Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 20:58: 8 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: ./ZrNi.save/ file Ni.rel-pbe-n-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 30 25 7 762 587 97 Max 31 26 8 765 606 102 Sum 1091 919 285 27467 21525 3555 bravais-lattice index = 14 lattice parameter (alat) = 9.8838 a.u. unit-cell volume = 449.3592 (a.u.)^3 number of atoms/cell = 4 number of atomic types = 2 number of electrons = 28.00 number of Kohn-Sham states= 36 kinetic-energy cutoff = 50.0000 Ry charge density cutoff = 236.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 9.883818 celldm(2)= 1.000000 celldm(3)= 0.784086 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.804799 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.804799 0.593548 0.000000 ) a(3) = ( 0.000000 0.000000 0.784086 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.355913 -0.000000 ) b(2) = ( 0.000000 1.684785 -0.000000 ) b(3) = ( 0.000000 0.000000 1.275370 ) PseudoPot. # 1 for Zr read from file: /users/gautes/Pseudo/Zr.rel-pbe-n-nc.UPF MD5 check sum: 453101d5cee66cf3691e2371f73c5d7d Pseudo is Norm-conserving + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 4 beta functions with: l(1) = 1 l(2) = 1 l(3) = 2 l(4) = 2 PseudoPot. # 2 for Ni read from file: /users/gautes/Pseudo/Ni.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: 9d95a5a85785a32f0d1fefdc4874c578 Pseudo is Ultrasoft + core correction, Zval = 10.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1195 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 Zr 4.00 91.22400 Zr( 1.00) Ni 10.00 58.69340 Ni( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.3920432 ) isym = 3 inversion 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 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.3920432 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 i -i s_h -s_h G_3+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_4+ 1.00 -1.00 0.00 0.00 1.00 -1.00 0.00 0.00 G_3- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 G_4- 1.00 -1.00 0.00 0.00 -1.00 1.00 0.00 0.00 imaginary part E -E C2 -C2 i -i s_h -s_h G_3+ 0.00 0.00 1.00 -1.00 0.00 0.00 1.00 -1.00 G_4+ 0.00 0.00 -1.00 1.00 0.00 0.00 -1.00 1.00 G_3- 0.00 0.00 1.00 -1.00 0.00 0.00 -1.00 1.00 G_4- 0.00 0.00 -1.00 1.00 0.00 0.00 1.00 -1.00 the symmetry operations in each class and the name of the first element: E 1 identity -E -1 identity E C2 2 180 deg rotation - cart. axis [0,0,1] -C2 -2 180 deg rotation - cart. axis [0,0,1] E i 3 inversion -i -3 inversion E s_h 4 inv. 180 deg rotation - cart. axis [0,0,1] -s_h -4 inv. 180 deg rotation - cart. axis [0,0,1] E Cartesian axes number of k points= 460 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 2) = ( 0.0051304 0.0155999 -0.0000000), wk = 0.0021739 k( 3) = ( 0.0102607 0.0311997 -0.0000000), wk = 0.0021739 k( 4) = ( 0.0153911 0.0467996 -0.0000000), wk = 0.0021739 k( 5) = ( 0.0205214 0.0623994 -0.0000000), wk = 0.0021739 k( 6) = ( 0.0256518 0.0779993 -0.0000000), wk = 0.0021739 k( 7) = ( 0.0307821 0.0935992 -0.0000000), wk = 0.0021739 k( 8) = ( 0.0359125 0.1091990 -0.0000000), wk = 0.0021739 k( 9) = ( 0.0410428 0.1247989 -0.0000000), wk = 0.0021739 k( 10) = ( 0.0461732 0.1403987 -0.0000000), wk = 0.0021739 k( 11) = ( 0.0513036 0.1559986 -0.0000000), wk = 0.0021739 k( 12) = ( 0.0564339 0.1715985 -0.0000000), wk = 0.0021739 k( 13) = ( 0.0615643 0.1871983 -0.0000000), wk = 0.0021739 k( 14) = ( 0.0666946 0.2027982 -0.0000000), wk = 0.0021739 k( 15) = ( 0.0718250 0.2183980 -0.0000000), wk = 0.0021739 k( 16) = ( 0.0769553 0.2339979 -0.0000000), wk = 0.0021739 k( 17) = ( 0.0820857 0.2495977 -0.0000000), wk = 0.0021739 k( 18) = ( 0.0872160 0.2651976 -0.0000000), wk = 0.0021739 k( 19) = ( 0.0923464 0.2807975 -0.0000000), wk = 0.0021739 k( 20) = ( 0.0974768 0.2963973 -0.0000000), wk = 0.0021739 k( 21) = ( 0.1026071 0.3119972 -0.0000000), wk = 0.0021739 k( 22) = ( 0.1077375 0.3275970 -0.0000000), wk = 0.0021739 k( 23) = ( 0.1128678 0.3431969 -0.0000000), wk = 0.0021739 k( 24) = ( 0.1179982 0.3587968 -0.0000000), wk = 0.0021739 k( 25) = ( 0.1231285 0.3743966 -0.0000000), wk = 0.0021739 k( 26) = ( 0.1282589 0.3899965 -0.0000000), wk = 0.0021739 k( 27) = ( 0.1333892 0.4055964 -0.0000000), wk = 0.0021739 k( 28) = ( 0.1385196 0.4211962 -0.0000000), wk = 0.0021739 k( 29) = ( 0.1436499 0.4367961 -0.0000000), wk = 0.0021739 k( 30) = ( 0.1487803 0.4523959 -0.0000000), wk = 0.0021739 k( 31) = ( 0.1539107 0.4679958 -0.0000000), wk = 0.0021739 k( 32) = ( 0.1590410 0.4835956 -0.0000000), wk = 0.0021739 k( 33) = ( 0.1641714 0.4991955 -0.0000000), wk = 0.0021739 k( 34) = ( 0.1693017 0.5147953 -0.0000000), wk = 0.0021739 k( 35) = ( 0.1744321 0.5303952 -0.0000000), wk = 0.0021739 k( 36) = ( 0.1795624 0.5459951 -0.0000000), wk = 0.0021739 k( 37) = ( 0.1846928 0.5615949 -0.0000000), wk = 0.0021739 k( 38) = ( 0.1898231 0.5771948 -0.0000000), wk = 0.0021739 k( 39) = ( 0.1949535 0.5927947 -0.0000000), wk = 0.0021739 k( 40) = ( 0.2000839 0.6083945 -0.0000000), wk = 0.0021739 k( 41) = ( 0.2052142 0.6239944 -0.0000000), wk = 0.0021739 k( 42) = ( 0.2103446 0.6395942 -0.0000000), wk = 0.0021739 k( 43) = ( 0.2154749 0.6551941 -0.0000000), wk = 0.0021739 k( 44) = ( 0.2206053 0.6707939 -0.0000000), wk = 0.0021739 k( 45) = ( 0.2257356 0.6863938 -0.0000000), wk = 0.0021739 k( 46) = ( 0.2308660 0.7019936 -0.0000000), wk = 0.0021739 k( 47) = ( 0.2359963 0.7175935 -0.0000000), wk = 0.0021739 k( 48) = ( 0.2411267 0.7331934 -0.0000000), wk = 0.0021739 k( 49) = ( 0.2462571 0.7487932 -0.0000000), wk = 0.0021739 k( 50) = ( 0.2513874 0.7643931 -0.0000000), wk = 0.0021739 k( 51) = ( 0.2565178 0.7799930 -0.0000000), wk = 0.0021739 k( 52) = ( 0.2616481 0.7955928 -0.0000000), wk = 0.0021739 k( 53) = ( 0.2667785 0.8111927 -0.0000000), wk = 0.0021739 k( 54) = ( 0.2719088 0.8267925 -0.0000000), wk = 0.0021739 k( 55) = ( 0.2770392 0.8423924 -0.0000000), wk = 0.0021739 k( 56) = ( 0.2770392 0.8423924 -0.0000000), wk = 0.0021739 k( 57) = ( 0.2607428 0.8423924 -0.0000000), wk = 0.0021739 k( 58) = ( 0.2444463 0.8423924 -0.0000000), wk = 0.0021739 k( 59) = ( 0.2281499 0.8423924 -0.0000000), wk = 0.0021739 k( 60) = ( 0.2118535 0.8423924 -0.0000000), wk = 0.0021739 k( 61) = ( 0.1955571 0.8423924 -0.0000000), wk = 0.0021739 k( 62) = ( 0.1792606 0.8423924 -0.0000000), wk = 0.0021739 k( 63) = ( 0.1629642 0.8423924 -0.0000000), wk = 0.0021739 k( 64) = ( 0.1466678 0.8423924 -0.0000000), wk = 0.0021739 k( 65) = ( 0.1303714 0.8423924 -0.0000000), wk = 0.0021739 k( 66) = ( 0.1140750 0.8423924 -0.0000000), wk = 0.0021739 k( 67) = ( 0.0977785 0.8423924 -0.0000000), wk = 0.0021739 k( 68) = ( 0.0814821 0.8423924 -0.0000000), wk = 0.0021739 k( 69) = ( 0.0651857 0.8423924 -0.0000000), wk = 0.0021739 k( 70) = ( 0.0488893 0.8423924 -0.0000000), wk = 0.0021739 k( 71) = ( 0.0325928 0.8423924 -0.0000000), wk = 0.0021739 k( 72) = ( 0.0162964 0.8423924 -0.0000000), wk = 0.0021739 k( 73) = ( 0.0000000 0.8423924 -0.0000000), wk = 0.0021739 k( 74) = ( 0.0000000 0.8423924 -0.0000000), wk = 0.0021739 k( 75) = ( 0.0000000 0.8423924 0.0163509), wk = 0.0021739 k( 76) = ( 0.0000000 0.8423924 0.0327018), wk = 0.0021739 k( 77) = ( 0.0000000 0.8423924 0.0490527), wk = 0.0021739 k( 78) = ( 0.0000000 0.8423924 0.0654036), wk = 0.0021739 k( 79) = ( 0.0000000 0.8423924 0.0817545), wk = 0.0021739 k( 80) = ( 0.0000000 0.8423924 0.0981054), wk = 0.0021739 k( 81) = ( 0.0000000 0.8423924 0.1144563), wk = 0.0021739 k( 82) = ( 0.0000000 0.8423924 0.1308072), wk = 0.0021739 k( 83) = ( 0.0000000 0.8423924 0.1471581), wk = 0.0021739 k( 84) = ( 0.0000000 0.8423924 0.1635089), wk = 0.0021739 k( 85) = ( 0.0000000 0.8423924 0.1798598), wk = 0.0021739 k( 86) = ( 0.0000000 0.8423924 0.1962107), wk = 0.0021739 k( 87) = ( 0.0000000 0.8423924 0.2125616), wk = 0.0021739 k( 88) = ( 0.0000000 0.8423924 0.2289125), wk = 0.0021739 k( 89) = ( 0.0000000 0.8423924 0.2452634), wk = 0.0021739 k( 90) = ( 0.0000000 0.8423924 0.2616143), wk = 0.0021739 k( 91) = ( 0.0000000 0.8423924 0.2779652), wk = 0.0021739 k( 92) = ( 0.0000000 0.8423924 0.2943161), wk = 0.0021739 k( 93) = ( 0.0000000 0.8423924 0.3106670), wk = 0.0021739 k( 94) = ( 0.0000000 0.8423924 0.3270179), wk = 0.0021739 k( 95) = ( 0.0000000 0.8423924 0.3433688), wk = 0.0021739 k( 96) = ( 0.0000000 0.8423924 0.3597197), wk = 0.0021739 k( 97) = ( 0.0000000 0.8423924 0.3760706), wk = 0.0021739 k( 98) = ( 0.0000000 0.8423924 0.3924215), wk = 0.0021739 k( 99) = ( 0.0000000 0.8423924 0.4087724), wk = 0.0021739 k( 100) = ( 0.0000000 0.8423924 0.4251233), wk = 0.0021739 k( 101) = ( 0.0000000 0.8423924 0.4414742), wk = 0.0021739 k( 102) = ( 0.0000000 0.8423924 0.4578250), wk = 0.0021739 k( 103) = ( 0.0000000 0.8423924 0.4741759), wk = 0.0021739 k( 104) = ( 0.0000000 0.8423924 0.4905268), wk = 0.0021739 k( 105) = ( 0.0000000 0.8423924 0.5068777), wk = 0.0021739 k( 106) = ( 0.0000000 0.8423924 0.5232286), wk = 0.0021739 k( 107) = ( 0.0000000 0.8423924 0.5395795), wk = 0.0021739 k( 108) = ( 0.0000000 0.8423924 0.5559304), wk = 0.0021739 k( 109) = ( 0.0000000 0.8423924 0.5722813), wk = 0.0021739 k( 110) = ( 0.0000000 0.8423924 0.5886322), wk = 0.0021739 k( 111) = ( 0.0000000 0.8423924 0.6049831), wk = 0.0021739 k( 112) = ( 0.0000000 0.8423924 0.6213340), wk = 0.0021739 k( 113) = ( 0.0000000 0.8423924 0.6376849), wk = 0.0021739 k( 114) = ( 0.0000000 0.8423924 0.6376849), wk = 0.0021739 k( 115) = ( 0.0162964 0.8423924 0.6376849), wk = 0.0021739 k( 116) = ( 0.0325928 0.8423924 0.6376849), wk = 0.0021739 k( 117) = ( 0.0488893 0.8423924 0.6376849), wk = 0.0021739 k( 118) = ( 0.0651857 0.8423924 0.6376849), wk = 0.0021739 k( 119) = ( 0.0814821 0.8423924 0.6376849), wk = 0.0021739 k( 120) = ( 0.0977785 0.8423924 0.6376849), wk = 0.0021739 k( 121) = ( 0.1140750 0.8423924 0.6376849), wk = 0.0021739 k( 122) = ( 0.1303714 0.8423924 0.6376849), wk = 0.0021739 k( 123) = ( 0.1466678 0.8423924 0.6376849), wk = 0.0021739 k( 124) = ( 0.1629642 0.8423924 0.6376849), wk = 0.0021739 k( 125) = ( 0.1792606 0.8423924 0.6376849), wk = 0.0021739 k( 126) = ( 0.1955571 0.8423924 0.6376849), wk = 0.0021739 k( 127) = ( 0.2118535 0.8423924 0.6376849), wk = 0.0021739 k( 128) = ( 0.2281499 0.8423924 0.6376849), wk = 0.0021739 k( 129) = ( 0.2444463 0.8423924 0.6376849), wk = 0.0021739 k( 130) = ( 0.2607428 0.8423924 0.6376849), wk = 0.0021739 k( 131) = ( 0.2770392 0.8423924 0.6376849), wk = 0.0021739 k( 132) = ( 0.2770392 0.8423924 0.6376849), wk = 0.0021739 k( 133) = ( 0.2719088 0.8267925 0.6376849), wk = 0.0021739 k( 134) = ( 0.2667785 0.8111927 0.6376849), wk = 0.0021739 k( 135) = ( 0.2616481 0.7955928 0.6376849), wk = 0.0021739 k( 136) = ( 0.2565178 0.7799930 0.6376849), wk = 0.0021739 k( 137) = ( 0.2513874 0.7643931 0.6376849), wk = 0.0021739 k( 138) = ( 0.2462571 0.7487932 0.6376849), wk = 0.0021739 k( 139) = ( 0.2411267 0.7331934 0.6376849), wk = 0.0021739 k( 140) = ( 0.2359963 0.7175935 0.6376849), wk = 0.0021739 k( 141) = ( 0.2308660 0.7019936 0.6376849), wk = 0.0021739 k( 142) = ( 0.2257356 0.6863938 0.6376849), wk = 0.0021739 k( 143) = ( 0.2206053 0.6707939 0.6376849), wk = 0.0021739 k( 144) = ( 0.2154749 0.6551941 0.6376849), wk = 0.0021739 k( 145) = ( 0.2103446 0.6395942 0.6376849), wk = 0.0021739 k( 146) = ( 0.2052142 0.6239944 0.6376849), wk = 0.0021739 k( 147) = ( 0.2000839 0.6083945 0.6376849), wk = 0.0021739 k( 148) = ( 0.1949535 0.5927947 0.6376849), wk = 0.0021739 k( 149) = ( 0.1898231 0.5771948 0.6376849), wk = 0.0021739 k( 150) = ( 0.1846928 0.5615949 0.6376849), wk = 0.0021739 k( 151) = ( 0.1795624 0.5459951 0.6376849), wk = 0.0021739 k( 152) = ( 0.1744321 0.5303952 0.6376849), wk = 0.0021739 k( 153) = ( 0.1693017 0.5147953 0.6376849), wk = 0.0021739 k( 154) = ( 0.1641714 0.4991955 0.6376849), wk = 0.0021739 k( 155) = ( 0.1590410 0.4835956 0.6376849), wk = 0.0021739 k( 156) = ( 0.1539107 0.4679958 0.6376849), wk = 0.0021739 k( 157) = ( 0.1487803 0.4523959 0.6376849), wk = 0.0021739 k( 158) = ( 0.1436499 0.4367961 0.6376849), wk = 0.0021739 k( 159) = ( 0.1385196 0.4211962 0.6376849), wk = 0.0021739 k( 160) = ( 0.1333892 0.4055964 0.6376849), wk = 0.0021739 k( 161) = ( 0.1282589 0.3899965 0.6376849), wk = 0.0021739 k( 162) = ( 0.1231285 0.3743966 0.6376849), wk = 0.0021739 k( 163) = ( 0.1179982 0.3587968 0.6376849), wk = 0.0021739 k( 164) = ( 0.1128678 0.3431969 0.6376849), wk = 0.0021739 k( 165) = ( 0.1077375 0.3275970 0.6376849), wk = 0.0021739 k( 166) = ( 0.1026071 0.3119972 0.6376849), wk = 0.0021739 k( 167) = ( 0.0974768 0.2963973 0.6376849), wk = 0.0021739 k( 168) = ( 0.0923464 0.2807975 0.6376849), wk = 0.0021739 k( 169) = ( 0.0872160 0.2651976 0.6376849), wk = 0.0021739 k( 170) = ( 0.0820857 0.2495977 0.6376849), wk = 0.0021739 k( 171) = ( 0.0769553 0.2339979 0.6376849), wk = 0.0021739 k( 172) = ( 0.0718250 0.2183980 0.6376849), wk = 0.0021739 k( 173) = ( 0.0666946 0.2027982 0.6376849), wk = 0.0021739 k( 174) = ( 0.0615643 0.1871983 0.6376849), wk = 0.0021739 k( 175) = ( 0.0564339 0.1715985 0.6376849), wk = 0.0021739 k( 176) = ( 0.0513036 0.1559986 0.6376849), wk = 0.0021739 k( 177) = ( 0.0461732 0.1403987 0.6376849), wk = 0.0021739 k( 178) = ( 0.0410428 0.1247989 0.6376849), wk = 0.0021739 k( 179) = ( 0.0359125 0.1091990 0.6376849), wk = 0.0021739 k( 180) = ( 0.0307821 0.0935992 0.6376849), wk = 0.0021739 k( 181) = ( 0.0256518 0.0779993 0.6376849), wk = 0.0021739 k( 182) = ( 0.0205214 0.0623994 0.6376849), wk = 0.0021739 k( 183) = ( 0.0153911 0.0467996 0.6376849), wk = 0.0021739 k( 184) = ( 0.0102607 0.0311997 0.6376849), wk = 0.0021739 k( 185) = ( 0.0051304 0.0155999 0.6376849), wk = 0.0021739 k( 186) = ( 0.0000000 0.0000000 0.6376849), wk = 0.0021739 k( 187) = ( 0.0000000 0.0000000 0.6376849), wk = 0.0021739 k( 188) = ( 0.0000000 0.0000000 0.6213340), wk = 0.0021739 k( 189) = ( 0.0000000 0.0000000 0.6049831), wk = 0.0021739 k( 190) = ( 0.0000000 0.0000000 0.5886322), wk = 0.0021739 k( 191) = ( 0.0000000 0.0000000 0.5722813), wk = 0.0021739 k( 192) = ( 0.0000000 0.0000000 0.5559304), wk = 0.0021739 k( 193) = ( 0.0000000 0.0000000 0.5395795), wk = 0.0021739 k( 194) = ( 0.0000000 0.0000000 0.5232286), wk = 0.0021739 k( 195) = ( 0.0000000 0.0000000 0.5068777), wk = 0.0021739 k( 196) = ( 0.0000000 0.0000000 0.4905268), wk = 0.0021739 k( 197) = ( 0.0000000 0.0000000 0.4741759), wk = 0.0021739 k( 198) = ( 0.0000000 0.0000000 0.4578250), wk = 0.0021739 k( 199) = ( 0.0000000 0.0000000 0.4414742), wk = 0.0021739 k( 200) = ( 0.0000000 0.0000000 0.4251233), wk = 0.0021739 k( 201) = ( 0.0000000 0.0000000 0.4087724), wk = 0.0021739 k( 202) = ( 0.0000000 0.0000000 0.3924215), wk = 0.0021739 k( 203) = ( 0.0000000 0.0000000 0.3760706), wk = 0.0021739 k( 204) = ( 0.0000000 0.0000000 0.3597197), wk = 0.0021739 k( 205) = ( 0.0000000 0.0000000 0.3433688), wk = 0.0021739 k( 206) = ( 0.0000000 0.0000000 0.3270179), wk = 0.0021739 k( 207) = ( 0.0000000 0.0000000 0.3106670), wk = 0.0021739 k( 208) = ( 0.0000000 0.0000000 0.2943161), wk = 0.0021739 k( 209) = ( 0.0000000 0.0000000 0.2779652), wk = 0.0021739 k( 210) = ( 0.0000000 0.0000000 0.2616143), wk = 0.0021739 k( 211) = ( 0.0000000 0.0000000 0.2452634), wk = 0.0021739 k( 212) = ( 0.0000000 0.0000000 0.2289125), wk = 0.0021739 k( 213) = ( 0.0000000 0.0000000 0.2125616), wk = 0.0021739 k( 214) = ( 0.0000000 0.0000000 0.1962107), wk = 0.0021739 k( 215) = ( 0.0000000 0.0000000 0.1798598), wk = 0.0021739 k( 216) = ( 0.0000000 0.0000000 0.1635089), wk = 0.0021739 k( 217) = ( 0.0000000 0.0000000 0.1471581), wk = 0.0021739 k( 218) = ( 0.0000000 0.0000000 0.1308072), wk = 0.0021739 k( 219) = ( 0.0000000 0.0000000 0.1144563), wk = 0.0021739 k( 220) = ( 0.0000000 0.0000000 0.0981054), wk = 0.0021739 k( 221) = ( 0.0000000 0.0000000 0.0817545), wk = 0.0021739 k( 222) = ( 0.0000000 0.0000000 0.0654036), wk = 0.0021739 k( 223) = ( 0.0000000 0.0000000 0.0490527), wk = 0.0021739 k( 224) = ( 0.0000000 0.0000000 0.0327018), wk = 0.0021739 k( 225) = ( 0.0000000 0.0000000 0.0163509), wk = 0.0021739 k( 226) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 227) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 228) = ( -0.0156250 0.0051386 0.0000000), wk = 0.0021739 k( 229) = ( -0.0312500 0.0102772 0.0000000), wk = 0.0021739 k( 230) = ( -0.0468750 0.0154159 0.0000000), wk = 0.0021739 k( 231) = ( -0.0625000 0.0205545 0.0000000), wk = 0.0021739 k( 232) = ( -0.0781250 0.0256931 0.0000000), wk = 0.0021739 k( 233) = ( -0.0937500 0.0308317 0.0000000), wk = 0.0021739 k( 234) = ( -0.1093750 0.0359704 0.0000000), wk = 0.0021739 k( 235) = ( -0.1250000 0.0411090 0.0000000), wk = 0.0021739 k( 236) = ( -0.1406250 0.0462476 0.0000000), wk = 0.0021739 k( 237) = ( -0.1562500 0.0513862 0.0000000), wk = 0.0021739 k( 238) = ( -0.1718750 0.0565249 0.0000000), wk = 0.0021739 k( 239) = ( -0.1875000 0.0616635 0.0000000), wk = 0.0021739 k( 240) = ( -0.2031250 0.0668021 0.0000000), wk = 0.0021739 k( 241) = ( -0.2187500 0.0719407 0.0000000), wk = 0.0021739 k( 242) = ( -0.2343750 0.0770793 0.0000000), wk = 0.0021739 k( 243) = ( -0.2500000 0.0822180 0.0000000), wk = 0.0021739 k( 244) = ( -0.2656250 0.0873566 0.0000000), wk = 0.0021739 k( 245) = ( -0.2812500 0.0924952 0.0000000), wk = 0.0021739 k( 246) = ( -0.2968750 0.0976338 0.0000000), wk = 0.0021739 k( 247) = ( -0.3125000 0.1027725 0.0000000), wk = 0.0021739 k( 248) = ( -0.3281250 0.1079111 0.0000000), wk = 0.0021739 k( 249) = ( -0.3437500 0.1130497 0.0000000), wk = 0.0021739 k( 250) = ( -0.3593750 0.1181883 0.0000000), wk = 0.0021739 k( 251) = ( -0.3750000 0.1233270 0.0000000), wk = 0.0021739 k( 252) = ( -0.3906250 0.1284656 0.0000000), wk = 0.0021739 k( 253) = ( -0.4062500 0.1336042 0.0000000), wk = 0.0021739 k( 254) = ( -0.4218750 0.1387428 0.0000000), wk = 0.0021739 k( 255) = ( -0.4375000 0.1438815 0.0000000), wk = 0.0021739 k( 256) = ( -0.4531250 0.1490201 0.0000000), wk = 0.0021739 k( 257) = ( -0.4687500 0.1541587 0.0000000), wk = 0.0021739 k( 258) = ( -0.4843750 0.1592973 0.0000000), wk = 0.0021739 k( 259) = ( -0.5000000 0.1644359 0.0000000), wk = 0.0021739 k( 260) = ( -0.5000000 0.1644359 0.0000000), wk = 0.0021739 k( 261) = ( -0.4948149 0.1802024 -0.0000000), wk = 0.0021739 k( 262) = ( -0.4896297 0.1959688 -0.0000000), wk = 0.0021739 k( 263) = ( -0.4844446 0.2117352 -0.0000000), wk = 0.0021739 k( 264) = ( -0.4792595 0.2275017 -0.0000000), wk = 0.0021739 k( 265) = ( -0.4740743 0.2432681 -0.0000000), wk = 0.0021739 k( 266) = ( -0.4688892 0.2590345 -0.0000000), wk = 0.0021739 k( 267) = ( -0.4637040 0.2748010 -0.0000000), wk = 0.0021739 k( 268) = ( -0.4585189 0.2905674 -0.0000000), wk = 0.0021739 k( 269) = ( -0.4533338 0.3063338 -0.0000000), wk = 0.0021739 k( 270) = ( -0.4481486 0.3221002 -0.0000000), wk = 0.0021739 k( 271) = ( -0.4429635 0.3378667 -0.0000000), wk = 0.0021739 k( 272) = ( -0.4377784 0.3536331 -0.0000000), wk = 0.0021739 k( 273) = ( -0.4325932 0.3693995 -0.0000000), wk = 0.0021739 k( 274) = ( -0.4274081 0.3851659 -0.0000000), wk = 0.0021739 k( 275) = ( -0.4222230 0.4009324 -0.0000000), wk = 0.0021739 k( 276) = ( -0.4170378 0.4166988 -0.0000000), wk = 0.0021739 k( 277) = ( -0.4118527 0.4324652 -0.0000000), wk = 0.0021739 k( 278) = ( -0.4066676 0.4482317 -0.0000000), wk = 0.0021739 k( 279) = ( -0.4014824 0.4639981 -0.0000000), wk = 0.0021739 k( 280) = ( -0.3962973 0.4797645 -0.0000000), wk = 0.0021739 k( 281) = ( -0.3911122 0.4955309 -0.0000000), wk = 0.0021739 k( 282) = ( -0.3859270 0.5112974 -0.0000000), wk = 0.0021739 k( 283) = ( -0.3807419 0.5270638 -0.0000000), wk = 0.0021739 k( 284) = ( -0.3755567 0.5428302 -0.0000000), wk = 0.0021739 k( 285) = ( -0.3703716 0.5585967 -0.0000000), wk = 0.0021739 k( 286) = ( -0.3651865 0.5743631 -0.0000000), wk = 0.0021739 k( 287) = ( -0.3600013 0.5901295 -0.0000000), wk = 0.0021739 k( 288) = ( -0.3548162 0.6058960 -0.0000000), wk = 0.0021739 k( 289) = ( -0.3496311 0.6216624 -0.0000000), wk = 0.0021739 k( 290) = ( -0.3444459 0.6374288 -0.0000000), wk = 0.0021739 k( 291) = ( -0.3392608 0.6531953 -0.0000000), wk = 0.0021739 k( 292) = ( -0.3340757 0.6689617 -0.0000000), wk = 0.0021739 k( 293) = ( -0.3288905 0.6847281 -0.0000000), wk = 0.0021739 k( 294) = ( -0.3237054 0.7004945 -0.0000000), wk = 0.0021739 k( 295) = ( -0.3185203 0.7162610 -0.0000000), wk = 0.0021739 k( 296) = ( -0.3133351 0.7320274 -0.0000000), wk = 0.0021739 k( 297) = ( -0.3081500 0.7477938 -0.0000000), wk = 0.0021739 k( 298) = ( -0.3029649 0.7635602 -0.0000000), wk = 0.0021739 k( 299) = ( -0.2977797 0.7793267 -0.0000000), wk = 0.0021739 k( 300) = ( -0.2925946 0.7950931 -0.0000000), wk = 0.0021739 k( 301) = ( -0.2874095 0.8108595 -0.0000000), wk = 0.0021739 k( 302) = ( -0.2822243 0.8266260 -0.0000000), wk = 0.0021739 k( 303) = ( -0.2770392 0.8423924 -0.0000000), wk = 0.0021739 k( 304) = ( -0.2770392 0.8423924 -0.0000000), wk = 0.0021739 k( 305) = ( -0.2770392 0.8423924 0.0163509), wk = 0.0021739 k( 306) = ( -0.2770392 0.8423924 0.0327018), wk = 0.0021739 k( 307) = ( -0.2770392 0.8423924 0.0490527), wk = 0.0021739 k( 308) = ( -0.2770392 0.8423924 0.0654036), wk = 0.0021739 k( 309) = ( -0.2770392 0.8423924 0.0817545), wk = 0.0021739 k( 310) = ( -0.2770392 0.8423924 0.0981054), wk = 0.0021739 k( 311) = ( -0.2770392 0.8423924 0.1144563), wk = 0.0021739 k( 312) = ( -0.2770392 0.8423924 0.1308072), wk = 0.0021739 k( 313) = ( -0.2770392 0.8423924 0.1471581), wk = 0.0021739 k( 314) = ( -0.2770392 0.8423924 0.1635089), wk = 0.0021739 k( 315) = ( -0.2770392 0.8423924 0.1798598), wk = 0.0021739 k( 316) = ( -0.2770392 0.8423924 0.1962107), wk = 0.0021739 k( 317) = ( -0.2770392 0.8423924 0.2125616), wk = 0.0021739 k( 318) = ( -0.2770392 0.8423924 0.2289125), wk = 0.0021739 k( 319) = ( -0.2770392 0.8423924 0.2452634), wk = 0.0021739 k( 320) = ( -0.2770392 0.8423924 0.2616143), wk = 0.0021739 k( 321) = ( -0.2770392 0.8423924 0.2779652), wk = 0.0021739 k( 322) = ( -0.2770392 0.8423924 0.2943161), wk = 0.0021739 k( 323) = ( -0.2770392 0.8423924 0.3106670), wk = 0.0021739 k( 324) = ( -0.2770392 0.8423924 0.3270179), wk = 0.0021739 k( 325) = ( -0.2770392 0.8423924 0.3433688), wk = 0.0021739 k( 326) = ( -0.2770392 0.8423924 0.3597197), wk = 0.0021739 k( 327) = ( -0.2770392 0.8423924 0.3760706), wk = 0.0021739 k( 328) = ( -0.2770392 0.8423924 0.3924215), wk = 0.0021739 k( 329) = ( -0.2770392 0.8423924 0.4087724), wk = 0.0021739 k( 330) = ( -0.2770392 0.8423924 0.4251233), wk = 0.0021739 k( 331) = ( -0.2770392 0.8423924 0.4414742), wk = 0.0021739 k( 332) = ( -0.2770392 0.8423924 0.4578250), wk = 0.0021739 k( 333) = ( -0.2770392 0.8423924 0.4741759), wk = 0.0021739 k( 334) = ( -0.2770392 0.8423924 0.4905268), wk = 0.0021739 k( 335) = ( -0.2770392 0.8423924 0.5068777), wk = 0.0021739 k( 336) = ( -0.2770392 0.8423924 0.5232286), wk = 0.0021739 k( 337) = ( -0.2770392 0.8423924 0.5395795), wk = 0.0021739 k( 338) = ( -0.2770392 0.8423924 0.5559304), wk = 0.0021739 k( 339) = ( -0.2770392 0.8423924 0.5722813), wk = 0.0021739 k( 340) = ( -0.2770392 0.8423924 0.5886322), wk = 0.0021739 k( 341) = ( -0.2770392 0.8423924 0.6049831), wk = 0.0021739 k( 342) = ( -0.2770392 0.8423924 0.6213340), wk = 0.0021739 k( 343) = ( -0.2770392 0.8423924 0.6376849), wk = 0.0021739 k( 344) = ( -0.2770392 0.8423924 0.6376849), wk = 0.0021739 k( 345) = ( -0.2822243 0.8266260 0.6376849), wk = 0.0021739 k( 346) = ( -0.2874095 0.8108595 0.6376849), wk = 0.0021739 k( 347) = ( -0.2925946 0.7950931 0.6376849), wk = 0.0021739 k( 348) = ( -0.2977797 0.7793267 0.6376849), wk = 0.0021739 k( 349) = ( -0.3029649 0.7635602 0.6376849), wk = 0.0021739 k( 350) = ( -0.3081500 0.7477938 0.6376849), wk = 0.0021739 k( 351) = ( -0.3133351 0.7320274 0.6376849), wk = 0.0021739 k( 352) = ( -0.3185203 0.7162610 0.6376849), wk = 0.0021739 k( 353) = ( -0.3237054 0.7004945 0.6376849), wk = 0.0021739 k( 354) = ( -0.3288905 0.6847281 0.6376849), wk = 0.0021739 k( 355) = ( -0.3340757 0.6689617 0.6376849), wk = 0.0021739 k( 356) = ( -0.3392608 0.6531953 0.6376849), wk = 0.0021739 k( 357) = ( -0.3444459 0.6374288 0.6376849), wk = 0.0021739 k( 358) = ( -0.3496311 0.6216624 0.6376849), wk = 0.0021739 k( 359) = ( -0.3548162 0.6058960 0.6376849), wk = 0.0021739 k( 360) = ( -0.3600013 0.5901295 0.6376849), wk = 0.0021739 k( 361) = ( -0.3651865 0.5743631 0.6376849), wk = 0.0021739 k( 362) = ( -0.3703716 0.5585967 0.6376849), wk = 0.0021739 k( 363) = ( -0.3755567 0.5428302 0.6376849), wk = 0.0021739 k( 364) = ( -0.3807419 0.5270638 0.6376849), wk = 0.0021739 k( 365) = ( -0.3859270 0.5112974 0.6376849), wk = 0.0021739 k( 366) = ( -0.3911122 0.4955309 0.6376849), wk = 0.0021739 k( 367) = ( -0.3962973 0.4797645 0.6376849), wk = 0.0021739 k( 368) = ( -0.4014824 0.4639981 0.6376849), wk = 0.0021739 k( 369) = ( -0.4066676 0.4482317 0.6376849), wk = 0.0021739 k( 370) = ( -0.4118527 0.4324652 0.6376849), wk = 0.0021739 k( 371) = ( -0.4170378 0.4166988 0.6376849), wk = 0.0021739 k( 372) = ( -0.4222230 0.4009324 0.6376849), wk = 0.0021739 k( 373) = ( -0.4274081 0.3851659 0.6376849), wk = 0.0021739 k( 374) = ( -0.4325932 0.3693995 0.6376849), wk = 0.0021739 k( 375) = ( -0.4377784 0.3536331 0.6376849), wk = 0.0021739 k( 376) = ( -0.4429635 0.3378667 0.6376849), wk = 0.0021739 k( 377) = ( -0.4481486 0.3221002 0.6376849), wk = 0.0021739 k( 378) = ( -0.4533338 0.3063338 0.6376849), wk = 0.0021739 k( 379) = ( -0.4585189 0.2905674 0.6376849), wk = 0.0021739 k( 380) = ( -0.4637040 0.2748010 0.6376849), wk = 0.0021739 k( 381) = ( -0.4688892 0.2590345 0.6376849), wk = 0.0021739 k( 382) = ( -0.4740743 0.2432681 0.6376849), wk = 0.0021739 k( 383) = ( -0.4792595 0.2275017 0.6376849), wk = 0.0021739 k( 384) = ( -0.4844446 0.2117352 0.6376849), wk = 0.0021739 k( 385) = ( -0.4896297 0.1959688 0.6376849), wk = 0.0021739 k( 386) = ( -0.4948149 0.1802024 0.6376849), wk = 0.0021739 k( 387) = ( -0.5000000 0.1644359 0.6376849), wk = 0.0021739 k( 388) = ( -0.5000000 0.1644359 0.6376849), wk = 0.0021739 k( 389) = ( -0.5000000 0.1644359 0.6213340), wk = 0.0021739 k( 390) = ( -0.5000000 0.1644359 0.6049831), wk = 0.0021739 k( 391) = ( -0.5000000 0.1644359 0.5886322), wk = 0.0021739 k( 392) = ( -0.5000000 0.1644359 0.5722813), wk = 0.0021739 k( 393) = ( -0.5000000 0.1644359 0.5559304), wk = 0.0021739 k( 394) = ( -0.5000000 0.1644359 0.5395795), wk = 0.0021739 k( 395) = ( -0.5000000 0.1644359 0.5232286), wk = 0.0021739 k( 396) = ( -0.5000000 0.1644359 0.5068777), wk = 0.0021739 k( 397) = ( -0.5000000 0.1644359 0.4905268), wk = 0.0021739 k( 398) = ( -0.5000000 0.1644359 0.4741759), wk = 0.0021739 k( 399) = ( -0.5000000 0.1644359 0.4578250), wk = 0.0021739 k( 400) = ( -0.5000000 0.1644359 0.4414742), wk = 0.0021739 k( 401) = ( -0.5000000 0.1644359 0.4251233), wk = 0.0021739 k( 402) = ( -0.5000000 0.1644359 0.4087724), wk = 0.0021739 k( 403) = ( -0.5000000 0.1644359 0.3924215), wk = 0.0021739 k( 404) = ( -0.5000000 0.1644359 0.3760706), wk = 0.0021739 k( 405) = ( -0.5000000 0.1644359 0.3597197), wk = 0.0021739 k( 406) = ( -0.5000000 0.1644359 0.3433688), wk = 0.0021739 k( 407) = ( -0.5000000 0.1644359 0.3270179), wk = 0.0021739 k( 408) = ( -0.5000000 0.1644359 0.3106670), wk = 0.0021739 k( 409) = ( -0.5000000 0.1644359 0.2943161), wk = 0.0021739 k( 410) = ( -0.5000000 0.1644359 0.2779652), wk = 0.0021739 k( 411) = ( -0.5000000 0.1644359 0.2616143), wk = 0.0021739 k( 412) = ( -0.5000000 0.1644359 0.2452634), wk = 0.0021739 k( 413) = ( -0.5000000 0.1644359 0.2289125), wk = 0.0021739 k( 414) = ( -0.5000000 0.1644359 0.2125616), wk = 0.0021739 k( 415) = ( -0.5000000 0.1644359 0.1962107), wk = 0.0021739 k( 416) = ( -0.5000000 0.1644359 0.1798598), wk = 0.0021739 k( 417) = ( -0.5000000 0.1644359 0.1635089), wk = 0.0021739 k( 418) = ( -0.5000000 0.1644359 0.1471581), wk = 0.0021739 k( 419) = ( -0.5000000 0.1644359 0.1308072), wk = 0.0021739 k( 420) = ( -0.5000000 0.1644359 0.1144563), wk = 0.0021739 k( 421) = ( -0.5000000 0.1644359 0.0981054), wk = 0.0021739 k( 422) = ( -0.5000000 0.1644359 0.0817545), wk = 0.0021739 k( 423) = ( -0.5000000 0.1644359 0.0654036), wk = 0.0021739 k( 424) = ( -0.5000000 0.1644359 0.0490527), wk = 0.0021739 k( 425) = ( -0.5000000 0.1644359 0.0327018), wk = 0.0021739 k( 426) = ( -0.5000000 0.1644359 0.0163509), wk = 0.0021739 k( 427) = ( -0.5000000 0.1644359 0.0000000), wk = 0.0021739 k( 428) = ( 0.0000000 0.0000000 0.6376849), wk = 0.0021739 k( 429) = ( -0.0156250 0.0051386 0.6376849), wk = 0.0021739 k( 430) = ( -0.0312500 0.0102772 0.6376849), wk = 0.0021739 k( 431) = ( -0.0468750 0.0154159 0.6376849), wk = 0.0021739 k( 432) = ( -0.0625000 0.0205545 0.6376849), wk = 0.0021739 k( 433) = ( -0.0781250 0.0256931 0.6376849), wk = 0.0021739 k( 434) = ( -0.0937500 0.0308317 0.6376849), wk = 0.0021739 k( 435) = ( -0.1093750 0.0359704 0.6376849), wk = 0.0021739 k( 436) = ( -0.1250000 0.0411090 0.6376849), wk = 0.0021739 k( 437) = ( -0.1406250 0.0462476 0.6376849), wk = 0.0021739 k( 438) = ( -0.1562500 0.0513862 0.6376849), wk = 0.0021739 k( 439) = ( -0.1718750 0.0565249 0.6376849), wk = 0.0021739 k( 440) = ( -0.1875000 0.0616635 0.6376849), wk = 0.0021739 k( 441) = ( -0.2031250 0.0668021 0.6376849), wk = 0.0021739 k( 442) = ( -0.2187500 0.0719407 0.6376849), wk = 0.0021739 k( 443) = ( -0.2343750 0.0770793 0.6376849), wk = 0.0021739 k( 444) = ( -0.2500000 0.0822180 0.6376849), wk = 0.0021739 k( 445) = ( -0.2656250 0.0873566 0.6376849), wk = 0.0021739 k( 446) = ( -0.2812500 0.0924952 0.6376849), wk = 0.0021739 k( 447) = ( -0.2968750 0.0976338 0.6376849), wk = 0.0021739 k( 448) = ( -0.3125000 0.1027725 0.6376849), wk = 0.0021739 k( 449) = ( -0.3281250 0.1079111 0.6376849), wk = 0.0021739 k( 450) = ( -0.3437500 0.1130497 0.6376849), wk = 0.0021739 k( 451) = ( -0.3593750 0.1181883 0.6376849), wk = 0.0021739 k( 452) = ( -0.3750000 0.1233270 0.6376849), wk = 0.0021739 k( 453) = ( -0.3906250 0.1284656 0.6376849), wk = 0.0021739 k( 454) = ( -0.4062500 0.1336042 0.6376849), wk = 0.0021739 k( 455) = ( -0.4218750 0.1387428 0.6376849), wk = 0.0021739 k( 456) = ( -0.4375000 0.1438815 0.6376849), wk = 0.0021739 k( 457) = ( -0.4531250 0.1490201 0.6376849), wk = 0.0021739 k( 458) = ( -0.4687500 0.1541587 0.6376849), wk = 0.0021739 k( 459) = ( -0.4843750 0.1592973 0.6376849), wk = 0.0021739 k( 460) = ( -0.5000000 0.1644359 0.6376849), wk = 0.0021739 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 2) = ( 0.0051304 0.0051304 -0.0000000), wk = 0.0021739 k( 3) = ( 0.0102607 0.0102607 -0.0000000), wk = 0.0021739 k( 4) = ( 0.0153911 0.0153911 0.0000000), wk = 0.0021739 k( 5) = ( 0.0205214 0.0205214 -0.0000000), wk = 0.0021739 k( 6) = ( 0.0256518 0.0256518 0.0000000), wk = 0.0021739 k( 7) = ( 0.0307821 0.0307821 0.0000000), wk = 0.0021739 k( 8) = ( 0.0359125 0.0359125 0.0000000), wk = 0.0021739 k( 9) = ( 0.0410428 0.0410428 -0.0000000), wk = 0.0021739 k( 10) = ( 0.0461732 0.0461732 0.0000000), wk = 0.0021739 k( 11) = ( 0.0513036 0.0513035 0.0000000), wk = 0.0021739 k( 12) = ( 0.0564339 0.0564339 0.0000000), wk = 0.0021739 k( 13) = ( 0.0615643 0.0615643 0.0000000), wk = 0.0021739 k( 14) = ( 0.0666946 0.0666946 0.0000000), wk = 0.0021739 k( 15) = ( 0.0718250 0.0718250 0.0000000), wk = 0.0021739 k( 16) = ( 0.0769553 0.0769553 0.0000000), wk = 0.0021739 k( 17) = ( 0.0820857 0.0820857 -0.0000000), wk = 0.0021739 k( 18) = ( 0.0872160 0.0872160 -0.0000000), wk = 0.0021739 k( 19) = ( 0.0923464 0.0923464 -0.0000000), wk = 0.0021739 k( 20) = ( 0.0974768 0.0974767 0.0000000), wk = 0.0021739 k( 21) = ( 0.1026071 0.1026071 0.0000000), wk = 0.0021739 k( 22) = ( 0.1077375 0.1077375 0.0000000), wk = 0.0021739 k( 23) = ( 0.1128678 0.1128678 0.0000000), wk = 0.0021739 k( 24) = ( 0.1179982 0.1179982 0.0000000), wk = 0.0021739 k( 25) = ( 0.1231285 0.1231285 0.0000000), wk = 0.0021739 k( 26) = ( 0.1282589 0.1282589 0.0000000), wk = 0.0021739 k( 27) = ( 0.1333892 0.1333892 0.0000000), wk = 0.0021739 k( 28) = ( 0.1385196 0.1385196 0.0000000), wk = 0.0021739 k( 29) = ( 0.1436499 0.1436499 0.0000000), wk = 0.0021739 k( 30) = ( 0.1487803 0.1487803 0.0000000), wk = 0.0021739 k( 31) = ( 0.1539107 0.1539107 0.0000000), wk = 0.0021739 k( 32) = ( 0.1590410 0.1590410 0.0000000), wk = 0.0021739 k( 33) = ( 0.1641714 0.1641714 0.0000000), wk = 0.0021739 k( 34) = ( 0.1693017 0.1693017 0.0000000), wk = 0.0021739 k( 35) = ( 0.1744321 0.1744321 -0.0000000), wk = 0.0021739 k( 36) = ( 0.1795624 0.1795624 0.0000000), wk = 0.0021739 k( 37) = ( 0.1846928 0.1846928 0.0000000), wk = 0.0021739 k( 38) = ( 0.1898231 0.1898231 0.0000000), wk = 0.0021739 k( 39) = ( 0.1949535 0.1949535 0.0000000), wk = 0.0021739 k( 40) = ( 0.2000839 0.2000839 0.0000000), wk = 0.0021739 k( 41) = ( 0.2052142 0.2052142 0.0000000), wk = 0.0021739 k( 42) = ( 0.2103446 0.2103446 0.0000000), wk = 0.0021739 k( 43) = ( 0.2154749 0.2154749 0.0000000), wk = 0.0021739 k( 44) = ( 0.2206053 0.2206053 0.0000000), wk = 0.0021739 k( 45) = ( 0.2257356 0.2257356 -0.0000000), wk = 0.0021739 k( 46) = ( 0.2308660 0.2308660 0.0000000), wk = 0.0021739 k( 47) = ( 0.2359963 0.2359963 0.0000000), wk = 0.0021739 k( 48) = ( 0.2411267 0.2411267 0.0000000), wk = 0.0021739 k( 49) = ( 0.2462571 0.2462571 0.0000000), wk = 0.0021739 k( 50) = ( 0.2513874 0.2513874 0.0000000), wk = 0.0021739 k( 51) = ( 0.2565178 0.2565178 0.0000000), wk = 0.0021739 k( 52) = ( 0.2616481 0.2616481 0.0000000), wk = 0.0021739 k( 53) = ( 0.2667785 0.2667785 0.0000000), wk = 0.0021739 k( 54) = ( 0.2719088 0.2719088 0.0000000), wk = 0.0021739 k( 55) = ( 0.2770392 0.2770392 0.0000000), wk = 0.0021739 k( 56) = ( 0.2770392 0.2770392 0.0000000), wk = 0.0021739 k( 57) = ( 0.2607428 0.2901545 0.0000000), wk = 0.0021739 k( 58) = ( 0.2444463 0.3032699 0.0000000), wk = 0.0021739 k( 59) = ( 0.2281499 0.3163852 0.0000000), wk = 0.0021739 k( 60) = ( 0.2118535 0.3295005 -0.0000000), wk = 0.0021739 k( 61) = ( 0.1955571 0.3426159 0.0000000), wk = 0.0021739 k( 62) = ( 0.1792606 0.3557312 0.0000000), wk = 0.0021739 k( 63) = ( 0.1629642 0.3688466 0.0000000), wk = 0.0021739 k( 64) = ( 0.1466678 0.3819619 0.0000000), wk = 0.0021739 k( 65) = ( 0.1303714 0.3950773 0.0000000), wk = 0.0021739 k( 66) = ( 0.1140750 0.4081926 -0.0000000), wk = 0.0021739 k( 67) = ( 0.0977785 0.4213079 0.0000000), wk = 0.0021739 k( 68) = ( 0.0814821 0.4344233 0.0000000), wk = 0.0021739 k( 69) = ( 0.0651857 0.4475386 0.0000000), wk = 0.0021739 k( 70) = ( 0.0488893 0.4606540 -0.0000000), wk = 0.0021739 k( 71) = ( 0.0325928 0.4737693 0.0000000), wk = 0.0021739 k( 72) = ( 0.0162964 0.4868847 0.0000000), wk = 0.0021739 k( 73) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021739 k( 74) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0021739 k( 75) = ( 0.0000000 0.5000000 0.0128205), wk = 0.0021739 k( 76) = ( 0.0000000 0.5000000 0.0256410), wk = 0.0021739 k( 77) = ( 0.0000000 0.5000000 0.0384615), wk = 0.0021739 k( 78) = ( 0.0000000 0.5000000 0.0512821), wk = 0.0021739 k( 79) = ( 0.0000000 0.5000000 0.0641026), wk = 0.0021739 k( 80) = ( 0.0000000 0.5000000 0.0769231), wk = 0.0021739 k( 81) = ( 0.0000000 0.5000000 0.0897436), wk = 0.0021739 k( 82) = ( 0.0000000 0.5000000 0.1025641), wk = 0.0021739 k( 83) = ( 0.0000000 0.5000000 0.1153846), wk = 0.0021739 k( 84) = ( 0.0000000 0.5000000 0.1282051), wk = 0.0021739 k( 85) = ( 0.0000000 0.5000000 0.1410256), wk = 0.0021739 k( 86) = ( 0.0000000 0.5000000 0.1538461), wk = 0.0021739 k( 87) = ( 0.0000000 0.5000000 0.1666667), wk = 0.0021739 k( 88) = ( 0.0000000 0.5000000 0.1794872), wk = 0.0021739 k( 89) = ( 0.0000000 0.5000000 0.1923077), wk = 0.0021739 k( 90) = ( 0.0000000 0.5000000 0.2051282), wk = 0.0021739 k( 91) = ( 0.0000000 0.5000000 0.2179487), wk = 0.0021739 k( 92) = ( 0.0000000 0.5000000 0.2307692), wk = 0.0021739 k( 93) = ( 0.0000000 0.5000000 0.2435897), wk = 0.0021739 k( 94) = ( 0.0000000 0.5000000 0.2564103), wk = 0.0021739 k( 95) = ( 0.0000000 0.5000000 0.2692308), wk = 0.0021739 k( 96) = ( 0.0000000 0.5000000 0.2820513), wk = 0.0021739 k( 97) = ( 0.0000000 0.5000000 0.2948718), wk = 0.0021739 k( 98) = ( 0.0000000 0.5000000 0.3076923), wk = 0.0021739 k( 99) = ( 0.0000000 0.5000000 0.3205128), wk = 0.0021739 k( 100) = ( 0.0000000 0.5000000 0.3333333), wk = 0.0021739 k( 101) = ( 0.0000000 0.5000000 0.3461538), wk = 0.0021739 k( 102) = ( 0.0000000 0.5000000 0.3589744), wk = 0.0021739 k( 103) = ( 0.0000000 0.5000000 0.3717949), wk = 0.0021739 k( 104) = ( 0.0000000 0.5000000 0.3846154), wk = 0.0021739 k( 105) = ( 0.0000000 0.5000000 0.3974359), wk = 0.0021739 k( 106) = ( 0.0000000 0.5000000 0.4102564), wk = 0.0021739 k( 107) = ( 0.0000000 0.5000000 0.4230769), wk = 0.0021739 k( 108) = ( 0.0000000 0.5000000 0.4358974), wk = 0.0021739 k( 109) = ( 0.0000000 0.5000000 0.4487179), wk = 0.0021739 k( 110) = ( 0.0000000 0.5000000 0.4615385), wk = 0.0021739 k( 111) = ( 0.0000000 0.5000000 0.4743590), wk = 0.0021739 k( 112) = ( 0.0000000 0.5000000 0.4871795), wk = 0.0021739 k( 113) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021739 k( 114) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0021739 k( 115) = ( 0.0162964 0.4868847 0.5000000), wk = 0.0021739 k( 116) = ( 0.0325928 0.4737693 0.5000000), wk = 0.0021739 k( 117) = ( 0.0488893 0.4606540 0.5000000), wk = 0.0021739 k( 118) = ( 0.0651857 0.4475386 0.5000000), wk = 0.0021739 k( 119) = ( 0.0814821 0.4344233 0.5000000), wk = 0.0021739 k( 120) = ( 0.0977785 0.4213079 0.5000000), wk = 0.0021739 k( 121) = ( 0.1140750 0.4081926 0.5000000), wk = 0.0021739 k( 122) = ( 0.1303714 0.3950773 0.5000000), wk = 0.0021739 k( 123) = ( 0.1466678 0.3819619 0.5000000), wk = 0.0021739 k( 124) = ( 0.1629642 0.3688466 0.5000000), wk = 0.0021739 k( 125) = ( 0.1792606 0.3557312 0.5000000), wk = 0.0021739 k( 126) = ( 0.1955571 0.3426159 0.5000000), wk = 0.0021739 k( 127) = ( 0.2118535 0.3295005 0.5000000), wk = 0.0021739 k( 128) = ( 0.2281499 0.3163852 0.5000000), wk = 0.0021739 k( 129) = ( 0.2444463 0.3032699 0.5000000), wk = 0.0021739 k( 130) = ( 0.2607428 0.2901545 0.5000000), wk = 0.0021739 k( 131) = ( 0.2770392 0.2770392 0.5000000), wk = 0.0021739 k( 132) = ( 0.2770392 0.2770392 0.5000000), wk = 0.0021739 k( 133) = ( 0.2719088 0.2719088 0.5000000), wk = 0.0021739 k( 134) = ( 0.2667785 0.2667785 0.5000000), wk = 0.0021739 k( 135) = ( 0.2616481 0.2616481 0.5000000), wk = 0.0021739 k( 136) = ( 0.2565178 0.2565178 0.5000000), wk = 0.0021739 k( 137) = ( 0.2513874 0.2513874 0.5000000), wk = 0.0021739 k( 138) = ( 0.2462571 0.2462571 0.5000000), wk = 0.0021739 k( 139) = ( 0.2411267 0.2411267 0.5000000), wk = 0.0021739 k( 140) = ( 0.2359963 0.2359963 0.5000000), wk = 0.0021739 k( 141) = ( 0.2308660 0.2308660 0.5000000), wk = 0.0021739 k( 142) = ( 0.2257356 0.2257356 0.5000000), wk = 0.0021739 k( 143) = ( 0.2206053 0.2206053 0.5000000), wk = 0.0021739 k( 144) = ( 0.2154749 0.2154749 0.5000000), wk = 0.0021739 k( 145) = ( 0.2103446 0.2103446 0.5000000), wk = 0.0021739 k( 146) = ( 0.2052142 0.2052142 0.5000000), wk = 0.0021739 k( 147) = ( 0.2000839 0.2000839 0.5000000), wk = 0.0021739 k( 148) = ( 0.1949535 0.1949535 0.5000000), wk = 0.0021739 k( 149) = ( 0.1898231 0.1898231 0.5000000), wk = 0.0021739 k( 150) = ( 0.1846928 0.1846928 0.5000000), wk = 0.0021739 k( 151) = ( 0.1795624 0.1795624 0.5000000), wk = 0.0021739 k( 152) = ( 0.1744321 0.1744321 0.5000000), wk = 0.0021739 k( 153) = ( 0.1693017 0.1693017 0.5000000), wk = 0.0021739 k( 154) = ( 0.1641714 0.1641714 0.5000000), wk = 0.0021739 k( 155) = ( 0.1590410 0.1590410 0.5000000), wk = 0.0021739 k( 156) = ( 0.1539107 0.1539107 0.5000000), wk = 0.0021739 k( 157) = ( 0.1487803 0.1487803 0.5000000), wk = 0.0021739 k( 158) = ( 0.1436499 0.1436499 0.5000000), wk = 0.0021739 k( 159) = ( 0.1385196 0.1385196 0.5000000), wk = 0.0021739 k( 160) = ( 0.1333892 0.1333892 0.5000000), wk = 0.0021739 k( 161) = ( 0.1282589 0.1282589 0.5000000), wk = 0.0021739 k( 162) = ( 0.1231285 0.1231285 0.5000000), wk = 0.0021739 k( 163) = ( 0.1179982 0.1179982 0.5000000), wk = 0.0021739 k( 164) = ( 0.1128678 0.1128678 0.5000000), wk = 0.0021739 k( 165) = ( 0.1077375 0.1077375 0.5000000), wk = 0.0021739 k( 166) = ( 0.1026071 0.1026071 0.5000000), wk = 0.0021739 k( 167) = ( 0.0974768 0.0974767 0.5000000), wk = 0.0021739 k( 168) = ( 0.0923464 0.0923464 0.5000000), wk = 0.0021739 k( 169) = ( 0.0872160 0.0872160 0.5000000), wk = 0.0021739 k( 170) = ( 0.0820857 0.0820857 0.5000000), wk = 0.0021739 k( 171) = ( 0.0769553 0.0769553 0.5000000), wk = 0.0021739 k( 172) = ( 0.0718250 0.0718250 0.5000000), wk = 0.0021739 k( 173) = ( 0.0666946 0.0666946 0.5000000), wk = 0.0021739 k( 174) = ( 0.0615643 0.0615643 0.5000000), wk = 0.0021739 k( 175) = ( 0.0564339 0.0564339 0.5000000), wk = 0.0021739 k( 176) = ( 0.0513036 0.0513035 0.5000000), wk = 0.0021739 k( 177) = ( 0.0461732 0.0461732 0.5000000), wk = 0.0021739 k( 178) = ( 0.0410428 0.0410428 0.5000000), wk = 0.0021739 k( 179) = ( 0.0359125 0.0359125 0.5000000), wk = 0.0021739 k( 180) = ( 0.0307821 0.0307821 0.5000000), wk = 0.0021739 k( 181) = ( 0.0256518 0.0256518 0.5000000), wk = 0.0021739 k( 182) = ( 0.0205214 0.0205214 0.5000000), wk = 0.0021739 k( 183) = ( 0.0153911 0.0153911 0.5000000), wk = 0.0021739 k( 184) = ( 0.0102607 0.0102607 0.5000000), wk = 0.0021739 k( 185) = ( 0.0051304 0.0051304 0.5000000), wk = 0.0021739 k( 186) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 187) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 188) = ( 0.0000000 0.0000000 0.4871795), wk = 0.0021739 k( 189) = ( 0.0000000 0.0000000 0.4743590), wk = 0.0021739 k( 190) = ( 0.0000000 0.0000000 0.4615385), wk = 0.0021739 k( 191) = ( 0.0000000 0.0000000 0.4487179), wk = 0.0021739 k( 192) = ( 0.0000000 0.0000000 0.4358974), wk = 0.0021739 k( 193) = ( 0.0000000 0.0000000 0.4230769), wk = 0.0021739 k( 194) = ( 0.0000000 0.0000000 0.4102564), wk = 0.0021739 k( 195) = ( 0.0000000 0.0000000 0.3974359), wk = 0.0021739 k( 196) = ( 0.0000000 0.0000000 0.3846154), wk = 0.0021739 k( 197) = ( 0.0000000 0.0000000 0.3717949), wk = 0.0021739 k( 198) = ( 0.0000000 0.0000000 0.3589744), wk = 0.0021739 k( 199) = ( 0.0000000 0.0000000 0.3461538), wk = 0.0021739 k( 200) = ( 0.0000000 0.0000000 0.3333333), wk = 0.0021739 k( 201) = ( 0.0000000 0.0000000 0.3205128), wk = 0.0021739 k( 202) = ( 0.0000000 0.0000000 0.3076923), wk = 0.0021739 k( 203) = ( 0.0000000 0.0000000 0.2948718), wk = 0.0021739 k( 204) = ( 0.0000000 0.0000000 0.2820513), wk = 0.0021739 k( 205) = ( 0.0000000 0.0000000 0.2692308), wk = 0.0021739 k( 206) = ( 0.0000000 0.0000000 0.2564103), wk = 0.0021739 k( 207) = ( 0.0000000 0.0000000 0.2435897), wk = 0.0021739 k( 208) = ( 0.0000000 0.0000000 0.2307692), wk = 0.0021739 k( 209) = ( 0.0000000 0.0000000 0.2179487), wk = 0.0021739 k( 210) = ( 0.0000000 0.0000000 0.2051282), wk = 0.0021739 k( 211) = ( 0.0000000 0.0000000 0.1923077), wk = 0.0021739 k( 212) = ( 0.0000000 0.0000000 0.1794872), wk = 0.0021739 k( 213) = ( 0.0000000 0.0000000 0.1666667), wk = 0.0021739 k( 214) = ( 0.0000000 0.0000000 0.1538461), wk = 0.0021739 k( 215) = ( 0.0000000 0.0000000 0.1410256), wk = 0.0021739 k( 216) = ( 0.0000000 0.0000000 0.1282051), wk = 0.0021739 k( 217) = ( 0.0000000 0.0000000 0.1153846), wk = 0.0021739 k( 218) = ( 0.0000000 0.0000000 0.1025641), wk = 0.0021739 k( 219) = ( 0.0000000 0.0000000 0.0897436), wk = 0.0021739 k( 220) = ( 0.0000000 0.0000000 0.0769231), wk = 0.0021739 k( 221) = ( 0.0000000 0.0000000 0.0641026), wk = 0.0021739 k( 222) = ( 0.0000000 0.0000000 0.0512821), wk = 0.0021739 k( 223) = ( 0.0000000 0.0000000 0.0384615), wk = 0.0021739 k( 224) = ( 0.0000000 0.0000000 0.0256410), wk = 0.0021739 k( 225) = ( 0.0000000 0.0000000 0.0128205), wk = 0.0021739 k( 226) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 227) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0021739 k( 228) = ( -0.0156250 0.0156250 -0.0000000), wk = 0.0021739 k( 229) = ( -0.0312500 0.0312500 -0.0000000), wk = 0.0021739 k( 230) = ( -0.0468750 0.0468750 -0.0000000), wk = 0.0021739 k( 231) = ( -0.0625000 0.0625000 -0.0000000), wk = 0.0021739 k( 232) = ( -0.0781250 0.0781250 0.0000000), wk = 0.0021739 k( 233) = ( -0.0937500 0.0937500 -0.0000000), wk = 0.0021739 k( 234) = ( -0.1093750 0.1093750 -0.0000000), wk = 0.0021739 k( 235) = ( -0.1250000 0.1250000 -0.0000000), wk = 0.0021739 k( 236) = ( -0.1406250 0.1406250 -0.0000000), wk = 0.0021739 k( 237) = ( -0.1562500 0.1562500 0.0000000), wk = 0.0021739 k( 238) = ( -0.1718750 0.1718750 -0.0000000), wk = 0.0021739 k( 239) = ( -0.1875000 0.1875000 -0.0000000), wk = 0.0021739 k( 240) = ( -0.2031250 0.2031250 -0.0000000), wk = 0.0021739 k( 241) = ( -0.2187500 0.2187500 -0.0000000), wk = 0.0021739 k( 242) = ( -0.2343750 0.2343750 -0.0000000), wk = 0.0021739 k( 243) = ( -0.2500000 0.2500000 -0.0000000), wk = 0.0021739 k( 244) = ( -0.2656250 0.2656250 0.0000000), wk = 0.0021739 k( 245) = ( -0.2812500 0.2812500 -0.0000000), wk = 0.0021739 k( 246) = ( -0.2968750 0.2968750 -0.0000000), wk = 0.0021739 k( 247) = ( -0.3125000 0.3125000 0.0000000), wk = 0.0021739 k( 248) = ( -0.3281250 0.3281250 -0.0000000), wk = 0.0021739 k( 249) = ( -0.3437500 0.3437500 -0.0000000), wk = 0.0021739 k( 250) = ( -0.3593750 0.3593750 -0.0000000), wk = 0.0021739 k( 251) = ( -0.3750000 0.3750000 -0.0000000), wk = 0.0021739 k( 252) = ( -0.3906250 0.3906250 -0.0000000), wk = 0.0021739 k( 253) = ( -0.4062500 0.4062500 -0.0000000), wk = 0.0021739 k( 254) = ( -0.4218750 0.4218750 0.0000000), wk = 0.0021739 k( 255) = ( -0.4375000 0.4375000 -0.0000000), wk = 0.0021739 k( 256) = ( -0.4531250 0.4531250 -0.0000000), wk = 0.0021739 k( 257) = ( -0.4687500 0.4687500 -0.0000000), wk = 0.0021739 k( 258) = ( -0.4843750 0.4843750 -0.0000000), wk = 0.0021739 k( 259) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021739 k( 260) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021739 k( 261) = ( -0.4948149 0.5051851 -0.0000000), wk = 0.0021739 k( 262) = ( -0.4896297 0.5103703 -0.0000000), wk = 0.0021739 k( 263) = ( -0.4844446 0.5155554 -0.0000000), wk = 0.0021739 k( 264) = ( -0.4792595 0.5207405 -0.0000000), wk = 0.0021739 k( 265) = ( -0.4740743 0.5259257 -0.0000000), wk = 0.0021739 k( 266) = ( -0.4688892 0.5311108 -0.0000000), wk = 0.0021739 k( 267) = ( -0.4637040 0.5362959 -0.0000000), wk = 0.0021739 k( 268) = ( -0.4585189 0.5414811 0.0000000), wk = 0.0021739 k( 269) = ( -0.4533338 0.5466662 -0.0000000), wk = 0.0021739 k( 270) = ( -0.4481486 0.5518513 -0.0000000), wk = 0.0021739 k( 271) = ( -0.4429635 0.5570365 -0.0000000), wk = 0.0021739 k( 272) = ( -0.4377784 0.5622216 -0.0000000), wk = 0.0021739 k( 273) = ( -0.4325932 0.5674068 0.0000000), wk = 0.0021739 k( 274) = ( -0.4274081 0.5725919 -0.0000000), wk = 0.0021739 k( 275) = ( -0.4222230 0.5777770 -0.0000000), wk = 0.0021739 k( 276) = ( -0.4170378 0.5829622 -0.0000000), wk = 0.0021739 k( 277) = ( -0.4118527 0.5881473 -0.0000000), wk = 0.0021739 k( 278) = ( -0.4066676 0.5933324 -0.0000000), wk = 0.0021739 k( 279) = ( -0.4014824 0.5985176 -0.0000000), wk = 0.0021739 k( 280) = ( -0.3962973 0.6037027 0.0000000), wk = 0.0021739 k( 281) = ( -0.3911122 0.6088878 -0.0000000), wk = 0.0021739 k( 282) = ( -0.3859270 0.6140730 -0.0000000), wk = 0.0021739 k( 283) = ( -0.3807419 0.6192581 0.0000000), wk = 0.0021739 k( 284) = ( -0.3755567 0.6244433 -0.0000000), wk = 0.0021739 k( 285) = ( -0.3703716 0.6296284 -0.0000000), wk = 0.0021739 k( 286) = ( -0.3651865 0.6348135 0.0000000), wk = 0.0021739 k( 287) = ( -0.3600013 0.6399987 0.0000000), wk = 0.0021739 k( 288) = ( -0.3548162 0.6451838 -0.0000000), wk = 0.0021739 k( 289) = ( -0.3496311 0.6503689 -0.0000000), wk = 0.0021739 k( 290) = ( -0.3444459 0.6555541 -0.0000000), wk = 0.0021739 k( 291) = ( -0.3392608 0.6607392 0.0000000), wk = 0.0021739 k( 292) = ( -0.3340757 0.6659243 -0.0000000), wk = 0.0021739 k( 293) = ( -0.3288905 0.6711095 -0.0000000), wk = 0.0021739 k( 294) = ( -0.3237054 0.6762946 0.0000000), wk = 0.0021739 k( 295) = ( -0.3185203 0.6814797 -0.0000000), wk = 0.0021739 k( 296) = ( -0.3133351 0.6866649 -0.0000000), wk = 0.0021739 k( 297) = ( -0.3081500 0.6918500 -0.0000000), wk = 0.0021739 k( 298) = ( -0.3029649 0.6970351 0.0000000), wk = 0.0021739 k( 299) = ( -0.2977797 0.7022203 -0.0000000), wk = 0.0021739 k( 300) = ( -0.2925946 0.7074054 0.0000000), wk = 0.0021739 k( 301) = ( -0.2874095 0.7125906 0.0000000), wk = 0.0021739 k( 302) = ( -0.2822243 0.7177757 0.0000000), wk = 0.0021739 k( 303) = ( -0.2770392 0.7229608 0.0000000), wk = 0.0021739 k( 304) = ( -0.2770392 0.7229608 0.0000000), wk = 0.0021739 k( 305) = ( -0.2770392 0.7229608 0.0128205), wk = 0.0021739 k( 306) = ( -0.2770392 0.7229608 0.0256410), wk = 0.0021739 k( 307) = ( -0.2770392 0.7229608 0.0384615), wk = 0.0021739 k( 308) = ( -0.2770392 0.7229608 0.0512821), wk = 0.0021739 k( 309) = ( -0.2770392 0.7229608 0.0641026), wk = 0.0021739 k( 310) = ( -0.2770392 0.7229608 0.0769231), wk = 0.0021739 k( 311) = ( -0.2770392 0.7229608 0.0897436), wk = 0.0021739 k( 312) = ( -0.2770392 0.7229608 0.1025641), wk = 0.0021739 k( 313) = ( -0.2770392 0.7229608 0.1153846), wk = 0.0021739 k( 314) = ( -0.2770392 0.7229608 0.1282051), wk = 0.0021739 k( 315) = ( -0.2770392 0.7229608 0.1410256), wk = 0.0021739 k( 316) = ( -0.2770392 0.7229608 0.1538461), wk = 0.0021739 k( 317) = ( -0.2770392 0.7229608 0.1666667), wk = 0.0021739 k( 318) = ( -0.2770392 0.7229608 0.1794872), wk = 0.0021739 k( 319) = ( -0.2770392 0.7229608 0.1923077), wk = 0.0021739 k( 320) = ( -0.2770392 0.7229608 0.2051282), wk = 0.0021739 k( 321) = ( -0.2770392 0.7229608 0.2179487), wk = 0.0021739 k( 322) = ( -0.2770392 0.7229608 0.2307692), wk = 0.0021739 k( 323) = ( -0.2770392 0.7229608 0.2435897), wk = 0.0021739 k( 324) = ( -0.2770392 0.7229608 0.2564103), wk = 0.0021739 k( 325) = ( -0.2770392 0.7229608 0.2692308), wk = 0.0021739 k( 326) = ( -0.2770392 0.7229608 0.2820513), wk = 0.0021739 k( 327) = ( -0.2770392 0.7229608 0.2948718), wk = 0.0021739 k( 328) = ( -0.2770392 0.7229608 0.3076923), wk = 0.0021739 k( 329) = ( -0.2770392 0.7229608 0.3205128), wk = 0.0021739 k( 330) = ( -0.2770392 0.7229608 0.3333333), wk = 0.0021739 k( 331) = ( -0.2770392 0.7229608 0.3461538), wk = 0.0021739 k( 332) = ( -0.2770392 0.7229608 0.3589744), wk = 0.0021739 k( 333) = ( -0.2770392 0.7229608 0.3717949), wk = 0.0021739 k( 334) = ( -0.2770392 0.7229608 0.3846154), wk = 0.0021739 k( 335) = ( -0.2770392 0.7229608 0.3974359), wk = 0.0021739 k( 336) = ( -0.2770392 0.7229608 0.4102564), wk = 0.0021739 k( 337) = ( -0.2770392 0.7229608 0.4230769), wk = 0.0021739 k( 338) = ( -0.2770392 0.7229608 0.4358974), wk = 0.0021739 k( 339) = ( -0.2770392 0.7229608 0.4487179), wk = 0.0021739 k( 340) = ( -0.2770392 0.7229608 0.4615385), wk = 0.0021739 k( 341) = ( -0.2770392 0.7229608 0.4743590), wk = 0.0021739 k( 342) = ( -0.2770392 0.7229608 0.4871795), wk = 0.0021739 k( 343) = ( -0.2770392 0.7229608 0.5000000), wk = 0.0021739 k( 344) = ( -0.2770392 0.7229608 0.5000000), wk = 0.0021739 k( 345) = ( -0.2822243 0.7177757 0.5000000), wk = 0.0021739 k( 346) = ( -0.2874095 0.7125906 0.5000000), wk = 0.0021739 k( 347) = ( -0.2925946 0.7074054 0.5000000), wk = 0.0021739 k( 348) = ( -0.2977797 0.7022203 0.5000000), wk = 0.0021739 k( 349) = ( -0.3029649 0.6970351 0.5000000), wk = 0.0021739 k( 350) = ( -0.3081500 0.6918500 0.5000000), wk = 0.0021739 k( 351) = ( -0.3133351 0.6866649 0.5000000), wk = 0.0021739 k( 352) = ( -0.3185203 0.6814797 0.5000000), wk = 0.0021739 k( 353) = ( -0.3237054 0.6762946 0.5000000), wk = 0.0021739 k( 354) = ( -0.3288905 0.6711095 0.5000000), wk = 0.0021739 k( 355) = ( -0.3340757 0.6659243 0.5000000), wk = 0.0021739 k( 356) = ( -0.3392608 0.6607392 0.5000000), wk = 0.0021739 k( 357) = ( -0.3444459 0.6555541 0.5000000), wk = 0.0021739 k( 358) = ( -0.3496311 0.6503689 0.5000000), wk = 0.0021739 k( 359) = ( -0.3548162 0.6451838 0.5000000), wk = 0.0021739 k( 360) = ( -0.3600013 0.6399987 0.5000000), wk = 0.0021739 k( 361) = ( -0.3651865 0.6348135 0.5000000), wk = 0.0021739 k( 362) = ( -0.3703716 0.6296284 0.5000000), wk = 0.0021739 k( 363) = ( -0.3755567 0.6244433 0.5000000), wk = 0.0021739 k( 364) = ( -0.3807419 0.6192581 0.5000000), wk = 0.0021739 k( 365) = ( -0.3859270 0.6140730 0.5000000), wk = 0.0021739 k( 366) = ( -0.3911122 0.6088878 0.5000000), wk = 0.0021739 k( 367) = ( -0.3962973 0.6037027 0.5000000), wk = 0.0021739 k( 368) = ( -0.4014824 0.5985176 0.5000000), wk = 0.0021739 k( 369) = ( -0.4066676 0.5933324 0.5000000), wk = 0.0021739 k( 370) = ( -0.4118527 0.5881473 0.5000000), wk = 0.0021739 k( 371) = ( -0.4170378 0.5829622 0.5000000), wk = 0.0021739 k( 372) = ( -0.4222230 0.5777770 0.5000000), wk = 0.0021739 k( 373) = ( -0.4274081 0.5725919 0.5000000), wk = 0.0021739 k( 374) = ( -0.4325932 0.5674068 0.5000000), wk = 0.0021739 k( 375) = ( -0.4377784 0.5622216 0.5000000), wk = 0.0021739 k( 376) = ( -0.4429635 0.5570365 0.5000000), wk = 0.0021739 k( 377) = ( -0.4481486 0.5518513 0.5000000), wk = 0.0021739 k( 378) = ( -0.4533338 0.5466662 0.5000000), wk = 0.0021739 k( 379) = ( -0.4585189 0.5414811 0.5000000), wk = 0.0021739 k( 380) = ( -0.4637040 0.5362959 0.5000000), wk = 0.0021739 k( 381) = ( -0.4688892 0.5311108 0.5000000), wk = 0.0021739 k( 382) = ( -0.4740743 0.5259257 0.5000000), wk = 0.0021739 k( 383) = ( -0.4792595 0.5207405 0.5000000), wk = 0.0021739 k( 384) = ( -0.4844446 0.5155554 0.5000000), wk = 0.0021739 k( 385) = ( -0.4896297 0.5103703 0.5000000), wk = 0.0021739 k( 386) = ( -0.4948149 0.5051851 0.5000000), wk = 0.0021739 k( 387) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021739 k( 388) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021739 k( 389) = ( -0.5000000 0.5000000 0.4871795), wk = 0.0021739 k( 390) = ( -0.5000000 0.5000000 0.4743590), wk = 0.0021739 k( 391) = ( -0.5000000 0.5000000 0.4615385), wk = 0.0021739 k( 392) = ( -0.5000000 0.5000000 0.4487179), wk = 0.0021739 k( 393) = ( -0.5000000 0.5000000 0.4358974), wk = 0.0021739 k( 394) = ( -0.5000000 0.5000000 0.4230769), wk = 0.0021739 k( 395) = ( -0.5000000 0.5000000 0.4102564), wk = 0.0021739 k( 396) = ( -0.5000000 0.5000000 0.3974359), wk = 0.0021739 k( 397) = ( -0.5000000 0.5000000 0.3846154), wk = 0.0021739 k( 398) = ( -0.5000000 0.5000000 0.3717949), wk = 0.0021739 k( 399) = ( -0.5000000 0.5000000 0.3589744), wk = 0.0021739 k( 400) = ( -0.5000000 0.5000000 0.3461538), wk = 0.0021739 k( 401) = ( -0.5000000 0.5000000 0.3333333), wk = 0.0021739 k( 402) = ( -0.5000000 0.5000000 0.3205128), wk = 0.0021739 k( 403) = ( -0.5000000 0.5000000 0.3076923), wk = 0.0021739 k( 404) = ( -0.5000000 0.5000000 0.2948718), wk = 0.0021739 k( 405) = ( -0.5000000 0.5000000 0.2820513), wk = 0.0021739 k( 406) = ( -0.5000000 0.5000000 0.2692308), wk = 0.0021739 k( 407) = ( -0.5000000 0.5000000 0.2564103), wk = 0.0021739 k( 408) = ( -0.5000000 0.5000000 0.2435897), wk = 0.0021739 k( 409) = ( -0.5000000 0.5000000 0.2307692), wk = 0.0021739 k( 410) = ( -0.5000000 0.5000000 0.2179487), wk = 0.0021739 k( 411) = ( -0.5000000 0.5000000 0.2051282), wk = 0.0021739 k( 412) = ( -0.5000000 0.5000000 0.1923077), wk = 0.0021739 k( 413) = ( -0.5000000 0.5000000 0.1794872), wk = 0.0021739 k( 414) = ( -0.5000000 0.5000000 0.1666667), wk = 0.0021739 k( 415) = ( -0.5000000 0.5000000 0.1538461), wk = 0.0021739 k( 416) = ( -0.5000000 0.5000000 0.1410256), wk = 0.0021739 k( 417) = ( -0.5000000 0.5000000 0.1282051), wk = 0.0021739 k( 418) = ( -0.5000000 0.5000000 0.1153846), wk = 0.0021739 k( 419) = ( -0.5000000 0.5000000 0.1025641), wk = 0.0021739 k( 420) = ( -0.5000000 0.5000000 0.0897436), wk = 0.0021739 k( 421) = ( -0.5000000 0.5000000 0.0769231), wk = 0.0021739 k( 422) = ( -0.5000000 0.5000000 0.0641026), wk = 0.0021739 k( 423) = ( -0.5000000 0.5000000 0.0512821), wk = 0.0021739 k( 424) = ( -0.5000000 0.5000000 0.0384615), wk = 0.0021739 k( 425) = ( -0.5000000 0.5000000 0.0256410), wk = 0.0021739 k( 426) = ( -0.5000000 0.5000000 0.0128205), wk = 0.0021739 k( 427) = ( -0.5000000 0.5000000 -0.0000000), wk = 0.0021739 k( 428) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0021739 k( 429) = ( -0.0156250 0.0156250 0.5000000), wk = 0.0021739 k( 430) = ( -0.0312500 0.0312500 0.5000000), wk = 0.0021739 k( 431) = ( -0.0468750 0.0468750 0.5000000), wk = 0.0021739 k( 432) = ( -0.0625000 0.0625000 0.5000000), wk = 0.0021739 k( 433) = ( -0.0781250 0.0781250 0.5000000), wk = 0.0021739 k( 434) = ( -0.0937500 0.0937500 0.5000000), wk = 0.0021739 k( 435) = ( -0.1093750 0.1093750 0.5000000), wk = 0.0021739 k( 436) = ( -0.1250000 0.1250000 0.5000000), wk = 0.0021739 k( 437) = ( -0.1406250 0.1406250 0.5000000), wk = 0.0021739 k( 438) = ( -0.1562500 0.1562500 0.5000000), wk = 0.0021739 k( 439) = ( -0.1718750 0.1718750 0.5000000), wk = 0.0021739 k( 440) = ( -0.1875000 0.1875000 0.5000000), wk = 0.0021739 k( 441) = ( -0.2031250 0.2031250 0.5000000), wk = 0.0021739 k( 442) = ( -0.2187500 0.2187500 0.5000000), wk = 0.0021739 k( 443) = ( -0.2343750 0.2343750 0.5000000), wk = 0.0021739 k( 444) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0021739 k( 445) = ( -0.2656250 0.2656250 0.5000000), wk = 0.0021739 k( 446) = ( -0.2812500 0.2812500 0.5000000), wk = 0.0021739 k( 447) = ( -0.2968750 0.2968750 0.5000000), wk = 0.0021739 k( 448) = ( -0.3125000 0.3125000 0.5000000), wk = 0.0021739 k( 449) = ( -0.3281250 0.3281250 0.5000000), wk = 0.0021739 k( 450) = ( -0.3437500 0.3437500 0.5000000), wk = 0.0021739 k( 451) = ( -0.3593750 0.3593750 0.5000000), wk = 0.0021739 k( 452) = ( -0.3750000 0.3750000 0.5000000), wk = 0.0021739 k( 453) = ( -0.3906250 0.3906250 0.5000000), wk = 0.0021739 k( 454) = ( -0.4062500 0.4062500 0.5000000), wk = 0.0021739 k( 455) = ( -0.4218750 0.4218750 0.5000000), wk = 0.0021739 k( 456) = ( -0.4375000 0.4375000 0.5000000), wk = 0.0021739 k( 457) = ( -0.4531250 0.4531250 0.5000000), wk = 0.0021739 k( 458) = ( -0.4687500 0.4687500 0.5000000), wk = 0.0021739 k( 459) = ( -0.4843750 0.4843750 0.5000000), wk = 0.0021739 k( 460) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0021739 Dense grid: 27467 G-vectors FFT dimensions: ( 50, 50, 40) Smooth grid: 21525 G-vectors FFT dimensions: ( 45, 45, 36) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.09 Mb ( 164, 36) NL pseudopotentials 0.13 Mb ( 82, 100) Each V/rho on FFT grid 0.08 Mb ( 5000) Each G-vector array 0.01 Mb ( 765) G-vector shells 0.00 Mb ( 398) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.36 Mb ( 164, 144) Each subspace H/S matrix 0.02 Mb ( 36, 36) Each matrix 0.11 Mb ( 100, 2, 36) The potential is recalculated from file : ./ZrNi.save/charge-density.dat Starting wfc are 72 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 1.9 secs Computing kpt #: 2 total cpu time spent up to now is 2.1 secs Computing kpt #: 3 total cpu time spent up to now is 2.4 secs Computing kpt #: 4 total cpu time spent up to now is 2.9 secs Computing kpt #: 5 total cpu time spent up to now is 3.4 secs Computing kpt #: 6 total cpu time spent up to now is 3.7 secs Computing kpt #: 7 total cpu time spent up to now is 4.1 secs Computing kpt #: 8 total cpu time spent up to now is 4.4 secs Computing kpt #: 9 total cpu time spent up to now is 4.7 secs Computing kpt #: 10 total cpu time spent up to now is 5.0 secs Computing kpt #: 11 total cpu time spent up to now is 5.2 secs Computing kpt #: 12 total cpu time spent up to now is 5.4 secs Computing kpt #: 13 total cpu time spent up to now is 5.7 secs Computing kpt #: 14 total cpu time spent up to now is 5.9 secs Computing kpt #: 15 total cpu time spent up to now is 6.2 secs Computing kpt #: 16 total cpu time spent up to now is 6.4 secs Computing kpt #: 17 total cpu time spent up to now is 6.8 secs Computing kpt #: 18 total cpu time spent up to now is 7.5 secs Computing kpt #: 19 total cpu time spent up to now is 7.9 secs Computing kpt #: 20 total cpu time spent up to now is 8.2 secs Computing kpt #: 21 total cpu time spent up to now is 8.5 secs Computing kpt #: 22 total cpu time spent up to now is 8.7 secs Computing kpt #: 23 total cpu time spent up to now is 9.0 secs Computing kpt #: 24 total cpu time spent up to now is 9.2 secs Computing kpt #: 25 total cpu time spent up to now is 9.5 secs Computing kpt #: 26 total cpu time spent up to now is 9.7 secs Computing kpt #: 27 total cpu time spent up to now is 10.0 secs Computing kpt #: 28 total cpu time spent up to now is 10.2 secs Computing kpt #: 29 total cpu time spent up to now is 10.4 secs Computing kpt #: 30 total cpu time spent up to now is 10.7 secs Computing kpt #: 31 total cpu time spent up to now is 10.9 secs Computing kpt #: 32 total cpu time spent up to now is 11.2 secs Computing kpt #: 33 total cpu time spent up to now is 11.4 secs Computing kpt #: 34 total cpu time spent up to now is 11.7 secs Computing kpt #: 35 total cpu time spent up to now is 12.0 secs Computing kpt #: 36 total cpu time spent up to now is 12.2 secs Computing kpt #: 37 total cpu time spent up to now is 12.5 secs Computing kpt #: 38 total cpu time spent up to now is 12.7 secs Computing kpt #: 39 total cpu time spent up to now is 13.0 secs Computing kpt #: 40 total cpu time spent up to now is 13.3 secs Computing kpt #: 41 total cpu time spent up to now is 13.6 secs Computing kpt #: 42 total cpu time spent up to now is 13.8 secs Computing kpt #: 43 total cpu time spent up to now is 14.1 secs Computing kpt #: 44 total cpu time spent up to now is 14.4 secs Computing kpt #: 45 total cpu time spent up to now is 14.6 secs Computing kpt #: 46 total cpu time spent up to now is 14.9 secs Computing kpt #: 47 total cpu time spent up to now is 15.2 secs Computing kpt #: 48 total cpu time spent up to now is 15.4 secs Computing kpt #: 49 total cpu time spent up to now is 15.7 secs Computing kpt #: 50 total cpu time spent up to now is 15.9 secs Computing kpt #: 51 total cpu time spent up to now is 16.2 secs Computing kpt #: 52 total cpu time spent up to now is 16.5 secs Computing kpt #: 53 total cpu time spent up to now is 16.7 secs Computing kpt #: 54 total cpu time spent up to now is 17.0 secs Computing kpt #: 55 total cpu time spent up to now is 17.3 secs Computing kpt #: 56 total cpu time spent up to now is 17.6 secs Computing kpt #: 57 total cpu time spent up to now is 17.8 secs Computing kpt #: 58 total cpu time spent up to now is 18.1 secs Computing kpt #: 59 total cpu time spent up to now is 18.4 secs Computing kpt #: 60 total cpu time spent up to now is 18.7 secs Computing kpt #: 61 total cpu time spent up to now is 19.1 secs Computing kpt #: 62 total cpu time spent up to now is 19.7 secs Computing kpt #: 63 total cpu time spent up to now is 20.4 secs Computing kpt #: 64 total cpu time spent up to now is 20.9 secs Computing kpt #: 65 total cpu time spent up to now is 21.4 secs Computing kpt #: 66 total cpu time spent up to now is 21.7 secs Computing kpt #: 67 total cpu time spent up to now is 22.0 secs Computing kpt #: 68 total cpu time spent up to now is 22.4 secs Computing kpt #: 69 total cpu time spent up to now is 22.6 secs Computing kpt #: 70 total cpu time spent up to now is 23.0 secs Computing kpt #: 71 total cpu time spent up to now is 23.2 secs Computing kpt #: 72 total cpu time spent up to now is 23.4 secs Computing kpt #: 73 total cpu time spent up to now is 23.7 secs Computing kpt #: 74 total cpu time spent up to now is 24.0 secs Computing kpt #: 75 total cpu time spent up to now is 24.2 secs Computing kpt #: 76 total cpu time spent up to now is 24.5 secs Computing kpt #: 77 total cpu time spent up to now is 24.7 secs Computing kpt #: 78 total cpu time spent up to now is 25.0 secs Computing kpt #: 79 total cpu time spent up to now is 25.2 secs Computing kpt #: 80 total cpu time spent up to now is 25.5 secs Computing kpt #: 81 total cpu time spent up to now is 25.7 secs Computing kpt #: 82 total cpu time spent up to now is 25.9 secs Computing kpt #: 83 total cpu time spent up to now is 26.2 secs Computing kpt #: 84 total cpu time spent up to now is 26.4 secs Computing kpt #: 85 total cpu time spent up to now is 26.6 secs Computing kpt #: 86 total cpu time spent up to now is 26.9 secs Computing kpt #: 87 total cpu time spent up to now is 27.1 secs Computing kpt #: 88 total cpu time spent up to now is 27.3 secs Computing kpt #: 89 total cpu time spent up to now is 27.6 secs Computing kpt #: 90 total cpu time spent up to now is 27.8 secs Computing kpt #: 91 total cpu time spent up to now is 28.1 secs Computing kpt #: 92 total cpu time spent up to now is 28.3 secs Computing kpt #: 93 total cpu time spent up to now is 28.5 secs Computing kpt #: 94 total cpu time spent up to now is 28.8 secs Computing kpt #: 95 total cpu time spent up to now is 29.0 secs Computing kpt #: 96 total cpu time spent up to now is 29.3 secs Computing kpt #: 97 total cpu time spent up to now is 29.5 secs Computing kpt #: 98 total cpu time spent up to now is 29.7 secs Computing kpt #: 99 total cpu time spent up to now is 30.0 secs Computing kpt #: 100 total cpu time spent up to now is 30.2 secs Computing kpt #: 101 total cpu time spent up to now is 30.4 secs Computing kpt #: 102 total cpu time spent up to now is 30.7 secs Computing kpt #: 103 total cpu time spent up to now is 30.9 secs Computing kpt #: 104 total cpu time spent up to now is 31.1 secs Computing kpt #: 105 total cpu time spent up to now is 31.4 secs Computing kpt #: 106 total cpu time spent up to now is 31.6 secs Computing kpt #: 107 total cpu time spent up to now is 31.8 secs Computing kpt #: 108 total cpu time spent up to now is 32.1 secs Computing kpt #: 109 total cpu time spent up to now is 32.3 secs Computing kpt #: 110 total cpu time spent up to now is 32.5 secs Computing kpt #: 111 total cpu time spent up to now is 32.7 secs Computing kpt #: 112 total cpu time spent up to now is 33.1 secs Computing kpt #: 113 total cpu time spent up to now is 33.3 secs Computing kpt #: 114 total cpu time spent up to now is 33.5 secs Computing kpt #: 115 total cpu time spent up to now is 33.7 secs Computing kpt #: 116 total cpu time spent up to now is 33.9 secs Computing kpt #: 117 total cpu time spent up to now is 34.2 secs Computing kpt #: 118 total cpu time spent up to now is 34.4 secs Computing kpt #: 119 total cpu time spent up to now is 34.6 secs Computing kpt #: 120 total cpu time spent up to now is 34.8 secs Computing kpt #: 121 total cpu time spent up to now is 35.1 secs Computing kpt #: 122 total cpu time spent up to now is 35.3 secs Computing kpt #: 123 total cpu time spent up to now is 35.5 secs Computing kpt #: 124 total cpu time spent up to now is 35.8 secs Computing kpt #: 125 total cpu time spent up to now is 36.0 secs Computing kpt #: 126 total cpu time spent up to now is 36.2 secs Computing kpt #: 127 total cpu time spent up to now is 36.5 secs Computing kpt #: 128 total cpu time spent up to now is 36.7 secs Computing kpt #: 129 total cpu time spent up to now is 36.9 secs Computing kpt #: 130 total cpu time spent up to now is 37.2 secs Computing kpt #: 131 total cpu time spent up to now is 37.4 secs Computing kpt #: 132 total cpu time spent up to now is 37.6 secs Computing kpt #: 133 total cpu time spent up to now is 37.9 secs Computing kpt #: 134 total cpu time spent up to now is 38.1 secs Computing kpt #: 135 total cpu time spent up to now is 38.4 secs Computing kpt #: 136 total cpu time spent up to now is 38.6 secs Computing kpt #: 137 total cpu time spent up to now is 38.8 secs Computing kpt #: 138 total cpu time spent up to now is 39.1 secs Computing kpt #: 139 total cpu time spent up to now is 39.3 secs Computing kpt #: 140 total cpu time spent up to now is 39.5 secs Computing kpt #: 141 total cpu time spent up to now is 39.8 secs Computing kpt #: 142 total cpu time spent up to now is 40.0 secs Computing kpt #: 143 total cpu time spent up to now is 40.3 secs Computing kpt #: 144 total cpu time spent up to now is 40.6 secs Computing kpt #: 145 total cpu time spent up to now is 40.8 secs Computing kpt #: 146 total cpu time spent up to now is 41.1 secs Computing kpt #: 147 total cpu time spent up to now is 41.3 secs Computing kpt #: 148 total cpu time spent up to now is 41.6 secs Computing kpt #: 149 total cpu time spent up to now is 41.8 secs Computing kpt #: 150 total cpu time spent up to now is 42.1 secs Computing kpt #: 151 total cpu time spent up to now is 42.3 secs Computing kpt #: 152 total cpu time spent up to now is 42.6 secs Computing kpt #: 153 total cpu time spent up to now is 42.8 secs Computing kpt #: 154 total cpu time spent up to now is 43.0 secs Computing kpt #: 155 total cpu time spent up to now is 43.3 secs Computing kpt #: 156 total cpu time spent up to now is 43.5 secs Computing kpt #: 157 total cpu time spent up to now is 43.8 secs Computing kpt #: 158 total cpu time spent up to now is 44.0 secs Computing kpt #: 159 total cpu time spent up to now is 44.2 secs Computing kpt #: 160 total cpu time spent up to now is 44.5 secs Computing kpt #: 161 total cpu time spent up to now is 44.7 secs Computing kpt #: 162 total cpu time spent up to now is 44.9 secs Computing kpt #: 163 total cpu time spent up to now is 45.2 secs Computing kpt #: 164 total cpu time spent up to now is 45.4 secs Computing kpt #: 165 total cpu time spent up to now is 45.6 secs Computing kpt #: 166 total cpu time spent up to now is 45.8 secs Computing kpt #: 167 total cpu time spent up to now is 46.1 secs Computing kpt #: 168 total cpu time spent up to now is 46.3 secs Computing kpt #: 169 total cpu time spent up to now is 46.5 secs Computing kpt #: 170 total cpu time spent up to now is 46.7 secs Computing kpt #: 171 total cpu time spent up to now is 47.0 secs Computing kpt #: 172 total cpu time spent up to now is 47.2 secs Computing kpt #: 173 total cpu time spent up to now is 47.4 secs Computing kpt #: 174 total cpu time spent up to now is 47.6 secs Computing kpt #: 175 total cpu time spent up to now is 47.8 secs Computing kpt #: 176 total cpu time spent up to now is 48.1 secs Computing kpt #: 177 total cpu time spent up to now is 48.3 secs Computing kpt #: 178 total cpu time spent up to now is 48.5 secs Computing kpt #: 179 total cpu time spent up to now is 48.7 secs Computing kpt #: 180 total cpu time spent up to now is 48.9 secs Computing kpt #: 181 total cpu time spent up to now is 49.2 secs Computing kpt #: 182 total cpu time spent up to now is 49.4 secs Computing kpt #: 183 total cpu time spent up to now is 49.6 secs Computing kpt #: 184 total cpu time spent up to now is 49.8 secs Computing kpt #: 185 total cpu time spent up to now is 50.0 secs Computing kpt #: 186 total cpu time spent up to now is 50.2 secs Computing kpt #: 187 total cpu time spent up to now is 50.5 secs Computing kpt #: 188 total cpu time spent up to now is 50.7 secs Computing kpt #: 189 total cpu time spent up to now is 50.9 secs Computing kpt #: 190 total cpu time spent up to now is 51.1 secs Computing kpt #: 191 total cpu time spent up to now is 51.3 secs Computing kpt #: 192 total cpu time spent up to now is 51.5 secs Computing kpt #: 193 total cpu time spent up to now is 51.8 secs Computing kpt #: 194 total cpu time spent up to now is 52.0 secs Computing kpt #: 195 total cpu time spent up to now is 52.2 secs Computing kpt #: 196 total cpu time spent up to now is 52.4 secs Computing kpt #: 197 total cpu time spent up to now is 52.6 secs Computing kpt #: 198 total cpu time spent up to now is 52.9 secs Computing kpt #: 199 total cpu time spent up to now is 53.1 secs Computing kpt #: 200 total cpu time spent up to now is 53.4 secs Computing kpt #: 201 total cpu time spent up to now is 53.6 secs Computing kpt #: 202 total cpu time spent up to now is 53.9 secs Computing kpt #: 203 total cpu time spent up to now is 54.2 secs Computing kpt #: 204 total cpu time spent up to now is 54.5 secs Computing kpt #: 205 total cpu time spent up to now is 54.8 secs Computing kpt #: 206 total cpu time spent up to now is 55.1 secs Computing kpt #: 207 total cpu time spent up to now is 55.4 secs Computing kpt #: 208 total cpu time spent up to now is 55.7 secs Computing kpt #: 209 total cpu time spent up to now is 56.1 secs Computing kpt #: 210 total cpu time spent up to now is 56.4 secs Computing kpt #: 211 total cpu time spent up to now is 56.8 secs Computing kpt #: 212 total cpu time spent up to now is 57.1 secs Computing kpt #: 213 total cpu time spent up to now is 57.4 secs Computing kpt #: 214 total cpu time spent up to now is 57.8 secs Computing kpt #: 215 total cpu time spent up to now is 58.1 secs Computing kpt #: 216 total cpu time spent up to now is 58.4 secs Computing kpt #: 217 total cpu time spent up to now is 58.7 secs Computing kpt #: 218 total cpu time spent up to now is 59.0 secs Computing kpt #: 219 total cpu time spent up to now is 59.3 secs Computing kpt #: 220 total cpu time spent up to now is 59.6 secs Computing kpt #: 221 total cpu time spent up to now is 59.8 secs Computing kpt #: 222 total cpu time spent up to now is 60.1 secs Computing kpt #: 223 total cpu time spent up to now is 60.4 secs Computing kpt #: 224 total cpu time spent up to now is 60.7 secs Computing kpt #: 225 total cpu time spent up to now is 60.9 secs Computing kpt #: 226 total cpu time spent up to now is 61.1 secs Computing kpt #: 227 total cpu time spent up to now is 61.4 secs Computing kpt #: 228 total cpu time spent up to now is 61.6 secs Computing kpt #: 229 total cpu time spent up to now is 61.9 secs Computing kpt #: 230 total cpu time spent up to now is 62.3 secs Computing kpt #: 231 total cpu time spent up to now is 62.8 secs Computing kpt #: 232 total cpu time spent up to now is 63.3 secs Computing kpt #: 233 total cpu time spent up to now is 63.7 secs Computing kpt #: 234 total cpu time spent up to now is 64.1 secs Computing kpt #: 235 total cpu time spent up to now is 64.4 secs Computing kpt #: 236 total cpu time spent up to now is 64.7 secs Computing kpt #: 237 total cpu time spent up to now is 65.0 secs Computing kpt #: 238 total cpu time spent up to now is 65.3 secs Computing kpt #: 239 total cpu time spent up to now is 65.5 secs Computing kpt #: 240 total cpu time spent up to now is 65.8 secs Computing kpt #: 241 total cpu time spent up to now is 66.1 secs Computing kpt #: 242 total cpu time spent up to now is 66.3 secs Computing kpt #: 243 total cpu time spent up to now is 66.6 secs Computing kpt #: 244 total cpu time spent up to now is 66.9 secs Computing kpt #: 245 total cpu time spent up to now is 67.2 secs Computing kpt #: 246 total cpu time spent up to now is 67.5 secs Computing kpt #: 247 total cpu time spent up to now is 67.9 secs Computing kpt #: 248 total cpu time spent up to now is 68.3 secs Computing kpt #: 249 total cpu time spent up to now is 69.1 secs Computing kpt #: 250 total cpu time spent up to now is 69.7 secs Computing kpt #: 251 total cpu time spent up to now is 70.4 secs Computing kpt #: 252 total cpu time spent up to now is 70.8 secs Computing kpt #: 253 total cpu time spent up to now is 71.2 secs Computing kpt #: 254 total cpu time spent up to now is 71.6 secs Computing kpt #: 255 total cpu time spent up to now is 72.0 secs Computing kpt #: 256 total cpu time spent up to now is 72.2 secs Computing kpt #: 257 total cpu time spent up to now is 72.5 secs Computing kpt #: 258 total cpu time spent up to now is 72.8 secs Computing kpt #: 259 total cpu time spent up to now is 73.2 secs Computing kpt #: 260 total cpu time spent up to now is 73.4 secs Computing kpt #: 261 total cpu time spent up to now is 73.7 secs Computing kpt #: 262 total cpu time spent up to now is 73.9 secs Computing kpt #: 263 total cpu time spent up to now is 74.3 secs Computing kpt #: 264 total cpu time spent up to now is 74.6 secs Computing kpt #: 265 total cpu time spent up to now is 74.9 secs Computing kpt #: 266 total cpu time spent up to now is 75.3 secs Computing kpt #: 267 total cpu time spent up to now is 75.6 secs Computing kpt #: 268 total cpu time spent up to now is 76.0 secs Computing kpt #: 269 total cpu time spent up to now is 76.4 secs Computing kpt #: 270 total cpu time spent up to now is 76.8 secs Computing kpt #: 271 total cpu time spent up to now is 77.2 secs Computing kpt #: 272 total cpu time spent up to now is 77.6 secs Computing kpt #: 273 total cpu time spent up to now is 78.0 secs Computing kpt #: 274 total cpu time spent up to now is 78.4 secs Computing kpt #: 275 total cpu time spent up to now is 78.8 secs Computing kpt #: 276 total cpu time spent up to now is 79.1 secs Computing kpt #: 277 total cpu time spent up to now is 79.4 secs Computing kpt #: 278 total cpu time spent up to now is 79.6 secs Computing kpt #: 279 total cpu time spent up to now is 79.9 secs Computing kpt #: 280 total cpu time spent up to now is 80.1 secs Computing kpt #: 281 total cpu time spent up to now is 80.3 secs Computing kpt #: 282 total cpu time spent up to now is 80.6 secs Computing kpt #: 283 total cpu time spent up to now is 80.8 secs Computing kpt #: 284 total cpu time spent up to now is 81.1 secs Computing kpt #: 285 total cpu time spent up to now is 81.3 secs Computing kpt #: 286 total cpu time spent up to now is 81.6 secs Computing kpt #: 287 total cpu time spent up to now is 81.8 secs Computing kpt #: 288 total cpu time spent up to now is 82.0 secs Computing kpt #: 289 total cpu time spent up to now is 82.3 secs Computing kpt #: 290 total cpu time spent up to now is 82.6 secs Computing kpt #: 291 total cpu time spent up to now is 82.8 secs Computing kpt #: 292 total cpu time spent up to now is 83.1 secs Computing kpt #: 293 total cpu time spent up to now is 83.4 secs Computing kpt #: 294 total cpu time spent up to now is 83.7 secs Computing kpt #: 295 total cpu time spent up to now is 84.1 secs Computing kpt #: 296 total cpu time spent up to now is 84.5 secs Computing kpt #: 297 total cpu time spent up to now is 84.9 secs Computing kpt #: 298 total cpu time spent up to now is 85.4 secs Computing kpt #: 299 total cpu time spent up to now is 86.0 secs Computing kpt #: 300 total cpu time spent up to now is 86.4 secs Computing kpt #: 301 total cpu time spent up to now is 86.8 secs Computing kpt #: 302 total cpu time spent up to now is 87.1 secs Computing kpt #: 303 total cpu time spent up to now is 87.3 secs Computing kpt #: 304 total cpu time spent up to now is 87.6 secs Computing kpt #: 305 total cpu time spent up to now is 87.9 secs Computing kpt #: 306 total cpu time spent up to now is 88.2 secs Computing kpt #: 307 total cpu time spent up to now is 88.5 secs Computing kpt #: 308 total cpu time spent up to now is 88.8 secs Computing kpt #: 309 total cpu time spent up to now is 89.2 secs Computing kpt #: 310 total cpu time spent up to now is 89.5 secs Computing kpt #: 311 total cpu time spent up to now is 89.8 secs Computing kpt #: 312 total cpu time spent up to now is 90.1 secs Computing kpt #: 313 total cpu time spent up to now is 90.4 secs Computing kpt #: 314 total cpu time spent up to now is 90.8 secs Computing kpt #: 315 total cpu time spent up to now is 91.1 secs Computing kpt #: 316 total cpu time spent up to now is 91.3 secs Computing kpt #: 317 total cpu time spent up to now is 91.6 secs Computing kpt #: 318 total cpu time spent up to now is 91.9 secs Computing kpt #: 319 total cpu time spent up to now is 92.2 secs Computing kpt #: 320 total cpu time spent up to now is 92.4 secs Computing kpt #: 321 total cpu time spent up to now is 92.7 secs Computing kpt #: 322 total cpu time spent up to now is 93.0 secs Computing kpt #: 323 total cpu time spent up to now is 93.3 secs Computing kpt #: 324 total cpu time spent up to now is 93.5 secs Computing kpt #: 325 total cpu time spent up to now is 93.8 secs Computing kpt #: 326 total cpu time spent up to now is 94.0 secs Computing kpt #: 327 total cpu time spent up to now is 94.3 secs Computing kpt #: 328 total cpu time spent up to now is 94.5 secs Computing kpt #: 329 total cpu time spent up to now is 94.8 secs Computing kpt #: 330 total cpu time spent up to now is 95.0 secs Computing kpt #: 331 total cpu time spent up to now is 95.3 secs Computing kpt #: 332 total cpu time spent up to now is 95.5 secs Computing kpt #: 333 total cpu time spent up to now is 95.7 secs Computing kpt #: 334 total cpu time spent up to now is 96.0 secs Computing kpt #: 335 total cpu time spent up to now is 96.2 secs Computing kpt #: 336 total cpu time spent up to now is 96.5 secs Computing kpt #: 337 total cpu time spent up to now is 96.7 secs Computing kpt #: 338 total cpu time spent up to now is 96.9 secs Computing kpt #: 339 total cpu time spent up to now is 97.2 secs Computing kpt #: 340 total cpu time spent up to now is 97.4 secs Computing kpt #: 341 total cpu time spent up to now is 97.6 secs Computing kpt #: 342 total cpu time spent up to now is 97.9 secs Computing kpt #: 343 total cpu time spent up to now is 98.1 secs Computing kpt #: 344 total cpu time spent up to now is 98.3 secs Computing kpt #: 345 total cpu time spent up to now is 98.6 secs Computing kpt #: 346 total cpu time spent up to now is 98.8 secs Computing kpt #: 347 total cpu time spent up to now is 99.0 secs Computing kpt #: 348 total cpu time spent up to now is 99.3 secs Computing kpt #: 349 total cpu time spent up to now is 99.5 secs Computing kpt #: 350 total cpu time spent up to now is 99.7 secs Computing kpt #: 351 total cpu time spent up to now is 100.0 secs Computing kpt #: 352 total cpu time spent up to now is 100.2 secs Computing kpt #: 353 total cpu time spent up to now is 100.4 secs Computing kpt #: 354 total cpu time spent up to now is 100.7 secs Computing kpt #: 355 total cpu time spent up to now is 100.9 secs Computing kpt #: 356 total cpu time spent up to now is 101.2 secs Computing kpt #: 357 total cpu time spent up to now is 101.4 secs Computing kpt #: 358 total cpu time spent up to now is 101.7 secs Computing kpt #: 359 total cpu time spent up to now is 101.9 secs Computing kpt #: 360 total cpu time spent up to now is 102.2 secs Computing kpt #: 361 total cpu time spent up to now is 102.4 secs Computing kpt #: 362 total cpu time spent up to now is 102.7 secs Computing kpt #: 363 total cpu time spent up to now is 103.0 secs Computing kpt #: 364 total cpu time spent up to now is 103.2 secs Computing kpt #: 365 total cpu time spent up to now is 103.5 secs Computing kpt #: 366 total cpu time spent up to now is 103.7 secs Computing kpt #: 367 total cpu time spent up to now is 104.0 secs Computing kpt #: 368 total cpu time spent up to now is 104.3 secs Computing kpt #: 369 total cpu time spent up to now is 104.5 secs Computing kpt #: 370 total cpu time spent up to now is 104.8 secs Computing kpt #: 371 total cpu time spent up to now is 105.1 secs Computing kpt #: 372 total cpu time spent up to now is 105.3 secs Computing kpt #: 373 total cpu time spent up to now is 105.6 secs Computing kpt #: 374 total cpu time spent up to now is 105.9 secs Computing kpt #: 375 total cpu time spent up to now is 106.2 secs Computing kpt #: 376 total cpu time spent up to now is 106.5 secs Computing kpt #: 377 total cpu time spent up to now is 106.9 secs Computing kpt #: 378 total cpu time spent up to now is 107.2 secs Computing kpt #: 379 total cpu time spent up to now is 107.6 secs Computing kpt #: 380 total cpu time spent up to now is 108.0 secs Computing kpt #: 381 total cpu time spent up to now is 108.4 secs Computing kpt #: 382 total cpu time spent up to now is 108.8 secs Computing kpt #: 383 total cpu time spent up to now is 109.1 secs Computing kpt #: 384 total cpu time spent up to now is 109.5 secs Computing kpt #: 385 total cpu time spent up to now is 109.9 secs Computing kpt #: 386 total cpu time spent up to now is 110.3 secs Computing kpt #: 387 total cpu time spent up to now is 110.6 secs Computing kpt #: 388 total cpu time spent up to now is 111.0 secs Computing kpt #: 389 total cpu time spent up to now is 111.4 secs Computing kpt #: 390 total cpu time spent up to now is 111.8 secs Computing kpt #: 391 total cpu time spent up to now is 112.1 secs Computing kpt #: 392 total cpu time spent up to now is 112.5 secs Computing kpt #: 393 total cpu time spent up to now is 112.9 secs Computing kpt #: 394 total cpu time spent up to now is 113.3 secs Computing kpt #: 395 total cpu time spent up to now is 113.7 secs Computing kpt #: 396 total cpu time spent up to now is 114.1 secs Computing kpt #: 397 total cpu time spent up to now is 114.5 secs Computing kpt #: 398 total cpu time spent up to now is 114.9 secs Computing kpt #: 399 total cpu time spent up to now is 115.3 secs Computing kpt #: 400 total cpu time spent up to now is 115.8 secs Computing kpt #: 401 total cpu time spent up to now is 116.2 secs Computing kpt #: 402 total cpu time spent up to now is 116.6 secs Computing kpt #: 403 total cpu time spent up to now is 117.0 secs Computing kpt #: 404 total cpu time spent up to now is 117.4 secs Computing kpt #: 405 total cpu time spent up to now is 117.9 secs Computing kpt #: 406 total cpu time spent up to now is 118.2 secs Computing kpt #: 407 total cpu time spent up to now is 118.6 secs Computing kpt #: 408 total cpu time spent up to now is 118.9 secs Computing kpt #: 409 total cpu time spent up to now is 119.1 secs Computing kpt #: 410 total cpu time spent up to now is 119.4 secs Computing kpt #: 411 total cpu time spent up to now is 119.7 secs Computing kpt #: 412 total cpu time spent up to now is 120.0 secs Computing kpt #: 413 total cpu time spent up to now is 120.4 secs Computing kpt #: 414 total cpu time spent up to now is 120.6 secs Computing kpt #: 415 total cpu time spent up to now is 120.9 secs Computing kpt #: 416 total cpu time spent up to now is 121.2 secs Computing kpt #: 417 total cpu time spent up to now is 121.6 secs Computing kpt #: 418 total cpu time spent up to now is 121.8 secs Computing kpt #: 419 total cpu time spent up to now is 122.2 secs Computing kpt #: 420 total cpu time spent up to now is 122.4 secs Computing kpt #: 421 total cpu time spent up to now is 122.8 secs Computing kpt #: 422 total cpu time spent up to now is 123.1 secs Computing kpt #: 423 total cpu time spent up to now is 123.5 secs Computing kpt #: 424 total cpu time spent up to now is 123.9 secs Computing kpt #: 425 total cpu time spent up to now is 124.1 secs Computing kpt #: 426 total cpu time spent up to now is 124.5 secs Computing kpt #: 427 total cpu time spent up to now is 124.9 secs Computing kpt #: 428 total cpu time spent up to now is 125.1 secs Computing kpt #: 429 total cpu time spent up to now is 125.3 secs Computing kpt #: 430 total cpu time spent up to now is 125.5 secs Computing kpt #: 431 total cpu time spent up to now is 125.7 secs Computing kpt #: 432 total cpu time spent up to now is 126.0 secs Computing kpt #: 433 total cpu time spent up to now is 126.2 secs Computing kpt #: 434 total cpu time spent up to now is 126.4 secs Computing kpt #: 435 total cpu time spent up to now is 126.6 secs Computing kpt #: 436 total cpu time spent up to now is 126.8 secs Computing kpt #: 437 total cpu time spent up to now is 127.0 secs Computing kpt #: 438 total cpu time spent up to now is 127.3 secs Computing kpt #: 439 total cpu time spent up to now is 127.5 secs Computing kpt #: 440 total cpu time spent up to now is 127.7 secs Computing kpt #: 441 total cpu time spent up to now is 127.9 secs Computing kpt #: 442 total cpu time spent up to now is 128.1 secs Computing kpt #: 443 total cpu time spent up to now is 128.3 secs Computing kpt #: 444 total cpu time spent up to now is 128.6 secs Computing kpt #: 445 total cpu time spent up to now is 128.8 secs Computing kpt #: 446 total cpu time spent up to now is 129.0 secs Computing kpt #: 447 total cpu time spent up to now is 129.2 secs Computing kpt #: 448 total cpu time spent up to now is 129.4 secs Computing kpt #: 449 total cpu time spent up to now is 129.7 secs Computing kpt #: 450 total cpu time spent up to now is 129.9 secs Computing kpt #: 451 total cpu time spent up to now is 130.2 secs Computing kpt #: 452 total cpu time spent up to now is 130.5 secs Computing kpt #: 453 total cpu time spent up to now is 130.8 secs Computing kpt #: 454 total cpu time spent up to now is 131.1 secs Computing kpt #: 455 total cpu time spent up to now is 131.4 secs Computing kpt #: 456 total cpu time spent up to now is 131.8 secs Computing kpt #: 457 total cpu time spent up to now is 132.1 secs Computing kpt #: 458 total cpu time spent up to now is 132.5 secs Computing kpt #: 459 total cpu time spent up to now is 132.9 secs Computing kpt #: 460 total cpu time spent up to now is 133.2 secs ethr = 3.57E-08, avg # of iterations = 24.0 total cpu time spent up to now is 133.2 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2667 PWs) bands (ev): 3.2022 3.2022 6.2950 6.2950 6.7372 6.7372 7.0156 7.0156 7.0569 7.0569 7.7073 7.7073 8.2812 8.2812 8.2912 8.2912 8.4427 8.4427 8.6472 8.6472 8.7539 8.7539 8.9425 8.9425 10.3471 10.3471 10.8081 10.8081 10.9216 10.9216 11.4448 11.4448 12.6278 12.6278 12.8232 12.8232 k = 0.0051 0.0156-0.0000 ( 2663 PWs) bands (ev): 3.2041 3.2041 6.2963 6.2963 6.7387 6.7387 7.0157 7.0157 7.0576 7.0576 7.7077 7.7077 8.2809 8.2809 8.2907 8.2907 8.4429 8.4429 8.6472 8.6472 8.7536 8.7536 8.9423 8.9423 10.3440 10.3440 10.8075 10.8075 10.9221 10.9221 11.4444 11.4444 12.6272 12.6272 12.8282 12.8282 k = 0.0103 0.0312-0.0000 ( 2663 PWs) bands (ev): 3.2099 3.2099 6.3004 6.3004 6.7432 6.7432 7.0158 7.0158 7.0597 7.0597 7.7088 7.7088 8.2795 8.2795 8.2891 8.2891 8.4433 8.4433 8.6473 8.6473 8.7526 8.7526 8.9417 8.9417 10.3350 10.3350 10.8056 10.8056 10.9238 10.9238 11.4434 11.4434 12.6255 12.6255 12.8433 12.8433 k = 0.0154 0.0468-0.0000 ( 2667 PWs) bands (ev): 3.2194 3.2194 6.3073 6.3073 6.7506 6.7506 7.0159 7.0159 7.0631 7.0631 7.7107 7.7107 8.2771 8.2771 8.2869 8.2869 8.4439 8.4439 8.6475 8.6475 8.7508 8.7508 8.9406 8.9406 10.3200 10.3200 10.8026 10.8026 10.9266 10.9266 11.4420 11.4420 12.6225 12.6225 12.8657 12.8657 k = 0.0205 0.0624-0.0000 ( 2659 PWs) bands (ev): 3.2328 3.2328 6.3168 6.3168 6.7609 6.7609 7.0161 7.0161 7.0680 7.0680 7.7134 7.7134 8.2733 8.2733 8.2844 8.2844 8.4448 8.4448 8.6477 8.6477 8.7484 8.7484 8.9391 8.9391 10.2994 10.2994 10.7983 10.7983 10.9305 10.9305 11.4409 11.4409 12.6181 12.6181 12.7982 12.7982 k = 0.0257 0.0780-0.0000 ( 2657 PWs) bands (ev): 3.2499 3.2499 6.3291 6.3291 6.7740 6.7740 7.0163 7.0163 7.0742 7.0742 7.7168 7.7168 8.2679 8.2679 8.2816 8.2816 8.4457 8.4457 8.6480 8.6480 8.7454 8.7454 8.9372 8.9372 10.2732 10.2732 10.7929 10.7929 10.9354 10.9354 11.4407 11.4407 12.6103 12.6103 12.7117 12.7117 k = 0.0308 0.0936-0.0000 ( 2659 PWs) bands (ev): 3.2708 3.2708 6.3440 6.3440 6.7897 6.7897 7.0164 7.0164 7.0816 7.0816 7.7208 7.7208 8.2609 8.2609 8.2788 8.2788 8.4467 8.4467 8.6484 8.6484 8.7418 8.7418 8.9350 8.9350 10.2420 10.2420 10.7863 10.7863 10.9414 10.9414 11.4420 11.4420 12.5797 12.5797 12.6383 12.6383 k = 0.0359 0.1092-0.0000 ( 2667 PWs) bands (ev): 3.2955 3.2955 6.3616 6.3616 6.8080 6.8080 7.0167 7.0167 7.0903 7.0903 7.7254 7.7254 8.2526 8.2526 8.2757 8.2757 8.4476 8.4476 8.6487 8.6487 8.7376 8.7376 8.9321 8.9321 10.2061 10.2061 10.7785 10.7785 10.9484 10.9484 11.4452 11.4452 12.4898 12.4898 12.6179 12.6179 k = 0.0410 0.1248-0.0000 ( 2663 PWs) bands (ev): 3.3238 3.3238 6.3819 6.3819 6.8287 6.8287 7.0170 7.0170 7.1002 7.1002 7.7307 7.7307 8.2432 8.2432 8.2723 8.2723 8.4484 8.4484 8.6492 8.6492 8.7329 8.7329 8.9289 8.9289 10.1661 10.1661 10.7696 10.7696 10.9564 10.9564 11.4509 11.4509 12.3823 12.3823 12.6110 12.6110 k = 0.0462 0.1404-0.0000 ( 2667 PWs) bands (ev): 3.3558 3.3558 6.4047 6.4047 6.8517 6.8517 7.0174 7.0174 7.1110 7.1110 7.7365 7.7365 8.2327 8.2327 8.2686 8.2686 8.4491 8.4491 8.6496 8.6496 8.7278 8.7278 8.9252 8.9252 10.1225 10.1225 10.7595 10.7595 10.9652 10.9652 11.4592 11.4592 12.2703 12.2703 12.6065 12.6065 k = 0.0513 0.1560-0.0000 ( 2663 PWs) bands (ev): 3.3915 3.3915 6.4301 6.4301 6.8767 6.8767 7.0179 7.0179 7.1227 7.1227 7.7428 7.7428 8.2212 8.2212 8.2646 8.2646 8.4496 8.4496 8.6499 8.6499 8.7225 8.7225 8.9211 8.9211 10.0761 10.0761 10.7484 10.7484 10.9749 10.9749 11.4704 11.4704 12.1565 12.1565 12.6034 12.6034 k = 0.0564 0.1716-0.0000 ( 2665 PWs) bands (ev): 3.4307 3.4307 6.4579 6.4579 6.9034 6.9034 7.0187 7.0187 7.1351 7.1351 7.7496 7.7496 8.2087 8.2087 8.2603 8.2603 8.4499 8.4499 8.6498 8.6498 8.7172 8.7172 8.9165 8.9165 10.0273 10.0273 10.7361 10.7361 10.9851 10.9851 11.4845 11.4845 12.0421 12.0421 12.6017 12.6017 k = 0.0616 0.1872-0.0000 ( 2661 PWs) bands (ev): 3.4734 3.4734 6.4883 6.4883 6.9316 6.9316 7.0197 7.0197 7.1480 7.1480 7.7568 7.7568 8.1955 8.1955 8.2556 8.2556 8.4499 8.4499 8.6493 8.6493 8.7124 8.7124 8.9114 8.9114 9.9769 9.9769 10.7230 10.7230 10.9959 10.9959 11.5015 11.5015 11.9284 11.9284 12.6015 12.6015 k = 0.0667 0.2028-0.0000 ( 2661 PWs) bands (ev): 3.5196 3.5196 6.5210 6.5210 6.9610 6.9610 7.0211 7.0211 7.1613 7.1613 7.7642 7.7642 8.1813 8.1813 8.2505 8.2505 8.4497 8.4497 8.6477 8.6477 8.7085 8.7085 8.9059 8.9059 9.9255 9.9255 10.7089 10.7089 11.0066 11.0066 11.5211 11.5211 11.8162 11.8162 12.6031 12.6031 k = 0.0718 0.2184-0.0000 ( 2665 PWs) bands (ev): 3.5692 3.5692 6.5561 6.5561 6.9910 6.9910 7.0232 7.0232 7.1748 7.1748 7.7719 7.7719 8.1663 8.1663 8.2451 8.2451 8.4492 8.4492 8.6449 8.6449 8.7059 8.7059 8.8999 8.8999 9.8737 9.8737 10.6939 10.6939 11.0166 11.0166 11.5430 11.5430 11.7071 11.7071 12.6067 12.6067 k = 0.0770 0.2340-0.0000 ( 2667 PWs) bands (ev): 3.6222 3.6222 6.5934 6.5934 7.0171 7.0171 7.0303 7.0303 7.1882 7.1882 7.7797 7.7797 8.1504 8.1504 8.2392 8.2392 8.4485 8.4485 8.6404 8.6404 8.7053 8.7053 8.8934 8.8934 9.8219 9.8219 10.6782 10.6782 11.0249 11.0249 11.5626 11.5626 11.6069 11.6069 12.6124 12.6124 k = 0.0821 0.2496-0.0000 ( 2671 PWs) bands (ev): 3.6784 3.6784 6.6329 6.6329 7.0244 7.0244 7.0568 7.0568 7.2013 7.2013 7.7877 7.7877 8.1337 8.1337 8.2331 8.2331 8.4476 8.4476 8.6343 8.6343 8.7066 8.7066 8.8866 8.8866 9.7707 9.7707 10.6618 10.6618 11.0290 11.0290 11.4983 11.4983 11.5996 11.5996 12.6203 12.6203 k = 0.0872 0.2652-0.0000 ( 2679 PWs) bands (ev): 3.7378 3.7378 6.6743 6.6743 7.0278 7.0278 7.0878 7.0878 7.2139 7.2139 7.7956 7.7956 8.1161 8.1161 8.2266 8.2266 8.4467 8.4467 8.6269 8.6269 8.7097 8.7097 8.8793 8.8793 9.7206 9.7206 10.6448 10.6448 11.0246 11.0246 11.4121 11.4121 11.6274 11.6274 12.6252 12.6252 k = 0.0923 0.2808-0.0000 ( 2677 PWs) bands (ev): 3.8004 3.8004 6.7177 6.7177 7.0313 7.0313 7.1189 7.1189 7.2259 7.2259 7.8035 7.8035 8.0977 8.0977 8.2199 8.2199 8.4458 8.4458 8.6187 8.6187 8.7146 8.7146 8.8716 8.8716 9.6719 9.6719 10.6272 10.6272 11.0046 11.0046 11.3436 11.3436 11.6579 11.6579 12.5635 12.5635 k = 0.0975 0.2964-0.0000 ( 2677 PWs) bands (ev): 3.8659 3.8659 6.7627 6.7627 7.0352 7.0352 7.1495 7.1495 7.2369 7.2369 7.8113 7.8113 8.0784 8.0784 8.2128 8.2128 8.4450 8.4450 8.6099 8.6099 8.7209 8.7209 8.8636 8.8636 9.6250 9.6250 10.6092 10.6092 10.9616 10.9616 11.3012 11.3012 11.6901 11.6901 12.4936 12.4937 k = 0.1026 0.3120-0.0000 ( 2677 PWs) bands (ev): 3.9344 3.9344 6.8093 6.8093 7.0398 7.0398 7.1792 7.1792 7.2468 7.2468 7.8189 7.8189 8.0583 8.0583 8.2054 8.2054 8.4444 8.4444 8.6011 8.6011 8.7284 8.7284 8.8553 8.8553 9.5802 9.5802 10.5908 10.5908 10.8961 10.8961 11.2846 11.2846 11.7232 11.7232 12.4254 12.4254 k = 0.1077 0.3276-0.0000 ( 2673 PWs) bands (ev): 4.0057 4.0057 6.8571 6.8571 7.0450 7.0450 7.2076 7.2076 7.2552 7.2552 7.8263 7.8263 8.0374 8.0374 8.1977 8.1977 8.4442 8.4442 8.5926 8.5926 8.7369 8.7369 8.8469 8.8469 9.5377 9.5377 10.5720 10.5721 10.8160 10.8160 11.2862 11.2862 11.7569 11.7569 12.3590 12.3590 k = 0.1129 0.3432-0.0000 ( 2671 PWs) bands (ev): 4.0797 4.0797 6.9056 6.9056 7.0512 7.0512 7.2345 7.2345 7.2621 7.2621 7.8333 7.8333 8.0157 8.0157 8.1898 8.1898 8.4444 8.4444 8.5847 8.5847 8.7463 8.7463 8.8386 8.8386 9.4976 9.4976 10.5529 10.5529 10.7287 10.7287 11.2989 11.2989 11.7906 11.7906 12.2947 12.2947 k = 0.1180 0.3588-0.0000 ( 2671 PWs) bands (ev): 4.1564 4.1564 6.9542 6.9542 7.0588 7.0588 7.2597 7.2597 7.2672 7.2672 7.8397 7.8397 7.9932 7.9932 8.1816 8.1816 8.4452 8.4452 8.5778 8.5778 8.7561 8.7561 8.8306 8.8306 9.4601 9.4601 10.5329 10.5329 10.6390 10.6390 11.3182 11.3182 11.8237 11.8237 12.2328 12.2328 k = 0.1231 0.3744-0.0000 ( 2673 PWs) bands (ev): 4.2355 4.2355 7.0011 7.0011 7.0691 7.0691 7.2699 7.2699 7.2834 7.2834 7.8456 7.8456 7.9703 7.9703 8.1733 8.1733 8.4467 8.4467 8.5723 8.5723 8.7653 8.7653 8.8238 8.8238 9.4252 9.4252 10.5084 10.5084 10.5529 10.5529 11.3421 11.3421 11.8555 11.8555 12.1732 12.1732 k = 0.1283 0.3900-0.0000 ( 2675 PWs) bands (ev): 4.3170 4.3170 7.0406 7.0406 7.0873 7.0873 7.2708 7.2708 7.3052 7.3052 7.8507 7.8507 7.9471 7.9471 8.1647 8.1647 8.4490 8.4490 8.5685 8.5685 8.7722 8.7722 8.8200 8.8200 9.3929 9.3929 10.4475 10.4475 10.5038 10.5038 11.3693 11.3693 11.8853 11.8853 12.1162 12.1162 k = 0.1334 0.4056-0.0000 ( 2675 PWs) bands (ev): 4.4007 4.4007 7.0638 7.0638 7.1213 7.1213 7.2695 7.2695 7.3256 7.3256 7.8544 7.8544 7.9242 7.9242 8.1560 8.1560 8.4523 8.4523 8.5668 8.5668 8.7740 8.7740 8.8220 8.8220 9.3631 9.3631 10.3612 10.3612 10.4812 10.4812 11.3992 11.3992 11.9121 11.9121 12.0619 12.0619 k = 0.1385 0.4212-0.0000 ( 2675 PWs) bands (ev): 4.4864 4.4864 7.0776 7.0776 7.1633 7.1633 7.2658 7.2658 7.3455 7.3455 7.8554 7.8554 7.9031 7.9031 8.1471 8.1471 8.4568 8.4568 8.5674 8.5674 8.7702 8.7702 8.8300 8.8300 9.3358 9.3358 10.2742 10.2742 10.4610 10.4610 11.4313 11.4313 11.9346 11.9346 12.0111 12.0111 k = 0.1436 0.4368-0.0000 ( 2677 PWs) bands (ev): 4.5741 4.5741 7.0891 7.0891 7.2039 7.2039 7.2599 7.2599 7.3661 7.3661 7.8497 7.8497 7.8879 7.8879 8.1381 8.1381 8.4627 8.4627 8.5705 8.5705 8.7632 8.7632 8.8417 8.8417 9.3109 9.3109 10.1887 10.1887 10.4412 10.4412 11.4654 11.4654 11.9435 11.9435 11.9720 11.9720 k = 0.1488 0.4524-0.0000 ( 2681 PWs) bands (ev): 4.6634 4.6634 7.1005 7.1005 7.2375 7.2375 7.2530 7.2530 7.3895 7.3895 7.8339 7.8339 7.8822 7.8822 8.1290 8.1290 8.4702 8.4702 8.5764 8.5764 8.7549 8.7549 8.8552 8.8552 9.2882 9.2882 10.1054 10.1054 10.4214 10.4214 11.5013 11.5013 11.9087 11.9087 11.9739 11.9739 k = 0.1539 0.4680-0.0000 ( 2683 PWs) bands (ev): 4.7543 4.7543 7.1122 7.1122 7.2392 7.2392 7.2671 7.2671 7.4175 7.4175 7.8128 7.8128 7.8815 7.8815 8.1198 8.1198 8.4797 8.4797 8.5852 8.5852 8.7460 8.7460 8.8695 8.8695 9.2674 9.2674 10.0244 10.0244 10.4013 10.4013 11.5389 11.5389 11.8660 11.8660 11.9804 11.9804 k = 0.1590 0.4836-0.0000 ( 2683 PWs) bands (ev): 4.8464 4.8464 7.1244 7.1244 7.2269 7.2269 7.2837 7.2837 7.4504 7.4504 7.7902 7.7902 7.8819 7.8819 8.1104 8.1104 8.4914 8.4914 8.5969 8.5969 8.7372 8.7372 8.8841 8.8841 9.2486 9.2486 9.9459 9.9459 10.3811 10.3811 11.5780 11.5780 11.8249 11.8249 11.9809 11.9809 k = 0.1642 0.4992-0.0000 ( 2687 PWs) bands (ev): 4.9396 4.9396 7.1370 7.1370 7.2125 7.2125 7.2925 7.2925 7.4864 7.4864 7.7675 7.7675 7.8823 7.8823 8.1009 8.1009 8.5053 8.5053 8.6115 8.6115 8.7289 8.7289 8.8987 8.8987 9.2315 9.2315 9.8701 9.8701 10.3605 10.3605 11.6186 11.6186 11.7863 11.7863 11.9744 11.9744 k = 0.1693 0.5148-0.0000 ( 2691 PWs) bands (ev): 5.0335 5.0335 7.1497 7.1497 7.1969 7.1969 7.2951 7.2951 7.5230 7.5230 7.7451 7.7451 7.8823 7.8823 8.0913 8.0913 8.5214 8.5214 8.6290 8.6290 8.7219 8.7219 8.9130 8.9130 9.2159 9.2159 9.7971 9.7971 10.3394 10.3394 11.6606 11.6606 11.7502 11.7502 11.9604 11.9604 k = 0.1744 0.5304-0.0000 ( 2695 PWs) bands (ev): 5.1278 5.1278 7.1589 7.1589 7.1841 7.1841 7.2931 7.2931 7.5583 7.5583 7.7237 7.7237 7.8816 7.8816 8.0817 8.0817 8.5393 8.5393 8.6483 8.6483 8.7175 8.7175 8.9268 8.9268 9.2017 9.2017 9.7268 9.7268 10.3179 10.3179 11.7024 11.7024 11.7181 11.7181 11.9387 11.9387 k = 0.1796 0.5460-0.0000 ( 2701 PWs) bands (ev): 5.2222 5.2222 7.1511 7.1511 7.1877 7.1877 7.2875 7.2875 7.5909 7.5909 7.7032 7.7032 7.8802 7.8802 8.0721 8.0721 8.5585 8.5585 8.6658 8.6658 8.7202 8.7202 8.9402 8.9402 9.1888 9.1888 9.6594 9.6594 10.2959 10.2959 11.6849 11.6849 11.7490 11.7490 11.9099 11.9099 k = 0.1847 0.5616-0.0000 ( 2701 PWs) bands (ev): 5.3162 5.3162 7.1331 7.1331 7.2016 7.2016 7.2792 7.2792 7.6196 7.6196 7.6844 7.6844 7.8781 7.8781 8.0626 8.0626 8.5781 8.5781 8.6745 8.6745 8.7374 8.7374 8.9532 8.9532 9.1771 9.1771 9.5950 9.5950 10.2733 10.2733 11.6565 11.6565 11.7935 11.7935 11.8751 11.8751 k = 0.1898 0.5772-0.0000 ( 2709 PWs) bands (ev): 5.4093 5.4093 7.1131 7.1131 7.2177 7.2177 7.2687 7.2687 7.6406 7.6406 7.6702 7.6702 7.8752 7.8752 8.0531 8.0531 8.5973 8.5973 8.6758 8.6758 8.7680 8.7680 8.9660 8.9660 9.1665 9.1665 9.5335 9.5335 10.2503 10.2503 11.6304 11.6304 11.8202 11.8202 11.8532 11.8532 k = 0.1950 0.5928-0.0000 ( 2705 PWs) bands (ev): 5.5010 5.5010 7.0930 7.0930 7.2341 7.2341 7.2571 7.2571 7.6389 7.6389 7.6760 7.6760 7.8715 7.8715 8.0438 8.0438 8.6145 8.6145 8.6764 8.6764 8.8056 8.8056 8.9797 8.9797 9.1571 9.1571 9.4750 9.4750 10.2268 10.2268 11.6067 11.6067 11.7799 11.7799 11.8940 11.8940 k = 0.2001 0.6084-0.0000 ( 2701 PWs) bands (ev): 5.5905 5.5905 7.0734 7.0734 7.2383 7.2383 7.2570 7.2570 7.6244 7.6244 7.6914 7.6914 7.8672 7.8672 8.0346 8.0346 8.6271 8.6271 8.6809 8.6809 8.8453 8.8453 8.9959 8.9959 9.1489 9.1489 9.4196 9.4196 10.2031 10.2031 11.5853 11.5853 11.7285 11.7285 11.9425 11.9425 k = 0.2052 0.6240-0.0000 ( 2705 PWs) bands (ev): 5.6771 5.6771 7.0551 7.0551 7.2246 7.2246 7.2743 7.2743 7.6090 7.6090 7.7049 7.7049 7.8622 7.8622 8.0258 8.0258 8.6332 8.6332 8.6919 8.6919 8.8820 8.8820 9.0184 9.0184 9.1420 9.1420 9.3673 9.3673 10.1793 10.1793 11.5659 11.5659 11.6730 11.6730 11.9925 11.9925 k = 0.2103 0.6396-0.0000 ( 2713 PWs) bands (ev): 5.7599 5.7599 7.0388 7.0388 7.2083 7.2083 7.2936 7.2936 7.5940 7.5940 7.7152 7.7152 7.8565 7.8565 8.0172 8.0172 8.6342 8.6342 8.7083 8.7083 8.9097 8.9097 9.0512 9.0512 9.1368 9.1368 9.3180 9.3180 10.1559 10.1559 11.5477 11.5477 11.6155 11.6155 12.0437 12.0437 k = 0.2155 0.6552-0.0000 ( 2709 PWs) bands (ev): 5.8376 5.8376 7.0254 7.0254 7.1911 7.1911 7.3135 7.3135 7.5799 7.5799 7.7223 7.7223 7.8504 7.8504 8.0089 8.0089 8.6331 8.6331 8.7274 8.7274 8.9264 8.9264 9.0941 9.0941 9.1347 9.1347 9.2719 9.2719 10.1336 10.1336 11.5259 11.5259 11.5616 11.5616 12.0957 12.0957 k = 0.2206 0.6708-0.0000 ( 2703 PWs) bands (ev): 5.9093 5.9093 7.0157 7.0157 7.1732 7.1732 7.3339 7.3339 7.5665 7.5665 7.7264 7.7264 7.8439 7.8439 8.0011 8.0011 8.6313 8.6313 8.7475 8.7475 8.9344 8.9344 9.1242 9.1242 9.1551 9.1551 9.2289 9.2289 10.1130 10.1130 11.4802 11.4802 11.5325 11.5325 12.1485 12.1485 k = 0.2257 0.6864-0.0000 ( 2705 PWs) bands (ev): 5.9735 5.9735 7.0105 7.0105 7.1549 7.1549 7.3545 7.3545 7.5539 7.5539 7.7276 7.7276 7.8371 7.8371 7.9937 7.9937 8.6296 8.6296 8.7677 8.7677 8.9363 8.9363 9.1282 9.1282 9.1890 9.1890 9.2076 9.2076 10.0954 10.0954 11.4198 11.4198 11.5195 11.5195 12.2019 12.2019 k = 0.2309 0.7020-0.0000 ( 2705 PWs) bands (ev): 6.0290 6.0290 7.0106 7.0106 7.1361 7.1361 7.3750 7.3750 7.5424 7.5424 7.7262 7.7262 7.8302 7.8302 7.9867 7.9867 8.6281 8.6281 8.7871 8.7871 8.9340 8.9340 9.1328 9.1328 9.1524 9.1524 9.2621 9.2621 10.0824 10.0824 11.3570 11.3570 11.5108 11.5108 12.2559 12.2559 k = 0.2360 0.7176-0.0000 ( 2697 PWs) bands (ev): 6.0747 6.0747 7.0166 7.0166 7.1173 7.1173 7.3951 7.3951 7.5318 7.5318 7.7225 7.7225 7.8234 7.8234 7.9801 7.9801 8.6272 8.6272 8.8052 8.8052 8.9283 8.9283 9.1188 9.1188 9.1413 9.1413 9.3132 9.3132 10.0760 10.0760 11.2941 11.2941 11.5048 11.5048 12.3103 12.3103 k = 0.2411 0.7332-0.0000 ( 2695 PWs) bands (ev): 6.1100 6.1100 7.0283 7.0283 7.0985 7.0985 7.4144 7.4144 7.5223 7.5223 7.7167 7.7167 7.8170 7.8170 7.9741 7.9741 8.6269 8.6269 8.8211 8.8211 8.9198 8.9198 9.0886 9.0886 9.1549 9.1549 9.3575 9.3575 10.0786 10.0786 11.2317 11.2317 11.5010 11.5010 12.3651 12.3651 k = 0.2463 0.7488-0.0000 ( 2703 PWs) bands (ev): 6.1346 6.1346 7.0445 7.0445 7.0805 7.0805 7.4325 7.4325 7.5140 7.5140 7.7088 7.7088 7.8112 7.8112 7.9685 7.9685 8.6272 8.6272 8.8338 8.8338 8.9089 8.9089 9.0615 9.0615 9.1744 9.1744 9.3922 9.3922 10.0925 10.0925 11.1705 11.1705 11.4993 11.4993 12.4200 12.4200 k = 0.2514 0.7644-0.0000 ( 2699 PWs) bands (ev): 6.1489 6.1489 7.0525 7.0525 7.0753 7.0753 7.4487 7.4487 7.5074 7.5074 7.6991 7.6991 7.8063 7.8063 7.9635 7.9635 8.6281 8.6281 8.8426 8.8426 8.8966 8.8966 9.0376 9.0376 9.2005 9.2005 9.4157 9.4157 10.1192 10.1192 11.1108 11.1108 11.4995 11.4995 12.4751 12.4751 k = 0.2565 0.7800-0.0000 ( 2707 PWs) bands (ev): 6.1539 6.1539 7.0367 7.0367 7.0969 7.0969 7.4616 7.4616 7.5033 7.5033 7.6876 7.6876 7.8028 7.8028 7.9591 7.9591 8.6296 8.6296 8.8454 8.8454 8.8847 8.8847 9.0171 9.0171 9.2330 9.2330 9.4280 9.4280 10.1589 10.1589 11.0529 11.0529 11.5016 11.5016 12.5302 12.5302 k = 0.2616 0.7956-0.0000 ( 2703 PWs) bands (ev): 6.1505 6.1505 7.0176 7.0176 7.1232 7.1232 7.4694 7.4694 7.5031 7.5031 7.6746 7.6746 7.8010 7.8010 7.9552 7.9552 8.6317 8.6317 8.8390 8.8390 8.8770 8.8770 8.9998 8.9998 9.2708 9.2708 9.4316 9.4316 10.2103 10.2103 10.9971 10.9971 11.5056 11.5056 12.5853 12.5853 k = 0.2668 0.8112-0.0000 ( 2697 PWs) bands (ev): 6.1400 6.1400 6.9979 6.9979 7.1500 7.1500 7.4717 7.4717 7.5069 7.5069 7.6600 7.6600 7.8013 7.8013 7.9520 7.9520 8.6345 8.6345 8.8231 8.8231 8.8744 8.8744 8.9860 8.9860 9.3098 9.3098 9.4322 9.4322 10.2712 10.2712 10.9435 10.9435 11.5113 11.5113 12.6400 12.6400 k = 0.2719 0.8268-0.0000 ( 2695 PWs) bands (ev): 6.1235 6.1235 6.9776 6.9776 7.1754 7.1754 7.4709 7.4709 7.5118 7.5118 7.6440 7.6440 7.8036 7.8036 7.9495 7.9495 8.6377 8.6377 8.8016 8.8016 8.8734 8.8734 8.9758 8.9758 9.3380 9.3380 9.4435 9.4435 10.3394 10.3394 10.8922 10.8922 11.5187 11.5187 12.6943 12.6943 k = 0.2770 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1019 6.1019 6.9569 6.9569 7.1985 7.1985 7.4691 7.4691 7.5156 7.5156 7.6266 7.6266 7.8081 7.8081 7.9477 7.9477 8.6414 8.6414 8.7766 8.7766 8.8724 8.8724 8.9692 8.9692 9.3407 9.3407 9.4818 9.4818 10.4127 10.4127 10.8434 10.8434 11.5277 11.5277 12.7481 12.7481 k = 0.2770 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1019 6.1019 6.9569 6.9569 7.1985 7.1985 7.4691 7.4691 7.5156 7.5156 7.6266 7.6266 7.8081 7.8081 7.9477 7.9477 8.6414 8.6414 8.7766 8.7766 8.8724 8.8724 8.9692 8.9692 9.3407 9.3407 9.4818 9.4818 10.4127 10.4127 10.8434 10.8434 11.5277 11.5277 12.7481 12.7481 k = 0.2607 0.8424-0.0000 ( 2700 PWs) bands (ev): 6.1089 6.1089 6.9608 6.9608 7.1947 7.1947 7.4694 7.4694 7.5140 7.5140 7.6323 7.6323 7.8062 7.8062 7.9487 7.9487 8.6402 8.6402 8.7821 8.7821 8.8749 8.8749 8.9714 8.9714 9.3390 9.3390 9.4706 9.4706 10.3917 10.3917 10.8562 10.8562 11.5230 11.5230 12.7336 12.7336 k = 0.2444 0.8424-0.0000 ( 2702 PWs) bands (ev): 6.1153 6.1153 6.9595 6.9595 7.1970 7.1970 7.4692 7.4692 7.5113 7.5113 7.6380 7.6380 7.8041 7.8041 7.9509 7.9509 8.6389 8.6389 8.7820 8.7820 8.8817 8.8817 8.9750 8.9750 9.3288 9.3288 9.4684 9.4684 10.3752 10.3752 10.8653 10.8653 11.5151 11.5151 12.7232 12.7233 k = 0.2281 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1211 6.1211 6.9533 6.9533 7.2047 7.2047 7.4685 7.4685 7.5077 7.5077 7.6437 7.6437 7.8018 7.8018 7.9541 7.9541 8.6376 8.6376 8.7773 8.7773 8.8923 8.8923 8.9798 8.9798 9.3120 9.3120 9.4731 9.4731 10.3636 10.3636 10.8705 10.8705 11.5041 11.5041 12.7172 12.7172 k = 0.2119 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1265 6.1265 6.9434 6.9434 7.2168 7.2168 7.4674 7.4674 7.5034 7.5034 7.6493 7.6493 7.7993 7.7993 7.9581 7.9581 8.6362 8.6362 8.7694 8.7694 8.9049 8.9049 8.9855 8.9855 9.2918 9.2918 9.4815 9.4815 10.3566 10.3566 10.8720 10.8720 11.4905 11.4905 12.7150 12.7150 k = 0.1956 0.8424-0.0000 ( 2697 PWs) bands (ev): 6.1314 6.1314 6.9309 6.9309 7.2318 7.2318 7.4658 7.4658 7.4987 7.4987 7.6547 7.6547 7.7967 7.7967 7.9627 7.9627 8.6348 8.6348 8.7595 8.7595 8.9184 8.9184 8.9920 8.9920 9.2704 9.2704 9.4916 9.4916 10.3541 10.3541 10.8701 10.8701 11.4746 11.4746 12.7161 12.7161 k = 0.1793 0.8424-0.0000 ( 2693 PWs) bands (ev): 6.1360 6.1360 6.9171 6.9171 7.2486 7.2486 7.4637 7.4637 7.4938 7.4938 7.6600 7.6600 7.7941 7.7941 7.9677 7.9677 8.6335 8.6335 8.7487 8.7487 8.9321 8.9321 8.9991 8.9991 9.2488 9.2488 9.5020 9.5020 10.3558 10.3558 10.8649 10.8649 11.4569 11.4569 12.7168 12.7169 k = 0.1630 0.8424-0.0000 ( 2693 PWs) bands (ev): 6.1402 6.1402 6.9028 6.9028 7.2661 7.2661 7.4612 7.4612 7.4889 7.4889 7.6650 7.6650 7.7914 7.7914 7.9729 7.9729 8.6321 8.6321 8.7373 8.7373 8.9455 8.9455 9.0065 9.0065 9.2279 9.2279 9.5123 9.5123 10.3615 10.3615 10.8568 10.8568 11.4382 11.4382 12.6925 12.6926 k = 0.1467 0.8424-0.0000 ( 2696 PWs) bands (ev): 6.1442 6.1442 6.8887 6.8887 7.2837 7.2837 7.4583 7.4583 7.4843 7.4843 7.6698 7.6698 7.7889 7.7889 7.9780 7.9780 8.6307 8.6307 8.7260 8.7260 8.9583 8.9583 9.0140 9.0140 9.2081 9.2081 9.5220 9.5220 10.3705 10.3705 10.8461 10.8461 11.4190 11.4190 12.6423 12.6423 k = 0.1304 0.8424-0.0000 ( 2690 PWs) bands (ev): 6.1478 6.1478 6.8751 6.8751 7.3009 7.3009 7.4551 7.4551 7.4799 7.4799 7.6744 7.6744 7.7865 7.7865 7.9831 7.9831 8.6294 8.6294 8.7150 8.7150 8.9704 8.9704 9.0214 9.0214 9.1896 9.1896 9.5309 9.5309 10.3824 10.3824 10.8332 10.8332 11.4000 11.4000 12.5928 12.5928 k = 0.1141 0.8424-0.0000 ( 2692 PWs) bands (ev): 6.1510 6.1510 6.8626 6.8626 7.3172 7.3172 7.4517 7.4517 7.4758 7.4758 7.6787 7.6787 7.7842 7.7842 7.9879 7.9879 8.6281 8.6281 8.7046 8.7046 8.9815 8.9815 9.0285 9.0285 9.1726 9.1726 9.5390 9.5390 10.3966 10.3966 10.8186 10.8186 11.3818 11.3818 12.5475 12.5475 k = 0.0978 0.8424-0.0000 ( 2692 PWs) bands (ev): 6.1539 6.1539 6.8513 6.8513 7.3322 7.3322 7.4482 7.4482 7.4720 7.4720 7.6827 7.6827 7.7821 7.7821 7.9923 7.9923 8.6269 8.6269 8.6951 8.6951 8.9916 8.9916 9.0350 9.0350 9.1574 9.1574 9.5461 9.5461 10.4124 10.4124 10.8028 10.8028 11.3648 11.3648 12.5074 12.5074 k = 0.0815 0.8424-0.0000 ( 2692 PWs) bands (ev): 6.1564 6.1564 6.8414 6.8414 7.3458 7.3458 7.4450 7.4450 7.4684 7.4684 7.6863 7.6863 7.7803 7.7803 7.9961 7.9961 8.6257 8.6257 8.6867 8.6867 9.0006 9.0006 9.0409 9.0409 9.1439 9.1439 9.5522 9.5522 10.4290 10.4290 10.7865 10.7865 11.3496 11.3496 12.4728 12.4728 k = 0.0652 0.8424-0.0000 ( 2701 PWs) bands (ev): 6.1585 6.1585 6.8331 6.8331 7.3575 7.3575 7.4420 7.4420 7.4651 7.4651 7.6894 7.6894 7.7788 7.7788 7.9994 7.9994 8.6247 8.6247 8.6796 8.6796 9.0084 9.0084 9.0459 9.0459 9.1325 9.1325 9.5573 9.5573 10.4455 10.4455 10.7704 10.7704 11.3365 11.3365 12.4441 12.4441 k = 0.0489 0.8424-0.0000 ( 2701 PWs) bands (ev): 6.1601 6.1601 6.8266 6.8266 7.3673 7.3673 7.4396 7.4396 7.4623 7.4623 7.6920 7.6920 7.7775 7.7775 8.0020 8.0020 8.6237 8.6237 8.6739 8.6739 9.0148 9.0148 9.0499 9.0499 9.1231 9.1231 9.5613 9.5613 10.4606 10.4606 10.7557 10.7557 11.3260 11.3260 12.4215 12.4215 k = 0.0326 0.8424-0.0000 ( 2705 PWs) bands (ev): 6.1613 6.1613 6.8218 6.8218 7.3746 7.3746 7.4377 7.4377 7.4600 7.4600 7.6939 7.6939 7.7766 7.7766 8.0039 8.0039 8.6230 8.6230 8.6698 8.6698 9.0196 9.0196 9.0528 9.0528 9.1162 9.1162 9.5641 9.5641 10.4732 10.4732 10.7435 10.7435 11.3183 11.3183 12.4052 12.4053 k = 0.0163 0.8424-0.0000 ( 2707 PWs) bands (ev): 6.1620 6.1620 6.8189 6.8189 7.3792 7.3792 7.4365 7.4365 7.4585 7.4585 7.6951 7.6951 7.7760 7.7760 8.0051 8.0051 8.6226 8.6226 8.6674 8.6674 9.0227 9.0227 9.0546 9.0546 9.1119 9.1119 9.5659 9.5659 10.4815 10.4815 10.7353 10.7353 11.3136 11.3136 12.3954 12.3954 k = 0.0000 0.8424-0.0000 ( 2708 PWs) bands (ev): 6.1623 6.1623 6.8180 6.8180 7.3808 7.3808 7.4360 7.4360 7.4579 7.4579 7.6955 7.6955 7.7758 7.7758 8.0054 8.0054 8.6224 8.6224 8.6666 8.6666 9.0237 9.0237 9.0552 9.0552 9.1104 9.1104 9.5665 9.5665 10.4845 10.4845 10.7325 10.7325 11.3120 11.3120 12.3922 12.3922 k = 0.0000 0.8424-0.0000 ( 2708 PWs) bands (ev): 6.1623 6.1623 6.8180 6.8180 7.3808 7.3808 7.4360 7.4360 7.4579 7.4579 7.6955 7.6955 7.7758 7.7758 8.0054 8.0054 8.6224 8.6224 8.6666 8.6666 9.0237 9.0237 9.0552 9.0552 9.1104 9.1104 9.5665 9.5665 10.4845 10.4845 10.7325 10.7325 11.3120 11.3120 12.3922 12.3922 k = 0.0000 0.8424 0.0164 ( 2706 PWs) bands (ev): 6.1616 6.1616 6.8186 6.8186 7.3685 7.3685 7.4447 7.4447 7.4627 7.4627 7.6951 7.6951 7.7769 7.7769 8.0067 8.0067 8.6225 8.6225 8.6669 8.6669 9.0127 9.0127 9.0639 9.0639 9.1105 9.1105 9.5665 9.5665 10.4809 10.4809 10.7356 10.7356 11.3121 11.3121 12.3885 12.3885 k = 0.0000 0.8424 0.0327 ( 2702 PWs) bands (ev): 6.1597 6.1597 6.8203 6.8203 7.3451 7.3451 7.4488 7.4488 7.4851 7.4851 7.6939 7.6939 7.7801 7.7801 8.0105 8.0105 8.6225 8.6225 8.6681 8.6681 8.9919 8.9919 9.0781 9.0781 9.1106 9.1106 9.5665 9.5665 10.4702 10.4702 10.7449 10.7449 11.3125 11.3125 12.3779 12.3779 k = 0.0000 0.8424 0.0491 ( 2702 PWs) bands (ev): 6.1566 6.1566 6.8231 6.8231 7.3202 7.3202 7.4477 7.4477 7.5163 7.5163 7.6921 7.6921 7.7852 7.7852 8.0167 8.0167 8.6221 8.6221 8.6699 8.6699 8.9686 8.9686 9.0913 9.0913 9.1110 9.1110 9.5666 9.5666 10.4528 10.4528 10.7600 10.7600 11.3130 11.3130 12.3607 12.3607 k = 0.0000 0.8424 0.0654 ( 2700 PWs) bands (ev): 6.1524 6.1524 6.8271 6.8271 7.2957 7.2957 7.4451 7.4451 7.5504 7.5504 7.6898 7.6898 7.7922 7.7922 8.0253 8.0253 8.6204 8.6204 8.6723 8.6723 8.9450 8.9450 9.1021 9.1021 9.1120 9.1120 9.5668 9.5668 10.4292 10.4292 10.7802 10.7802 11.3133 11.3133 12.3378 12.3378 k = 0.0000 0.8424 0.0818 ( 2698 PWs) bands (ev): 6.1472 6.1472 6.8319 6.8319 7.2722 7.2722 7.4415 7.4415 7.5857 7.5857 7.6877 7.6877 7.8009 7.8009 8.0361 8.0361 8.6163 8.6163 8.6752 8.6752 8.9233 8.9233 9.1086 9.1086 9.1158 9.1158 9.5671 9.5671 10.4001 10.4001 10.8048 10.8048 11.3133 11.3133 12.3101 12.3101 k = 0.0000 0.8424 0.0981 ( 2696 PWs) bands (ev): 6.1410 6.1410 6.8377 6.8377 7.2498 7.2498 7.4373 7.4373 7.6201 7.6201 7.6872 7.6872 7.8110 7.8110 8.0490 8.0490 8.6083 8.6083 8.6785 8.6785 8.9057 8.9057 9.1106 9.1106 9.1226 9.1226 9.5675 9.5675 10.3664 10.3664 10.8330 10.8330 11.3125 11.3125 12.2785 12.2785 k = 0.0000 0.8424 0.1145 ( 2692 PWs) bands (ev): 6.1342 6.1342 6.8441 6.8441 7.2287 7.2287 7.4324 7.4324 7.6470 7.6470 7.6947 7.6947 7.8227 7.8227 8.0638 8.0638 8.5948 8.5948 8.6825 8.6825 8.8943 8.8943 9.1119 9.1119 9.1290 9.1290 9.5683 9.5683 10.3287 10.3287 10.8637 10.8637 11.3110 11.3110 12.2442 12.2442 k = 0.0000 0.8424 0.1308 ( 2692 PWs) bands (ev): 6.1267 6.1267 6.8511 6.8511 7.2087 7.2087 7.4271 7.4271 7.6557 7.6557 7.7207 7.7207 7.8357 7.8357 8.0803 8.0803 8.5749 8.5749 8.6870 8.6870 8.8905 8.8905 9.1134 9.1134 9.1344 9.1344 9.5693 9.5693 10.2879 10.2879 10.8961 10.8961 11.3085 11.3085 12.2079 12.2079 k = 0.0000 0.8424 0.1472 ( 2692 PWs) bands (ev): 6.1188 6.1188 6.8583 6.8583 7.1901 7.1901 7.4213 7.4213 7.6535 7.6535 7.7572 7.7572 7.8501 7.8501 8.0982 8.0982 8.5490 8.5490 8.6923 8.6923 8.8946 8.8946 9.1154 9.1154 9.1387 9.1387 9.5708 9.5708 10.2447 10.2447 10.9291 10.9291 11.3049 11.3049 12.1707 12.1707 k = 0.0000 0.8424 0.1635 ( 2694 PWs) bands (ev): 6.1107 6.1107 6.8657 6.8657 7.1726 7.1726 7.4153 7.4153 7.6480 7.6480 7.7961 7.7961 7.8658 7.8658 8.1176 8.1176 8.5186 8.5186 8.6985 8.6985 8.9058 8.9058 9.1181 9.1181 9.1422 9.1422 9.5728 9.5728 10.1999 10.1999 10.9617 10.9617 11.3003 11.3003 12.1331 12.1331 k = 0.0000 0.8424 0.1799 ( 2688 PWs) bands (ev): 6.1025 6.1025 6.8728 6.8728 7.1562 7.1562 7.4091 7.4091 7.6407 7.6407 7.8348 7.8348 7.8835 7.8835 8.1380 8.1380 8.4854 8.4854 8.7055 8.7055 8.9230 8.9230 9.1217 9.1217 9.1450 9.1450 9.5755 9.5755 10.1540 10.1540 10.9931 10.9931 11.2947 11.2947 12.0960 12.0960 k = 0.0000 0.8424 0.1962 ( 2690 PWs) bands (ev): 6.0945 6.0945 6.8793 6.8793 7.1411 7.1411 7.4029 7.4029 7.6322 7.6322 7.8703 7.8703 7.9047 7.9047 8.1594 8.1594 8.4510 8.4510 8.7133 8.7133 8.9452 8.9452 9.1265 9.1265 9.1472 9.1472 9.5788 9.5788 10.1077 10.1077 11.0223 11.0223 11.2881 11.2881 12.0598 12.0598 k = 0.0000 0.8424 0.2126 ( 2688 PWs) bands (ev): 6.0866 6.0866 6.8849 6.8849 7.1270 7.1270 7.3967 7.3967 7.6229 7.6229 7.8987 7.8987 7.9324 7.9324 8.1815 8.1815 8.4171 8.4171 8.7218 8.7218 8.9713 8.9713 9.1327 9.1327 9.1491 9.1491 9.5827 9.5827 10.0619 10.0619 11.0487 11.0487 11.2806 11.2806 12.0250 12.0250 k = 0.0000 0.8424 0.2289 ( 2688 PWs) bands (ev): 6.0792 6.0792 6.8891 6.8891 7.1141 7.1141 7.3906 7.3906 7.6129 7.6129 7.9205 7.9205 7.9651 7.9651 8.2041 8.2041 8.3849 8.3849 8.7310 8.7310 9.0006 9.0006 9.1403 9.1403 9.1512 9.1512 9.5873 9.5873 10.0170 10.0170 11.0714 11.0714 11.2724 11.2724 11.9919 11.9919 k = 0.0000 0.8424 0.2453 ( 2688 PWs) bands (ev): 6.0723 6.0723 6.8915 6.8915 7.1023 7.1023 7.3847 7.3847 7.6025 7.6025 7.9394 7.9394 7.9982 7.9982 8.2267 8.2267 8.3558 8.3558 8.7409 8.7409 9.0320 9.0320 9.1465 9.1465 9.1573 9.1573 9.5923 9.5923 9.9741 9.9741 11.0899 11.0899 11.2635 11.2635 11.9607 11.9607 k = 0.0000 0.8424 0.2616 ( 2690 PWs) bands (ev): 6.0661 6.0661 6.8917 6.8917 7.0915 7.0915 7.3788 7.3788 7.5921 7.5921 7.9569 7.9569 8.0292 8.0292 8.2485 8.2485 8.3312 8.3312 8.7515 8.7515 9.0645 9.0645 9.1483 9.1483 9.1714 9.1714 9.5973 9.5973 9.9343 9.9343 11.1038 11.1038 11.2539 11.2539 11.9315 11.9315 k = 0.0000 0.8424 0.2780 ( 2688 PWs) bands (ev): 6.0607 6.0607 6.8891 6.8891 7.0817 7.0817 7.3729 7.3729 7.5824 7.5824 7.9731 7.9731 8.0572 8.0572 8.2665 8.2665 8.3143 8.3143 8.7626 8.7626 9.0964 9.0964 9.1489 9.1489 9.1922 9.1922 9.6015 9.6015 9.8989 9.8989 11.1129 11.1129 11.2439 11.2439 11.9041 11.9041 k = 0.0000 0.8424 0.2943 ( 2690 PWs) bands (ev): 6.0562 6.0562 6.8835 6.8835 7.0730 7.0730 7.3667 7.3667 7.5741 7.5741 7.9877 7.9877 8.0816 8.0816 8.2728 8.2728 8.3130 8.3130 8.7741 8.7741 9.1253 9.1253 9.1498 9.1498 9.2202 9.2202 9.6038 9.6038 9.8698 9.8698 11.1171 11.1171 11.2334 11.2334 11.8781 11.8781 k = 0.0000 0.8424 0.3107 ( 2692 PWs) bands (ev): 6.0527 6.0527 6.8745 6.8745 7.0654 7.0654 7.3598 7.3598 7.5678 7.5678 8.0004 8.0004 8.1024 8.1024 8.2687 8.2687 8.3259 8.3259 8.7859 8.7859 9.1420 9.1420 9.1601 9.1601 9.2556 9.2556 9.6029 9.6029 9.8491 9.8491 11.1167 11.1167 11.2226 11.2226 11.8530 11.8530 k = 0.0000 0.8424 0.3270 ( 2692 PWs) bands (ev): 6.0504 6.0504 6.8620 6.8620 7.0587 7.0587 7.3518 7.3518 7.5646 7.5646 8.0108 8.0108 8.1195 8.1195 8.2655 8.2655 8.3413 8.3413 8.7978 8.7978 9.1433 9.1433 9.1838 9.1838 9.2972 9.2972 9.5981 9.5981 9.8386 9.8386 11.1119 11.1119 11.2115 11.2115 11.8281 11.8281 k = 0.0000 0.8424 0.3434 ( 2692 PWs) bands (ev): 6.0492 6.0492 6.8458 6.8458 7.0531 7.0531 7.3424 7.3424 7.5649 7.5649 8.0188 8.0188 8.1333 8.1333 8.2665 8.2665 8.3549 8.3549 8.8094 8.8094 9.1421 9.1421 9.2081 9.2081 9.3434 9.3434 9.5906 9.5906 9.8386 9.8386 11.1032 11.1032 11.2002 11.2002 11.8029 11.8029 k = 0.0000 0.8424 0.3597 ( 2692 PWs) bands (ev): 6.0494 6.0494 6.8262 6.8262 7.0484 7.0484 7.3315 7.3315 7.5691 7.5691 8.0246 8.0246 8.1442 8.1442 8.2717 8.2717 8.3659 8.3659 8.8205 8.8205 9.1403 9.1403 9.2306 9.2306 9.3927 9.3927 9.5837 9.5837 9.8479 9.8479 11.0910 11.0910 11.1888 11.1888 11.7764 11.7764 k = 0.0000 0.8424 0.3761 ( 2688 PWs) bands (ev): 6.0509 6.0509 6.8033 6.8033 7.0448 7.0448 7.3193 7.3193 7.5772 7.5772 8.0286 8.0286 8.1526 8.1526 8.2796 8.2796 8.3746 8.3746 8.8308 8.8308 9.1381 9.1381 9.2489 9.2489 9.4443 9.4443 9.5822 9.5822 9.8646 9.8646 11.0757 11.0757 11.1776 11.1776 11.7481 11.7481 k = 0.0000 0.8424 0.3924 ( 2684 PWs) bands (ev): 6.0539 6.0539 6.7774 6.7774 7.0421 7.0421 7.3058 7.3058 7.5890 7.5890 8.0316 8.0316 8.1590 8.1590 8.2882 8.2882 8.3819 8.3819 8.8398 8.8398 9.1356 9.1356 9.2599 9.2599 9.4972 9.4972 9.5913 9.5913 9.8867 9.8867 11.0578 11.0578 11.1665 11.1665 11.7174 11.7174 k = 0.0000 0.8424 0.4088 ( 2684 PWs) bands (ev): 6.0583 6.0583 6.7490 6.7490 7.0404 7.0404 7.2916 7.2916 7.6041 7.6041 8.0340 8.0340 8.1633 8.1633 8.2950 8.2950 8.3898 8.3898 8.8475 8.8475 9.1328 9.1328 9.2616 9.2616 9.5507 9.5507 9.6142 9.6142 9.9129 9.9129 11.0376 11.0376 11.1557 11.1557 11.6840 11.6840 k = 0.0000 0.8424 0.4251 ( 2684 PWs) bands (ev): 6.0642 6.0642 6.7185 6.7185 7.0396 7.0396 7.2768 7.2768 7.6220 7.6220 8.0362 8.0362 8.1658 8.1658 8.2972 8.2972 8.4008 8.4008 8.8537 8.8537 9.1297 9.1297 9.2543 9.2543 9.6045 9.6045 9.6510 9.6510 9.9418 9.9418 11.0154 11.0154 11.1454 11.1454 11.6477 11.6477 k = 0.0000 0.8424 0.4415 ( 2680 PWs) bands (ev): 6.0718 6.0718 6.6863 6.6863 7.0397 7.0397 7.2618 7.2618 7.6425 7.6425 8.0387 8.0387 8.1666 8.1666 8.2933 8.2933 8.4160 8.4160 8.8583 8.8583 9.1264 9.1264 9.2402 9.2402 9.6593 9.6593 9.6984 9.6984 9.9724 9.9724 10.9914 10.9914 11.1356 11.1356 11.6085 11.6085 k = 0.0000 0.8424 0.4578 ( 2684 PWs) bands (ev): 6.0809 6.0809 6.6528 6.6528 7.0407 7.0407 7.2468 7.2468 7.6651 7.6651 8.0415 8.0415 8.1658 8.1658 8.2838 8.2838 8.4351 8.4351 8.8611 8.8611 9.1229 9.1229 9.2221 9.2221 9.7160 9.7160 9.7521 9.7521 10.0041 10.0041 10.9658 10.9658 11.1263 11.1263 11.5666 11.5666 k = 0.0000 0.8424 0.4742 ( 2684 PWs) bands (ev): 6.0916 6.0916 6.6184 6.6184 7.0426 7.0426 7.2320 7.2320 7.6894 7.6894 8.0449 8.0449 8.1635 8.1635 8.2696 8.2696 8.4573 8.4573 8.8618 8.8618 9.1192 9.1192 9.2021 9.2021 9.7741 9.7741 9.8099 9.8099 10.0359 10.0359 10.9384 10.9384 11.1177 11.1177 11.5224 11.5224 k = 0.0000 0.8424 0.4905 ( 2688 PWs) bands (ev): 6.1041 6.1041 6.5835 6.5835 7.0453 7.0453 7.2173 7.2173 7.7153 7.7153 8.0488 8.0488 8.1597 8.1597 8.2520 8.2520 8.4816 8.4816 8.8603 8.8603 9.1154 9.1154 9.1818 9.1818 9.8318 9.8318 9.8712 9.8712 10.0673 10.0673 10.9092 10.9092 11.1100 11.1100 11.4765 11.4765 k = 0.0000 0.8424 0.5069 ( 2690 PWs) bands (ev): 6.1181 6.1181 6.5485 6.5485 7.0489 7.0489 7.2030 7.2030 7.7425 7.7425 8.0532 8.0532 8.1544 8.1544 8.2319 8.2319 8.5072 8.5072 8.8563 8.8563 9.1116 9.1116 9.1624 9.1624 9.8873 9.8873 9.9355 9.9355 10.0977 10.0977 10.8779 10.8779 11.1033 11.1033 11.4296 11.4296 k = 0.0000 0.8424 0.5232 ( 2688 PWs) bands (ev): 6.1339 6.1339 6.5136 6.5136 7.0533 7.0533 7.1890 7.1890 7.7708 7.7708 8.0580 8.0580 8.1474 8.1474 8.2106 8.2106 8.5339 8.5339 8.8496 8.8496 9.1078 9.1078 9.1448 9.1448 9.9395 9.9395 10.0016 10.0016 10.1269 10.1269 10.8441 10.8441 11.0980 11.0980 11.3826 11.3826 k = 0.0000 0.8424 0.5396 ( 2690 PWs) bands (ev): 6.1514 6.1514 6.4790 6.4790 7.0585 7.0585 7.1755 7.1755 7.7999 7.7999 8.0628 8.0628 8.1379 8.1379 8.1894 8.1894 8.5612 8.5612 8.8399 8.8399 9.1041 9.1041 9.1296 9.1296 9.9879 9.9879 10.0664 10.0664 10.1564 10.1564 10.8074 10.8074 11.0943 11.0943 11.3365 11.3365 k = 0.0000 0.8424 0.5559 ( 2688 PWs) bands (ev): 6.1705 6.1705 6.4451 6.4451 7.0645 7.0645 7.1625 7.1625 7.8297 7.8297 8.0671 8.0671 8.1253 8.1253 8.1704 8.1704 8.5888 8.5888 8.8270 8.8270 9.1005 9.1005 9.1171 9.1171 10.0321 10.0321 10.1220 10.1220 10.1922 10.1922 10.7673 10.7673 11.0926 11.0926 11.2924 11.2924 k = 0.0000 0.8424 0.5723 ( 2688 PWs) bands (ev): 6.1913 6.1913 6.4119 6.4119 7.0713 7.0713 7.1499 7.1499 7.8600 7.8600 8.0684 8.0684 8.1107 8.1107 8.1550 8.1550 8.6165 8.6165 8.8112 8.8112 9.0973 9.0973 9.1074 9.1074 10.0715 10.0715 10.1565 10.1565 10.2445 10.2445 10.7233 10.7233 11.0935 11.0935 11.2515 11.2515 k = 0.0000 0.8424 0.5886 ( 2686 PWs) bands (ev): 6.2137 6.2137 6.3798 6.3798 7.0788 7.0788 7.1380 7.1380 7.8907 7.8907 8.0598 8.0598 8.1019 8.1019 8.1430 8.1430 8.6441 8.6441 8.7925 8.7925 9.0945 9.0945 9.1004 9.1004 10.1057 10.1057 10.1736 10.1736 10.3082 10.3082 10.6750 10.6750 11.0974 11.0974 11.2145 11.2145 k = 0.0000 0.8424 0.6050 ( 2688 PWs) bands (ev): 6.2378 6.2378 6.3487 6.3487 7.0870 7.0870 7.1265 7.1265 7.9215 7.9215 8.0386 8.0386 8.1031 8.1031 8.1330 8.1330 8.6713 8.6713 8.7715 8.7715 9.0924 9.0924 9.0956 9.0956 10.1340 10.1340 10.1805 10.1805 10.3749 10.3749 10.6224 10.6224 11.1051 11.1051 11.1823 11.1823 k = 0.0000 0.8424 0.6213 ( 2692 PWs) bands (ev): 6.2633 6.2633 6.3189 6.3189 7.0959 7.0959 7.1157 7.1157 7.9522 7.9522 8.0116 8.0116 8.1087 8.1087 8.1241 8.1241 8.6980 8.6980 8.7484 8.7484 9.0912 9.0912 9.0927 9.0927 10.1560 10.1560 10.1796 10.1796 10.4409 10.4409 10.5655 10.5655 11.1169 11.1169 11.1553 11.1553 k = 0.0000 0.8424 0.6377 ( 2688 PWs) bands (ev): 6.2904 6.2904 6.2904 6.2904 7.1055 7.1055 7.1055 7.1055 7.9824 7.9824 7.9824 7.9824 8.1159 8.1159 8.1159 8.1159 8.7238 8.7238 8.7238 8.7238 9.0913 9.0913 9.0913 9.0913 10.1713 10.1713 10.1713 10.1713 10.5047 10.5047 10.5047 10.5047 11.1336 11.1336 11.1336 11.1336 k = 0.0000 0.8424 0.6377 ( 2688 PWs) bands (ev): 6.2904 6.2904 6.2904 6.2904 7.1055 7.1055 7.1055 7.1055 7.9824 7.9824 7.9824 7.9824 8.1159 8.1159 8.1159 8.1159 8.7238 8.7238 8.7238 8.7238 9.0913 9.0913 9.0913 9.0913 10.1713 10.1713 10.1713 10.1713 10.5047 10.5047 10.5047 10.5047 11.1336 11.1336 11.1336 11.1336 k = 0.0163 0.8424 0.6377 ( 2690 PWs) bands (ev): 6.2899 6.2899 6.2904 6.2904 7.1054 7.1054 7.1078 7.1078 7.9779 7.9779 7.9851 7.9851 8.1132 8.1132 8.1210 8.1210 8.7206 8.7206 8.7247 8.7247 9.0898 9.0898 9.0924 9.0924 10.1583 10.1583 10.1688 10.1688 10.5078 10.5078 10.5179 10.5179 11.1324 11.1324 11.1367 11.1367 k = 0.0326 0.8424 0.6377 ( 2688 PWs) bands (ev): 6.2890 6.2890 6.2899 6.2899 7.1076 7.1076 7.1123 7.1123 7.9719 7.9719 7.9858 7.9858 8.1132 8.1132 8.1280 8.1280 8.7153 8.7153 8.7234 8.7234 9.0880 9.0880 9.0931 9.0931 10.1331 10.1331 10.1516 10.1516 10.5262 10.5262 10.5437 10.5437 11.1332 11.1332 11.1418 11.1418 k = 0.0489 0.8424 0.6377 ( 2696 PWs) bands (ev): 6.2876 6.2876 6.2889 6.2889 7.1119 7.1119 7.1189 7.1189 7.9649 7.9649 7.9843 7.9843 8.1157 8.1157 8.1367 8.1367 8.7079 8.7079 8.7197 8.7197 9.0859 9.0859 9.0932 9.0932 10.1006 10.1006 10.1240 10.1240 10.5553 10.5553 10.5771 10.5771 11.1360 11.1360 11.1491 11.1491 k = 0.0652 0.8424 0.6377 ( 2692 PWs) bands (ev): 6.2859 6.2859 6.2877 6.2877 7.1180 7.1180 7.1274 7.1274 7.9572 7.9572 7.9810 7.9810 8.1207 8.1207 8.1468 8.1468 8.6985 8.6985 8.7138 8.7138 9.0835 9.0835 9.0928 9.0928 10.0647 10.0647 10.0909 10.0909 10.5905 10.5905 10.6141 10.6141 11.1409 11.1409 11.1588 11.1588 k = 0.0815 0.8424 0.6377 ( 2690 PWs) bands (ev): 6.2840 6.2840 6.2862 6.2862 7.1258 7.1258 7.1375 7.1375 7.9491 7.9491 7.9762 7.9762 8.1278 8.1278 8.1579 8.1579 8.6874 8.6874 8.7057 8.7057 9.0808 9.0808 9.0918 9.0918 10.0278 10.0278 10.0554 10.0554 10.6280 10.6280 10.6518 10.6518 11.1480 11.1480 11.1708 11.1708 k = 0.0978 0.8424 0.6377 ( 2692 PWs) bands (ev): 6.2821 6.2821 6.2847 6.2847 7.1349 7.1349 7.1489 7.1489 7.9408 7.9408 7.9703 7.9703 8.1366 8.1366 8.1700 8.1700 8.6746 8.6746 8.6954 8.6954 9.0778 9.0778 9.0902 9.0902 9.9916 9.9916 10.0198 10.0198 10.6654 10.6654 10.6881 10.6881 11.1574 11.1574 11.1854 11.1854 k = 0.1141 0.8424 0.6377 ( 2692 PWs) bands (ev): 6.2802 6.2802 6.2832 6.2832 7.1448 7.1448 7.1610 7.1610 7.9324 7.9324 7.9638 7.9638 8.1467 8.1467 8.1829 8.1829 8.6603 8.6603 8.6832 8.6832 9.0746 9.0746 9.0880 9.0880 9.9571 9.9571 9.9854 9.9854 10.7008 10.7008 10.7218 10.7218 11.1693 11.1693 11.2025 11.2025 k = 0.1304 0.8424 0.6377 ( 2692 PWs) bands (ev): 6.2785 6.2785 6.2819 6.2819 7.1552 7.1552 7.1736 7.1736 7.9243 7.9243 7.9570 7.9570 8.1579 8.1579 8.1966 8.1966 8.6449 8.6449 8.6692 8.6692 9.0712 9.0712 9.0851 9.0851 9.9251 9.9251 9.9532 9.9532 10.7330 10.7330 10.7521 10.7521 11.1836 11.1836 11.2219 11.2219 k = 0.1467 0.8424 0.6377 ( 2684 PWs) bands (ev): 6.2772 6.2772 6.2810 6.2810 7.1656 7.1656 7.1860 7.1860 7.9166 7.9166 7.9501 7.9501 8.1699 8.1699 8.2108 8.2108 8.6287 8.6287 8.6540 8.6540 9.0674 9.0674 9.0816 9.0816 9.8961 9.8961 9.9239 9.9239 10.7614 10.7614 10.7783 10.7783 11.2001 11.2001 11.2431 11.2431 k = 0.1630 0.8424 0.6377 ( 2684 PWs) bands (ev): 6.2764 6.2764 6.2805 6.2805 7.1754 7.1754 7.1978 7.1978 7.9093 7.9093 7.9435 7.9435 8.1824 8.1824 8.2254 8.2254 8.6121 8.6121 8.6377 8.6377 9.0633 9.0633 9.0774 9.0774 9.8704 9.8704 9.8977 9.8977 10.7853 10.7853 10.8004 10.8004 11.2183 11.2183 11.2655 11.2655 k = 0.1793 0.8424 0.6377 ( 2680 PWs) bands (ev): 6.2762 6.2762 6.2807 6.2807 7.1842 7.1842 7.2085 7.2085 7.9028 7.9028 7.9374 7.9374 8.1951 8.1951 8.2403 8.2403 8.5954 8.5954 8.6209 8.6209 9.0589 9.0589 9.0726 9.0726 9.8482 9.8482 9.8750 9.8750 10.8048 10.8048 10.8184 10.8184 11.2376 11.2376 11.2882 11.2882 k = 0.1956 0.8424 0.6377 ( 2678 PWs) bands (ev): 6.2767 6.2767 6.2814 6.2814 7.1916 7.1916 7.2176 7.2176 7.8971 7.8971 7.9319 7.9319 8.2077 8.2077 8.2550 8.2550 8.5794 8.5794 8.6042 8.6042 9.0541 9.0541 9.0672 9.0672 9.8296 9.8296 9.8560 9.8560 10.8200 10.8200 10.8327 10.8327 11.2571 11.2571 11.3103 11.3103 k = 0.2119 0.8424 0.6377 ( 2678 PWs) bands (ev): 6.2780 6.2780 6.2830 6.2830 7.1972 7.1972 7.2246 7.2246 7.8924 7.8924 7.9272 7.9272 8.2198 8.2198 8.2692 8.2692 8.5647 8.5647 8.5882 8.5882 9.0489 9.0489 9.0612 9.0612 9.8147 9.8147 9.8407 9.8407 10.8312 10.8312 10.8435 10.8435 11.2760 11.2760 11.3308 11.3308 k = 0.2281 0.8424 0.6377 ( 2678 PWs) bands (ev): 6.2801 6.2801 6.2853 6.2853 7.2005 7.2005 7.2292 7.2292 7.8888 7.8888 7.9236 7.9236 8.2307 8.2307 8.2824 8.2824 8.5519 8.5519 8.5740 8.5740 9.0432 9.0432 9.0547 9.0547 9.8036 9.8036 9.8292 9.8292 10.8387 10.8387 10.8512 10.8512 11.2934 11.2934 11.3489 11.3489 k = 0.2444 0.8424 0.6377 ( 2678 PWs) bands (ev): 6.2831 6.2831 6.2884 6.2884 7.2015 7.2015 7.2312 7.2312 7.8864 7.8864 7.9210 7.9210 8.2399 8.2399 8.2937 8.2937 8.5419 8.5419 8.5623 8.5623 9.0371 9.0371 9.0477 9.0477 9.7961 9.7961 9.8214 9.8214 10.8429 10.8429 10.8561 10.8561 11.3086 11.3086 11.3638 11.3638 k = 0.2607 0.8424 0.6377 ( 2684 PWs) bands (ev): 6.2869 6.2869 6.2923 6.2923 7.1998 7.1998 7.2302 7.2302 7.8853 7.8853 7.9196 7.9196 8.2468 8.2468 8.3022 8.3022 8.5354 8.5354 8.5543 8.5543 9.0304 9.0304 9.0403 9.0403 9.7924 9.7924 9.8174 9.8174 10.8439 10.8440 10.8582 10.8582 11.3210 11.3210 11.3750 11.3750 k = 0.2770 0.8424 0.6377 ( 2686 PWs) bands (ev): 6.2915 6.2915 6.2970 6.2970 7.1955 7.1955 7.2264 7.2264 7.8856 7.8856 7.9195 7.9195 8.2507 8.2507 8.3072 8.3072 8.5330 8.5330 8.5509 8.5509 9.0231 9.0231 9.0323 9.0323 9.7922 9.7922 9.8171 9.8171 10.8421 10.8421 10.8579 10.8579 11.3303 11.3303 11.3823 11.3823 k = 0.2770 0.8424 0.6377 ( 2686 PWs) bands (ev): 6.2915 6.2915 6.2970 6.2970 7.1955 7.1955 7.2264 7.2264 7.8856 7.8856 7.9195 7.9195 8.2507 8.2507 8.3072 8.3072 8.5330 8.5330 8.5509 8.5509 9.0231 9.0231 9.0323 9.0323 9.7922 9.7922 9.8171 9.8171 10.8421 10.8421 10.8579 10.8579 11.3303 11.3303 11.3823 11.3823 k = 0.2719 0.8268 0.6377 ( 2674 PWs) bands (ev): 6.2759 6.2759 6.2812 6.2812 7.2135 7.2135 7.2434 7.2434 7.8834 7.8834 7.9186 7.9186 8.2422 8.2422 8.2965 8.2965 8.5335 8.5335 8.5538 8.5538 9.0463 9.0463 9.0577 9.0577 9.7853 9.7853 9.8104 9.8104 10.8523 10.8523 10.8626 10.8626 11.3082 11.3082 11.3680 11.3680 k = 0.2668 0.8112 0.6377 ( 2674 PWs) bands (ev): 6.2614 6.2614 6.2664 6.2664 7.2317 7.2317 7.2607 7.2607 7.8823 7.8823 7.9187 7.9187 8.2323 8.2323 8.2841 8.2841 8.5328 8.5328 8.5559 8.5559 9.0664 9.0664 9.0805 9.0805 9.7762 9.7762 9.8012 9.8012 10.8606 10.8606 10.8659 10.8659 11.2919 11.2919 11.3589 11.3589 k = 0.2616 0.7956 0.6377 ( 2682 PWs) bands (ev): 6.2481 6.2481 6.2527 6.2527 7.2502 7.2502 7.2782 7.2782 7.8823 7.8823 7.9200 7.9200 8.2210 8.2210 8.2702 8.2702 8.5313 8.5313 8.5575 8.5575 9.0820 9.0820 9.0993 9.0993 9.7670 9.7670 9.7914 9.7914 10.8657 10.8657 10.8670 10.8670 11.2818 11.2818 11.3549 11.3549 k = 0.2565 0.7800 0.6377 ( 2686 PWs) bands (ev): 6.2358 6.2358 6.2401 6.2401 7.2688 7.2688 7.2959 7.2959 7.8836 7.8836 7.9225 7.9225 8.2084 8.2084 8.2547 8.2547 8.5290 8.5290 8.5588 8.5588 9.0920 9.0920 9.1130 9.1130 9.7592 9.7592 9.7830 9.7830 10.8659 10.8659 10.8669 10.8669 11.2775 11.2775 11.3552 11.3552 k = 0.2514 0.7644 0.6377 ( 2686 PWs) bands (ev): 6.2246 6.2246 6.2286 6.2286 7.2877 7.2877 7.3138 7.3138 7.8861 7.8861 7.9264 7.9264 8.1943 8.1943 8.2377 8.2377 8.5263 8.5263 8.5599 8.5599 9.0953 9.0953 9.1203 9.1203 9.7544 9.7544 9.7775 9.7775 10.8627 10.8627 10.8642 10.8642 11.2782 11.2782 11.3587 11.3587 k = 0.2463 0.7488 0.6377 ( 2686 PWs) bands (ev): 6.2144 6.2144 6.2181 6.2181 7.3067 7.3067 7.3318 7.3318 7.8900 7.8900 7.9317 7.9317 8.1786 8.1786 8.2190 8.2190 8.5233 8.5233 8.5611 8.5611 9.0911 9.0911 9.1203 9.1203 9.7537 9.7537 9.7762 9.7762 10.8580 10.8580 10.8584 10.8584 11.2823 11.2823 11.3641 11.3641 k = 0.2411 0.7332 0.6377 ( 2686 PWs) bands (ev): 6.2053 6.2053 6.2085 6.2085 7.3258 7.3258 7.3500 7.3500 7.8953 7.8953 7.9384 7.9384 8.1613 8.1613 8.1988 8.1988 8.5201 8.5201 8.5623 8.5623 9.0793 9.0793 9.1128 9.1128 9.7576 9.7576 9.7797 9.7797 10.8506 10.8506 10.8526 10.8526 11.2882 11.2882 11.3700 11.3700 k = 0.2360 0.7176 0.6377 ( 2682 PWs) bands (ev): 6.1970 6.1970 6.1999 6.1999 7.3451 7.3451 7.3683 7.3683 7.9019 7.9019 7.9465 7.9465 8.1424 8.1424 8.1770 8.1770 8.5170 8.5170 8.5638 8.5638 9.0602 9.0602 9.0980 9.0980 9.7660 9.7660 9.7881 9.7881 10.8419 10.8419 10.8473 10.8473 11.2941 11.2941 11.3752 11.3752 k = 0.2309 0.7020 0.6377 ( 2686 PWs) bands (ev): 6.1897 6.1897 6.1921 6.1921 7.3643 7.3643 7.3867 7.3867 7.9098 7.9098 7.9560 7.9560 8.1219 8.1219 8.1537 8.1537 8.5141 8.5141 8.5655 8.5655 9.0346 9.0346 9.0766 9.0766 9.7784 9.7784 9.8008 9.8008 10.8334 10.8334 10.8426 10.8426 11.2987 11.2987 11.3784 11.3784 k = 0.2257 0.6864 0.6377 ( 2684 PWs) bands (ev): 6.1831 6.1831 6.1851 6.1851 7.3836 7.3836 7.4051 7.4051 7.9189 7.9189 7.9668 7.9668 8.0999 8.0999 8.1293 8.1293 8.5114 8.5114 8.5675 8.5675 9.0036 9.0036 9.0497 9.0497 9.7940 9.7940 9.8171 9.8171 10.8257 10.8257 10.8391 10.8391 11.3008 11.3008 11.3788 11.3788 k = 0.2206 0.6708 0.6377 ( 2686 PWs) bands (ev): 6.1772 6.1772 6.1787 6.1787 7.4028 7.4028 7.4235 7.4235 7.9288 7.9288 7.9782 7.9782 8.0770 8.0770 8.1039 8.1039 8.5090 8.5090 8.5698 8.5698 8.9683 8.9683 9.0184 9.0184 9.8119 9.8119 9.8358 9.8358 10.8195 10.8195 10.8372 10.8372 11.2995 11.2995 11.3757 11.3757 k = 0.2155 0.6552 0.6377 ( 2686 PWs) bands (ev): 6.1719 6.1719 6.1729 6.1729 7.4218 7.4218 7.4418 7.4418 7.9390 7.9390 7.9885 7.9885 8.0549 8.0549 8.0786 8.0786 8.5070 8.5070 8.5725 8.5725 8.9298 8.9298 8.9839 8.9839 9.8314 9.8314 9.8562 9.8562 10.8153 10.8153 10.8371 10.8371 11.2942 11.2942 11.3685 11.3685 k = 0.2103 0.6396 0.6377 ( 2690 PWs) bands (ev): 6.1670 6.1670 6.1675 6.1675 7.4406 7.4406 7.4601 7.4601 7.9475 7.9475 7.9904 7.9904 8.0411 8.0411 8.0551 8.0551 8.5052 8.5052 8.5753 8.5753 8.8890 8.8890 8.9471 8.9471 9.8517 9.8517 9.8774 9.8774 10.8132 10.8132 10.8390 10.8390 11.2845 11.2845 11.3569 11.3569 k = 0.2052 0.6240 0.6377 ( 2686 PWs) bands (ev): 6.1625 6.1625 6.1625 6.1625 7.4591 7.4591 7.4782 7.4782 7.9499 7.9499 7.9740 7.9740 8.0380 8.0380 8.0456 8.0456 8.5036 8.5036 8.5783 8.5783 8.8469 8.8469 8.9091 8.9091 9.8723 9.8723 9.8987 9.8987 10.8135 10.8135 10.8429 10.8429 11.2703 11.2703 11.3406 11.3406 k = 0.2001 0.6084 0.6377 ( 2686 PWs) bands (ev): 6.1576 6.1576 6.1582 6.1582 7.4771 7.4771 7.4962 7.4962 7.9400 7.9400 7.9468 7.9468 8.0339 8.0339 8.0607 8.0607 8.5022 8.5022 8.5811 8.5811 8.8043 8.8043 8.8706 8.8706 9.8927 9.8927 9.9197 9.9197 10.8162 10.8162 10.8489 10.8489 11.2515 11.2515 11.3196 11.3196 k = 0.1950 0.5928 0.6377 ( 2690 PWs) bands (ev): 6.1527 6.1527 6.1539 6.1539 7.4946 7.4946 7.5139 7.5139 7.9158 7.9158 7.9181 7.9181 8.0426 8.0426 8.0799 8.0799 8.5006 8.5006 8.5833 8.5833 8.7623 8.7623 8.8324 8.8324 9.9127 9.9127 9.9398 9.9398 10.8211 10.8211 10.8567 10.8567 11.2282 11.2282 11.2942 11.2942 k = 0.1898 0.5772 0.6377 ( 2690 PWs) bands (ev): 6.1477 6.1477 6.1495 6.1495 7.5113 7.5113 7.5312 7.5312 7.8829 7.8829 7.8901 7.8901 8.0584 8.0584 8.1013 8.1013 8.4986 8.4986 8.5837 8.5837 8.7224 8.7224 8.7951 8.7951 9.9321 9.9321 9.9590 9.9590 10.8281 10.8281 10.8662 10.8662 11.2011 11.2011 11.2647 11.2647 k = 0.1847 0.5616 0.6377 ( 2690 PWs) bands (ev): 6.1424 6.1424 6.1448 6.1448 7.5268 7.5268 7.5482 7.5482 7.8489 7.8489 7.8598 7.8598 8.0780 8.0780 8.1243 8.1243 8.4958 8.4958 8.5799 8.5799 8.6874 8.6874 8.7597 8.7597 9.9507 9.9507 9.9770 9.9770 10.8366 10.8366 10.8770 10.8770 11.1705 11.1705 11.2316 11.2316 k = 0.1796 0.5460 0.6377 ( 2696 PWs) bands (ev): 6.1367 6.1367 6.1397 6.1397 7.5407 7.5407 7.5643 7.5643 7.8145 7.8145 7.8292 7.8292 8.0999 8.0999 8.1484 8.1484 8.4915 8.4915 8.5669 8.5669 8.6625 8.6625 8.7269 8.7269 9.9684 9.9684 9.9936 9.9936 10.8462 10.8462 10.8884 10.8884 11.1375 11.1375 11.1958 11.1958 k = 0.1744 0.5304 0.6377 ( 2688 PWs) bands (ev): 6.1303 6.1303 6.1340 6.1340 7.5521 7.5521 7.5793 7.5793 7.7806 7.7806 7.8002 7.8002 8.1234 8.1234 8.1735 8.1735 8.4851 8.4851 8.5420 8.5420 8.6509 8.6509 8.6979 8.6979 9.9852 9.9852 10.0089 10.0089 10.8558 10.8558 10.8998 10.8998 11.1036 11.1036 11.1585 11.1585 k = 0.1693 0.5148 0.6377 ( 2696 PWs) bands (ev): 6.1232 6.1232 6.1275 6.1275 7.5596 7.5596 7.5919 7.5919 7.7485 7.7485 7.7744 7.7744 8.1480 8.1480 8.1991 8.1991 8.4757 8.4757 8.5090 8.5090 8.6488 8.6488 8.6735 8.6735 10.0009 10.0009 10.0226 10.0226 10.8634 10.8634 10.9095 10.9095 11.0709 11.0709 11.1218 11.1218 k = 0.1642 0.4992 0.6377 ( 2700 PWs) bands (ev): 6.1151 6.1151 6.1200 6.1200 7.5612 7.5612 7.5996 7.5996 7.7211 7.7211 7.7542 7.7542 8.1735 8.1735 8.2248 8.2248 8.4629 8.4629 8.4727 8.4727 8.6514 8.6514 8.6547 8.6547 10.0155 10.0155 10.0349 10.0349 10.8661 10.8661 10.9145 10.9145 11.0432 11.0432 11.0892 11.0892 k = 0.1590 0.4836 0.6377 ( 2700 PWs) bands (ev): 6.1059 6.1059 6.1114 6.1114 7.5550 7.5550 7.5976 7.5976 7.7034 7.7034 7.7419 7.7419 8.1993 8.1993 8.2501 8.2501 8.4359 8.4359 8.4471 8.4471 8.6415 8.6415 8.6564 8.6564 10.0289 10.0289 10.0455 10.0455 10.8596 10.8596 10.9102 10.9102 11.0254 11.0254 11.0660 11.0660 k = 0.1539 0.4680 0.6377 ( 2700 PWs) bands (ev): 6.0955 6.0955 6.1015 6.1015 7.5406 7.5406 7.5820 7.5820 7.6995 7.6995 7.7382 7.7382 8.2250 8.2250 8.2738 8.2738 8.4001 8.4001 8.4297 8.4297 8.6336 8.6336 8.6628 8.6628 10.0409 10.0409 10.0543 10.0543 10.8415 10.8415 10.8926 10.8926 11.0204 11.0204 11.0569 11.0569 k = 0.1488 0.4524 0.6377 ( 2700 PWs) bands (ev): 6.0837 6.0837 6.0903 6.0903 7.5195 7.5195 7.5565 7.5565 7.7060 7.7060 7.7417 7.7417 8.2494 8.2494 8.2936 8.2936 8.3666 8.3666 8.4140 8.4140 8.6298 8.6298 8.6700 8.6700 10.0512 10.0512 10.0611 10.0611 10.8146 10.8146 10.8640 10.8640 11.0264 11.0264 11.0605 11.0605 k = 0.1436 0.4368 0.6377 ( 2700 PWs) bands (ev): 6.0705 6.0705 6.0776 6.0776 7.4940 7.4940 7.5264 7.5264 7.7176 7.7176 7.7502 7.7502 8.2688 8.2688 8.3047 8.3047 8.3395 8.3395 8.4057 8.4057 8.6292 8.6292 8.6778 8.6778 10.0595 10.0595 10.0654 10.0654 10.7836 10.7836 10.8299 10.8299 11.0394 11.0394 11.0719 11.0719 k = 0.1385 0.4212 0.6377 ( 2696 PWs) bands (ev): 6.0559 6.0559 6.0634 6.0634 7.4661 7.4661 7.4947 7.4947 7.7315 7.7315 7.7618 7.7618 8.2695 8.2695 8.3022 8.3022 8.3323 8.3323 8.4102 8.4102 8.6310 8.6310 8.6860 8.6860 10.0653 10.0653 10.0671 10.0671 10.7525 10.7525 10.7951 10.7951 11.0564 11.0564 11.0874 11.0874 k = 0.1334 0.4056 0.6377 ( 2696 PWs) bands (ev): 6.0397 6.0397 6.0476 6.0476 7.4372 7.4372 7.4626 7.4626 7.7463 7.7463 7.7752 7.7752 8.2487 8.2487 8.2886 8.2886 8.3480 8.3480 8.4255 8.4255 8.6345 8.6345 8.6944 8.6944 10.0657 10.0657 10.0683 10.0683 10.7237 10.7237 10.7624 10.7624 11.0757 11.0757 11.1053 11.1053 k = 0.1283 0.3900 0.6377 ( 2692 PWs) bands (ev): 6.0221 6.0221 6.0302 6.0302 7.4080 7.4080 7.4309 7.4309 7.7615 7.7615 7.7898 7.7898 8.2224 8.2224 8.2701 8.2701 8.3704 8.3704 8.4458 8.4458 8.6393 8.6393 8.7031 8.7031 10.0609 10.0609 10.0679 10.0679 10.6990 10.6990 10.7336 10.7336 11.0963 11.0963 11.1244 11.1244 k = 0.1231 0.3744 0.6377 ( 2688 PWs) bands (ev): 6.0030 6.0030 6.0114 6.0114 7.3790 7.3790 7.3998 7.3998 7.7767 7.7767 7.8049 7.8049 8.1963 8.1963 8.2501 8.2501 8.3938 8.3938 8.4678 8.4678 8.6451 8.6451 8.7118 8.7118 10.0526 10.0526 10.0639 10.0639 10.6794 10.6794 10.7100 10.7100 11.1178 11.1178 11.1442 11.1442 k = 0.1180 0.3588 0.6377 ( 2692 PWs) bands (ev): 5.9825 5.9825 5.9911 5.9911 7.3505 7.3505 7.3694 7.3694 7.7917 7.7917 7.8200 7.8200 8.1717 8.1717 8.2304 8.2304 8.4170 8.4170 8.4899 8.4899 8.6516 8.6516 8.7206 8.7206 10.0409 10.0409 10.0562 10.0562 10.6656 10.6656 10.6923 10.6923 11.1397 11.1397 11.1644 11.1644 k = 0.1129 0.3432 0.6377 ( 2692 PWs) bands (ev): 5.9608 5.9608 5.9695 5.9695 7.3226 7.3226 7.3400 7.3400 7.8062 7.8062 7.8350 7.8350 8.1492 8.1492 8.2117 8.2117 8.4393 8.4393 8.5112 8.5112 8.6587 8.6587 8.7292 8.7292 10.0262 10.0262 10.0449 10.0449 10.6576 10.6576 10.6810 10.6810 11.1618 11.1618 11.1847 11.1847 k = 0.1077 0.3276 0.6377 ( 2692 PWs) bands (ev): 5.9380 5.9380 5.9467 5.9467 7.2955 7.2955 7.3113 7.3113 7.8202 7.8202 7.8495 7.8495 8.1293 8.1293 8.1947 8.1947 8.4605 8.4605 8.5314 8.5314 8.6662 8.6662 8.7377 8.7377 10.0091 10.0091 10.0305 10.0305 10.6553 10.6553 10.6758 10.6758 11.1840 11.1840 11.2051 11.2051 k = 0.1026 0.3120 0.6377 ( 2692 PWs) bands (ev): 5.9143 5.9143 5.9229 5.9229 7.2691 7.2691 7.2836 7.2836 7.8334 7.8334 7.8631 7.8631 8.1122 8.1122 8.1796 8.1796 8.4804 8.4804 8.5503 8.5503 8.6738 8.6738 8.7459 8.7459 9.9903 9.9903 10.0137 10.0137 10.6582 10.6582 10.6765 10.6765 11.2061 11.2061 11.2254 11.2254 k = 0.0975 0.2964 0.6377 ( 2688 PWs) bands (ev): 5.8899 5.8899 5.8984 5.8984 7.2435 7.2435 7.2568 7.2568 7.8457 7.8457 7.8756 7.8756 8.0981 8.0981 8.1666 8.1666 8.4988 8.4988 8.5676 8.5676 8.6815 8.6815 8.7537 8.7537 9.9707 9.9707 9.9952 9.9952 10.6656 10.6656 10.6822 10.6822 11.2280 11.2280 11.2455 11.2455 k = 0.0923 0.2808 0.6377 ( 2684 PWs) bands (ev): 5.8650 5.8650 5.8733 5.8733 7.2188 7.2188 7.2309 7.2309 7.8569 7.8569 7.8864 7.8864 8.0875 8.0875 8.1559 8.1559 8.5158 8.5158 8.5833 8.5833 8.6891 8.6891 8.7609 8.7609 9.9509 9.9509 9.9761 9.9761 10.6769 10.6769 10.6922 10.6922 11.2496 11.2496 11.2653 11.2653 k = 0.0872 0.2652 0.6377 ( 2684 PWs) bands (ev): 5.8399 5.8399 5.8479 5.8479 7.1948 7.1948 7.2058 7.2058 7.8669 7.8669 7.8953 7.8953 8.0805 8.0805 8.1476 8.1476 8.5312 8.5312 8.5974 8.5974 8.6963 8.6963 8.7675 8.7675 9.9317 9.9317 9.9569 9.9569 10.6913 10.6913 10.7057 10.7057 11.2708 11.2708 11.2849 11.2849 k = 0.0821 0.2496 0.6377 ( 2688 PWs) bands (ev): 5.8147 5.8147 5.8224 5.8224 7.1716 7.1716 7.1817 7.1817 7.8757 7.8757 7.9020 7.9020 8.0771 8.0771 8.1416 8.1416 8.5450 8.5450 8.6098 8.6098 8.7030 8.7030 8.7735 8.7735 9.9136 9.9136 9.9383 9.9383 10.7083 10.7083 10.7220 10.7220 11.2916 11.2916 11.3040 11.3040 k = 0.0770 0.2340 0.6377 ( 2684 PWs) bands (ev): 5.7897 5.7897 5.7970 5.7970 7.1493 7.1493 7.1585 7.1585 7.8831 7.8831 7.9067 7.9067 8.0773 8.0773 8.1380 8.1380 8.5574 8.5574 8.6207 8.6207 8.7093 8.7093 8.7786 8.7786 9.8970 9.8970 9.9208 9.9208 10.7271 10.7271 10.7404 10.7404 11.3118 11.3118 11.3227 11.3227 k = 0.0718 0.2184 0.6377 ( 2684 PWs) bands (ev): 5.7651 5.7651 5.7721 5.7721 7.1279 7.1279 7.1362 7.1362 7.8892 7.8892 7.9094 7.9094 8.0806 8.0806 8.1364 8.1364 8.5683 8.5683 8.6300 8.6300 8.7150 8.7150 8.7830 8.7830 9.8821 9.8821 9.9048 9.9048 10.7474 10.7474 10.7602 10.7602 11.3315 11.3315 11.3410 11.3410 k = 0.0667 0.2028 0.6377 ( 2692 PWs) bands (ev): 5.7412 5.7412 5.7477 5.7477 7.1075 7.1075 7.1150 7.1150 7.8941 7.8941 7.9105 7.9105 8.0863 8.0863 8.1368 8.1368 8.5778 8.5778 8.6376 8.6376 8.7203 8.7203 8.7865 8.7865 9.8690 9.8690 9.8904 9.8904 10.7685 10.7685 10.7809 10.7809 11.3505 11.3505 11.3586 11.3586 k = 0.0616 0.1872 0.6377 ( 2688 PWs) bands (ev): 5.7181 5.7181 5.7243 5.7243 7.0881 7.0881 7.0949 7.0949 7.8980 7.8980 7.9107 7.9107 8.0939 8.0939 8.1387 8.1387 8.5860 8.5860 8.6437 8.6437 8.7252 8.7252 8.7893 8.7893 9.8578 9.8578 9.8777 9.8777 10.7901 10.7901 10.8021 10.8021 11.3688 11.3688 11.3757 11.3757 k = 0.0564 0.1716 0.6377 ( 2684 PWs) bands (ev): 5.6962 5.6962 5.7018 5.7018 7.0699 7.0699 7.0760 7.0760 7.9009 7.9009 7.9103 7.9103 8.1027 8.1027 8.1420 8.1420 8.5930 8.5930 8.6481 8.6481 8.7300 8.7300 8.7914 8.7914 9.8485 9.8485 9.8667 9.8667 10.8117 10.8117 10.8232 10.8232 11.3862 11.3862 11.3920 11.3920 k = 0.0513 0.1560 0.6377 ( 2688 PWs) bands (ev): 5.6755 5.6755 5.6807 5.6807 7.0529 7.0529 7.0583 7.0583 7.9030 7.9030 7.9095 7.9095 8.1121 8.1121 8.1461 8.1461 8.5990 8.5990 8.6509 8.6509 8.7347 8.7347 8.7927 8.7927 9.8408 9.8408 9.8574 9.8574 10.8329 10.8329 10.8439 10.8439 11.4026 11.4027 11.4074 11.4074 k = 0.0462 0.1404 0.6377 ( 2684 PWs) bands (ev): 5.6562 5.6562 5.6609 5.6609 7.0372 7.0372 7.0420 7.0420 7.9046 7.9046 7.9087 7.9087 8.1217 8.1217 8.1508 8.1508 8.6039 8.6039 8.6523 8.6523 8.7394 8.7394 8.7933 8.7933 9.8348 9.8348 9.8497 9.8497 10.8534 10.8534 10.8637 10.8637 11.4180 11.4181 11.4219 11.4219 k = 0.0410 0.1248 0.6377 ( 2680 PWs) bands (ev): 5.6386 5.6386 5.6428 5.6428 7.0229 7.0229 7.0271 7.0271 7.9057 7.9057 7.9080 7.9080 8.1312 8.1312 8.1559 8.1559 8.6081 8.6081 8.6523 8.6523 8.7441 8.7441 8.7934 8.7934 9.8301 9.8301 9.8433 9.8433 10.8728 10.8728 10.8823 10.8823 11.4323 11.4323 11.4354 11.4354 k = 0.0359 0.1092 0.6377 ( 2684 PWs) bands (ev): 5.6227 5.6227 5.6264 5.6264 7.0100 7.0100 7.0137 7.0137 7.9064 7.9064 7.9074 7.9074 8.1402 8.1402 8.1609 8.1609 8.6116 8.6116 8.6511 8.6511 8.7488 8.7488 8.7930 8.7930 9.8266 9.8266 9.8381 9.8381 10.8909 10.8909 10.8995 10.8995 11.4452 11.4452 11.4477 11.4477 k = 0.0308 0.0936 0.6377 ( 2680 PWs) bands (ev): 5.6087 5.6087 5.6118 5.6118 6.9988 6.9988 7.0019 7.0019 7.9069 7.9069 7.9070 7.9070 8.1486 8.1486 8.1656 8.1656 8.6146 8.6146 8.6491 8.6491 8.7536 8.7536 8.7920 8.7920 9.8241 9.8241 9.8339 9.8339 10.9072 10.9072 10.9149 10.9149 11.4568 11.4568 11.4587 11.4587 k = 0.0257 0.0780 0.6377 ( 2684 PWs) bands (ev): 5.5967 5.5967 5.5993 5.5993 6.9891 6.9891 6.9917 6.9917 7.9067 7.9067 7.9071 7.9071 8.1561 8.1561 8.1698 8.1698 8.6173 8.6173 8.6464 8.6464 8.7582 8.7582 8.7907 8.7907 9.8224 9.8224 9.8306 9.8306 10.9217 10.9217 10.9282 10.9282 11.4668 11.4668 11.4682 11.4682 k = 0.0205 0.0624 0.6377 ( 2686 PWs) bands (ev): 5.5868 5.5868 5.5889 5.5889 6.9812 6.9812 6.9833 6.9833 7.9065 7.9065 7.9072 7.9072 8.1627 8.1627 8.1732 8.1732 8.6198 8.6198 8.6433 8.6433 8.7627 8.7627 8.7890 8.7890 9.8214 9.8214 9.8279 9.8279 10.9339 10.9339 10.9393 10.9393 11.4752 11.4752 11.4762 11.4762 k = 0.0154 0.0468 0.6377 ( 2686 PWs) bands (ev): 5.5790 5.5790 5.5806 5.5806 6.9750 6.9750 6.9766 6.9766 7.9065 7.9065 7.9072 7.9072 8.1682 8.1682 8.1759 8.1759 8.6223 8.6223 8.6400 8.6400 8.7670 8.7670 8.7868 8.7868 9.8210 9.8210 9.8259 9.8259 10.9438 10.9438 10.9479 10.9479 11.4818 11.4818 11.4826 11.4826 k = 0.0103 0.0312 0.6377 ( 2686 PWs) bands (ev): 5.5736 5.5736 5.5746 5.5746 6.9707 6.9707 6.9717 6.9717 7.9065 7.9065 7.9071 7.9071 8.1725 8.1725 8.1775 8.1775 8.6248 8.6248 8.6367 8.6367 8.7711 8.7711 8.7844 8.7844 9.8210 9.8210 9.8242 9.8242 10.9512 10.9512 10.9540 10.9540 11.4867 11.4867 11.4872 11.4872 k = 0.0051 0.0156 0.6377 ( 2690 PWs) bands (ev): 5.5704 5.5704 5.5709 5.5709 6.9682 6.9682 6.9687 6.9687 7.9066 7.9066 7.9070 7.9070 8.1756 8.1756 8.1781 8.1781 8.6275 8.6275 8.6334 8.6334 8.7749 8.7749 8.7815 8.7815 9.8213 9.8213 9.8229 9.8229 10.9560 10.9560 10.9574 10.9574 11.4897 11.4897 11.4899 11.4899 k = 0.0000 0.0000 0.6377 ( 2694 PWs) bands (ev): 5.5695 5.5695 5.5695 5.5695 6.9675 6.9675 6.9675 6.9675 7.9068 7.9068 7.9068 7.9068 8.1774 8.1774 8.1774 8.1774 8.6303 8.6303 8.6303 8.6303 8.7783 8.7783 8.7783 8.7783 9.8220 9.8220 9.8220 9.8220 10.9581 10.9581 10.9581 10.9581 11.4907 11.4907 11.4907 11.4907 k = 0.0000 0.0000 0.6377 ( 2694 PWs) bands (ev): 5.5695 5.5695 5.5695 5.5695 6.9675 6.9675 6.9675 6.9675 7.9068 7.9068 7.9068 7.9068 8.1774 8.1774 8.1774 8.1774 8.6303 8.6303 8.6303 8.6303 8.7783 8.7783 8.7783 8.7783 9.8220 9.8220 9.8220 9.8220 10.9581 10.9581 10.9581 10.9581 11.4907 11.4907 11.4907 11.4907 k = 0.0000 0.0000 0.6213 ( 2694 PWs) bands (ev): 5.4828 5.4828 5.6535 5.6535 6.9379 6.9379 6.9984 6.9984 7.8923 7.8923 7.9203 7.9203 8.1748 8.1748 8.1791 8.1791 8.6130 8.6130 8.6502 8.6502 8.7610 8.7610 8.7959 8.7959 9.7510 9.7510 9.8920 9.8920 10.9502 10.9502 10.9650 10.9650 11.4569 11.4569 11.5279 11.5279 k = 0.0000 0.0000 0.6050 ( 2694 PWs) bands (ev): 5.3940 5.3940 5.7344 5.7344 6.9099 6.9099 7.0307 7.0307 7.8771 7.8771 7.9326 7.9326 8.1716 8.1716 8.1796 8.1796 8.5980 8.5980 8.6726 8.6726 8.7446 8.7446 8.8132 8.8132 9.6791 9.6791 9.9607 9.9607 10.9415 10.9415 10.9707 10.9707 11.4268 11.4268 11.5681 11.5681 k = 0.0000 0.0000 0.5886 ( 2688 PWs) bands (ev): 5.3036 5.3036 5.8115 5.8115 6.8836 6.8836 7.0639 7.0639 7.8613 7.8613 7.9438 7.9438 8.1678 8.1678 8.1789 8.1789 8.5851 8.5851 8.6963 8.6963 8.7309 8.7309 8.8298 8.8298 9.6067 9.6067 10.0282 10.0282 10.9322 10.9322 10.9753 10.9753 11.4008 11.4008 11.6110 11.6110 k = 0.0000 0.0000 0.5723 ( 2684 PWs) bands (ev): 5.2121 5.2121 5.8844 5.8844 6.8591 6.8591 7.0981 7.0981 7.8451 7.8451 7.9534 7.9534 8.1635 8.1635 8.1766 8.1766 8.5740 8.5740 8.7059 8.7059 8.7363 8.7363 8.8455 8.8455 9.5341 9.5341 10.0941 10.0941 10.9224 10.9224 10.9786 10.9786 11.3791 11.3791 11.6562 11.6562 k = 0.0000 0.0000 0.5559 ( 2678 PWs) bands (ev): 5.1199 5.1199 5.9523 5.9523 6.8365 6.8365 7.1328 7.1328 7.8288 7.8288 7.9614 7.9614 8.1590 8.1590 8.1726 8.1726 8.5645 8.5645 8.6961 8.6961 8.7664 8.7664 8.8601 8.8601 9.4616 9.4616 10.1585 10.1585 10.9125 10.9125 10.9806 10.9806 11.3621 11.3621 11.7033 11.7033 k = 0.0000 0.0000 0.5396 ( 2680 PWs) bands (ev): 5.0275 5.0275 6.0150 6.0150 6.8158 6.8158 7.1677 7.1677 7.8127 7.8127 7.9677 7.9677 8.1540 8.1540 8.1669 8.1669 8.5565 8.5565 8.6854 8.6854 8.8021 8.8021 8.8740 8.8740 9.3898 9.3898 10.2212 10.2212 10.9025 10.9025 10.9813 10.9813 11.3499 11.3499 11.7520 11.7520 k = 0.0000 0.0000 0.5232 ( 2680 PWs) bands (ev): 4.9352 4.9352 6.0718 6.0718 6.7971 6.7971 7.2023 7.2023 7.7973 7.7973 7.9719 7.9719 8.1484 8.1484 8.1597 8.1597 8.5500 8.5500 8.6762 8.6762 8.8386 8.8386 8.8901 8.8901 9.3193 9.3193 10.2821 10.2821 10.8927 10.8927 10.9807 10.9807 11.3429 11.3429 11.8020 11.8020 k = 0.0000 0.0000 0.5069 ( 2678 PWs) bands (ev): 4.8433 4.8433 6.1227 6.1227 6.7805 6.7805 7.2360 7.2360 7.7832 7.7832 7.9739 7.9739 8.1410 8.1410 8.1520 8.1520 8.5450 8.5450 8.6689 8.6689 8.8656 8.8656 8.9177 8.9177 9.2510 9.2510 10.3411 10.3411 10.8834 10.8834 10.9790 10.9790 11.3412 11.3412 11.8528 11.8528 k = 0.0000 0.0000 0.4905 ( 2674 PWs) bands (ev): 4.7521 4.7521 6.1672 6.1672 6.7660 6.7660 7.2680 7.2680 7.7712 7.7712 7.9735 7.9735 8.1305 8.1305 8.1453 8.1453 8.5413 8.5413 8.6636 8.6636 8.8777 8.8777 8.9609 8.9609 9.1868 9.1868 10.3981 10.3981 10.8746 10.8746 10.9762 10.9762 11.3449 11.3449 11.9042 11.9042 k = 0.0000 0.0000 0.4742 ( 2674 PWs) bands (ev): 4.6620 4.6620 6.2056 6.2056 6.7534 6.7534 7.2972 7.2972 7.7623 7.7623 7.9705 7.9705 8.1169 8.1169 8.1395 8.1395 8.5389 8.5389 8.6600 8.6600 8.8817 8.8817 9.0069 9.0069 9.1332 9.1332 10.4528 10.4528 10.8666 10.8666 10.9727 10.9727 11.3541 11.3541 11.9557 11.9557 k = 0.0000 0.0000 0.4578 ( 2668 PWs) bands (ev): 4.5733 4.5733 6.2378 6.2378 6.7426 6.7426 7.3225 7.3225 7.7578 7.7578 7.9646 7.9646 8.1009 8.1009 8.1342 8.1342 8.5378 8.5378 8.6582 8.6582 8.8811 8.8811 9.0184 9.0184 9.1242 9.1242 10.5049 10.5049 10.8594 10.8594 10.9688 10.9688 11.3687 11.3687 12.0069 12.0069 k = 0.0000 0.0000 0.4415 ( 2670 PWs) bands (ev): 4.4860 4.4860 6.2643 6.2643 6.7335 6.7335 7.3424 7.3424 7.7589 7.7589 7.9558 7.9558 8.0830 8.0830 8.1290 8.1290 8.5378 8.5378 8.6579 8.6579 8.8764 8.8764 8.9798 8.9798 9.1756 9.1756 10.5539 10.5539 10.8534 10.8534 10.9649 10.9649 11.3888 11.3888 12.0576 12.0576 k = 0.0000 0.0000 0.4251 ( 2674 PWs) bands (ev): 4.4005 4.4005 6.2856 6.2856 6.7257 6.7257 7.3558 7.3558 7.7665 7.7665 7.9436 7.9436 8.0635 8.0635 8.1240 8.1240 8.5390 8.5390 8.6588 8.6588 8.8666 8.8666 8.9343 8.9343 9.2450 9.2450 10.5990 10.5990 10.8484 10.8484 10.9617 10.9617 11.4141 11.4141 12.1073 12.1073 k = 0.0000 0.0000 0.4088 ( 2682 PWs) bands (ev): 4.3169 4.3169 6.3021 6.3021 6.7190 6.7190 7.3622 7.3622 7.7808 7.7808 7.9281 7.9281 8.0427 8.0427 8.1192 8.1192 8.5411 8.5411 8.6609 8.6609 8.8484 8.8484 8.8966 8.8966 9.3216 9.3216 10.6392 10.6392 10.8448 10.8448 10.9604 10.9604 11.4446 11.4446 12.1557 12.1557 k = 0.0000 0.0000 0.3924 ( 2682 PWs) bands (ev): 4.2355 4.2355 6.3147 6.3147 6.7129 6.7129 7.3620 7.3620 7.8002 7.8002 7.9100 7.9100 8.0215 8.0215 8.1148 8.1148 8.5443 8.5443 8.6639 8.6639 8.8195 8.8195 8.8717 8.8717 9.4027 9.4027 10.6728 10.6728 10.8424 10.8424 10.9624 10.9624 11.4800 11.4800 12.2024 12.2024 k = 0.0000 0.0000 0.3761 ( 2672 PWs) bands (ev): 4.1563 4.1563 6.3239 6.3239 6.7073 6.7073 7.3560 7.3560 7.8192 7.8192 7.8932 7.8932 8.0004 8.0004 8.1111 8.1111 8.5484 8.5484 8.6677 8.6677 8.7867 8.7867 8.8535 8.8535 9.4872 9.4872 10.6984 10.6984 10.8412 10.8412 10.9697 10.9697 11.5201 11.5201 12.2471 12.2471 k = 0.0000 0.0000 0.3597 ( 2672 PWs) bands (ev): 4.0796 4.0796 6.3304 6.3304 6.7019 6.7019 7.3454 7.3454 7.8204 7.8204 7.8930 7.8930 7.9808 7.9808 8.1080 8.1080 8.5532 8.5532 8.6719 8.6719 8.7560 8.7560 8.8365 8.8365 9.5741 9.5741 10.7146 10.7146 10.8409 10.8409 10.9835 10.9835 11.5645 11.5645 12.2895 12.2895 k = 0.0000 0.0000 0.3434 ( 2671 PWs) bands (ev): 4.0055 4.0055 6.3347 6.3347 6.6966 6.6966 7.3313 7.3313 7.7959 7.7959 7.9120 7.9120 7.9671 7.9671 8.1058 8.1058 8.5586 8.5586 8.6762 8.6762 8.7294 8.7294 8.8193 8.8193 9.6626 9.6626 10.7217 10.7217 10.8412 10.8412 11.0042 11.0042 11.6130 11.6130 12.3294 12.3294 k = 0.0000 0.0000 0.3270 ( 2675 PWs) bands (ev): 3.9341 3.9341 6.3373 6.3373 6.6914 6.6914 7.3148 7.3148 7.7599 7.7599 7.9180 7.9180 7.9770 7.9770 8.1045 8.1045 8.5647 8.5647 8.6797 8.6797 8.7079 8.7079 8.8015 8.8015 9.7518 9.7518 10.7207 10.7207 10.8422 10.8422 11.0303 11.0303 11.6654 11.6654 12.3665 12.3665 k = 0.0000 0.0000 0.3107 ( 2671 PWs) bands (ev): 3.8655 3.8655 6.3385 6.3385 6.6862 6.6862 7.2967 7.2967 7.7184 7.7184 7.9049 7.9049 8.0104 8.0104 8.1042 8.1042 8.5712 8.5712 8.6776 8.6776 8.6959 8.6959 8.7837 8.7837 9.8409 9.8409 10.7133 10.7133 10.8440 10.8440 11.0601 11.0601 11.7212 11.7212 12.4007 12.4007 k = 0.0000 0.0000 0.2943 ( 2663 PWs) bands (ev): 3.7998 3.7998 6.3388 6.3388 6.6813 6.6813 7.2777 7.2777 7.6735 7.6735 7.8878 7.8878 8.0502 8.0502 8.1048 8.1048 8.5777 8.5777 8.6667 8.6667 8.6961 8.6961 8.7663 8.7663 9.9291 9.9291 10.7010 10.7010 10.8467 10.8467 11.0919 11.0919 11.7801 11.7801 12.4320 12.4320 k = 0.0000 0.0000 0.2780 ( 2663 PWs) bands (ev): 3.7372 3.7372 6.3382 6.3382 6.6766 6.6766 7.2581 7.2581 7.6264 7.6264 7.8702 7.8702 8.0916 8.0916 8.1065 8.1065 8.5832 8.5832 8.6561 8.6561 8.6984 8.6984 8.7509 8.7509 10.0156 10.0156 10.6850 10.6850 10.8505 10.8505 11.1245 11.1245 11.8418 11.8418 12.4604 12.4604 k = 0.0000 0.0000 0.2616 ( 2655 PWs) bands (ev): 3.6778 3.6778 6.3370 6.3370 6.6726 6.6726 7.2385 7.2385 7.5781 7.5781 7.8529 7.8529 8.1091 8.1091 8.1329 8.1329 8.5859 8.5859 8.6499 8.6499 8.6981 8.6981 8.7401 8.7401 10.0996 10.0996 10.6661 10.6661 10.8551 10.8551 11.1570 11.1570 11.9060 11.9060 12.4861 12.4861 k = 0.0000 0.0000 0.2453 ( 2655 PWs) bands (ev): 3.6215 3.6215 6.3351 6.3351 6.6692 6.6692 7.2190 7.2190 7.5291 7.5291 7.8362 7.8362 8.1128 8.1128 8.1731 8.1731 8.5831 8.5831 8.6501 8.6501 8.6928 8.6928 8.7365 8.7365 10.1804 10.1804 10.6452 10.6452 10.8606 10.8606 11.1888 11.1888 11.9723 11.9723 12.5091 12.5091 k = 0.0000 0.0000 0.2289 ( 2649 PWs) bands (ev): 3.5685 3.5685 6.3329 6.3329 6.6668 6.6668 7.1999 7.1999 7.4801 7.4801 7.8204 7.8204 8.1175 8.1175 8.2115 8.2115 8.5743 8.5743 8.6568 8.6568 8.6841 8.6841 8.7391 8.7391 10.2572 10.2572 10.6227 10.6227 10.8668 10.8668 11.2196 11.2196 12.0403 12.0403 12.5295 12.5295 k = 0.0000 0.0000 0.2126 ( 2651 PWs) bands (ev): 3.5189 3.5189 6.3302 6.3302 6.6655 6.6655 7.1815 7.1815 7.4316 7.4316 7.8054 7.8054 8.1231 8.1231 8.2473 8.2473 8.5606 8.5606 8.6677 8.6677 8.6754 8.6754 8.7452 8.7452 10.3292 10.3292 10.5993 10.5993 10.8735 10.8735 11.2489 11.2489 12.1097 12.1097 12.5475 12.5475 k = 0.0000 0.0000 0.1962 ( 2651 PWs) bands (ev): 3.4727 3.4727 6.3272 6.3272 6.6655 6.6655 7.1639 7.1639 7.3840 7.3840 7.7913 7.7913 8.1298 8.1298 8.2801 8.2801 8.5437 8.5437 8.6675 8.6675 8.6816 8.6816 8.7538 8.7538 10.3954 10.3954 10.5761 10.5761 10.8804 10.8804 11.2766 11.2766 12.1802 12.1802 12.5631 12.5631 k = 0.0000 0.0000 0.1799 ( 2643 PWs) bands (ev): 3.4300 3.4300 6.3239 6.3239 6.6670 6.6670 7.1472 7.1472 7.3378 7.3378 7.7782 7.7782 8.1375 8.1375 8.3094 8.3094 8.5246 8.5246 8.6617 8.6617 8.6958 8.6958 8.7652 8.7652 10.4529 10.4529 10.5559 10.5559 10.8875 10.8875 11.3025 11.3025 12.2511 12.2511 12.5765 12.5765 k = 0.0000 0.0000 0.1635 ( 2653 PWs) bands (ev): 3.3909 3.3909 6.3203 6.3203 6.6700 6.6700 7.1316 7.1316 7.2930 7.2930 7.7661 7.7661 8.1461 8.1461 8.3349 8.3349 8.5042 8.5042 8.6573 8.6573 8.7089 8.7089 8.7798 8.7798 10.4870 10.4870 10.5537 10.5537 10.8944 10.8944 11.3265 11.3265 12.3221 12.3221 12.5879 12.5879 k = 0.0000 0.0000 0.1472 ( 2653 PWs) bands (ev): 3.3553 3.3553 6.3167 6.3167 6.6745 6.6745 7.1171 7.1171 7.2503 7.2503 7.7551 7.7551 8.1558 8.1558 8.3565 8.3565 8.4832 8.4832 8.6541 8.6541 8.7200 8.7200 8.7980 8.7980 10.4802 10.4802 10.5871 10.5871 10.9010 10.9010 11.3485 11.3485 12.3927 12.3927 12.5974 12.5974 k = 0.0000 0.0000 0.1308 ( 2657 PWs) bands (ev): 3.3234 3.3234 6.3130 6.3130 6.6804 6.6804 7.1038 7.1038 7.2097 7.2097 7.7452 7.7452 8.1664 8.1664 8.3741 8.3741 8.4624 8.4624 8.6518 8.6518 8.7287 8.7287 8.8190 8.8190 10.4599 10.4599 10.6293 10.6293 10.9069 10.9069 11.3683 11.3683 12.4620 12.4620 12.6053 12.6053 k = 0.0000 0.0000 0.1145 ( 2657 PWs) bands (ev): 3.2951 3.2951 6.3094 6.3094 6.6877 6.6877 7.0918 7.0918 7.1718 7.1718 7.7363 7.7363 8.1781 8.1781 8.3867 8.3867 8.4431 8.4431 8.6502 8.6502 8.7356 8.7356 8.8415 8.8415 10.4378 10.4378 10.6689 10.6689 10.9121 10.9121 11.3860 11.3860 12.5291 12.5291 12.6120 12.6120 k = 0.0000 0.0000 0.0981 ( 2661 PWs) bands (ev): 3.2706 3.2706 6.3059 6.3059 6.6961 6.6961 7.0809 7.0809 7.1371 7.1371 7.7286 7.7286 8.1908 8.1908 8.3907 8.3907 8.4297 8.4297 8.6491 8.6491 8.7410 8.7410 8.8642 8.8642 10.4164 10.4164 10.7042 10.7042 10.9162 10.9162 11.4015 11.4015 12.5916 12.5916 12.6192 12.6192 k = 0.0000 0.0000 0.0818 ( 2655 PWs) bands (ev): 3.2497 3.2497 6.3028 6.3028 6.7051 6.7051 7.0708 7.0708 7.1065 7.1065 7.7222 7.7222 8.2044 8.2044 8.3810 8.3810 8.4279 8.4279 8.6484 8.6484 8.7452 8.7452 8.8857 8.8857 10.3969 10.3969 10.7347 10.7347 10.9192 10.9192 11.4147 11.4147 12.6182 12.6182 12.6569 12.6569 k = 0.0000 0.0000 0.0654 ( 2651 PWs) bands (ev): 3.2326 3.2326 6.3001 6.3001 6.7144 6.7144 7.0597 7.0597 7.0822 7.0822 7.7169 7.7169 8.2190 8.2190 8.3635 8.3635 8.4320 8.4320 8.6479 8.6479 8.7485 8.7485 8.9049 8.9049 10.3798 10.3798 10.7602 10.7602 10.9211 10.9211 11.4255 11.4255 12.6224 12.6224 12.7102 12.7102 k = 0.0000 0.0000 0.0491 ( 2655 PWs) bands (ev): 3.2193 3.2193 6.2979 6.2979 6.7232 6.7232 7.0448 7.0448 7.0681 7.0681 7.7127 7.7127 8.2344 8.2344 8.3441 8.3441 8.4364 8.4364 8.6476 8.6476 8.7509 8.7509 8.9208 8.9208 10.3659 10.3659 10.7806 10.7806 10.9219 10.9219 11.4339 11.4339 12.6249 12.6249 12.7564 12.7564 k = 0.0000 0.0000 0.0327 ( 2663 PWs) bands (ev): 3.2098 3.2098 6.2963 6.2963 6.7305 6.7305 7.0296 7.0296 7.0613 7.0613 7.7097 7.7097 8.2506 8.2506 8.3246 8.3246 8.4398 8.4398 8.6473 8.6473 8.7526 8.7526 8.9327 8.9327 10.3556 10.3556 10.7956 10.7956 10.9219 10.9219 11.4400 11.4400 12.6265 12.6265 12.7923 12.7923 k = 0.0000 0.0000 0.0164 ( 2663 PWs) bands (ev): 3.2041 3.2041 6.2953 6.2953 6.7354 6.7354 7.0193 7.0193 7.0580 7.0580 7.7079 7.7079 8.2675 8.2675 8.3056 8.3056 8.4420 8.4420 8.6472 8.6472 8.7536 8.7536 8.9400 8.9400 10.3492 10.3492 10.8049 10.8049 10.9217 10.9217 11.4436 11.4436 12.6275 12.6275 12.8153 12.8153 k = 0.0000 0.0000 0.0000 ( 2667 PWs) bands (ev): 3.2022 3.2022 6.2950 6.2950 6.7372 6.7372 7.0156 7.0156 7.0569 7.0569 7.7073 7.7073 8.2812 8.2812 8.2912 8.2912 8.4427 8.4427 8.6472 8.6472 8.7539 8.7539 8.9425 8.9425 10.3471 10.3471 10.8081 10.8081 10.9216 10.9216 11.4448 11.4448 12.6278 12.6278 12.8232 12.8232 k = 0.0000 0.0000 0.0000 ( 2667 PWs) bands (ev): 3.2022 3.2022 6.2950 6.2950 6.7372 6.7372 7.0156 7.0156 7.0569 7.0569 7.7073 7.7073 8.2812 8.2812 8.2912 8.2912 8.4427 8.4427 8.6472 8.6472 8.7539 8.7539 8.9425 8.9425 10.3471 10.3471 10.8081 10.8081 10.9216 10.9216 11.4448 11.4448 12.6278 12.6278 12.8232 12.8232 k =-0.0156 0.0051 0.0000 ( 2663 PWs) bands (ev): 3.2041 3.2041 6.2956 6.2956 6.7358 6.7358 7.0164 7.0164 7.0565 7.0565 7.7069 7.7069 8.2816 8.2816 8.2900 8.2900 8.4416 8.4416 8.6478 8.6478 8.7540 8.7540 8.9420 8.9420 10.3450 10.3450 10.8076 10.8076 10.9217 10.9217 11.4461 11.4461 12.6269 12.6269 12.8278 12.8278 k =-0.0312 0.0103 0.0000 ( 2655 PWs) bands (ev): 3.2097 3.2097 6.2975 6.2975 6.7317 6.7317 7.0188 7.0188 7.0554 7.0554 7.7058 7.7058 8.2826 8.2826 8.2866 8.2866 8.4384 8.4384 8.6495 8.6495 8.7541 8.7541 8.9405 8.9405 10.3390 10.3390 10.8062 10.8062 10.9223 10.9223 11.4500 11.4500 12.6246 12.6246 12.8415 12.8415 k =-0.0469 0.0154 0.0000 ( 2651 PWs) bands (ev): 3.2191 3.2191 6.3004 6.3004 6.7250 6.7250 7.0224 7.0224 7.0536 7.0536 7.7040 7.7040 8.2808 8.2808 8.2844 8.2844 8.4331 8.4331 8.6522 8.6522 8.7543 8.7543 8.9378 8.9378 10.3290 10.3290 10.8040 10.8040 10.9231 10.9231 11.4563 11.4563 12.6217 12.6217 12.8629 12.8629 k =-0.0625 0.0206 0.0000 ( 2651 PWs) bands (ev): 3.2322 3.2322 6.3043 6.3043 6.7159 6.7159 7.0269 7.0269 7.0518 7.0518 7.7015 7.7015 8.2730 8.2730 8.2867 8.2867 8.4257 8.4257 8.6557 8.6557 8.7545 8.7545 8.9340 8.9340 10.3154 10.3154 10.8010 10.8010 10.9242 10.9242 11.4650 11.4650 12.6190 12.6190 12.8625 12.8625 k =-0.0781 0.0257 0.0000 ( 2651 PWs) bands (ev): 3.2489 3.2489 6.3088 6.3088 6.7049 6.7049 7.0304 7.0304 7.0516 7.0516 7.6984 7.6984 8.2632 8.2632 8.2897 8.2897 8.4162 8.4162 8.6598 8.6598 8.7548 8.7548 8.9292 8.9292 10.2985 10.2985 10.7974 10.7974 10.9254 10.9254 11.4759 11.4759 12.6169 12.6169 12.8037 12.8037 k =-0.0938 0.0308 0.0000 ( 2657 PWs) bands (ev): 3.2694 3.2694 6.3135 6.3135 6.6922 6.6922 7.0302 7.0302 7.0558 7.0558 7.6946 7.6946 8.2516 8.2516 8.2931 8.2931 8.4047 8.4047 8.6640 8.6640 8.7553 8.7553 8.9233 8.9233 10.2785 10.2785 10.7933 10.7933 10.9268 10.9268 11.4888 11.4888 12.6148 12.6148 12.7398 12.7398 k =-0.1094 0.0360 0.0000 ( 2657 PWs) bands (ev): 3.2934 3.2934 6.3177 6.3177 6.6786 6.6786 7.0262 7.0262 7.0647 7.0647 7.6903 7.6903 8.2384 8.2384 8.2970 8.2970 8.3913 8.3913 8.6682 8.6682 8.7559 8.7559 8.9163 8.9163 10.2561 10.2561 10.7889 10.7889 10.9282 10.9282 11.5033 11.5033 12.6077 12.6077 12.6785 12.6785 k =-0.1250 0.0411 0.0000 ( 2667 PWs) bands (ev): 3.3211 3.3211 6.3206 6.3206 6.6649 6.6649 7.0200 7.0200 7.0764 7.0764 7.6856 7.6856 8.2237 8.2237 8.3013 8.3013 8.3761 8.3761 8.6720 8.6720 8.7568 8.7568 8.9084 8.9084 10.2316 10.2316 10.7842 10.7842 10.9295 10.9295 11.5194 11.5194 12.5713 12.5713 12.6460 12.6460 k =-0.1406 0.0462 0.0000 ( 2667 PWs) bands (ev): 3.3523 3.3523 6.3213 6.3213 6.6518 6.6518 7.0126 7.0126 7.0902 7.0902 7.6804 7.6804 8.2078 8.2078 8.3057 8.3057 8.3594 8.3594 8.6752 8.6752 8.7581 8.7581 8.8995 8.8995 10.2055 10.2055 10.7796 10.7796 10.9305 10.9305 11.5366 11.5366 12.5058 12.5058 12.6435 12.6435 k =-0.1562 0.0514 0.0000 ( 2671 PWs) bands (ev): 3.3869 3.3869 6.3184 6.3184 6.6407 6.6407 7.0044 7.0044 7.1057 7.1057 7.6749 7.6749 8.1908 8.1908 8.3095 8.3095 8.3419 8.3419 8.6774 8.6774 8.7596 8.7596 8.8896 8.8896 10.1784 10.1784 10.7749 10.7749 10.9312 10.9312 11.5547 11.5547 12.4344 12.4344 12.6489 12.6489 k =-0.1719 0.0565 0.0000 ( 2673 PWs) bands (ev): 3.4250 3.4250 6.3107 6.3107 6.6324 6.6324 6.9958 6.9958 7.1227 7.1227 7.6692 7.6692 8.1728 8.1728 8.3085 8.3085 8.3278 8.3278 8.6786 8.6786 8.7614 8.7614 8.8790 8.8790 10.1508 10.1508 10.7705 10.7705 10.9314 10.9314 11.5733 11.5733 12.3626 12.3626 12.6574 12.6574 k =-0.1875 0.0617 0.0000 ( 2677 PWs) bands (ev): 3.4663 3.4663 6.2971 6.2971 6.6278 6.6278 6.9871 6.9871 7.1412 7.1412 7.6633 7.6633 8.1540 8.1540 8.2933 8.2933 8.3269 8.3269 8.6787 8.6787 8.7634 8.7634 8.8674 8.8674 10.1231 10.1231 10.7663 10.7663 10.9308 10.9308 11.5921 11.5921 12.2923 12.2923 12.6679 12.6679 k =-0.2031 0.0668 0.0000 ( 2673 PWs) bands (ev): 3.5109 3.5109 6.2770 6.2770 6.6272 6.6272 6.9787 6.9787 7.1609 7.1609 7.6572 7.6572 8.1346 8.1346 8.2717 8.2717 8.3312 8.3312 8.6778 8.6778 8.7654 8.7654 8.8552 8.8552 10.0956 10.0956 10.7623 10.7623 10.9294 10.9294 11.6107 11.6107 12.2243 12.2243 12.6799 12.6799 k =-0.2188 0.0719 0.0000 ( 2671 PWs) bands (ev): 3.5585 3.5585 6.2504 6.2504 6.6301 6.6301 6.9711 6.9711 7.1818 7.1818 7.6511 7.6511 8.1146 8.1146 8.2484 8.2484 8.3365 8.3365 8.6760 8.6760 8.7670 8.7670 8.8425 8.8425 10.0689 10.0689 10.7587 10.7587 10.9270 10.9270 11.6287 11.6287 12.1594 12.1594 12.6931 12.6931 k =-0.2344 0.0771 0.0000 ( 2671 PWs) bands (ev): 3.6092 3.6092 6.2176 6.2176 6.6355 6.6355 6.9647 6.9647 7.2036 7.2036 7.6449 7.6449 8.0941 8.0941 8.2244 8.2244 8.3422 8.3422 8.6733 8.6733 8.7679 8.7679 8.8296 8.8296 10.0431 10.0431 10.7556 10.7556 10.9234 10.9234 11.6458 11.6458 12.0981 12.0981 12.7071 12.7071 k =-0.2500 0.0822 0.0000 ( 2675 PWs) bands (ev): 3.6627 3.6627 6.1793 6.1793 6.6424 6.6424 6.9602 6.9602 7.2263 7.2263 7.6388 7.6388 8.0732 8.0732 8.2001 8.2001 8.3478 8.3478 8.6700 8.6700 8.7673 8.7673 8.8170 8.8170 10.0184 10.0184 10.7528 10.7528 10.9185 10.9185 11.6616 11.6616 12.0409 12.0409 12.7218 12.7218 k =-0.2656 0.0874 0.0000 ( 2679 PWs) bands (ev): 3.7188 3.7188 6.1360 6.1360 6.6495 6.6495 6.9580 6.9580 7.2498 7.2498 7.6328 7.6328 8.0522 8.0522 8.1760 8.1760 8.3534 8.3534 8.6662 8.6662 8.7642 8.7642 8.8059 8.8059 9.9950 9.9950 10.7504 10.7504 10.9122 10.9122 11.6756 11.6756 11.9882 11.9882 12.7368 12.7368 k =-0.2812 0.0925 0.0000 ( 2679 PWs) bands (ev): 3.7775 3.7775 6.0882 6.0882 6.6558 6.6558 6.9588 6.9588 7.2738 7.2738 7.6270 7.6270 8.0310 8.0310 8.1526 8.1526 8.3589 8.3589 8.6619 8.6619 8.7574 8.7574 8.7975 8.7975 9.9731 9.9731 10.7484 10.7484 10.9045 10.9045 11.6875 11.6875 11.9401 11.9401 12.7518 12.7519 k =-0.2969 0.0976 0.0000 ( 2681 PWs) bands (ev): 3.8384 3.8384 6.0366 6.0366 6.6605 6.6605 6.9628 6.9628 7.2980 7.2980 7.6214 7.6214 8.0099 8.0099 8.1302 8.1302 8.3642 8.3642 8.6574 8.6574 8.7465 8.7465 8.7921 8.7921 9.9526 9.9526 10.7468 10.7468 10.8955 10.8955 11.6969 11.6969 11.8970 11.8970 12.7666 12.7666 k =-0.3125 0.1028 0.0000 ( 2671 PWs) bands (ev): 3.9013 3.9013 5.9814 5.9814 6.6632 6.6632 6.9699 6.9699 7.3225 7.3225 7.6160 7.6160 7.9890 7.9890 8.1092 8.1092 8.3693 8.3693 8.6526 8.6526 8.7330 8.7330 8.7886 8.7886 9.9335 9.9335 10.7455 10.7455 10.8853 10.8853 11.7035 11.7035 11.8590 11.8590 12.7804 12.7804 k =-0.3281 0.1079 0.0000 ( 2675 PWs) bands (ev): 3.9659 3.9659 5.9233 5.9233 6.6638 6.6638 6.9800 6.9800 7.3468 7.3468 7.6110 7.6110 7.9687 7.9687 8.0896 8.0896 8.3741 8.3741 8.6476 8.6476 8.7181 8.7181 8.7859 8.7859 9.9160 9.9160 10.7446 10.7446 10.8740 10.8740 11.7070 11.7070 11.8263 11.8263 12.7919 12.7919 k =-0.3438 0.1130 0.0000 ( 2689 PWs) bands (ev): 4.0318 4.0318 5.8627 5.8627 6.6625 6.6625 6.9924 6.9924 7.3706 7.3706 7.6062 7.6062 7.9491 7.9491 8.0716 8.0716 8.3785 8.3785 8.6424 8.6424 8.7026 8.7026 8.7833 8.7833 9.8999 9.8999 10.7440 10.7440 10.8619 10.8619 11.7069 11.7069 11.7991 11.7991 12.7963 12.7963 k =-0.3594 0.1182 0.0000 ( 2695 PWs) bands (ev): 4.0986 4.0986 5.8002 5.8002 6.6597 6.6597 7.0065 7.0065 7.3937 7.3937 7.6018 7.6018 7.9306 7.9306 8.0554 8.0554 8.3826 8.3826 8.6369 8.6369 8.6875 8.6875 8.7806 8.7806 9.8853 9.8853 10.7436 10.7436 10.8494 10.8494 11.7033 11.7033 11.7774 11.7774 12.7846 12.7846 k =-0.3750 0.1233 0.0000 ( 2695 PWs) bands (ev): 4.1656 4.1656 5.7366 5.7366 6.6559 6.6559 7.0214 7.0214 7.4159 7.4159 7.5978 7.5978 7.9135 7.9135 8.0410 8.0410 8.3864 8.3864 8.6311 8.6311 8.6733 8.6733 8.7778 8.7778 9.8722 9.8722 10.7434 10.7434 10.8369 10.8369 11.6963 11.6963 11.7611 11.7611 12.7632 12.7632 k =-0.3906 0.1285 0.0000 ( 2697 PWs) bands (ev): 4.2321 4.2321 5.6727 5.6727 6.6516 6.6516 7.0363 7.0363 7.4367 7.4367 7.5942 7.5942 7.8980 7.8980 8.0284 8.0284 8.3899 8.3899 8.6247 8.6247 8.6606 8.6606 8.7749 8.7749 9.8606 9.8606 10.7433 10.7433 10.8247 10.8247 11.6871 11.6871 11.7490 11.7490 12.7425 12.7425 k =-0.4062 0.1336 0.0000 ( 2697 PWs) bands (ev): 4.2971 4.2971 5.6097 5.6097 6.6471 6.6471 7.0507 7.0507 7.4558 7.4558 7.5910 7.5910 7.8843 7.8843 8.0175 8.0175 8.3929 8.3929 8.6174 8.6174 8.6502 8.6502 8.7720 8.7720 9.8504 9.8504 10.7434 10.7434 10.8132 10.8132 11.6772 11.6772 11.7398 11.7398 12.7249 12.7249 k =-0.4219 0.1387 0.0000 ( 2697 PWs) bands (ev): 4.3592 4.3592 5.5490 5.5490 6.6428 6.6428 7.0638 7.0638 7.4728 7.4728 7.5883 7.5883 7.8725 7.8725 8.0083 8.0083 8.3955 8.3955 8.6095 8.6095 8.6422 8.6422 8.7692 8.7692 9.8418 9.8418 10.7436 10.7436 10.8028 10.8028 11.6678 11.6678 11.7324 11.7324 12.7108 12.7108 k =-0.4375 0.1439 0.0000 ( 2690 PWs) bands (ev): 4.4165 4.4165 5.4927 5.4927 6.6389 6.6389 7.0753 7.0753 7.4873 7.4873 7.5860 7.5860 7.8628 7.8628 8.0009 8.0009 8.3977 8.3977 8.6016 8.6016 8.6364 8.6364 8.7667 8.7667 9.8347 9.8347 10.7438 10.7438 10.7938 10.7938 11.6598 11.6598 11.7265 11.7265 12.6999 12.6999 k =-0.4531 0.1490 0.0000 ( 2690 PWs) bands (ev): 4.4666 4.4666 5.4433 5.4433 6.6358 6.6358 7.0846 7.0846 7.4991 7.4991 7.5843 7.5843 7.8552 7.8552 7.9951 7.9951 8.3994 8.3994 8.5946 8.5946 8.6324 8.6324 8.7645 8.7645 9.8291 9.8291 10.7439 10.7439 10.7865 10.7865 11.6533 11.6533 11.7217 11.7217 12.6920 12.6920 k =-0.4688 0.1542 0.0000 ( 2690 PWs) bands (ev): 4.5062 4.5062 5.4040 5.4040 6.6334 6.6334 7.0915 7.0915 7.5077 7.5077 7.5830 7.5830 7.8498 7.8498 7.9910 7.9910 8.4007 8.4007 8.5891 8.5891 8.6297 8.6297 8.7629 8.7629 9.8251 9.8251 10.7441 10.7441 10.7812 10.7812 11.6487 11.6487 11.7182 11.7182 12.6866 12.6866 k =-0.4844 0.1593 0.0000 ( 2694 PWs) bands (ev): 4.5321 4.5321 5.3784 5.3784 6.6319 6.6319 7.0957 7.0957 7.5130 7.5130 7.5822 7.5822 7.8465 7.8465 7.9885 7.9885 8.4014 8.4014 8.5855 8.5855 8.6282 8.6282 8.7619 8.7619 9.8227 9.8227 10.7442 10.7442 10.7779 10.7779 11.6458 11.6458 11.7161 11.7161 12.6835 12.6835 k =-0.5000 0.1644 0.0000 ( 2696 PWs) bands (ev): 4.5411 4.5411 5.3695 5.3695 6.6314 6.6314 7.0971 7.0971 7.5147 7.5147 7.5819 7.5819 7.8454 7.8454 7.9877 7.9877 8.4016 8.4016 8.5843 8.5843 8.6277 8.6277 8.7615 8.7615 9.8219 9.8219 10.7442 10.7442 10.7768 10.7768 11.6449 11.6449 11.7154 11.7154 12.6824 12.6824 k =-0.5000 0.1644 0.0000 ( 2696 PWs) bands (ev): 4.5411 4.5411 5.3695 5.3695 6.6314 6.6314 7.0971 7.0971 7.5147 7.5147 7.5819 7.5819 7.8454 7.8454 7.9877 7.9877 8.4016 8.4016 8.5843 8.5843 8.6277 8.6277 8.7615 8.7615 9.8219 9.8219 10.7442 10.7442 10.7768 10.7768 11.6449 11.6449 11.7154 11.7154 12.6824 12.6824 k =-0.4948 0.1802-0.0000 ( 2692 PWs) bands (ev): 4.5425 4.5425 5.3713 5.3713 6.6324 6.6324 7.0978 7.0978 7.5133 7.5133 7.5837 7.5837 7.8450 7.8450 7.9866 7.9866 8.4000 8.4000 8.5855 8.5855 8.6283 8.6283 8.7622 8.7622 9.8233 9.8233 10.7444 10.7444 10.7738 10.7738 11.6455 11.6455 11.7160 11.7160 12.6829 12.6829 k =-0.4896 0.1960-0.0000 ( 2692 PWs) bands (ev): 4.5470 4.5470 5.3767 5.3767 6.6356 6.6356 7.0999 7.0999 7.5095 7.5095 7.5884 7.5884 7.8436 7.8436 7.9835 7.9835 8.3951 8.3951 8.5889 8.5889 8.6301 8.6301 8.7641 8.7641 9.8274 9.8274 10.7450 10.7450 10.7648 10.7648 11.6472 11.6472 11.7179 11.7179 12.6844 12.6844 k =-0.4844 0.2117-0.0000 ( 2684 PWs) bands (ev): 4.5544 4.5544 5.3856 5.3856 6.6407 6.6407 7.1034 7.1034 7.5040 7.5040 7.5954 7.5954 7.8414 7.8414 7.9784 7.9784 8.3875 8.3875 8.5942 8.5942 8.6331 8.6331 8.7672 8.7672 9.8342 9.8342 10.7461 10.7461 10.7500 10.7500 11.6501 11.6501 11.7211 11.7211 12.6868 12.6868 k =-0.4793 0.2275-0.0000 ( 2684 PWs) bands (ev): 4.5647 4.5647 5.3982 5.3982 6.6479 6.6479 7.1083 7.1083 7.4976 7.4976 7.6038 7.6038 7.8382 7.8382 7.9717 7.9717 8.3775 8.3775 8.6009 8.6009 8.6372 8.6372 8.7713 8.7713 9.8436 9.8436 10.7294 10.7294 10.7476 10.7476 11.6540 11.6540 11.7255 11.7255 12.6903 12.6903 k =-0.4741 0.2433-0.0000 ( 2683 PWs) bands (ev): 4.5778 4.5778 5.4142 5.4142 6.6570 6.6570 7.1144 7.1144 7.4908 7.4908 7.6132 7.6132 7.8340 7.8340 7.9637 7.9637 8.3657 8.3657 8.6086 8.6086 8.6424 8.6424 8.7764 8.7764 9.8555 9.8555 10.7033 10.7033 10.7496 10.7496 11.6589 11.6589 11.7309 11.7309 12.6949 12.6949 k =-0.4689 0.2590-0.0000 ( 2683 PWs) bands (ev): 4.5939 4.5939 5.4337 5.4337 6.6681 6.6681 7.1217 7.1217 7.4839 7.4839 7.6232 7.6232 7.8289 7.8289 7.9549 7.9549 8.3524 8.3524 8.6169 8.6169 8.6485 8.6485 8.7823 8.7823 9.8696 9.8696 10.6720 10.6720 10.7522 10.7522 11.6648 11.6648 11.7374 11.7374 12.7005 12.7005 k =-0.4637 0.2748-0.0000 ( 2685 PWs) bands (ev): 4.6127 4.6127 5.4565 5.4565 6.6811 6.6811 7.1300 7.1300 7.4771 7.4771 7.6336 7.6336 7.8226 7.8226 7.9459 7.9459 8.3380 8.3380 8.6255 8.6255 8.6555 8.6555 8.7887 8.7887 9.8860 9.8860 10.6357 10.6357 10.7554 10.7554 11.6714 11.6714 11.7447 11.7447 12.7073 12.7073 k =-0.4585 0.2906-0.0000 ( 2683 PWs) bands (ev): 4.6342 4.6342 5.4827 5.4827 6.6959 6.6959 7.1392 7.1392 7.4705 7.4705 7.6441 7.6441 7.8151 7.8151 7.9373 7.9373 8.3227 8.3227 8.6342 8.6342 8.6631 8.6631 8.7956 8.7956 9.9042 9.9042 10.5949 10.5949 10.7592 10.7592 11.6788 11.6788 11.7527 11.7527 12.7151 12.7151 k =-0.4533 0.3063-0.0000 ( 2679 PWs) bands (ev): 4.6584 4.6584 5.5120 5.5120 6.7123 6.7123 7.1492 7.1492 7.4642 7.4642 7.6547 7.6547 7.8062 7.8062 7.9298 7.9298 8.3069 8.3069 8.6429 8.6429 8.6712 8.6712 8.8029 8.8029 9.9241 9.9241 10.5499 10.5499 10.7637 10.7637 11.6866 11.6866 11.7611 11.7611 12.7234 12.7234 k =-0.4481 0.3221-0.0000 ( 2677 PWs) bands (ev): 4.6852 4.6852 5.5444 5.5444 6.7304 6.7304 7.1597 7.1597 7.4583 7.4583 7.6649 7.6649 7.7960 7.7960 7.9240 7.9240 8.2906 8.2906 8.6516 8.6516 8.6798 8.6798 8.8103 8.8103 9.9454 9.9454 10.5010 10.5010 10.7691 10.7691 11.6948 11.6948 11.7698 11.7698 12.7304 12.7304 k =-0.4430 0.3379-0.0000 ( 2673 PWs) bands (ev): 4.7145 4.7145 5.5798 5.5798 6.7501 6.7501 7.1706 7.1706 7.4528 7.4528 7.6745 7.6745 7.7849 7.7849 7.9205 7.9205 8.2740 8.2740 8.6601 8.6601 8.6886 8.6886 8.8179 8.8179 9.9678 9.9678 10.4487 10.4487 10.7752 10.7752 11.7031 11.7031 11.7785 11.7785 12.7312 12.7312 k =-0.4378 0.3536-0.0000 ( 2681 PWs) bands (ev): 4.7462 4.7462 5.6180 5.6180 6.7711 6.7711 7.1817 7.1817 7.4477 7.4477 7.6827 7.6827 7.7734 7.7734 7.9194 7.9194 8.2572 8.2572 8.6683 8.6683 8.6976 8.6976 8.8255 8.8255 9.9909 9.9909 10.3933 10.3933 10.7821 10.7821 11.7113 11.7113 11.7868 11.7868 12.7203 12.7203 k =-0.4326 0.3694-0.0000 ( 2683 PWs) bands (ev): 4.7801 4.7801 5.6589 5.6589 6.7934 6.7934 7.1929 7.1929 7.4431 7.4431 7.6882 7.6882 7.7634 7.7634 7.9211 7.9211 8.2403 8.2403 8.6761 8.6761 8.7069 8.7069 8.8332 8.8332 10.0145 10.0145 10.3354 10.3354 10.7898 10.7898 11.7191 11.7191 11.7946 11.7946 12.7009 12.7009 k =-0.4274 0.3852-0.0000 ( 2679 PWs) bands (ev): 4.8163 4.8163 5.7023 5.7023 6.8168 6.8168 7.2039 7.2039 7.4390 7.4390 7.6889 7.6889 7.7571 7.7571 7.9257 7.9257 8.2234 8.2234 8.6834 8.6834 8.7164 8.7164 8.8408 8.8408 10.0380 10.0380 10.2755 10.2755 10.7982 10.7982 11.7261 11.7261 11.8015 11.8015 12.6774 12.6774 k =-0.4222 0.4009-0.0000 ( 2679 PWs) bands (ev): 4.8545 4.8545 5.7480 5.7480 6.8413 6.8413 7.2145 7.2145 7.4355 7.4355 7.6831 7.6831 7.7567 7.7567 7.9331 7.9331 8.2066 8.2066 8.6901 8.6901 8.7259 8.7259 8.8485 8.8485 10.0609 10.0609 10.2143 10.2143 10.8071 10.8071 11.7320 11.7320 11.8074 11.8074 12.6518 12.6518 k =-0.4170 0.4167-0.0000 ( 2679 PWs) bands (ev): 4.8946 4.8946 5.7959 5.7959 6.8666 6.8666 7.2248 7.2248 7.4324 7.4324 7.6716 7.6716 7.7613 7.7613 7.9433 7.9433 8.1899 8.1899 8.6961 8.6961 8.7356 8.7356 8.8562 8.8562 10.0804 10.0804 10.1546 10.1546 10.8162 10.8162 11.7360 11.7360 11.8121 11.8121 12.6250 12.6250 k =-0.4119 0.4325-0.0000 ( 2677 PWs) bands (ev): 4.9365 4.9365 5.8457 5.8457 6.8926 6.8926 7.2345 7.2345 7.4299 7.4299 7.6569 7.6569 7.7690 7.7690 7.9562 7.9562 8.1735 8.1735 8.7013 8.7013 8.7454 8.7454 8.8639 8.8639 10.0696 10.0696 10.1236 10.1236 10.8252 10.8252 11.7377 11.7377 11.8156 11.8156 12.5976 12.5976 k =-0.4067 0.4482-0.0000 ( 2681 PWs) bands (ev): 4.9801 4.9801 5.8972 5.8972 6.9192 6.9192 7.2436 7.2436 7.4279 7.4279 7.6407 7.6407 7.7782 7.7782 7.9719 7.9719 8.1573 8.1573 8.7058 8.7058 8.7551 8.7551 8.8719 8.8719 10.0116 10.0116 10.1382 10.1382 10.8334 10.8334 11.7364 11.7364 11.8181 11.8181 12.5703 12.5703 k =-0.4015 0.4640-0.0000 ( 2689 PWs) bands (ev): 5.0252 5.0252 5.9501 5.9501 6.9461 6.9461 7.2522 7.2522 7.4265 7.4265 7.6239 7.6239 7.7881 7.7881 7.9903 7.9903 8.1414 8.1414 8.7095 8.7095 8.7647 8.7647 8.8801 8.8801 9.9468 9.9468 10.1584 10.1584 10.8401 10.8401 11.7314 11.7314 11.8194 11.8194 12.5437 12.5437 k =-0.3963 0.4798-0.0000 ( 2679 PWs) bands (ev): 5.0716 5.0716 6.0043 6.0043 6.9732 6.9732 7.2604 7.2604 7.4257 7.4257 7.6072 7.6072 7.7984 7.7984 8.0112 8.0112 8.1259 8.1259 8.7125 8.7125 8.7742 8.7742 8.8887 8.8887 9.8809 9.8809 10.1788 10.1788 10.8446 10.8446 11.7221 11.7221 11.8197 11.8197 12.5187 12.5187 k =-0.3911 0.4955-0.0000 ( 2679 PWs) bands (ev): 5.1193 5.1193 6.0593 6.0593 7.0003 7.0003 7.2682 7.2682 7.4255 7.4255 7.5908 7.5908 7.8087 7.8087 8.0344 8.0344 8.1108 8.1108 8.7147 8.7147 8.7834 8.7834 8.8979 8.8979 9.8148 9.8148 10.1988 10.1988 10.8459 10.8459 11.7084 11.7084 11.8188 11.8188 12.4961 12.4961 k =-0.3859 0.5113-0.0000 ( 2675 PWs) bands (ev): 5.1679 5.1679 6.1150 6.1150 7.0272 7.0272 7.2758 7.2758 7.4258 7.4258 7.5749 7.5749 7.8188 7.8188 8.0597 8.0597 8.0963 8.0963 8.7161 8.7161 8.7921 8.7921 8.9079 8.9079 9.7491 9.7491 10.2182 10.2182 10.8427 10.8427 11.6899 11.6899 11.8166 11.8166 12.4768 12.4768 k =-0.3807 0.5271-0.0000 ( 2675 PWs) bands (ev): 5.2174 5.2174 6.1710 6.1710 7.0537 7.0537 7.2834 7.2834 7.4268 7.4268 7.5598 7.5598 7.8286 7.8286 8.0797 8.0797 8.0898 8.0898 8.7168 8.7168 8.8003 8.8003 8.9187 8.9187 9.6841 9.6841 10.2369 10.2369 10.8341 10.8341 11.6666 11.6666 11.8127 11.8127 12.4618 12.4618 k =-0.3756 0.5428-0.0000 ( 2675 PWs) bands (ev): 5.2676 5.2676 6.2270 6.2270 7.0797 7.0797 7.2912 7.2912 7.4283 7.4283 7.5457 7.5457 7.8379 7.8379 8.0677 8.0677 8.1176 8.1176 8.7169 8.7169 8.8078 8.8078 8.9305 8.9305 9.6201 9.6201 10.2552 10.2552 10.8190 10.8190 11.6385 11.6385 11.8071 11.8071 12.4522 12.4522 k =-0.3704 0.5586-0.0000 ( 2683 PWs) bands (ev): 5.3183 5.3183 6.2825 6.2825 7.1049 7.1049 7.2993 7.2993 7.4304 7.4304 7.5326 7.5326 7.8465 7.8465 8.0547 8.0547 8.1486 8.1486 8.7162 8.7162 8.8147 8.8147 8.9433 8.9433 9.5574 9.5574 10.2729 10.2729 10.7966 10.7966 11.6056 11.6056 11.7996 11.7996 12.4486 12.4486 k =-0.3652 0.5744-0.0000 ( 2691 PWs) bands (ev): 5.3693 5.3693 6.3374 6.3374 7.1291 7.1291 7.3081 7.3081 7.4330 7.4330 7.5209 7.5209 7.8544 7.8544 8.0423 8.0423 8.1812 8.1812 8.7148 8.7148 8.8209 8.8209 8.9574 8.9574 9.4965 9.4965 10.2902 10.2902 10.7665 10.7665 11.5681 11.5681 11.7902 11.7902 12.4518 12.4518 k =-0.3600 0.5901-0.0000 ( 2679 PWs) bands (ev): 5.4204 5.4204 6.3912 6.3912 7.1521 7.1521 7.3177 7.3177 7.4362 7.4362 7.5106 7.5106 7.8614 7.8614 8.0305 8.0305 8.2151 8.2151 8.7130 8.7130 8.8265 8.8265 8.9729 8.9729 9.4375 9.4375 10.3067 10.3067 10.7287 10.7287 11.5260 11.5260 11.7790 11.7790 12.4621 12.4621 k =-0.3548 0.6059-0.0000 ( 2685 PWs) bands (ev): 5.4715 5.4715 6.4435 6.4435 7.1736 7.1736 7.3284 7.3284 7.4397 7.4397 7.5019 7.5019 7.8674 7.8674 8.0193 8.0193 8.2501 8.2501 8.7105 8.7105 8.8314 8.8314 8.9896 8.9896 9.3808 9.3808 10.3222 10.3222 10.6840 10.6840 11.4794 11.4794 11.7660 11.7660 12.4793 12.4793 k =-0.3496 0.6217-0.0000 ( 2685 PWs) bands (ev): 5.5224 5.5224 6.4940 6.4940 7.1934 7.1934 7.3403 7.3403 7.4436 7.4436 7.4950 7.4950 7.8722 7.8722 8.0089 8.0089 8.2860 8.2860 8.7075 8.7075 8.8359 8.8359 9.0075 9.0075 9.3267 9.3267 10.3352 10.3352 10.6343 10.6343 11.4285 11.4285 11.7514 11.7514 12.5034 12.5034 k =-0.3444 0.6374-0.0000 ( 2685 PWs) bands (ev): 5.5728 5.5728 6.5425 6.5425 7.2112 7.2112 7.3535 7.3535 7.4475 7.4475 7.4902 7.4902 7.8756 7.8756 7.9992 7.9992 8.3225 8.3225 8.7041 8.7041 8.8398 8.8398 9.0268 9.0268 9.2755 9.2755 10.3428 10.3428 10.5833 10.5833 11.3735 11.3735 11.7356 11.7356 12.5337 12.5337 k =-0.3393 0.6532-0.0000 ( 2689 PWs) bands (ev): 5.6226 5.6226 6.5886 6.5886 7.2268 7.2268 7.3680 7.3680 7.4513 7.4513 7.4876 7.4876 7.8777 7.8777 7.9902 7.9902 8.3597 8.3597 8.7002 8.7002 8.8433 8.8433 9.0473 9.0473 9.2274 9.2274 10.3377 10.3377 10.5396 10.5396 11.3144 11.3144 11.7186 11.7186 12.5695 12.5696 k =-0.3341 0.6690-0.0000 ( 2689 PWs) bands (ev): 5.6716 5.6716 6.6321 6.6321 7.2401 7.2401 7.3840 7.3840 7.4548 7.4548 7.4876 7.4876 7.8782 7.8782 7.9820 7.9820 8.3971 8.3971 8.6960 8.6960 8.8465 8.8465 9.0690 9.0690 9.1828 9.1828 10.3091 10.3091 10.5150 10.5150 11.2516 11.2516 11.7010 11.7010 12.6102 12.6102 k =-0.3289 0.6847-0.0000 ( 2687 PWs) bands (ev): 5.7197 5.7197 6.6729 6.6729 7.2507 7.2507 7.4009 7.4009 7.4581 7.4581 7.4899 7.4899 7.8772 7.8772 7.9747 7.9747 8.4348 8.4348 8.6914 8.6914 8.8495 8.8495 9.0917 9.0917 9.1421 9.1421 10.2548 10.2548 10.5131 10.5131 11.1853 11.1853 11.6828 11.6828 12.6548 12.6548 k =-0.3237 0.7005-0.0000 ( 2687 PWs) bands (ev): 5.7666 5.7666 6.7110 6.7110 7.2587 7.2587 7.4184 7.4184 7.4617 7.4617 7.4944 7.4944 7.8745 7.8745 7.9682 7.9682 8.4724 8.4724 8.6866 8.6866 8.8524 8.8524 9.1028 9.1028 9.1181 9.1181 10.1840 10.1840 10.5260 10.5260 11.1158 11.1158 11.6645 11.6645 12.7025 12.7025 k =-0.3185 0.7163-0.0000 ( 2687 PWs) bands (ev): 5.8122 5.8122 6.7464 6.7464 7.2641 7.2641 7.4349 7.4349 7.4666 7.4666 7.5006 7.5006 7.8703 7.8703 7.9624 7.9624 8.5098 8.5098 8.6815 8.6815 8.8550 8.8550 9.0714 9.0714 9.1418 9.1418 10.1046 10.1046 10.5471 10.5471 11.0433 11.0433 11.6462 11.6462 12.7524 12.7524 k =-0.3133 0.7320-0.0000 ( 2691 PWs) bands (ev): 5.8562 5.8562 6.7792 6.7792 7.2667 7.2667 7.4477 7.4477 7.4749 7.4749 7.5084 7.5084 7.8645 7.8645 7.9576 7.9576 8.5468 8.5468 8.6764 8.6764 8.8577 8.8577 9.0430 9.0430 9.1678 9.1678 10.0211 10.0211 10.5733 10.5733 10.9682 10.9682 11.6283 11.6283 12.8038 12.8038 k =-0.3081 0.7478-0.0000 ( 2695 PWs) bands (ev): 5.8985 5.8985 6.8097 6.8097 7.2666 7.2666 7.4551 7.4551 7.4870 7.4870 7.5186 7.5186 7.8573 7.8573 7.9536 7.9536 8.5832 8.5832 8.6712 8.6712 8.8602 8.8602 9.0190 9.0190 9.1946 9.1946 9.9359 9.9359 10.6031 10.6031 10.8910 10.8910 11.6108 11.6108 12.8555 12.8556 k =-0.3030 0.7636-0.0000 ( 2703 PWs) bands (ev): 5.9389 5.9389 6.8380 6.8380 7.2635 7.2635 7.4592 7.4592 7.4986 7.4986 7.5324 7.5324 7.8491 7.8491 7.9505 7.9505 8.6186 8.6186 8.6660 8.6660 8.8627 8.8627 8.9995 8.9995 9.2220 9.2220 9.8508 9.8508 10.6361 10.6361 10.8121 10.8121 11.5942 11.5942 12.9055 12.9055 k =-0.2978 0.7793-0.0000 ( 2699 PWs) bands (ev): 5.9772 5.9772 6.8644 6.8644 7.2574 7.2574 7.4618 7.4618 7.5073 7.5073 7.5497 7.5497 7.8403 7.8403 7.9483 7.9483 8.6513 8.6513 8.6627 8.6627 8.8651 8.8651 8.9845 8.9845 9.2496 9.2496 9.7674 9.7674 10.6715 10.6715 10.7324 10.7324 11.5785 11.5785 12.9366 12.9367 k =-0.2926 0.7951-0.0000 ( 2699 PWs) bands (ev): 6.0130 6.0130 6.8892 6.8892 7.2480 7.2480 7.4638 7.4638 7.5130 7.5130 7.5689 7.5689 7.8312 7.8312 7.9469 7.9469 8.6546 8.6546 8.6876 8.6876 8.8673 8.8673 8.9741 8.9741 9.2768 9.2768 9.6869 9.6869 10.6501 10.6501 10.7118 10.7118 11.5638 11.5638 12.9037 12.9038 k =-0.2874 0.8109-0.0000 ( 2699 PWs) bands (ev): 6.0460 6.0460 6.9128 6.9128 7.2351 7.2351 7.4655 7.4655 7.5163 7.5163 7.5886 7.5886 7.8224 7.8224 7.9463 7.9463 8.6501 8.6501 8.7190 8.7190 8.8694 8.8694 8.9682 8.9682 9.3027 9.3027 9.6108 9.6108 10.5699 10.5699 10.7527 10.7527 11.5504 11.5504 12.8541 12.8541 k =-0.2822 0.8266-0.0000 ( 2699 PWs) bands (ev): 6.0758 6.0758 6.9352 6.9352 7.2186 7.2186 7.4672 7.4672 7.5171 7.5171 7.6080 7.6080 7.8145 7.8145 7.9466 7.9466 8.6456 8.6456 8.7489 8.7489 8.8711 8.8711 8.9666 8.9666 9.3254 9.3254 9.5411 9.5411 10.4903 10.4903 10.7967 10.7967 11.5383 11.5383 12.8017 12.8017 k =-0.2770 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1019 6.1019 6.9569 6.9569 7.1985 7.1985 7.4691 7.4691 7.5156 7.5156 7.6266 7.6266 7.8081 7.8081 7.9477 7.9477 8.6414 8.6414 8.7766 8.7766 8.8724 8.8724 8.9692 8.9692 9.3407 9.3407 9.4818 9.4818 10.4127 10.4127 10.8434 10.8434 11.5277 11.5277 12.7481 12.7481 k =-0.2770 0.8424-0.0000 ( 2699 PWs) bands (ev): 6.1019 6.1019 6.9569 6.9569 7.1985 7.1985 7.4691 7.4691 7.5156 7.5156 7.6266 7.6266 7.8081 7.8081 7.9477 7.9477 8.6414 8.6414 8.7766 8.7766 8.8724 8.8724 8.9692 8.9692 9.3407 9.3407 9.4818 9.4818 10.4127 10.4127 10.8434 10.8434 11.5277 11.5277 12.7481 12.7481 k =-0.2770 0.8424 0.0164 ( 2701 PWs) bands (ev): 6.1017 6.1017 6.9561 6.9561 7.1990 7.1990 7.4690 7.4690 7.5140 7.5140 7.6300 7.6300 7.8090 7.8090 7.9493 7.9493 8.6403 8.6403 8.7729 8.7729 8.8730 8.8730 8.9671 8.9671 9.3446 9.3446 9.4829 9.4829 10.4129 10.4129 10.8401 10.8401 11.5289 11.5289 12.7477 12.7477 k =-0.2770 0.8424 0.0327 ( 2699 PWs) bands (ev): 6.1010 6.1010 6.9537 6.9537 7.2005 7.2005 7.4688 7.4688 7.5101 7.5101 7.6392 7.6392 7.8120 7.8120 7.9539 7.9539 8.6369 8.6369 8.7616 8.7616 8.8748 8.8748 8.9613 8.9613 9.3558 9.3558 9.4863 9.4863 10.4135 10.4135 10.8305 10.8305 11.5325 11.5325 12.7462 12.7462 k =-0.2770 0.8424 0.0491 ( 2701 PWs) bands (ev): 6.0999 6.0999 6.9497 6.9497 7.2029 7.2029 7.4683 7.4683 7.5057 7.5057 7.6521 7.6521 7.8174 7.8174 7.9617 7.9617 8.6315 8.6315 8.7428 8.7428 8.8775 8.8775 8.9537 8.9537 9.3721 9.3721 9.4922 9.4922 10.4143 10.4143 10.8152 10.8152 11.5378 11.5378 12.7435 12.7435 k =-0.2770 0.8424 0.0654 ( 2697 PWs) bands (ev): 6.0984 6.0984 6.9443 6.9443 7.2064 7.2064 7.4673 7.4673 7.5022 7.5022 7.6666 7.6666 7.8258 7.8258 7.9725 7.9725 8.6243 8.6243 8.7173 8.7173 8.8807 8.8807 8.9459 8.9459 9.3914 9.3914 9.5008 9.5008 10.4156 10.4156 10.7951 10.7951 11.5439 11.5439 12.7391 12.7391 k =-0.2770 0.8424 0.0818 ( 2701 PWs) bands (ev): 6.0964 6.0964 6.9376 6.9376 7.2107 7.2107 7.4659 7.4659 7.5006 7.5006 7.6807 7.6807 7.8378 7.8378 7.9860 7.9860 8.6154 8.6154 8.6864 8.6864 8.8843 8.8843 8.9390 8.9390 9.4113 9.4113 9.5125 9.5125 10.4171 10.4171 10.7712 10.7712 11.5500 11.5500 12.7325 12.7325 k =-0.2770 0.8424 0.0981 ( 2699 PWs) bands (ev): 6.0941 6.0941 6.9296 6.9296 7.2159 7.2159 7.4645 7.4645 7.5011 7.5011 7.6929 7.6929 7.8542 7.8542 8.0023 8.0023 8.6041 8.6041 8.6524 8.6524 8.8877 8.8877 8.9332 8.9332 9.4301 9.4301 9.5275 9.5275 10.4190 10.4190 10.7446 10.7446 11.5550 11.5550 12.7232 12.7232 k =-0.2770 0.8424 0.1145 ( 2701 PWs) bands (ev): 6.0915 6.0915 6.9206 6.9206 7.2218 7.2218 7.4635 7.4635 7.5036 7.5036 7.7020 7.7020 7.8750 7.8750 8.0210 8.0210 8.5868 8.5868 8.6210 8.6210 8.8907 8.8907 8.9285 8.9285 9.4468 9.4468 9.5458 9.5458 10.4212 10.4212 10.7165 10.7165 11.5581 11.5581 12.7107 12.7107 k =-0.2770 0.8424 0.1308 ( 2702 PWs) bands (ev): 6.0887 6.0887 6.9106 6.9106 7.2283 7.2283 7.4634 7.4634 7.5079 7.5079 7.7076 7.7076 7.9001 7.9001 8.0421 8.0421 8.5566 8.5566 8.6010 8.6010 8.8930 8.8930 8.9247 8.9247 9.4611 9.4611 9.5667 9.5667 10.4236 10.4236 10.6879 10.6879 11.5585 11.5585 12.6945 12.6945 k =-0.2770 0.8424 0.1472 ( 2701 PWs) bands (ev): 6.0857 6.0857 6.8998 6.8998 7.2352 7.2352 7.4644 7.4644 7.5138 7.5138 7.7097 7.7097 7.9286 7.9286 8.0651 8.0651 8.5188 8.5188 8.5888 8.5888 8.8946 8.8946 8.9215 8.9215 9.4731 9.4731 9.5893 9.5893 10.4263 10.4263 10.6600 10.6600 11.5559 11.5559 12.6744 12.6744 k =-0.2770 0.8424 0.1635 ( 2699 PWs) bands (ev): 6.0825 6.0825 6.8883 6.8883 7.2423 7.2423 7.4667 7.4667 7.5213 7.5213 7.7084 7.7084 7.9596 7.9596 8.0898 8.0898 8.4798 8.4798 8.5795 8.5795 8.8953 8.8953 8.9187 8.9187 9.4830 9.4830 9.6129 9.6129 10.4293 10.4293 10.6338 10.6338 11.5499 11.5499 12.6500 12.6500 k =-0.2770 0.8424 0.1799 ( 2701 PWs) bands (ev): 6.0794 6.0794 6.8763 6.8763 7.2494 7.2494 7.4703 7.4703 7.5306 7.5306 7.7037 7.7037 7.9922 7.9922 8.1158 8.1158 8.4423 8.4423 8.5720 8.5720 8.8950 8.8950 8.9160 8.9160 9.4909 9.4909 9.6368 9.6368 10.4324 10.4324 10.6102 10.6102 11.5403 11.5403 12.6213 12.6213 k =-0.2770 0.8424 0.1962 ( 2695 PWs) bands (ev): 6.0762 6.0762 6.8638 6.8638 7.2563 7.2563 7.4753 7.4753 7.5416 7.5416 7.6956 7.6956 8.0255 8.0255 8.1426 8.1426 8.4078 8.4078 8.5665 8.5665 8.8940 8.8940 8.9135 8.9135 9.4964 9.4964 9.6608 9.6608 10.4357 10.4357 10.5902 10.5902 11.5273 11.5273 12.5884 12.5884 k =-0.2770 0.8424 0.2126 ( 2685 PWs) bands (ev): 6.0732 6.0732 6.8509 6.8509 7.2628 7.2628 7.4815 7.4815 7.5544 7.5544 7.6840 7.6840 8.0586 8.0586 8.1697 8.1697 8.3776 8.3776 8.5633 8.5633 8.8920 8.8920 8.9111 8.9111 9.4993 9.4993 9.6849 9.6849 10.4392 10.4392 10.5745 10.5745 11.5110 11.5110 12.5514 12.5514 k =-0.2770 0.8424 0.2289 ( 2685 PWs) bands (ev): 6.0705 6.0705 6.8376 6.8376 7.2685 7.2685 7.4888 7.4888 7.5689 7.5689 7.6689 7.6689 8.0903 8.0903 8.1961 8.1961 8.3529 8.3529 8.5629 8.5629 8.8890 8.8890 8.9090 8.9090 9.4993 9.4993 9.7090 9.7090 10.4428 10.4428 10.5640 10.5640 11.4918 11.4918 12.5104 12.5104 k =-0.2770 0.8424 0.2453 ( 2689 PWs) bands (ev): 6.0680 6.0680 6.8238 6.8238 7.2735 7.2735 7.4972 7.4972 7.5850 7.5850 7.6503 7.6503 8.1196 8.1196 8.2210 8.2210 8.3350 8.3350 8.5661 8.5661 8.8849 8.8849 8.9074 8.9074 9.4960 9.4960 9.7333 9.7333 10.4467 10.4467 10.5592 10.5592 11.4701 11.4701 12.4657 12.4657 k =-0.2770 0.8424 0.2616 ( 2689 PWs) bands (ev): 6.0660 6.0660 6.8098 6.8098 7.2776 7.2776 7.5064 7.5064 7.6017 7.6017 7.6299 7.6299 8.1449 8.1449 8.2431 8.2431 8.3255 8.3255 8.5735 8.5735 8.8798 8.8798 8.9064 8.9064 9.4893 9.4893 9.7580 9.7580 10.4509 10.4509 10.5603 10.5603 11.4462 11.4462 12.4175 12.4175 k =-0.2770 0.8424 0.2780 ( 2687 PWs) bands (ev): 6.0645 6.0645 6.7952 6.7952 7.2807 7.2807 7.5162 7.5162 7.5999 7.5999 7.6269 7.6269 8.1650 8.1650 8.2611 8.2611 8.3255 8.3255 8.5857 8.5857 8.8740 8.8740 8.9063 8.9063 9.4792 9.4792 9.7832 9.7832 10.4557 10.4557 10.5674 10.5674 11.4206 11.4206 12.3662 12.3662 k =-0.2770 0.8424 0.2943 ( 2687 PWs) bands (ev): 6.0636 6.0636 6.7802 6.7802 7.2829 7.2829 7.5249 7.5249 7.5766 7.5766 7.6463 7.6463 8.1793 8.1793 8.2749 8.2749 8.3344 8.3344 8.6027 8.6027 8.8680 8.8680 8.9069 8.9069 9.4657 9.4657 9.8091 9.8091 10.4611 10.4611 10.5804 10.5804 11.3937 11.3937 12.3122 12.3122 k =-0.2770 0.8424 0.3107 ( 2683 PWs) bands (ev): 6.0634 6.0634 6.7646 6.7646 7.2840 7.2840 7.5243 7.5243 7.5603 7.5603 7.6681 7.6681 8.1890 8.1890 8.2857 8.2857 8.3492 8.3492 8.6240 8.6240 8.8627 8.8627 8.9084 8.9084 9.4492 9.4492 9.8356 9.8356 10.4673 10.4673 10.5989 10.5989 11.3659 11.3659 12.2557 12.2557 k =-0.2770 0.8424 0.3270 ( 2681 PWs) bands (ev): 6.0639 6.0639 6.7483 6.7483 7.2842 7.2842 7.5030 7.5030 7.5643 7.5643 7.6911 7.6911 8.1959 8.1959 8.2943 8.2943 8.3663 8.3663 8.6479 8.6479 8.8594 8.8594 8.9107 8.9107 9.4301 9.4301 9.8628 9.8628 10.4743 10.4743 10.6227 10.6227 11.3375 11.3375 12.1971 12.1971 k =-0.2770 0.8424 0.3434 ( 2679 PWs) bands (ev): 6.0654 6.0654 6.7312 6.7312 7.2835 7.2835 7.4740 7.4740 7.5765 7.5765 7.7146 7.7146 8.2017 8.2017 8.3007 8.3007 8.3839 8.3839 8.6716 8.6716 8.8604 8.8604 8.9139 8.9139 9.4089 9.4089 9.8904 9.8904 10.4824 10.4824 10.6512 10.6512 11.3090 11.3090 12.1370 12.1370 k =-0.2770 0.8424 0.3597 ( 2679 PWs) bands (ev): 6.0677 6.0677 6.7132 6.7132 7.2819 7.2819 7.4438 7.4438 7.5909 7.5909 7.7385 7.7385 8.2074 8.2074 8.3053 8.3053 8.4005 8.4005 8.6910 8.6910 8.8691 8.8691 8.9181 8.9181 9.3861 9.3861 9.9183 9.9183 10.4917 10.4917 10.6837 10.6837 11.2806 11.2806 12.0758 12.0758 k =-0.2770 0.8424 0.3761 ( 2681 PWs) bands (ev): 6.0711 6.0711 6.6943 6.6943 7.2794 7.2794 7.4139 7.4139 7.6066 7.6066 7.7623 7.7623 8.2132 8.2132 8.3084 8.3084 8.4156 8.4156 8.7025 8.7025 8.8879 8.8879 8.9241 8.9241 9.3622 9.3622 9.9458 9.9458 10.5025 10.5025 10.7196 10.7196 11.2527 11.2527 12.0139 12.0139 k =-0.2770 0.8424 0.3924 ( 2688 PWs) bands (ev): 6.0755 6.0755 6.6742 6.6742 7.2762 7.2762 7.3854 7.3854 7.6232 7.6232 7.7857 7.7857 8.2191 8.2191 8.3105 8.3105 8.4288 8.4288 8.7051 8.7051 8.9123 8.9123 8.9365 8.9365 9.3378 9.3378 9.9724 9.9724 10.5150 10.5150 10.7581 10.7581 11.2256 11.2256 11.9519 11.9519 k =-0.2770 0.8424 0.4088 ( 2690 PWs) bands (ev): 6.0811 6.0811 6.6531 6.6531 7.2722 7.2722 7.3587 7.3587 7.6406 7.6406 7.8085 7.8085 8.2250 8.2250 8.3120 8.3120 8.4399 8.4399 8.7009 8.7009 8.9262 8.9262 8.9689 8.9689 9.3133 9.3133 9.9973 9.9973 10.5295 10.5295 10.7982 10.7982 11.1999 11.1999 11.8903 11.8903 k =-0.2770 0.8424 0.4251 ( 2688 PWs) bands (ev): 6.0879 6.0879 6.6308 6.6308 7.2675 7.2675 7.3344 7.3344 7.6586 7.6586 7.8304 7.8304 8.2307 8.2307 8.3131 8.3131 8.4493 8.4493 8.6924 8.6924 8.9338 8.9338 9.0138 9.0138 9.2896 9.2896 10.0196 10.0196 10.5464 10.5464 10.8387 10.8387 11.1761 11.1761 11.8299 11.8299 k =-0.2770 0.8424 0.4415 ( 2688 PWs) bands (ev): 6.0959 6.0959 6.6074 6.6074 7.2619 7.2619 7.3128 7.3128 7.6773 7.6773 7.8510 7.8510 8.2356 8.2356 8.3142 8.3142 8.4570 8.4570 8.6814 8.6814 8.9404 8.9404 9.0632 9.0632 9.2676 9.2676 10.0382 10.0382 10.5659 10.5659 10.8782 10.8782 11.1553 11.1553 11.7712 11.7712 k =-0.2770 0.8424 0.4578 ( 2688 PWs) bands (ev): 6.1052 6.1052 6.5830 6.5830 7.2552 7.2552 7.2943 7.2943 7.6965 7.6965 7.8702 7.8702 8.2397 8.2397 8.3153 8.3153 8.4635 8.4635 8.6691 8.6691 8.9467 8.9467 9.1122 9.1122 9.2503 9.2503 10.0522 10.0522 10.5878 10.5878 10.9142 10.9142 11.1393 11.1393 11.7149 11.7149 k =-0.2770 0.8424 0.4742 ( 2690 PWs) bands (ev): 6.1158 6.1158 6.5576 6.5576 7.2474 7.2474 7.2792 7.2792 7.7160 7.7160 7.8875 7.8875 8.2428 8.2428 8.3164 8.3164 8.4691 8.4691 8.6561 8.6561 8.9529 8.9529 9.1500 9.1500 9.2475 9.2475 10.0609 10.0609 10.6121 10.6121 10.9431 10.9431 11.1312 11.1312 11.6617 11.6617 k =-0.2770 0.8424 0.4905 ( 2686 PWs) bands (ev): 6.1278 6.1278 6.5315 6.5315 7.2386 7.2386 7.2675 7.2675 7.7359 7.7359 7.9027 7.9027 8.2447 8.2447 8.3174 8.3174 8.4744 8.4744 8.6430 8.6430 8.9591 8.9591 9.1588 9.1588 9.2767 9.2767 10.0636 10.0636 10.6382 10.6382 10.9602 10.9602 11.1348 11.1348 11.6124 11.6124 k =-0.2770 0.8424 0.5069 ( 2682 PWs) bands (ev): 6.1410 6.1410 6.5048 6.5048 7.2295 7.2295 7.2585 7.2585 7.7558 7.7558 7.9154 7.9154 8.2459 8.2459 8.3180 8.3180 8.4797 8.4797 8.6301 8.6301 8.9652 8.9652 9.1476 9.1476 9.3282 9.3282 10.0599 10.0599 10.6654 10.6654 10.9641 10.9641 11.1513 11.1513 11.5674 11.5674 k =-0.2770 0.8424 0.5232 ( 2678 PWs) bands (ev): 6.1557 6.1557 6.4778 6.4778 7.2210 7.2210 7.2511 7.2511 7.7759 7.7759 7.9254 7.9254 8.2464 8.2464 8.3181 8.3181 8.4854 8.4854 8.6176 8.6176 8.9715 8.9715 9.1312 9.1312 9.3870 9.3870 10.0496 10.0496 10.6929 10.6929 10.9580 10.9580 11.1765 11.1765 11.5274 11.5274 k =-0.2770 0.8424 0.5396 ( 2682 PWs) bands (ev): 6.1716 6.1716 6.4506 6.4506 7.2136 7.2136 7.2449 7.2449 7.7957 7.7957 7.9323 7.9323 8.2467 8.2467 8.3174 8.3174 8.4915 8.4915 8.6056 8.6056 8.9779 8.9779 9.1139 9.1139 9.4483 9.4483 10.0326 10.0326 10.7199 10.7199 10.9463 10.9463 11.2056 11.2056 11.4925 11.4925 k =-0.2770 0.8424 0.5559 ( 2681 PWs) bands (ev): 6.1889 6.1889 6.4234 6.4234 7.2076 7.2076 7.2396 7.2396 7.8151 7.8151 7.9361 7.9361 8.2471 8.2471 8.3160 8.3160 8.4983 8.4983 8.5942 8.5942 8.9846 8.9846 9.0969 9.0969 9.5104 9.5104 10.0091 10.0091 10.7457 10.7457 10.9319 10.9319 11.2349 11.2349 11.4628 11.4628 k =-0.2770 0.8424 0.5723 ( 2681 PWs) bands (ev): 6.2076 6.2076 6.3964 6.3964 7.2029 7.2029 7.2351 7.2351 7.8338 7.8338 7.9366 7.9366 8.2477 8.2477 8.3139 8.3139 8.5057 8.5057 8.5833 8.5833 8.9917 8.9917 9.0809 9.0809 9.5723 9.5723 9.9793 9.9793 10.7698 10.7698 10.9165 10.9165 11.2626 11.2626 11.4379 11.4379 k =-0.2770 0.8424 0.5886 ( 2679 PWs) bands (ev): 6.2275 6.2275 6.3699 6.3699 7.1995 7.1995 7.2314 7.2314 7.8515 7.8515 7.9341 7.9341 8.2486 8.2486 8.3116 8.3116 8.5135 8.5135 8.5730 8.5730 8.9993 8.9993 9.0660 9.0660 9.6332 9.6332 9.9435 9.9435 10.7920 10.7920 10.9006 10.9006 11.2873 11.2873 11.4173 11.4173 k =-0.2770 0.8424 0.6050 ( 2684 PWs) bands (ev): 6.2485 6.2485 6.3439 6.3439 7.1972 7.1972 7.2286 7.2286 7.8673 7.8673 7.9290 7.9290 8.2496 8.2496 8.3094 8.3094 8.5215 8.5215 8.5634 8.5634 9.0076 9.0076 9.0523 9.0523 9.6925 9.6925 9.9024 9.9024 10.8123 10.8123 10.8845 10.8845 11.3082 11.3082 11.4004 11.4004 k =-0.2770 0.8424 0.6213 ( 2684 PWs) bands (ev): 6.2707 6.2707 6.3188 6.3188 7.1959 7.1959 7.2270 7.2270 7.8800 7.8800 7.9229 7.9229 8.2504 8.2504 8.3078 8.3078 8.5290 8.5290 8.5551 8.5551 9.0165 9.0165 9.0401 9.0401 9.7489 9.7489 9.8567 9.8567 10.8305 10.8305 10.8688 10.8688 11.3239 11.3239 11.3877 11.3877 k =-0.2770 0.8424 0.6377 ( 2686 PWs) bands (ev): 6.2915 6.2915 6.2970 6.2970 7.1955 7.1955 7.2264 7.2264 7.8856 7.8856 7.9195 7.9195 8.2507 8.2507 8.3072 8.3072 8.5330 8.5330 8.5509 8.5509 9.0231 9.0231 9.0323 9.0323 9.7922 9.7922 9.8171 9.8171 10.8421 10.8421 10.8579 10.8579 11.3303 11.3303 11.3823 11.3823 k =-0.2770 0.8424 0.6377 ( 2686 PWs) bands (ev): 6.2915 6.2915 6.2970 6.2970 7.1955 7.1955 7.2264 7.2264 7.8856 7.8856 7.9195 7.9195 8.2507 8.2507 8.3072 8.3072 8.5330 8.5330 8.5509 8.5509 9.0231 9.0231 9.0323 9.0323 9.7922 9.7922 9.8171 9.8171 10.8421 10.8421 10.8579 10.8579 11.3303 11.3303 11.3823 11.3823 k =-0.2822 0.8266 0.6377 ( 2686 PWs) bands (ev): 6.3084 6.3084 6.3142 6.3142 7.1776 7.1776 7.2093 7.2093 7.8888 7.8888 7.9215 7.9215 8.2580 8.2580 8.3165 8.3165 8.5312 8.5312 8.5469 8.5469 8.9979 8.9979 9.0054 9.0054 9.7954 9.7954 9.8196 9.8196 10.8319 10.8319 10.8530 10.8530 11.3579 11.3579 11.4020 11.4020 k =-0.2874 0.8109 0.6377 ( 2682 PWs) bands (ev): 6.3263 6.3263 6.3324 6.3324 7.1599 7.1599 7.1926 7.1926 7.8929 7.8929 7.9245 7.9245 8.2637 8.2637 8.3242 8.3242 8.5279 8.5279 8.5417 8.5417 8.9721 8.9721 8.9783 8.9783 9.7932 9.7932 9.8160 9.8160 10.8237 10.8237 10.8493 10.8493 11.3897 11.3897 11.4264 11.4264 k =-0.2926 0.7951 0.6377 ( 2682 PWs) bands (ev): 6.3453 6.3453 6.3516 6.3516 7.1425 7.1425 7.1760 7.1760 7.8979 7.8979 7.9282 7.9282 8.2678 8.2678 8.3300 8.3300 8.5230 8.5230 8.5351 8.5351 8.9467 8.9467 8.9519 8.9519 9.7842 9.7842 9.8050 9.8050 10.8192 10.8192 10.8482 10.8482 11.4250 11.4250 11.4549 11.4549 k =-0.2978 0.7793 0.6377 ( 2678 PWs) bands (ev): 6.3653 6.3653 6.3719 6.3719 7.1253 7.1253 7.1596 7.1596 7.9035 7.9035 7.9327 7.9327 8.2699 8.2699 8.3339 8.3339 8.5167 8.5167 8.5269 8.5269 8.9228 8.9228 8.9272 8.9272 9.7677 9.7677 9.7858 9.7858 10.8197 10.8197 10.8511 10.8511 11.4629 11.4629 11.4867 11.4867 k =-0.3030 0.7636 0.6377 ( 2678 PWs) bands (ev): 6.3862 6.3862 6.3930 6.3930 7.1083 7.1083 7.1433 7.1433 7.9098 7.9098 7.9378 7.9378 8.2696 8.2696 8.3354 8.3354 8.5093 8.5093 8.5173 8.5173 8.9011 8.9011 8.9048 8.9048 9.7433 9.7433 9.7583 9.7583 10.8260 10.8260 10.8586 10.8586 11.5029 11.5029 11.5212 11.5212 k =-0.3081 0.7478 0.6377 ( 2676 PWs) bands (ev): 6.4078 6.4078 6.4149 6.4149 7.0916 7.0916 7.1273 7.1273 7.9164 7.9164 7.9432 7.9432 8.2664 8.2664 8.3341 8.3341 8.5012 8.5012 8.5066 8.5066 8.8822 8.8822 8.8851 8.8851 9.7112 9.7112 9.7226 9.7226 10.8381 10.8381 10.8711 10.8711 11.5443 11.5443 11.5579 11.5579 k =-0.3133 0.7320 0.6377 ( 2672 PWs) bands (ev): 6.4301 6.4301 6.4374 6.4374 7.0752 7.0752 7.1114 7.1114 7.9234 7.9234 7.9490 7.9490 8.2600 8.2600 8.3295 8.3295 8.4932 8.4932 8.4956 8.4956 8.8664 8.8664 8.8682 8.8682 9.6719 9.6719 9.6795 9.6795 10.8557 10.8557 10.8884 10.8884 11.5867 11.5867 11.5961 11.5961 k =-0.3185 0.7163 0.6377 ( 2662 PWs) bands (ev): 6.4529 6.4529 6.4605 6.4605 7.0591 7.0591 7.0958 7.0958 7.9305 7.9305 7.9550 7.9550 8.2498 8.2498 8.3210 8.3210 8.4850 8.4850 8.4860 8.4860 8.8538 8.8538 8.8542 8.8542 9.6264 9.6264 9.6302 9.6302 10.8782 10.8782 10.9102 10.9102 11.6298 11.6298 11.6355 11.6355 k =-0.3237 0.7005 0.6377 ( 2674 PWs) bands (ev): 6.4759 6.4759 6.4839 6.4839 7.0434 7.0434 7.0803 7.0803 7.9374 7.9374 7.9609 7.9609 8.2357 8.2357 8.3082 8.3082 8.4756 8.4756 8.4803 8.4803 8.8426 8.8426 8.8442 8.8442 9.5757 9.5757 9.5758 9.5758 10.9047 10.9047 10.9357 10.9357 11.6731 11.6731 11.6757 11.6757 k =-0.3289 0.6847 0.6377 ( 2670 PWs) bands (ev): 6.4990 6.4990 6.5074 6.5074 7.0282 7.0282 7.0653 7.0653 7.9441 7.9441 7.9666 7.9666 8.2181 8.2181 8.2913 8.2913 8.4678 8.4678 8.4764 8.4764 8.8333 8.8333 8.8373 8.8373 9.5178 9.5178 9.5211 9.5211 10.9345 10.9345 10.9643 10.9643 11.7164 11.7164 11.7165 11.7165 k =-0.3341 0.6690 0.6377 ( 2676 PWs) bands (ev): 6.5217 6.5217 6.5305 6.5305 7.0138 7.0138 7.0507 7.0507 7.9502 7.9502 7.9718 7.9718 8.1972 8.1972 8.2706 8.2706 8.4618 8.4618 8.4743 8.4743 8.8256 8.8256 8.8326 8.8326 9.4574 9.4574 9.4639 9.4639 10.9667 10.9667 10.9951 10.9951 11.7575 11.7575 11.7599 11.7599 k =-0.3393 0.6532 0.6377 ( 2680 PWs) bands (ev): 6.5435 6.5435 6.5531 6.5531 7.0005 7.0005 7.0369 7.0369 7.9554 7.9554 7.9765 7.9765 8.1739 8.1739 8.2471 8.2471 8.4573 8.4573 8.4739 8.4739 8.8189 8.8189 8.8297 8.8297 9.3962 9.3962 9.4052 9.4052 11.0003 11.0003 11.0274 11.0274 11.7989 11.7989 11.8030 11.8030 k =-0.3444 0.6374 0.6377 ( 2680 PWs) bands (ev): 6.5641 6.5641 6.5745 6.5745 6.9886 6.9886 7.0241 7.0241 7.9595 7.9595 7.9802 7.9802 8.1489 8.1489 8.2217 8.2217 8.4540 8.4540 8.4750 8.4750 8.8126 8.8126 8.8280 8.8280 9.3357 9.3357 9.3466 9.3466 11.0348 11.0348 11.0604 11.0604 11.8404 11.8404 11.8459 11.8459 k =-0.3496 0.6217 0.6377 ( 2680 PWs) bands (ev): 6.5826 6.5826 6.5942 6.5942 6.9788 6.9788 7.0128 7.0128 7.9620 7.9620 7.9827 7.9827 8.1230 8.1230 8.1952 8.1952 8.4516 8.4516 8.4772 8.4772 8.8058 8.8058 8.8268 8.8268 9.2774 9.2774 9.2895 9.2895 11.0694 11.0694 11.0935 11.0935 11.8823 11.8823 11.8886 11.8886 k =-0.3548 0.6059 0.6377 ( 2684 PWs) bands (ev): 6.5982 6.5982 6.6115 6.6115 6.9716 6.9716 7.0035 7.0035 7.9623 7.9623 7.9833 7.9833 8.0971 8.0971 8.1684 8.1684 8.4500 8.4500 8.4802 8.4802 8.7972 8.7972 8.8250 8.8250 9.2232 9.2232 9.2353 9.2353 11.1034 11.1034 11.1259 11.1259 11.9244 11.9244 11.9310 11.9310 k =-0.3600 0.5901 0.6377 ( 2684 PWs) bands (ev): 6.6102 6.6102 6.6254 6.6254 6.9679 6.9679 6.9970 6.9970 7.9598 7.9598 7.9812 7.9812 8.0723 8.0723 8.1422 8.1422 8.4489 8.4489 8.4838 8.4838 8.7855 8.7855 8.8215 8.8215 9.1752 9.1752 9.1861 9.1861 11.1363 11.1363 11.1570 11.1570 11.9669 11.9669 11.9734 11.9734 k =-0.3652 0.5744 0.6377 ( 2684 PWs) bands (ev): 6.6177 6.6177 6.6353 6.6353 6.9682 6.9682 6.9939 6.9939 7.9537 7.9537 7.9750 7.9750 8.0502 8.0502 8.1174 8.1174 8.4484 8.4484 8.4879 8.4879 8.7695 8.7695 8.8149 8.8149 9.1353 9.1353 9.1439 9.1439 11.1674 11.1674 11.1863 11.1863 12.0099 12.0099 12.0156 12.0156 k =-0.3704 0.5586 0.6377 ( 2688 PWs) bands (ev): 6.6202 6.6202 6.6404 6.6404 6.9729 6.9729 6.9946 6.9946 7.9431 7.9431 7.9627 7.9627 8.0329 8.0329 8.0950 8.0950 8.4482 8.4482 8.4919 8.4919 8.7481 8.7481 8.8035 8.8035 9.1053 9.1053 9.1106 9.1106 11.1964 11.1964 11.2133 11.2133 12.0534 12.0534 12.0577 12.0577 k =-0.3756 0.5428 0.6377 ( 2688 PWs) bands (ev): 6.6177 6.6177 6.6404 6.6404 6.9820 6.9820 6.9995 6.9995 7.9275 7.9275 7.9439 7.9439 8.0209 8.0209 8.0757 8.0757 8.4485 8.4485 8.4958 8.4958 8.7218 8.7218 8.7866 8.7866 9.0854 9.0854 9.0877 9.0877 11.2227 11.2227 11.2376 11.2376 12.0974 12.0974 12.0998 12.0998 k =-0.3807 0.5271 0.6377 ( 2692 PWs) bands (ev): 6.6105 6.6105 6.6354 6.6354 6.9951 6.9951 7.0082 7.0082 7.9067 7.9067 7.9204 7.9204 8.0125 8.0125 8.0597 8.0597 8.4489 8.4489 8.4987 8.4987 8.6922 8.6922 8.7647 8.7647 9.0749 9.0749 9.0750 9.0750 11.2461 11.2461 11.2588 11.2588 12.1416 12.1416 12.1418 12.1418 k =-0.3859 0.5113 0.6377 ( 2696 PWs) bands (ev): 6.5992 6.5992 6.6258 6.6258 7.0112 7.0112 7.0201 7.0201 7.8814 7.8814 7.8944 7.8944 8.0059 8.0059 8.0467 8.0467 8.4492 8.4492 8.4995 8.4995 8.6620 8.6620 8.7394 8.7394 9.0713 9.0713 9.0722 9.0722 11.2663 11.2663 11.2768 11.2768 12.1828 12.1828 12.1863 12.1863 k =-0.3911 0.4955 0.6377 ( 2696 PWs) bands (ev): 6.5846 6.5846 6.6123 6.6123 7.0297 7.0297 7.0343 7.0343 7.8527 7.8527 7.8672 7.8672 8.0000 8.0000 8.0359 8.0359 8.4489 8.4489 8.4965 8.4965 8.6350 8.6350 8.7131 8.7131 9.0746 9.0746 9.0757 9.0757 11.2833 11.2833 11.2916 11.2916 12.2230 12.2230 12.2303 12.2303 k =-0.3963 0.4798 0.6377 ( 2688 PWs) bands (ev): 6.5673 6.5673 6.5957 6.5957 7.0495 7.0495 7.0499 7.0499 7.8220 7.8220 7.8399 7.8399 7.9944 7.9944 8.0266 8.0266 8.4473 8.4473 8.4869 8.4869 8.6151 8.6151 8.6880 8.6880 9.0832 9.0832 9.0840 9.0840 11.2969 11.2969 11.3031 11.3031 12.2617 12.2617 12.2732 12.2732 k =-0.4015 0.4640 0.6377 ( 2688 PWs) bands (ev): 6.5482 6.5482 6.5767 6.5767 7.0660 7.0660 7.0697 7.0697 7.7904 7.7904 7.8130 7.8130 7.9889 7.9889 8.0185 8.0185 8.4436 8.4436 8.4695 8.4695 8.6042 8.6042 8.6660 8.6660 9.0955 9.0955 9.0958 9.0958 11.3074 11.3074 11.3115 11.3115 12.2979 12.2979 12.3141 12.3141 k =-0.4067 0.4482 0.6377 ( 2676 PWs) bands (ev): 6.5276 6.5276 6.5560 6.5560 7.0815 7.0815 7.0895 7.0895 7.7589 7.7589 7.7873 7.7873 7.9837 7.9837 8.0113 8.0113 8.4369 8.4369 8.4458 8.4458 8.6015 8.6015 8.6485 8.6485 9.1103 9.1103 9.1106 9.1106 11.3148 11.3148 11.3171 11.3171 12.3309 12.3309 12.3517 12.3517 k =-0.4119 0.4325 0.6377 ( 2680 PWs) bands (ev): 6.5062 6.5062 6.5339 6.5339 7.0957 7.0957 7.1081 7.1081 7.7288 7.7288 7.7635 7.7635 7.9789 7.9789 8.0048 8.0048 8.4188 8.4188 8.4266 8.4266 8.6039 8.6039 8.6361 8.6361 9.1268 9.1268 9.1276 9.1276 11.3195 11.3195 11.3201 11.3201 12.3597 12.3597 12.3850 12.3850 k =-0.4170 0.4167 0.6377 ( 2680 PWs) bands (ev): 6.4842 6.4842 6.5111 6.5111 7.1079 7.1079 7.1246 7.1246 7.7011 7.7011 7.7423 7.7423 7.9744 7.9744 7.9989 7.9989 8.3907 8.3907 8.4127 8.4127 8.6093 8.6093 8.6290 8.6290 9.1448 9.1448 9.1461 9.1461 11.3209 11.3209 11.3217 11.3217 12.3838 12.3838 12.4128 12.4128 k =-0.4222 0.4009 0.6377 ( 2680 PWs) bands (ev): 6.4620 6.4620 6.4879 6.4879 7.1174 7.1174 7.1383 7.1383 7.6768 7.6768 7.7245 7.7245 7.9705 7.9705 7.9937 7.9937 8.3624 8.3624 8.3955 8.3955 8.6165 8.6165 8.6266 8.6266 9.1640 9.1640 9.1656 9.1656 11.3198 11.3198 11.3218 11.3218 12.4027 12.4027 12.4347 12.4347 k =-0.4274 0.3852 0.6377 ( 2682 PWs) bands (ev): 6.4400 6.4400 6.4646 6.4646 7.1238 7.1238 7.1484 7.1484 7.6570 7.6570 7.7106 7.7106 7.9673 7.9673 7.9891 7.9891 8.3346 8.3346 8.3759 8.3759 8.6246 8.6246 8.6277 8.6277 9.1838 9.1838 9.1857 9.1857 11.3172 11.3172 11.3202 11.3202 12.4165 12.4165 12.4504 12.4504 k =-0.4326 0.3694 0.6377 ( 2686 PWs) bands (ev): 6.4183 6.4183 6.4416 6.4416 7.1268 7.1268 7.1543 7.1543 7.6425 7.6425 7.7010 7.7010 7.9647 7.9647 7.9851 7.9851 8.3074 8.3074 8.3545 8.3545 8.6315 8.6315 8.6332 8.6332 9.2040 9.2040 9.2061 9.2061 11.3134 11.3134 11.3171 11.3171 12.4256 12.4256 12.4603 12.4603 k =-0.4378 0.3536 0.6377 ( 2682 PWs) bands (ev): 6.3973 6.3973 6.4191 6.4191 7.1266 7.1266 7.1559 7.1559 7.6337 7.6337 7.6957 7.6957 7.9629 7.9629 7.9818 7.9818 8.2810 8.2810 8.3320 8.3320 8.6371 8.6371 8.6420 8.6420 9.2242 9.2242 9.2264 9.2264 11.3088 11.3088 11.3130 11.3130 12.4305 12.4305 12.4651 12.4651 k =-0.4430 0.3379 0.6377 ( 2682 PWs) bands (ev): 6.3772 6.3772 6.3974 6.3974 7.1233 7.1233 7.1533 7.1533 7.6306 7.6306 7.6946 7.6946 7.9619 7.9619 7.9792 7.9792 8.2554 8.2554 8.3089 8.3089 8.6438 8.6438 8.6507 8.6507 9.2442 9.2442 9.2464 9.2464 11.3036 11.3036 11.3082 11.3082 12.4321 12.4321 12.4658 12.4658 k =-0.4481 0.3221 0.6377 ( 2686 PWs) bands (ev): 6.3582 6.3582 6.3767 6.3767 7.1176 7.1176 7.1471 7.1471 7.6327 7.6327 7.6971 7.6971 7.9618 7.9618 7.9771 7.9771 8.2304 8.2304 8.2853 8.2853 8.6510 8.6510 8.6591 8.6591 9.2635 9.2635 9.2657 9.2657 11.2982 11.2982 11.3029 11.3029 12.4311 12.4311 12.4632 12.4632 k =-0.4533 0.3063 0.6377 ( 2686 PWs) bands (ev): 6.3404 6.3404 6.3572 6.3572 7.1102 7.1102 7.1381 7.1381 7.6392 7.6392 7.7025 7.7025 7.9627 7.9627 7.9758 7.9758 8.2063 8.2063 8.2616 8.2616 8.6585 8.6585 8.6671 8.6671 9.2821 9.2821 9.2842 9.2842 11.2927 11.2927 11.2974 11.2974 12.4280 12.4280 12.4581 12.4581 k =-0.4585 0.2906 0.6377 ( 2682 PWs) bands (ev): 6.3241 6.3241 6.3392 6.3392 7.1017 7.1017 7.1274 7.1274 7.6491 7.6491 7.7100 7.7100 7.9646 7.9646 7.9752 7.9752 8.1830 8.1830 8.2379 8.2379 8.6660 8.6660 8.6745 8.6745 9.2995 9.2995 9.3015 9.3015 11.2874 11.2874 11.2919 11.2919 12.4236 12.4236 12.4511 12.4511 k =-0.4637 0.2748 0.6377 ( 2678 PWs) bands (ev): 6.3094 6.3094 6.3227 6.3227 7.0928 7.0928 7.1157 7.1157 7.6614 7.6614 7.7186 7.7186 7.9677 7.9677 7.9754 7.9754 8.1607 8.1607 8.2144 8.2144 8.6731 8.6731 8.6812 8.6812 9.3156 9.3156 9.3174 9.3174 11.2825 11.2825 11.2867 11.2867 12.4184 12.4184 12.4430 12.4430 k =-0.4689 0.2590 0.6377 ( 2678 PWs) bands (ev): 6.2965 6.2965 6.3079 6.3079 7.0842 7.0842 7.1041 7.1041 7.6752 7.6752 7.7275 7.7275 7.9719 7.9719 7.9763 7.9763 8.1396 8.1396 8.1913 8.1913 8.6798 8.6798 8.6871 8.6871 9.3301 9.3301 9.3317 9.3317 11.2780 11.2780 11.2818 11.2818 12.4128 12.4128 12.4342 12.4342 k =-0.4741 0.2433 0.6377 ( 2668 PWs) bands (ev): 6.2855 6.2855 6.2951 6.2951 7.0763 7.0763 7.0930 7.0930 7.6897 7.6897 7.7358 7.7358 7.9773 7.9773 7.9782 7.9782 8.1201 8.1201 8.1688 8.1688 8.6858 8.6858 8.6922 8.6922 9.3428 9.3428 9.3442 9.3442 11.2742 11.2742 11.2774 11.2774 12.4074 12.4074 12.4254 12.4254 k =-0.4793 0.2275 0.6377 ( 2668 PWs) bands (ev): 6.2766 6.2766 6.2842 6.2842 7.0697 7.0697 7.0830 7.0830 7.7038 7.7038 7.7426 7.7426 7.9811 7.9811 7.9837 7.9837 8.1027 8.1027 8.1471 8.1471 8.6909 8.6909 8.6963 8.6963 9.3535 9.3535 9.3546 9.3546 11.2710 11.2710 11.2737 11.2737 12.4025 12.4025 12.4170 12.4170 k =-0.4844 0.2117 0.6377 ( 2664 PWs) bands (ev): 6.2697 6.2697 6.2754 6.2754 7.0646 7.0646 7.0746 7.0746 7.7170 7.7170 7.7474 7.7474 7.9849 7.9849 7.9905 7.9905 8.0883 8.0883 8.1266 8.1266 8.6953 8.6953 8.6994 8.6994 9.3620 9.3620 9.3628 9.3628 11.2685 11.2685 11.2706 11.2706 12.3987 12.3987 12.4095 12.4095 k =-0.4896 0.1960 0.6377 ( 2672 PWs) bands (ev): 6.2650 6.2650 6.2688 6.2688 7.0612 7.0612 7.0679 7.0679 7.7287 7.7287 7.7496 7.7496 7.9895 7.9895 7.9963 7.9963 8.0786 8.0786 8.1079 8.1079 8.6986 8.6986 8.7014 8.7014 9.3682 9.3682 9.3688 9.3688 11.2669 11.2669 11.2683 11.2683 12.3961 12.3961 12.4034 12.4034 k =-0.4948 0.1802 0.6377 ( 2676 PWs) bands (ev): 6.2625 6.2625 6.2644 6.2644 7.0598 7.0598 7.0631 7.0631 7.7381 7.7381 7.7488 7.7488 7.9943 7.9943 7.9993 7.9993 8.0756 8.0756 8.0921 8.0921 8.7009 8.7009 8.7023 8.7023 9.3720 9.3720 9.3723 9.3723 11.2660 11.2660 11.2667 11.2667 12.3952 12.3952 12.3988 12.3988 k =-0.5000 0.1644 0.6377 ( 2676 PWs) bands (ev): 6.2623 6.2623 6.2623 6.2623 7.0604 7.0604 7.0604 7.0604 7.7449 7.7449 7.7449 7.7449 7.9982 7.9982 7.9982 7.9982 8.0806 8.0806 8.0806 8.0806 8.7021 8.7021 8.7021 8.7021 9.3734 9.3734 9.3734 9.3734 11.2659 11.2659 11.2659 11.2659 12.3961 12.3961 12.3961 12.3961 k =-0.5000 0.1644 0.6377 ( 2676 PWs) bands (ev): 6.2623 6.2623 6.2623 6.2623 7.0604 7.0604 7.0604 7.0604 7.7449 7.7449 7.7449 7.7449 7.9982 7.9982 7.9982 7.9982 8.0806 8.0806 8.0806 8.0806 8.7021 8.7021 8.7021 8.7021 9.3734 9.3734 9.3734 9.3734 11.2659 11.2659 11.2659 11.2659 12.3961 12.3961 12.3961 12.3961 k =-0.5000 0.1644 0.6213 ( 2676 PWs) bands (ev): 6.2025 6.2025 6.3209 6.3209 7.0135 7.0135 7.1038 7.1038 7.7310 7.7310 7.7592 7.7592 7.9923 7.9923 8.0003 8.0003 8.0661 8.0661 8.0989 8.0989 8.6783 8.6783 8.7248 8.7248 9.3681 9.3681 9.3807 9.3807 11.2468 11.2468 11.2855 11.2855 12.3923 12.3923 12.4039 12.4039 k =-0.5000 0.1644 0.6050 ( 2672 PWs) bands (ev): 6.1417 6.1417 6.3782 6.3782 6.9638 6.9638 7.1430 7.1430 7.7187 7.7187 7.7730 7.7730 7.9849 7.9849 7.9951 7.9951 8.0587 8.0587 8.1188 8.1188 8.6537 8.6537 8.7460 8.7460 9.3650 9.3650 9.3895 9.3895 11.2280 11.2280 11.3055 11.3055 12.3927 12.3927 12.4155 12.4155 k =-0.5000 0.1644 0.5886 ( 2674 PWs) bands (ev): 6.0799 6.0799 6.4339 6.4339 6.9118 6.9118 7.1769 7.1769 7.7092 7.7092 7.7852 7.7852 7.9774 7.9774 7.9821 7.9821 8.0587 8.0587 8.1392 8.1392 8.6287 8.6287 8.7656 8.7656 9.3647 9.3647 9.3997 9.3997 11.2095 11.2095 11.3260 11.3260 12.3973 12.3973 12.4307 12.4307 k =-0.5000 0.1644 0.5723 ( 2670 PWs) bands (ev): 6.0173 6.0173 6.4880 6.4880 6.8579 6.8579 7.2044 7.2044 7.7036 7.7036 7.7948 7.7948 7.9650 7.9650 7.9705 7.9705 8.0626 8.0626 8.1599 8.1599 8.6039 8.6039 8.7832 8.7832 9.3676 9.3676 9.4108 9.4108 11.1913 11.1913 11.3469 11.3469 12.4064 12.4064 12.4493 12.4493 k =-0.5000 0.1644 0.5559 ( 2668 PWs) bands (ev): 5.9541 5.9541 6.5403 6.5403 6.8025 6.8025 7.2247 7.2247 7.7029 7.7029 7.8010 7.8010 7.9467 7.9467 7.9647 7.9647 8.0676 8.0676 8.1804 8.1804 8.5796 8.5796 8.7986 8.7986 9.3739 9.3739 9.4228 9.4228 11.1735 11.1735 11.3683 11.3683 12.4198 12.4198 12.4711 12.4711 k =-0.5000 0.1644 0.5396 ( 2672 PWs) bands (ev): 5.8906 5.8906 6.5902 6.5902 6.7466 6.7466 7.2368 7.2368 7.7077 7.7077 7.8033 7.8033 7.9290 7.9290 7.9603 7.9603 8.0720 8.0720 8.2006 8.2006 8.5564 8.5564 8.8117 8.8117 9.3839 9.3839 9.4355 9.4355 11.1558 11.1558 11.3901 11.3901 12.4377 12.4377 12.4958 12.4958 k =-0.5000 0.1644 0.5232 ( 2672 PWs) bands (ev): 5.8267 5.8267 6.6336 6.6336 6.6943 6.6943 7.2409 7.2409 7.7168 7.7168 7.8023 7.8023 7.9129 7.9129 7.9574 7.9574 8.0749 8.0749 8.2206 8.2206 8.5350 8.5350 8.8223 8.8223 9.3978 9.3978 9.4489 9.4489 11.1383 11.1383 11.4124 11.4124 12.4600 12.4600 12.5232 12.5232 k =-0.5000 0.1644 0.5069 ( 2668 PWs) bands (ev): 5.7628 5.7628 6.6193 6.6193 6.6971 6.6971 7.2375 7.2375 7.7269 7.7269 7.8011 7.8011 7.8987 7.8987 7.9557 7.9557 8.0755 8.0755 8.2404 8.2404 8.5160 8.5160 8.8304 8.8304 9.4155 9.4155 9.4632 9.4632 11.1210 11.1210 11.4351 11.4351 12.4866 12.4866 12.5528 12.5528 k =-0.5000 0.1644 0.4905 ( 2668 PWs) bands (ev): 5.6990 5.6990 6.5633 6.5633 6.7391 6.7391 7.2276 7.2276 7.7306 7.7306 7.8068 7.8068 7.8867 7.8867 7.9547 7.9547 8.0734 8.0734 8.2598 8.2598 8.5001 8.5001 8.8359 8.8359 9.4365 9.4365 9.4789 9.4789 11.1038 11.1038 11.4583 11.4583 12.5171 12.5171 12.5839 12.5839 k =-0.5000 0.1644 0.4742 ( 2672 PWs) bands (ev): 5.6356 5.6356 6.5039 6.5039 6.7822 6.7822 7.2124 7.2124 7.7227 7.7227 7.8243 7.8243 7.8763 7.8763 7.9539 7.9539 8.0681 8.0681 8.2790 8.2790 8.4876 8.4876 8.8388 8.8388 9.4594 9.4594 9.4974 9.4974 11.0867 11.0867 11.4819 11.4819 12.5511 12.5511 12.6152 12.6152 k =-0.5000 0.1644 0.4578 ( 2672 PWs) bands (ev): 5.5725 5.5725 6.4438 6.4438 6.8239 6.8239 7.1932 7.1932 7.7067 7.7067 7.8502 7.8502 7.8675 7.8675 7.9528 7.9528 8.0594 8.0594 8.2980 8.2980 8.4788 8.4788 8.8391 8.8391 9.4814 9.4814 9.5212 9.5212 11.0697 11.0697 11.5058 11.5058 12.5872 12.5872 12.6428 12.6428 k =-0.5000 0.1644 0.4415 ( 2672 PWs) bands (ev): 5.5102 5.5102 6.3834 6.3834 6.8640 6.8640 7.1709 7.1709 7.6865 7.6865 7.8583 7.8583 7.8823 7.8823 7.9512 7.9512 8.0475 8.0475 8.3167 8.3167 8.4739 8.4739 8.8369 8.8369 9.5005 9.5005 9.5522 9.5522 11.0527 11.0527 11.5299 11.5299 12.6208 12.6208 12.6601 12.6601 k =-0.5000 0.1644 0.4251 ( 2680 PWs) bands (ev): 5.4486 5.4486 6.3230 6.3230 6.9021 6.9021 7.1462 7.1462 7.6643 7.6643 7.8512 7.8512 7.9153 7.9153 7.9490 7.9490 8.0328 8.0328 8.3353 8.3353 8.4725 8.4725 8.8322 8.8322 9.5173 9.5173 9.5893 9.5893 11.0359 11.0359 11.5542 11.5542 12.6314 12.6314 12.6787 12.6787 k =-0.5000 0.1644 0.4088 ( 2684 PWs) bands (ev): 5.3881 5.3881 6.2630 6.2630 6.9383 6.9383 7.1199 7.1199 7.6413 7.6413 7.8445 7.8445 7.9447 7.9447 7.9505 7.9505 8.0167 8.0167 8.3538 8.3538 8.4743 8.4743 8.8253 8.8253 9.5330 9.5330 9.6312 9.6312 11.0191 11.0191 11.5785 11.5785 12.6154 12.6154 12.7003 12.7003 k =-0.5000 0.1644 0.3924 ( 2680 PWs) bands (ev): 5.3286 5.3286 6.2035 6.2035 6.9723 6.9723 7.0924 7.0924 7.6182 7.6182 7.8383 7.8383 7.9421 7.9421 7.9766 7.9766 8.0065 8.0065 8.3723 8.3723 8.4789 8.4789 8.8162 8.8162 9.5483 9.5483 9.6768 9.6768 11.0024 11.0024 11.6027 11.6027 12.5886 12.5886 12.7129 12.7129 k =-0.5000 0.1644 0.3761 ( 2672 PWs) bands (ev): 5.2705 5.2705 6.1448 6.1448 7.0041 7.0041 7.0640 7.0640 7.5955 7.5955 7.8324 7.8324 7.9374 7.9374 7.9701 7.9701 8.0296 8.0296 8.3906 8.3906 8.4857 8.4857 8.8052 8.8052 9.5633 9.5633 9.7255 9.7255 10.9858 10.9858 11.6267 11.6267 12.5552 12.5552 12.7208 12.7208 k =-0.5000 0.1644 0.3597 ( 2674 PWs) bands (ev): 5.2138 5.2138 6.0870 6.0870 7.0332 7.0332 7.0355 7.0355 7.5738 7.5738 7.8266 7.8266 7.9305 7.9305 7.9535 7.9535 8.0643 8.0643 8.4089 8.4089 8.4942 8.4942 8.7923 8.7923 9.5783 9.5783 9.7766 9.7766 10.9693 10.9693 11.6502 11.6502 12.5167 12.5167 12.7259 12.7259 k =-0.5000 0.1644 0.3434 ( 2678 PWs) bands (ev): 5.1587 5.1587 6.0303 6.0303 7.0062 7.0062 7.0601 7.0601 7.5533 7.5533 7.8206 7.8206 7.9180 7.9180 7.9413 7.9413 8.1001 8.1001 8.4270 8.4270 8.5041 8.5041 8.7779 8.7779 9.5933 9.5933 9.8298 9.8298 10.9530 10.9530 11.6729 11.6729 12.4743 12.4743 12.7288 12.7288 k =-0.5000 0.1644 0.3270 ( 2686 PWs) bands (ev): 5.1053 5.1053 5.9750 5.9750 6.9772 6.9772 7.0839 7.0839 7.5346 7.5346 7.8139 7.8139 7.9008 7.9008 7.9347 7.9347 8.1358 8.1358 8.4448 8.4448 8.5150 8.5150 8.7622 8.7622 9.6082 9.6082 9.8846 9.8846 10.9368 10.9368 11.6947 11.6947 12.4286 12.4286 12.7297 12.7297 k =-0.5000 0.1644 0.3107 ( 2686 PWs) bands (ev): 5.0537 5.0537 5.9213 5.9213 6.9485 6.9485 7.1046 7.1046 7.5180 7.5180 7.8057 7.8057 7.8836 7.8836 7.9306 7.9306 8.1712 8.1712 8.4623 8.4623 8.5265 8.5265 8.7456 8.7456 9.6232 9.6232 9.9406 9.9406 10.9209 10.9209 11.7152 11.7152 12.3804 12.3804 12.7289 12.7289 k =-0.5000 0.1644 0.2943 ( 2686 PWs) bands (ev): 5.0041 5.0041 5.8692 5.8692 6.9202 6.9202 7.1218 7.1218 7.5039 7.5039 7.7950 7.7950 7.8690 7.8690 7.9277 7.9277 8.2059 8.2059 8.4792 8.4792 8.5384 8.5384 8.7283 8.7283 9.6381 9.6381 9.9976 9.9976 10.9052 10.9052 11.7341 11.7341 12.3303 12.3303 12.7264 12.7264 k =-0.5000 0.1644 0.2780 ( 2692 PWs) bands (ev): 4.9565 4.9565 5.8190 5.8190 6.8925 6.8925 7.1353 7.1353 7.4926 7.4926 7.7812 7.7812 7.8579 7.8579 7.9258 7.9258 8.2398 8.2398 8.4954 8.4954 8.5501 8.5501 8.7111 8.7111 9.6530 9.6530 10.0552 10.0552 10.8899 10.8899 11.7511 11.7511 12.2789 12.2789 12.7227 12.7227 k =-0.5000 0.1644 0.2616 ( 2692 PWs) bands (ev): 4.9111 4.9111 5.7708 5.7708 6.8656 6.8656 7.1452 7.1452 7.4844 7.4844 7.7650 7.7650 7.8504 7.8504 7.9250 7.9250 8.2728 8.2728 8.5107 8.5107 8.5609 8.5609 8.6947 8.6947 9.6677 9.6677 10.1131 10.1131 10.8749 10.8749 11.7657 11.7657 12.2268 12.2268 12.7179 12.7179 k =-0.5000 0.1644 0.2453 ( 2692 PWs) bands (ev): 4.8680 4.8680 5.7248 5.7248 6.8397 6.8397 7.1513 7.1513 7.4791 7.4791 7.7472 7.7472 7.8454 7.8454 7.9252 7.9252 8.3048 8.3048 8.5248 8.5248 8.5697 8.5697 8.6805 8.6805 9.6823 9.6823 10.1711 10.1711 10.8605 10.8605 11.7777 11.7777 12.1745 12.1745 12.7124 12.7124 k =-0.5000 0.1644 0.2289 ( 2688 PWs) bands (ev): 4.8272 4.8272 5.6811 5.6811 6.8148 6.8148 7.1539 7.1539 7.4767 7.4767 7.7289 7.7289 7.8423 7.8423 7.9265 7.9265 8.3355 8.3355 8.5374 8.5374 8.5745 8.5745 8.6709 8.6709 9.6967 9.6967 10.2287 10.2287 10.8466 10.8466 11.7866 11.7866 12.1227 12.1227 12.7067 12.7067 k =-0.5000 0.1644 0.2126 ( 2676 PWs) bands (ev): 4.7889 4.7889 5.6398 5.6398 6.7911 6.7911 7.1536 7.1536 7.4768 7.4768 7.7108 7.7108 7.8404 7.8404 7.9289 7.9289 8.3648 8.3648 8.5473 8.5473 8.5744 8.5744 8.6680 8.6680 9.7108 9.7108 10.2859 10.2859 10.8333 10.8333 11.7921 11.7921 12.0717 12.0717 12.7010 12.7010 k =-0.5000 0.1644 0.1962 ( 2672 PWs) bands (ev): 4.7531 4.7531 5.6012 5.6012 6.7687 6.7687 7.1509 7.1509 7.4787 7.4787 7.6932 7.6932 7.8393 7.8393 7.9322 7.9322 8.3925 8.3925 8.5499 8.5499 8.5740 8.5740 8.6718 8.6718 9.7246 9.7246 10.3422 10.3422 10.8207 10.8207 11.7940 11.7940 12.0222 12.0222 12.6956 12.6956 k =-0.5000 0.1644 0.1799 ( 2674 PWs) bands (ev): 4.7199 4.7199 5.5652 5.5652 6.7477 6.7477 7.1464 7.1464 7.4820 7.4820 7.6764 7.6764 7.8388 7.8388 7.9365 7.9365 8.4182 8.4182 8.5414 8.5414 8.5795 8.5795 8.6800 8.6800 9.7378 9.7378 10.3973 10.3973 10.8089 10.8089 11.7922 11.7922 11.9747 11.9747 12.6909 12.6909 k =-0.5000 0.1644 0.1635 ( 2676 PWs) bands (ev): 4.6894 4.6894 5.5320 5.5320 6.7283 6.7283 7.1408 7.1408 7.4860 7.4860 7.6607 7.6607 7.8387 7.8387 7.9415 7.9415 8.4412 8.4412 8.5283 8.5283 8.5873 8.5873 8.6905 8.6905 9.7506 9.7506 10.4509 10.4509 10.7979 10.7979 11.7864 11.7864 11.9298 11.9298 12.6871 12.6871 k =-0.5000 0.1644 0.1472 ( 2674 PWs) bands (ev): 4.6616 4.6616 5.5017 5.5017 6.7104 6.7104 7.1345 7.1345 7.4905 7.4905 7.6462 7.6462 7.8391 7.8391 7.9471 7.9471 8.4595 8.4595 8.5165 8.5165 8.5951 8.5951 8.7017 8.7017 9.7627 9.7627 10.5026 10.5026 10.7878 10.7878 11.7767 11.7767 11.8883 11.8883 12.6841 12.6841 k =-0.5000 0.1644 0.1308 ( 2672 PWs) bands (ev): 4.6365 4.6365 5.4743 5.4743 6.6942 6.6942 7.1280 7.1280 7.4950 7.4950 7.6331 7.6331 7.8397 7.8397 7.9532 7.9532 8.4667 8.4667 8.5136 8.5136 8.6022 8.6022 8.7129 8.7129 9.7740 9.7740 10.5519 10.5519 10.7788 10.7788 11.7631 11.7631 11.8509 11.8509 12.6821 12.6821 k =-0.5000 0.1644 0.1145 ( 2676 PWs) bands (ev): 4.6143 4.6143 5.4500 5.4500 6.6797 6.6797 7.1215 7.1215 7.4993 7.4993 7.6213 7.6213 7.8406 7.8406 7.9594 7.9594 8.4601 8.4601 8.5229 8.5229 8.6085 8.6085 8.7234 8.7234 9.7844 9.7844 10.5983 10.5983 10.7707 10.7707 11.7460 11.7460 11.8184 11.8184 12.6809 12.6810 k =-0.5000 0.1644 0.0981 ( 2684 PWs) bands (ev): 4.5950 4.5950 5.4288 5.4288 6.6671 6.6671 7.1156 7.1156 7.5033 7.5033 7.6109 7.6109 7.8415 7.8415 7.9656 7.9656 8.4480 8.4480 8.5366 8.5366 8.6138 8.6138 8.7330 8.7330 9.7938 9.7938 10.6410 10.6410 10.7636 10.7636 11.7261 11.7261 11.7911 11.7911 12.6805 12.6805 k =-0.5000 0.1644 0.0818 ( 2688 PWs) bands (ev): 4.5786 4.5786 5.4108 5.4108 6.6563 6.6563 7.1102 7.1102 7.5067 7.5067 7.6021 7.6021 7.8425 7.8425 7.9715 7.9715 8.4355 8.4355 8.5500 8.5500 8.6183 8.6183 8.7415 8.7415 9.8021 9.8021 10.6794 10.6794 10.7577 10.7577 11.7052 11.7052 11.7685 11.7685 12.6805 12.6805 k =-0.5000 0.1644 0.0654 ( 2690 PWs) bands (ev): 4.5651 4.5651 5.3959 5.3959 6.6474 6.6474 7.1056 7.1056 7.5096 7.5096 7.5949 7.5949 7.8434 7.8434 7.9768 7.9768 8.4241 8.4241 8.5618 8.5618 8.6219 8.6219 8.7486 8.7486 9.8090 9.8090 10.7127 10.7127 10.7528 10.7528 11.6854 11.6854 11.7500 11.7500 12.6809 12.6809 k =-0.5000 0.1644 0.0491 ( 2690 PWs) bands (ev): 4.5546 4.5546 5.3844 5.3844 6.6404 6.6404 7.1019 7.1019 7.5118 7.5118 7.5893 7.5893 7.8443 7.8443 7.9814 7.9814 8.4147 8.4147 8.5714 8.5714 8.6245 8.6245 8.7542 8.7542 9.8146 9.8146 10.7398 10.7398 10.7491 10.7491 11.6685 11.6685 11.7353 11.7353 12.6814 12.6815 k =-0.5000 0.1644 0.0327 ( 2686 PWs) bands (ev): 4.5471 4.5471 5.3761 5.3761 6.6354 6.6354 7.0993 7.0993 7.5135 7.5135 7.5852 7.5852 7.8449 7.8449 7.9848 7.9848 8.4076 8.4076 8.5785 8.5785 8.6263 8.6263 8.7583 8.7583 9.8186 9.8186 10.7463 10.7463 10.7601 10.7601 11.6556 11.6556 11.7244 11.7244 12.6820 12.6820 k =-0.5000 0.1644 0.0164 ( 2688 PWs) bands (ev): 4.5426 4.5426 5.3711 5.3711 6.6324 6.6324 7.0976 7.0976 7.5144 7.5144 7.5828 7.5828 7.8453 7.8453 7.9870 7.9870 8.4031 8.4031 8.5829 8.5829 8.6274 8.6274 8.7607 8.7607 9.8211 9.8211 10.7448 10.7448 10.7725 10.7725 11.6476 11.6476 11.7177 11.7177 12.6823 12.6823 k =-0.5000 0.1644 0.0000 ( 2696 PWs) bands (ev): 4.5411 4.5411 5.3695 5.3695 6.6314 6.6314 7.0971 7.0971 7.5147 7.5147 7.5819 7.5819 7.8454 7.8454 7.9877 7.9877 8.4016 8.4016 8.5843 8.5843 8.6277 8.6277 8.7615 8.7615 9.8219 9.8219 10.7442 10.7442 10.7768 10.7768 11.6449 11.6449 11.7154 11.7154 12.6824 12.6824 k = 0.0000 0.0000 0.6377 ( 2694 PWs) bands (ev): 5.5695 5.5695 5.5695 5.5695 6.9675 6.9675 6.9675 6.9675 7.9068 7.9068 7.9068 7.9068 8.1774 8.1774 8.1774 8.1774 8.6303 8.6303 8.6303 8.6303 8.7783 8.7783 8.7783 8.7783 9.8220 9.8220 9.8220 9.8220 10.9581 10.9581 10.9581 10.9581 11.4907 11.4907 11.4907 11.4907 k =-0.0156 0.0051 0.6377 ( 2686 PWs) bands (ev): 5.5707 5.5707 5.5707 5.5707 6.9677 6.9677 6.9677 6.9677 7.9065 7.9065 7.9065 7.9065 8.1770 8.1770 8.1770 8.1770 8.6296 8.6296 8.6296 8.6296 8.7781 8.7781 8.7781 8.7781 9.8209 9.8209 9.8209 9.8209 10.9585 10.9585 10.9585 10.9585 11.4925 11.4925 11.4925 11.4925 k =-0.0312 0.0103 0.6377 ( 2686 PWs) bands (ev): 5.5745 5.5745 5.5745 5.5745 6.9682 6.9682 6.9682 6.9682 7.9055 7.9055 7.9055 7.9055 8.1758 8.1758 8.1758 8.1758 8.6272 8.6272 8.6272 8.6272 8.7773 8.7773 8.7773 8.7773 9.8175 9.8175 9.8175 9.8175 10.9597 10.9597 10.9597 10.9597 11.4978 11.4978 11.4978 11.4978 k =-0.0469 0.0154 0.6377 ( 2684 PWs) bands (ev): 5.5807 5.5807 5.5807 5.5807 6.9691 6.9691 6.9691 6.9691 7.9040 7.9040 7.9040 7.9040 8.1738 8.1738 8.1738 8.1738 8.6233 8.6233 8.6233 8.6233 8.7759 8.7759 8.7759 8.7759 9.8119 9.8119 9.8119 9.8119 10.9618 10.9618 10.9618 10.9618 11.5066 11.5066 11.5066 11.5066 k =-0.0625 0.0206 0.6377 ( 2682 PWs) bands (ev): 5.5894 5.5894 5.5894 5.5894 6.9703 6.9703 6.9703 6.9703 7.9018 7.9018 7.9018 7.9018 8.1709 8.1709 8.1709 8.1709 8.6178 8.6178 8.6178 8.6178 8.7741 8.7741 8.7741 8.7741 9.8041 9.8041 9.8041 9.8041 10.9648 10.9648 10.9648 10.9648 11.5188 11.5188 11.5188 11.5188 k =-0.0781 0.0257 0.6377 ( 2682 PWs) bands (ev): 5.6005 5.6005 5.6005 5.6005 6.9718 6.9718 6.9718 6.9718 7.8991 7.8991 7.8991 7.8991 8.1673 8.1673 8.1673 8.1673 8.6106 8.6106 8.6106 8.6106 8.7718 8.7718 8.7718 8.7718 9.7941 9.7941 9.7941 9.7941 10.9688 10.9688 10.9688 10.9688 11.5343 11.5343 11.5343 11.5343 k =-0.0938 0.0308 0.6377 ( 2678 PWs) bands (ev): 5.6140 5.6140 5.6140 5.6140 6.9736 6.9736 6.9736 6.9736 7.8958 7.8958 7.8958 7.8958 8.1630 8.1630 8.1630 8.1630 8.6018 8.6018 8.6018 8.6018 8.7691 8.7691 8.7691 8.7691 9.7821 9.7821 9.7821 9.7821 10.9738 10.9738 10.9738 10.9738 11.5531 11.5531 11.5531 11.5531 k =-0.1094 0.0360 0.6377 ( 2674 PWs) bands (ev): 5.6298 5.6298 5.6298 5.6298 6.9757 6.9757 6.9757 6.9757 7.8920 7.8920 7.8920 7.8920 8.1580 8.1580 8.1580 8.1580 8.5913 8.5913 8.5913 8.5913 8.7660 8.7660 8.7660 8.7660 9.7680 9.7680 9.7680 9.7680 10.9799 10.9799 10.9800 10.9800 11.5750 11.5750 11.5750 11.5750 k =-0.1250 0.0411 0.6377 ( 2672 PWs) bands (ev): 5.6478 5.6478 5.6478 5.6478 6.9782 6.9782 6.9782 6.9782 7.8878 7.8878 7.8878 7.8878 8.1524 8.1524 8.1524 8.1524 8.5791 8.5791 8.5791 8.5791 8.7627 8.7627 8.7627 8.7627 9.7522 9.7522 9.7522 9.7522 10.9872 10.9872 10.9872 10.9872 11.5999 11.5999 11.5999 11.5999 k =-0.1406 0.0462 0.6377 ( 2676 PWs) bands (ev): 5.6681 5.6681 5.6681 5.6681 6.9808 6.9808 6.9808 6.9808 7.8831 7.8831 7.8831 7.8831 8.1461 8.1461 8.1461 8.1461 8.5650 8.5650 8.5650 8.5650 8.7591 8.7591 8.7591 8.7591 9.7346 9.7346 9.7346 9.7346 10.9956 10.9956 10.9956 10.9956 11.6276 11.6276 11.6276 11.6276 k =-0.1562 0.0514 0.6377 ( 2680 PWs) bands (ev): 5.6904 5.6904 5.6904 5.6904 6.9838 6.9838 6.9838 6.9838 7.8780 7.8780 7.8780 7.8780 8.1394 8.1394 8.1394 8.1394 8.5492 8.5492 8.5492 8.5492 8.7553 8.7553 8.7553 8.7553 9.7156 9.7156 9.7156 9.7156 11.0052 11.0052 11.0052 11.0052 11.6580 11.6580 11.6580 11.6580 k =-0.1719 0.0565 0.6377 ( 2680 PWs) bands (ev): 5.7147 5.7147 5.7147 5.7147 6.9869 6.9869 6.9869 6.9869 7.8727 7.8727 7.8727 7.8727 8.1322 8.1322 8.1322 8.1322 8.5316 8.5316 8.5316 8.5316 8.7515 8.7515 8.7515 8.7515 9.6953 9.6953 9.6953 9.6953 11.0160 11.0160 11.0160 11.0160 11.6907 11.6907 11.6907 11.6907 k =-0.1875 0.0617 0.6377 ( 2680 PWs) bands (ev): 5.7409 5.7409 5.7409 5.7409 6.9903 6.9903 6.9903 6.9903 7.8670 7.8670 7.8670 7.8670 8.1246 8.1246 8.1246 8.1246 8.5122 8.5122 8.5122 8.5122 8.7476 8.7476 8.7476 8.7476 9.6739 9.6739 9.6739 9.6739 11.0278 11.0278 11.0278 11.0278 11.7258 11.7258 11.7258 11.7258 k =-0.2031 0.0668 0.6377 ( 2678 PWs) bands (ev): 5.7688 5.7688 5.7688 5.7688 6.9939 6.9939 6.9939 6.9939 7.8611 7.8611 7.8611 7.8611 8.1167 8.1167 8.1167 8.1167 8.4909 8.4909 8.4909 8.4909 8.7437 8.7437 8.7437 8.7437 9.6518 9.6518 9.6518 9.6518 11.0408 11.0408 11.0408 11.0408 11.7628 11.7628 11.7628 11.7628 k =-0.2188 0.0719 0.6377 ( 2678 PWs) bands (ev): 5.7982 5.7982 5.7982 5.7982 6.9976 6.9976 6.9976 6.9976 7.8549 7.8549 7.8549 7.8549 8.1086 8.1086 8.1086 8.1086 8.4680 8.4680 8.4680 8.4680 8.7399 8.7399 8.7399 8.7399 9.6292 9.6292 9.6292 9.6292 11.0546 11.0546 11.0546 11.0546 11.8016 11.8016 11.8016 11.8016 k =-0.2344 0.0771 0.6377 ( 2674 PWs) bands (ev): 5.8290 5.8290 5.8290 5.8290 7.0015 7.0015 7.0015 7.0015 7.8487 7.8487 7.8487 7.8487 8.1003 8.1003 8.1003 8.1003 8.4435 8.4435 8.4435 8.4435 8.7361 8.7361 8.7361 8.7361 9.6064 9.6064 9.6064 9.6064 11.0692 11.0692 11.0692 11.0692 11.8420 11.8420 11.8420 11.8420 k =-0.2500 0.0822 0.6377 ( 2674 PWs) bands (ev): 5.8610 5.8610 5.8610 5.8610 7.0055 7.0055 7.0055 7.0055 7.8422 7.8422 7.8422 7.8422 8.0919 8.0919 8.0919 8.0919 8.4175 8.4175 8.4175 8.4175 8.7325 8.7325 8.7325 8.7325 9.5836 9.5836 9.5836 9.5836 11.0845 11.0845 11.0845 11.0845 11.8836 11.8836 11.8836 11.8836 k =-0.2656 0.0874 0.6377 ( 2674 PWs) bands (ev): 5.8940 5.8940 5.8940 5.8940 7.0097 7.0097 7.0097 7.0097 7.8356 7.8356 7.8356 7.8356 8.0836 8.0836 8.0836 8.0836 8.3902 8.3902 8.3902 8.3902 8.7290 8.7290 8.7290 8.7290 9.5611 9.5611 9.5611 9.5611 11.1002 11.1002 11.1002 11.1002 11.9262 11.9262 11.9262 11.9262 k =-0.2812 0.0925 0.6377 ( 2674 PWs) bands (ev): 5.9277 5.9277 5.9277 5.9277 7.0139 7.0139 7.0139 7.0139 7.8289 7.8289 7.8289 7.8289 8.0753 8.0753 8.0753 8.0753 8.3618 8.3618 8.3618 8.3618 8.7257 8.7257 8.7257 8.7257 9.5392 9.5392 9.5392 9.5392 11.1163 11.1163 11.1163 11.1163 11.9695 11.9695 11.9695 11.9695 k =-0.2969 0.0976 0.6377 ( 2678 PWs) bands (ev): 5.9618 5.9618 5.9618 5.9618 7.0181 7.0181 7.0181 7.0181 7.8221 7.8221 7.8221 7.8221 8.0670 8.0670 8.0670 8.0670 8.3326 8.3326 8.3326 8.3326 8.7225 8.7225 8.7225 8.7225 9.5180 9.5180 9.5180 9.5180 11.1325 11.1325 11.1325 11.1325 12.0131 12.0131 12.0131 12.0131 k =-0.3125 0.1028 0.6377 ( 2674 PWs) bands (ev): 5.9960 5.9960 5.9960 5.9960 7.0225 7.0225 7.0225 7.0225 7.8152 7.8152 7.8152 7.8152 8.0591 8.0591 8.0591 8.0591 8.3030 8.3030 8.3030 8.3030 8.7196 8.7196 8.7196 8.7196 9.4979 9.4979 9.4979 9.4979 11.1486 11.1486 11.1486 11.1486 12.0567 12.0567 12.0567 12.0567 k =-0.3281 0.1079 0.6377 ( 2668 PWs) bands (ev): 6.0300 6.0300 6.0300 6.0300 7.0268 7.0268 7.0268 7.0268 7.8081 7.8081 7.8081 7.8081 8.0513 8.0513 8.0513 8.0513 8.2735 8.2735 8.2735 8.2735 8.7169 8.7169 8.7169 8.7169 9.4789 9.4789 9.4789 9.4789 11.1644 11.1644 11.1644 11.1644 12.0999 12.0999 12.0999 12.0999 k =-0.3438 0.1130 0.6377 ( 2668 PWs) bands (ev): 6.0633 6.0633 6.0633 6.0633 7.0311 7.0311 7.0311 7.0311 7.8009 7.8009 7.8009 7.8009 8.0439 8.0439 8.0439 8.0439 8.2443 8.2443 8.2443 8.2443 8.7144 8.7144 8.7144 8.7144 9.4612 9.4612 9.4612 9.4612 11.1798 11.1798 11.1798 11.1798 12.1422 12.1422 12.1422 12.1422 k =-0.3594 0.1182 0.6377 ( 2668 PWs) bands (ev): 6.0956 6.0956 6.0956 6.0956 7.0354 7.0354 7.0354 7.0354 7.7937 7.7937 7.7937 7.7937 8.0368 8.0368 8.0368 8.0368 8.2161 8.2161 8.2161 8.2161 8.7121 8.7121 8.7121 8.7121 9.4449 9.4449 9.4449 9.4449 11.1944 11.1944 11.1944 11.1944 12.1831 12.1831 12.1831 12.1832 k =-0.3750 0.1233 0.6377 ( 2666 PWs) bands (ev): 6.1264 6.1264 6.1264 6.1264 7.0396 7.0396 7.0396 7.0396 7.7863 7.7863 7.7863 7.7863 8.0301 8.0301 8.0301 8.0301 8.1895 8.1895 8.1895 8.1895 8.7100 8.7100 8.7100 8.7100 9.4302 9.4302 9.4302 9.4302 11.2082 11.2082 11.2082 11.2082 12.2223 12.2223 12.2223 12.2223 k =-0.3906 0.1285 0.6377 ( 2666 PWs) bands (ev): 6.1553 6.1553 6.1553 6.1553 7.0437 7.0437 7.0437 7.0437 7.7789 7.7789 7.7789 7.7789 8.0238 8.0238 8.0238 8.0238 8.1649 8.1649 8.1649 8.1649 8.7082 8.7082 8.7082 8.7082 9.4171 9.4171 9.4171 9.4171 11.2209 11.2209 11.2209 11.2209 12.2589 12.2589 12.2589 12.2589 k =-0.4062 0.1336 0.6377 ( 2664 PWs) bands (ev): 6.1816 6.1816 6.1816 6.1816 7.0476 7.0476 7.0476 7.0476 7.7716 7.7716 7.7716 7.7716 8.0179 8.0179 8.0179 8.0179 8.1429 8.1429 8.1429 8.1429 8.7066 8.7066 8.7066 8.7066 9.4056 9.4056 9.4056 9.4056 11.2323 11.2323 11.2323 11.2323 12.2925 12.2925 12.2925 12.2925 k =-0.4219 0.1387 0.6377 ( 2658 PWs) bands (ev): 6.2050 6.2050 6.2050 6.2050 7.0511 7.0511 7.0511 7.0511 7.7647 7.7647 7.7647 7.7647 8.0126 8.0126 8.0126 8.0126 8.1239 8.1239 8.1239 8.1239 8.7053 8.7053 8.7053 8.7053 9.3958 9.3958 9.3958 9.3958 11.2422 11.2422 11.2422 11.2422 12.3225 12.3225 12.3225 12.3225 k =-0.4375 0.1439 0.6377 ( 2658 PWs) bands (ev): 6.2250 6.2250 6.2250 6.2250 7.0543 7.0543 7.0543 7.0543 7.7583 7.7583 7.7583 7.7583 8.0078 8.0078 8.0078 8.0078 8.1082 8.1082 8.1082 8.1082 8.7041 8.7041 8.7041 8.7041 9.3878 9.3878 9.3878 9.3878 11.2506 11.2506 11.2506 11.2506 12.3480 12.3480 12.3480 12.3480 k =-0.4531 0.1490 0.6377 ( 2664 PWs) bands (ev): 6.2410 6.2410 6.2410 6.2410 7.0568 7.0568 7.0568 7.0568 7.7528 7.7528 7.7528 7.7528 8.0039 8.0039 8.0039 8.0039 8.0960 8.0960 8.0960 8.0960 8.7033 8.7033 8.7033 8.7033 9.3815 9.3815 9.3815 9.3815 11.2572 11.2572 11.2572 11.2572 12.3686 12.3686 12.3686 12.3686 k =-0.4688 0.1542 0.6377 ( 2664 PWs) bands (ev): 6.2528 6.2528 6.2528 6.2528 7.0588 7.0588 7.0588 7.0588 7.7486 7.7486 7.7486 7.7486 8.0008 8.0008 8.0008 8.0008 8.0874 8.0874 8.0874 8.0874 8.7026 8.7026 8.7026 8.7026 9.3770 9.3770 9.3770 9.3770 11.2620 11.2620 11.2620 11.2620 12.3838 12.3838 12.3838 12.3838 k =-0.4844 0.1593 0.6377 ( 2672 PWs) bands (ev): 6.2599 6.2599 6.2599 6.2599 7.0600 7.0600 7.0600 7.0600 7.7458 7.7458 7.7458 7.7458 7.9989 7.9989 7.9989 7.9989 8.0823 8.0823 8.0823 8.0823 8.7022 8.7022 8.7022 8.7022 9.3743 9.3743 9.3743 9.3743 11.2650 11.2650 11.2650 11.2650 12.3930 12.3930 12.3930 12.3930 k =-0.5000 0.1644 0.6377 ( 2676 PWs) bands (ev): 6.2623 6.2623 6.2623 6.2623 7.0604 7.0604 7.0604 7.0604 7.7449 7.7449 7.7449 7.7449 7.9982 7.9982 7.9982 7.9982 8.0806 8.0806 8.0806 8.0806 8.7021 8.7021 8.7021 8.7021 9.3734 9.3734 9.3734 9.3734 11.2659 11.2659 11.2659 11.2659 12.3961 12.3961 12.3961 12.3961 Writing output data file ZrNi.save init_run : 0.14s CPU 0.28s WALL ( 1 calls) electrons : 128.98s CPU 131.62s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.01s WALL ( 1 calls) potinit : 0.02s CPU 0.06s WALL ( 1 calls) Called by electrons: c_bands : 128.97s CPU 131.61s WALL ( 1 calls) v_of_rho : 0.00s CPU 0.00s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.00s CPU 0.00s WALL ( 1 calls) newd : 0.02s CPU 0.03s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.02s CPU 0.04s WALL ( 460 calls) cegterg : 116.00s CPU 118.02s WALL ( 744 calls) Called by sum_band: Called by *egterg: h_psi : 66.77s CPU 68.61s WALL ( 12257 calls) s_psi : 2.90s CPU 2.93s WALL ( 12257 calls) g_psi : 0.17s CPU 0.19s WALL ( 11053 calls) cdiaghg : 46.36s CPU 46.86s WALL ( 11513 calls) cegterg:over : 3.84s CPU 3.90s WALL ( 11053 calls) cegterg:upda : 2.64s CPU 2.67s WALL ( 11053 calls) cegterg:last : 1.87s CPU 1.86s WALL ( 2127 calls) cdiaghg:chol : 2.47s CPU 2.47s WALL ( 11513 calls) cdiaghg:inve : 1.31s CPU 1.17s WALL ( 11513 calls) cdiaghg:para : 2.78s CPU 2.81s WALL ( 23026 calls) Called by h_psi: h_psi:vloc : 58.80s CPU 60.56s WALL ( 12257 calls) h_psi:vnl : 7.88s CPU 7.92s WALL ( 12257 calls) add_vuspsi : 4.25s CPU 4.18s WALL ( 12257 calls) General routines calbec : 3.59s CPU 3.71s WALL ( 12257 calls) fft : 0.01s CPU 0.00s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 54.99s CPU 56.47s WALL ( 955644 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.18s CPU 0.17s WALL ( 920 calls) Parallel routines fft_scatter : 20.68s CPU 21.35s WALL ( 955667 calls) PWSCF : 2m21.82s CPU 2m44.07s WALL This run was terminated on: 21: 0:52 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=