Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 18: 6:22 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: ./MnGaFe2.save/ file Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D renormalized file Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF: wavefunction(s) 3D 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 33 9 871 871 137 Max 34 34 10 876 876 142 Sum 1201 1201 357 31463 31463 5041 bravais-lattice index = 14 lattice parameter (alat) = 6.8862 a.u. unit-cell volume = 326.5364 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 3 number of electrons = 44.00 number of Kohn-Sham states= 52 kinetic-energy cutoff = 80.0000 Ry charge density cutoff = 320.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 6.886162 celldm(2)= 1.000000 celldm(3)= 1.000000 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 1.000000 ) 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 1.000000 ) PseudoPot. # 1 for Mn read from file: /users/gautes/Pseudo/Mn.rel-pbe-oncvpsp.UPF MD5 check sum: d838f0974ec4eb0180564ac5264e0bcc Pseudo is Norm-conserving, Zval = 15.0 Generated using ONCVPSP code by D. R. Hamann Using radial grid of 1464 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 PseudoPot. # 2 for Fe read from file: /users/gautes/Pseudo/Fe.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 1f786298b0c3f78d6037ec413201e537 Pseudo is Ultrasoft + core correction, Zval = 8.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1191 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Ga read from file: /users/gautes/Pseudo/Ga.rel-pbe-dnl-rrkjus_psl.1.0.0.UPF MD5 check sum: a45069c11dc40ba088a6a50723da268c Pseudo is Ultrasoft + core correction, Zval = 13.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1205 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 Mn 15.00 54.93800 Mn( 1.00) Fe 8.00 55.84500 Fe( 1.00) Ga 13.00 69.72300 Ga( 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 [0,1,1] cryst. s( 5) = ( -1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s( 5) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 6 180 deg rotation - cart. axis [0,1,-1] cryst. s( 6) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s( 6) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 7 90 deg rotation - cart. axis [-1,0,0] cryst. s( 7) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s( 7) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 8 90 deg rotation - cart. axis [1,0,0] cryst. s( 8) = ( 1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s( 8) = ( 1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 9 inversion cryst. s( 9) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 9) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 10 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s(10) = ( 1 0 0 ) ( 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 [0,1,1] cryst. s(13) = ( 1 0 0 ) ( 0 0 -1 ) ( 0 -1 0 ) cart. s(13) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 -0.0000000 -1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) isym = 14 inv. 180 deg rotation - cart. axis [0,1,-1] cryst. s(14) = ( 1 0 0 ) ( 0 0 1 ) ( 0 1 0 ) cart. s(14) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 15 inv. 90 deg rotation - cart. axis [-1,0,0] cryst. s(15) = ( -1 0 0 ) ( 0 0 1 ) ( 0 -1 0 ) cart. s(15) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) isym = 16 inv. 90 deg rotation - cart. axis [1,0,0] cryst. s(16) = ( -1 0 0 ) ( 0 0 -1 ) ( 0 1 0 ) cart. s(16) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -0.0000000 1.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) double point group D_4h(4/mmm) there are 14 classes and 4 irreducible representations the character table: E -E 2C4 -2C4 C2 2C2' 2C2'' i -i 2S4 -2S4 s_h -C2 -2C2' -2C2' -s_h G_6+ 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 2.00 -2.00 1.41 -1.41 0.00 G_7+ 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 2.00 -2.00 -1.41 1.41 0.00 G_6- 2.00 -2.00 1.41 -1.41 0.00 0.00 0.00 -2.00 2.00 -1.41 1.41 0.00 G_7- 2.00 -2.00 -1.41 1.41 0.00 0.00 0.00 -2.00 2.00 1.41 -1.41 0.00 2s_v 2s_d -2s_v -2s_d G_6+ 0.00 0.00 G_7+ 0.00 0.00 G_6- 0.00 0.00 G_7- 0.00 0.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E 2C4 7 8 90 deg rotation - cart. axis [-1,0,0] -2C4 -7 -8 90 deg rotation - cart. axis [-1,0,0] E C2 -C2 4 -4 180 deg rotation - cart. axis [1,0,0] 2C2'-2C2' 2 -2 3 -3 180 deg rotation - cart. axis [0,0,1] 2C2''-2C2' 5 6 -6 -5 180 deg rotation - cart. axis [0,1,1] i 9 inversion -i -9 inversion E 2S4 15 16 inv. 90 deg rotation - cart. axis [-1,0,0] -2S4 -15 -16 inv. 90 deg rotation - cart. axis [-1,0,0] E s_h -s_h 12 -12 inv. 180 deg rotation - cart. axis [1,0,0] 2s_v-2s_v 10 -10 11 -11 inv. 180 deg rotation - cart. axis [0,0,1] 2s_d-2s_d 13 14 -14 -13 inv. 180 deg rotation - cart. axis [0,1,1] Cartesian axes number of k points= 439 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 2) = ( 0.0000000 0.0113636 -0.0000000), wk = 0.0022779 k( 3) = ( 0.0000000 0.0227273 -0.0000000), wk = 0.0022779 k( 4) = ( 0.0000000 0.0340909 -0.0000000), wk = 0.0022779 k( 5) = ( 0.0000000 0.0454546 -0.0000000), wk = 0.0022779 k( 6) = ( 0.0000000 0.0568182 -0.0000000), wk = 0.0022779 k( 7) = ( 0.0000000 0.0681818 -0.0000000), wk = 0.0022779 k( 8) = ( 0.0000000 0.0795455 -0.0000000), wk = 0.0022779 k( 9) = ( 0.0000000 0.0909091 -0.0000000), wk = 0.0022779 k( 10) = ( 0.0000000 0.1022727 -0.0000000), wk = 0.0022779 k( 11) = ( 0.0000000 0.1136364 -0.0000000), wk = 0.0022779 k( 12) = ( 0.0000000 0.1250000 -0.0000000), wk = 0.0022779 k( 13) = ( 0.0000000 0.1363636 -0.0000000), wk = 0.0022779 k( 14) = ( 0.0000000 0.1477273 -0.0000000), wk = 0.0022779 k( 15) = ( 0.0000000 0.1590909 -0.0000000), wk = 0.0022779 k( 16) = ( 0.0000000 0.1704546 -0.0000000), wk = 0.0022779 k( 17) = ( 0.0000000 0.1818182 -0.0000000), wk = 0.0022779 k( 18) = ( 0.0000000 0.1931818 -0.0000000), wk = 0.0022779 k( 19) = ( 0.0000000 0.2045454 -0.0000000), wk = 0.0022779 k( 20) = ( 0.0000000 0.2159091 -0.0000000), wk = 0.0022779 k( 21) = ( 0.0000000 0.2272727 -0.0000000), wk = 0.0022779 k( 22) = ( 0.0000000 0.2386364 -0.0000000), wk = 0.0022779 k( 23) = ( 0.0000000 0.2500000 -0.0000000), wk = 0.0022779 k( 24) = ( 0.0000000 0.2613636 -0.0000000), wk = 0.0022779 k( 25) = ( 0.0000000 0.2727273 -0.0000000), wk = 0.0022779 k( 26) = ( 0.0000000 0.2840909 -0.0000000), wk = 0.0022779 k( 27) = ( 0.0000000 0.2954545 -0.0000000), wk = 0.0022779 k( 28) = ( 0.0000000 0.3068182 -0.0000000), wk = 0.0022779 k( 29) = ( 0.0000000 0.3181818 -0.0000000), wk = 0.0022779 k( 30) = ( 0.0000000 0.3295455 -0.0000000), wk = 0.0022779 k( 31) = ( 0.0000000 0.3409091 -0.0000000), wk = 0.0022779 k( 32) = ( 0.0000000 0.3522727 -0.0000000), wk = 0.0022779 k( 33) = ( 0.0000000 0.3636364 -0.0000000), wk = 0.0022779 k( 34) = ( 0.0000000 0.3750000 -0.0000000), wk = 0.0022779 k( 35) = ( 0.0000000 0.3863636 -0.0000000), wk = 0.0022779 k( 36) = ( 0.0000000 0.3977273 -0.0000000), wk = 0.0022779 k( 37) = ( 0.0000000 0.4090909 -0.0000000), wk = 0.0022779 k( 38) = ( 0.0000000 0.4204545 -0.0000000), wk = 0.0022779 k( 39) = ( 0.0000000 0.4318182 -0.0000000), wk = 0.0022779 k( 40) = ( 0.0000000 0.4431818 -0.0000000), wk = 0.0022779 k( 41) = ( 0.0000000 0.4545455 -0.0000000), wk = 0.0022779 k( 42) = ( 0.0000000 0.4659091 -0.0000000), wk = 0.0022779 k( 43) = ( 0.0000000 0.4772727 -0.0000000), wk = 0.0022779 k( 44) = ( 0.0000000 0.4886364 -0.0000000), wk = 0.0022779 k( 45) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0022779 k( 46) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0022779 k( 47) = ( 0.0113636 0.5000000 -0.0000000), wk = 0.0022779 k( 48) = ( 0.0227273 0.5000000 -0.0000000), wk = 0.0022779 k( 49) = ( 0.0340909 0.5000000 -0.0000000), wk = 0.0022779 k( 50) = ( 0.0454546 0.5000000 -0.0000000), wk = 0.0022779 k( 51) = ( 0.0568182 0.5000000 -0.0000000), wk = 0.0022779 k( 52) = ( 0.0681818 0.5000000 -0.0000000), wk = 0.0022779 k( 53) = ( 0.0795455 0.5000000 -0.0000000), wk = 0.0022779 k( 54) = ( 0.0909091 0.5000000 -0.0000000), wk = 0.0022779 k( 55) = ( 0.1022727 0.5000000 -0.0000000), wk = 0.0022779 k( 56) = ( 0.1136364 0.5000000 -0.0000000), wk = 0.0022779 k( 57) = ( 0.1250000 0.5000000 -0.0000000), wk = 0.0022779 k( 58) = ( 0.1363636 0.5000000 -0.0000000), wk = 0.0022779 k( 59) = ( 0.1477273 0.5000000 -0.0000000), wk = 0.0022779 k( 60) = ( 0.1590909 0.5000000 -0.0000000), wk = 0.0022779 k( 61) = ( 0.1704546 0.5000000 -0.0000000), wk = 0.0022779 k( 62) = ( 0.1818182 0.5000000 -0.0000000), wk = 0.0022779 k( 63) = ( 0.1931818 0.5000000 -0.0000000), wk = 0.0022779 k( 64) = ( 0.2045454 0.5000000 -0.0000000), wk = 0.0022779 k( 65) = ( 0.2159091 0.5000000 -0.0000000), wk = 0.0022779 k( 66) = ( 0.2272727 0.5000000 -0.0000000), wk = 0.0022779 k( 67) = ( 0.2386364 0.5000000 -0.0000000), wk = 0.0022779 k( 68) = ( 0.2500000 0.5000000 -0.0000000), wk = 0.0022779 k( 69) = ( 0.2613636 0.5000000 -0.0000000), wk = 0.0022779 k( 70) = ( 0.2727273 0.5000000 -0.0000000), wk = 0.0022779 k( 71) = ( 0.2840909 0.5000000 -0.0000000), wk = 0.0022779 k( 72) = ( 0.2954545 0.5000000 -0.0000000), wk = 0.0022779 k( 73) = ( 0.3068182 0.5000000 -0.0000000), wk = 0.0022779 k( 74) = ( 0.3181818 0.5000000 -0.0000000), wk = 0.0022779 k( 75) = ( 0.3295455 0.5000000 -0.0000000), wk = 0.0022779 k( 76) = ( 0.3409091 0.5000000 -0.0000000), wk = 0.0022779 k( 77) = ( 0.3522727 0.5000000 -0.0000000), wk = 0.0022779 k( 78) = ( 0.3636364 0.5000000 -0.0000000), wk = 0.0022779 k( 79) = ( 0.3750000 0.5000000 -0.0000000), wk = 0.0022779 k( 80) = ( 0.3863636 0.5000000 -0.0000000), wk = 0.0022779 k( 81) = ( 0.3977273 0.5000000 -0.0000000), wk = 0.0022779 k( 82) = ( 0.4090909 0.5000000 -0.0000000), wk = 0.0022779 k( 83) = ( 0.4204545 0.5000000 -0.0000000), wk = 0.0022779 k( 84) = ( 0.4318182 0.5000000 -0.0000000), wk = 0.0022779 k( 85) = ( 0.4431818 0.5000000 -0.0000000), wk = 0.0022779 k( 86) = ( 0.4545455 0.5000000 -0.0000000), wk = 0.0022779 k( 87) = ( 0.4659091 0.5000000 -0.0000000), wk = 0.0022779 k( 88) = ( 0.4772727 0.5000000 -0.0000000), wk = 0.0022779 k( 89) = ( 0.4886364 0.5000000 -0.0000000), wk = 0.0022779 k( 90) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0022779 k( 91) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0022779 k( 92) = ( 0.4918033 0.4918033 -0.0000000), wk = 0.0022779 k( 93) = ( 0.4836066 0.4836066 -0.0000000), wk = 0.0022779 k( 94) = ( 0.4754098 0.4754098 -0.0000000), wk = 0.0022779 k( 95) = ( 0.4672131 0.4672131 -0.0000000), wk = 0.0022779 k( 96) = ( 0.4590164 0.4590164 -0.0000000), wk = 0.0022779 k( 97) = ( 0.4508197 0.4508197 -0.0000000), wk = 0.0022779 k( 98) = ( 0.4426230 0.4426229 -0.0000000), wk = 0.0022779 k( 99) = ( 0.4344262 0.4344262 -0.0000000), wk = 0.0022779 k( 100) = ( 0.4262295 0.4262295 -0.0000000), wk = 0.0022779 k( 101) = ( 0.4180328 0.4180328 -0.0000000), wk = 0.0022779 k( 102) = ( 0.4098361 0.4098361 -0.0000000), wk = 0.0022779 k( 103) = ( 0.4016393 0.4016393 -0.0000000), wk = 0.0022779 k( 104) = ( 0.3934426 0.3934426 -0.0000000), wk = 0.0022779 k( 105) = ( 0.3852459 0.3852459 -0.0000000), wk = 0.0022779 k( 106) = ( 0.3770492 0.3770492 -0.0000000), wk = 0.0022779 k( 107) = ( 0.3688525 0.3688525 -0.0000000), wk = 0.0022779 k( 108) = ( 0.3606557 0.3606557 -0.0000000), wk = 0.0022779 k( 109) = ( 0.3524590 0.3524590 -0.0000000), wk = 0.0022779 k( 110) = ( 0.3442623 0.3442623 -0.0000000), wk = 0.0022779 k( 111) = ( 0.3360656 0.3360656 -0.0000000), wk = 0.0022779 k( 112) = ( 0.3278688 0.3278688 -0.0000000), wk = 0.0022779 k( 113) = ( 0.3196721 0.3196721 -0.0000000), wk = 0.0022779 k( 114) = ( 0.3114754 0.3114754 -0.0000000), wk = 0.0022779 k( 115) = ( 0.3032787 0.3032787 -0.0000000), wk = 0.0022779 k( 116) = ( 0.2950820 0.2950820 -0.0000000), wk = 0.0022779 k( 117) = ( 0.2868852 0.2868852 -0.0000000), wk = 0.0022779 k( 118) = ( 0.2786885 0.2786885 -0.0000000), wk = 0.0022779 k( 119) = ( 0.2704918 0.2704918 -0.0000000), wk = 0.0022779 k( 120) = ( 0.2622951 0.2622951 -0.0000000), wk = 0.0022779 k( 121) = ( 0.2540984 0.2540984 -0.0000000), wk = 0.0022779 k( 122) = ( 0.2459016 0.2459016 -0.0000000), wk = 0.0022779 k( 123) = ( 0.2377049 0.2377049 -0.0000000), wk = 0.0022779 k( 124) = ( 0.2295082 0.2295082 -0.0000000), wk = 0.0022779 k( 125) = ( 0.2213115 0.2213115 -0.0000000), wk = 0.0022779 k( 126) = ( 0.2131147 0.2131147 -0.0000000), wk = 0.0022779 k( 127) = ( 0.2049180 0.2049180 -0.0000000), wk = 0.0022779 k( 128) = ( 0.1967213 0.1967213 -0.0000000), wk = 0.0022779 k( 129) = ( 0.1885246 0.1885246 -0.0000000), wk = 0.0022779 k( 130) = ( 0.1803279 0.1803279 -0.0000000), wk = 0.0022779 k( 131) = ( 0.1721312 0.1721311 -0.0000000), wk = 0.0022779 k( 132) = ( 0.1639344 0.1639344 -0.0000000), wk = 0.0022779 k( 133) = ( 0.1557377 0.1557377 -0.0000000), wk = 0.0022779 k( 134) = ( 0.1475410 0.1475410 -0.0000000), wk = 0.0022779 k( 135) = ( 0.1393443 0.1393443 -0.0000000), wk = 0.0022779 k( 136) = ( 0.1311475 0.1311475 -0.0000000), wk = 0.0022779 k( 137) = ( 0.1229508 0.1229508 -0.0000000), wk = 0.0022779 k( 138) = ( 0.1147541 0.1147541 -0.0000000), wk = 0.0022779 k( 139) = ( 0.1065574 0.1065574 -0.0000000), wk = 0.0022779 k( 140) = ( 0.0983607 0.0983607 -0.0000000), wk = 0.0022779 k( 141) = ( 0.0901639 0.0901639 -0.0000000), wk = 0.0022779 k( 142) = ( 0.0819672 0.0819672 -0.0000000), wk = 0.0022779 k( 143) = ( 0.0737705 0.0737705 -0.0000000), wk = 0.0022779 k( 144) = ( 0.0655738 0.0655738 -0.0000000), wk = 0.0022779 k( 145) = ( 0.0573770 0.0573770 -0.0000000), wk = 0.0022779 k( 146) = ( 0.0491803 0.0491803 -0.0000000), wk = 0.0022779 k( 147) = ( 0.0409836 0.0409836 -0.0000000), wk = 0.0022779 k( 148) = ( 0.0327869 0.0327869 -0.0000000), wk = 0.0022779 k( 149) = ( 0.0245902 0.0245902 -0.0000000), wk = 0.0022779 k( 150) = ( 0.0163934 0.0163934 -0.0000000), wk = 0.0022779 k( 151) = ( 0.0081967 0.0081967 -0.0000000), wk = 0.0022779 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 154) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0022779 k( 155) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0022779 k( 156) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0022779 k( 157) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0022779 k( 158) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0022779 k( 159) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0022779 k( 160) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0022779 k( 161) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0022779 k( 162) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0022779 k( 163) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0022779 k( 164) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0022779 k( 165) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0022779 k( 166) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0022779 k( 167) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0022779 k( 168) = ( 0.0000000 0.0000000 0.1704546), wk = 0.0022779 k( 169) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0022779 k( 170) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0022779 k( 171) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0022779 k( 172) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0022779 k( 173) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0022779 k( 174) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0022779 k( 175) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0022779 k( 176) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0022779 k( 177) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0022779 k( 178) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0022779 k( 179) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0022779 k( 180) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0022779 k( 181) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0022779 k( 182) = ( 0.0000000 0.0000000 0.3295455), wk = 0.0022779 k( 183) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0022779 k( 184) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0022779 k( 185) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0022779 k( 186) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0022779 k( 187) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0022779 k( 188) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0022779 k( 189) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0022779 k( 190) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0022779 k( 191) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0022779 k( 192) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0022779 k( 193) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0022779 k( 194) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0022779 k( 195) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0022779 k( 196) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0022779 k( 197) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 198) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 199) = ( 0.0000000 0.0113636 0.5000000), wk = 0.0022779 k( 200) = ( 0.0000000 0.0227273 0.5000000), wk = 0.0022779 k( 201) = ( 0.0000000 0.0340909 0.5000000), wk = 0.0022779 k( 202) = ( 0.0000000 0.0454546 0.5000000), wk = 0.0022779 k( 203) = ( 0.0000000 0.0568182 0.5000000), wk = 0.0022779 k( 204) = ( 0.0000000 0.0681818 0.5000000), wk = 0.0022779 k( 205) = ( 0.0000000 0.0795455 0.5000000), wk = 0.0022779 k( 206) = ( 0.0000000 0.0909091 0.5000000), wk = 0.0022779 k( 207) = ( 0.0000000 0.1022727 0.5000000), wk = 0.0022779 k( 208) = ( 0.0000000 0.1136364 0.5000000), wk = 0.0022779 k( 209) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0022779 k( 210) = ( 0.0000000 0.1363636 0.5000000), wk = 0.0022779 k( 211) = ( 0.0000000 0.1477273 0.5000000), wk = 0.0022779 k( 212) = ( 0.0000000 0.1590909 0.5000000), wk = 0.0022779 k( 213) = ( 0.0000000 0.1704546 0.5000000), wk = 0.0022779 k( 214) = ( 0.0000000 0.1818182 0.5000000), wk = 0.0022779 k( 215) = ( 0.0000000 0.1931818 0.5000000), wk = 0.0022779 k( 216) = ( 0.0000000 0.2045454 0.5000000), wk = 0.0022779 k( 217) = ( 0.0000000 0.2159091 0.5000000), wk = 0.0022779 k( 218) = ( 0.0000000 0.2272727 0.5000000), wk = 0.0022779 k( 219) = ( 0.0000000 0.2386364 0.5000000), wk = 0.0022779 k( 220) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0022779 k( 221) = ( 0.0000000 0.2613636 0.5000000), wk = 0.0022779 k( 222) = ( 0.0000000 0.2727273 0.5000000), wk = 0.0022779 k( 223) = ( 0.0000000 0.2840909 0.5000000), wk = 0.0022779 k( 224) = ( 0.0000000 0.2954545 0.5000000), wk = 0.0022779 k( 225) = ( 0.0000000 0.3068182 0.5000000), wk = 0.0022779 k( 226) = ( 0.0000000 0.3181818 0.5000000), wk = 0.0022779 k( 227) = ( 0.0000000 0.3295455 0.5000000), wk = 0.0022779 k( 228) = ( 0.0000000 0.3409091 0.5000000), wk = 0.0022779 k( 229) = ( 0.0000000 0.3522727 0.5000000), wk = 0.0022779 k( 230) = ( 0.0000000 0.3636364 0.5000000), wk = 0.0022779 k( 231) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0022779 k( 232) = ( 0.0000000 0.3863636 0.5000000), wk = 0.0022779 k( 233) = ( 0.0000000 0.3977273 0.5000000), wk = 0.0022779 k( 234) = ( 0.0000000 0.4090909 0.5000000), wk = 0.0022779 k( 235) = ( 0.0000000 0.4204545 0.5000000), wk = 0.0022779 k( 236) = ( 0.0000000 0.4318182 0.5000000), wk = 0.0022779 k( 237) = ( 0.0000000 0.4431818 0.5000000), wk = 0.0022779 k( 238) = ( 0.0000000 0.4545455 0.5000000), wk = 0.0022779 k( 239) = ( 0.0000000 0.4659091 0.5000000), wk = 0.0022779 k( 240) = ( 0.0000000 0.4772727 0.5000000), wk = 0.0022779 k( 241) = ( 0.0000000 0.4886364 0.5000000), wk = 0.0022779 k( 242) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 243) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 244) = ( 0.0113636 0.5000000 0.5000000), wk = 0.0022779 k( 245) = ( 0.0227273 0.5000000 0.5000000), wk = 0.0022779 k( 246) = ( 0.0340909 0.5000000 0.5000000), wk = 0.0022779 k( 247) = ( 0.0454546 0.5000000 0.5000000), wk = 0.0022779 k( 248) = ( 0.0568182 0.5000000 0.5000000), wk = 0.0022779 k( 249) = ( 0.0681818 0.5000000 0.5000000), wk = 0.0022779 k( 250) = ( 0.0795455 0.5000000 0.5000000), wk = 0.0022779 k( 251) = ( 0.0909091 0.5000000 0.5000000), wk = 0.0022779 k( 252) = ( 0.1022727 0.5000000 0.5000000), wk = 0.0022779 k( 253) = ( 0.1136364 0.5000000 0.5000000), wk = 0.0022779 k( 254) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0022779 k( 255) = ( 0.1363636 0.5000000 0.5000000), wk = 0.0022779 k( 256) = ( 0.1477273 0.5000000 0.5000000), wk = 0.0022779 k( 257) = ( 0.1590909 0.5000000 0.5000000), wk = 0.0022779 k( 258) = ( 0.1704546 0.5000000 0.5000000), wk = 0.0022779 k( 259) = ( 0.1818182 0.5000000 0.5000000), wk = 0.0022779 k( 260) = ( 0.1931818 0.5000000 0.5000000), wk = 0.0022779 k( 261) = ( 0.2045454 0.5000000 0.5000000), wk = 0.0022779 k( 262) = ( 0.2159091 0.5000000 0.5000000), wk = 0.0022779 k( 263) = ( 0.2272727 0.5000000 0.5000000), wk = 0.0022779 k( 264) = ( 0.2386364 0.5000000 0.5000000), wk = 0.0022779 k( 265) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0022779 k( 266) = ( 0.2613636 0.5000000 0.5000000), wk = 0.0022779 k( 267) = ( 0.2727273 0.5000000 0.5000000), wk = 0.0022779 k( 268) = ( 0.2840909 0.5000000 0.5000000), wk = 0.0022779 k( 269) = ( 0.2954545 0.5000000 0.5000000), wk = 0.0022779 k( 270) = ( 0.3068182 0.5000000 0.5000000), wk = 0.0022779 k( 271) = ( 0.3181818 0.5000000 0.5000000), wk = 0.0022779 k( 272) = ( 0.3295455 0.5000000 0.5000000), wk = 0.0022779 k( 273) = ( 0.3409091 0.5000000 0.5000000), wk = 0.0022779 k( 274) = ( 0.3522727 0.5000000 0.5000000), wk = 0.0022779 k( 275) = ( 0.3636364 0.5000000 0.5000000), wk = 0.0022779 k( 276) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0022779 k( 277) = ( 0.3863636 0.5000000 0.5000000), wk = 0.0022779 k( 278) = ( 0.3977273 0.5000000 0.5000000), wk = 0.0022779 k( 279) = ( 0.4090909 0.5000000 0.5000000), wk = 0.0022779 k( 280) = ( 0.4204545 0.5000000 0.5000000), wk = 0.0022779 k( 281) = ( 0.4318182 0.5000000 0.5000000), wk = 0.0022779 k( 282) = ( 0.4431818 0.5000000 0.5000000), wk = 0.0022779 k( 283) = ( 0.4545455 0.5000000 0.5000000), wk = 0.0022779 k( 284) = ( 0.4659091 0.5000000 0.5000000), wk = 0.0022779 k( 285) = ( 0.4772727 0.5000000 0.5000000), wk = 0.0022779 k( 286) = ( 0.4886364 0.5000000 0.5000000), wk = 0.0022779 k( 287) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 k( 288) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 k( 289) = ( 0.4918033 0.4918033 0.5000000), wk = 0.0022779 k( 290) = ( 0.4836066 0.4836066 0.5000000), wk = 0.0022779 k( 291) = ( 0.4754098 0.4754098 0.5000000), wk = 0.0022779 k( 292) = ( 0.4672131 0.4672131 0.5000000), wk = 0.0022779 k( 293) = ( 0.4590164 0.4590164 0.5000000), wk = 0.0022779 k( 294) = ( 0.4508197 0.4508197 0.5000000), wk = 0.0022779 k( 295) = ( 0.4426230 0.4426229 0.5000000), wk = 0.0022779 k( 296) = ( 0.4344262 0.4344262 0.5000000), wk = 0.0022779 k( 297) = ( 0.4262295 0.4262295 0.5000000), wk = 0.0022779 k( 298) = ( 0.4180328 0.4180328 0.5000000), wk = 0.0022779 k( 299) = ( 0.4098361 0.4098361 0.5000000), wk = 0.0022779 k( 300) = ( 0.4016393 0.4016393 0.5000000), wk = 0.0022779 k( 301) = ( 0.3934426 0.3934426 0.5000000), wk = 0.0022779 k( 302) = ( 0.3852459 0.3852459 0.5000000), wk = 0.0022779 k( 303) = ( 0.3770492 0.3770492 0.5000000), wk = 0.0022779 k( 304) = ( 0.3688525 0.3688525 0.5000000), wk = 0.0022779 k( 305) = ( 0.3606557 0.3606557 0.5000000), wk = 0.0022779 k( 306) = ( 0.3524590 0.3524590 0.5000000), wk = 0.0022779 k( 307) = ( 0.3442623 0.3442623 0.5000000), wk = 0.0022779 k( 308) = ( 0.3360656 0.3360656 0.5000000), wk = 0.0022779 k( 309) = ( 0.3278688 0.3278688 0.5000000), wk = 0.0022779 k( 310) = ( 0.3196721 0.3196721 0.5000000), wk = 0.0022779 k( 311) = ( 0.3114754 0.3114754 0.5000000), wk = 0.0022779 k( 312) = ( 0.3032787 0.3032787 0.5000000), wk = 0.0022779 k( 313) = ( 0.2950820 0.2950820 0.5000000), wk = 0.0022779 k( 314) = ( 0.2868852 0.2868852 0.5000000), wk = 0.0022779 k( 315) = ( 0.2786885 0.2786885 0.5000000), wk = 0.0022779 k( 316) = ( 0.2704918 0.2704918 0.5000000), wk = 0.0022779 k( 317) = ( 0.2622951 0.2622951 0.5000000), wk = 0.0022779 k( 318) = ( 0.2540984 0.2540984 0.5000000), wk = 0.0022779 k( 319) = ( 0.2459016 0.2459016 0.5000000), wk = 0.0022779 k( 320) = ( 0.2377049 0.2377049 0.5000000), wk = 0.0022779 k( 321) = ( 0.2295082 0.2295082 0.5000000), wk = 0.0022779 k( 322) = ( 0.2213115 0.2213115 0.5000000), wk = 0.0022779 k( 323) = ( 0.2131147 0.2131147 0.5000000), wk = 0.0022779 k( 324) = ( 0.2049180 0.2049180 0.5000000), wk = 0.0022779 k( 325) = ( 0.1967213 0.1967213 0.5000000), wk = 0.0022779 k( 326) = ( 0.1885246 0.1885246 0.5000000), wk = 0.0022779 k( 327) = ( 0.1803279 0.1803279 0.5000000), wk = 0.0022779 k( 328) = ( 0.1721312 0.1721311 0.5000000), wk = 0.0022779 k( 329) = ( 0.1639344 0.1639344 0.5000000), wk = 0.0022779 k( 330) = ( 0.1557377 0.1557377 0.5000000), wk = 0.0022779 k( 331) = ( 0.1475410 0.1475410 0.5000000), wk = 0.0022779 k( 332) = ( 0.1393443 0.1393443 0.5000000), wk = 0.0022779 k( 333) = ( 0.1311475 0.1311475 0.5000000), wk = 0.0022779 k( 334) = ( 0.1229508 0.1229508 0.5000000), wk = 0.0022779 k( 335) = ( 0.1147541 0.1147541 0.5000000), wk = 0.0022779 k( 336) = ( 0.1065574 0.1065574 0.5000000), wk = 0.0022779 k( 337) = ( 0.0983607 0.0983607 0.5000000), wk = 0.0022779 k( 338) = ( 0.0901639 0.0901639 0.5000000), wk = 0.0022779 k( 339) = ( 0.0819672 0.0819672 0.5000000), wk = 0.0022779 k( 340) = ( 0.0737705 0.0737705 0.5000000), wk = 0.0022779 k( 341) = ( 0.0655738 0.0655738 0.5000000), wk = 0.0022779 k( 342) = ( 0.0573770 0.0573770 0.5000000), wk = 0.0022779 k( 343) = ( 0.0491803 0.0491803 0.5000000), wk = 0.0022779 k( 344) = ( 0.0409836 0.0409836 0.5000000), wk = 0.0022779 k( 345) = ( 0.0327869 0.0327869 0.5000000), wk = 0.0022779 k( 346) = ( 0.0245902 0.0245902 0.5000000), wk = 0.0022779 k( 347) = ( 0.0163934 0.0163934 0.5000000), wk = 0.0022779 k( 348) = ( 0.0081967 0.0081967 0.5000000), wk = 0.0022779 k( 349) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 350) = ( 0.0000000 0.5000000 -0.0000000), wk = 0.0022779 k( 351) = ( 0.0000000 0.5000000 0.0113636), wk = 0.0022779 k( 352) = ( 0.0000000 0.5000000 0.0227273), wk = 0.0022779 k( 353) = ( 0.0000000 0.5000000 0.0340909), wk = 0.0022779 k( 354) = ( 0.0000000 0.5000000 0.0454545), wk = 0.0022779 k( 355) = ( 0.0000000 0.5000000 0.0568182), wk = 0.0022779 k( 356) = ( 0.0000000 0.5000000 0.0681818), wk = 0.0022779 k( 357) = ( 0.0000000 0.5000000 0.0795454), wk = 0.0022779 k( 358) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0022779 k( 359) = ( 0.0000000 0.5000000 0.1022727), wk = 0.0022779 k( 360) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0022779 k( 361) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0022779 k( 362) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0022779 k( 363) = ( 0.0000000 0.5000000 0.1477273), wk = 0.0022779 k( 364) = ( 0.0000000 0.5000000 0.1590909), wk = 0.0022779 k( 365) = ( 0.0000000 0.5000000 0.1704545), wk = 0.0022779 k( 366) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0022779 k( 367) = ( 0.0000000 0.5000000 0.1931818), wk = 0.0022779 k( 368) = ( 0.0000000 0.5000000 0.2045454), wk = 0.0022779 k( 369) = ( 0.0000000 0.5000000 0.2159091), wk = 0.0022779 k( 370) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0022779 k( 371) = ( 0.0000000 0.5000000 0.2386364), wk = 0.0022779 k( 372) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0022779 k( 373) = ( 0.0000000 0.5000000 0.2613636), wk = 0.0022779 k( 374) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0022779 k( 375) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0022779 k( 376) = ( 0.0000000 0.5000000 0.2954545), wk = 0.0022779 k( 377) = ( 0.0000000 0.5000000 0.3068182), wk = 0.0022779 k( 378) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0022779 k( 379) = ( 0.0000000 0.5000000 0.3295454), wk = 0.0022779 k( 380) = ( 0.0000000 0.5000000 0.3409091), wk = 0.0022779 k( 381) = ( 0.0000000 0.5000000 0.3522727), wk = 0.0022779 k( 382) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0022779 k( 383) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0022779 k( 384) = ( 0.0000000 0.5000000 0.3863636), wk = 0.0022779 k( 385) = ( 0.0000000 0.5000000 0.3977273), wk = 0.0022779 k( 386) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0022779 k( 387) = ( 0.0000000 0.5000000 0.4204545), wk = 0.0022779 k( 388) = ( 0.0000000 0.5000000 0.4318182), wk = 0.0022779 k( 389) = ( 0.0000000 0.5000000 0.4431818), wk = 0.0022779 k( 390) = ( 0.0000000 0.5000000 0.4545454), wk = 0.0022779 k( 391) = ( 0.0000000 0.5000000 0.4659091), wk = 0.0022779 k( 392) = ( 0.0000000 0.5000000 0.4772727), wk = 0.0022779 k( 393) = ( 0.0000000 0.5000000 0.4886364), wk = 0.0022779 k( 394) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 395) = ( 0.5000000 0.5000000 -0.0000000), wk = 0.0022779 k( 396) = ( 0.5000000 0.5000000 0.0113636), wk = 0.0022779 k( 397) = ( 0.5000000 0.5000000 0.0227273), wk = 0.0022779 k( 398) = ( 0.5000000 0.5000000 0.0340909), wk = 0.0022779 k( 399) = ( 0.5000000 0.5000000 0.0454545), wk = 0.0022779 k( 400) = ( 0.5000000 0.5000000 0.0568182), wk = 0.0022779 k( 401) = ( 0.5000000 0.5000000 0.0681818), wk = 0.0022779 k( 402) = ( 0.5000000 0.5000000 0.0795454), wk = 0.0022779 k( 403) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0022779 k( 404) = ( 0.5000000 0.5000000 0.1022727), wk = 0.0022779 k( 405) = ( 0.5000000 0.5000000 0.1136364), wk = 0.0022779 k( 406) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0022779 k( 407) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0022779 k( 408) = ( 0.5000000 0.5000000 0.1477273), wk = 0.0022779 k( 409) = ( 0.5000000 0.5000000 0.1590909), wk = 0.0022779 k( 410) = ( 0.5000000 0.5000000 0.1704545), wk = 0.0022779 k( 411) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0022779 k( 412) = ( 0.5000000 0.5000000 0.1931818), wk = 0.0022779 k( 413) = ( 0.5000000 0.5000000 0.2045454), wk = 0.0022779 k( 414) = ( 0.5000000 0.5000000 0.2159091), wk = 0.0022779 k( 415) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0022779 k( 416) = ( 0.5000000 0.5000000 0.2386364), wk = 0.0022779 k( 417) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0022779 k( 418) = ( 0.5000000 0.5000000 0.2613636), wk = 0.0022779 k( 419) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0022779 k( 420) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0022779 k( 421) = ( 0.5000000 0.5000000 0.2954545), wk = 0.0022779 k( 422) = ( 0.5000000 0.5000000 0.3068182), wk = 0.0022779 k( 423) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0022779 k( 424) = ( 0.5000000 0.5000000 0.3295454), wk = 0.0022779 k( 425) = ( 0.5000000 0.5000000 0.3409091), wk = 0.0022779 k( 426) = ( 0.5000000 0.5000000 0.3522727), wk = 0.0022779 k( 427) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0022779 k( 428) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0022779 k( 429) = ( 0.5000000 0.5000000 0.3863636), wk = 0.0022779 k( 430) = ( 0.5000000 0.5000000 0.3977273), wk = 0.0022779 k( 431) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0022779 k( 432) = ( 0.5000000 0.5000000 0.4204545), wk = 0.0022779 k( 433) = ( 0.5000000 0.5000000 0.4318182), wk = 0.0022779 k( 434) = ( 0.5000000 0.5000000 0.4431818), wk = 0.0022779 k( 435) = ( 0.5000000 0.5000000 0.4545454), wk = 0.0022779 k( 436) = ( 0.5000000 0.5000000 0.4659091), wk = 0.0022779 k( 437) = ( 0.5000000 0.5000000 0.4772727), wk = 0.0022779 k( 438) = ( 0.5000000 0.5000000 0.4886364), wk = 0.0022779 k( 439) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 2) = ( 0.0000000 0.0113636 0.0000000), wk = 0.0022779 k( 3) = ( 0.0000000 0.0227273 0.0000000), wk = 0.0022779 k( 4) = ( 0.0000000 0.0340909 0.0000000), wk = 0.0022779 k( 5) = ( 0.0000000 0.0454546 0.0000000), wk = 0.0022779 k( 6) = ( 0.0000000 0.0568182 0.0000000), wk = 0.0022779 k( 7) = ( 0.0000000 0.0681818 0.0000000), wk = 0.0022779 k( 8) = ( 0.0000000 0.0795455 0.0000000), wk = 0.0022779 k( 9) = ( 0.0000000 0.0909091 0.0000000), wk = 0.0022779 k( 10) = ( 0.0000000 0.1022727 0.0000000), wk = 0.0022779 k( 11) = ( 0.0000000 0.1136364 0.0000000), wk = 0.0022779 k( 12) = ( 0.0000000 0.1250000 0.0000000), wk = 0.0022779 k( 13) = ( 0.0000000 0.1363636 0.0000000), wk = 0.0022779 k( 14) = ( 0.0000000 0.1477273 0.0000000), wk = 0.0022779 k( 15) = ( 0.0000000 0.1590909 0.0000000), wk = 0.0022779 k( 16) = ( 0.0000000 0.1704546 0.0000000), wk = 0.0022779 k( 17) = ( 0.0000000 0.1818182 0.0000000), wk = 0.0022779 k( 18) = ( 0.0000000 0.1931818 0.0000000), wk = 0.0022779 k( 19) = ( 0.0000000 0.2045454 0.0000000), wk = 0.0022779 k( 20) = ( 0.0000000 0.2159091 0.0000000), wk = 0.0022779 k( 21) = ( 0.0000000 0.2272727 0.0000000), wk = 0.0022779 k( 22) = ( 0.0000000 0.2386364 0.0000000), wk = 0.0022779 k( 23) = ( 0.0000000 0.2500000 0.0000000), wk = 0.0022779 k( 24) = ( 0.0000000 0.2613636 0.0000000), wk = 0.0022779 k( 25) = ( 0.0000000 0.2727273 0.0000000), wk = 0.0022779 k( 26) = ( 0.0000000 0.2840909 0.0000000), wk = 0.0022779 k( 27) = ( 0.0000000 0.2954545 0.0000000), wk = 0.0022779 k( 28) = ( 0.0000000 0.3068182 0.0000000), wk = 0.0022779 k( 29) = ( 0.0000000 0.3181818 0.0000000), wk = 0.0022779 k( 30) = ( 0.0000000 0.3295455 0.0000000), wk = 0.0022779 k( 31) = ( 0.0000000 0.3409091 0.0000000), wk = 0.0022779 k( 32) = ( 0.0000000 0.3522727 0.0000000), wk = 0.0022779 k( 33) = ( 0.0000000 0.3636364 0.0000000), wk = 0.0022779 k( 34) = ( 0.0000000 0.3750000 0.0000000), wk = 0.0022779 k( 35) = ( 0.0000000 0.3863636 0.0000000), wk = 0.0022779 k( 36) = ( 0.0000000 0.3977273 0.0000000), wk = 0.0022779 k( 37) = ( 0.0000000 0.4090909 0.0000000), wk = 0.0022779 k( 38) = ( 0.0000000 0.4204545 0.0000000), wk = 0.0022779 k( 39) = ( 0.0000000 0.4318182 0.0000000), wk = 0.0022779 k( 40) = ( 0.0000000 0.4431818 0.0000000), wk = 0.0022779 k( 41) = ( 0.0000000 0.4545455 0.0000000), wk = 0.0022779 k( 42) = ( 0.0000000 0.4659091 0.0000000), wk = 0.0022779 k( 43) = ( 0.0000000 0.4772727 0.0000000), wk = 0.0022779 k( 44) = ( 0.0000000 0.4886364 0.0000000), wk = 0.0022779 k( 45) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022779 k( 46) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022779 k( 47) = ( 0.0113636 0.5000000 0.0000000), wk = 0.0022779 k( 48) = ( 0.0227273 0.5000000 0.0000000), wk = 0.0022779 k( 49) = ( 0.0340909 0.5000000 0.0000000), wk = 0.0022779 k( 50) = ( 0.0454546 0.5000000 0.0000000), wk = 0.0022779 k( 51) = ( 0.0568182 0.5000000 0.0000000), wk = 0.0022779 k( 52) = ( 0.0681818 0.5000000 0.0000000), wk = 0.0022779 k( 53) = ( 0.0795455 0.5000000 0.0000000), wk = 0.0022779 k( 54) = ( 0.0909091 0.5000000 0.0000000), wk = 0.0022779 k( 55) = ( 0.1022727 0.5000000 0.0000000), wk = 0.0022779 k( 56) = ( 0.1136364 0.5000000 0.0000000), wk = 0.0022779 k( 57) = ( 0.1250000 0.5000000 0.0000000), wk = 0.0022779 k( 58) = ( 0.1363636 0.5000000 0.0000000), wk = 0.0022779 k( 59) = ( 0.1477273 0.5000000 0.0000000), wk = 0.0022779 k( 60) = ( 0.1590909 0.5000000 0.0000000), wk = 0.0022779 k( 61) = ( 0.1704546 0.5000000 0.0000000), wk = 0.0022779 k( 62) = ( 0.1818182 0.5000000 0.0000000), wk = 0.0022779 k( 63) = ( 0.1931818 0.5000000 0.0000000), wk = 0.0022779 k( 64) = ( 0.2045454 0.5000000 0.0000000), wk = 0.0022779 k( 65) = ( 0.2159091 0.5000000 0.0000000), wk = 0.0022779 k( 66) = ( 0.2272727 0.5000000 0.0000000), wk = 0.0022779 k( 67) = ( 0.2386364 0.5000000 0.0000000), wk = 0.0022779 k( 68) = ( 0.2500000 0.5000000 0.0000000), wk = 0.0022779 k( 69) = ( 0.2613636 0.5000000 0.0000000), wk = 0.0022779 k( 70) = ( 0.2727273 0.5000000 0.0000000), wk = 0.0022779 k( 71) = ( 0.2840909 0.5000000 0.0000000), wk = 0.0022779 k( 72) = ( 0.2954545 0.5000000 0.0000000), wk = 0.0022779 k( 73) = ( 0.3068182 0.5000000 0.0000000), wk = 0.0022779 k( 74) = ( 0.3181818 0.5000000 0.0000000), wk = 0.0022779 k( 75) = ( 0.3295455 0.5000000 0.0000000), wk = 0.0022779 k( 76) = ( 0.3409091 0.5000000 0.0000000), wk = 0.0022779 k( 77) = ( 0.3522727 0.5000000 0.0000000), wk = 0.0022779 k( 78) = ( 0.3636364 0.5000000 0.0000000), wk = 0.0022779 k( 79) = ( 0.3750000 0.5000000 0.0000000), wk = 0.0022779 k( 80) = ( 0.3863636 0.5000000 0.0000000), wk = 0.0022779 k( 81) = ( 0.3977273 0.5000000 -0.0000000), wk = 0.0022779 k( 82) = ( 0.4090909 0.5000000 0.0000000), wk = 0.0022779 k( 83) = ( 0.4204545 0.5000000 0.0000000), wk = 0.0022779 k( 84) = ( 0.4318182 0.5000000 0.0000000), wk = 0.0022779 k( 85) = ( 0.4431818 0.5000000 0.0000000), wk = 0.0022779 k( 86) = ( 0.4545455 0.5000000 0.0000000), wk = 0.0022779 k( 87) = ( 0.4659091 0.5000000 0.0000000), wk = 0.0022779 k( 88) = ( 0.4772727 0.5000000 0.0000000), wk = 0.0022779 k( 89) = ( 0.4886364 0.5000000 0.0000000), wk = 0.0022779 k( 90) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022779 k( 91) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022779 k( 92) = ( 0.4918033 0.4918033 0.0000000), wk = 0.0022779 k( 93) = ( 0.4836066 0.4836066 0.0000000), wk = 0.0022779 k( 94) = ( 0.4754098 0.4754098 0.0000000), wk = 0.0022779 k( 95) = ( 0.4672131 0.4672131 0.0000000), wk = 0.0022779 k( 96) = ( 0.4590164 0.4590164 0.0000000), wk = 0.0022779 k( 97) = ( 0.4508197 0.4508197 0.0000000), wk = 0.0022779 k( 98) = ( 0.4426230 0.4426230 0.0000000), wk = 0.0022779 k( 99) = ( 0.4344262 0.4344262 0.0000000), wk = 0.0022779 k( 100) = ( 0.4262295 0.4262295 0.0000000), wk = 0.0022779 k( 101) = ( 0.4180328 0.4180328 0.0000000), wk = 0.0022779 k( 102) = ( 0.4098361 0.4098361 0.0000000), wk = 0.0022779 k( 103) = ( 0.4016393 0.4016393 0.0000000), wk = 0.0022779 k( 104) = ( 0.3934426 0.3934426 0.0000000), wk = 0.0022779 k( 105) = ( 0.3852459 0.3852459 0.0000000), wk = 0.0022779 k( 106) = ( 0.3770492 0.3770492 0.0000000), wk = 0.0022779 k( 107) = ( 0.3688525 0.3688525 0.0000000), wk = 0.0022779 k( 108) = ( 0.3606557 0.3606557 0.0000000), wk = 0.0022779 k( 109) = ( 0.3524590 0.3524590 0.0000000), wk = 0.0022779 k( 110) = ( 0.3442623 0.3442623 0.0000000), wk = 0.0022779 k( 111) = ( 0.3360656 0.3360656 0.0000000), wk = 0.0022779 k( 112) = ( 0.3278688 0.3278688 0.0000000), wk = 0.0022779 k( 113) = ( 0.3196721 0.3196721 0.0000000), wk = 0.0022779 k( 114) = ( 0.3114754 0.3114754 0.0000000), wk = 0.0022779 k( 115) = ( 0.3032787 0.3032787 0.0000000), wk = 0.0022779 k( 116) = ( 0.2950820 0.2950820 0.0000000), wk = 0.0022779 k( 117) = ( 0.2868852 0.2868852 0.0000000), wk = 0.0022779 k( 118) = ( 0.2786885 0.2786885 0.0000000), wk = 0.0022779 k( 119) = ( 0.2704918 0.2704918 0.0000000), wk = 0.0022779 k( 120) = ( 0.2622951 0.2622951 0.0000000), wk = 0.0022779 k( 121) = ( 0.2540984 0.2540984 0.0000000), wk = 0.0022779 k( 122) = ( 0.2459016 0.2459016 0.0000000), wk = 0.0022779 k( 123) = ( 0.2377049 0.2377049 0.0000000), wk = 0.0022779 k( 124) = ( 0.2295082 0.2295082 0.0000000), wk = 0.0022779 k( 125) = ( 0.2213115 0.2213115 0.0000000), wk = 0.0022779 k( 126) = ( 0.2131147 0.2131147 0.0000000), wk = 0.0022779 k( 127) = ( 0.2049180 0.2049180 0.0000000), wk = 0.0022779 k( 128) = ( 0.1967213 0.1967213 0.0000000), wk = 0.0022779 k( 129) = ( 0.1885246 0.1885246 0.0000000), wk = 0.0022779 k( 130) = ( 0.1803279 0.1803279 0.0000000), wk = 0.0022779 k( 131) = ( 0.1721312 0.1721312 0.0000000), wk = 0.0022779 k( 132) = ( 0.1639344 0.1639344 0.0000000), wk = 0.0022779 k( 133) = ( 0.1557377 0.1557377 0.0000000), wk = 0.0022779 k( 134) = ( 0.1475410 0.1475410 0.0000000), wk = 0.0022779 k( 135) = ( 0.1393443 0.1393443 0.0000000), wk = 0.0022779 k( 136) = ( 0.1311475 0.1311475 0.0000000), wk = 0.0022779 k( 137) = ( 0.1229508 0.1229508 0.0000000), wk = 0.0022779 k( 138) = ( 0.1147541 0.1147541 0.0000000), wk = 0.0022779 k( 139) = ( 0.1065574 0.1065574 0.0000000), wk = 0.0022779 k( 140) = ( 0.0983607 0.0983607 0.0000000), wk = 0.0022779 k( 141) = ( 0.0901639 0.0901639 0.0000000), wk = 0.0022779 k( 142) = ( 0.0819672 0.0819672 0.0000000), wk = 0.0022779 k( 143) = ( 0.0737705 0.0737705 0.0000000), wk = 0.0022779 k( 144) = ( 0.0655738 0.0655738 0.0000000), wk = 0.0022779 k( 145) = ( 0.0573770 0.0573770 0.0000000), wk = 0.0022779 k( 146) = ( 0.0491803 0.0491803 0.0000000), wk = 0.0022779 k( 147) = ( 0.0409836 0.0409836 0.0000000), wk = 0.0022779 k( 148) = ( 0.0327869 0.0327869 0.0000000), wk = 0.0022779 k( 149) = ( 0.0245902 0.0245902 0.0000000), wk = 0.0022779 k( 150) = ( 0.0163934 0.0163934 0.0000000), wk = 0.0022779 k( 151) = ( 0.0081967 0.0081967 0.0000000), wk = 0.0022779 k( 152) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 153) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022779 k( 154) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0022779 k( 155) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0022779 k( 156) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0022779 k( 157) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0022779 k( 158) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0022779 k( 159) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0022779 k( 160) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0022779 k( 161) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0022779 k( 162) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0022779 k( 163) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0022779 k( 164) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0022779 k( 165) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0022779 k( 166) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0022779 k( 167) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0022779 k( 168) = ( 0.0000000 0.0000000 0.1704546), wk = 0.0022779 k( 169) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0022779 k( 170) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0022779 k( 171) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0022779 k( 172) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0022779 k( 173) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0022779 k( 174) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0022779 k( 175) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0022779 k( 176) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0022779 k( 177) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0022779 k( 178) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0022779 k( 179) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0022779 k( 180) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0022779 k( 181) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0022779 k( 182) = ( 0.0000000 0.0000000 0.3295455), wk = 0.0022779 k( 183) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0022779 k( 184) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0022779 k( 185) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0022779 k( 186) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0022779 k( 187) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0022779 k( 188) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0022779 k( 189) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0022779 k( 190) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0022779 k( 191) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0022779 k( 192) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0022779 k( 193) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0022779 k( 194) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0022779 k( 195) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0022779 k( 196) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0022779 k( 197) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 198) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 199) = ( 0.0000000 0.0113636 0.5000000), wk = 0.0022779 k( 200) = ( 0.0000000 0.0227273 0.5000000), wk = 0.0022779 k( 201) = ( 0.0000000 0.0340909 0.5000000), wk = 0.0022779 k( 202) = ( 0.0000000 0.0454546 0.5000000), wk = 0.0022779 k( 203) = ( 0.0000000 0.0568182 0.5000000), wk = 0.0022779 k( 204) = ( 0.0000000 0.0681818 0.5000000), wk = 0.0022779 k( 205) = ( 0.0000000 0.0795455 0.5000000), wk = 0.0022779 k( 206) = ( 0.0000000 0.0909091 0.5000000), wk = 0.0022779 k( 207) = ( 0.0000000 0.1022727 0.5000000), wk = 0.0022779 k( 208) = ( 0.0000000 0.1136364 0.5000000), wk = 0.0022779 k( 209) = ( 0.0000000 0.1250000 0.5000000), wk = 0.0022779 k( 210) = ( 0.0000000 0.1363636 0.5000000), wk = 0.0022779 k( 211) = ( 0.0000000 0.1477273 0.5000000), wk = 0.0022779 k( 212) = ( 0.0000000 0.1590909 0.5000000), wk = 0.0022779 k( 213) = ( 0.0000000 0.1704546 0.5000000), wk = 0.0022779 k( 214) = ( 0.0000000 0.1818182 0.5000000), wk = 0.0022779 k( 215) = ( 0.0000000 0.1931818 0.5000000), wk = 0.0022779 k( 216) = ( 0.0000000 0.2045454 0.5000000), wk = 0.0022779 k( 217) = ( 0.0000000 0.2159091 0.5000000), wk = 0.0022779 k( 218) = ( 0.0000000 0.2272727 0.5000000), wk = 0.0022779 k( 219) = ( 0.0000000 0.2386364 0.5000000), wk = 0.0022779 k( 220) = ( 0.0000000 0.2500000 0.5000000), wk = 0.0022779 k( 221) = ( 0.0000000 0.2613636 0.5000000), wk = 0.0022779 k( 222) = ( 0.0000000 0.2727273 0.5000000), wk = 0.0022779 k( 223) = ( 0.0000000 0.2840909 0.5000000), wk = 0.0022779 k( 224) = ( 0.0000000 0.2954545 0.5000000), wk = 0.0022779 k( 225) = ( 0.0000000 0.3068182 0.5000000), wk = 0.0022779 k( 226) = ( 0.0000000 0.3181818 0.5000000), wk = 0.0022779 k( 227) = ( 0.0000000 0.3295455 0.5000000), wk = 0.0022779 k( 228) = ( 0.0000000 0.3409091 0.5000000), wk = 0.0022779 k( 229) = ( 0.0000000 0.3522727 0.5000000), wk = 0.0022779 k( 230) = ( 0.0000000 0.3636364 0.5000000), wk = 0.0022779 k( 231) = ( 0.0000000 0.3750000 0.5000000), wk = 0.0022779 k( 232) = ( 0.0000000 0.3863636 0.5000000), wk = 0.0022779 k( 233) = ( 0.0000000 0.3977273 0.5000000), wk = 0.0022779 k( 234) = ( 0.0000000 0.4090909 0.5000000), wk = 0.0022779 k( 235) = ( 0.0000000 0.4204545 0.5000000), wk = 0.0022779 k( 236) = ( 0.0000000 0.4318182 0.5000000), wk = 0.0022779 k( 237) = ( 0.0000000 0.4431818 0.5000000), wk = 0.0022779 k( 238) = ( 0.0000000 0.4545455 0.5000000), wk = 0.0022779 k( 239) = ( 0.0000000 0.4659091 0.5000000), wk = 0.0022779 k( 240) = ( 0.0000000 0.4772727 0.5000000), wk = 0.0022779 k( 241) = ( 0.0000000 0.4886364 0.5000000), wk = 0.0022779 k( 242) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 243) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 244) = ( 0.0113636 0.5000000 0.5000000), wk = 0.0022779 k( 245) = ( 0.0227273 0.5000000 0.5000000), wk = 0.0022779 k( 246) = ( 0.0340909 0.5000000 0.5000000), wk = 0.0022779 k( 247) = ( 0.0454546 0.5000000 0.5000000), wk = 0.0022779 k( 248) = ( 0.0568182 0.5000000 0.5000000), wk = 0.0022779 k( 249) = ( 0.0681818 0.5000000 0.5000000), wk = 0.0022779 k( 250) = ( 0.0795455 0.5000000 0.5000000), wk = 0.0022779 k( 251) = ( 0.0909091 0.5000000 0.5000000), wk = 0.0022779 k( 252) = ( 0.1022727 0.5000000 0.5000000), wk = 0.0022779 k( 253) = ( 0.1136364 0.5000000 0.5000000), wk = 0.0022779 k( 254) = ( 0.1250000 0.5000000 0.5000000), wk = 0.0022779 k( 255) = ( 0.1363636 0.5000000 0.5000000), wk = 0.0022779 k( 256) = ( 0.1477273 0.5000000 0.5000000), wk = 0.0022779 k( 257) = ( 0.1590909 0.5000000 0.5000000), wk = 0.0022779 k( 258) = ( 0.1704546 0.5000000 0.5000000), wk = 0.0022779 k( 259) = ( 0.1818182 0.5000000 0.5000000), wk = 0.0022779 k( 260) = ( 0.1931818 0.5000000 0.5000000), wk = 0.0022779 k( 261) = ( 0.2045454 0.5000000 0.5000000), wk = 0.0022779 k( 262) = ( 0.2159091 0.5000000 0.5000000), wk = 0.0022779 k( 263) = ( 0.2272727 0.5000000 0.5000000), wk = 0.0022779 k( 264) = ( 0.2386364 0.5000000 0.5000000), wk = 0.0022779 k( 265) = ( 0.2500000 0.5000000 0.5000000), wk = 0.0022779 k( 266) = ( 0.2613636 0.5000000 0.5000000), wk = 0.0022779 k( 267) = ( 0.2727273 0.5000000 0.5000000), wk = 0.0022779 k( 268) = ( 0.2840909 0.5000000 0.5000000), wk = 0.0022779 k( 269) = ( 0.2954545 0.5000000 0.5000000), wk = 0.0022779 k( 270) = ( 0.3068182 0.5000000 0.5000000), wk = 0.0022779 k( 271) = ( 0.3181818 0.5000000 0.5000000), wk = 0.0022779 k( 272) = ( 0.3295455 0.5000000 0.5000000), wk = 0.0022779 k( 273) = ( 0.3409091 0.5000000 0.5000000), wk = 0.0022779 k( 274) = ( 0.3522727 0.5000000 0.5000000), wk = 0.0022779 k( 275) = ( 0.3636364 0.5000000 0.5000000), wk = 0.0022779 k( 276) = ( 0.3750000 0.5000000 0.5000000), wk = 0.0022779 k( 277) = ( 0.3863636 0.5000000 0.5000000), wk = 0.0022779 k( 278) = ( 0.3977273 0.5000000 0.5000000), wk = 0.0022779 k( 279) = ( 0.4090909 0.5000000 0.5000000), wk = 0.0022779 k( 280) = ( 0.4204545 0.5000000 0.5000000), wk = 0.0022779 k( 281) = ( 0.4318182 0.5000000 0.5000000), wk = 0.0022779 k( 282) = ( 0.4431818 0.5000000 0.5000000), wk = 0.0022779 k( 283) = ( 0.4545455 0.5000000 0.5000000), wk = 0.0022779 k( 284) = ( 0.4659091 0.5000000 0.5000000), wk = 0.0022779 k( 285) = ( 0.4772727 0.5000000 0.5000000), wk = 0.0022779 k( 286) = ( 0.4886364 0.5000000 0.5000000), wk = 0.0022779 k( 287) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 k( 288) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 k( 289) = ( 0.4918033 0.4918033 0.5000000), wk = 0.0022779 k( 290) = ( 0.4836066 0.4836066 0.5000000), wk = 0.0022779 k( 291) = ( 0.4754098 0.4754098 0.5000000), wk = 0.0022779 k( 292) = ( 0.4672131 0.4672131 0.5000000), wk = 0.0022779 k( 293) = ( 0.4590164 0.4590164 0.5000000), wk = 0.0022779 k( 294) = ( 0.4508197 0.4508197 0.5000000), wk = 0.0022779 k( 295) = ( 0.4426230 0.4426230 0.5000000), wk = 0.0022779 k( 296) = ( 0.4344262 0.4344262 0.5000000), wk = 0.0022779 k( 297) = ( 0.4262295 0.4262295 0.5000000), wk = 0.0022779 k( 298) = ( 0.4180328 0.4180328 0.5000000), wk = 0.0022779 k( 299) = ( 0.4098361 0.4098361 0.5000000), wk = 0.0022779 k( 300) = ( 0.4016393 0.4016393 0.5000000), wk = 0.0022779 k( 301) = ( 0.3934426 0.3934426 0.5000000), wk = 0.0022779 k( 302) = ( 0.3852459 0.3852459 0.5000000), wk = 0.0022779 k( 303) = ( 0.3770492 0.3770492 0.5000000), wk = 0.0022779 k( 304) = ( 0.3688525 0.3688525 0.5000000), wk = 0.0022779 k( 305) = ( 0.3606557 0.3606557 0.5000000), wk = 0.0022779 k( 306) = ( 0.3524590 0.3524590 0.5000000), wk = 0.0022779 k( 307) = ( 0.3442623 0.3442623 0.5000000), wk = 0.0022779 k( 308) = ( 0.3360656 0.3360656 0.5000000), wk = 0.0022779 k( 309) = ( 0.3278688 0.3278688 0.5000000), wk = 0.0022779 k( 310) = ( 0.3196721 0.3196721 0.5000000), wk = 0.0022779 k( 311) = ( 0.3114754 0.3114754 0.5000000), wk = 0.0022779 k( 312) = ( 0.3032787 0.3032787 0.5000000), wk = 0.0022779 k( 313) = ( 0.2950820 0.2950820 0.5000000), wk = 0.0022779 k( 314) = ( 0.2868852 0.2868852 0.5000000), wk = 0.0022779 k( 315) = ( 0.2786885 0.2786885 0.5000000), wk = 0.0022779 k( 316) = ( 0.2704918 0.2704918 0.5000000), wk = 0.0022779 k( 317) = ( 0.2622951 0.2622951 0.5000000), wk = 0.0022779 k( 318) = ( 0.2540984 0.2540984 0.5000000), wk = 0.0022779 k( 319) = ( 0.2459016 0.2459016 0.5000000), wk = 0.0022779 k( 320) = ( 0.2377049 0.2377049 0.5000000), wk = 0.0022779 k( 321) = ( 0.2295082 0.2295082 0.5000000), wk = 0.0022779 k( 322) = ( 0.2213115 0.2213115 0.5000000), wk = 0.0022779 k( 323) = ( 0.2131147 0.2131147 0.5000000), wk = 0.0022779 k( 324) = ( 0.2049180 0.2049180 0.5000000), wk = 0.0022779 k( 325) = ( 0.1967213 0.1967213 0.5000000), wk = 0.0022779 k( 326) = ( 0.1885246 0.1885246 0.5000000), wk = 0.0022779 k( 327) = ( 0.1803279 0.1803279 0.5000000), wk = 0.0022779 k( 328) = ( 0.1721312 0.1721312 0.5000000), wk = 0.0022779 k( 329) = ( 0.1639344 0.1639344 0.5000000), wk = 0.0022779 k( 330) = ( 0.1557377 0.1557377 0.5000000), wk = 0.0022779 k( 331) = ( 0.1475410 0.1475410 0.5000000), wk = 0.0022779 k( 332) = ( 0.1393443 0.1393443 0.5000000), wk = 0.0022779 k( 333) = ( 0.1311475 0.1311475 0.5000000), wk = 0.0022779 k( 334) = ( 0.1229508 0.1229508 0.5000000), wk = 0.0022779 k( 335) = ( 0.1147541 0.1147541 0.5000000), wk = 0.0022779 k( 336) = ( 0.1065574 0.1065574 0.5000000), wk = 0.0022779 k( 337) = ( 0.0983607 0.0983607 0.5000000), wk = 0.0022779 k( 338) = ( 0.0901639 0.0901639 0.5000000), wk = 0.0022779 k( 339) = ( 0.0819672 0.0819672 0.5000000), wk = 0.0022779 k( 340) = ( 0.0737705 0.0737705 0.5000000), wk = 0.0022779 k( 341) = ( 0.0655738 0.0655738 0.5000000), wk = 0.0022779 k( 342) = ( 0.0573770 0.0573770 0.5000000), wk = 0.0022779 k( 343) = ( 0.0491803 0.0491803 0.5000000), wk = 0.0022779 k( 344) = ( 0.0409836 0.0409836 0.5000000), wk = 0.0022779 k( 345) = ( 0.0327869 0.0327869 0.5000000), wk = 0.0022779 k( 346) = ( 0.0245902 0.0245902 0.5000000), wk = 0.0022779 k( 347) = ( 0.0163934 0.0163934 0.5000000), wk = 0.0022779 k( 348) = ( 0.0081967 0.0081967 0.5000000), wk = 0.0022779 k( 349) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022779 k( 350) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022779 k( 351) = ( 0.0000000 0.5000000 0.0113636), wk = 0.0022779 k( 352) = ( 0.0000000 0.5000000 0.0227273), wk = 0.0022779 k( 353) = ( 0.0000000 0.5000000 0.0340909), wk = 0.0022779 k( 354) = ( 0.0000000 0.5000000 0.0454546), wk = 0.0022779 k( 355) = ( 0.0000000 0.5000000 0.0568182), wk = 0.0022779 k( 356) = ( 0.0000000 0.5000000 0.0681818), wk = 0.0022779 k( 357) = ( 0.0000000 0.5000000 0.0795455), wk = 0.0022779 k( 358) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0022779 k( 359) = ( 0.0000000 0.5000000 0.1022727), wk = 0.0022779 k( 360) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0022779 k( 361) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0022779 k( 362) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0022779 k( 363) = ( 0.0000000 0.5000000 0.1477273), wk = 0.0022779 k( 364) = ( 0.0000000 0.5000000 0.1590909), wk = 0.0022779 k( 365) = ( 0.0000000 0.5000000 0.1704546), wk = 0.0022779 k( 366) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0022779 k( 367) = ( 0.0000000 0.5000000 0.1931818), wk = 0.0022779 k( 368) = ( 0.0000000 0.5000000 0.2045454), wk = 0.0022779 k( 369) = ( 0.0000000 0.5000000 0.2159091), wk = 0.0022779 k( 370) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0022779 k( 371) = ( 0.0000000 0.5000000 0.2386364), wk = 0.0022779 k( 372) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0022779 k( 373) = ( 0.0000000 0.5000000 0.2613636), wk = 0.0022779 k( 374) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0022779 k( 375) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0022779 k( 376) = ( 0.0000000 0.5000000 0.2954545), wk = 0.0022779 k( 377) = ( 0.0000000 0.5000000 0.3068182), wk = 0.0022779 k( 378) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0022779 k( 379) = ( 0.0000000 0.5000000 0.3295455), wk = 0.0022779 k( 380) = ( 0.0000000 0.5000000 0.3409091), wk = 0.0022779 k( 381) = ( 0.0000000 0.5000000 0.3522727), wk = 0.0022779 k( 382) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0022779 k( 383) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0022779 k( 384) = ( 0.0000000 0.5000000 0.3863636), wk = 0.0022779 k( 385) = ( 0.0000000 0.5000000 0.3977273), wk = 0.0022779 k( 386) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0022779 k( 387) = ( 0.0000000 0.5000000 0.4204545), wk = 0.0022779 k( 388) = ( 0.0000000 0.5000000 0.4318182), wk = 0.0022779 k( 389) = ( 0.0000000 0.5000000 0.4431818), wk = 0.0022779 k( 390) = ( 0.0000000 0.5000000 0.4545455), wk = 0.0022779 k( 391) = ( 0.0000000 0.5000000 0.4659091), wk = 0.0022779 k( 392) = ( 0.0000000 0.5000000 0.4772727), wk = 0.0022779 k( 393) = ( 0.0000000 0.5000000 0.4886364), wk = 0.0022779 k( 394) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022779 k( 395) = ( 0.5000000 0.5000000 0.0000000), wk = 0.0022779 k( 396) = ( 0.5000000 0.5000000 0.0113636), wk = 0.0022779 k( 397) = ( 0.5000000 0.5000000 0.0227273), wk = 0.0022779 k( 398) = ( 0.5000000 0.5000000 0.0340909), wk = 0.0022779 k( 399) = ( 0.5000000 0.5000000 0.0454546), wk = 0.0022779 k( 400) = ( 0.5000000 0.5000000 0.0568182), wk = 0.0022779 k( 401) = ( 0.5000000 0.5000000 0.0681818), wk = 0.0022779 k( 402) = ( 0.5000000 0.5000000 0.0795455), wk = 0.0022779 k( 403) = ( 0.5000000 0.5000000 0.0909091), wk = 0.0022779 k( 404) = ( 0.5000000 0.5000000 0.1022727), wk = 0.0022779 k( 405) = ( 0.5000000 0.5000000 0.1136364), wk = 0.0022779 k( 406) = ( 0.5000000 0.5000000 0.1250000), wk = 0.0022779 k( 407) = ( 0.5000000 0.5000000 0.1363636), wk = 0.0022779 k( 408) = ( 0.5000000 0.5000000 0.1477273), wk = 0.0022779 k( 409) = ( 0.5000000 0.5000000 0.1590909), wk = 0.0022779 k( 410) = ( 0.5000000 0.5000000 0.1704546), wk = 0.0022779 k( 411) = ( 0.5000000 0.5000000 0.1818182), wk = 0.0022779 k( 412) = ( 0.5000000 0.5000000 0.1931818), wk = 0.0022779 k( 413) = ( 0.5000000 0.5000000 0.2045454), wk = 0.0022779 k( 414) = ( 0.5000000 0.5000000 0.2159091), wk = 0.0022779 k( 415) = ( 0.5000000 0.5000000 0.2272727), wk = 0.0022779 k( 416) = ( 0.5000000 0.5000000 0.2386364), wk = 0.0022779 k( 417) = ( 0.5000000 0.5000000 0.2500000), wk = 0.0022779 k( 418) = ( 0.5000000 0.5000000 0.2613636), wk = 0.0022779 k( 419) = ( 0.5000000 0.5000000 0.2727273), wk = 0.0022779 k( 420) = ( 0.5000000 0.5000000 0.2840909), wk = 0.0022779 k( 421) = ( 0.5000000 0.5000000 0.2954545), wk = 0.0022779 k( 422) = ( 0.5000000 0.5000000 0.3068182), wk = 0.0022779 k( 423) = ( 0.5000000 0.5000000 0.3181818), wk = 0.0022779 k( 424) = ( 0.5000000 0.5000000 0.3295455), wk = 0.0022779 k( 425) = ( 0.5000000 0.5000000 0.3409091), wk = 0.0022779 k( 426) = ( 0.5000000 0.5000000 0.3522727), wk = 0.0022779 k( 427) = ( 0.5000000 0.5000000 0.3636364), wk = 0.0022779 k( 428) = ( 0.5000000 0.5000000 0.3750000), wk = 0.0022779 k( 429) = ( 0.5000000 0.5000000 0.3863636), wk = 0.0022779 k( 430) = ( 0.5000000 0.5000000 0.3977273), wk = 0.0022779 k( 431) = ( 0.5000000 0.5000000 0.4090909), wk = 0.0022779 k( 432) = ( 0.5000000 0.5000000 0.4204545), wk = 0.0022779 k( 433) = ( 0.5000000 0.5000000 0.4318182), wk = 0.0022779 k( 434) = ( 0.5000000 0.5000000 0.4431818), wk = 0.0022779 k( 435) = ( 0.5000000 0.5000000 0.4545455), wk = 0.0022779 k( 436) = ( 0.5000000 0.5000000 0.4659091), wk = 0.0022779 k( 437) = ( 0.5000000 0.5000000 0.4772727), wk = 0.0022779 k( 438) = ( 0.5000000 0.5000000 0.4886364), wk = 0.0022779 k( 439) = ( 0.5000000 0.5000000 0.5000000), wk = 0.0022779 Dense grid: 31463 G-vectors FFT dimensions: ( 40, 40, 40) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.19 Mb ( 240, 52) NL pseudopotentials 0.25 Mb ( 120, 136) Each V/rho on FFT grid 0.05 Mb ( 3200) Each G-vector array 0.01 Mb ( 873) G-vector shells 0.00 Mb ( 236) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.76 Mb ( 240, 208) Each subspace H/S matrix 0.04 Mb ( 52, 52) Each matrix 0.22 Mb ( 136, 2, 52) The potential is recalculated from file : ./MnGaFe2.save/charge-density.dat Starting wfc are 74 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 2.6 secs Computing kpt #: 2 total cpu time spent up to now is 3.1 secs Computing kpt #: 3 total cpu time spent up to now is 3.6 secs Computing kpt #: 4 total cpu time spent up to now is 4.0 secs Computing kpt #: 5 total cpu time spent up to now is 4.4 secs Computing kpt #: 6 total cpu time spent up to now is 5.0 secs Computing kpt #: 7 total cpu time spent up to now is 5.4 secs Computing kpt #: 8 total cpu time spent up to now is 5.9 secs Computing kpt #: 9 total cpu time spent up to now is 6.3 secs Computing kpt #: 10 total cpu time spent up to now is 6.8 secs Computing kpt #: 11 total cpu time spent up to now is 7.3 secs Computing kpt #: 12 total cpu time spent up to now is 7.7 secs Computing kpt #: 13 total cpu time spent up to now is 8.1 secs Computing kpt #: 14 total cpu time spent up to now is 8.5 secs Computing kpt #: 15 total cpu time spent up to now is 8.9 secs Computing kpt #: 16 total cpu time spent up to now is 9.4 secs Computing kpt #: 17 total cpu time spent up to now is 9.8 secs Computing kpt #: 18 total cpu time spent up to now is 10.2 secs Computing kpt #: 19 total cpu time spent up to now is 10.6 secs Computing kpt #: 20 total cpu time spent up to now is 10.9 secs Computing kpt #: 21 total cpu time spent up to now is 11.3 secs Computing kpt #: 22 total cpu time spent up to now is 11.7 secs Computing kpt #: 23 total cpu time spent up to now is 12.1 secs Computing kpt #: 24 total cpu time spent up to now is 12.5 secs Computing kpt #: 25 total cpu time spent up to now is 12.8 secs Computing kpt #: 26 total cpu time spent up to now is 13.2 secs Computing kpt #: 27 total cpu time spent up to now is 13.6 secs Computing kpt #: 28 total cpu time spent up to now is 13.9 secs Computing kpt #: 29 total cpu time spent up to now is 14.3 secs Computing kpt #: 30 total cpu time spent up to now is 14.6 secs Computing kpt #: 31 total cpu time spent up to now is 15.0 secs Computing kpt #: 32 total cpu time spent up to now is 15.3 secs Computing kpt #: 33 total cpu time spent up to now is 15.6 secs Computing kpt #: 34 total cpu time spent up to now is 16.0 secs Computing kpt #: 35 total cpu time spent up to now is 16.3 secs Computing kpt #: 36 total cpu time spent up to now is 16.6 secs Computing kpt #: 37 total cpu time spent up to now is 17.0 secs Computing kpt #: 38 total cpu time spent up to now is 17.3 secs Computing kpt #: 39 total cpu time spent up to now is 17.6 secs Computing kpt #: 40 total cpu time spent up to now is 17.9 secs Computing kpt #: 41 total cpu time spent up to now is 18.2 secs Computing kpt #: 42 total cpu time spent up to now is 18.5 secs Computing kpt #: 43 total cpu time spent up to now is 18.9 secs Computing kpt #: 44 total cpu time spent up to now is 19.2 secs Computing kpt #: 45 total cpu time spent up to now is 19.5 secs Computing kpt #: 46 total cpu time spent up to now is 19.8 secs Computing kpt #: 47 total cpu time spent up to now is 20.1 secs Computing kpt #: 48 total cpu time spent up to now is 20.4 secs Computing kpt #: 49 total cpu time spent up to now is 20.7 secs Computing kpt #: 50 total cpu time spent up to now is 21.0 secs Computing kpt #: 51 total cpu time spent up to now is 21.4 secs Computing kpt #: 52 total cpu time spent up to now is 21.7 secs Computing kpt #: 53 total cpu time spent up to now is 22.0 secs Computing kpt #: 54 total cpu time spent up to now is 22.3 secs Computing kpt #: 55 total cpu time spent up to now is 22.6 secs Computing kpt #: 56 total cpu time spent up to now is 23.0 secs Computing kpt #: 57 total cpu time spent up to now is 23.3 secs Computing kpt #: 58 total cpu time spent up to now is 23.6 secs Computing kpt #: 59 total cpu time spent up to now is 24.0 secs Computing kpt #: 60 total cpu time spent up to now is 24.3 secs Computing kpt #: 61 total cpu time spent up to now is 24.7 secs Computing kpt #: 62 total cpu time spent up to now is 25.0 secs Computing kpt #: 63 total cpu time spent up to now is 25.4 secs Computing kpt #: 64 total cpu time spent up to now is 25.8 secs Computing kpt #: 65 total cpu time spent up to now is 26.1 secs Computing kpt #: 66 total cpu time spent up to now is 26.5 secs Computing kpt #: 67 total cpu time spent up to now is 26.9 secs Computing kpt #: 68 total cpu time spent up to now is 27.2 secs Computing kpt #: 69 total cpu time spent up to now is 27.6 secs Computing kpt #: 70 total cpu time spent up to now is 28.0 secs Computing kpt #: 71 total cpu time spent up to now is 28.4 secs Computing kpt #: 72 total cpu time spent up to now is 28.8 secs Computing kpt #: 73 total cpu time spent up to now is 29.2 secs Computing kpt #: 74 total cpu time spent up to now is 29.6 secs Computing kpt #: 75 total cpu time spent up to now is 29.9 secs Computing kpt #: 76 total cpu time spent up to now is 30.3 secs Computing kpt #: 77 total cpu time spent up to now is 30.7 secs Computing kpt #: 78 total cpu time spent up to now is 31.1 secs Computing kpt #: 79 total cpu time spent up to now is 31.5 secs Computing kpt #: 80 total cpu time spent up to now is 31.9 secs Computing kpt #: 81 total cpu time spent up to now is 32.3 secs Computing kpt #: 82 total cpu time spent up to now is 32.6 secs Computing kpt #: 83 total cpu time spent up to now is 33.0 secs Computing kpt #: 84 total cpu time spent up to now is 33.3 secs Computing kpt #: 85 total cpu time spent up to now is 33.7 secs Computing kpt #: 86 total cpu time spent up to now is 34.0 secs Computing kpt #: 87 total cpu time spent up to now is 34.3 secs Computing kpt #: 88 total cpu time spent up to now is 34.7 secs Computing kpt #: 89 total cpu time spent up to now is 35.0 secs Computing kpt #: 90 total cpu time spent up to now is 35.3 secs Computing kpt #: 91 total cpu time spent up to now is 35.6 secs Computing kpt #: 92 total cpu time spent up to now is 36.0 secs Computing kpt #: 93 total cpu time spent up to now is 36.3 secs Computing kpt #: 94 total cpu time spent up to now is 36.6 secs Computing kpt #: 95 total cpu time spent up to now is 37.0 secs Computing kpt #: 96 total cpu time spent up to now is 37.3 secs Computing kpt #: 97 total cpu time spent up to now is 37.7 secs Computing kpt #: 98 total cpu time spent up to now is 38.0 secs Computing kpt #: 99 total cpu time spent up to now is 38.4 secs Computing kpt #: 100 total cpu time spent up to now is 38.8 secs Computing kpt #: 101 total cpu time spent up to now is 39.1 secs Computing kpt #: 102 total cpu time spent up to now is 39.5 secs Computing kpt #: 103 total cpu time spent up to now is 39.9 secs Computing kpt #: 104 total cpu time spent up to now is 40.3 secs Computing kpt #: 105 total cpu time spent up to now is 40.7 secs Computing kpt #: 106 total cpu time spent up to now is 41.0 secs Computing kpt #: 107 total cpu time spent up to now is 41.4 secs Computing kpt #: 108 total cpu time spent up to now is 41.9 secs Computing kpt #: 109 total cpu time spent up to now is 42.3 secs Computing kpt #: 110 total cpu time spent up to now is 42.6 secs Computing kpt #: 111 total cpu time spent up to now is 43.0 secs Computing kpt #: 112 total cpu time spent up to now is 43.4 secs Computing kpt #: 113 total cpu time spent up to now is 43.7 secs Computing kpt #: 114 total cpu time spent up to now is 44.1 secs Computing kpt #: 115 total cpu time spent up to now is 44.4 secs Computing kpt #: 116 total cpu time spent up to now is 44.8 secs Computing kpt #: 117 total cpu time spent up to now is 45.2 secs Computing kpt #: 118 total cpu time spent up to now is 45.5 secs Computing kpt #: 119 total cpu time spent up to now is 45.9 secs Computing kpt #: 120 total cpu time spent up to now is 46.2 secs Computing kpt #: 121 total cpu time spent up to now is 46.6 secs Computing kpt #: 122 total cpu time spent up to now is 46.9 secs Computing kpt #: 123 total cpu time spent up to now is 47.3 secs Computing kpt #: 124 total cpu time spent up to now is 47.6 secs Computing kpt #: 125 total cpu time spent up to now is 48.0 secs Computing kpt #: 126 total cpu time spent up to now is 48.4 secs Computing kpt #: 127 total cpu time spent up to now is 48.8 secs Computing kpt #: 128 total cpu time spent up to now is 49.1 secs Computing kpt #: 129 total cpu time spent up to now is 49.5 secs Computing kpt #: 130 total cpu time spent up to now is 49.9 secs Computing kpt #: 131 total cpu time spent up to now is 50.3 secs Computing kpt #: 132 total cpu time spent up to now is 50.7 secs Computing kpt #: 133 total cpu time spent up to now is 51.1 secs Computing kpt #: 134 total cpu time spent up to now is 51.6 secs Computing kpt #: 135 total cpu time spent up to now is 52.0 secs Computing kpt #: 136 total cpu time spent up to now is 52.4 secs Computing kpt #: 137 total cpu time spent up to now is 52.8 secs Computing kpt #: 138 total cpu time spent up to now is 53.2 secs Computing kpt #: 139 total cpu time spent up to now is 53.6 secs Computing kpt #: 140 total cpu time spent up to now is 54.0 secs Computing kpt #: 141 total cpu time spent up to now is 54.5 secs Computing kpt #: 142 total cpu time spent up to now is 54.9 secs Computing kpt #: 143 total cpu time spent up to now is 55.3 secs Computing kpt #: 144 total cpu time spent up to now is 55.7 secs Computing kpt #: 145 total cpu time spent up to now is 56.2 secs Computing kpt #: 146 total cpu time spent up to now is 56.6 secs Computing kpt #: 147 total cpu time spent up to now is 57.0 secs Computing kpt #: 148 total cpu time spent up to now is 57.5 secs Computing kpt #: 149 total cpu time spent up to now is 57.9 secs Computing kpt #: 150 total cpu time spent up to now is 58.3 secs Computing kpt #: 151 total cpu time spent up to now is 58.8 secs Computing kpt #: 152 total cpu time spent up to now is 59.2 secs Computing kpt #: 153 total cpu time spent up to now is 59.6 secs Computing kpt #: 154 total cpu time spent up to now is 60.1 secs Computing kpt #: 155 total cpu time spent up to now is 60.5 secs Computing kpt #: 156 total cpu time spent up to now is 60.9 secs Computing kpt #: 157 total cpu time spent up to now is 61.4 secs Computing kpt #: 158 total cpu time spent up to now is 61.8 secs Computing kpt #: 159 total cpu time spent up to now is 62.3 secs Computing kpt #: 160 total cpu time spent up to now is 62.7 secs Computing kpt #: 161 total cpu time spent up to now is 63.1 secs Computing kpt #: 162 total cpu time spent up to now is 63.6 secs Computing kpt #: 163 total cpu time spent up to now is 64.0 secs Computing kpt #: 164 total cpu time spent up to now is 64.4 secs Computing kpt #: 165 total cpu time spent up to now is 64.8 secs Computing kpt #: 166 total cpu time spent up to now is 65.3 secs Computing kpt #: 167 total cpu time spent up to now is 65.7 secs Computing kpt #: 168 total cpu time spent up to now is 66.1 secs Computing kpt #: 169 total cpu time spent up to now is 66.5 secs Computing kpt #: 170 total cpu time spent up to now is 66.9 secs Computing kpt #: 171 total cpu time spent up to now is 67.3 secs Computing kpt #: 172 total cpu time spent up to now is 67.7 secs Computing kpt #: 173 total cpu time spent up to now is 68.1 secs Computing kpt #: 174 total cpu time spent up to now is 68.5 secs Computing kpt #: 175 total cpu time spent up to now is 68.9 secs Computing kpt #: 176 total cpu time spent up to now is 69.2 secs Computing kpt #: 177 total cpu time spent up to now is 69.6 secs Computing kpt #: 178 total cpu time spent up to now is 70.0 secs Computing kpt #: 179 total cpu time spent up to now is 70.3 secs Computing kpt #: 180 total cpu time spent up to now is 70.7 secs Computing kpt #: 181 total cpu time spent up to now is 71.0 secs Computing kpt #: 182 total cpu time spent up to now is 71.4 secs Computing kpt #: 183 total cpu time spent up to now is 71.7 secs Computing kpt #: 184 total cpu time spent up to now is 72.1 secs Computing kpt #: 185 total cpu time spent up to now is 72.4 secs Computing kpt #: 186 total cpu time spent up to now is 72.7 secs Computing kpt #: 187 total cpu time spent up to now is 73.1 secs Computing kpt #: 188 total cpu time spent up to now is 73.4 secs Computing kpt #: 189 total cpu time spent up to now is 73.7 secs Computing kpt #: 190 total cpu time spent up to now is 74.0 secs Computing kpt #: 191 total cpu time spent up to now is 74.4 secs Computing kpt #: 192 total cpu time spent up to now is 74.7 secs Computing kpt #: 193 total cpu time spent up to now is 75.0 secs Computing kpt #: 194 total cpu time spent up to now is 75.3 secs Computing kpt #: 195 total cpu time spent up to now is 75.6 secs Computing kpt #: 196 total cpu time spent up to now is 75.9 secs Computing kpt #: 197 total cpu time spent up to now is 76.2 secs Computing kpt #: 198 total cpu time spent up to now is 76.5 secs Computing kpt #: 199 total cpu time spent up to now is 76.9 secs Computing kpt #: 200 total cpu time spent up to now is 77.2 secs Computing kpt #: 201 total cpu time spent up to now is 77.5 secs Computing kpt #: 202 total cpu time spent up to now is 77.8 secs Computing kpt #: 203 total cpu time spent up to now is 78.1 secs Computing kpt #: 204 total cpu time spent up to now is 78.5 secs Computing kpt #: 205 total cpu time spent up to now is 78.8 secs Computing kpt #: 206 total cpu time spent up to now is 79.1 secs Computing kpt #: 207 total cpu time spent up to now is 79.4 secs Computing kpt #: 208 total cpu time spent up to now is 79.8 secs Computing kpt #: 209 total cpu time spent up to now is 80.1 secs Computing kpt #: 210 total cpu time spent up to now is 80.4 secs Computing kpt #: 211 total cpu time spent up to now is 80.7 secs Computing kpt #: 212 total cpu time spent up to now is 81.1 secs Computing kpt #: 213 total cpu time spent up to now is 81.4 secs Computing kpt #: 214 total cpu time spent up to now is 81.8 secs Computing kpt #: 215 total cpu time spent up to now is 82.1 secs Computing kpt #: 216 total cpu time spent up to now is 82.5 secs Computing kpt #: 217 total cpu time spent up to now is 82.8 secs Computing kpt #: 218 total cpu time spent up to now is 83.2 secs Computing kpt #: 219 total cpu time spent up to now is 83.6 secs Computing kpt #: 220 total cpu time spent up to now is 83.9 secs Computing kpt #: 221 total cpu time spent up to now is 84.3 secs Computing kpt #: 222 total cpu time spent up to now is 84.7 secs Computing kpt #: 223 total cpu time spent up to now is 85.0 secs Computing kpt #: 224 total cpu time spent up to now is 85.4 secs Computing kpt #: 225 total cpu time spent up to now is 85.8 secs Computing kpt #: 226 total cpu time spent up to now is 86.2 secs Computing kpt #: 227 total cpu time spent up to now is 86.6 secs Computing kpt #: 228 total cpu time spent up to now is 87.0 secs Computing kpt #: 229 total cpu time spent up to now is 87.4 secs Computing kpt #: 230 total cpu time spent up to now is 87.7 secs Computing kpt #: 231 total cpu time spent up to now is 88.1 secs Computing kpt #: 232 total cpu time spent up to now is 88.5 secs Computing kpt #: 233 total cpu time spent up to now is 88.9 secs Computing kpt #: 234 total cpu time spent up to now is 89.3 secs Computing kpt #: 235 total cpu time spent up to now is 89.7 secs Computing kpt #: 236 total cpu time spent up to now is 90.0 secs Computing kpt #: 237 total cpu time spent up to now is 90.4 secs Computing kpt #: 238 total cpu time spent up to now is 90.8 secs Computing kpt #: 239 total cpu time spent up to now is 91.2 secs Computing kpt #: 240 total cpu time spent up to now is 91.5 secs Computing kpt #: 241 total cpu time spent up to now is 91.9 secs Computing kpt #: 242 total cpu time spent up to now is 92.2 secs Computing kpt #: 243 total cpu time spent up to now is 92.6 secs Computing kpt #: 244 total cpu time spent up to now is 92.9 secs Computing kpt #: 245 total cpu time spent up to now is 93.2 secs Computing kpt #: 246 total cpu time spent up to now is 93.6 secs Computing kpt #: 247 total cpu time spent up to now is 93.9 secs Computing kpt #: 248 total cpu time spent up to now is 94.3 secs Computing kpt #: 249 total cpu time spent up to now is 94.6 secs Computing kpt #: 250 total cpu time spent up to now is 95.0 secs Computing kpt #: 251 total cpu time spent up to now is 95.4 secs Computing kpt #: 252 total cpu time spent up to now is 95.7 secs Computing kpt #: 253 total cpu time spent up to now is 96.1 secs Computing kpt #: 254 total cpu time spent up to now is 96.5 secs Computing kpt #: 255 total cpu time spent up to now is 96.9 secs Computing kpt #: 256 total cpu time spent up to now is 97.3 secs Computing kpt #: 257 total cpu time spent up to now is 97.7 secs Computing kpt #: 258 total cpu time spent up to now is 98.1 secs Computing kpt #: 259 total cpu time spent up to now is 98.5 secs Computing kpt #: 260 total cpu time spent up to now is 98.9 secs Computing kpt #: 261 total cpu time spent up to now is 99.3 secs Computing kpt #: 262 total cpu time spent up to now is 99.7 secs Computing kpt #: 263 total cpu time spent up to now is 100.1 secs Computing kpt #: 264 total cpu time spent up to now is 100.5 secs Computing kpt #: 265 total cpu time spent up to now is 100.9 secs Computing kpt #: 266 total cpu time spent up to now is 101.4 secs Computing kpt #: 267 total cpu time spent up to now is 101.8 secs Computing kpt #: 268 total cpu time spent up to now is 102.2 secs Computing kpt #: 269 total cpu time spent up to now is 102.6 secs Computing kpt #: 270 total cpu time spent up to now is 103.0 secs Computing kpt #: 271 total cpu time spent up to now is 103.5 secs Computing kpt #: 272 total cpu time spent up to now is 103.9 secs Computing kpt #: 273 total cpu time spent up to now is 104.4 secs Computing kpt #: 274 total cpu time spent up to now is 104.8 secs Computing kpt #: 275 total cpu time spent up to now is 105.2 secs Computing kpt #: 276 total cpu time spent up to now is 105.7 secs Computing kpt #: 277 total cpu time spent up to now is 106.2 secs Computing kpt #: 278 total cpu time spent up to now is 106.7 secs Computing kpt #: 279 total cpu time spent up to now is 107.2 secs Computing kpt #: 280 total cpu time spent up to now is 107.7 secs Computing kpt #: 281 total cpu time spent up to now is 108.3 secs Computing kpt #: 282 total cpu time spent up to now is 108.8 secs Computing kpt #: 283 total cpu time spent up to now is 109.3 secs Computing kpt #: 284 total cpu time spent up to now is 109.9 secs Computing kpt #: 285 total cpu time spent up to now is 110.4 secs Computing kpt #: 286 total cpu time spent up to now is 110.9 secs Computing kpt #: 287 total cpu time spent up to now is 111.4 secs Computing kpt #: 288 total cpu time spent up to now is 112.0 secs Computing kpt #: 289 total cpu time spent up to now is 112.5 secs Computing kpt #: 290 total cpu time spent up to now is 113.0 secs Computing kpt #: 291 total cpu time spent up to now is 113.5 secs Computing kpt #: 292 total cpu time spent up to now is 113.9 secs Computing kpt #: 293 total cpu time spent up to now is 114.4 secs Computing kpt #: 294 total cpu time spent up to now is 114.8 secs Computing kpt #: 295 total cpu time spent up to now is 115.3 secs Computing kpt #: 296 total cpu time spent up to now is 115.7 secs Computing kpt #: 297 total cpu time spent up to now is 116.4 secs Computing kpt #: 298 total cpu time spent up to now is 117.0 secs Computing kpt #: 299 total cpu time spent up to now is 117.6 secs Computing kpt #: 300 total cpu time spent up to now is 118.3 secs Computing kpt #: 301 total cpu time spent up to now is 118.8 secs Computing kpt #: 302 total cpu time spent up to now is 119.3 secs Computing kpt #: 303 total cpu time spent up to now is 119.8 secs Computing kpt #: 304 total cpu time spent up to now is 120.3 secs Computing kpt #: 305 total cpu time spent up to now is 120.8 secs Computing kpt #: 306 total cpu time spent up to now is 121.3 secs Computing kpt #: 307 total cpu time spent up to now is 121.7 secs Computing kpt #: 308 total cpu time spent up to now is 122.1 secs Computing kpt #: 309 total cpu time spent up to now is 122.5 secs Computing kpt #: 310 total cpu time spent up to now is 123.0 secs Computing kpt #: 311 total cpu time spent up to now is 123.4 secs Computing kpt #: 312 total cpu time spent up to now is 123.8 secs Computing kpt #: 313 total cpu time spent up to now is 124.2 secs Computing kpt #: 314 total cpu time spent up to now is 124.7 secs Computing kpt #: 315 total cpu time spent up to now is 125.1 secs Computing kpt #: 316 total cpu time spent up to now is 125.5 secs Computing kpt #: 317 total cpu time spent up to now is 125.9 secs Computing kpt #: 318 total cpu time spent up to now is 126.3 secs Computing kpt #: 319 total cpu time spent up to now is 126.7 secs Computing kpt #: 320 total cpu time spent up to now is 127.1 secs Computing kpt #: 321 total cpu time spent up to now is 127.5 secs Computing kpt #: 322 total cpu time spent up to now is 127.9 secs Computing kpt #: 323 total cpu time spent up to now is 128.3 secs Computing kpt #: 324 total cpu time spent up to now is 128.7 secs Computing kpt #: 325 total cpu time spent up to now is 129.0 secs Computing kpt #: 326 total cpu time spent up to now is 129.4 secs Computing kpt #: 327 total cpu time spent up to now is 129.8 secs Computing kpt #: 328 total cpu time spent up to now is 130.2 secs Computing kpt #: 329 total cpu time spent up to now is 130.5 secs Computing kpt #: 330 total cpu time spent up to now is 130.9 secs Computing kpt #: 331 total cpu time spent up to now is 131.3 secs Computing kpt #: 332 total cpu time spent up to now is 131.6 secs Computing kpt #: 333 total cpu time spent up to now is 132.0 secs Computing kpt #: 334 total cpu time spent up to now is 132.3 secs Computing kpt #: 335 total cpu time spent up to now is 132.7 secs Computing kpt #: 336 total cpu time spent up to now is 133.0 secs Computing kpt #: 337 total cpu time spent up to now is 133.3 secs Computing kpt #: 338 total cpu time spent up to now is 133.6 secs Computing kpt #: 339 total cpu time spent up to now is 134.0 secs Computing kpt #: 340 total cpu time spent up to now is 134.3 secs Computing kpt #: 341 total cpu time spent up to now is 134.6 secs Computing kpt #: 342 total cpu time spent up to now is 135.0 secs Computing kpt #: 343 total cpu time spent up to now is 135.3 secs Computing kpt #: 344 total cpu time spent up to now is 135.6 secs Computing kpt #: 345 total cpu time spent up to now is 135.9 secs Computing kpt #: 346 total cpu time spent up to now is 136.2 secs Computing kpt #: 347 total cpu time spent up to now is 136.5 secs Computing kpt #: 348 total cpu time spent up to now is 136.8 secs Computing kpt #: 349 total cpu time spent up to now is 137.1 secs Computing kpt #: 350 total cpu time spent up to now is 137.5 secs Computing kpt #: 351 total cpu time spent up to now is 137.8 secs Computing kpt #: 352 total cpu time spent up to now is 138.1 secs Computing kpt #: 353 total cpu time spent up to now is 138.4 secs Computing kpt #: 354 total cpu time spent up to now is 138.7 secs Computing kpt #: 355 total cpu time spent up to now is 139.0 secs Computing kpt #: 356 total cpu time spent up to now is 139.3 secs Computing kpt #: 357 total cpu time spent up to now is 139.7 secs Computing kpt #: 358 total cpu time spent up to now is 140.0 secs Computing kpt #: 359 total cpu time spent up to now is 140.3 secs Computing kpt #: 360 total cpu time spent up to now is 140.6 secs Computing kpt #: 361 total cpu time spent up to now is 141.0 secs Computing kpt #: 362 total cpu time spent up to now is 141.3 secs Computing kpt #: 363 total cpu time spent up to now is 141.6 secs Computing kpt #: 364 total cpu time spent up to now is 142.0 secs Computing kpt #: 365 total cpu time spent up to now is 142.3 secs Computing kpt #: 366 total cpu time spent up to now is 142.6 secs Computing kpt #: 367 total cpu time spent up to now is 143.0 secs Computing kpt #: 368 total cpu time spent up to now is 143.3 secs Computing kpt #: 369 total cpu time spent up to now is 143.7 secs Computing kpt #: 370 total cpu time spent up to now is 144.1 secs Computing kpt #: 371 total cpu time spent up to now is 144.4 secs Computing kpt #: 372 total cpu time spent up to now is 144.8 secs Computing kpt #: 373 total cpu time spent up to now is 145.2 secs Computing kpt #: 374 total cpu time spent up to now is 145.5 secs Computing kpt #: 375 total cpu time spent up to now is 145.9 secs Computing kpt #: 376 total cpu time spent up to now is 146.3 secs Computing kpt #: 377 total cpu time spent up to now is 146.7 secs Computing kpt #: 378 total cpu time spent up to now is 147.1 secs Computing kpt #: 379 total cpu time spent up to now is 147.5 secs Computing kpt #: 380 total cpu time spent up to now is 147.8 secs Computing kpt #: 381 total cpu time spent up to now is 148.2 secs Computing kpt #: 382 total cpu time spent up to now is 148.6 secs Computing kpt #: 383 total cpu time spent up to now is 149.0 secs Computing kpt #: 384 total cpu time spent up to now is 149.4 secs Computing kpt #: 385 total cpu time spent up to now is 149.8 secs Computing kpt #: 386 total cpu time spent up to now is 150.2 secs Computing kpt #: 387 total cpu time spent up to now is 150.5 secs Computing kpt #: 388 total cpu time spent up to now is 150.9 secs Computing kpt #: 389 total cpu time spent up to now is 151.3 secs Computing kpt #: 390 total cpu time spent up to now is 151.7 secs Computing kpt #: 391 total cpu time spent up to now is 152.0 secs Computing kpt #: 392 total cpu time spent up to now is 152.4 secs Computing kpt #: 393 total cpu time spent up to now is 152.7 secs Computing kpt #: 394 total cpu time spent up to now is 153.1 secs Computing kpt #: 395 total cpu time spent up to now is 153.4 secs Computing kpt #: 396 total cpu time spent up to now is 153.7 secs Computing kpt #: 397 total cpu time spent up to now is 154.1 secs Computing kpt #: 398 total cpu time spent up to now is 154.4 secs Computing kpt #: 399 total cpu time spent up to now is 154.7 secs Computing kpt #: 400 total cpu time spent up to now is 155.1 secs Computing kpt #: 401 total cpu time spent up to now is 155.4 secs Computing kpt #: 402 total cpu time spent up to now is 155.7 secs Computing kpt #: 403 total cpu time spent up to now is 156.1 secs Computing kpt #: 404 total cpu time spent up to now is 156.4 secs Computing kpt #: 405 total cpu time spent up to now is 156.7 secs Computing kpt #: 406 total cpu time spent up to now is 157.1 secs Computing kpt #: 407 total cpu time spent up to now is 157.4 secs Computing kpt #: 408 total cpu time spent up to now is 157.8 secs Computing kpt #: 409 total cpu time spent up to now is 158.2 secs Computing kpt #: 410 total cpu time spent up to now is 158.5 secs Computing kpt #: 411 total cpu time spent up to now is 158.9 secs Computing kpt #: 412 total cpu time spent up to now is 159.3 secs Computing kpt #: 413 total cpu time spent up to now is 159.7 secs Computing kpt #: 414 total cpu time spent up to now is 160.1 secs Computing kpt #: 415 total cpu time spent up to now is 160.5 secs Computing kpt #: 416 total cpu time spent up to now is 160.9 secs Computing kpt #: 417 total cpu time spent up to now is 161.3 secs Computing kpt #: 418 total cpu time spent up to now is 161.7 secs Computing kpt #: 419 total cpu time spent up to now is 162.2 secs Computing kpt #: 420 total cpu time spent up to now is 162.6 secs Computing kpt #: 421 total cpu time spent up to now is 163.0 secs Computing kpt #: 422 total cpu time spent up to now is 163.4 secs Computing kpt #: 423 total cpu time spent up to now is 163.8 secs Computing kpt #: 424 total cpu time spent up to now is 164.3 secs Computing kpt #: 425 total cpu time spent up to now is 164.7 secs Computing kpt #: 426 total cpu time spent up to now is 165.1 secs Computing kpt #: 427 total cpu time spent up to now is 165.5 secs Computing kpt #: 428 total cpu time spent up to now is 166.0 secs Computing kpt #: 429 total cpu time spent up to now is 166.4 secs Computing kpt #: 430 total cpu time spent up to now is 166.8 secs Computing kpt #: 431 total cpu time spent up to now is 167.3 secs Computing kpt #: 432 total cpu time spent up to now is 167.8 secs Computing kpt #: 433 total cpu time spent up to now is 168.2 secs Computing kpt #: 434 total cpu time spent up to now is 168.7 secs Computing kpt #: 435 total cpu time spent up to now is 169.1 secs Computing kpt #: 436 total cpu time spent up to now is 169.6 secs Computing kpt #: 437 total cpu time spent up to now is 170.1 secs Computing kpt #: 438 total cpu time spent up to now is 170.6 secs Computing kpt #: 439 total cpu time spent up to now is 171.1 secs ethr = 2.27E-08, avg # of iterations = 12.7 total cpu time spent up to now is 171.1 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3911 PWs) bands (ev): -63.9834 -63.9834 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0169 -0.0169 -0.0078 -0.0078 0.4274 0.4274 0.4374 0.4374 0.4625 0.4625 4.4542 4.4542 10.2678 10.2678 11.7104 11.7104 11.8204 11.8204 11.9657 11.9657 11.9748 11.9748 11.9836 11.9836 14.2752 14.2752 14.3136 14.3136 14.5458 14.5458 15.0578 15.0578 15.2913 15.2913 15.3386 15.3386 15.3812 15.3812 15.3839 15.3839 15.7501 15.7501 15.7942 15.7942 k = 0.0000 0.0114-0.0000 ( 3907 PWs) bands (ev): -63.9829 -63.9829 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0168 -0.0168 -0.0077 -0.0077 0.4274 0.4274 0.4374 0.4374 0.4625 0.4625 4.4557 4.4557 10.2685 10.2685 11.7099 11.7099 11.8208 11.8208 11.9664 11.9664 11.9755 11.9755 11.9839 11.9839 14.2732 14.2732 14.3117 14.3117 14.5426 14.5426 15.0564 15.0564 15.2899 15.2899 15.3384 15.3384 15.3791 15.3791 15.3811 15.3811 15.7501 15.7501 15.8032 15.8032 k = 0.0000 0.0227-0.0000 ( 3899 PWs) bands (ev): -63.9820 -63.9820 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0167 -0.0167 -0.0077 -0.0077 0.4276 0.4276 0.4375 0.4375 0.4626 0.4626 4.4603 4.4603 10.2709 10.2709 11.7072 11.7072 11.8220 11.8220 11.9683 11.9683 11.9776 11.9776 11.9845 11.9845 14.2664 14.2664 14.3068 14.3068 14.5293 14.5293 15.0520 15.0520 15.2851 15.2851 15.3383 15.3383 15.3667 15.3667 15.3800 15.3800 15.7490 15.7490 15.8291 15.8291 k = 0.0000 0.0341-0.0000 ( 3899 PWs) bands (ev): -63.9819 -63.9819 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0165 -0.0165 -0.0075 -0.0075 0.4279 0.4279 0.4377 0.4377 0.4626 0.4626 4.4678 4.4678 10.2742 10.2742 11.7014 11.7014 11.8244 11.8244 11.9694 11.9694 11.9789 11.9789 11.9850 11.9850 14.2529 14.2529 14.3001 14.3001 14.5034 14.5034 15.0441 15.0441 15.2755 15.2755 15.3348 15.3348 15.3497 15.3497 15.3783 15.3783 15.7461 15.7461 15.8700 15.8700 k = 0.0000 0.0455-0.0000 ( 3899 PWs) bands (ev): -63.9819 -63.9819 -33.7546 -33.7546 -32.5510 -32.5510 -32.5479 -32.5479 -0.0161 -0.0161 -0.0073 -0.0073 0.4283 0.4283 0.4379 0.4379 0.4627 0.4627 4.4784 4.4784 10.2788 10.2788 11.6923 11.6923 11.8285 11.8285 11.9708 11.9708 11.9808 11.9808 11.9857 11.9857 14.2323 14.2323 14.2934 14.2934 14.4694 14.4694 15.0319 15.0319 15.2587 15.2587 15.3233 15.3233 15.3385 15.3385 15.3758 15.3758 15.7419 15.7419 15.9234 15.9234 k = 0.0000 0.0568-0.0000 ( 3903 PWs) bands (ev): -63.9824 -63.9824 -33.7546 -33.7546 -32.5511 -32.5511 -32.5480 -32.5480 -0.0157 -0.0157 -0.0071 -0.0071 0.4288 0.4288 0.4382 0.4382 0.4629 0.4629 4.4919 4.4919 10.2843 10.2843 11.6783 11.6783 11.8347 11.8347 11.9722 11.9722 11.9832 11.9832 11.9865 11.9865 14.2053 14.2053 14.2866 14.2866 14.4280 14.4280 15.0141 15.0141 15.2337 15.2337 15.3052 15.3052 15.3342 15.3342 15.3722 15.3722 15.7350 15.7350 15.9870 15.9871 k = 0.0000 0.0682-0.0000 ( 3903 PWs) bands (ev): -63.9823 -63.9823 -33.7546 -33.7546 -32.5511 -32.5511 -32.5481 -32.5481 -0.0153 -0.0153 -0.0068 -0.0068 0.4294 0.4294 0.4386 0.4386 0.4630 0.4630 4.5084 4.5084 10.2912 10.2912 11.6615 11.6615 11.8433 11.8433 11.9740 11.9740 11.9862 11.9862 11.9879 11.9879 14.1734 14.1734 14.2792 14.2792 14.3834 14.3834 14.9893 14.9893 15.2032 15.2032 15.2882 15.2882 15.3311 15.3311 15.3678 15.3678 15.7281 15.7281 16.0583 16.0583 k = 0.0000 0.0795-0.0000 ( 3911 PWs) bands (ev): -63.9832 -63.9832 -33.7547 -33.7547 -32.5511 -32.5511 -32.5481 -32.5481 -0.0147 -0.0147 -0.0065 -0.0065 0.4301 0.4301 0.4390 0.4390 0.4632 0.4632 4.5279 4.5279 10.2991 10.2991 11.6405 11.6405 11.8544 11.8544 11.9744 11.9744 11.9874 11.9874 11.9897 11.9897 14.1374 14.1374 14.2690 14.2690 14.3337 14.3337 14.9555 14.9555 15.1714 15.1714 15.2709 15.2709 15.3269 15.3269 15.3615 15.3615 15.7198 15.7198 16.1265 16.1265 k = 0.0000 0.0909-0.0000 ( 3911 PWs) bands (ev): -63.9832 -63.9832 -33.7547 -33.7547 -32.5512 -32.5512 -32.5482 -32.5482 -0.0141 -0.0141 -0.0061 -0.0061 0.4309 0.4309 0.4395 0.4395 0.4634 0.4634 4.5504 4.5504 10.3079 10.3079 11.6152 11.6152 11.8679 11.8679 11.9764 11.9764 11.9888 11.9888 11.9943 11.9943 14.0989 14.0989 14.2513 14.2513 14.2928 14.2928 14.9118 14.9118 15.1415 15.1415 15.2541 15.2541 15.3219 15.3219 15.3547 15.3547 15.7101 15.7101 16.1447 16.1447 k = 0.0000 0.1023-0.0000 ( 3915 PWs) bands (ev): -63.9836 -63.9836 -33.7548 -33.7548 -32.5512 -32.5512 -32.5483 -32.5483 -0.0134 -0.0134 -0.0056 -0.0056 0.4317 0.4317 0.4401 0.4401 0.4636 0.4636 4.5758 4.5758 10.3174 10.3174 11.5856 11.5856 11.8838 11.8838 11.9780 11.9780 11.9900 11.9900 11.9986 11.9986 14.0583 14.0583 14.2124 14.2124 14.2696 14.2696 14.8588 14.8588 15.1146 15.1146 15.2359 15.2359 15.3151 15.3151 15.3466 15.3466 15.6991 15.6991 16.1446 16.1446 k = 0.0000 0.1136-0.0000 ( 3923 PWs) bands (ev): -63.9845 -63.9845 -33.7549 -33.7549 -32.5513 -32.5513 -32.5484 -32.5484 -0.0127 -0.0127 -0.0051 -0.0051 0.4326 0.4326 0.4408 0.4408 0.4638 0.4638 4.6042 4.6042 10.3268 10.3268 11.5504 11.5504 11.9015 11.9015 11.9792 11.9792 11.9909 11.9909 12.0047 12.0047 14.0166 14.0166 14.1612 14.1612 14.2569 14.2569 14.7980 14.7980 15.0904 15.0904 15.2165 15.2165 15.3052 15.3052 15.3369 15.3369 15.6838 15.6838 16.1452 16.1452 k = 0.0000 0.1250-0.0000 ( 3927 PWs) bands (ev): -63.9850 -63.9850 -33.7549 -33.7549 -32.5514 -32.5514 -32.5485 -32.5485 -0.0119 -0.0119 -0.0045 -0.0045 0.4335 0.4335 0.4416 0.4416 0.4641 0.4641 4.6355 4.6355 10.3366 10.3366 11.5129 11.5129 11.9221 11.9221 11.9805 11.9805 11.9918 11.9918 12.0112 12.0112 13.9740 13.9740 14.1074 14.1074 14.2459 14.2459 14.7334 14.7334 15.0676 15.0676 15.1954 15.1954 15.2924 15.2924 15.3277 15.3277 15.6717 15.6717 16.1449 16.1449 k = 0.0000 0.1364-0.0000 ( 3927 PWs) bands (ev): -63.9849 -63.9849 -33.7550 -33.7550 -32.5514 -32.5514 -32.5486 -32.5486 -0.0111 -0.0111 -0.0038 -0.0038 0.4345 0.4345 0.4425 0.4425 0.4644 0.4644 4.6697 4.6697 10.3464 10.3464 11.4713 11.4713 11.9443 11.9443 11.9828 11.9828 11.9932 11.9932 12.0186 12.0186 13.9316 13.9316 14.0556 14.0556 14.2351 14.2351 14.6654 14.6654 15.0454 15.0454 15.1742 15.1742 15.2781 15.2781 15.3202 15.3202 15.6568 15.6568 16.1451 16.1451 k = 0.0000 0.1477-0.0000 ( 3931 PWs) bands (ev): -63.9853 -63.9853 -33.7551 -33.7551 -32.5515 -32.5515 -32.5487 -32.5487 -0.0103 -0.0103 -0.0031 -0.0031 0.4354 0.4354 0.4435 0.4435 0.4647 0.4647 4.7068 4.7068 10.3552 10.3552 11.4261 11.4261 11.9683 11.9683 11.9841 11.9841 11.9941 11.9941 12.0267 12.0267 13.8893 13.8893 14.0032 14.0032 14.2239 14.2239 14.5963 14.5963 15.0231 15.0231 15.1511 15.1511 15.2599 15.2599 15.3125 15.3125 15.6404 15.6404 16.1452 16.1452 k = 0.0000 0.1591-0.0000 ( 3923 PWs) bands (ev): -63.9843 -63.9843 -33.7551 -33.7551 -32.5515 -32.5515 -32.5487 -32.5487 -0.0095 -0.0095 -0.0023 -0.0023 0.4363 0.4363 0.4447 0.4447 0.4650 0.4650 4.7468 4.7468 10.3630 10.3630 11.3786 11.3786 11.9880 11.9880 11.9928 11.9928 11.9977 11.9977 12.0361 12.0361 13.8480 13.8480 13.9560 13.9560 14.2124 14.2124 14.5277 14.5277 15.0002 15.0002 15.1291 15.1291 15.2427 15.2427 15.3068 15.3068 15.6240 15.6240 16.1465 16.1465 k = 0.0000 0.1705-0.0000 ( 3927 PWs) bands (ev): -63.9847 -63.9847 -33.7552 -33.7552 -32.5516 -32.5516 -32.5488 -32.5488 -0.0087 -0.0087 -0.0014 -0.0014 0.4372 0.4372 0.4459 0.4459 0.4654 0.4654 4.7896 4.7896 10.3678 10.3678 11.3284 11.3284 11.9895 11.9895 11.9966 11.9966 12.0214 12.0214 12.0461 12.0461 13.8073 13.8073 13.9067 13.9067 14.2001 14.2001 14.4596 14.4596 14.9763 14.9763 15.1041 15.1041 15.2205 15.2205 15.2994 15.2994 15.6049 15.6049 16.1464 16.1464 k = 0.0000 0.1818-0.0000 ( 3919 PWs) bands (ev): -63.9837 -63.9837 -33.7553 -33.7553 -32.5517 -32.5517 -32.5489 -32.5489 -0.0079 -0.0079 -0.0004 -0.0004 0.4381 0.4381 0.4473 0.4473 0.4657 0.4657 4.8352 4.8352 10.3698 10.3698 11.2781 11.2781 11.9929 11.9929 11.9986 11.9986 12.0463 12.0463 12.0611 12.0611 13.7681 13.7681 13.8621 13.8621 14.1875 14.1875 14.3944 14.3944 14.9515 14.9515 15.0803 15.0803 15.2000 15.2000 15.2936 15.2936 15.5868 15.5868 16.1479 16.1479 k = 0.0000 0.1932-0.0000 ( 3911 PWs) bands (ev): -63.9826 -63.9826 -33.7553 -33.7553 -32.5518 -32.5518 -32.5489 -32.5489 -0.0072 -0.0072 0.0006 0.0006 0.4390 0.4390 0.4488 0.4488 0.4661 0.4661 4.8835 4.8835 10.3670 10.3670 11.2286 11.2286 11.9958 11.9958 12.0004 12.0004 12.0617 12.0617 12.0874 12.0874 13.7304 13.7304 13.8190 13.8190 14.1743 14.1743 14.3326 14.3326 14.9255 14.9255 15.0553 15.0553 15.1777 15.1777 15.2879 15.2879 15.5692 15.5692 16.1482 16.1482 k = 0.0000 0.2045-0.0000 ( 3920 PWs) bands (ev): -63.9837 -63.9837 -33.7554 -33.7554 -32.5519 -32.5519 -32.5491 -32.5491 -0.0064 -0.0064 0.0017 0.0017 0.4398 0.4398 0.4504 0.4504 0.4665 0.4665 4.9345 4.9345 10.3565 10.3565 11.1802 11.1802 11.9961 11.9961 12.0003 12.0003 12.0722 12.0722 12.1189 12.1189 13.6938 13.6938 13.7747 13.7747 14.1605 14.1605 14.2731 14.2731 14.8983 14.8983 15.0270 15.0270 15.1497 15.1497 15.2783 15.2783 15.5481 15.5481 16.1460 16.1460 k = 0.0000 0.2159-0.0000 ( 3932 PWs) bands (ev): -63.9851 -63.9851 -33.7555 -33.7555 -32.5521 -32.5521 -32.5492 -32.5492 -0.0057 -0.0057 0.0029 0.0029 0.4407 0.4407 0.4520 0.4520 0.4669 0.4669 4.9881 4.9881 10.3375 10.3375 11.1367 11.1367 11.9949 11.9949 11.9991 11.9991 12.0827 12.0827 12.1528 12.1528 13.6586 13.6586 13.7313 13.7313 14.1463 14.1463 14.2175 14.2175 14.8699 14.8699 14.9963 14.9963 15.1182 15.1182 15.2684 15.2684 15.5274 15.5274 16.1448 16.1448 k = 0.0000 0.2273-0.0000 ( 3932 PWs) bands (ev): -63.9851 -63.9851 -33.7556 -33.7556 -32.5522 -32.5522 -32.5492 -32.5492 -0.0050 -0.0050 0.0041 0.0041 0.4414 0.4414 0.4537 0.4537 0.4673 0.4673 5.0444 5.0444 10.3081 10.3081 11.1006 11.1006 11.9955 11.9955 11.9994 11.9994 12.0938 12.0938 12.1882 12.1882 13.6257 13.6257 13.6934 13.6934 14.1317 14.1317 14.1661 14.1661 14.8406 14.8406 14.9678 14.9678 15.0900 15.0900 15.2588 15.2588 15.5079 15.5079 16.1447 16.1447 k = 0.0000 0.2386-0.0000 ( 3932 PWs) bands (ev): -63.9850 -63.9850 -33.7557 -33.7557 -32.5523 -32.5523 -32.5493 -32.5493 -0.0043 -0.0043 0.0053 0.0053 0.4422 0.4422 0.4554 0.4554 0.4677 0.4677 5.1032 5.1032 10.2668 10.2668 11.0728 11.0728 11.9955 11.9955 11.9996 11.9996 12.1052 12.1052 12.2250 12.2250 13.5949 13.5949 13.6580 13.6580 14.1145 14.1145 14.1210 14.1210 14.8102 14.8102 14.9389 14.9389 15.0611 15.0611 15.2477 15.2477 15.4891 15.4891 16.1447 16.1447 k = 0.0000 0.2500-0.0000 ( 3948 PWs) bands (ev): -63.9869 -63.9869 -33.7558 -33.7558 -32.5525 -32.5525 -32.5494 -32.5494 -0.0037 -0.0037 0.0066 0.0066 0.4430 0.4430 0.4572 0.4572 0.4682 0.4682 5.1644 5.1644 10.2117 10.2117 11.0523 11.0523 11.9937 11.9937 11.9983 11.9983 12.1166 12.1166 12.2621 12.2621 13.5656 13.5656 13.6238 13.6238 14.0720 14.0720 14.1028 14.1028 14.7785 14.7785 14.9075 14.9075 15.0284 15.0284 15.2289 15.2289 15.4658 15.4658 16.1444 16.1444 k = 0.0000 0.2614-0.0000 ( 3948 PWs) bands (ev): -63.9868 -63.9868 -33.7559 -33.7559 -32.5526 -32.5526 -32.5495 -32.5495 -0.0030 -0.0030 0.0078 0.0078 0.4437 0.4437 0.4589 0.4589 0.4687 0.4687 5.2281 5.2281 10.1458 10.1458 11.0428 11.0428 11.9925 11.9925 11.9982 11.9982 12.1284 12.1284 12.3010 12.3010 13.5388 13.5388 13.5937 13.5937 14.0323 14.0323 14.0876 14.0876 14.7464 14.7464 14.8780 14.8780 14.9985 14.9985 15.2139 15.2139 15.4492 15.4492 16.1444 16.1444 k = 0.0000 0.2727-0.0000 ( 3948 PWs) bands (ev): -63.9868 -63.9868 -33.7560 -33.7560 -32.5528 -32.5528 -32.5495 -32.5495 -0.0024 -0.0024 0.0091 0.0091 0.4444 0.4444 0.4607 0.4607 0.4692 0.4692 5.2940 5.2940 10.0691 10.0691 11.0413 11.0413 11.9908 11.9908 11.9979 11.9979 12.1402 12.1402 12.3407 12.3407 13.5140 13.5140 13.5661 13.5661 13.9963 13.9963 14.0724 14.0724 14.7135 14.7135 14.8484 14.8484 14.9683 14.9683 15.1964 15.1964 15.4343 15.4343 16.1444 16.1444 k = 0.0000 0.2841-0.0000 ( 3948 PWs) bands (ev): -63.9867 -63.9867 -33.7561 -33.7561 -32.5529 -32.5529 -32.5496 -32.5496 -0.0018 -0.0018 0.0104 0.0104 0.4451 0.4451 0.4623 0.4623 0.4697 0.4697 5.3621 5.3621 9.9834 9.9834 11.0467 11.0467 11.9883 11.9883 11.9969 11.9969 12.1520 12.1520 12.3814 12.3814 13.4913 13.4913 13.5410 13.5410 13.9649 13.9649 14.0572 14.0572 14.6804 14.6804 14.8182 14.8182 14.9370 14.9370 15.1783 15.1783 15.4215 15.4215 16.1442 16.1442 k = 0.0000 0.2955-0.0000 ( 3948 PWs) bands (ev): -63.9866 -63.9866 -33.7561 -33.7561 -32.5531 -32.5531 -32.5496 -32.5496 -0.0012 -0.0012 0.0116 0.0116 0.4458 0.4458 0.4640 0.4640 0.4703 0.4703 5.4323 5.4323 9.8902 9.8902 11.0575 11.0575 11.9857 11.9857 11.9959 11.9959 12.1639 12.1639 12.4223 12.4223 13.4708 13.4708 13.5186 13.5186 13.9359 13.9359 14.0421 14.0421 14.6466 14.6466 14.7888 14.7888 14.9067 14.9067 15.1561 15.1561 15.4102 15.4102 16.1442 16.1442 k = 0.0000 0.3068-0.0000 ( 3952 PWs) bands (ev): -63.9871 -63.9871 -33.7562 -33.7562 -32.5532 -32.5532 -32.5497 -32.5497 -0.0006 -0.0006 0.0128 0.0128 0.4464 0.4464 0.4654 0.4654 0.4710 0.4710 5.5044 5.5044 9.7905 9.7905 11.0733 11.0733 11.9830 11.9830 11.9947 11.9947 12.1740 12.1740 12.4631 12.4631 13.4523 13.4523 13.4986 13.4986 13.9080 13.9080 14.0269 14.0269 14.6125 14.6125 14.7600 14.7600 14.8772 14.8772 15.1283 15.1283 15.4025 15.4025 16.1409 16.1409 k = 0.0000 0.3182-0.0000 ( 3960 PWs) bands (ev): -63.9880 -63.9880 -33.7563 -33.7563 -32.5534 -32.5534 -32.5497 -32.5497 -0.0001 -0.0001 0.0140 0.0140 0.4471 0.4471 0.4667 0.4667 0.4718 0.4718 5.5781 5.5781 9.6868 9.6868 11.0910 11.0910 11.9782 11.9782 11.9915 11.9915 12.1856 12.1856 12.5044 12.5044 13.4353 13.4353 13.4805 13.4805 13.8846 13.8846 14.0121 14.0121 14.5784 14.5784 14.7295 14.7295 14.8446 14.8446 15.1003 15.1003 15.3938 15.3938 16.1407 16.1407 k = 0.0000 0.3295-0.0000 ( 3960 PWs) bands (ev): -63.9880 -63.9880 -33.7564 -33.7564 -32.5536 -32.5536 -32.5497 -32.5497 0.0004 0.0004 0.0152 0.0152 0.4477 0.4477 0.4678 0.4678 0.4728 0.4728 5.6534 5.6534 9.5804 9.5804 11.1112 11.1112 11.9746 11.9746 11.9897 11.9897 12.1971 12.1971 12.5458 12.5458 13.4208 13.4208 13.4654 13.4654 13.8646 13.8646 13.9977 13.9977 14.5445 14.5445 14.7016 14.7016 14.8155 14.8155 15.0723 15.0723 15.3874 15.3874 16.1407 16.1407 k = 0.0000 0.3409-0.0000 ( 3952 PWs) bands (ev): -63.9870 -63.9870 -33.7565 -33.7565 -32.5537 -32.5537 -32.5497 -32.5497 0.0009 0.0009 0.0163 0.0163 0.4483 0.4483 0.4687 0.4687 0.4739 0.4739 5.7300 5.7300 9.4724 9.4724 11.1339 11.1339 11.9715 11.9715 11.9882 11.9882 12.2092 12.2092 12.5872 12.5872 13.4082 13.4082 13.4524 13.4524 13.8490 13.8490 13.9838 13.9838 14.5111 14.5111 14.6749 14.6749 14.7880 14.7880 15.0474 15.0474 15.3839 15.3839 16.1426 16.1426 k = 0.0000 0.3523-0.0000 ( 3952 PWs) bands (ev): -63.9869 -63.9869 -33.7565 -33.7565 -32.5538 -32.5538 -32.5498 -32.5498 0.0014 0.0014 0.0174 0.0174 0.4488 0.4488 0.4694 0.4694 0.4751 0.4751 5.8075 5.8075 9.3630 9.3630 11.1565 11.1565 11.9675 11.9675 11.9859 11.9859 12.2200 12.2200 12.6276 12.6276 13.3973 13.3973 13.4413 13.4413 13.8339 13.8339 13.9702 13.9702 14.4782 14.4782 14.6486 14.6486 14.7606 14.7606 15.0177 15.0177 15.3795 15.3795 16.1425 16.1425 k = 0.0000 0.3636-0.0000 ( 3960 PWs) bands (ev): -63.9879 -63.9879 -33.7566 -33.7566 -32.5540 -32.5540 -32.5498 -32.5498 0.0018 0.0018 0.0184 0.0184 0.4493 0.4493 0.4699 0.4699 0.4764 0.4764 5.8856 5.8856 9.2534 9.2534 11.1792 11.1792 11.9619 11.9619 11.9822 11.9822 12.2293 12.2293 12.6672 12.6672 13.3877 13.3877 13.4318 13.4318 13.8210 13.8210 13.9572 13.9572 14.4460 14.4460 14.6210 14.6210 14.7306 14.7306 14.9876 14.9876 15.3756 15.3756 16.1405 16.1405 k = 0.0000 0.3750-0.0000 ( 3952 PWs) bands (ev): -63.9869 -63.9869 -33.7566 -33.7566 -32.5541 -32.5541 -32.5498 -32.5498 0.0022 0.0022 0.0193 0.0193 0.4498 0.4498 0.4704 0.4704 0.4777 0.4777 5.9640 5.9640 9.1454 9.1454 11.2022 11.2022 11.9591 11.9591 11.9808 11.9808 12.2393 12.2393 12.7058 12.7058 13.3803 13.3803 13.4245 13.4245 13.8118 13.8118 13.9449 13.9449 14.4149 14.4149 14.5990 14.5990 14.7084 14.7084 14.9610 14.9610 15.3732 15.3732 16.1405 16.1405 k = 0.0000 0.3864-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7567 -33.7567 -32.5541 -32.5541 -32.5498 -32.5498 0.0026 0.0026 0.0202 0.0202 0.4503 0.4503 0.4708 0.4708 0.4789 0.4789 6.0419 6.0419 9.0390 9.0390 11.2244 11.2244 11.9554 11.9554 11.9784 11.9784 12.2488 12.2488 12.7429 12.7429 13.3740 13.3740 13.4185 13.4185 13.8046 13.8046 13.9333 13.9333 14.3852 14.3852 14.5768 14.5768 14.6853 14.6853 14.9354 14.9354 15.3708 15.3708 16.1405 16.1405 k = 0.0000 0.3977-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7567 -33.7567 -32.5542 -32.5542 -32.5498 -32.5498 0.0029 0.0029 0.0210 0.0210 0.4507 0.4507 0.4711 0.4711 0.4800 0.4800 6.1188 6.1188 8.9353 8.9353 11.2457 11.2457 11.9515 11.9515 11.9759 11.9759 12.2575 12.2575 12.7780 12.7780 13.3689 13.3689 13.4138 13.4138 13.7972 13.7972 13.9226 13.9226 14.3569 14.3569 14.5558 14.5558 14.6632 14.6632 14.9073 14.9073 15.3688 15.3688 16.1404 16.1404 k = 0.0000 0.4091-0.0000 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7568 -33.7568 -32.5544 -32.5544 -32.5499 -32.5499 0.0032 0.0032 0.0217 0.0217 0.4511 0.4511 0.4714 0.4714 0.4811 0.4811 6.1939 6.1939 8.8351 8.8351 11.2657 11.2657 11.9477 11.9477 11.9734 11.9734 12.2656 12.2656 12.8108 12.8108 13.3648 13.3648 13.4102 13.4102 13.7892 13.7892 13.9127 13.9127 14.3303 14.3303 14.5363 14.5363 14.6426 14.6426 14.8767 14.8767 15.3672 15.3672 16.1404 16.1404 k = 0.0000 0.4205-0.0000 ( 3952 PWs) bands (ev): -63.9867 -63.9867 -33.7568 -33.7568 -32.5545 -32.5545 -32.5499 -32.5499 0.0035 0.0035 0.0224 0.0224 0.4514 0.4514 0.4717 0.4717 0.4820 0.4820 6.2661 6.2661 8.7406 8.7406 11.2842 11.2842 11.9442 11.9442 11.9712 11.9712 12.2730 12.2730 12.8411 12.8411 13.3617 13.3617 13.4076 13.4076 13.7845 13.7845 13.9038 13.9038 14.3061 14.3061 14.5189 14.5189 14.6243 14.6243 14.8518 14.8518 15.3659 15.3659 16.1404 16.1404 k = 0.0000 0.4318-0.0000 ( 3948 PWs) bands (ev): -63.9862 -63.9862 -33.7569 -33.7569 -32.5545 -32.5545 -32.5499 -32.5499 0.0038 0.0038 0.0229 0.0229 0.4517 0.4517 0.4719 0.4719 0.4829 0.4829 6.3342 6.3342 8.6532 8.6532 11.2992 11.2992 11.9419 11.9419 11.9696 11.9696 12.2789 12.2789 12.8686 12.8686 13.3594 13.3594 13.4057 13.4057 13.7836 13.7836 13.8960 13.8960 14.2844 14.2844 14.5043 14.5043 14.6094 14.6094 14.8358 14.8358 15.3615 15.3615 16.1392 16.1392 k = 0.0000 0.4432-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7569 -33.7569 -32.5546 -32.5546 -32.5499 -32.5499 0.0040 0.0040 0.0234 0.0234 0.4519 0.4519 0.4721 0.4721 0.4836 0.4836 6.3967 6.3967 8.5736 8.5736 11.3129 11.3129 11.9371 11.9371 11.9662 11.9662 12.2841 12.2841 12.8925 12.8925 13.3576 13.3576 13.4044 13.4044 13.7807 13.7807 13.8892 13.8892 14.2653 14.2653 14.4886 14.4886 14.5917 14.5917 14.8156 14.8156 15.3592 15.3592 16.1384 16.1384 k = 0.0000 0.4545-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7570 -33.7570 -32.5546 -32.5546 -32.5499 -32.5499 0.0041 0.0041 0.0238 0.0238 0.4522 0.4522 0.4722 0.4722 0.4842 0.4842 6.4519 6.4519 8.5044 8.5044 11.3250 11.3250 11.9347 11.9347 11.9646 11.9646 12.2888 12.2888 12.9126 12.9126 13.3564 13.3564 13.4036 13.4036 13.7788 13.7788 13.8836 13.8836 14.2492 14.2492 14.4775 14.4775 14.5799 14.5799 14.7987 14.7987 15.3585 15.3585 16.1383 16.1383 k = 0.0000 0.4659-0.0000 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0043 0.0043 0.0241 0.0241 0.4523 0.4523 0.4723 0.4723 0.4847 0.4847 6.4978 6.4978 8.4469 8.4469 11.3346 11.3346 11.9324 11.9324 11.9630 11.9630 12.2924 12.2924 12.9287 12.9287 13.3556 13.3556 13.4031 13.4031 13.7739 13.7739 13.8792 13.8792 14.2363 14.2363 14.4682 14.4682 14.5699 14.5699 14.7761 14.7761 15.3580 15.3580 16.1383 16.1383 k = 0.0000 0.4773-0.0000 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0044 0.0044 0.0244 0.0244 0.4524 0.4524 0.4724 0.4724 0.4850 0.4850 6.5325 6.5325 8.4043 8.4043 11.3433 11.3433 11.9315 11.9315 11.9623 11.9623 12.2966 12.2966 12.9404 12.9404 13.3551 13.3551 13.4029 13.4029 13.7740 13.7740 13.8760 13.8760 14.2270 14.2270 14.4625 14.4625 14.5641 14.5641 14.7680 14.7680 15.3618 15.3618 16.1408 16.1408 k = 0.0000 0.4886-0.0000 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0044 0.0044 0.0245 0.0245 0.4525 0.4525 0.4725 0.4725 0.4852 0.4852 6.5541 6.5541 8.3778 8.3778 11.3476 11.3476 11.9307 11.9307 11.9618 11.9618 12.2982 12.2982 12.9476 12.9476 13.3549 13.3549 13.4028 13.4028 13.7735 13.7735 13.8741 13.8741 14.2214 14.2214 14.4587 14.4587 14.5601 14.5601 14.7619 14.7619 15.3616 15.3616 16.1407 16.1407 k = 0.0000 0.5000-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0000 0.5000-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0114 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4526 0.4526 0.4725 0.4725 0.4853 0.4853 6.5626 6.5626 8.3705 8.3705 11.3493 11.3493 11.9319 11.9319 11.9606 11.9606 12.2986 12.2986 12.9502 12.9502 13.3543 13.3543 13.4010 13.4010 13.7754 13.7754 13.8726 13.8726 14.2165 14.2165 14.4611 14.4611 14.5648 14.5648 14.7603 14.7603 15.3598 15.3598 16.1383 16.1383 k = 0.0227 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0045 0.0045 0.0245 0.0245 0.4526 0.4526 0.4724 0.4724 0.4853 0.4853 6.5658 6.5658 8.3747 8.3747 11.3517 11.3517 11.9310 11.9310 11.9539 11.9539 12.2994 12.2994 12.9507 12.9507 13.3525 13.3525 13.3962 13.3962 13.7799 13.7799 13.8699 13.8699 14.2078 14.2078 14.4644 14.4644 14.5708 14.5708 14.7602 14.7602 15.3577 15.3577 16.1329 16.1329 k = 0.0341 0.5000-0.0000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0047 0.0047 0.0245 0.0245 0.4528 0.4528 0.4724 0.4724 0.4854 0.4854 6.5713 6.5713 8.3819 8.3819 11.3552 11.3552 11.9291 11.9291 11.9447 11.9447 12.3002 12.3002 12.9516 12.9516 13.3486 13.3486 13.3897 13.3897 13.7869 13.7869 13.8658 13.8658 14.1946 14.1946 14.4698 14.4698 14.5851 14.5851 14.7602 14.7602 15.3526 15.3526 16.1232 16.1232 k = 0.0455 0.5000-0.0000 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0048 0.0048 0.0245 0.0245 0.4530 0.4530 0.4723 0.4723 0.4855 0.4855 6.5790 6.5790 8.3920 8.3920 11.3608 11.3608 11.9237 11.9237 11.9336 11.9336 12.3022 12.3022 12.9527 12.9527 13.3409 13.3409 13.3834 13.3834 13.7958 13.7958 13.8608 13.8608 14.1780 14.1780 14.4753 14.4753 14.6035 14.6035 14.7608 14.7608 15.3482 15.3482 16.1112 16.1112 k = 0.0568 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0050 0.0050 0.0245 0.0245 0.4533 0.4533 0.4722 0.4722 0.4856 0.4856 6.5888 6.5888 8.4051 8.4051 11.3694 11.3694 11.9118 11.9118 11.9282 11.9282 12.3066 12.3066 12.9542 12.9542 13.3285 13.3285 13.3793 13.3793 13.8052 13.8052 13.8563 13.8563 14.1596 14.1596 14.4848 14.4848 14.6285 14.6285 14.7635 14.7635 15.3449 15.3449 16.0993 16.0993 k = 0.0682 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0052 0.0052 0.0245 0.0245 0.4536 0.4536 0.4721 0.4721 0.4857 0.4857 6.6009 6.6009 8.4210 8.4210 11.3771 11.3771 11.8930 11.8930 11.9260 11.9260 12.3094 12.3094 12.9559 12.9559 13.3116 13.3116 13.3773 13.3773 13.8105 13.8105 13.8550 13.8550 14.1402 14.1402 14.4959 14.4959 14.6558 14.6558 14.7630 14.7630 15.3365 15.3365 16.0801 16.0801 k = 0.0795 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5549 -32.5549 -32.5500 -32.5500 0.0055 0.0055 0.0245 0.0245 0.4540 0.4540 0.4719 0.4719 0.4859 0.4859 6.6150 6.6150 8.4396 8.4396 11.3879 11.3879 11.8684 11.8684 11.9236 11.9236 12.3134 12.3134 12.9575 12.9575 13.2916 13.2916 13.3767 13.3767 13.8090 13.8090 13.8607 13.8607 14.1197 14.1197 14.5075 14.5075 14.6812 14.6812 14.7649 14.7649 15.3291 15.3291 16.0590 16.0590 k = 0.0909 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5549 -32.5549 -32.5501 -32.5501 0.0058 0.0058 0.0245 0.0245 0.4544 0.4544 0.4717 0.4717 0.4862 0.4862 6.6314 6.6314 8.4610 8.4610 11.4004 11.4004 11.8398 11.8398 11.9209 11.9209 12.3179 12.3179 12.9591 12.9591 13.2695 13.2695 13.3771 13.3771 13.8014 13.8014 13.8722 13.8722 14.0993 14.0993 14.5200 14.5200 14.7070 14.7070 14.7671 14.7671 15.3211 15.3211 16.0349 16.0349 k = 0.1023 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7571 -33.7571 -32.5549 -32.5549 -32.5501 -32.5501 0.0061 0.0061 0.0245 0.0245 0.4549 0.4549 0.4715 0.4715 0.4865 0.4865 6.6498 6.6498 8.4852 8.4852 11.4154 11.4154 11.8080 11.8080 11.9174 11.9174 12.3215 12.3215 12.9606 12.9606 13.2456 13.2456 13.3781 13.3781 13.7905 13.7905 13.8862 13.8862 14.0797 14.0797 14.5328 14.5328 14.7347 14.7347 14.7692 14.7692 15.3139 15.3139 16.0054 16.0054 k = 0.1136 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9866 -63.9866 -33.7572 -33.7572 -32.5549 -32.5549 -32.5501 -32.5501 0.0065 0.0065 0.0245 0.0245 0.4554 0.4554 0.4713 0.4713 0.4868 0.4868 6.6704 6.6704 8.5121 8.5121 11.4310 11.4310 11.7728 11.7728 11.9156 11.9156 12.3279 12.3279 12.9619 12.9619 13.2207 13.2207 13.3795 13.3795 13.7779 13.7779 13.9009 13.9009 14.0613 14.0613 14.5482 14.5482 14.7620 14.7620 14.7713 14.7713 15.3035 15.3035 15.9779 15.9779 k = 0.1250 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7572 -33.7572 -32.5550 -32.5550 -32.5502 -32.5502 0.0069 0.0069 0.0245 0.0245 0.4559 0.4559 0.4710 0.4710 0.4872 0.4872 6.6931 6.6931 8.5414 8.5414 11.4480 11.4480 11.7332 11.7332 11.9113 11.9113 12.3338 12.3338 12.9626 12.9626 13.1949 13.1949 13.3813 13.3813 13.7643 13.7643 13.9149 13.9149 14.0441 14.0441 14.5615 14.5615 14.7704 14.7704 14.7883 14.7883 15.2923 15.2923 15.9460 15.9460 k = 0.1364 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7572 -33.7572 -32.5551 -32.5551 -32.5502 -32.5502 0.0073 0.0073 0.0245 0.0245 0.4564 0.4564 0.4707 0.4707 0.4877 0.4877 6.7179 6.7179 8.5735 8.5735 11.4657 11.4657 11.6907 11.6907 11.9079 11.9079 12.3415 12.3415 12.9629 12.9629 13.1687 13.1687 13.3835 13.3835 13.7502 13.7502 13.9282 13.9282 14.0294 14.0294 14.5766 14.5766 14.7719 14.7719 14.8137 14.8137 15.2784 15.2784 15.9144 15.9144 k = 0.1477 0.5000-0.0000 ( 3968 PWs) bands (ev): -63.9885 -63.9885 -33.7573 -33.7573 -32.5552 -32.5552 -32.5503 -32.5503 0.0077 0.0077 0.0244 0.0244 0.4570 0.4570 0.4703 0.4703 0.4882 0.4882 6.7447 6.7447 8.6079 8.6079 11.4843 11.4843 11.6443 11.6443 11.9021 11.9021 12.3471 12.3471 12.9623 12.9623 13.1413 13.1413 13.3859 13.3859 13.7356 13.7356 13.9381 13.9381 14.0183 14.0183 14.5891 14.5891 14.7684 14.7684 14.8376 14.8376 15.2627 15.2627 15.8763 15.8763 k = 0.1591 0.5000-0.0000 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7574 -33.7574 -32.5552 -32.5552 -32.5503 -32.5503 0.0081 0.0081 0.0244 0.0244 0.4576 0.4576 0.4700 0.4700 0.4888 0.4888 6.7735 6.7735 8.6452 8.6452 11.5056 11.5056 11.5970 11.5970 11.8983 11.8983 12.3531 12.3531 12.9618 12.9618 13.1143 13.1143 13.3886 13.3886 13.7211 13.7211 13.9445 13.9445 14.0139 14.0139 14.6046 14.6046 14.7675 14.7675 14.8648 14.8648 15.2490 15.2490 15.8369 15.8369 k = 0.1705 0.5000-0.0000 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7574 -33.7574 -32.5553 -32.5553 -32.5504 -32.5504 0.0086 0.0086 0.0244 0.0244 0.4581 0.4581 0.4696 0.4696 0.4895 0.4895 6.8044 6.8044 8.6847 8.6847 11.5272 11.5272 11.5457 11.5457 11.8939 11.8939 12.3612 12.3612 12.9602 12.9602 13.0876 13.0876 13.3915 13.3915 13.7066 13.7066 13.9455 13.9455 14.0158 14.0158 14.6192 14.6192 14.7667 14.7667 14.8888 14.8888 15.2330 15.2330 15.7987 15.7987 k = 0.1818 0.5000-0.0000 ( 3962 PWs) bands (ev): -63.9878 -63.9878 -33.7574 -33.7574 -32.5553 -32.5553 -32.5504 -32.5504 0.0091 0.0091 0.0244 0.0244 0.4587 0.4587 0.4692 0.4692 0.4902 0.4902 6.8371 6.8371 8.7266 8.7266 11.4923 11.4923 11.5498 11.5498 11.8901 11.8901 12.3704 12.3704 12.9582 12.9582 13.0612 13.0612 13.3947 13.3947 13.6922 13.6922 13.9427 13.9427 14.0233 14.0233 14.6350 14.6350 14.7637 14.7637 14.9131 14.9131 15.2164 15.2164 15.7604 15.7604 k = 0.1932 0.5000-0.0000 ( 3962 PWs) bands (ev): -63.9877 -63.9877 -33.7575 -33.7575 -32.5554 -32.5554 -32.5504 -32.5504 0.0095 0.0095 0.0243 0.0243 0.4592 0.4592 0.4688 0.4688 0.4910 0.4910 6.8718 6.8718 8.7707 8.7707 11.4355 11.4355 11.5732 11.5732 11.8852 11.8852 12.3793 12.3793 12.9550 12.9550 13.0350 13.0350 13.3981 13.3981 13.6781 13.6781 13.9380 13.9380 14.0337 14.0337 14.6492 14.6492 14.7609 14.7609 14.9345 14.9345 15.1984 15.1984 15.7199 15.7199 k = 0.2045 0.5000-0.0000 ( 3958 PWs) bands (ev): -63.9872 -63.9872 -33.7575 -33.7575 -32.5554 -32.5554 -32.5505 -32.5505 0.0100 0.0100 0.0243 0.0243 0.4597 0.4597 0.4685 0.4685 0.4918 0.4918 6.9084 6.9084 8.8170 8.8170 11.3761 11.3761 11.5979 11.5979 11.8810 11.8810 12.3886 12.3886 12.9507 12.9507 13.0099 13.0099 13.4017 13.4017 13.6644 13.6644 13.9336 13.9336 14.0456 14.0456 14.6643 14.6643 14.7597 14.7597 14.9543 14.9543 15.1802 15.1802 15.6788 15.6788 k = 0.2159 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7576 -33.7576 -32.5555 -32.5555 -32.5505 -32.5505 0.0105 0.0105 0.0243 0.0243 0.4602 0.4602 0.4681 0.4681 0.4927 0.4927 6.9467 6.9467 8.8653 8.8653 11.3144 11.3144 11.6229 11.6229 11.8757 11.8757 12.3988 12.3988 12.9452 12.9452 12.9852 12.9852 13.4056 13.4056 13.6510 13.6510 13.9301 13.9301 14.0578 14.0578 14.6778 14.6778 14.7555 14.7555 14.9726 14.9726 15.1604 15.1604 15.6382 15.6382 k = 0.2273 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7576 -33.7576 -32.5556 -32.5556 -32.5505 -32.5505 0.0110 0.0110 0.0242 0.0242 0.4606 0.4606 0.4678 0.4678 0.4937 0.4937 6.9868 6.9868 8.9152 8.9152 11.2501 11.2501 11.6482 11.6482 11.8716 11.8716 12.4092 12.4092 12.9373 12.9373 12.9620 12.9620 13.4096 13.4096 13.6381 13.6381 13.9278 13.9278 14.0695 14.0695 14.6926 14.6926 14.7475 14.7475 14.9880 14.9880 15.1391 15.1391 15.5969 15.5969 k = 0.2386 0.5000-0.0000 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7577 -33.7577 -32.5556 -32.5556 -32.5505 -32.5505 0.0114 0.0114 0.0242 0.0242 0.4609 0.4609 0.4676 0.4676 0.4947 0.4947 7.0286 7.0286 8.9673 8.9673 11.1852 11.1852 11.6742 11.6742 11.8663 11.8663 12.4203 12.4203 12.9254 12.9254 12.9452 12.9452 13.4139 13.4139 13.6257 13.6257 13.9279 13.9279 14.0813 14.0813 14.7055 14.7055 14.7414 14.7414 15.0040 15.0040 15.1185 15.1185 15.5562 15.5562 k = 0.2500 0.5000-0.0000 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7577 -33.7577 -32.5557 -32.5557 -32.5506 -32.5506 0.0119 0.0119 0.0241 0.0241 0.4611 0.4611 0.4675 0.4675 0.4957 0.4957 7.0720 7.0720 9.0207 9.0207 11.1173 11.1173 11.6997 11.6997 11.8607 11.8607 12.4304 12.4304 12.9061 12.9061 12.9341 12.9341 13.4183 13.4183 13.6139 13.6139 13.9291 13.9291 14.0925 14.0925 14.7172 14.7172 14.7327 14.7327 15.0148 15.0148 15.0967 15.0967 15.5136 15.5136 k = 0.2614 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7578 -33.7578 -32.5558 -32.5558 -32.5506 -32.5506 0.0123 0.0123 0.0241 0.0241 0.4612 0.4612 0.4674 0.4674 0.4968 0.4968 7.1168 7.1168 9.0755 9.0755 11.0478 11.0478 11.7236 11.7236 11.8551 11.8551 12.4406 12.4406 12.8851 12.8851 12.9252 12.9252 13.4229 13.4229 13.6026 13.6026 13.9319 13.9319 14.1028 14.1028 14.7173 14.7173 14.7304 14.7304 15.0202 15.0202 15.0760 15.0760 15.4711 15.4711 k = 0.2727 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7578 -33.7578 -32.5559 -32.5559 -32.5506 -32.5506 0.0127 0.0127 0.0241 0.0241 0.4612 0.4612 0.4674 0.4674 0.4979 0.4979 7.1631 7.1631 9.1319 9.1319 10.9774 10.9774 11.7495 11.7495 11.8494 11.8494 12.4483 12.4483 12.8645 12.8645 12.9173 12.9173 13.4277 13.4277 13.5920 13.5920 13.9366 13.9366 14.1127 14.1127 14.7058 14.7058 14.7406 14.7406 15.0160 15.0160 15.0647 15.0647 15.4250 15.4250 k = 0.2841 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7579 -33.7579 -32.5560 -32.5560 -32.5507 -32.5507 0.0131 0.0131 0.0240 0.0240 0.4611 0.4611 0.4675 0.4675 0.4990 0.4990 7.2106 7.2106 9.1891 9.1891 10.9053 10.9053 11.7737 11.7737 11.8438 11.8438 12.4586 12.4586 12.8449 12.8449 12.9084 12.9084 13.4325 13.4325 13.5820 13.5820 13.9426 13.9426 14.1221 14.1221 14.6926 14.6926 14.7510 14.7510 14.9973 14.9973 15.0623 15.0623 15.3834 15.3834 k = 0.2955 0.5000-0.0000 ( 3954 PWs) bands (ev): -63.9865 -63.9865 -33.7579 -33.7579 -32.5561 -32.5561 -32.5507 -32.5507 0.0135 0.0135 0.0240 0.0240 0.4609 0.4609 0.4677 0.4677 0.5002 0.5002 7.2593 7.2593 9.2470 9.2470 10.8321 10.8321 11.7965 11.7965 11.8383 11.8383 12.4689 12.4689 12.8266 12.8266 12.8989 12.8989 13.4375 13.4375 13.5727 13.5727 13.9499 13.9499 14.1306 14.1306 14.6777 14.6777 14.7608 14.7608 14.9710 14.9710 15.0634 15.0634 15.3426 15.3426 k = 0.3068 0.5000-0.0000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7580 -33.7580 -32.5562 -32.5562 -32.5507 -32.5507 0.0139 0.0139 0.0240 0.0240 0.4606 0.4606 0.4680 0.4680 0.5013 0.5013 7.3089 7.3089 9.3055 9.3055 10.7580 10.7580 11.8187 11.8187 11.8325 11.8325 12.4781 12.4781 12.8095 12.8095 12.8886 12.8886 13.4425 13.4425 13.5641 13.5641 13.9583 13.9583 14.1385 14.1385 14.6633 14.6633 14.7695 14.7695 14.9412 14.9412 15.0640 15.0640 15.3015 15.3015 k = 0.3182 0.5000-0.0000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7580 -33.7580 -32.5563 -32.5563 -32.5508 -32.5508 0.0142 0.0142 0.0239 0.0239 0.4603 0.4603 0.4682 0.4682 0.5024 0.5024 7.3593 7.3593 9.3645 9.3645 10.6847 10.6847 11.8269 11.8269 11.8379 11.8379 12.4893 12.4893 12.7938 12.7938 12.8804 12.8804 13.4475 13.4475 13.5561 13.5561 13.9683 13.9683 14.1452 14.1452 14.6454 14.6454 14.7775 14.7775 14.9088 14.9088 15.0653 15.0653 15.2643 15.2643 k = 0.3295 0.5000-0.0000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7581 -33.7581 -32.5564 -32.5564 -32.5508 -32.5508 0.0145 0.0145 0.0239 0.0239 0.4600 0.4600 0.4685 0.4685 0.5036 0.5036 7.4104 7.4104 9.4234 9.4234 10.6107 10.6107 11.8215 11.8215 11.8570 11.8570 12.4985 12.4985 12.7808 12.7808 12.8706 12.8706 13.4525 13.4525 13.5490 13.5490 13.9790 13.9790 14.1516 14.1516 14.6307 14.6307 14.7846 14.7846 14.8772 14.8772 15.0641 15.0641 15.2255 15.2255 k = 0.3409 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9862 -63.9862 -33.7581 -33.7581 -32.5564 -32.5564 -32.5508 -32.5508 0.0147 0.0147 0.0239 0.0239 0.4596 0.4596 0.4688 0.4688 0.5047 0.5047 7.4617 7.4617 9.4821 9.4821 10.5378 10.5378 11.8166 11.8166 11.8737 11.8737 12.5096 12.5096 12.7703 12.7703 12.8623 12.8623 13.4572 13.4572 13.5426 13.5426 13.9907 13.9907 14.1567 14.1567 14.6142 14.6142 14.7904 14.7904 14.8459 14.8459 15.0620 15.0620 15.1923 15.1923 k = 0.3523 0.5000-0.0000 ( 3960 PWs) bands (ev): -63.9871 -63.9871 -33.7582 -33.7582 -32.5566 -32.5566 -32.5508 -32.5508 0.0150 0.0150 0.0239 0.0239 0.4593 0.4593 0.4691 0.4691 0.5057 0.5057 7.5132 7.5132 9.5397 9.5397 10.4646 10.4646 11.8117 11.8117 11.8867 11.8867 12.5180 12.5180 12.7615 12.7615 12.8517 12.8517 13.4617 13.4617 13.5370 13.5370 14.0027 14.0027 14.1603 14.1603 14.5927 14.5927 14.7876 14.7876 14.8207 14.8207 15.0571 15.0571 15.1566 15.1566 k = 0.3636 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7582 -33.7582 -32.5566 -32.5566 -32.5508 -32.5508 0.0152 0.0152 0.0239 0.0239 0.4589 0.4589 0.4693 0.4693 0.5067 0.5067 7.5643 7.5643 9.5967 9.5967 10.3935 10.3935 11.8089 11.8089 11.8986 11.8986 12.5250 12.5250 12.7556 12.7556 12.8430 12.8430 13.4658 13.4658 13.5324 13.5324 14.0153 14.0153 14.1634 14.1634 14.5788 14.5788 14.7659 14.7659 14.8183 14.8183 15.0513 15.0513 15.1214 15.1214 k = 0.3750 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7582 -33.7582 -32.5567 -32.5567 -32.5508 -32.5508 0.0154 0.0154 0.0239 0.0239 0.4586 0.4586 0.4696 0.4696 0.5077 0.5077 7.6149 7.6149 9.6518 9.6518 10.3243 10.3243 11.8054 11.8054 11.9066 11.9066 12.5338 12.5338 12.7514 12.7514 12.8354 12.8354 13.4694 13.4694 13.5288 13.5288 14.0280 14.0280 14.1647 14.1647 14.5560 14.5560 14.7348 14.7348 14.8234 14.8234 15.0439 15.0439 15.0926 15.0926 k = 0.3864 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7583 -33.7583 -32.5568 -32.5568 -32.5508 -32.5508 0.0156 0.0156 0.0240 0.0240 0.4583 0.4583 0.4698 0.4698 0.5086 0.5086 7.6644 7.6644 9.7049 9.7049 10.2572 10.2572 11.8013 11.8013 11.9129 11.9129 12.5416 12.5416 12.7498 12.7498 12.8275 12.8275 13.4723 13.4723 13.5262 13.5262 14.0408 14.0408 14.1651 14.1651 14.5374 14.5374 14.7036 14.7036 14.8280 14.8280 15.0331 15.0331 15.0673 15.0673 k = 0.3977 0.5000-0.0000 ( 3952 PWs) bands (ev): -63.9861 -63.9861 -33.7583 -33.7583 -32.5568 -32.5568 -32.5508 -32.5508 0.0157 0.0157 0.0240 0.0240 0.4580 0.4580 0.4701 0.4701 0.5095 0.5095 7.7123 7.7123 9.7556 9.7556 10.1933 10.1933 11.7983 11.7983 11.9167 11.9167 12.5495 12.5495 12.7503 12.7503 12.8213 12.8213 13.4744 13.4744 13.5247 13.5247 14.0533 14.0533 14.1642 14.1642 14.5184 14.5184 14.6739 14.6739 14.8338 14.8338 15.0185 15.0185 15.0492 15.0492 k = 0.4091 0.5000-0.0000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7583 -33.7583 -32.5569 -32.5569 -32.5508 -32.5508 0.0158 0.0158 0.0240 0.0240 0.4577 0.4577 0.4703 0.4703 0.5103 0.5103 7.7581 7.7581 9.8030 9.8030 10.1326 10.1326 11.7947 11.7947 11.9180 11.9180 12.5550 12.5550 12.7524 12.7524 12.8142 12.8142 13.4756 13.4756 13.5243 13.5243 14.0653 14.0653 14.1620 14.1620 14.4983 14.4983 14.6463 14.6463 14.8379 14.8379 14.9975 14.9975 15.0358 15.0358 k = 0.4205 0.5000-0.0000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7584 -33.7584 -32.5570 -32.5570 -32.5508 -32.5508 0.0159 0.0159 0.0240 0.0240 0.4575 0.4575 0.4704 0.4704 0.5110 0.5110 7.8011 7.8011 9.8468 9.8468 10.0764 10.0764 11.7915 11.7915 11.9174 11.9174 12.5612 12.5612 12.7539 12.7539 12.8083 12.8083 13.4761 13.4761 13.5248 13.5248 14.0767 14.0767 14.1586 14.1586 14.4824 14.4824 14.6213 14.6213 14.8415 14.8415 14.9778 14.9778 15.0261 15.0261 k = 0.4318 0.5000-0.0000 ( 3954 PWs) bands (ev): -63.9864 -63.9864 -33.7584 -33.7584 -32.5570 -32.5570 -32.5508 -32.5508 0.0160 0.0160 0.0241 0.0241 0.4573 0.4573 0.4706 0.4706 0.5116 0.5116 7.8407 7.8407 9.8866 9.8866 10.0254 10.0254 11.7888 11.7888 11.9159 11.9159 12.5665 12.5665 12.7588 12.7588 12.8035 12.8035 13.4761 13.4761 13.5259 13.5259 14.0872 14.0872 14.1548 14.1548 14.4711 14.4711 14.6000 14.6000 14.8448 14.8448 14.9592 14.9592 15.0177 15.0177 k = 0.4432 0.5000-0.0000 ( 3950 PWs) bands (ev): -63.9859 -63.9859 -33.7584 -33.7584 -32.5570 -32.5570 -32.5508 -32.5508 0.0161 0.0161 0.0241 0.0241 0.4571 0.4571 0.4707 0.4707 0.5122 0.5122 7.8760 7.8760 9.9209 9.9209 9.9806 9.9806 11.7875 11.7875 11.9133 11.9133 12.5715 12.5715 12.7643 12.7643 12.7991 12.7991 13.4758 13.4758 13.5273 13.5273 14.0966 14.0966 14.1500 14.1500 14.4577 14.4577 14.5820 14.5820 14.8495 14.8495 14.9440 14.9440 15.0103 15.0103 k = 0.4545 0.5000-0.0000 ( 3946 PWs) bands (ev): -63.9854 -63.9854 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0161 0.0161 0.0241 0.0241 0.4570 0.4570 0.4708 0.4708 0.5126 0.5126 7.9064 7.9064 9.9372 9.9372 9.9551 9.9551 11.7859 11.7859 11.9103 11.9103 12.5761 12.5761 12.7701 12.7701 12.7953 12.7953 13.4753 13.4753 13.5288 13.5288 14.1048 14.1048 14.1450 14.1450 14.4480 14.4480 14.5674 14.5674 14.8527 14.8527 14.9321 14.9321 15.0040 15.0040 k = 0.4659 0.5000-0.0000 ( 3942 PWs) bands (ev): -63.9849 -63.9849 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0161 0.0161 0.0241 0.0241 0.4568 0.4568 0.4709 0.4709 0.5129 0.5129 7.9310 7.9310 9.9089 9.9089 9.9755 9.9755 11.7852 11.7852 11.9072 11.9072 12.5812 12.5812 12.7750 12.7750 12.7918 12.7918 13.4747 13.4747 13.5301 13.5301 14.1115 14.1115 14.1401 14.1401 14.4393 14.4393 14.5561 14.5561 14.8557 14.8557 14.9250 14.9250 14.9988 14.9988 k = 0.4773 0.5000-0.0000 ( 3938 PWs) bands (ev): -63.9844 -63.9844 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4568 0.4568 0.4710 0.4710 0.5132 0.5132 7.9491 7.9491 9.8868 9.8868 9.9926 9.9926 11.7841 11.7841 11.9047 11.9047 12.5835 12.5835 12.7788 12.7788 12.7908 12.7908 13.4743 13.4743 13.5311 13.5311 14.1168 14.1168 14.1359 14.1359 14.4344 14.4344 14.5481 14.5481 14.8571 14.8571 14.9177 14.9177 14.9950 14.9950 k = 0.4886 0.5000-0.0000 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4710 0.4710 0.5134 0.5134 7.9602 7.9602 9.8730 9.8730 10.0034 10.0034 11.7835 11.7835 11.9031 11.9031 12.5851 12.5851 12.7819 12.7819 12.7899 12.7899 13.4740 13.4740 13.5318 13.5318 14.1205 14.1205 14.1327 14.1327 14.4375 14.4375 14.5433 14.5433 14.8578 14.8578 14.9135 14.9135 14.9926 14.9926 k = 0.5000 0.5000-0.0000 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4710 0.4710 0.5134 0.5134 7.9640 7.9640 9.8684 9.8684 10.0069 10.0069 11.7833 11.7833 11.9025 11.9025 12.5855 12.5855 12.7826 12.7826 12.7895 12.7895 13.4739 13.4739 13.5320 13.5320 14.1219 14.1219 14.1314 14.1314 14.4361 14.4361 14.5418 14.5418 14.8581 14.8581 14.9119 14.9119 14.9918 14.9918 k = 0.5000 0.5000-0.0000 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4710 0.4710 0.5134 0.5134 7.9640 7.9640 9.8684 9.8684 10.0069 10.0069 11.7833 11.7833 11.9025 11.9025 12.5855 12.5855 12.7826 12.7826 12.7895 12.7895 13.4739 13.4739 13.5320 13.5320 14.1219 14.1219 14.1314 14.1314 14.4361 14.4361 14.5418 14.5418 14.8581 14.8581 14.9119 14.9119 14.9918 14.9918 k = 0.4918 0.4918-0.0000 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4710 0.4710 0.5134 0.5134 7.9602 7.9602 9.8692 9.8692 10.0074 10.0074 11.7835 11.7835 11.9032 11.9032 12.5850 12.5850 12.7824 12.7824 12.7894 12.7894 13.4740 13.4740 13.5321 13.5321 14.1195 14.1195 14.1348 14.1348 14.4359 14.4359 14.5432 14.5432 14.8578 14.8578 14.9133 14.9133 14.9931 14.9931 k = 0.4836 0.4836-0.0000 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0161 0.0161 0.0242 0.0242 0.4568 0.4568 0.4710 0.4710 0.5132 0.5132 7.9487 7.9487 9.8712 9.8712 10.0087 10.0087 11.7843 11.7843 11.9051 11.9051 12.5835 12.5835 12.7807 12.7807 12.7884 12.7884 13.4735 13.4735 13.5330 13.5330 14.1156 14.1156 14.1414 14.1414 14.4334 14.4334 14.5476 14.5476 14.8568 14.8568 14.9170 14.9170 14.9967 14.9967 k = 0.4754 0.4754-0.0000 ( 3940 PWs) bands (ev): -63.9846 -63.9846 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0161 0.0161 0.0242 0.0242 0.4568 0.4568 0.4709 0.4709 0.5129 0.5129 7.9297 7.9297 9.8753 9.8753 10.0114 10.0114 11.7854 11.7854 11.9082 11.9082 12.5811 12.5811 12.7766 12.7766 12.7909 12.7909 13.4707 13.4707 13.5365 13.5365 14.1122 14.1122 14.1492 14.1492 14.4252 14.4252 14.5547 14.5547 14.8550 14.8550 14.9232 14.9232 15.0026 15.0026 k = 0.4672 0.4672-0.0000 ( 3954 PWs) bands (ev): -63.9864 -63.9864 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0160 0.0160 0.0242 0.0242 0.4570 0.4570 0.4707 0.4707 0.5126 0.5126 7.9033 7.9033 9.8805 9.8805 10.0153 10.0153 11.7857 11.7857 11.9119 11.9119 12.5763 12.5763 12.7677 12.7677 12.7943 12.7943 13.4636 13.4636 13.5445 13.5445 14.1095 14.1095 14.1579 14.1579 14.4162 14.4162 14.5644 14.5644 14.8500 14.8500 14.9288 14.9288 15.0103 15.0103 k = 0.4590 0.4590-0.0000 ( 3954 PWs) bands (ev): -63.9864 -63.9864 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0158 0.0158 0.0242 0.0242 0.4571 0.4571 0.4706 0.4706 0.5121 0.5121 7.8696 7.8696 9.8872 9.8872 10.0214 10.0214 11.7881 11.7881 11.9159 11.9159 12.5731 12.5731 12.7603 12.7603 12.7994 12.7994 13.4517 13.4517 13.5574 13.5574 14.1074 14.1074 14.1673 14.1673 14.4155 14.4155 14.5763 14.5763 14.8475 14.8475 14.9405 14.9405 15.0201 15.0201 k = 0.4508 0.4508-0.0000 ( 3954 PWs) bands (ev): -63.9864 -63.9864 -33.7584 -33.7584 -32.5570 -32.5570 -32.5508 -32.5508 0.0157 0.0157 0.0242 0.0242 0.4573 0.4573 0.4704 0.4704 0.5115 0.5115 7.8291 7.8291 9.8953 9.8953 10.0297 10.0297 11.7909 11.7909 11.9198 11.9198 12.5696 12.5696 12.7513 12.7513 12.8058 12.8058 13.4357 13.4357 13.5748 13.5748 14.1059 14.1059 14.1771 14.1771 14.4157 14.4157 14.5901 14.5901 14.8443 14.8443 14.9546 14.9546 15.0316 15.0316 k = 0.4426 0.4426-0.0000 ( 3962 PWs) bands (ev): -63.9873 -63.9873 -33.7584 -33.7584 -32.5570 -32.5570 -32.5508 -32.5508 0.0155 0.0155 0.0242 0.0242 0.4574 0.4574 0.4701 0.4701 0.5109 0.5109 7.7819 7.7819 9.9044 9.9044 10.0402 10.0402 11.7932 11.7932 11.9229 11.9229 12.5652 12.5652 12.7393 12.7393 12.8128 12.8128 13.4160 13.4160 13.5959 13.5959 14.1047 14.1047 14.1870 14.1870 14.4152 14.4152 14.6054 14.6054 14.8388 14.8388 14.9692 14.9692 15.0444 15.0444 k = 0.4344 0.4344-0.0000 ( 3966 PWs) bands (ev): -63.9878 -63.9878 -33.7583 -33.7583 -32.5570 -32.5570 -32.5508 -32.5508 0.0153 0.0153 0.0242 0.0242 0.4577 0.4577 0.4698 0.4698 0.5101 0.5101 7.7285 7.7285 9.9147 9.9147 10.0536 10.0536 11.7967 11.7967 11.9248 11.9248 12.5618 12.5618 12.7289 12.7289 12.8207 12.8207 13.3932 13.3932 13.6203 13.6203 14.1034 14.1034 14.1969 14.1969 14.4146 14.4146 14.6217 14.6217 14.8341 14.8341 14.9866 14.9866 15.0581 15.0581 k = 0.4262 0.4262-0.0000 ( 3962 PWs) bands (ev): -63.9873 -63.9873 -33.7583 -33.7583 -32.5569 -32.5569 -32.5508 -32.5508 0.0150 0.0150 0.0242 0.0242 0.4579 0.4579 0.4695 0.4695 0.5093 0.5093 7.6693 7.6693 9.9268 9.9268 10.0699 10.0699 11.8010 11.8010 11.9253 11.9253 12.5598 12.5598 12.7166 12.7166 12.8316 12.8316 13.3680 13.3680 13.6475 13.6475 14.1021 14.1021 14.2072 14.2072 14.4228 14.4228 14.6389 14.6389 14.8300 14.8300 15.0073 15.0073 15.0739 15.0739 k = 0.4180 0.4180-0.0000 ( 3966 PWs) bands (ev): -63.9878 -63.9878 -33.7583 -33.7583 -32.5569 -32.5569 -32.5508 -32.5508 0.0147 0.0147 0.0242 0.0242 0.4581 0.4581 0.4692 0.4692 0.5083 0.5083 7.6048 7.6048 9.9403 9.9403 10.0891 10.0891 11.8037 11.8037 11.9238 11.9238 12.5563 12.5563 12.7030 12.7030 12.8438 12.8438 13.3401 13.3401 13.6770 13.6770 14.1001 14.1001 14.2176 14.2176 14.4317 14.4317 14.6563 14.6563 14.8224 14.8224 15.0259 15.0259 15.0905 15.0905 k = 0.4098 0.4098-0.0000 ( 3964 PWs) bands (ev): -63.9876 -63.9876 -33.7582 -33.7582 -32.5568 -32.5568 -32.5507 -32.5507 0.0144 0.0144 0.0242 0.0242 0.4584 0.4584 0.4689 0.4689 0.5073 0.5073 7.5354 7.5354 9.9552 9.9552 10.1112 10.1112 11.8080 11.8080 11.9200 11.9200 12.5561 12.5561 12.6893 12.6893 12.8559 12.8559 13.3106 13.3106 13.7088 13.7088 14.0971 14.0971 14.2287 14.2287 14.4453 14.4453 14.6734 14.6734 14.8170 14.8170 15.0488 15.0488 15.1085 15.1085 k = 0.4016 0.4016-0.0000 ( 3964 PWs) bands (ev): -63.9876 -63.9876 -33.7582 -33.7582 -32.5567 -32.5567 -32.5507 -32.5507 0.0140 0.0140 0.0242 0.0242 0.4586 0.4586 0.4685 0.4685 0.5062 0.5062 7.4616 7.4616 9.9719 9.9719 10.1359 10.1359 11.8122 11.8122 11.9139 11.9139 12.5566 12.5566 12.6745 12.6745 12.8705 12.8705 13.2793 13.2793 13.7425 13.7425 14.0927 14.0927 14.2394 14.2394 14.4587 14.4587 14.6901 14.6901 14.8109 14.8109 15.0721 15.0721 15.1272 15.1272 k = 0.3934 0.3934-0.0000 ( 3962 PWs) bands (ev): -63.9873 -63.9873 -33.7581 -33.7581 -32.5567 -32.5567 -32.5507 -32.5507 0.0136 0.0136 0.0241 0.0241 0.4588 0.4588 0.4681 0.4681 0.5050 0.5050 7.3840 7.3840 9.9908 9.9908 10.1628 10.1628 11.8164 11.8164 11.9056 11.9056 12.5590 12.5590 12.6582 12.6582 12.8890 12.8890 13.2465 13.2465 13.7779 13.7779 14.0870 14.0870 14.2502 14.2502 14.4736 14.4736 14.7065 14.7065 14.8048 14.8048 15.0963 15.0963 15.1468 15.1468 k = 0.3852 0.3852-0.0000 ( 3962 PWs) bands (ev): -63.9873 -63.9873 -33.7581 -33.7581 -32.5566 -32.5566 -32.5506 -32.5506 0.0132 0.0132 0.0240 0.0240 0.4590 0.4590 0.4678 0.4678 0.5037 0.5037 7.3030 7.3030 10.0111 10.0111 10.1925 10.1925 11.8202 11.8202 11.8949 11.8949 12.5618 12.5618 12.6418 12.6418 12.9074 12.9074 13.2122 13.2122 13.8147 13.8147 14.0794 14.0794 14.2628 14.2628 14.4938 14.4938 14.7213 14.7213 14.7981 14.7981 15.1199 15.1199 15.1675 15.1675 k = 0.3770 0.3770-0.0000 ( 3962 PWs) bands (ev): -63.9874 -63.9874 -33.7580 -33.7580 -32.5565 -32.5565 -32.5506 -32.5506 0.0128 0.0128 0.0239 0.0239 0.4592 0.4592 0.4674 0.4674 0.5023 0.5023 7.2191 7.2191 10.0329 10.0329 10.2246 10.2246 11.8240 11.8240 11.8820 11.8820 12.5673 12.5673 12.6250 12.6250 12.9251 12.9251 13.1769 13.1769 13.8527 13.8527 14.0698 14.0698 14.2771 14.2771 14.5176 14.5176 14.7340 14.7340 14.7923 14.7923 15.1444 15.1444 15.1895 15.1895 k = 0.3689 0.3689-0.0000 ( 3950 PWs) bands (ev): -63.9859 -63.9859 -33.7580 -33.7580 -32.5563 -32.5563 -32.5505 -32.5505 0.0123 0.0123 0.0238 0.0238 0.4593 0.4593 0.4670 0.4670 0.5009 0.5009 7.1328 7.1328 10.0566 10.0566 10.2590 10.2590 11.8298 11.8298 11.8672 11.8672 12.5764 12.5764 12.6088 12.6088 12.9461 12.9461 13.1416 13.1416 13.8922 13.8922 14.0588 14.0588 14.2929 14.2929 14.5433 14.5433 14.7449 14.7449 14.7920 14.7920 15.1716 15.1716 15.2139 15.2139 k = 0.3607 0.3607-0.0000 ( 3940 PWs) bands (ev): -63.9847 -63.9847 -33.7579 -33.7579 -32.5562 -32.5562 -32.5504 -32.5504 0.0118 0.0118 0.0236 0.0236 0.4594 0.4594 0.4667 0.4667 0.4994 0.4994 7.0445 7.0445 10.0821 10.0821 10.2957 10.2957 11.8342 11.8342 11.8509 11.8509 12.5839 12.5839 12.5954 12.5954 12.9703 12.9703 13.1049 13.1049 13.9319 13.9319 14.0464 14.0464 14.3092 14.3092 14.5694 14.5694 14.7517 14.7517 14.7931 14.7931 15.1966 15.1966 15.2382 15.2382 k = 0.3525 0.3525-0.0000 ( 3940 PWs) bands (ev): -63.9848 -63.9848 -33.7578 -33.7578 -32.5561 -32.5561 -32.5504 -32.5504 0.0112 0.0112 0.0234 0.0234 0.4593 0.4593 0.4665 0.4665 0.4979 0.4979 6.9546 6.9546 10.1088 10.1088 10.3337 10.3337 11.8321 11.8321 11.8378 11.8378 12.5718 12.5718 12.6005 12.6005 12.9937 12.9937 13.0679 13.0679 13.9700 13.9700 14.0336 14.0336 14.3262 14.3262 14.5962 14.5962 14.7515 14.7515 14.7977 14.7977 15.2202 15.2202 15.2627 15.2627 k = 0.3443 0.3443-0.0000 ( 3932 PWs) bands (ev): -63.9838 -63.9838 -33.7577 -33.7577 -32.5560 -32.5560 -32.5503 -32.5503 0.0106 0.0106 0.0232 0.0232 0.4592 0.4592 0.4663 0.4663 0.4962 0.4962 6.8636 6.8636 10.1371 10.1371 10.3735 10.3735 11.8131 11.8131 11.8415 11.8415 12.5533 12.5533 12.6158 12.6158 13.0157 13.0157 13.0356 13.0356 13.9945 13.9945 14.0341 14.0341 14.3450 14.3450 14.6251 14.6251 14.7492 14.7492 14.8067 14.8067 15.2444 15.2444 15.2894 15.2894 k = 0.3361 0.3361-0.0000 ( 3922 PWs) bands (ev): -63.9826 -63.9826 -33.7576 -33.7576 -32.5558 -32.5558 -32.5502 -32.5502 0.0100 0.0100 0.0229 0.0229 0.4589 0.4589 0.4662 0.4662 0.4946 0.4946 6.7717 6.7717 10.1664 10.1664 10.4151 10.4151 11.7934 11.7934 11.8448 11.8448 12.5342 12.5342 12.6333 12.6333 12.9904 12.9904 13.0510 13.0510 13.9866 13.9866 14.0663 14.0663 14.3668 14.3668 14.6569 14.6569 14.7447 14.7447 14.8172 14.8172 15.2689 15.2689 15.3170 15.3170 k = 0.3279 0.3279-0.0000 ( 3924 PWs) bands (ev): -63.9829 -63.9829 -33.7576 -33.7576 -32.5557 -32.5557 -32.5502 -32.5502 0.0094 0.0094 0.0226 0.0226 0.4585 0.4585 0.4661 0.4661 0.4929 0.4929 6.6793 6.6793 10.1964 10.1964 10.4578 10.4578 11.7726 11.7726 11.8473 11.8473 12.5131 12.5131 12.6516 12.6516 12.9524 12.9524 13.0789 13.0789 13.9677 13.9677 14.1069 14.1069 14.3874 14.3874 14.6853 14.6853 14.7392 14.7392 14.8275 14.8275 15.2906 15.2906 15.3428 15.3428 k = 0.3197 0.3197-0.0000 ( 3936 PWs) bands (ev): -63.9844 -63.9844 -33.7575 -33.7575 -32.5556 -32.5556 -32.5502 -32.5502 0.0087 0.0087 0.0222 0.0222 0.4580 0.4580 0.4661 0.4661 0.4911 0.4911 6.5867 6.5867 10.2267 10.2267 10.5017 10.5017 11.7514 11.7514 11.8488 11.8488 12.4907 12.4907 12.6701 12.6701 12.9125 12.9125 13.1094 13.1094 13.9452 13.9452 14.1488 14.1488 14.4074 14.4074 14.7045 14.7045 14.7391 14.7391 14.8375 14.8375 15.3094 15.3094 15.3661 15.3661 k = 0.3115 0.3115-0.0000 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7575 -33.7575 -32.5555 -32.5555 -32.5502 -32.5502 0.0080 0.0080 0.0217 0.0217 0.4574 0.4574 0.4662 0.4662 0.4893 0.4893 6.4942 6.4942 10.2573 10.2573 10.5467 10.5467 11.7303 11.7303 11.8497 11.8497 12.4682 12.4682 12.6921 12.6921 12.8732 12.8732 13.1402 13.1402 13.9207 13.9207 14.1909 14.1909 14.4283 14.4283 14.7040 14.7040 14.7590 14.7590 14.8473 14.8473 15.3276 15.3276 15.3903 15.3903 k = 0.3033 0.3033-0.0000 ( 3952 PWs) bands (ev): -63.9864 -63.9864 -33.7574 -33.7574 -32.5554 -32.5554 -32.5501 -32.5501 0.0073 0.0073 0.0212 0.0212 0.4568 0.4568 0.4662 0.4662 0.4875 0.4875 6.4021 6.4021 10.2879 10.2879 10.5926 10.5926 11.7105 11.7105 11.8516 11.8516 12.4453 12.4453 12.7173 12.7173 12.8346 12.8346 13.1749 13.1749 13.8964 13.8964 14.2335 14.2335 14.4506 14.4506 14.6974 14.6974 14.7887 14.7887 14.8583 14.8583 15.3461 15.3461 15.4162 15.4162 k = 0.2951 0.2951-0.0000 ( 3952 PWs) bands (ev): -63.9865 -63.9865 -33.7573 -33.7573 -32.5553 -32.5553 -32.5501 -32.5501 0.0066 0.0066 0.0207 0.0207 0.4560 0.4560 0.4663 0.4663 0.4856 0.4856 6.3107 6.3107 10.3181 10.3181 10.6395 10.6395 11.6920 11.6920 11.8538 11.8538 12.4222 12.4222 12.7441 12.7441 12.7971 12.7971 13.2117 13.2117 13.8722 13.8722 14.2759 14.2759 14.4750 14.4750 14.6901 14.6901 14.8211 14.8211 14.8709 14.8709 15.3650 15.3650 15.4426 15.4426 k = 0.2869 0.2869-0.0000 ( 3952 PWs) bands (ev): -63.9865 -63.9865 -33.7572 -33.7572 -32.5551 -32.5551 -32.5500 -32.5500 0.0058 0.0058 0.0201 0.0201 0.4553 0.4553 0.4664 0.4664 0.4837 0.4837 6.2201 6.2201 10.3474 10.3474 10.6870 10.6870 11.6753 11.6753 11.8559 11.8559 12.3989 12.3989 12.7524 12.7524 12.7802 12.7802 13.2508 13.2508 13.8483 13.8483 14.3177 14.3177 14.4999 14.4999 14.6826 14.6826 14.8516 14.8516 14.8865 14.8865 15.3829 15.3829 15.4685 15.4685 k = 0.2787 0.2787-0.0000 ( 3946 PWs) bands (ev): -63.9858 -63.9858 -33.7571 -33.7571 -32.5550 -32.5550 -32.5499 -32.5499 0.0050 0.0050 0.0194 0.0194 0.4544 0.4544 0.4665 0.4665 0.4818 0.4818 6.1306 6.1306 10.3756 10.3756 10.7353 10.7353 11.6607 11.6607 11.8587 11.8587 12.3757 12.3757 12.7178 12.7178 12.8104 12.8104 13.2914 13.2914 13.8248 13.8248 14.3586 14.3586 14.5268 14.5268 14.6774 14.6774 14.8767 14.8767 14.9099 14.9099 15.4016 15.4016 15.4956 15.4956 k = 0.2705 0.2705-0.0000 ( 3942 PWs) bands (ev): -63.9853 -63.9853 -33.7570 -33.7570 -32.5548 -32.5548 -32.5498 -32.5498 0.0043 0.0043 0.0187 0.0187 0.4535 0.4535 0.4666 0.4666 0.4799 0.4799 6.0423 6.0423 10.4021 10.4021 10.7838 10.7838 11.6487 11.6487 11.8610 11.8610 12.3522 12.3522 12.6807 12.6807 12.8442 12.8442 13.3343 13.3343 13.8021 13.8021 14.3978 14.3978 14.5542 14.5542 14.6723 14.6723 14.8941 14.8941 14.9420 14.9420 15.4195 15.4195 15.5212 15.5212 k = 0.2623 0.2623-0.0000 ( 3952 PWs) bands (ev): -63.9866 -63.9866 -33.7569 -33.7569 -32.5547 -32.5547 -32.5498 -32.5498 0.0034 0.0034 0.0179 0.0179 0.4526 0.4526 0.4667 0.4667 0.4780 0.4780 5.9552 5.9552 10.4257 10.4257 10.8324 10.8324 11.6383 11.6383 11.8633 11.8633 12.3275 12.3275 12.6428 12.6428 12.8785 12.8785 13.3758 13.3758 13.7769 13.7769 14.4344 14.4344 14.5800 14.5800 14.6685 14.6685 14.9066 14.9066 14.9754 14.9754 15.4342 15.4342 15.5450 15.5450 k = 0.2541 0.2541-0.0000 ( 3952 PWs) bands (ev): -63.9867 -63.9867 -33.7568 -33.7568 -32.5545 -32.5545 -32.5497 -32.5497 0.0026 0.0026 0.0171 0.0171 0.4517 0.4517 0.4667 0.4667 0.4761 0.4761 5.8698 5.8698 10.4470 10.4470 10.8810 10.8810 11.6317 11.6317 11.8659 11.8659 12.3036 12.3036 12.6061 12.6061 12.9165 12.9165 13.4220 13.4220 13.7558 13.7558 14.4672 14.4672 14.6064 14.6064 14.6694 14.6694 14.9191 14.9191 15.0113 15.0113 15.4488 15.4488 15.5697 15.5697 k = 0.2459 0.2459-0.0000 ( 3948 PWs) bands (ev): -63.9862 -63.9862 -33.7567 -33.7567 -32.5544 -32.5544 -32.5496 -32.5496 0.0018 0.0018 0.0162 0.0162 0.4507 0.4507 0.4667 0.4667 0.4742 0.4742 5.7860 5.7860 10.4654 10.4654 10.9299 10.9299 11.6281 11.6281 11.8687 11.8687 12.2811 12.2811 12.5709 12.5709 12.9582 12.9582 13.4687 13.4687 13.7355 13.7355 14.4943 14.4943 14.6330 14.6330 14.6769 14.6769 14.9318 14.9318 15.0479 15.0479 15.4625 15.4625 15.5947 15.5947 k = 0.2377 0.2377-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7566 -33.7566 -32.5542 -32.5542 -32.5496 -32.5496 0.0010 0.0010 0.0153 0.0153 0.4497 0.4497 0.4667 0.4667 0.4723 0.4723 5.7041 5.7041 10.4802 10.4802 10.9781 10.9781 11.6281 11.6281 11.8717 11.8717 12.2575 12.2575 12.5354 12.5354 12.9997 12.9997 13.5174 13.5174 13.7195 13.7195 14.5136 14.5136 14.6592 14.6592 14.6908 14.6908 14.9441 14.9441 15.0843 15.0843 15.4751 15.4751 15.6183 15.6183 k = 0.2295 0.2295-0.0000 ( 3952 PWs) bands (ev): -63.9869 -63.9869 -33.7565 -33.7565 -32.5541 -32.5541 -32.5495 -32.5495 0.0001 0.0001 0.0143 0.0143 0.4487 0.4487 0.4665 0.4665 0.4705 0.4705 5.6241 5.6241 10.4914 10.4914 11.0258 11.0258 11.6309 11.6309 11.8749 11.8749 12.2339 12.2339 12.5005 12.5005 13.0429 13.0429 13.5645 13.5645 13.7065 13.7065 14.5247 14.5247 14.6857 14.6857 14.7117 14.7117 14.9559 14.9559 15.1199 15.1199 15.4863 15.4863 15.6412 15.6412 k = 0.2213 0.2213-0.0000 ( 3942 PWs) bands (ev): -63.9857 -63.9857 -33.7564 -33.7564 -32.5539 -32.5539 -32.5494 -32.5494 -0.0007 -0.0007 0.0133 0.0133 0.4476 0.4476 0.4662 0.4662 0.4688 0.4688 5.5463 5.5463 10.4999 10.4999 11.0732 11.0732 11.6378 11.6378 11.8786 11.8786 12.2117 12.2117 12.4677 12.4677 13.0901 13.0901 13.6075 13.6075 13.7071 13.7071 14.5298 14.5298 14.7147 14.7147 14.7391 14.7391 14.9700 14.9700 15.1571 15.1571 15.4990 15.4990 15.6655 15.6655 k = 0.2131 0.2131-0.0000 ( 3948 PWs) bands (ev): -63.9865 -63.9865 -33.7563 -33.7563 -32.5537 -32.5537 -32.5494 -32.5494 -0.0016 -0.0016 0.0123 0.0123 0.4466 0.4466 0.4654 0.4654 0.4677 0.4677 5.4705 5.4705 10.5040 10.5040 11.1195 11.1195 11.6471 11.6471 11.8811 11.8811 12.1891 12.1891 12.4337 12.4337 13.1353 13.1353 13.6331 13.6331 13.7288 13.7288 14.5280 14.5280 14.7423 14.7423 14.7664 14.7664 14.9824 14.9824 15.1923 15.1923 15.5085 15.5085 15.6851 15.6851 k = 0.2049 0.2049-0.0000 ( 3952 PWs) bands (ev): -63.9871 -63.9871 -33.7562 -33.7562 -32.5536 -32.5536 -32.5493 -32.5493 -0.0025 -0.0025 0.0112 0.0112 0.4455 0.4455 0.4640 0.4640 0.4671 0.4671 5.3970 5.3970 10.5044 10.5044 11.1649 11.1649 11.6584 11.6584 11.8849 11.8849 12.1670 12.1670 12.4013 12.4013 13.1832 13.1832 13.6407 13.6407 13.7717 13.7717 14.5245 14.5245 14.7693 14.7693 14.7982 14.7982 14.9947 14.9947 15.2266 15.2266 15.5159 15.5159 15.7061 15.7061 k = 0.1967 0.1967-0.0000 ( 3942 PWs) bands (ev): -63.9860 -63.9860 -33.7561 -33.7561 -32.5534 -32.5534 -32.5492 -32.5492 -0.0033 -0.0033 0.0102 0.0102 0.4445 0.4445 0.4623 0.4623 0.4668 0.4668 5.3259 5.3259 10.5029 10.5029 11.2101 11.2101 11.6722 11.6722 11.8900 11.8900 12.1477 12.1477 12.3698 12.3698 13.2324 13.2324 13.6436 13.6436 13.8286 13.8286 14.5202 14.5202 14.7968 14.7968 14.8335 14.8335 15.0102 15.0102 15.2622 15.2622 15.5256 15.5256 15.7274 15.7274 k = 0.1885 0.1885-0.0000 ( 3934 PWs) bands (ev): -63.9850 -63.9850 -33.7560 -33.7560 -32.5532 -32.5532 -32.5491 -32.5491 -0.0042 -0.0042 0.0091 0.0091 0.4434 0.4434 0.4606 0.4606 0.4666 0.4666 5.2572 5.2572 10.4981 10.4981 11.2537 11.2537 11.6880 11.6880 11.8944 11.8944 12.1282 12.1282 12.3400 12.3400 13.2844 13.2844 13.6478 13.6478 13.8918 13.8918 14.5148 14.5148 14.8223 14.8223 14.8677 14.8677 15.0257 15.0257 15.2971 15.2971 15.5332 15.5332 15.7479 15.7479 k = 0.1803 0.1803-0.0000 ( 3930 PWs) bands (ev): -63.9846 -63.9846 -33.7559 -33.7559 -32.5530 -32.5530 -32.5490 -32.5490 -0.0050 -0.0050 0.0080 0.0080 0.4424 0.4424 0.4588 0.4588 0.4664 0.4664 5.1910 5.1910 10.4907 10.4907 11.2959 11.2959 11.7036 11.7036 11.8992 11.8992 12.1091 12.1091 12.3111 12.3111 13.3375 13.3375 13.6542 13.6542 13.9552 13.9552 14.5093 14.5093 14.8462 14.8462 14.9024 14.9024 15.0412 15.0412 15.3302 15.3302 15.5392 15.5392 15.7677 15.7677 k = 0.1721 0.1721-0.0000 ( 3926 PWs) bands (ev): -63.9842 -63.9842 -33.7558 -33.7558 -32.5529 -32.5529 -32.5489 -32.5489 -0.0058 -0.0058 0.0068 0.0068 0.4413 0.4413 0.4571 0.4571 0.4662 0.4662 5.1273 5.1273 10.4811 10.4811 11.3369 11.3369 11.7199 11.7199 11.9039 11.9039 12.0914 12.0914 12.2826 12.2826 13.3906 13.3906 13.6651 13.6651 14.0225 14.0225 14.5027 14.5027 14.8686 14.8686 14.9359 14.9359 15.0576 15.0576 15.3630 15.3630 15.5442 15.5442 15.7858 15.7858 k = 0.1639 0.1639-0.0000 ( 3930 PWs) bands (ev): -63.9848 -63.9848 -33.7557 -33.7557 -32.5527 -32.5527 -32.5489 -32.5489 -0.0067 -0.0067 0.0057 0.0057 0.4403 0.4403 0.4555 0.4555 0.4660 0.4660 5.0662 5.0662 10.4693 10.4693 11.3759 11.3759 11.7346 11.7346 11.9085 11.9085 12.0736 12.0736 12.2551 12.2551 13.4446 13.4446 13.6792 13.6792 14.0897 14.0897 14.4958 14.4958 14.8891 14.8891 14.9685 14.9685 15.0731 15.0731 15.3931 15.3931 15.5468 15.5468 15.8027 15.8027 k = 0.1557 0.1557-0.0000 ( 3930 PWs) bands (ev): -63.9848 -63.9848 -33.7556 -33.7556 -32.5526 -32.5526 -32.5488 -32.5488 -0.0075 -0.0075 0.0046 0.0046 0.4392 0.4392 0.4538 0.4538 0.4658 0.4658 5.0078 5.0078 10.4567 10.4567 11.4137 11.4137 11.7480 11.7480 11.9133 11.9133 12.0580 12.0580 12.2288 12.2288 13.4996 13.4996 13.6981 13.6981 14.1588 14.1588 14.4893 14.4893 14.9084 14.9084 15.0004 15.0004 15.0903 15.0903 15.4221 15.4221 15.5501 15.5501 15.8189 15.8189 k = 0.1475 0.1475-0.0000 ( 3932 PWs) bands (ev): -63.9851 -63.9851 -33.7555 -33.7555 -32.5525 -32.5525 -32.5487 -32.5487 -0.0083 -0.0083 0.0035 0.0035 0.4382 0.4382 0.4523 0.4523 0.4655 0.4655 4.9521 4.9521 10.4429 10.4429 11.4498 11.4498 11.7597 11.7597 11.9180 11.9180 12.0440 12.0440 12.2036 12.2036 13.5552 13.5552 13.7214 13.7214 14.2289 14.2289 14.4828 14.4828 14.9260 14.9260 15.0310 15.0310 15.1075 15.1075 15.4488 15.4488 15.5524 15.5524 15.8338 15.8338 k = 0.1393 0.1393-0.0000 ( 3934 PWs) bands (ev): -63.9854 -63.9854 -33.7554 -33.7554 -32.5523 -32.5523 -32.5487 -32.5487 -0.0091 -0.0091 0.0024 0.0024 0.4372 0.4372 0.4507 0.4507 0.4653 0.4653 4.8991 4.8991 10.4282 10.4282 11.4840 11.4840 11.7698 11.7698 11.9226 11.9226 12.0315 12.0315 12.1795 12.1795 13.6113 13.6113 13.7494 13.7494 14.3005 14.3005 14.4768 14.4768 14.9421 14.9421 15.0604 15.0604 15.1250 15.1250 15.4728 15.4728 15.5549 15.5549 15.8477 15.8477 k = 0.1311 0.1311-0.0000 ( 3930 PWs) bands (ev): -63.9850 -63.9850 -33.7553 -33.7553 -32.5522 -32.5522 -32.5486 -32.5486 -0.0098 -0.0098 0.0014 0.0014 0.4363 0.4363 0.4493 0.4493 0.4651 0.4651 4.8491 4.8491 10.4138 10.4138 11.5165 11.5165 11.7775 11.7775 11.9282 11.9282 12.0208 12.0208 12.1574 12.1574 13.6686 13.6686 13.7816 13.7816 14.3718 14.3718 14.4736 14.4736 14.9571 14.9571 15.0898 15.0898 15.1442 15.1442 15.4916 15.4916 15.5619 15.5619 15.8620 15.8620 k = 0.1230 0.1230-0.0000 ( 3930 PWs) bands (ev): -63.9851 -63.9851 -33.7552 -33.7552 -32.5521 -32.5521 -32.5485 -32.5485 -0.0106 -0.0106 0.0004 0.0004 0.4353 0.4353 0.4479 0.4479 0.4648 0.4648 4.8018 4.8018 10.3990 10.3990 11.5469 11.5469 11.7829 11.7829 11.9330 11.9330 12.0117 12.0117 12.1359 12.1359 13.7251 13.7251 13.8178 13.8178 14.4373 14.4373 14.4761 14.4761 14.9707 14.9707 15.1171 15.1171 15.1630 15.1630 15.5031 15.5031 15.5730 15.5730 15.8741 15.8741 k = 0.1148 0.1148-0.0000 ( 3914 PWs) bands (ev): -63.9831 -63.9831 -33.7551 -33.7551 -32.5519 -32.5519 -32.5484 -32.5484 -0.0113 -0.0113 -0.0006 -0.0006 0.4344 0.4344 0.4466 0.4466 0.4646 0.4646 4.7575 4.7575 10.3855 10.3855 11.5762 11.5762 11.7875 11.7875 11.9386 11.9386 12.0049 12.0049 12.1179 12.1179 13.7845 13.7845 13.8586 13.8586 14.4596 14.4596 14.5262 14.5262 14.9834 14.9834 15.1444 15.1444 15.1843 15.1843 15.5088 15.5088 15.5915 15.5915 15.8876 15.8876 k = 0.1066 0.1066-0.0000 ( 3918 PWs) bands (ev): -63.9837 -63.9837 -33.7551 -33.7551 -32.5518 -32.5518 -32.5484 -32.5484 -0.0120 -0.0120 -0.0016 -0.0016 0.4335 0.4335 0.4454 0.4454 0.4643 0.4643 4.7161 4.7161 10.3711 10.3711 11.6023 11.6023 11.7894 11.7894 11.9431 11.9431 11.9982 11.9982 12.0979 12.0979 13.8381 13.8381 13.9016 13.9016 14.4576 14.4576 14.5968 14.5968 14.9949 14.9949 15.1689 15.1689 15.2023 15.2023 15.5077 15.5077 15.6094 15.6094 15.8958 15.8958 k = 0.0984 0.0984-0.0000 ( 3920 PWs) bands (ev): -63.9840 -63.9840 -33.7550 -33.7550 -32.5517 -32.5517 -32.5483 -32.5483 -0.0126 -0.0126 -0.0024 -0.0024 0.4327 0.4327 0.4442 0.4442 0.4641 0.4641 4.6777 4.6777 10.3571 10.3571 11.6261 11.6261 11.7902 11.7902 11.9473 11.9473 11.9932 11.9932 12.0794 12.0794 13.8908 13.8908 13.9474 13.9474 14.4546 14.4546 14.6692 14.6692 15.0056 15.0056 15.1922 15.1922 15.2198 15.2198 15.5036 15.5036 15.6283 15.6283 15.9027 15.9027 k = 0.0902 0.0902-0.0000 ( 3918 PWs) bands (ev): -63.9838 -63.9838 -33.7549 -33.7549 -32.5516 -32.5516 -32.5483 -32.5483 -0.0132 -0.0132 -0.0033 -0.0033 0.4319 0.4319 0.4432 0.4432 0.4639 0.4639 4.6422 4.6422 10.3440 10.3440 11.6473 11.6473 11.7903 11.7903 11.9515 11.9515 11.9893 11.9893 12.0632 12.0632 13.9428 13.9428 13.9954 13.9954 14.4537 14.4537 14.7409 14.7409 15.0159 15.0159 15.2145 15.2145 15.2369 15.2369 15.4969 15.4969 15.6469 15.6469 15.9085 15.9085 k = 0.0820 0.0820-0.0000 ( 3918 PWs) bands (ev): -63.9839 -63.9839 -33.7549 -33.7549 -32.5515 -32.5515 -32.5482 -32.5482 -0.0138 -0.0138 -0.0040 -0.0040 0.4312 0.4312 0.4422 0.4422 0.4636 0.4636 4.6097 4.6097 10.3313 10.3313 11.6651 11.6651 11.7901 11.7901 11.9555 11.9555 11.9855 11.9855 12.0488 12.0488 13.9929 13.9929 14.0444 14.0444 14.4546 14.4546 14.8107 14.8107 15.0260 15.0260 15.2355 15.2355 15.2520 15.2520 15.4879 15.4879 15.6635 15.6635 15.9123 15.9123 k = 0.0738 0.0738-0.0000 ( 3914 PWs) bands (ev): -63.9835 -63.9835 -33.7548 -33.7548 -32.5514 -32.5514 -32.5481 -32.5481 -0.0144 -0.0144 -0.0047 -0.0047 0.4305 0.4305 0.4413 0.4413 0.4634 0.4634 4.5803 4.5803 10.3202 10.3202 11.6805 11.6805 11.7912 11.7912 11.9591 11.9591 11.9831 11.9831 12.0353 12.0353 14.0406 14.0406 14.0925 14.0925 14.4565 14.4565 14.8783 14.8783 15.0368 15.0368 15.2554 15.2554 15.2677 15.2677 15.4792 15.4792 15.6807 15.6807 15.9128 15.9128 k = 0.0656 0.0656-0.0000 ( 3913 PWs) bands (ev): -63.9834 -63.9834 -33.7547 -33.7547 -32.5513 -32.5513 -32.5481 -32.5481 -0.0149 -0.0149 -0.0053 -0.0053 0.4299 0.4299 0.4405 0.4405 0.4633 0.4633 4.5539 4.5539 10.3095 10.3095 11.6921 11.6921 11.7931 11.7931 11.9622 11.9622 11.9810 11.9810 12.0232 12.0232 14.0857 14.0857 14.1383 14.1383 14.4606 14.4606 14.9403 14.9403 15.0501 15.0501 15.2737 15.2737 15.2813 15.2813 15.4684 15.4684 15.6955 15.6955 15.9097 15.9097 k = 0.0574 0.0574-0.0000 ( 3913 PWs) bands (ev): -63.9835 -63.9835 -33.7547 -33.7547 -32.5513 -32.5513 -32.5481 -32.5481 -0.0153 -0.0153 -0.0059 -0.0059 0.4293 0.4293 0.4398 0.4398 0.4631 0.4631 4.5306 4.5306 10.2999 10.2999 11.7003 11.7003 11.7962 11.7962 11.9648 11.9648 11.9790 11.9790 12.0126 12.0126 14.1277 14.1277 14.1802 14.1802 14.4674 14.4674 14.9906 14.9906 15.0714 15.0714 15.2892 15.2892 15.2953 15.2953 15.4568 15.4568 15.7084 15.7084 15.9023 15.9023 k = 0.0492 0.0492-0.0000 ( 3909 PWs) bands (ev): -63.9831 -63.9831 -33.7547 -33.7547 -32.5512 -32.5512 -32.5480 -32.5480 -0.0157 -0.0157 -0.0064 -0.0064 0.4288 0.4288 0.4391 0.4391 0.4629 0.4629 4.5104 4.5104 10.2920 10.2920 11.7059 11.7059 11.8006 11.8006 11.9670 11.9670 11.9775 11.9775 12.0039 12.0039 14.1659 14.1659 14.2171 14.2171 14.4785 14.4785 15.0210 15.0210 15.1084 15.1084 15.3007 15.3007 15.3120 15.3120 15.4456 15.4456 15.7202 15.7202 15.8902 15.8902 k = 0.0410 0.0410-0.0000 ( 3905 PWs) bands (ev): -63.9826 -63.9826 -33.7546 -33.7546 -32.5511 -32.5511 -32.5480 -32.5480 -0.0161 -0.0161 -0.0068 -0.0068 0.4284 0.4284 0.4386 0.4386 0.4628 0.4628 4.4933 4.4933 10.2848 10.2848 11.7089 11.7089 11.8055 11.8055 11.9683 11.9683 11.9772 11.9772 11.9974 11.9974 14.1997 14.1997 14.2481 14.2481 14.4934 14.4934 15.0361 15.0361 15.1548 15.1548 15.3092 15.3092 15.3283 15.3283 15.4333 15.4333 15.7297 15.7297 15.8732 15.8732 k = 0.0328 0.0328-0.0000 ( 3901 PWs) bands (ev): -63.9821 -63.9821 -33.7546 -33.7546 -32.5511 -32.5511 -32.5479 -32.5479 -0.0163 -0.0163 -0.0072 -0.0072 0.4280 0.4280 0.4382 0.4382 0.4627 0.4627 4.4792 4.4792 10.2790 10.2790 11.7107 11.7107 11.8103 11.8103 11.9689 11.9689 11.9775 11.9775 11.9918 11.9918 14.2278 14.2278 14.2723 14.2723 14.5094 14.5094 15.0450 15.0450 15.2002 15.2002 15.3163 15.3163 15.3443 15.3443 15.4213 15.4213 15.7379 15.7379 15.8524 15.8524 k = 0.0246 0.0246-0.0000 ( 3901 PWs) bands (ev): -63.9822 -63.9822 -33.7546 -33.7546 -32.5510 -32.5510 -32.5479 -32.5479 -0.0166 -0.0166 -0.0074 -0.0074 0.4278 0.4278 0.4379 0.4379 0.4626 0.4626 4.4683 4.4683 10.2743 10.2743 11.7112 11.7112 11.8145 11.8145 11.9686 11.9686 11.9773 11.9773 11.9877 11.9877 14.2493 14.2493 14.2905 14.2905 14.5247 14.5247 15.0509 15.0509 15.2392 15.2392 15.3224 15.3224 15.3590 15.3590 15.4090 15.4090 15.7438 15.7438 15.8308 15.8308 k = 0.0164 0.0164-0.0000 ( 3901 PWs) bands (ev): -63.9822 -63.9822 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0167 -0.0167 -0.0076 -0.0076 0.4276 0.4276 0.4376 0.4376 0.4626 0.4626 4.4605 4.4605 10.2709 10.2709 11.7113 11.7113 11.8178 11.8178 11.9679 11.9679 11.9770 11.9770 11.9853 11.9853 14.2643 14.2643 14.3035 14.3035 14.5379 14.5379 15.0548 15.0548 15.2686 15.2686 15.3288 15.3288 15.3717 15.3717 15.3970 15.3970 15.7478 15.7478 15.8119 15.8119 k = 0.0082 0.0082-0.0000 ( 3905 PWs) bands (ev): -63.9827 -63.9827 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0168 -0.0168 -0.0077 -0.0077 0.4274 0.4274 0.4375 0.4375 0.4625 0.4625 4.4558 4.4558 10.2687 10.2687 11.7110 11.7110 11.8198 11.8198 11.9667 11.9667 11.9759 11.9759 11.9842 11.9842 14.2727 14.2727 14.3112 14.3112 14.5453 14.5453 15.0571 15.0571 15.2859 15.2859 15.3355 15.3355 15.3804 15.3804 15.3863 15.3863 15.7499 15.7499 15.7989 15.7989 k = 0.0000 0.0000 0.0000 ( 3911 PWs) bands (ev): -63.9834 -63.9834 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0169 -0.0169 -0.0078 -0.0078 0.4274 0.4274 0.4374 0.4374 0.4625 0.4625 4.4542 4.4542 10.2678 10.2678 11.7104 11.7104 11.8204 11.8204 11.9657 11.9657 11.9748 11.9748 11.9836 11.9836 14.2752 14.2752 14.3136 14.3136 14.5458 14.5458 15.0578 15.0578 15.2913 15.2913 15.3386 15.3386 15.3812 15.3812 15.3839 15.3839 15.7501 15.7501 15.7942 15.7942 k = 0.0000 0.0000 0.0000 ( 3911 PWs) bands (ev): -63.9834 -63.9834 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0169 -0.0169 -0.0078 -0.0078 0.4274 0.4274 0.4374 0.4374 0.4625 0.4625 4.4542 4.4542 10.2678 10.2678 11.7104 11.7104 11.8204 11.8204 11.9657 11.9657 11.9748 11.9748 11.9836 11.9836 14.2752 14.2752 14.3136 14.3136 14.5458 14.5458 15.0578 15.0578 15.2913 15.2913 15.3386 15.3386 15.3812 15.3812 15.3839 15.3839 15.7501 15.7501 15.7942 15.7942 k = 0.0000 0.0000 0.0114 ( 3907 PWs) bands (ev): -63.9829 -63.9829 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0168 -0.0168 -0.0077 -0.0077 0.4274 0.4274 0.4374 0.4374 0.4625 0.4625 4.4557 4.4557 10.2685 10.2685 11.7099 11.7099 11.8208 11.8208 11.9664 11.9664 11.9755 11.9755 11.9839 11.9839 14.2732 14.2732 14.3117 14.3117 14.5426 14.5426 15.0564 15.0564 15.2899 15.2899 15.3384 15.3384 15.3791 15.3791 15.3811 15.3811 15.7501 15.7501 15.8032 15.8032 k = 0.0000 0.0000 0.0227 ( 3899 PWs) bands (ev): -63.9820 -63.9820 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0167 -0.0167 -0.0077 -0.0077 0.4276 0.4276 0.4375 0.4375 0.4626 0.4626 4.4603 4.4603 10.2709 10.2709 11.7072 11.7072 11.8220 11.8220 11.9683 11.9683 11.9776 11.9776 11.9845 11.9845 14.2664 14.2664 14.3068 14.3068 14.5293 14.5293 15.0520 15.0520 15.2851 15.2851 15.3383 15.3383 15.3667 15.3667 15.3800 15.3800 15.7490 15.7490 15.8291 15.8291 k = 0.0000 0.0000 0.0341 ( 3899 PWs) bands (ev): -63.9819 -63.9819 -33.7545 -33.7545 -32.5510 -32.5510 -32.5479 -32.5479 -0.0165 -0.0165 -0.0075 -0.0075 0.4279 0.4279 0.4377 0.4377 0.4626 0.4626 4.4678 4.4678 10.2742 10.2742 11.7014 11.7014 11.8244 11.8244 11.9694 11.9694 11.9789 11.9789 11.9850 11.9850 14.2529 14.2529 14.3001 14.3001 14.5034 14.5034 15.0441 15.0441 15.2755 15.2755 15.3348 15.3348 15.3497 15.3497 15.3783 15.3783 15.7461 15.7461 15.8700 15.8700 k = 0.0000 0.0000 0.0455 ( 3899 PWs) bands (ev): -63.9819 -63.9819 -33.7546 -33.7546 -32.5510 -32.5510 -32.5479 -32.5479 -0.0161 -0.0161 -0.0073 -0.0073 0.4283 0.4283 0.4379 0.4379 0.4627 0.4627 4.4784 4.4784 10.2788 10.2788 11.6923 11.6923 11.8285 11.8285 11.9708 11.9708 11.9808 11.9808 11.9857 11.9857 14.2323 14.2323 14.2934 14.2934 14.4694 14.4694 15.0319 15.0319 15.2587 15.2587 15.3233 15.3233 15.3385 15.3385 15.3758 15.3758 15.7419 15.7419 15.9234 15.9234 k = 0.0000 0.0000 0.0568 ( 3903 PWs) bands (ev): -63.9824 -63.9824 -33.7546 -33.7546 -32.5511 -32.5511 -32.5480 -32.5480 -0.0157 -0.0157 -0.0071 -0.0071 0.4288 0.4288 0.4382 0.4382 0.4629 0.4629 4.4919 4.4919 10.2843 10.2843 11.6783 11.6783 11.8347 11.8347 11.9722 11.9722 11.9832 11.9832 11.9865 11.9865 14.2053 14.2053 14.2866 14.2866 14.4280 14.4280 15.0141 15.0141 15.2337 15.2337 15.3052 15.3052 15.3342 15.3342 15.3722 15.3722 15.7350 15.7350 15.9870 15.9870 k = 0.0000 0.0000 0.0682 ( 3903 PWs) bands (ev): -63.9823 -63.9823 -33.7546 -33.7546 -32.5511 -32.5511 -32.5481 -32.5481 -0.0153 -0.0153 -0.0068 -0.0068 0.4294 0.4294 0.4386 0.4386 0.4630 0.4630 4.5084 4.5084 10.2912 10.2912 11.6615 11.6615 11.8433 11.8433 11.9740 11.9740 11.9862 11.9862 11.9879 11.9879 14.1734 14.1734 14.2792 14.2792 14.3834 14.3834 14.9893 14.9893 15.2032 15.2032 15.2882 15.2882 15.3311 15.3311 15.3678 15.3678 15.7281 15.7281 16.0583 16.0583 k = 0.0000 0.0000 0.0795 ( 3911 PWs) bands (ev): -63.9832 -63.9832 -33.7547 -33.7547 -32.5511 -32.5511 -32.5481 -32.5481 -0.0147 -0.0147 -0.0065 -0.0065 0.4301 0.4301 0.4390 0.4390 0.4632 0.4632 4.5279 4.5279 10.2991 10.2991 11.6405 11.6405 11.8544 11.8544 11.9744 11.9744 11.9874 11.9874 11.9897 11.9897 14.1374 14.1374 14.2690 14.2690 14.3337 14.3337 14.9555 14.9555 15.1714 15.1714 15.2709 15.2709 15.3269 15.3269 15.3615 15.3615 15.7198 15.7198 16.1265 16.1265 k = 0.0000 0.0000 0.0909 ( 3911 PWs) bands (ev): -63.9832 -63.9832 -33.7547 -33.7547 -32.5512 -32.5512 -32.5482 -32.5482 -0.0141 -0.0141 -0.0061 -0.0061 0.4309 0.4309 0.4395 0.4395 0.4634 0.4634 4.5504 4.5504 10.3079 10.3079 11.6152 11.6152 11.8679 11.8679 11.9764 11.9764 11.9888 11.9888 11.9943 11.9943 14.0989 14.0989 14.2513 14.2513 14.2928 14.2928 14.9118 14.9118 15.1415 15.1415 15.2541 15.2541 15.3219 15.3219 15.3547 15.3547 15.7101 15.7101 16.1447 16.1447 k = 0.0000 0.0000 0.1023 ( 3915 PWs) bands (ev): -63.9836 -63.9836 -33.7548 -33.7548 -32.5512 -32.5512 -32.5483 -32.5483 -0.0134 -0.0134 -0.0056 -0.0056 0.4317 0.4317 0.4401 0.4401 0.4636 0.4636 4.5758 4.5758 10.3174 10.3174 11.5856 11.5856 11.8838 11.8838 11.9780 11.9780 11.9900 11.9900 11.9986 11.9986 14.0583 14.0583 14.2124 14.2124 14.2696 14.2696 14.8588 14.8588 15.1146 15.1146 15.2359 15.2359 15.3151 15.3151 15.3466 15.3466 15.6991 15.6991 16.1446 16.1446 k = 0.0000 0.0000 0.1136 ( 3923 PWs) bands (ev): -63.9845 -63.9845 -33.7549 -33.7549 -32.5513 -32.5513 -32.5484 -32.5484 -0.0127 -0.0127 -0.0051 -0.0051 0.4326 0.4326 0.4408 0.4408 0.4638 0.4638 4.6042 4.6042 10.3268 10.3268 11.5504 11.5504 11.9015 11.9015 11.9792 11.9792 11.9909 11.9909 12.0047 12.0047 14.0166 14.0166 14.1612 14.1612 14.2569 14.2569 14.7980 14.7980 15.0904 15.0904 15.2165 15.2165 15.3052 15.3052 15.3369 15.3369 15.6838 15.6838 16.1452 16.1452 k = 0.0000 0.0000 0.1250 ( 3927 PWs) bands (ev): -63.9850 -63.9850 -33.7549 -33.7549 -32.5514 -32.5514 -32.5485 -32.5485 -0.0119 -0.0119 -0.0045 -0.0045 0.4335 0.4335 0.4416 0.4416 0.4641 0.4641 4.6355 4.6355 10.3366 10.3366 11.5129 11.5129 11.9221 11.9221 11.9805 11.9805 11.9918 11.9918 12.0112 12.0112 13.9740 13.9740 14.1074 14.1074 14.2459 14.2459 14.7334 14.7334 15.0676 15.0676 15.1954 15.1954 15.2924 15.2924 15.3277 15.3277 15.6717 15.6717 16.1449 16.1449 k = 0.0000 0.0000 0.1364 ( 3927 PWs) bands (ev): -63.9849 -63.9849 -33.7550 -33.7550 -32.5514 -32.5514 -32.5486 -32.5486 -0.0111 -0.0111 -0.0038 -0.0038 0.4345 0.4345 0.4425 0.4425 0.4644 0.4644 4.6697 4.6697 10.3464 10.3464 11.4713 11.4713 11.9443 11.9443 11.9828 11.9828 11.9932 11.9932 12.0186 12.0186 13.9316 13.9316 14.0556 14.0556 14.2351 14.2351 14.6654 14.6654 15.0454 15.0454 15.1742 15.1742 15.2781 15.2781 15.3202 15.3202 15.6568 15.6568 16.1451 16.1451 k = 0.0000 0.0000 0.1477 ( 3931 PWs) bands (ev): -63.9853 -63.9853 -33.7551 -33.7551 -32.5515 -32.5515 -32.5487 -32.5487 -0.0103 -0.0103 -0.0031 -0.0031 0.4354 0.4354 0.4435 0.4435 0.4647 0.4647 4.7068 4.7068 10.3552 10.3552 11.4261 11.4261 11.9683 11.9683 11.9841 11.9841 11.9941 11.9941 12.0267 12.0267 13.8893 13.8893 14.0032 14.0032 14.2239 14.2239 14.5963 14.5963 15.0231 15.0231 15.1511 15.1511 15.2599 15.2599 15.3125 15.3125 15.6404 15.6404 16.1452 16.1452 k = 0.0000 0.0000 0.1591 ( 3923 PWs) bands (ev): -63.9843 -63.9843 -33.7551 -33.7551 -32.5515 -32.5515 -32.5487 -32.5487 -0.0095 -0.0095 -0.0023 -0.0023 0.4363 0.4363 0.4447 0.4447 0.4650 0.4650 4.7468 4.7468 10.3630 10.3630 11.3786 11.3786 11.9880 11.9880 11.9928 11.9928 11.9977 11.9977 12.0361 12.0361 13.8480 13.8480 13.9560 13.9560 14.2124 14.2124 14.5277 14.5277 15.0002 15.0002 15.1291 15.1291 15.2427 15.2427 15.3068 15.3068 15.6240 15.6240 16.1465 16.1465 k = 0.0000 0.0000 0.1705 ( 3927 PWs) bands (ev): -63.9847 -63.9847 -33.7552 -33.7552 -32.5516 -32.5516 -32.5488 -32.5488 -0.0087 -0.0087 -0.0014 -0.0014 0.4372 0.4372 0.4459 0.4459 0.4654 0.4654 4.7896 4.7896 10.3678 10.3678 11.3284 11.3284 11.9895 11.9895 11.9966 11.9966 12.0214 12.0214 12.0461 12.0461 13.8073 13.8073 13.9067 13.9067 14.2001 14.2001 14.4596 14.4596 14.9763 14.9763 15.1041 15.1041 15.2205 15.2205 15.2994 15.2994 15.6049 15.6049 16.1464 16.1464 k = 0.0000 0.0000 0.1818 ( 3919 PWs) bands (ev): -63.9837 -63.9837 -33.7553 -33.7553 -32.5517 -32.5517 -32.5489 -32.5489 -0.0079 -0.0079 -0.0004 -0.0004 0.4381 0.4381 0.4473 0.4473 0.4657 0.4657 4.8352 4.8352 10.3698 10.3698 11.2781 11.2781 11.9929 11.9929 11.9986 11.9986 12.0463 12.0463 12.0611 12.0611 13.7681 13.7681 13.8621 13.8621 14.1875 14.1875 14.3944 14.3944 14.9515 14.9515 15.0803 15.0803 15.2000 15.2000 15.2936 15.2936 15.5868 15.5868 16.1479 16.1479 k = 0.0000 0.0000 0.1932 ( 3911 PWs) bands (ev): -63.9826 -63.9826 -33.7553 -33.7553 -32.5518 -32.5518 -32.5489 -32.5489 -0.0072 -0.0072 0.0006 0.0006 0.4390 0.4390 0.4488 0.4488 0.4661 0.4661 4.8835 4.8835 10.3670 10.3670 11.2286 11.2286 11.9958 11.9958 12.0004 12.0004 12.0617 12.0617 12.0874 12.0874 13.7304 13.7304 13.8190 13.8190 14.1743 14.1743 14.3326 14.3326 14.9255 14.9255 15.0553 15.0553 15.1777 15.1777 15.2879 15.2879 15.5692 15.5692 16.1482 16.1482 k = 0.0000 0.0000 0.2045 ( 3920 PWs) bands (ev): -63.9837 -63.9837 -33.7554 -33.7554 -32.5519 -32.5519 -32.5491 -32.5491 -0.0064 -0.0064 0.0017 0.0017 0.4398 0.4398 0.4504 0.4504 0.4665 0.4665 4.9345 4.9345 10.3565 10.3565 11.1802 11.1802 11.9961 11.9961 12.0003 12.0003 12.0722 12.0722 12.1189 12.1189 13.6938 13.6938 13.7747 13.7747 14.1605 14.1605 14.2731 14.2731 14.8983 14.8983 15.0270 15.0270 15.1497 15.1497 15.2783 15.2783 15.5481 15.5481 16.1460 16.1460 k = 0.0000 0.0000 0.2159 ( 3932 PWs) bands (ev): -63.9851 -63.9851 -33.7555 -33.7555 -32.5521 -32.5521 -32.5492 -32.5492 -0.0057 -0.0057 0.0029 0.0029 0.4407 0.4407 0.4520 0.4520 0.4669 0.4669 4.9881 4.9881 10.3375 10.3375 11.1367 11.1367 11.9949 11.9949 11.9991 11.9991 12.0827 12.0827 12.1528 12.1528 13.6586 13.6586 13.7313 13.7313 14.1463 14.1463 14.2175 14.2175 14.8699 14.8699 14.9963 14.9963 15.1182 15.1182 15.2684 15.2684 15.5274 15.5274 16.1448 16.1448 k = 0.0000 0.0000 0.2273 ( 3932 PWs) bands (ev): -63.9851 -63.9851 -33.7556 -33.7556 -32.5522 -32.5522 -32.5492 -32.5492 -0.0050 -0.0050 0.0041 0.0041 0.4414 0.4414 0.4537 0.4537 0.4673 0.4673 5.0444 5.0444 10.3081 10.3081 11.1006 11.1006 11.9955 11.9955 11.9994 11.9994 12.0938 12.0938 12.1882 12.1882 13.6257 13.6257 13.6934 13.6934 14.1317 14.1317 14.1661 14.1661 14.8406 14.8406 14.9678 14.9678 15.0900 15.0900 15.2588 15.2588 15.5079 15.5079 16.1447 16.1447 k = 0.0000 0.0000 0.2386 ( 3932 PWs) bands (ev): -63.9850 -63.9850 -33.7557 -33.7557 -32.5523 -32.5523 -32.5493 -32.5493 -0.0043 -0.0043 0.0053 0.0053 0.4422 0.4422 0.4554 0.4554 0.4677 0.4677 5.1032 5.1032 10.2668 10.2668 11.0728 11.0728 11.9955 11.9955 11.9996 11.9996 12.1052 12.1052 12.2250 12.2250 13.5949 13.5949 13.6580 13.6580 14.1145 14.1145 14.1210 14.1210 14.8102 14.8102 14.9389 14.9389 15.0611 15.0611 15.2477 15.2477 15.4891 15.4891 16.1447 16.1447 k = 0.0000 0.0000 0.2500 ( 3948 PWs) bands (ev): -63.9869 -63.9869 -33.7558 -33.7558 -32.5525 -32.5525 -32.5494 -32.5494 -0.0037 -0.0037 0.0066 0.0066 0.4430 0.4430 0.4572 0.4572 0.4682 0.4682 5.1644 5.1644 10.2117 10.2117 11.0523 11.0523 11.9937 11.9937 11.9983 11.9983 12.1166 12.1166 12.2621 12.2621 13.5656 13.5656 13.6238 13.6238 14.0720 14.0720 14.1028 14.1028 14.7785 14.7785 14.9075 14.9075 15.0284 15.0284 15.2289 15.2289 15.4658 15.4658 16.1444 16.1444 k = 0.0000 0.0000 0.2614 ( 3948 PWs) bands (ev): -63.9868 -63.9868 -33.7559 -33.7559 -32.5526 -32.5526 -32.5495 -32.5495 -0.0030 -0.0030 0.0078 0.0078 0.4437 0.4437 0.4589 0.4589 0.4687 0.4687 5.2281 5.2281 10.1458 10.1458 11.0428 11.0428 11.9925 11.9925 11.9982 11.9982 12.1284 12.1284 12.3010 12.3010 13.5388 13.5388 13.5937 13.5937 14.0323 14.0323 14.0876 14.0876 14.7464 14.7464 14.8780 14.8780 14.9985 14.9985 15.2139 15.2139 15.4492 15.4492 16.1444 16.1444 k = 0.0000 0.0000 0.2727 ( 3948 PWs) bands (ev): -63.9868 -63.9868 -33.7560 -33.7560 -32.5528 -32.5528 -32.5495 -32.5495 -0.0024 -0.0024 0.0091 0.0091 0.4444 0.4444 0.4607 0.4607 0.4692 0.4692 5.2940 5.2940 10.0691 10.0691 11.0413 11.0413 11.9908 11.9908 11.9979 11.9979 12.1402 12.1402 12.3407 12.3407 13.5140 13.5140 13.5661 13.5661 13.9963 13.9963 14.0724 14.0724 14.7135 14.7135 14.8484 14.8484 14.9683 14.9683 15.1964 15.1964 15.4343 15.4343 16.1444 16.1444 k = 0.0000 0.0000 0.2841 ( 3948 PWs) bands (ev): -63.9867 -63.9867 -33.7561 -33.7561 -32.5529 -32.5529 -32.5496 -32.5496 -0.0018 -0.0018 0.0104 0.0104 0.4451 0.4451 0.4623 0.4623 0.4697 0.4697 5.3621 5.3621 9.9834 9.9834 11.0467 11.0467 11.9883 11.9883 11.9969 11.9969 12.1520 12.1520 12.3814 12.3814 13.4913 13.4913 13.5410 13.5410 13.9649 13.9649 14.0572 14.0572 14.6804 14.6804 14.8182 14.8182 14.9370 14.9370 15.1783 15.1783 15.4215 15.4215 16.1442 16.1442 k = 0.0000 0.0000 0.2955 ( 3948 PWs) bands (ev): -63.9866 -63.9866 -33.7561 -33.7561 -32.5531 -32.5531 -32.5496 -32.5496 -0.0012 -0.0012 0.0116 0.0116 0.4458 0.4458 0.4640 0.4640 0.4703 0.4703 5.4323 5.4323 9.8902 9.8902 11.0575 11.0575 11.9857 11.9857 11.9959 11.9959 12.1639 12.1639 12.4223 12.4223 13.4708 13.4708 13.5186 13.5186 13.9359 13.9359 14.0421 14.0421 14.6466 14.6466 14.7888 14.7888 14.9067 14.9067 15.1561 15.1561 15.4102 15.4102 16.1442 16.1442 k = 0.0000 0.0000 0.3068 ( 3952 PWs) bands (ev): -63.9871 -63.9871 -33.7562 -33.7562 -32.5532 -32.5532 -32.5497 -32.5497 -0.0006 -0.0006 0.0128 0.0128 0.4464 0.4464 0.4654 0.4654 0.4710 0.4710 5.5044 5.5044 9.7905 9.7905 11.0733 11.0733 11.9830 11.9830 11.9947 11.9947 12.1740 12.1740 12.4631 12.4631 13.4523 13.4523 13.4986 13.4986 13.9080 13.9080 14.0269 14.0269 14.6125 14.6125 14.7600 14.7600 14.8772 14.8772 15.1283 15.1283 15.4025 15.4025 16.1409 16.1409 k = 0.0000 0.0000 0.3182 ( 3960 PWs) bands (ev): -63.9880 -63.9880 -33.7563 -33.7563 -32.5534 -32.5534 -32.5497 -32.5497 -0.0001 -0.0001 0.0140 0.0140 0.4471 0.4471 0.4667 0.4667 0.4718 0.4718 5.5781 5.5781 9.6868 9.6868 11.0910 11.0910 11.9782 11.9782 11.9915 11.9915 12.1856 12.1856 12.5044 12.5044 13.4353 13.4353 13.4805 13.4805 13.8846 13.8846 14.0121 14.0121 14.5784 14.5784 14.7295 14.7295 14.8446 14.8446 15.1003 15.1003 15.3938 15.3938 16.1407 16.1407 k = 0.0000 0.0000 0.3295 ( 3960 PWs) bands (ev): -63.9880 -63.9880 -33.7564 -33.7564 -32.5536 -32.5536 -32.5497 -32.5497 0.0004 0.0004 0.0152 0.0152 0.4477 0.4477 0.4678 0.4678 0.4728 0.4728 5.6534 5.6534 9.5804 9.5804 11.1112 11.1112 11.9746 11.9746 11.9897 11.9897 12.1971 12.1971 12.5458 12.5458 13.4208 13.4208 13.4654 13.4654 13.8646 13.8646 13.9977 13.9977 14.5445 14.5445 14.7016 14.7016 14.8155 14.8155 15.0723 15.0723 15.3874 15.3874 16.1407 16.1407 k = 0.0000 0.0000 0.3409 ( 3952 PWs) bands (ev): -63.9870 -63.9870 -33.7565 -33.7565 -32.5537 -32.5537 -32.5497 -32.5497 0.0009 0.0009 0.0163 0.0163 0.4483 0.4483 0.4687 0.4687 0.4739 0.4739 5.7300 5.7300 9.4724 9.4724 11.1339 11.1339 11.9715 11.9715 11.9882 11.9882 12.2092 12.2092 12.5872 12.5872 13.4082 13.4082 13.4524 13.4524 13.8490 13.8490 13.9838 13.9838 14.5111 14.5111 14.6749 14.6749 14.7880 14.7880 15.0474 15.0474 15.3839 15.3839 16.1426 16.1426 k = 0.0000 0.0000 0.3523 ( 3952 PWs) bands (ev): -63.9869 -63.9869 -33.7565 -33.7565 -32.5538 -32.5538 -32.5498 -32.5498 0.0014 0.0014 0.0174 0.0174 0.4488 0.4488 0.4694 0.4694 0.4751 0.4751 5.8075 5.8075 9.3630 9.3630 11.1565 11.1565 11.9675 11.9675 11.9859 11.9859 12.2200 12.2200 12.6276 12.6276 13.3973 13.3973 13.4413 13.4413 13.8339 13.8339 13.9702 13.9702 14.4782 14.4782 14.6486 14.6486 14.7606 14.7606 15.0177 15.0177 15.3795 15.3795 16.1425 16.1425 k = 0.0000 0.0000 0.3636 ( 3960 PWs) bands (ev): -63.9879 -63.9879 -33.7566 -33.7566 -32.5540 -32.5540 -32.5498 -32.5498 0.0018 0.0018 0.0184 0.0184 0.4493 0.4493 0.4699 0.4699 0.4764 0.4764 5.8856 5.8856 9.2534 9.2534 11.1792 11.1792 11.9619 11.9619 11.9822 11.9822 12.2293 12.2293 12.6672 12.6672 13.3877 13.3877 13.4318 13.4318 13.8210 13.8210 13.9572 13.9572 14.4460 14.4460 14.6210 14.6210 14.7306 14.7306 14.9876 14.9876 15.3756 15.3756 16.1405 16.1405 k = 0.0000 0.0000 0.3750 ( 3952 PWs) bands (ev): -63.9869 -63.9869 -33.7566 -33.7566 -32.5541 -32.5541 -32.5498 -32.5498 0.0022 0.0022 0.0193 0.0193 0.4498 0.4498 0.4704 0.4704 0.4777 0.4777 5.9640 5.9640 9.1454 9.1454 11.2022 11.2022 11.9591 11.9591 11.9808 11.9808 12.2393 12.2393 12.7058 12.7058 13.3803 13.3803 13.4245 13.4245 13.8118 13.8118 13.9449 13.9449 14.4149 14.4149 14.5990 14.5990 14.7084 14.7084 14.9610 14.9610 15.3732 15.3732 16.1405 16.1405 k = 0.0000 0.0000 0.3864 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7567 -33.7567 -32.5541 -32.5541 -32.5498 -32.5498 0.0026 0.0026 0.0202 0.0202 0.4503 0.4503 0.4708 0.4708 0.4789 0.4789 6.0419 6.0419 9.0390 9.0390 11.2244 11.2244 11.9554 11.9554 11.9784 11.9784 12.2488 12.2488 12.7429 12.7429 13.3740 13.3740 13.4185 13.4185 13.8046 13.8046 13.9333 13.9333 14.3852 14.3852 14.5768 14.5768 14.6853 14.6853 14.9354 14.9354 15.3708 15.3708 16.1405 16.1405 k = 0.0000 0.0000 0.3977 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7567 -33.7567 -32.5542 -32.5542 -32.5498 -32.5498 0.0029 0.0029 0.0210 0.0210 0.4507 0.4507 0.4711 0.4711 0.4800 0.4800 6.1188 6.1188 8.9353 8.9353 11.2457 11.2457 11.9515 11.9515 11.9759 11.9759 12.2575 12.2575 12.7780 12.7780 13.3689 13.3689 13.4138 13.4138 13.7972 13.7972 13.9226 13.9226 14.3569 14.3569 14.5558 14.5558 14.6632 14.6632 14.9073 14.9073 15.3688 15.3688 16.1404 16.1404 k = 0.0000 0.0000 0.4091 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7568 -33.7568 -32.5544 -32.5544 -32.5499 -32.5499 0.0032 0.0032 0.0217 0.0217 0.4511 0.4511 0.4714 0.4714 0.4811 0.4811 6.1939 6.1939 8.8351 8.8351 11.2657 11.2657 11.9477 11.9477 11.9734 11.9734 12.2656 12.2656 12.8108 12.8108 13.3648 13.3648 13.4102 13.4102 13.7892 13.7892 13.9127 13.9127 14.3303 14.3303 14.5363 14.5363 14.6426 14.6426 14.8767 14.8767 15.3672 15.3672 16.1404 16.1404 k = 0.0000 0.0000 0.4205 ( 3952 PWs) bands (ev): -63.9867 -63.9867 -33.7568 -33.7568 -32.5545 -32.5545 -32.5499 -32.5499 0.0035 0.0035 0.0224 0.0224 0.4514 0.4514 0.4717 0.4717 0.4820 0.4820 6.2661 6.2661 8.7406 8.7406 11.2842 11.2842 11.9442 11.9442 11.9712 11.9712 12.2730 12.2730 12.8411 12.8411 13.3617 13.3617 13.4076 13.4076 13.7845 13.7845 13.9038 13.9038 14.3061 14.3061 14.5189 14.5189 14.6243 14.6243 14.8518 14.8518 15.3659 15.3659 16.1404 16.1404 k = 0.0000 0.0000 0.4318 ( 3948 PWs) bands (ev): -63.9862 -63.9862 -33.7569 -33.7569 -32.5545 -32.5545 -32.5499 -32.5499 0.0038 0.0038 0.0229 0.0229 0.4517 0.4517 0.4719 0.4719 0.4829 0.4829 6.3342 6.3342 8.6532 8.6532 11.2992 11.2992 11.9419 11.9419 11.9696 11.9696 12.2789 12.2789 12.8686 12.8686 13.3594 13.3594 13.4057 13.4057 13.7836 13.7836 13.8960 13.8960 14.2844 14.2844 14.5043 14.5043 14.6094 14.6094 14.8358 14.8358 15.3615 15.3615 16.1392 16.1392 k = 0.0000 0.0000 0.4432 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7569 -33.7569 -32.5546 -32.5546 -32.5499 -32.5499 0.0040 0.0040 0.0234 0.0234 0.4519 0.4519 0.4721 0.4721 0.4836 0.4836 6.3967 6.3967 8.5736 8.5736 11.3129 11.3129 11.9371 11.9371 11.9662 11.9662 12.2841 12.2841 12.8925 12.8925 13.3576 13.3576 13.4044 13.4044 13.7807 13.7807 13.8892 13.8892 14.2653 14.2653 14.4886 14.4886 14.5917 14.5917 14.8156 14.8156 15.3592 15.3592 16.1384 16.1384 k = 0.0000 0.0000 0.4545 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7570 -33.7570 -32.5546 -32.5546 -32.5499 -32.5499 0.0041 0.0041 0.0238 0.0238 0.4522 0.4522 0.4722 0.4722 0.4842 0.4842 6.4519 6.4519 8.5044 8.5044 11.3250 11.3250 11.9347 11.9347 11.9646 11.9646 12.2888 12.2888 12.9126 12.9126 13.3564 13.3564 13.4036 13.4036 13.7788 13.7788 13.8836 13.8836 14.2492 14.2492 14.4775 14.4775 14.5799 14.5799 14.7987 14.7987 15.3585 15.3585 16.1383 16.1383 k = 0.0000 0.0000 0.4659 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0043 0.0043 0.0241 0.0241 0.4523 0.4523 0.4723 0.4723 0.4847 0.4847 6.4978 6.4978 8.4469 8.4469 11.3346 11.3346 11.9324 11.9324 11.9630 11.9630 12.2924 12.2924 12.9287 12.9287 13.3556 13.3556 13.4031 13.4031 13.7739 13.7739 13.8792 13.8792 14.2363 14.2363 14.4682 14.4682 14.5699 14.5699 14.7761 14.7761 15.3580 15.3580 16.1383 16.1383 k = 0.0000 0.0000 0.4773 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0044 0.0044 0.0244 0.0244 0.4524 0.4524 0.4724 0.4724 0.4850 0.4850 6.5325 6.5325 8.4043 8.4043 11.3433 11.3433 11.9315 11.9315 11.9623 11.9623 12.2966 12.2966 12.9404 12.9404 13.3551 13.3551 13.4029 13.4029 13.7740 13.7740 13.8760 13.8760 14.2270 14.2270 14.4625 14.4625 14.5641 14.5641 14.7680 14.7680 15.3618 15.3618 16.1408 16.1408 k = 0.0000 0.0000 0.4886 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0044 0.0044 0.0245 0.0245 0.4525 0.4525 0.4725 0.4725 0.4852 0.4852 6.5541 6.5541 8.3778 8.3778 11.3476 11.3476 11.9307 11.9307 11.9618 11.9618 12.2982 12.2982 12.9476 12.9476 13.3549 13.3549 13.4028 13.4028 13.7735 13.7735 13.8741 13.8741 14.2214 14.2214 14.4587 14.4587 14.5601 14.5601 14.7619 14.7619 15.3616 15.3616 16.1407 16.1407 k = 0.0000 0.0000 0.5000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0000 0.0000 0.5000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0000 0.0114 0.5000 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0245 0.0245 0.4526 0.4526 0.4725 0.4725 0.4853 0.4853 6.5625 6.5625 8.3706 8.3706 11.3494 11.3494 11.9299 11.9299 11.9626 11.9626 12.2986 12.2986 12.9501 12.9501 13.3529 13.3529 13.4022 13.4022 13.7757 13.7757 13.8731 13.8731 14.2157 14.2157 14.4637 14.4637 14.5628 14.5628 14.7601 14.7601 15.3598 15.3598 16.1380 16.1380 k = 0.0000 0.0227 0.5000 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0046 0.0046 0.0245 0.0245 0.4527 0.4527 0.4724 0.4724 0.4853 0.4853 6.5656 6.5656 8.3748 8.3748 11.3517 11.3517 11.9226 11.9226 11.9619 11.9619 12.2995 12.2995 12.9504 12.9504 13.3472 13.3472 13.4008 13.4008 13.7821 13.7821 13.8719 13.8719 14.2051 14.2051 14.4737 14.4737 14.5639 14.5639 14.7591 14.7591 15.3579 15.3579 16.1319 16.1319 k = 0.0000 0.0341 0.5000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0047 0.0047 0.0245 0.0245 0.4528 0.4528 0.4723 0.4723 0.4854 0.4854 6.5708 6.5708 8.3820 8.3820 11.3550 11.3550 11.9131 11.9131 11.9608 11.9608 12.3006 12.3006 12.9509 12.9509 13.3374 13.3374 13.3995 13.3995 13.7922 13.7922 13.8700 13.8700 14.1895 14.1895 14.4915 14.4915 14.5659 14.5659 14.7577 14.7577 15.3535 15.3535 16.1210 16.1210 k = 0.0000 0.0455 0.5000 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0048 0.0048 0.0245 0.0245 0.4531 0.4531 0.4721 0.4721 0.4855 0.4855 6.5780 6.5780 8.3919 8.3919 11.3608 11.3608 11.8997 11.8997 11.9586 11.9586 12.3030 12.3030 12.9515 12.9515 13.3235 13.3235 13.3987 13.3987 13.8050 13.8050 13.8676 13.8676 14.1709 14.1709 14.5118 14.5118 14.5677 14.5677 14.7564 14.7564 15.3496 15.3496 16.1074 16.1074 k = 0.0000 0.0568 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0050 0.0050 0.0244 0.0244 0.4534 0.4534 0.4719 0.4719 0.4857 0.4857 6.5874 6.5874 8.4049 8.4049 11.3695 11.3695 11.8848 11.8848 11.9574 11.9574 12.3077 12.3077 12.9523 12.9523 13.3062 13.3062 13.3987 13.3987 13.8202 13.8202 13.8657 13.8657 14.1510 14.1510 14.5337 14.5337 14.5775 14.5775 14.7565 14.7565 15.3475 15.3475 16.0934 16.0934 k = 0.0000 0.0682 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5501 -32.5501 0.0053 0.0053 0.0244 0.0244 0.4537 0.4537 0.4717 0.4717 0.4859 0.4859 6.5987 6.5987 8.4207 8.4207 11.3777 11.3777 11.8662 11.8662 11.9562 11.9562 12.3111 12.3111 12.9530 12.9530 13.2860 13.2860 13.3994 13.3994 13.8323 13.8323 13.8664 13.8664 14.1308 14.1308 14.5504 14.5504 14.5956 14.5956 14.7535 14.7535 15.3396 15.3396 16.0716 16.0716 k = 0.0000 0.0795 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5502 -32.5502 0.0055 0.0055 0.0243 0.0243 0.4541 0.4541 0.4714 0.4714 0.4861 0.4861 6.6121 6.6121 8.4392 8.4392 11.3885 11.3885 11.8417 11.8417 11.9543 11.9543 12.3156 12.3156 12.9536 12.9536 13.2638 13.2638 13.4007 13.4007 13.8380 13.8380 13.8749 13.8749 14.1104 14.1104 14.5600 14.5600 14.6197 14.6197 14.7521 14.7521 15.3335 15.3335 16.0476 16.0476 k = 0.0000 0.0909 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5503 -32.5503 0.0058 0.0058 0.0243 0.0243 0.4546 0.4546 0.4711 0.4711 0.4864 0.4864 6.6276 6.6276 8.4606 8.4606 11.4012 11.4012 11.8134 11.8134 11.9522 11.9522 12.3208 12.3208 12.9541 12.9541 13.2400 13.2400 13.4025 13.4025 13.8362 13.8362 13.8911 13.8911 14.0907 14.0907 14.5667 14.5667 14.6476 14.6476 14.7507 14.7507 15.3269 15.3269 16.0202 16.0202 k = 0.0000 0.1023 0.5000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7572 -33.7572 -32.5547 -32.5547 -32.5504 -32.5504 0.0062 0.0062 0.0242 0.0242 0.4551 0.4551 0.4707 0.4707 0.4867 0.4867 6.6450 6.6450 8.4846 8.4846 11.4161 11.4161 11.7824 11.7824 11.9494 11.9494 12.3252 12.3252 12.9543 12.9543 13.2151 13.2151 13.4046 13.4046 13.8310 13.8310 13.9101 13.9101 14.0728 14.0728 14.5718 14.5718 14.6782 14.6782 14.7485 14.7485 15.3218 15.3218 15.9870 15.9870 k = 0.0000 0.1136 0.5000 ( 3952 PWs) bands (ev): -63.9866 -63.9866 -33.7572 -33.7572 -32.5547 -32.5547 -32.5505 -32.5505 0.0066 0.0066 0.0241 0.0241 0.4557 0.4557 0.4703 0.4703 0.4871 0.4871 6.6645 6.6645 8.5115 8.5115 11.4316 11.4316 11.7480 11.7480 11.9476 11.9476 12.3324 12.3324 12.9541 12.9541 13.1894 13.1894 13.4073 13.4073 13.8252 13.8252 13.9290 13.9290 14.0571 14.0571 14.5791 14.5791 14.7097 14.7097 14.7461 14.7461 15.3136 15.3136 15.9555 15.9555 k = 0.0000 0.1250 0.5000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7573 -33.7573 -32.5547 -32.5547 -32.5506 -32.5506 0.0070 0.0070 0.0240 0.0240 0.4563 0.4563 0.4699 0.4699 0.4875 0.4875 6.6859 6.6859 8.5407 8.5407 11.4486 11.4486 11.7089 11.7089 11.9443 11.9443 12.3392 12.3392 12.9535 12.9535 13.1630 13.1630 13.4104 13.4104 13.8176 13.8176 13.9458 13.9458 14.0446 14.0446 14.5833 14.5833 14.7374 14.7374 14.7444 14.7444 15.3051 15.3051 15.9192 15.9192 k = 0.0000 0.1364 0.5000 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7573 -33.7573 -32.5547 -32.5547 -32.5507 -32.5507 0.0074 0.0074 0.0239 0.0239 0.4569 0.4569 0.4695 0.4695 0.4879 0.4879 6.7092 6.7092 8.5726 8.5726 11.4663 11.4663 11.6672 11.6672 11.9414 11.9414 12.3478 12.3478 12.9523 12.9523 13.1365 13.1365 13.4141 13.4141 13.8100 13.8100 13.9586 13.9586 14.0381 14.0381 14.5891 14.5891 14.7372 14.7372 14.7723 14.7723 15.2941 15.2941 15.8828 15.8828 k = 0.0000 0.1477 0.5000 ( 3968 PWs) bands (ev): -63.9885 -63.9885 -33.7574 -33.7574 -32.5548 -32.5548 -32.5509 -32.5509 0.0079 0.0079 0.0237 0.0237 0.4575 0.4575 0.4690 0.4690 0.4884 0.4884 6.7345 6.7345 8.6069 8.6069 11.4847 11.4847 11.6217 11.6217 11.9370 11.9370 12.3547 12.3547 12.9504 12.9504 13.1096 13.1096 13.4176 13.4176 13.8006 13.8006 13.9632 13.9632 14.0396 14.0396 14.5919 14.5919 14.7289 14.7289 14.8023 14.8023 15.2820 15.2820 15.8400 15.8400 k = 0.0000 0.1591 0.5000 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7575 -33.7575 -32.5547 -32.5547 -32.5510 -32.5510 0.0083 0.0083 0.0236 0.0236 0.4581 0.4581 0.4686 0.4686 0.4890 0.4890 6.7616 6.7616 8.6438 8.6438 11.5061 11.5061 11.5760 11.5760 11.9337 11.9337 12.3620 12.3620 12.9478 12.9478 13.0830 13.0830 13.4215 13.4215 13.7928 13.7928 13.9623 13.9623 14.0501 14.0501 14.5979 14.5979 14.7230 14.7230 14.8357 14.8357 15.2723 15.2723 15.7958 15.7958 k = 0.0000 0.1705 0.5000 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7575 -33.7575 -32.5547 -32.5547 -32.5511 -32.5511 0.0088 0.0088 0.0235 0.0235 0.4588 0.4588 0.4681 0.4681 0.4896 0.4896 6.7906 6.7906 8.6831 8.6831 11.5253 11.5253 11.5287 11.5287 11.9300 11.9300 12.3713 12.3713 12.9445 12.9445 13.0566 13.0566 13.4261 13.4261 13.7844 13.7844 13.9576 13.9576 14.0655 14.0655 14.6029 14.6029 14.7174 14.7174 14.8670 14.8670 15.2607 15.2607 15.7522 15.7522 k = 0.0000 0.1818 0.5000 ( 3962 PWs) bands (ev): -63.9877 -63.9877 -33.7576 -33.7576 -32.5547 -32.5547 -32.5513 -32.5513 0.0093 0.0093 0.0233 0.0233 0.4594 0.4594 0.4677 0.4677 0.4902 0.4902 6.8214 6.8214 8.7246 8.7246 11.4746 11.4746 11.5507 11.5507 11.9265 11.9265 12.3816 12.3816 12.9403 12.9403 13.0306 13.0306 13.4315 13.4315 13.7769 13.7769 13.9525 13.9525 14.0824 14.0824 14.6090 14.6090 14.7104 14.7104 14.8995 14.8995 15.2485 15.2485 15.7080 15.7080 k = 0.0000 0.1932 0.5000 ( 3962 PWs) bands (ev): -63.9877 -63.9877 -33.7576 -33.7576 -32.5547 -32.5547 -32.5514 -32.5514 0.0098 0.0098 0.0231 0.0231 0.4599 0.4599 0.4673 0.4673 0.4909 0.4909 6.8540 6.8540 8.7683 8.7683 11.4196 11.4196 11.5744 11.5744 11.9224 11.9224 12.3918 12.3918 12.9351 12.9351 13.0051 13.0051 13.4369 13.4369 13.7687 13.7687 13.9476 13.9476 14.1002 14.1002 14.6136 14.6136 14.7032 14.7032 14.9299 14.9299 15.2361 15.2361 15.6617 15.6617 k = 0.0000 0.2045 0.5000 ( 3958 PWs) bands (ev): -63.9872 -63.9872 -33.7577 -33.7577 -32.5547 -32.5547 -32.5516 -32.5516 0.0104 0.0104 0.0230 0.0230 0.4604 0.4604 0.4670 0.4670 0.4917 0.4917 6.8883 6.8883 8.8142 8.8142 11.3623 11.3623 11.5992 11.5992 11.9186 11.9186 12.4024 12.4024 12.9288 12.9288 12.9805 12.9805 13.4429 13.4429 13.7617 13.7617 13.9440 13.9440 14.1187 14.1187 14.6189 14.6189 14.6977 14.6977 14.9598 14.9598 15.2241 15.2241 15.6145 15.6145 k = 0.0000 0.2159 0.5000 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7577 -33.7577 -32.5547 -32.5547 -32.5517 -32.5517 0.0109 0.0109 0.0228 0.0228 0.4608 0.4608 0.4668 0.4668 0.4925 0.4925 6.9242 6.9242 8.8619 8.8619 11.3029 11.3029 11.6244 11.6244 11.9142 11.9142 12.4138 12.4138 12.9211 12.9211 12.9571 12.9571 13.4496 13.4496 13.7540 13.7540 13.9419 13.9419 14.1360 14.1360 14.6231 14.6231 14.6895 14.6895 14.9890 14.9890 15.2116 15.2116 15.5674 15.5674 k = 0.0000 0.2273 0.5000 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7578 -33.7578 -32.5547 -32.5547 -32.5519 -32.5519 0.0114 0.0114 0.0226 0.0226 0.4610 0.4610 0.4667 0.4667 0.4933 0.4933 6.9616 6.9616 8.9113 8.9113 11.2410 11.2410 11.6497 11.6497 11.9101 11.9101 12.4254 12.4254 12.9108 12.9108 12.9361 12.9361 13.4567 13.4567 13.7483 13.7483 13.9411 13.9411 14.1513 14.1513 14.6282 14.6282 14.6781 14.6781 15.0162 15.0162 15.1984 15.1984 15.5194 15.5194 k = 0.0000 0.2386 0.5000 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7579 -33.7579 -32.5546 -32.5546 -32.5520 -32.5520 0.0119 0.0119 0.0224 0.0224 0.4610 0.4610 0.4668 0.4668 0.4942 0.4942 7.0007 7.0007 8.9626 8.9626 11.1790 11.1790 11.6764 11.6764 11.9056 11.9056 12.4376 12.4376 12.8961 12.8961 12.9199 12.9199 13.4647 13.4647 13.7414 13.7414 13.9429 13.9429 14.1667 14.1667 14.6320 14.6320 14.6691 14.6691 15.0464 15.0464 15.1867 15.1867 15.4715 15.4715 k = 0.0000 0.2500 0.5000 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7579 -33.7579 -32.5546 -32.5546 -32.5522 -32.5522 0.0125 0.0125 0.0222 0.0222 0.4608 0.4608 0.4671 0.4671 0.4951 0.4951 7.0410 7.0410 9.0152 9.0152 11.1141 11.1141 11.7023 11.7023 11.9009 11.9009 12.4490 12.4490 12.8774 12.8774 12.9079 12.9079 13.4725 13.4725 13.7347 13.7347 13.9455 13.9455 14.1801 14.1801 14.6354 14.6354 14.6583 14.6583 15.0720 15.0720 15.1739 15.1739 15.4220 15.4220 k = 0.0000 0.2614 0.5000 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7580 -33.7580 -32.5546 -32.5546 -32.5524 -32.5524 0.0130 0.0130 0.0219 0.0219 0.4606 0.4606 0.4674 0.4674 0.4961 0.4961 7.0827 7.0827 9.0692 9.0692 11.0478 11.0478 11.7269 11.7269 11.8962 11.8962 12.4606 12.4606 12.8575 12.8575 12.8976 12.8976 13.4808 13.4808 13.7282 13.7282 13.9496 13.9496 14.1906 14.1906 14.6382 14.6382 14.6457 14.6457 15.0947 15.0947 15.1597 15.1597 15.3724 15.3724 k = 0.0000 0.2727 0.5000 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7581 -33.7581 -32.5546 -32.5546 -32.5525 -32.5525 0.0135 0.0135 0.0217 0.0217 0.4602 0.4602 0.4678 0.4678 0.4971 0.4971 7.1256 7.1256 9.1244 9.1244 10.9809 10.9809 11.7537 11.7537 11.8914 11.8914 12.4705 12.4705 12.8381 12.8381 12.8876 12.8876 13.4875 13.4875 13.7218 13.7218 13.9556 13.9556 14.2005 14.2005 14.6325 14.6325 14.6417 14.6417 15.1125 15.1125 15.1564 15.1564 15.3205 15.3205 k = 0.0000 0.2841 0.5000 ( 3952 PWs) bands (ev): -63.9862 -63.9862 -33.7581 -33.7581 -32.5546 -32.5546 -32.5527 -32.5527 0.0139 0.0139 0.0215 0.0215 0.4598 0.4598 0.4682 0.4682 0.4981 0.4981 7.1695 7.1695 9.1805 9.1805 10.9125 10.9125 11.7786 11.7786 11.8867 11.8867 12.4823 12.4823 12.8195 12.8195 12.8777 12.8777 13.4966 13.4966 13.7160 13.7160 13.9625 13.9625 14.2087 14.2087 14.6203 14.6203 14.6441 14.6441 15.1130 15.1130 15.1646 15.1646 15.2721 15.2721 k = 0.0000 0.2955 0.5000 ( 3954 PWs) bands (ev): -63.9865 -63.9865 -33.7582 -33.7582 -32.5546 -32.5546 -32.5528 -32.5528 0.0144 0.0144 0.0213 0.0213 0.4594 0.4594 0.4687 0.4687 0.4991 0.4991 7.2143 7.2143 9.2373 9.2373 10.8433 10.8433 11.8022 11.8022 11.8820 11.8820 12.4939 12.4939 12.8023 12.8023 12.8678 12.8678 13.5061 13.5061 13.7107 13.7107 13.9703 13.9703 14.2146 14.2146 14.6077 14.6077 14.6465 14.6465 15.1021 15.1021 15.1793 15.1793 15.2258 15.2258 k = 0.0000 0.3068 0.5000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7583 -33.7583 -32.5546 -32.5546 -32.5530 -32.5530 0.0149 0.0149 0.0210 0.0210 0.4589 0.4589 0.4692 0.4692 0.5002 0.5002 7.2598 7.2598 9.2945 9.2945 10.7736 10.7736 11.8251 11.8251 11.8773 11.8773 12.5048 12.5048 12.7865 12.7865 12.8579 12.8579 13.5152 13.5152 13.7050 13.7050 13.9790 13.9790 14.2190 14.2190 14.5952 14.5952 14.6485 14.6485 15.0887 15.0887 15.1685 15.1685 15.2055 15.2055 k = 0.0000 0.3182 0.5000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7583 -33.7583 -32.5546 -32.5546 -32.5531 -32.5531 0.0153 0.0153 0.0208 0.0208 0.4584 0.4584 0.4696 0.4696 0.5012 0.5012 7.3061 7.3061 9.3519 9.3519 10.7048 10.7048 11.8453 11.8453 11.8727 11.8727 12.5167 12.5167 12.7725 12.7725 12.8480 12.8480 13.5266 13.5266 13.7000 13.7000 13.9893 13.9893 14.2203 14.2203 14.5818 14.5818 14.6503 14.6503 15.0705 15.0705 15.1259 15.1259 15.2242 15.2242 k = 0.0000 0.3295 0.5000 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7584 -33.7584 -32.5547 -32.5547 -32.5532 -32.5532 0.0157 0.0157 0.0206 0.0206 0.4579 0.4579 0.4700 0.4700 0.5022 0.5022 7.3525 7.3525 9.4092 9.4092 10.6357 10.6357 11.8658 11.8658 11.8683 11.8683 12.5275 12.5275 12.7603 12.7603 12.8383 12.8383 13.5365 13.5365 13.6952 13.6952 13.9998 13.9998 14.2209 14.2209 14.5706 14.5706 14.6520 14.6520 15.0570 15.0570 15.0800 15.0800 15.2414 15.2414 k = 0.0000 0.3409 0.5000 ( 3952 PWs) bands (ev): -63.9861 -63.9861 -33.7584 -33.7584 -32.5546 -32.5546 -32.5533 -32.5533 0.0161 0.0161 0.0203 0.0203 0.4575 0.4575 0.4705 0.4705 0.5032 0.5032 7.3992 7.3992 9.4660 9.4660 10.5678 10.5678 11.8640 11.8640 11.8842 11.8842 12.5387 12.5387 12.7501 12.7501 12.8287 12.8287 13.5498 13.5498 13.6918 13.6918 14.0112 14.0112 14.2188 14.2188 14.5597 14.5597 14.6537 14.6537 15.0362 15.0362 15.0432 15.0432 15.2612 15.2612 k = 0.0000 0.3523 0.5000 ( 3960 PWs) bands (ev): -63.9871 -63.9871 -33.7585 -33.7585 -32.5547 -32.5547 -32.5535 -32.5535 0.0165 0.0165 0.0201 0.0201 0.4571 0.4571 0.4708 0.4708 0.5042 0.5042 7.4454 7.4454 9.5220 9.5220 10.5003 10.5003 11.8599 11.8599 11.8985 11.8985 12.5487 12.5487 12.7419 12.7419 12.8195 12.8195 13.5600 13.5600 13.6881 13.6881 14.0223 14.0223 14.2134 14.2134 14.5458 14.5458 14.6550 14.6550 14.9930 14.9930 15.0248 15.0248 15.2735 15.2735 k = 0.0000 0.3636 0.5000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7585 -33.7585 -32.5547 -32.5547 -32.5536 -32.5536 0.0168 0.0168 0.0199 0.0199 0.4566 0.4566 0.4712 0.4712 0.5052 0.5052 7.4914 7.4914 9.5769 9.5769 10.4348 10.4348 11.8563 11.8563 11.9125 11.9125 12.5578 12.5578 12.7361 12.7361 12.8107 12.8107 13.5688 13.5688 13.6893 13.6893 14.0340 14.0340 14.2078 14.2078 14.5379 14.5379 14.6567 14.6567 14.9504 14.9504 15.0109 15.0109 15.2890 15.2890 k = 0.0000 0.3750 0.5000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7586 -33.7586 -32.5547 -32.5547 -32.5537 -32.5537 0.0171 0.0171 0.0197 0.0197 0.4562 0.4562 0.4715 0.4715 0.5061 0.5061 7.5365 7.5365 9.6301 9.6301 10.3713 10.3713 11.8526 11.8526 11.9226 11.9226 12.5671 12.5671 12.7322 12.7322 12.8023 12.8023 13.5811 13.5811 13.6888 13.6888 14.0457 14.0457 14.1995 14.1995 14.5227 14.5227 14.6580 14.6580 14.9110 14.9110 14.9948 14.9948 15.3049 15.3049 k = 0.0000 0.3864 0.5000 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7586 -33.7586 -32.5547 -32.5547 -32.5537 -32.5537 0.0174 0.0174 0.0195 0.0195 0.4559 0.4559 0.4718 0.4718 0.5069 0.5069 7.5804 7.5804 9.6811 9.6811 10.3102 10.3102 11.8492 11.8492 11.9313 11.9313 12.5758 12.5758 12.7303 12.7303 12.7945 12.7945 13.5922 13.5922 13.6866 13.6866 14.0571 14.0571 14.1910 14.1910 14.5104 14.5104 14.6589 14.6589 14.8734 14.8734 14.9815 14.9815 15.3176 15.3176 k = 0.0000 0.3977 0.5000 ( 3952 PWs) bands (ev): -63.9861 -63.9861 -33.7587 -33.7587 -32.5548 -32.5548 -32.5538 -32.5538 0.0177 0.0177 0.0194 0.0194 0.4555 0.4555 0.4721 0.4721 0.5078 0.5078 7.6227 7.6227 9.7295 9.7295 10.2523 10.2523 11.8460 11.8460 11.9377 11.9377 12.5837 12.5837 12.7303 12.7303 12.7872 12.7872 13.6047 13.6047 13.6868 13.6868 14.0682 14.0682 14.1817 14.1817 14.4973 14.4973 14.6597 14.6597 14.8388 14.8388 14.9696 14.9696 15.3319 15.3319 k = 0.0000 0.4091 0.5000 ( 3956 PWs) bands (ev): -63.9865 -63.9865 -33.7587 -33.7587 -32.5548 -32.5548 -32.5538 -32.5538 0.0179 0.0179 0.0192 0.0192 0.4552 0.4552 0.4723 0.4723 0.5085 0.5085 7.6626 7.6626 9.7748 9.7748 10.1978 10.1978 11.8431 11.8431 11.9415 11.9415 12.5908 12.5908 12.7318 12.7318 12.7806 12.7806 13.6129 13.6129 13.6852 13.6852 14.0785 14.0785 14.1720 14.1720 14.4825 14.4825 14.6604 14.6604 14.8056 14.8056 14.9580 14.9580 15.3412 15.3412 k = 0.0000 0.4205 0.5000 ( 3958 PWs) bands (ev): -63.9868 -63.9868 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0181 0.0181 0.0191 0.0191 0.4550 0.4550 0.4726 0.4726 0.5092 0.5092 7.6999 7.6999 9.8165 9.8165 10.1476 10.1476 11.8404 11.8404 11.9428 11.9428 12.5973 12.5973 12.7345 12.7345 12.7746 12.7746 13.6230 13.6230 13.6841 13.6841 14.0881 14.0881 14.1624 14.1624 14.4712 14.4712 14.6609 14.6609 14.7760 14.7760 14.9436 14.9436 15.3507 15.3507 k = 0.0000 0.4318 0.5000 ( 3954 PWs) bands (ev): -63.9863 -63.9863 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0191 0.0191 0.4547 0.4547 0.4727 0.4727 0.5098 0.5098 7.7340 7.7340 9.8540 9.8540 10.1023 10.1023 11.8381 11.8381 11.9444 11.9444 12.6030 12.6030 12.7381 12.7381 12.7694 12.7694 13.6315 13.6315 13.6838 13.6838 14.0968 14.0968 14.1539 14.1539 14.4636 14.4636 14.6614 14.6614 14.7495 14.7495 14.9363 14.9363 15.3598 15.3598 k = 0.0000 0.4432 0.5000 ( 3950 PWs) bands (ev): -63.9858 -63.9858 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4545 0.4545 0.4729 0.4729 0.5103 0.5103 7.7641 7.7641 9.8868 9.8868 10.0625 10.0625 11.8361 11.8361 11.9444 11.9444 12.6080 12.6080 12.7419 12.7419 12.7650 12.7650 13.6404 13.6404 13.6867 13.6867 14.1043 14.1043 14.1457 14.1457 14.4531 14.4531 14.6618 14.6618 14.7266 14.7266 14.9308 14.9308 15.3669 15.3669 k = 0.0000 0.4545 0.5000 ( 3946 PWs) bands (ev): -63.9853 -63.9853 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4544 0.4544 0.4730 0.4730 0.5107 0.5107 7.7898 7.7898 9.9143 9.9143 10.0289 10.0289 11.8345 11.8345 11.9438 11.9438 12.6120 12.6120 12.7458 12.7458 12.7614 12.7614 13.6483 13.6483 13.6890 13.6890 14.1105 14.1105 14.1388 14.1388 14.4454 14.4454 14.6622 14.6622 14.7073 14.7073 14.9270 14.9270 15.3723 15.3723 k = 0.0000 0.4659 0.5000 ( 3942 PWs) bands (ev): -63.9848 -63.9848 -33.7588 -33.7588 -32.5550 -32.5550 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4542 0.4542 0.4731 0.4731 0.5110 0.5110 7.8103 7.8103 9.9361 9.9361 10.0022 10.0022 11.8332 11.8332 11.9423 11.9423 12.6152 12.6152 12.7490 12.7490 12.7587 12.7587 13.6568 13.6568 13.6933 13.6933 14.1153 14.1153 14.1333 14.1333 14.4378 14.4378 14.6624 14.6624 14.6920 14.6920 14.9240 14.9240 15.3746 15.3746 k = 0.0000 0.4773 0.5000 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7588 -33.7588 -32.5550 -32.5550 -32.5539 -32.5539 0.0183 0.0183 0.0192 0.0192 0.4541 0.4541 0.4732 0.4732 0.5113 0.5113 7.8257 7.8257 9.9513 9.9513 9.9834 9.9834 11.8323 11.8323 11.9417 11.9417 12.6174 12.6174 12.7513 12.7513 12.7571 12.7571 13.6599 13.6599 13.6952 13.6952 14.1182 14.1182 14.1298 14.1298 14.4339 14.4339 14.6626 14.6626 14.6807 14.6807 14.9216 14.9216 15.3811 15.3811 k = 0.0000 0.4886 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4541 0.4541 0.4733 0.4733 0.5114 0.5114 7.8350 7.8350 9.9585 9.9585 9.9740 9.9740 11.8317 11.8317 11.9419 11.9419 12.6188 12.6188 12.7522 12.7522 12.7567 12.7567 13.6617 13.6617 13.6967 13.6967 14.1193 14.1193 14.1283 14.1283 14.4379 14.4379 14.6627 14.6627 14.6739 14.6739 14.9209 14.9209 15.3840 15.3840 k = 0.0000 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4541 0.4541 0.4733 0.4733 0.5115 0.5115 7.8381 7.8381 9.9590 9.9590 9.9728 9.9728 11.8315 11.8315 11.9416 11.9416 12.6192 12.6192 12.7523 12.7523 12.7568 12.7568 13.6621 13.6621 13.6971 13.6971 14.1194 14.1194 14.1281 14.1281 14.4367 14.4367 14.6627 14.6627 14.6716 14.6716 14.9203 14.9203 15.3846 15.3846 k = 0.0000 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4541 0.4541 0.4733 0.4733 0.5115 0.5115 7.8381 7.8381 9.9590 9.9590 9.9728 9.9728 11.8315 11.8315 11.9416 11.9416 12.6192 12.6192 12.7523 12.7523 12.7568 12.7568 13.6621 13.6621 13.6971 13.6971 14.1194 14.1194 14.1281 14.1281 14.4367 14.4367 14.6627 14.6627 14.6716 14.6716 14.9203 14.9203 15.3846 15.3846 k = 0.0114 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4540 0.4540 0.4733 0.4733 0.5114 0.5114 7.8381 7.8381 9.9603 9.9603 9.9741 9.9741 11.8322 11.8322 11.9407 11.9407 12.6210 12.6210 12.7519 12.7519 12.7564 12.7564 13.6605 13.6605 13.6955 13.6955 14.1215 14.1215 14.1302 14.1302 14.4296 14.4296 14.6626 14.6626 14.6790 14.6790 14.9209 14.9209 15.3843 15.3843 k = 0.0227 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4539 0.4539 0.4734 0.4734 0.5114 0.5114 7.8382 7.8382 9.9642 9.9642 9.9780 9.9780 11.8341 11.8341 11.9379 11.9379 12.6262 12.6262 12.7506 12.7506 12.7554 12.7554 13.6556 13.6556 13.6907 13.6907 14.1275 14.1275 14.1364 14.1364 14.4103 14.4103 14.6625 14.6625 14.6990 14.6990 14.9227 14.9227 15.3835 15.3835 k = 0.0341 0.5000 0.5000 ( 3940 PWs) bands (ev): -63.9846 -63.9846 -33.7588 -33.7588 -32.5550 -32.5550 -32.5540 -32.5540 0.0181 0.0181 0.0192 0.0192 0.4537 0.4537 0.4735 0.4735 0.5112 0.5112 7.8382 7.8382 9.9707 9.9707 9.9844 9.9844 11.8374 11.8374 11.9338 11.9338 12.6349 12.6349 12.7485 12.7485 12.7536 12.7536 13.6415 13.6415 13.6768 13.6768 14.1370 14.1370 14.1461 14.1461 14.3824 14.3824 14.6622 14.6622 14.7272 14.7272 14.9265 14.9265 15.3807 15.3807 k = 0.0455 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7589 -33.7589 -32.5550 -32.5550 -32.5540 -32.5540 0.0180 0.0180 0.0191 0.0191 0.4535 0.4535 0.4736 0.4736 0.5110 0.5110 7.8381 7.8381 9.9797 9.9797 9.9935 9.9935 11.8419 11.8419 11.9275 11.9275 12.6469 12.6469 12.7455 12.7455 12.7512 12.7512 13.6290 13.6290 13.6647 13.6647 14.1493 14.1493 14.1591 14.1591 14.3511 14.3511 14.6619 14.6619 14.7603 14.7603 14.9303 14.9303 15.3765 15.3765 k = 0.0568 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7589 -33.7589 -32.5549 -32.5549 -32.5540 -32.5540 0.0178 0.0178 0.0191 0.0191 0.4531 0.4531 0.4738 0.4738 0.5108 0.5108 7.8383 7.8383 9.9914 9.9914 10.0051 10.0051 11.8478 11.8478 11.9195 11.9195 12.6621 12.6621 12.7416 12.7416 12.7481 12.7481 13.6170 13.6170 13.6531 13.6531 14.1640 14.1640 14.1748 14.1748 14.3178 14.3178 14.6614 14.6614 14.7964 14.7964 14.9353 14.9353 15.3740 15.3740 k = 0.0682 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7589 -33.7589 -32.5549 -32.5549 -32.5541 -32.5541 0.0176 0.0176 0.0190 0.0190 0.4527 0.4527 0.4741 0.4741 0.5105 0.5105 7.8385 7.8385 10.0055 10.0055 10.0193 10.0193 11.8549 11.8549 11.9102 11.9102 12.6802 12.6802 12.7370 12.7370 12.7446 12.7446 13.6037 13.6037 13.6403 13.6403 14.1795 14.1795 14.1929 14.1929 14.2845 14.2845 14.6608 14.6608 14.8342 14.8342 14.9413 14.9413 15.3709 15.3709 k = 0.0795 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7589 -33.7589 -32.5549 -32.5549 -32.5541 -32.5541 0.0174 0.0174 0.0189 0.0189 0.4522 0.4522 0.4744 0.4744 0.5101 0.5101 7.8387 7.8387 10.0222 10.0222 10.0360 10.0360 11.8632 11.8632 11.8996 11.8996 12.7005 12.7005 12.7315 12.7315 12.7411 12.7411 13.5893 13.5893 13.6267 13.6267 14.1920 14.1920 14.2126 14.2126 14.2552 14.2552 14.6602 14.6602 14.8731 14.8731 14.9484 14.9484 15.3673 15.3673 k = 0.0909 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7589 -33.7589 -32.5549 -32.5549 -32.5541 -32.5541 0.0172 0.0172 0.0188 0.0188 0.4517 0.4517 0.4747 0.4747 0.5098 0.5098 7.8390 7.8390 10.0413 10.0413 10.0551 10.0551 11.8728 11.8728 11.8878 11.8878 12.7191 12.7191 12.7253 12.7253 12.7415 12.7415 13.5745 13.5745 13.6126 13.6126 14.1867 14.1867 14.2336 14.2336 14.2447 14.2447 14.6595 14.6595 14.9125 14.9125 14.9563 14.9563 15.3630 15.3630 k = 0.1023 0.5000 0.5000 ( 3936 PWs) bands (ev): -63.9840 -63.9840 -33.7589 -33.7589 -32.5548 -32.5548 -32.5542 -32.5542 0.0169 0.0169 0.0187 0.0187 0.4511 0.4511 0.4751 0.4751 0.5093 0.5093 7.8398 7.8398 10.0629 10.0629 10.0767 10.0767 11.8762 11.8762 11.8837 11.8837 12.7183 12.7183 12.7227 12.7227 12.7595 12.7595 13.5605 13.5605 13.5994 13.5994 14.1597 14.1597 14.2556 14.2556 14.2571 14.2571 14.6586 14.6586 14.9523 14.9523 14.9688 14.9688 15.3652 15.3652 k = 0.1136 0.5000 0.5000 ( 3952 PWs) bands (ev): -63.9860 -63.9860 -33.7589 -33.7589 -32.5549 -32.5549 -32.5542 -32.5542 0.0166 0.0166 0.0185 0.0185 0.4504 0.4504 0.4755 0.4755 0.5089 0.5089 7.8396 7.8396 10.0869 10.0869 10.1007 10.1007 11.8608 11.8608 11.8957 11.8957 12.7105 12.7105 12.7176 12.7176 12.7868 12.7868 13.5443 13.5443 13.5842 13.5842 14.1179 14.1179 14.2755 14.2755 14.2777 14.2777 14.6577 14.6577 14.9750 14.9750 14.9864 14.9864 15.3513 15.3513 k = 0.1250 0.5000 0.5000 ( 3952 PWs) bands (ev): -63.9859 -63.9859 -33.7589 -33.7589 -32.5548 -32.5548 -32.5543 -32.5543 0.0162 0.0162 0.0184 0.0184 0.4497 0.4497 0.4760 0.4760 0.5084 0.5084 7.8400 7.8400 10.1132 10.1132 10.1269 10.1269 11.8465 11.8465 11.9089 11.9089 12.7021 12.7021 12.7108 12.7108 12.8186 12.8186 13.5296 13.5296 13.5705 13.5705 14.0830 14.0830 14.2967 14.2967 14.3003 14.3003 14.6568 14.6568 14.9848 14.9848 15.0258 15.0258 15.3451 15.3451 k = 0.1364 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9849 -63.9849 -33.7589 -33.7589 -32.5548 -32.5548 -32.5543 -32.5543 0.0159 0.0159 0.0182 0.0182 0.4489 0.4489 0.4765 0.4765 0.5078 0.5078 7.8405 7.8405 10.1418 10.1418 10.1556 10.1556 11.8318 11.8318 11.9232 11.9232 12.6933 12.6933 12.7034 12.7034 12.8531 12.8531 13.5188 13.5188 13.5606 13.5606 14.0505 14.0505 14.3193 14.3193 14.3237 14.3237 14.6557 14.6557 14.9955 14.9955 15.0665 15.0665 15.3388 15.3388 k = 0.1477 0.5000 0.5000 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7590 -33.7590 -32.5548 -32.5548 -32.5544 -32.5544 0.0155 0.0155 0.0180 0.0180 0.4480 0.4480 0.4771 0.4771 0.5073 0.5073 7.8405 7.8405 10.1725 10.1725 10.1863 10.1863 11.8171 11.8171 11.9386 11.9386 12.6835 12.6835 12.6948 12.6948 12.8921 12.8921 13.5023 13.5023 13.5452 13.5452 14.0120 14.0120 14.3396 14.3396 14.3449 14.3449 14.6546 14.6546 15.0190 15.0190 15.1021 15.1021 15.3251 15.3251 k = 0.1591 0.5000 0.5000 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7590 -33.7590 -32.5548 -32.5548 -32.5545 -32.5545 0.0151 0.0151 0.0178 0.0178 0.4471 0.4471 0.4777 0.4777 0.5067 0.5067 7.8410 7.8410 10.2054 10.2054 10.2191 10.2191 11.8013 11.8013 11.9551 11.9551 12.6734 12.6734 12.6858 12.6858 12.9317 12.9317 13.4894 13.4894 13.5332 13.5332 13.9778 13.9778 14.3606 14.3606 14.3663 14.3663 14.6534 14.6534 15.0295 15.0295 15.1402 15.1402 15.3170 15.3170 k = 0.1705 0.5000 0.5000 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7590 -33.7590 -32.5547 -32.5547 -32.5545 -32.5545 0.0147 0.0147 0.0176 0.0176 0.4462 0.4462 0.4783 0.4783 0.5061 0.5061 7.8416 7.8416 10.2403 10.2403 10.2540 10.2540 11.7853 11.7853 11.9726 11.9726 12.6629 12.6629 12.6765 12.6765 12.9735 12.9735 13.4772 13.4772 13.5220 13.5220 13.9443 13.9443 14.3809 14.3809 14.3870 14.3870 14.6522 14.6522 15.0401 15.0401 15.1773 15.1773 15.3085 15.3085 k = 0.1818 0.5000 0.5000 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7590 -33.7590 -32.5547 -32.5547 -32.5546 -32.5546 0.0142 0.0142 0.0174 0.0174 0.4451 0.4451 0.4790 0.4790 0.5055 0.5055 7.8423 7.8423 10.2772 10.2772 10.2909 10.2909 11.7692 11.7692 11.9911 11.9911 12.6522 12.6522 12.6668 12.6668 13.0174 13.0174 13.4659 13.4659 13.5116 13.5116 13.9115 13.9115 14.4002 14.4002 14.4066 14.4066 14.6509 14.6509 15.0505 15.0505 15.2128 15.2128 15.3004 15.3004 k = 0.1932 0.5000 0.5000 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7590 -33.7590 -32.5547 -32.5547 -32.5546 -32.5546 0.0138 0.0138 0.0171 0.0171 0.4441 0.4441 0.4797 0.4797 0.5049 0.5049 7.8430 7.8430 10.3160 10.3160 10.3296 10.3296 11.7526 11.7526 12.0105 12.0105 12.6414 12.6414 12.6570 12.6570 13.0620 13.0620 13.4565 13.4565 13.5030 13.5030 13.8806 13.8806 14.4186 14.4186 14.4254 14.4254 14.6496 14.6496 15.0557 15.0557 15.2440 15.2440 15.2961 15.2961 k = 0.2045 0.5000 0.5000 ( 3956 PWs) bands (ev): -63.9864 -63.9864 -33.7590 -33.7590 -32.5548 -32.5548 -32.5546 -32.5546 0.0133 0.0133 0.0168 0.0168 0.4430 0.4430 0.4804 0.4804 0.5043 0.5043 7.8435 7.8435 10.3563 10.3563 10.3699 10.3699 11.7366 11.7366 12.0308 12.0308 12.6296 12.6296 12.6462 12.6462 13.1100 13.1100 13.4435 13.4435 13.4908 13.4908 13.8504 13.8504 14.4336 14.4336 14.4406 14.4406 14.6482 14.6482 15.0654 15.0654 15.2545 15.2545 15.3070 15.3070 k = 0.2159 0.5000 0.5000 ( 3956 PWs) bands (ev): -63.9864 -63.9864 -33.7591 -33.7591 -32.5549 -32.5549 -32.5546 -32.5546 0.0128 0.0128 0.0165 0.0165 0.4419 0.4419 0.4812 0.4812 0.5037 0.5037 7.8443 7.8443 10.3983 10.3983 10.4118 10.4118 11.7204 11.7204 12.0519 12.0519 12.6185 12.6185 12.6360 12.6360 13.1597 13.1597 13.4348 13.4348 13.4827 13.4827 13.8199 13.8199 14.4487 14.4487 14.4558 14.4558 14.6468 14.6468 15.0745 15.0745 15.2481 15.2481 15.3359 15.3359 k = 0.2273 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7591 -33.7591 -32.5550 -32.5550 -32.5545 -32.5545 0.0123 0.0123 0.0161 0.0161 0.4408 0.4408 0.4820 0.4820 0.5031 0.5031 7.8451 7.8451 10.4418 10.4418 10.4552 10.4552 11.7041 11.7041 12.0738 12.0738 12.6075 12.6075 12.6260 12.6260 13.2092 13.2092 13.4270 13.4270 13.4753 13.4753 13.7904 13.7904 14.4619 14.4619 14.4691 14.4691 14.6453 14.6453 15.0771 15.0771 15.2364 15.2364 15.3683 15.3683 k = 0.2386 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7591 -33.7591 -32.5551 -32.5551 -32.5545 -32.5545 0.0118 0.0118 0.0158 0.0158 0.4396 0.4396 0.4829 0.4829 0.5025 0.5025 7.8460 7.8460 10.4866 10.4866 10.4999 10.4999 11.6882 11.6882 12.0963 12.0963 12.5968 12.5968 12.6162 12.6162 13.2621 13.2621 13.4200 13.4200 13.4686 13.4686 13.7619 13.7619 14.4731 14.4731 14.4803 14.4803 14.6439 14.6439 15.0845 15.0845 15.2227 15.2227 15.4011 15.4011 k = 0.2500 0.5000 0.5000 ( 3968 PWs) bands (ev): -63.9879 -63.9879 -33.7591 -33.7591 -32.5552 -32.5552 -32.5545 -32.5545 0.0113 0.0113 0.0154 0.0154 0.4384 0.4384 0.4837 0.4837 0.5019 0.5019 7.8467 7.8467 10.5322 10.5322 10.5454 10.5454 11.6726 11.6726 12.1194 12.1194 12.5858 12.5858 12.6059 12.6059 13.3162 13.3162 13.4119 13.4119 13.4603 13.4603 13.7343 13.7343 14.4809 14.4809 14.4882 14.4882 14.6424 14.6424 15.0900 15.0900 15.2048 15.2048 15.4333 15.4333 k = 0.2614 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7591 -33.7591 -32.5553 -32.5553 -32.5544 -32.5544 0.0108 0.0108 0.0150 0.0150 0.4373 0.4373 0.4846 0.4846 0.5013 0.5013 7.8479 7.8479 10.5794 10.5794 10.5924 10.5924 11.6574 11.6574 12.1431 12.1431 12.5766 12.5766 12.5976 12.5976 13.3701 13.3701 13.4103 13.4103 13.4565 13.4565 13.7091 13.7091 14.4885 14.4885 14.4956 14.4956 14.6408 14.6408 15.0951 15.0951 15.1915 15.1915 15.4661 15.4661 k = 0.2727 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7592 -33.7592 -32.5554 -32.5554 -32.5543 -32.5543 0.0103 0.0103 0.0147 0.0147 0.4361 0.4361 0.4855 0.4855 0.5007 0.5007 7.8489 7.8489 10.6269 10.6269 10.6398 10.6398 11.6425 11.6425 12.1672 12.1672 12.5674 12.5674 12.5892 12.5892 13.3970 13.3970 13.4359 13.4359 13.4514 13.4514 13.6837 13.6837 14.4926 14.4926 14.4994 14.4994 14.6393 14.6393 15.0988 15.0988 15.1742 15.1742 15.4966 15.4966 k = 0.2841 0.5000 0.5000 ( 3968 PWs) bands (ev): -63.9878 -63.9878 -33.7592 -33.7592 -32.5555 -32.5555 -32.5543 -32.5543 0.0098 0.0098 0.0143 0.0143 0.4349 0.4349 0.4864 0.4864 0.5001 0.5001 7.8498 7.8498 10.6747 10.6747 10.6874 10.6874 11.6280 11.6280 12.1916 12.1916 12.5582 12.5582 12.5808 12.5808 13.3932 13.3932 13.4449 13.4449 13.4913 13.4913 13.6592 13.6592 14.4929 14.4929 14.4995 14.4995 14.6378 14.6378 15.0986 15.0986 15.1552 15.1552 15.5255 15.5255 k = 0.2955 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9868 -63.9868 -33.7592 -33.7592 -32.5556 -32.5556 -32.5542 -32.5542 0.0093 0.0093 0.0139 0.0139 0.4338 0.4338 0.4873 0.4873 0.4996 0.4996 7.8508 7.8508 10.7235 10.7235 10.7360 10.7360 11.6139 11.6139 12.2162 12.2162 12.5514 12.5514 12.5747 12.5747 13.3915 13.3915 13.4424 13.4424 13.5510 13.5510 13.6383 13.6383 14.4923 14.4923 14.4985 14.4985 14.6363 14.6363 15.0993 15.0993 15.1363 15.1363 15.5558 15.5558 k = 0.3068 0.5000 0.5000 ( 3968 PWs) bands (ev): -63.9878 -63.9878 -33.7592 -33.7592 -32.5557 -32.5557 -32.5542 -32.5542 0.0089 0.0089 0.0134 0.0134 0.4326 0.4326 0.4882 0.4882 0.4991 0.4991 7.8518 7.8518 10.7717 10.7717 10.7839 10.7839 11.6004 11.6004 12.2409 12.2409 12.5443 12.5443 12.5683 12.5683 13.3868 13.3868 13.4372 13.4372 13.6092 13.6092 13.6162 13.6162 14.4873 14.4873 14.4930 14.4930 14.6349 14.6349 15.0926 15.0926 15.1166 15.1166 15.5826 15.5826 k = 0.3182 0.5000 0.5000 ( 3968 PWs) bands (ev): -63.9878 -63.9878 -33.7592 -33.7592 -32.5558 -32.5558 -32.5542 -32.5542 0.0084 0.0084 0.0130 0.0130 0.4315 0.4315 0.4890 0.4890 0.4986 0.4986 7.8528 7.8528 10.8198 10.8198 10.8318 10.8318 11.5874 11.5874 12.2655 12.2655 12.5389 12.5389 12.5636 12.5636 13.3835 13.3835 13.4332 13.4332 13.5955 13.5955 13.6710 13.6710 14.4799 14.4799 14.4851 14.4851 14.6335 14.6335 15.0891 15.0891 15.0964 15.0964 15.6083 15.6083 k = 0.3295 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9868 -63.9868 -33.7592 -33.7592 -32.5558 -32.5558 -32.5541 -32.5541 0.0079 0.0079 0.0126 0.0126 0.4305 0.4305 0.4899 0.4899 0.4981 0.4981 7.8540 7.8540 10.8685 10.8685 10.8802 10.8802 11.5748 11.5748 12.2899 12.2899 12.5360 12.5360 12.5613 12.5613 13.3834 13.3834 13.4322 13.4322 13.5776 13.5776 13.7287 13.7287 14.4708 14.4708 14.4752 14.4752 14.6321 14.6321 15.0768 15.0768 15.0772 15.0772 15.6341 15.6341 k = 0.3409 0.5000 0.5000 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7593 -33.7593 -32.5559 -32.5559 -32.5540 -32.5540 0.0075 0.0075 0.0122 0.0122 0.4294 0.4294 0.4907 0.4907 0.4977 0.4977 7.8550 7.8550 10.9153 10.9153 10.9267 10.9267 11.5630 11.5630 12.3140 12.3140 12.5330 12.5330 12.5589 12.5589 13.3803 13.3803 13.4282 13.4282 13.5596 13.5596 13.7916 13.7916 14.4575 14.4575 14.4612 14.4612 14.6308 14.6308 15.0561 15.0561 15.0687 15.0687 15.6572 15.6572 k = 0.3523 0.5000 0.5000 ( 3952 PWs) bands (ev): -63.9859 -63.9859 -33.7593 -33.7593 -32.5559 -32.5559 -32.5540 -32.5540 0.0071 0.0071 0.0118 0.0118 0.4284 0.4284 0.4916 0.4916 0.4972 0.4972 7.8561 7.8561 10.9614 10.9614 10.9725 10.9725 11.5519 11.5519 12.3375 12.3375 12.5319 12.5319 12.5584 12.5584 13.3785 13.3785 13.4251 13.4251 13.5431 13.5431 13.8571 13.8571 14.4421 14.4421 14.4449 14.4449 14.6296 14.6296 15.0354 15.0354 15.0618 15.0618 15.6789 15.6789 k = 0.3636 0.5000 0.5000 ( 3952 PWs) bands (ev): -63.9859 -63.9859 -33.7593 -33.7593 -32.5560 -32.5560 -32.5540 -32.5540 0.0067 0.0067 0.0115 0.0115 0.4275 0.4275 0.4924 0.4924 0.4968 0.4968 7.8570 7.8570 11.0052 11.0052 11.0159 11.0159 11.5415 11.5415 12.3604 12.3604 12.5314 12.5314 12.5584 12.5584 13.3752 13.3752 13.4200 13.4200 13.5250 13.5250 13.9257 13.9257 14.4236 14.4236 14.4255 14.4255 14.6285 14.6285 15.0137 15.0137 15.0561 15.0561 15.6952 15.6952 k = 0.3750 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7593 -33.7593 -32.5560 -32.5560 -32.5539 -32.5539 0.0063 0.0063 0.0111 0.0111 0.4266 0.4266 0.4931 0.4931 0.4965 0.4965 7.8579 7.8579 11.0475 11.0475 11.0578 11.0578 11.5320 11.5320 12.3823 12.3823 12.5328 12.5328 12.5601 12.5601 13.3728 13.3728 13.4163 13.4163 13.5161 13.5161 13.9907 13.9907 14.4036 14.4036 14.4045 14.4045 14.6275 14.6275 14.9930 14.9930 15.0409 15.0409 15.7192 15.7192 k = 0.3864 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7593 -33.7593 -32.5561 -32.5561 -32.5539 -32.5539 0.0059 0.0059 0.0108 0.0108 0.4258 0.4258 0.4938 0.4938 0.4961 0.4961 7.8587 7.8587 11.0873 11.0873 11.0972 11.0972 11.5230 11.5230 12.4030 12.4030 12.5353 12.5353 12.5630 12.5630 13.3702 13.3702 13.4117 13.4117 13.5037 13.5037 14.0541 14.0541 14.3821 14.3821 14.3821 14.3821 14.6265 14.6265 14.9729 14.9729 15.0219 15.0219 15.7356 15.7356 k = 0.3977 0.5000 0.5000 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7593 -33.7593 -32.5561 -32.5561 -32.5539 -32.5539 0.0056 0.0056 0.0104 0.0104 0.4250 0.4250 0.4944 0.4944 0.4958 0.4958 7.8596 7.8596 11.1245 11.1245 11.1340 11.1340 11.5149 11.5149 12.4225 12.4225 12.5392 12.5392 12.5670 12.5670 13.3675 13.3675 13.4069 13.4069 13.4926 13.4926 14.1169 14.1169 14.3587 14.3587 14.3598 14.3598 14.6256 14.6256 14.9535 14.9535 15.0001 15.0001 15.7496 15.7496 k = 0.4091 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9835 -63.9835 -33.7593 -33.7593 -32.5562 -32.5562 -32.5538 -32.5538 0.0053 0.0053 0.0101 0.0101 0.4243 0.4243 0.4950 0.4950 0.4955 0.4955 7.8609 7.8609 11.1595 11.1595 11.1686 11.1686 11.5077 11.5077 12.4404 12.4404 12.5444 12.5444 12.5722 12.5722 13.3657 13.3657 13.4031 13.4031 13.4851 13.4851 14.1803 14.1803 14.3354 14.3354 14.3373 14.3373 14.6248 14.6248 14.9416 14.9416 14.9764 14.9764 15.7620 15.7620 k = 0.4205 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9835 -63.9835 -33.7593 -33.7593 -32.5562 -32.5562 -32.5537 -32.5537 0.0051 0.0051 0.0099 0.0099 0.4237 0.4237 0.4953 0.4953 0.4956 0.4956 7.8616 7.8616 11.1905 11.1905 11.1992 11.1992 11.5012 11.5012 12.4565 12.4565 12.5502 12.5502 12.5778 12.5778 13.3632 13.3632 13.3982 13.3982 13.4768 13.4768 14.2407 14.2407 14.3131 14.3131 14.3151 14.3151 14.6241 14.6241 14.9246 14.9246 14.9491 14.9491 15.7647 15.7647 k = 0.4318 0.5000 0.5000 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7593 -33.7593 -32.5563 -32.5563 -32.5537 -32.5537 0.0048 0.0048 0.0096 0.0096 0.4231 0.4231 0.4951 0.4951 0.4960 0.4960 7.8626 7.8626 11.2178 11.2178 11.2261 11.2261 11.4955 11.4955 12.4708 12.4708 12.5565 12.5565 12.5838 12.5838 13.3605 13.3605 13.3935 13.3935 13.4702 13.4702 14.2807 14.2807 14.2941 14.2941 14.3023 14.3023 14.6235 14.6235 14.9128 14.9128 14.9133 14.9133 15.7601 15.7601 k = 0.4432 0.5000 0.5000 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7593 -33.7593 -32.5563 -32.5563 -32.5537 -32.5537 0.0046 0.0046 0.0094 0.0094 0.4226 0.4226 0.4949 0.4949 0.4965 0.4965 7.8631 7.8631 11.2413 11.2413 11.2494 11.2494 11.4907 11.4907 12.4831 12.4831 12.5631 12.5631 12.5900 12.5900 13.3582 13.3582 13.3891 13.3891 13.4643 13.4643 14.2678 14.2678 14.2749 14.2749 14.3522 14.3522 14.6229 14.6229 14.8817 14.8817 14.8992 14.8992 15.7536 15.7536 k = 0.4545 0.5000 0.5000 ( 3928 PWs) bands (ev): -63.9831 -63.9831 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0045 0.0045 0.0092 0.0092 0.4223 0.4223 0.4947 0.4947 0.4968 0.4968 7.8637 7.8637 11.2622 11.2622 11.2701 11.2701 11.4867 11.4867 12.4932 12.4932 12.5694 12.5694 12.5959 12.5959 13.3571 13.3571 13.3860 13.3860 13.4600 13.4600 14.2509 14.2509 14.2583 14.2583 14.4063 14.4063 14.6225 14.6225 14.8487 14.8487 14.8895 14.8895 15.7498 15.7498 k = 0.4659 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9811 -63.9811 -33.7593 -33.7593 -32.5562 -32.5562 -32.5536 -32.5536 0.0043 0.0043 0.0091 0.0091 0.4220 0.4220 0.4946 0.4946 0.4971 0.4971 7.8641 7.8641 11.2791 11.2791 11.2867 11.2867 11.4837 11.4837 12.5012 12.5012 12.5748 12.5748 12.6009 12.6009 13.3565 13.3565 13.3836 13.3836 13.4567 13.4567 14.2368 14.2368 14.2447 14.2447 14.4698 14.4698 14.6222 14.6222 14.8202 14.8202 14.8813 14.8813 15.7473 15.7473 k = 0.4773 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0043 0.0043 0.0090 0.0090 0.4217 0.4217 0.4945 0.4945 0.4973 0.4973 7.8644 7.8644 11.2902 11.2902 11.2977 11.2977 11.4814 11.4814 12.5070 12.5070 12.5790 12.5790 12.6048 12.6048 13.3551 13.3551 13.3811 13.3811 13.4540 13.4540 14.2262 14.2262 14.2345 14.2345 14.5155 14.5155 14.6220 14.6220 14.7862 14.7862 14.8746 14.8746 15.7438 15.7439 k = 0.4886 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4945 0.4945 0.4974 0.4974 7.8645 7.8645 11.2969 11.2969 11.3043 11.3043 11.4801 11.4801 12.5105 12.5105 12.5816 12.5816 12.6072 12.6072 13.3542 13.3542 13.3795 13.3795 13.4524 13.4524 14.2197 14.2197 14.2283 14.2283 14.5503 14.5503 14.6218 14.6218 14.7584 14.7584 14.8705 14.8705 15.7418 15.7418 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4945 0.4945 0.4974 0.4974 7.8646 7.8646 11.2991 11.2991 11.3065 11.3065 11.4796 11.4796 12.5116 12.5116 12.5826 12.5826 12.6081 12.6081 13.3539 13.3539 13.3790 13.3790 13.4519 13.4519 14.2175 14.2175 14.2262 14.2262 14.5643 14.5643 14.6218 14.6218 14.7467 14.7467 14.8691 14.8691 15.7411 15.7411 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4945 0.4945 0.4974 0.4974 7.8646 7.8646 11.2991 11.2991 11.3065 11.3065 11.4796 11.4796 12.5116 12.5116 12.5826 12.5826 12.6081 12.6081 13.3539 13.3539 13.3790 13.3790 13.4519 13.4519 14.2175 14.2175 14.2262 14.2262 14.5643 14.5643 14.6218 14.6218 14.7467 14.7467 14.8691 14.8691 15.7411 15.7411 k = 0.4918 0.4918 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4945 0.4945 0.4974 0.4974 7.8646 7.8646 11.2974 11.2974 11.3049 11.3049 11.4786 11.4786 12.5108 12.5108 12.5816 12.5816 12.6071 12.6071 13.3543 13.3543 13.3794 13.3794 13.4523 13.4523 14.2177 14.2177 14.2271 14.2271 14.5579 14.5579 14.6223 14.6223 14.7539 14.7539 14.8699 14.8699 15.7416 15.7416 k = 0.4836 0.4836 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0043 0.0043 0.0090 0.0090 0.4218 0.4218 0.4944 0.4944 0.4974 0.4974 7.8647 7.8647 11.2911 11.2911 11.3006 11.3006 11.4760 11.4760 12.5085 12.5085 12.5786 12.5786 12.6041 12.6041 13.3553 13.3553 13.3806 13.3806 13.4535 13.4535 14.2159 14.2159 14.2317 14.2317 14.5411 14.5411 14.6236 14.6236 14.7731 14.7731 14.8723 14.8723 15.7432 15.7432 k = 0.4754 0.4754 0.5000 ( 3912 PWs) bands (ev): -63.9811 -63.9811 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0044 0.0044 0.0091 0.0091 0.4220 0.4220 0.4944 0.4944 0.4973 0.4973 7.8648 7.8648 11.2794 11.2794 11.2936 11.2936 11.4728 11.4728 12.5047 12.5047 12.5738 12.5738 12.5993 12.5993 13.3569 13.3569 13.3826 13.3826 13.4555 13.4555 14.2100 14.2100 14.2411 14.2411 14.5189 14.5189 14.6259 14.6259 14.8002 14.8002 14.8761 14.8761 15.7455 15.7455 k = 0.4672 0.4672 0.5000 ( 3926 PWs) bands (ev): -63.9828 -63.9828 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0045 0.0045 0.0093 0.0093 0.4223 0.4223 0.4944 0.4944 0.4971 0.4971 7.8646 7.8646 11.2617 11.2617 11.2802 11.2802 11.4707 11.4707 12.4995 12.4995 12.5672 12.5672 12.5928 12.5928 13.3578 13.3578 13.3837 13.3837 13.4564 13.4564 14.1991 14.1991 14.2540 14.2540 14.4901 14.4901 14.6292 14.6292 14.8304 14.8304 14.8789 14.8789 15.7456 15.7456 k = 0.4590 0.4590 0.5000 ( 3940 PWs) bands (ev): -63.9846 -63.9846 -33.7593 -33.7593 -32.5563 -32.5563 -32.5537 -32.5537 0.0047 0.0047 0.0095 0.0095 0.4227 0.4227 0.4943 0.4943 0.4970 0.4970 7.8641 7.8641 11.2391 11.2391 11.2624 11.2624 11.4716 11.4716 12.4932 12.4932 12.5590 12.5590 12.5849 12.5849 13.3591 13.3591 13.3855 13.3855 13.4584 13.4584 14.1820 14.1820 14.2696 14.2696 14.4622 14.4622 14.6336 14.6336 14.8621 14.8621 14.8821 14.8821 15.7473 15.7473 k = 0.4508 0.4508 0.5000 ( 3946 PWs) bands (ev): -63.9853 -63.9853 -33.7593 -33.7593 -32.5563 -32.5563 -32.5537 -32.5537 0.0049 0.0049 0.0097 0.0097 0.4232 0.4232 0.4942 0.4942 0.4969 0.4969 7.8638 7.8638 11.2133 11.2133 11.2377 11.2377 11.4767 11.4767 12.4857 12.4857 12.5500 12.5500 12.5760 12.5760 13.3607 13.3607 13.3880 13.3880 13.4623 13.4623 14.1571 14.1571 14.2869 14.2869 14.4423 14.4423 14.6392 14.6392 14.8869 14.8869 14.8998 14.8998 15.7494 15.7494 k = 0.4426 0.4426 0.5000 ( 3942 PWs) bands (ev): -63.9848 -63.9848 -33.7593 -33.7593 -32.5563 -32.5563 -32.5537 -32.5537 0.0051 0.0051 0.0100 0.0100 0.4238 0.4238 0.4940 0.4940 0.4967 0.4967 7.8633 7.8633 11.1839 11.1839 11.2068 11.2068 11.4866 11.4866 12.4771 12.4771 12.5407 12.5407 12.5668 12.5668 13.3625 13.3625 13.3916 13.3916 13.4700 13.4700 14.1241 14.1241 14.3050 14.3050 14.4318 14.4318 14.6462 14.6462 14.8967 14.8967 14.9380 14.9380 15.7529 15.7529 k = 0.4344 0.4344 0.5000 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0054 0.0054 0.0103 0.0103 0.4245 0.4245 0.4938 0.4938 0.4966 0.4966 7.8624 7.8624 11.1512 11.1512 11.1688 11.1688 11.5009 11.5009 12.4670 12.4670 12.5314 12.5314 12.5576 12.5576 13.3636 13.3636 13.3947 13.3947 13.4795 13.4795 14.0832 14.0832 14.3230 14.3230 14.4279 14.4279 14.6547 14.6547 14.9064 14.9064 14.9783 14.9783 15.7552 15.7552 k = 0.4262 0.4262 0.5000 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7592 -33.7592 -32.5562 -32.5562 -32.5536 -32.5536 0.0057 0.0057 0.0106 0.0106 0.4252 0.4252 0.4935 0.4935 0.4965 0.4965 7.8609 7.8609 11.1150 11.1150 11.1252 11.1252 11.5190 11.5190 12.4551 12.4551 12.5222 12.5222 12.5493 12.5493 13.3639 13.3639 13.3964 13.3964 13.4902 13.4902 14.0350 14.0350 14.3401 14.3401 14.4264 14.4264 14.6648 14.6648 14.9165 14.9165 15.0169 15.0169 15.7560 15.7560 k = 0.4180 0.4180 0.5000 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7592 -33.7592 -32.5562 -32.5562 -32.5536 -32.5536 0.0060 0.0060 0.0110 0.0110 0.4261 0.4261 0.4932 0.4932 0.4965 0.4965 7.8586 7.8586 11.0717 11.0717 11.0817 11.0817 11.5408 11.5408 12.4415 12.4415 12.5123 12.5123 12.5430 12.5430 13.3635 13.3635 13.3975 13.3975 13.5029 13.5029 13.9809 13.9809 14.3558 14.3558 14.4284 14.4284 14.6764 14.6764 14.9265 14.9265 15.0534 15.0534 15.7571 15.7571 k = 0.4098 0.4098 0.5000 ( 3934 PWs) bands (ev): -63.9837 -63.9837 -33.7592 -33.7592 -32.5562 -32.5562 -32.5536 -32.5536 0.0064 0.0064 0.0114 0.0114 0.4270 0.4270 0.4927 0.4927 0.4964 0.4964 7.8555 7.8555 11.0190 11.0190 11.0419 11.0419 11.5660 11.5660 12.4262 12.4262 12.5013 12.5013 12.5402 12.5402 13.3626 13.3626 13.3979 13.3979 13.5184 13.5184 13.9228 13.9228 14.3695 14.3695 14.4354 14.4354 14.6896 14.6896 14.9365 14.9365 15.0880 15.0880 15.7584 15.7584 k = 0.4016 0.4016 0.5000 ( 3934 PWs) bands (ev): -63.9837 -63.9837 -33.7592 -33.7592 -32.5561 -32.5561 -32.5536 -32.5536 0.0067 0.0067 0.0118 0.0118 0.4279 0.4279 0.4923 0.4923 0.4964 0.4964 7.8514 7.8514 10.9608 10.9608 11.0026 11.0026 11.5937 11.5937 12.4096 12.4096 12.4884 12.4884 12.5409 12.5409 13.3608 13.3608 13.3970 13.3970 13.5340 13.5340 13.8605 13.8605 14.3810 14.3810 14.4438 14.4438 14.7042 14.7042 14.9474 14.9474 15.1162 15.1162 15.7580 15.7580 k = 0.3934 0.3934 0.5000 ( 3942 PWs) bands (ev): -63.9847 -63.9847 -33.7592 -33.7592 -32.5561 -32.5561 -32.5536 -32.5536 0.0071 0.0071 0.0122 0.0122 0.4289 0.4289 0.4917 0.4917 0.4964 0.4964 7.8457 7.8457 10.8988 10.8988 10.9629 10.9629 11.6239 11.6239 12.3919 12.3919 12.4733 12.4733 12.5444 12.5444 13.3574 13.3574 13.3944 13.3944 13.5509 13.5509 13.7951 13.7951 14.3901 14.3901 14.4520 14.4520 14.7198 14.7198 14.9554 14.9554 15.1371 15.1371 15.7564 15.7564 k = 0.3852 0.3852 0.5000 ( 3954 PWs) bands (ev): -63.9861 -63.9861 -33.7592 -33.7592 -32.5561 -32.5561 -32.5536 -32.5536 0.0075 0.0075 0.0127 0.0127 0.4300 0.4300 0.4911 0.4911 0.4964 0.4964 7.8385 7.8385 10.8344 10.8344 10.9235 10.9235 11.6562 11.6562 12.3736 12.3736 12.4567 12.4567 12.5512 12.5512 13.3529 13.3529 13.3903 13.3903 13.5688 13.5688 13.7280 13.7280 14.3969 14.3969 14.4605 14.4605 14.7360 14.7360 14.9600 14.9600 15.1504 15.1504 15.7532 15.7532 k = 0.3770 0.3770 0.5000 ( 3966 PWs) bands (ev): -63.9876 -63.9876 -33.7592 -33.7592 -32.5561 -32.5561 -32.5536 -32.5536 0.0078 0.0078 0.0132 0.0132 0.4311 0.4311 0.4904 0.4904 0.4964 0.4964 7.8295 7.8295 10.7674 10.7674 10.8858 10.8858 11.6915 11.6915 12.3548 12.3548 12.4386 12.4386 12.5596 12.5596 13.3472 13.3472 13.3855 13.3855 13.5870 13.5870 13.6626 13.6626 14.4015 14.4015 14.4693 14.4693 14.7523 14.7523 14.9643 14.9643 15.1575 15.1575 15.7501 15.7501 k = 0.3689 0.3689 0.5000 ( 3958 PWs) bands (ev): -63.9866 -63.9866 -33.7591 -33.7591 -32.5561 -32.5561 -32.5535 -32.5535 0.0082 0.0082 0.0137 0.0137 0.4323 0.4323 0.4897 0.4897 0.4964 0.4964 7.8190 7.8190 10.6993 10.6993 10.8508 10.8508 11.7297 11.7297 12.3359 12.3359 12.4215 12.4215 12.5716 12.5716 13.3417 13.3417 13.3807 13.3807 13.5781 13.5781 13.6326 13.6326 14.4044 14.4044 14.4833 14.4833 14.7688 14.7688 14.9708 14.9708 15.1634 15.1634 15.7476 15.7476 k = 0.3607 0.3607 0.5000 ( 3954 PWs) bands (ev): -63.9861 -63.9861 -33.7591 -33.7591 -32.5560 -32.5560 -32.5535 -32.5535 0.0086 0.0086 0.0142 0.0142 0.4335 0.4335 0.4890 0.4890 0.4964 0.4964 7.8066 7.8066 10.6290 10.6290 10.8184 10.8184 11.7695 11.7695 12.3172 12.3172 12.4028 12.4028 12.5860 12.5860 13.3355 13.3355 13.3751 13.3751 13.5179 13.5179 13.6527 13.6527 14.4054 14.4054 14.4973 14.4973 14.7848 14.7848 14.9766 14.9766 15.1612 15.1612 15.7446 15.7446 k = 0.3525 0.3525 0.5000 ( 3954 PWs) bands (ev): -63.9861 -63.9861 -33.7590 -33.7590 -32.5560 -32.5560 -32.5534 -32.5534 0.0090 0.0090 0.0148 0.0148 0.4348 0.4348 0.4882 0.4882 0.4964 0.4964 7.7919 7.7919 10.5569 10.5569 10.7891 10.7891 11.8108 11.8108 12.2985 12.2985 12.3828 12.3828 12.6021 12.6021 13.3279 13.3279 13.3675 13.3675 13.4529 13.4529 13.6799 13.6799 14.4050 14.4050 14.5122 14.5122 14.7999 14.7999 14.9806 14.9806 15.1533 15.1533 15.7407 15.7407 k = 0.3443 0.3443 0.5000 ( 3950 PWs) bands (ev): -63.9856 -63.9856 -33.7590 -33.7590 -32.5559 -32.5559 -32.5534 -32.5534 0.0094 0.0094 0.0153 0.0153 0.4360 0.4360 0.4874 0.4874 0.4964 0.4964 7.7747 7.7747 10.4835 10.4835 10.7634 10.7634 11.8539 11.8539 12.2801 12.2801 12.3629 12.3629 12.6201 12.6201 13.3191 13.3191 13.3540 13.3540 13.3940 13.3940 13.7111 13.7111 14.4032 14.4032 14.5298 14.5298 14.8137 14.8137 14.9836 14.9836 15.1424 15.1424 15.7366 15.7366 k = 0.3361 0.3361 0.5000 ( 3946 PWs) bands (ev): -63.9851 -63.9851 -33.7589 -33.7589 -32.5559 -32.5559 -32.5533 -32.5533 0.0098 0.0098 0.0158 0.0158 0.4373 0.4373 0.4865 0.4865 0.4964 0.4964 7.7553 7.7553 10.4093 10.4093 10.7418 10.7418 11.8989 11.8989 12.2620 12.2620 12.3416 12.3416 12.6400 12.6400 13.3049 13.3049 13.3157 13.3157 13.3659 13.3659 13.7431 13.7431 14.4003 14.4003 14.5471 14.5471 14.8260 14.8260 14.9861 14.9861 15.1264 15.1264 15.7347 15.7347 k = 0.3279 0.3279 0.5000 ( 3946 PWs) bands (ev): -63.9852 -63.9852 -33.7589 -33.7589 -32.5558 -32.5558 -32.5533 -32.5533 0.0101 0.0101 0.0163 0.0163 0.4387 0.4387 0.4857 0.4857 0.4964 0.4964 7.7334 7.7334 10.3343 10.3343 10.7243 10.7243 11.9442 11.9442 12.2448 12.2448 12.3188 12.3188 12.6623 12.6623 13.2474 13.2474 13.3015 13.3015 13.3559 13.3559 13.7753 13.7753 14.3963 14.3963 14.5643 14.5643 14.8364 14.8364 14.9880 14.9880 15.1057 15.1057 15.7300 15.7300 k = 0.3197 0.3197 0.5000 ( 3946 PWs) bands (ev): -63.9852 -63.9852 -33.7589 -33.7589 -32.5558 -32.5558 -32.5532 -32.5532 0.0105 0.0105 0.0168 0.0168 0.4400 0.4400 0.4847 0.4847 0.4963 0.4963 7.7090 7.7090 10.2587 10.2587 10.7115 10.7115 11.9911 11.9911 12.2276 12.2276 12.2950 12.2950 12.6855 12.6855 13.1852 13.1852 13.2903 13.2903 13.3478 13.3478 13.8106 13.8106 14.3914 14.3914 14.5818 14.5818 14.8447 14.8447 14.9892 14.9892 15.0835 15.0835 15.7252 15.7252 k = 0.3115 0.3115 0.5000 ( 3942 PWs) bands (ev): -63.9847 -63.9847 -33.7588 -33.7588 -32.5557 -32.5557 -32.5531 -32.5531 0.0108 0.0108 0.0173 0.0173 0.4413 0.4413 0.4838 0.4838 0.4963 0.4963 7.6822 7.6822 10.1827 10.1827 10.7036 10.7036 12.0388 12.0388 12.2112 12.2112 12.2719 12.2719 12.7106 12.7106 13.1248 13.1248 13.2788 13.2788 13.3398 13.3398 13.8463 13.8463 14.3857 14.3857 14.6029 14.6029 14.8509 14.8509 14.9906 14.9906 15.0586 15.0586 15.7202 15.7202 k = 0.3033 0.3033 0.5000 ( 3958 PWs) bands (ev): -63.9867 -63.9867 -33.7588 -33.7588 -32.5557 -32.5557 -32.5531 -32.5531 0.0111 0.0111 0.0178 0.0178 0.4427 0.4427 0.4829 0.4829 0.4962 0.4962 7.6526 7.6526 10.1064 10.1064 10.6996 10.6996 12.0866 12.0866 12.1945 12.1945 12.2451 12.2451 12.7353 12.7353 13.0652 13.0652 13.2646 13.2646 13.3304 13.3304 13.8834 13.8834 14.3792 14.3792 14.6182 14.6182 14.8525 14.8525 14.9869 14.9869 15.0313 15.0313 15.7122 15.7122 k = 0.2951 0.2951 0.5000 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7587 -33.7587 -32.5556 -32.5556 -32.5530 -32.5530 0.0114 0.0114 0.0182 0.0182 0.4440 0.4440 0.4819 0.4819 0.4961 0.4961 7.6213 7.6213 10.0307 10.0307 10.7017 10.7017 12.1342 12.1342 12.1799 12.1799 12.2223 12.2223 12.7640 12.7640 13.0097 13.0097 13.2532 13.2532 13.3244 13.3244 13.9244 13.9244 14.3722 14.3722 14.6402 14.6402 14.8539 14.8539 14.9864 14.9864 15.0099 15.0099 15.7098 15.7098 k = 0.2869 0.2869 0.5000 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7586 -33.7586 -32.5555 -32.5555 -32.5529 -32.5529 0.0116 0.0116 0.0187 0.0187 0.4453 0.4453 0.4809 0.4809 0.4959 0.4959 7.5877 7.5877 9.9551 9.9551 10.7087 10.7087 12.1641 12.1641 12.1697 12.1697 12.2097 12.2097 12.7932 12.7932 12.9558 12.9558 13.2404 13.2404 13.3184 13.3184 13.9666 13.9666 14.3647 14.3647 14.6590 14.6590 14.8529 14.8529 14.9722 14.9722 15.0008 15.0008 15.7060 15.7060 k = 0.2787 0.2787 0.5000 ( 3934 PWs) bands (ev): -63.9839 -63.9839 -33.7586 -33.7586 -32.5555 -32.5555 -32.5528 -32.5528 0.0118 0.0118 0.0191 0.0191 0.4467 0.4467 0.4800 0.4800 0.4958 0.4958 7.5521 7.5521 9.8799 9.8799 10.7201 10.7201 12.1507 12.1507 12.1551 12.1551 12.2454 12.2454 12.8234 12.8234 12.9053 12.9053 13.2271 13.2271 13.3116 13.3116 14.0094 14.0094 14.3566 14.3566 14.6779 14.6779 14.8485 14.8485 14.9481 14.9481 14.9999 14.9999 15.7017 15.7017 k = 0.2705 0.2705 0.5000 ( 3934 PWs) bands (ev): -63.9839 -63.9839 -33.7585 -33.7585 -32.5554 -32.5554 -32.5527 -32.5527 0.0120 0.0120 0.0195 0.0195 0.4480 0.4480 0.4790 0.4790 0.4956 0.4956 7.5148 7.5148 9.8051 9.8051 10.7360 10.7360 12.1261 12.1261 12.1377 12.1377 12.2939 12.2939 12.8520 12.8520 12.8592 12.8592 13.2133 13.2133 13.3050 13.3050 14.0515 14.0515 14.3480 14.3480 14.6950 14.6950 14.8413 14.8413 14.9222 14.9222 15.0001 15.0001 15.6973 15.6973 k = 0.2623 0.2623 0.5000 ( 3936 PWs) bands (ev): -63.9842 -63.9842 -33.7585 -33.7585 -32.5554 -32.5554 -32.5526 -32.5526 0.0122 0.0122 0.0199 0.0199 0.4492 0.4492 0.4780 0.4780 0.4954 0.4954 7.4759 7.4759 9.7311 9.7311 10.7554 10.7554 12.0951 12.0951 12.1249 12.1249 12.3438 12.3438 12.8110 12.8110 12.8871 12.8871 13.1996 13.1996 13.2984 13.2984 14.0942 14.0942 14.3389 14.3389 14.7096 14.7096 14.8302 14.8302 14.8988 14.8988 15.0002 15.0002 15.6930 15.6930 k = 0.2541 0.2541 0.5000 ( 3940 PWs) bands (ev): -63.9847 -63.9847 -33.7584 -33.7584 -32.5554 -32.5554 -32.5525 -32.5525 0.0123 0.0123 0.0202 0.0202 0.4505 0.4505 0.4770 0.4770 0.4951 0.4951 7.4358 7.4358 9.6578 9.6578 10.7799 10.7799 12.0623 12.0623 12.1126 12.1126 12.3940 12.3940 12.7670 12.7670 12.9201 12.9201 13.1859 13.1859 13.2925 13.2925 14.1342 14.1342 14.3296 14.3296 14.7183 14.7183 14.8195 14.8195 14.8786 14.8786 15.0003 15.0003 15.6890 15.6890 k = 0.2459 0.2459 0.5000 ( 3940 PWs) bands (ev): -63.9847 -63.9847 -33.7584 -33.7584 -32.5553 -32.5553 -32.5524 -32.5524 0.0123 0.0123 0.0206 0.0206 0.4517 0.4517 0.4760 0.4760 0.4948 0.4948 7.3947 7.3947 9.5855 9.5855 10.8084 10.8084 12.0289 12.0289 12.1010 12.1010 12.4443 12.4443 12.7270 12.7270 12.9539 12.9539 13.1725 13.1725 13.2870 13.2870 14.1756 14.1756 14.3202 14.3202 14.7177 14.7177 14.8116 14.8116 14.8668 14.8668 14.9998 14.9998 15.6861 15.6861 k = 0.2377 0.2377 0.5000 ( 3940 PWs) bands (ev): -63.9847 -63.9847 -33.7583 -33.7583 -32.5553 -32.5553 -32.5523 -32.5523 0.0124 0.0124 0.0209 0.0209 0.4529 0.4529 0.4750 0.4750 0.4945 0.4945 7.3528 7.3528 9.5144 9.5144 10.8405 10.8405 11.9954 11.9954 12.0900 12.0900 12.4943 12.4943 12.6891 12.6891 12.9881 12.9881 13.1598 13.1598 13.2821 13.2821 14.2147 14.2147 14.3110 14.3110 14.7047 14.7047 14.8062 14.8062 14.8648 14.8648 14.9985 14.9985 15.6840 15.6840 k = 0.2295 0.2295 0.5000 ( 3944 PWs) bands (ev): -63.9853 -63.9853 -33.7582 -33.7582 -32.5553 -32.5553 -32.5522 -32.5522 0.0123 0.0123 0.0212 0.0212 0.4540 0.4540 0.4740 0.4740 0.4942 0.4942 7.3103 7.3103 9.4445 9.4445 10.8758 10.8758 11.9603 11.9603 12.0792 12.0792 12.5437 12.5437 12.6546 12.6546 13.0215 13.0215 13.1475 13.1475 13.2774 13.2774 14.2502 14.2502 14.3033 14.3033 14.6841 14.6841 14.7980 14.7980 14.8725 14.8725 14.9951 14.9951 15.6823 15.6823 k = 0.2213 0.2213 0.5000 ( 3940 PWs) bands (ev): -63.9848 -63.9848 -33.7582 -33.7582 -32.5552 -32.5552 -32.5521 -32.5521 0.0123 0.0123 0.0215 0.0215 0.4551 0.4551 0.4730 0.4730 0.4939 0.4939 7.2675 7.2675 9.3760 9.3760 10.9144 10.9144 11.9255 11.9255 12.0694 12.0694 12.5916 12.5916 12.6256 12.6256 13.0533 13.0533 13.1394 13.1394 13.2734 13.2734 14.2723 14.2723 14.3065 14.3065 14.6633 14.6633 14.7880 14.7880 14.8890 14.8890 14.9922 14.9922 15.6826 15.6826 k = 0.2131 0.2131 0.5000 ( 3948 PWs) bands (ev): -63.9858 -63.9858 -33.7581 -33.7581 -32.5552 -32.5552 -32.5520 -32.5520 0.0121 0.0121 0.0218 0.0218 0.4562 0.4562 0.4721 0.4721 0.4935 0.4935 7.2247 7.2247 9.3089 9.3089 10.9557 10.9557 11.8892 11.8892 12.0592 12.0592 12.5915 12.5915 12.6431 12.6431 13.0763 13.0763 13.1391 13.1391 13.2698 13.2698 14.2698 14.2698 14.3266 14.3266 14.6396 14.6396 14.7757 14.7757 14.9078 14.9078 14.9868 14.9868 15.6822 15.6822 k = 0.2049 0.2049 0.5000 ( 3940 PWs) bands (ev): -63.9848 -63.9848 -33.7580 -33.7580 -32.5552 -32.5552 -32.5519 -32.5519 0.0120 0.0120 0.0220 0.0220 0.4571 0.4571 0.4712 0.4712 0.4931 0.4931 7.1821 7.1821 9.2436 9.2436 10.9997 10.9997 11.8557 11.8557 12.0511 12.0511 12.5650 12.5650 12.6899 12.6899 13.0822 13.0822 13.1601 13.1601 13.2678 13.2678 14.2606 14.2606 14.3461 14.3461 14.6233 14.6233 14.7634 14.7634 14.9332 14.9332 14.9848 14.9848 15.6857 15.6857 k = 0.1967 0.1967 0.5000 ( 3940 PWs) bands (ev): -63.9848 -63.9848 -33.7580 -33.7580 -32.5551 -32.5551 -32.5518 -32.5518 0.0118 0.0118 0.0223 0.0223 0.4580 0.4580 0.4703 0.4703 0.4927 0.4927 7.1398 7.1398 9.1799 9.1799 11.0454 11.0454 11.8209 11.8209 12.0426 12.0426 12.5408 12.5408 12.7364 12.7364 13.0764 13.0764 13.1915 13.1915 13.2659 13.2659 14.2499 14.2499 14.3560 14.3560 14.6150 14.6150 14.7491 14.7491 14.9516 14.9516 14.9853 14.9853 15.6900 15.6900 k = 0.1885 0.1885 0.5000 ( 3940 PWs) bands (ev): -63.9849 -63.9849 -33.7579 -33.7579 -32.5551 -32.5551 -32.5516 -32.5516 0.0116 0.0116 0.0225 0.0225 0.4588 0.4588 0.4695 0.4695 0.4922 0.4922 7.0981 7.0981 9.1180 9.1180 11.0932 11.0932 11.7866 11.7866 12.0348 12.0348 12.5174 12.5174 12.7818 12.7818 13.0673 13.0673 13.2265 13.2265 13.2661 13.2661 14.2387 14.2387 14.3536 14.3536 14.6147 14.6147 14.7351 14.7351 14.9552 14.9552 15.0013 15.0013 15.6957 15.6957 k = 0.1803 0.1803 0.5000 ( 3942 PWs) bands (ev): -63.9851 -63.9851 -33.7578 -33.7578 -32.5551 -32.5551 -32.5515 -32.5515 0.0113 0.0113 0.0227 0.0227 0.4595 0.4595 0.4688 0.4688 0.4918 0.4918 7.0571 7.0571 9.0581 9.0581 11.1435 11.1435 11.7531 11.7531 12.0273 12.0273 12.4925 12.4925 12.8260 12.8260 13.0574 13.0574 13.2537 13.2537 13.2772 13.2772 14.2272 14.2272 14.3401 14.3401 14.6181 14.6181 14.7237 14.7237 14.9488 14.9488 15.0277 15.0277 15.7017 15.7017 k = 0.1721 0.1721 0.5000 ( 3938 PWs) bands (ev): -63.9847 -63.9847 -33.7578 -33.7578 -32.5550 -32.5550 -32.5514 -32.5514 0.0110 0.0110 0.0229 0.0229 0.4600 0.4600 0.4682 0.4682 0.4913 0.4913 7.0170 7.0170 9.0002 9.0002 11.1940 11.1940 11.7205 11.7205 12.0209 12.0209 12.4732 12.4732 12.8691 12.8691 13.0478 13.0478 13.2596 13.2596 13.3115 13.3115 14.2155 14.2155 14.3184 14.3184 14.6323 14.6323 14.7097 14.7097 14.9399 14.9399 15.0570 15.0570 15.7122 15.7122 k = 0.1639 0.1639 0.5000 ( 3938 PWs) bands (ev): -63.9847 -63.9847 -33.7577 -33.7577 -32.5550 -32.5550 -32.5513 -32.5513 0.0106 0.0106 0.0231 0.0231 0.4603 0.4603 0.4679 0.4679 0.4909 0.4909 6.9780 6.9780 8.9444 8.9444 11.2454 11.2454 11.6885 11.6885 12.0144 12.0144 12.4545 12.4545 12.9106 12.9106 13.0385 13.0385 13.2615 13.2615 13.3504 13.3504 14.2036 14.2036 14.2913 14.2913 14.6480 14.6480 14.6957 14.6957 14.9279 14.9279 15.0863 15.0863 15.7246 15.7246 k = 0.1557 0.1557 0.5000 ( 3948 PWs) bands (ev): -63.9860 -63.9860 -33.7577 -33.7577 -32.5550 -32.5550 -32.5512 -32.5512 0.0103 0.0103 0.0233 0.0233 0.4604 0.4604 0.4677 0.4677 0.4904 0.4904 6.9402 6.9402 8.8906 8.8906 11.2972 11.2972 11.6563 11.6563 12.0074 12.0074 12.4347 12.4347 12.9500 12.9500 13.0300 13.0300 13.2634 13.2634 13.3895 13.3895 14.1912 14.1912 14.2609 14.2609 14.6592 14.6592 14.6822 14.6822 14.9127 14.9127 15.1127 15.1127 15.7373 15.7373 k = 0.1475 0.1475 0.5000 ( 3946 PWs) bands (ev): -63.9857 -63.9857 -33.7576 -33.7576 -32.5550 -32.5550 -32.5511 -32.5511 0.0099 0.0099 0.0234 0.0234 0.4602 0.4602 0.4677 0.4677 0.4900 0.4900 6.9037 6.9037 8.8392 8.8392 11.3490 11.3490 11.6253 11.6253 12.0013 12.0013 12.4218 12.4218 12.9853 12.9853 13.0250 13.0250 13.2660 13.2660 13.4295 13.4295 14.1784 14.1784 14.2301 14.2301 14.6628 14.6628 14.6834 14.6834 14.8973 14.8973 15.1393 15.1393 15.7573 15.7573 k = 0.1393 0.1393 0.5000 ( 3946 PWs) bands (ev): -63.9858 -63.9858 -33.7575 -33.7575 -32.5549 -32.5549 -32.5510 -32.5510 0.0095 0.0095 0.0236 0.0236 0.4599 0.4599 0.4679 0.4679 0.4895 0.4895 6.8686 6.8686 8.7902 8.7902 11.4009 11.4009 11.5967 11.5967 11.9958 11.9958 12.4071 12.4071 13.0018 13.0018 13.0380 13.0380 13.2695 13.2695 13.4698 13.4698 14.1635 14.1635 14.2003 14.2003 14.6503 14.6503 14.6961 14.6961 14.8808 14.8808 15.1664 15.1664 15.7778 15.7778 k = 0.1311 0.1311 0.5000 ( 3958 PWs) bands (ev): -63.9873 -63.9873 -33.7575 -33.7575 -32.5550 -32.5550 -32.5509 -32.5509 0.0090 0.0090 0.0237 0.0237 0.4594 0.4594 0.4683 0.4683 0.4891 0.4891 6.8351 6.8351 8.7432 8.7432 11.4508 11.4508 11.5688 11.5688 11.9903 11.9903 12.3916 12.3916 12.9986 12.9986 13.0691 13.0691 13.2724 13.2724 13.5095 13.5095 14.1422 14.1422 14.1761 14.1761 14.6339 14.6339 14.7033 14.7033 14.8624 14.8624 15.1907 15.1907 15.7966 15.7966 k = 0.1230 0.1230 0.5000 ( 3962 PWs) bands (ev): -63.9878 -63.9878 -33.7575 -33.7575 -32.5550 -32.5550 -32.5508 -32.5508 0.0086 0.0086 0.0238 0.0238 0.4588 0.4588 0.4687 0.4687 0.4886 0.4886 6.8032 6.8032 8.6991 8.6991 11.5012 11.5012 11.5423 11.5423 11.9847 11.9847 12.3786 12.3786 12.9927 12.9927 13.1022 13.1022 13.2777 13.2777 13.5487 13.5487 14.1137 14.1137 14.1604 14.1604 14.6202 14.6202 14.7135 14.7135 14.8422 14.8422 15.2132 15.2132 15.8211 15.8211 k = 0.1148 0.1148 0.5000 ( 3950 PWs) bands (ev): -63.9863 -63.9863 -33.7574 -33.7574 -32.5549 -32.5549 -32.5507 -32.5507 0.0082 0.0082 0.0239 0.0239 0.4582 0.4582 0.4691 0.4691 0.4882 0.4882 6.7730 6.7730 8.6576 8.6576 11.5194 11.5194 11.5513 11.5513 11.9808 11.9808 12.3692 12.3692 12.9869 12.9869 13.1344 13.1344 13.2848 13.2848 13.5881 13.5881 14.0829 14.0829 14.1494 14.1494 14.6084 14.6084 14.7277 14.7277 14.8226 14.8226 15.2378 15.2378 15.8525 15.8525 k = 0.1066 0.1066 0.5000 ( 3954 PWs) bands (ev): -63.9868 -63.9868 -33.7573 -33.7573 -32.5549 -32.5549 -32.5506 -32.5506 0.0078 0.0078 0.0240 0.0240 0.4575 0.4575 0.4695 0.4695 0.4878 0.4878 6.7447 6.7447 8.6186 8.6186 11.4953 11.4953 11.5986 11.5986 11.9767 11.9767 12.3589 12.3589 12.9813 12.9813 13.1646 13.1646 13.2918 13.2918 13.6259 13.6259 14.0504 14.0504 14.1406 14.1406 14.5942 14.5942 14.7345 14.7345 14.8011 14.8011 15.2543 15.2543 15.8811 15.8811 k = 0.0984 0.0984 0.5000 ( 3954 PWs) bands (ev): -63.9869 -63.9869 -33.7573 -33.7573 -32.5549 -32.5549 -32.5505 -32.5505 0.0073 0.0073 0.0241 0.0241 0.4569 0.4569 0.4699 0.4699 0.4875 0.4875 6.7182 6.7182 8.5823 8.5823 11.4739 11.4739 11.6446 11.6446 11.9729 11.9729 12.3493 12.3493 12.9762 12.9762 13.1930 13.1930 13.2998 13.2998 13.6624 13.6624 14.0184 14.0184 14.1338 14.1338 14.5820 14.5820 14.7403 14.7403 14.7787 14.7787 15.2717 15.2717 15.9106 15.9106 k = 0.0902 0.0902 0.5000 ( 3962 PWs) bands (ev): -63.9879 -63.9879 -33.7573 -33.7573 -32.5549 -32.5549 -32.5504 -32.5504 0.0069 0.0069 0.0242 0.0242 0.4562 0.4562 0.4703 0.4703 0.4871 0.4871 6.6936 6.6936 8.5486 8.5486 11.4529 11.4529 11.6882 11.6882 11.9677 11.9677 12.3400 12.3400 12.9715 12.9715 13.2192 13.2192 13.3086 13.3086 13.6962 13.6962 13.9869 13.9869 14.1288 14.1288 14.5694 14.5694 14.7440 14.7440 14.7528 14.7528 15.2844 15.2844 15.9392 15.9392 k = 0.0820 0.0820 0.5000 ( 3958 PWs) bands (ev): -63.9874 -63.9874 -33.7572 -33.7572 -32.5548 -32.5548 -32.5503 -32.5503 0.0066 0.0066 0.0243 0.0243 0.4557 0.4557 0.4707 0.4707 0.4868 0.4868 6.6710 6.6710 8.5179 8.5179 11.4355 11.4355 11.7290 11.7290 11.9656 11.9656 12.3324 12.3324 12.9675 12.9675 13.2431 13.2431 13.3190 13.3190 13.7287 13.7287 13.9575 13.9575 14.1266 14.1266 14.5570 14.5570 14.7296 14.7296 14.7502 14.7502 15.2992 15.2992 15.9692 15.9692 k = 0.0738 0.0738 0.5000 ( 3960 PWs) bands (ev): -63.9876 -63.9876 -33.7572 -33.7572 -32.5548 -32.5548 -32.5503 -32.5503 0.0062 0.0062 0.0243 0.0243 0.4551 0.4551 0.4710 0.4710 0.4865 0.4865 6.6504 6.6504 8.4898 8.4898 11.4189 11.4189 11.7674 11.7674 11.9618 11.9618 12.3253 12.3253 12.9638 12.9638 13.2645 13.2645 13.3296 13.3296 13.7575 13.7575 13.9293 13.9293 14.1269 14.1269 14.5459 14.5459 14.7036 14.7036 14.7531 14.7531 15.3109 15.3109 15.9971 15.9971 k = 0.0656 0.0656 0.5000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7571 -33.7571 -32.5548 -32.5548 -32.5502 -32.5502 0.0058 0.0058 0.0244 0.0244 0.4546 0.4546 0.4713 0.4713 0.4862 0.4862 6.6319 6.6319 8.4646 8.4646 11.4040 11.4040 11.8027 11.8027 11.9594 11.9594 12.3191 12.3191 12.9608 12.9608 13.2835 13.2835 13.3409 13.3409 13.7827 13.7827 13.9031 13.9031 14.1306 14.1306 14.5353 14.5353 14.6791 14.6791 14.7547 14.7547 15.3213 15.3213 16.0238 16.0238 k = 0.0574 0.0574 0.5000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7571 -33.7571 -32.5548 -32.5548 -32.5501 -32.5501 0.0055 0.0055 0.0244 0.0244 0.4541 0.4541 0.4716 0.4716 0.4860 0.4860 6.6155 6.6155 8.4424 8.4424 11.3902 11.3902 11.8337 11.8337 11.9584 11.9584 12.3140 12.3140 12.9581 12.9581 13.3000 13.3000 13.3526 13.3526 13.8026 13.8026 13.8803 13.8803 14.1380 14.1380 14.5235 14.5235 14.6562 14.6562 14.7563 14.7563 15.3289 15.3289 16.0492 16.0492 k = 0.0492 0.0492 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5548 -32.5548 -32.5501 -32.5501 0.0053 0.0053 0.0245 0.0245 0.4537 0.4537 0.4719 0.4719 0.4858 0.4858 6.6013 6.6013 8.4230 8.4230 11.3799 11.3799 11.8619 11.8619 11.9574 11.9574 12.3097 12.3097 12.9559 12.9559 13.3142 13.3142 13.3640 13.3640 13.8144 13.8144 13.8639 13.8639 14.1487 14.1487 14.5134 14.5134 14.6340 14.6340 14.7574 14.7574 15.3386 15.3386 16.0720 16.0720 k = 0.0410 0.0410 0.5000 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0050 0.0050 0.0245 0.0245 0.4534 0.4534 0.4720 0.4720 0.4856 0.4856 6.5891 6.5891 8.4064 8.4064 11.3699 11.3699 11.8845 11.8845 11.9553 11.9553 12.3082 12.3082 12.9540 12.9540 13.3262 13.3262 13.3747 13.3747 13.8133 13.8133 13.8590 13.8590 14.1618 14.1618 14.5013 14.5013 14.6108 14.6108 14.7597 14.7597 15.3443 15.3443 16.0964 16.0964 k = 0.0328 0.0328 0.5000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0048 0.0048 0.0245 0.0245 0.4531 0.4531 0.4722 0.4722 0.4855 0.4855 6.5792 6.5792 8.3929 8.3929 11.3617 11.3617 11.9031 11.9031 11.9541 11.9541 12.3043 12.3043 12.9525 12.9525 13.3362 13.3362 13.3842 13.3842 13.8024 13.8024 13.8623 13.8623 14.1769 14.1769 14.4897 14.4897 14.5907 14.5907 14.7596 14.7596 15.3490 15.3490 16.1113 16.1113 k = 0.0246 0.0246 0.5000 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0047 0.0047 0.0245 0.0245 0.4528 0.4528 0.4723 0.4723 0.4854 0.4854 6.5714 6.5714 8.3824 8.3824 11.3552 11.3552 11.9165 11.9165 11.9551 11.9551 12.3004 12.3004 12.9514 12.9514 13.3442 13.3442 13.3920 13.3920 13.7902 13.7902 13.8670 13.8670 14.1924 14.1924 14.4780 14.4780 14.5758 14.5758 14.7583 14.7583 15.3524 15.3524 16.1212 16.1212 k = 0.0164 0.0164 0.5000 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0046 0.0046 0.0245 0.0245 0.4527 0.4527 0.4724 0.4724 0.4853 0.4853 6.5659 6.5659 8.3750 8.3750 11.3510 11.3510 11.9258 11.9258 11.9582 11.9582 12.2988 12.2988 12.9506 12.9506 13.3500 13.3500 13.3979 13.3979 13.7809 13.7809 13.8707 13.8707 14.2062 14.2062 14.4688 14.4688 14.5674 14.5674 14.7587 14.7587 15.3556 15.3556 16.1309 16.1309 k = 0.0082 0.0082 0.5000 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4526 0.4526 0.4725 0.4725 0.4853 0.4853 6.5626 6.5626 8.3706 8.3706 11.3494 11.3494 11.9308 11.9308 11.9616 11.9616 12.2986 12.2986 12.9501 12.9501 13.3536 13.3536 13.4015 13.4015 13.7756 13.7756 13.8728 13.8728 14.2160 14.2160 14.4625 14.4625 14.5639 14.5639 14.7602 14.7602 15.3598 15.3598 16.1381 16.1381 k = 0.0000 0.0000 0.5000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0000 0.5000-0.0000 ( 3948 PWs) bands (ev): -63.9863 -63.9863 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0246 0.0246 0.4525 0.4525 0.4725 0.4725 0.4853 0.4853 6.5615 6.5615 8.3691 8.3691 11.3493 11.3493 11.9322 11.9322 11.9628 11.9628 12.2990 12.2990 12.9500 12.9500 13.3548 13.3548 13.4027 13.4027 13.7740 13.7740 13.8735 13.8735 14.2195 14.2195 14.4600 14.4600 14.5625 14.5625 14.7611 14.7611 15.3624 15.3624 16.1412 16.1412 k = 0.0000 0.5000 0.0114 ( 3952 PWs) bands (ev): -63.9868 -63.9868 -33.7570 -33.7570 -32.5547 -32.5547 -32.5499 -32.5499 0.0045 0.0045 0.0245 0.0245 0.4526 0.4526 0.4725 0.4725 0.4853 0.4853 6.5625 6.5625 8.3706 8.3706 11.3494 11.3494 11.9299 11.9299 11.9626 11.9626 12.2986 12.2986 12.9501 12.9501 13.3529 13.3529 13.4022 13.4022 13.7757 13.7757 13.8731 13.8731 14.2157 14.2157 14.4637 14.4637 14.5628 14.5628 14.7601 14.7601 15.3598 15.3598 16.1380 16.1380 k = 0.0000 0.5000 0.0227 ( 3956 PWs) bands (ev): -63.9873 -63.9873 -33.7570 -33.7570 -32.5548 -32.5548 -32.5499 -32.5499 0.0046 0.0046 0.0245 0.0245 0.4527 0.4527 0.4724 0.4724 0.4853 0.4853 6.5656 6.5656 8.3748 8.3748 11.3517 11.3517 11.9226 11.9226 11.9619 11.9619 12.2995 12.2995 12.9504 12.9504 13.3472 13.3472 13.4008 13.4008 13.7821 13.7821 13.8719 13.8719 14.2051 14.2051 14.4737 14.4737 14.5639 14.5639 14.7591 14.7591 15.3579 15.3579 16.1319 16.1319 k = 0.0000 0.5000 0.0341 ( 3960 PWs) bands (ev): -63.9877 -63.9877 -33.7570 -33.7570 -32.5548 -32.5548 -32.5500 -32.5500 0.0047 0.0047 0.0245 0.0245 0.4528 0.4528 0.4723 0.4723 0.4854 0.4854 6.5708 6.5708 8.3820 8.3820 11.3550 11.3550 11.9131 11.9131 11.9608 11.9608 12.3006 12.3006 12.9509 12.9509 13.3374 13.3374 13.3995 13.3995 13.7922 13.7922 13.8700 13.8700 14.1895 14.1895 14.4915 14.4915 14.5659 14.5659 14.7577 14.7577 15.3535 15.3535 16.1210 16.1210 k = 0.0000 0.5000 0.0455 ( 3964 PWs) bands (ev): -63.9882 -63.9882 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0048 0.0048 0.0245 0.0245 0.4531 0.4531 0.4721 0.4721 0.4855 0.4855 6.5780 6.5780 8.3919 8.3919 11.3608 11.3608 11.8997 11.8997 11.9586 11.9586 12.3030 12.3030 12.9515 12.9515 13.3235 13.3235 13.3987 13.3987 13.8050 13.8050 13.8676 13.8676 14.1709 14.1709 14.5118 14.5118 14.5677 14.5677 14.7564 14.7564 15.3496 15.3496 16.1074 16.1074 k = 0.0000 0.5000 0.0568 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5548 -32.5548 -32.5500 -32.5500 0.0050 0.0050 0.0244 0.0244 0.4534 0.4534 0.4719 0.4719 0.4857 0.4857 6.5874 6.5874 8.4049 8.4049 11.3695 11.3695 11.8848 11.8848 11.9574 11.9574 12.3077 12.3077 12.9523 12.9523 13.3062 13.3062 13.3987 13.3987 13.8202 13.8202 13.8657 13.8657 14.1510 14.1510 14.5337 14.5337 14.5775 14.5775 14.7565 14.7565 15.3475 15.3475 16.0934 16.0934 k = 0.0000 0.5000 0.0682 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5501 -32.5501 0.0053 0.0053 0.0244 0.0244 0.4537 0.4537 0.4717 0.4717 0.4859 0.4859 6.5987 6.5987 8.4207 8.4207 11.3777 11.3777 11.8662 11.8662 11.9562 11.9562 12.3111 12.3111 12.9530 12.9530 13.2860 13.2860 13.3994 13.3994 13.8323 13.8323 13.8664 13.8664 14.1308 14.1308 14.5504 14.5504 14.5956 14.5956 14.7535 14.7535 15.3396 15.3396 16.0716 16.0716 k = 0.0000 0.5000 0.0795 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5502 -32.5502 0.0055 0.0055 0.0243 0.0243 0.4541 0.4541 0.4714 0.4714 0.4861 0.4861 6.6121 6.6121 8.4392 8.4392 11.3885 11.3885 11.8417 11.8417 11.9543 11.9543 12.3156 12.3156 12.9536 12.9536 13.2638 13.2638 13.4007 13.4007 13.8380 13.8380 13.8749 13.8749 14.1104 14.1104 14.5600 14.5600 14.6197 14.6197 14.7521 14.7521 15.3335 15.3335 16.0476 16.0476 k = 0.0000 0.5000 0.0909 ( 3956 PWs) bands (ev): -63.9872 -63.9872 -33.7571 -33.7571 -32.5547 -32.5547 -32.5503 -32.5503 0.0058 0.0058 0.0243 0.0243 0.4546 0.4546 0.4711 0.4711 0.4864 0.4864 6.6276 6.6276 8.4606 8.4606 11.4012 11.4012 11.8134 11.8134 11.9522 11.9522 12.3208 12.3208 12.9541 12.9541 13.2400 13.2400 13.4025 13.4025 13.8362 13.8362 13.8911 13.8911 14.0907 14.0907 14.5667 14.5667 14.6476 14.6476 14.7507 14.7507 15.3269 15.3269 16.0202 16.0202 k = 0.0000 0.5000 0.1023 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7572 -33.7572 -32.5547 -32.5547 -32.5504 -32.5504 0.0062 0.0062 0.0242 0.0242 0.4551 0.4551 0.4707 0.4707 0.4867 0.4867 6.6450 6.6450 8.4846 8.4846 11.4161 11.4161 11.7824 11.7824 11.9494 11.9494 12.3252 12.3252 12.9543 12.9543 13.2151 13.2151 13.4046 13.4046 13.8310 13.8310 13.9101 13.9101 14.0728 14.0728 14.5718 14.5718 14.6782 14.6782 14.7485 14.7485 15.3218 15.3218 15.9870 15.9870 k = 0.0000 0.5000 0.1136 ( 3952 PWs) bands (ev): -63.9866 -63.9866 -33.7572 -33.7572 -32.5547 -32.5547 -32.5505 -32.5505 0.0066 0.0066 0.0241 0.0241 0.4557 0.4557 0.4703 0.4703 0.4871 0.4871 6.6645 6.6645 8.5115 8.5115 11.4316 11.4316 11.7480 11.7480 11.9476 11.9476 12.3324 12.3324 12.9541 12.9541 13.1894 13.1894 13.4073 13.4073 13.8252 13.8252 13.9290 13.9290 14.0571 14.0571 14.5791 14.5791 14.7097 14.7097 14.7461 14.7461 15.3136 15.3136 15.9555 15.9555 k = 0.0000 0.5000 0.1250 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7573 -33.7573 -32.5547 -32.5547 -32.5506 -32.5506 0.0070 0.0070 0.0240 0.0240 0.4563 0.4563 0.4699 0.4699 0.4875 0.4875 6.6859 6.6859 8.5407 8.5407 11.4486 11.4486 11.7089 11.7089 11.9443 11.9443 12.3392 12.3392 12.9535 12.9535 13.1630 13.1630 13.4104 13.4104 13.8176 13.8176 13.9458 13.9458 14.0446 14.0446 14.5833 14.5833 14.7374 14.7374 14.7444 14.7444 15.3051 15.3051 15.9192 15.9192 k = 0.0000 0.5000 0.1364 ( 3956 PWs) bands (ev): -63.9871 -63.9871 -33.7573 -33.7573 -32.5547 -32.5547 -32.5507 -32.5507 0.0074 0.0074 0.0239 0.0239 0.4569 0.4569 0.4695 0.4695 0.4879 0.4879 6.7092 6.7092 8.5726 8.5726 11.4663 11.4663 11.6672 11.6672 11.9414 11.9414 12.3478 12.3478 12.9523 12.9523 13.1365 13.1365 13.4141 13.4141 13.8100 13.8100 13.9586 13.9586 14.0381 14.0381 14.5891 14.5891 14.7372 14.7372 14.7723 14.7723 15.2941 15.2941 15.8828 15.8828 k = 0.0000 0.5000 0.1477 ( 3968 PWs) bands (ev): -63.9885 -63.9885 -33.7574 -33.7574 -32.5548 -32.5548 -32.5509 -32.5509 0.0079 0.0079 0.0237 0.0237 0.4575 0.4575 0.4690 0.4690 0.4884 0.4884 6.7345 6.7345 8.6069 8.6069 11.4847 11.4847 11.6217 11.6217 11.9370 11.9370 12.3547 12.3547 12.9504 12.9504 13.1096 13.1096 13.4176 13.4176 13.8006 13.8006 13.9632 13.9632 14.0396 14.0396 14.5919 14.5919 14.7289 14.7289 14.8023 14.8023 15.2820 15.2820 15.8400 15.8400 k = 0.0000 0.5000 0.1591 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7575 -33.7575 -32.5547 -32.5547 -32.5510 -32.5510 0.0083 0.0083 0.0236 0.0236 0.4581 0.4581 0.4686 0.4686 0.4890 0.4890 6.7616 6.7616 8.6438 8.6438 11.5061 11.5061 11.5760 11.5760 11.9337 11.9337 12.3620 12.3620 12.9478 12.9478 13.0830 13.0830 13.4215 13.4215 13.7928 13.7928 13.9623 13.9623 14.0501 14.0501 14.5979 14.5979 14.7230 14.7230 14.8357 14.8357 15.2723 15.2723 15.7958 15.7958 k = 0.0000 0.5000 0.1705 ( 3966 PWs) bands (ev): -63.9883 -63.9883 -33.7575 -33.7575 -32.5547 -32.5547 -32.5511 -32.5511 0.0088 0.0088 0.0235 0.0235 0.4588 0.4588 0.4681 0.4681 0.4896 0.4896 6.7906 6.7906 8.6831 8.6831 11.5253 11.5253 11.5287 11.5287 11.9300 11.9300 12.3713 12.3713 12.9445 12.9445 13.0566 13.0566 13.4261 13.4261 13.7844 13.7844 13.9576 13.9576 14.0655 14.0655 14.6029 14.6029 14.7174 14.7174 14.8670 14.8670 15.2607 15.2607 15.7522 15.7522 k = 0.0000 0.5000 0.1818 ( 3962 PWs) bands (ev): -63.9877 -63.9877 -33.7576 -33.7576 -32.5547 -32.5547 -32.5513 -32.5513 0.0093 0.0093 0.0233 0.0233 0.4594 0.4594 0.4677 0.4677 0.4902 0.4902 6.8214 6.8214 8.7246 8.7246 11.4746 11.4746 11.5507 11.5507 11.9265 11.9265 12.3816 12.3816 12.9403 12.9403 13.0306 13.0306 13.4315 13.4315 13.7769 13.7769 13.9525 13.9525 14.0824 14.0824 14.6090 14.6090 14.7104 14.7104 14.8995 14.8995 15.2485 15.2485 15.7080 15.7080 k = 0.0000 0.5000 0.1932 ( 3962 PWs) bands (ev): -63.9877 -63.9877 -33.7576 -33.7576 -32.5547 -32.5547 -32.5514 -32.5514 0.0098 0.0098 0.0231 0.0231 0.4599 0.4599 0.4673 0.4673 0.4909 0.4909 6.8540 6.8540 8.7683 8.7683 11.4196 11.4196 11.5744 11.5744 11.9224 11.9224 12.3918 12.3918 12.9351 12.9351 13.0051 13.0051 13.4369 13.4369 13.7687 13.7687 13.9476 13.9476 14.1002 14.1002 14.6136 14.6136 14.7032 14.7032 14.9299 14.9299 15.2361 15.2361 15.6617 15.6617 k = 0.0000 0.5000 0.2045 ( 3958 PWs) bands (ev): -63.9872 -63.9872 -33.7577 -33.7577 -32.5547 -32.5547 -32.5516 -32.5516 0.0104 0.0104 0.0230 0.0230 0.4604 0.4604 0.4670 0.4670 0.4917 0.4917 6.8883 6.8883 8.8142 8.8142 11.3623 11.3623 11.5992 11.5992 11.9186 11.9186 12.4024 12.4024 12.9288 12.9288 12.9805 12.9805 13.4429 13.4429 13.7617 13.7617 13.9440 13.9440 14.1187 14.1187 14.6189 14.6189 14.6977 14.6977 14.9598 14.9598 15.2241 15.2241 15.6145 15.6145 k = 0.0000 0.5000 0.2159 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7577 -33.7577 -32.5547 -32.5547 -32.5517 -32.5517 0.0109 0.0109 0.0228 0.0228 0.4608 0.4608 0.4668 0.4668 0.4925 0.4925 6.9242 6.9242 8.8619 8.8619 11.3029 11.3029 11.6244 11.6244 11.9142 11.9142 12.4138 12.4138 12.9211 12.9211 12.9571 12.9571 13.4496 13.4496 13.7540 13.7540 13.9419 13.9419 14.1360 14.1360 14.6231 14.6231 14.6895 14.6895 14.9890 14.9890 15.2116 15.2116 15.5674 15.5674 k = 0.0000 0.5000 0.2273 ( 3956 PWs) bands (ev): -63.9869 -63.9869 -33.7578 -33.7578 -32.5547 -32.5547 -32.5519 -32.5519 0.0114 0.0114 0.0226 0.0226 0.4610 0.4610 0.4667 0.4667 0.4933 0.4933 6.9616 6.9616 8.9113 8.9113 11.2410 11.2410 11.6497 11.6497 11.9101 11.9101 12.4254 12.4254 12.9108 12.9108 12.9361 12.9361 13.4567 13.4567 13.7483 13.7483 13.9411 13.9411 14.1513 14.1513 14.6282 14.6282 14.6781 14.6781 15.0162 15.0162 15.1984 15.1984 15.5194 15.5194 k = 0.0000 0.5000 0.2386 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7579 -33.7579 -32.5546 -32.5546 -32.5520 -32.5520 0.0119 0.0119 0.0224 0.0224 0.4610 0.4610 0.4668 0.4668 0.4942 0.4942 7.0007 7.0007 8.9626 8.9626 11.1790 11.1790 11.6764 11.6764 11.9056 11.9056 12.4376 12.4376 12.8961 12.8961 12.9199 12.9199 13.4647 13.4647 13.7414 13.7414 13.9429 13.9429 14.1667 14.1667 14.6320 14.6320 14.6691 14.6691 15.0464 15.0464 15.1867 15.1867 15.4715 15.4715 k = 0.0000 0.5000 0.2500 ( 3948 PWs) bands (ev): -63.9859 -63.9859 -33.7579 -33.7579 -32.5546 -32.5546 -32.5522 -32.5522 0.0125 0.0125 0.0222 0.0222 0.4608 0.4608 0.4671 0.4671 0.4951 0.4951 7.0410 7.0410 9.0152 9.0152 11.1141 11.1141 11.7023 11.7023 11.9009 11.9009 12.4490 12.4490 12.8774 12.8774 12.9079 12.9079 13.4725 13.4725 13.7347 13.7347 13.9455 13.9455 14.1801 14.1801 14.6354 14.6354 14.6583 14.6583 15.0720 15.0720 15.1739 15.1739 15.4220 15.4220 k = 0.0000 0.5000 0.2614 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7580 -33.7580 -32.5546 -32.5546 -32.5524 -32.5524 0.0130 0.0130 0.0219 0.0219 0.4606 0.4606 0.4674 0.4674 0.4961 0.4961 7.0827 7.0827 9.0692 9.0692 11.0478 11.0478 11.7269 11.7269 11.8962 11.8962 12.4606 12.4606 12.8575 12.8575 12.8976 12.8976 13.4808 13.4808 13.7282 13.7282 13.9496 13.9496 14.1906 14.1906 14.6382 14.6382 14.6457 14.6457 15.0947 15.0947 15.1597 15.1597 15.3724 15.3724 k = 0.0000 0.5000 0.2727 ( 3952 PWs) bands (ev): -63.9863 -63.9863 -33.7581 -33.7581 -32.5546 -32.5546 -32.5525 -32.5525 0.0135 0.0135 0.0217 0.0217 0.4602 0.4602 0.4678 0.4678 0.4971 0.4971 7.1256 7.1256 9.1244 9.1244 10.9809 10.9809 11.7537 11.7537 11.8914 11.8914 12.4705 12.4705 12.8381 12.8381 12.8876 12.8876 13.4875 13.4875 13.7218 13.7218 13.9556 13.9556 14.2005 14.2005 14.6325 14.6325 14.6417 14.6417 15.1125 15.1125 15.1564 15.1564 15.3205 15.3205 k = 0.0000 0.5000 0.2841 ( 3952 PWs) bands (ev): -63.9862 -63.9862 -33.7581 -33.7581 -32.5546 -32.5546 -32.5527 -32.5527 0.0139 0.0139 0.0215 0.0215 0.4598 0.4598 0.4682 0.4682 0.4981 0.4981 7.1695 7.1695 9.1805 9.1805 10.9125 10.9125 11.7786 11.7786 11.8867 11.8867 12.4823 12.4823 12.8195 12.8195 12.8777 12.8777 13.4966 13.4966 13.7160 13.7160 13.9625 13.9625 14.2087 14.2087 14.6203 14.6203 14.6441 14.6441 15.1130 15.1130 15.1646 15.1646 15.2721 15.2721 k = 0.0000 0.5000 0.2955 ( 3954 PWs) bands (ev): -63.9865 -63.9865 -33.7582 -33.7582 -32.5546 -32.5546 -32.5528 -32.5528 0.0144 0.0144 0.0213 0.0213 0.4594 0.4594 0.4687 0.4687 0.4991 0.4991 7.2143 7.2143 9.2373 9.2373 10.8433 10.8433 11.8022 11.8022 11.8820 11.8820 12.4939 12.4939 12.8023 12.8023 12.8678 12.8678 13.5061 13.5061 13.7107 13.7107 13.9703 13.9703 14.2146 14.2146 14.6077 14.6077 14.6465 14.6465 15.1021 15.1021 15.1793 15.1793 15.2258 15.2258 k = 0.0000 0.5000 0.3068 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7583 -33.7583 -32.5546 -32.5546 -32.5530 -32.5530 0.0149 0.0149 0.0210 0.0210 0.4589 0.4589 0.4692 0.4692 0.5002 0.5002 7.2598 7.2598 9.2945 9.2945 10.7736 10.7736 11.8251 11.8251 11.8773 11.8773 12.5048 12.5048 12.7865 12.7865 12.8579 12.8579 13.5152 13.5152 13.7050 13.7050 13.9790 13.9790 14.2190 14.2190 14.5952 14.5952 14.6485 14.6485 15.0887 15.0887 15.1685 15.1685 15.2055 15.2055 k = 0.0000 0.5000 0.3182 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7583 -33.7583 -32.5546 -32.5546 -32.5531 -32.5531 0.0153 0.0153 0.0208 0.0208 0.4584 0.4584 0.4696 0.4696 0.5012 0.5012 7.3061 7.3061 9.3519 9.3519 10.7048 10.7048 11.8453 11.8453 11.8727 11.8727 12.5167 12.5167 12.7725 12.7725 12.8480 12.8480 13.5266 13.5266 13.7000 13.7000 13.9893 13.9893 14.2203 14.2203 14.5818 14.5818 14.6503 14.6503 15.0705 15.0705 15.1259 15.1259 15.2242 15.2242 k = 0.0000 0.5000 0.3295 ( 3958 PWs) bands (ev): -63.9869 -63.9869 -33.7584 -33.7584 -32.5547 -32.5547 -32.5532 -32.5532 0.0157 0.0157 0.0206 0.0206 0.4579 0.4579 0.4700 0.4700 0.5022 0.5022 7.3525 7.3525 9.4092 9.4092 10.6357 10.6357 11.8658 11.8658 11.8683 11.8683 12.5275 12.5275 12.7603 12.7603 12.8383 12.8383 13.5365 13.5365 13.6952 13.6952 13.9998 13.9998 14.2209 14.2209 14.5706 14.5706 14.6520 14.6520 15.0570 15.0570 15.0800 15.0800 15.2414 15.2414 k = 0.0000 0.5000 0.3409 ( 3952 PWs) bands (ev): -63.9861 -63.9861 -33.7584 -33.7584 -32.5546 -32.5546 -32.5533 -32.5533 0.0161 0.0161 0.0203 0.0203 0.4575 0.4575 0.4705 0.4705 0.5032 0.5032 7.3992 7.3992 9.4660 9.4660 10.5678 10.5678 11.8640 11.8640 11.8842 11.8842 12.5387 12.5387 12.7501 12.7501 12.8287 12.8287 13.5498 13.5498 13.6918 13.6918 14.0112 14.0112 14.2188 14.2188 14.5597 14.5597 14.6537 14.6537 15.0362 15.0362 15.0432 15.0432 15.2612 15.2612 k = 0.0000 0.5000 0.3523 ( 3960 PWs) bands (ev): -63.9871 -63.9871 -33.7585 -33.7585 -32.5547 -32.5547 -32.5535 -32.5535 0.0165 0.0165 0.0201 0.0201 0.4571 0.4571 0.4708 0.4708 0.5042 0.5042 7.4454 7.4454 9.5220 9.5220 10.5003 10.5003 11.8599 11.8599 11.8985 11.8985 12.5487 12.5487 12.7419 12.7419 12.8195 12.8195 13.5600 13.5600 13.6881 13.6881 14.0223 14.0223 14.2134 14.2134 14.5458 14.5458 14.6550 14.6550 14.9930 14.9930 15.0248 15.0248 15.2735 15.2735 k = 0.0000 0.5000 0.3636 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7585 -33.7585 -32.5547 -32.5547 -32.5536 -32.5536 0.0168 0.0168 0.0199 0.0199 0.4566 0.4566 0.4712 0.4712 0.5052 0.5052 7.4914 7.4914 9.5769 9.5769 10.4348 10.4348 11.8563 11.8563 11.9125 11.9125 12.5578 12.5578 12.7361 12.7361 12.8107 12.8107 13.5688 13.5688 13.6893 13.6893 14.0340 14.0340 14.2078 14.2078 14.5379 14.5379 14.6567 14.6567 14.9504 14.9504 15.0109 15.0109 15.2890 15.2890 k = 0.0000 0.5000 0.3750 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7586 -33.7586 -32.5547 -32.5547 -32.5537 -32.5537 0.0171 0.0171 0.0197 0.0197 0.4562 0.4562 0.4715 0.4715 0.5061 0.5061 7.5365 7.5365 9.6301 9.6301 10.3713 10.3713 11.8526 11.8526 11.9226 11.9226 12.5671 12.5671 12.7322 12.7322 12.8023 12.8023 13.5811 13.5811 13.6888 13.6888 14.0457 14.0457 14.1995 14.1995 14.5227 14.5227 14.6580 14.6580 14.9110 14.9110 14.9948 14.9948 15.3049 15.3049 k = 0.0000 0.5000 0.3864 ( 3956 PWs) bands (ev): -63.9866 -63.9866 -33.7586 -33.7586 -32.5547 -32.5547 -32.5537 -32.5537 0.0174 0.0174 0.0195 0.0195 0.4559 0.4559 0.4718 0.4718 0.5069 0.5069 7.5804 7.5804 9.6811 9.6811 10.3102 10.3102 11.8492 11.8492 11.9313 11.9313 12.5758 12.5758 12.7303 12.7303 12.7945 12.7945 13.5922 13.5922 13.6866 13.6866 14.0571 14.0571 14.1910 14.1910 14.5104 14.5104 14.6589 14.6589 14.8734 14.8734 14.9815 14.9815 15.3176 15.3176 k = 0.0000 0.5000 0.3977 ( 3952 PWs) bands (ev): -63.9861 -63.9861 -33.7587 -33.7587 -32.5548 -32.5548 -32.5538 -32.5538 0.0177 0.0177 0.0194 0.0194 0.4555 0.4555 0.4721 0.4721 0.5078 0.5078 7.6227 7.6227 9.7295 9.7295 10.2523 10.2523 11.8460 11.8460 11.9377 11.9377 12.5837 12.5837 12.7303 12.7303 12.7872 12.7872 13.6047 13.6047 13.6868 13.6868 14.0682 14.0682 14.1817 14.1817 14.4973 14.4973 14.6597 14.6597 14.8388 14.8388 14.9696 14.9696 15.3319 15.3319 k = 0.0000 0.5000 0.4091 ( 3956 PWs) bands (ev): -63.9865 -63.9865 -33.7587 -33.7587 -32.5548 -32.5548 -32.5538 -32.5538 0.0179 0.0179 0.0192 0.0192 0.4552 0.4552 0.4723 0.4723 0.5085 0.5085 7.6626 7.6626 9.7748 9.7748 10.1978 10.1978 11.8431 11.8431 11.9415 11.9415 12.5908 12.5908 12.7318 12.7318 12.7806 12.7806 13.6129 13.6129 13.6852 13.6852 14.0785 14.0785 14.1720 14.1720 14.4825 14.4825 14.6604 14.6604 14.8056 14.8056 14.9580 14.9580 15.3412 15.3412 k = 0.0000 0.5000 0.4205 ( 3958 PWs) bands (ev): -63.9868 -63.9868 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0181 0.0181 0.0191 0.0191 0.4550 0.4550 0.4726 0.4726 0.5092 0.5092 7.6999 7.6999 9.8165 9.8165 10.1476 10.1476 11.8404 11.8404 11.9428 11.9428 12.5973 12.5973 12.7345 12.7345 12.7746 12.7746 13.6230 13.6230 13.6841 13.6841 14.0881 14.0881 14.1624 14.1624 14.4712 14.4712 14.6609 14.6609 14.7760 14.7760 14.9436 14.9436 15.3507 15.3507 k = 0.0000 0.5000 0.4318 ( 3954 PWs) bands (ev): -63.9863 -63.9863 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0191 0.0191 0.4547 0.4547 0.4727 0.4727 0.5098 0.5098 7.7340 7.7340 9.8540 9.8540 10.1023 10.1023 11.8381 11.8381 11.9444 11.9444 12.6030 12.6030 12.7381 12.7381 12.7694 12.7694 13.6315 13.6315 13.6838 13.6838 14.0968 14.0968 14.1539 14.1539 14.4636 14.4636 14.6614 14.6614 14.7495 14.7495 14.9363 14.9363 15.3598 15.3598 k = 0.0000 0.5000 0.4432 ( 3950 PWs) bands (ev): -63.9858 -63.9858 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4545 0.4545 0.4729 0.4729 0.5103 0.5103 7.7641 7.7641 9.8868 9.8868 10.0625 10.0625 11.8361 11.8361 11.9444 11.9444 12.6080 12.6080 12.7419 12.7419 12.7650 12.7650 13.6404 13.6404 13.6867 13.6867 14.1043 14.1043 14.1457 14.1457 14.4531 14.4531 14.6618 14.6618 14.7266 14.7266 14.9308 14.9308 15.3669 15.3669 k = 0.0000 0.5000 0.4545 ( 3946 PWs) bands (ev): -63.9853 -63.9853 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4544 0.4544 0.4730 0.4730 0.5107 0.5107 7.7898 7.7898 9.9143 9.9143 10.0289 10.0289 11.8345 11.8345 11.9438 11.9438 12.6120 12.6120 12.7458 12.7458 12.7614 12.7614 13.6483 13.6483 13.6890 13.6890 14.1105 14.1105 14.1388 14.1388 14.4454 14.4454 14.6622 14.6622 14.7073 14.7073 14.9270 14.9270 15.3723 15.3723 k = 0.0000 0.5000 0.4659 ( 3942 PWs) bands (ev): -63.9848 -63.9848 -33.7588 -33.7588 -32.5550 -32.5550 -32.5539 -32.5539 0.0183 0.0183 0.0191 0.0191 0.4542 0.4542 0.4731 0.4731 0.5110 0.5110 7.8103 7.8103 9.9361 9.9361 10.0022 10.0022 11.8332 11.8332 11.9423 11.9423 12.6152 12.6152 12.7490 12.7490 12.7587 12.7587 13.6568 13.6568 13.6933 13.6933 14.1153 14.1153 14.1333 14.1333 14.4378 14.4378 14.6624 14.6624 14.6920 14.6920 14.9240 14.9240 15.3746 15.3746 k = 0.0000 0.5000 0.4773 ( 3938 PWs) bands (ev): -63.9843 -63.9843 -33.7588 -33.7588 -32.5550 -32.5550 -32.5539 -32.5539 0.0183 0.0183 0.0192 0.0192 0.4541 0.4541 0.4732 0.4732 0.5113 0.5113 7.8257 7.8257 9.9513 9.9513 9.9834 9.9834 11.8323 11.8323 11.9417 11.9417 12.6174 12.6174 12.7513 12.7513 12.7571 12.7571 13.6599 13.6599 13.6952 13.6952 14.1182 14.1182 14.1298 14.1298 14.4339 14.4339 14.6626 14.6626 14.6807 14.6807 14.9216 14.9216 15.3811 15.3811 k = 0.0000 0.5000 0.4886 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4541 0.4541 0.4733 0.4733 0.5114 0.5114 7.8350 7.8350 9.9585 9.9585 9.9740 9.9740 11.8317 11.8317 11.9419 11.9419 12.6188 12.6188 12.7522 12.7522 12.7567 12.7567 13.6617 13.6617 13.6967 13.6967 14.1193 14.1193 14.1283 14.1283 14.4379 14.4379 14.6627 14.6627 14.6739 14.6739 14.9209 14.9209 15.3840 15.3840 k = 0.0000 0.5000 0.5000 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7588 -33.7588 -32.5549 -32.5549 -32.5539 -32.5539 0.0182 0.0182 0.0192 0.0192 0.4541 0.4541 0.4733 0.4733 0.5115 0.5115 7.8381 7.8381 9.9590 9.9590 9.9728 9.9728 11.8315 11.8315 11.9416 11.9416 12.6192 12.6192 12.7523 12.7523 12.7568 12.7568 13.6621 13.6621 13.6971 13.6971 14.1194 14.1194 14.1281 14.1281 14.4367 14.4367 14.6627 14.6627 14.6716 14.6716 14.9203 14.9203 15.3846 15.3846 k = 0.5000 0.5000-0.0000 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4710 0.4710 0.5134 0.5134 7.9640 7.9640 9.8684 9.8684 10.0069 10.0069 11.7833 11.7833 11.9025 11.9025 12.5855 12.5855 12.7826 12.7826 12.7895 12.7895 13.4739 13.4739 13.5320 13.5320 14.1219 14.1219 14.1314 14.1314 14.4361 14.4361 14.5418 14.5418 14.8581 14.8581 14.9119 14.9119 14.9918 14.9918 k = 0.5000 0.5000 0.0114 ( 3932 PWs) bands (ev): -63.9837 -63.9837 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0242 0.0242 0.4567 0.4567 0.4711 0.4711 0.5134 0.5134 7.9638 7.9638 9.8697 9.8697 10.0083 10.0083 11.7841 11.7841 11.9011 11.9011 12.5875 12.5875 12.7822 12.7822 12.7890 12.7890 13.4733 13.4733 13.5315 13.5315 14.1224 14.1224 14.1302 14.1302 14.4373 14.4373 14.5425 14.5425 14.8580 14.8580 14.9140 14.9140 14.9918 14.9918 k = 0.5000 0.5000 0.0227 ( 3932 PWs) bands (ev): -63.9836 -63.9836 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0162 0.0162 0.0241 0.0241 0.4565 0.4565 0.4711 0.4711 0.5133 0.5133 7.9634 7.9634 9.8738 9.8738 10.0126 10.0126 11.7865 11.7865 11.8968 11.8968 12.5936 12.5936 12.7809 12.7809 12.7875 12.7875 13.4714 13.4714 13.5299 13.5299 14.1202 14.1202 14.1303 14.1303 14.4407 14.4407 14.5446 14.5446 14.8578 14.8578 14.9200 14.9200 14.9917 14.9917 k = 0.5000 0.5000 0.0341 ( 3940 PWs) bands (ev): -63.9846 -63.9846 -33.7584 -33.7584 -32.5571 -32.5571 -32.5508 -32.5508 0.0161 0.0161 0.0240 0.0240 0.4563 0.4563 0.4712 0.4712 0.5132 0.5132 7.9626 7.9626 9.8804 9.8804 10.0198 10.0198 11.7885 11.7885 11.8897 11.8897 12.6012 12.6012 12.7794 12.7794 12.7847 12.7847 13.4684 13.4684 13.5274 13.5274 14.1115 14.1115 14.1357 14.1357 14.4452 14.4452 14.5482 14.5482 14.8530 14.8530 14.9251 14.9251 14.9916 14.9916 k = 0.5000 0.5000 0.0455 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7584 -33.7584 -32.5571 -32.5571 -32.5509 -32.5509 0.0160 0.0160 0.0239 0.0239 0.4560 0.4560 0.4714 0.4714 0.5130 0.5130 7.9616 7.9616 9.8895 9.8895 10.0296 10.0296 11.7933 11.7933 11.8802 11.8802 12.6139 12.6139 12.7761 12.7761 12.7807 12.7807 13.4643 13.4643 13.5239 13.5239 14.0987 14.0987 14.1441 14.1441 14.4528 14.4528 14.5531 14.5531 14.8509 14.8509 14.9363 14.9363 14.9918 14.9918 k = 0.5000 0.5000 0.0568 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7584 -33.7584 -32.5571 -32.5571 -32.5509 -32.5509 0.0160 0.0160 0.0237 0.0237 0.4557 0.4557 0.4716 0.4716 0.5128 0.5128 7.9602 7.9602 9.9016 9.9016 10.0423 10.0423 11.8005 11.8005 11.8684 11.8684 12.6311 12.6311 12.7721 12.7721 12.7764 12.7764 13.4593 13.4593 13.5198 13.5198 14.0827 14.0827 14.1547 14.1547 14.4624 14.4624 14.5594 14.5594 14.8500 14.8500 14.9511 14.9511 14.9931 14.9931 k = 0.5000 0.5000 0.0682 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7585 -33.7585 -32.5571 -32.5571 -32.5510 -32.5510 0.0159 0.0159 0.0235 0.0235 0.4552 0.4552 0.4718 0.4718 0.5125 0.5125 7.9586 7.9586 9.9163 9.9163 10.0577 10.0577 11.8093 11.8093 11.8546 11.8546 12.6515 12.6515 12.7672 12.7672 12.7713 12.7713 13.4537 13.4537 13.5150 13.5150 14.0641 14.0641 14.1672 14.1672 14.4737 14.4737 14.5670 14.5670 14.8490 14.8490 14.9650 14.9650 14.9979 14.9979 k = 0.5000 0.5000 0.0795 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7585 -33.7585 -32.5570 -32.5570 -32.5510 -32.5510 0.0158 0.0158 0.0233 0.0233 0.4547 0.4547 0.4721 0.4721 0.5121 0.5121 7.9567 7.9567 9.9336 9.9336 10.0759 10.0759 11.8196 11.8196 11.8391 11.8391 12.6748 12.6748 12.7615 12.7615 12.7654 12.7654 13.4475 13.4475 13.5097 13.5097 14.0433 14.0433 14.1814 14.1814 14.4866 14.4866 14.5757 14.5757 14.8477 14.8477 14.9731 14.9731 15.0107 15.0107 k = 0.5000 0.5000 0.0909 ( 3944 PWs) bands (ev): -63.9851 -63.9851 -33.7585 -33.7585 -32.5570 -32.5570 -32.5511 -32.5511 0.0156 0.0156 0.0230 0.0230 0.4541 0.4541 0.4724 0.4724 0.5118 0.5118 7.9546 7.9546 9.9535 9.9535 10.0968 10.0968 11.8218 11.8218 11.8319 11.8319 12.7005 12.7005 12.7552 12.7552 12.7589 12.7589 13.4410 13.4410 13.5042 13.5042 14.0207 14.0207 14.1969 14.1969 14.5009 14.5009 14.5856 14.5856 14.8463 14.8463 14.9752 14.9752 15.0312 15.0312 k = 0.5000 0.5000 0.1023 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7585 -33.7585 -32.5570 -32.5570 -32.5511 -32.5511 0.0155 0.0155 0.0227 0.0227 0.4534 0.4534 0.4728 0.4728 0.5114 0.5114 7.9523 7.9523 9.9766 9.9766 10.1207 10.1207 11.8041 11.8041 11.8454 11.8454 12.7268 12.7268 12.7508 12.7508 12.7547 12.7547 13.4345 13.4345 13.4988 13.4988 13.9969 13.9969 14.2135 14.2135 14.5167 14.5167 14.5966 14.5966 14.8455 14.8455 14.9748 14.9748 15.0564 15.0564 k = 0.5000 0.5000 0.1136 ( 3952 PWs) bands (ev): -63.9860 -63.9860 -33.7585 -33.7585 -32.5570 -32.5570 -32.5512 -32.5512 0.0153 0.0153 0.0224 0.0224 0.4527 0.4527 0.4732 0.4732 0.5109 0.5109 7.9497 7.9497 10.0007 10.0007 10.1460 10.1460 11.7849 11.7849 11.8597 11.8597 12.7341 12.7341 12.7422 12.7422 12.7658 12.7658 13.4274 13.4274 13.4920 13.4920 13.9717 13.9717 14.2308 14.2308 14.5199 14.5199 14.6083 14.6083 14.8427 14.8427 14.9731 14.9731 15.0822 15.0822 k = 0.5000 0.5000 0.1250 ( 3952 PWs) bands (ev): -63.9860 -63.9860 -33.7586 -33.7586 -32.5570 -32.5570 -32.5513 -32.5513 0.0151 0.0151 0.0220 0.0220 0.4519 0.4519 0.4737 0.4737 0.5104 0.5104 7.9469 7.9469 10.0280 10.0280 10.1747 10.1747 11.7651 11.7651 11.8759 11.8759 12.7265 12.7265 12.7338 12.7338 12.7971 12.7971 13.4209 13.4209 13.4862 13.4862 13.9458 13.9458 14.2488 14.2488 14.5371 14.5371 14.6210 14.6210 14.8406 14.8406 14.9708 14.9708 15.1102 15.1102 k = 0.5000 0.5000 0.1364 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7586 -33.7586 -32.5570 -32.5570 -32.5513 -32.5513 0.0149 0.0149 0.0216 0.0216 0.4510 0.4510 0.4742 0.4742 0.5099 0.5099 7.9440 7.9440 10.0578 10.0578 10.2060 10.2060 11.7454 11.7454 11.8949 11.8949 12.7170 12.7170 12.7248 12.7248 12.8331 12.8331 13.4147 13.4147 13.4809 13.4809 13.9200 13.9200 14.2671 14.2671 14.5584 14.5584 14.6344 14.6344 14.8411 14.8411 14.9685 14.9685 15.1419 15.1419 k = 0.5000 0.5000 0.1477 ( 3948 PWs) bands (ev): -63.9855 -63.9855 -33.7586 -33.7586 -32.5570 -32.5570 -32.5514 -32.5514 0.0147 0.0147 0.0212 0.0212 0.4500 0.4500 0.4747 0.4747 0.5094 0.5094 7.9409 7.9409 10.0892 10.0892 10.2395 10.2395 11.7241 11.7241 11.9126 11.9126 12.7055 12.7055 12.7199 12.7199 12.8693 12.8693 13.4087 13.4087 13.4761 13.4761 13.8928 13.8928 14.2854 14.2854 14.5701 14.5701 14.6482 14.6482 14.8360 14.8360 14.9651 14.9651 15.1689 15.1689 k = 0.5000 0.5000 0.1591 ( 3948 PWs) bands (ev): -63.9855 -63.9855 -33.7586 -33.7586 -32.5569 -32.5569 -32.5515 -32.5515 0.0144 0.0144 0.0208 0.0208 0.4490 0.4490 0.4753 0.4753 0.5089 0.5089 7.9376 7.9376 10.1234 10.1234 10.2754 10.2754 11.7029 11.7029 11.9327 11.9327 12.6941 12.6941 12.7096 12.7096 12.9083 12.9083 13.4032 13.4032 13.4711 13.4711 13.8659 13.8659 14.3037 14.3037 14.5882 14.5882 14.6625 14.6625 14.8332 14.8332 14.9616 14.9616 15.1988 15.1988 k = 0.5000 0.5000 0.1705 ( 3948 PWs) bands (ev): -63.9855 -63.9855 -33.7587 -33.7587 -32.5569 -32.5569 -32.5516 -32.5516 0.0141 0.0141 0.0203 0.0203 0.4480 0.4480 0.4760 0.4760 0.5083 0.5083 7.9343 7.9343 10.1599 10.1599 10.3136 10.3136 11.6816 11.6816 11.9540 11.9540 12.6823 12.6823 12.6990 12.6990 12.9491 12.9491 13.3982 13.3982 13.4666 13.4666 13.8390 13.8390 14.3216 14.3216 14.6063 14.6063 14.6771 14.6771 14.8301 14.8301 14.9578 14.9578 15.2290 15.2290 k = 0.5000 0.5000 0.1818 ( 3948 PWs) bands (ev): -63.9855 -63.9855 -33.7587 -33.7587 -32.5569 -32.5569 -32.5517 -32.5517 0.0138 0.0138 0.0199 0.0199 0.4469 0.4469 0.4766 0.4766 0.5077 0.5077 7.9308 7.9308 10.1983 10.1983 10.3540 10.3540 11.6603 11.6603 11.9764 11.9764 12.6701 12.6701 12.6881 12.6881 12.9915 12.9915 13.3938 13.3938 13.4624 13.4624 13.8123 13.8123 14.3390 14.3390 14.6242 14.6242 14.6918 14.6918 14.8268 14.8268 14.9537 14.9537 15.2592 15.2592 k = 0.5000 0.5000 0.1932 ( 3948 PWs) bands (ev): -63.9854 -63.9854 -33.7587 -33.7587 -32.5568 -32.5568 -32.5518 -32.5518 0.0135 0.0135 0.0194 0.0194 0.4457 0.4457 0.4773 0.4773 0.5071 0.5071 7.9273 7.9273 10.2388 10.2388 10.3963 10.3963 11.6394 11.6394 12.0003 12.0003 12.6575 12.6575 12.6749 12.6749 13.0357 13.0357 13.3899 13.3899 13.4583 13.4583 13.7861 13.7861 14.3556 14.3556 14.6433 14.6433 14.7066 14.7066 14.8241 14.8241 14.9496 14.9496 15.2901 15.2901 k = 0.5000 0.5000 0.2045 ( 3956 PWs) bands (ev): -63.9864 -63.9864 -33.7588 -33.7588 -32.5568 -32.5568 -32.5520 -32.5520 0.0131 0.0131 0.0189 0.0189 0.4446 0.4446 0.4781 0.4781 0.5065 0.5065 7.9236 7.9236 10.2807 10.2807 10.4407 10.4407 11.6171 11.6171 12.0230 12.0230 12.6443 12.6443 12.6638 12.6638 13.0799 13.0799 13.3863 13.3863 13.4551 13.4551 13.7591 13.7591 14.3712 14.3712 14.6615 14.6615 14.7211 14.7211 14.8172 14.8172 14.9437 14.9437 15.3164 15.3164 k = 0.5000 0.5000 0.2159 ( 3956 PWs) bands (ev): -63.9864 -63.9864 -33.7588 -33.7588 -32.5568 -32.5568 -32.5521 -32.5521 0.0127 0.0127 0.0184 0.0184 0.4434 0.4434 0.4789 0.4789 0.5059 0.5059 7.9199 7.9199 10.3248 10.3248 10.4868 10.4868 11.5961 11.5961 12.0484 12.0484 12.6317 12.6317 12.6527 12.6527 13.1265 13.1265 13.3835 13.3835 13.4521 13.4521 13.7335 13.7335 14.3858 14.3858 14.6772 14.6772 14.7353 14.7353 14.8130 14.8130 14.9387 14.9387 15.3457 15.3457 k = 0.5000 0.5000 0.2273 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7588 -33.7588 -32.5568 -32.5568 -32.5522 -32.5522 0.0123 0.0123 0.0178 0.0178 0.4421 0.4421 0.4797 0.4797 0.5054 0.5054 7.9163 7.9163 10.3704 10.3704 10.5344 10.5344 11.5754 11.5754 12.0745 12.0745 12.6190 12.6190 12.6395 12.6395 13.1741 13.1741 13.3813 13.3813 13.4484 13.4484 13.7084 13.7084 14.3990 14.3990 14.6918 14.6918 14.7489 14.7489 14.8084 14.8084 14.9336 14.9336 15.3746 15.3746 k = 0.5000 0.5000 0.2386 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7589 -33.7589 -32.5567 -32.5567 -32.5523 -32.5523 0.0119 0.0119 0.0173 0.0173 0.4409 0.4409 0.4805 0.4805 0.5048 0.5048 7.9126 7.9126 10.4175 10.4175 10.5836 10.5836 11.5551 11.5551 12.1014 12.1014 12.6066 12.6066 12.6288 12.6288 13.2225 13.2225 13.3800 13.3800 13.4460 13.4460 13.6841 13.6841 14.4107 14.4107 14.7053 14.7053 14.7619 14.7619 14.8036 14.8036 14.9282 14.9282 15.4028 15.4028 k = 0.5000 0.5000 0.2500 ( 3968 PWs) bands (ev): -63.9879 -63.9879 -33.7589 -33.7589 -32.5567 -32.5567 -32.5524 -32.5524 0.0115 0.0115 0.0168 0.0168 0.4396 0.4396 0.4813 0.4813 0.5042 0.5042 7.9088 7.9088 10.4655 10.4655 10.6341 10.6341 11.5342 11.5342 12.1279 12.1279 12.5941 12.5941 12.6181 12.6181 13.2705 13.2705 13.3796 13.3796 13.4438 13.4438 13.6595 13.6595 14.4206 14.4206 14.7171 14.7171 14.7737 14.7737 14.7967 14.7967 14.9212 14.9212 15.4276 15.4276 k = 0.5000 0.5000 0.2614 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7589 -33.7589 -32.5567 -32.5567 -32.5525 -32.5525 0.0110 0.0110 0.0162 0.0162 0.4383 0.4383 0.4822 0.4822 0.5036 0.5036 7.9054 7.9054 10.5155 10.5155 10.6858 10.6858 11.5159 11.5159 12.1568 12.1568 12.5830 12.5830 12.6083 12.6083 13.3174 13.3174 13.3832 13.3832 13.4424 13.4424 13.6374 13.6374 14.4287 14.4287 14.7295 14.7295 14.7834 14.7834 14.7941 14.7941 14.9169 14.9169 15.4565 15.4565 k = 0.5000 0.5000 0.2727 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7590 -33.7590 -32.5567 -32.5567 -32.5526 -32.5526 0.0106 0.0106 0.0157 0.0157 0.4371 0.4371 0.4831 0.4831 0.5030 0.5030 7.9019 7.9019 10.5659 10.5659 10.7383 10.7383 11.4971 11.4971 12.1852 12.1852 12.5719 12.5719 12.5991 12.5991 13.3516 13.3516 13.3996 13.3996 13.4411 13.4411 13.6157 13.6157 14.4347 14.4347 14.7378 14.7378 14.7831 14.7831 14.7985 14.7985 14.9115 14.9115 15.4824 15.4824 k = 0.5000 0.5000 0.2841 ( 3968 PWs) bands (ev): -63.9879 -63.9879 -33.7590 -33.7590 -32.5566 -32.5566 -32.5528 -32.5528 0.0101 0.0101 0.0151 0.0151 0.4358 0.4358 0.4840 0.4840 0.5025 0.5025 7.8983 7.8983 10.6169 10.6169 10.7914 10.7914 11.4778 11.4778 12.2130 12.2130 12.5612 12.5612 12.5897 12.5897 13.3627 13.3627 13.4331 13.4331 13.4455 13.4455 13.5941 13.5941 14.4384 14.4384 14.7431 14.7431 14.7760 14.7760 14.8067 14.8067 14.9040 14.9040 15.5049 15.5049 k = 0.5000 0.5000 0.2955 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7590 -33.7590 -32.5566 -32.5566 -32.5528 -32.5528 0.0096 0.0096 0.0146 0.0146 0.4346 0.4346 0.4849 0.4849 0.5020 0.5020 7.8952 7.8952 10.6685 10.6685 10.8449 10.8449 11.4614 11.4614 12.2426 12.2426 12.5514 12.5514 12.5821 12.5821 13.3656 13.3656 13.4365 13.4365 13.4907 13.4907 13.5760 13.5760 14.4398 14.4398 14.7496 14.7496 14.7708 14.7708 14.8146 14.8146 14.9009 14.9009 15.5313 15.5313 k = 0.5000 0.5000 0.3068 ( 3968 PWs) bands (ev): -63.9878 -63.9878 -33.7591 -33.7591 -32.5566 -32.5566 -32.5530 -32.5530 0.0091 0.0091 0.0141 0.0141 0.4334 0.4334 0.4857 0.4857 0.5015 0.5015 7.8917 7.8917 10.7203 10.7203 10.8985 10.8985 11.4437 11.4437 12.2708 12.2708 12.5422 12.5422 12.5737 12.5737 13.3663 13.3663 13.4337 13.4337 13.5369 13.5369 13.5622 13.5622 14.4386 14.4386 14.7488 14.7488 14.7635 14.7635 14.8210 14.8210 14.8941 14.8941 15.5525 15.5525 k = 0.5000 0.5000 0.3182 ( 3968 PWs) bands (ev): -63.9878 -63.9878 -33.7591 -33.7591 -32.5566 -32.5566 -32.5531 -32.5531 0.0087 0.0087 0.0136 0.0136 0.4322 0.4322 0.4866 0.4866 0.5010 0.5010 7.8886 7.8886 10.7720 10.7720 10.9519 10.9519 11.4276 11.4276 12.2995 12.2995 12.5341 12.5341 12.5679 12.5679 13.3667 13.3667 13.4319 13.4319 13.5355 13.5355 13.5993 13.5993 14.4348 14.4348 14.7447 14.7447 14.7577 14.7577 14.8260 14.8260 14.8892 14.8892 15.5744 15.5744 k = 0.5000 0.5000 0.3295 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7591 -33.7591 -32.5565 -32.5565 -32.5531 -32.5531 0.0082 0.0082 0.0131 0.0131 0.4310 0.4310 0.4875 0.4875 0.5005 0.5005 7.8863 7.8863 10.8236 10.8236 11.0048 11.0048 11.4149 11.4149 12.3289 12.3289 12.5271 12.5271 12.5613 12.5613 13.3669 13.3669 13.4281 13.4281 13.5218 13.5218 13.6522 13.6522 14.4284 14.4284 14.7388 14.7388 14.7530 14.7530 14.8297 14.8297 14.8897 14.8897 15.5994 15.5994 k = 0.5000 0.5000 0.3409 ( 3960 PWs) bands (ev): -63.9869 -63.9869 -33.7592 -33.7592 -32.5565 -32.5565 -32.5532 -32.5532 0.0078 0.0078 0.0126 0.0126 0.4299 0.4299 0.4883 0.4883 0.5001 0.5001 7.8834 7.8834 10.8743 10.8743 11.0567 11.0567 11.4004 11.4004 12.3565 12.3565 12.5211 12.5211 12.5580 12.5580 13.3669 13.3669 13.4252 13.4252 13.5077 13.5077 13.7052 13.7052 14.4193 14.4193 14.7296 14.7296 14.7451 14.7451 14.8316 14.8316 14.8856 14.8856 15.6188 15.6188 k = 0.5000 0.5000 0.3523 ( 3952 PWs) bands (ev): -63.9859 -63.9859 -33.7592 -33.7592 -32.5565 -32.5565 -32.5533 -32.5533 0.0073 0.0073 0.0122 0.0122 0.4289 0.4289 0.4891 0.4891 0.4997 0.4997 7.8811 7.8811 10.9240 10.9240 11.1073 11.1073 11.3879 11.3879 12.3837 12.3837 12.5164 12.5164 12.5569 12.5569 13.3671 13.3671 13.4229 13.4229 13.4959 13.4959 13.7583 13.7583 14.4077 14.4077 14.7199 14.7199 14.7357 14.7357 14.8320 14.8320 14.8841 14.8841 15.6388 15.6388 k = 0.5000 0.5000 0.3636 ( 3952 PWs) bands (ev): -63.9859 -63.9859 -33.7592 -33.7592 -32.5565 -32.5565 -32.5533 -32.5533 0.0069 0.0069 0.0117 0.0117 0.4278 0.4278 0.4899 0.4899 0.4993 0.4993 7.8784 7.8784 10.9720 10.9720 11.1562 11.1562 11.3746 11.3746 12.4092 12.4092 12.5128 12.5128 12.5575 12.5575 13.3671 13.3671 13.4201 13.4201 13.4855 13.4855 13.8104 13.8104 14.3938 14.3938 14.7089 14.7089 14.7193 14.7193 14.8305 14.8305 14.8792 14.8792 15.6545 15.6545 k = 0.5000 0.5000 0.3750 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7592 -33.7592 -32.5564 -32.5564 -32.5534 -32.5534 0.0065 0.0065 0.0113 0.0113 0.4269 0.4269 0.4906 0.4906 0.4990 0.4990 7.8762 7.8762 11.0183 11.0183 11.2032 11.2032 11.3630 11.3630 12.4335 12.4335 12.5107 12.5107 12.5584 12.5584 13.3670 13.3670 13.4162 13.4162 13.4778 13.4778 13.8619 13.8619 14.3779 14.3779 14.6986 14.6986 14.7132 14.7132 14.8275 14.8275 14.8766 14.8766 15.6705 15.6705 k = 0.5000 0.5000 0.3864 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7592 -33.7592 -32.5564 -32.5564 -32.5534 -32.5534 0.0061 0.0061 0.0109 0.0109 0.4260 0.4260 0.4913 0.4913 0.4986 0.4986 7.8740 7.8740 11.0623 11.0623 11.2475 11.2475 11.3521 11.3521 12.4558 12.4558 12.5104 12.5104 12.5601 12.5601 13.3664 13.3664 13.4102 13.4102 13.4711 13.4711 13.9120 13.9120 14.3603 14.3603 14.6878 14.6878 14.6967 14.6967 14.8227 14.8227 14.8735 14.8735 15.6846 15.6846 k = 0.5000 0.5000 0.3977 ( 3944 PWs) bands (ev): -63.9850 -63.9850 -33.7592 -33.7592 -32.5564 -32.5564 -32.5535 -32.5535 0.0058 0.0058 0.0106 0.0106 0.4252 0.4252 0.4919 0.4919 0.4984 0.4984 7.8721 7.8721 11.1038 11.1038 11.2890 11.2890 11.3422 11.3422 12.4747 12.4747 12.5129 12.5129 12.5631 12.5631 13.3655 13.3655 13.4038 13.4038 13.4659 13.4659 13.9604 13.9604 14.3415 14.3415 14.6765 14.6765 14.6792 14.6792 14.8164 14.8164 14.8707 14.8707 15.6972 15.6972 k = 0.5000 0.5000 0.4091 ( 3932 PWs) bands (ev): -63.9835 -63.9835 -33.7592 -33.7592 -32.5563 -32.5563 -32.5535 -32.5535 0.0055 0.0055 0.0102 0.0102 0.4245 0.4245 0.4925 0.4925 0.4981 0.4981 7.8706 7.8706 11.1440 11.1440 11.3272 11.3272 11.3342 11.3342 12.4884 12.4884 12.5202 12.5202 12.5676 12.5676 13.3657 13.3657 13.3987 13.3987 13.4630 13.4630 14.0068 14.0068 14.3222 14.3222 14.6632 14.6632 14.6675 14.6675 14.8087 14.8087 14.8706 14.8706 15.7098 15.7098 k = 0.5000 0.5000 0.4205 ( 3932 PWs) bands (ev): -63.9835 -63.9835 -33.7593 -33.7593 -32.5563 -32.5563 -32.5535 -32.5535 0.0052 0.0052 0.0099 0.0099 0.4238 0.4238 0.4930 0.4930 0.4979 0.4979 7.8690 7.8690 11.1790 11.1790 11.3263 11.3263 11.3617 11.3617 12.4959 12.4959 12.5317 12.5317 12.5728 12.5728 13.3641 13.3641 13.3930 13.3930 13.4598 13.4598 14.0505 14.0505 14.3028 14.3028 14.6441 14.6441 14.6577 14.6577 14.7997 14.7997 14.8685 14.8685 15.7194 15.7194 k = 0.5000 0.5000 0.4318 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0049 0.0049 0.0097 0.0097 0.4232 0.4232 0.4934 0.4934 0.4977 0.4977 7.8676 7.8676 11.2113 11.2113 11.3192 11.3192 11.3921 11.3921 12.5003 12.5003 12.5446 12.5446 12.5781 12.5781 13.3627 13.3627 13.3867 13.3867 13.4548 13.4548 14.0909 14.0909 14.2842 14.2842 14.6238 14.6238 14.6489 14.6489 14.7899 14.7899 14.8661 14.8661 15.7268 15.7268 k = 0.5000 0.5000 0.4432 ( 3936 PWs) bands (ev): -63.9841 -63.9841 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0047 0.0047 0.0095 0.0095 0.4227 0.4227 0.4937 0.4937 0.4976 0.4976 7.8664 7.8664 11.2383 11.2383 11.3134 11.3134 11.4183 11.4183 12.5035 12.5035 12.5563 12.5563 12.5850 12.5850 13.3604 13.3604 13.3830 13.3830 13.4525 13.4525 14.1274 14.1274 14.2670 14.2670 14.6061 14.6061 14.6410 14.6410 14.7796 14.7796 14.8645 14.8645 15.7327 15.7327 k = 0.5000 0.5000 0.4545 ( 3928 PWs) bands (ev): -63.9831 -63.9831 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0045 0.0045 0.0093 0.0093 0.4223 0.4223 0.4940 0.4940 0.4975 0.4975 7.8658 7.8658 11.2613 11.2613 11.3100 11.3100 11.4401 11.4401 12.5062 12.5062 12.5660 12.5660 12.5921 12.5921 13.3586 13.3586 13.3808 13.3808 13.4509 13.4509 14.1592 14.1592 14.2519 14.2519 14.5913 14.5913 14.6343 14.6343 14.7696 14.7696 14.8672 14.8672 15.7386 15.7386 k = 0.5000 0.5000 0.4659 ( 3912 PWs) bands (ev): -63.9811 -63.9811 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0044 0.0044 0.0091 0.0091 0.4220 0.4220 0.4942 0.4942 0.4975 0.4975 7.8655 7.8655 11.2792 11.2792 11.3081 11.3081 11.4575 11.4575 12.5084 12.5084 12.5734 12.5734 12.5987 12.5987 13.3571 13.3571 13.3815 13.3815 13.4538 13.4538 14.1853 14.1853 14.2395 14.2395 14.5821 14.5821 14.6290 14.6290 14.7605 14.7605 14.8704 14.8704 15.7422 15.7422 k = 0.5000 0.5000 0.4773 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0043 0.0043 0.0090 0.0090 0.4218 0.4218 0.4944 0.4944 0.4974 0.4974 7.8650 7.8650 11.2915 11.2915 11.3060 11.3060 11.4698 11.4698 12.5102 12.5102 12.5785 12.5785 12.6037 12.6037 13.3554 13.3554 13.3801 13.3801 13.4528 13.4528 14.2045 14.2045 14.2306 14.2306 14.5724 14.5724 14.6250 14.6250 14.7532 14.7532 14.8697 14.8697 15.7421 15.7421 k = 0.5000 0.5000 0.4886 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4944 0.4944 0.4974 0.4974 7.8647 7.8647 11.2978 11.2978 11.3058 11.3058 11.4772 11.4772 12.5113 12.5113 12.5815 12.5815 12.6070 12.6070 13.3543 13.3543 13.3792 13.3792 13.4521 13.4521 14.2153 14.2153 14.2262 14.2262 14.5664 14.5664 14.6226 14.6226 14.7484 14.7484 14.8693 14.8693 15.7414 15.7414 k = 0.5000 0.5000 0.5000 ( 3912 PWs) bands (ev): -63.9812 -63.9812 -33.7593 -33.7593 -32.5563 -32.5563 -32.5536 -32.5536 0.0042 0.0042 0.0090 0.0090 0.4216 0.4216 0.4945 0.4945 0.4974 0.4974 7.8646 7.8646 11.2991 11.2991 11.3065 11.3065 11.4796 11.4796 12.5116 12.5116 12.5826 12.5826 12.6081 12.6081 13.3539 13.3539 13.3790 13.3790 13.4519 13.4519 14.2175 14.2175 14.2262 14.2262 14.5643 14.5643 14.6218 14.6218 14.7467 14.7467 14.8691 14.8691 15.7411 15.7411 Writing output data file MnGaFe2.save init_run : 0.16s CPU 0.33s WALL ( 1 calls) electrons : 165.84s CPU 169.00s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.00s CPU 0.04s WALL ( 1 calls) Called by electrons: c_bands : 165.84s CPU 168.99s 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 : 0.05s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.06s CPU 0.08s WALL ( 439 calls) cegterg : 147.59s CPU 149.65s WALL ( 465 calls) Called by sum_band: Called by *egterg: h_psi : 93.50s CPU 95.40s WALL ( 6475 calls) s_psi : 5.48s CPU 5.29s WALL ( 6475 calls) g_psi : 0.27s CPU 0.28s WALL ( 5571 calls) cdiaghg : 45.72s CPU 46.32s WALL ( 6010 calls) cegterg:over : 6.52s CPU 6.58s WALL ( 5571 calls) cegterg:upda : 4.91s CPU 4.94s WALL ( 5571 calls) cegterg:last : 3.30s CPU 3.28s WALL ( 1404 calls) cdiaghg:chol : 2.61s CPU 2.66s WALL ( 6010 calls) cdiaghg:inve : 1.74s CPU 1.76s WALL ( 6010 calls) cdiaghg:para : 2.64s CPU 2.85s WALL ( 12020 calls) Called by h_psi: h_psi:vloc : 79.92s CPU 81.46s WALL ( 6475 calls) h_psi:vnl : 13.30s CPU 13.67s WALL ( 6475 calls) add_vuspsi : 6.87s CPU 7.17s WALL ( 6475 calls) General routines calbec : 6.41s CPU 6.49s WALL ( 6475 calls) fft : 0.00s CPU 0.00s WALL ( 15 calls) fftw : 75.94s CPU 77.19s WALL ( 972612 calls) davcio : 0.24s CPU 0.36s WALL ( 878 calls) Parallel routines fft_scatter : 28.26s CPU 28.58s WALL ( 972627 calls) PWSCF : 3m 6.32s CPU 3m24.64s WALL This run was terminated on: 18: 9:46 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=