Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 19:53:58 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: ./LiHPd.save/ file Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 5S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: one sub-group per k-point group (pool) will be used scalapack distributed-memory algorithm (size of sub-group: 4* 4 procs) Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 33 25 7 1259 821 133 Max 34 26 9 1268 840 136 Sum 1201 917 277 45425 29821 4855 bravais-lattice index = 14 lattice parameter (alat) = 5.2837 a.u. unit-cell volume = 211.2451 (a.u.)^3 number of atoms/cell = 3 number of atomic types = 3 number of electrons = 22.00 number of Kohn-Sham states= 30 kinetic-energy cutoff = 103.0000 Ry charge density cutoff = 545.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 5.283674 celldm(2)= 1.000000 celldm(3)= 1.432117 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 1.432117 ) 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 0.698267 ) PseudoPot. # 1 for H read from file: /users/gautes/Pseudo/H.rel-pbe-rrkjus_psl.1.0.0.UPF MD5 check sum: 34277445e838504cb8bc9abe3bdfc49d Pseudo is Ultrasoft, Zval = 1.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 929 points, 2 beta functions with: l(1) = 0 l(2) = 0 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Li read from file: /users/gautes/Pseudo/Li.rel-pbe-s-rrkjus_psl.1.0.0.UPF MD5 check sum: 9da6379fed0e9079eb53e17c51ce5ca0 Pseudo is Ultrasoft, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1017 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Pd read from file: /users/gautes/Pseudo/Pd.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 7926b04c0aa9b348bf6cb39d90ce6236 Pseudo is Ultrasoft + core correction, Zval = 18.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1235 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential H 1.00 1.00790 H( 1.00) Li 3.00 6.94100 Li( 1.00) Pd 18.00 106.42000 Pd( 1.00) 16 Sym. Ops., with inversion, found 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 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 180 deg rotation - cart. axis [0,1,0] cryst. s( 3) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 180 deg rotation - cart. axis [1,0,0] cryst. s( 4) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 5 180 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 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s( 6) = ( -0.0000000 -1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 7 90 deg rotation - cart. axis [0,0,-1] cryst. s( 7) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 1 ) cart. s( 7) = ( -0.0000000 1.0000000 0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 8 90 deg rotation - cart. axis [0,0,1] cryst. s( 8) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 1 ) cart. s( 8) = ( 0.0000000 -1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s(10) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 11 inv. 180 deg rotation - cart. axis [0,1,0] cryst. s(11) = ( 1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s(11) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 12 inv. 180 deg rotation - cart. axis [1,0,0] cryst. s(12) = ( -1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s(12) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) 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 ) ( 1 0 0 ) ( 0 0 1 ) cart. s(14) = ( 0.0000000 1.0000000 0.0000000 ) ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [0,0,-1] cryst. s(15) = ( 0 1 0 ) ( -1 0 0 ) ( 0 0 -1 ) cart. s(15) = ( 0.0000000 -1.0000000 -0.0000000 ) ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [0,0,1] cryst. s(16) = ( 0 -1 0 ) ( 1 0 0 ) ( 0 0 -1 ) cart. s(16) = ( -0.0000000 1.0000000 -0.0000000 ) ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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= 517 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 2) = ( 0.0000000 0.0087719 -0.0000000), wk = 0.0019342 k( 3) = ( 0.0000000 0.0175439 -0.0000000), wk = 0.0019342 k( 4) = ( 0.0000000 0.0263158 -0.0000000), wk = 0.0019342 k( 5) = ( 0.0000000 0.0350877 -0.0000000), wk = 0.0019342 k( 6) = ( 0.0000000 0.0438597 -0.0000000), wk = 0.0019342 k( 7) = ( 0.0000000 0.0526316 -0.0000000), wk = 0.0019342 k( 8) = ( 0.0000000 0.0614035 -0.0000000), wk = 0.0019342 k( 9) = ( 0.0000000 0.0701754 -0.0000000), wk = 0.0019342 k( 10) = ( 0.0000000 0.0789474 -0.0000000), wk = 0.0019342 k( 11) = ( 0.0000000 0.0877193 -0.0000000), wk = 0.0019342 k( 12) = ( 0.0000000 0.0964912 -0.0000000), wk = 0.0019342 k( 13) = ( 0.0000000 0.1052632 -0.0000000), wk = 0.0019342 k( 14) = ( 0.0000000 0.1140351 -0.0000000), wk = 0.0019342 k( 15) = ( 0.0000000 0.1228070 -0.0000000), wk = 0.0019342 k( 16) = ( 0.0000000 0.1315790 -0.0000000), wk = 0.0019342 k( 17) = ( 0.0000000 0.1403509 -0.0000000), wk = 0.0019342 k( 18) = ( 0.0000000 0.1491228 -0.0000000), wk = 0.0019342 k( 19) = ( 0.0000000 0.1578947 -0.0000000), wk = 0.0019342 k( 20) = ( 0.0000000 0.1666667 -0.0000000), wk = 0.0019342 k( 21) = ( 0.0000000 0.1754386 -0.0000000), wk = 0.0019342 k( 22) = ( 0.0000000 0.1842105 -0.0000000), wk = 0.0019342 k( 23) = ( 0.0000000 0.1929825 -0.0000000), wk = 0.0019342 k( 24) = ( 0.0000000 0.2017544 -0.0000000), wk = 0.0019342 k( 25) = ( 0.0000000 0.2105263 -0.0000000), wk = 0.0019342 k( 26) = ( 0.0000000 0.2192983 -0.0000000), wk = 0.0019342 k( 27) = ( 0.0000000 0.2280702 -0.0000000), wk = 0.0019342 k( 28) = ( 0.0000000 0.2368421 -0.0000000), wk = 0.0019342 k( 29) = ( 0.0000000 0.2456140 -0.0000000), wk = 0.0019342 k( 30) = ( 0.0000000 0.2543860 -0.0000000), wk = 0.0019342 k( 31) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0019342 k( 32) = ( 0.0000000 0.2719298 -0.0000000), wk = 0.0019342 k( 33) = ( 0.0000000 0.2807018 -0.0000000), wk = 0.0019342 k( 34) = ( 0.0000000 0.2894737 -0.0000000), wk = 0.0019342 k( 35) = ( 0.0000000 0.2982456 -0.0000000), wk = 0.0019342 k( 36) = ( 0.0000000 0.3070175 -0.0000000), wk = 0.0019342 k( 37) = ( 0.0000000 0.3157895 -0.0000000), wk = 0.0019342 k( 38) = ( 0.0000000 0.3245614 -0.0000000), wk = 0.0019342 k( 39) = ( 0.0000000 0.3333333 -0.0000000), wk = 0.0019342 k( 40) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0019342 k( 41) = ( 0.0000000 0.3508772 -0.0000000), wk = 0.0019342 k( 42) = ( 0.0000000 0.3596491 -0.0000000), wk = 0.0019342 k( 43) = ( 0.0000000 0.3684211 -0.0000000), wk = 0.0019342 k( 44) = ( 0.0000000 0.3771930 -0.0000000), wk = 0.0019342 k( 45) = ( 0.0000000 0.3859649 -0.0000000), wk = 0.0019342 k( 46) = ( 0.0000000 0.3947368 -0.0000000), wk = 0.0019342 k( 47) = ( 0.0000000 0.4035088 -0.0000000), wk = 0.0019342 k( 48) = ( 0.0000000 0.4122807 -0.0000000), wk = 0.0019342 k( 49) = ( 0.0000000 0.4210526 -0.0000000), wk = 0.0019342 k( 50) = ( 0.0000000 0.4298246 -0.0000000), wk = 0.0019342 k( 51) = ( 0.0000000 0.4385965 -0.0000000), wk = 0.0019342 k( 52) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0019342 k( 53) = ( 0.0000000 0.4561404 -0.0000000), wk = 0.0019342 k( 54) = ( 0.0000000 0.4649123 -0.0000000), wk = 0.0019342 k( 55) = ( 0.0000000 0.4736842 -0.0000000), wk = 0.0019342 k( 56) = ( 0.0000000 0.4824561 -0.0000000), wk = 0.0019342 k( 57) = ( 0.0000000 0.4912281 -0.0000000), wk = 0.0019342 k( 58) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0019342 k( 59) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0019342 k( 60) = ( 0.0087719 0.5000000 -0.0000000), wk = 0.0019342 k( 61) = ( 0.0175439 0.5000000 -0.0000000), wk = 0.0019342 k( 62) = ( 0.0263158 0.5000000 -0.0000000), wk = 0.0019342 k( 63) = ( 0.0350877 0.5000000 -0.0000000), wk = 0.0019342 k( 64) = ( 0.0438597 0.5000000 -0.0000000), wk = 0.0019342 k( 65) = ( 0.0526316 0.5000000 -0.0000000), wk = 0.0019342 k( 66) = ( 0.0614035 0.5000000 -0.0000000), wk = 0.0019342 k( 67) = ( 0.0701754 0.5000000 -0.0000000), wk = 0.0019342 k( 68) = ( 0.0789474 0.5000000 -0.0000000), wk = 0.0019342 k( 69) = ( 0.0877193 0.5000000 -0.0000000), wk = 0.0019342 k( 70) = ( 0.0964912 0.5000000 -0.0000000), wk = 0.0019342 k( 71) = ( 0.1052632 0.5000000 -0.0000000), wk = 0.0019342 k( 72) = ( 0.1140351 0.5000000 -0.0000000), wk = 0.0019342 k( 73) = ( 0.1228070 0.5000000 -0.0000000), wk = 0.0019342 k( 74) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0019342 k( 75) = ( 0.1403509 0.5000000 -0.0000000), wk = 0.0019342 k( 76) = ( 0.1491228 0.5000000 -0.0000000), wk = 0.0019342 k( 77) = ( 0.1578947 0.5000000 -0.0000000), wk = 0.0019342 k( 78) = ( 0.1666667 0.5000000 -0.0000000), wk = 0.0019342 k( 79) = ( 0.1754386 0.5000000 -0.0000000), wk = 0.0019342 k( 80) = ( 0.1842105 0.5000000 -0.0000000), wk = 0.0019342 k( 81) = ( 0.1929825 0.5000000 -0.0000000), wk = 0.0019342 k( 82) = ( 0.2017544 0.5000000 -0.0000000), wk = 0.0019342 k( 83) = ( 0.2105263 0.5000000 -0.0000000), wk = 0.0019342 k( 84) = ( 0.2192983 0.5000000 -0.0000000), wk = 0.0019342 k( 85) = ( 0.2280702 0.5000000 -0.0000000), wk = 0.0019342 k( 86) = ( 0.2368421 0.5000000 -0.0000000), wk = 0.0019342 k( 87) = ( 0.2456140 0.5000000 -0.0000000), wk = 0.0019342 k( 88) = ( 0.2543860 0.5000000 -0.0000000), wk = 0.0019342 k( 89) = ( 0.2631579 0.5000000 -0.0000000), wk = 0.0019342 k( 90) = ( 0.2719298 0.5000000 -0.0000000), wk = 0.0019342 k( 91) = ( 0.2807018 0.5000000 -0.0000000), wk = 0.0019342 k( 92) = ( 0.2894737 0.5000000 -0.0000000), wk = 0.0019342 k( 93) = ( 0.2982456 0.5000000 -0.0000000), wk = 0.0019342 k( 94) = ( 0.3070175 0.5000000 -0.0000000), wk = 0.0019342 k( 95) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0019342 k( 96) = ( 0.3245614 0.5000000 -0.0000000), wk = 0.0019342 k( 97) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0019342 k( 98) = ( 0.3421053 0.5000000 -0.0000000), wk = 0.0019342 k( 99) = ( 0.3508772 0.5000000 -0.0000000), wk = 0.0019342 k( 100) = ( 0.3596491 0.5000000 -0.0000000), wk = 0.0019342 k( 101) = ( 0.3684211 0.5000000 -0.0000000), wk = 0.0019342 k( 102) = ( 0.3771930 0.5000000 -0.0000000), wk = 0.0019342 k( 103) = ( 0.3859649 0.5000000 -0.0000000), wk = 0.0019342 k( 104) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0019342 k( 105) = ( 0.4035088 0.5000000 -0.0000000), wk = 0.0019342 k( 106) = ( 0.4122807 0.5000000 -0.0000000), wk = 0.0019342 k( 107) = ( 0.4210526 0.5000000 -0.0000000), wk = 0.0019342 k( 108) = ( 0.4298246 0.5000000 -0.0000000), wk = 0.0019342 k( 109) = ( 0.4385965 0.5000000 -0.0000000), wk = 0.0019342 k( 110) = ( 0.4473684 0.5000000 -0.0000000), wk = 0.0019342 k( 111) = ( 0.4561404 0.5000000 -0.0000000), wk = 0.0019342 k( 112) = ( 0.4649123 0.5000000 -0.0000000), wk = 0.0019342 k( 113) = ( 0.4736842 0.5000000 -0.0000000), wk = 0.0019342 k( 114) = ( 0.4824561 0.5000000 -0.0000000), wk = 0.0019342 k( 115) = ( 0.4912281 0.5000000 -0.0000000), wk = 0.0019342 k( 116) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0019342 k( 117) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0019342 k( 118) = ( 0.4937500 0.4937500 -0.0000000), wk = 0.0019342 k( 119) = ( 0.4875000 0.4875000 -0.0000000), wk = 0.0019342 k( 120) = ( 0.4812500 0.4812500 -0.0000000), wk = 0.0019342 k( 121) = ( 0.4750000 0.4750000 -0.0000000), wk = 0.0019342 k( 122) = ( 0.4687500 0.4687500 -0.0000000), wk = 0.0019342 k( 123) = ( 0.4625000 0.4625000 -0.0000000), wk = 0.0019342 k( 124) = ( 0.4562500 0.4562500 -0.0000000), wk = 0.0019342 k( 125) = ( 0.4500000 0.4500000 -0.0000000), wk = 0.0019342 k( 126) = ( 0.4437500 0.4437500 -0.0000000), wk = 0.0019342 k( 127) = ( 0.4375000 0.4375000 -0.0000000), wk = 0.0019342 k( 128) = ( 0.4312500 0.4312500 -0.0000000), wk = 0.0019342 k( 129) = ( 0.4250000 0.4250000 -0.0000000), wk = 0.0019342 k( 130) = ( 0.4187500 0.4187500 -0.0000000), wk = 0.0019342 k( 131) = ( 0.4125000 0.4125000 -0.0000000), wk = 0.0019342 k( 132) = ( 0.4062500 0.4062500 -0.0000000), wk = 0.0019342 k( 133) = ( 0.4000000 0.4000000 -0.0000000), wk = 0.0019342 k( 134) = ( 0.3937500 0.3937500 -0.0000000), wk = 0.0019342 k( 135) = ( 0.3875000 0.3875000 -0.0000000), wk = 0.0019342 k( 136) = ( 0.3812500 0.3812500 -0.0000000), wk = 0.0019342 k( 137) = ( 0.3750000 0.3750000 -0.0000000), wk = 0.0019342 k( 138) = ( 0.3687500 0.3687500 -0.0000000), wk = 0.0019342 k( 139) = ( 0.3625000 0.3625000 -0.0000000), wk = 0.0019342 k( 140) = ( 0.3562500 0.3562500 -0.0000000), wk = 0.0019342 k( 141) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0019342 k( 142) = ( 0.3437500 0.3437500 -0.0000000), wk = 0.0019342 k( 143) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0019342 k( 144) = ( 0.3312500 0.3312500 -0.0000000), wk = 0.0019342 k( 145) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0019342 k( 146) = ( 0.3187500 0.3187500 -0.0000000), wk = 0.0019342 k( 147) = ( 0.3125000 0.3125000 -0.0000000), wk = 0.0019342 k( 148) = ( 0.3062500 0.3062500 -0.0000000), wk = 0.0019342 k( 149) = ( 0.3000000 0.3000000 -0.0000000), wk = 0.0019342 k( 150) = ( 0.2937500 0.2937500 -0.0000000), wk = 0.0019342 k( 151) = ( 0.2875000 0.2875000 -0.0000000), wk = 0.0019342 k( 152) = ( 0.2812500 0.2812500 -0.0000000), wk = 0.0019342 k( 153) = ( 0.2750000 0.2750000 -0.0000000), wk = 0.0019342 k( 154) = ( 0.2687500 0.2687500 -0.0000000), wk = 0.0019342 k( 155) = ( 0.2625000 0.2625000 -0.0000000), wk = 0.0019342 k( 156) = ( 0.2562500 0.2562500 -0.0000000), wk = 0.0019342 k( 157) = ( 0.2500000 0.2500000 -0.0000000), wk = 0.0019342 k( 158) = ( 0.2437500 0.2437500 -0.0000000), wk = 0.0019342 k( 159) = ( 0.2375000 0.2375000 -0.0000000), wk = 0.0019342 k( 160) = ( 0.2312500 0.2312500 -0.0000000), wk = 0.0019342 k( 161) = ( 0.2250000 0.2250000 -0.0000000), wk = 0.0019342 k( 162) = ( 0.2187500 0.2187500 -0.0000000), wk = 0.0019342 k( 163) = ( 0.2125000 0.2125000 -0.0000000), wk = 0.0019342 k( 164) = ( 0.2062500 0.2062500 -0.0000000), wk = 0.0019342 k( 165) = ( 0.2000000 0.2000000 -0.0000000), wk = 0.0019342 k( 166) = ( 0.1937500 0.1937500 -0.0000000), wk = 0.0019342 k( 167) = ( 0.1875000 0.1875000 -0.0000000), wk = 0.0019342 k( 168) = ( 0.1812500 0.1812500 -0.0000000), wk = 0.0019342 k( 169) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0019342 k( 170) = ( 0.1687500 0.1687500 -0.0000000), wk = 0.0019342 k( 171) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0019342 k( 172) = ( 0.1562500 0.1562500 -0.0000000), wk = 0.0019342 k( 173) = ( 0.1500000 0.1500000 -0.0000000), wk = 0.0019342 k( 174) = ( 0.1437500 0.1437500 -0.0000000), wk = 0.0019342 k( 175) = ( 0.1375000 0.1375000 -0.0000000), wk = 0.0019342 k( 176) = ( 0.1312500 0.1312500 -0.0000000), wk = 0.0019342 k( 177) = ( 0.1250000 0.1250000 -0.0000000), wk = 0.0019342 k( 178) = ( 0.1187500 0.1187500 -0.0000000), wk = 0.0019342 k( 179) = ( 0.1125000 0.1125000 -0.0000000), wk = 0.0019342 k( 180) = ( 0.1062500 0.1062500 -0.0000000), wk = 0.0019342 k( 181) = ( 0.1000000 0.1000000 -0.0000000), wk = 0.0019342 k( 182) = ( 0.0937500 0.0937500 -0.0000000), wk = 0.0019342 k( 183) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0019342 k( 184) = ( 0.0812500 0.0812500 -0.0000000), wk = 0.0019342 k( 185) = ( 0.0750000 0.0750000 -0.0000000), wk = 0.0019342 k( 186) = ( 0.0687500 0.0687500 -0.0000000), wk = 0.0019342 k( 187) = ( 0.0625000 0.0625000 -0.0000000), wk = 0.0019342 k( 188) = ( 0.0562500 0.0562500 -0.0000000), wk = 0.0019342 k( 189) = ( 0.0500000 0.0500000 -0.0000000), wk = 0.0019342 k( 190) = ( 0.0437500 0.0437500 -0.0000000), wk = 0.0019342 k( 191) = ( 0.0375000 0.0375000 -0.0000000), wk = 0.0019342 k( 192) = ( 0.0312500 0.0312500 -0.0000000), wk = 0.0019342 k( 193) = ( 0.0250000 0.0250000 -0.0000000), wk = 0.0019342 k( 194) = ( 0.0187500 0.0187500 -0.0000000), wk = 0.0019342 k( 195) = ( 0.0125000 0.0125000 -0.0000000), wk = 0.0019342 k( 196) = ( 0.0062500 0.0062500 -0.0000000), wk = 0.0019342 k( 197) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 198) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 199) = ( 0.0000000 0.0000000 0.0087283), wk = 0.0019342 k( 200) = ( 0.0000000 0.0000000 0.0174567), wk = 0.0019342 k( 201) = ( 0.0000000 0.0000000 0.0261850), wk = 0.0019342 k( 202) = ( 0.0000000 0.0000000 0.0349133), wk = 0.0019342 k( 203) = ( 0.0000000 0.0000000 0.0436417), wk = 0.0019342 k( 204) = ( 0.0000000 0.0000000 0.0523700), wk = 0.0019342 k( 205) = ( 0.0000000 0.0000000 0.0610983), wk = 0.0019342 k( 206) = ( 0.0000000 0.0000000 0.0698267), wk = 0.0019342 k( 207) = ( 0.0000000 0.0000000 0.0785550), wk = 0.0019342 k( 208) = ( 0.0000000 0.0000000 0.0872834), wk = 0.0019342 k( 209) = ( 0.0000000 0.0000000 0.0960117), wk = 0.0019342 k( 210) = ( 0.0000000 0.0000000 0.1047400), wk = 0.0019342 k( 211) = ( 0.0000000 0.0000000 0.1134684), wk = 0.0019342 k( 212) = ( 0.0000000 0.0000000 0.1221967), wk = 0.0019342 k( 213) = ( 0.0000000 0.0000000 0.1309250), wk = 0.0019342 k( 214) = ( 0.0000000 0.0000000 0.1396534), wk = 0.0019342 k( 215) = ( 0.0000000 0.0000000 0.1483817), wk = 0.0019342 k( 216) = ( 0.0000000 0.0000000 0.1571100), wk = 0.0019342 k( 217) = ( 0.0000000 0.0000000 0.1658384), wk = 0.0019342 k( 218) = ( 0.0000000 0.0000000 0.1745667), wk = 0.0019342 k( 219) = ( 0.0000000 0.0000000 0.1832950), wk = 0.0019342 k( 220) = ( 0.0000000 0.0000000 0.1920234), wk = 0.0019342 k( 221) = ( 0.0000000 0.0000000 0.2007517), wk = 0.0019342 k( 222) = ( 0.0000000 0.0000000 0.2094800), wk = 0.0019342 k( 223) = ( 0.0000000 0.0000000 0.2182084), wk = 0.0019342 k( 224) = ( 0.0000000 0.0000000 0.2269367), wk = 0.0019342 k( 225) = ( 0.0000000 0.0000000 0.2356651), wk = 0.0019342 k( 226) = ( 0.0000000 0.0000000 0.2443934), wk = 0.0019342 k( 227) = ( 0.0000000 0.0000000 0.2531217), wk = 0.0019342 k( 228) = ( 0.0000000 0.0000000 0.2618501), wk = 0.0019342 k( 229) = ( 0.0000000 0.0000000 0.2705784), wk = 0.0019342 k( 230) = ( 0.0000000 0.0000000 0.2793067), wk = 0.0019342 k( 231) = ( 0.0000000 0.0000000 0.2880351), wk = 0.0019342 k( 232) = ( 0.0000000 0.0000000 0.2967634), wk = 0.0019342 k( 233) = ( 0.0000000 0.0000000 0.3054917), wk = 0.0019342 k( 234) = ( 0.0000000 0.0000000 0.3142201), wk = 0.0019342 k( 235) = ( 0.0000000 0.0000000 0.3229484), wk = 0.0019342 k( 236) = ( 0.0000000 0.0000000 0.3316767), wk = 0.0019342 k( 237) = ( 0.0000000 0.0000000 0.3404051), wk = 0.0019342 k( 238) = ( 0.0000000 0.0000000 0.3491334), wk = 0.0019342 k( 239) = ( 0.0000000 0.0000000 0.3491334), wk = 0.0019342 k( 240) = ( 0.0000000 0.0087719 0.3491334), wk = 0.0019342 k( 241) = ( 0.0000000 0.0175439 0.3491334), wk = 0.0019342 k( 242) = ( 0.0000000 0.0263158 0.3491334), wk = 0.0019342 k( 243) = ( 0.0000000 0.0350877 0.3491334), wk = 0.0019342 k( 244) = ( 0.0000000 0.0438597 0.3491334), wk = 0.0019342 k( 245) = ( 0.0000000 0.0526316 0.3491334), wk = 0.0019342 k( 246) = ( 0.0000000 0.0614035 0.3491334), wk = 0.0019342 k( 247) = ( 0.0000000 0.0701754 0.3491334), wk = 0.0019342 k( 248) = ( 0.0000000 0.0789474 0.3491334), wk = 0.0019342 k( 249) = ( 0.0000000 0.0877193 0.3491334), wk = 0.0019342 k( 250) = ( 0.0000000 0.0964912 0.3491334), wk = 0.0019342 k( 251) = ( 0.0000000 0.1052632 0.3491334), wk = 0.0019342 k( 252) = ( 0.0000000 0.1140351 0.3491334), wk = 0.0019342 k( 253) = ( 0.0000000 0.1228070 0.3491334), wk = 0.0019342 k( 254) = ( 0.0000000 0.1315790 0.3491334), wk = 0.0019342 k( 255) = ( 0.0000000 0.1403509 0.3491334), wk = 0.0019342 k( 256) = ( 0.0000000 0.1491228 0.3491334), wk = 0.0019342 k( 257) = ( 0.0000000 0.1578947 0.3491334), wk = 0.0019342 k( 258) = ( 0.0000000 0.1666667 0.3491334), wk = 0.0019342 k( 259) = ( 0.0000000 0.1754386 0.3491334), wk = 0.0019342 k( 260) = ( 0.0000000 0.1842105 0.3491334), wk = 0.0019342 k( 261) = ( 0.0000000 0.1929825 0.3491334), wk = 0.0019342 k( 262) = ( 0.0000000 0.2017544 0.3491334), wk = 0.0019342 k( 263) = ( 0.0000000 0.2105263 0.3491334), wk = 0.0019342 k( 264) = ( 0.0000000 0.2192983 0.3491334), wk = 0.0019342 k( 265) = ( 0.0000000 0.2280702 0.3491334), wk = 0.0019342 k( 266) = ( 0.0000000 0.2368421 0.3491334), wk = 0.0019342 k( 267) = ( 0.0000000 0.2456140 0.3491334), wk = 0.0019342 k( 268) = ( 0.0000000 0.2543860 0.3491334), wk = 0.0019342 k( 269) = ( 0.0000000 0.2631579 0.3491334), wk = 0.0019342 k( 270) = ( 0.0000000 0.2719298 0.3491334), wk = 0.0019342 k( 271) = ( 0.0000000 0.2807018 0.3491334), wk = 0.0019342 k( 272) = ( 0.0000000 0.2894737 0.3491334), wk = 0.0019342 k( 273) = ( 0.0000000 0.2982456 0.3491334), wk = 0.0019342 k( 274) = ( 0.0000000 0.3070175 0.3491334), wk = 0.0019342 k( 275) = ( 0.0000000 0.3157895 0.3491334), wk = 0.0019342 k( 276) = ( 0.0000000 0.3245614 0.3491334), wk = 0.0019342 k( 277) = ( 0.0000000 0.3333333 0.3491334), wk = 0.0019342 k( 278) = ( 0.0000000 0.3421053 0.3491334), wk = 0.0019342 k( 279) = ( 0.0000000 0.3508772 0.3491334), wk = 0.0019342 k( 280) = ( 0.0000000 0.3596491 0.3491334), wk = 0.0019342 k( 281) = ( 0.0000000 0.3684211 0.3491334), wk = 0.0019342 k( 282) = ( 0.0000000 0.3771930 0.3491334), wk = 0.0019342 k( 283) = ( 0.0000000 0.3859649 0.3491334), wk = 0.0019342 k( 284) = ( 0.0000000 0.3947368 0.3491334), wk = 0.0019342 k( 285) = ( 0.0000000 0.4035088 0.3491334), wk = 0.0019342 k( 286) = ( 0.0000000 0.4122807 0.3491334), wk = 0.0019342 k( 287) = ( 0.0000000 0.4210526 0.3491334), wk = 0.0019342 k( 288) = ( 0.0000000 0.4298246 0.3491334), wk = 0.0019342 k( 289) = ( 0.0000000 0.4385965 0.3491334), wk = 0.0019342 k( 290) = ( 0.0000000 0.4473684 0.3491334), wk = 0.0019342 k( 291) = ( 0.0000000 0.4561404 0.3491334), wk = 0.0019342 k( 292) = ( 0.0000000 0.4649123 0.3491334), wk = 0.0019342 k( 293) = ( 0.0000000 0.4736842 0.3491334), wk = 0.0019342 k( 294) = ( 0.0000000 0.4824561 0.3491334), wk = 0.0019342 k( 295) = ( 0.0000000 0.4912281 0.3491334), wk = 0.0019342 k( 296) = ( 0.0000000 0.5000000 0.3491334), wk = 0.0019342 k( 297) = ( 0.0000000 0.5000000 0.3491334), wk = 0.0019342 k( 298) = ( 0.0087719 0.5000000 0.3491334), wk = 0.0019342 k( 299) = ( 0.0175439 0.5000000 0.3491334), wk = 0.0019342 k( 300) = ( 0.0263158 0.5000000 0.3491334), wk = 0.0019342 k( 301) = ( 0.0350877 0.5000000 0.3491334), wk = 0.0019342 k( 302) = ( 0.0438597 0.5000000 0.3491334), wk = 0.0019342 k( 303) = ( 0.0526316 0.5000000 0.3491334), wk = 0.0019342 k( 304) = ( 0.0614035 0.5000000 0.3491334), wk = 0.0019342 k( 305) = ( 0.0701754 0.5000000 0.3491334), wk = 0.0019342 k( 306) = ( 0.0789474 0.5000000 0.3491334), wk = 0.0019342 k( 307) = ( 0.0877193 0.5000000 0.3491334), wk = 0.0019342 k( 308) = ( 0.0964912 0.5000000 0.3491334), wk = 0.0019342 k( 309) = ( 0.1052632 0.5000000 0.3491334), wk = 0.0019342 k( 310) = ( 0.1140351 0.5000000 0.3491334), wk = 0.0019342 k( 311) = ( 0.1228070 0.5000000 0.3491334), wk = 0.0019342 k( 312) = ( 0.1315790 0.5000000 0.3491334), wk = 0.0019342 k( 313) = ( 0.1403509 0.5000000 0.3491334), wk = 0.0019342 k( 314) = ( 0.1491228 0.5000000 0.3491334), wk = 0.0019342 k( 315) = ( 0.1578947 0.5000000 0.3491334), wk = 0.0019342 k( 316) = ( 0.1666667 0.5000000 0.3491334), wk = 0.0019342 k( 317) = ( 0.1754386 0.5000000 0.3491334), wk = 0.0019342 k( 318) = ( 0.1842105 0.5000000 0.3491334), wk = 0.0019342 k( 319) = ( 0.1929825 0.5000000 0.3491334), wk = 0.0019342 k( 320) = ( 0.2017544 0.5000000 0.3491334), wk = 0.0019342 k( 321) = ( 0.2105263 0.5000000 0.3491334), wk = 0.0019342 k( 322) = ( 0.2192983 0.5000000 0.3491334), wk = 0.0019342 k( 323) = ( 0.2280702 0.5000000 0.3491334), wk = 0.0019342 k( 324) = ( 0.2368421 0.5000000 0.3491334), wk = 0.0019342 k( 325) = ( 0.2456140 0.5000000 0.3491334), wk = 0.0019342 k( 326) = ( 0.2543860 0.5000000 0.3491334), wk = 0.0019342 k( 327) = ( 0.2631579 0.5000000 0.3491334), wk = 0.0019342 k( 328) = ( 0.2719298 0.5000000 0.3491334), wk = 0.0019342 k( 329) = ( 0.2807018 0.5000000 0.3491334), wk = 0.0019342 k( 330) = ( 0.2894737 0.5000000 0.3491334), wk = 0.0019342 k( 331) = ( 0.2982456 0.5000000 0.3491334), wk = 0.0019342 k( 332) = ( 0.3070175 0.5000000 0.3491334), wk = 0.0019342 k( 333) = ( 0.3157895 0.5000000 0.3491334), wk = 0.0019342 k( 334) = ( 0.3245614 0.5000000 0.3491334), wk = 0.0019342 k( 335) = ( 0.3333333 0.5000000 0.3491334), wk = 0.0019342 k( 336) = ( 0.3421053 0.5000000 0.3491334), wk = 0.0019342 k( 337) = ( 0.3508772 0.5000000 0.3491334), wk = 0.0019342 k( 338) = ( 0.3596491 0.5000000 0.3491334), wk = 0.0019342 k( 339) = ( 0.3684211 0.5000000 0.3491334), wk = 0.0019342 k( 340) = ( 0.3771930 0.5000000 0.3491334), wk = 0.0019342 k( 341) = ( 0.3859649 0.5000000 0.3491334), wk = 0.0019342 k( 342) = ( 0.3947368 0.5000000 0.3491334), wk = 0.0019342 k( 343) = ( 0.4035088 0.5000000 0.3491334), wk = 0.0019342 k( 344) = ( 0.4122807 0.5000000 0.3491334), wk = 0.0019342 k( 345) = ( 0.4210526 0.5000000 0.3491334), wk = 0.0019342 k( 346) = ( 0.4298246 0.5000000 0.3491334), wk = 0.0019342 k( 347) = ( 0.4385965 0.5000000 0.3491334), wk = 0.0019342 k( 348) = ( 0.4473684 0.5000000 0.3491334), wk = 0.0019342 k( 349) = ( 0.4561404 0.5000000 0.3491334), wk = 0.0019342 k( 350) = ( 0.4649123 0.5000000 0.3491334), wk = 0.0019342 k( 351) = ( 0.4736842 0.5000000 0.3491334), wk = 0.0019342 k( 352) = ( 0.4824561 0.5000000 0.3491334), wk = 0.0019342 k( 353) = ( 0.4912281 0.5000000 0.3491334), wk = 0.0019342 k( 354) = ( 0.5000000 0.5000000 0.3491334), wk = 0.0019342 k( 355) = ( 0.5000000 0.5000000 0.3491334), wk = 0.0019342 k( 356) = ( 0.4937500 0.4937500 0.3491334), wk = 0.0019342 k( 357) = ( 0.4875000 0.4875000 0.3491334), wk = 0.0019342 k( 358) = ( 0.4812500 0.4812500 0.3491334), wk = 0.0019342 k( 359) = ( 0.4750000 0.4750000 0.3491334), wk = 0.0019342 k( 360) = ( 0.4687500 0.4687500 0.3491334), wk = 0.0019342 k( 361) = ( 0.4625000 0.4625000 0.3491334), wk = 0.0019342 k( 362) = ( 0.4562500 0.4562500 0.3491334), wk = 0.0019342 k( 363) = ( 0.4500000 0.4500000 0.3491334), wk = 0.0019342 k( 364) = ( 0.4437500 0.4437500 0.3491334), wk = 0.0019342 k( 365) = ( 0.4375000 0.4375000 0.3491334), wk = 0.0019342 k( 366) = ( 0.4312500 0.4312500 0.3491334), wk = 0.0019342 k( 367) = ( 0.4250000 0.4250000 0.3491334), wk = 0.0019342 k( 368) = ( 0.4187500 0.4187500 0.3491334), wk = 0.0019342 k( 369) = ( 0.4125000 0.4125000 0.3491334), wk = 0.0019342 k( 370) = ( 0.4062500 0.4062500 0.3491334), wk = 0.0019342 k( 371) = ( 0.4000000 0.4000000 0.3491334), wk = 0.0019342 k( 372) = ( 0.3937500 0.3937500 0.3491334), wk = 0.0019342 k( 373) = ( 0.3875000 0.3875000 0.3491334), wk = 0.0019342 k( 374) = ( 0.3812500 0.3812500 0.3491334), wk = 0.0019342 k( 375) = ( 0.3750000 0.3750000 0.3491334), wk = 0.0019342 k( 376) = ( 0.3687500 0.3687500 0.3491334), wk = 0.0019342 k( 377) = ( 0.3625000 0.3625000 0.3491334), wk = 0.0019342 k( 378) = ( 0.3562500 0.3562500 0.3491334), wk = 0.0019342 k( 379) = ( 0.3500000 0.3500000 0.3491334), wk = 0.0019342 k( 380) = ( 0.3437500 0.3437500 0.3491334), wk = 0.0019342 k( 381) = ( 0.3375000 0.3375000 0.3491334), wk = 0.0019342 k( 382) = ( 0.3312500 0.3312500 0.3491334), wk = 0.0019342 k( 383) = ( 0.3250000 0.3250000 0.3491334), wk = 0.0019342 k( 384) = ( 0.3187500 0.3187500 0.3491334), wk = 0.0019342 k( 385) = ( 0.3125000 0.3125000 0.3491334), wk = 0.0019342 k( 386) = ( 0.3062500 0.3062500 0.3491334), wk = 0.0019342 k( 387) = ( 0.3000000 0.3000000 0.3491334), wk = 0.0019342 k( 388) = ( 0.2937500 0.2937500 0.3491334), wk = 0.0019342 k( 389) = ( 0.2875000 0.2875000 0.3491334), wk = 0.0019342 k( 390) = ( 0.2812500 0.2812500 0.3491334), wk = 0.0019342 k( 391) = ( 0.2750000 0.2750000 0.3491334), wk = 0.0019342 k( 392) = ( 0.2687500 0.2687500 0.3491334), wk = 0.0019342 k( 393) = ( 0.2625000 0.2625000 0.3491334), wk = 0.0019342 k( 394) = ( 0.2562500 0.2562500 0.3491334), wk = 0.0019342 k( 395) = ( 0.2500000 0.2500000 0.3491334), wk = 0.0019342 k( 396) = ( 0.2437500 0.2437500 0.3491334), wk = 0.0019342 k( 397) = ( 0.2375000 0.2375000 0.3491334), wk = 0.0019342 k( 398) = ( 0.2312500 0.2312500 0.3491334), wk = 0.0019342 k( 399) = ( 0.2250000 0.2250000 0.3491334), wk = 0.0019342 k( 400) = ( 0.2187500 0.2187500 0.3491334), wk = 0.0019342 k( 401) = ( 0.2125000 0.2125000 0.3491334), wk = 0.0019342 k( 402) = ( 0.2062500 0.2062500 0.3491334), wk = 0.0019342 k( 403) = ( 0.2000000 0.2000000 0.3491334), wk = 0.0019342 k( 404) = ( 0.1937500 0.1937500 0.3491334), wk = 0.0019342 k( 405) = ( 0.1875000 0.1875000 0.3491334), wk = 0.0019342 k( 406) = ( 0.1812500 0.1812500 0.3491334), wk = 0.0019342 k( 407) = ( 0.1750000 0.1750000 0.3491334), wk = 0.0019342 k( 408) = ( 0.1687500 0.1687500 0.3491334), wk = 0.0019342 k( 409) = ( 0.1625000 0.1625000 0.3491334), wk = 0.0019342 k( 410) = ( 0.1562500 0.1562500 0.3491334), wk = 0.0019342 k( 411) = ( 0.1500000 0.1500000 0.3491334), wk = 0.0019342 k( 412) = ( 0.1437500 0.1437500 0.3491334), wk = 0.0019342 k( 413) = ( 0.1375000 0.1375000 0.3491334), wk = 0.0019342 k( 414) = ( 0.1312500 0.1312500 0.3491334), wk = 0.0019342 k( 415) = ( 0.1250000 0.1250000 0.3491334), wk = 0.0019342 k( 416) = ( 0.1187500 0.1187500 0.3491334), wk = 0.0019342 k( 417) = ( 0.1125000 0.1125000 0.3491334), wk = 0.0019342 k( 418) = ( 0.1062500 0.1062500 0.3491334), wk = 0.0019342 k( 419) = ( 0.1000000 0.1000000 0.3491334), wk = 0.0019342 k( 420) = ( 0.0937500 0.0937500 0.3491334), wk = 0.0019342 k( 421) = ( 0.0875000 0.0875000 0.3491334), wk = 0.0019342 k( 422) = ( 0.0812500 0.0812500 0.3491334), wk = 0.0019342 k( 423) = ( 0.0750000 0.0750000 0.3491334), wk = 0.0019342 k( 424) = ( 0.0687500 0.0687500 0.3491334), wk = 0.0019342 k( 425) = ( 0.0625000 0.0625000 0.3491334), wk = 0.0019342 k( 426) = ( 0.0562500 0.0562500 0.3491334), wk = 0.0019342 k( 427) = ( 0.0500000 0.0500000 0.3491334), wk = 0.0019342 k( 428) = ( 0.0437500 0.0437500 0.3491334), wk = 0.0019342 k( 429) = ( 0.0375000 0.0375000 0.3491334), wk = 0.0019342 k( 430) = ( 0.0312500 0.0312500 0.3491334), wk = 0.0019342 k( 431) = ( 0.0250000 0.0250000 0.3491334), wk = 0.0019342 k( 432) = ( 0.0187500 0.0187500 0.3491334), wk = 0.0019342 k( 433) = ( 0.0125000 0.0125000 0.3491334), wk = 0.0019342 k( 434) = ( 0.0062500 0.0062500 0.3491334), wk = 0.0019342 k( 435) = ( 0.0000000 0.0000000 0.3491334), wk = 0.0019342 k( 436) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0019342 k( 437) = ( 0.0000000 0.5000000 0.0087283), wk = 0.0019342 k( 438) = ( 0.0000000 0.5000000 0.0174567), wk = 0.0019342 k( 439) = ( 0.0000000 0.5000000 0.0261850), wk = 0.0019342 k( 440) = ( 0.0000000 0.5000000 0.0349133), wk = 0.0019342 k( 441) = ( 0.0000000 0.5000000 0.0436417), wk = 0.0019342 k( 442) = ( 0.0000000 0.5000000 0.0523700), wk = 0.0019342 k( 443) = ( 0.0000000 0.5000000 0.0610983), wk = 0.0019342 k( 444) = ( 0.0000000 0.5000000 0.0698267), wk = 0.0019342 k( 445) = ( 0.0000000 0.5000000 0.0785550), wk = 0.0019342 k( 446) = ( 0.0000000 0.5000000 0.0872834), wk = 0.0019342 k( 447) = ( 0.0000000 0.5000000 0.0960117), wk = 0.0019342 k( 448) = ( 0.0000000 0.5000000 0.1047400), wk = 0.0019342 k( 449) = ( 0.0000000 0.5000000 0.1134684), wk = 0.0019342 k( 450) = ( 0.0000000 0.5000000 0.1221967), wk = 0.0019342 k( 451) = ( 0.0000000 0.5000000 0.1309250), wk = 0.0019342 k( 452) = ( 0.0000000 0.5000000 0.1396534), wk = 0.0019342 k( 453) = ( 0.0000000 0.5000000 0.1483817), wk = 0.0019342 k( 454) = ( 0.0000000 0.5000000 0.1571100), wk = 0.0019342 k( 455) = ( 0.0000000 0.5000000 0.1658384), wk = 0.0019342 k( 456) = ( 0.0000000 0.5000000 0.1745667), wk = 0.0019342 k( 457) = ( 0.0000000 0.5000000 0.1832950), wk = 0.0019342 k( 458) = ( 0.0000000 0.5000000 0.1920234), wk = 0.0019342 k( 459) = ( 0.0000000 0.5000000 0.2007517), wk = 0.0019342 k( 460) = ( 0.0000000 0.5000000 0.2094800), wk = 0.0019342 k( 461) = ( 0.0000000 0.5000000 0.2182084), wk = 0.0019342 k( 462) = ( 0.0000000 0.5000000 0.2269367), wk = 0.0019342 k( 463) = ( 0.0000000 0.5000000 0.2356651), wk = 0.0019342 k( 464) = ( 0.0000000 0.5000000 0.2443934), wk = 0.0019342 k( 465) = ( 0.0000000 0.5000000 0.2531217), wk = 0.0019342 k( 466) = ( 0.0000000 0.5000000 0.2618501), wk = 0.0019342 k( 467) = ( 0.0000000 0.5000000 0.2705784), wk = 0.0019342 k( 468) = ( 0.0000000 0.5000000 0.2793067), wk = 0.0019342 k( 469) = ( 0.0000000 0.5000000 0.2880351), wk = 0.0019342 k( 470) = ( 0.0000000 0.5000000 0.2967634), wk = 0.0019342 k( 471) = ( 0.0000000 0.5000000 0.3054917), wk = 0.0019342 k( 472) = ( 0.0000000 0.5000000 0.3142201), wk = 0.0019342 k( 473) = ( 0.0000000 0.5000000 0.3229484), wk = 0.0019342 k( 474) = ( 0.0000000 0.5000000 0.3316767), wk = 0.0019342 k( 475) = ( 0.0000000 0.5000000 0.3404051), wk = 0.0019342 k( 476) = ( 0.0000000 0.5000000 0.3491334), wk = 0.0019342 k( 477) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0019342 k( 478) = ( 0.5000000 0.5000000 0.0087283), wk = 0.0019342 k( 479) = ( 0.5000000 0.5000000 0.0174567), wk = 0.0019342 k( 480) = ( 0.5000000 0.5000000 0.0261850), wk = 0.0019342 k( 481) = ( 0.5000000 0.5000000 0.0349133), wk = 0.0019342 k( 482) = ( 0.5000000 0.5000000 0.0436417), wk = 0.0019342 k( 483) = ( 0.5000000 0.5000000 0.0523700), wk = 0.0019342 k( 484) = ( 0.5000000 0.5000000 0.0610983), wk = 0.0019342 k( 485) = ( 0.5000000 0.5000000 0.0698267), wk = 0.0019342 k( 486) = ( 0.5000000 0.5000000 0.0785550), wk = 0.0019342 k( 487) = ( 0.5000000 0.5000000 0.0872834), wk = 0.0019342 k( 488) = ( 0.5000000 0.5000000 0.0960117), wk = 0.0019342 k( 489) = ( 0.5000000 0.5000000 0.1047400), wk = 0.0019342 k( 490) = ( 0.5000000 0.5000000 0.1134684), wk = 0.0019342 k( 491) = ( 0.5000000 0.5000000 0.1221967), wk = 0.0019342 k( 492) = ( 0.5000000 0.5000000 0.1309250), wk = 0.0019342 k( 493) = ( 0.5000000 0.5000000 0.1396534), wk = 0.0019342 k( 494) = ( 0.5000000 0.5000000 0.1483817), wk = 0.0019342 k( 495) = ( 0.5000000 0.5000000 0.1571100), wk = 0.0019342 k( 496) = ( 0.5000000 0.5000000 0.1658384), wk = 0.0019342 k( 497) = ( 0.5000000 0.5000000 0.1745667), wk = 0.0019342 k( 498) = ( 0.5000000 0.5000000 0.1832950), wk = 0.0019342 k( 499) = ( 0.5000000 0.5000000 0.1920234), wk = 0.0019342 k( 500) = ( 0.5000000 0.5000000 0.2007517), wk = 0.0019342 k( 501) = ( 0.5000000 0.5000000 0.2094800), wk = 0.0019342 k( 502) = ( 0.5000000 0.5000000 0.2182084), wk = 0.0019342 k( 503) = ( 0.5000000 0.5000000 0.2269367), wk = 0.0019342 k( 504) = ( 0.5000000 0.5000000 0.2356651), wk = 0.0019342 k( 505) = ( 0.5000000 0.5000000 0.2443934), wk = 0.0019342 k( 506) = ( 0.5000000 0.5000000 0.2531217), wk = 0.0019342 k( 507) = ( 0.5000000 0.5000000 0.2618501), wk = 0.0019342 k( 508) = ( 0.5000000 0.5000000 0.2705784), wk = 0.0019342 k( 509) = ( 0.5000000 0.5000000 0.2793067), wk = 0.0019342 k( 510) = ( 0.5000000 0.5000000 0.2880351), wk = 0.0019342 k( 511) = ( 0.5000000 0.5000000 0.2967634), wk = 0.0019342 k( 512) = ( 0.5000000 0.5000000 0.3054917), wk = 0.0019342 k( 513) = ( 0.5000000 0.5000000 0.3142201), wk = 0.0019342 k( 514) = ( 0.5000000 0.5000000 0.3229484), wk = 0.0019342 k( 515) = ( 0.5000000 0.5000000 0.3316767), wk = 0.0019342 k( 516) = ( 0.5000000 0.5000000 0.3404051), wk = 0.0019342 k( 517) = ( 0.5000000 0.5000000 0.3491334), wk = 0.0019342 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 2) = ( 0.0000000 0.0087719 0.0000000), wk = 0.0019342 k( 3) = ( 0.0000000 0.0175439 0.0000000), wk = 0.0019342 k( 4) = ( 0.0000000 0.0263158 0.0000000), wk = 0.0019342 k( 5) = ( 0.0000000 0.0350877 0.0000000), wk = 0.0019342 k( 6) = ( 0.0000000 0.0438597 0.0000000), wk = 0.0019342 k( 7) = ( 0.0000000 0.0526316 0.0000000), wk = 0.0019342 k( 8) = ( 0.0000000 0.0614035 0.0000000), wk = 0.0019342 k( 9) = ( 0.0000000 0.0701754 0.0000000), wk = 0.0019342 k( 10) = ( 0.0000000 0.0789474 0.0000000), wk = 0.0019342 k( 11) = ( 0.0000000 0.0877193 0.0000000), wk = 0.0019342 k( 12) = ( 0.0000000 0.0964912 0.0000000), wk = 0.0019342 k( 13) = ( 0.0000000 0.1052632 0.0000000), wk = 0.0019342 k( 14) = ( 0.0000000 0.1140351 -0.0000000), wk = 0.0019342 k( 15) = ( 0.0000000 0.1228070 0.0000000), wk = 0.0019342 k( 16) = ( 0.0000000 0.1315790 0.0000000), wk = 0.0019342 k( 17) = ( 0.0000000 0.1403509 0.0000000), wk = 0.0019342 k( 18) = ( 0.0000000 0.1491228 0.0000000), wk = 0.0019342 k( 19) = ( 0.0000000 0.1578947 0.0000000), wk = 0.0019342 k( 20) = ( 0.0000000 0.1666667 0.0000000), wk = 0.0019342 k( 21) = ( 0.0000000 0.1754386 0.0000000), wk = 0.0019342 k( 22) = ( 0.0000000 0.1842105 0.0000000), wk = 0.0019342 k( 23) = ( 0.0000000 0.1929825 0.0000000), wk = 0.0019342 k( 24) = ( 0.0000000 0.2017544 0.0000000), wk = 0.0019342 k( 25) = ( 0.0000000 0.2105263 0.0000000), wk = 0.0019342 k( 26) = ( 0.0000000 0.2192983 0.0000000), wk = 0.0019342 k( 27) = ( 0.0000000 0.2280702 -0.0000000), wk = 0.0019342 k( 28) = ( 0.0000000 0.2368421 0.0000000), wk = 0.0019342 k( 29) = ( 0.0000000 0.2456140 0.0000000), wk = 0.0019342 k( 30) = ( 0.0000000 0.2543860 0.0000000), wk = 0.0019342 k( 31) = ( 0.0000000 0.2631579 -0.0000000), wk = 0.0019342 k( 32) = ( 0.0000000 0.2719298 0.0000000), wk = 0.0019342 k( 33) = ( 0.0000000 0.2807018 0.0000000), wk = 0.0019342 k( 34) = ( 0.0000000 0.2894737 0.0000000), wk = 0.0019342 k( 35) = ( 0.0000000 0.2982456 -0.0000000), wk = 0.0019342 k( 36) = ( 0.0000000 0.3070175 -0.0000000), wk = 0.0019342 k( 37) = ( 0.0000000 0.3157895 0.0000000), wk = 0.0019342 k( 38) = ( 0.0000000 0.3245614 0.0000000), wk = 0.0019342 k( 39) = ( 0.0000000 0.3333333 0.0000000), wk = 0.0019342 k( 40) = ( 0.0000000 0.3421053 -0.0000000), wk = 0.0019342 k( 41) = ( 0.0000000 0.3508772 0.0000000), wk = 0.0019342 k( 42) = ( 0.0000000 0.3596491 -0.0000000), wk = 0.0019342 k( 43) = ( 0.0000000 0.3684211 0.0000000), wk = 0.0019342 k( 44) = ( 0.0000000 0.3771930 0.0000000), wk = 0.0019342 k( 45) = ( 0.0000000 0.3859649 0.0000000), wk = 0.0019342 k( 46) = ( 0.0000000 0.3947368 0.0000000), wk = 0.0019342 k( 47) = ( 0.0000000 0.4035088 -0.0000000), wk = 0.0019342 k( 48) = ( 0.0000000 0.4122807 0.0000000), wk = 0.0019342 k( 49) = ( 0.0000000 0.4210526 0.0000000), wk = 0.0019342 k( 50) = ( 0.0000000 0.4298246 0.0000000), wk = 0.0019342 k( 51) = ( 0.0000000 0.4385965 0.0000000), wk = 0.0019342 k( 52) = ( 0.0000000 0.4473684 -0.0000000), wk = 0.0019342 k( 53) = ( 0.0000000 0.4561404 0.0000000), wk = 0.0019342 k( 54) = ( 0.0000000 0.4649123 -0.0000000), wk = 0.0019342 k( 55) = ( 0.0000000 0.4736842 0.0000000), wk = 0.0019342 k( 56) = ( 0.0000000 0.4824561 0.0000000), wk = 0.0019342 k( 57) = ( 0.0000000 0.4912281 0.0000000), wk = 0.0019342 k( 58) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0019342 k( 59) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0019342 k( 60) = ( 0.0087719 0.5000000 0.0000000), wk = 0.0019342 k( 61) = ( 0.0175439 0.5000000 0.0000000), wk = 0.0019342 k( 62) = ( 0.0263158 0.5000000 0.0000000), wk = 0.0019342 k( 63) = ( 0.0350877 0.5000000 0.0000000), wk = 0.0019342 k( 64) = ( 0.0438597 0.5000000 0.0000000), wk = 0.0019342 k( 65) = ( 0.0526316 0.5000000 0.0000000), wk = 0.0019342 k( 66) = ( 0.0614035 0.5000000 0.0000000), wk = 0.0019342 k( 67) = ( 0.0701754 0.5000000 0.0000000), wk = 0.0019342 k( 68) = ( 0.0789474 0.5000000 0.0000000), wk = 0.0019342 k( 69) = ( 0.0877193 0.5000000 0.0000000), wk = 0.0019342 k( 70) = ( 0.0964912 0.5000000 0.0000000), wk = 0.0019342 k( 71) = ( 0.1052632 0.5000000 0.0000000), wk = 0.0019342 k( 72) = ( 0.1140351 0.5000000 0.0000000), wk = 0.0019342 k( 73) = ( 0.1228070 0.5000000 0.0000000), wk = 0.0019342 k( 74) = ( 0.1315790 0.5000000 -0.0000000), wk = 0.0019342 k( 75) = ( 0.1403509 0.5000000 -0.0000000), wk = 0.0019342 k( 76) = ( 0.1491228 0.5000000 0.0000000), wk = 0.0019342 k( 77) = ( 0.1578947 0.5000000 0.0000000), wk = 0.0019342 k( 78) = ( 0.1666667 0.5000000 0.0000000), wk = 0.0019342 k( 79) = ( 0.1754386 0.5000000 0.0000000), wk = 0.0019342 k( 80) = ( 0.1842105 0.5000000 0.0000000), wk = 0.0019342 k( 81) = ( 0.1929825 0.5000000 0.0000000), wk = 0.0019342 k( 82) = ( 0.2017544 0.5000000 0.0000000), wk = 0.0019342 k( 83) = ( 0.2105263 0.5000000 0.0000000), wk = 0.0019342 k( 84) = ( 0.2192983 0.5000000 0.0000000), wk = 0.0019342 k( 85) = ( 0.2280702 0.5000000 0.0000000), wk = 0.0019342 k( 86) = ( 0.2368421 0.5000000 0.0000000), wk = 0.0019342 k( 87) = ( 0.2456140 0.5000000 0.0000000), wk = 0.0019342 k( 88) = ( 0.2543860 0.5000000 0.0000000), wk = 0.0019342 k( 89) = ( 0.2631579 0.5000000 0.0000000), wk = 0.0019342 k( 90) = ( 0.2719298 0.5000000 0.0000000), wk = 0.0019342 k( 91) = ( 0.2807018 0.5000000 -0.0000000), wk = 0.0019342 k( 92) = ( 0.2894737 0.5000000 0.0000000), wk = 0.0019342 k( 93) = ( 0.2982456 0.5000000 0.0000000), wk = 0.0019342 k( 94) = ( 0.3070175 0.5000000 0.0000000), wk = 0.0019342 k( 95) = ( 0.3157895 0.5000000 -0.0000000), wk = 0.0019342 k( 96) = ( 0.3245614 0.5000000 0.0000000), wk = 0.0019342 k( 97) = ( 0.3333333 0.5000000 -0.0000000), wk = 0.0019342 k( 98) = ( 0.3421053 0.5000000 0.0000000), wk = 0.0019342 k( 99) = ( 0.3508772 0.5000000 -0.0000000), wk = 0.0019342 k( 100) = ( 0.3596491 0.5000000 -0.0000000), wk = 0.0019342 k( 101) = ( 0.3684211 0.5000000 0.0000000), wk = 0.0019342 k( 102) = ( 0.3771930 0.5000000 -0.0000000), wk = 0.0019342 k( 103) = ( 0.3859649 0.5000000 0.0000000), wk = 0.0019342 k( 104) = ( 0.3947368 0.5000000 -0.0000000), wk = 0.0019342 k( 105) = ( 0.4035088 0.5000000 0.0000000), wk = 0.0019342 k( 106) = ( 0.4122807 0.5000000 0.0000000), wk = 0.0019342 k( 107) = ( 0.4210526 0.5000000 0.0000000), wk = 0.0019342 k( 108) = ( 0.4298246 0.5000000 -0.0000000), wk = 0.0019342 k( 109) = ( 0.4385965 0.5000000 0.0000000), wk = 0.0019342 k( 110) = ( 0.4473684 0.5000000 0.0000000), wk = 0.0019342 k( 111) = ( 0.4561404 0.5000000 0.0000000), wk = 0.0019342 k( 112) = ( 0.4649123 0.5000000 -0.0000000), wk = 0.0019342 k( 113) = ( 0.4736842 0.5000000 0.0000000), wk = 0.0019342 k( 114) = ( 0.4824561 0.5000000 0.0000000), wk = 0.0019342 k( 115) = ( 0.4912281 0.5000000 0.0000000), wk = 0.0019342 k( 116) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0019342 k( 117) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0019342 k( 118) = ( 0.4937500 0.4937500 0.0000000), wk = 0.0019342 k( 119) = ( 0.4875000 0.4875000 0.0000000), wk = 0.0019342 k( 120) = ( 0.4812500 0.4812500 0.0000000), wk = 0.0019342 k( 121) = ( 0.4750000 0.4750000 0.0000000), wk = 0.0019342 k( 122) = ( 0.4687500 0.4687500 0.0000000), wk = 0.0019342 k( 123) = ( 0.4625000 0.4625000 0.0000000), wk = 0.0019342 k( 124) = ( 0.4562500 0.4562500 0.0000000), wk = 0.0019342 k( 125) = ( 0.4500000 0.4500000 0.0000000), wk = 0.0019342 k( 126) = ( 0.4437500 0.4437500 0.0000000), wk = 0.0019342 k( 127) = ( 0.4375000 0.4375000 0.0000000), wk = 0.0019342 k( 128) = ( 0.4312500 0.4312500 0.0000000), wk = 0.0019342 k( 129) = ( 0.4250000 0.4250000 0.0000000), wk = 0.0019342 k( 130) = ( 0.4187500 0.4187500 0.0000000), wk = 0.0019342 k( 131) = ( 0.4125000 0.4125000 0.0000000), wk = 0.0019342 k( 132) = ( 0.4062500 0.4062500 0.0000000), wk = 0.0019342 k( 133) = ( 0.4000000 0.4000000 0.0000000), wk = 0.0019342 k( 134) = ( 0.3937500 0.3937500 0.0000000), wk = 0.0019342 k( 135) = ( 0.3875000 0.3875000 0.0000000), wk = 0.0019342 k( 136) = ( 0.3812500 0.3812500 0.0000000), wk = 0.0019342 k( 137) = ( 0.3750000 0.3750000 0.0000000), wk = 0.0019342 k( 138) = ( 0.3687500 0.3687500 0.0000000), wk = 0.0019342 k( 139) = ( 0.3625000 0.3625000 0.0000000), wk = 0.0019342 k( 140) = ( 0.3562500 0.3562500 0.0000000), wk = 0.0019342 k( 141) = ( 0.3500000 0.3500000 -0.0000000), wk = 0.0019342 k( 142) = ( 0.3437500 0.3437500 -0.0000000), wk = 0.0019342 k( 143) = ( 0.3375000 0.3375000 -0.0000000), wk = 0.0019342 k( 144) = ( 0.3312500 0.3312500 -0.0000000), wk = 0.0019342 k( 145) = ( 0.3250000 0.3250000 -0.0000000), wk = 0.0019342 k( 146) = ( 0.3187500 0.3187500 -0.0000000), wk = 0.0019342 k( 147) = ( 0.3125000 0.3125000 0.0000000), wk = 0.0019342 k( 148) = ( 0.3062500 0.3062500 0.0000000), wk = 0.0019342 k( 149) = ( 0.3000000 0.3000000 0.0000000), wk = 0.0019342 k( 150) = ( 0.2937500 0.2937500 0.0000000), wk = 0.0019342 k( 151) = ( 0.2875000 0.2875000 0.0000000), wk = 0.0019342 k( 152) = ( 0.2812500 0.2812500 0.0000000), wk = 0.0019342 k( 153) = ( 0.2750000 0.2750000 0.0000000), wk = 0.0019342 k( 154) = ( 0.2687500 0.2687500 0.0000000), wk = 0.0019342 k( 155) = ( 0.2625000 0.2625000 0.0000000), wk = 0.0019342 k( 156) = ( 0.2562500 0.2562500 0.0000000), wk = 0.0019342 k( 157) = ( 0.2500000 0.2500000 0.0000000), wk = 0.0019342 k( 158) = ( 0.2437500 0.2437500 0.0000000), wk = 0.0019342 k( 159) = ( 0.2375000 0.2375000 0.0000000), wk = 0.0019342 k( 160) = ( 0.2312500 0.2312500 0.0000000), wk = 0.0019342 k( 161) = ( 0.2250000 0.2250000 0.0000000), wk = 0.0019342 k( 162) = ( 0.2187500 0.2187500 0.0000000), wk = 0.0019342 k( 163) = ( 0.2125000 0.2125000 0.0000000), wk = 0.0019342 k( 164) = ( 0.2062500 0.2062500 0.0000000), wk = 0.0019342 k( 165) = ( 0.2000000 0.2000000 0.0000000), wk = 0.0019342 k( 166) = ( 0.1937500 0.1937500 0.0000000), wk = 0.0019342 k( 167) = ( 0.1875000 0.1875000 0.0000000), wk = 0.0019342 k( 168) = ( 0.1812500 0.1812500 0.0000000), wk = 0.0019342 k( 169) = ( 0.1750000 0.1750000 -0.0000000), wk = 0.0019342 k( 170) = ( 0.1687500 0.1687500 -0.0000000), wk = 0.0019342 k( 171) = ( 0.1625000 0.1625000 -0.0000000), wk = 0.0019342 k( 172) = ( 0.1562500 0.1562500 0.0000000), wk = 0.0019342 k( 173) = ( 0.1500000 0.1500000 0.0000000), wk = 0.0019342 k( 174) = ( 0.1437500 0.1437500 0.0000000), wk = 0.0019342 k( 175) = ( 0.1375000 0.1375000 0.0000000), wk = 0.0019342 k( 176) = ( 0.1312500 0.1312500 0.0000000), wk = 0.0019342 k( 177) = ( 0.1250000 0.1250000 0.0000000), wk = 0.0019342 k( 178) = ( 0.1187500 0.1187500 0.0000000), wk = 0.0019342 k( 179) = ( 0.1125000 0.1125000 0.0000000), wk = 0.0019342 k( 180) = ( 0.1062500 0.1062500 0.0000000), wk = 0.0019342 k( 181) = ( 0.1000000 0.1000000 0.0000000), wk = 0.0019342 k( 182) = ( 0.0937500 0.0937500 0.0000000), wk = 0.0019342 k( 183) = ( 0.0875000 0.0875000 -0.0000000), wk = 0.0019342 k( 184) = ( 0.0812500 0.0812500 -0.0000000), wk = 0.0019342 k( 185) = ( 0.0750000 0.0750000 0.0000000), wk = 0.0019342 k( 186) = ( 0.0687500 0.0687500 0.0000000), wk = 0.0019342 k( 187) = ( 0.0625000 0.0625000 0.0000000), wk = 0.0019342 k( 188) = ( 0.0562500 0.0562500 0.0000000), wk = 0.0019342 k( 189) = ( 0.0500000 0.0500000 0.0000000), wk = 0.0019342 k( 190) = ( 0.0437500 0.0437500 -0.0000000), wk = 0.0019342 k( 191) = ( 0.0375000 0.0375000 0.0000000), wk = 0.0019342 k( 192) = ( 0.0312500 0.0312500 0.0000000), wk = 0.0019342 k( 193) = ( 0.0250000 0.0250000 0.0000000), wk = 0.0019342 k( 194) = ( 0.0187500 0.0187500 0.0000000), wk = 0.0019342 k( 195) = ( 0.0125000 0.0125000 0.0000000), wk = 0.0019342 k( 196) = ( 0.0062500 0.0062500 0.0000000), wk = 0.0019342 k( 197) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 198) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0019342 k( 199) = ( 0.0000000 0.0000000 0.0125000), wk = 0.0019342 k( 200) = ( 0.0000000 0.0000000 0.0250000), wk = 0.0019342 k( 201) = ( 0.0000000 0.0000000 0.0375000), wk = 0.0019342 k( 202) = ( 0.0000000 0.0000000 0.0500000), wk = 0.0019342 k( 203) = ( 0.0000000 0.0000000 0.0625000), wk = 0.0019342 k( 204) = ( 0.0000000 0.0000000 0.0750000), wk = 0.0019342 k( 205) = ( 0.0000000 0.0000000 0.0875000), wk = 0.0019342 k( 206) = ( 0.0000000 0.0000000 0.1000000), wk = 0.0019342 k( 207) = ( 0.0000000 0.0000000 0.1125000), wk = 0.0019342 k( 208) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0019342 k( 209) = ( 0.0000000 0.0000000 0.1375000), wk = 0.0019342 k( 210) = ( 0.0000000 0.0000000 0.1500000), wk = 0.0019342 k( 211) = ( 0.0000000 0.0000000 0.1625000), wk = 0.0019342 k( 212) = ( 0.0000000 0.0000000 0.1750000), wk = 0.0019342 k( 213) = ( 0.0000000 0.0000000 0.1875000), wk = 0.0019342 k( 214) = ( 0.0000000 0.0000000 0.2000000), wk = 0.0019342 k( 215) = ( 0.0000000 0.0000000 0.2125000), wk = 0.0019342 k( 216) = ( 0.0000000 0.0000000 0.2250000), wk = 0.0019342 k( 217) = ( 0.0000000 0.0000000 0.2375000), wk = 0.0019342 k( 218) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0019342 k( 219) = ( 0.0000000 0.0000000 0.2625000), wk = 0.0019342 k( 220) = ( 0.0000000 0.0000000 0.2750000), wk = 0.0019342 k( 221) = ( 0.0000000 0.0000000 0.2875000), wk = 0.0019342 k( 222) = ( 0.0000000 0.0000000 0.3000000), wk = 0.0019342 k( 223) = ( 0.0000000 0.0000000 0.3125000), wk = 0.0019342 k( 224) = ( 0.0000000 0.0000000 0.3250000), wk = 0.0019342 k( 225) = ( 0.0000000 0.0000000 0.3375000), wk = 0.0019342 k( 226) = ( 0.0000000 0.0000000 0.3500000), wk = 0.0019342 k( 227) = ( 0.0000000 0.0000000 0.3625000), wk = 0.0019342 k( 228) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0019342 k( 229) = ( 0.0000000 0.0000000 0.3875000), wk = 0.0019342 k( 230) = ( 0.0000000 0.0000000 0.4000000), wk = 0.0019342 k( 231) = ( 0.0000000 0.0000000 0.4125000), wk = 0.0019342 k( 232) = ( 0.0000000 0.0000000 0.4250000), wk = 0.0019342 k( 233) = ( 0.0000000 0.0000000 0.4375000), wk = 0.0019342 k( 234) = ( 0.0000000 0.0000000 0.4500000), wk = 0.0019342 k( 235) = ( 0.0000000 0.0000000 0.4625000), wk = 0.0019342 k( 236) = ( 0.0000000 0.0000000 0.4750000), wk = 0.0019342 k( 237) = ( 0.0000000 0.0000000 0.4875000), wk = 0.0019342 k( 238) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0019342 k( 239) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0019342 k( 240) = ( 0.0000000 0.0087719 0.5000000), wk = 0.0019342 k( 241) = ( 0.0000000 0.0175439 0.5000000), wk = 0.0019342 k( 242) = ( 0.0000000 0.0263158 0.5000000), wk = 0.0019342 k( 243) = ( 0.0000000 0.0350877 0.5000000), wk = 0.0019342 k( 244) = ( 0.0000000 0.0438597 0.5000000), wk = 0.0019342 k( 245) = ( 0.0000000 0.0526316 0.5000000), wk = 0.0019342 k( 246) = ( 0.0000000 0.0614035 0.5000000), wk = 0.0019342 k( 247) = ( 0.0000000 0.0701754 0.5000000), wk = 0.0019342 k( 248) = ( 0.0000000 0.0789474 0.5000000), wk = 0.0019342 k( 249) = ( 0.0000000 0.0877193 0.5000000), wk = 0.0019342 k( 250) = ( 0.0000000 0.0964912 0.5000000), wk = 0.0019342 k( 251) = ( 0.0000000 0.1052632 0.5000000), wk = 0.0019342 k( 252) = ( 0.0000000 0.1140351 0.5000000), wk = 0.0019342 k( 253) = ( 0.0000000 0.1228070 0.5000000), wk = 0.0019342 k( 254) = ( 0.0000000 0.1315790 0.5000000), wk = 0.0019342 k( 255) = ( 0.0000000 0.1403509 0.5000000), wk = 0.0019342 k( 256) = ( 0.0000000 0.1491228 0.5000000), wk = 0.0019342 k( 257) = ( 0.0000000 0.1578947 0.5000000), wk = 0.0019342 k( 258) = ( 0.0000000 0.1666667 0.5000000), wk = 0.0019342 k( 259) = ( 0.0000000 0.1754386 0.5000000), wk = 0.0019342 k( 260) = ( 0.0000000 0.1842105 0.5000000), wk = 0.0019342 k( 261) = ( 0.0000000 0.1929825 0.5000000), wk = 0.0019342 k( 262) = ( 0.0000000 0.2017544 0.5000000), wk = 0.0019342 k( 263) = ( 0.0000000 0.2105263 0.5000000), wk = 0.0019342 k( 264) = ( 0.0000000 0.2192983 0.5000000), wk = 0.0019342 k( 265) = ( 0.0000000 0.2280702 0.5000000), wk = 0.0019342 k( 266) = ( 0.0000000 0.2368421 0.5000000), wk = 0.0019342 k( 267) = ( 0.0000000 0.2456140 0.5000000), wk = 0.0019342 k( 268) = ( 0.0000000 0.2543860 0.5000000), wk = 0.0019342 k( 269) = ( 0.0000000 0.2631579 0.5000000), wk = 0.0019342 k( 270) = ( 0.0000000 0.2719298 0.5000000), wk = 0.0019342 k( 271) = ( 0.0000000 0.2807018 0.5000000), wk = 0.0019342 k( 272) = ( 0.0000000 0.2894737 0.5000000), wk = 0.0019342 k( 273) = ( 0.0000000 0.2982456 0.5000000), wk = 0.0019342 k( 274) = ( 0.0000000 0.3070175 0.5000000), wk = 0.0019342 k( 275) = ( 0.0000000 0.3157895 0.5000000), wk = 0.0019342 k( 276) = ( 0.0000000 0.3245614 0.5000000), wk = 0.0019342 k( 277) = ( 0.0000000 0.3333333 0.5000000), wk = 0.0019342 k( 278) = ( 0.0000000 0.3421053 0.5000000), wk = 0.0019342 k( 279) = ( 0.0000000 0.3508772 0.5000000), wk = 0.0019342 k( 280) = ( 0.0000000 0.3596491 0.5000000), wk = 0.0019342 k( 281) = ( 0.0000000 0.3684211 0.5000000), wk = 0.0019342 k( 282) = ( 0.0000000 0.3771930 0.5000000), wk = 0.0019342 k( 283) = ( 0.0000000 0.3859649 0.5000000), wk = 0.0019342 k( 284) = ( 0.0000000 0.3947368 0.5000000), wk = 0.0019342 k( 285) = ( 0.0000000 0.4035088 0.5000000), wk = 0.0019342 k( 286) = ( 0.0000000 0.4122807 0.5000000), wk = 0.0019342 k( 287) = ( 0.0000000 0.4210526 0.5000000), wk = 0.0019342 k( 288) = ( 0.0000000 0.4298246 0.5000000), wk = 0.0019342 k( 289) = ( 0.0000000 0.4385965 0.5000000), wk = 0.0019342 k( 290) = ( 0.0000000 0.4473684 0.5000000), wk = 0.0019342 k( 291) = ( 0.0000000 0.4561404 0.5000000), wk = 0.0019342 k( 292) = ( 0.0000000 0.4649123 0.5000000), wk = 0.0019342 k( 293) = ( 0.0000000 0.4736842 0.5000000), wk = 0.0019342 k( 294) = ( 0.0000000 0.4824561 0.5000000), wk = 0.0019342 k( 295) = ( 0.0000000 0.4912281 0.5000000), wk = 0.0019342 k( 296) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0019342 k( 297) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0019342 k( 298) = ( 0.0087719 0.5000000 0.5000000), wk = 0.0019342 k( 299) = ( 0.0175439 0.5000000 0.5000000), wk = 0.0019342 k( 300) = ( 0.0263158 0.5000000 0.5000000), wk = 0.0019342 k( 301) = ( 0.0350877 0.5000000 0.5000000), wk = 0.0019342 k( 302) = ( 0.0438597 0.5000000 0.5000000), wk = 0.0019342 k( 303) = ( 0.0526316 0.5000000 0.5000000), wk = 0.0019342 k( 304) = ( 0.0614035 0.5000000 0.5000000), wk = 0.0019342 k( 305) = ( 0.0701754 0.5000000 0.5000000), wk = 0.0019342 k( 306) = ( 0.0789474 0.5000000 0.5000000), wk = 0.0019342 k( 307) = ( 0.0877193 0.5000000 0.5000000), wk = 0.0019342 k( 308) = ( 0.0964912 0.5000000 0.5000000), wk = 0.0019342 k( 309) = ( 0.1052632 0.5000000 0.5000000), wk = 0.0019342 k( 310) = ( 0.1140351 0.5000000 0.5000000), wk = 0.0019342 k( 311) = ( 0.1228070 0.5000000 0.5000000), wk = 0.0019342 k( 312) = ( 0.1315790 0.5000000 0.5000000), wk = 0.0019342 k( 313) = ( 0.1403509 0.5000000 0.5000000), wk = 0.0019342 k( 314) = ( 0.1491228 0.5000000 0.5000000), wk = 0.0019342 k( 315) = ( 0.1578947 0.5000000 0.5000000), wk = 0.0019342 k( 316) = ( 0.1666667 0.5000000 0.5000000), wk = 0.0019342 k( 317) = ( 0.1754386 0.5000000 0.5000000), wk = 0.0019342 k( 318) = ( 0.1842105 0.5000000 0.5000000), wk = 0.0019342 k( 319) = ( 0.1929825 0.5000000 0.5000000), wk = 0.0019342 k( 320) = ( 0.2017544 0.5000000 0.5000000), wk = 0.0019342 k( 321) = ( 0.2105263 0.5000000 0.5000000), wk = 0.0019342 k( 322) = ( 0.2192983 0.5000000 0.5000000), wk = 0.0019342 k( 323) = ( 0.2280702 0.5000000 0.5000000), wk = 0.0019342 k( 324) = ( 0.2368421 0.5000000 0.5000000), wk = 0.0019342 k( 325) = ( 0.2456140 0.5000000 0.5000000), wk = 0.0019342 k( 326) = ( 0.2543860 0.5000000 0.5000000), wk = 0.0019342 k( 327) = ( 0.2631579 0.5000000 0.5000000), wk = 0.0019342 k( 328) = ( 0.2719298 0.5000000 0.5000000), wk = 0.0019342 k( 329) = ( 0.2807018 0.5000000 0.5000000), wk = 0.0019342 k( 330) = ( 0.2894737 0.5000000 0.5000000), wk = 0.0019342 k( 331) = ( 0.2982456 0.5000000 0.5000000), wk = 0.0019342 k( 332) = ( 0.3070175 0.5000000 0.5000000), wk = 0.0019342 k( 333) = ( 0.3157895 0.5000000 0.5000000), wk = 0.0019342 k( 334) = ( 0.3245614 0.5000000 0.5000000), wk = 0.0019342 k( 335) = ( 0.3333333 0.5000000 0.5000000), wk = 0.0019342 k( 336) = ( 0.3421053 0.5000000 0.5000000), wk = 0.0019342 k( 337) = ( 0.3508772 0.5000000 0.5000000), wk = 0.0019342 k( 338) = ( 0.3596491 0.5000000 0.5000000), wk = 0.0019342 k( 339) = ( 0.3684211 0.5000000 0.5000000), wk = 0.0019342 k( 340) = ( 0.3771930 0.5000000 0.5000000), wk = 0.0019342 k( 341) = ( 0.3859649 0.5000000 0.5000000), wk = 0.0019342 k( 342) = ( 0.3947368 0.5000000 0.5000000), wk = 0.0019342 k( 343) = ( 0.4035088 0.5000000 0.5000000), wk = 0.0019342 k( 344) = ( 0.4122807 0.5000000 0.5000000), wk = 0.0019342 k( 345) = ( 0.4210526 0.5000000 0.5000000), wk = 0.0019342 k( 346) = ( 0.4298246 0.5000000 0.5000000), wk = 0.0019342 k( 347) = ( 0.4385965 0.5000000 0.5000000), wk = 0.0019342 k( 348) = ( 0.4473684 0.5000000 0.5000000), wk = 0.0019342 k( 349) = ( 0.4561404 0.5000000 0.5000000), wk = 0.0019342 k( 350) = ( 0.4649123 0.5000000 0.5000000), wk = 0.0019342 k( 351) = ( 0.4736842 0.5000000 0.5000000), wk = 0.0019342 k( 352) = ( 0.4824561 0.5000000 0.5000000), wk = 0.0019342 k( 353) = ( 0.4912281 0.5000000 0.5000000), wk = 0.0019342 k( 354) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019342 k( 355) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019342 k( 356) = ( 0.4937500 0.4937500 0.5000000), wk = 0.0019342 k( 357) = ( 0.4875000 0.4875000 0.5000000), wk = 0.0019342 k( 358) = ( 0.4812500 0.4812500 0.5000000), wk = 0.0019342 k( 359) = ( 0.4750000 0.4750000 0.5000000), wk = 0.0019342 k( 360) = ( 0.4687500 0.4687500 0.5000000), wk = 0.0019342 k( 361) = ( 0.4625000 0.4625000 0.5000000), wk = 0.0019342 k( 362) = ( 0.4562500 0.4562500 0.5000000), wk = 0.0019342 k( 363) = ( 0.4500000 0.4500000 0.5000000), wk = 0.0019342 k( 364) = ( 0.4437500 0.4437500 0.5000000), wk = 0.0019342 k( 365) = ( 0.4375000 0.4375000 0.5000000), wk = 0.0019342 k( 366) = ( 0.4312500 0.4312500 0.5000000), wk = 0.0019342 k( 367) = ( 0.4250000 0.4250000 0.5000000), wk = 0.0019342 k( 368) = ( 0.4187500 0.4187500 0.5000000), wk = 0.0019342 k( 369) = ( 0.4125000 0.4125000 0.5000000), wk = 0.0019342 k( 370) = ( 0.4062500 0.4062500 0.5000000), wk = 0.0019342 k( 371) = ( 0.4000000 0.4000000 0.5000000), wk = 0.0019342 k( 372) = ( 0.3937500 0.3937500 0.5000000), wk = 0.0019342 k( 373) = ( 0.3875000 0.3875000 0.5000000), wk = 0.0019342 k( 374) = ( 0.3812500 0.3812500 0.5000000), wk = 0.0019342 k( 375) = ( 0.3750000 0.3750000 0.5000000), wk = 0.0019342 k( 376) = ( 0.3687500 0.3687500 0.5000000), wk = 0.0019342 k( 377) = ( 0.3625000 0.3625000 0.5000000), wk = 0.0019342 k( 378) = ( 0.3562500 0.3562500 0.5000000), wk = 0.0019342 k( 379) = ( 0.3500000 0.3500000 0.5000000), wk = 0.0019342 k( 380) = ( 0.3437500 0.3437500 0.5000000), wk = 0.0019342 k( 381) = ( 0.3375000 0.3375000 0.5000000), wk = 0.0019342 k( 382) = ( 0.3312500 0.3312500 0.5000000), wk = 0.0019342 k( 383) = ( 0.3250000 0.3250000 0.5000000), wk = 0.0019342 k( 384) = ( 0.3187500 0.3187500 0.5000000), wk = 0.0019342 k( 385) = ( 0.3125000 0.3125000 0.5000000), wk = 0.0019342 k( 386) = ( 0.3062500 0.3062500 0.5000000), wk = 0.0019342 k( 387) = ( 0.3000000 0.3000000 0.5000000), wk = 0.0019342 k( 388) = ( 0.2937500 0.2937500 0.5000000), wk = 0.0019342 k( 389) = ( 0.2875000 0.2875000 0.5000000), wk = 0.0019342 k( 390) = ( 0.2812500 0.2812500 0.5000000), wk = 0.0019342 k( 391) = ( 0.2750000 0.2750000 0.5000000), wk = 0.0019342 k( 392) = ( 0.2687500 0.2687500 0.5000000), wk = 0.0019342 k( 393) = ( 0.2625000 0.2625000 0.5000000), wk = 0.0019342 k( 394) = ( 0.2562500 0.2562500 0.5000000), wk = 0.0019342 k( 395) = ( 0.2500000 0.2500000 0.5000000), wk = 0.0019342 k( 396) = ( 0.2437500 0.2437500 0.5000000), wk = 0.0019342 k( 397) = ( 0.2375000 0.2375000 0.5000000), wk = 0.0019342 k( 398) = ( 0.2312500 0.2312500 0.5000000), wk = 0.0019342 k( 399) = ( 0.2250000 0.2250000 0.5000000), wk = 0.0019342 k( 400) = ( 0.2187500 0.2187500 0.5000000), wk = 0.0019342 k( 401) = ( 0.2125000 0.2125000 0.5000000), wk = 0.0019342 k( 402) = ( 0.2062500 0.2062500 0.5000000), wk = 0.0019342 k( 403) = ( 0.2000000 0.2000000 0.5000000), wk = 0.0019342 k( 404) = ( 0.1937500 0.1937500 0.5000000), wk = 0.0019342 k( 405) = ( 0.1875000 0.1875000 0.5000000), wk = 0.0019342 k( 406) = ( 0.1812500 0.1812500 0.5000000), wk = 0.0019342 k( 407) = ( 0.1750000 0.1750000 0.5000000), wk = 0.0019342 k( 408) = ( 0.1687500 0.1687500 0.5000000), wk = 0.0019342 k( 409) = ( 0.1625000 0.1625000 0.5000000), wk = 0.0019342 k( 410) = ( 0.1562500 0.1562500 0.5000000), wk = 0.0019342 k( 411) = ( 0.1500000 0.1500000 0.5000000), wk = 0.0019342 k( 412) = ( 0.1437500 0.1437500 0.5000000), wk = 0.0019342 k( 413) = ( 0.1375000 0.1375000 0.5000000), wk = 0.0019342 k( 414) = ( 0.1312500 0.1312500 0.5000000), wk = 0.0019342 k( 415) = ( 0.1250000 0.1250000 0.5000000), wk = 0.0019342 k( 416) = ( 0.1187500 0.1187500 0.5000000), wk = 0.0019342 k( 417) = ( 0.1125000 0.1125000 0.5000000), wk = 0.0019342 k( 418) = ( 0.1062500 0.1062500 0.5000000), wk = 0.0019342 k( 419) = ( 0.1000000 0.1000000 0.5000000), wk = 0.0019342 k( 420) = ( 0.0937500 0.0937500 0.5000000), wk = 0.0019342 k( 421) = ( 0.0875000 0.0875000 0.5000000), wk = 0.0019342 k( 422) = ( 0.0812500 0.0812500 0.5000000), wk = 0.0019342 k( 423) = ( 0.0750000 0.0750000 0.5000000), wk = 0.0019342 k( 424) = ( 0.0687500 0.0687500 0.5000000), wk = 0.0019342 k( 425) = ( 0.0625000 0.0625000 0.5000000), wk = 0.0019342 k( 426) = ( 0.0562500 0.0562500 0.5000000), wk = 0.0019342 k( 427) = ( 0.0500000 0.0500000 0.5000000), wk = 0.0019342 k( 428) = ( 0.0437500 0.0437500 0.5000000), wk = 0.0019342 k( 429) = ( 0.0375000 0.0375000 0.5000000), wk = 0.0019342 k( 430) = ( 0.0312500 0.0312500 0.5000000), wk = 0.0019342 k( 431) = ( 0.0250000 0.0250000 0.5000000), wk = 0.0019342 k( 432) = ( 0.0187500 0.0187500 0.5000000), wk = 0.0019342 k( 433) = ( 0.0125000 0.0125000 0.5000000), wk = 0.0019342 k( 434) = ( 0.0062500 0.0062500 0.5000000), wk = 0.0019342 k( 435) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0019342 k( 436) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0019342 k( 437) = ( 0.0000000 0.5000000 0.0125000), wk = 0.0019342 k( 438) = ( 0.0000000 0.5000000 0.0250000), wk = 0.0019342 k( 439) = ( 0.0000000 0.5000000 0.0375000), wk = 0.0019342 k( 440) = ( 0.0000000 0.5000000 0.0500000), wk = 0.0019342 k( 441) = ( 0.0000000 0.5000000 0.0625000), wk = 0.0019342 k( 442) = ( 0.0000000 0.5000000 0.0750000), wk = 0.0019342 k( 443) = ( 0.0000000 0.5000000 0.0875000), wk = 0.0019342 k( 444) = ( 0.0000000 0.5000000 0.1000000), wk = 0.0019342 k( 445) = ( 0.0000000 0.5000000 0.1125000), wk = 0.0019342 k( 446) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0019342 k( 447) = ( 0.0000000 0.5000000 0.1375000), wk = 0.0019342 k( 448) = ( 0.0000000 0.5000000 0.1500000), wk = 0.0019342 k( 449) = ( 0.0000000 0.5000000 0.1625000), wk = 0.0019342 k( 450) = ( 0.0000000 0.5000000 0.1750000), wk = 0.0019342 k( 451) = ( 0.0000000 0.5000000 0.1875000), wk = 0.0019342 k( 452) = ( 0.0000000 0.5000000 0.2000000), wk = 0.0019342 k( 453) = ( 0.0000000 0.5000000 0.2125000), wk = 0.0019342 k( 454) = ( 0.0000000 0.5000000 0.2250000), wk = 0.0019342 k( 455) = ( 0.0000000 0.5000000 0.2375000), wk = 0.0019342 k( 456) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0019342 k( 457) = ( 0.0000000 0.5000000 0.2625000), wk = 0.0019342 k( 458) = ( 0.0000000 0.5000000 0.2750000), wk = 0.0019342 k( 459) = ( 0.0000000 0.5000000 0.2875000), wk = 0.0019342 k( 460) = ( 0.0000000 0.5000000 0.3000000), wk = 0.0019342 k( 461) = ( 0.0000000 0.5000000 0.3125000), wk = 0.0019342 k( 462) = ( 0.0000000 0.5000000 0.3250000), wk = 0.0019342 k( 463) = ( 0.0000000 0.5000000 0.3375000), wk = 0.0019342 k( 464) = ( 0.0000000 0.5000000 0.3500000), wk = 0.0019342 k( 465) = ( 0.0000000 0.5000000 0.3625000), wk = 0.0019342 k( 466) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0019342 k( 467) = ( 0.0000000 0.5000000 0.3875000), wk = 0.0019342 k( 468) = ( 0.0000000 0.5000000 0.4000000), wk = 0.0019342 k( 469) = ( 0.0000000 0.5000000 0.4125000), wk = 0.0019342 k( 470) = ( 0.0000000 0.5000000 0.4250000), wk = 0.0019342 k( 471) = ( 0.0000000 0.5000000 0.4375000), wk = 0.0019342 k( 472) = ( 0.0000000 0.5000000 0.4500000), wk = 0.0019342 k( 473) = ( 0.0000000 0.5000000 0.4625000), wk = 0.0019342 k( 474) = ( 0.0000000 0.5000000 0.4750000), wk = 0.0019342 k( 475) = ( 0.0000000 0.5000000 0.4875000), wk = 0.0019342 k( 476) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0019342 k( 477) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0019342 k( 478) = ( 0.5000000 0.5000000 0.0125000), wk = 0.0019342 k( 479) = ( 0.5000000 0.5000000 0.0250000), wk = 0.0019342 k( 480) = ( 0.5000000 0.5000000 0.0375000), wk = 0.0019342 k( 481) = ( 0.5000000 0.5000000 0.0500000), wk = 0.0019342 k( 482) = ( 0.5000000 0.5000000 0.0625000), wk = 0.0019342 k( 483) = ( 0.5000000 0.5000000 0.0750000), wk = 0.0019342 k( 484) = ( 0.5000000 0.5000000 0.0875000), wk = 0.0019342 k( 485) = ( 0.5000000 0.5000000 0.1000000), wk = 0.0019342 k( 486) = ( 0.5000000 0.5000000 0.1125000), wk = 0.0019342 k( 487) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0019342 k( 488) = ( 0.5000000 0.5000000 0.1375000), wk = 0.0019342 k( 489) = ( 0.5000000 0.5000000 0.1500000), wk = 0.0019342 k( 490) = ( 0.5000000 0.5000000 0.1625000), wk = 0.0019342 k( 491) = ( 0.5000000 0.5000000 0.1750000), wk = 0.0019342 k( 492) = ( 0.5000000 0.5000000 0.1875000), wk = 0.0019342 k( 493) = ( 0.5000000 0.5000000 0.2000000), wk = 0.0019342 k( 494) = ( 0.5000000 0.5000000 0.2125000), wk = 0.0019342 k( 495) = ( 0.5000000 0.5000000 0.2250000), wk = 0.0019342 k( 496) = ( 0.5000000 0.5000000 0.2375000), wk = 0.0019342 k( 497) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0019342 k( 498) = ( 0.5000000 0.5000000 0.2625000), wk = 0.0019342 k( 499) = ( 0.5000000 0.5000000 0.2750000), wk = 0.0019342 k( 500) = ( 0.5000000 0.5000000 0.2875000), wk = 0.0019342 k( 501) = ( 0.5000000 0.5000000 0.3000000), wk = 0.0019342 k( 502) = ( 0.5000000 0.5000000 0.3125000), wk = 0.0019342 k( 503) = ( 0.5000000 0.5000000 0.3250000), wk = 0.0019342 k( 504) = ( 0.5000000 0.5000000 0.3375000), wk = 0.0019342 k( 505) = ( 0.5000000 0.5000000 0.3500000), wk = 0.0019342 k( 506) = ( 0.5000000 0.5000000 0.3625000), wk = 0.0019342 k( 507) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0019342 k( 508) = ( 0.5000000 0.5000000 0.3875000), wk = 0.0019342 k( 509) = ( 0.5000000 0.5000000 0.4000000), wk = 0.0019342 k( 510) = ( 0.5000000 0.5000000 0.4125000), wk = 0.0019342 k( 511) = ( 0.5000000 0.5000000 0.4250000), wk = 0.0019342 k( 512) = ( 0.5000000 0.5000000 0.4375000), wk = 0.0019342 k( 513) = ( 0.5000000 0.5000000 0.4500000), wk = 0.0019342 k( 514) = ( 0.5000000 0.5000000 0.4625000), wk = 0.0019342 k( 515) = ( 0.5000000 0.5000000 0.4750000), wk = 0.0019342 k( 516) = ( 0.5000000 0.5000000 0.4875000), wk = 0.0019342 k( 517) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0019342 Dense grid: 45425 G-vectors FFT dimensions: ( 40, 40, 60) Smooth grid: 29821 G-vectors FFT dimensions: ( 36, 36, 50) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.10 Mb ( 210, 30) NL pseudopotentials 0.08 Mb ( 105, 50) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 1268) G-vector shells 0.00 Mb ( 651) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.38 Mb ( 210, 120) Each subspace H/S matrix 0.01 Mb ( 30, 30) Each matrix 0.05 Mb ( 50, 2, 30) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./LiHPd.save/charge-density.dat Starting wfc are 32 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.9 secs Computing kpt #: 2 total cpu time spent up to now is 2.0 secs Computing kpt #: 3 total cpu time spent up to now is 2.2 secs Computing kpt #: 4 total cpu time spent up to now is 2.3 secs Computing kpt #: 5 total cpu time spent up to now is 2.4 secs Computing kpt #: 6 total cpu time spent up to now is 2.6 secs Computing kpt #: 7 total cpu time spent up to now is 2.7 secs Computing kpt #: 8 total cpu time spent up to now is 2.9 secs Computing kpt #: 9 total cpu time spent up to now is 3.0 secs Computing kpt #: 10 total cpu time spent up to now is 3.2 secs Computing kpt #: 11 total cpu time spent up to now is 3.3 secs Computing kpt #: 12 total cpu time spent up to now is 3.5 secs Computing kpt #: 13 total cpu time spent up to now is 3.6 secs Computing kpt #: 14 total cpu time spent up to now is 3.8 secs Computing kpt #: 15 total cpu time spent up to now is 3.9 secs Computing kpt #: 16 total cpu time spent up to now is 4.1 secs Computing kpt #: 17 total cpu time spent up to now is 4.2 secs Computing kpt #: 18 total cpu time spent up to now is 4.4 secs Computing kpt #: 19 total cpu time spent up to now is 4.6 secs Computing kpt #: 20 total cpu time spent up to now is 4.7 secs Computing kpt #: 21 total cpu time spent up to now is 4.9 secs Computing kpt #: 22 total cpu time spent up to now is 5.0 secs Computing kpt #: 23 total cpu time spent up to now is 5.2 secs Computing kpt #: 24 total cpu time spent up to now is 5.4 secs Computing kpt #: 25 total cpu time spent up to now is 5.5 secs Computing kpt #: 26 total cpu time spent up to now is 5.7 secs Computing kpt #: 27 total cpu time spent up to now is 5.9 secs Computing kpt #: 28 total cpu time spent up to now is 6.0 secs Computing kpt #: 29 total cpu time spent up to now is 6.1 secs Computing kpt #: 30 total cpu time spent up to now is 6.3 secs Computing kpt #: 31 total cpu time spent up to now is 6.4 secs Computing kpt #: 32 total cpu time spent up to now is 6.6 secs Computing kpt #: 33 total cpu time spent up to now is 6.7 secs Computing kpt #: 34 total cpu time spent up to now is 6.9 secs Computing kpt #: 35 total cpu time spent up to now is 7.0 secs Computing kpt #: 36 total cpu time spent up to now is 7.1 secs Computing kpt #: 37 total cpu time spent up to now is 7.3 secs Computing kpt #: 38 total cpu time spent up to now is 7.4 secs Computing kpt #: 39 total cpu time spent up to now is 7.6 secs Computing kpt #: 40 total cpu time spent up to now is 7.7 secs Computing kpt #: 41 total cpu time spent up to now is 7.8 secs Computing kpt #: 42 total cpu time spent up to now is 8.0 secs Computing kpt #: 43 total cpu time spent up to now is 8.1 secs Computing kpt #: 44 total cpu time spent up to now is 8.3 secs Computing kpt #: 45 total cpu time spent up to now is 8.4 secs Computing kpt #: 46 total cpu time spent up to now is 8.6 secs Computing kpt #: 47 total cpu time spent up to now is 8.7 secs Computing kpt #: 48 total cpu time spent up to now is 8.9 secs Computing kpt #: 49 total cpu time spent up to now is 9.0 secs Computing kpt #: 50 total cpu time spent up to now is 9.1 secs Computing kpt #: 51 total cpu time spent up to now is 9.3 secs Computing kpt #: 52 total cpu time spent up to now is 9.4 secs Computing kpt #: 53 total cpu time spent up to now is 9.5 secs Computing kpt #: 54 total cpu time spent up to now is 9.7 secs Computing kpt #: 55 total cpu time spent up to now is 9.8 secs Computing kpt #: 56 total cpu time spent up to now is 9.9 secs Computing kpt #: 57 total cpu time spent up to now is 10.1 secs Computing kpt #: 58 total cpu time spent up to now is 10.2 secs Computing kpt #: 59 total cpu time spent up to now is 10.4 secs Computing kpt #: 60 total cpu time spent up to now is 10.5 secs Computing kpt #: 61 total cpu time spent up to now is 10.7 secs Computing kpt #: 62 total cpu time spent up to now is 10.8 secs Computing kpt #: 63 total cpu time spent up to now is 11.0 secs Computing kpt #: 64 total cpu time spent up to now is 11.1 secs Computing kpt #: 65 total cpu time spent up to now is 11.2 secs Computing kpt #: 66 total cpu time spent up to now is 11.4 secs Computing kpt #: 67 total cpu time spent up to now is 11.5 secs Computing kpt #: 68 total cpu time spent up to now is 11.6 secs Computing kpt #: 69 total cpu time spent up to now is 11.8 secs Computing kpt #: 70 total cpu time spent up to now is 11.9 secs Computing kpt #: 71 total cpu time spent up to now is 12.1 secs Computing kpt #: 72 total cpu time spent up to now is 12.2 secs Computing kpt #: 73 total cpu time spent up to now is 12.4 secs Computing kpt #: 74 total cpu time spent up to now is 12.5 secs Computing kpt #: 75 total cpu time spent up to now is 12.6 secs Computing kpt #: 76 total cpu time spent up to now is 12.8 secs Computing kpt #: 77 total cpu time spent up to now is 12.9 secs Computing kpt #: 78 total cpu time spent up to now is 13.1 secs Computing kpt #: 79 total cpu time spent up to now is 13.2 secs Computing kpt #: 80 total cpu time spent up to now is 13.4 secs Computing kpt #: 81 total cpu time spent up to now is 13.5 secs Computing kpt #: 82 total cpu time spent up to now is 13.7 secs Computing kpt #: 83 total cpu time spent up to now is 13.9 secs Computing kpt #: 84 total cpu time spent up to now is 14.0 secs Computing kpt #: 85 total cpu time spent up to now is 14.2 secs Computing kpt #: 86 total cpu time spent up to now is 14.4 secs Computing kpt #: 87 total cpu time spent up to now is 14.6 secs Computing kpt #: 88 total cpu time spent up to now is 14.7 secs Computing kpt #: 89 total cpu time spent up to now is 14.9 secs Computing kpt #: 90 total cpu time spent up to now is 15.1 secs Computing kpt #: 91 total cpu time spent up to now is 15.2 secs Computing kpt #: 92 total cpu time spent up to now is 15.4 secs Computing kpt #: 93 total cpu time spent up to now is 15.5 secs Computing kpt #: 94 total cpu time spent up to now is 15.6 secs Computing kpt #: 95 total cpu time spent up to now is 15.8 secs Computing kpt #: 96 total cpu time spent up to now is 15.9 secs Computing kpt #: 97 total cpu time spent up to now is 16.1 secs Computing kpt #: 98 total cpu time spent up to now is 16.2 secs Computing kpt #: 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Computing kpt #: 130 total cpu time spent up to now is 20.7 secs Computing kpt #: 131 total cpu time spent up to now is 20.9 secs Computing kpt #: 132 total cpu time spent up to now is 21.0 secs Computing kpt #: 133 total cpu time spent up to now is 21.1 secs Computing kpt #: 134 total cpu time spent up to now is 21.3 secs Computing kpt #: 135 total cpu time spent up to now is 21.4 secs Computing kpt #: 136 total cpu time spent up to now is 21.6 secs Computing kpt #: 137 total cpu time spent up to now is 21.7 secs Computing kpt #: 138 total cpu time spent up to now is 21.8 secs Computing kpt #: 139 total cpu time spent up to now is 22.0 secs Computing kpt #: 140 total cpu time spent up to now is 22.1 secs Computing kpt #: 141 total cpu time spent up to now is 22.3 secs Computing kpt #: 142 total cpu time spent up to now is 22.4 secs Computing kpt #: 143 total cpu time spent up to now is 22.5 secs Computing kpt #: 144 total cpu time spent up to now is 22.7 secs Computing kpt #: 145 total cpu time spent up to now is 22.8 secs Computing kpt #: 146 total cpu time spent up to now is 23.0 secs Computing kpt #: 147 total cpu time spent up to now is 23.1 secs Computing kpt #: 148 total cpu time spent up to now is 23.2 secs Computing kpt #: 149 total cpu time spent up to now is 23.4 secs Computing kpt #: 150 total cpu time spent up to now is 23.5 secs Computing kpt #: 151 total cpu time spent up to now is 23.6 secs Computing kpt #: 152 total cpu time spent up to now is 23.8 secs Computing kpt #: 153 total cpu time spent up to now is 23.9 secs Computing kpt #: 154 total cpu time spent up to now is 24.1 secs Computing kpt #: 155 total cpu time spent up to now is 24.2 secs Computing kpt #: 156 total cpu time spent up to now is 24.3 secs Computing kpt #: 157 total cpu time spent up to now is 24.5 secs Computing kpt #: 158 total cpu time spent up to now is 24.6 secs Computing kpt #: 159 total cpu time spent up to now is 24.7 secs Computing kpt #: 160 total cpu time spent up 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total cpu time spent up to now is 29.1 secs Computing kpt #: 192 total cpu time spent up to now is 29.2 secs Computing kpt #: 193 total cpu time spent up to now is 29.3 secs Computing kpt #: 194 total cpu time spent up to now is 29.5 secs Computing kpt #: 195 total cpu time spent up to now is 29.6 secs Computing kpt #: 196 total cpu time spent up to now is 29.8 secs Computing kpt #: 197 total cpu time spent up to now is 29.9 secs Computing kpt #: 198 total cpu time spent up to now is 30.1 secs Computing kpt #: 199 total cpu time spent up to now is 30.2 secs Computing kpt #: 200 total cpu time spent up to now is 30.3 secs Computing kpt #: 201 total cpu time spent up to now is 30.5 secs Computing kpt #: 202 total cpu time spent up to now is 30.6 secs Computing kpt #: 203 total cpu time spent up to now is 30.8 secs Computing kpt #: 204 total cpu time spent up to now is 30.9 secs Computing kpt #: 205 total cpu time spent up to now is 31.1 secs Computing kpt #: 206 total cpu time spent up to now is 31.2 secs Computing kpt #: 207 total cpu time spent up to now is 31.4 secs Computing kpt #: 208 total cpu time spent up to now is 31.5 secs Computing kpt #: 209 total cpu time spent up to now is 31.7 secs Computing kpt #: 210 total cpu time spent up to now is 31.8 secs Computing kpt #: 211 total cpu time spent up to now is 31.9 secs Computing kpt #: 212 total cpu time spent up to now is 32.1 secs Computing kpt #: 213 total cpu time spent up to now is 32.2 secs Computing kpt #: 214 total cpu time spent up to now is 32.4 secs Computing kpt #: 215 total cpu time spent up to now is 32.5 secs Computing kpt #: 216 total cpu time spent up to now is 32.7 secs Computing kpt #: 217 total cpu time spent up to now is 32.9 secs Computing kpt #: 218 total cpu time spent up to now is 33.0 secs Computing kpt #: 219 total cpu time spent up to now is 33.2 secs Computing kpt #: 220 total cpu time spent up to now is 33.3 secs Computing kpt #: 221 total cpu time spent up to now is 33.5 secs Computing kpt #: 222 total cpu time spent up to now is 33.6 secs Computing kpt #: 223 total cpu time spent up to now is 33.8 secs Computing kpt #: 224 total cpu time spent up to now is 34.0 secs Computing kpt #: 225 total cpu time spent up to now is 34.1 secs Computing kpt #: 226 total cpu time spent up to now is 34.3 secs Computing kpt #: 227 total cpu time spent up to now is 34.5 secs Computing kpt #: 228 total cpu time spent up to now is 34.6 secs Computing kpt #: 229 total cpu time spent up to now is 34.8 secs Computing kpt #: 230 total cpu time spent up to now is 35.0 secs Computing kpt #: 231 total cpu time spent up to now is 35.2 secs Computing kpt #: 232 total cpu time spent up to now is 35.5 secs Computing kpt #: 233 total cpu time spent up to now is 35.7 secs Computing kpt #: 234 total cpu time spent up to now is 35.9 secs Computing kpt #: 235 total cpu time spent up to now is 36.1 secs Computing kpt #: 236 total cpu time spent up to now is 36.3 secs Computing kpt #: 237 total cpu time spent up to now is 36.6 secs Computing kpt #: 238 total cpu time spent up to now is 36.9 secs Computing kpt #: 239 total cpu time spent up to now is 37.2 secs Computing kpt #: 240 total cpu time spent up to now is 37.5 secs Computing kpt #: 241 total cpu time spent up to now is 37.8 secs Computing kpt #: 242 total cpu time spent up to now is 38.0 secs Computing kpt #: 243 total cpu time spent up to now is 38.2 secs Computing kpt #: 244 total cpu time spent up to now is 38.4 secs Computing kpt #: 245 total cpu time spent up to now is 38.6 secs Computing kpt #: 246 total cpu time spent up to now is 38.8 secs Computing kpt #: 247 total cpu time spent up to now is 39.0 secs Computing kpt #: 248 total cpu time spent up to now is 39.2 secs Computing kpt #: 249 total cpu time spent up to now is 39.4 secs Computing kpt #: 250 total cpu time spent up to now is 39.6 secs Computing kpt #: 251 total cpu time spent up to now is 39.8 secs Computing kpt #: 252 total cpu time spent up to now is 40.0 secs Computing kpt #: 253 total cpu time spent up to now is 40.2 secs Computing kpt #: 254 total cpu time spent up to now is 40.3 secs Computing kpt #: 255 total cpu time spent up to now is 40.5 secs Computing kpt #: 256 total cpu time spent up to now is 40.6 secs Computing kpt #: 257 total cpu time spent up to now is 40.8 secs Computing kpt #: 258 total cpu time spent up to now is 40.9 secs Computing kpt #: 259 total cpu time spent up to now is 41.1 secs Computing kpt #: 260 total cpu time spent up to now is 41.2 secs Computing kpt #: 261 total cpu time spent up to now is 41.4 secs Computing kpt #: 262 total cpu time spent up to now is 41.5 secs Computing kpt #: 263 total cpu time spent up to now is 41.7 secs Computing kpt #: 264 total cpu time spent up to now is 41.8 secs Computing kpt #: 265 total cpu time spent up to now is 41.9 secs Computing kpt #: 266 total cpu time spent up to now is 42.1 secs Computing kpt #: 267 total cpu time spent up to now is 42.2 secs 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total cpu time spent up to now is 44.5 secs Computing kpt #: 284 total cpu time spent up to now is 44.6 secs Computing kpt #: 285 total cpu time spent up to now is 44.7 secs Computing kpt #: 286 total cpu time spent up to now is 44.9 secs Computing kpt #: 287 total cpu time spent up to now is 45.0 secs Computing kpt #: 288 total cpu time spent up to now is 45.1 secs Computing kpt #: 289 total cpu time spent up to now is 45.3 secs Computing kpt #: 290 total cpu time spent up to now is 45.4 secs Computing kpt #: 291 total cpu time spent up to now is 45.5 secs Computing kpt #: 292 total cpu time spent up to now is 45.7 secs Computing kpt #: 293 total cpu time spent up to now is 45.8 secs Computing kpt #: 294 total cpu time spent up to now is 45.9 secs Computing kpt #: 295 total cpu time spent up to now is 46.1 secs Computing kpt #: 296 total cpu time spent up to now is 46.2 secs Computing kpt #: 297 total cpu time spent up to now is 46.3 secs Computing kpt #: 298 total cpu time spent up 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total cpu time spent up to now is 50.7 secs Computing kpt #: 330 total cpu time spent up to now is 50.9 secs Computing kpt #: 331 total cpu time spent up to now is 51.0 secs Computing kpt #: 332 total cpu time spent up to now is 51.1 secs Computing kpt #: 333 total cpu time spent up to now is 51.3 secs Computing kpt #: 334 total cpu time spent up to now is 51.4 secs Computing kpt #: 335 total cpu time spent up to now is 51.6 secs Computing kpt #: 336 total cpu time spent up to now is 51.7 secs Computing kpt #: 337 total cpu time spent up to now is 51.8 secs Computing kpt #: 338 total cpu time spent up to now is 52.0 secs Computing kpt #: 339 total cpu time spent up to now is 52.1 secs Computing kpt #: 340 total cpu time spent up to now is 52.2 secs Computing kpt #: 341 total cpu time spent up to now is 52.4 secs Computing kpt #: 342 total cpu time spent up to now is 52.5 secs Computing kpt #: 343 total cpu time spent up to now is 52.7 secs Computing kpt #: 344 total cpu time spent up to now is 52.8 secs Computing kpt #: 345 total cpu time spent up to now is 52.9 secs Computing kpt #: 346 total cpu time spent up to now is 53.1 secs Computing kpt #: 347 total cpu time spent up to now is 53.2 secs Computing kpt #: 348 total cpu time spent up to now is 53.4 secs Computing kpt #: 349 total cpu time spent up to now is 53.5 secs Computing kpt #: 350 total cpu time spent up to now is 53.6 secs Computing kpt #: 351 total cpu time spent up to now is 53.8 secs Computing kpt #: 352 total cpu time spent up to now is 54.0 secs Computing kpt #: 353 total cpu time spent up to now is 54.2 secs Computing kpt #: 354 total cpu time spent up to now is 54.3 secs Computing kpt #: 355 total cpu time spent up to now is 54.5 secs Computing kpt #: 356 total cpu time spent up to now is 54.7 secs Computing kpt #: 357 total cpu time spent up to now is 54.8 secs Computing kpt #: 358 total cpu time spent up to now is 55.0 secs Computing kpt #: 359 total cpu time spent up to now is 55.1 secs Computing kpt #: 360 total cpu time spent up to now is 55.3 secs Computing kpt #: 361 total cpu time spent up to now is 55.4 secs Computing kpt #: 362 total cpu time spent up to now is 55.6 secs Computing kpt #: 363 total cpu time spent up to now is 55.7 secs Computing kpt #: 364 total cpu time spent up to now is 55.8 secs Computing kpt #: 365 total cpu time spent up to now is 56.0 secs Computing kpt #: 366 total cpu time spent up to now is 56.1 secs Computing kpt #: 367 total cpu time spent up to now is 56.2 secs Computing kpt #: 368 total cpu time spent up to now is 56.4 secs Computing kpt #: 369 total cpu time spent up to now is 56.5 secs Computing kpt #: 370 total cpu time spent up to now is 56.7 secs Computing kpt #: 371 total cpu time spent up to now is 56.8 secs Computing kpt #: 372 total cpu time spent up to now is 56.9 secs Computing kpt #: 373 total cpu time spent up to now is 57.1 secs Computing kpt #: 374 total cpu time spent up to now is 57.2 secs Computing kpt #: 375 total cpu time spent up to now is 57.3 secs Computing kpt #: 376 total cpu time spent up to now is 57.5 secs Computing kpt #: 377 total cpu time spent up to now is 57.6 secs Computing kpt #: 378 total cpu time spent up to now is 57.7 secs Computing kpt #: 379 total cpu time spent up to now is 57.9 secs Computing kpt #: 380 total cpu time spent up to now is 58.0 secs Computing kpt #: 381 total cpu time spent up to now is 58.2 secs Computing kpt #: 382 total cpu time spent up to now is 58.3 secs Computing kpt #: 383 total cpu time spent up to now is 58.4 secs Computing kpt #: 384 total cpu time spent up to now is 58.6 secs Computing kpt #: 385 total cpu time spent up to now is 58.7 secs Computing kpt #: 386 total cpu time spent up to now is 58.8 secs Computing kpt #: 387 total cpu time spent up to now is 59.0 secs Computing kpt #: 388 total cpu time spent up to now is 59.1 secs Computing kpt #: 389 total cpu time spent up to now is 59.2 secs Computing kpt #: 390 total cpu time spent up to now is 59.4 secs Computing kpt #: 391 total cpu time spent up to now is 59.5 secs Computing kpt #: 392 total cpu time spent up to now is 59.7 secs Computing kpt #: 393 total cpu time spent up to now is 59.8 secs Computing kpt #: 394 total cpu time spent up to now is 60.0 secs Computing kpt #: 395 total cpu time spent up to now is 60.1 secs Computing kpt #: 396 total cpu time spent up to now is 60.2 secs Computing kpt #: 397 total cpu time spent up to now is 60.4 secs Computing kpt #: 398 total cpu time spent up to now is 60.5 secs Computing kpt #: 399 total cpu time spent up to now is 60.7 secs Computing kpt #: 400 total cpu time spent up to now is 60.8 secs Computing kpt #: 401 total cpu time spent up to now is 61.0 secs Computing kpt #: 402 total cpu time spent up to now is 61.1 secs Computing kpt #: 403 total cpu time spent up to now is 61.3 secs Computing kpt #: 404 total cpu time spent up to now is 61.5 secs Computing kpt #: 405 total cpu time spent up to now is 61.6 secs Computing kpt #: 406 total cpu time spent up to now is 61.8 secs Computing kpt #: 407 total cpu time spent up to now is 61.9 secs Computing kpt #: 408 total cpu time spent up to now is 62.1 secs Computing kpt #: 409 total cpu time spent up to now is 62.3 secs Computing kpt #: 410 total cpu time spent up to now is 62.4 secs Computing kpt #: 411 total cpu time spent up to now is 62.6 secs Computing kpt #: 412 total cpu time spent up to now is 62.8 secs Computing kpt #: 413 total cpu time spent up to now is 62.9 secs Computing kpt #: 414 total cpu time spent up to now is 63.1 secs Computing kpt #: 415 total cpu time spent up to now is 63.3 secs Computing kpt #: 416 total cpu time spent up to now is 63.4 secs Computing kpt #: 417 total cpu time spent up to now is 63.6 secs Computing kpt #: 418 total cpu time spent up to now is 63.8 secs Computing kpt #: 419 total cpu time spent up to now is 63.9 secs Computing kpt #: 420 total cpu time spent up to now is 64.1 secs Computing kpt #: 421 total cpu time spent up to now is 64.3 secs Computing kpt #: 422 total cpu time spent up to now is 64.4 secs Computing kpt #: 423 total cpu time spent up to now is 64.6 secs Computing kpt #: 424 total cpu time spent up to now is 64.8 secs Computing kpt #: 425 total cpu time spent up to now is 65.0 secs Computing kpt #: 426 total cpu time spent up to now is 65.2 secs Computing kpt #: 427 total cpu time spent up to now is 65.3 secs Computing kpt #: 428 total cpu time spent up to now is 65.5 secs Computing kpt #: 429 total cpu time spent up to now is 65.7 secs Computing kpt #: 430 total cpu time spent up to now is 65.9 secs Computing kpt #: 431 total cpu time spent up to now is 66.1 secs Computing kpt #: 432 total cpu time spent up to now is 66.3 secs Computing kpt #: 433 total cpu time spent up to now is 66.5 secs Computing kpt #: 434 total cpu time spent up to now is 67.0 secs Computing kpt #: 435 total cpu time spent up to now is 67.3 secs Computing kpt #: 436 total cpu time spent up to now is 67.5 secs Computing kpt #: 437 total cpu time spent up to now is 67.6 secs Computing kpt #: 438 total cpu time spent up to now is 67.7 secs Computing kpt #: 439 total cpu time spent up to now is 67.9 secs Computing kpt #: 440 total cpu time spent up to now is 68.0 secs Computing kpt #: 441 total cpu time spent up to now is 68.1 secs Computing kpt #: 442 total cpu time spent up to now is 68.3 secs Computing kpt #: 443 total cpu time spent up to now is 68.4 secs Computing kpt #: 444 total cpu time spent up to now is 68.5 secs Computing kpt #: 445 total cpu time spent up to now is 68.6 secs Computing kpt #: 446 total cpu time spent up to now is 68.8 secs Computing kpt #: 447 total cpu time spent up to now is 68.9 secs Computing kpt #: 448 total cpu time spent up to now is 69.0 secs Computing kpt #: 449 total cpu time spent up to now is 69.2 secs Computing kpt #: 450 total cpu time spent up to now is 69.3 secs Computing kpt #: 451 total cpu time spent up to now is 69.4 secs Computing kpt #: 452 total cpu time spent up to now is 69.6 secs Computing kpt #: 453 total cpu time spent up to now is 69.7 secs Computing kpt #: 454 total cpu time spent up to now is 69.8 secs Computing kpt #: 455 total cpu time spent up to now is 70.0 secs Computing kpt #: 456 total cpu time spent up to now is 70.1 secs Computing kpt #: 457 total cpu time spent up to now is 70.2 secs Computing kpt #: 458 total cpu time spent up to now is 70.3 secs Computing kpt #: 459 total cpu time spent up to now is 70.5 secs Computing kpt #: 460 total cpu time spent up to now is 70.6 secs Computing kpt #: 461 total cpu time spent up to now is 70.7 secs Computing kpt #: 462 total cpu time spent up to now is 70.9 secs Computing kpt #: 463 total cpu time spent up to now is 71.0 secs Computing kpt #: 464 total cpu time spent up to now is 71.1 secs Computing kpt #: 465 total cpu time spent up to now is 71.3 secs Computing kpt #: 466 total cpu time spent up to now is 71.4 secs Computing kpt #: 467 total cpu time spent up to now is 73.4 secs Computing kpt #: 468 total cpu time spent up to now is 73.6 secs Computing kpt #: 469 total cpu time spent up to now is 73.7 secs Computing kpt #: 470 total cpu time spent up to now is 73.8 secs Computing kpt #: 471 total cpu time spent up to now is 73.9 secs Computing kpt #: 472 total cpu time spent up to now is 74.1 secs Computing kpt #: 473 total cpu time spent up to now is 74.2 secs Computing kpt #: 474 total cpu time spent up to now is 74.3 secs Computing kpt #: 475 total cpu time spent up to now is 74.4 secs Computing kpt #: 476 total cpu time spent up to now is 74.6 secs Computing kpt #: 477 total cpu time spent up to now is 74.7 secs Computing kpt #: 478 total cpu time spent up to now is 74.8 secs Computing kpt #: 479 total cpu time spent up to now is 75.0 secs Computing kpt #: 480 total cpu time spent up to now is 75.1 secs Computing kpt #: 481 total cpu time spent up to now is 75.2 secs Computing kpt #: 482 total cpu time spent up to now is 75.4 secs Computing kpt #: 483 total cpu time spent up to now is 75.5 secs Computing kpt #: 484 total cpu time spent up to now is 75.6 secs Computing kpt #: 485 total cpu time spent up to now is 75.8 secs Computing kpt #: 486 total cpu time spent up to now is 75.9 secs Computing kpt #: 487 total cpu time spent up to now is 76.0 secs Computing kpt #: 488 total cpu time spent up to now is 76.2 secs Computing kpt #: 489 total cpu time spent up to now is 76.3 secs Computing kpt #: 490 total cpu time spent up to now is 76.5 secs Computing kpt #: 491 total cpu time spent up to now is 76.6 secs Computing kpt #: 492 total cpu time spent up to now is 76.7 secs Computing kpt #: 493 total cpu time spent up to now is 76.9 secs Computing kpt #: 494 total cpu time spent up to now is 77.0 secs Computing kpt #: 495 total cpu time spent up to now is 77.1 secs Computing kpt #: 496 total cpu time spent up to now is 77.3 secs Computing kpt #: 497 total cpu time spent up to now is 77.4 secs Computing kpt #: 498 total cpu time spent up to now is 77.6 secs Computing kpt #: 499 total cpu time spent up to now is 77.7 secs Computing kpt #: 500 total cpu time spent up to now is 77.9 secs Computing kpt #: 501 total cpu time spent up to now is 78.0 secs Computing kpt #: 502 total cpu time spent up to now is 78.2 secs Computing kpt #: 503 total cpu time spent up to now is 78.3 secs Computing kpt #: 504 total cpu time spent up to now is 78.5 secs Computing kpt #: 505 total cpu time spent up to now is 78.6 secs Computing kpt #: 506 total cpu time spent up to now is 78.8 secs Computing kpt #: 507 total cpu time spent up to now is 78.9 secs Computing kpt #: 508 total cpu time spent up to now is 79.1 secs Computing kpt #: 509 total cpu time spent up to now is 79.2 secs Computing kpt #: 510 total cpu time spent up to now is 79.4 secs Computing kpt #: 511 total cpu time spent up to now is 79.5 secs Computing kpt #: 512 total cpu time spent up to now is 79.7 secs Computing kpt #: 513 total cpu time spent up to now is 79.8 secs Computing kpt #: 514 total cpu time spent up to now is 80.0 secs Computing kpt #: 515 total cpu time spent up to now is 80.2 secs Computing kpt #: 516 total cpu time spent up to now is 80.3 secs Computing kpt #: 517 total cpu time spent up to now is 80.5 secs ethr = 4.55E-08, avg # of iterations = 13.0 total cpu time spent up to now is 80.5 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3721 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9324 -34.9324 1.9428 1.9428 6.3202 6.3202 6.8485 6.8485 8.9849 8.9849 9.1275 9.1275 9.5452 9.5452 12.3117 12.3117 16.2027 16.2027 21.2370 21.2370 21.3976 21.3976 k = 0.0000 0.0088-0.0000 ( 3711 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9003 -37.9003 -37.8928 -37.8928 -34.9324 -34.9324 1.9445 1.9445 6.3211 6.3211 6.8490 6.8490 8.9835 8.9835 9.1262 9.1262 9.5439 9.5439 12.3158 12.3158 16.2003 16.2003 21.2323 21.2323 21.3930 21.3930 k = 0.0000 0.0175-0.0000 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9005 -37.9005 -37.8929 -37.8929 -34.9323 -34.9323 1.9495 1.9495 6.3237 6.3237 6.8504 6.8504 8.9793 8.9793 9.1222 9.1222 9.5402 9.5402 12.3281 12.3281 16.1929 16.1929 21.2148 21.2148 21.3830 21.3830 k = 0.0000 0.0263-0.0000 ( 3709 PWs) bands (ev): -73.6060 -73.6060 -42.3778 -42.3778 -37.9009 -37.9009 -37.8929 -37.8929 -34.9323 -34.9323 1.9579 1.9579 6.3280 6.3280 6.8527 6.8527 8.9716 8.9716 9.1162 9.1162 9.5340 9.5340 12.3484 12.3484 16.1806 16.1806 21.1772 21.1772 21.3767 21.3767 k = 0.0000 0.0351-0.0000 ( 3707 PWs) bands (ev): -73.6060 -73.6060 -42.3781 -42.3781 -37.9015 -37.9015 -37.8930 -37.8930 -34.9322 -34.9322 1.9696 1.9696 6.3341 6.3341 6.8559 6.8559 8.9600 8.9600 9.1091 9.1091 9.5254 9.5254 12.3766 12.3766 16.1634 16.1634 21.1155 21.1155 21.3801 21.3801 k = 0.0000 0.0439-0.0000 ( 3715 PWs) bands (ev): -73.6058 -73.6058 -42.3784 -42.3784 -37.9023 -37.9023 -37.8930 -37.8930 -34.9320 -34.9320 1.9846 1.9846 6.3418 6.3418 6.8601 6.8601 8.9437 8.9437 9.1018 9.1018 9.5146 9.5146 12.4123 12.4123 16.1410 16.1410 21.0326 21.0326 21.3934 21.3934 k = 0.0000 0.0526-0.0000 ( 3715 PWs) bands (ev): -73.6057 -73.6057 -42.3787 -42.3787 -37.9033 -37.9033 -37.8930 -37.8930 -34.9319 -34.9319 2.0029 2.0029 6.3511 6.3511 6.8652 6.8652 8.9221 8.9221 9.0950 9.0950 9.5016 9.5016 12.4552 12.4552 16.1136 16.1136 20.9332 20.9332 21.4145 21.4145 k = 0.0000 0.0614-0.0000 ( 3715 PWs) bands (ev): -73.6056 -73.6056 -42.3791 -42.3791 -37.9045 -37.9045 -37.8930 -37.8930 -34.9317 -34.9317 2.0244 2.0244 6.3621 6.3621 6.8712 6.8712 8.8951 8.8951 9.0893 9.0893 9.4867 9.4867 12.5049 12.5049 16.0809 16.0809 20.8215 20.8215 21.4422 21.4422 k = 0.0000 0.0702-0.0000 ( 3711 PWs) bands (ev): -73.6054 -73.6054 -42.3796 -42.3796 -37.9059 -37.9059 -37.8929 -37.8929 -34.9315 -34.9315 2.0493 2.0493 6.3747 6.3747 6.8780 6.8780 8.8630 8.8630 9.0847 9.0847 9.4698 9.4698 12.5610 12.5610 16.0430 16.0430 20.7010 20.7010 21.4754 21.4754 k = 0.0000 0.0789-0.0000 ( 3711 PWs) bands (ev): -73.6052 -73.6052 -42.3802 -42.3802 -37.9075 -37.9075 -37.8927 -37.8927 -34.9313 -34.9313 2.0774 2.0774 6.3887 6.3887 6.8858 6.8858 8.8263 8.8263 9.0811 9.0811 9.4513 9.4513 12.6231 12.6231 15.9996 15.9996 20.5744 20.5744 21.5138 21.5138 k = 0.0000 0.0877-0.0000 ( 3713 PWs) bands (ev): -73.6050 -73.6050 -42.3808 -42.3808 -37.9093 -37.9093 -37.8926 -37.8926 -34.9310 -34.9310 2.1087 2.1087 6.4043 6.4043 6.8943 6.8943 8.7855 8.7855 9.0782 9.0782 9.4313 9.4313 12.6907 12.6907 15.9507 15.9507 20.4441 20.4441 21.5569 21.5569 k = 0.0000 0.0965-0.0000 ( 3719 PWs) bands (ev): -73.6048 -73.6048 -42.3815 -42.3815 -37.9113 -37.9113 -37.8924 -37.8924 -34.9308 -34.9308 2.1432 2.1432 6.4213 6.4213 6.9038 6.9038 8.7413 8.7413 9.0757 9.0757 9.4100 9.4100 12.7635 12.7635 15.8963 15.8963 20.3118 20.3118 21.6047 21.6047 k = 0.0000 0.1053-0.0000 ( 3719 PWs) bands (ev): -73.6045 -73.6045 -42.3822 -42.3822 -37.9135 -37.9135 -37.8921 -37.8921 -34.9305 -34.9305 2.1808 2.1808 6.4396 6.4396 6.9140 6.9140 8.6941 8.6941 9.0734 9.0734 9.3877 9.3877 12.8412 12.8412 15.8362 15.8362 20.1791 20.1791 21.6568 21.6568 k = 0.0000 0.1140-0.0000 ( 3727 PWs) bands (ev): -73.6043 -73.6043 -42.3829 -42.3829 -37.9158 -37.9158 -37.8918 -37.8918 -34.9301 -34.9301 2.2215 2.2215 6.4592 6.4592 6.9250 6.9250 8.6445 8.6445 9.0709 9.0709 9.3646 9.3646 12.9233 12.9233 15.7704 15.7704 20.0473 20.0473 21.7132 21.7132 k = 0.0000 0.1228-0.0000 ( 3737 PWs) bands (ev): -73.6040 -73.6040 -42.3838 -42.3838 -37.9183 -37.9183 -37.8915 -37.8915 -34.9298 -34.9298 2.2653 2.2653 6.4800 6.4800 6.9367 6.9367 8.5929 8.5929 9.0679 9.0679 9.3411 9.3411 13.0095 13.0095 15.6990 15.6990 19.9175 19.9175 21.7736 21.7736 k = 0.0000 0.1316-0.0000 ( 3737 PWs) bands (ev): -73.6037 -73.6037 -42.3846 -42.3846 -37.9210 -37.9210 -37.8912 -37.8912 -34.9294 -34.9294 2.3122 2.3122 6.5019 6.5019 6.9492 6.9492 8.5397 8.5397 9.0639 9.0639 9.3177 9.3177 13.0996 13.0996 15.6219 15.6219 19.7904 19.7904 21.8380 21.8380 k = 0.0000 0.1404-0.0000 ( 3733 PWs) bands (ev): -73.6033 -73.6033 -42.3856 -42.3856 -37.9238 -37.9238 -37.8908 -37.8908 -34.9291 -34.9291 2.3620 2.3620 6.5248 6.5248 6.9623 6.9623 8.4853 8.4853 9.0585 9.0585 9.2950 9.2950 13.1933 13.1933 15.5394 15.5394 19.6666 19.6666 21.9063 21.9063 k = 0.0000 0.1491-0.0000 ( 3733 PWs) bands (ev): -73.6030 -73.6030 -42.3865 -42.3865 -37.9268 -37.9268 -37.8904 -37.8904 -34.9287 -34.9287 2.4147 2.4147 6.5485 6.5485 6.9761 6.9761 8.4300 8.4300 9.0509 9.0509 9.2735 9.2735 13.2904 13.2904 15.4515 15.4515 19.5468 19.5468 21.9782 21.9782 k = 0.0000 0.1579-0.0000 ( 3737 PWs) bands (ev): -73.6027 -73.6027 -42.3875 -42.3875 -37.9299 -37.9299 -37.8900 -37.8900 -34.9283 -34.9283 2.4703 2.4703 6.5731 6.5731 6.9906 6.9906 8.3740 8.3740 9.0406 9.0406 9.2542 9.2542 13.3906 13.3906 15.3584 15.3584 19.4312 19.4312 22.0537 22.0537 k = 0.0000 0.1667-0.0000 ( 3729 PWs) bands (ev): -73.6023 -73.6023 -42.3886 -42.3886 -37.9331 -37.9331 -37.8896 -37.8896 -34.9278 -34.9278 2.5288 2.5288 6.5982 6.5982 7.0055 7.0055 8.3177 8.3177 9.0269 9.0269 9.2376 9.2376 13.4938 13.4938 15.2605 15.2605 19.3200 19.3200 22.1327 22.1327 k = 0.0000 0.1754-0.0000 ( 3733 PWs) bands (ev): -73.6019 -73.6019 -42.3897 -42.3897 -37.9364 -37.9364 -37.8891 -37.8891 -34.9274 -34.9274 2.5900 2.5900 6.6238 6.6238 7.0210 7.0210 8.2613 8.2613 9.0094 9.0094 9.2243 9.2243 13.5998 13.5998 15.1580 15.1580 19.2133 19.2133 22.2150 22.2150 k = 0.0000 0.1842-0.0000 ( 3729 PWs) bands (ev): -73.6016 -73.6016 -42.3908 -42.3908 -37.9397 -37.9397 -37.8887 -37.8887 -34.9269 -34.9269 2.6539 2.6539 6.6498 6.6498 7.0370 7.0370 8.2050 8.2050 8.9883 8.9883 9.2142 9.2142 13.7084 13.7084 15.0513 15.0513 19.1113 19.1113 22.3006 22.3006 k = 0.0000 0.1930-0.0000 ( 3729 PWs) bands (ev): -73.6012 -73.6012 -42.3919 -42.3919 -37.9432 -37.9432 -37.8882 -37.8882 -34.9264 -34.9264 2.7204 2.7204 6.6759 6.6759 7.0533 7.0533 8.1490 8.1490 8.9638 8.9638 9.2072 9.2072 13.8195 13.8195 14.9408 14.9408 19.0137 19.0137 22.3892 22.3892 k = 0.0000 0.2018-0.0000 ( 3733 PWs) bands (ev): -73.6008 -73.6008 -42.3931 -42.3931 -37.9467 -37.9467 -37.8877 -37.8877 -34.9260 -34.9260 2.7896 2.7896 6.7020 6.7020 7.0700 7.0700 8.0934 8.0934 8.9364 8.9364 9.2027 9.2027 13.9330 13.9330 14.8270 14.8270 18.9205 18.9205 22.4809 22.4809 k = 0.0000 0.2105-0.0000 ( 3733 PWs) bands (ev): -73.6004 -73.6004 -42.3943 -42.3943 -37.9503 -37.9503 -37.8872 -37.8872 -34.9255 -34.9255 2.8612 2.8612 6.7280 6.7280 7.0869 7.0869 8.0386 8.0386 8.9069 8.9069 9.2003 9.2003 14.0488 14.0488 14.7105 14.7105 18.8315 18.8315 22.5754 22.5754 k = 0.0000 0.2193-0.0000 ( 3731 PWs) bands (ev): -73.5999 -73.5999 -42.3955 -42.3955 -37.9540 -37.9540 -37.8867 -37.8867 -34.9250 -34.9250 2.9353 2.9353 6.7536 6.7536 7.1040 7.1040 7.9846 7.9846 8.8758 8.8758 9.1995 9.1995 14.1668 14.1668 14.5917 14.5917 18.7465 18.7465 22.6727 22.6727 k = 0.0000 0.2281-0.0000 ( 3737 PWs) bands (ev): -73.5995 -73.5995 -42.3967 -42.3967 -37.9576 -37.9576 -37.8862 -37.8862 -34.9245 -34.9245 3.0117 3.0117 6.7786 6.7786 7.1211 7.1211 7.9316 7.9316 8.8435 8.8435 9.1999 9.1999 14.2867 14.2867 14.4713 14.4713 18.6653 18.6653 22.7725 22.7725 k = 0.0000 0.2368-0.0000 ( 3737 PWs) bands (ev): -73.5991 -73.5991 -42.3980 -42.3980 -37.9613 -37.9613 -37.8857 -37.8857 -34.9240 -34.9240 3.0904 3.0904 6.8028 6.8028 7.1382 7.1382 7.8798 7.8798 8.8104 8.8104 9.2013 9.2013 14.3474 14.3474 14.4109 14.4109 18.5876 18.5876 22.7169 22.7169 k = 0.0000 0.2456-0.0000 ( 3733 PWs) bands (ev): -73.5987 -73.5987 -42.3992 -42.3992 -37.9650 -37.9650 -37.8852 -37.8852 -34.9235 -34.9235 3.1713 3.1713 6.8260 6.8260 7.1550 7.1550 7.8294 7.8294 8.7768 8.7768 9.2034 9.2034 14.2259 14.2259 14.5340 14.5340 18.5131 18.5131 22.6155 22.6155 k = 0.0000 0.2544-0.0000 ( 3733 PWs) bands (ev): -73.5983 -73.5983 -42.4004 -42.4004 -37.9688 -37.9688 -37.8846 -37.8846 -34.9230 -34.9230 3.2543 3.2543 6.8480 6.8480 7.1715 7.1715 7.7807 7.7807 8.7429 8.7429 9.2060 9.2060 14.1032 14.1032 14.6601 14.6601 18.4418 18.4418 22.5179 22.5179 k = 0.0000 0.2632-0.0000 ( 3737 PWs) bands (ev): -73.5978 -73.5978 -42.4017 -42.4017 -37.9725 -37.9725 -37.8841 -37.8841 -34.9225 -34.9225 3.3394 3.3394 6.8685 6.8685 7.1873 7.1873 7.7337 7.7337 8.7090 8.7090 9.2090 9.2090 13.9808 13.9808 14.7881 14.7881 18.3733 18.3733 22.4242 22.4242 k = 0.0000 0.2719-0.0000 ( 3729 PWs) bands (ev): -73.5974 -73.5974 -42.4029 -42.4029 -37.9761 -37.9761 -37.8836 -37.8836 -34.9220 -34.9220 3.4263 3.4263 6.8872 6.8872 7.2023 7.2023 7.6890 7.6890 8.6753 8.6753 9.2124 9.2124 13.8592 13.8592 14.9181 14.9181 18.3074 18.3074 22.3346 22.3346 k = 0.0000 0.2807-0.0000 ( 3729 PWs) bands (ev): -73.5970 -73.5970 -42.4042 -42.4042 -37.9798 -37.9798 -37.8831 -37.8831 -34.9215 -34.9215 3.5151 3.5151 6.9039 6.9039 7.2159 7.2159 7.6467 7.6467 8.6418 8.6418 9.2160 9.2160 13.7390 13.7390 15.0498 15.0498 18.2439 18.2439 22.2490 22.2490 k = 0.0000 0.2895-0.0000 ( 3733 PWs) bands (ev): -73.5966 -73.5966 -42.4054 -42.4054 -37.9834 -37.9834 -37.8826 -37.8826 -34.9210 -34.9210 3.6056 3.6056 6.9183 6.9183 7.2278 7.2278 7.6076 7.6076 8.6087 8.6087 9.2197 9.2197 13.6206 13.6206 15.1834 15.1834 18.1828 18.1828 22.1678 22.1678 k = 0.0000 0.2982-0.0000 ( 3739 PWs) bands (ev): -73.5962 -73.5962 -42.4066 -42.4066 -37.9869 -37.9869 -37.8820 -37.8820 -34.9205 -34.9205 3.6978 3.6978 6.9302 6.9302 7.2373 7.2373 7.5721 7.5721 8.5762 8.5762 9.2236 9.2236 13.5045 13.5045 15.3187 15.3187 18.1239 18.1239 22.0908 22.0908 k = 0.0000 0.3070-0.0000 ( 3743 PWs) bands (ev): -73.5958 -73.5958 -42.4078 -42.4078 -37.9904 -37.9904 -37.8815 -37.8815 -34.9200 -34.9200 3.7915 3.7915 6.9392 6.9392 7.2434 7.2434 7.5413 7.5413 8.5444 8.5444 9.2276 9.2276 13.3912 13.3912 15.4558 15.4558 18.0670 18.0670 22.0182 22.0182 k = 0.0000 0.3158-0.0000 ( 3747 PWs) bands (ev): -73.5954 -73.5954 -42.4090 -42.4090 -37.9938 -37.9938 -37.8811 -37.8811 -34.9196 -34.9196 3.8865 3.8865 6.9452 6.9452 7.2451 7.2451 7.5160 7.5160 8.5132 8.5132 9.2316 9.2316 13.2811 13.2811 15.5946 15.5946 18.0121 18.0121 21.9500 21.9500 k = 0.0000 0.3246-0.0000 ( 3751 PWs) bands (ev): -73.5950 -73.5950 -42.4101 -42.4101 -37.9971 -37.9971 -37.8806 -37.8806 -34.9191 -34.9191 3.9829 3.9829 6.9477 6.9477 7.2416 7.2416 7.4973 7.4973 8.4829 8.4829 9.2356 9.2356 13.1745 13.1745 15.7350 15.7350 17.9592 17.9592 21.8860 21.8860 k = 0.0000 0.3333-0.0000 ( 3747 PWs) bands (ev): -73.5946 -73.5946 -42.4112 -42.4112 -38.0004 -38.0004 -37.8801 -37.8801 -34.9187 -34.9187 4.0803 4.0803 6.9467 6.9467 7.2325 7.2325 7.4854 7.4854 8.4535 8.4535 9.2396 9.2396 13.0718 13.0718 15.8771 15.8771 17.9083 17.9083 21.8264 21.8264 k = 0.0000 0.3421-0.0000 ( 3747 PWs) bands (ev): -73.5943 -73.5943 -42.4123 -42.4123 -38.0035 -38.0035 -37.8797 -37.8797 -34.9183 -34.9183 4.1788 4.1788 6.9418 6.9418 7.2182 7.2182 7.4799 7.4799 8.4251 8.4251 9.2435 9.2435 12.9734 12.9734 16.0208 16.0208 17.8592 17.8592 21.7711 21.7711 k = 0.0000 0.3509-0.0000 ( 3747 PWs) bands (ev): -73.5939 -73.5939 -42.4134 -42.4134 -38.0065 -38.0065 -37.8792 -37.8792 -34.9178 -34.9178 4.2781 4.2781 6.9329 6.9329 7.1999 7.1999 7.4795 7.4795 8.3977 8.3977 9.2473 9.2473 12.8796 12.8796 16.1662 16.1662 17.8122 17.8122 21.7199 21.7199 k = 0.0000 0.3596-0.0000 ( 3747 PWs) bands (ev): -73.5936 -73.5936 -42.4144 -42.4144 -38.0094 -38.0094 -37.8788 -37.8788 -34.9174 -34.9174 4.3782 4.3782 6.9198 6.9198 7.1789 7.1789 7.4829 7.4829 8.3714 8.3714 9.2510 9.2510 12.7907 12.7907 16.3130 16.3130 17.7672 17.7672 21.6727 21.6727 k = 0.0000 0.3684-0.0000 ( 3739 PWs) bands (ev): -73.5933 -73.5933 -42.4153 -42.4153 -38.0121 -38.0121 -37.8784 -37.8784 -34.9171 -34.9171 4.4787 4.4787 6.9023 6.9023 7.1565 7.1565 7.4888 7.4888 8.3463 8.3463 9.2546 9.2546 12.7068 12.7068 16.4614 16.4614 17.7242 17.7242 21.6293 21.6293 k = 0.0000 0.3772-0.0000 ( 3735 PWs) bands (ev): -73.5930 -73.5930 -42.4163 -42.4163 -38.0147 -38.0147 -37.8780 -37.8780 -34.9167 -34.9167 4.5795 4.5795 6.8805 6.8805 7.1336 7.1336 7.4962 7.4962 8.3225 8.3225 9.2581 9.2581 12.6282 12.6282 16.6112 16.6112 17.6834 17.6834 21.5887 21.5887 k = 0.0000 0.3860-0.0000 ( 3737 PWs) bands (ev): -73.5927 -73.5927 -42.4171 -42.4171 -38.0172 -38.0172 -37.8777 -37.8777 -34.9164 -34.9164 4.6805 4.6805 6.8541 6.8541 7.1107 7.1107 7.5046 7.5046 8.3000 8.3000 9.2613 9.2613 12.5550 12.5550 16.7623 16.7623 17.6448 17.6448 21.4992 21.4992 k = 0.0000 0.3947-0.0000 ( 3729 PWs) bands (ev): -73.5924 -73.5924 -42.4179 -42.4179 -38.0195 -38.0195 -37.8773 -37.8773 -34.9160 -34.9160 4.7813 4.7813 6.8233 6.8233 7.0885 7.0885 7.5133 7.5133 8.2789 8.2789 9.2644 9.2644 12.4874 12.4874 16.9147 16.9147 17.6086 17.6086 21.3043 21.3043 k = 0.0000 0.4035-0.0000 ( 3733 PWs) bands (ev): -73.5922 -73.5922 -42.4187 -42.4187 -38.0216 -38.0216 -37.8770 -37.8770 -34.9157 -34.9157 4.8817 4.8817 6.7879 6.7879 7.0672 7.0672 7.5221 7.5221 8.2592 8.2592 9.2673 9.2673 12.4253 12.4253 17.0681 17.0681 17.5749 17.5749 21.1089 21.1089 k = 0.0000 0.4123-0.0000 ( 3729 PWs) bands (ev): -73.5919 -73.5919 -42.4194 -42.4194 -38.0236 -38.0236 -37.8767 -37.8767 -34.9155 -34.9155 4.9814 4.9814 6.7480 6.7480 7.0472 7.0472 7.5306 7.5306 8.2411 8.2411 9.2700 9.2700 12.3689 12.3689 17.2222 17.2222 17.5441 17.5441 20.9157 20.9157 k = 0.0000 0.4211-0.0000 ( 3723 PWs) bands (ev): -73.5917 -73.5917 -42.4200 -42.4200 -38.0254 -38.0254 -37.8765 -37.8765 -34.9152 -34.9152 5.0800 5.0800 6.7039 6.7039 7.0287 7.0287 7.5388 7.5388 8.2245 8.2245 9.2725 9.2725 12.3182 12.3182 17.3754 17.3754 17.5175 17.5175 20.7254 20.7254 k = 0.0000 0.4298-0.0000 ( 3723 PWs) bands (ev): -73.5915 -73.5915 -42.4206 -42.4206 -38.0271 -38.0271 -37.8762 -37.8762 -34.9150 -34.9150 5.1770 5.1770 6.6557 6.6557 7.0120 7.0120 7.5463 7.5463 8.2095 8.2095 9.2747 9.2747 12.2731 12.2731 17.4780 17.4780 17.5447 17.5447 20.5383 20.5383 k = 0.0000 0.4386-0.0000 ( 3721 PWs) bands (ev): -73.5914 -73.5914 -42.4211 -42.4211 -38.0285 -38.0285 -37.8760 -37.8760 -34.9148 -34.9148 5.2718 5.2718 6.6042 6.6042 6.9970 6.9970 7.5533 7.5533 8.1961 8.1961 9.2767 9.2767 12.2335 12.2335 17.4618 17.4618 17.6933 17.6933 20.3549 20.3549 k = 0.0000 0.4474-0.0000 ( 3717 PWs) bands (ev): -73.5912 -73.5912 -42.4216 -42.4216 -38.0298 -38.0298 -37.8758 -37.8758 -34.9146 -34.9146 5.3636 5.3636 6.5499 6.5499 6.9839 6.9839 7.5594 7.5594 8.1845 8.1845 9.2785 9.2785 12.1995 12.1995 17.4424 17.4424 17.8469 17.8469 20.1763 20.1763 k = 0.0000 0.4561-0.0000 ( 3715 PWs) bands (ev): -73.5911 -73.5911 -42.4220 -42.4220 -38.0309 -38.0309 -37.8757 -37.8757 -34.9144 -34.9144 5.4512 5.4512 6.4940 6.4940 6.9727 6.9727 7.5648 7.5648 8.1746 8.1746 9.2800 9.2800 12.1708 12.1708 17.4254 17.4254 17.9988 17.9988 20.0037 20.0037 k = 0.0000 0.4649-0.0000 ( 3717 PWs) bands (ev): -73.5910 -73.5910 -42.4223 -42.4223 -38.0318 -38.0318 -37.8756 -37.8756 -34.9143 -34.9143 5.5329 5.5329 6.4383 6.4383 6.9636 6.9636 7.5692 7.5692 8.1664 8.1664 9.2812 9.2812 12.1475 12.1475 17.4112 17.4112 18.1460 18.1460 19.8397 19.8397 k = 0.0000 0.4737-0.0000 ( 3722 PWs) bands (ev): -73.5909 -73.5909 -42.4225 -42.4225 -38.0325 -38.0325 -37.8754 -37.8754 -34.9142 -34.9142 5.6059 5.6059 6.3854 6.3854 6.9564 6.9564 7.5727 7.5727 8.1601 8.1601 9.2822 9.2822 12.1295 12.1295 17.4001 17.4001 18.2840 18.2840 19.6886 19.6886 k = 0.0000 0.4825-0.0000 ( 3716 PWs) bands (ev): -73.5908 -73.5908 -42.4227 -42.4227 -38.0330 -38.0330 -37.8754 -37.8754 -34.9141 -34.9141 5.6659 5.6659 6.3398 6.3398 6.9513 6.9513 7.5752 7.5752 8.1555 8.1555 9.2829 9.2829 12.1167 12.1167 17.3921 17.3921 18.4043 18.4043 19.5590 19.5590 k = 0.0000 0.4912-0.0000 ( 3712 PWs) bands (ev): -73.5908 -73.5908 -42.4228 -42.4228 -38.0333 -38.0333 -37.8753 -37.8753 -34.9141 -34.9141 5.7067 5.7067 6.3077 6.3077 6.9482 6.9482 7.5767 7.5767 8.1528 8.1528 9.2833 9.2833 12.1090 12.1090 17.3873 17.3873 18.4916 18.4916 19.4661 19.4661 k = 0.0000 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7213 5.7213 6.2958 6.2958 6.9472 6.9472 7.5772 7.5772 8.1519 8.1519 9.2834 9.2834 12.1065 12.1065 17.3857 17.3857 18.5247 18.5247 19.4311 19.4311 k = 0.0000 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7213 5.7213 6.2958 6.2958 6.9472 6.9472 7.5772 7.5772 8.1519 8.1519 9.2834 9.2834 12.1065 12.1065 17.3857 17.3857 18.5247 18.5247 19.4311 19.4311 k = 0.0088 0.5000-0.0000 ( 3718 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8754 -37.8754 -34.9141 -34.9141 5.7168 5.7168 6.2981 6.2981 6.9477 6.9477 7.5779 7.5779 8.1573 8.1573 9.2819 9.2819 12.1067 12.1067 17.3846 17.3846 18.5279 18.5279 19.4308 19.4308 k = 0.0175 0.5000-0.0000 ( 3714 PWs) bands (ev): -73.5907 -73.5907 -42.4230 -42.4230 -38.0334 -38.0334 -37.8756 -37.8756 -34.9140 -34.9140 5.7031 5.7031 6.3050 6.3050 6.9493 6.9493 7.5799 7.5799 8.1734 8.1734 9.2775 9.2775 12.1074 12.1074 17.3813 17.3813 18.5376 18.5376 19.4298 19.4298 k = 0.0263 0.5000-0.0000 ( 3718 PWs) bands (ev): -73.5907 -73.5907 -42.4231 -42.4231 -38.0335 -38.0335 -37.8759 -37.8759 -34.9140 -34.9140 5.6809 5.6809 6.3165 6.3165 6.9518 6.9518 7.5831 7.5831 8.1997 8.1997 9.2701 9.2701 12.1085 12.1085 17.3759 17.3759 18.5536 18.5536 19.4282 19.4282 k = 0.0351 0.5000-0.0000 ( 3718 PWs) bands (ev): -73.5906 -73.5906 -42.4233 -42.4233 -38.0336 -38.0336 -37.8764 -37.8764 -34.9139 -34.9139 5.6506 5.6506 6.3324 6.3324 6.9554 6.9554 7.5877 7.5877 8.2358 8.2358 9.2599 9.2599 12.1101 12.1101 17.3683 17.3683 18.5759 18.5759 19.4260 19.4260 k = 0.0439 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5905 -73.5905 -42.4236 -42.4236 -38.0337 -38.0337 -37.8770 -37.8770 -34.9138 -34.9138 5.6131 5.6131 6.3528 6.3528 6.9599 6.9599 7.5935 7.5935 8.2810 8.2810 9.2468 9.2468 12.1121 12.1121 17.3586 17.3586 18.6046 18.6046 19.4232 19.4232 k = 0.0526 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5904 -73.5904 -42.4239 -42.4239 -38.0339 -38.0339 -37.8778 -37.8778 -34.9137 -34.9137 5.5691 5.5691 6.3776 6.3776 6.9654 6.9654 7.6005 7.6005 8.3344 8.3344 9.2311 9.2311 12.1146 12.1146 17.3467 17.3467 18.6394 18.6394 19.4196 19.4196 k = 0.0614 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5902 -73.5902 -42.4243 -42.4243 -38.0341 -38.0341 -37.8786 -37.8786 -34.9135 -34.9135 5.5195 5.5195 6.4067 6.4067 6.9718 6.9718 7.6088 7.6088 8.3952 8.3952 9.2129 9.2129 12.1175 12.1175 17.3328 17.3328 18.6803 18.6803 19.4155 19.4155 k = 0.0702 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5901 -73.5901 -42.4247 -42.4247 -38.0343 -38.0343 -37.8796 -37.8796 -34.9134 -34.9134 5.4651 5.4651 6.4402 6.4402 6.9791 6.9791 7.6183 7.6183 8.4624 8.4624 9.1923 9.1923 12.1209 12.1209 17.3168 17.3168 18.7273 18.7273 19.4107 19.4107 k = 0.0789 0.5000-0.0000 ( 3728 PWs) bands (ev): -73.5899 -73.5899 -42.4252 -42.4252 -38.0346 -38.0346 -37.8807 -37.8807 -34.9132 -34.9132 5.4068 5.4068 6.4779 6.4779 6.9873 6.9873 7.6289 7.6289 8.5354 8.5354 9.1696 9.1696 12.1247 12.1247 17.2988 17.2988 18.7800 18.7800 19.4053 19.4053 k = 0.0877 0.5000-0.0000 ( 3732 PWs) bands (ev): -73.5897 -73.5897 -42.4257 -42.4257 -38.0349 -38.0349 -37.8819 -37.8819 -34.9130 -34.9130 5.3451 5.3451 6.5198 6.5198 6.9964 6.9964 7.6406 7.6406 8.6130 8.6130 9.1451 9.1451 12.1290 12.1290 17.2789 17.2789 18.8385 18.8385 19.3992 19.3992 k = 0.0965 0.5000-0.0000 ( 3732 PWs) bands (ev): -73.5895 -73.5895 -42.4263 -42.4263 -38.0352 -38.0352 -37.8831 -37.8831 -34.9127 -34.9127 5.2808 5.2808 6.5660 6.5660 7.0063 7.0063 7.6535 7.6535 8.6943 8.6943 9.1195 9.1195 12.1338 12.1338 17.2570 17.2570 18.9026 18.9026 19.3925 19.3925 k = 0.1053 0.5000-0.0000 ( 3732 PWs) bands (ev): -73.5892 -73.5892 -42.4269 -42.4269 -38.0356 -38.0356 -37.8845 -37.8845 -34.9125 -34.9125 5.2143 5.2143 6.6162 6.6162 7.0171 7.0171 7.6675 7.6675 8.7774 8.7774 9.0940 9.0940 12.1389 12.1389 17.2332 17.2332 18.9721 18.9721 19.3852 19.3852 k = 0.1140 0.5000-0.0000 ( 3736 PWs) bands (ev): -73.5889 -73.5889 -42.4276 -42.4276 -38.0361 -38.0361 -37.8860 -37.8860 -34.9122 -34.9122 5.1462 5.1462 6.6704 6.6704 7.0287 7.0287 7.6825 7.6825 8.8581 8.8581 9.0728 9.0728 12.1446 12.1446 17.2076 17.2076 19.0468 19.0468 19.3772 19.3772 k = 0.1228 0.5000-0.0000 ( 3732 PWs) bands (ev): -73.5887 -73.5887 -42.4283 -42.4283 -38.0365 -38.0365 -37.8875 -37.8875 -34.9119 -34.9119 5.0769 5.0769 6.7286 6.7286 7.0411 7.0411 7.6985 7.6985 8.9212 8.9212 9.0705 9.0705 12.1506 12.1506 17.1803 17.1803 19.1265 19.1265 19.3687 19.3687 k = 0.1316 0.5000-0.0000 ( 3728 PWs) bands (ev): -73.5884 -73.5884 -42.4291 -42.4291 -38.0371 -38.0371 -37.8891 -37.8891 -34.9116 -34.9116 5.0067 5.0067 6.7907 6.7907 7.0544 7.0544 7.7155 7.7155 8.9368 8.9368 9.1170 9.1170 12.1571 12.1571 17.1512 17.1512 19.2109 19.2109 19.3598 19.3598 k = 0.1404 0.5000-0.0000 ( 3724 PWs) bands (ev): -73.5881 -73.5881 -42.4299 -42.4299 -38.0377 -38.0377 -37.8907 -37.8907 -34.9113 -34.9113 4.9361 4.9361 6.8563 6.8563 7.0688 7.0688 7.7333 7.7333 8.9173 8.9173 9.1997 9.1997 12.1641 12.1641 17.1205 17.1205 19.2984 19.2984 19.3520 19.3520 k = 0.1491 0.5000-0.0000 ( 3724 PWs) bands (ev): -73.5877 -73.5877 -42.4307 -42.4307 -38.0384 -38.0384 -37.8924 -37.8924 -34.9110 -34.9110 4.8653 4.8653 6.9250 6.9250 7.0844 7.0844 7.7521 7.7521 8.8863 8.8863 9.2947 9.2947 12.1715 12.1715 17.0882 17.0882 19.3355 19.3355 19.3985 19.3985 k = 0.1579 0.5000-0.0000 ( 3724 PWs) bands (ev): -73.5874 -73.5874 -42.4316 -42.4316 -38.0391 -38.0391 -37.8941 -37.8941 -34.9106 -34.9106 4.7944 4.7944 6.9958 6.9958 7.1023 7.1023 7.7716 7.7716 8.8510 8.8510 9.3950 9.3950 12.1793 12.1793 17.0545 17.0545 19.3259 19.3259 19.4954 19.4954 k = 0.1667 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5870 -73.5870 -42.4325 -42.4325 -38.0399 -38.0399 -37.8958 -37.8958 -34.9103 -34.9103 4.7239 4.7239 7.0633 7.0633 7.1277 7.1277 7.7919 7.7919 8.8136 8.8136 9.4982 9.4982 12.1876 12.1876 17.0193 17.0193 19.3144 19.3144 19.5978 19.5978 k = 0.1754 0.5000-0.0000 ( 3730 PWs) bands (ev): -73.5867 -73.5867 -42.4335 -42.4335 -38.0408 -38.0408 -37.8975 -37.8975 -34.9099 -34.9099 4.6538 4.6538 7.1090 7.1090 7.1790 7.1790 7.8128 7.8128 8.7749 8.7749 9.6034 9.6034 12.1963 12.1963 16.9827 16.9827 19.3021 19.3021 19.7045 19.7045 k = 0.1842 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5863 -73.5863 -42.4344 -42.4344 -38.0417 -38.0417 -37.8992 -37.8992 -34.9095 -34.9095 4.5844 4.5844 7.1336 7.1336 7.2551 7.2551 7.8343 7.8343 8.7354 8.7354 9.7102 9.7102 12.2055 12.2055 16.9449 16.9449 19.2891 19.2891 19.8152 19.8152 k = 0.1930 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5859 -73.5859 -42.4354 -42.4354 -38.0427 -38.0427 -37.9010 -37.9010 -34.9091 -34.9091 4.5157 4.5157 7.1533 7.1533 7.3400 7.3400 7.8563 7.8563 8.6955 8.6955 9.8182 9.8182 12.2150 12.2150 16.9058 16.9058 19.2755 19.2755 19.9296 19.9296 k = 0.2018 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5855 -73.5855 -42.4365 -42.4365 -38.0438 -38.0438 -37.9026 -37.9026 -34.9087 -34.9087 4.4479 4.4479 7.1719 7.1719 7.4293 7.4293 7.8787 7.8787 8.6557 8.6557 9.9272 9.9272 12.2251 12.2251 16.8656 16.8656 19.2613 19.2613 20.0475 20.0475 k = 0.2105 0.5000-0.0000 ( 3722 PWs) bands (ev): -73.5851 -73.5851 -42.4375 -42.4375 -38.0450 -38.0450 -37.9043 -37.9043 -34.9083 -34.9083 4.3812 4.3812 7.1902 7.1902 7.5220 7.5220 7.9014 7.9014 8.6161 8.6161 10.0369 10.0369 12.2355 12.2355 16.8244 16.8244 19.2466 19.2466 20.1688 20.1688 k = 0.2193 0.5000-0.0000 ( 3720 PWs) bands (ev): -73.5847 -73.5847 -42.4386 -42.4386 -38.0462 -38.0462 -37.9059 -37.9059 -34.9079 -34.9079 4.3157 4.3157 7.2086 7.2086 7.6174 7.6174 7.9244 7.9244 8.5772 8.5772 10.1471 10.1471 12.2464 12.2464 16.7821 16.7821 19.2314 19.2314 20.2932 20.2932 k = 0.2281 0.5000-0.0000 ( 3720 PWs) bands (ev): -73.5843 -73.5843 -42.4396 -42.4396 -38.0475 -38.0475 -37.9075 -37.9075 -34.9075 -34.9075 4.2514 4.2514 7.2271 7.2271 7.7149 7.7149 7.9476 7.9476 8.5394 8.5394 10.2577 10.2577 12.2578 12.2578 16.7390 16.7390 19.2156 19.2156 20.4206 20.4206 k = 0.2368 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5839 -73.5839 -42.4407 -42.4407 -38.0489 -38.0489 -37.9090 -37.9090 -34.9071 -34.9071 4.1885 4.1885 7.2457 7.2457 7.8132 7.8132 7.9716 7.9716 8.5034 8.5034 10.3685 10.3685 12.2695 12.2695 16.6950 16.6950 19.1994 19.1994 20.5507 20.5507 k = 0.2456 0.5000-0.0000 ( 3734 PWs) bands (ev): -73.5835 -73.5835 -42.4418 -42.4418 -38.0503 -38.0503 -37.9105 -37.9105 -34.9066 -34.9066 4.1270 4.1270 7.2644 7.2644 7.9084 7.9084 7.9992 7.9992 8.4700 8.4700 10.4794 10.4794 12.2817 12.2817 16.6502 16.6502 19.1828 19.1828 20.6832 20.6832 k = 0.2544 0.5000-0.0000 ( 3740 PWs) bands (ev): -73.5831 -73.5831 -42.4429 -42.4429 -38.0518 -38.0518 -37.9119 -37.9119 -34.9062 -34.9062 4.0670 4.0670 7.2831 7.2831 7.9799 7.9799 8.0490 8.0490 8.4411 8.4411 10.5901 10.5901 12.2944 12.2944 16.6048 16.6048 19.1658 19.1658 20.8179 20.8179 k = 0.2632 0.5000-0.0000 ( 3732 PWs) bands (ev): -73.5827 -73.5827 -42.4440 -42.4440 -38.0534 -38.0534 -37.9132 -37.9132 -34.9058 -34.9058 4.0086 4.0086 7.3018 7.3018 8.0114 8.0114 8.1335 8.1335 8.4204 8.4204 10.7006 10.7006 12.3075 12.3075 16.5588 16.5588 19.1485 19.1485 20.8328 20.8328 k = 0.2719 0.5000-0.0000 ( 3728 PWs) bands (ev): -73.5823 -73.5823 -42.4451 -42.4451 -38.0550 -38.0550 -37.9145 -37.9145 -34.9054 -34.9054 3.9519 3.9519 7.3204 7.3204 8.0288 8.0288 8.2164 8.2164 8.4181 8.4181 10.8107 10.8107 12.3210 12.3210 16.5122 16.5122 19.1309 19.1309 20.7086 20.7086 k = 0.2807 0.5000-0.0000 ( 3724 PWs) bands (ev): -73.5818 -73.5818 -42.4462 -42.4462 -38.0566 -38.0566 -37.9157 -37.9157 -34.9049 -34.9049 3.8968 3.8968 7.3389 7.3389 8.0392 8.0392 8.2685 8.2685 8.4559 8.4559 10.9203 10.9203 12.3350 12.3350 16.4652 16.4652 19.1131 19.1131 20.5658 20.5658 k = 0.2895 0.5000-0.0000 ( 3712 PWs) bands (ev): -73.5814 -73.5814 -42.4472 -42.4472 -38.0583 -38.0583 -37.9168 -37.9168 -34.9045 -34.9045 3.8436 3.8436 7.3571 7.3571 8.0428 8.0428 8.2857 8.2857 8.5377 8.5377 11.0291 11.0291 12.3495 12.3495 16.4177 16.4177 19.0951 19.0951 20.4080 20.4080 k = 0.2982 0.5000-0.0000 ( 3712 PWs) bands (ev): -73.5810 -73.5810 -42.4483 -42.4483 -38.0600 -38.0600 -37.9179 -37.9179 -34.9041 -34.9041 3.7922 3.7922 7.3751 7.3751 8.0391 8.0391 8.2918 8.2918 8.6397 8.6397 11.1370 11.1370 12.3644 12.3644 16.3700 16.3700 19.0771 19.0771 20.2392 20.2392 k = 0.3070 0.5000-0.0000 ( 3712 PWs) bands (ev): -73.5807 -73.5807 -42.4493 -42.4493 -38.0618 -38.0618 -37.9188 -37.9188 -34.9037 -34.9037 3.7426 3.7426 7.3927 7.3927 8.0286 8.0286 8.2988 8.2988 8.7494 8.7494 11.2438 11.2438 12.3798 12.3798 16.3221 16.3221 19.0589 19.0589 20.0631 20.0631 k = 0.3158 0.5000-0.0000 ( 3716 PWs) bands (ev): -73.5803 -73.5803 -42.4504 -42.4504 -38.0635 -38.0635 -37.9198 -37.9198 -34.9033 -34.9033 3.6950 3.6950 7.4099 7.4099 8.0128 8.0128 8.3092 8.3092 8.8623 8.8623 11.3493 11.3493 12.3957 12.3957 16.2741 16.2741 19.0408 19.0408 19.8828 19.8828 k = 0.3246 0.5000-0.0000 ( 3712 PWs) bands (ev): -73.5799 -73.5799 -42.4514 -42.4514 -38.0653 -38.0653 -37.9206 -37.9206 -34.9029 -34.9029 3.6493 3.6493 7.4265 7.4265 7.9932 7.9932 8.3228 8.3228 8.9767 8.9767 11.4534 11.4534 12.4121 12.4121 16.2260 16.2260 19.0228 19.0228 19.7005 19.7005 k = 0.3333 0.5000-0.0000 ( 3720 PWs) bands (ev): -73.5795 -73.5795 -42.4524 -42.4524 -38.0670 -38.0670 -37.9213 -37.9213 -34.9026 -34.9026 3.6056 3.6056 7.4425 7.4425 7.9715 7.9715 8.3387 8.3387 9.0915 9.0915 11.5557 11.5557 12.4291 12.4291 16.1780 16.1780 19.0049 19.0049 19.5181 19.5181 k = 0.3421 0.5000-0.0000 ( 3720 PWs) bands (ev): -73.5792 -73.5792 -42.4533 -42.4533 -38.0688 -38.0688 -37.9220 -37.9220 -34.9022 -34.9022 3.5639 3.5639 7.4578 7.4578 7.9488 7.9488 8.3560 8.3560 9.2061 9.2061 11.6560 11.6560 12.4467 12.4467 16.1302 16.1302 18.9871 18.9871 19.3371 19.3371 k = 0.3509 0.5000-0.0000 ( 3724 PWs) bands (ev): -73.5788 -73.5788 -42.4542 -42.4542 -38.0705 -38.0705 -37.9227 -37.9227 -34.9019 -34.9019 3.5244 3.5244 7.4722 7.4722 7.9260 7.9260 8.3742 8.3742 9.3197 9.3197 11.7541 11.7541 12.4648 12.4648 16.0827 16.0827 18.9691 18.9691 19.1591 19.1591 k = 0.3596 0.5000-0.0000 ( 3716 PWs) bands (ev): -73.5785 -73.5785 -42.4551 -42.4551 -38.0722 -38.0722 -37.9233 -37.9233 -34.9015 -34.9015 3.4869 3.4869 7.4857 7.4857 7.9037 7.9037 8.3926 8.3926 9.4318 9.4318 11.8495 11.8495 12.4837 12.4837 16.0357 16.0357 18.9449 18.9449 18.9911 18.9911 k = 0.3684 0.5000-0.0000 ( 3716 PWs) bands (ev): -73.5782 -73.5782 -42.4559 -42.4559 -38.0738 -38.0738 -37.9238 -37.9238 -34.9012 -34.9012 3.4515 3.4515 7.4982 7.4982 7.8823 7.8823 8.4110 8.4110 9.5418 9.5418 11.9420 11.9420 12.5032 12.5032 15.9893 15.9893 18.8078 18.8078 18.9407 18.9407 k = 0.3772 0.5000-0.0000 ( 3704 PWs) bands (ev): -73.5779 -73.5779 -42.4568 -42.4568 -38.0753 -38.0753 -37.9242 -37.9242 -34.9009 -34.9009 3.4184 3.4184 7.5095 7.5095 7.8623 7.8623 8.4290 8.4290 9.6491 9.6491 12.0310 12.0310 12.5236 12.5236 15.9438 15.9438 18.6430 18.6430 18.9237 18.9237 k = 0.3860 0.5000-0.0000 ( 3708 PWs) bands (ev): -73.5776 -73.5776 -42.4575 -42.4575 -38.0768 -38.0768 -37.9247 -37.9247 -34.9006 -34.9006 3.3874 3.3874 7.5196 7.5196 7.8438 7.8438 8.4465 8.4465 9.7531 9.7531 12.1161 12.1161 12.5449 12.5449 15.8992 15.8992 18.4830 18.4830 18.9083 18.9083 k = 0.3947 0.5000-0.0000 ( 3716 PWs) bands (ev): -73.5774 -73.5774 -42.4582 -42.4582 -38.0783 -38.0783 -37.9250 -37.9250 -34.9003 -34.9003 3.3586 3.3586 7.5283 7.5283 7.8272 7.8272 8.4631 8.4631 9.8530 9.8530 12.1966 12.1966 12.5673 12.5673 15.8559 15.8559 18.3294 18.3294 18.8938 18.8938 k = 0.4035 0.5000-0.0000 ( 3714 PWs) bands (ev): -73.5771 -73.5771 -42.4589 -42.4589 -38.0796 -38.0796 -37.9254 -37.9254 -34.9001 -34.9001 3.3320 3.3320 7.5355 7.5355 7.8125 7.8125 8.4789 8.4789 9.9482 9.9482 12.2718 12.2718 12.5911 12.5911 15.8142 15.8142 18.1831 18.1831 18.8803 18.8803 k = 0.4123 0.5000-0.0000 ( 3710 PWs) bands (ev): -73.5769 -73.5769 -42.4595 -42.4595 -38.0809 -38.0809 -37.9257 -37.9257 -34.8999 -34.8999 3.3077 3.3077 7.5413 7.5413 7.7998 7.7998 8.4937 8.4937 10.0382 10.0382 12.3408 12.3408 12.6165 12.6165 15.7742 15.7742 18.0451 18.0451 18.8677 18.8677 k = 0.4211 0.5000-0.0000 ( 3706 PWs) bands (ev): -73.5767 -73.5767 -42.4601 -42.4601 -38.0820 -38.0820 -37.9259 -37.9259 -34.8996 -34.8996 3.2856 3.2856 7.5456 7.5456 7.7893 7.7893 8.5074 8.5074 10.1221 10.1221 12.4026 12.4026 12.6439 12.6439 15.7364 15.7364 17.9162 17.9162 18.8561 18.8561 k = 0.4298 0.5000-0.0000 ( 3710 PWs) bands (ev): -73.5765 -73.5765 -42.4606 -42.4606 -38.0831 -38.0831 -37.9261 -37.9261 -34.8994 -34.8994 3.2658 3.2658 7.5485 7.5485 7.7807 7.7807 8.5198 8.5198 10.1992 10.1992 12.4563 12.4563 12.6734 12.6734 15.7010 15.7010 17.7972 17.7972 18.8456 18.8456 k = 0.4386 0.5000-0.0000 ( 3706 PWs) bands (ev): -73.5763 -73.5763 -42.4610 -42.4610 -38.0840 -38.0840 -37.9263 -37.9263 -34.8993 -34.8993 3.2483 3.2483 7.5502 7.5502 7.7739 7.7739 8.5310 8.5310 10.2691 10.2691 12.5015 12.5015 12.7047 12.7047 15.6685 15.6685 17.6893 17.6893 18.8361 18.8361 k = 0.4474 0.5000-0.0000 ( 3706 PWs) bands (ev): -73.5762 -73.5762 -42.4614 -42.4614 -38.0849 -38.0849 -37.9265 -37.9265 -34.8991 -34.8991 3.2332 3.2332 7.5510 7.5510 7.7688 7.7688 8.5408 8.5408 10.3310 10.3310 12.5382 12.5382 12.7367 12.7367 15.6393 15.6393 17.5932 17.5932 18.8278 18.8278 k = 0.4561 0.5000-0.0000 ( 3706 PWs) bands (ev): -73.5761 -73.5761 -42.4618 -42.4618 -38.0856 -38.0856 -37.9266 -37.9266 -34.8990 -34.8990 3.2203 3.2203 7.5510 7.5510 7.7651 7.7651 8.5492 8.5492 10.3843 10.3843 12.5674 12.5674 12.7678 12.7678 15.6137 15.6137 17.5100 17.5100 18.8207 18.8207 k = 0.4649 0.5000-0.0000 ( 3710 PWs) bands (ev): -73.5760 -73.5760 -42.4620 -42.4620 -38.0862 -38.0862 -37.9267 -37.9267 -34.8989 -34.8989 3.2098 3.2098 7.5505 7.5505 7.7625 7.7625 8.5561 8.5561 10.4287 10.4287 12.5900 12.5900 12.7961 12.7961 15.5921 15.5921 17.4404 17.4404 18.8148 18.8148 k = 0.4737 0.5000-0.0000 ( 3716 PWs) bands (ev): -73.5759 -73.5759 -42.4623 -42.4623 -38.0866 -38.0866 -37.9268 -37.9268 -34.8988 -34.8988 3.2016 3.2016 7.5499 7.5499 7.7608 7.7608 8.5615 8.5615 10.4637 10.4637 12.6068 12.6068 12.8198 12.8198 15.5749 15.5749 17.3854 17.3854 18.8102 18.8102 k = 0.4825 0.5000-0.0000 ( 3720 PWs) bands (ev): -73.5758 -73.5758 -42.4624 -42.4624 -38.0869 -38.0869 -37.9268 -37.9268 -34.8988 -34.8988 3.1957 3.1957 7.5493 7.5493 7.7597 7.7597 8.5654 8.5654 10.4889 10.4889 12.6186 12.6186 12.8377 12.8377 15.5623 15.5623 17.3456 17.3456 18.8069 18.8069 k = 0.4912 0.5000-0.0000 ( 3712 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0871 -38.0871 -37.9269 -37.9269 -34.8987 -34.8987 3.1922 3.1922 7.5489 7.5489 7.7591 7.7591 8.5677 8.5677 10.5041 10.5041 12.6255 12.6255 12.8487 12.8487 15.5547 15.5547 17.3215 17.3215 18.8049 18.8049 k = 0.5000 0.5000-0.0000 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1910 3.1910 7.5487 7.5487 7.7589 7.7589 8.5685 8.5685 10.5092 10.5092 12.6278 12.6278 12.8525 12.8525 15.5522 15.5522 17.3134 17.3134 18.8042 18.8042 k = 0.5000 0.5000-0.0000 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1910 3.1910 7.5487 7.5487 7.7589 7.7589 8.5685 8.5685 10.5092 10.5092 12.6278 12.6278 12.8525 12.8525 15.5522 15.5522 17.3134 17.3134 18.8042 18.8042 k = 0.4938 0.4937-0.0000 ( 3708 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0871 -38.0871 -37.9269 -37.9269 -34.8987 -34.8987 3.1922 3.1922 7.5489 7.5489 7.7591 7.7591 8.5677 8.5677 10.5040 10.5040 12.6252 12.6252 12.8490 12.8490 15.5547 15.5547 17.3216 17.3216 18.8049 18.8049 k = 0.4875 0.4875-0.0000 ( 3722 PWs) bands (ev): -73.5758 -73.5758 -42.4624 -42.4624 -38.0869 -38.0869 -37.9268 -37.9268 -34.8988 -34.8988 3.1958 3.1958 7.5494 7.5494 7.7597 7.7597 8.5653 8.5653 10.4887 10.4887 12.6136 12.6136 12.8425 12.8425 15.5620 15.5620 17.3462 17.3462 18.8069 18.8069 k = 0.4813 0.4812-0.0000 ( 3718 PWs) bands (ev): -73.5759 -73.5759 -42.4623 -42.4623 -38.0866 -38.0866 -37.9268 -37.9268 -34.8988 -34.8988 3.2017 3.2017 7.5501 7.5501 7.7606 7.7606 8.5614 8.5614 10.4637 10.4637 12.5842 12.5842 12.8429 12.8429 15.5728 15.5728 17.3870 17.3870 18.8101 18.8101 k = 0.4750 0.4750-0.0000 ( 3712 PWs) bands (ev): -73.5760 -73.5760 -42.4620 -42.4620 -38.0861 -38.0861 -37.9267 -37.9267 -34.8989 -34.8989 3.2100 3.2100 7.5512 7.5512 7.7620 7.7620 8.5558 8.5558 10.4296 10.4296 12.5298 12.5298 12.8584 12.8584 15.5855 15.5855 17.4439 17.4439 18.8144 18.8144 k = 0.4688 0.4687-0.0000 ( 3710 PWs) bands (ev): -73.5761 -73.5761 -42.4618 -42.4618 -38.0855 -38.0855 -37.9266 -37.9266 -34.8990 -34.8990 3.2206 3.2206 7.5525 7.5525 7.7638 7.7638 8.5488 8.5488 10.3872 10.3872 12.4511 12.4511 12.8899 12.8899 15.5982 15.5982 17.5163 17.5163 18.8196 18.8196 k = 0.4625 0.4625-0.0000 ( 3710 PWs) bands (ev): -73.5762 -73.5762 -42.4614 -42.4614 -38.0848 -38.0848 -37.9265 -37.9265 -34.8991 -34.8991 3.2334 3.2334 7.5540 7.5540 7.7661 7.7661 8.5402 8.5402 10.3376 10.3376 12.3528 12.3528 12.9344 12.9344 15.6095 15.6095 17.6034 17.6034 18.8254 18.8254 k = 0.4562 0.4562-0.0000 ( 3706 PWs) bands (ev): -73.5763 -73.5763 -42.4610 -42.4610 -38.0839 -38.0839 -37.9263 -37.9263 -34.8993 -34.8993 3.2485 3.2485 7.5556 7.5556 7.7690 7.7690 8.5301 8.5301 10.2816 10.2816 12.2391 12.2391 12.9889 12.9889 15.6180 15.6180 17.7041 17.7041 18.8314 18.8314 k = 0.4500 0.4500-0.0000 ( 3710 PWs) bands (ev): -73.5765 -73.5765 -42.4605 -42.4605 -38.0829 -38.0829 -37.9262 -37.9262 -34.8995 -34.8995 3.2657 3.2657 7.5574 7.5574 7.7725 7.7725 8.5185 8.5185 10.2200 10.2200 12.1135 12.1135 13.0514 13.0514 15.6229 15.6229 17.8172 17.8172 18.8373 18.8373 k = 0.4437 0.4437-0.0000 ( 3702 PWs) bands (ev): -73.5767 -73.5767 -42.4600 -42.4600 -38.0818 -38.0818 -37.9260 -37.9260 -34.8997 -34.8997 3.2850 3.2850 7.5593 7.5593 7.7766 7.7766 8.5055 8.5055 10.1537 10.1537 11.9786 11.9786 13.1203 13.1203 15.6239 15.6239 17.9410 17.9410 18.8425 18.8425 k = 0.4375 0.4375-0.0000 ( 3692 PWs) bands (ev): -73.5769 -73.5769 -42.4594 -42.4594 -38.0805 -38.0805 -37.9258 -37.9258 -34.8999 -34.8999 3.3063 3.3063 7.5612 7.5612 7.7815 7.7815 8.4911 8.4911 10.0835 10.0835 11.8365 11.8365 13.1946 13.1946 15.6207 15.6207 18.0740 18.0740 18.8465 18.8465 k = 0.4313 0.4312-0.0000 ( 3704 PWs) bands (ev): -73.5772 -73.5772 -42.4588 -42.4588 -38.0792 -38.0792 -37.9255 -37.9255 -34.9001 -34.9001 3.3294 3.3294 7.5631 7.5631 7.7871 7.7871 8.4754 8.4754 10.0099 10.0099 11.6889 11.6889 13.2735 13.2735 15.6135 15.6135 18.2144 18.2144 18.8486 18.8486 k = 0.4250 0.4250-0.0000 ( 3708 PWs) bands (ev): -73.5774 -73.5774 -42.4581 -42.4581 -38.0776 -38.0776 -37.9253 -37.9253 -34.9004 -34.9004 3.3544 3.3544 7.5650 7.5650 7.7935 7.7935 8.4585 8.4585 9.9336 9.9336 11.5373 11.5373 13.3563 13.3563 15.6025 15.6025 18.3606 18.3606 18.8483 18.8483 k = 0.4188 0.4187-0.0000 ( 3716 PWs) bands (ev): -73.5777 -73.5777 -42.4573 -42.4573 -38.0760 -38.0760 -37.9250 -37.9250 -34.9007 -34.9007 3.3810 3.3810 7.5668 7.5668 7.8008 7.8008 8.4403 8.4403 9.8551 9.8551 11.3827 11.3827 13.4425 13.4425 15.5883 15.5883 18.5108 18.5108 18.8447 18.8447 k = 0.4125 0.4125-0.0000 ( 3726 PWs) bands (ev): -73.5780 -73.5780 -42.4565 -42.4565 -38.0743 -38.0743 -37.9247 -37.9247 -34.9010 -34.9010 3.4092 3.4092 7.5686 7.5686 7.8089 7.8089 8.4210 8.4210 9.7746 9.7746 11.2263 11.2263 13.5316 13.5316 15.5710 15.5710 18.6632 18.6632 18.8373 18.8373 k = 0.4062 0.4062-0.0000 ( 3738 PWs) bands (ev): -73.5783 -73.5783 -42.4556 -42.4556 -38.0724 -38.0724 -37.9244 -37.9244 -34.9014 -34.9014 3.4387 3.4387 7.5702 7.5702 7.8178 7.8178 8.4006 8.4006 9.6928 9.6928 11.0689 11.0689 13.6233 13.6233 15.5512 15.5512 18.8064 18.8064 18.8348 18.8348 k = 0.4000 0.4000-0.0000 ( 3738 PWs) bands (ev): -73.5786 -73.5786 -42.4547 -42.4547 -38.0704 -38.0704 -37.9241 -37.9241 -34.9017 -34.9017 3.4694 3.4694 7.5718 7.5718 7.8276 7.8276 8.3793 8.3793 9.6098 9.6098 10.9113 10.9113 13.7173 13.7173 15.5291 15.5291 18.8033 18.8033 18.9721 18.9721 k = 0.3937 0.3937-0.0000 ( 3738 PWs) bands (ev): -73.5790 -73.5790 -42.4537 -42.4537 -38.0683 -38.0683 -37.9237 -37.9237 -34.9021 -34.9021 3.5011 3.5011 7.5734 7.5734 7.8381 7.8381 8.3571 8.3571 9.5259 9.5259 10.7542 10.7542 13.8134 13.8134 15.5053 15.5053 18.7784 18.7784 19.1222 19.1222 k = 0.3875 0.3875-0.0000 ( 3738 PWs) bands (ev): -73.5794 -73.5794 -42.4527 -42.4527 -38.0661 -38.0661 -37.9233 -37.9233 -34.9025 -34.9025 3.5336 3.5336 7.5749 7.5749 7.8494 7.8494 8.3342 8.3342 9.4414 9.4414 10.5983 10.5983 13.9115 13.9115 15.4801 15.4801 18.7458 18.7458 19.2687 19.2687 k = 0.3812 0.3812-0.0000 ( 3730 PWs) bands (ev): -73.5798 -73.5798 -42.4516 -42.4516 -38.0638 -38.0638 -37.9229 -37.9229 -34.9029 -34.9029 3.5667 3.5667 7.5764 7.5764 7.8612 7.8612 8.3108 8.3108 9.3565 9.3565 10.4442 10.4442 14.0112 14.0112 15.4537 15.4537 18.7051 18.7051 19.4100 19.4100 k = 0.3750 0.3750-0.0000 ( 3732 PWs) bands (ev): -73.5802 -73.5802 -42.4504 -42.4504 -38.0614 -38.0614 -37.9225 -37.9225 -34.9033 -34.9033 3.6002 3.6002 7.5780 7.5780 7.8734 7.8734 8.2869 8.2869 9.2714 9.2714 10.2925 10.2925 14.1126 14.1126 15.4265 15.4265 18.6559 18.6559 19.5444 19.5444 k = 0.3688 0.3687-0.0000 ( 3718 PWs) bands (ev): -73.5806 -73.5806 -42.4493 -42.4493 -38.0588 -38.0588 -37.9221 -37.9221 -34.9037 -34.9037 3.6336 3.6336 7.5796 7.5796 7.8859 7.8859 8.2629 8.2629 9.1862 9.1862 10.1437 10.1437 14.2155 14.2155 15.3987 15.3987 18.5979 18.5979 19.6709 19.6709 k = 0.3625 0.3625-0.0000 ( 3718 PWs) bands (ev): -73.5811 -73.5811 -42.4480 -42.4480 -38.0562 -38.0562 -37.9216 -37.9216 -34.9042 -34.9042 3.6668 3.6668 7.5812 7.5812 7.8983 7.8983 8.2391 8.2391 9.1012 9.1012 9.9982 9.9982 14.3198 14.3198 15.3708 15.3708 18.5310 18.5310 19.7885 19.7885 k = 0.3563 0.3562-0.0000 ( 3718 PWs) bands (ev): -73.5815 -73.5815 -42.4468 -42.4468 -38.0535 -38.0535 -37.9212 -37.9212 -34.9047 -34.9047 3.6995 3.6995 7.5830 7.5830 7.9101 7.9101 8.2159 8.2159 9.0165 9.0165 9.8568 9.8568 14.4254 14.4254 15.3428 15.3428 18.4555 18.4555 19.8964 19.8964 k = 0.3500 0.3500-0.0000 ( 3716 PWs) bands (ev): -73.5820 -73.5820 -42.4455 -42.4455 -38.0507 -38.0507 -37.9207 -37.9207 -34.9052 -34.9052 3.7312 3.7312 7.5849 7.5849 7.9208 7.9208 8.1941 8.1941 8.9323 8.9323 9.7198 9.7198 14.5323 14.5323 15.3150 15.3150 18.3715 18.3715 19.9945 19.9945 k = 0.3438 0.3437-0.0000 ( 3718 PWs) bands (ev): -73.5825 -73.5825 -42.4441 -42.4441 -38.0478 -38.0478 -37.9202 -37.9202 -34.9057 -34.9057 3.7616 3.7616 7.5868 7.5868 7.9294 7.9294 8.1744 8.1744 8.8488 8.8488 9.5878 9.5878 14.6405 14.6405 15.2878 15.2878 18.2794 18.2794 20.0829 20.0829 k = 0.3375 0.3375-0.0000 ( 3722 PWs) bands (ev): -73.5830 -73.5830 -42.4428 -42.4428 -38.0448 -38.0448 -37.9197 -37.9197 -34.9062 -34.9062 3.7904 3.7904 7.5889 7.5889 7.9348 7.9348 8.1582 8.1582 8.7662 8.7662 9.4611 9.4611 14.7496 14.7496 15.2613 15.2613 18.1799 18.1799 20.1619 20.1619 k = 0.3312 0.3312-0.0000 ( 3722 PWs) bands (ev): -73.5835 -73.5835 -42.4413 -42.4413 -38.0417 -38.0417 -37.9191 -37.9191 -34.9068 -34.9068 3.8170 3.8170 7.5909 7.5909 7.9357 7.9357 8.1466 8.1466 8.6848 8.6848 9.3404 9.3404 14.8596 14.8596 15.2361 15.2361 18.0736 18.0736 20.2322 20.2322 k = 0.3250 0.3250-0.0000 ( 3718 PWs) bands (ev): -73.5840 -73.5840 -42.4399 -42.4399 -38.0386 -38.0386 -37.9186 -37.9186 -34.9073 -34.9073 3.8411 3.8411 7.5928 7.5928 7.9309 7.9309 8.1407 8.1407 8.6051 8.6051 9.2260 9.2260 14.9695 14.9695 15.2131 15.2131 17.9611 17.9611 20.2945 20.2945 k = 0.3187 0.3187-0.0000 ( 3726 PWs) bands (ev): -73.5845 -73.5845 -42.4384 -42.4384 -38.0354 -38.0354 -37.9180 -37.9180 -34.9079 -34.9079 3.8622 3.8622 7.5945 7.5945 7.9205 7.9205 8.1400 8.1400 8.5278 8.5278 9.1182 9.1182 15.0749 15.0749 15.1970 15.1970 17.8431 17.8431 20.3498 20.3498 k = 0.3125 0.3125-0.0000 ( 3742 PWs) bands (ev): -73.5851 -73.5851 -42.4369 -42.4369 -38.0321 -38.0321 -37.9174 -37.9174 -34.9085 -34.9085 3.8799 3.8799 7.5956 7.5956 7.9054 7.9054 8.1431 8.1431 8.4540 8.4540 9.0175 9.0175 15.1353 15.1353 15.2283 15.2283 17.7202 17.7202 20.3988 20.3988 k = 0.3063 0.3062-0.0000 ( 3744 PWs) bands (ev): -73.5856 -73.5856 -42.4354 -42.4354 -38.0288 -38.0288 -37.9169 -37.9169 -34.9091 -34.9091 3.8938 3.8938 7.5960 7.5960 7.8871 7.8871 8.1467 8.1467 8.3862 8.3862 8.9242 8.9242 15.1284 15.1284 15.3297 15.3297 17.5931 17.5931 20.4424 20.4424 k = 0.3000 0.3000-0.0000 ( 3744 PWs) bands (ev): -73.5862 -73.5862 -42.4338 -42.4338 -38.0254 -38.0254 -37.9163 -37.9163 -34.9097 -34.9097 3.9034 3.9034 7.5951 7.5951 7.8670 7.8670 8.1446 8.1446 8.3295 8.3295 8.8385 8.8385 15.1115 15.1115 15.4437 15.4437 17.4624 17.4624 20.4813 20.4813 k = 0.2938 0.2937-0.0000 ( 3746 PWs) bands (ev): -73.5868 -73.5868 -42.4322 -42.4322 -38.0219 -38.0219 -37.9156 -37.9156 -34.9103 -34.9103 3.9083 3.9083 7.5925 7.5925 7.8463 7.8463 8.1270 8.1270 8.2936 8.2936 8.7607 8.7607 15.0943 15.0943 15.5610 15.5610 17.3286 17.3286 20.5162 20.5162 k = 0.2875 0.2875-0.0000 ( 3742 PWs) bands (ev): -73.5873 -73.5873 -42.4306 -42.4306 -38.0185 -38.0185 -37.9150 -37.9150 -34.9110 -34.9110 3.9082 3.9082 7.5875 7.5875 7.8258 7.8258 8.0892 8.0892 8.2832 8.2832 8.6909 8.6909 15.0781 15.0781 15.6802 15.6802 17.1923 17.1923 20.5476 20.5476 k = 0.2812 0.2812-0.0000 ( 3742 PWs) bands (ev): -73.5879 -73.5879 -42.4290 -42.4290 -38.0149 -38.0149 -37.9144 -37.9144 -34.9116 -34.9116 3.9028 3.9028 7.5796 7.5796 7.8054 7.8054 8.0404 8.0404 8.2899 8.2899 8.6294 8.6294 15.0635 15.0635 15.8009 15.8009 17.0540 17.0540 20.5761 20.5761 k = 0.2750 0.2750-0.0000 ( 3742 PWs) bands (ev): -73.5885 -73.5885 -42.4274 -42.4274 -38.0114 -38.0114 -37.9137 -37.9137 -34.9122 -34.9122 3.8919 3.8919 7.5683 7.5683 7.7841 7.7841 7.9910 7.9910 8.3050 8.3050 8.5763 8.5763 15.0507 15.0507 15.9229 15.9229 16.9142 16.9142 20.6022 20.6022 k = 0.2687 0.2687-0.0000 ( 3742 PWs) bands (ev): -73.5891 -73.5891 -42.4257 -42.4257 -38.0078 -38.0078 -37.9131 -37.9131 -34.9129 -34.9129 3.8754 3.8754 7.5535 7.5535 7.7588 7.7588 7.9482 7.9482 8.3241 8.3241 8.5315 8.5315 15.0399 15.0399 16.0460 16.0460 16.7733 16.7733 20.6261 20.6261 k = 0.2625 0.2625-0.0000 ( 3738 PWs) bands (ev): -73.5897 -73.5897 -42.4241 -42.4241 -38.0041 -38.0041 -37.9124 -37.9124 -34.9135 -34.9135 3.8533 3.8533 7.5357 7.5357 7.7259 7.7259 7.9174 7.9174 8.3455 8.3455 8.4953 8.4953 15.0313 15.0313 16.1696 16.1696 16.6324 16.6324 20.6483 20.6483 k = 0.2562 0.2562-0.0000 ( 3736 PWs) bands (ev): -73.5903 -73.5903 -42.4224 -42.4224 -38.0005 -38.0005 -37.9118 -37.9118 -34.9142 -34.9142 3.8255 3.8255 7.5152 7.5152 7.6839 7.6839 7.9004 7.9004 8.3678 8.3678 8.4679 8.4679 15.0248 15.0248 16.2900 16.2900 16.4954 16.4954 20.6690 20.6690 k = 0.2500 0.2500-0.0000 ( 3740 PWs) bands (ev): -73.5909 -73.5909 -42.4207 -42.4207 -37.9968 -37.9968 -37.9111 -37.9111 -34.9148 -34.9148 3.7923 3.7923 7.4929 7.4929 7.6349 7.6349 7.8949 7.8949 8.3894 8.3894 8.4502 8.4502 15.0208 15.0208 16.3208 16.3208 16.4488 16.4488 20.6884 20.6884 k = 0.2437 0.2437-0.0000 ( 3736 PWs) bands (ev): -73.5915 -73.5915 -42.4191 -42.4191 -37.9931 -37.9931 -37.9104 -37.9104 -34.9155 -34.9155 3.7538 3.7538 7.4691 7.4691 7.5818 7.5818 7.8979 7.8979 8.4059 8.4059 8.4461 8.4461 15.0191 15.0191 16.1909 16.1909 16.5642 16.5642 20.7068 20.7068 k = 0.2375 0.2375-0.0000 ( 3740 PWs) bands (ev): -73.5921 -73.5921 -42.4174 -42.4174 -37.9895 -37.9895 -37.9098 -37.9098 -34.9162 -34.9162 3.7105 3.7105 7.4442 7.4442 7.5269 7.5269 7.9068 7.9068 8.4125 8.4125 8.4597 8.4597 15.0201 15.0201 16.0495 16.0495 16.6925 16.6925 20.7244 20.7244 k = 0.2313 0.2312-0.0000 ( 3742 PWs) bands (ev): -73.5927 -73.5927 -42.4157 -42.4157 -37.9858 -37.9858 -37.9091 -37.9091 -34.9168 -34.9168 3.6626 3.6626 7.4185 7.4185 7.4716 7.4716 7.9202 7.9202 8.4171 8.4171 8.4827 8.4827 15.0236 15.0236 15.9069 15.9069 16.8236 16.8236 20.7413 20.7413 k = 0.2250 0.2250-0.0000 ( 3730 PWs) bands (ev): -73.5933 -73.5933 -42.4141 -42.4141 -37.9821 -37.9821 -37.9084 -37.9084 -34.9175 -34.9175 3.6107 3.6107 7.3906 7.3906 7.4181 7.4181 7.9371 7.9371 8.4255 8.4255 8.5087 8.5087 15.0298 15.0298 15.7644 15.7644 16.9565 16.9565 20.7576 20.7576 k = 0.2188 0.2187-0.0000 ( 3730 PWs) bands (ev): -73.5939 -73.5939 -42.4124 -42.4124 -37.9785 -37.9785 -37.9077 -37.9077 -34.9181 -34.9181 3.5551 3.5551 7.3517 7.3517 7.3760 7.3760 7.9569 7.9569 8.4386 8.4386 8.5362 8.5362 15.0387 15.0387 15.6222 15.6222 17.0908 17.0908 20.7736 20.7736 k = 0.2125 0.2125-0.0000 ( 3734 PWs) bands (ev): -73.5944 -73.5944 -42.4108 -42.4108 -37.9748 -37.9748 -37.9071 -37.9071 -34.9188 -34.9188 3.4963 3.4963 7.3003 7.3003 7.3472 7.3472 7.9792 7.9792 8.4562 8.4562 8.5646 8.5646 15.0504 15.0504 15.4808 15.4808 17.2266 17.2266 20.7892 20.7892 k = 0.2062 0.2062-0.0000 ( 3730 PWs) bands (ev): -73.5950 -73.5950 -42.4091 -42.4091 -37.9712 -37.9712 -37.9064 -37.9064 -34.9194 -34.9194 3.4348 3.4348 7.2472 7.2472 7.3211 7.3211 8.0038 8.0038 8.4779 8.4779 8.5938 8.5938 15.0650 15.0650 15.3402 15.3402 17.3637 17.3637 20.8047 20.8047 k = 0.2000 0.2000-0.0000 ( 3726 PWs) bands (ev): -73.5956 -73.5956 -42.4075 -42.4075 -37.9677 -37.9677 -37.9057 -37.9057 -34.9201 -34.9201 3.3711 3.3711 7.1947 7.1947 7.2958 7.2958 8.0303 8.0303 8.5030 8.5030 8.6240 8.6240 15.0823 15.0823 15.2009 15.2009 17.5020 17.5020 20.8200 20.8200 k = 0.1938 0.1937-0.0000 ( 3730 PWs) bands (ev): -73.5961 -73.5961 -42.4059 -42.4059 -37.9641 -37.9641 -37.9051 -37.9051 -34.9207 -34.9207 3.3057 3.3057 7.1432 7.1432 7.2709 7.2709 8.0586 8.0586 8.5307 8.5307 8.6552 8.6552 15.0616 15.0616 15.1035 15.1035 17.6415 17.6415 20.8354 20.8354 k = 0.1875 0.1875-0.0000 ( 3730 PWs) bands (ev): -73.5967 -73.5967 -42.4044 -42.4044 -37.9606 -37.9606 -37.9044 -37.9044 -34.9214 -34.9214 3.2390 3.2390 7.0929 7.0929 7.2465 7.2465 8.0885 8.0885 8.5603 8.5603 8.6876 8.6876 14.9253 14.9253 15.1261 15.1261 17.7822 17.7822 20.8508 20.8508 k = 0.1812 0.1812-0.0000 ( 3730 PWs) bands (ev): -73.5973 -73.5973 -42.4028 -42.4028 -37.9572 -37.9572 -37.9038 -37.9038 -34.9220 -34.9220 3.1715 3.1715 7.0438 7.0438 7.2226 7.2226 8.1199 8.1199 8.5910 8.5910 8.7214 8.7214 14.7899 14.7899 15.1521 15.1521 17.9240 17.9240 20.8663 20.8663 k = 0.1750 0.1750-0.0000 ( 3730 PWs) bands (ev): -73.5978 -73.5978 -42.4013 -42.4013 -37.9538 -37.9538 -37.9031 -37.9031 -34.9226 -34.9226 3.1034 3.1034 6.9961 6.9961 7.1991 7.1991 8.1527 8.1527 8.6221 8.6221 8.7567 8.7567 14.6561 14.6561 15.1809 15.1809 18.0667 18.0667 20.8820 20.8820 k = 0.1688 0.1687-0.0000 ( 3730 PWs) bands (ev): -73.5983 -73.5983 -42.3998 -42.3998 -37.9504 -37.9504 -37.9025 -37.9025 -34.9232 -34.9232 3.0353 3.0353 6.9499 6.9499 7.1762 7.1762 8.1868 8.1868 8.6529 8.6529 8.7937 8.7937 14.5241 14.5241 15.2124 15.2124 18.2104 18.2104 20.8979 20.8979 k = 0.1625 0.1625-0.0000 ( 3726 PWs) bands (ev): -73.5988 -73.5988 -42.3983 -42.3983 -37.9471 -37.9471 -37.9019 -37.9019 -34.9238 -34.9238 2.9675 2.9675 6.9051 6.9051 7.1538 7.1538 8.2220 8.2220 8.6830 8.6830 8.8324 8.8324 14.3939 14.3939 15.2466 15.2466 18.3549 18.3549 20.9142 20.9142 k = 0.1562 0.1562-0.0000 ( 3730 PWs) bands (ev): -73.5993 -73.5993 -42.3969 -42.3969 -37.9439 -37.9439 -37.9013 -37.9013 -34.9244 -34.9244 2.9002 2.9002 6.8618 6.8618 7.1320 7.1320 8.2583 8.2583 8.7120 8.7120 8.8724 8.8724 14.2658 14.2658 15.2833 15.2833 18.5001 18.5001 20.9307 20.9307 k = 0.1500 0.1500-0.0000 ( 3726 PWs) bands (ev): -73.5998 -73.5998 -42.3955 -42.3955 -37.9408 -37.9408 -37.9007 -37.9007 -34.9250 -34.9250 2.8338 2.8338 6.8201 6.8201 7.1109 7.1109 8.2956 8.2956 8.7399 8.7399 8.9135 8.9135 14.1399 14.1399 15.3225 15.3225 18.6460 18.6460 20.9476 20.9476 k = 0.1437 0.1437-0.0000 ( 3726 PWs) bands (ev): -73.6003 -73.6003 -42.3941 -42.3941 -37.9378 -37.9378 -37.9001 -37.9001 -34.9255 -34.9255 2.7685 2.7685 6.7799 6.7799 7.0904 7.0904 8.3337 8.3337 8.7666 8.7666 8.9554 8.9554 14.0162 14.0162 15.3638 15.3638 18.7922 18.7922 20.9650 20.9650 k = 0.1375 0.1375-0.0000 ( 3726 PWs) bands (ev): -73.6008 -73.6008 -42.3928 -42.3928 -37.9348 -37.9348 -37.8995 -37.8995 -34.9261 -34.9261 2.7047 2.7047 6.7413 6.7413 7.0706 7.0706 8.3725 8.3725 8.7922 8.7922 8.9975 8.9975 13.8950 13.8950 15.4071 15.4071 18.9388 18.9388 20.9827 20.9827 k = 0.1313 0.1313-0.0000 ( 3726 PWs) bands (ev): -73.6012 -73.6012 -42.3915 -42.3915 -37.9320 -37.9320 -37.8990 -37.8990 -34.9266 -34.9266 2.6424 2.6424 6.7043 6.7043 7.0516 7.0516 8.4120 8.4120 8.8167 8.8167 9.0396 9.0396 13.7764 13.7764 15.4523 15.4523 19.0855 19.0855 21.0008 21.0008 k = 0.1250 0.1250-0.0000 ( 3730 PWs) bands (ev): -73.6017 -73.6017 -42.3903 -42.3903 -37.9292 -37.9292 -37.8984 -37.8984 -34.9271 -34.9271 2.5819 2.5819 6.6690 6.6690 7.0333 7.0333 8.4519 8.4519 8.8401 8.8401 9.0812 9.0812 13.6606 13.6606 15.4990 15.4990 19.2320 19.2320 21.0193 21.0193 k = 0.1187 0.1187-0.0000 ( 3730 PWs) bands (ev): -73.6021 -73.6021 -42.3891 -42.3891 -37.9265 -37.9265 -37.8979 -37.8979 -34.9276 -34.9276 2.5235 2.5235 6.6353 6.6353 7.0157 7.0157 8.4921 8.4921 8.8625 8.8625 9.1221 9.1221 13.5478 13.5478 15.5469 15.5469 19.3782 19.3782 21.0383 21.0383 k = 0.1125 0.1125-0.0000 ( 3730 PWs) bands (ev): -73.6025 -73.6025 -42.3880 -42.3880 -37.9240 -37.9240 -37.8974 -37.8974 -34.9280 -34.9280 2.4672 2.4672 6.6032 6.6032 6.9990 6.9990 8.5325 8.5325 8.8840 8.8840 9.1620 9.1620 13.4380 13.4380 15.5957 15.5957 19.5237 19.5237 21.0576 21.0576 k = 0.1062 0.1062-0.0000 ( 3730 PWs) bands (ev): -73.6029 -73.6029 -42.3869 -42.3869 -37.9215 -37.9215 -37.8970 -37.8970 -34.9285 -34.9285 2.4132 2.4132 6.5729 6.5729 6.9831 6.9831 8.5728 8.5728 8.9046 8.9046 9.2005 9.2005 13.3317 13.3317 15.6452 15.6452 19.6683 19.6683 21.0772 21.0772 k = 0.1000 0.1000-0.0000 ( 3734 PWs) bands (ev): -73.6032 -73.6032 -42.3859 -42.3859 -37.9192 -37.9192 -37.8965 -37.8965 -34.9289 -34.9289 2.3617 2.3617 6.5442 6.5442 6.9680 6.9680 8.6128 8.6128 8.9243 8.9243 9.2376 9.2376 13.2288 13.2288 15.6949 15.6949 19.8114 19.8114 21.0971 21.0971 k = 0.0938 0.0937-0.0000 ( 3726 PWs) bands (ev): -73.6036 -73.6036 -42.3849 -42.3849 -37.9170 -37.9170 -37.8961 -37.8961 -34.9293 -34.9293 2.3127 2.3127 6.5172 6.5172 6.9537 6.9537 8.6524 8.6524 8.9432 8.9432 9.2730 9.2730 13.1298 13.1298 15.7444 15.7444 19.9527 19.9527 21.1173 21.1173 k = 0.0875 0.0875-0.0000 ( 3722 PWs) bands (ev): -73.6039 -73.6039 -42.3840 -42.3840 -37.9149 -37.9149 -37.8957 -37.8957 -34.9297 -34.9297 2.2665 2.2665 6.4919 6.4919 6.9403 6.9403 8.6911 8.6911 8.9613 8.9613 9.3066 9.3066 13.0349 13.0349 15.7934 15.7934 20.0916 20.0916 21.1376 21.1376 k = 0.0813 0.0812-0.0000 ( 3728 PWs) bands (ev): -73.6042 -73.6042 -42.3831 -42.3831 -37.9129 -37.9129 -37.8953 -37.8953 -34.9301 -34.9301 2.2230 2.2230 6.4684 6.4684 6.9278 6.9278 8.7287 8.7287 8.9786 8.9786 9.3383 9.3383 12.9442 12.9442 15.8415 15.8415 20.2276 20.2276 21.1579 21.1579 k = 0.0750 0.0750-0.0000 ( 3728 PWs) bands (ev): -73.6045 -73.6045 -42.3823 -42.3823 -37.9111 -37.9111 -37.8949 -37.8949 -34.9304 -34.9304 2.1825 2.1825 6.4465 6.4465 6.9162 6.9162 8.7650 8.7650 8.9953 8.9953 9.3680 9.3680 12.8582 12.8582 15.8881 15.8881 20.3599 20.3599 21.1782 21.1782 k = 0.0688 0.0688-0.0000 ( 3724 PWs) bands (ev): -73.6047 -73.6047 -42.3816 -42.3816 -37.9094 -37.9094 -37.8946 -37.8946 -34.9307 -34.9307 2.1449 2.1449 6.4264 6.4264 6.9055 6.9055 8.7994 8.7994 9.0114 9.0114 9.3956 9.3956 12.7771 12.7771 15.9330 15.9330 20.4876 20.4876 21.1983 21.1983 k = 0.0625 0.0625-0.0000 ( 3716 PWs) bands (ev): -73.6050 -73.6050 -42.3809 -42.3809 -37.9078 -37.9078 -37.8943 -37.8943 -34.9310 -34.9310 2.1103 2.1103 6.4080 6.4080 6.8956 6.8956 8.8317 8.8317 9.0269 9.0269 9.4210 9.4210 12.7013 12.7013 15.9756 15.9756 20.6099 20.6099 21.2182 21.2182 k = 0.0563 0.0562-0.0000 ( 3716 PWs) bands (ev): -73.6052 -73.6052 -42.3802 -42.3802 -37.9064 -37.9064 -37.8940 -37.8940 -34.9313 -34.9313 2.0788 2.0788 6.3914 6.3914 6.8867 6.8867 8.8614 8.8614 9.0419 9.0419 9.4441 9.4441 12.6312 12.6312 16.0156 16.0156 20.7256 20.7256 21.2378 21.2378 k = 0.0500 0.0500-0.0000 ( 3714 PWs) bands (ev): -73.6054 -73.6054 -42.3797 -42.3797 -37.9051 -37.9051 -37.8938 -37.8938 -34.9315 -34.9315 2.0506 2.0506 6.3765 6.3765 6.8787 6.8787 8.8882 8.8882 9.0563 9.0563 9.4650 9.4650 12.5670 12.5670 16.0526 16.0526 20.8333 20.8333 21.2571 21.2571 k = 0.0437 0.0437-0.0000 ( 3710 PWs) bands (ev): -73.6056 -73.6056 -42.3792 -42.3792 -37.9040 -37.9040 -37.8935 -37.8935 -34.9317 -34.9317 2.0255 2.0255 6.3633 6.3633 6.8717 6.8717 8.9118 8.9118 9.0702 9.0702 9.4836 9.4836 12.5092 12.5092 16.0863 16.0863 20.9315 20.9315 21.2764 21.2764 k = 0.0375 0.0375-0.0000 ( 3706 PWs) bands (ev): -73.6057 -73.6057 -42.3787 -42.3787 -37.9030 -37.9030 -37.8933 -37.8933 -34.9319 -34.9319 2.0037 2.0037 6.3519 6.3519 6.8655 6.8655 8.9320 8.9320 9.0834 9.0834 9.4997 9.4997 12.4582 12.4582 16.1162 16.1162 21.0183 21.0183 21.2958 21.2958 k = 0.0312 0.0312-0.0000 ( 3715 PWs) bands (ev): -73.6058 -73.6058 -42.3784 -42.3784 -37.9021 -37.9021 -37.8932 -37.8932 -34.9320 -34.9320 1.9851 1.9851 6.3422 6.3422 6.8603 6.8603 8.9487 8.9487 9.0956 9.0956 9.5135 9.5135 12.4143 12.4143 16.1420 16.1420 21.0916 21.0916 21.3161 21.3161 k = 0.0250 0.0250-0.0000 ( 3711 PWs) bands (ev): -73.6059 -73.6059 -42.3781 -42.3781 -37.9015 -37.9015 -37.8930 -37.8930 -34.9322 -34.9322 1.9699 1.9699 6.3343 6.3343 6.8561 6.8561 8.9621 8.9621 9.1063 9.1063 9.5249 9.5249 12.3778 12.3778 16.1635 16.1635 21.1494 21.1494 21.3375 21.3375 k = 0.0187 0.0187-0.0000 ( 3715 PWs) bands (ev): -73.6060 -73.6060 -42.3778 -42.3778 -37.9009 -37.9009 -37.8929 -37.8929 -34.9323 -34.9323 1.9581 1.9581 6.3282 6.3282 6.8528 6.8528 8.9722 8.9722 9.1152 9.1152 9.5337 9.5337 12.3491 12.3491 16.1805 16.1805 21.1911 21.1911 21.3593 21.3593 k = 0.0125 0.0125-0.0000 ( 3711 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9005 -37.9005 -37.8929 -37.8929 -34.9323 -34.9323 1.9496 1.9496 6.3238 6.3238 6.8504 6.8504 8.9793 8.9793 9.1220 9.1220 9.5401 9.5401 12.3283 12.3283 16.1928 16.1928 21.2179 21.2179 21.3789 21.3789 k = 0.0063 0.0062-0.0000 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9003 -37.9003 -37.8928 -37.8928 -34.9324 -34.9324 1.9445 1.9445 6.3211 6.3211 6.8490 6.8490 8.9835 8.9835 9.1261 9.1261 9.5439 9.5439 12.3158 12.3158 16.2002 16.2002 21.2324 21.2324 21.3927 21.3927 k = 0.0000 0.0000 0.0000 ( 3721 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9324 -34.9324 1.9428 1.9428 6.3202 6.3202 6.8485 6.8485 8.9849 8.9849 9.1275 9.1275 9.5452 9.5452 12.3117 12.3117 16.2027 16.2027 21.2370 21.2370 21.3976 21.3976 k = 0.0000 0.0000 0.0000 ( 3721 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9324 -34.9324 1.9428 1.9428 6.3202 6.3202 6.8485 6.8485 8.9849 8.9849 9.1275 9.1275 9.5452 9.5452 12.3117 12.3117 16.2027 16.2027 21.2370 21.2370 21.3976 21.3976 k = 0.0000 0.0000 0.0087 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9324 -34.9324 1.9430 1.9430 6.3203 6.3203 6.8495 6.8495 8.9847 8.9847 9.1274 9.1274 9.5452 9.5452 12.3053 12.3053 16.2105 16.2105 21.2391 21.2391 21.3997 21.3997 k = 0.0000 0.0000 0.0175 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9324 -34.9324 1.9435 1.9435 6.3204 6.3204 6.8525 6.8525 8.9842 8.9842 9.1269 9.1269 9.5451 9.5451 12.2863 12.2863 16.2338 16.2338 21.2453 21.2453 21.4060 21.4060 k = 0.0000 0.0000 0.0262 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8928 -37.8928 -34.9323 -34.9323 1.9444 1.9444 6.3207 6.3207 6.8576 6.8576 8.9833 8.9833 9.1262 9.1262 9.5450 9.5450 12.2551 12.2551 16.2721 16.2721 21.2558 21.2558 21.4165 21.4165 k = 0.0000 0.0000 0.0349 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3775 -42.3775 -37.9002 -37.9002 -37.8929 -37.8929 -34.9323 -34.9323 1.9456 1.9456 6.3210 6.3210 6.8647 6.8647 8.9821 8.9821 9.1251 9.1251 9.5448 9.5448 12.2124 12.2124 16.3247 16.3247 21.2704 21.2704 21.4312 21.4312 k = 0.0000 0.0000 0.0436 ( 3705 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8929 -37.8929 -34.9323 -34.9323 1.9471 1.9471 6.3214 6.3214 6.8739 6.8739 8.9805 8.9805 9.1237 9.1237 9.5446 9.5446 12.1592 12.1592 16.3907 16.3907 21.2891 21.2891 21.4500 21.4500 k = 0.0000 0.0000 0.0524 ( 3713 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8929 -37.8929 -34.9323 -34.9323 1.9489 1.9489 6.3218 6.3218 6.8851 6.8851 8.9786 8.9786 9.1220 9.1220 9.5444 9.5444 12.0963 12.0963 16.4692 16.4692 21.3119 21.3119 21.4730 21.4730 k = 0.0000 0.0000 0.0611 ( 3705 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8930 -37.8930 -34.9322 -34.9322 1.9511 1.9511 6.3224 6.3224 6.8984 6.8984 8.9763 8.9763 9.1201 9.1201 9.5442 9.5442 12.0250 12.0250 16.5589 16.5589 21.3389 21.3389 21.5002 21.5002 k = 0.0000 0.0000 0.0698 ( 3717 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8931 -37.8931 -34.9322 -34.9322 1.9535 1.9535 6.3230 6.3230 6.9137 6.9137 8.9738 8.9738 9.1179 9.1179 9.5439 9.5439 11.9461 11.9461 16.6589 16.6589 21.3699 21.3699 21.5314 21.5314 k = 0.0000 0.0000 0.0786 ( 3717 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8931 -37.8931 -34.9321 -34.9321 1.9562 1.9562 6.3237 6.3237 6.9311 6.9311 8.9710 8.9710 9.1154 9.1154 9.5435 9.5435 11.8608 11.8608 16.7681 16.7681 21.4050 21.4050 21.5667 21.5667 k = 0.0000 0.0000 0.0873 ( 3721 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8932 -37.8932 -34.9321 -34.9321 1.9592 1.9592 6.3245 6.3245 6.9507 6.9507 8.9679 8.9679 9.1128 9.1128 9.5432 9.5432 11.7699 11.7699 16.8855 16.8855 21.4442 21.4442 21.6061 21.6061 k = 0.0000 0.0000 0.0960 ( 3721 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8933 -37.8933 -34.9320 -34.9320 1.9623 1.9623 6.3253 6.3253 6.9723 6.9723 8.9645 8.9645 9.1098 9.1098 9.5428 9.5428 11.6743 11.6743 17.0103 17.0103 21.4873 21.4873 21.6495 21.6495 k = 0.0000 0.0000 0.1047 ( 3709 PWs) bands (ev): -73.6061 -73.6061 -42.3776 -42.3776 -37.9002 -37.9002 -37.8934 -37.8934 -34.9319 -34.9319 1.9657 1.9657 6.3262 6.3262 6.9961 6.9961 8.9610 8.9610 9.1067 9.1067 9.5425 9.5425 11.5748 11.5748 17.1416 17.1416 21.5344 21.5344 21.6969 21.6969 k = 0.0000 0.0000 0.1135 ( 3717 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9002 -37.9002 -37.8934 -37.8934 -34.9318 -34.9318 1.9693 1.9693 6.3272 6.3272 7.0221 7.0221 8.9572 8.9572 9.1034 9.1034 9.5421 9.5421 11.4720 11.4720 17.2788 17.2788 21.5854 21.5854 21.7482 21.7482 k = 0.0000 0.0000 0.1222 ( 3717 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9002 -37.9002 -37.8935 -37.8935 -34.9318 -34.9318 1.9731 1.9731 6.3282 6.3282 7.0502 7.0502 8.9532 8.9532 9.0999 9.0999 9.5417 9.5417 11.3666 11.3666 17.4210 17.4210 21.6403 21.6403 21.8034 21.8034 k = 0.0000 0.0000 0.1309 ( 3717 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9002 -37.9002 -37.8936 -37.8936 -34.9317 -34.9317 1.9770 1.9770 6.3292 6.3292 7.0806 7.0806 8.9491 8.9491 9.0963 9.0963 9.5412 9.5412 11.2590 11.2590 17.5678 17.5678 21.6990 21.6990 21.8625 21.8625 k = 0.0000 0.0000 0.1397 ( 3725 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9002 -37.9002 -37.8937 -37.8937 -34.9316 -34.9316 1.9810 1.9810 6.3303 6.3303 7.1131 7.1131 8.9448 8.9448 9.0926 9.0926 9.5408 9.5408 11.1498 11.1498 17.7185 17.7185 21.7615 21.7615 21.9254 21.9254 k = 0.0000 0.0000 0.1484 ( 3729 PWs) bands (ev): -73.6061 -73.6061 -42.3777 -42.3777 -37.9002 -37.9002 -37.8938 -37.8938 -34.9315 -34.9315 1.9851 1.9851 6.3314 6.3314 7.1479 7.1479 8.9404 8.9404 9.0887 9.0887 9.5404 9.5404 11.0394 11.0394 17.8726 17.8726 21.8278 21.8278 21.9920 21.9920 k = 0.0000 0.0000 0.1571 ( 3728 PWs) bands (ev): -73.6061 -73.6061 -42.3778 -42.3778 -37.9002 -37.9002 -37.8939 -37.8939 -34.9314 -34.9314 1.9892 1.9892 6.3325 6.3325 7.1849 7.1849 8.9359 8.9359 9.0848 9.0848 9.5400 9.5400 10.9280 10.9280 18.0297 18.0297 21.8977 21.8977 22.0623 22.0623 k = 0.0000 0.0000 0.1658 ( 3728 PWs) bands (ev): -73.6061 -73.6061 -42.3778 -42.3778 -37.9002 -37.9002 -37.8940 -37.8940 -34.9313 -34.9313 1.9934 1.9934 6.3336 6.3336 7.2241 7.2241 8.9313 8.9313 9.0809 9.0809 9.5396 9.5396 10.8161 10.8161 18.1892 18.1892 21.9713 21.9713 22.1363 22.1363 k = 0.0000 0.0000 0.1746 ( 3728 PWs) bands (ev): -73.6061 -73.6061 -42.3778 -42.3778 -37.9002 -37.9002 -37.8941 -37.8941 -34.9312 -34.9312 1.9976 1.9976 6.3348 6.3348 7.2657 7.2657 8.9266 8.9266 9.0769 9.0769 9.5392 9.5392 10.7040 10.7040 18.3508 18.3508 22.0485 22.0485 22.2138 22.2138 k = 0.0000 0.0000 0.1833 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3778 -42.3778 -37.9002 -37.9002 -37.8942 -37.8942 -34.9312 -34.9312 2.0018 2.0018 6.3359 6.3359 7.3095 7.3095 8.9220 8.9220 9.0729 9.0729 9.5388 9.5388 10.5918 10.5918 18.5140 18.5140 22.1292 22.1292 22.2949 22.2949 k = 0.0000 0.0000 0.1920 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3778 -42.3778 -37.9002 -37.9002 -37.8943 -37.8943 -34.9311 -34.9311 2.0059 2.0059 6.3371 6.3371 7.3556 7.3556 8.9173 8.9173 9.0689 9.0689 9.5385 9.5385 10.4798 10.4798 18.6782 18.6782 22.2133 22.2133 22.3795 22.3795 k = 0.0000 0.0000 0.2008 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3779 -42.3779 -37.9002 -37.9002 -37.8944 -37.8944 -34.9310 -34.9310 2.0100 2.0100 6.3382 6.3382 7.4039 7.4039 8.9126 8.9126 9.0650 9.0650 9.5381 9.5381 10.3682 10.3682 18.8431 18.8431 22.3009 22.3009 22.4675 22.4675 k = 0.0000 0.0000 0.2095 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3779 -42.3779 -37.9001 -37.9001 -37.8945 -37.8945 -34.9309 -34.9309 2.0140 2.0140 6.3393 6.3393 7.4545 7.4545 8.9079 8.9079 9.0611 9.0611 9.5377 9.5377 10.2573 10.2573 19.0080 19.0080 22.3918 22.3918 22.5588 22.5588 k = 0.0000 0.0000 0.2182 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3779 -42.3779 -37.9001 -37.9001 -37.8946 -37.8946 -34.9308 -34.9308 2.0178 2.0178 6.3404 6.3404 7.5075 7.5075 8.9032 8.9032 9.0574 9.0574 9.5374 9.5374 10.1472 10.1472 19.1725 19.1725 22.4859 22.4859 22.6534 22.6534 k = 0.0000 0.0000 0.2269 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3779 -42.3779 -37.9001 -37.9001 -37.8947 -37.8947 -34.9307 -34.9307 2.0216 2.0216 6.3414 6.3414 7.5626 7.5626 8.8985 8.8985 9.0538 9.0538 9.5371 9.5371 10.0381 10.0381 19.3360 19.3360 22.5833 22.5833 22.7512 22.7512 k = 0.0000 0.0000 0.2357 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3779 -42.3779 -37.9001 -37.9001 -37.8948 -37.8948 -34.9307 -34.9307 2.0251 2.0251 6.3424 6.3424 7.6200 7.6200 8.8938 8.8938 9.0503 9.0503 9.5368 9.5368 9.9302 9.9302 19.4976 19.4976 22.6838 22.6838 22.8522 22.8522 k = 0.0000 0.0000 0.2444 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8949 -37.8949 -34.9306 -34.9306 2.0285 2.0285 6.3433 6.3433 7.6796 7.6796 8.8891 8.8891 9.0469 9.0469 9.5366 9.5366 9.8238 9.8238 19.6567 19.6567 22.7874 22.7874 22.9562 22.9562 k = 0.0000 0.0000 0.2531 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8950 -37.8950 -34.9305 -34.9305 2.0317 2.0317 6.3442 6.3442 7.7414 7.7414 8.8842 8.8842 9.0438 9.0438 9.5363 9.5363 9.7190 9.7190 19.8123 19.8123 22.8939 22.8939 23.0633 23.0633 k = 0.0000 0.0000 0.2619 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8951 -37.8951 -34.9304 -34.9304 2.0347 2.0347 6.3451 6.3451 7.8053 7.8053 8.8790 8.8790 9.0409 9.0409 9.5361 9.5361 9.6161 9.6161 19.9635 19.9635 23.0033 23.0033 23.1732 23.1732 k = 0.0000 0.0000 0.2706 ( 3716 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8951 -37.8951 -34.9304 -34.9304 2.0374 2.0374 6.3459 6.3459 7.8712 7.8712 8.8734 8.8734 9.0382 9.0382 9.5157 9.5157 9.5359 9.5359 20.1088 20.1088 23.1154 23.1154 23.2859 23.2859 k = 0.0000 0.0000 0.2793 ( 3720 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8952 -37.8952 -34.9303 -34.9303 2.0399 2.0399 6.3466 6.3466 7.9391 7.9391 8.8669 8.8669 9.0357 9.0357 9.4181 9.4181 9.5357 9.5357 20.2471 20.2471 23.2301 23.2301 23.4014 23.4014 k = 0.0000 0.0000 0.2880 ( 3712 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8953 -37.8953 -34.9302 -34.9302 2.0421 2.0421 6.3472 6.3472 8.0087 8.0087 8.8589 8.8589 9.0335 9.0335 9.3243 9.3243 9.5355 9.5355 20.3767 20.3767 23.3469 23.3469 23.5195 23.5195 k = 0.0000 0.0000 0.2968 ( 3712 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8953 -37.8953 -34.9302 -34.9302 2.0441 2.0441 6.3478 6.3478 8.0798 8.0798 8.8484 8.8484 9.0315 9.0315 9.2358 9.2358 9.5354 9.5354 20.4956 20.4956 23.4648 23.4648 23.6399 23.6399 k = 0.0000 0.0000 0.3055 ( 3720 PWs) bands (ev): -73.6061 -73.6061 -42.3780 -42.3780 -37.9001 -37.9001 -37.8954 -37.8954 -34.9302 -34.9302 2.0457 2.0457 6.3483 6.3483 8.1521 8.1521 8.8331 8.8331 9.0298 9.0298 9.1549 9.1549 9.5353 9.5353 20.6019 20.6019 23.5782 23.5782 23.7195 23.7195 k = 0.0000 0.0000 0.3142 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8954 -37.8954 -34.9301 -34.9301 2.0471 2.0471 6.3487 6.3487 8.2250 8.2250 8.8099 8.8099 9.0284 9.0284 9.0858 9.0858 9.5352 9.5352 20.6933 20.6933 23.6374 23.6374 23.7484 23.7484 k = 0.0000 0.0000 0.3229 ( 3724 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8954 -37.8954 -34.9301 -34.9301 2.0482 2.0482 6.3490 6.3490 8.2972 8.2972 8.7752 8.7752 9.0274 9.0274 9.0331 9.0331 9.5351 9.5351 20.7676 20.7676 23.6222 23.6222 23.8600 23.8600 k = 0.0000 0.0000 0.3317 ( 3736 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8954 -37.8954 -34.9301 -34.9301 2.0490 2.0490 6.3492 6.3492 8.3658 8.3658 8.7297 8.7297 8.9990 8.9990 9.0266 9.0266 9.5350 9.5350 20.8225 20.8225 23.6019 23.6019 23.9863 23.9863 k = 0.0000 0.0000 0.3404 ( 3736 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8954 -37.8954 -34.9301 -34.9301 2.0494 2.0494 6.3493 6.3493 8.4234 8.4234 8.6835 8.6835 8.9810 8.9810 9.0261 9.0261 9.5350 9.5350 20.8563 20.8563 23.5882 23.5882 24.1154 24.1154 k = 0.0000 0.0000 0.3491 ( 3736 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8955 -37.8955 -34.9301 -34.9301 2.0496 2.0496 6.3494 6.3494 8.4492 8.4492 8.6610 8.6610 8.9756 8.9756 9.0260 9.0260 9.5350 9.5350 20.8677 20.8677 23.5834 23.5834 24.2179 24.2179 k = 0.0000 0.0000 0.3491 ( 3736 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8955 -37.8955 -34.9301 -34.9301 2.0496 2.0496 6.3494 6.3494 8.4492 8.4492 8.6610 8.6610 8.9756 8.9756 9.0260 9.0260 9.5350 9.5350 20.8677 20.8677 23.5834 23.5834 24.2179 24.2179 k = 0.0000 0.0088 0.3491 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9002 -37.9002 -37.8955 -37.8955 -34.9301 -34.9301 2.0513 2.0513 6.3503 6.3503 8.4476 8.4476 8.6555 8.6555 8.9790 8.9790 9.0298 9.0298 9.5340 9.5340 20.8581 20.8581 23.5746 23.5746 24.2122 24.2122 k = 0.0000 0.0175 0.3491 ( 3732 PWs) bands (ev): -73.6060 -73.6060 -42.3782 -42.3782 -37.9004 -37.9004 -37.8955 -37.8955 -34.9301 -34.9301 2.0563 2.0563 6.3530 6.3530 8.4425 8.4425 8.6410 8.6410 8.9862 8.9862 9.0429 9.0429 9.5311 9.5311 20.8293 20.8293 23.5441 23.5441 24.1123 24.1123 k = 0.0000 0.0263 0.3491 ( 3736 PWs) bands (ev): -73.6060 -73.6060 -42.3784 -42.3784 -37.9008 -37.9008 -37.8955 -37.8955 -34.9300 -34.9300 2.0647 2.0647 6.3574 6.3574 8.4328 8.4328 8.6217 8.6217 8.9924 8.9924 9.0669 9.0669 9.5264 9.5264 20.7819 20.7819 23.4805 23.4805 24.0028 24.0028 k = 0.0000 0.0351 0.3491 ( 3728 PWs) bands (ev): -73.6059 -73.6059 -42.3786 -42.3786 -37.9014 -37.9014 -37.8956 -37.8956 -34.9299 -34.9299 2.0765 2.0765 6.3636 6.3636 8.4172 8.4172 8.6021 8.6021 8.9965 8.9965 9.0995 9.0995 9.5199 9.5199 20.7165 20.7165 23.3747 23.3747 23.9302 23.9302 k = 0.0000 0.0439 0.3491 ( 3732 PWs) bands (ev): -73.6058 -73.6058 -42.3789 -42.3789 -37.9022 -37.9022 -37.8955 -37.8955 -34.9298 -34.9298 2.0916 2.0916 6.3716 6.3716 8.3945 8.3945 8.5857 8.5857 8.9994 8.9994 9.1372 9.1372 9.5120 9.5120 20.6342 20.6342 23.2328 23.2328 23.8942 23.8942 k = 0.0000 0.0526 0.3491 ( 3732 PWs) bands (ev): -73.6057 -73.6057 -42.3793 -42.3793 -37.9033 -37.9033 -37.8955 -37.8955 -34.9297 -34.9297 2.1101 2.1101 6.3813 6.3813 8.3647 8.3647 8.5741 8.5741 9.0018 9.0018 9.1776 9.1776 9.5029 9.5029 20.5360 20.5360 23.0693 23.0693 23.8826 23.8826 k = 0.0000 0.0614 0.3491 ( 3732 PWs) bands (ev): -73.6055 -73.6055 -42.3797 -42.3797 -37.9045 -37.9045 -37.8954 -37.8954 -34.9295 -34.9295 2.1318 2.1318 6.3926 6.3926 8.3288 8.3288 8.5671 8.5671 9.0041 9.0041 9.2187 9.2187 9.4934 9.4934 20.4235 20.4235 22.8951 22.8951 23.8853 23.8853 k = 0.0000 0.0702 0.3491 ( 3730 PWs) bands (ev): -73.6054 -73.6054 -42.3802 -42.3802 -37.9059 -37.9059 -37.8952 -37.8952 -34.9294 -34.9294 2.1569 2.1569 6.4056 6.4056 8.2884 8.2884 8.5638 8.5638 9.0063 9.0063 9.2587 9.2587 9.4846 9.4846 20.2979 20.2979 22.7160 22.7160 23.8960 23.8960 k = 0.0000 0.0789 0.3491 ( 3734 PWs) bands (ev): -73.6052 -73.6052 -42.3807 -42.3807 -37.9076 -37.9076 -37.8950 -37.8950 -34.9292 -34.9292 2.1852 2.1852 6.4202 6.4202 8.2449 8.2449 8.5632 8.5632 9.0086 9.0086 9.2946 9.2946 9.4791 9.4791 20.1608 20.1608 22.5353 22.5353 23.9086 23.9086 k = 0.0000 0.0877 0.3491 ( 3734 PWs) bands (ev): -73.6050 -73.6050 -42.3813 -42.3813 -37.9094 -37.9094 -37.8948 -37.8948 -34.9290 -34.9290 2.2167 2.2167 6.4363 6.4363 8.1993 8.1993 8.5647 8.5647 9.0109 9.0109 9.3215 9.3215 9.4816 9.4816 20.0135 20.0135 22.3546 22.3546 23.9092 23.9092 k = 0.0000 0.0965 0.3491 ( 3738 PWs) bands (ev): -73.6047 -73.6047 -42.3820 -42.3820 -37.9115 -37.9115 -37.8946 -37.8946 -34.9287 -34.9287 2.2514 2.2514 6.4538 6.4538 8.1523 8.1523 8.5678 8.5678 9.0131 9.0131 9.3341 9.3341 9.4974 9.4974 19.8575 19.8575 22.1750 22.1750 23.8827 23.8827 k = 0.0000 0.1053 0.3491 ( 3738 PWs) bands (ev): -73.6045 -73.6045 -42.3827 -42.3827 -37.9137 -37.9137 -37.8943 -37.8943 -34.9285 -34.9285 2.2893 2.2893 6.4728 6.4728 8.1043 8.1043 8.5720 8.5720 9.0152 9.0152 9.3321 9.3321 9.5267 9.5267 19.6942 19.6942 21.9970 21.9970 23.8421 23.8421 k = 0.0000 0.1140 0.3491 ( 3736 PWs) bands (ev): -73.6042 -73.6042 -42.3835 -42.3835 -37.9160 -37.9160 -37.8939 -37.8939 -34.9282 -34.9282 2.3303 2.3303 6.4931 6.4931 8.0559 8.0559 8.5772 8.5772 9.0171 9.0171 9.3203 9.3203 9.5648 9.5648 19.5247 19.5247 21.8211 21.8211 23.7976 23.7976 k = 0.0000 0.1228 0.3491 ( 3736 PWs) bands (ev): -73.6039 -73.6039 -42.3843 -42.3843 -37.9186 -37.9186 -37.8936 -37.8936 -34.9279 -34.9279 2.3744 2.3744 6.5146 6.5146 8.0071 8.0071 8.5833 8.5833 9.0187 9.0187 9.3030 9.3030 9.6075 9.6075 19.3501 19.3501 21.6475 21.6475 23.7518 23.7518 k = 0.0000 0.1316 0.3491 ( 3744 PWs) bands (ev): -73.6036 -73.6036 -42.3851 -42.3851 -37.9212 -37.9212 -37.8932 -37.8932 -34.9276 -34.9276 2.4215 2.4215 6.5373 6.5373 7.9582 7.9582 8.5900 8.5900 9.0196 9.0196 9.2828 9.2828 9.6527 9.6527 19.1716 19.1716 21.4765 21.4765 23.7056 23.7056 k = 0.0000 0.1404 0.3491 ( 3738 PWs) bands (ev): -73.6033 -73.6033 -42.3861 -42.3861 -37.9241 -37.9241 -37.8928 -37.8928 -34.9273 -34.9273 2.4716 2.4716 6.5610 6.5610 7.9093 7.9093 8.5974 8.5974 9.0195 9.0195 9.2611 9.2611 9.6991 9.6991 18.9900 18.9900 21.3082 21.3082 23.6590 23.6590 k = 0.0000 0.1491 0.3491 ( 3742 PWs) bands (ev): -73.6030 -73.6030 -42.3870 -42.3870 -37.9270 -37.9270 -37.8924 -37.8924 -34.9270 -34.9270 2.5246 2.5246 6.5856 6.5856 7.8606 7.8606 8.6053 8.6053 9.0180 9.0180 9.2391 9.2391 9.7462 9.7462 18.8062 18.8062 21.1427 21.1427 23.6121 23.6121 k = 0.0000 0.1579 0.3491 ( 3742 PWs) bands (ev): -73.6026 -73.6026 -42.3880 -42.3880 -37.9301 -37.9301 -37.8919 -37.8919 -34.9266 -34.9266 2.5805 2.5805 6.6110 6.6110 7.8122 7.8122 8.6138 8.6138 9.0145 9.0145 9.2179 9.2179 9.7936 9.7936 18.6209 18.6209 20.9801 20.9801 23.5648 23.5648 k = 0.0000 0.1667 0.3491 ( 3738 PWs) bands (ev): -73.6023 -73.6023 -42.3891 -42.3891 -37.9333 -37.9333 -37.8915 -37.8915 -34.9263 -34.9263 2.6392 2.6392 6.6370 6.6370 7.7641 7.7641 8.6226 8.6226 9.0079 9.0079 9.1985 9.1985 9.8411 9.8411 18.4349 18.4349 20.8206 20.8206 23.5171 23.5171 k = 0.0000 0.1754 0.3491 ( 3734 PWs) bands (ev): -73.6019 -73.6019 -42.3901 -42.3901 -37.9366 -37.9366 -37.8910 -37.8910 -34.9259 -34.9259 2.7006 2.7006 6.6636 6.6636 7.7165 7.7165 8.6319 8.6319 8.9976 8.9976 9.1821 9.1821 9.8885 9.8885 18.2486 18.2486 20.6641 20.6641 23.4688 23.4688 k = 0.0000 0.1842 0.3491 ( 3732 PWs) bands (ev): -73.6015 -73.6015 -42.3912 -42.3912 -37.9399 -37.9399 -37.8905 -37.8905 -34.9255 -34.9255 2.7648 2.7648 6.6905 6.6905 7.6694 7.6694 8.6416 8.6416 8.9829 8.9829 9.1694 9.1694 9.9357 9.9357 18.0628 18.0628 20.5107 20.5107 23.4198 23.4198 k = 0.0000 0.1930 0.3491 ( 3732 PWs) bands (ev): -73.6011 -73.6011 -42.3924 -42.3924 -37.9434 -37.9434 -37.8900 -37.8900 -34.9251 -34.9251 2.8315 2.8315 6.7176 6.7176 7.6229 7.6229 8.6516 8.6516 8.9637 8.9637 9.1607 9.1607 9.9827 9.9827 17.8779 17.8779 20.3606 20.3606 23.3701 23.3701 k = 0.0000 0.2018 0.3491 ( 3736 PWs) bands (ev): -73.6007 -73.6007 -42.3935 -42.3935 -37.9469 -37.9469 -37.8895 -37.8895 -34.9247 -34.9247 2.9007 2.9007 6.7447 6.7447 7.5771 7.5771 8.6619 8.6619 8.9404 8.9404 9.1556 9.1556 10.0294 10.0294 17.6943 17.6943 20.2137 20.2137 23.3197 23.3197 k = 0.0000 0.2105 0.3491 ( 3744 PWs) bands (ev): -73.6003 -73.6003 -42.3947 -42.3947 -37.9505 -37.9505 -37.8889 -37.8889 -34.9243 -34.9243 2.9725 2.9725 6.7716 6.7716 7.5319 7.5319 8.6725 8.6725 8.9140 8.9140 9.1534 9.1534 10.0756 10.0756 17.5125 17.5125 20.0701 20.0701 23.2685 23.2685 k = 0.0000 0.2193 0.3491 ( 3744 PWs) bands (ev): -73.5999 -73.5999 -42.3959 -42.3959 -37.9541 -37.9541 -37.8884 -37.8884 -34.9239 -34.9239 3.0466 3.0466 6.7981 6.7981 7.4876 7.4876 8.6833 8.6833 8.8853 8.8853 9.1535 9.1535 10.1215 10.1215 17.3329 17.3329 19.9299 19.9299 23.2164 23.2164 k = 0.0000 0.2281 0.3491 ( 3738 PWs) bands (ev): -73.5995 -73.5995 -42.3972 -42.3972 -37.9578 -37.9578 -37.8878 -37.8878 -34.9235 -34.9235 3.1229 3.1229 6.8240 6.8240 7.4440 7.4440 8.6942 8.6942 8.8550 8.8550 9.1552 9.1552 10.1668 10.1668 17.1559 17.1559 19.7931 19.7931 23.1636 23.1636 k = 0.0000 0.2368 0.3491 ( 3738 PWs) bands (ev): -73.5991 -73.5991 -42.3984 -42.3984 -37.9614 -37.9614 -37.8873 -37.8873 -34.9230 -34.9230 3.2015 3.2015 6.8490 6.8490 7.4014 7.4014 8.7051 8.7051 8.8237 8.8237 9.1581 9.1581 10.2116 10.2116 16.9817 16.9817 19.6597 19.6597 23.1100 23.1100 k = 0.0000 0.2456 0.3491 ( 3742 PWs) bands (ev): -73.5986 -73.5986 -42.3996 -42.3996 -37.9651 -37.9651 -37.8867 -37.8867 -34.9226 -34.9226 3.2822 3.2822 6.8729 6.8729 7.3598 7.3598 8.7156 8.7156 8.7924 8.7924 9.1618 9.1618 10.2558 10.2558 16.8109 16.8109 19.5299 19.5299 23.0556 23.0556 k = 0.0000 0.2544 0.3491 ( 3742 PWs) bands (ev): -73.5982 -73.5982 -42.4009 -42.4009 -37.9688 -37.9688 -37.8862 -37.8862 -34.9222 -34.9222 3.3649 3.3649 6.8954 6.8954 7.3192 7.3192 8.7235 8.7235 8.7634 8.7634 9.1661 9.1661 10.2994 10.2994 16.6435 16.6435 19.4036 19.4036 23.0006 23.0006 k = 0.0000 0.2632 0.3491 ( 3744 PWs) bands (ev): -73.5978 -73.5978 -42.4021 -42.4021 -37.9725 -37.9725 -37.8856 -37.8856 -34.9218 -34.9218 3.4496 3.4496 6.9164 6.9164 7.2797 7.2797 8.7148 8.7148 8.7511 8.7511 9.1710 9.1710 10.3422 10.3422 16.4800 16.4800 19.2809 19.2809 22.9451 22.9451 k = 0.0000 0.2719 0.3491 ( 3744 PWs) bands (ev): -73.5974 -73.5974 -42.4033 -42.4033 -37.9762 -37.9762 -37.8851 -37.8851 -34.9214 -34.9214 3.5360 3.5360 6.9353 6.9353 7.2414 7.2414 8.6867 8.6867 8.7584 8.7584 9.1761 9.1761 10.3843 10.3843 16.3206 16.3206 19.1619 19.1619 22.8890 22.8890 k = 0.0000 0.2807 0.3491 ( 3740 PWs) bands (ev): -73.5970 -73.5970 -42.4046 -42.4046 -37.9798 -37.9798 -37.8845 -37.8845 -34.9209 -34.9209 3.6241 3.6241 6.9520 6.9520 7.2044 7.2044 8.6552 8.6552 8.7694 8.7694 9.1815 9.1815 10.4257 10.4257 16.1656 16.1656 19.0466 19.0466 22.8327 22.8327 k = 0.0000 0.2895 0.3491 ( 3740 PWs) bands (ev): -73.5965 -73.5965 -42.4058 -42.4058 -37.9834 -37.9834 -37.8840 -37.8840 -34.9205 -34.9205 3.7138 3.7138 6.9660 6.9660 7.1690 7.1690 8.6233 8.6233 8.7812 8.7812 9.1870 9.1870 10.4662 10.4662 16.0153 16.0153 18.9350 18.9350 22.7761 22.7761 k = 0.0000 0.2982 0.3491 ( 3736 PWs) bands (ev): -73.5961 -73.5961 -42.4070 -42.4070 -37.9869 -37.9869 -37.8835 -37.8835 -34.9201 -34.9201 3.8049 3.8049 6.9768 6.9768 7.1353 7.1353 8.5916 8.5916 8.7935 8.7935 9.1926 9.1926 10.5057 10.5057 15.8698 15.8698 18.8273 18.8273 22.7194 22.7194 k = 0.0000 0.3070 0.3491 ( 3740 PWs) bands (ev): -73.5957 -73.5957 -42.4082 -42.4082 -37.9903 -37.9903 -37.8829 -37.8829 -34.9197 -34.9197 3.8974 3.8974 6.9837 6.9837 7.1039 7.1039 8.5604 8.5604 8.8059 8.8059 9.1983 9.1983 10.5443 10.5443 15.7295 15.7295 18.7235 18.7235 22.6629 22.6629 k = 0.0000 0.3158 0.3491 ( 3748 PWs) bands (ev): -73.5953 -73.5953 -42.4094 -42.4094 -37.9937 -37.9937 -37.8824 -37.8824 -34.9193 -34.9193 3.9911 3.9911 6.9856 6.9856 7.0759 7.0759 8.5298 8.5298 8.8184 8.8184 9.2040 9.2040 10.5819 10.5819 15.5945 15.5945 18.6236 18.6236 22.6066 22.6066 k = 0.0000 0.3246 0.3491 ( 3752 PWs) bands (ev): -73.5950 -73.5950 -42.4105 -42.4105 -37.9970 -37.9970 -37.8819 -37.8819 -34.9189 -34.9189 4.0857 4.0857 6.9805 6.9805 7.0527 7.0527 8.4999 8.4999 8.8310 8.8310 9.2096 9.2096 10.6184 10.6184 15.4651 15.4651 18.5277 18.5277 22.5508 22.5508 k = 0.0000 0.3333 0.3491 ( 3752 PWs) bands (ev): -73.5946 -73.5946 -42.4116 -42.4116 -38.0002 -38.0002 -37.8814 -37.8814 -34.9186 -34.9186 4.1813 4.1813 6.9674 6.9674 7.0354 7.0354 8.4710 8.4710 8.8436 8.8436 9.2152 9.2152 10.6537 10.6537 15.3414 15.3414 18.4359 18.4359 22.4957 22.4957 k = 0.0000 0.3421 0.3491 ( 3752 PWs) bands (ev): -73.5942 -73.5942 -42.4127 -42.4127 -38.0033 -38.0033 -37.8810 -37.8810 -34.9182 -34.9182 4.2776 4.2776 6.9478 6.9478 7.0222 7.0222 8.4429 8.4429 8.8561 8.8561 9.2207 9.2207 10.6878 10.6878 15.2236 15.2236 18.3482 18.3482 22.4414 22.4414 k = 0.0000 0.3509 0.3491 ( 3744 PWs) bands (ev): -73.5939 -73.5939 -42.4137 -42.4137 -38.0063 -38.0063 -37.8805 -37.8805 -34.9178 -34.9178 4.3744 4.3744 6.9253 6.9253 7.0096 7.0096 8.4159 8.4159 8.8685 8.8685 9.2261 9.2261 10.7207 10.7207 15.1118 15.1118 18.2647 18.2647 22.3883 22.3883 k = 0.0000 0.3596 0.3491 ( 3742 PWs) bands (ev): -73.5936 -73.5936 -42.4147 -42.4147 -38.0092 -38.0092 -37.8801 -37.8801 -34.9175 -34.9175 4.4715 4.4715 6.9019 6.9019 6.9952 6.9952 8.3899 8.3899 8.8807 8.8807 9.2314 9.2314 10.7521 10.7521 15.0063 15.0063 18.1856 18.1856 22.3365 22.3365 k = 0.0000 0.3684 0.3491 ( 3740 PWs) bands (ev): -73.5932 -73.5932 -42.4157 -42.4157 -38.0119 -38.0119 -37.8797 -37.8797 -34.9172 -34.9172 4.5688 4.5688 6.8789 6.8789 6.9779 6.9779 8.3651 8.3651 8.8927 8.8927 9.2365 9.2365 10.7821 10.7821 14.9071 14.9071 18.1107 18.1107 22.2862 22.2862 k = 0.0000 0.3772 0.3491 ( 3738 PWs) bands (ev): -73.5929 -73.5929 -42.4166 -42.4166 -38.0145 -38.0145 -37.8793 -37.8793 -34.9169 -34.9169 4.6660 4.6660 6.8567 6.8567 6.9572 6.9572 8.3415 8.3415 8.9043 8.9043 9.2414 9.2414 10.8106 10.8106 14.8142 14.8142 18.0403 18.0403 22.2378 22.2378 k = 0.0000 0.3860 0.3491 ( 3740 PWs) bands (ev): -73.5926 -73.5926 -42.4175 -42.4175 -38.0170 -38.0170 -37.8789 -37.8789 -34.9166 -34.9166 4.7627 4.7627 6.8356 6.8356 6.9328 6.9328 8.3193 8.3193 8.9156 8.9156 9.2462 9.2462 10.8376 10.8376 14.7278 14.7278 17.9743 17.9743 22.1914 22.1914 k = 0.0000 0.3947 0.3491 ( 3744 PWs) bands (ev): -73.5924 -73.5924 -42.4183 -42.4183 -38.0193 -38.0193 -37.8785 -37.8785 -34.9163 -34.9163 4.8588 4.8588 6.8156 6.8156 6.9048 6.9048 8.2984 8.2984 8.9263 8.9263 9.2507 9.2507 10.8629 10.8629 14.6479 14.6479 17.9129 17.9129 22.1472 22.1472 k = 0.0000 0.4035 0.3491 ( 3744 PWs) bands (ev): -73.5921 -73.5921 -42.4190 -42.4190 -38.0214 -38.0214 -37.8782 -37.8782 -34.9161 -34.9161 4.9538 4.9538 6.7970 6.7970 6.8732 6.8732 8.2789 8.2789 8.9365 8.9365 9.2550 9.2550 10.8864 10.8864 14.5746 14.5746 17.8561 17.8561 22.1056 22.1056 k = 0.0000 0.4123 0.3491 ( 3736 PWs) bands (ev): -73.5919 -73.5919 -42.4197 -42.4197 -38.0234 -38.0234 -37.8779 -37.8779 -34.9158 -34.9158 5.0474 5.0474 6.7794 6.7794 6.8384 6.8384 8.2609 8.2609 8.9461 8.9461 9.2591 9.2591 10.9082 10.9082 14.5078 14.5078 17.8040 17.8040 22.0667 22.0667 k = 0.0000 0.4211 0.3491 ( 3740 PWs) bands (ev): -73.5917 -73.5917 -42.4204 -42.4204 -38.0252 -38.0252 -37.8776 -37.8776 -34.9156 -34.9156 5.1391 5.1391 6.7624 6.7624 6.8014 6.8014 8.2445 8.2445 8.9550 8.9550 9.2629 9.2629 10.9282 10.9282 14.4476 14.4476 17.7566 17.7566 22.0308 22.0308 k = 0.0000 0.4298 0.3491 ( 3740 PWs) bands (ev): -73.5915 -73.5915 -42.4209 -42.4209 -38.0268 -38.0268 -37.8774 -37.8774 -34.9154 -34.9154 5.2282 5.2282 6.7420 6.7420 6.7665 6.7665 8.2296 8.2296 8.9632 8.9632 9.2664 9.2664 10.9462 10.9462 14.3938 14.3938 17.7141 17.7141 21.9980 21.9980 k = 0.0000 0.4386 0.3491 ( 3736 PWs) bands (ev): -73.5913 -73.5913 -42.4214 -42.4214 -38.0283 -38.0283 -37.8771 -37.8771 -34.9153 -34.9153 5.3140 5.3140 6.7077 6.7077 6.7451 6.7451 8.2164 8.2164 8.9705 8.9705 9.2695 9.2695 10.9622 10.9622 14.3466 14.3466 17.6764 17.6764 21.9686 21.9686 k = 0.0000 0.4474 0.3491 ( 3748 PWs) bands (ev): -73.5912 -73.5912 -42.4219 -42.4219 -38.0295 -38.0295 -37.8769 -37.8769 -34.9151 -34.9151 5.3954 5.3954 6.6653 6.6653 6.7322 6.7322 8.2049 8.2049 8.9769 8.9769 9.2723 9.2723 10.9763 10.9763 14.3057 14.3057 17.6436 17.6436 21.9427 21.9427 k = 0.0000 0.4561 0.3491 ( 3748 PWs) bands (ev): -73.5910 -73.5910 -42.4223 -42.4223 -38.0306 -38.0306 -37.8768 -37.8768 -34.9150 -34.9150 5.4711 5.4711 6.6216 6.6216 6.7223 6.7223 8.1951 8.1951 8.9825 8.9825 9.2747 9.2747 10.9882 10.9882 14.2713 14.2713 17.6158 17.6158 21.9205 21.9205 k = 0.0000 0.4649 0.3491 ( 3748 PWs) bands (ev): -73.5909 -73.5909 -42.4226 -42.4226 -38.0315 -38.0315 -37.8766 -37.8766 -34.9149 -34.9149 5.5394 5.5394 6.5794 6.5794 6.7145 6.7145 8.1870 8.1870 8.9870 8.9870 9.2767 9.2767 10.9981 10.9981 14.2432 14.2432 17.5930 17.5930 21.9021 21.9021 k = 0.0000 0.4737 0.3491 ( 3740 PWs) bands (ev): -73.5909 -73.5909 -42.4228 -42.4228 -38.0322 -38.0322 -37.8765 -37.8765 -34.9148 -34.9148 5.5978 5.5978 6.5412 6.5412 6.7085 6.7085 8.1807 8.1807 8.9906 8.9906 9.2783 9.2783 11.0058 11.0058 14.2214 14.2214 17.5752 17.5752 21.8877 21.8877 k = 0.0000 0.4825 0.3491 ( 3744 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0327 -38.0327 -37.8765 -37.8765 -34.9147 -34.9147 5.6432 5.6432 6.5101 6.5101 6.7042 6.7042 8.1762 8.1762 8.9932 8.9932 9.2795 9.2795 11.0113 11.0113 14.2059 14.2059 17.5625 17.5625 21.8774 21.8774 k = 0.0000 0.4912 0.3491 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0330 -38.0330 -37.8764 -37.8764 -34.9147 -34.9147 5.6724 5.6724 6.4896 6.4896 6.7017 6.7017 8.1735 8.1735 8.9948 8.9948 9.2802 9.2802 11.0146 11.0146 14.1966 14.1966 17.5548 17.5548 21.8711 21.8711 k = 0.0000 0.5000 0.3491 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6826 5.6826 6.4823 6.4823 6.7008 6.7008 8.1725 8.1725 8.9953 8.9953 9.2804 9.2804 11.0157 11.0157 14.1935 14.1935 17.5523 17.5523 21.8690 21.8690 k = 0.0000 0.5000 0.3491 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6826 5.6826 6.4823 6.4823 6.7008 6.7008 8.1725 8.1725 8.9953 8.9953 9.2804 9.2804 11.0157 11.0157 14.1935 14.1935 17.5523 17.5523 21.8690 21.8690 k = 0.0088 0.5000 0.3491 ( 3740 PWs) bands (ev): -73.5907 -73.5907 -42.4232 -42.4232 -38.0331 -38.0331 -37.8765 -37.8765 -34.9147 -34.9147 5.6778 5.6778 6.4846 6.4846 6.7012 6.7012 8.1784 8.1784 8.9947 8.9947 9.2778 9.2778 11.0200 11.0200 14.1938 14.1938 17.5520 17.5520 21.8685 21.8685 k = 0.0175 0.5000 0.3491 ( 3736 PWs) bands (ev): -73.5907 -73.5907 -42.4233 -42.4233 -38.0331 -38.0331 -37.8767 -37.8767 -34.9146 -34.9146 5.6636 5.6636 6.4913 6.4913 6.7023 6.7023 8.1960 8.1960 8.9929 8.9929 9.2703 9.2703 11.0329 11.0329 14.1950 14.1950 17.5511 17.5511 21.8670 21.8670 k = 0.0263 0.5000 0.3491 ( 3740 PWs) bands (ev): -73.5907 -73.5907 -42.4234 -42.4234 -38.0332 -38.0332 -37.8770 -37.8770 -34.9146 -34.9146 5.6404 5.6404 6.5025 6.5025 6.7042 6.7042 8.2248 8.2248 8.9895 8.9895 9.2584 9.2584 11.0541 11.0541 14.1969 14.1969 17.5497 17.5497 21.8644 21.8644 k = 0.0351 0.5000 0.3491 ( 3744 PWs) bands (ev): -73.5906 -73.5906 -42.4236 -42.4236 -38.0333 -38.0333 -37.8775 -37.8775 -34.9145 -34.9145 5.6089 5.6089 6.5180 6.5180 6.7068 6.7068 8.2642 8.2642 8.9842 8.9842 9.2429 9.2429 11.0830 11.0830 14.1995 14.1995 17.5477 17.5477 21.8605 21.8605 k = 0.0439 0.5000 0.3491 ( 3736 PWs) bands (ev): -73.5905 -73.5905 -42.4239 -42.4239 -38.0334 -38.0334 -37.8781 -37.8781 -34.9144 -34.9144 5.5698 5.5698 6.5379 6.5379 6.7100 6.7100 8.3135 8.3135 8.9763 8.9763 9.2252 9.2252 11.1193 11.1193 14.2030 14.2030 17.5451 17.5451 21.8551 21.8551 k = 0.0526 0.5000 0.3491 ( 3732 PWs) bands (ev): -73.5903 -73.5903 -42.4242 -42.4242 -38.0336 -38.0336 -37.8788 -37.8788 -34.9142 -34.9142 5.5241 5.5241 6.5621 6.5621 6.7140 6.7140 8.3717 8.3717 8.9648 8.9648 9.2069 9.2069 11.1623 11.1623 14.2072 14.2072 17.5420 17.5420 21.8481 21.8481 k = 0.0614 0.5000 0.3491 ( 3732 PWs) bands (ev): -73.5902 -73.5902 -42.4246 -42.4246 -38.0338 -38.0338 -37.8797 -37.8797 -34.9141 -34.9141 5.4727 5.4727 6.5905 6.5905 6.7186 6.7186 8.4379 8.4379 8.9489 8.9489 9.1895 9.1895 11.2114 11.2114 14.2121 14.2121 17.5384 17.5384 21.8391 21.8391 k = 0.0702 0.5000 0.3491 ( 3732 PWs) bands (ev): -73.5900 -73.5900 -42.4250 -42.4250 -38.0340 -38.0340 -37.8807 -37.8807 -34.9139 -34.9139 5.4164 5.4164 6.6231 6.6231 6.7238 6.7238 8.5110 8.5110 8.9277 8.9277 9.1747 9.1747 11.2661 11.2661 14.2178 14.2178 17.5342 17.5342 21.8278 21.8278 k = 0.0789 0.5000 0.3491 ( 3732 PWs) bands (ev): -73.5898 -73.5898 -42.4255 -42.4255 -38.0342 -38.0342 -37.8818 -37.8818 -34.9137 -34.9137 5.3561 5.3561 6.6597 6.6597 6.7296 6.7296 8.5899 8.5899 8.9013 8.9013 9.1635 9.1635 11.3257 11.3257 14.2243 14.2243 17.5296 17.5296 21.8137 21.8137 k = 0.0877 0.5000 0.3491 ( 3736 PWs) bands (ev): -73.5896 -73.5896 -42.4260 -42.4260 -38.0346 -38.0346 -37.8830 -37.8830 -34.9135 -34.9135 5.2924 5.2924 6.7004 6.7004 6.7360 6.7360 8.6723 8.6723 8.8711 8.8711 9.1565 9.1565 11.3899 11.3899 14.2316 14.2316 17.5245 17.5245 21.7964 21.7964 k = 0.0965 0.5000 0.3491 ( 3732 PWs) bands (ev): -73.5894 -73.5894 -42.4266 -42.4266 -38.0349 -38.0349 -37.8843 -37.8843 -34.9132 -34.9132 5.2261 5.2261 6.7427 6.7427 6.7454 6.7454 8.7496 8.7496 8.8453 8.8453 9.1539 9.1539 11.4581 11.4581 14.2396 14.2396 17.5189 17.5189 21.7753 21.7753 k = 0.1053 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5892 -73.5892 -42.4272 -42.4272 -38.0353 -38.0353 -37.8856 -37.8856 -34.9130 -34.9130 5.1577 5.1577 6.7505 6.7505 6.7938 6.7938 8.7665 8.7665 8.8784 8.8784 9.1563 9.1563 11.5301 11.5301 14.2484 14.2484 17.5129 17.5129 21.7498 21.7498 k = 0.1140 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5889 -73.5889 -42.4279 -42.4279 -38.0357 -38.0357 -37.8871 -37.8871 -34.9127 -34.9127 5.0877 5.0877 6.7586 6.7586 6.8462 6.8462 8.7305 8.7305 8.9604 8.9604 9.1663 9.1663 11.6054 11.6054 14.2579 14.2579 17.5064 17.5064 21.7192 21.7192 k = 0.1228 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5886 -73.5886 -42.4286 -42.4286 -38.0362 -38.0362 -37.8886 -37.8886 -34.9124 -34.9124 5.0166 5.0166 6.7672 6.7672 6.9023 6.9023 8.6855 8.6855 9.0383 9.0383 9.1926 9.1926 11.6838 11.6838 14.2683 14.2683 17.4997 17.4997 21.6830 21.6830 k = 0.1316 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5883 -73.5883 -42.4294 -42.4294 -38.0368 -38.0368 -37.8902 -37.8902 -34.9120 -34.9120 4.9447 4.9447 6.7763 6.7763 6.9621 6.9621 8.6375 8.6375 9.0895 9.0895 9.2521 9.2521 11.7651 11.7651 14.2794 14.2794 17.4925 17.4925 21.6405 21.6405 k = 0.1404 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5880 -73.5880 -42.4302 -42.4302 -38.0374 -38.0374 -37.8919 -37.8919 -34.9117 -34.9117 4.8724 4.8724 6.7858 6.7858 7.0253 7.0253 8.5878 8.5878 9.1144 9.1144 9.3427 9.3427 11.8491 11.8491 14.2913 14.2913 17.4851 17.4851 21.5910 21.5910 k = 0.1491 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5877 -73.5877 -42.4310 -42.4310 -38.0380 -38.0380 -37.8935 -37.8935 -34.9113 -34.9113 4.8000 4.8000 6.7958 6.7958 7.0918 7.0918 8.5372 8.5372 9.1285 9.1285 9.4484 9.4484 11.9357 11.9357 14.3040 14.3040 17.4773 17.4773 21.5339 21.5339 k = 0.1579 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5874 -73.5874 -42.4319 -42.4319 -38.0388 -38.0388 -37.8952 -37.8952 -34.9110 -34.9110 4.7277 4.7277 6.8063 6.8063 7.1616 7.1616 8.4862 8.4862 9.1390 9.1390 9.5612 9.5612 12.0246 12.0246 14.3175 14.3175 17.4693 17.4693 21.4687 21.4687 k = 0.1667 0.5000 0.3491 ( 3704 PWs) bands (ev): -73.5870 -73.5870 -42.4328 -42.4328 -38.0396 -38.0396 -37.8970 -37.8970 -34.9106 -34.9106 4.6557 4.6557 6.8171 6.8171 7.2342 7.2342 8.4351 8.4351 9.1484 9.1484 9.6786 9.6786 12.1159 12.1159 14.3318 14.3318 17.4611 17.4611 21.3950 21.3950 k = 0.1754 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5866 -73.5866 -42.4338 -42.4338 -38.0404 -38.0404 -37.8987 -37.8987 -34.9102 -34.9102 4.5843 4.5843 6.8283 6.8283 7.3096 7.3096 8.3843 8.3843 9.1576 9.1576 9.7992 9.7992 12.2093 12.2093 14.3469 14.3469 17.4528 17.4528 21.3126 21.3126 k = 0.1842 0.5000 0.3491 ( 3704 PWs) bands (ev): -73.5863 -73.5863 -42.4347 -42.4347 -38.0414 -38.0414 -37.9004 -37.9004 -34.9098 -34.9098 4.5135 4.5135 6.8399 6.8399 7.3873 7.3873 8.3343 8.3343 9.1670 9.1670 9.9226 9.9226 12.3049 12.3049 14.3628 14.3628 17.4442 17.4442 21.2213 21.2213 k = 0.1930 0.5000 0.3491 ( 3704 PWs) bands (ev): -73.5859 -73.5859 -42.4357 -42.4357 -38.0424 -38.0424 -37.9022 -37.9022 -34.9093 -34.9093 4.4436 4.4436 6.8517 6.8517 7.4668 7.4668 8.2854 8.2854 9.1767 9.1767 10.0484 10.0484 12.4026 12.4026 14.3796 14.3796 17.4356 17.4356 21.1213 21.1213 k = 0.2018 0.5000 0.3491 ( 3700 PWs) bands (ev): -73.5855 -73.5855 -42.4368 -42.4368 -38.0435 -38.0435 -37.9039 -37.9039 -34.9089 -34.9089 4.3747 4.3747 6.8638 6.8638 7.5474 7.5474 8.2385 8.2385 9.1869 9.1869 10.1763 10.1763 12.5023 12.5023 14.3973 14.3973 17.4269 17.4269 21.0128 21.0128 k = 0.2105 0.5000 0.3491 ( 3700 PWs) bands (ev): -73.5851 -73.5851 -42.4378 -42.4378 -38.0446 -38.0446 -37.9055 -37.9055 -34.9085 -34.9085 4.3069 4.3069 6.8762 6.8762 7.6280 7.6280 8.1944 8.1944 9.1977 9.1977 10.3062 10.3062 12.6040 12.6040 14.4158 14.4158 17.4182 17.4182 20.8960 20.8960 k = 0.2193 0.5000 0.3491 ( 3704 PWs) bands (ev): -73.5847 -73.5847 -42.4389 -42.4389 -38.0459 -38.0459 -37.9072 -37.9072 -34.9080 -34.9080 4.2403 4.2403 6.8888 6.8888 7.7061 7.7061 8.1556 8.1556 9.2092 9.2092 10.4379 10.4379 12.7077 12.7077 14.4352 14.4352 17.4095 17.4095 20.7716 20.7716 k = 0.2281 0.5000 0.3491 ( 3712 PWs) bands (ev): -73.5843 -73.5843 -42.4399 -42.4399 -38.0472 -38.0472 -37.9087 -37.9087 -34.9076 -34.9076 4.1751 4.1751 6.9015 6.9015 7.7770 7.7770 8.1265 8.1265 9.2215 9.2215 10.5713 10.5713 12.8134 12.8134 14.4555 14.4555 17.4009 17.4009 20.6399 20.6399 k = 0.2368 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5839 -73.5839 -42.4410 -42.4410 -38.0485 -38.0485 -37.9103 -37.9103 -34.9072 -34.9072 4.1112 4.1112 6.9143 6.9143 7.8304 7.8304 8.1170 8.1170 9.2347 9.2347 10.7064 10.7064 12.9209 12.9209 14.4768 14.4768 17.3923 17.3923 20.5017 20.5017 k = 0.2456 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5835 -73.5835 -42.4421 -42.4421 -38.0500 -38.0500 -37.9117 -37.9117 -34.9067 -34.9067 4.0489 4.0489 6.9272 6.9272 7.8533 7.8533 8.1402 8.1402 9.2490 9.2490 10.8430 10.8430 13.0304 13.0304 14.4990 14.4990 17.3839 17.3839 20.3574 20.3574 k = 0.2544 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5830 -73.5830 -42.4432 -42.4432 -38.0515 -38.0515 -37.9132 -37.9132 -34.9063 -34.9063 3.9881 3.9881 6.9402 6.9402 7.8456 7.8456 8.1955 8.1955 9.2646 9.2646 10.9812 10.9812 13.1418 13.1418 14.5222 14.5222 17.3756 17.3756 20.2078 20.2078 k = 0.2632 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5826 -73.5826 -42.4443 -42.4443 -38.0530 -38.0530 -37.9145 -37.9145 -34.9058 -34.9058 3.9290 3.9290 6.9531 6.9531 7.8205 7.8205 8.2694 8.2694 9.2818 9.2818 11.1208 11.1208 13.2552 13.2552 14.5465 14.5465 17.3675 17.3675 20.0535 20.0535 k = 0.2719 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5822 -73.5822 -42.4454 -42.4454 -38.0546 -38.0546 -37.9158 -37.9158 -34.9054 -34.9054 3.8715 3.8715 6.9660 6.9660 7.7877 7.7877 8.3515 8.3515 9.3009 9.3009 11.2618 11.2618 13.3704 13.3704 14.5718 14.5718 17.3597 17.3597 19.8950 19.8950 k = 0.2807 0.5000 0.3491 ( 3712 PWs) bands (ev): -73.5818 -73.5818 -42.4465 -42.4465 -38.0563 -38.0563 -37.9170 -37.9170 -34.9049 -34.9049 3.8158 3.8158 6.9788 6.9788 7.7518 7.7518 8.4364 8.4364 9.3225 9.3225 11.4041 11.4041 13.4875 13.4875 14.5982 14.5982 17.3521 17.3521 19.7328 19.7328 k = 0.2895 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5814 -73.5814 -42.4475 -42.4475 -38.0580 -38.0580 -37.9181 -37.9181 -34.9045 -34.9045 3.7619 3.7619 6.9914 6.9914 7.7149 7.7149 8.5214 8.5214 9.3472 9.3472 11.5478 11.5478 13.6066 13.6066 14.6257 14.6257 17.3448 17.3448 19.5675 19.5675 k = 0.2982 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5810 -73.5810 -42.4486 -42.4486 -38.0597 -38.0597 -37.9191 -37.9191 -34.9040 -34.9040 3.7099 3.7099 7.0038 7.0038 7.6780 7.6780 8.6043 8.6043 9.3756 9.3756 11.6927 11.6927 13.7275 13.7275 14.6544 14.6544 17.3378 17.3378 19.3995 19.3995 k = 0.3070 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5806 -73.5806 -42.4496 -42.4496 -38.0615 -38.0615 -37.9201 -37.9201 -34.9036 -34.9036 3.6598 3.6598 7.0159 7.0159 7.6418 7.6418 8.6834 8.6834 9.4086 9.4086 11.8389 11.8389 13.8503 13.8503 14.6843 14.6843 17.3311 17.3311 19.2292 19.2292 k = 0.3158 0.5000 0.3491 ( 3720 PWs) bands (ev): -73.5802 -73.5802 -42.4507 -42.4507 -38.0632 -38.0632 -37.9210 -37.9210 -34.9032 -34.9032 3.6117 3.6117 7.0277 7.0277 7.6065 7.6065 8.7572 8.7572 9.4470 9.4470 11.9864 11.9864 13.9749 13.9749 14.7155 14.7155 17.3248 17.3248 19.0570 19.0570 k = 0.3246 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5799 -73.5799 -42.4517 -42.4517 -38.0650 -38.0650 -37.9219 -37.9219 -34.9028 -34.9028 3.5655 3.5655 7.0391 7.0391 7.5724 7.5724 8.8244 8.8244 9.4917 9.4917 12.1350 12.1350 14.1013 14.1013 14.7481 14.7481 17.3188 17.3188 18.8833 18.8833 k = 0.3333 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5795 -73.5795 -42.4526 -42.4526 -38.0668 -38.0668 -37.9226 -37.9226 -34.9024 -34.9024 3.5214 3.5214 7.0501 7.0501 7.5398 7.5398 8.8841 8.8841 9.5429 9.5429 12.2848 12.2848 14.2293 14.2293 14.7821 14.7821 17.3132 17.3132 18.7083 18.7083 k = 0.3421 0.5000 0.3491 ( 3712 PWs) bands (ev): -73.5791 -73.5791 -42.4536 -42.4536 -38.0685 -38.0685 -37.9233 -37.9233 -34.9020 -34.9020 3.4793 3.4793 7.0605 7.0605 7.5087 7.5087 8.9359 8.9359 9.6006 9.6006 12.4357 12.4357 14.3587 14.3587 14.8178 14.8178 17.3080 17.3080 18.5323 18.5323 k = 0.3509 0.5000 0.3491 ( 3712 PWs) bands (ev): -73.5788 -73.5788 -42.4545 -42.4545 -38.0702 -38.0702 -37.9240 -37.9240 -34.9016 -34.9016 3.4394 3.4394 7.0704 7.0704 7.4792 7.4792 8.9800 8.9800 9.6639 9.6639 12.5878 12.5878 14.4892 14.4892 14.8555 14.8555 17.3032 17.3032 18.3557 18.3557 k = 0.3596 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5785 -73.5785 -42.4554 -42.4554 -38.0719 -38.0719 -37.9245 -37.9245 -34.9013 -34.9013 3.4016 3.4016 7.0795 7.0795 7.4515 7.4515 9.0171 9.0171 9.7318 9.7318 12.7409 12.7409 14.6195 14.6195 14.8964 14.8964 17.2987 17.2987 18.1785 18.1785 k = 0.3684 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5782 -73.5782 -42.4562 -42.4562 -38.0735 -38.0735 -37.9251 -37.9251 -34.9009 -34.9009 3.3659 3.3659 7.0879 7.0879 7.4257 7.4257 9.0481 9.0481 9.8027 9.8027 12.8951 12.8951 14.7465 14.7465 14.9433 14.9433 17.2945 17.2945 18.0012 18.0012 k = 0.3772 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5779 -73.5779 -42.4570 -42.4570 -38.0751 -38.0751 -37.9255 -37.9255 -34.9006 -34.9006 3.3324 3.3324 7.0954 7.0954 7.4019 7.4019 9.0741 9.0741 9.8752 9.8752 13.0504 13.0504 14.8606 14.8606 15.0059 15.0059 17.2906 17.2906 17.8239 17.8239 k = 0.3860 0.5000 0.3491 ( 3708 PWs) bands (ev): -73.5776 -73.5776 -42.4578 -42.4578 -38.0766 -38.0766 -37.9259 -37.9259 -34.9003 -34.9003 3.3011 3.3011 7.1019 7.1019 7.3802 7.3802 9.0959 9.0959 9.9479 9.9479 13.2066 13.2066 14.9444 14.9444 15.1015 15.1015 17.2867 17.2867 17.6470 17.6470 k = 0.3947 0.5000 0.3491 ( 3704 PWs) bands (ev): -73.5773 -73.5773 -42.4585 -42.4585 -38.0780 -38.0780 -37.9263 -37.9263 -34.9000 -34.9000 3.2721 3.2721 7.1074 7.1074 7.3607 7.3607 9.1143 9.1143 10.0196 10.0196 13.3638 13.3638 15.0013 15.0013 15.2260 15.2260 17.2816 17.2816 17.4718 17.4718 k = 0.4035 0.5000 0.3491 ( 3712 PWs) bands (ev): -73.5771 -73.5771 -42.4592 -42.4592 -38.0794 -38.0794 -37.9266 -37.9266 -34.8998 -34.8998 3.2453 3.2453 7.1118 7.1118 7.3435 7.3435 9.1299 9.1299 10.0890 10.0890 13.5219 13.5219 15.0474 15.0474 15.3634 15.3634 17.2574 17.2574 17.3166 17.3166 k = 0.4123 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5768 -73.5768 -42.4598 -42.4598 -38.0806 -38.0806 -37.9269 -37.9269 -34.8995 -34.8995 3.2208 3.2208 7.1150 7.1150 7.3286 7.3286 9.1431 9.1431 10.1552 10.1552 13.6808 13.6808 15.0890 15.0890 15.5068 15.5068 17.1086 17.1086 17.2867 17.2867 k = 0.4211 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5766 -73.5766 -42.4604 -42.4604 -38.0818 -38.0818 -37.9272 -37.9272 -34.8993 -34.8993 3.1985 3.1985 7.1170 7.1170 7.3159 7.3159 9.1543 9.1543 10.2175 10.2175 13.8404 13.8404 15.1280 15.1280 15.6537 15.6537 16.9353 16.9353 17.2824 17.2824 k = 0.4298 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5765 -73.5765 -42.4609 -42.4609 -38.0829 -38.0829 -37.9274 -37.9274 -34.8991 -34.8991 3.1786 3.1786 7.1179 7.1179 7.3055 7.3055 9.1639 9.1639 10.2751 10.2751 14.0007 14.0007 15.1647 15.1647 15.8033 15.8033 16.7614 16.7614 17.2800 17.2800 k = 0.4386 0.5000 0.3491 ( 3724 PWs) bands (ev): -73.5763 -73.5763 -42.4613 -42.4613 -38.0838 -38.0838 -37.9276 -37.9276 -34.8989 -34.8989 3.1610 3.1610 7.1179 7.1179 7.2972 7.2972 9.1719 9.1719 10.3273 10.3273 14.1615 14.1615 15.1990 15.1990 15.9549 15.9549 16.5887 16.5887 17.2783 17.2783 k = 0.4474 0.5000 0.3491 ( 3720 PWs) bands (ev): -73.5761 -73.5761 -42.4617 -42.4617 -38.0846 -38.0846 -37.9277 -37.9277 -34.8988 -34.8988 3.1457 3.1457 7.1171 7.1171 7.2908 7.2908 9.1787 9.1787 10.3737 10.3737 14.3223 14.3223 15.2304 15.2304 16.1067 16.1067 16.4189 16.4189 17.2770 17.2770 k = 0.4561 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5760 -73.5760 -42.4621 -42.4621 -38.0854 -38.0854 -37.9279 -37.9279 -34.8986 -34.8986 3.1327 3.1327 7.1158 7.1158 7.2860 7.2860 9.1842 9.1842 10.4137 10.4137 14.4828 14.4828 15.2586 15.2586 16.2132 16.2132 16.2979 16.2979 17.2759 17.2759 k = 0.4649 0.5000 0.3491 ( 3720 PWs) bands (ev): -73.5759 -73.5759 -42.4623 -42.4623 -38.0859 -38.0859 -37.9280 -37.9280 -34.8985 -34.8985 3.1221 3.1221 7.1143 7.1143 7.2825 7.2825 9.1886 9.1886 10.4470 10.4470 14.6420 14.6420 15.2831 15.2831 16.0702 16.0702 16.4303 16.4303 17.2749 17.2749 k = 0.4737 0.5000 0.3491 ( 3716 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0864 -38.0864 -37.9281 -37.9281 -34.8984 -34.8984 3.1138 3.1138 7.1129 7.1129 7.2801 7.2801 9.1920 9.1920 10.4732 10.4732 14.7976 14.7976 15.3041 15.3041 15.9085 15.9085 16.5855 16.5855 17.2738 17.2738 k = 0.4825 0.5000 0.3491 ( 3720 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0867 -38.0867 -37.9281 -37.9281 -34.8984 -34.8984 3.1079 3.1079 7.1117 7.1117 7.2785 7.2785 9.1944 9.1944 10.4920 10.4920 14.9442 14.9442 15.3223 15.3223 15.7539 15.7539 16.7391 16.7391 17.2720 17.2720 k = 0.4912 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0869 -38.0869 -37.9282 -37.9282 -34.8983 -34.8983 3.1044 3.1044 7.1109 7.1109 7.2777 7.2777 9.1958 9.1958 10.5034 10.5034 15.0654 15.0654 15.3410 15.3410 15.6201 15.6201 16.8791 16.8791 17.2650 17.2650 k = 0.5000 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9282 -37.9282 -34.8983 -34.8983 3.1032 3.1032 7.1106 7.1106 7.2774 7.2774 9.1962 9.1962 10.5073 10.5073 15.1180 15.1180 15.3556 15.3556 15.5550 15.5550 16.9524 16.9524 17.2430 17.2430 k = 0.5000 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9282 -37.9282 -34.8983 -34.8983 3.1032 3.1032 7.1106 7.1106 7.2774 7.2774 9.1962 9.1962 10.5073 10.5073 15.1180 15.1180 15.3556 15.3556 15.5550 15.5550 16.9524 16.9524 17.2430 17.2430 k = 0.4938 0.4937 0.3491 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0869 -38.0869 -37.9282 -37.9282 -34.8983 -34.8983 3.1044 3.1044 7.1109 7.1109 7.2777 7.2777 9.1958 9.1958 10.5034 10.5034 15.0632 15.0632 15.3439 15.3439 15.6194 15.6194 16.8781 16.8781 17.2659 17.2659 k = 0.4875 0.4875 0.3491 ( 3720 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0867 -38.0867 -37.9281 -37.9281 -34.8984 -34.8984 3.1080 3.1080 7.1117 7.1117 7.2785 7.2785 9.1944 9.1944 10.4918 10.4918 14.9309 14.9309 15.3448 15.3448 15.7445 15.7445 16.7360 16.7360 17.2757 17.2757 k = 0.4813 0.4812 0.3491 ( 3720 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0864 -38.0864 -37.9281 -37.9281 -34.8984 -34.8984 3.1140 3.1140 7.1131 7.1131 7.2800 7.2800 9.1920 9.1920 10.4728 10.4728 14.7651 14.7651 15.3639 15.3639 15.8804 15.8804 16.5797 16.5797 17.2822 17.2822 k = 0.4750 0.4750 0.3491 ( 3716 PWs) bands (ev): -73.5759 -73.5759 -42.4623 -42.4623 -38.0859 -38.0859 -37.9280 -37.9280 -34.8985 -34.8985 3.1223 3.1223 7.1149 7.1149 7.2821 7.2821 9.1886 9.1886 10.4464 10.4464 14.5844 14.5844 15.3957 15.3957 16.0138 16.0138 16.4207 16.4207 17.2898 17.2898 k = 0.4688 0.4687 0.3491 ( 3716 PWs) bands (ev): -73.5760 -73.5760 -42.4620 -42.4620 -38.0853 -38.0853 -37.9279 -37.9279 -34.8986 -34.8986 3.1330 3.1330 7.1172 7.1172 7.2848 7.2848 9.1843 9.1843 10.4131 10.4131 14.3954 14.3954 15.4374 15.4374 16.1375 16.1375 16.2654 16.2654 17.2992 17.2992 k = 0.4625 0.4625 0.3491 ( 3724 PWs) bands (ev): -73.5762 -73.5762 -42.4617 -42.4617 -38.0846 -38.0846 -37.9278 -37.9278 -34.8988 -34.8988 3.1459 3.1459 7.1198 7.1198 7.2884 7.2884 9.1790 9.1790 10.3733 10.3733 14.2012 14.2012 15.4871 15.4871 16.0986 16.0986 16.2669 16.2669 17.3104 17.3104 k = 0.4562 0.4562 0.3491 ( 3728 PWs) bands (ev): -73.5763 -73.5763 -42.4613 -42.4613 -38.0837 -38.0837 -37.9276 -37.9276 -34.8989 -34.8989 3.1611 3.1611 7.1228 7.1228 7.2928 7.2928 9.1727 9.1727 10.3274 10.3274 14.0035 14.0035 15.5413 15.5413 15.9501 15.9501 16.3748 16.3748 17.3237 17.3237 k = 0.4500 0.4500 0.3491 ( 3724 PWs) bands (ev): -73.5765 -73.5765 -42.4608 -42.4608 -38.0827 -38.0827 -37.9275 -37.9275 -34.8991 -34.8991 3.1785 3.1785 7.1259 7.1259 7.2981 7.2981 9.1654 9.1654 10.2759 10.2759 13.8036 13.8036 15.5864 15.5864 15.8186 15.8186 16.4753 16.4753 17.3389 17.3389 k = 0.4437 0.4437 0.3491 ( 3724 PWs) bands (ev): -73.5767 -73.5767 -42.4603 -42.4603 -38.0816 -38.0816 -37.9273 -37.9273 -34.8993 -34.8993 3.1980 3.1980 7.1292 7.1292 7.3045 7.3045 9.1570 9.1570 10.2193 10.2193 13.6023 13.6023 15.5569 15.5569 15.7708 15.7708 16.5671 16.5671 17.3562 17.3562 k = 0.4375 0.4375 0.3491 ( 3716 PWs) bands (ev): -73.5769 -73.5769 -42.4597 -42.4597 -38.0803 -38.0803 -37.9271 -37.9271 -34.8995 -34.8995 3.2196 3.2196 7.1326 7.1326 7.3120 7.3120 9.1476 9.1476 10.1582 10.1582 13.4004 13.4004 15.4356 15.4356 15.8238 15.8238 16.6500 16.6500 17.3755 17.3755 k = 0.4313 0.4312 0.3491 ( 3712 PWs) bands (ev): -73.5771 -73.5771 -42.4591 -42.4591 -38.0789 -38.0789 -37.9268 -37.9268 -34.8998 -34.8998 3.2431 3.2431 7.1359 7.1359 7.3207 7.3207 9.1370 9.1370 10.0930 10.0930 13.1987 13.1987 15.2933 15.2933 15.9063 15.9063 16.7246 16.7246 17.3968 17.3968 k = 0.4250 0.4250 0.3491 ( 3716 PWs) bands (ev): -73.5774 -73.5774 -42.4583 -42.4583 -38.0774 -38.0774 -37.9266 -37.9266 -34.9001 -34.9001 3.2684 3.2684 7.1391 7.1391 7.3306 7.3306 9.1253 9.1253 10.0241 10.0241 12.9978 12.9978 15.1478 15.1478 16.0000 16.0000 16.7915 16.7915 17.4200 17.4200 k = 0.4188 0.4187 0.3491 ( 3720 PWs) bands (ev): -73.5777 -73.5777 -42.4576 -42.4576 -38.0758 -38.0758 -37.9263 -37.9263 -34.9004 -34.9004 3.2955 3.2955 7.1423 7.1423 7.3418 7.3418 9.1125 9.1125 9.9521 9.9521 12.7983 12.7983 15.0024 15.0024 16.1012 16.1012 16.8513 16.8513 17.4453 17.4453 k = 0.4125 0.4125 0.3491 ( 3716 PWs) bands (ev): -73.5780 -73.5780 -42.4568 -42.4568 -38.0740 -38.0740 -37.9260 -37.9260 -34.9007 -34.9007 3.3241 3.3241 7.1453 7.1453 7.3544 7.3544 9.0984 9.0984 9.8774 9.8774 12.6006 12.6006 14.8583 14.8583 16.2081 16.2081 16.9049 16.9049 17.4726 17.4726 k = 0.4062 0.4062 0.3491 ( 3716 PWs) bands (ev): -73.5783 -73.5783 -42.4559 -42.4559 -38.0721 -38.0721 -37.9257 -37.9257 -34.9011 -34.9011 3.3543 3.3543 7.1482 7.1482 7.3682 7.3682 9.0829 9.0829 9.8004 9.8004 12.4053 12.4053 14.7158 14.7158 16.3199 16.3199 16.9531 16.9531 17.5019 17.5019 k = 0.4000 0.4000 0.3491 ( 3708 PWs) bands (ev): -73.5786 -73.5786 -42.4550 -42.4550 -38.0701 -38.0701 -37.9254 -37.9254 -34.9014 -34.9014 3.3857 3.3857 7.1510 7.1510 7.3834 7.3834 9.0662 9.0662 9.7215 9.7215 12.2129 12.2129 14.5751 14.5751 16.4356 16.4356 16.9968 16.9968 17.5332 17.5332 k = 0.3937 0.3937 0.3491 ( 3708 PWs) bands (ev): -73.5790 -73.5790 -42.4540 -42.4540 -38.0680 -38.0680 -37.9250 -37.9250 -34.9018 -34.9018 3.4183 3.4183 7.1538 7.1538 7.3999 7.3999 9.0479 9.0479 9.6411 9.6411 12.0238 12.0238 14.4364 14.4364 16.5544 16.5544 17.0372 17.0372 17.5665 17.5665 k = 0.3875 0.3875 0.3491 ( 3700 PWs) bands (ev): -73.5793 -73.5793 -42.4529 -42.4529 -38.0658 -38.0658 -37.9246 -37.9246 -34.9022 -34.9022 3.4518 3.4518 7.1565 7.1565 7.4177 7.4177 9.0281 9.0281 9.5595 9.5595 11.8386 11.8386 14.2997 14.2997 16.6747 16.6747 17.0757 17.0757 17.6019 17.6019 k = 0.3812 0.3812 0.3491 ( 3708 PWs) bands (ev): -73.5797 -73.5797 -42.4519 -42.4519 -38.0635 -38.0635 -37.9242 -37.9242 -34.9026 -34.9026 3.4860 3.4860 7.1592 7.1592 7.4367 7.4367 9.0065 9.0065 9.4770 9.4770 11.6576 11.6576 14.1649 14.1649 16.7943 16.7943 17.1150 17.1150 17.6393 17.6393 k = 0.3750 0.3750 0.3491 ( 3708 PWs) bands (ev): -73.5801 -73.5801 -42.4507 -42.4507 -38.0611 -38.0611 -37.9238 -37.9238 -34.9031 -34.9031 3.5207 3.5207 7.1620 7.1620 7.4568 7.4568 8.9831 8.9831 9.3940 9.3940 11.4814 11.4814 14.0322 14.0322 16.9077 16.9077 17.1607 17.1607 17.6787 17.6787 k = 0.3688 0.3687 0.3491 ( 3712 PWs) bands (ev): -73.5806 -73.5806 -42.4496 -42.4496 -38.0585 -38.0585 -37.9234 -37.9234 -34.9035 -34.9035 3.5557 3.5557 7.1650 7.1650 7.4780 7.4780 8.9575 8.9575 9.3109 9.3109 11.3103 11.3103 13.9016 13.9016 17.0040 17.0040 17.2238 17.2238 17.7202 17.7202 k = 0.3625 0.3625 0.3491 ( 3712 PWs) bands (ev): -73.5810 -73.5810 -42.4483 -42.4483 -38.0559 -38.0559 -37.9230 -37.9230 -34.9040 -34.9040 3.5907 3.5907 7.1681 7.1681 7.5003 7.5003 8.9296 8.9296 9.2282 9.2282 11.1450 11.1450 13.7729 13.7729 17.0721 17.0721 17.3157 17.3157 17.7639 17.7639 k = 0.3563 0.3562 0.3491 ( 3720 PWs) bands (ev): -73.5815 -73.5815 -42.4471 -42.4471 -38.0532 -38.0532 -37.9225 -37.9225 -34.9045 -34.9045 3.6254 3.6254 7.1714 7.1714 7.5236 7.5236 8.8987 8.8987 9.1464 9.1464 10.9857 10.9857 13.6463 13.6463 17.1159 17.1159 17.4326 17.4326 17.8097 17.8097 k = 0.3500 0.3500 0.3491 ( 3720 PWs) bands (ev): -73.5819 -73.5819 -42.4458 -42.4458 -38.0504 -38.0504 -37.9220 -37.9220 -34.9050 -34.9050 3.6595 3.6595 7.1751 7.1751 7.5479 7.5479 8.8641 8.8641 9.0665 9.0665 10.8330 10.8330 13.5216 13.5216 17.1464 17.1464 17.5633 17.5633 17.8577 17.8577 k = 0.3438 0.3437 0.3491 ( 3720 PWs) bands (ev): -73.5824 -73.5824 -42.4444 -42.4444 -38.0475 -38.0475 -37.9215 -37.9215 -34.9055 -34.9055 3.6926 3.6926 7.1791 7.1791 7.5730 7.5730 8.8245 8.8245 8.9900 8.9900 10.6873 10.6873 13.3990 13.3990 17.1704 17.1704 17.7014 17.7014 17.9081 17.9081 k = 0.3375 0.3375 0.3491 ( 3720 PWs) bands (ev): -73.5829 -73.5829 -42.4431 -42.4431 -38.0445 -38.0445 -37.9210 -37.9210 -34.9061 -34.9061 3.7244 3.7244 7.1835 7.1835 7.5989 7.5989 8.7777 8.7777 8.9191 8.9191 10.5490 10.5490 13.2782 13.2782 17.1909 17.1909 17.8432 17.8432 17.9616 17.9616 k = 0.3312 0.3312 0.3491 ( 3718 PWs) bands (ev): -73.5834 -73.5834 -42.4416 -42.4416 -38.0414 -38.0414 -37.9205 -37.9205 -34.9066 -34.9066 3.7545 3.7545 7.1883 7.1883 7.6255 7.6255 8.7218 8.7218 8.8560 8.8560 10.4184 10.4184 13.1594 13.1594 17.2094 17.2094 17.9812 17.9812 18.0242 18.0242 k = 0.3250 0.3250 0.3491 ( 3722 PWs) bands (ev): -73.5840 -73.5840 -42.4402 -42.4402 -38.0383 -38.0383 -37.9200 -37.9200 -34.9072 -34.9072 3.7825 3.7825 7.1936 7.1936 7.6528 7.6528 8.6570 8.6570 8.8010 8.8010 10.2958 10.2958 13.0425 13.0425 17.2267 17.2267 18.0643 18.0643 18.1464 18.1464 k = 0.3187 0.3187 0.3491 ( 3722 PWs) bands (ev): -73.5845 -73.5845 -42.4387 -42.4387 -38.0351 -38.0351 -37.9194 -37.9194 -34.9077 -34.9077 3.8080 3.8080 7.1994 7.1994 7.6807 7.6807 8.5859 8.5859 8.7517 8.7517 10.1813 10.1813 12.9275 12.9275 17.2435 17.2435 18.1254 18.1254 18.2947 18.2947 k = 0.3125 0.3125 0.3491 ( 3726 PWs) bands (ev): -73.5850 -73.5850 -42.4372 -42.4372 -38.0318 -38.0318 -37.9189 -37.9189 -34.9083 -34.9083 3.8306 3.8306 7.2057 7.2057 7.7090 7.7090 8.5117 8.5117 8.7056 8.7056 10.0750 10.0750 12.8143 12.8143 17.2602 17.2602 18.1870 18.1870 18.4464 18.4464 k = 0.3063 0.3062 0.3491 ( 3722 PWs) bands (ev): -73.5856 -73.5856 -42.4357 -42.4357 -38.0284 -38.0284 -37.9183 -37.9183 -34.9089 -34.9089 3.8498 3.8498 7.2127 7.2127 7.7375 7.7375 8.4363 8.4363 8.6612 8.6612 9.9769 9.9769 12.7029 12.7029 17.2771 17.2771 18.2504 18.2504 18.5999 18.5999 k = 0.3000 0.3000 0.3491 ( 3718 PWs) bands (ev): -73.5862 -73.5862 -42.4341 -42.4341 -38.0250 -38.0250 -37.9177 -37.9177 -34.9095 -34.9095 3.8653 3.8653 7.2202 7.2202 7.7662 7.7662 8.3613 8.3613 8.6181 8.6181 9.8867 9.8867 12.5934 12.5934 17.2946 17.2946 18.3160 18.3160 18.7547 18.7547 k = 0.2938 0.2937 0.3491 ( 3722 PWs) bands (ev): -73.5867 -73.5867 -42.4325 -42.4325 -38.0216 -38.0216 -37.9171 -37.9171 -34.9101 -34.9101 3.8766 3.8766 7.2285 7.2285 7.7945 7.7945 8.2875 8.2875 8.5763 8.5763 9.8041 9.8041 12.4855 12.4855 17.3130 17.3130 18.3837 18.3837 18.9105 18.9105 k = 0.2875 0.2875 0.3491 ( 3722 PWs) bands (ev): -73.5873 -73.5873 -42.4309 -42.4309 -38.0181 -38.0181 -37.9165 -37.9165 -34.9107 -34.9107 3.8834 3.8834 7.2374 7.2374 7.8218 7.8218 8.2160 8.2160 8.5363 8.5363 9.7287 9.7287 12.3794 12.3794 17.3324 17.3324 18.4537 18.4537 19.0672 19.0672 k = 0.2812 0.2812 0.3491 ( 3722 PWs) bands (ev): -73.5879 -73.5879 -42.4293 -42.4293 -38.0146 -38.0146 -37.9159 -37.9159 -34.9113 -34.9113 3.8854 3.8854 7.2470 7.2470 7.8468 7.8468 8.1484 8.1484 8.4987 8.4987 9.6600 9.6600 12.2750 12.2750 17.3532 17.3532 18.5260 18.5260 19.2245 19.2245 k = 0.2750 0.2750 0.3491 ( 3722 PWs) bands (ev): -73.5885 -73.5885 -42.4277 -42.4277 -38.0110 -38.0110 -37.9153 -37.9153 -34.9120 -34.9120 3.8822 3.8822 7.2573 7.2573 7.8659 7.8659 8.0882 8.0882 8.4641 8.4641 9.5974 9.5974 12.1722 12.1722 17.3756 17.3756 18.6005 18.6005 19.3824 19.3824 k = 0.2687 0.2687 0.3491 ( 3726 PWs) bands (ev): -73.5891 -73.5891 -42.4261 -42.4261 -38.0074 -38.0074 -37.9147 -37.9147 -34.9126 -34.9126 3.8737 3.8737 7.2684 7.2684 7.8706 7.8706 8.0443 8.0443 8.4331 8.4331 9.5404 9.5404 12.0711 12.0711 17.3998 17.3998 18.6775 18.6775 19.5407 19.5407 k = 0.2625 0.2625 0.3491 ( 3722 PWs) bands (ev): -73.5897 -73.5897 -42.4244 -42.4244 -38.0038 -38.0038 -37.9140 -37.9140 -34.9132 -34.9132 3.8598 3.8598 7.2803 7.2803 7.8487 7.8487 8.0287 8.0287 8.4064 8.4064 9.4884 9.4884 11.9716 11.9716 17.4260 17.4260 18.7567 18.7567 19.6992 19.6992 k = 0.2562 0.2562 0.3491 ( 3726 PWs) bands (ev): -73.5902 -73.5902 -42.4227 -42.4227 -38.0001 -38.0001 -37.9134 -37.9134 -34.9138 -34.9138 3.8403 3.8403 7.2928 7.2928 7.8034 7.8034 8.0383 8.0383 8.3845 8.3845 9.4410 9.4410 11.8736 11.8736 17.4544 17.4544 18.8384 18.8384 19.8579 19.8579 k = 0.2500 0.2500 0.3491 ( 3726 PWs) bands (ev): -73.5908 -73.5908 -42.4211 -42.4211 -37.9965 -37.9965 -37.9127 -37.9127 -34.9145 -34.9145 3.8154 3.8154 7.3059 7.3059 7.7478 7.7478 8.0601 8.0601 8.3678 8.3678 9.3975 9.3975 11.7771 11.7771 17.4853 17.4853 18.9225 18.9225 20.0165 20.0165 k = 0.2437 0.2437 0.3491 ( 3726 PWs) bands (ev): -73.5914 -73.5914 -42.4194 -42.4194 -37.9928 -37.9928 -37.9121 -37.9121 -34.9151 -34.9151 3.7851 3.7851 7.3195 7.3195 7.6891 7.6891 8.0868 8.0868 8.3565 8.3565 9.3577 9.3577 11.6822 11.6822 17.5189 17.5189 19.0090 19.0090 20.1750 20.1750 k = 0.2375 0.2375 0.3491 ( 3734 PWs) bands (ev): -73.5920 -73.5920 -42.4177 -42.4177 -37.9891 -37.9891 -37.9115 -37.9115 -34.9157 -34.9157 3.7497 3.7497 7.3330 7.3330 7.6306 7.6306 8.1158 8.1158 8.3506 8.3506 9.3212 9.3212 11.5886 11.5886 17.5552 17.5552 19.0979 19.0979 20.3333 20.3333 k = 0.2313 0.2312 0.3491 ( 3732 PWs) bands (ev): -73.5926 -73.5926 -42.4161 -42.4161 -37.9854 -37.9854 -37.9108 -37.9108 -34.9163 -34.9163 3.7094 3.7094 7.3456 7.3456 7.5743 7.5743 8.1459 8.1459 8.3502 8.3502 9.2876 9.2876 11.4966 11.4966 17.5947 17.5947 19.1894 19.1894 20.4911 20.4911 k = 0.2250 0.2250 0.3491 ( 3740 PWs) bands (ev): -73.5932 -73.5932 -42.4144 -42.4144 -37.9818 -37.9818 -37.9102 -37.9102 -34.9169 -34.9169 3.6647 3.6647 7.3548 7.3548 7.5232 7.5232 8.1764 8.1764 8.3550 8.3550 9.2568 9.2568 11.4059 11.4059 17.6373 17.6373 19.2833 19.2833 20.6484 20.6484 k = 0.2188 0.2187 0.3491 ( 3748 PWs) bands (ev): -73.5938 -73.5938 -42.4128 -42.4128 -37.9781 -37.9781 -37.9095 -37.9095 -34.9176 -34.9176 3.6159 3.6159 7.3538 7.3538 7.4844 7.4844 8.2071 8.2071 8.3648 8.3648 9.2286 9.2286 11.3166 11.3166 17.6834 17.6834 19.3797 19.3797 20.8050 20.8050 k = 0.2125 0.2125 0.3491 ( 3746 PWs) bands (ev): -73.5944 -73.5944 -42.4111 -42.4111 -37.9745 -37.9745 -37.9089 -37.9089 -34.9182 -34.9182 3.5633 3.5633 7.3327 7.3327 7.4679 7.4679 8.2376 8.2376 8.3791 8.3791 9.2030 9.2030 11.2286 11.2286 17.7330 17.7330 19.4787 19.4787 20.9607 20.9607 k = 0.2062 0.2062 0.3491 ( 3746 PWs) bands (ev): -73.5950 -73.5950 -42.4095 -42.4095 -37.9709 -37.9709 -37.9082 -37.9082 -34.9188 -34.9188 3.5076 3.5076 7.2931 7.2931 7.4723 7.4723 8.2679 8.2679 8.3975 8.3975 9.1797 9.1797 11.1419 11.1419 17.7864 17.7864 19.5803 19.5803 21.1155 21.1155 k = 0.2000 0.2000 0.3491 ( 3748 PWs) bands (ev): -73.5955 -73.5955 -42.4079 -42.4079 -37.9673 -37.9673 -37.9076 -37.9076 -34.9194 -34.9194 3.4492 3.4492 7.2455 7.2455 7.4870 7.4870 8.2977 8.2977 8.4195 8.4195 9.1588 9.1588 11.0565 11.0565 17.8436 17.8436 19.6845 19.6845 21.2692 21.2692 k = 0.1938 0.1937 0.3491 ( 3748 PWs) bands (ev): -73.5961 -73.5961 -42.4063 -42.4063 -37.9638 -37.9638 -37.9070 -37.9070 -34.9199 -34.9199 3.3884 3.3884 7.1956 7.1956 7.5067 7.5067 8.3268 8.3268 8.4445 8.4445 9.1404 9.1404 10.9723 10.9723 17.9049 17.9049 19.7913 19.7913 21.4216 21.4216 k = 0.1875 0.1875 0.3491 ( 3744 PWs) bands (ev): -73.5967 -73.5967 -42.4048 -42.4048 -37.9603 -37.9603 -37.9063 -37.9063 -34.9205 -34.9205 3.3259 3.3259 7.1453 7.1453 7.5293 7.5293 8.3552 8.3552 8.4720 8.4720 9.1247 9.1247 10.8894 10.8894 17.9704 17.9704 19.9007 19.9007 21.5725 21.5725 k = 0.1812 0.1812 0.3491 ( 3748 PWs) bands (ev): -73.5972 -73.5972 -42.4032 -42.4032 -37.9568 -37.9568 -37.9057 -37.9057 -34.9211 -34.9211 3.2620 3.2620 7.0956 7.0956 7.5538 7.5538 8.3825 8.3825 8.5012 8.5012 9.1116 9.1116 10.8077 10.8077 18.0401 18.0401 20.0127 20.0127 21.7217 21.7217 k = 0.1750 0.1750 0.3491 ( 3752 PWs) bands (ev): -73.5978 -73.5978 -42.4017 -42.4017 -37.9535 -37.9535 -37.9051 -37.9051 -34.9216 -34.9216 3.1972 3.1972 7.0469 7.0469 7.5799 7.5799 8.4087 8.4087 8.5316 8.5316 9.1016 9.1016 10.7271 10.7271 18.1141 18.1141 20.1275 20.1275 21.8689 21.8689 k = 0.1688 0.1687 0.3491 ( 3752 PWs) bands (ev): -73.5983 -73.5983 -42.4002 -42.4002 -37.9501 -37.9501 -37.9045 -37.9045 -34.9222 -34.9222 3.1319 3.1319 6.9995 6.9995 7.6074 7.6074 8.4333 8.4333 8.5627 8.5627 9.0947 9.0947 10.6477 10.6477 18.1926 18.1926 20.2450 20.2450 22.0136 22.0136 k = 0.1625 0.1625 0.3491 ( 3752 PWs) bands (ev): -73.5988 -73.5988 -42.3988 -42.3988 -37.9469 -37.9469 -37.9039 -37.9039 -34.9227 -34.9227 3.0664 3.0664 6.9535 6.9535 7.6361 7.6361 8.4563 8.4563 8.5937 8.5937 9.0914 9.0914 10.5694 10.5694 18.2756 18.2756 20.3652 20.3652 22.1524 22.1524 k = 0.1562 0.1562 0.3491 ( 3752 PWs) bands (ev): -73.5993 -73.5993 -42.3973 -42.3973 -37.9437 -37.9437 -37.9034 -37.9034 -34.9232 -34.9232 3.0012 3.0012 6.9089 6.9089 7.6661 7.6661 8.4773 8.4773 8.6242 8.6242 9.0919 9.0919 10.4922 10.4922 18.3631 18.3631 20.4882 20.4882 22.2464 22.2464 k = 0.1500 0.1500 0.3491 ( 3748 PWs) bands (ev): -73.5998 -73.5998 -42.3959 -42.3959 -37.9406 -37.9406 -37.9028 -37.9028 -34.9237 -34.9237 2.9364 2.9364 6.8658 6.8658 7.6971 7.6971 8.4961 8.4961 8.6538 8.6538 9.0964 9.0964 10.4161 10.4161 18.4551 18.4551 20.6139 20.6139 22.3073 22.3073 k = 0.1437 0.1437 0.3491 ( 3744 PWs) bands (ev): -73.6003 -73.6003 -42.3946 -42.3946 -37.9375 -37.9375 -37.9023 -37.9023 -34.9242 -34.9242 2.8726 2.8726 6.8244 6.8244 7.7293 7.7293 8.5126 8.5126 8.6820 8.6820 9.1049 9.1049 10.3412 10.3412 18.5515 18.5515 20.7424 20.7424 22.3656 22.3656 k = 0.1375 0.1375 0.3491 ( 3744 PWs) bands (ev): -73.6007 -73.6007 -42.3933 -42.3933 -37.9346 -37.9346 -37.9017 -37.9017 -34.9247 -34.9247 2.8099 2.8099 6.7845 6.7845 7.7624 7.7624 8.5266 8.5266 8.7087 8.7087 9.1174 9.1174 10.2673 10.2673 18.6522 18.6522 20.8737 20.8737 22.4233 22.4233 k = 0.1313 0.1313 0.3491 ( 3744 PWs) bands (ev): -73.6012 -73.6012 -42.3920 -42.3920 -37.9317 -37.9317 -37.9012 -37.9012 -34.9251 -34.9251 2.7485 2.7485 6.7463 6.7463 7.7966 7.7966 8.5380 8.5380 8.7339 8.7339 9.1336 9.1336 10.1945 10.1945 18.7573 18.7573 21.0079 21.0079 22.4809 22.4809 k = 0.1250 0.1250 0.3491 ( 3748 PWs) bands (ev): -73.6016 -73.6016 -42.3908 -42.3908 -37.9290 -37.9290 -37.9007 -37.9007 -34.9256 -34.9256 2.6888 2.6888 6.7098 6.7098 7.8318 7.8318 8.5469 8.5469 8.7576 8.7576 9.1530 9.1530 10.1228 10.1228 18.8664 18.8664 21.1449 21.1449 22.5384 22.5384 k = 0.1187 0.1187 0.3491 ( 3748 PWs) bands (ev): -73.6020 -73.6020 -42.3896 -42.3896 -37.9263 -37.9263 -37.9002 -37.9002 -34.9260 -34.9260 2.6308 2.6308 6.6750 6.6750 7.8678 7.8678 8.5534 8.5534 8.7800 8.7800 9.1749 9.1749 10.0523 10.0523 18.9794 18.9794 21.2848 21.2848 22.5959 22.5959 k = 0.1125 0.1125 0.3491 ( 3744 PWs) bands (ev): -73.6024 -73.6024 -42.3885 -42.3885 -37.9237 -37.9237 -37.8998 -37.8998 -34.9264 -34.9264 2.5749 2.5749 6.6419 6.6419 7.9048 7.9048 8.5579 8.5579 8.8012 8.8012 9.1987 9.1987 9.9829 9.9829 19.0959 19.0959 21.4275 21.4275 22.6536 22.6536 k = 0.1062 0.1062 0.3491 ( 3742 PWs) bands (ev): -73.6028 -73.6028 -42.3874 -42.3874 -37.9213 -37.9213 -37.8993 -37.8993 -34.9268 -34.9268 2.5212 2.5212 6.6105 6.6105 7.9425 7.9425 8.5607 8.5607 8.8213 8.8213 9.2236 9.2236 9.9148 9.9148 19.2157 19.2157 21.5732 21.5732 22.7115 22.7115 k = 0.1000 0.1000 0.3491 ( 3746 PWs) bands (ev): -73.6032 -73.6032 -42.3864 -42.3864 -37.9190 -37.9190 -37.8989 -37.8989 -34.9272 -34.9272 2.4699 2.4699 6.5808 6.5808 7.9811 7.9811 8.5620 8.5620 8.8404 8.8404 9.2488 9.2488 9.8480 9.8480 19.3384 19.3384 21.7217 21.7217 22.7696 22.7696 k = 0.0938 0.0937 0.3491 ( 3738 PWs) bands (ev): -73.6035 -73.6035 -42.3854 -42.3854 -37.9168 -37.9168 -37.8985 -37.8985 -34.9275 -34.9275 2.4210 2.4210 6.5529 6.5529 8.0203 8.0203 8.5622 8.5622 8.8586 8.8586 9.2738 9.2738 9.7828 9.7828 19.4633 19.4633 21.8731 21.8731 22.8281 22.8281 k = 0.0875 0.0875 0.3491 ( 3742 PWs) bands (ev): -73.6038 -73.6038 -42.3845 -42.3845 -37.9147 -37.9147 -37.8981 -37.8981 -34.9278 -34.9278 2.3747 2.3747 6.5268 6.5268 8.0601 8.0601 8.5616 8.5616 8.8758 8.8758 9.2977 9.2977 9.7195 9.7195 19.5900 19.5900 22.0275 22.0275 22.8869 22.8869 k = 0.0813 0.0812 0.3491 ( 3746 PWs) bands (ev): -73.6041 -73.6041 -42.3836 -42.3836 -37.9127 -37.9127 -37.8978 -37.8978 -34.9281 -34.9281 2.3312 2.3312 6.5024 6.5024 8.1004 8.1004 8.5606 8.5606 8.8920 8.8920 9.3195 9.3195 9.6586 9.6586 19.7177 19.7177 22.1847 22.1847 22.9461 22.9461 k = 0.0750 0.0750 0.3491 ( 3738 PWs) bands (ev): -73.6044 -73.6044 -42.3828 -42.3828 -37.9109 -37.9109 -37.8974 -37.8974 -34.9284 -34.9284 2.2906 2.2906 6.4799 6.4799 8.1410 8.1410 8.5595 8.5595 8.9072 8.9072 9.3377 9.3377 9.6015 9.6015 19.8455 19.8455 22.3448 22.3448 23.0057 23.0057 k = 0.0688 0.0688 0.3491 ( 3738 PWs) bands (ev): -73.6047 -73.6047 -42.3821 -42.3821 -37.9092 -37.9092 -37.8971 -37.8971 -34.9287 -34.9287 2.2528 2.2528 6.4591 6.4591 8.1817 8.1817 8.5586 8.5586 8.9213 8.9213 9.3493 9.3493 9.5509 9.5509 19.9726 19.9726 22.5078 22.5078 23.0655 23.0655 k = 0.0625 0.0625 0.3491 ( 3738 PWs) bands (ev): -73.6049 -73.6049 -42.3814 -42.3814 -37.9077 -37.9077 -37.8968 -37.8968 -34.9289 -34.9289 2.2181 2.2181 6.4401 6.4401 8.2222 8.2222 8.5583 8.5583 8.9343 8.9343 9.3486 9.3486 9.5124 9.5124 20.0976 20.0976 22.6736 22.6736 23.1256 23.1256 k = 0.0563 0.0562 0.3491 ( 3738 PWs) bands (ev): -73.6051 -73.6051 -42.3808 -42.3808 -37.9062 -37.9062 -37.8966 -37.8966 -34.9292 -34.9292 2.1865 2.1865 6.4229 6.4229 8.2619 8.2619 8.5590 8.5590 8.9462 8.9462 9.3291 9.3291 9.4926 9.4926 20.2193 20.2193 22.8422 22.8422 23.1857 23.1857 k = 0.0500 0.0500 0.3491 ( 3734 PWs) bands (ev): -73.6053 -73.6053 -42.3802 -42.3802 -37.9050 -37.9050 -37.8963 -37.8963 -34.9293 -34.9293 2.1581 2.1581 6.4075 6.4075 8.3004 8.3004 8.5612 8.5612 8.9568 8.9568 9.2927 9.2927 9.4895 9.4895 20.3361 20.3361 23.0135 23.0135 23.2455 23.2455 k = 0.0437 0.0437 0.3491 ( 3736 PWs) bands (ev): -73.6055 -73.6055 -42.3797 -42.3797 -37.9038 -37.9038 -37.8961 -37.8961 -34.9295 -34.9295 2.1328 2.1328 6.3939 6.3939 8.3365 8.3365 8.5658 8.5658 8.9661 8.9661 9.2478 9.2478 9.4949 9.4949 20.4464 20.4464 23.1872 23.1872 23.3048 23.3048 k = 0.0375 0.0375 0.3491 ( 3736 PWs) bands (ev): -73.6057 -73.6057 -42.3793 -42.3793 -37.9029 -37.9029 -37.8960 -37.8960 -34.9297 -34.9297 2.1109 2.1109 6.3821 6.3821 8.3690 8.3690 8.5737 8.5737 8.9741 8.9741 9.2004 9.2004 9.5032 9.5032 20.5482 20.5482 23.3558 23.3558 23.3703 23.3703 k = 0.0312 0.0312 0.3491 ( 3736 PWs) bands (ev): -73.6058 -73.6058 -42.3789 -42.3789 -37.9020 -37.9020 -37.8958 -37.8958 -34.9298 -34.9298 2.0922 2.0922 6.3721 6.3721 8.3965 8.3965 8.5858 8.5858 8.9804 8.9804 9.1537 9.1537 9.5119 9.5119 20.6394 20.6394 23.4171 23.4171 23.5426 23.5426 k = 0.0250 0.0250 0.3491 ( 3730 PWs) bands (ev): -73.6059 -73.6059 -42.3786 -42.3786 -37.9013 -37.9013 -37.8957 -37.8957 -34.9299 -34.9299 2.0769 2.0769 6.3639 6.3639 8.4179 8.4179 8.6022 8.6022 8.9849 8.9849 9.1102 9.1102 9.5198 9.5198 20.7180 20.7180 23.4688 23.4688 23.7218 23.7218 k = 0.0187 0.0187 0.3491 ( 3734 PWs) bands (ev): -73.6060 -73.6060 -42.3784 -42.3784 -37.9008 -37.9008 -37.8956 -37.8956 -34.9300 -34.9300 2.0650 2.0650 6.3575 6.3575 8.4329 8.4329 8.6216 8.6216 8.9867 8.9867 9.0725 9.0725 9.5263 9.5263 20.7818 20.7818 23.5143 23.5143 23.9007 23.9007 k = 0.0125 0.0125 0.3491 ( 3730 PWs) bands (ev): -73.6060 -73.6060 -42.3782 -42.3782 -37.9004 -37.9004 -37.8955 -37.8955 -34.9300 -34.9300 2.0564 2.0564 6.3530 6.3530 8.4424 8.4424 8.6409 8.6409 8.9846 8.9846 9.0447 9.0447 9.5311 9.5311 20.8290 20.8290 23.5509 23.5509 24.0745 24.0745 k = 0.0063 0.0062 0.3491 ( 3732 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9002 -37.9002 -37.8955 -37.8955 -34.9301 -34.9301 2.0513 2.0513 6.3503 6.3503 8.4476 8.4476 8.6555 8.6555 8.9789 8.9789 9.0300 9.0300 9.5340 9.5340 20.8580 20.8580 23.5749 23.5749 24.2154 24.2154 k = 0.0000 0.0000 0.3491 ( 3736 PWs) bands (ev): -73.6061 -73.6061 -42.3781 -42.3781 -37.9001 -37.9001 -37.8955 -37.8955 -34.9301 -34.9301 2.0496 2.0496 6.3494 6.3494 8.4492 8.4492 8.6610 8.6610 8.9756 8.9756 9.0260 9.0260 9.5350 9.5350 20.8677 20.8677 23.5834 23.5834 24.2179 24.2179 k = 0.0000 0.5000-0.0000 ( 3726 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7213 5.7213 6.2958 6.2958 6.9472 6.9472 7.5772 7.5772 8.1519 8.1519 9.2834 9.2834 12.1065 12.1065 17.3857 17.3857 18.5247 18.5247 19.4311 19.4311 k = 0.0000 0.5000 0.0087 ( 3718 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7213 5.7213 6.2962 6.2962 6.9469 6.9469 7.5784 7.5784 8.1519 8.1519 9.2833 9.2833 12.1059 12.1059 17.3856 17.3856 18.5053 18.5053 19.4345 19.4345 k = 0.0000 0.5000 0.0175 ( 3722 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7211 5.7211 6.2974 6.2974 6.9458 6.9458 7.5820 7.5820 8.1520 8.1520 9.2830 9.2830 12.1043 12.1043 17.3854 17.3854 18.4489 18.4489 19.4448 19.4448 k = 0.0000 0.5000 0.0262 ( 3720 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7207 5.7207 6.2994 6.2994 6.9440 6.9440 7.5881 7.5881 8.1522 8.1522 9.2825 9.2825 12.1015 12.1015 17.3851 17.3851 18.3600 18.3600 19.4617 19.4617 k = 0.0000 0.5000 0.0349 ( 3724 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0334 -38.0334 -37.8753 -37.8753 -34.9141 -34.9141 5.7203 5.7203 6.3021 6.3021 6.9414 6.9414 7.5966 7.5966 8.1524 8.1524 9.2819 9.2819 12.0977 12.0977 17.3847 17.3847 18.2450 18.2450 19.4853 19.4853 k = 0.0000 0.5000 0.0436 ( 3728 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8754 -37.8754 -34.9141 -34.9141 5.7197 5.7197 6.3055 6.3055 6.9382 6.9382 7.6075 7.6075 8.1527 8.1527 9.2810 9.2810 12.0927 12.0927 17.3844 17.3844 18.1098 18.1098 19.5153 19.5153 k = 0.0000 0.5000 0.0524 ( 3728 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8754 -37.8754 -34.9141 -34.9141 5.7190 5.7190 6.3096 6.3096 6.9343 6.9343 7.6209 7.6209 8.1530 8.1530 9.2800 9.2800 12.0865 12.0865 17.3840 17.3840 17.9598 17.9598 19.5516 19.5516 k = 0.0000 0.5000 0.0611 ( 3730 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8754 -37.8754 -34.9141 -34.9141 5.7181 5.7181 6.3143 6.3143 6.9297 6.9297 7.6369 7.6369 8.1534 8.1534 9.2788 9.2788 12.0790 12.0790 17.3838 17.3838 17.7994 17.7994 19.5940 19.5940 k = 0.0000 0.5000 0.0698 ( 3724 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8754 -37.8754 -34.9142 -34.9142 5.7172 5.7172 6.3196 6.3196 6.9245 6.9245 7.6554 7.6554 8.1538 8.1538 9.2775 9.2775 12.0703 12.0703 17.3835 17.3835 17.6323 17.6323 19.6422 19.6422 k = 0.0000 0.5000 0.0786 ( 3724 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8754 -37.8754 -34.9142 -34.9142 5.7161 5.7161 6.3254 6.3254 6.9187 6.9187 7.6765 7.6765 8.1543 8.1543 9.2760 9.2760 12.0602 12.0602 17.3809 17.3809 17.4632 17.4632 19.6959 19.6959 k = 0.0000 0.5000 0.0873 ( 3724 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8755 -37.8755 -34.9142 -34.9142 5.7150 5.7150 6.3317 6.3317 6.9122 6.9122 7.7003 7.7003 8.1549 8.1549 9.2744 9.2744 12.0487 12.0487 17.2803 17.2803 17.3901 17.3901 19.7550 19.7550 k = 0.0000 0.5000 0.0960 ( 3732 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8755 -37.8755 -34.9142 -34.9142 5.7138 5.7138 6.3383 6.3383 6.9052 6.9052 7.7266 7.7266 8.1555 8.1555 9.2727 9.2727 12.0356 12.0356 17.1066 17.1066 17.3895 17.3895 19.8190 19.8190 k = 0.0000 0.5000 0.1047 ( 3734 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8755 -37.8755 -34.9142 -34.9142 5.7125 5.7125 6.3452 6.3452 6.8977 6.8977 7.7556 7.7556 8.1561 8.1561 9.2708 9.2708 12.0210 12.0210 16.9316 16.9316 17.3911 17.3911 19.8876 19.8876 k = 0.0000 0.5000 0.1135 ( 3734 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8756 -37.8756 -34.9142 -34.9142 5.7111 5.7111 6.3524 6.3524 6.8898 6.8898 7.7873 7.7873 8.1568 8.1568 9.2689 9.2689 12.0046 12.0046 16.7577 16.7577 17.3936 17.3936 19.9606 19.9606 k = 0.0000 0.5000 0.1222 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4229 -42.4229 -38.0333 -38.0333 -37.8756 -37.8756 -34.9143 -34.9143 5.7097 5.7097 6.3598 6.3598 6.8814 6.8814 7.8217 7.8217 8.1575 8.1575 9.2669 9.2669 11.9864 11.9864 16.5857 16.5857 17.3969 17.3969 20.0376 20.0376 k = 0.0000 0.5000 0.1309 ( 3736 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0333 -38.0333 -37.8757 -37.8757 -34.9143 -34.9143 5.7082 5.7082 6.3673 6.3673 6.8726 6.8726 7.8586 7.8586 8.1583 8.1583 9.2648 9.2648 11.9663 11.9663 16.4166 16.4166 17.4008 17.4008 20.1182 20.1182 k = 0.0000 0.5000 0.1397 ( 3732 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0333 -38.0333 -37.8757 -37.8757 -34.9143 -34.9143 5.7067 5.7067 6.3749 6.3749 6.8635 6.8635 7.8982 7.8982 8.1590 8.1590 9.2627 9.2627 11.9441 11.9441 16.2510 16.2510 17.4054 17.4054 20.2021 20.2021 k = 0.0000 0.5000 0.1484 ( 3734 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8757 -37.8757 -34.9143 -34.9143 5.7052 5.7052 6.3825 6.3825 6.8542 6.8542 7.9404 7.9404 8.1598 8.1598 9.2606 9.2606 11.9197 11.9197 16.0894 16.0894 17.4106 17.4106 20.2888 20.2888 k = 0.0000 0.5000 0.1571 ( 3734 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8758 -37.8758 -34.9143 -34.9143 5.7036 5.7036 6.3900 6.3900 6.8447 6.8447 7.9851 7.9851 8.1607 8.1607 9.2584 9.2584 11.8930 11.8930 15.9324 15.9324 17.4165 17.4165 20.3780 20.3780 k = 0.0000 0.5000 0.1658 ( 3734 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8758 -37.8758 -34.9144 -34.9144 5.7021 5.7021 6.3974 6.3974 6.8350 6.8350 8.0321 8.0321 8.1616 8.1616 9.2563 9.2563 11.8638 11.8638 15.7804 15.7804 17.4229 17.4229 20.4692 20.4692 k = 0.0000 0.5000 0.1746 ( 3730 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8759 -37.8759 -34.9144 -34.9144 5.7006 5.7006 6.4046 6.4046 6.8253 6.8253 8.0814 8.0814 8.1626 8.1626 9.2543 9.2543 11.8321 11.8321 15.6339 15.6339 17.4298 17.4298 20.5620 20.5620 k = 0.0000 0.5000 0.1833 ( 3730 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8759 -37.8759 -34.9144 -34.9144 5.6990 5.6990 6.4117 6.4117 6.8156 6.8156 8.1322 8.1322 8.1642 8.1642 9.2523 9.2523 11.7978 11.7978 15.4933 15.4933 17.4372 17.4372 20.6559 20.6559 k = 0.0000 0.5000 0.1920 ( 3730 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8759 -37.8759 -34.9144 -34.9144 5.6976 5.6976 6.4185 6.4185 6.8059 6.8059 8.1621 8.1621 8.1887 8.1887 9.2504 9.2504 11.7608 11.7608 15.3589 15.3589 17.4450 17.4450 20.7504 20.7504 k = 0.0000 0.5000 0.2008 ( 3722 PWs) bands (ev): -73.5908 -73.5908 -42.4230 -42.4230 -38.0332 -38.0332 -37.8760 -37.8760 -34.9144 -34.9144 5.6961 5.6961 6.4251 6.4251 6.7963 6.7963 8.1640 8.1640 8.2431 8.2431 9.2487 9.2487 11.7210 11.7210 15.2311 15.2311 17.4531 17.4531 20.8449 20.8449 k = 0.0000 0.5000 0.2095 ( 3722 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0332 -38.0332 -37.8760 -37.8760 -34.9145 -34.9145 5.6947 5.6947 6.4314 6.4314 6.7869 6.7869 8.1650 8.1650 8.2999 8.2999 9.2472 9.2472 11.6785 11.6785 15.1103 15.1103 17.4614 17.4614 20.9390 20.9390 k = 0.0000 0.5000 0.2182 ( 3718 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8761 -37.8761 -34.9145 -34.9145 5.6933 5.6933 6.4374 6.4374 6.7777 6.7777 8.1659 8.1659 8.3582 8.3582 9.2458 9.2458 11.6335 11.6335 14.9967 14.9967 17.4698 17.4698 21.0319 21.0319 k = 0.0000 0.5000 0.2269 ( 3732 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8761 -37.8761 -34.9145 -34.9145 5.6920 5.6920 6.4430 6.4430 6.7689 6.7689 8.1667 8.1667 8.4175 8.4175 9.2447 9.2447 11.5859 11.5859 14.8904 14.8904 17.4783 17.4783 21.1231 21.1231 k = 0.0000 0.5000 0.2357 ( 3732 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8761 -37.8761 -34.9145 -34.9145 5.6908 5.6908 6.4483 6.4483 6.7603 6.7603 8.1674 8.1674 8.4773 8.4773 9.2440 9.2440 11.5362 11.5362 14.7917 14.7917 17.4867 17.4867 21.2120 21.2120 k = 0.0000 0.5000 0.2444 ( 3750 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8762 -37.8762 -34.9146 -34.9146 5.6896 5.6896 6.4533 6.4533 6.7522 6.7522 8.1681 8.1681 8.5373 8.5373 9.2436 9.2436 11.4847 11.4847 14.7008 14.7008 17.4949 17.4949 21.2979 21.2979 k = 0.0000 0.5000 0.2531 ( 3750 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8762 -37.8762 -34.9146 -34.9146 5.6885 5.6885 6.4579 6.4579 6.7445 6.7445 8.1688 8.1688 8.5969 8.5969 9.2437 9.2437 11.4318 11.4318 14.6175 14.6175 17.5029 17.5029 21.3801 21.3801 k = 0.0000 0.5000 0.2619 ( 3750 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8762 -37.8762 -34.9146 -34.9146 5.6875 5.6875 6.4621 6.4621 6.7373 6.7373 8.1694 8.1694 8.6554 8.6554 9.2444 9.2444 11.3781 11.3781 14.5420 14.5420 17.5106 17.5106 21.4579 21.4579 k = 0.0000 0.5000 0.2706 ( 3736 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8763 -37.8763 -34.9146 -34.9146 5.6866 5.6866 6.4659 6.4659 6.7307 6.7307 8.1700 8.1700 8.7121 8.7121 9.2458 9.2458 11.3244 11.3244 14.4743 14.4743 17.5179 17.5179 21.5308 21.5308 k = 0.0000 0.5000 0.2793 ( 3736 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8763 -37.8763 -34.9146 -34.9146 5.6858 5.6858 6.4693 6.4693 6.7246 6.7246 8.1705 8.1705 8.7661 8.7661 9.2480 9.2480 11.2715 11.2715 14.4142 14.4142 17.5246 17.5246 21.5980 21.5980 k = 0.0000 0.5000 0.2880 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8763 -37.8763 -34.9146 -34.9146 5.6850 5.6850 6.4724 6.4724 6.7192 6.7192 8.1710 8.1710 8.8164 8.8164 9.2510 9.2510 11.2205 11.2205 14.3616 14.3616 17.5308 17.5308 21.6589 21.6589 k = 0.0000 0.5000 0.2968 ( 3736 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8763 -37.8763 -34.9147 -34.9147 5.6844 5.6844 6.4750 6.4750 6.7144 6.7144 8.1714 8.1714 8.8621 8.8621 9.2550 9.2550 11.1724 11.1724 14.3164 14.3164 17.5363 17.5363 21.7129 21.7129 k = 0.0000 0.5000 0.3055 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4231 -42.4231 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6838 5.6838 6.4772 6.4772 6.7103 6.7103 8.1717 8.1717 8.9021 8.9021 9.2598 9.2598 11.1286 11.1286 14.2785 14.2785 17.5410 17.5410 21.7596 21.7596 k = 0.0000 0.5000 0.3142 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6834 5.6834 6.4791 6.4791 6.7069 6.7069 8.1720 8.1720 8.9355 8.9355 9.2653 9.2653 11.0902 11.0902 14.2477 14.2477 17.5450 17.5450 21.7985 21.7985 k = 0.0000 0.5000 0.3229 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6830 5.6830 6.4805 6.4805 6.7043 6.7043 8.1722 8.1722 8.9617 8.9617 9.2709 9.2709 11.0587 11.0587 14.2239 14.2239 17.5482 17.5482 21.8291 21.8291 k = 0.0000 0.5000 0.3317 ( 3736 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6828 5.6828 6.4815 6.4815 6.7024 6.7024 8.1724 8.1724 8.9804 8.9804 9.2758 9.2758 11.0352 11.0352 14.2069 14.2069 17.5504 17.5504 21.8512 21.8512 k = 0.0000 0.5000 0.3404 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6826 5.6826 6.4821 6.4821 6.7012 6.7012 8.1725 8.1725 8.9916 8.9916 9.2792 9.2792 11.0206 11.0206 14.1968 14.1968 17.5518 17.5518 21.8646 21.8646 k = 0.0000 0.5000 0.3491 ( 3740 PWs) bands (ev): -73.5908 -73.5908 -42.4232 -42.4232 -38.0331 -38.0331 -37.8764 -37.8764 -34.9147 -34.9147 5.6826 5.6826 6.4823 6.4823 6.7008 6.7008 8.1725 8.1725 8.9953 8.9953 9.2804 9.2804 11.0157 11.0157 14.1935 14.1935 17.5523 17.5523 21.8690 21.8690 k = 0.5000 0.5000-0.0000 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1910 3.1910 7.5487 7.5487 7.7589 7.7589 8.5685 8.5685 10.5092 10.5092 12.6278 12.6278 12.8525 12.8525 15.5522 15.5522 17.3134 17.3134 18.8042 18.8042 k = 0.5000 0.5000 0.0087 ( 3696 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1909 3.1909 7.5480 7.5480 7.7580 7.7580 8.5693 8.5693 10.5092 10.5092 12.6305 12.6305 12.8553 12.8553 15.5518 15.5518 17.3130 17.3130 18.8058 18.8058 k = 0.5000 0.5000 0.0175 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4625 -42.4625 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1905 3.1905 7.5457 7.5457 7.7554 7.7554 8.5717 8.5717 10.5092 10.5092 12.6384 12.6384 12.8636 12.8636 15.5507 15.5507 17.3119 17.3119 18.8107 18.8107 k = 0.5000 0.5000 0.0262 ( 3700 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1898 3.1898 7.5419 7.5419 7.7510 7.7510 8.5758 8.5758 10.5091 10.5091 12.6517 12.6517 12.8773 12.8773 15.5488 15.5488 17.3100 17.3100 18.8189 18.8189 k = 0.5000 0.5000 0.0349 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1888 3.1888 7.5366 7.5366 7.7449 7.7449 8.5814 8.5814 10.5091 10.5091 12.6702 12.6702 12.8966 12.8966 15.5462 15.5462 17.3074 17.3074 18.8302 18.8302 k = 0.5000 0.5000 0.0436 ( 3712 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9269 -37.9269 -34.8987 -34.8987 3.1876 3.1876 7.5299 7.5299 7.7372 7.7372 8.5886 8.5886 10.5090 10.5090 12.6939 12.6939 12.9212 12.9212 15.5429 15.5429 17.3040 17.3040 18.8447 18.8447 k = 0.5000 0.5000 0.0524 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9270 -37.9270 -34.8987 -34.8987 3.1862 3.1862 7.5218 7.5218 7.7279 7.7279 8.5973 8.5973 10.5090 10.5090 12.7226 12.7226 12.9511 12.9511 15.5390 15.5390 17.2999 17.2999 18.8621 18.8621 k = 0.5000 0.5000 0.0611 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9270 -37.9270 -34.8987 -34.8987 3.1845 3.1845 7.5124 7.5124 7.7172 7.7172 8.6076 8.6076 10.5089 10.5089 12.7563 12.7563 12.9862 12.9862 15.5345 15.5345 17.2950 17.2950 18.8825 18.8825 k = 0.5000 0.5000 0.0698 ( 3688 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9270 -37.9270 -34.8986 -34.8986 3.1825 3.1825 7.5018 7.5018 7.7051 7.7051 8.6194 8.6194 10.5088 10.5088 12.7949 12.7949 13.0263 13.0263 15.5294 15.5294 17.2893 17.2893 18.9057 18.9057 k = 0.5000 0.5000 0.0786 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9270 -37.9270 -34.8987 -34.8987 3.1804 3.1804 7.4901 7.4901 7.6917 7.6917 8.6327 8.6327 10.5088 10.5088 12.8382 12.8382 13.0714 13.0714 15.5237 15.5237 17.2829 17.2829 18.9316 18.9316 k = 0.5000 0.5000 0.0873 ( 3692 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9271 -37.9271 -34.8986 -34.8986 3.1780 3.1780 7.4772 7.4772 7.6772 7.6772 8.6475 8.6475 10.5087 10.5087 12.8862 12.8862 13.1213 13.1213 15.5177 15.5177 17.2757 17.2757 18.9599 18.9599 k = 0.5000 0.5000 0.0960 ( 3684 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9271 -37.9271 -34.8986 -34.8986 3.1755 3.1755 7.4635 7.4635 7.6617 7.6617 8.6636 8.6636 10.5086 10.5086 12.9385 12.9385 13.1758 13.1758 15.5112 15.5112 17.2677 17.2677 18.9907 18.9907 k = 0.5000 0.5000 0.1047 ( 3680 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9272 -37.9272 -34.8986 -34.8986 3.1727 3.1727 7.4489 7.4489 7.6453 7.6453 8.6810 8.6810 10.5085 10.5085 12.9952 12.9952 13.2348 13.2348 15.5044 15.5044 17.2589 17.2589 19.0235 19.0235 k = 0.5000 0.5000 0.1135 ( 3676 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9272 -37.9272 -34.8986 -34.8986 3.1698 3.1698 7.4335 7.4335 7.6282 7.6282 8.6997 8.6997 10.5084 10.5084 13.0559 13.0559 13.2981 13.2981 15.4973 15.4973 17.2493 17.2493 19.0584 19.0584 k = 0.5000 0.5000 0.1222 ( 3692 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0872 -38.0872 -37.9272 -37.9272 -34.8986 -34.8986 3.1668 3.1668 7.4176 7.4176 7.6104 7.6104 8.7195 8.7195 10.5083 10.5083 13.1206 13.1206 13.3656 13.3656 15.4899 15.4899 17.2390 17.2390 19.0950 19.0950 k = 0.5000 0.5000 0.1309 ( 3688 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0871 -38.0871 -37.9273 -37.9273 -34.8986 -34.8986 3.1637 3.1637 7.4011 7.4011 7.5922 7.5922 8.7404 8.7404 10.5082 10.5082 13.1890 13.1890 13.4370 13.4370 15.4824 15.4824 17.2279 17.2279 19.1331 19.1331 k = 0.5000 0.5000 0.1397 ( 3688 PWs) bands (ev): -73.5758 -73.5758 -42.4626 -42.4626 -38.0871 -38.0871 -37.9273 -37.9273 -34.8985 -34.8985 3.1604 3.1604 7.3843 7.3843 7.5736 7.5736 8.7622 8.7622 10.5081 10.5081 13.2610 13.2610 13.5122 13.5122 15.4748 15.4748 17.2160 17.2160 19.1726 19.1726 k = 0.5000 0.5000 0.1484 ( 3696 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0871 -38.0871 -37.9274 -37.9274 -34.8985 -34.8985 3.1571 3.1571 7.3672 7.3672 7.5547 7.5547 8.7849 8.7849 10.5081 10.5081 13.3364 13.3364 13.5909 13.5909 15.4671 15.4671 17.2035 17.2035 19.2132 19.2132 k = 0.5000 0.5000 0.1571 ( 3696 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0871 -38.0871 -37.9274 -37.9274 -34.8985 -34.8985 3.1537 3.1537 7.3499 7.3499 7.5358 7.5358 8.8083 8.8083 10.5080 10.5080 13.4150 13.4150 13.6731 13.6731 15.4594 15.4594 17.1902 17.1902 19.2547 19.2547 k = 0.5000 0.5000 0.1658 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0871 -38.0871 -37.9275 -37.9275 -34.8985 -34.8985 3.1502 3.1502 7.3326 7.3326 7.5169 7.5169 8.8323 8.8323 10.5079 10.5079 13.4965 13.4965 13.7585 13.7585 15.4517 15.4517 17.1763 17.1763 19.2968 19.2968 k = 0.5000 0.5000 0.1746 ( 3704 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0871 -38.0871 -37.9275 -37.9275 -34.8985 -34.8985 3.1468 3.1468 7.3154 7.3154 7.4981 7.4981 8.8567 8.8567 10.5078 10.5078 13.5807 13.5807 13.8470 13.8470 15.4442 15.4442 17.1618 17.1618 19.3392 19.3392 k = 0.5000 0.5000 0.1833 ( 3712 PWs) bands (ev): -73.5758 -73.5758 -42.4627 -42.4627 -38.0871 -38.0871 -37.9276 -37.9276 -34.8985 -34.8985 3.1434 3.1434 7.2984 7.2984 7.4795 7.4795 8.8814 8.8814 10.5078 10.5078 13.6674 13.6674 13.9382 13.9382 15.4367 15.4367 17.1468 17.1468 19.2119 19.2119 k = 0.5000 0.5000 0.1920 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4627 -42.4627 -38.0871 -38.0871 -37.9276 -37.9276 -34.8985 -34.8985 3.1399 3.1399 7.2816 7.2816 7.4613 7.4613 8.9063 8.9063 10.5077 10.5077 13.7564 13.7564 14.0320 14.0320 15.4295 15.4295 17.1314 17.1314 19.0749 19.0749 k = 0.5000 0.5000 0.2008 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4627 -42.4627 -38.0871 -38.0871 -37.9277 -37.9277 -34.8985 -34.8985 3.1366 3.1366 7.2652 7.2652 7.4435 7.4435 8.9312 8.9312 10.5076 10.5076 13.8474 13.8474 14.1281 14.1281 15.4225 15.4225 17.1156 17.1156 18.9379 18.9379 k = 0.5000 0.5000 0.2095 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4627 -42.4627 -38.0871 -38.0871 -37.9277 -37.9277 -34.8984 -34.8984 3.1333 3.1333 7.2493 7.2493 7.4263 7.4263 8.9559 8.9559 10.5076 10.5076 13.9401 13.9401 14.2264 14.2264 15.4157 15.4157 17.0995 17.0995 18.8015 18.8015 k = 0.5000 0.5000 0.2182 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4627 -42.4627 -38.0871 -38.0871 -37.9278 -37.9278 -34.8984 -34.8984 3.1300 3.1300 7.2339 7.2339 7.4097 7.4097 8.9803 8.9803 10.5076 10.5076 14.0341 14.0341 14.3264 14.3264 15.4092 15.4092 17.0834 17.0834 18.6659 18.6659 k = 0.5000 0.5000 0.2269 ( 3704 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0871 -38.0871 -37.9278 -37.9278 -34.8984 -34.8984 3.1269 3.1269 7.2192 7.2192 7.3938 7.3938 9.0042 9.0042 10.5075 10.5075 14.1292 14.1292 14.4280 14.4280 15.4030 15.4030 17.0673 17.0673 18.5317 18.5317 k = 0.5000 0.5000 0.2357 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0871 -38.0871 -37.9279 -37.9279 -34.8984 -34.8984 3.1239 3.1239 7.2052 7.2052 7.3787 7.3787 9.0274 9.0274 10.5075 10.5075 14.2249 14.2249 14.5307 14.5307 15.3971 15.3971 17.0514 17.0514 18.3992 18.3992 k = 0.5000 0.5000 0.2444 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9279 -37.9279 -34.8984 -34.8984 3.1211 3.1211 7.1919 7.1919 7.3645 7.3645 9.0497 9.0497 10.5074 10.5074 14.3206 14.3206 14.6342 14.6342 15.3916 15.3916 17.0359 17.0359 18.2690 18.2690 k = 0.5000 0.5000 0.2531 ( 3704 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9279 -37.9279 -34.8984 -34.8984 3.1184 3.1184 7.1795 7.1795 7.3511 7.3511 9.0710 9.0710 10.5074 10.5074 14.4159 14.4159 14.7378 14.7378 15.3865 15.3865 17.0210 17.0210 18.1417 18.1417 k = 0.5000 0.5000 0.2619 ( 3712 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9280 -37.9280 -34.8984 -34.8984 3.1159 3.1159 7.1680 7.1680 7.3387 7.3387 9.0911 9.0911 10.5074 10.5074 14.5101 14.5101 14.8411 14.8411 15.3819 15.3819 17.0069 17.0069 18.0179 18.0179 k = 0.5000 0.5000 0.2706 ( 3720 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9280 -37.9280 -34.8984 -34.8984 3.1136 3.1136 7.1574 7.1574 7.3274 7.3274 9.1099 9.1099 10.5073 10.5073 14.6024 14.6024 14.9433 14.9433 15.3777 15.3777 16.9939 16.9939 17.8983 17.8983 k = 0.5000 0.5000 0.2793 ( 3736 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9280 -37.9280 -34.8984 -34.8984 3.1115 3.1115 7.1478 7.1478 7.3171 7.3171 9.1271 9.1271 10.5073 10.5073 14.6917 14.6917 15.0433 15.0433 15.3740 15.3740 16.9821 16.9821 17.7839 17.7839 k = 0.5000 0.5000 0.2880 ( 3736 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9281 -37.9281 -34.8984 -34.8984 3.1096 3.1096 7.1392 7.1392 7.3079 7.3079 9.1427 9.1427 10.5073 10.5073 14.7770 14.7770 15.1399 15.1399 15.3710 15.3710 16.9719 16.9719 17.6759 17.6759 k = 0.5000 0.5000 0.2968 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9281 -37.9281 -34.8983 -34.8983 3.1079 3.1079 7.1317 7.1317 7.2999 7.2999 9.1565 9.1565 10.5073 10.5073 14.8568 14.8568 15.2311 15.2311 15.3691 15.3691 16.9636 16.9636 17.5754 17.5754 k = 0.5000 0.5000 0.3055 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9281 -37.9281 -34.8983 -34.8983 3.1065 3.1065 7.1253 7.1253 7.2931 7.2931 9.1684 9.1684 10.5073 10.5073 14.9295 14.9295 15.3121 15.3121 15.3712 15.3712 16.9573 16.9573 17.4842 17.4842 k = 0.5000 0.5000 0.3142 ( 3736 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9281 -37.9281 -34.8983 -34.8983 3.1053 3.1053 7.1201 7.1201 7.2875 7.2875 9.1783 9.1783 10.5073 10.5073 14.9932 14.9932 15.3525 15.3525 15.4054 15.4054 16.9533 16.9533 17.4041 17.4041 k = 0.5000 0.5000 0.3229 ( 3736 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9281 -37.9281 -34.8983 -34.8983 3.1044 3.1044 7.1159 7.1159 7.2831 7.2831 9.1861 9.1861 10.5073 10.5073 15.0457 15.0457 15.3560 15.3560 15.4650 15.4650 16.9514 16.9514 17.3372 17.3372 k = 0.5000 0.5000 0.3317 ( 3736 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9282 -37.9282 -34.8983 -34.8983 3.1037 3.1037 7.1130 7.1130 7.2799 7.2799 9.1917 9.1917 10.5073 10.5073 15.0852 15.0852 15.3560 15.3560 15.5134 15.5134 16.9513 16.9513 17.2863 17.2863 k = 0.5000 0.5000 0.3404 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9282 -37.9282 -34.8983 -34.8983 3.1033 3.1033 7.1112 7.1112 7.2780 7.2780 9.1951 9.1951 10.5073 10.5073 15.1097 15.1097 15.3557 15.3557 15.5443 15.5443 16.9520 16.9520 17.2541 17.2541 k = 0.5000 0.5000 0.3491 ( 3728 PWs) bands (ev): -73.5757 -73.5757 -42.4628 -42.4628 -38.0870 -38.0870 -37.9282 -37.9282 -34.8983 -34.8983 3.1032 3.1032 7.1106 7.1106 7.2774 7.2774 9.1962 9.1962 10.5073 10.5073 15.1180 15.1180 15.3556 15.3556 15.5550 15.5550 16.9524 16.9524 17.2430 17.2430 Writing output data file LiHPd.save init_run : 0.16s CPU 0.32s WALL ( 1 calls) electrons : 76.90s CPU 78.79s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.01s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 76.90s CPU 78.78s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.04s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.06s WALL ( 517 calls) cegterg : 67.72s CPU 69.05s WALL ( 551 calls) Called by sum_band: Called by *egterg: h_psi : 43.78s CPU 44.72s WALL ( 7779 calls) s_psi : 0.98s CPU 1.07s WALL ( 7779 calls) g_psi : 0.18s CPU 0.15s WALL ( 6711 calls) cdiaghg : 22.01s CPU 22.47s WALL ( 7228 calls) cegterg:over : 2.41s CPU 2.49s WALL ( 6711 calls) cegterg:upda : 1.82s CPU 1.85s WALL ( 6711 calls) cegterg:last : 1.28s CPU 1.30s WALL ( 1585 calls) cdiaghg:chol : 1.13s CPU 1.20s WALL ( 7228 calls) cdiaghg:inve : 0.54s CPU 0.49s WALL ( 7228 calls) cdiaghg:para : 1.36s CPU 1.37s WALL ( 14456 calls) Called by h_psi: h_psi:vloc : 41.28s CPU 42.08s WALL ( 7779 calls) h_psi:vnl : 2.41s CPU 2.57s WALL ( 7779 calls) add_vuspsi : 1.32s CPU 1.33s WALL ( 7779 calls) General routines calbec : 1.05s CPU 1.22s WALL ( 7779 calls) fft : 0.01s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 39.10s CPU 39.85s WALL ( 568576 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.20s CPU 0.29s WALL ( 1034 calls) Parallel routines fft_scatter : 15.74s CPU 16.18s WALL ( 568599 calls) PWSCF : 1m31.20s CPU 1m45.19s WALL This run was terminated on: 19:55:43 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=