17.0723 -17.0723 -17.0717 -17.0717 -16.9915 -16.9915 -16.9893 -16.9893 -1.5240 -1.5240 -1.5227 -1.5227 3.1771 3.1771 3.2199 3.2199 5.7627 5.7627 5.7906 5.7906 7.8438 7.8438 7.9748 7.9748 8.3847 8.3847 8.4388 8.4388 8.8467 8.8467 8.8852 8.8852 10.2822 10.2822 10.2970 10.2970 14.0746 14.0746 14.0920 14.0920 14.9453 14.9453 15.0933 15.0933 k = 0.2791 0.5000-0.0000 ( 4212 PWs) bands (ev): -50.3987 -50.3987 -50.3987 -50.3987 -24.7292 -24.7292 -24.7287 -24.7287 -17.0732 -17.0732 -17.0726 -17.0726 -16.9926 -16.9926 -16.9905 -16.9905 -1.5177 -1.5177 -1.5164 -1.5164 3.2340 3.2340 3.2776 3.2776 5.7768 5.7768 5.8029 5.8029 7.8184 7.8184 7.9538 7.9538 8.2916 8.2916 8.3220 8.3220 8.8022 8.8022 8.8140 8.8140 10.2671 10.2671 10.2856 10.2856 14.0940 14.0940 14.1227 14.1227 14.9949 14.9949 15.1342 15.1342 k = 0.2907 0.5000-0.0000 ( 4220 PWs) bands (ev): -50.3986 -50.3986 -50.3986 -50.3986 -24.7297 -24.7297 -24.7293 -24.7293 -17.0742 -17.0742 -17.0737 -17.0737 -16.9937 -16.9937 -16.9917 -16.9917 -1.5115 -1.5115 -1.5102 -1.5102 3.2924 3.2924 3.3367 3.3367 5.7897 5.7897 5.8138 5.8138 7.7943 7.7943 7.9308 7.9308 8.1905 8.1905 8.1979 8.1979 8.7576 8.7576 8.7689 8.7689 10.2525 10.2525 10.2743 10.2743 14.1177 14.1177 14.1575 14.1575 15.0418 15.0418 15.1721 15.1721 k = 0.3023 0.5000-0.0000 ( 4216 PWs) bands (ev): -50.3985 -50.3985 -50.3985 -50.3985 -24.7301 -24.7301 -24.7297 -24.7297 -17.0752 -17.0752 -17.0747 -17.0747 -16.9946 -16.9946 -16.9927 -16.9927 -1.5054 -1.5054 -1.5041 -1.5041 3.3524 3.3524 3.3971 3.3971 5.8012 5.8012 5.8233 5.8233 7.7700 7.7700 7.8999 7.8999 8.0735 8.0735 8.0914 8.0914 8.7125 8.7125 8.7421 8.7421 10.2385 10.2385 10.2631 10.2631 14.1455 14.1455 14.1965 14.1965 15.0862 15.0862 15.2071 15.2071 k = 0.3140 0.5000-0.0000 ( 4226 PWs) bands (ev): -50.3984 -50.3984 -50.3984 -50.3984 -24.7306 -24.7306 -24.7302 -24.7302 -17.0763 -17.0763 -17.0759 -17.0759 -16.9954 -16.9954 -16.9936 -16.9936 -1.4994 -1.4994 -1.4982 -1.4982 3.4135 3.4135 3.4586 3.4586 5.8113 5.8113 5.8313 5.8313 7.7405 7.7405 7.8457 7.8457 7.9565 7.9565 8.0133 8.0133 8.6753 8.6753 8.7192 8.7192 10.2252 10.2252 10.2522 10.2522 14.1777 14.1777 14.2397 14.2397 15.1279 15.1279 15.2392 15.2392 k = 0.3256 0.5000-0.0000 ( 4218 PWs) bands (ev): -50.3983 -50.3983 -50.3983 -50.3983 -24.7310 -24.7310 -24.7306 -24.7306 -17.0774 -17.0774 -17.0771 -17.0771 -16.9961 -16.9961 -16.9944 -16.9944 -1.4935 -1.4935 -1.4924 -1.4924 3.4758 3.4758 3.5209 3.5209 5.8200 5.8200 5.8380 5.8380 7.6925 7.6925 7.7574 7.7574 7.8623 7.8623 7.9693 7.9693 8.6440 8.6440 8.6987 8.6987 10.2126 10.2126 10.2416 10.2416 14.2141 14.2141 14.2872 14.2872 15.1668 15.1668 15.2685 15.2685 k = 0.3372 0.5000-0.0000 ( 4212 PWs) bands (ev): -50.3983 -50.3983 -50.3982 -50.3982 -24.7313 -24.7313 -24.7309 -24.7309 -17.0786 -17.0786 -17.0783 -17.0783 -16.9966 -16.9966 -16.9951 -16.9951 -1.4879 -1.4879 -1.4869 -1.4869 3.5388 3.5388 3.5838 3.5838 5.8273 5.8273 5.8433 5.8433 7.6096 7.6096 7.6496 7.6496 7.8082 7.8082 7.9466 7.9466 8.6172 8.6172 8.6798 8.6798 10.2009 10.2009 10.2313 10.2313 14.2548 14.2548 14.3388 14.3388 15.2029 15.2029 15.2951 15.2951 k = 0.3488 0.5000-0.0000 ( 4220 PWs) bands (ev): -50.3982 -50.3982 -50.3982 -50.3982 -24.7318 -24.7318 -24.7314 -24.7314 -17.0797 -17.0797 -17.0795 -17.0795 -16.9972 -16.9972 -16.9957 -16.9957 -1.4825 -1.4825 -1.4815 -1.4815 3.6022 3.6022 3.6469 3.6469 5.8333 5.8333 5.8474 5.8474 7.5034 7.5034 7.5358 7.5358 7.7833 7.7833 7.9327 7.9327 8.5939 8.5939 8.6622 8.6622 10.1900 10.1900 10.2214 10.2214 14.2995 14.2995 14.3945 14.3945 15.2360 15.2360 15.3193 15.3193 k = 0.3605 0.5000-0.0000 ( 4220 PWs) bands (ev): -50.3981 -50.3981 -50.3981 -50.3981 -24.7321 -24.7321 -24.7318 -24.7318 -17.0809 -17.0809 -17.0807 -17.0807 -16.9976 -16.9976 -16.9963 -16.9963 -1.4774 -1.4774 -1.4764 -1.4764 3.6658 3.6658 3.7098 3.7098 5.8380 5.8380 5.8505 5.8505 7.3912 7.3912 7.4218 7.4218 7.7710 7.7710 7.9227 7.9227 8.5738 8.5738 8.6457 8.6457 10.1801 10.1801 10.2119 10.2119 14.3483 14.3483 14.4541 14.4541 15.2659 15.2659 15.3411 15.3411 k = 0.3721 0.5000-0.0000 ( 4224 PWs) bands (ev): -50.3980 -50.3980 -50.3980 -50.3980 -24.7325 -24.7325 -24.7322 -24.7322 -17.0820 -17.0820 -17.0819 -17.0819 -16.9980 -16.9980 -16.9967 -16.9967 -1.4725 -1.4725 -1.4717 -1.4717 3.7290 3.7290 3.7720 3.7720 5.8417 5.8417 5.8525 5.8525 7.2799 7.2799 7.3100 7.3100 7.7650 7.7650 7.9148 7.9148 8.5564 8.5564 8.6301 8.6301 10.1712 10.1712 10.2028 10.2028 14.4010 14.4010 14.5175 14.5175 15.2927 15.2927 15.3606 15.3606 k = 0.3837 0.5000-0.0000 ( 4226 PWs) bands (ev): -50.3980 -50.3980 -50.3980 -50.3980 -24.7328 -24.7328 -24.7325 -24.7325 -17.0831 -17.0831 -17.0830 -17.0830 -16.9983 -16.9983 -16.9971 -16.9971 -1.4680 -1.4680 -1.4672 -1.4672 3.7914 3.7914 3.8330 3.8330 5.8443 5.8443 5.8537 5.8537 7.1723 7.1723 7.2022 7.2022 7.7628 7.7628 7.9079 7.9079 8.5416 8.5416 8.6153 8.6153 10.1633 10.1633 10.1942 10.1942 14.4572 14.4572 14.5844 14.5844 15.3162 15.3162 15.3781 15.3781 k = 0.3953 0.5000-0.0000 ( 4230 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7331 -24.7331 -24.7329 -24.7329 -17.0842 -17.0842 -17.0841 -17.0841 -16.9985 -16.9985 -16.9975 -16.9975 -1.4638 -1.4638 -1.4631 -1.4631 3.8523 3.8523 3.8922 3.8922 5.8460 5.8460 5.8541 5.8541 7.0701 7.0701 7.0993 7.0993 7.7634 7.7634 7.9014 7.9014 8.5293 8.5293 8.6013 8.6013 10.1564 10.1564 10.1862 10.1862 14.5168 14.5168 14.6544 14.6544 15.3363 15.3363 15.3936 15.3936 k = 0.4070 0.5000-0.0000 ( 4230 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7334 -24.7334 -24.7332 -24.7332 -17.0852 -17.0852 -17.0851 -17.0851 -16.9986 -16.9986 -16.9978 -16.9978 -1.4600 -1.4600 -1.4594 -1.4594 3.9111 3.9111 3.9488 3.9488 5.8470 5.8470 5.8540 5.8540 6.9745 6.9745 7.0026 7.0026 7.7662 7.7662 7.8950 7.8950 8.5194 8.5194 8.5880 8.5880 10.1506 10.1506 10.1786 10.1786 14.5795 14.5795 14.7270 14.7270 15.3530 15.3530 15.4073 15.4073 k = 0.4186 0.5000-0.0000 ( 4234 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7337 -24.7337 -24.7334 -24.7334 -17.0861 -17.0861 -17.0860 -17.0860 -16.9988 -16.9988 -16.9980 -16.9980 -1.4566 -1.4566 -1.4560 -1.4560 3.9670 3.9670 4.0020 4.0020 5.8474 5.8474 5.8535 5.8535 6.8865 6.8865 6.9129 6.9129 7.7708 7.7708 7.8883 7.8883 8.5118 8.5118 8.5756 8.5756 10.1459 10.1459 10.1716 10.1716 14.6448 14.6448 14.8016 14.8016 15.3662 15.3662 15.4193 15.4193 k = 0.4302 0.5000-0.0000 ( 4230 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7338 -24.7338 -24.7336 -24.7336 -17.0869 -17.0869 -17.0868 -17.0868 -16.9989 -16.9989 -16.9982 -16.9982 -1.4536 -1.4536 -1.4531 -1.4531 4.0191 4.0191 4.0508 4.0508 5.8475 5.8475 5.8526 5.8526 6.8074 6.8074 6.8315 6.8315 7.7769 7.7769 7.8813 7.8813 8.5064 8.5064 8.5639 8.5639 10.1422 10.1422 10.1652 10.1652 14.7123 14.7123 14.8770 14.8770 15.3758 15.3758 15.4296 15.4296 k = 0.4419 0.5000-0.0000 ( 4222 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7340 -24.7340 -24.7338 -24.7338 -17.0875 -17.0875 -17.0875 -17.0875 -16.9989 -16.9989 -16.9984 -16.9984 -1.4510 -1.4510 -1.4506 -1.4506 4.0664 4.0664 4.0941 4.0941 5.8472 5.8472 5.8516 5.8516 6.7381 6.7381 6.7595 6.7595 7.7841 7.7841 7.8738 7.8738 8.5031 8.5031 8.5530 8.5530 10.1395 10.1395 10.1594 10.1594 14.7812 14.7812 14.9515 14.9515 15.3820 15.3820 15.4383 15.4383 k = 0.4535 0.5000-0.0000 ( 4230 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7341 -24.7341 -24.7340 -24.7340 -17.0881 -17.0881 -17.0881 -17.0881 -16.9990 -16.9990 -16.9985 -16.9985 -1.4489 -1.4489 -1.4485 -1.4485 4.1078 4.1078 4.1310 4.1310 5.8469 5.8469 5.8504 5.8504 6.6800 6.6800 6.6979 6.6979 7.7922 7.7922 7.8658 7.8658 8.5017 8.5017 8.5430 8.5430 10.1377 10.1377 10.1541 10.1541 14.8506 14.8506 15.0216 15.0216 15.3851 15.3851 15.4452 15.4452 k = 0.4651 0.5000-0.0000 ( 4228 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7342 -24.7342 -24.7341 -24.7341 -17.0886 -17.0886 -17.0886 -17.0886 -16.9990 -16.9990 -16.9986 -16.9986 -1.4472 -1.4472 -1.4469 -1.4469 4.1422 4.1422 4.1602 4.1602 5.8466 5.8466 5.8493 5.8493 6.6339 6.6339 6.6479 6.6479 7.8009 7.8009 7.8572 7.8572 8.5021 8.5021 8.5338 8.5338 10.1369 10.1369 10.1495 10.1495 14.9194 14.9194 15.0808 15.0808 15.3878 15.3878 15.4502 15.4502 k = 0.4767 0.5000-0.0000 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0889 -17.0889 -17.0889 -17.0889 -16.9990 -16.9990 -16.9987 -16.9987 -1.4459 -1.4459 -1.4458 -1.4458 4.1687 4.1687 4.1810 4.1810 5.8464 5.8464 5.8483 5.8483 6.6010 6.6010 6.6106 6.6106 7.8102 7.8102 7.8482 7.8482 8.5041 8.5041 8.5256 8.5256 10.1371 10.1371 10.1456 10.1456 14.9854 14.9854 15.1179 15.1179 15.3962 15.3962 15.4523 15.4523 k = 0.4884 0.5000-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9988 -16.9988 -1.4452 -1.4452 -1.4451 -1.4451 4.1862 4.1862 4.1925 4.1925 5.8465 5.8465 5.8474 5.8474 6.5819 6.5819 6.5868 6.5868 7.8197 7.8197 7.8389 7.8389 8.5076 8.5076 8.5185 8.5185 10.1380 10.1380 10.1423 10.1423 15.0454 15.0454 15.1218 15.1218 15.4154 15.4154 15.4492 15.4492 k = 0.5000 0.5000-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4449 -1.4449 -1.4449 -1.4449 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5771 6.5771 6.5771 6.5771 7.8293 7.8293 7.8293 7.8293 8.5124 8.5124 8.5124 8.5124 10.1398 10.1398 10.1398 10.1398 15.0940 15.0940 15.0940 15.0940 15.4369 15.4369 15.4369 15.4369 k = 0.5000 0.5000-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4449 -1.4449 -1.4449 -1.4449 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5771 6.5771 6.5771 6.5771 7.8293 7.8293 7.8293 7.8293 8.5124 8.5124 8.5124 8.5124 10.1398 10.1398 10.1398 10.1398 15.0940 15.0940 15.0940 15.0940 15.4369 15.4369 15.4369 15.4369 k = 0.4918 0.4918-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9988 -16.9988 -1.4459 -1.4459 -1.4444 -1.4444 4.1824 4.1824 4.1963 4.1963 5.8460 5.8460 5.8479 5.8479 6.5775 6.5775 6.5910 6.5910 7.8191 7.8191 7.8395 7.8395 8.5076 8.5076 8.5185 8.5185 10.1379 10.1379 10.1424 10.1424 15.0423 15.0423 15.1263 15.1263 15.4120 15.4120 15.4508 15.4508 k = 0.4836 0.4836-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7343 -24.7343 -17.0890 -17.0890 -17.0890 -17.0890 -16.9990 -16.9990 -16.9987 -16.9987 -1.4488 -1.4488 -1.4430 -1.4430 4.1499 4.1499 4.2005 4.2005 5.8439 5.8439 5.8509 5.8509 6.5801 6.5801 6.6306 6.6306 7.8054 7.8054 7.8530 7.8530 8.5040 8.5040 8.5257 8.5257 10.1366 10.1366 10.1461 10.1461 14.9667 14.9667 15.1527 15.1527 15.3714 15.3714 15.4578 15.4578 k = 0.4754 0.4754-0.0000 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7342 -24.7342 -17.0886 -17.0886 -17.0886 -17.0886 -16.9990 -16.9990 -16.9986 -16.9986 -1.4536 -1.4536 -1.4405 -1.4405 4.0981 4.0981 4.2073 4.2073 5.8407 5.8407 5.8557 5.8557 6.5844 6.5844 6.6943 6.6943 7.7861 7.7861 7.8715 7.8715 8.5017 8.5017 8.5342 8.5342 10.1355 10.1355 10.1512 10.1512 14.8735 14.8735 15.1811 15.1811 15.3212 15.3212 15.4570 15.4570 k = 0.4672 0.4672-0.0000 ( 4230 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7341 -24.7341 -24.7340 -24.7340 -17.0881 -17.0881 -17.0881 -17.0881 -16.9990 -16.9990 -16.9985 -16.9985 -1.4603 -1.4603 -1.4372 -1.4372 4.0297 4.0297 4.2168 4.2168 5.8367 5.8367 5.8624 5.8624 6.5904 6.5904 6.7793 6.7793 7.7607 7.7607 7.8955 7.8955 8.5008 8.5008 8.5439 8.5439 10.1346 10.1346 10.1579 10.1579 14.7704 14.7704 15.2064 15.2064 15.2739 15.2739 15.4502 15.4502 k = 0.4590 0.4590-0.0000 ( 4224 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7340 -24.7340 -24.7338 -24.7338 -17.0875 -17.0875 -17.0874 -17.0874 -16.9990 -16.9990 -16.9983 -16.9983 -1.4690 -1.4690 -1.4329 -1.4329 3.9479 3.9479 4.2290 4.2290 5.8321 5.8321 5.8709 5.8709 6.5981 6.5981 6.8825 6.8825 7.7289 7.7289 7.9249 7.9249 8.5013 8.5013 8.5550 8.5550 10.1341 10.1341 10.1662 10.1662 14.6628 14.6628 15.1831 15.1831 15.2768 15.2768 15.4385 15.4385 k = 0.4508 0.4508-0.0000 ( 4230 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7339 -24.7339 -24.7336 -24.7336 -17.0868 -17.0868 -17.0868 -17.0868 -16.9991 -16.9991 -16.9981 -16.9981 -1.4796 -1.4796 -1.4277 -1.4277 3.8555 3.8555 4.2440 4.2440 5.8276 5.8276 5.8812 5.8812 6.6075 6.6075 7.0007 7.0007 7.6912 7.6912 7.9591 7.9591 8.5031 8.5031 8.5676 8.5676 10.1342 10.1342 10.1763 10.1763 14.5543 14.5543 15.1250 15.1250 15.3141 15.3141 15.4228 15.4228 k = 0.4426 0.4426-0.0000 ( 4220 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7336 -24.7336 -24.7333 -24.7333 -17.0859 -17.0859 -17.0858 -17.0858 -16.9991 -16.9991 -16.9979 -16.9979 -1.4922 -1.4922 -1.4217 -1.4217 3.7550 3.7550 4.2617 4.2617 5.8235 5.8235 5.8932 5.8932 6.6187 6.6187 7.1311 7.1311 7.6482 7.6482 7.9974 7.9974 8.5063 8.5063 8.5818 8.5818 10.1350 10.1350 10.1882 10.1882 14.4472 14.4472 15.0613 15.0613 15.3527 15.3527 15.4035 15.4035 k = 0.4344 0.4344-0.0000 ( 4225 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7334 -24.7334 -24.7331 -24.7331 -17.0849 -17.0849 -17.0848 -17.0848 -16.9991 -16.9991 -16.9977 -16.9977 -1.5066 -1.5066 -1.4150 -1.4150 3.6486 3.6486 4.2821 4.2821 5.8204 5.8204 5.9070 5.9070 6.6315 6.6315 7.2700 7.2700 7.6016 7.6016 8.0389 8.0389 8.5107 8.5107 8.5977 8.5977 10.1367 10.1367 10.2018 10.2018 14.3435 14.3435 14.9956 14.9956 15.3719 15.3719 15.3939 15.3939 k = 0.4262 0.4262-0.0000 ( 4223 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7331 -24.7331 -24.7328 -24.7328 -17.0838 -17.0838 -17.0837 -17.0837 -16.9991 -16.9991 -16.9974 -16.9974 -1.5230 -1.5230 -1.4075 -1.4075 3.5380 3.5380 4.3052 4.3052 5.8188 5.8188 5.9226 5.9226 6.6459 6.6459 7.4077 7.4077 7.5599 7.5599 8.0832 8.0832 8.5163 8.5163 8.6155 8.6155 10.1396 10.1396 10.2172 10.2172 14.2446 14.2446 14.9288 14.9288 15.3475 15.3475 15.4139 15.4139 k = 0.4180 0.4180-0.0000 ( 4223 PWs) bands (ev): -50.3980 -50.3980 -50.3980 -50.3980 -24.7329 -24.7329 -24.7324 -24.7324 -17.0826 -17.0826 -17.0824 -17.0824 -16.9992 -16.9992 -16.9970 -16.9970 -1.5413 -1.5413 -1.3994 -1.3994 3.4246 3.4246 4.3310 4.3310 5.8191 5.8191 5.9399 5.9399 6.6618 6.6618 7.4580 7.4580 7.6080 7.6080 8.1295 8.1295 8.5230 8.5230 8.6353 8.6353 10.1439 10.1439 10.2343 10.2343 14.1519 14.1519 14.8610 14.8610 15.3157 15.3157 15.4255 15.4255 k = 0.4098 0.4098-0.0000 ( 4219 PWs) bands (ev): -50.3981 -50.3981 -50.3980 -50.3980 -24.7325 -24.7325 -24.7320 -24.7320 -17.0812 -17.0812 -17.0810 -17.0810 -16.9992 -16.9992 -16.9967 -16.9967 -1.5615 -1.5615 -1.3907 -1.3907 3.3095 3.3095 4.3595 4.3595 5.8218 5.8218 5.9591 5.9591 6.6790 6.6790 7.4099 7.4099 7.7554 7.7554 8.1781 8.1781 8.5310 8.5310 8.6570 8.6570 10.1496 10.1496 10.2532 10.2532 14.0664 14.0664 14.7926 14.7926 15.2801 15.2801 15.4262 15.4262 k = 0.4016 0.4016-0.0000 ( 4225 PWs) bands (ev): -50.3981 -50.3981 -50.3981 -50.3981 -24.7322 -24.7322 -24.7316 -24.7316 -17.0797 -17.0797 -17.0795 -17.0795 -16.9992 -16.9992 -16.9964 -16.9964 -1.5835 -1.5835 -1.3815 -1.3815 3.1934 3.1934 4.3907 4.3907 5.8273 5.8273 5.9800 5.9800 6.6971 6.6971 7.3495 7.3495 7.9134 7.9134 8.2305 8.2305 8.5403 8.5403 8.6807 8.6807 10.1569 10.1569 10.2739 10.2739 13.9890 13.9890 14.7236 14.7236 15.2415 15.2415 15.4172 15.4172 k = 0.3934 0.3934-0.0000 ( 4225 PWs) bands (ev): -50.3982 -50.3982 -50.3982 -50.3982 -24.7318 -24.7318 -24.7312 -24.7312 -17.0781 -17.0781 -17.0779 -17.0779 -16.9992 -16.9992 -16.9960 -16.9960 -1.6074 -1.6074 -1.3719 -1.3719 3.0771 3.0771 4.4247 4.4247 5.8358 5.8358 6.0027 6.0027 6.7156 6.7156 7.2865 7.2865 8.0643 8.0643 8.2934 8.2934 8.5516 8.5516 8.7066 8.7066 10.1659 10.1659 10.2963 10.2963 13.9208 13.9208 14.6540 14.6540 15.2006 15.2006 15.4003 15.4003 k = 0.3852 0.3852-0.0000 ( 4229 PWs) bands (ev): -50.3983 -50.3983 -50.3983 -50.3983 -24.7314 -24.7314 -24.7308 -24.7308 -17.0763 -17.0763 -17.0761 -17.0761 -16.9993 -16.9993 -16.9956 -16.9956 -1.6331 -1.6331 -1.3620 -1.3620 2.9611 2.9611 4.4613 4.4613 5.8479 5.8479 6.0272 6.0272 6.7334 6.7334 7.2236 7.2236 8.1850 8.1850 8.3847 8.3847 8.5672 8.5672 8.7349 8.7349 10.1766 10.1766 10.3204 10.3204 13.8622 13.8622 14.5838 14.5838 15.1582 15.1582 15.3770 15.3770 k = 0.3770 0.3770-0.0000 ( 4235 PWs) bands (ev): -50.3984 -50.3984 -50.3984 -50.3984 -24.7311 -24.7311 -24.7303 -24.7303 -17.0745 -17.0745 -17.0742 -17.0742 -16.9994 -16.9994 -16.9952 -16.9952 -1.6606 -1.6606 -1.3518 -1.3518 2.8459 2.8459 4.5006 4.5006 5.8636 5.8636 6.0535 6.0535 6.7488 6.7488 7.1638 7.1638 8.2598 8.2598 8.5001 8.5001 8.6037 8.6037 8.7668 8.7668 10.1891 10.1891 10.3462 10.3462 13.8140 13.8140 14.5130 14.5130 15.1151 15.1151 15.3485 15.3485 k = 0.3689 0.3689-0.0000 ( 4219 PWs) bands (ev): -50.3985 -50.3985 -50.3984 -50.3984 -24.7305 -24.7305 -24.7297 -24.7297 -17.0725 -17.0725 -17.0722 -17.0722 -16.9992 -16.9992 -16.9947 -16.9947 -1.6899 -1.6899 -1.3416 -1.3416 2.7318 2.7318 4.5426 4.5426 5.8832 5.8832 6.0816 6.0816 6.7586 6.7586 7.1110 7.1110 8.3066 8.3066 8.5568 8.5568 8.7153 8.7153 8.8120 8.8120 10.2034 10.2034 10.3736 10.3736 13.7764 13.7764 14.4415 14.4415 15.0721 15.0721 15.3156 15.3156 k = 0.3607 0.3607-0.0000 ( 4227 PWs) bands (ev): -50.3986 -50.3986 -50.3985 -50.3985 -24.7301 -24.7301 -24.7292 -24.7292 -17.0705 -17.0705 -17.0701 -17.0701 -16.9993 -16.9993 -16.9942 -16.9942 -1.7207 -1.7207 -1.3313 -1.3313 2.6191 2.6191 4.5872 4.5872 5.9069 5.9069 6.1114 6.1114 6.7576 6.7576 7.0712 7.0712 8.3398 8.3398 8.5771 8.5771 8.8021 8.8021 8.9320 8.9320 10.2195 10.2195 10.4027 10.4027 13.7497 13.7497 14.3693 14.3693 15.0301 15.0301 15.2791 15.2791 k = 0.3525 0.3525-0.0000 ( 4223 PWs) bands (ev): -50.3987 -50.3987 -50.3986 -50.3986 -24.7295 -24.7295 -24.7286 -24.7286 -17.0684 -17.0684 -17.0679 -17.0679 -16.9993 -16.9993 -16.9937 -16.9937 -1.7532 -1.7532 -1.3211 -1.3211 2.5080 2.5080 4.6346 4.6346 5.9348 5.9348 6.1431 6.1431 6.7404 6.7404 7.0503 7.0503 8.3644 8.3644 8.5919 8.5919 8.8435 8.8435 9.1108 9.1108 10.2376 10.2376 10.4333 10.4333 13.7336 13.7336 14.2962 14.2962 14.9898 14.9898 15.2395 15.2395 k = 0.3443 0.3443-0.0000 ( 4225 PWs) bands (ev): -50.3988 -50.3988 -50.3987 -50.3987 -24.7291 -24.7291 -24.7280 -24.7280 -17.0661 -17.0661 -17.0656 -17.0656 -16.9993 -16.9993 -16.9931 -16.9931 -1.7872 -1.7872 -1.3112 -1.3112 2.3988 2.3988 4.6846 4.6846 5.9670 5.9670 6.1765 6.1765 6.7059 6.7059 7.0499 7.0499 8.3819 8.3819 8.6055 8.6055 8.8793 8.8793 9.3016 9.3016 10.2576 10.2576 10.4655 10.4655 13.7277 13.7277 14.2223 14.2223 14.9521 14.9521 15.1971 15.1971 k = 0.3361 0.3361-0.0000 ( 4229 PWs) bands (ev): -50.3989 -50.3989 -50.3988 -50.3988 -24.7285 -24.7285 -24.7275 -24.7275 -17.0637 -17.0637 -17.0632 -17.0632 -16.9993 -16.9993 -16.9926 -16.9926 -1.8227 -1.8227 -1.3015 -1.3015 2.2916 2.2916 4.7372 4.7372 6.0033 6.0033 6.2117 6.2117 6.6589 6.6589 7.0660 7.0660 8.3932 8.3932 8.6188 8.6188 8.9142 8.9142 9.4974 9.4974 10.2795 10.2795 10.4991 10.4991 13.7310 13.7310 14.1476 14.1476 14.9178 14.9178 15.1524 15.1524 k = 0.3279 0.3279-0.0000 ( 4227 PWs) bands (ev): -50.3990 -50.3990 -50.3990 -50.3990 -24.7279 -24.7279 -24.7268 -24.7268 -17.0613 -17.0613 -17.0607 -17.0607 -16.9993 -16.9993 -16.9920 -16.9920 -1.8596 -1.8596 -1.2923 -1.2923 2.1865 2.1865 4.7926 4.7926 6.0439 6.0439 6.2486 6.2486 6.6050 6.6050 7.0933 7.0933 8.3983 8.3983 8.6323 8.6323 8.9489 8.9489 9.6961 9.6961 10.3036 10.3036 10.5342 10.5342 13.7418 13.7418 14.0726 14.0726 14.8876 14.8876 15.1054 15.1054 k = 0.3197 0.3197-0.0000 ( 4223 PWs) bands (ev): -50.3991 -50.3991 -50.3991 -50.3991 -24.7274 -24.7274 -24.7261 -24.7261 -17.0588 -17.0588 -17.0581 -17.0581 -16.9993 -16.9993 -16.9913 -16.9913 -1.8976 -1.8976 -1.2836 -1.2836 2.0836 2.0836 4.8505 4.8505 6.0886 6.0886 6.2874 6.2874 6.5484 6.5484 7.1281 7.1281 8.3976 8.3976 8.6464 8.6464 8.9833 8.9833 9.8966 9.8966 10.3299 10.3299 10.5707 10.5707 13.7570 13.7570 13.9986 13.9986 14.8620 14.8620 15.0565 15.0565 k = 0.3115 0.3115-0.0000 ( 4225 PWs) bands (ev): -50.3993 -50.3993 -50.3992 -50.3992 -24.7268 -24.7268 -24.7255 -24.7255 -17.0562 -17.0562 -17.0555 -17.0555 -16.9993 -16.9993 -16.9907 -16.9907 -1.9369 -1.9369 -1.2755 -1.2755 1.9831 1.9831 4.9111 4.9111 6.1372 6.1372 6.3278 6.3278 6.4916 6.4916 7.1684 7.1684 8.3915 8.3915 8.6614 8.6614 9.0173 9.0173 10.0975 10.0975 10.3590 10.3590 10.6086 10.6086 13.7691 13.7691 13.9311 13.9311 14.8407 14.8407 15.0064 15.0064 k = 0.3033 0.3033-0.0000 ( 4225 PWs) bands (ev): -50.3994 -50.3994 -50.3993 -50.3993 -24.7262 -24.7262 -24.7248 -24.7248 -17.0535 -17.0535 -17.0528 -17.0528 -16.9992 -16.9992 -16.9901 -16.9901 -1.9772 -1.9772 -1.2681 -1.2681 1.8851 1.8851 4.9743 4.9743 6.1893 6.1893 6.3700 6.3700 6.4363 6.4363 7.2130 7.2130 8.3803 8.3803 8.6775 8.6775 9.0503 9.0503 10.2939 10.2939 10.3950 10.3950 10.6483 10.6483 13.7562 13.7562 13.8894 13.8894 14.8212 14.8212 14.9571 14.9571 k = 0.2951 0.2951-0.0000 ( 4221 PWs) bands (ev): -50.3995 -50.3995 -50.3994 -50.3994 -24.7255 -24.7255 -24.7241 -24.7241 -17.0507 -17.0507 -17.0500 -17.0500 -16.9992 -16.9992 -16.9894 -16.9894 -2.0185 -2.0185 -1.2615 -1.2615 1.7895 1.7895 5.0400 5.0400 6.2443 6.2443 6.3833 6.3833 6.4146 6.4146 7.2613 7.2613 8.3647 8.3647 8.6948 8.6948 9.0822 9.0822 10.4088 10.4088 10.5127 10.5127 10.6913 10.6913 13.7001 13.7001 13.8890 13.8890 14.7963 14.7963 14.9138 14.9138 k = 0.2869 0.2869-0.0000 ( 4225 PWs) bands (ev): -50.3996 -50.3996 -50.3996 -50.3996 -24.7249 -24.7249 -24.7234 -24.7234 -17.0480 -17.0480 -17.0471 -17.0471 -16.9992 -16.9992 -16.9888 -16.9888 -2.0606 -2.0606 -1.2559 -1.2559 1.6964 1.6964 5.1084 5.1084 6.2956 6.2956 6.3409 6.3409 6.4600 6.4600 7.3127 7.3127 8.3456 8.3456 8.7135 8.7135 9.1124 9.1124 10.4487 10.4487 10.6840 10.6840 10.7584 10.7584 13.6219 13.6219 13.9064 13.9064 14.7550 14.7550 14.8827 14.8827 k = 0.2787 0.2787-0.0000 ( 4219 PWs) bands (ev): -50.3998 -50.3998 -50.3997 -50.3997 -24.7243 -24.7243 -24.7226 -24.7226 -17.0452 -17.0452 -17.0441 -17.0441 -16.9991 -16.9991 -16.9880 -16.9880 -2.1033 -2.1033 -1.2512 -1.2512 1.6059 1.6059 5.1793 5.1793 6.2789 6.2789 6.3723 6.3723 6.5074 6.5074 7.3672 7.3672 8.3240 8.3240 8.7337 8.7337 9.1407 9.1407 10.4866 10.4866 10.7555 10.7555 10.9293 10.9293 13.5351 13.5351 13.9258 13.9258 14.6954 14.6954 14.8576 14.8576 k = 0.2705 0.2705-0.0000 ( 4225 PWs) bands (ev): -50.3999 -50.3999 -50.3998 -50.3998 -24.7237 -24.7237 -24.7219 -24.7219 -17.0423 -17.0423 -17.0412 -17.0412 -16.9990 -16.9990 -16.9874 -16.9874 -2.1467 -2.1467 -1.2475 -1.2475 1.5181 1.5181 5.2528 5.2528 6.2377 6.2377 6.4340 6.4340 6.5566 6.5566 7.4244 7.4244 8.3010 8.3010 8.7552 8.7552 9.1665 9.1665 10.5261 10.5261 10.8005 10.8005 11.1263 11.1263 13.4433 13.4433 13.9424 13.9424 14.6238 14.6238 14.8243 14.8243 k = 0.2623 0.2623-0.0000 ( 4225 PWs) bands (ev): -50.4000 -50.4000 -50.3999 -50.3999 -24.7230 -24.7230 -24.7212 -24.7212 -17.0394 -17.0394 -17.0382 -17.0382 -16.9989 -16.9989 -16.9867 -16.9867 -2.1904 -2.1904 -1.2449 -1.2449 1.4329 1.4329 5.3288 5.3288 6.1991 6.1991 6.4986 6.4986 6.6076 6.6076 7.4843 7.4843 8.2778 8.2778 8.7782 8.7782 9.1897 9.1897 10.5675 10.5675 10.8430 10.8430 11.3237 11.3237 13.3477 13.3477 13.9544 13.9544 14.5449 14.5449 14.7766 14.7766 k = 0.2541 0.2541-0.0000 ( 4225 PWs) bands (ev): -50.4002 -50.4002 -50.4001 -50.4001 -24.7224 -24.7224 -24.7205 -24.7205 -17.0364 -17.0364 -17.0352 -17.0352 -16.9988 -16.9988 -16.9860 -16.9860 -2.2345 -2.2345 -1.2435 -1.2435 1.3503 1.3503 5.4073 5.4073 6.1644 6.1644 6.5639 6.5639 6.6604 6.6604 7.5468 7.5468 8.2558 8.2558 8.8026 8.8026 9.2097 9.2097 10.6109 10.6109 10.8847 10.8847 11.5185 11.5185 13.2487 13.2487 13.9614 13.9614 14.4619 14.4619 14.7173 14.7173 k = 0.2459 0.2459-0.0000 ( 4221 PWs) bands (ev): -50.4003 -50.4003 -50.4002 -50.4002 -24.7217 -24.7217 -24.7197 -24.7197 -17.0334 -17.0334 -17.0321 -17.0321 -16.9987 -16.9987 -16.9852 -16.9852 -2.2788 -2.2788 -1.2432 -1.2432 1.2704 1.2704 5.4883 5.4883 6.1342 6.1342 6.6285 6.6285 6.7149 6.7149 7.6118 7.6118 8.2367 8.2367 8.8285 8.8285 9.2263 9.2263 10.6562 10.6562 10.9257 10.9257 11.7091 11.7091 13.1465 13.1465 13.9633 13.9633 14.3778 14.3778 14.6512 14.6512 k = 0.2377 0.2377-0.0000 ( 4217 PWs) bands (ev): -50.4004 -50.4004 -50.4003 -50.4003 -24.7210 -24.7210 -24.7189 -24.7189 -17.0303 -17.0303 -17.0290 -17.0290 -16.9986 -16.9986 -16.9845 -16.9845 -2.3231 -2.3231 -1.2440 -1.2440 1.1933 1.1933 5.5718 5.5718 6.1085 6.1085 6.6909 6.6909 6.7713 6.7713 7.6793 7.6793 8.2221 8.2221 8.8559 8.8559 9.2393 9.2393 10.7033 10.7033 10.9659 10.9659 11.8938 11.8938 13.0413 13.0413 13.9594 13.9594 14.2963 14.2963 14.5819 14.5819 k = 0.2295 0.2295-0.0000 ( 4229 PWs) bands (ev): -50.4006 -50.4006 -50.4004 -50.4004 -24.7204 -24.7204 -24.7183 -24.7183 -17.0274 -17.0274 -17.0260 -17.0260 -16.9985 -16.9985 -16.9839 -16.9839 -2.3673 -2.3673 -1.2460 -1.2460 1.1188 1.1188 5.6576 5.6576 6.0875 6.0875 6.7497 6.7497 6.8294 6.8294 7.7491 7.7491 8.2139 8.2139 8.8847 8.8847 9.2485 9.2485 10.7518 10.7518 11.0050 11.0050 12.0708 12.0708 12.9335 12.9335 13.9468 13.9468 14.2225 14.2225 14.5116 14.5116 k = 0.2213 0.2213-0.0000 ( 4237 PWs) bands (ev): -50.4007 -50.4007 -50.4006 -50.4006 -24.7198 -24.7198 -24.7176 -24.7176 -17.0244 -17.0244 -17.0230 -17.0230 -16.9984 -16.9984 -16.9832 -16.9832 -2.4113 -2.4113 -1.2491 -1.2491 1.0470 1.0470 5.7458 5.7458 6.0714 6.0714 6.8035 6.8035 6.8889 6.8889 7.8212 7.8212 8.2141 8.2141 8.9150 8.9150 9.2537 9.2537 10.8013 10.8013 11.0426 11.0426 12.2377 12.2377 12.8236 12.8236 13.9204 13.9204 14.1642 14.1642 14.4420 14.4420 k = 0.2131 0.2131-0.0000 ( 4233 PWs) bands (ev): -50.4008 -50.4008 -50.4007 -50.4007 -24.7191 -24.7191 -24.7168 -24.7168 -17.0213 -17.0213 -17.0199 -17.0199 -16.9982 -16.9982 -16.9824 -16.9824 -2.4549 -2.4549 -1.2533 -1.2533 0.9779 0.9779 5.8362 5.8362 6.0601 6.0601 6.8506 6.8506 6.9495 6.9495 7.8954 7.8954 8.2247 8.2247 8.9467 8.9467 9.2548 9.2548 10.8515 10.8515 11.0784 11.0784 12.3904 12.3904 12.7140 12.7140 13.8756 13.8756 14.1274 14.1274 14.3748 14.3748 k = 0.2049 0.2049-0.0000 ( 4229 PWs) bands (ev): -50.4009 -50.4009 -50.4008 -50.4008 -24.7184 -24.7184 -24.7161 -24.7161 -17.0183 -17.0183 -17.0169 -17.0169 -16.9979 -16.9979 -16.9817 -16.9817 -2.4980 -2.4980 -1.2586 -1.2586 0.9116 0.9116 5.9288 5.9288 6.0538 6.0538 6.8897 6.8897 7.0111 7.0111 7.9718 7.9718 8.2474 8.2474 8.9795 8.9795 9.2521 9.2521 10.9016 10.9016 11.1119 11.1119 12.5045 12.5045 12.6271 12.6271 13.8155 13.8155 14.1097 14.1097 14.3118 14.3118 k = 0.1967 0.1967-0.0000 ( 4227 PWs) bands (ev): -50.4011 -50.4011 -50.4009 -50.4009 -24.7178 -24.7178 -24.7153 -24.7153 -17.0154 -17.0154 -17.0140 -17.0140 -16.9977 -16.9977 -16.9810 -16.9810 -2.5406 -2.5406 -1.2649 -1.2649 0.8479 0.8479 6.0210 6.0210 6.0548 6.0548 6.9196 6.9196 7.0737 7.0737 8.0502 8.0502 8.2832 8.2832 9.0134 9.0134 9.2457 9.2457 10.9511 10.9511 11.1429 11.1429 12.4515 12.4515 12.6897 12.6897 13.7482 13.7482 14.1011 14.1011 14.2570 14.2570 k = 0.1885 0.1885-0.0000 ( 4233 PWs) bands (ev): -50.4012 -50.4012 -50.4011 -50.4011 -24.7172 -24.7172 -24.7147 -24.7147 -17.0125 -17.0125 -17.0112 -17.0112 -16.9973 -16.9973 -16.9803 -16.9803 -2.5824 -2.5824 -1.2721 -1.2721 0.7869 0.7869 6.0520 6.0520 6.1239 6.1239 6.9397 6.9397 7.1374 7.1374 8.1304 8.1304 8.3327 8.3327 9.0475 9.0475 9.2364 9.2364 10.9992 10.9992 11.1709 11.1709 12.3372 12.3372 12.7945 12.7945 13.6802 13.6802 14.0887 14.0887 14.2181 14.2181 k = 0.1803 0.1803-0.0000 ( 4241 PWs) bands (ev): -50.4013 -50.4013 -50.4012 -50.4012 -24.7166 -24.7166 -24.7140 -24.7140 -17.0097 -17.0097 -17.0085 -17.0085 -16.9969 -16.9969 -16.9797 -16.9797 -2.6233 -2.6233 -1.2801 -1.2801 0.7286 0.7286 6.0601 6.0601 6.2225 6.2225 6.9503 6.9503 7.2021 7.2021 8.2123 8.2123 8.3956 8.3956 9.0799 9.0799 9.2263 9.2263 11.0447 11.0447 11.1957 11.1957 12.2157 12.2157 12.8865 12.8865 13.6153 13.6153 14.0613 14.0613 14.2028 14.2028 k = 0.1721 0.1721-0.0000 ( 4237 PWs) bands (ev): -50.4014 -50.4014 -50.4013 -50.4013 -24.7159 -24.7159 -24.7133 -24.7133 -17.0071 -17.0071 -17.0058 -17.0058 -16.9963 -16.9963 -16.9790 -16.9790 -2.6633 -2.6633 -1.2889 -1.2889 0.6730 0.6730 6.0720 6.0720 6.3238 6.3238 6.9522 6.9522 7.2678 7.2678 8.2957 8.2957 8.4709 8.4709 9.1057 9.1057 9.2206 9.2206 11.0866 11.0866 11.2174 11.2174 12.0913 12.0913 12.9612 12.9612 13.5562 13.5562 14.0223 14.0223 14.2037 14.2037 k = 0.1639 0.1639-0.0000 ( 4237 PWs) bands (ev): -50.4016 -50.4016 -50.4014 -50.4014 -24.7153 -24.7153 -24.7127 -24.7127 -17.0048 -17.0048 -17.0032 -17.0032 -16.9954 -16.9954 -16.9784 -16.9784 -2.7022 -2.7022 -1.2984 -1.2984 0.6201 0.6201 6.0880 6.0880 6.4273 6.4273 6.9466 6.9466 7.3345 7.3345 8.3804 8.3804 8.5570 8.5570 9.1144 9.1144 9.2300 9.2300 11.1231 11.1231 11.2365 11.2365 11.9649 11.9649 13.0182 13.0182 13.5050 13.5050 13.9808 13.9808 14.1998 14.1998 k = 0.1557 0.1557-0.0000 ( 4243 PWs) bands (ev): -50.4017 -50.4017 -50.4015 -50.4015 -24.7148 -24.7148 -24.7120 -24.7120 -17.0030 -17.0030 -17.0007 -17.0007 -16.9941 -16.9941 -16.9778 -16.9778 -2.7399 -2.7399 -1.3084 -1.3084 0.5698 0.5698 6.1080 6.1080 6.5327 6.5327 6.9350 6.9350 7.4018 7.4018 8.4659 8.4659 8.6524 8.6524 9.1023 9.1023 9.2584 9.2584 11.1517 11.1517 11.2542 11.2542 11.8373 11.8373 13.0575 13.0575 13.4634 13.4634 13.9417 13.9417 14.1149 14.1149 k = 0.1475 0.1475-0.0000 ( 4247 PWs) bands (ev): -50.4018 -50.4018 -50.4016 -50.4016 -24.7142 -24.7142 -24.7115 -24.7115 -17.0016 -17.0016 -16.9981 -16.9981 -16.9926 -16.9926 -16.9772 -16.9772 -2.7763 -2.7763 -1.3188 -1.3188 0.5222 0.5222 6.1318 6.1318 6.6399 6.6399 6.9187 6.9187 7.4697 7.4697 8.5519 8.5519 8.7552 8.7552 9.0779 9.0779 9.2985 9.2985 11.1700 11.1700 11.2719 11.2719 11.7090 11.7090 13.0800 13.0800 13.4325 13.4325 13.9064 13.9064 13.9678 13.9678 k = 0.1393 0.1393-0.0000 ( 4239 PWs) bands (ev): -50.4019 -50.4019 -50.4017 -50.4017 -24.7136 -24.7136 -24.7108 -24.7108 -17.0007 -17.0007 -16.9956 -16.9956 -16.9906 -16.9906 -16.9766 -16.9766 -2.8113 -2.8113 -1.3295 -1.3295 0.4772 0.4772 6.1592 6.1592 6.7487 6.7487 6.8991 6.8991 7.5379 7.5379 8.6374 8.6374 8.8634 8.8634 9.0476 9.0476 9.3448 9.3448 11.1766 11.1766 11.2892 11.2892 11.5814 11.5814 13.0876 13.0876 13.4122 13.4122 13.8110 13.8110 13.8793 13.8793 k = 0.1311 0.1311-0.0000 ( 4241 PWs) bands (ev): -50.4020 -50.4020 -50.4018 -50.4018 -24.7131 -24.7131 -24.7103 -24.7103 -17.0000 -17.0000 -16.9932 -16.9932 -16.9886 -16.9886 -16.9760 -16.9760 -2.8449 -2.8449 -1.3405 -1.3405 0.4349 0.4349 6.1898 6.1898 6.8584 6.8584 6.8779 6.8779 7.6062 7.6062 8.7205 8.7205 8.9731 8.9731 9.0174 9.0174 9.3958 9.3958 11.1721 11.1721 11.3010 11.3010 11.4591 11.4591 13.0830 13.0830 13.4003 13.4003 13.6583 13.6583 13.8550 13.8550 k = 0.1230 0.1230-0.0000 ( 4235 PWs) bands (ev): -50.4021 -50.4021 -50.4019 -50.4019 -24.7125 -24.7125 -24.7098 -24.7098 -16.9995 -16.9995 -16.9907 -16.9907 -16.9865 -16.9865 -16.9755 -16.9755 -2.8768 -2.8768 -1.3515 -1.3515 0.3952 0.3952 6.2234 6.2234 6.8534 6.8534 6.9712 6.9712 7.6742 7.6742 8.7951 8.7951 8.9852 8.9852 9.0917 9.0917 9.4511 9.4511 11.1569 11.1569 11.2746 11.2746 11.3744 11.3744 13.0696 13.0696 13.3899 13.3899 13.5130 13.5130 13.8369 13.8369 k = 0.1148 0.1148-0.0000 ( 4225 PWs) bands (ev): -50.4022 -50.4022 -50.4020 -50.4020 -24.7120 -24.7120 -24.7091 -24.7091 -16.9991 -16.9991 -16.9885 -16.9885 -16.9843 -16.9843 -16.9749 -16.9749 -2.9071 -2.9071 -1.3624 -1.3624 0.3581 0.3581 6.2596 6.2596 6.8293 6.8293 7.0841 7.0841 7.7416 7.7416 8.8390 8.8390 8.9859 8.9859 9.2045 9.2045 9.5113 9.5113 11.1230 11.1230 11.1809 11.1809 11.3651 11.3651 13.0499 13.0499 13.3301 13.3301 13.4257 13.4257 13.8243 13.8243 k = 0.1066 0.1066-0.0000 ( 4229 PWs) bands (ev): -50.4023 -50.4023 -50.4021 -50.4021 -24.7116 -24.7116 -24.7086 -24.7086 -16.9989 -16.9989 -16.9864 -16.9864 -16.9823 -16.9823 -16.9744 -16.9744 -2.9357 -2.9357 -1.3732 -1.3732 0.3235 0.3235 6.2980 6.2980 6.8052 6.8052 7.1978 7.1978 7.8080 7.8080 8.8292 8.8292 9.0370 9.0370 9.3144 9.3144 9.5777 9.5777 11.0263 11.0263 11.1240 11.1240 11.3723 11.3723 13.0243 13.0243 13.1998 13.1998 13.4186 13.4186 13.8165 13.8165 k = 0.0984 0.0984-0.0000 ( 4237 PWs) bands (ev): -50.4023 -50.4023 -50.4021 -50.4021 -24.7112 -24.7112 -24.7082 -24.7082 -16.9987 -16.9987 -16.9844 -16.9844 -16.9803 -16.9803 -16.9740 -16.9740 -2.9624 -2.9624 -1.3837 -1.3837 0.2916 0.2916 6.3382 6.3382 6.7815 6.7815 7.3122 7.3122 7.8728 7.8728 8.7931 8.7931 9.1118 9.1118 9.4178 9.4178 9.6522 9.6522 10.9013 10.9013 11.0867 11.0867 11.3797 11.3797 12.9862 12.9862 13.0742 13.0742 13.4242 13.4242 13.8132 13.8132 k = 0.0902 0.0902-0.0000 ( 4233 PWs) bands (ev): -50.4024 -50.4024 -50.4022 -50.4022 -24.7109 -24.7109 -24.7077 -24.7077 -16.9985 -16.9985 -16.9826 -16.9826 -16.9784 -16.9784 -16.9735 -16.9735 -2.9873 -2.9873 -1.3938 -1.3938 0.2623 0.2623 6.3796 6.3796 6.7586 6.7586 7.4266 7.4266 7.9355 7.9355 8.7496 8.7496 9.1917 9.1917 9.5119 9.5119 9.7356 9.7356 10.7732 10.7732 11.0474 11.0474 11.3852 11.3852 12.9007 12.9007 12.9978 12.9978 13.4341 13.4341 13.8135 13.8135 k = 0.0820 0.0820-0.0000 ( 4227 PWs) bands (ev): -50.4025 -50.4025 -50.4023 -50.4023 -24.7104 -24.7104 -24.7073 -24.7073 -16.9983 -16.9983 -16.9808 -16.9808 -16.9767 -16.9767 -16.9731 -16.9731 -3.0102 -3.0102 -1.4034 -1.4034 0.2355 0.2355 6.4217 6.4217 6.7369 6.7369 7.5407 7.5407 7.9953 7.9953 8.7041 8.7041 9.2716 9.2716 9.5962 9.5962 9.8269 9.8269 10.6455 10.6455 11.0046 11.0046 11.3889 11.3889 12.7826 12.7826 12.9577 12.9577 13.4475 13.4475 13.8167 13.8167 k = 0.0738 0.0738-0.0000 ( 4227 PWs) bands (ev): -50.4025 -50.4025 -50.4023 -50.4023 -24.7101 -24.7101 -24.7069 -24.7069 -16.9981 -16.9981 -16.9792 -16.9792 -16.9751 -16.9751 -16.9728 -16.9728 -3.0311 -3.0311 -1.4124 -1.4124 0.2114 0.2114 6.4639 6.4639 6.7167 6.7167 7.6537 7.6537 8.0513 8.0513 8.6593 8.6593 9.3494 9.3494 9.6728 9.6728 9.9221 9.9221 10.5193 10.5193 10.9590 10.9590 11.3908 11.3908 12.6657 12.6657 12.9218 12.9218 13.4647 13.4647 13.8223 13.8223 k = 0.0656 0.0656-0.0000 ( 4223 PWs) bands (ev): -50.4026 -50.4026 -50.4024 -50.4024 -24.7097 -24.7097 -24.7066 -24.7066 -16.9980 -16.9980 -16.9777 -16.9777 -16.9737 -16.9737 -16.9724 -16.9724 -3.0499 -3.0499 -1.4207 -1.4207 0.1898 0.1898 6.5053 6.5053 6.6983 6.6983 7.7644 7.7644 8.1028 8.1028 8.6171 8.6171 9.4235 9.4235 9.7442 9.7442 10.0163 10.0163 10.3958 10.3958 10.9116 10.9116 11.3915 11.3915 12.5560 12.5560 12.8857 12.8857 13.4859 13.4859 13.8293 13.8293 k = 0.0574 0.0574-0.0000 ( 4227 PWs) bands (ev): -50.4026 -50.4026 -50.4024 -50.4024 -24.7095 -24.7095 -24.7064 -24.7064 -16.9979 -16.9979 -16.9764 -16.9764 -16.9726 -16.9726 -16.9720 -16.9720 -3.0666 -3.0666 -1.4283 -1.4283 0.1707 0.1707 6.5450 6.5450 6.6820 6.6820 7.8714 7.8714 8.1486 8.1486 8.5793 8.5793 9.4929 9.4929 9.8125 9.8125 10.1049 10.1049 10.2761 10.2761 10.8637 10.8637 11.3913 11.3913 12.4555 12.4555 12.8495 12.8495 13.5116 13.5116 13.8373 13.8373 k = 0.0492 0.0492-0.0000 ( 4225 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7092 -24.7092 -24.7061 -24.7061 -16.9978 -16.9978 -16.9753 -16.9753 -16.9721 -16.9721 -16.9712 -16.9712 -3.0812 -3.0812 -1.4350 -1.4350 0.1542 0.1542 6.5819 6.5819 6.6682 6.6682 7.9720 7.9720 8.1885 8.1885 8.5481 8.5481 9.5564 9.5564 9.8789 9.8789 10.1614 10.1614 10.1837 10.1837 10.8173 10.8173 11.3906 11.3906 12.3655 12.3655 12.8139 12.8139 13.5422 13.5422 13.8454 13.8454 k = 0.0410 0.0410-0.0000 ( 4221 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7090 -24.7090 -24.7059 -24.7059 -16.9977 -16.9977 -16.9743 -16.9743 -16.9718 -16.9718 -16.9702 -16.9702 -3.0936 -3.0936 -1.4408 -1.4408 0.1402 0.1402 6.6133 6.6133 6.6586 6.6586 8.0609 8.0609 8.2243 8.2243 8.5250 8.5250 9.6127 9.6127 9.9438 9.9438 10.0548 10.0548 10.2471 10.2471 10.7751 10.7751 11.3898 11.3898 12.2872 12.2872 12.7804 12.7804 13.5780 13.5780 13.8531 13.8531 k = 0.0328 0.0328-0.0000 ( 4223 PWs) bands (ev): -50.4028 -50.4028 -50.4025 -50.4025 -24.7088 -24.7088 -24.7058 -24.7058 -16.9976 -16.9976 -16.9735 -16.9735 -16.9716 -16.9716 -16.9695 -16.9695 -3.1038 -3.1038 -1.4456 -1.4456 0.1288 0.1288 6.6300 6.6300 6.6616 6.6616 8.1282 8.1282 8.2632 8.2632 8.5106 8.5106 9.6606 9.6606 9.9572 9.9572 10.0083 10.0083 10.2909 10.2909 10.7408 10.7408 11.3891 11.3891 12.2215 12.2215 12.7504 12.7504 13.6188 13.6188 13.8595 13.8595 k = 0.0246 0.0246-0.0000 ( 4223 PWs) bands (ev): -50.4028 -50.4028 -50.4025 -50.4025 -24.7087 -24.7087 -24.7056 -24.7056 -16.9976 -16.9976 -16.9729 -16.9729 -16.9715 -16.9715 -16.9689 -16.9689 -3.1118 -3.1118 -1.4494 -1.4494 0.1199 0.1199 6.6286 6.6286 6.6796 6.6796 8.1652 8.1652 8.3121 8.3121 8.5035 8.5035 9.6989 9.6989 9.8746 9.8746 10.0701 10.0701 10.3106 10.3106 10.7175 10.7175 11.3885 11.3885 12.1694 12.1694 12.7253 12.7253 13.6644 13.6644 13.8638 13.8638 k = 0.0164 0.0164-0.0000 ( 4223 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7086 -24.7086 -24.7055 -24.7055 -16.9975 -16.9975 -16.9724 -16.9724 -16.9714 -16.9714 -16.9684 -16.9684 -3.1175 -3.1175 -1.4521 -1.4521 0.1136 0.1136 6.6244 6.6244 6.6965 6.6965 8.1796 8.1796 8.3622 8.3622 8.5006 8.5006 9.7259 9.7259 9.8109 9.8109 10.1300 10.1300 10.3052 10.3052 10.7057 10.7057 11.3881 11.3881 12.1315 12.1315 12.7063 12.7063 13.7138 13.7138 13.8635 13.8635 k = 0.0082 0.0082-0.0000 ( 4223 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7055 -24.7055 -16.9975 -16.9975 -16.9722 -16.9722 -16.9713 -16.9713 -16.9682 -16.9682 -3.1209 -3.1209 -1.4537 -1.4537 0.1098 0.1098 6.6214 6.6214 6.7074 6.7074 8.1840 8.1840 8.3991 8.3991 8.4990 8.4990 9.7377 9.7377 9.7746 9.7746 10.1862 10.1862 10.2787 10.2787 10.7019 10.7019 11.3879 11.3879 12.1085 12.1085 12.6945 12.6945 13.7650 13.7650 13.8505 13.8505 k = 0.0000 0.0000 0.0000 ( 4219 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7084 -24.7084 -24.7055 -24.7055 -16.9974 -16.9974 -16.9721 -16.9721 -16.9713 -16.9713 -16.9681 -16.9681 -3.1220 -3.1220 -1.4543 -1.4543 0.1085 0.1085 6.6203 6.6203 6.7111 6.7111 8.1848 8.1848 8.4129 8.4129 8.4981 8.4981 9.7362 9.7362 9.7675 9.7675 10.2326 10.2326 10.2416 10.2416 10.7013 10.7013 11.3878 11.3878 12.1009 12.1009 12.6905 12.6905 13.8101 13.8101 13.8183 13.8183 k = 0.0000 0.0000 0.0000 ( 4219 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7084 -24.7084 -24.7055 -24.7055 -16.9974 -16.9974 -16.9721 -16.9721 -16.9713 -16.9713 -16.9681 -16.9681 -3.1220 -3.1220 -1.4543 -1.4543 0.1085 0.1085 6.6203 6.6203 6.7111 6.7111 8.1848 8.1848 8.4129 8.4129 8.4981 8.4981 9.7362 9.7362 9.7675 9.7675 10.2326 10.2326 10.2416 10.2416 10.7013 10.7013 11.3878 11.3878 12.1009 12.1009 12.6905 12.6905 13.8101 13.8101 13.8183 13.8183 k = 0.0000 0.0000 0.0112 ( 4231 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7086 -24.7086 -24.7055 -24.7055 -16.9975 -16.9975 -16.9721 -16.9721 -16.9714 -16.9714 -16.9681 -16.9681 -3.1217 -3.1217 -1.4554 -1.4554 0.1093 0.1093 6.5743 6.5743 6.7608 6.7608 8.1849 8.1849 8.4132 8.4132 8.4983 8.4983 9.7356 9.7356 9.7672 9.7672 10.2323 10.2323 10.2397 10.2397 10.7015 10.7015 11.3773 11.3773 12.1040 12.1040 12.6934 12.6934 13.8111 13.8111 13.8183 13.8183 k = 0.0000 0.0000 0.0225 ( 4231 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7055 -24.7055 -16.9974 -16.9974 -16.9721 -16.9721 -16.9715 -16.9715 -16.9681 -16.9681 -3.1205 -3.1205 -1.4586 -1.4586 0.1116 0.1116 6.5041 6.5041 6.8420 6.8420 8.1851 8.1851 8.4142 8.4142 8.4989 8.4989 9.7340 9.7340 9.7665 9.7665 10.2316 10.2316 10.2338 10.2338 10.7022 10.7022 11.3461 11.3461 12.1135 12.1135 12.7022 12.7022 13.8141 13.8141 13.8185 13.8185 k = 0.0000 0.0000 0.0337 ( 4239 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7086 -24.7086 -24.7056 -24.7056 -16.9973 -16.9973 -16.9721 -16.9721 -16.9716 -16.9716 -16.9682 -16.9682 -3.1186 -3.1186 -1.4639 -1.4639 0.1153 0.1153 6.4340 6.4340 6.9305 6.9305 8.1854 8.1854 8.4158 8.4158 8.4999 8.4999 9.7314 9.7314 9.7652 9.7652 10.2244 10.2244 10.2304 10.2304 10.7032 10.7032 11.2955 11.2955 12.1290 12.1290 12.7167 12.7167 13.8188 13.8188 13.8191 13.8191 k = 0.0000 0.0000 0.0450 ( 4230 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7056 -24.7056 -16.9970 -16.9970 -16.9720 -16.9720 -16.9719 -16.9719 -16.9682 -16.9682 -3.1160 -3.1160 -1.4710 -1.4710 0.1203 0.1203 6.3667 6.3667 7.0235 7.0235 8.1859 8.1859 8.4180 8.4180 8.5014 8.5014 9.7277 9.7277 9.7636 9.7636 10.2116 10.2116 10.2283 10.2283 10.7047 10.7047 11.2274 11.2274 12.1500 12.1500 12.7369 12.7369 13.8193 13.8193 13.8263 13.8263 k = 0.0000 0.0000 0.0562 ( 4242 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7086 -24.7086 -24.7056 -24.7056 -16.9969 -16.9969 -16.9722 -16.9722 -16.9720 -16.9720 -16.9683 -16.9683 -3.1128 -3.1128 -1.4799 -1.4799 0.1265 0.1265 6.3028 6.3028 7.1204 7.1204 8.1866 8.1866 8.4207 8.4207 8.5031 8.5031 9.7233 9.7233 9.7615 9.7615 10.1960 10.1960 10.2252 10.2252 10.7064 10.7064 11.1443 11.1443 12.1761 12.1761 12.7626 12.7626 13.8202 13.8202 13.8356 13.8356 k = 0.0000 0.0000 0.0675 ( 4234 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7056 -24.7056 -16.9965 -16.9965 -16.9724 -16.9724 -16.9720 -16.9720 -16.9683 -16.9683 -3.1090 -3.1090 -1.4903 -1.4903 0.1337 0.1337 6.2426 6.2426 7.2210 7.2210 8.1874 8.1874 8.4239 8.4239 8.5052 8.5052 9.7180 9.7180 9.7591 9.7591 10.1781 10.1781 10.2207 10.2207 10.7084 10.7084 11.0487 11.0487 12.2065 12.2065 12.7937 12.7937 13.8214 13.8214 13.8468 13.8468 k = 0.0000 0.0000 0.0787 ( 4234 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7085 -24.7085 -24.7056 -24.7056 -16.9961 -16.9961 -16.9729 -16.9729 -16.9719 -16.9719 -16.9683 -16.9683 -3.1047 -3.1047 -1.5019 -1.5019 0.1417 0.1417 6.1862 6.1862 7.3250 7.3250 8.1884 8.1884 8.4276 8.4276 8.5076 8.5076 9.7122 9.7122 9.7564 9.7564 10.1584 10.1584 10.2138 10.2138 10.7106 10.7106 10.9438 10.9438 12.2404 12.2404 12.8298 12.8298 13.8230 13.8230 13.8598 13.8598 k = 0.0000 0.0000 0.0900 ( 4226 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7084 -24.7084 -24.7056 -24.7056 -16.9956 -16.9956 -16.9732 -16.9732 -16.9718 -16.9718 -16.9684 -16.9684 -3.1000 -3.1000 -1.5144 -1.5144 0.1503 0.1503 6.1336 6.1336 7.4324 7.4324 8.1897 8.1897 8.4315 8.4315 8.5102 8.5102 9.7058 9.7058 9.7535 9.7535 10.1375 10.1375 10.2031 10.2031 10.7129 10.7129 10.8331 10.8331 12.2771 12.2771 12.8706 12.8706 13.8250 13.8250 13.8744 13.8744 k = 0.0000 0.0000 0.1012 ( 4238 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7084 -24.7084 -24.7058 -24.7058 -16.9951 -16.9951 -16.9739 -16.9739 -16.9718 -16.9718 -16.9685 -16.9685 -3.0949 -3.0949 -1.5275 -1.5275 0.1592 0.1592 6.0850 6.0850 7.5430 7.5430 8.1913 8.1913 8.4357 8.4357 8.5130 8.5130 9.6992 9.6992 9.7504 9.7504 10.1160 10.1160 10.1862 10.1862 10.7153 10.7153 10.7209 10.7209 12.3157 12.3157 12.9156 12.9156 13.8274 13.8274 13.8900 13.8900 k = 0.0000 0.0000 0.1125 ( 4234 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7083 -24.7083 -24.7058 -24.7058 -16.9945 -16.9945 -16.9744 -16.9744 -16.9717 -16.9717 -16.9685 -16.9685 -3.0897 -3.0897 -1.5408 -1.5408 0.1683 0.1683 6.0404 6.0404 7.6563 7.6563 8.1935 8.1935 8.4401 8.4401 8.5159 8.5159 9.6924 9.6924 9.7473 9.7473 10.0943 10.0943 10.1584 10.1584 10.6135 10.6135 10.7177 10.7177 12.3552 12.3552 12.9641 12.9641 13.8300 13.8300 13.9063 13.9063 k = 0.0000 0.0000 0.1237 ( 4238 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7082 -24.7082 -24.7059 -24.7059 -16.9940 -16.9940 -16.9751 -16.9751 -16.9716 -16.9716 -16.9686 -16.9686 -3.0844 -3.0844 -1.5542 -1.5542 0.1772 0.1772 5.9999 5.9999 7.7719 7.7719 8.1968 8.1968 8.4444 8.4444 8.5189 8.5189 9.6856 9.6856 9.7441 9.7441 10.0731 10.0731 10.1123 10.1123 10.5197 10.5197 10.7201 10.7201 12.3949 12.3949 13.0155 13.0155 13.8330 13.8330 13.9227 13.9227 k = 0.0000 0.0000 0.1350 ( 4258 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7083 -24.7083 -24.7061 -24.7061 -16.9935 -16.9935 -16.9757 -16.9757 -16.9716 -16.9716 -16.9688 -16.9688 -3.0792 -3.0792 -1.5671 -1.5671 0.1858 0.1858 5.9634 5.9634 7.8885 7.8885 8.2022 8.2022 8.4487 8.4487 8.5219 8.5219 9.6789 9.6789 9.7409 9.7409 10.0404 10.0404 10.0528 10.0528 10.4484 10.4484 10.7224 10.7224 12.4336 12.4336 13.0689 13.0689 13.8361 13.8361 13.9387 13.9387 k = 0.0000 0.0000 0.1462 ( 4262 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7082 -24.7082 -24.7062 -24.7062 -16.9929 -16.9929 -16.9764 -16.9764 -16.9715 -16.9715 -16.9689 -16.9689 -3.0742 -3.0742 -1.5794 -1.5794 0.1939 0.1939 5.9311 5.9311 8.0021 8.0021 8.2137 8.2137 8.4528 8.4528 8.5247 8.5247 9.6727 9.6727 9.7376 9.7376 9.9420 9.9420 10.0338 10.0338 10.4014 10.4014 10.7245 10.7245 12.4706 12.4706 13.1230 13.1230 13.8394 13.8394 13.9537 13.9537 k = 0.0000 0.0000 0.1575 ( 4254 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7081 -24.7081 -24.7062 -24.7062 -16.9923 -16.9923 -16.9768 -16.9768 -16.9714 -16.9714 -16.9690 -16.9690 -3.0695 -3.0695 -1.5907 -1.5907 0.2013 0.2013 5.9031 5.9031 8.0978 8.0978 8.2461 8.2461 8.4566 8.4566 8.5274 8.5274 9.6669 9.6669 9.7332 9.7332 9.8252 9.8252 10.0164 10.0164 10.3727 10.3727 10.7264 10.7264 12.5049 12.5049 13.1766 13.1766 13.8426 13.8426 13.9671 13.9671 k = 0.0000 0.0000 0.1687 ( 4238 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7080 -24.7080 -24.7061 -24.7061 -16.9916 -16.9916 -16.9774 -16.9774 -16.9713 -16.9713 -16.9690 -16.9690 -3.0653 -3.0653 -1.6008 -1.6008 0.2078 0.2078 5.8792 5.8792 8.1474 8.1474 8.3272 8.3272 8.4600 8.4600 8.5299 8.5299 9.6617 9.6617 9.6856 9.6856 9.7398 9.7398 10.0012 10.0012 10.3553 10.3553 10.7282 10.7282 12.5357 12.5357 13.2280 13.2280 13.8457 13.8457 13.9773 13.9773 k = 0.0000 0.0000 0.1800 ( 4238 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7079 -24.7079 -24.7062 -24.7062 -16.9911 -16.9911 -16.9779 -16.9779 -16.9712 -16.9712 -16.9690 -16.9690 -3.0617 -3.0617 -1.6094 -1.6094 0.2134 0.2134 5.8597 5.8597 8.1642 8.1642 8.4437 8.4437 8.4630 8.4630 8.5320 8.5320 9.5525 9.5525 9.6573 9.6573 9.7336 9.7336 9.9883 9.9883 10.3445 10.3445 10.7296 10.7296 12.5622 12.5622 13.2751 13.2751 13.8485 13.8485 13.9778 13.9778 k = 0.0000 0.0000 0.1912 ( 4234 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7079 -24.7079 -24.7062 -24.7062 -16.9906 -16.9906 -16.9783 -16.9783 -16.9712 -16.9712 -16.9691 -16.9691 -3.0587 -3.0587 -1.6163 -1.6163 0.2178 0.2178 5.8445 5.8445 8.1709 8.1709 8.4653 8.4653 8.5337 8.5337 8.5726 8.5726 9.4124 9.4124 9.6538 9.6538 9.7314 9.7314 9.9780 9.9780 10.3378 10.3378 10.7308 10.7308 12.5836 12.5836 13.3157 13.3157 13.8509 13.8509 13.9779 13.9779 k = 0.0000 0.0000 0.2025 ( 4246 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7079 -24.7079 -24.7063 -24.7063 -16.9904 -16.9904 -16.9787 -16.9787 -16.9711 -16.9711 -16.9692 -16.9692 -3.0566 -3.0566 -1.6214 -1.6214 0.2210 0.2210 5.8336 5.8336 8.1741 8.1741 8.4670 8.4670 8.5350 8.5350 8.7069 8.7069 9.2706 9.2706 9.6512 9.6512 9.7300 9.7300 9.9705 9.9705 10.3338 10.3338 10.7316 10.7316 12.5993 12.5993 13.3472 13.3472 13.8527 13.8527 13.9779 13.9779 k = 0.0000 0.0000 0.2137 ( 4230 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7062 -24.7062 -16.9901 -16.9901 -16.9789 -16.9789 -16.9711 -16.9711 -16.9691 -16.9691 -3.0552 -3.0552 -1.6245 -1.6245 0.2230 0.2230 5.8270 5.8270 8.1756 8.1756 8.4681 8.4681 8.5358 8.5358 8.8441 8.8441 9.1289 9.1289 9.6496 9.6496 9.7292 9.7292 9.9660 9.9660 10.3315 10.3315 10.7321 10.7321 12.6089 12.6089 13.3672 13.3672 13.8539 13.8539 13.9778 13.9778 k = 0.0000 0.0000 0.2250 ( 4218 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7061 -24.7061 -16.9900 -16.9900 -16.9789 -16.9789 -16.9710 -16.9710 -16.9690 -16.9690 -3.0548 -3.0548 -1.6255 -1.6255 0.2237 0.2237 5.8248 5.8248 8.1761 8.1761 8.4685 8.4685 8.5361 8.5361 8.9656 8.9656 9.0059 9.0059 9.6491 9.6491 9.7289 9.7289 9.9644 9.9644 10.3309 10.3309 10.7323 10.7323 12.6122 12.6122 13.3741 13.3741 13.8543 13.8543 13.9778 13.9778 k = 0.0000 0.0000 0.2250 ( 4218 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7061 -24.7061 -16.9900 -16.9900 -16.9789 -16.9789 -16.9710 -16.9710 -16.9690 -16.9690 -3.0548 -3.0548 -1.6255 -1.6255 0.2237 0.2237 5.8248 5.8248 8.1761 8.1761 8.4685 8.4685 8.5361 8.5361 8.9656 8.9656 9.0059 9.0059 9.6491 9.6491 9.7289 9.7289 9.9644 9.9644 10.3309 10.3309 10.7323 10.7323 12.6122 12.6122 13.3741 13.3741 13.8543 13.8543 13.9778 13.9778 k = 0.0000 0.0116 0.2250 ( 4232 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7063 -24.7063 -16.9900 -16.9900 -16.9790 -16.9790 -16.9711 -16.9711 -16.9692 -16.9692 -3.0537 -3.0537 -1.6247 -1.6247 0.2246 0.2246 5.8261 5.8261 8.1680 8.1680 8.4520 8.4520 8.5225 8.5225 8.9737 8.9737 9.0124 9.0124 9.6547 9.6547 9.7347 9.7347 9.9692 9.9692 10.3287 10.3287 10.7286 10.7286 12.6196 12.6196 13.3711 13.3711 13.8563 13.8563 13.9362 13.9362 k = 0.0000 0.0233 0.2250 ( 4244 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7079 -24.7079 -24.7064 -24.7064 -16.9901 -16.9901 -16.9791 -16.9791 -16.9714 -16.9714 -16.9696 -16.9696 -3.0504 -3.0504 -1.6222 -1.6222 0.2273 0.2273 5.8300 5.8300 8.1424 8.1424 8.4046 8.4046 8.4897 8.4897 8.9766 8.9766 9.0469 9.0469 9.6679 9.6679 9.7531 9.7531 9.9834 9.9834 10.3226 10.3226 10.7179 10.7179 12.6417 12.6417 13.3622 13.3622 13.8530 13.8530 13.8937 13.8937 k = 0.0000 0.0349 0.2250 ( 4248 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7080 -24.7080 -24.7066 -24.7066 -16.9902 -16.9902 -16.9792 -16.9792 -16.9719 -16.9719 -16.9700 -16.9700 -3.0450 -3.0450 -1.6180 -1.6180 0.2318 0.2318 5.8365 5.8365 8.0970 8.0970 8.3309 8.3309 8.4526 8.4526 8.9688 8.9688 9.1034 9.1034 9.6826 9.6826 9.7829 9.7829 10.0070 10.0070 10.3144 10.3144 10.7018 10.7018 12.6773 12.6773 13.3471 13.3471 13.8111 13.8111 13.8938 13.8938 k = 0.0000 0.0465 0.2250 ( 4244 PWs) bands (ev): -50.4027 -50.4027 -50.4026 -50.4026 -24.7082 -24.7082 -24.7066 -24.7066 -16.9904 -16.9904 -16.9794 -16.9794 -16.9725 -16.9725 -16.9705 -16.9705 -3.0374 -3.0374 -1.6123 -1.6123 0.2382 0.2382 5.8456 5.8456 8.0315 8.0315 8.2351 8.2351 8.4215 8.4215 8.9568 8.9568 9.1664 9.1664 9.6967 9.6967 9.8173 9.8173 10.0400 10.0400 10.3064 10.3064 10.6827 10.6827 12.7251 12.7251 13.3260 13.3260 13.7559 13.7559 13.9098 13.9098 k = 0.0000 0.0581 0.2250 ( 4240 PWs) bands (ev): -50.4027 -50.4027 -50.4026 -50.4026 -24.7083 -24.7083 -24.7068 -24.7068 -16.9906 -16.9906 -16.9797 -16.9797 -16.9731 -16.9731 -16.9710 -16.9710 -3.0276 -3.0276 -1.6049 -1.6049 0.2464 0.2464 5.8571 5.8571 7.9491 7.9491 8.1221 8.1221 8.3991 8.3991 8.9420 8.9420 9.2292 9.2292 9.7109 9.7109 9.8471 9.8471 10.0819 10.0819 10.3012 10.3012 10.6644 10.6644 12.7832 12.7832 13.2988 13.2988 13.7002 13.7002 13.9246 13.9246 k = 0.0000 0.0698 0.2250 ( 4236 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7085 -24.7085 -24.7069 -24.7069 -16.9910 -16.9910 -16.9801 -16.9801 -16.9739 -16.9739 -16.9716 -16.9716 -3.0157 -3.0157 -1.5961 -1.5961 0.2564 0.2564 5.8711 5.8711 7.8548 7.8548 7.9961 7.9961 8.3836 8.3836 8.9237 8.9237 9.2884 9.2884 9.7259 9.7259 9.8651 9.8651 10.1320 10.1320 10.2993 10.2993 10.6522 10.6522 12.8496 12.8496 13.2656 13.2656 13.6457 13.6457 13.9281 13.9281 k = 0.0000 0.0814 0.2250 ( 4224 PWs) bands (ev): -50.4026 -50.4026 -50.4025 -50.4025 -24.7087 -24.7087 -24.7071 -24.7071 -16.9915 -16.9915 -16.9808 -16.9808 -16.9746 -16.9746 -16.9721 -16.9721 -3.0016 -3.0016 -1.5858 -1.5858 0.2683 0.2683 5.8875 5.8875 7.7528 7.7528 7.8604 7.8604 8.3727 8.3727 8.9011 8.9011 9.3428 9.3428 9.7416 9.7416 9.8692 9.8692 10.1882 10.1882 10.2980 10.2980 10.6529 10.6529 12.9221 12.9221 13.2273 13.2273 13.5933 13.5933 13.9143 13.9143 k = 0.0000 0.0930 0.2250 ( 4226 PWs) bands (ev): -50.4026 -50.4026 -50.4024 -50.4024 -24.7090 -24.7090 -24.7074 -24.7074 -16.9922 -16.9922 -16.9819 -16.9819 -16.9753 -16.9753 -16.9724 -16.9724 -2.9855 -2.9855 -1.5742 -1.5742 0.2821 0.2821 5.9061 5.9061 7.6455 7.6455 7.7182 7.7182 8.3647 8.3647 8.8730 8.8730 9.3916 9.3916 9.7569 9.7569 9.8628 9.8628 10.2404 10.2404 10.3000 10.3000 10.6718 10.6718 12.9969 12.9969 13.1862 13.1862 13.5433 13.5433 13.8867 13.8867 k = 0.0000 0.1047 0.2250 ( 4230 PWs) bands (ev): -50.4025 -50.4025 -50.4024 -50.4024 -24.7093 -24.7093 -24.7078 -24.7078 -16.9932 -16.9932 -16.9834 -16.9834 -16.9760 -16.9760 -16.9727 -16.9727 -2.9674 -2.9674 -1.5613 -1.5613 0.2978 0.2978 5.9268 5.9268 7.5329 7.5329 7.5735 7.5735 8.3584 8.3584 8.8381 8.8381 9.4351 9.4351 9.7687 9.7687 9.8536 9.8536 10.2463 10.2463 10.3425 10.3425 10.7098 10.7098 13.0590 13.0590 13.1564 13.1564 13.4961 13.4961 13.8517 13.8517 k = 0.0000 0.1163 0.2250 ( 4228 PWs) bands (ev): -50.4024 -50.4024 -50.4023 -50.4023 -24.7096 -24.7096 -24.7081 -24.7081 -16.9945 -16.9945 -16.9851 -16.9851 -16.9764 -16.9764 -16.9727 -16.9727 -2.9471 -2.9471 -1.5473 -1.5473 0.3154 0.3154 5.9494 5.9494 7.4036 7.4036 7.4408 7.4408 8.3531 8.3531 8.7955 8.7955 9.4734 9.4734 9.7711 9.7711 9.8517 9.8517 10.2199 10.2199 10.4117 10.4117 10.7632 10.7632 13.0520 13.0520 13.1936 13.1936 13.4525 13.4525 13.8137 13.8137 k = 0.0000 0.1279 0.2250 ( 4228 PWs) bands (ev): -50.4024 -50.4024 -50.4022 -50.4022 -24.7100 -24.7100 -24.7085 -24.7085 -16.9961 -16.9961 -16.9872 -16.9872 -16.9767 -16.9767 -16.9727 -16.9727 -2.9249 -2.9249 -1.5323 -1.5323 0.3350 0.3350 5.9733 5.9733 7.2542 7.2542 7.3257 7.3257 8.3484 8.3484 8.7446 8.7446 9.5069 9.5069 9.7628 9.7628 9.8612 9.8612 10.1849 10.1849 10.4862 10.4862 10.8273 10.8273 13.0037 13.0037 13.2668 13.2668 13.4153 13.4153 13.7750 13.7750 k = 0.0000 0.1395 0.2250 ( 4228 PWs) bands (ev): -50.4023 -50.4023 -50.4022 -50.4022 -24.7104 -24.7104 -24.7089 -24.7089 -16.9980 -16.9980 -16.9895 -16.9895 -16.9769 -16.9769 -16.9725 -16.9725 -2.9008 -2.9008 -1.5164 -1.5164 0.3566 0.3566 5.9980 5.9980 7.1002 7.1002 7.2154 7.2154 8.3438 8.3438 8.6852 8.6852 9.5355 9.5355 9.7504 9.7504 9.8757 9.8757 10.1491 10.1491 10.5617 10.5617 10.8983 10.8983 12.9486 12.9486 13.3205 13.3205 13.4065 13.4065 13.7372 13.7372 k = 0.0000 0.1512 0.2250 ( 4220 PWs) bands (ev): -50.4022 -50.4022 -50.4021 -50.4021 -24.7107 -24.7107 -24.7093 -24.7093 -17.0001 -17.0001 -16.9920 -16.9920 -16.9769 -16.9769 -16.9722 -16.9722 -2.8747 -2.8747 -1.4998 -1.4998 0.3803 0.3803 6.0222 6.0222 6.9464 6.9464 7.1073 7.1073 8.3389 8.3389 8.6177 8.6177 9.5590 9.5590 9.7394 9.7394 9.8871 9.8871 10.1195 10.1195 10.6363 10.6363 10.9738 10.9738 12.8925 12.8925 13.3092 13.3092 13.4659 13.4659 13.7015 13.7015 k = 0.0000 0.1628 0.2250 ( 4224 PWs) bands (ev): -50.4022 -50.4022 -50.4020 -50.4020 -24.7112 -24.7112 -24.7097 -24.7097 -17.0025 -17.0025 -16.9947 -16.9947 -16.9768 -16.9768 -16.9719 -16.9719 -2.8468 -2.8468 -1.4827 -1.4827 0.4061 0.4061 6.0436 6.0436 6.7962 6.7962 7.0014 7.0014 8.3327 8.3327 8.5438 8.5438 9.5768 9.5768 9.7322 9.7322 9.8873 9.8873 10.1046 10.1046 10.7084 10.7084 11.0523 11.0523 12.8380 12.8380 13.2789 13.2789 13.5444 13.5444 13.6699 13.6699 k = 0.0000 0.1744 0.2250 ( 4232 PWs) bands (ev): -50.4021 -50.4021 -50.4020 -50.4020 -24.7117 -24.7117 -24.7102 -24.7102 -17.0052 -17.0052 -16.9977 -16.9977 -16.9766 -16.9766 -16.9715 -16.9715 -2.8171 -2.8171 -1.4652 -1.4652 0.4341 0.4341 6.0573 6.0573 6.6552 6.6552 6.8980 6.8980 8.3224 8.3224 8.4670 8.4670 9.5877 9.5877 9.7291 9.7291 9.8727 9.8727 10.1099 10.1099 10.7768 10.7768 11.1330 11.1330 12.7870 12.7870 13.2478 13.2478 13.6040 13.6040 13.6619 13.6619 k = 0.0000 0.1860 0.2250 ( 4240 PWs) bands (ev): -50.4020 -50.4020 -50.4019 -50.4019 -24.7123 -24.7123 -24.7107 -24.7107 -17.0080 -17.0080 -17.0007 -17.0007 -16.9762 -16.9762 -16.9711 -16.9711 -2.7856 -2.7856 -1.4475 -1.4475 0.4643 0.4643 6.0526 6.0526 6.5344 6.5344 6.7975 6.7975 8.2972 8.2972 8.3991 8.3991 9.5899 9.5899 9.7296 9.7296 9.8483 9.8483 10.1328 10.1328 10.8401 10.8401 11.2154 11.2154 12.7414 12.7414 13.2185 13.2185 13.5935 13.5935 13.7260 13.7260 k = 0.0000 0.1977 0.2250 ( 4244 PWs) bands (ev): -50.4019 -50.4019 -50.4018 -50.4018 -24.7128 -24.7128 -24.7113 -24.7113 -17.0110 -17.0110 -17.0039 -17.0039 -16.9758 -16.9758 -16.9707 -16.9707 -2.7524 -2.7524 -1.4299 -1.4299 0.4969 0.4969 6.0117 6.0117 6.4520 6.4520 6.7002 6.7002 8.2356 8.2356 8.3629 8.3629 9.5809 9.5809 9.7325 9.7325 9.8232 9.8232 10.1673 10.1673 10.8972 10.8972 11.2990 11.2990 12.7028 12.7028 13.1917 13.1917 13.5695 13.5695 13.8049 13.8049 k = 0.0000 0.2093 0.2250 ( 4244 PWs) bands (ev): -50.4018 -50.4018 -50.4017 -50.4017 -24.7132 -24.7132 -24.7118 -24.7118 -17.0140 -17.0140 -17.0071 -17.0071 -16.9753 -16.9753 -16.9702 -16.9702 -2.7176 -2.7176 -1.4126 -1.4126 0.5318 0.5318 5.9235 5.9235 6.4191 6.4191 6.6067 6.6067 8.1473 8.1473 8.3496 8.3496 9.5594 9.5594 9.7351 9.7351 9.8051 9.8051 10.2094 10.2094 10.9472 10.9472 11.3839 11.3839 12.6725 12.6725 13.1675 13.1675 13.5471 13.5471 13.8832 13.8832 k = 0.0000 0.2209 0.2250 ( 4240 PWs) bands (ev): -50.4017 -50.4017 -50.4016 -50.4016 -24.7137 -24.7137 -24.7123 -24.7123 -17.0171 -17.0171 -17.0104 -17.0104 -16.9747 -16.9747 -16.9697 -16.9697 -2.6813 -2.6813 -1.3958 -1.3958 0.5692 0.5692 5.7999 5.7999 6.4230 6.4230 6.5184 6.5184 8.0493 8.0493 8.3433 8.3433 9.5259 9.5259 9.7330 9.7330 9.7991 9.7991 10.2569 10.2569 10.9893 10.9893 11.4699 11.4699 12.6519 12.6519 13.1461 13.1461 13.5283 13.5283 13.9592 13.9592 k = 0.0000 0.2326 0.2250 ( 4240 PWs) bands (ev): -50.4016 -50.4016 -50.4015 -50.4015 -24.7142 -24.7142 -24.7128 -24.7128 -17.0203 -17.0203 -17.0138 -17.0138 -16.9742 -16.9742 -16.9692 -16.9692 -2.6434 -2.6434 -1.3797 -1.3797 0.6093 0.6093 5.6579 5.6579 6.4184 6.4184 6.4639 6.4639 7.9470 7.9470 8.3395 8.3395 9.4834 9.4834 9.7235 9.7235 9.8054 9.8054 10.3087 10.3087 11.0231 11.0231 11.5570 11.5570 12.6415 12.6415 13.1274 13.1274 13.5140 13.5140 14.0321 14.0321 k = 0.0000 0.2442 0.2250 ( 4244 PWs) bands (ev): -50.4015 -50.4015 -50.4014 -50.4014 -24.7148 -24.7148 -24.7134 -24.7134 -17.0235 -17.0235 -17.0172 -17.0172 -16.9736 -16.9736 -16.9687 -16.9687 -2.6042 -2.6042 -1.3646 -1.3646 0.6519 0.6519 5.5073 5.5073 6.3439 6.3439 6.4952 6.4952 7.8424 7.8424 8.3369 8.3369 9.4349 9.4349 9.7075 9.7075 9.8200 9.8200 10.3641 10.3641 11.0485 11.0485 11.6452 11.6452 12.6415 12.6415 13.1114 13.1114 13.5050 13.5050 14.1014 14.1014 k = 0.0000 0.2558 0.2250 ( 4236 PWs) bands (ev): -50.4014 -50.4014 -50.4013 -50.4013 -24.7153 -24.7153 -24.7139 -24.7139 -17.0268 -17.0268 -17.0205 -17.0205 -16.9730 -16.9730 -16.9681 -16.9681 -2.5636 -2.5636 -1.3508 -1.3508 0.6974 0.6974 5.3527 5.3527 6.2674 6.2674 6.5401 6.5401 7.7367 7.7367 8.3351 8.3351 9.3831 9.3831 9.6855 9.6855 9.8394 9.8394 10.4227 10.4227 11.0659 11.0659 11.7344 11.7344 12.6515 12.6515 13.0979 13.0979 13.5020 13.5020 14.1668 14.1668 k = 0.0000 0.2674 0.2250 ( 4240 PWs) bands (ev): -50.4013 -50.4013 -50.4013 -50.4013 -24.7158 -24.7158 -24.7144 -24.7144 -17.0300 -17.0300 -17.0240 -17.0240 -16.9723 -16.9723 -16.9676 -16.9676 -2.5218 -2.5218 -1.3384 -1.3384 0.7456 0.7456 5.1965 5.1965 6.1951 6.1951 6.5904 6.5904 7.6309 7.6309 8.3341 8.3341 9.3296 9.3296 9.6574 9.6574 9.8621 9.8621 10.4842 10.4842 11.0759 11.0759 11.8246 11.8246 12.6705 12.6705 13.0866 13.0866 13.5059 13.5059 14.2280 14.2280 k = 0.0000 0.2791 0.2250 ( 4244 PWs) bands (ev): -50.4013 -50.4013 -50.4012 -50.4012 -24.7164 -24.7164 -24.7150 -24.7150 -17.0332 -17.0332 -17.0274 -17.0274 -16.9717 -16.9717 -16.9671 -16.9671 -2.4788 -2.4788 -1.3277 -1.3277 0.7969 0.7969 5.0399 5.0399 6.1276 6.1276 6.6445 6.6445 7.5256 7.5256 8.3336 8.3336 9.2754 9.2754 9.6229 9.6229 9.8872 9.8872 10.5483 10.5483 11.0796 11.0796 11.9157 11.9157 12.6971 12.6971 13.0773 13.0773 13.5174 13.5174 14.2849 14.2849 k = 0.0000 0.2907 0.2250 ( 4244 PWs) bands (ev): -50.4012 -50.4012 -50.4011 -50.4011 -24.7169 -24.7169 -24.7155 -24.7155 -17.0364 -17.0364 -17.0307 -17.0307 -16.9710 -16.9710 -16.9666 -16.9666 -2.4349 -2.4349 -1.3189 -1.3189 0.8512 0.8512 4.8837 4.8837 6.0652 6.0652 6.7011 6.7011 7.4218 7.4218 8.3338 8.3338 9.2212 9.2212 9.5818 9.5818 9.9142 9.9142 10.6147 10.6147 11.0780 11.0780 12.0076 12.0076 12.7297 12.7297 13.0697 13.0697 13.5372 13.5372 14.3376 14.3376 k = 0.0000 0.3023 0.2250 ( 4240 PWs) bands (ev): -50.4011 -50.4011 -50.4010 -50.4010 -24.7173 -24.7173 -24.7161 -24.7161 -17.0395 -17.0395 -17.0340 -17.0340 -16.9703 -16.9703 -16.9661 -16.9661 -2.3899 -2.3899 -1.3122 -1.3122 0.9085 0.9085 4.7283 4.7283 6.0081 6.0081 6.7590 6.7590 7.3206 7.3206 8.3347 8.3347 9.1674 9.1674 9.5343 9.5343 9.9428 9.9428 10.6830 10.6830 11.0724 11.0724 12.1001 12.1001 12.7666 12.7666 13.0634 13.0634 13.5658 13.5658 14.3857 14.3857 k = 0.0000 0.3140 0.2250 ( 4238 PWs) bands (ev): -50.4010 -50.4010 -50.4009 -50.4009 -24.7178 -24.7178 -24.7165 -24.7165 -17.0425 -17.0425 -17.0372 -17.0372 -16.9696 -16.9696 -16.9656 -16.9656 -2.3442 -2.3442 -1.3079 -1.3079 0.9691 0.9691 4.5741 4.5741 5.9565 5.9565 6.8161 6.8161 7.2242 7.2242 8.3363 8.3363 9.1144 9.1144 9.4805 9.4805 9.9728 9.9728 10.7524 10.7524 11.0642 11.0642 12.1929 12.1929 12.8059 12.8059 13.0578 13.0578 13.6033 13.6033 14.4275 14.4275 k = 0.0000 0.3256 0.2250 ( 4240 PWs) bands (ev): -50.4009 -50.4009 -50.4008 -50.4008 -24.7183 -24.7183 -24.7170 -24.7170 -17.0454 -17.0454 -17.0404 -17.0404 -16.9690 -16.9690 -16.9651 -16.9651 -2.2977 -2.2977 -1.3060 -1.3060 1.0330 1.0330 4.4214 4.4214 5.9106 5.9106 6.8662 6.8662 7.1391 7.1391 8.3387 8.3387 9.0625 9.0625 9.4209 9.4209 10.0040 10.0040 10.8207 10.8207 11.0560 11.0560 12.2859 12.2859 12.8459 12.8459 13.0528 13.0528 13.6497 13.6497 14.4450 14.4450 k = 0.0000 0.3372 0.2250 ( 4242 PWs) bands (ev): -50.4008 -50.4008 -50.4008 -50.4008 -24.7187 -24.7187 -24.7175 -24.7175 -17.0482 -17.0482 -17.0435 -17.0435 -16.9684 -16.9684 -16.9647 -16.9647 -2.2506 -2.2506 -1.3068 -1.3068 1.1002 1.1002 4.2703 4.2703 5.8705 5.8705 6.8873 6.8873 7.0873 7.0873 8.3420 8.3420 9.0116 9.0116 9.3561 9.3561 10.0363 10.0363 10.8823 10.8823 11.0538 11.0538 12.3785 12.3785 12.8846 12.8846 13.0482 13.0482 13.7045 13.7045 14.4027 14.4027 k = 0.0000 0.3488 0.2250 ( 4236 PWs) bands (ev): -50.4007 -50.4007 -50.4007 -50.4007 -24.7191 -24.7191 -24.7180 -24.7180 -17.0508 -17.0508 -17.0463 -17.0463 -16.9677 -16.9677 -16.9643 -16.9643 -2.2031 -2.2031 -1.3103 -1.3103 1.1707 1.1707 4.1210 4.1210 5.8363 5.8363 6.8485 6.8485 7.0998 7.0998 8.3463 8.3463 8.9620 8.9620 9.2868 9.2868 10.0694 10.0694 10.9224 10.9224 11.0727 11.0727 12.4703 12.4703 12.9185 12.9185 13.0457 13.0457 13.7665 13.7665 14.3457 14.3457 k = 0.0000 0.3605 0.2250 ( 4236 PWs) bands (ev): -50.4006 -50.4006 -50.4006 -50.4006 -24.7195 -24.7195 -24.7185 -24.7185 -17.0533 -17.0533 -17.0491 -17.0491 -16.9671 -16.9671 -16.9639 -16.9639 -2.1552 -2.1552 -1.3166 -1.3166 1.2446 1.2446 3.9737 3.9737 5.8081 5.8081 6.7739 6.7739 7.1528 7.1528 8.3516 8.3516 8.9135 8.9135 9.2136 9.2136 10.1034 10.1034 10.9295 10.9295 11.1244 11.1244 12.5607 12.5607 12.9406 12.9406 13.0505 13.0505 13.8337 13.8337 14.2925 14.2925 k = 0.0000 0.3721 0.2250 ( 4240 PWs) bands (ev): -50.4006 -50.4006 -50.4005 -50.4005 -24.7199 -24.7199 -24.7188 -24.7188 -17.0557 -17.0557 -17.0517 -17.0517 -16.9665 -16.9665 -16.9636 -16.9636 -2.1071 -2.1071 -1.3259 -1.3259 1.3220 1.3220 3.8285 3.8285 5.7859 5.7859 6.6902 6.6902 7.2196 7.2196 8.3580 8.3580 8.8661 8.8661 9.1373 9.1373 10.1381 10.1381 10.9162 10.9162 11.1963 11.1963 12.6487 12.6487 12.9430 12.9430 13.0688 13.0688 13.9026 13.9026 14.2501 14.2501 k = 0.0000 0.3837 0.2250 ( 4244 PWs) bands (ev): -50.4005 -50.4005 -50.4005 -50.4005 -24.7203 -24.7203 -24.7193 -24.7193 -17.0579 -17.0579 -17.0542 -17.0542 -16.9660 -16.9660 -16.9633 -16.9633 -2.0590 -2.0590 -1.3380 -1.3380 1.4027 1.4027 3.6855 3.6855 5.7698 5.7698 6.6054 6.6054 7.2923 7.2923 8.3655 8.3655 8.8195 8.8195 9.0590 9.0590 10.1735 10.1735 10.8940 10.8940 11.2772 11.2772 12.7327 12.7327 12.9276 12.9276 13.0981 13.0981 13.9661 13.9661 14.2265 14.2265 k = 0.0000 0.3953 0.2250 ( 4244 PWs) bands (ev): -50.4004 -50.4004 -50.4004 -50.4004 -24.7205 -24.7205 -24.7197 -24.7197 -17.0598 -17.0598 -17.0566 -17.0566 -16.9654 -16.9654 -16.9630 -16.9630 -2.0110 -2.0110 -1.3531 -1.3531 1.4869 1.4869 3.5447 3.5447 5.7598 5.7598 6.5221 6.5221 7.3686 7.3686 8.3744 8.3744 8.7731 8.7731 8.9796 8.9796 10.2095 10.2095 10.8671 10.8671 11.3627 11.3627 12.8056 12.8056 12.9055 12.9055 13.1319 13.1319 14.0117 14.0117 14.2349 14.2349 k = 0.0000 0.4070 0.2250 ( 4256 PWs) bands (ev): -50.4004 -50.4004 -50.4004 -50.4004 -24.7208 -24.7208 -24.7202 -24.7202 -17.0617 -17.0617 -17.0588 -17.0588 -16.9649 -16.9649 -16.9628 -16.9628 -1.9632 -1.9632 -1.3712 -1.3712 1.5745 1.5745 3.4063 3.4063 5.7559 5.7559 6.4413 6.4413 7.4474 7.4474 8.3846 8.3846 8.7257 8.7257 8.9010 8.9010 10.2460 10.2460 10.8373 10.8373 11.4512 11.4512 12.8225 12.8225 12.9236 12.9236 13.1662 13.1662 14.0329 14.0329 14.2815 14.2815 k = 0.0000 0.4186 0.2250 ( 4250 PWs) bands (ev): -50.4004 -50.4004 -50.4003 -50.4003 -24.7210 -24.7210 -24.7205 -24.7205 -17.0632 -17.0632 -17.0606 -17.0606 -16.9644 -16.9644 -16.9626 -16.9626 -1.9158 -1.9158 -1.3921 -1.3921 1.6655 1.6655 3.2705 3.2705 5.7580 5.7580 6.3638 6.3638 7.5283 7.5283 8.3962 8.3962 8.6750 8.6750 8.8260 8.8260 10.2830 10.2830 10.8053 10.8053 11.5421 11.5421 12.7785 12.7785 12.9872 12.9872 13.1991 13.1991 14.0417 14.0417 14.3533 14.3533 k = 0.0000 0.4302 0.2250 ( 4246 PWs) bands (ev): -50.4003 -50.4003 -50.4003 -50.4003 -24.7212 -24.7212 -24.7207 -24.7207 -17.0645 -17.0645 -17.0623 -17.0623 -16.9640 -16.9640 -16.9624 -16.9624 -1.8690 -1.8690 -1.4157 -1.4157 1.7599 1.7599 3.1371 3.1371 5.7662 5.7662 6.2898 6.2898 7.6109 7.6109 8.4094 8.4094 8.6174 8.6174 8.7584 8.7584 10.3204 10.3204 10.7717 10.7717 11.6349 11.6349 12.7170 12.7170 13.0530 13.0530 13.2293 13.2293 14.0507 14.0507 14.4358 14.4358 k = 0.0000 0.4419 0.2250 ( 4250 PWs) bands (ev): -50.4003 -50.4003 -50.4002 -50.4002 -24.7214 -24.7214 -24.7210 -24.7210 -17.0657 -17.0657 -17.0638 -17.0638 -16.9637 -16.9637 -16.9623 -16.9623 -1.8229 -1.8229 -1.4421 -1.4421 1.8576 1.8576 3.0063 3.0063 5.7802 5.7802 6.2196 6.2196 7.6950 7.6950 8.4241 8.4241 8.5501 8.5501 8.7016 8.7016 10.3582 10.3582 10.7367 10.7367 11.7290 11.7290 12.6457 12.6457 13.1136 13.1136 13.2555 13.2555 14.0653 14.0653 14.5006 14.5006 k = 0.0000 0.4535 0.2250 ( 4242 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7215 -24.7215 -24.7212 -24.7212 -17.0665 -17.0665 -17.0650 -17.0650 -16.9633 -16.9633 -16.9622 -16.9622 -1.7778 -1.7778 -1.4711 -1.4711 1.9586 1.9586 2.8783 2.8783 5.8002 5.8002 6.1537 6.1537 7.7803 7.7803 8.4404 8.4404 8.4738 8.4738 8.6553 8.6553 10.3963 10.3963 10.7006 10.7006 11.8243 11.8243 12.5670 12.5670 13.1670 13.1670 13.2768 13.2768 14.0869 14.0869 14.4447 14.4447 k = 0.0000 0.4651 0.2250 ( 4254 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7214 -24.7214 -17.0672 -17.0672 -17.0661 -17.0661 -16.9630 -16.9630 -16.9622 -16.9622 -1.7337 -1.7337 -1.5025 -1.5025 2.0628 2.0628 2.7530 2.7530 5.8258 5.8258 6.0921 6.0921 7.8668 7.8668 8.3911 8.3911 8.4590 8.4590 8.6165 8.6165 10.4346 10.4346 10.6637 10.6637 11.9203 11.9203 12.4827 12.4827 13.2121 13.2121 13.2920 13.2920 14.1154 14.1154 14.3893 14.3893 k = 0.0000 0.4767 0.2250 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7216 -24.7216 -17.0676 -17.0676 -17.0669 -17.0669 -16.9628 -16.9628 -16.9622 -16.9622 -1.6909 -1.6909 -1.5362 -1.5362 2.1702 2.1702 2.6305 2.6305 5.8570 5.8570 6.0351 6.0351 7.9540 7.9540 8.3055 8.3055 8.4791 8.4791 8.5828 8.5828 10.4730 10.4730 10.6262 10.6262 12.0166 12.0166 12.3940 12.3940 13.2483 13.2483 13.3003 13.3003 14.1502 14.1502 14.3355 14.3355 k = 0.0000 0.4884 0.2250 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7216 -24.7216 -17.0678 -17.0678 -17.0674 -17.0674 -16.9626 -16.9626 -16.9623 -16.9623 -1.6496 -1.6496 -1.5721 -1.5721 2.2807 2.2807 2.5109 2.5109 5.8937 5.8937 5.9830 5.9830 8.0419 8.0419 8.2181 8.2181 8.5014 8.5014 8.5528 8.5528 10.5115 10.5115 10.5882 10.5882 12.1127 12.1127 12.3022 12.3022 13.2750 13.2750 13.3007 13.3007 14.1905 14.1905 14.2839 14.2839 k = 0.0000 0.5000 0.2250 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6100 -1.6100 -1.6100 -1.6100 2.3943 2.3943 2.3943 2.3943 5.9358 5.9358 5.9358 5.9358 8.1301 8.1301 8.1301 8.1301 8.5258 8.5258 8.5258 8.5258 10.5500 10.5500 10.5500 10.5500 12.2082 12.2082 12.2082 12.2082 13.2924 13.2924 13.2924 13.2924 14.2353 14.2353 14.2353 14.2353 k = 0.0000 0.5000 0.2250 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6100 -1.6100 -1.6100 -1.6100 2.3943 2.3943 2.3943 2.3943 5.9358 5.9358 5.9358 5.9358 8.1301 8.1301 8.1301 8.1301 8.5258 8.5258 8.5258 8.5258 10.5500 10.5500 10.5500 10.5500 12.2082 12.2082 12.2082 12.2082 13.2924 13.2924 13.2924 13.2924 14.2353 14.2353 14.2353 14.2353 k = 0.0116 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0678 -17.0678 -17.0677 -17.0677 -16.9626 -16.9626 -16.9624 -16.9624 -1.6098 -1.6098 -1.6097 -1.6097 2.3947 2.3947 2.3967 2.3967 5.9343 5.9343 5.9384 5.9384 8.1179 8.1179 8.1395 8.1395 8.5135 8.5135 8.5389 8.5389 10.5456 10.5456 10.5482 10.5482 12.1884 12.1884 12.1918 12.1918 13.2981 13.2981 13.3130 13.3130 14.2229 14.2229 14.2368 14.2368 k = 0.0233 0.5000 0.2250 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7218 -24.7218 -24.7218 -24.7218 -17.0678 -17.0678 -17.0677 -17.0677 -16.9629 -16.9629 -16.9626 -16.9626 -1.6092 -1.6092 -1.6090 -1.6090 2.3980 2.3980 2.4020 2.4020 5.9339 5.9339 5.9422 5.9422 8.1034 8.1034 8.1456 8.1456 8.5023 8.5023 8.5521 8.5521 10.5351 10.5351 10.5405 10.5405 12.1365 12.1365 12.1410 12.1410 13.3284 13.3284 13.3547 13.3547 14.2021 14.2021 14.2280 14.2280 k = 0.0349 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7219 -24.7219 -24.7218 -24.7218 -17.0678 -17.0678 -17.0676 -17.0676 -16.9634 -16.9634 -16.9629 -16.9629 -1.6081 -1.6081 -1.6078 -1.6078 2.4040 2.4040 2.4100 2.4100 5.9346 5.9346 5.9469 5.9469 8.0871 8.0871 8.1482 8.1482 8.4928 8.4928 8.5651 8.5651 10.5181 10.5181 10.5269 10.5269 12.0596 12.0596 12.0621 12.0621 13.3767 13.3767 13.4086 13.4086 14.1783 14.1783 14.2123 14.2123 k = 0.0465 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7220 -24.7220 -24.7219 -24.7219 -17.0678 -17.0678 -17.0675 -17.0675 -16.9641 -16.9641 -16.9634 -16.9634 -1.6067 -1.6067 -1.6062 -1.6062 2.4129 2.4129 2.4209 2.4209 5.9364 5.9364 5.9526 5.9526 8.0695 8.0695 8.1470 8.1470 8.4851 8.4851 8.5775 8.5775 10.4946 10.4946 10.5072 10.5072 11.9626 11.9626 11.9650 11.9650 13.4344 13.4344 13.4642 13.4642 14.1590 14.1590 14.1949 14.1949 k = 0.0581 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7222 -24.7222 -24.7220 -24.7220 -17.0678 -17.0678 -17.0675 -17.0675 -16.9649 -16.9649 -16.9640 -16.9640 -1.6048 -1.6048 -1.6042 -1.6042 2.4246 2.4246 2.4346 2.4346 5.9392 5.9392 5.9592 5.9592 8.0511 8.0511 8.1420 8.1420 8.4794 8.4794 8.5889 8.5889 10.4642 10.4642 10.4815 10.4815 11.8488 11.8488 11.8585 11.8585 13.4931 13.4931 13.5117 13.5117 14.1524 14.1524 14.1817 14.1817 k = 0.0698 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7224 -24.7224 -24.7222 -24.7222 -17.0678 -17.0678 -17.0674 -17.0674 -16.9659 -16.9659 -16.9649 -16.9649 -1.6025 -1.6025 -1.6018 -1.6018 2.4391 2.4391 2.4510 2.4510 5.9428 5.9428 5.9663 5.9663 8.0324 8.0324 8.1336 8.1336 8.4756 8.4756 8.5991 8.5991 10.4266 10.4266 10.4495 10.4495 11.7257 11.7257 11.7446 11.7446 13.5434 13.5434 13.5454 13.5454 14.1654 14.1654 14.1789 14.1789 k = 0.0814 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4000 -50.4000 -50.4000 -50.4000 -24.7226 -24.7226 -24.7224 -24.7224 -17.0678 -17.0678 -17.0673 -17.0673 -16.9670 -16.9670 -16.9658 -16.9658 -1.5997 -1.5997 -1.5990 -1.5990 2.4564 2.4564 2.4702 2.4702 5.9470 5.9470 5.9739 5.9739 8.0137 8.0137 8.1224 8.1224 8.4733 8.4733 8.6079 8.6079 10.3814 10.3814 10.4111 10.4111 11.5970 11.5970 11.6266 11.6266 13.5566 13.5566 13.5857 13.5857 14.1912 14.1912 14.2003 14.2003 k = 0.0930 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.4000 -50.4000 -50.4000 -50.4000 -24.7229 -24.7229 -24.7226 -24.7226 -17.0678 -17.0678 -17.0673 -17.0673 -16.9683 -16.9683 -16.9669 -16.9669 -1.5966 -1.5966 -1.5958 -1.5958 2.4765 2.4765 2.4922 2.4922 5.9518 5.9518 5.9817 5.9817 7.9955 7.9955 8.1091 8.1091 8.4720 8.4720 8.6150 8.6150 10.3282 10.3282 10.3660 10.3660 11.4657 11.4657 11.5071 11.5071 13.5542 13.5542 13.6113 13.6113 14.2208 14.2208 14.2540 14.2540 k = 0.1047 0.5000 0.2250 ( 4248 PWs) bands (ev): -50.3999 -50.3999 -50.3999 -50.3999 -24.7231 -24.7231 -24.7229 -24.7229 -17.0678 -17.0678 -17.0672 -17.0672 -16.9696 -16.9696 -16.9681 -16.9681 -1.5931 -1.5931 -1.5923 -1.5923 2.4993 2.4993 2.5169 2.5169 5.9568 5.9568 5.9894 5.9894 7.9783 7.9783 8.0943 8.0943 8.4712 8.4712 8.6202 8.6202 10.2669 10.2669 10.3137 10.3137 11.3342 11.3342 11.3883 11.3883 13.5421 13.5421 13.6237 13.6237 14.2656 14.2656 14.3204 14.3204 k = 0.1163 0.5000 0.2250 ( 4248 PWs) bands (ev): -50.3999 -50.3999 -50.3999 -50.3999 -24.7235 -24.7235 -24.7231 -24.7231 -17.0678 -17.0678 -17.0672 -17.0672 -16.9710 -16.9710 -16.9694 -16.9694 -1.5893 -1.5893 -1.5883 -1.5883 2.5249 2.5249 2.5443 2.5443 5.9620 5.9620 5.9969 5.9969 7.9625 7.9625 8.0789 8.0789 8.4703 8.4703 8.6232 8.6232 10.1971 10.1971 10.2539 10.2539 11.2047 11.2047 11.2721 11.2721 13.5256 13.5256 13.6267 13.6267 14.3210 14.3210 14.3935 14.3935 k = 0.1279 0.5000 0.2250 ( 4256 PWs) bands (ev): -50.3998 -50.3998 -50.3998 -50.3998 -24.7238 -24.7238 -24.7235 -24.7235 -17.0679 -17.0679 -17.0672 -17.0672 -16.9726 -16.9726 -16.9709 -16.9709 -1.5851 -1.5851 -1.5841 -1.5841 2.5533 2.5533 2.5744 2.5744 5.9670 5.9670 6.0037 6.0037 7.9484 7.9484 8.0636 8.0636 8.4687 8.4687 8.6239 8.6239 10.1190 10.1190 10.1862 10.1862 11.0792 11.0792 11.1598 11.1598 13.5088 13.5088 13.6248 13.6248 14.3818 14.3818 14.4689 14.4689 k = 0.1395 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.3997 -50.3997 -50.3997 -50.3997 -24.7242 -24.7242 -24.7238 -24.7238 -17.0679 -17.0679 -17.0672 -17.0672 -16.9742 -16.9742 -16.9724 -16.9724 -1.5806 -1.5806 -1.5795 -1.5795 2.5843 2.5843 2.6072 2.6072 5.9716 5.9716 6.0098 6.0098 7.9365 7.9365 8.0489 8.0489 8.4659 8.4659 8.6219 8.6219 10.0329 10.0329 10.1103 10.1103 10.9594 10.9594 11.0526 11.0526 13.4941 13.4941 13.6214 13.6214 14.4437 14.4437 14.5437 14.5437 k = 0.1512 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.3997 -50.3997 -50.3997 -50.3997 -24.7246 -24.7246 -24.7242 -24.7242 -17.0680 -17.0680 -17.0673 -17.0673 -16.9759 -16.9759 -16.9739 -16.9739 -1.5758 -1.5758 -1.5747 -1.5747 2.6180 2.6180 2.6425 2.6425 5.9756 5.9756 6.0146 6.0146 7.9272 7.9272 8.0355 8.0355 8.4610 8.4610 8.6168 8.6168 9.9397 9.9397 10.0263 10.0263 10.8468 10.8468 10.9512 10.9512 13.4829 13.4829 13.6189 13.6189 14.5032 14.5032 14.6156 14.6156 k = 0.1628 0.5000 0.2250 ( 4252 PWs) bands (ev): -50.3996 -50.3996 -50.3996 -50.3996 -24.7249 -24.7249 -24.7246 -24.7246 -17.0682 -17.0682 -17.0674 -17.0674 -16.9776 -16.9776 -16.9755 -16.9755 -1.5707 -1.5707 -1.5696 -1.5696 2.6544 2.6544 2.6805 2.6805 5.9787 5.9787 6.0181 6.0181 7.9206 7.9206 8.0239 8.0239 8.4535 8.4535 8.6081 8.6081 9.8408 9.8408 9.9350 9.9350 10.7422 10.7422 10.8558 10.8558 13.4761 13.4761 13.6187 13.6187 14.5580 14.5580 14.6835 14.6835 k = 0.1744 0.5000 0.2250 ( 4256 PWs) bands (ev): -50.3995 -50.3995 -50.3995 -50.3995 -24.7254 -24.7254 -24.7250 -24.7250 -17.0684 -17.0684 -17.0676 -17.0676 -16.9793 -16.9793 -16.9772 -16.9772 -1.5654 -1.5654 -1.5642 -1.5642 2.6934 2.6934 2.7210 2.7210 5.9807 5.9807 6.0200 6.0200 7.9169 7.9169 8.0145 8.0145 8.4423 8.4423 8.5952 8.5952 9.7379 9.7379 9.8377 9.8377 10.6459 10.6459 10.7665 10.7665 13.4742 13.4742 13.6218 13.6218 14.6068 14.6068 14.7462 14.7462 k = 0.1860 0.5000 0.2250 ( 4244 PWs) bands (ev): -50.3994 -50.3994 -50.3994 -50.3994 -24.7257 -24.7257 -24.7253 -24.7253 -17.0686 -17.0686 -17.0678 -17.0678 -16.9810 -16.9810 -16.9788 -16.9788 -1.5599 -1.5599 -1.5586 -1.5586 2.7350 2.7350 2.7641 2.7641 5.9814 5.9814 6.0200 6.0200 7.9163 7.9163 8.0076 8.0076 8.4264 8.4264 8.5773 8.5773 9.6332 9.6332 9.7365 9.7365 10.5578 10.5578 10.6828 10.6828 13.4772 13.4772 13.6285 13.6285 14.6489 14.6489 14.8032 14.8032 k = 0.1977 0.5000 0.2250 ( 4240 PWs) bands (ev): -50.3993 -50.3993 -50.3993 -50.3993 -24.7262 -24.7262 -24.7257 -24.7257 -17.0689 -17.0689 -17.0681 -17.0681 -16.9827 -16.9827 -16.9804 -16.9804 -1.5541 -1.5541 -1.5529 -1.5529 2.7791 2.7791 2.8095 2.8095 5.9807 5.9807 6.0182 6.0182 7.9186 7.9186 8.0033 8.0033 8.4042 8.4042 8.5533 8.5533 9.5296 9.5296 9.6339 9.6339 10.4773 10.4773 10.6046 10.6046 13.4850 13.4850 13.6390 13.6390 14.6843 14.6843 14.8537 14.8537 k = 0.2093 0.5000 0.2250 ( 4236 PWs) bands (ev): -50.3992 -50.3992 -50.3992 -50.3992 -24.7266 -24.7266 -24.7261 -24.7261 -17.0693 -17.0693 -17.0685 -17.0685 -16.9843 -16.9843 -16.9820 -16.9820 -1.5483 -1.5483 -1.5470 -1.5470 2.8256 2.8256 2.8574 2.8574 5.9785 5.9785 6.0142 6.0142 7.9235 7.9235 8.0018 8.0018 8.3742 8.3742 8.5222 8.5222 9.4298 9.4298 9.5331 9.5331 10.4036 10.4036 10.5313 10.5313 13.4974 13.4974 13.6533 13.6533 14.7132 14.7132 14.8971 14.8971 k = 0.2209 0.5000 0.2250 ( 4232 PWs) bands (ev): -50.3991 -50.3991 -50.3991 -50.3991 -24.7270 -24.7270 -24.7266 -24.7266 -17.0698 -17.0698 -17.0690 -17.0690 -16.9859 -16.9859 -16.9836 -16.9836 -1.5422 -1.5422 -1.5410 -1.5410 2.8746 2.8746 2.9076 2.9076 5.9746 5.9746 6.0083 6.0083 7.9305 7.9305 8.0030 8.0030 8.3345 8.3345 8.4829 8.4829 9.3370 9.3370 9.4371 9.4371 10.3362 10.3362 10.4627 10.4627 13.5142 13.5142 13.6710 13.6710 14.7363 14.7363 14.9324 14.9324 k = 0.2326 0.5000 0.2250 ( 4236 PWs) bands (ev): -50.3991 -50.3991 -50.3991 -50.3991 -24.7275 -24.7275 -24.7270 -24.7270 -17.0704 -17.0704 -17.0696 -17.0696 -16.9874 -16.9874 -16.9851 -16.9851 -1.5361 -1.5361 -1.5349 -1.5349 2.9260 2.9260 2.9601 2.9601 5.9691 5.9691 6.0004 6.0004 7.9381 7.9381 8.0064 8.0064 8.2838 8.2838 8.4350 8.4350 9.2539 9.2539 9.3486 9.3486 10.2744 10.2744 10.3985 10.3985 13.5349 13.5349 13.6919 13.6919 14.7541 14.7541 14.9586 14.9586 k = 0.2442 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3990 -50.3990 -50.3990 -50.3990 -24.7279 -24.7279 -24.7275 -24.7275 -17.0710 -17.0710 -17.0703 -17.0703 -16.9888 -16.9888 -16.9866 -16.9866 -1.5299 -1.5299 -1.5287 -1.5287 2.9796 2.9796 3.0147 3.0147 5.9620 5.9620 5.9906 5.9906 7.9443 7.9443 8.0110 8.0110 8.2218 8.2218 8.3796 8.3796 9.1825 9.1825 9.2699 9.2699 10.2180 10.2180 10.3386 10.3386 13.5591 13.5591 13.7154 13.7154 14.7671 14.7671 14.9748 14.9748 k = 0.2558 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3989 -50.3989 -50.3989 -50.3989 -24.7284 -24.7284 -24.7279 -24.7279 -17.0717 -17.0717 -17.0710 -17.0710 -16.9902 -16.9902 -16.9880 -16.9880 -1.5237 -1.5237 -1.5225 -1.5225 3.0354 3.0354 3.0715 3.0715 5.9535 5.9535 5.9791 5.9791 7.9447 7.9447 8.0126 8.0126 8.1522 8.1522 8.3205 8.3205 9.1239 9.1239 9.2019 9.2019 10.1666 10.1666 10.2829 10.2829 13.5863 13.5863 13.7409 13.7409 14.7757 14.7757 14.9804 14.9804 k = 0.2674 0.5000 0.2250 ( 4216 PWs) bands (ev): -50.3988 -50.3988 -50.3988 -50.3988 -24.7288 -24.7288 -24.7283 -24.7283 -17.0724 -17.0724 -17.0718 -17.0718 -16.9914 -16.9914 -16.9893 -16.9893 -1.5175 -1.5175 -1.5163 -1.5163 3.0933 3.0933 3.1302 3.1302 5.9437 5.9437 5.9661 5.9661 7.9313 7.9313 7.9918 7.9918 8.0952 8.0952 8.2661 8.2661 9.0776 9.0776 9.1446 9.1446 10.1204 10.1204 10.2315 10.2315 13.6159 13.6159 13.7676 13.7676 14.7805 14.7805 14.9757 14.9757 k = 0.2791 0.5000 0.2250 ( 4212 PWs) bands (ev): -50.3987 -50.3987 -50.3987 -50.3987 -24.7292 -24.7292 -24.7288 -24.7288 -17.0733 -17.0733 -17.0727 -17.0727 -16.9926 -16.9926 -16.9905 -16.9905 -1.5113 -1.5113 -1.5101 -1.5101 3.1532 3.1532 3.1908 3.1908 5.9327 5.9327 5.9518 5.9518 7.8936 7.8936 7.9185 7.9185 8.0823 8.0823 8.2282 8.2282 9.0422 9.0422 9.0968 9.0968 10.0792 10.0792 10.1846 10.1846 13.6471 13.6471 13.7945 13.7945 14.7820 14.7820 14.9617 14.9617 k = 0.2907 0.5000 0.2250 ( 4212 PWs) bands (ev): -50.3986 -50.3986 -50.3986 -50.3986 -24.7297 -24.7297 -24.7292 -24.7292 -17.0743 -17.0743 -17.0737 -17.0737 -16.9936 -16.9936 -16.9916 -16.9916 -1.5052 -1.5052 -1.5040 -1.5040 3.2149 3.2149 3.2531 3.2531 5.9208 5.9208 5.9366 5.9366 7.8169 7.8169 7.8267 7.8267 8.0916 8.0916 8.2132 8.2132 9.0158 9.0158 9.0570 9.0570 10.0431 10.0431 10.1422 10.1422 13.6790 13.6790 13.8205 13.8205 14.7810 14.7810 14.9400 14.9400 k = 0.3023 0.5000 0.2250 ( 4212 PWs) bands (ev): -50.3985 -50.3985 -50.3985 -50.3985 -24.7301 -24.7301 -24.7297 -24.7297 -17.0753 -17.0753 -17.0748 -17.0748 -16.9945 -16.9945 -16.9926 -16.9926 -1.4992 -1.4992 -1.4981 -1.4981 3.2784 3.2784 3.3169 3.3169 5.9083 5.9083 5.9208 5.9208 7.7044 7.7044 7.7366 7.7366 8.1071 8.1071 8.2169 8.2169 8.9964 8.9964 9.0235 9.0235 10.0125 10.0125 10.1047 10.1047 13.7107 13.7107 13.8440 13.8440 14.7788 14.7788 14.9122 14.9122 k = 0.3140 0.5000 0.2250 ( 4220 PWs) bands (ev): -50.3984 -50.3984 -50.3984 -50.3984 -24.7306 -24.7306 -24.7302 -24.7302 -17.0764 -17.0764 -17.0759 -17.0759 -16.9954 -16.9954 -16.9936 -16.9936 -1.4933 -1.4933 -1.4922 -1.4922 3.3433 3.3433 3.3821 3.3821 5.8954 5.8954 5.9045 5.9045 7.5864 7.5864 7.6320 7.6320 8.1254 8.1254 8.2316 8.2316 8.9822 8.9822 8.9949 8.9949 9.9872 9.9872 10.0722 10.0722 13.7407 13.7407 13.8634 13.8634 14.7768 14.7768 14.8807 14.8807 k = 0.3256 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3983 -50.3983 -50.3983 -50.3983 -24.7310 -24.7310 -24.7306 -24.7306 -17.0775 -17.0775 -17.0771 -17.0771 -16.9961 -16.9961 -16.9944 -16.9944 -1.4875 -1.4875 -1.4865 -1.4865 3.4095 3.4095 3.4484 3.4484 5.8825 5.8825 5.8882 5.8882 7.4654 7.4654 7.5192 7.5192 8.1452 8.1452 8.2522 8.2522 8.9698 8.9698 8.9715 8.9715 9.9676 9.9676 10.0449 10.0449 13.7677 13.7677 13.8769 13.8769 14.7771 14.7771 14.8479 14.8479 k = 0.3372 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3983 -50.3983 -50.3983 -50.3983 -24.7315 -24.7315 -24.7311 -24.7311 -17.0787 -17.0787 -17.0783 -17.0783 -16.9967 -16.9967 -16.9951 -16.9951 -1.4820 -1.4820 -1.4811 -1.4811 3.4768 3.4768 3.5156 3.5156 5.8698 5.8698 5.8722 5.8722 7.3432 7.3432 7.4023 7.4023 8.1657 8.1657 8.2757 8.2757 8.9474 8.9474 8.9632 8.9632 9.9534 9.9534 10.0230 10.0230 13.7897 13.7897 13.8830 13.8830 14.7815 14.7815 14.8169 14.8169 k = 0.3488 0.5000 0.2250 ( 4232 PWs) bands (ev): -50.3982 -50.3982 -50.3982 -50.3982 -24.7319 -24.7319 -24.7315 -24.7315 -17.0798 -17.0798 -17.0796 -17.0796 -16.9973 -16.9973 -16.9958 -16.9958 -1.4767 -1.4767 -1.4758 -1.4758 3.5448 3.5448 3.5833 3.5833 5.8568 5.8568 5.8577 5.8577 7.2211 7.2211 7.2836 7.2836 8.1866 8.1866 8.3001 8.3001 8.9269 8.9269 8.9561 8.9561 9.9447 9.9447 10.0066 10.0066 13.8050 13.8050 13.8803 13.8803 14.7907 14.7907 14.7922 14.7922 k = 0.3605 0.5000 0.2250 ( 4236 PWs) bands (ev): -50.3981 -50.3981 -50.3981 -50.3981 -24.7323 -24.7323 -24.7319 -24.7319 -17.0810 -17.0810 -17.0808 -17.0808 -16.9977 -16.9977 -16.9963 -16.9963 -1.4717 -1.4717 -1.4708 -1.4708 3.6131 3.6131 3.6511 3.6511 5.8424 5.8424 5.8464 5.8464 7.1002 7.1002 7.1648 7.1648 8.2076 8.2076 8.3242 8.3242 8.9081 8.9081 8.9495 8.9495 9.9412 9.9412 9.9955 9.9955 13.8119 13.8119 13.8683 13.8683 14.7722 14.7722 14.8103 14.8103 k = 0.3721 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3981 -50.3981 -50.3980 -50.3980 -24.7326 -24.7326 -24.7322 -24.7322 -17.0821 -17.0821 -17.0819 -17.0819 -16.9980 -16.9980 -16.9968 -16.9968 -1.4669 -1.4669 -1.4661 -1.4661 3.6814 3.6814 3.7185 3.7185 5.8291 5.8291 5.8365 5.8365 6.9815 6.9815 7.0473 7.0473 8.2284 8.2284 8.3472 8.3472 8.8907 8.8907 8.9426 8.9426 9.9425 9.9425 9.9896 9.9896 13.8091 13.8091 13.8476 13.8476 14.7639 14.7639 14.8364 14.8364 k = 0.3837 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3980 -50.3980 -50.3980 -50.3980 -24.7328 -24.7328 -24.7325 -24.7325 -17.0831 -17.0831 -17.0830 -17.0830 -16.9983 -16.9983 -16.9972 -16.9972 -1.4625 -1.4625 -1.4617 -1.4617 3.7491 3.7491 3.7851 3.7851 5.8175 5.8175 5.8281 5.8281 6.8658 6.8658 6.9322 6.9322 8.2488 8.2488 8.3684 8.3684 8.8747 8.8747 8.9352 8.9352 9.9481 9.9481 9.9884 9.9884 13.7965 13.7965 13.8194 13.8194 14.7670 14.7670 14.8700 14.8700 k = 0.3953 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7332 -24.7332 -24.7329 -24.7329 -17.0842 -17.0842 -17.0841 -17.0841 -16.9985 -16.9985 -16.9975 -16.9975 -1.4583 -1.4583 -1.4577 -1.4577 3.8156 3.8156 3.8501 3.8501 5.8079 5.8079 5.8216 5.8216 6.7540 6.7540 6.8203 6.8203 8.2687 8.2687 8.3873 8.3873 8.8602 8.8602 8.9269 8.9269 9.9572 9.9572 9.9912 9.9912 13.7752 13.7752 13.7857 13.7857 14.7815 14.7815 14.9103 14.9103 k = 0.4070 0.5000 0.2250 ( 4220 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7334 -24.7334 -24.7331 -24.7331 -17.0851 -17.0851 -17.0850 -17.0850 -16.9987 -16.9987 -16.9978 -16.9978 -1.4546 -1.4546 -1.4540 -1.4540 3.8801 3.8801 3.9127 3.9127 5.8006 5.8006 5.8174 5.8174 6.6471 6.6471 6.7126 6.7126 8.2881 8.2881 8.4033 8.4033 8.8475 8.8475 8.9177 8.9177 9.9691 9.9691 9.9975 9.9975 13.7471 13.7471 13.7486 13.7486 14.8064 14.8064 14.9556 14.9556 k = 0.4186 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7336 -24.7336 -24.7334 -24.7334 -17.0860 -17.0860 -17.0860 -17.0860 -16.9988 -16.9988 -16.9980 -16.9980 -1.4512 -1.4512 -1.4507 -1.4507 3.9418 3.9418 3.9720 3.9720 5.7960 5.7960 5.8157 5.8157 6.5459 6.5459 6.6100 6.6100 8.3068 8.3068 8.4162 8.4162 8.8368 8.8368 8.9076 8.9076 9.9828 9.9828 10.0061 10.0061 13.7103 13.7103 13.7147 13.7147 14.8400 14.8400 15.0041 15.0041 k = 0.4302 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7338 -24.7338 -24.7336 -24.7336 -17.0868 -17.0868 -17.0868 -17.0868 -16.9989 -16.9989 -16.9982 -16.9982 -1.4483 -1.4483 -1.4478 -1.4478 3.9995 3.9995 4.0268 4.0268 5.7946 5.7946 5.8169 5.8169 6.4517 6.4517 6.5136 6.5136 8.3249 8.3249 8.4258 8.4258 8.8285 8.8285 8.8969 8.8969 9.9974 9.9974 10.0163 10.0163 13.6730 13.6730 13.6806 13.6806 14.8805 14.8805 15.0535 15.0535 k = 0.4419 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7340 -24.7340 -24.7338 -24.7338 -17.0875 -17.0875 -17.0875 -17.0875 -16.9989 -16.9989 -16.9984 -16.9984 -1.4457 -1.4457 -1.4454 -1.4454 4.0522 4.0522 4.0761 4.0761 5.7965 5.7965 5.8209 5.8209 6.3659 6.3659 6.4244 6.4244 8.3422 8.3422 8.4318 8.4318 8.8228 8.8228 8.8857 8.8857 10.0120 10.0120 10.0269 10.0269 13.6385 13.6385 13.6473 13.6473 14.9258 14.9258 15.1010 15.1010 k = 0.4535 0.5000 0.2250 ( 4228 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7341 -24.7341 -24.7340 -24.7340 -17.0881 -17.0881 -17.0881 -17.0881 -16.9990 -16.9990 -16.9985 -16.9985 -1.4436 -1.4436 -1.4433 -1.4433 4.0985 4.0985 4.1185 4.1185 5.8021 5.8021 5.8274 5.8274 6.2903 6.2903 6.3438 6.3438 8.3587 8.3587 8.4342 8.4342 8.8199 8.8199 8.8743 8.8743 10.0256 10.0256 10.0369 10.0369 13.6083 13.6083 13.6169 13.6169 14.9740 14.9740 15.1424 15.1424 k = 0.4651 0.5000 0.2250 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7342 -24.7342 -17.0886 -17.0886 -17.0886 -17.0886 -16.9990 -16.9990 -16.9987 -16.9987 -1.4420 -1.4420 -1.4417 -1.4417 4.1370 4.1370 4.1526 4.1526 5.8111 5.8111 5.8356 5.8356 6.2274 6.2274 6.2736 6.2736 8.3741 8.3741 8.4332 8.4332 8.8198 8.8198 8.8631 8.8631 10.0374 10.0374 10.0456 10.0456 13.5838 13.5838 13.5911 13.5911 15.0232 15.0232 15.1723 15.1723 k = 0.4767 0.5000 0.2250 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7343 -24.7343 -17.0890 -17.0890 -17.0890 -17.0890 -16.9990 -16.9990 -16.9988 -16.9988 -1.4408 -1.4408 -1.4406 -1.4406 4.1665 4.1665 4.1772 4.1772 5.8226 5.8226 5.8431 5.8431 6.1807 6.1807 6.2159 6.2159 8.3885 8.3885 8.4291 8.4291 8.8223 8.8223 8.8525 8.8525 10.0467 10.0467 10.0520 10.0520 13.5660 13.5660 13.5712 13.5712 15.0713 15.0713 15.1850 15.1850 k = 0.4884 0.5000 0.2250 ( 4224 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0891 -17.0891 -17.0891 -17.0891 -16.9989 -16.9989 -16.9988 -16.9988 -1.4400 -1.4400 -1.4400 -1.4400 4.1859 4.1859 4.1913 4.1913 5.8346 5.8346 5.8467 5.8467 6.1546 6.1546 6.1742 6.1742 8.4015 8.4015 8.4221 8.4221 8.8271 8.8271 8.8426 8.8426 10.0530 10.0530 10.0556 10.0556 13.5556 13.5556 13.5583 13.5583 15.1157 15.1157 15.1776 15.1776 k = 0.5000 0.5000 0.2250 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4398 -1.4398 -1.4398 -1.4398 4.1942 4.1942 4.1942 4.1942 5.8437 5.8437 5.8437 5.8437 6.1525 6.1525 6.1525 6.1525 8.4128 8.4128 8.4128 8.4128 8.8341 8.8341 8.8341 8.8341 10.0560 10.0560 10.0560 10.0560 13.5530 13.5530 13.5530 13.5530 15.1528 15.1528 15.1528 15.1528 k = 0.5000 0.5000 0.2250 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4398 -1.4398 -1.4398 -1.4398 4.1942 4.1942 4.1942 4.1942 5.8437 5.8437 5.8437 5.8437 6.1525 6.1525 6.1525 6.1525 8.4128 8.4128 8.4128 8.4128 8.8341 8.8341 8.8341 8.8341 10.0560 10.0560 10.0560 10.0560 13.5530 13.5530 13.5530 13.5530 15.1528 15.1528 15.1528 15.1528 k = 0.4918 0.4918 0.2250 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9988 -16.9988 -1.4407 -1.4407 -1.4393 -1.4393 4.1812 4.1812 4.1961 4.1961 5.8331 5.8331 5.8481 5.8481 6.1545 6.1545 6.1742 6.1742 8.4013 8.4013 8.4223 8.4223 8.8270 8.8270 8.8427 8.8427 10.0517 10.0517 10.0569 10.0569 13.5555 13.5555 13.5583 13.5583 15.1153 15.1153 15.1785 15.1785 k = 0.4836 0.4836 0.2250 ( 4228 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7342 -24.7342 -17.0889 -17.0889 -17.0889 -17.0889 -16.9990 -16.9990 -16.9987 -16.9987 -1.4435 -1.4435 -1.4379 -1.4379 4.1446 4.1446 4.2002 4.2002 5.8131 5.8131 5.8517 5.8517 6.1794 6.1794 6.2169 6.2169 8.3870 8.3870 8.4307 8.4307 8.8213 8.8213 8.8535 8.8535 10.0400 10.0400 10.0587 10.0587 13.5658 13.5658 13.5712 13.5712 15.0682 15.0682 15.1927 15.1927 k = 0.4754 0.4754 0.2250 ( 4230 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7341 -24.7341 -17.0886 -17.0886 -17.0885 -17.0885 -16.9990 -16.9990 -16.9987 -16.9987 -1.4482 -1.4482 -1.4355 -1.4355 4.0868 4.0868 4.2070 4.2070 5.7860 5.7860 5.8565 5.8565 6.2214 6.2214 6.2792 6.2792 8.3691 8.3691 8.4385 8.4385 8.8164 8.8164 8.8667 8.8667 10.0211 10.0211 10.0617 10.0617 13.5831 13.5831 13.5913 13.5913 15.0152 15.0152 15.1981 15.1981 k = 0.4672 0.4672 0.2250 ( 4218 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7341 -24.7341 -24.7339 -24.7339 -17.0881 -17.0881 -17.0880 -17.0880 -16.9990 -16.9990 -16.9985 -16.9985 -1.4548 -1.4548 -1.4323 -1.4323 4.0116 4.0116 4.2165 4.2165 5.7557 5.7557 5.8629 5.8629 6.2732 6.2732 6.3601 6.3601 8.3472 8.3472 8.4465 8.4465 8.8120 8.8120 8.8830 8.8830 9.9958 9.9958 10.0658 10.0658 13.6065 13.6065 13.6180 13.6180 14.9597 14.9597 15.1974 15.1974 k = 0.4590 0.4590 0.2250 ( 4222 PWs) bands (ev): -50.3978 -50.3978 -50.3977 -50.3977 -24.7340 -24.7340 -24.7338 -24.7338 -17.0875 -17.0875 -17.0874 -17.0874 -16.9990 -16.9990 -16.9984 -16.9984 -1.4633 -1.4633 -1.4281 -1.4281 3.9227 3.9227 4.2287 4.2287 5.7248 5.7248 5.8711 5.8711 6.3303 6.3303 6.4572 6.4572 8.3209 8.3209 8.4549 8.4549 8.8077 8.8077 8.9026 8.9026 9.9654 9.9654 10.0712 10.0712 13.6344 13.6344 13.6506 13.6506 14.9048 14.9048 15.1936 15.1936 k = 0.4508 0.4508 0.2250 ( 4222 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7338 -24.7338 -24.7336 -24.7336 -17.0867 -17.0867 -17.0867 -17.0867 -16.9990 -16.9990 -16.9983 -16.9983 -1.4736 -1.4736 -1.4232 -1.4232 3.8236 3.8236 4.2436 4.2436 5.6951 5.6951 5.8812 5.8812 6.3907 6.3907 6.5671 6.5671 8.2904 8.2904 8.4638 8.4638 8.8030 8.8030 8.9260 8.9260 9.9311 9.9311 10.0777 10.0777 13.6649 13.6649 13.6882 13.6882 14.8531 14.8531 15.1884 15.1884 k = 0.4426 0.4426 0.2250 ( 4226 PWs) bands (ev): -50.3978 -50.3978 -50.3978 -50.3978 -24.7336 -24.7336 -24.7334 -24.7334 -17.0859 -17.0859 -17.0859 -17.0859 -16.9989 -16.9989 -16.9981 -16.9981 -1.4858 -1.4858 -1.4174 -1.4174 3.7170 3.7170 4.2612 4.2612 5.6678 5.6678 5.8930 5.8930 6.4533 6.4533 6.6863 6.6863 8.2561 8.2561 8.4735 8.4735 8.7972 8.7972 8.9537 8.9537 9.8946 9.8946 10.0855 10.0855 13.6960 13.6960 13.7294 13.7294 14.8067 14.8067 15.1834 15.1834 k = 0.4344 0.4344 0.2250 ( 4228 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7334 -24.7334 -24.7331 -24.7331 -17.0849 -17.0849 -17.0849 -17.0849 -16.9989 -16.9989 -16.9979 -16.9979 -1.5000 -1.5000 -1.4109 -1.4109 3.6051 3.6051 4.2815 4.2815 5.6434 5.6434 5.9067 5.9067 6.5176 6.5176 6.8115 6.8115 8.2187 8.2187 8.4839 8.4839 8.7893 8.7893 8.9861 8.9861 9.8577 9.8577 10.0944 10.0944 13.7257 13.7257 13.7726 13.7726 14.7679 14.7679 15.1779 15.1779 k = 0.4262 0.4262 0.2250 ( 4224 PWs) bands (ev): -50.3979 -50.3979 -50.3979 -50.3979 -24.7331 -24.7331 -24.7328 -24.7328 -17.0837 -17.0837 -17.0837 -17.0837 -16.9988 -16.9988 -16.9977 -16.9977 -1.5159 -1.5159 -1.4037 -1.4037 3.4897 3.4897 4.3045 4.3045 5.6227 5.6227 5.9221 5.9221 6.5832 6.5832 6.9399 6.9399 8.1791 8.1791 8.4949 8.4949 8.7784 8.7784 9.0237 9.0237 9.8220 9.8220 10.1046 10.1046 13.7523 13.7523 13.8156 13.8156 14.7390 14.7390 15.1675 15.1675 k = 0.4180 0.4180 0.2250 ( 4228 PWs) bands (ev): -50.3980 -50.3980 -50.3980 -50.3980 -24.7328 -24.7328 -24.7325 -24.7325 -17.0825 -17.0825 -17.0825 -17.0825 -16.9988 -16.9988 -16.9975 -16.9975 -1.5338 -1.5338 -1.3959 -1.3959 3.3720 3.3720 4.3303 4.3303 5.6059 5.6059 5.9394 5.9394 6.6497 6.6497 7.0684 7.0684 8.1392 8.1392 8.5063 8.5063 8.7636 8.7636 9.0669 9.0669 9.7895 9.7895 10.1159 10.1159 13.7744 13.7744 13.8560 13.8560 14.7221 14.7221 15.1437 15.1437 k = 0.4098 0.4098 0.2250 ( 4228 PWs) bands (ev): -50.3981 -50.3981 -50.3981 -50.3981 -24.7325 -24.7325 -24.7321 -24.7321 -17.0811 -17.0811 -17.0811 -17.0811 -16.9987 -16.9987 -16.9972 -16.9972 -1.5535 -1.5535 -1.3876 -1.3876 3.2531 3.2531 4.3587 4.3587 5.5933 5.5933 5.9585 5.9585 6.7169 6.7169 7.1938 7.1938 8.1012 8.1012 8.5176 8.5176 8.7443 8.7443 9.1163 9.1163 9.7618 9.7618 10.1285 10.1285 13.7911 13.7911 13.8913 13.8913 14.7194 14.7194 15.1080 15.1080 k = 0.4016 0.4016 0.2250 ( 4232 PWs) bands (ev): -50.3981 -50.3981 -50.3981 -50.3981 -24.7322 -24.7322 -24.7317 -24.7317 -17.0797 -17.0797 -17.0796 -17.0796 -16.9987 -16.9987 -16.9970 -16.9970 -1.5750 -1.5750 -1.3788 -1.3788 3.1337 3.1337 4.3898 4.3898 5.5851 5.5851 5.9793 5.9793 6.7845 6.7845 7.3110 7.3110 8.0689 8.0689 8.5282 8.5282 8.7205 8.7205 9.1725 9.1725 9.7400 9.7400 10.1422 10.1422 13.8022 13.8022 13.9196 13.9196 14.7320 14.7320 15.0666 15.0666 k = 0.3934 0.3934 0.2250 ( 4236 PWs) bands (ev): -50.3982 -50.3982 -50.3982 -50.3982 -24.7319 -24.7319 -24.7313 -24.7313 -17.0781 -17.0781 -17.0780 -17.0780 -16.9986 -16.9986 -16.9967 -16.9967 -1.5983 -1.5983 -1.3697 -1.3697 3.0145 3.0145 4.4237 4.4237 5.5816 5.5816 6.0019 6.0019 6.8522 6.8522 7.4130 7.4130 8.0487 8.0487 8.5362 8.5362 8.6939 8.6939 9.2361 9.2361 9.7250 9.7250 10.1571 10.1571 13.8080 13.8080 13.9401 13.9401 14.7598 14.7598 15.0229 15.0229 k = 0.3852 0.3852 0.2250 ( 4232 PWs) bands (ev): -50.3983 -50.3983 -50.3983 -50.3983 -24.7315 -24.7315 -24.7308 -24.7308 -17.0764 -17.0764 -17.0762 -17.0762 -16.9985 -16.9985 -16.9964 -16.9964 -1.6233 -1.6233 -1.3603 -1.3603 2.8959 2.8959 4.4602 4.4602 5.5828 5.5828 6.0263 6.0263 6.9198 6.9198 7.4899 7.4899 8.0495 8.0495 8.5372 8.5372 8.6691 8.6691 9.3077 9.3077 9.7170 9.7170 10.1731 10.1731 13.8094 13.8094 13.9534 13.9534 14.8007 14.8007 14.9782 14.9782 k = 0.3770 0.3770 0.2250 ( 4238 PWs) bands (ev): -50.3984 -50.3984 -50.3984 -50.3984 -24.7311 -24.7311 -24.7304 -24.7304 -17.0746 -17.0746 -17.0744 -17.0744 -16.9984 -16.9984 -16.9960 -16.9960 -1.6501 -1.6501 -1.3508 -1.3508 2.7783 2.7783 4.4994 4.4994 5.5889 5.5889 6.0525 6.0525 6.9869 6.9869 7.5324 7.5324 8.0794 8.0794 8.5240 8.5240 8.6545 8.6545 9.3877 9.3877 9.7158 9.7158 10.1902 10.1902 13.8076 13.8076 13.9608 13.9608 14.8480 14.8480 14.9366 14.9366 k = 0.3689 0.3689 0.2250 ( 4234 PWs) bands (ev): -50.3985 -50.3985 -50.3985 -50.3985 -24.7306 -24.7306 -24.7298 -24.7298 -17.0726 -17.0726 -17.0724 -17.0724 -16.9983 -16.9983 -16.9957 -16.9957 -1.6786 -1.6786 -1.3412 -1.3412 2.6622 2.6622 4.5412 4.5412 5.5999 5.5999 6.0804 6.0804 7.0534 7.0534 7.5404 7.5404 8.1368 8.1368 8.4941 8.4941 8.6550 8.6550 9.4766 9.4766 9.7208 9.7208 10.2084 10.2084 13.8039 13.8039 13.9644 13.9644 14.8600 14.8600 14.9359 14.9359 k = 0.3607 0.3607 0.2250 ( 4226 PWs) bands (ev): -50.3986 -50.3986 -50.3986 -50.3986 -24.7301 -24.7301 -24.7292 -24.7292 -17.0705 -17.0705 -17.0702 -17.0702 -16.9981 -16.9981 -16.9953 -16.9953 -1.7086 -1.7086 -1.3316 -1.3316 2.5476 2.5476 4.5858 4.5858 5.6158 5.6158 6.1101 6.1101 7.1187 7.1187 7.5233 7.5233 8.2082 8.2082 8.4565 8.4565 8.6666 8.6666 9.5738 9.5738 9.7318 9.7318 10.2277 10.2277 13.7997 13.7997 13.9662 13.9662 14.8177 14.8177 14.9903 14.9903 k = 0.3525 0.3525 0.2250 ( 4234 PWs) bands (ev): -50.3987 -50.3987 -50.3987 -50.3987 -24.7296 -24.7296 -24.7287 -24.7287 -17.0684 -17.0684 -17.0681 -17.0681 -16.9980 -16.9980 -16.9949 -16.9949 -1.7403 -1.7403 -1.3223 -1.3223 2.4350 2.4350 4.6330 4.6330 5.6367 5.6367 6.1415 6.1415 7.1822 7.1822 7.4913 7.4913 8.2681 8.2681 8.4324 8.4324 8.6851 8.6851 9.6748 9.6748 9.7520 9.7520 10.2480 10.2480 13.7961 13.7961 13.9681 13.9681 14.7659 14.7659 15.0468 15.0468 k = 0.3443 0.3443 0.2250 ( 4226 PWs) bands (ev): -50.3988 -50.3988 -50.3988 -50.3988 -24.7290 -24.7290 -24.7281 -24.7281 -17.0660 -17.0660 -17.0658 -17.0658 -16.9978 -16.9978 -16.9945 -16.9945 -1.7733 -1.7733 -1.3133 -1.3133 2.3244 2.3244 4.6829 4.6829 5.6625 5.6625 6.1746 6.1746 7.2433 7.2433 7.4516 7.4516 8.2737 8.2737 8.4608 8.4608 8.7089 8.7089 9.7416 9.7416 9.8182 9.8182 10.2695 10.2695 13.7941 13.7941 13.9717 13.9717 14.7105 14.7105 15.0812 15.0812 k = 0.3361 0.3361 0.2250 ( 4226 PWs) bands (ev): -50.3989 -50.3989 -50.3989 -50.3989 -24.7284 -24.7284 -24.7276 -24.7276 -17.0637 -17.0637 -17.0635 -17.0635 -16.9976 -16.9976 -16.9941 -16.9941 -1.8078 -1.8078 -1.3046 -1.3046 2.2160 2.2160 4.7355 4.7355 5.6931 5.6931 6.2093 6.2093 7.3006 7.3006 7.4085 7.4085 8.2364 8.2364 8.5282 8.5282 8.7387 8.7387 9.7666 9.7666 9.9358 9.9358 10.2922 10.2922 13.7947 13.7947 13.9782 13.9782 14.6521 14.6521 15.0690 15.0690 k = 0.3279 0.3279 0.2250 ( 4224 PWs) bands (ev): -50.3990 -50.3990 -50.3990 -50.3990 -24.7278 -24.7278 -24.7269 -24.7269 -17.0612 -17.0612 -17.0611 -17.0611 -16.9974 -16.9974 -16.9937 -16.9937 -1.8436 -1.8436 -1.2966 -1.2966 2.1101 2.1101 4.7907 4.7907 5.7284 5.7284 6.2458 6.2458 7.3476 7.3476 7.3693 7.3693 8.1897 8.1897 8.5993 8.5993 8.7771 8.7771 9.7865 9.7865 10.0659 10.0659 10.3167 10.3167 13.7985 13.7985 13.9885 13.9885 14.5905 14.5905 15.0317 15.0317 k = 0.3197 0.3197 0.2250 ( 4226 PWs) bands (ev): -50.3991 -50.3991 -50.3991 -50.3991 -24.7273 -24.7273 -24.7263 -24.7263 -17.0587 -17.0587 -17.0585 -17.0585 -16.9972 -16.9972 -16.9932 -16.9932 -1.8806 -1.8806 -1.2892 -1.2892 2.0066 2.0066 4.8485 4.8485 5.7682 5.7682 6.2839 6.2839 7.3170 7.3170 7.4008 7.4008 8.1456 8.1456 8.6612 8.6612 8.8273 8.8273 9.8052 9.8052 10.1996 10.1996 10.3457 10.3457 13.8059 13.8059 14.0032 14.0032 14.5260 14.5260 14.9868 14.9868 k = 0.3115 0.3115 0.2250 ( 4226 PWs) bands (ev): -50.3992 -50.3992 -50.3992 -50.3992 -24.7267 -24.7267 -24.7256 -24.7256 -17.0561 -17.0561 -17.0559 -17.0559 -16.9970 -16.9970 -16.9928 -16.9928 -1.9186 -1.9186 -1.2826 -1.2826 1.9059 1.9059 4.9090 4.9090 5.8124 5.8124 6.3237 6.3237 7.2744 7.2744 7.4352 7.4352 8.1104 8.1104 8.7109 8.7109 8.8898 8.8898 9.8228 9.8228 10.3148 10.3148 10.3993 10.3993 13.8174 13.8174 14.0226 14.0226 14.4587 14.4587 14.9382 14.9382 k = 0.3033 0.3033 0.2250 ( 4226 PWs) bands (ev): -50.3994 -50.3994 -50.3993 -50.3993 -24.7260 -24.7260 -24.7250 -24.7250 -17.0534 -17.0534 -17.0532 -17.0532 -16.9967 -16.9967 -16.9923 -16.9923 -1.9577 -1.9577 -1.2769 -1.2769 1.8079 1.8079 4.9721 4.9721 5.8606 5.8606 6.3650 6.3650 7.2336 7.2336 7.4562 7.4562 8.0889 8.0889 8.7516 8.7516 8.9608 8.9608 9.8391 9.8391 10.3667 10.3667 10.5201 10.5201 13.8330 13.8330 14.0461 14.0461 14.3896 14.3896 14.8871 14.8872 k = 0.2951 0.2951 0.2250 ( 4222 PWs) bands (ev): -50.3995 -50.3995 -50.3995 -50.3995 -24.7254 -24.7254 -24.7242 -24.7242 -17.0507 -17.0507 -17.0505 -17.0505 -16.9965 -16.9965 -16.9917 -16.9917 -1.9977 -1.9977 -1.2722 -1.2722 1.7127 1.7127 5.0378 5.0378 5.9125 5.9125 6.4079 6.4079 7.1953 7.1953 7.4611 7.4611 8.0847 8.0847 8.7876 8.7876 9.0359 9.0359 9.8538 9.8538 10.3966 10.3966 10.6656 10.6656 13.8523 13.8523 14.0716 14.0716 14.3213 14.3213 14.8343 14.8343 k = 0.2869 0.2869 0.2250 ( 4224 PWs) bands (ev): -50.3996 -50.3996 -50.3996 -50.3996 -24.7248 -24.7248 -24.7236 -24.7236 -17.0479 -17.0479 -17.0476 -17.0476 -16.9962 -16.9962 -16.9913 -16.9913 -2.0384 -2.0384 -1.2687 -1.2687 1.6205 1.6205 5.1061 5.1061 5.9676 5.9676 6.4524 6.4524 7.1602 7.1602 7.4500 7.4500 8.0987 8.0987 8.8215 8.8215 9.1126 9.1126 9.8666 9.8666 10.4228 10.4228 10.8153 10.8153 13.8737 13.8737 14.0922 14.0922 14.2625 14.2625 14.7798 14.7798 k = 0.2787 0.2787 0.2250 ( 4218 PWs) bands (ev): -50.3997 -50.3997 -50.3997 -50.3997 -24.7241 -24.7241 -24.7229 -24.7229 -17.0450 -17.0450 -17.0448 -17.0448 -16.9959 -16.9959 -16.9908 -16.9908 -2.0797 -2.0797 -1.2663 -1.2663 1.5314 1.5314 5.1770 5.1770 6.0252 6.0252 6.4983 6.4983 7.1287 7.1287 7.4259 7.4259 8.1285 8.1285 8.8550 8.8550 9.1895 9.1895 9.8774 9.8774 10.4478 10.4478 10.9652 10.9652 13.8912 13.8912 14.0904 14.0904 14.2367 14.2367 14.7243 14.7243 k = 0.2705 0.2705 0.2250 ( 4222 PWs) bands (ev): -50.3999 -50.3999 -50.3998 -50.3998 -24.7234 -24.7234 -24.7222 -24.7222 -17.0421 -17.0421 -17.0418 -17.0418 -16.9956 -16.9956 -16.9903 -16.9903 -2.1215 -2.1215 -1.2653 -1.2653 1.4453 1.4453 5.2505 5.2505 6.0846 6.0846 6.5456 6.5456 7.1010 7.1010 7.3934 7.3934 8.1707 8.1707 8.8886 8.8886 9.2660 9.2660 9.8862 9.8862 10.4721 10.4721 11.1134 11.1134 13.8862 13.8862 14.0731 14.0731 14.2547 14.2547 14.6681 14.6681 k = 0.2623 0.2623 0.2250 ( 4222 PWs) bands (ev): -50.4000 -50.4000 -50.3999 -50.3999 -24.7227 -24.7227 -24.7215 -24.7215 -17.0392 -17.0392 -17.0389 -17.0389 -16.9953 -16.9953 -16.9898 -16.9898 -2.1638 -2.1638 -1.2657 -1.2657 1.3623 1.3623 5.3266 5.3266 6.1445 6.1445 6.5943 6.5943 7.0775 7.0775 7.3571 7.3571 8.2218 8.2218 8.9229 8.9229 9.3417 9.3417 9.8931 9.8931 10.4955 10.4955 11.2580 11.2580 13.8370 13.8370 14.0840 14.0840 14.2935 14.2935 14.6119 14.6119 k = 0.2541 0.2541 0.2250 ( 4218 PWs) bands (ev): -50.4001 -50.4001 -50.4001 -50.4001 -24.7220 -24.7220 -24.7208 -24.7208 -17.0362 -17.0362 -17.0358 -17.0358 -16.9950 -16.9950 -16.9893 -16.9893 -2.2063 -2.2063 -1.2675 -1.2675 1.2826 1.2826 5.4052 5.4052 6.2035 6.2035 6.6441 6.6441 7.0586 7.0586 7.3214 7.3214 8.2791 8.2791 8.9581 8.9581 9.4163 9.4163 9.8982 9.8982 10.5181 10.5181 11.3979 11.3979 13.7548 13.7548 14.1243 14.1243 14.3381 14.3381 14.5577 14.5577 k = 0.2459 0.2459 0.2250 ( 4218 PWs) bands (ev): -50.4003 -50.4003 -50.4002 -50.4002 -24.7213 -24.7213 -24.7201 -24.7201 -17.0332 -17.0332 -17.0328 -17.0328 -16.9946 -16.9946 -16.9887 -16.9887 -2.2489 -2.2489 -1.2707 -1.2707 1.2061 1.2061 5.4863 5.4863 6.2597 6.2597 6.6949 6.6949 7.0444 7.0444 7.2900 7.2900 8.3406 8.3406 8.9944 8.9944 9.4895 9.4895 9.9017 9.9017 10.5395 10.5395 11.5318 11.5318 13.6564 13.6564 14.1804 14.1804 14.3778 14.3778 14.5114 14.5114 k = 0.2377 0.2377 0.2250 ( 4220 PWs) bands (ev): -50.4004 -50.4004 -50.4003 -50.4003 -24.7206 -24.7206 -24.7194 -24.7194 -17.0303 -17.0303 -17.0298 -17.0298 -16.9943 -16.9943 -16.9882 -16.9882 -2.2915 -2.2915 -1.2755 -1.2755 1.1329 1.1329 5.5699 5.5699 6.3104 6.3104 6.7464 6.7464 7.0355 7.0355 7.2667 7.2667 8.4050 8.4050 9.0319 9.0319 9.5609 9.5609 9.9038 9.9038 10.5594 10.5594 11.6587 11.6587 13.5488 13.5488 14.2453 14.2453 14.3861 14.3861 14.4594 14.4594 k = 0.2295 0.2295 0.2250 ( 4224 PWs) bands (ev): -50.4005 -50.4005 -50.4005 -50.4005 -24.7199 -24.7199 -24.7187 -24.7187 -17.0273 -17.0273 -17.0267 -17.0267 -16.9939 -16.9939 -16.9877 -16.9877 -2.3340 -2.3340 -1.2818 -1.2818 1.0630 1.0630 5.6560 5.6560 6.3526 6.3526 6.7981 6.7981 7.0326 7.0326 7.2551 7.2551 8.4714 8.4714 9.0706 9.0706 9.6302 9.6302 9.9049 9.9049 10.5776 10.5776 11.7780 11.7780 13.4346 13.4346 14.3075 14.3075 14.3445 14.3445 14.3605 14.3605 k = 0.2213 0.2213 0.2250 ( 4236 PWs) bands (ev): -50.4007 -50.4007 -50.4006 -50.4006 -24.7194 -24.7194 -24.7180 -24.7180 -17.0243 -17.0243 -17.0237 -17.0237 -16.9936 -16.9936 -16.9872 -16.9872 -2.3762 -2.3762 -1.2896 -1.2896 0.9964 0.9964 5.7445 5.7445 6.3836 6.3836 6.8491 6.8491 7.0365 7.0365 7.2584 7.2584 8.5390 8.5390 9.1105 9.1105 9.6967 9.6967 9.9053 9.9053 10.5938 10.5938 11.8890 11.8890 13.3153 13.3153 14.2286 14.2286 14.2959 14.2959 14.3993 14.3993 k = 0.2131 0.2131 0.2250 ( 4232 PWs) bands (ev): -50.4008 -50.4008 -50.4007 -50.4007 -24.7186 -24.7186 -24.7173 -24.7173 -17.0213 -17.0213 -17.0207 -17.0207 -16.9932 -16.9932 -16.9867 -16.9867 -2.4181 -2.4181 -1.2988 -1.2988 0.9330 0.9330 5.8355 5.8355 6.4010 6.4010 6.8982 6.8982 7.0489 7.0489 7.2790 7.2790 8.6073 8.6073 9.1518 9.1518 9.7598 9.7598 9.9054 9.9054 10.6076 10.6076 11.9917 11.9917 13.1916 13.1916 14.1190 14.1190 14.2450 14.2450 14.4704 14.4704 k = 0.2049 0.2049 0.2250 ( 4224 PWs) bands (ev): -50.4009 -50.4009 -50.4008 -50.4008 -24.7179 -24.7179 -24.7165 -24.7165 -17.0184 -17.0184 -17.0176 -17.0176 -16.9928 -16.9928 -16.9861 -16.9861 -2.4594 -2.4594 -1.3094 -1.3094 0.8728 0.8728 5.9288 5.9288 6.4047 6.4047 6.9431 6.9431 7.0718 7.0718 7.3172 7.3172 8.6758 8.6758 9.1942 9.1942 9.8184 9.8184 9.9060 9.9060 10.6186 10.6186 12.0860 12.0860 13.0642 13.0642 14.0133 14.0133 14.1941 14.1941 14.5352 14.5352 k = 0.1967 0.1967 0.2250 ( 4224 PWs) bands (ev): -50.4010 -50.4010 -50.4010 -50.4010 -24.7173 -24.7173 -24.7158 -24.7158 -17.0155 -17.0155 -17.0146 -17.0146 -16.9923 -16.9923 -16.9856 -16.9856 -2.5002 -2.5002 -1.3214 -1.3214 0.8159 0.8159 6.0244 6.0244 6.3959 6.3959 6.9822 6.9822 7.1067 7.1067 7.3718 7.3718 8.7442 8.7442 9.2379 9.2379 9.8699 9.8699 9.9093 9.9093 10.6265 10.6265 12.1722 12.1722 12.9337 12.9337 13.9135 13.9135 14.1454 14.1454 14.5823 14.5823 k = 0.1885 0.1885 0.2250 ( 4228 PWs) bands (ev): -50.4012 -50.4012 -50.4011 -50.4011 -24.7166 -24.7166 -24.7151 -24.7151 -17.0127 -17.0127 -17.0116 -17.0116 -16.9918 -16.9918 -16.9851 -16.9851 -2.5402 -2.5402 -1.3345 -1.3345 0.7622 0.7622 6.1221 6.1221 6.3773 6.3773 7.0164 7.0164 7.1527 7.1527 7.4402 7.4402 8.8121 8.8121 9.2828 9.2828 9.8980 9.8980 9.9309 9.9309 10.6309 10.6309 12.2506 12.2506 12.8006 12.8006 13.8211 13.8211 14.0997 14.0997 14.5994 14.5994 k = 0.1803 0.1803 0.2250 ( 4232 PWs) bands (ev): -50.4013 -50.4013 -50.4012 -50.4012 -24.7160 -24.7160 -24.7145 -24.7145 -17.0100 -17.0100 -17.0088 -17.0088 -16.9913 -16.9913 -16.9847 -16.9847 -2.5794 -2.5794 -1.3488 -1.3488 0.7115 0.7115 6.2211 6.2211 6.3522 6.3522 7.0488 7.0488 7.2065 7.2065 7.5196 7.5196 8.8790 8.8790 9.3286 9.3286 9.9043 9.9043 9.9691 9.9691 10.6314 10.6314 12.3213 12.3213 12.6660 12.6660 13.7372 13.7372 14.0577 14.0577 14.5796 14.5796 k = 0.1721 0.1721 0.2250 ( 4236 PWs) bands (ev): -50.4014 -50.4014 -50.4013 -50.4013 -24.7154 -24.7154 -24.7138 -24.7138 -17.0074 -17.0074 -17.0059 -17.0059 -16.9908 -16.9908 -16.9842 -16.9842 -2.6176 -2.6176 -1.3640 -1.3640 0.6639 0.6639 6.3029 6.3029 6.3416 6.3416 7.0821 7.0821 7.2651 7.2651 7.6073 7.6073 8.9446 8.9446 9.3754 9.3754 9.9092 9.9092 10.0025 10.0025 10.6278 10.6278 12.3811 12.3811 12.5345 12.5345 13.6629 13.6629 14.0202 14.0202 14.5227 14.5227 k = 0.1639 0.1639 0.2250 ( 4240 PWs) bands (ev): -50.4015 -50.4015 -50.4014 -50.4014 -24.7148 -24.7148 -24.7132 -24.7132 -17.0049 -17.0049 -17.0031 -17.0031 -16.9901 -16.9901 -16.9838 -16.9838 -2.6548 -2.6548 -1.3800 -1.3800 0.6192 0.6192 6.2811 6.2811 6.4337 6.4337 7.1178 7.1178 7.3269 7.3269 7.7010 7.7010 9.0086 9.0086 9.4227 9.4227 9.9159 9.9159 10.0279 10.0279 10.6197 10.6197 12.3632 12.3632 12.4737 12.4737 13.5992 13.5992 13.9875 13.9875 14.4368 14.4368 k = 0.1557 0.1557 0.2250 ( 4240 PWs) bands (ev): -50.4016 -50.4016 -50.4015 -50.4015 -24.7142 -24.7142 -24.7126 -24.7126 -17.0026 -17.0026 -17.0003 -17.0003 -16.9894 -16.9894 -16.9833 -16.9833 -2.6908 -2.6908 -1.3967 -1.3967 0.5774 0.5774 6.2460 6.2460 6.5394 6.5394 7.1569 7.1569 7.3908 7.3908 7.7991 7.7991 9.0705 9.0705 9.4704 9.4704 9.9252 9.9252 10.0440 10.0440 10.6070 10.6070 12.2339 12.2339 12.5194 12.5194 13.5466 13.5466 13.9598 13.9598 14.3330 14.3330 k = 0.1475 0.1475 0.2250 ( 4244 PWs) bands (ev): -50.4018 -50.4018 -50.4016 -50.4016 -24.7136 -24.7136 -24.7120 -24.7120 -17.0005 -17.0005 -16.9977 -16.9977 -16.9885 -16.9885 -16.9829 -16.9829 -2.7256 -2.7256 -1.4139 -1.4139 0.5384 0.5384 6.2094 6.2094 6.6479 6.6479 7.1995 7.1995 7.4562 7.4562 7.8997 7.8997 9.1299 9.1299 9.5181 9.5181 9.9378 9.9378 10.0501 10.0501 10.5895 10.5895 12.0935 12.0935 12.5725 12.5725 13.5052 13.5052 13.9372 13.9372 14.2194 14.2194 k = 0.1393 0.1393 0.2250 ( 4238 PWs) bands (ev): -50.4019 -50.4019 -50.4017 -50.4017 -24.7130 -24.7130 -24.7114 -24.7114 -16.9986 -16.9986 -16.9950 -16.9950 -16.9874 -16.9874 -16.9824 -16.9824 -2.7590 -2.7590 -1.4314 -1.4314 0.5020 0.5020 6.1728 6.1728 6.7585 6.7585 7.2459 7.2459 7.5229 7.5229 8.0015 8.0015 9.1864 9.1864 9.5653 9.5653 9.9539 9.9539 10.0463 10.0463 10.5672 10.5672 11.9510 11.9510 12.6258 12.6258 13.4747 13.4747 13.9188 13.9188 14.1015 14.1015 k = 0.1311 0.1311 0.2250 ( 4234 PWs) bands (ev): -50.4020 -50.4020 -50.4018 -50.4018 -24.7124 -24.7124 -24.7109 -24.7109 -16.9970 -16.9970 -16.9925 -16.9925 -16.9862 -16.9862 -16.9820 -16.9820 -2.7909 -2.7909 -1.4491 -1.4491 0.4683 0.4683 6.1367 6.1367 6.8710 6.8710 7.2961 7.2961 7.5904 7.5904 8.1033 8.1033 9.2397 9.2397 9.6112 9.6112 9.9727 9.9727 10.0339 10.0339 10.5401 10.5401 11.8080 11.8080 12.6793 12.6793 13.4546 13.4546 13.8982 13.8982 13.9886 13.9886 k = 0.1230 0.1230 0.2250 ( 4236 PWs) bands (ev): -50.4021 -50.4021 -50.4019 -50.4019 -24.7119 -24.7119 -24.7104 -24.7104 -16.9957 -16.9957 -16.9901 -16.9901 -16.9849 -16.9849 -16.9816 -16.9816 -2.8214 -2.8214 -1.4666 -1.4666 0.4371 0.4371 6.1016 6.1016 6.9851 6.9851 7.3499 7.3499 7.6585 7.6585 8.2039 8.2039 9.2896 9.2896 9.6549 9.6549 9.9844 9.9844 10.0241 10.0241 10.5085 10.5085 11.6652 11.6652 12.7337 12.7337 13.4439 13.4439 13.8297 13.8297 13.9280 13.9280 k = 0.1148 0.1148 0.2250 ( 4238 PWs) bands (ev): -50.4021 -50.4021 -50.4020 -50.4020 -24.7114 -24.7114 -24.7099 -24.7099 -16.9946 -16.9946 -16.9879 -16.9879 -16.9834 -16.9834 -16.9812 -16.9812 -2.8503 -2.8503 -1.4840 -1.4840 0.4083 0.4083 6.0680 6.0680 7.1007 7.1007 7.4073 7.4073 7.7271 7.7271 8.3019 8.3019 9.3360 9.3360 9.6945 9.6945 9.9646 9.9646 10.0431 10.0431 10.4727 10.4727 11.5234 11.5234 12.7897 12.7897 13.4415 13.4415 13.7151 13.7151 13.9196 13.9196 k = 0.1066 0.1066 0.2250 ( 4242 PWs) bands (ev): -50.4022 -50.4022 -50.4021 -50.4021 -24.7110 -24.7110 -24.7094 -24.7094 -16.9937 -16.9937 -16.9858 -16.9858 -16.9818 -16.9818 -16.9808 -16.9808 -2.8775 -2.8775 -1.5010 -1.5010 0.3818 0.3818 6.0360 6.0360 7.2175 7.2175 7.4680 7.4680 7.7957 7.7957 8.3963 8.3963 9.3789 9.3789 9.7255 9.7255 9.9323 9.9323 10.0763 10.0763 10.4332 10.4332 11.3837 11.3837 12.8473 12.8473 13.4465 13.4465 13.5959 13.5959 13.9226 13.9226 k = 0.0984 0.0984 0.2250 ( 4242 PWs) bands (ev): -50.4023 -50.4023 -50.4022 -50.4022 -24.7106 -24.7106 -24.7090 -24.7090 -16.9930 -16.9930 -16.9839 -16.9839 -16.9805 -16.9805 -16.9801 -16.9801 -2.9029 -2.9029 -1.5174 -1.5174 0.3576 0.3576 6.0059 6.0059 7.3352 7.3352 7.5318 7.5318 7.8643 7.8643 8.4860 8.4860 9.4185 9.4185 9.7370 9.7370 9.9073 9.9073 10.1145 10.1145 10.3904 10.3904 11.2472 11.2472 12.9062 12.9062 13.4568 13.4568 13.4796 13.4796 13.9309 13.9309 k = 0.0902 0.0902 0.2250 ( 4238 PWs) bands (ev): -50.4024 -50.4024 -50.4022 -50.4022 -24.7101 -24.7101 -24.7085 -24.7085 -16.9925 -16.9925 -16.9823 -16.9823 -16.9799 -16.9799 -16.9786 -16.9786 -2.9266 -2.9266 -1.5332 -1.5332 0.3356 0.3356 5.9778 5.9778 7.4533 7.4533 7.5986 7.5986 7.9326 7.9326 8.5698 8.5698 9.4552 9.4552 9.7144 9.7144 9.9057 9.9057 10.1551 10.1551 10.3451 10.3451 11.1158 11.1158 12.9649 12.9649 13.3655 13.3655 13.4754 13.4754 13.9425 13.9425 k = 0.0820 0.0820 0.2250 ( 4226 PWs) bands (ev): -50.4024 -50.4024 -50.4023 -50.4023 -24.7097 -24.7097 -24.7080 -24.7080 -16.9919 -16.9919 -16.9811 -16.9811 -16.9790 -16.9790 -16.9770 -16.9770 -2.9484 -2.9484 -1.5480 -1.5480 0.3157 0.3157 5.9518 5.9518 7.5708 7.5708 7.6683 7.6683 8.0002 8.0002 8.6468 8.6468 9.4893 9.4893 9.6623 9.6623 9.9233 9.9233 10.1956 10.1956 10.2982 10.2982 10.9923 10.9923 13.0198 13.0198 13.2614 13.2614 13.4977 13.4977 13.9555 13.9555 k = 0.0738 0.0738 0.2250 ( 4226 PWs) bands (ev): -50.4025 -50.4025 -50.4024 -50.4024 -24.7093 -24.7093 -24.7077 -24.7077 -16.9915 -16.9915 -16.9804 -16.9804 -16.9778 -16.9778 -16.9756 -16.9756 -2.9683 -2.9683 -1.5619 -1.5619 0.2979 0.2979 5.9281 5.9281 7.6849 7.6849 7.7426 7.7426 8.0669 8.0669 8.7162 8.7162 9.5210 9.5210 9.5944 9.5944 9.9458 9.9458 10.2321 10.2321 10.2510 10.2510 10.8809 10.8809 13.0541 13.0541 13.1820 13.1820 13.5255 13.5255 13.9675 13.9675 k = 0.0656 0.0656 0.2250 ( 4222 PWs) bands (ev): -50.4025 -50.4025 -50.4024 -50.4024 -24.7090 -24.7090 -24.7073 -24.7073 -16.9912 -16.9912 -16.9800 -16.9800 -16.9765 -16.9765 -16.9743 -16.9743 -2.9862 -2.9862 -1.5746 -1.5746 0.2821 0.2821 5.9067 5.9067 7.7853 7.7853 7.8303 7.8303 8.1325 8.1325 8.7776 8.7776 9.5167 9.5167 9.5521 9.5521 9.9635 9.9635 10.2019 10.2019 10.2636 10.2636 10.7880 10.7880 13.0151 13.0151 13.1794 13.1794 13.5590 13.5590 13.9749 13.9749 k = 0.0574 0.0574 0.2250 ( 4230 PWs) bands (ev): -50.4026 -50.4026 -50.4025 -50.4025 -24.7088 -24.7088 -24.7071 -24.7071 -16.9909 -16.9909 -16.9798 -16.9798 -16.9752 -16.9752 -16.9731 -16.9731 -3.0021 -3.0021 -1.5861 -1.5861 0.2682 0.2682 5.8877 5.8877 7.8647 7.8647 7.9366 7.9366 8.1968 8.1968 8.8306 8.8306 9.4361 9.4361 9.5792 9.5792 9.9687 9.9687 10.1554 10.1554 10.2829 10.2829 10.7218 10.7218 12.9366 12.9366 13.2188 13.2188 13.5985 13.5985 13.9734 13.9734 k = 0.0492 0.0492 0.2250 ( 4242 PWs) bands (ev): -50.4027 -50.4027 -50.4025 -50.4025 -24.7086 -24.7086 -24.7069 -24.7069 -16.9907 -16.9907 -16.9796 -16.9796 -16.9743 -16.9743 -16.9721 -16.9721 -3.0160 -3.0160 -1.5963 -1.5963 0.2563 0.2563 5.8711 5.8711 7.9353 7.9353 8.0463 8.0463 8.2596 8.2596 8.8753 8.8753 9.3526 9.3526 9.6043 9.6043 9.9545 9.9545 10.1111 10.1111 10.2922 10.2922 10.6869 10.6869 12.8582 12.8582 13.2601 13.2601 13.6441 13.6441 13.9609 13.9609 k = 0.0410 0.0410 0.2250 ( 4242 PWs) bands (ev): -50.4027 -50.4027 -50.4026 -50.4026 -24.7084 -24.7084 -24.7067 -24.7067 -16.9905 -16.9905 -16.9794 -16.9794 -16.9733 -16.9733 -16.9712 -16.9712 -3.0278 -3.0278 -1.6051 -1.6051 0.2463 0.2463 5.8570 5.8570 8.0004 8.0004 8.1522 8.1522 8.3207 8.3207 8.9120 8.9120 9.2690 9.2690 9.6264 9.6264 9.9178 9.9178 10.0705 10.0705 10.2977 10.2977 10.6793 10.6793 12.7874 12.7874 13.2959 13.2959 13.6953 13.6953 13.9404 13.9404 k = 0.0328 0.0328 0.2250 ( 4250 PWs) bands (ev): -50.4027 -50.4027 -50.4026 -50.4026 -24.7083 -24.7083 -24.7066 -24.7066 -16.9904 -16.9904 -16.9793 -16.9793 -16.9726 -16.9726 -16.9706 -16.9706 -3.0375 -3.0375 -1.6124 -1.6124 0.2381 0.2381 5.8455 5.8455 8.0587 8.0587 8.2505 8.2505 8.3801 8.3801 8.9408 8.9408 9.1877 9.1877 9.6443 9.6443 9.8647 9.8647 10.0347 10.0347 10.3048 10.3048 10.6882 10.6882 12.7267 12.7267 13.3249 13.3249 13.7505 13.7505 13.9177 13.9177 k = 0.0246 0.0246 0.2250 ( 4248 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7081 -24.7081 -24.7065 -24.7065 -16.9902 -16.9902 -16.9792 -16.9792 -16.9719 -16.9719 -16.9700 -16.9700 -3.0450 -3.0450 -1.6181 -1.6181 0.2318 0.2318 5.8365 5.8365 8.1078 8.1078 8.3369 8.3369 8.4363 8.4363 8.9621 8.9621 9.1123 9.1123 9.6565 9.6565 9.8074 9.8074 10.0051 10.0051 10.3139 10.3139 10.7035 10.7035 12.6777 12.6777 13.3469 13.3469 13.8067 13.8067 13.8983 13.8983 k = 0.0164 0.0164 0.2250 ( 4242 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7080 -24.7080 -24.7064 -24.7064 -16.9901 -16.9901 -16.9791 -16.9791 -16.9714 -16.9714 -16.9695 -16.9695 -3.0505 -3.0505 -1.6222 -1.6222 0.2273 0.2273 5.8300 5.8300 8.1450 8.1450 8.4062 8.4062 8.4860 8.4860 8.9748 8.9748 9.0492 9.0492 9.6601 9.6601 9.7604 9.7604 9.9829 9.9829 10.3226 10.3226 10.7183 10.7183 12.6417 12.6417 13.3622 13.3622 13.8509 13.8509 13.8958 13.8958 k = 0.0082 0.0082 0.2250 ( 4234 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7063 -24.7063 -16.9900 -16.9900 -16.9790 -16.9790 -16.9711 -16.9711 -16.9692 -16.9692 -3.0537 -3.0537 -1.6247 -1.6247 0.2246 0.2246 5.8261 5.8261 8.1682 8.1682 8.4522 8.4522 8.5223 8.5223 8.9736 8.9736 9.0125 9.0125 9.6541 9.6541 9.7353 9.7353 9.9691 9.9691 10.3287 10.3287 10.7286 10.7286 12.6196 12.6196 13.3712 13.3712 13.8562 13.8562 13.9364 13.9364 k = 0.0000 0.0000 0.2250 ( 4218 PWs) bands (ev): -50.4028 -50.4028 -50.4026 -50.4026 -24.7078 -24.7078 -24.7061 -24.7061 -16.9900 -16.9900 -16.9789 -16.9789 -16.9710 -16.9710 -16.9690 -16.9690 -3.0548 -3.0548 -1.6255 -1.6255 0.2237 0.2237 5.8248 5.8248 8.1761 8.1761 8.4685 8.4685 8.5361 8.5361 8.9656 8.9656 9.0059 9.0059 9.6491 9.6491 9.7289 9.7289 9.9644 9.9644 10.3309 10.3309 10.7323 10.7323 12.6122 12.6122 13.3741 13.3741 13.8543 13.8543 13.9778 13.9778 k = 0.0000 0.5000-0.0000 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6182 -1.6182 -1.6182 -1.6182 2.5083 2.5083 2.5083 2.5083 5.4647 5.4647 5.4647 5.4647 8.5209 8.5209 8.5209 8.5209 8.8861 8.8861 8.8861 8.8861 10.4252 10.4252 10.4252 10.4252 11.9055 11.9055 11.9055 11.9055 13.1388 13.1388 13.1388 13.1388 14.1317 14.1317 14.1317 14.1317 k = 0.0000 0.5000 0.0112 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6182 -1.6182 -1.6182 -1.6182 2.5076 2.5076 2.5076 2.5076 5.4672 5.4672 5.4672 5.4672 8.5206 8.5206 8.5206 8.5206 8.8816 8.8816 8.8816 8.8816 10.4266 10.4266 10.4266 10.4266 11.9070 11.9070 11.9070 11.9070 13.1389 13.1389 13.1389 13.1389 14.1367 14.1367 14.1367 14.1367 k = 0.0000 0.5000 0.0225 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6180 -1.6180 -1.6180 -1.6180 2.5054 2.5054 2.5054 2.5054 5.4747 5.4747 5.4747 5.4747 8.5197 8.5197 8.5197 8.5197 8.8684 8.8684 8.8684 8.8684 10.4305 10.4305 10.4305 10.4305 11.9117 11.9117 11.9117 11.9117 13.1394 13.1394 13.1394 13.1394 14.1516 14.1516 14.1516 14.1516 k = 0.0000 0.5000 0.0337 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6178 -1.6178 -1.6178 -1.6178 2.5017 2.5017 2.5017 2.5017 5.4871 5.4871 5.4871 5.4871 8.5180 8.5180 8.5180 8.5180 8.8469 8.8469 8.8469 8.8469 10.4367 10.4367 10.4367 10.4367 11.9193 11.9193 11.9193 11.9193 13.1405 13.1405 13.1405 13.1405 14.1756 14.1756 14.1756 14.1756 k = 0.0000 0.5000 0.0450 ( 4256 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6174 -1.6174 -1.6174 -1.6174 2.4968 2.4968 2.4968 2.4968 5.5042 5.5042 5.5042 5.5042 8.5156 8.5156 8.5156 8.5156 8.8181 8.8181 8.8181 8.8181 10.4449 10.4449 10.4449 10.4449 11.9299 11.9299 11.9299 11.9299 13.1425 13.1425 13.1425 13.1425 14.2079 14.2079 14.2079 14.2079 k = 0.0000 0.5000 0.0562 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9627 -16.9627 -16.9627 -16.9627 -1.6170 -1.6170 -1.6170 -1.6170 2.4907 2.4907 2.4907 2.4907 5.5256 5.5256 5.5256 5.5256 8.5122 8.5122 8.5122 8.5122 8.7829 8.7829 8.7829 8.7829 10.4544 10.4544 10.4544 10.4544 11.9432 11.9432 11.9432 11.9432 13.1457 13.1457 13.1457 13.1457 14.2474 14.2474 14.2474 14.2474 k = 0.0000 0.5000 0.0675 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0675 -17.0675 -17.0675 -17.0675 -16.9626 -16.9626 -16.9626 -16.9626 -1.6165 -1.6165 -1.6165 -1.6165 2.4836 2.4836 2.4836 2.4836 5.5510 5.5510 5.5510 5.5510 8.5074 8.5074 8.5074 8.5074 8.7430 8.7430 8.7430 8.7430 10.4648 10.4648 10.4648 10.4648 11.9591 11.9591 11.9591 11.9591 13.1505 13.1505 13.1505 13.1505 14.2924 14.2924 14.2924 14.2924 k = 0.0000 0.5000 0.0787 ( 4238 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0675 -17.0675 -17.0675 -17.0675 -16.9625 -16.9625 -16.9625 -16.9625 -1.6160 -1.6160 -1.6160 -1.6160 2.4757 2.4757 2.4757 2.4757 5.5799 5.5799 5.5799 5.5799 8.5005 8.5005 8.5005 8.5005 8.7001 8.7001 8.7001 8.7001 10.4756 10.4756 10.4756 10.4756 11.9773 11.9773 11.9773 11.9773 13.1572 13.1572 13.1572 13.1572 14.3412 14.3412 14.3412 14.3412 k = 0.0000 0.5000 0.0900 ( 4238 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0675 -17.0675 -17.0675 -17.0675 -16.9625 -16.9625 -16.9625 -16.9625 -1.6154 -1.6154 -1.6154 -1.6154 2.4672 2.4672 2.4672 2.4672 5.6117 5.6117 5.6117 5.6117 8.4899 8.4899 8.4899 8.4899 8.6571 8.6571 8.6571 8.6571 10.4863 10.4863 10.4863 10.4863 11.9974 11.9974 11.9974 11.9974 13.1657 13.1657 13.1657 13.1657 14.3912 14.3912 14.3912 14.3912 k = 0.0000 0.5000 0.1012 ( 4232 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0675 -17.0675 -17.0675 -17.0675 -16.9625 -16.9625 -16.9625 -16.9625 -1.6147 -1.6147 -1.6147 -1.6147 2.4584 2.4584 2.4584 2.4584 5.6459 5.6459 5.6459 5.6459 8.4730 8.4730 8.4730 8.4730 8.6177 8.6177 8.6177 8.6177 10.4966 10.4966 10.4966 10.4966 12.0191 12.0191 12.0191 12.0191 13.1760 13.1760 13.1760 13.1760 14.4389 14.4389 14.4389 14.4389 k = 0.0000 0.5000 0.1125 ( 4232 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0676 -17.0676 -17.0676 -17.0676 -16.9624 -16.9624 -16.9624 -16.9624 -1.6141 -1.6141 -1.6141 -1.6141 2.4495 2.4495 2.4495 2.4495 5.6817 5.6817 5.6817 5.6817 8.4466 8.4466 8.4466 8.4466 8.5866 8.5866 8.5866 8.5866 10.5062 10.5062 10.5062 10.5062 12.0420 12.0420 12.0420 12.0420 13.1880 13.1880 13.1880 13.1880 14.4776 14.4776 14.4776 14.4776 k = 0.0000 0.5000 0.1237 ( 4240 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0676 -17.0676 -17.0676 -17.0676 -16.9624 -16.9624 -16.9624 -16.9624 -1.6134 -1.6134 -1.6134 -1.6134 2.4406 2.4406 2.4406 2.4406 5.7184 5.7184 5.7184 5.7184 8.4101 8.4101 8.4101 8.4101 8.5654 8.5654 8.5654 8.5654 10.5149 10.5149 10.5149 10.5149 12.0657 12.0657 12.0657 12.0657 13.2012 13.2012 13.2012 13.2012 14.4948 14.4948 14.4948 14.4948 k = 0.0000 0.5000 0.1350 ( 4240 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0676 -17.0676 -17.0676 -17.0676 -16.9624 -16.9624 -16.9624 -16.9624 -1.6128 -1.6128 -1.6128 -1.6128 2.4321 2.4321 2.4321 2.4321 5.7551 5.7551 5.7551 5.7551 8.3669 8.3669 8.3669 8.3669 8.5521 8.5521 8.5521 8.5521 10.5227 10.5227 10.5227 10.5227 12.0894 12.0894 12.0894 12.0894 13.2153 13.2153 13.2153 13.2153 14.4794 14.4794 14.4794 14.4794 k = 0.0000 0.5000 0.1462 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9625 -16.9625 -16.9625 -16.9625 -1.6122 -1.6122 -1.6122 -1.6122 2.4240 2.4240 2.4240 2.4240 5.7909 5.7909 5.7909 5.7909 8.3215 8.3215 8.3215 8.3215 8.5435 8.5435 8.5435 8.5435 10.5294 10.5294 10.5294 10.5294 12.1127 12.1127 12.1127 12.1127 13.2298 13.2298 13.2298 13.2298 14.4407 14.4407 14.4407 14.4407 k = 0.0000 0.5000 0.1575 ( 4244 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6117 -1.6117 -1.6117 -1.6117 2.4166 2.4166 2.4166 2.4166 5.8248 5.8248 5.8248 5.8248 8.2770 8.2770 8.2770 8.2770 8.5377 8.5377 8.5377 8.5377 10.5351 10.5351 10.5351 10.5351 12.1349 12.1349 12.1349 12.1349 13.2439 13.2439 13.2439 13.2439 14.3948 14.3948 14.3948 14.3948 k = 0.0000 0.5000 0.1687 ( 4244 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6112 -1.6112 -1.6112 -1.6112 2.4101 2.4101 2.4101 2.4101 5.8559 5.8559 5.8559 5.8559 8.2359 8.2359 8.2359 8.2359 8.5336 8.5336 8.5336 8.5336 10.5398 10.5398 10.5398 10.5398 12.1553 12.1553 12.1553 12.1553 13.2572 13.2572 13.2572 13.2572 14.3502 14.3502 14.3502 14.3502 k = 0.0000 0.5000 0.1800 ( 4240 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6108 -1.6108 -1.6108 -1.6108 2.4046 2.4046 2.4046 2.4046 5.8830 5.8830 5.8830 5.8830 8.1998 8.1998 8.1998 8.1998 8.5306 8.5306 8.5306 8.5306 10.5436 10.5436 10.5436 10.5436 12.1733 12.1733 12.1733 12.1733 13.2691 13.2691 13.2691 13.2691 14.3107 14.3107 14.3107 14.3107 k = 0.0000 0.5000 0.1912 ( 4240 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6104 -1.6104 -1.6104 -1.6104 2.4002 2.4002 2.4002 2.4002 5.9054 5.9054 5.9054 5.9054 8.1702 8.1702 8.1702 8.1702 8.5284 8.5284 8.5284 8.5284 10.5464 10.5464 10.5464 10.5464 12.1880 12.1880 12.1880 12.1880 13.2789 13.2789 13.2789 13.2789 14.2785 14.2785 14.2785 14.2785 k = 0.0000 0.5000 0.2025 ( 4240 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7216 -24.7216 -24.7216 -24.7216 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6102 -1.6102 -1.6102 -1.6102 2.3969 2.3969 2.3969 2.3969 5.9220 5.9220 5.9220 5.9220 8.1482 8.1482 8.1482 8.1482 8.5270 8.5270 8.5270 8.5270 10.5484 10.5484 10.5484 10.5484 12.1990 12.1990 12.1990 12.1990 13.2863 13.2863 13.2863 13.2863 14.2548 14.2548 14.2548 14.2548 k = 0.0000 0.5000 0.2137 ( 4252 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6100 -1.6100 -1.6100 -1.6100 2.3950 2.3950 2.3950 2.3950 5.9323 5.9323 5.9323 5.9323 8.1347 8.1347 8.1347 8.1347 8.5261 8.5261 8.5261 8.5261 10.5496 10.5496 10.5496 10.5496 12.2059 12.2059 12.2059 12.2059 13.2909 13.2909 13.2909 13.2909 14.2402 14.2402 14.2402 14.2402 k = 0.0000 0.5000 0.2250 ( 4248 PWs) bands (ev): -50.4002 -50.4002 -50.4002 -50.4002 -24.7217 -24.7217 -24.7217 -24.7217 -17.0677 -17.0677 -17.0677 -17.0677 -16.9624 -16.9624 -16.9624 -16.9624 -1.6100 -1.6100 -1.6100 -1.6100 2.3943 2.3943 2.3943 2.3943 5.9358 5.9358 5.9358 5.9358 8.1301 8.1301 8.1301 8.1301 8.5258 8.5258 8.5258 8.5258 10.5500 10.5500 10.5500 10.5500 12.2082 12.2082 12.2082 12.2082 13.2924 13.2924 13.2924 13.2924 14.2353 14.2353 14.2353 14.2353 k = 0.5000 0.5000-0.0000 ( 4236 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4449 -1.4449 -1.4449 -1.4449 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5771 6.5771 6.5771 6.5771 7.8293 7.8293 7.8293 7.8293 8.5124 8.5124 8.5124 8.5124 10.1398 10.1398 10.1398 10.1398 15.0940 15.0940 15.0940 15.0940 15.4369 15.4369 15.4369 15.4369 k = 0.5000 0.5000 0.0112 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4449 -1.4449 -1.4449 -1.4449 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5731 6.5731 6.5731 6.5731 7.8353 7.8353 7.8353 7.8353 8.5130 8.5130 8.5130 8.5130 10.1393 10.1393 10.1393 10.1393 15.0917 15.0917 15.0917 15.0917 15.4288 15.4288 15.4288 15.4288 k = 0.5000 0.5000 0.0225 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4448 -1.4448 -1.4448 -1.4448 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5614 6.5614 6.5614 6.5614 7.8528 7.8528 7.8528 7.8528 8.5148 8.5148 8.5148 8.5148 10.1377 10.1377 10.1377 10.1377 15.0839 15.0839 15.0839 15.0839 15.4008 15.4008 15.4008 15.4008 k = 0.5000 0.5000 0.0337 ( 4216 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4446 -1.4446 -1.4446 -1.4446 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5429 6.5429 6.5429 6.5429 7.8807 7.8807 7.8807 7.8807 8.5178 8.5178 8.5178 8.5178 10.1352 10.1352 10.1352 10.1352 15.0660 15.0660 15.0660 15.0660 15.3471 15.3471 15.3471 15.3471 k = 0.5000 0.5000 0.0450 ( 4212 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7342 -24.7342 -24.7342 -24.7342 -17.0891 -17.0891 -17.0891 -17.0891 -16.9988 -16.9988 -16.9988 -16.9988 -1.4444 -1.4444 -1.4444 -1.4444 4.1942 4.1942 4.1942 4.1942 5.8468 5.8468 5.8468 5.8468 6.5186 6.5186 6.5186 6.5186 7.9177 7.9177 7.9177 7.9177 8.5221 8.5221 8.5221 8.5221 10.1318 10.1318 10.1318 10.1318 15.0270 15.0270 15.0270 15.0270 15.2784 15.2784 15.2784 15.2784 k = 0.5000 0.5000 0.0562 ( 4212 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7342 -24.7342 -24.7342 -24.7342 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4442 -1.4442 -1.4442 -1.4442 4.1942 4.1942 4.1942 4.1942 5.8467 5.8467 5.8467 5.8467 6.4901 6.4901 6.4901 6.4901 7.9619 7.9619 7.9619 7.9619 8.5280 8.5280 8.5280 8.5280 10.1275 10.1275 10.1275 10.1275 14.9513 14.9513 14.9513 14.9513 15.2230 15.2230 15.2230 15.2230 k = 0.5000 0.5000 0.0675 ( 4212 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7342 -24.7342 -24.7342 -24.7342 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4438 -1.4438 -1.4438 -1.4438 4.1942 4.1942 4.1942 4.1942 5.8466 5.8466 5.8466 5.8466 6.4587 6.4587 6.4587 6.4587 8.0114 8.0114 8.0114 8.0114 8.5356 8.5356 8.5356 8.5356 10.1226 10.1226 10.1226 10.1226 14.8400 14.8400 14.8400 14.8400 15.1920 15.1920 15.1920 15.1920 k = 0.5000 0.5000 0.0787 ( 4200 PWs) bands (ev): -50.3976 -50.3976 -50.3976 -50.3976 -24.7342 -24.7342 -24.7342 -24.7342 -17.0891 -17.0891 -17.0891 -17.0891 -16.9987 -16.9987 -16.9987 -16.9987 -1.4435 -1.4435 -1.4435 -1.4435 4.1942 4.1942 4.1942 4.1942 5.8465 5.8465 5.8465 5.8465 6.4255 6.4255 6.4255 6.4255 8.0641 8.0641 8.0641 8.0641 8.5453 8.5453 8.5453 8.5453 10.1170 10.1170 10.1170 10.1170 14.7097 14.7097 14.7097 14.7097 15.1762 15.1762 15.1762 15.1762 k = 0.5000 0.5000 0.0900 ( 4216 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4431 -1.4431 -1.4431 -1.4431 4.1942 4.1942 4.1942 4.1942 5.8464 5.8464 5.8464 5.8464 6.3918 6.3918 6.3918 6.3918 8.1179 8.1179 8.1179 8.1179 8.5576 8.5576 8.5576 8.5576 10.1109 10.1109 10.1109 10.1109 14.5727 14.5727 14.5727 14.5727 15.1677 15.1677 15.1677 15.1677 k = 0.5000 0.5000 0.1012 ( 4224 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4427 -1.4427 -1.4427 -1.4427 4.1942 4.1942 4.1942 4.1942 5.8463 5.8463 5.8463 5.8463 6.3583 6.3583 6.3583 6.3583 8.1708 8.1708 8.1708 8.1708 8.5731 8.5731 8.5731 8.5731 10.1045 10.1045 10.1045 10.1045 14.4355 14.4355 14.4355 14.4355 15.1626 15.1626 15.1626 15.1626 k = 0.5000 0.5000 0.1125 ( 4216 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4423 -1.4423 -1.4423 -1.4423 4.1942 4.1942 4.1942 4.1942 5.8461 5.8461 5.8461 5.8461 6.3260 6.3260 6.3260 6.3260 8.2205 8.2205 8.2205 8.2205 8.5924 8.5924 8.5924 8.5924 10.0980 10.0980 10.0980 10.0980 14.3019 14.3019 14.3019 14.3019 15.1594 15.1594 15.1594 15.1594 k = 0.5000 0.5000 0.1237 ( 4224 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7343 -24.7343 -24.7343 -24.7343 -17.0892 -17.0892 -17.0892 -17.0892 -16.9988 -16.9988 -16.9988 -16.9988 -1.4419 -1.4419 -1.4419 -1.4419 4.1942 4.1942 4.1942 4.1942 5.8458 5.8458 5.8458 5.8458 6.2953 6.2953 6.2953 6.2953 8.2651 8.2651 8.2651 8.2651 8.6160 8.6160 8.6160 8.6160 10.0914 10.0914 10.0914 10.0914 14.1744 14.1744 14.1744 14.1744 15.1573 15.1573 15.1573 15.1573 k = 0.5000 0.5000 0.1350 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4415 -1.4415 -1.4415 -1.4415 4.1942 4.1942 4.1942 4.1942 5.8456 5.8456 5.8456 5.8456 6.2669 6.2669 6.2669 6.2669 8.3033 8.3033 8.3033 8.3033 8.6440 8.6440 8.6440 8.6440 10.0850 10.0850 10.0850 10.0850 14.0548 14.0548 14.0548 14.0548 15.1558 15.1558 15.1558 15.1558 k = 0.5000 0.5000 0.1462 ( 4240 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4412 -1.4412 -1.4412 -1.4412 4.1942 4.1942 4.1942 4.1942 5.8453 5.8453 5.8453 5.8453 6.2410 6.2410 6.2410 6.2410 8.3345 8.3345 8.3345 8.3345 8.6754 8.6754 8.6754 8.6754 10.0789 10.0789 10.0789 10.0789 13.9448 13.9448 13.9448 13.9448 15.1548 15.1548 15.1548 15.1548 k = 0.5000 0.5000 0.1575 ( 4240 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4408 -1.4408 -1.4408 -1.4408 4.1942 4.1942 4.1942 4.1942 5.8450 5.8450 5.8450 5.8450 6.2181 6.2181 6.2181 6.2181 8.3589 8.3589 8.3589 8.3589 8.7088 8.7088 8.7088 8.7088 10.0733 10.0733 10.0733 10.0733 13.8460 13.8460 13.8460 13.8460 15.1541 15.1541 15.1541 15.1541 k = 0.5000 0.5000 0.1687 ( 4240 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4405 -1.4405 -1.4405 -1.4405 4.1942 4.1942 4.1942 4.1942 5.8447 5.8447 5.8447 5.8447 6.1984 6.1984 6.1984 6.1984 8.3776 8.3776 8.3776 8.3776 8.7417 8.7417 8.7417 8.7417 10.0683 10.0683 10.0683 10.0683 13.7596 13.7596 13.7596 13.7596 15.1536 15.1536 15.1536 15.1536 k = 0.5000 0.5000 0.1800 ( 4240 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4402 -1.4402 -1.4402 -1.4402 4.1942 4.1942 4.1942 4.1942 5.8444 5.8444 5.8444 5.8444 6.1820 6.1820 6.1820 6.1820 8.3913 8.3913 8.3913 8.3913 8.7722 8.7722 8.7722 8.7722 10.0640 10.0640 10.0640 10.0640 13.6869 13.6869 13.6869 13.6869 15.1533 15.1533 15.1533 15.1533 k = 0.5000 0.5000 0.1912 ( 4248 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7345 -24.7345 -24.7345 -24.7345 -17.0893 -17.0893 -17.0893 -17.0893 -16.9990 -16.9990 -16.9990 -16.9990 -1.4400 -1.4400 -1.4400 -1.4400 4.1942 4.1942 4.1942 4.1942 5.8441 5.8441 5.8441 5.8441 6.1692 6.1692 6.1692 6.1692 8.4012 8.4012 8.4012 8.4012 8.7980 8.7980 8.7980 8.7980 10.0606 10.0606 10.0606 10.0606 13.6291 13.6291 13.6291 13.6291 15.1530 15.1530 15.1530 15.1530 k = 0.5000 0.5000 0.2025 ( 4248 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7345 -24.7345 -24.7345 -24.7345 -17.0893 -17.0893 -17.0893 -17.0893 -16.9989 -16.9989 -16.9989 -16.9989 -1.4399 -1.4399 -1.4399 -1.4399 4.1942 4.1942 4.1942 4.1942 5.8439 5.8439 5.8439 5.8439 6.1599 6.1599 6.1599 6.1599 8.4078 8.4078 8.4078 8.4078 8.8176 8.8176 8.8176 8.8176 10.0580 10.0580 10.0580 10.0580 13.5871 13.5871 13.5871 13.5871 15.1529 15.1529 15.1529 15.1529 k = 0.5000 0.5000 0.2137 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4398 -1.4398 -1.4398 -1.4398 4.1942 4.1942 4.1942 4.1942 5.8438 5.8438 5.8438 5.8438 6.1544 6.1544 6.1544 6.1544 8.4116 8.4116 8.4116 8.4116 8.8299 8.8299 8.8299 8.8299 10.0565 10.0565 10.0565 10.0565 13.5616 13.5616 13.5616 13.5616 15.1528 15.1528 15.1528 15.1528 k = 0.5000 0.5000 0.2250 ( 4232 PWs) bands (ev): -50.3977 -50.3977 -50.3977 -50.3977 -24.7344 -24.7344 -24.7344 -24.7344 -17.0892 -17.0892 -17.0892 -17.0892 -16.9989 -16.9989 -16.9989 -16.9989 -1.4398 -1.4398 -1.4398 -1.4398 4.1942 4.1942 4.1942 4.1942 5.8437 5.8437 5.8437 5.8437 6.1525 6.1525 6.1525 6.1525 8.4128 8.4128 8.4128 8.4128 8.8341 8.8341 8.8341 8.8341 10.0560 10.0560 10.0560 10.0560 13.5530 13.5530 13.5530 13.5530 15.1528 15.1528 15.1528 15.1528 Writing output data file HfGeSe.save init_run : 0.20s CPU 0.36s WALL ( 1 calls) electrons : 146.23s CPU 148.99s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 146.21s CPU 148.97s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.03s CPU 0.05s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.04s CPU 0.06s WALL ( 363 calls) cegterg : 132.42s CPU 134.44s WALL ( 530 calls) Called by sum_band: Called by *egterg: h_psi : 58.93s CPU 60.50s WALL ( 8303 calls) s_psi : 4.49s CPU 4.34s WALL ( 8303 calls) g_psi : 0.34s CPU 0.26s WALL ( 7410 calls) cdiaghg : 59.40s CPU 60.33s WALL ( 7773 calls) cegterg:over : 6.43s CPU 6.56s WALL ( 7410 calls) cegterg:upda : 5.76s CPU 5.73s WALL ( 7410 calls) cegterg:last : 2.95s CPU 2.98s WALL ( 1256 calls) cdiaghg:chol : 3.30s CPU 3.40s WALL ( 7773 calls) cdiaghg:inve : 2.19s CPU 2.27s WALL ( 7773 calls) cdiaghg:para : 3.53s CPU 3.66s WALL ( 15546 calls) Called by h_psi: h_psi:vloc : 48.20s CPU 49.34s WALL ( 8303 calls) h_psi:vnl : 10.46s CPU 10.90s WALL ( 8303 calls) add_vuspsi : 5.16s CPU 5.24s WALL ( 8303 calls) General routines calbec : 5.28s CPU 5.63s WALL ( 8303 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 44.44s CPU 45.46s WALL ( 869396 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.19s CPU 0.32s WALL ( 726 calls) Parallel routines fft_scatter : 23.28s CPU 24.00s WALL ( 869419 calls) PWSCF : 2m43.43s CPU 2m57.24s WALL This run was terminated on: 19:10:14 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=