Program PWSCF v.5.3.0 (svn rev. 11974) starts on 5Jan2017 at 16:53:44 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: ./YBC.save/ file B.rel-pbe-n-rrkjus_psl.1.0.0.UPF: wavefunction(s) 2S renormalized file Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S 4P 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 60 31 9 1572 591 99 Max 61 32 10 1576 608 102 Sum 2161 1131 351 56683 21663 3653 bravais-lattice index = 14 lattice parameter (alat) = 13.3282 a.u. unit-cell volume = 567.7486 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 3 number of electrons = 36.00 number of Kohn-Sham states= 44 kinetic-energy cutoff = 43.0000 Ry charge density cutoff = 327.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 13.328156 celldm(2)= 1.000000 celldm(3)= 0.514252 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.884624 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.884624 0.466304 0.000000 ) a(3) = ( 0.000000 0.000000 0.514252 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.897096 -0.000000 ) b(2) = ( 0.000000 2.144522 -0.000000 ) b(3) = ( 0.000000 0.000000 1.944570 ) PseudoPot. # 1 for B read from file: /users/gautes/Pseudo/B.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: e6935728e521ae6844adca162131706c Pseudo is Ultrasoft + core correction, Zval = 3.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1059 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for C read from file: /users/gautes/Pseudo/C.rel-pbe-n-rrkjus_psl.1.0.0.UPF MD5 check sum: de79cff2a1a990998107dfc0a7a38bf3 Pseudo is Ultrasoft + core correction, Zval = 4.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1073 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients PseudoPot. # 3 for Y read from file: /users/gautes/Pseudo/Y.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 25a826a599bbcba7ebf619f9598d90b1 Pseudo is Ultrasoft + core correction, Zval = 11.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1223 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 B 3.00 10.81100 B( 1.00) C 4.00 12.01070 C( 1.00) Y 11.00 88.90590 Y( 1.00) 4 Sym. Ops., with inversion, found s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 -0.0000000 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 1 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 3 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 ) ( 0 1 0 ) ( 0 0 -1 ) cart. s( 4) = ( 1.0000000 -0.0000000 -0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) 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= 446 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 2) = ( 0.0053061 0.0214452 -0.0000000), wk = 0.0022422 k( 3) = ( 0.0106122 0.0428904 -0.0000000), wk = 0.0022422 k( 4) = ( 0.0159183 0.0643356 -0.0000000), wk = 0.0022422 k( 5) = ( 0.0212244 0.0857809 -0.0000000), wk = 0.0022422 k( 6) = ( 0.0265305 0.1072261 -0.0000000), wk = 0.0022422 k( 7) = ( 0.0318366 0.1286713 -0.0000000), wk = 0.0022422 k( 8) = ( 0.0371427 0.1501165 -0.0000000), wk = 0.0022422 k( 9) = ( 0.0424488 0.1715617 -0.0000000), wk = 0.0022422 k( 10) = ( 0.0477549 0.1930070 -0.0000000), wk = 0.0022422 k( 11) = ( 0.0530610 0.2144521 -0.0000000), wk = 0.0022422 k( 12) = ( 0.0583671 0.2358974 -0.0000000), wk = 0.0022422 k( 13) = ( 0.0636732 0.2573426 -0.0000000), wk = 0.0022422 k( 14) = ( 0.0689793 0.2787878 -0.0000000), wk = 0.0022422 k( 15) = ( 0.0742854 0.3002330 -0.0000000), wk = 0.0022422 k( 16) = ( 0.0795915 0.3216782 -0.0000000), wk = 0.0022422 k( 17) = ( 0.0848976 0.3431235 -0.0000000), wk = 0.0022422 k( 18) = ( 0.0902037 0.3645687 -0.0000000), wk = 0.0022422 k( 19) = ( 0.0955098 0.3860139 -0.0000000), wk = 0.0022422 k( 20) = ( 0.1008158 0.4074591 -0.0000000), wk = 0.0022422 k( 21) = ( 0.1061220 0.4289043 -0.0000000), wk = 0.0022422 k( 22) = ( 0.1114280 0.4503495 -0.0000000), wk = 0.0022422 k( 23) = ( 0.1167341 0.4717947 -0.0000000), wk = 0.0022422 k( 24) = ( 0.1220402 0.4932400 -0.0000000), wk = 0.0022422 k( 25) = ( 0.1273463 0.5146852 -0.0000000), wk = 0.0022422 k( 26) = ( 0.1326524 0.5361304 -0.0000000), wk = 0.0022422 k( 27) = ( 0.1379585 0.5575756 -0.0000000), wk = 0.0022422 k( 28) = ( 0.1432646 0.5790208 -0.0000000), wk = 0.0022422 k( 29) = ( 0.1485707 0.6004661 -0.0000000), wk = 0.0022422 k( 30) = ( 0.1538768 0.6219112 -0.0000000), wk = 0.0022422 k( 31) = ( 0.1591829 0.6433565 -0.0000000), wk = 0.0022422 k( 32) = ( 0.1644890 0.6648017 -0.0000000), wk = 0.0022422 k( 33) = ( 0.1697951 0.6862469 -0.0000000), wk = 0.0022422 k( 34) = ( 0.1751012 0.7076921 -0.0000000), wk = 0.0022422 k( 35) = ( 0.1804073 0.7291373 -0.0000000), wk = 0.0022422 k( 36) = ( 0.1857134 0.7505826 -0.0000000), wk = 0.0022422 k( 37) = ( 0.1910195 0.7720278 -0.0000000), wk = 0.0022422 k( 38) = ( 0.1963256 0.7934730 -0.0000000), wk = 0.0022422 k( 39) = ( 0.2016317 0.8149182 -0.0000000), wk = 0.0022422 k( 40) = ( 0.2069378 0.8363634 -0.0000000), wk = 0.0022422 k( 41) = ( 0.2122439 0.8578086 -0.0000000), wk = 0.0022422 k( 42) = ( 0.2175500 0.8792538 -0.0000000), wk = 0.0022422 k( 43) = ( 0.2228561 0.9006991 -0.0000000), wk = 0.0022422 k( 44) = ( 0.2281622 0.9221443 -0.0000000), wk = 0.0022422 k( 45) = ( 0.2334683 0.9435895 -0.0000000), wk = 0.0022422 k( 46) = ( 0.2387744 0.9650347 -0.0000000), wk = 0.0022422 k( 47) = ( 0.2440805 0.9864799 -0.0000000), wk = 0.0022422 k( 48) = ( 0.2493866 1.0079252 -0.0000000), wk = 0.0022422 k( 49) = ( 0.2546927 1.0293703 -0.0000000), wk = 0.0022422 k( 50) = ( 0.2599988 1.0508156 -0.0000000), wk = 0.0022422 k( 51) = ( 0.2653049 1.0722608 -0.0000000), wk = 0.0022422 k( 52) = ( 0.2653049 1.0722608 -0.0000000), wk = 0.0022422 k( 53) = ( 0.2431961 1.0722608 -0.0000000), wk = 0.0022422 k( 54) = ( 0.2210874 1.0722608 -0.0000000), wk = 0.0022422 k( 55) = ( 0.1989787 1.0722608 -0.0000000), wk = 0.0022422 k( 56) = ( 0.1768699 1.0722608 -0.0000000), wk = 0.0022422 k( 57) = ( 0.1547612 1.0722608 -0.0000000), wk = 0.0022422 k( 58) = ( 0.1326524 1.0722608 -0.0000000), wk = 0.0022422 k( 59) = ( 0.1105437 1.0722608 -0.0000000), wk = 0.0022422 k( 60) = ( 0.0884350 1.0722608 -0.0000000), wk = 0.0022422 k( 61) = ( 0.0663262 1.0722608 -0.0000000), wk = 0.0022422 k( 62) = ( 0.0442175 1.0722608 -0.0000000), wk = 0.0022422 k( 63) = ( 0.0221087 1.0722608 -0.0000000), wk = 0.0022422 k( 64) = ( 0.0000000 1.0722608 -0.0000000), wk = 0.0022422 k( 65) = ( 0.0000000 1.0722608 -0.0000000), wk = 0.0022422 k( 66) = ( 0.0000000 1.0722608 0.0220974), wk = 0.0022422 k( 67) = ( 0.0000000 1.0722608 0.0441948), wk = 0.0022422 k( 68) = ( 0.0000000 1.0722608 0.0662922), wk = 0.0022422 k( 69) = ( 0.0000000 1.0722608 0.0883896), wk = 0.0022422 k( 70) = ( 0.0000000 1.0722608 0.1104869), wk = 0.0022422 k( 71) = ( 0.0000000 1.0722608 0.1325843), wk = 0.0022422 k( 72) = ( 0.0000000 1.0722608 0.1546817), wk = 0.0022422 k( 73) = ( 0.0000000 1.0722608 0.1767791), wk = 0.0022422 k( 74) = ( 0.0000000 1.0722608 0.1988765), wk = 0.0022422 k( 75) = ( 0.0000000 1.0722608 0.2209739), wk = 0.0022422 k( 76) = ( 0.0000000 1.0722608 0.2430713), wk = 0.0022422 k( 77) = ( 0.0000000 1.0722608 0.2651687), wk = 0.0022422 k( 78) = ( 0.0000000 1.0722608 0.2872661), wk = 0.0022422 k( 79) = ( 0.0000000 1.0722608 0.3093635), wk = 0.0022422 k( 80) = ( 0.0000000 1.0722608 0.3314609), wk = 0.0022422 k( 81) = ( 0.0000000 1.0722608 0.3535582), wk = 0.0022422 k( 82) = ( 0.0000000 1.0722608 0.3756556), wk = 0.0022422 k( 83) = ( 0.0000000 1.0722608 0.3977530), wk = 0.0022422 k( 84) = ( 0.0000000 1.0722608 0.4198504), wk = 0.0022422 k( 85) = ( 0.0000000 1.0722608 0.4419478), wk = 0.0022422 k( 86) = ( 0.0000000 1.0722608 0.4640452), wk = 0.0022422 k( 87) = ( 0.0000000 1.0722608 0.4861426), wk = 0.0022422 k( 88) = ( 0.0000000 1.0722608 0.5082400), wk = 0.0022422 k( 89) = ( 0.0000000 1.0722608 0.5303374), wk = 0.0022422 k( 90) = ( 0.0000000 1.0722608 0.5524348), wk = 0.0022422 k( 91) = ( 0.0000000 1.0722608 0.5745322), wk = 0.0022422 k( 92) = ( 0.0000000 1.0722608 0.5966295), wk = 0.0022422 k( 93) = ( 0.0000000 1.0722608 0.6187269), wk = 0.0022422 k( 94) = ( 0.0000000 1.0722608 0.6408243), wk = 0.0022422 k( 95) = ( 0.0000000 1.0722608 0.6629217), wk = 0.0022422 k( 96) = ( 0.0000000 1.0722608 0.6850191), wk = 0.0022422 k( 97) = ( 0.0000000 1.0722608 0.7071165), wk = 0.0022422 k( 98) = ( 0.0000000 1.0722608 0.7292139), wk = 0.0022422 k( 99) = ( 0.0000000 1.0722608 0.7513113), wk = 0.0022422 k( 100) = ( 0.0000000 1.0722608 0.7734087), wk = 0.0022422 k( 101) = ( 0.0000000 1.0722608 0.7955061), wk = 0.0022422 k( 102) = ( 0.0000000 1.0722608 0.8176035), wk = 0.0022422 k( 103) = ( 0.0000000 1.0722608 0.8397008), wk = 0.0022422 k( 104) = ( 0.0000000 1.0722608 0.8617982), wk = 0.0022422 k( 105) = ( 0.0000000 1.0722608 0.8838956), wk = 0.0022422 k( 106) = ( 0.0000000 1.0722608 0.9059930), wk = 0.0022422 k( 107) = ( 0.0000000 1.0722608 0.9280904), wk = 0.0022422 k( 108) = ( 0.0000000 1.0722608 0.9501878), wk = 0.0022422 k( 109) = ( 0.0000000 1.0722608 0.9722852), wk = 0.0022422 k( 110) = ( 0.0000000 1.0722608 0.9722852), wk = 0.0022422 k( 111) = ( 0.0221087 1.0722608 0.9722852), wk = 0.0022422 k( 112) = ( 0.0442175 1.0722608 0.9722852), wk = 0.0022422 k( 113) = ( 0.0663262 1.0722608 0.9722852), wk = 0.0022422 k( 114) = ( 0.0884350 1.0722608 0.9722852), wk = 0.0022422 k( 115) = ( 0.1105437 1.0722608 0.9722852), wk = 0.0022422 k( 116) = ( 0.1326524 1.0722608 0.9722852), wk = 0.0022422 k( 117) = ( 0.1547612 1.0722608 0.9722852), wk = 0.0022422 k( 118) = ( 0.1768699 1.0722608 0.9722852), wk = 0.0022422 k( 119) = ( 0.1989787 1.0722608 0.9722852), wk = 0.0022422 k( 120) = ( 0.2210874 1.0722608 0.9722852), wk = 0.0022422 k( 121) = ( 0.2431961 1.0722608 0.9722852), wk = 0.0022422 k( 122) = ( 0.2653049 1.0722608 0.9722852), wk = 0.0022422 k( 123) = ( 0.2653049 1.0722608 0.9722852), wk = 0.0022422 k( 124) = ( 0.2599988 1.0508156 0.9722852), wk = 0.0022422 k( 125) = ( 0.2546927 1.0293703 0.9722852), wk = 0.0022422 k( 126) = ( 0.2493866 1.0079252 0.9722852), wk = 0.0022422 k( 127) = ( 0.2440805 0.9864799 0.9722852), wk = 0.0022422 k( 128) = ( 0.2387744 0.9650347 0.9722852), wk = 0.0022422 k( 129) = ( 0.2334683 0.9435895 0.9722852), wk = 0.0022422 k( 130) = ( 0.2281622 0.9221443 0.9722852), wk = 0.0022422 k( 131) = ( 0.2228561 0.9006991 0.9722852), wk = 0.0022422 k( 132) = ( 0.2175500 0.8792538 0.9722852), wk = 0.0022422 k( 133) = ( 0.2122439 0.8578086 0.9722852), wk = 0.0022422 k( 134) = ( 0.2069378 0.8363634 0.9722852), wk = 0.0022422 k( 135) = ( 0.2016317 0.8149182 0.9722852), wk = 0.0022422 k( 136) = ( 0.1963256 0.7934730 0.9722852), wk = 0.0022422 k( 137) = ( 0.1910195 0.7720278 0.9722852), wk = 0.0022422 k( 138) = ( 0.1857134 0.7505826 0.9722852), wk = 0.0022422 k( 139) = ( 0.1804073 0.7291373 0.9722852), wk = 0.0022422 k( 140) = ( 0.1751012 0.7076921 0.9722852), wk = 0.0022422 k( 141) = ( 0.1697951 0.6862469 0.9722852), wk = 0.0022422 k( 142) = ( 0.1644890 0.6648017 0.9722852), wk = 0.0022422 k( 143) = ( 0.1591829 0.6433565 0.9722852), wk = 0.0022422 k( 144) = ( 0.1538768 0.6219112 0.9722852), wk = 0.0022422 k( 145) = ( 0.1485707 0.6004661 0.9722852), wk = 0.0022422 k( 146) = ( 0.1432646 0.5790208 0.9722852), wk = 0.0022422 k( 147) = ( 0.1379585 0.5575756 0.9722852), wk = 0.0022422 k( 148) = ( 0.1326524 0.5361304 0.9722852), wk = 0.0022422 k( 149) = ( 0.1273463 0.5146852 0.9722852), wk = 0.0022422 k( 150) = ( 0.1220402 0.4932400 0.9722852), wk = 0.0022422 k( 151) = ( 0.1167341 0.4717947 0.9722852), wk = 0.0022422 k( 152) = ( 0.1114280 0.4503495 0.9722852), wk = 0.0022422 k( 153) = ( 0.1061220 0.4289043 0.9722852), wk = 0.0022422 k( 154) = ( 0.1008158 0.4074591 0.9722852), wk = 0.0022422 k( 155) = ( 0.0955098 0.3860139 0.9722852), wk = 0.0022422 k( 156) = ( 0.0902037 0.3645687 0.9722852), wk = 0.0022422 k( 157) = ( 0.0848976 0.3431235 0.9722852), wk = 0.0022422 k( 158) = ( 0.0795915 0.3216782 0.9722852), wk = 0.0022422 k( 159) = ( 0.0742854 0.3002330 0.9722852), wk = 0.0022422 k( 160) = ( 0.0689793 0.2787878 0.9722852), wk = 0.0022422 k( 161) = ( 0.0636732 0.2573426 0.9722852), wk = 0.0022422 k( 162) = ( 0.0583671 0.2358974 0.9722852), wk = 0.0022422 k( 163) = ( 0.0530610 0.2144521 0.9722852), wk = 0.0022422 k( 164) = ( 0.0477549 0.1930070 0.9722852), wk = 0.0022422 k( 165) = ( 0.0424488 0.1715617 0.9722852), wk = 0.0022422 k( 166) = ( 0.0371427 0.1501165 0.9722852), wk = 0.0022422 k( 167) = ( 0.0318366 0.1286713 0.9722852), wk = 0.0022422 k( 168) = ( 0.0265305 0.1072261 0.9722852), wk = 0.0022422 k( 169) = ( 0.0212244 0.0857809 0.9722852), wk = 0.0022422 k( 170) = ( 0.0159183 0.0643356 0.9722852), wk = 0.0022422 k( 171) = ( 0.0106122 0.0428904 0.9722852), wk = 0.0022422 k( 172) = ( 0.0053061 0.0214452 0.9722852), wk = 0.0022422 k( 173) = ( 0.0000000 0.0000000 0.9722852), wk = 0.0022422 k( 174) = ( 0.0000000 0.0000000 0.9722852), wk = 0.0022422 k( 175) = ( 0.0000000 0.0000000 0.9501878), wk = 0.0022422 k( 176) = ( 0.0000000 0.0000000 0.9280904), wk = 0.0022422 k( 177) = ( 0.0000000 0.0000000 0.9059930), wk = 0.0022422 k( 178) = ( 0.0000000 0.0000000 0.8838956), wk = 0.0022422 k( 179) = ( 0.0000000 0.0000000 0.8617982), wk = 0.0022422 k( 180) = ( 0.0000000 0.0000000 0.8397008), wk = 0.0022422 k( 181) = ( 0.0000000 0.0000000 0.8176035), wk = 0.0022422 k( 182) = ( 0.0000000 0.0000000 0.7955061), wk = 0.0022422 k( 183) = ( 0.0000000 0.0000000 0.7734087), wk = 0.0022422 k( 184) = ( 0.0000000 0.0000000 0.7513113), wk = 0.0022422 k( 185) = ( 0.0000000 0.0000000 0.7292139), wk = 0.0022422 k( 186) = ( 0.0000000 0.0000000 0.7071165), wk = 0.0022422 k( 187) = ( 0.0000000 0.0000000 0.6850191), wk = 0.0022422 k( 188) = ( 0.0000000 0.0000000 0.6629217), wk = 0.0022422 k( 189) = ( 0.0000000 0.0000000 0.6408243), wk = 0.0022422 k( 190) = ( 0.0000000 0.0000000 0.6187269), wk = 0.0022422 k( 191) = ( 0.0000000 0.0000000 0.5966295), wk = 0.0022422 k( 192) = ( 0.0000000 0.0000000 0.5745322), wk = 0.0022422 k( 193) = ( 0.0000000 0.0000000 0.5524348), wk = 0.0022422 k( 194) = ( 0.0000000 0.0000000 0.5303374), wk = 0.0022422 k( 195) = ( 0.0000000 0.0000000 0.5082400), wk = 0.0022422 k( 196) = ( 0.0000000 0.0000000 0.4861426), wk = 0.0022422 k( 197) = ( 0.0000000 0.0000000 0.4640452), wk = 0.0022422 k( 198) = ( 0.0000000 0.0000000 0.4419478), wk = 0.0022422 k( 199) = ( 0.0000000 0.0000000 0.4198504), wk = 0.0022422 k( 200) = ( 0.0000000 0.0000000 0.3977530), wk = 0.0022422 k( 201) = ( 0.0000000 0.0000000 0.3756556), wk = 0.0022422 k( 202) = ( 0.0000000 0.0000000 0.3535582), wk = 0.0022422 k( 203) = ( 0.0000000 0.0000000 0.3314609), wk = 0.0022422 k( 204) = ( 0.0000000 0.0000000 0.3093635), wk = 0.0022422 k( 205) = ( 0.0000000 0.0000000 0.2872661), wk = 0.0022422 k( 206) = ( 0.0000000 0.0000000 0.2651687), wk = 0.0022422 k( 207) = ( 0.0000000 0.0000000 0.2430713), wk = 0.0022422 k( 208) = ( 0.0000000 0.0000000 0.2209739), wk = 0.0022422 k( 209) = ( 0.0000000 0.0000000 0.1988765), wk = 0.0022422 k( 210) = ( 0.0000000 0.0000000 0.1767791), wk = 0.0022422 k( 211) = ( 0.0000000 0.0000000 0.1546817), wk = 0.0022422 k( 212) = ( 0.0000000 0.0000000 0.1325843), wk = 0.0022422 k( 213) = ( 0.0000000 0.0000000 0.1104869), wk = 0.0022422 k( 214) = ( 0.0000000 0.0000000 0.0883896), wk = 0.0022422 k( 215) = ( 0.0000000 0.0000000 0.0662922), wk = 0.0022422 k( 216) = ( 0.0000000 0.0000000 0.0441948), wk = 0.0022422 k( 217) = ( 0.0000000 0.0000000 0.0220974), wk = 0.0022422 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 220) = ( -0.0217391 0.0053788 -0.0000000), wk = 0.0022422 k( 221) = ( -0.0434783 0.0107576 -0.0000000), wk = 0.0022422 k( 222) = ( -0.0652174 0.0161365 -0.0000000), wk = 0.0022422 k( 223) = ( -0.0869565 0.0215153 -0.0000000), wk = 0.0022422 k( 224) = ( -0.1086957 0.0268941 -0.0000000), wk = 0.0022422 k( 225) = ( -0.1304348 0.0322729 -0.0000000), wk = 0.0022422 k( 226) = ( -0.1521739 0.0376517 -0.0000000), wk = 0.0022422 k( 227) = ( -0.1739130 0.0430306 -0.0000000), wk = 0.0022422 k( 228) = ( -0.1956522 0.0484094 -0.0000000), wk = 0.0022422 k( 229) = ( -0.2173913 0.0537882 -0.0000000), wk = 0.0022422 k( 230) = ( -0.2391304 0.0591670 -0.0000000), wk = 0.0022422 k( 231) = ( -0.2608696 0.0645458 -0.0000000), wk = 0.0022422 k( 232) = ( -0.2826087 0.0699247 -0.0000000), wk = 0.0022422 k( 233) = ( -0.3043478 0.0753035 -0.0000000), wk = 0.0022422 k( 234) = ( -0.3260870 0.0806823 -0.0000000), wk = 0.0022422 k( 235) = ( -0.3478261 0.0860611 -0.0000000), wk = 0.0022422 k( 236) = ( -0.3695652 0.0914399 -0.0000000), wk = 0.0022422 k( 237) = ( -0.3913044 0.0968187 -0.0000000), wk = 0.0022422 k( 238) = ( -0.4130435 0.1021976 -0.0000000), wk = 0.0022422 k( 239) = ( -0.4347826 0.1075764 -0.0000000), wk = 0.0022422 k( 240) = ( -0.4565217 0.1129552 -0.0000000), wk = 0.0022422 k( 241) = ( -0.4782609 0.1183340 -0.0000000), wk = 0.0022422 k( 242) = ( -0.5000000 0.1237128 -0.0000000), wk = 0.0022422 k( 243) = ( -0.5000000 0.1237128 -0.0000000), wk = 0.0022422 k( 244) = ( -0.4946660 0.1452708 -0.0000000), wk = 0.0022422 k( 245) = ( -0.4893320 0.1668287 -0.0000000), wk = 0.0022422 k( 246) = ( -0.4839981 0.1883866 -0.0000000), wk = 0.0022422 k( 247) = ( -0.4786641 0.2099445 -0.0000000), wk = 0.0022422 k( 248) = ( -0.4733301 0.2315024 -0.0000000), wk = 0.0022422 k( 249) = ( -0.4679961 0.2530603 -0.0000000), wk = 0.0022422 k( 250) = ( -0.4626621 0.2746182 -0.0000000), wk = 0.0022422 k( 251) = ( -0.4573282 0.2961761 -0.0000000), wk = 0.0022422 k( 252) = ( -0.4519942 0.3177340 -0.0000000), wk = 0.0022422 k( 253) = ( -0.4466602 0.3392919 -0.0000000), wk = 0.0022422 k( 254) = ( -0.4413262 0.3608498 -0.0000000), wk = 0.0022422 k( 255) = ( -0.4359922 0.3824077 -0.0000000), wk = 0.0022422 k( 256) = ( -0.4306583 0.4039656 -0.0000000), wk = 0.0022422 k( 257) = ( -0.4253243 0.4255235 -0.0000000), wk = 0.0022422 k( 258) = ( -0.4199903 0.4470814 -0.0000000), wk = 0.0022422 k( 259) = ( -0.4146563 0.4686394 -0.0000000), wk = 0.0022422 k( 260) = ( -0.4093223 0.4901973 -0.0000000), wk = 0.0022422 k( 261) = ( -0.4039884 0.5117552 -0.0000000), wk = 0.0022422 k( 262) = ( -0.3986544 0.5333131 -0.0000000), wk = 0.0022422 k( 263) = ( -0.3933204 0.5548710 -0.0000000), wk = 0.0022422 k( 264) = ( -0.3879864 0.5764289 -0.0000000), wk = 0.0022422 k( 265) = ( -0.3826524 0.5979868 -0.0000000), wk = 0.0022422 k( 266) = ( -0.3773185 0.6195447 -0.0000000), wk = 0.0022422 k( 267) = ( -0.3719845 0.6411026 -0.0000000), wk = 0.0022422 k( 268) = ( -0.3666505 0.6626606 -0.0000000), wk = 0.0022422 k( 269) = ( -0.3613165 0.6842185 -0.0000000), wk = 0.0022422 k( 270) = ( -0.3559825 0.7057764 -0.0000000), wk = 0.0022422 k( 271) = ( -0.3506486 0.7273343 -0.0000000), wk = 0.0022422 k( 272) = ( -0.3453146 0.7488922 -0.0000000), wk = 0.0022422 k( 273) = ( -0.3399806 0.7704501 -0.0000000), wk = 0.0022422 k( 274) = ( -0.3346466 0.7920080 -0.0000000), wk = 0.0022422 k( 275) = ( -0.3293126 0.8135659 -0.0000000), wk = 0.0022422 k( 276) = ( -0.3239786 0.8351238 -0.0000000), wk = 0.0022422 k( 277) = ( -0.3186447 0.8566817 -0.0000000), wk = 0.0022422 k( 278) = ( -0.3133107 0.8782396 -0.0000000), wk = 0.0022422 k( 279) = ( -0.3079767 0.8997975 -0.0000000), wk = 0.0022422 k( 280) = ( -0.3026427 0.9213554 -0.0000000), wk = 0.0022422 k( 281) = ( -0.2973088 0.9429133 -0.0000000), wk = 0.0022422 k( 282) = ( -0.2919748 0.9644713 -0.0000000), wk = 0.0022422 k( 283) = ( -0.2866408 0.9860292 -0.0000000), wk = 0.0022422 k( 284) = ( -0.2813068 1.0075871 -0.0000000), wk = 0.0022422 k( 285) = ( -0.2759728 1.0291450 -0.0000000), wk = 0.0022422 k( 286) = ( -0.2706388 1.0507029 -0.0000000), wk = 0.0022422 k( 287) = ( -0.2653049 1.0722608 -0.0000000), wk = 0.0022422 k( 288) = ( -0.2653049 1.0722608 -0.0000000), wk = 0.0022422 k( 289) = ( -0.2653049 1.0722608 0.0220974), wk = 0.0022422 k( 290) = ( -0.2653049 1.0722608 0.0441948), wk = 0.0022422 k( 291) = ( -0.2653049 1.0722608 0.0662922), wk = 0.0022422 k( 292) = ( -0.2653049 1.0722608 0.0883896), wk = 0.0022422 k( 293) = ( -0.2653049 1.0722608 0.1104869), wk = 0.0022422 k( 294) = ( -0.2653049 1.0722608 0.1325843), wk = 0.0022422 k( 295) = ( -0.2653049 1.0722608 0.1546817), wk = 0.0022422 k( 296) = ( -0.2653049 1.0722608 0.1767791), wk = 0.0022422 k( 297) = ( -0.2653049 1.0722608 0.1988765), wk = 0.0022422 k( 298) = ( -0.2653049 1.0722608 0.2209739), wk = 0.0022422 k( 299) = ( -0.2653049 1.0722608 0.2430713), wk = 0.0022422 k( 300) = ( -0.2653049 1.0722608 0.2651687), wk = 0.0022422 k( 301) = ( -0.2653049 1.0722608 0.2872661), wk = 0.0022422 k( 302) = ( -0.2653049 1.0722608 0.3093635), wk = 0.0022422 k( 303) = ( -0.2653049 1.0722608 0.3314609), wk = 0.0022422 k( 304) = ( -0.2653049 1.0722608 0.3535582), wk = 0.0022422 k( 305) = ( -0.2653049 1.0722608 0.3756556), wk = 0.0022422 k( 306) = ( -0.2653049 1.0722608 0.3977530), wk = 0.0022422 k( 307) = ( -0.2653049 1.0722608 0.4198504), wk = 0.0022422 k( 308) = ( -0.2653049 1.0722608 0.4419478), wk = 0.0022422 k( 309) = ( -0.2653049 1.0722608 0.4640452), wk = 0.0022422 k( 310) = ( -0.2653049 1.0722608 0.4861426), wk = 0.0022422 k( 311) = ( -0.2653049 1.0722608 0.5082400), wk = 0.0022422 k( 312) = ( -0.2653049 1.0722608 0.5303374), wk = 0.0022422 k( 313) = ( -0.2653049 1.0722608 0.5524348), wk = 0.0022422 k( 314) = ( -0.2653049 1.0722608 0.5745322), wk = 0.0022422 k( 315) = ( -0.2653049 1.0722608 0.5966295), wk = 0.0022422 k( 316) = ( -0.2653049 1.0722608 0.6187269), wk = 0.0022422 k( 317) = ( -0.2653049 1.0722608 0.6408243), wk = 0.0022422 k( 318) = ( -0.2653049 1.0722608 0.6629217), wk = 0.0022422 k( 319) = ( -0.2653049 1.0722608 0.6850191), wk = 0.0022422 k( 320) = ( -0.2653049 1.0722608 0.7071165), wk = 0.0022422 k( 321) = ( -0.2653049 1.0722608 0.7292139), wk = 0.0022422 k( 322) = ( -0.2653049 1.0722608 0.7513113), wk = 0.0022422 k( 323) = ( -0.2653049 1.0722608 0.7734087), wk = 0.0022422 k( 324) = ( -0.2653049 1.0722608 0.7955061), wk = 0.0022422 k( 325) = ( -0.2653049 1.0722608 0.8176035), wk = 0.0022422 k( 326) = ( -0.2653049 1.0722608 0.8397008), wk = 0.0022422 k( 327) = ( -0.2653049 1.0722608 0.8617982), wk = 0.0022422 k( 328) = ( -0.2653049 1.0722608 0.8838956), wk = 0.0022422 k( 329) = ( -0.2653049 1.0722608 0.9059930), wk = 0.0022422 k( 330) = ( -0.2653049 1.0722608 0.9280904), wk = 0.0022422 k( 331) = ( -0.2653049 1.0722608 0.9501878), wk = 0.0022422 k( 332) = ( -0.2653049 1.0722608 0.9722852), wk = 0.0022422 k( 333) = ( -0.2653049 1.0722608 0.9722852), wk = 0.0022422 k( 334) = ( -0.2706388 1.0507029 0.9722852), wk = 0.0022422 k( 335) = ( -0.2759728 1.0291450 0.9722852), wk = 0.0022422 k( 336) = ( -0.2813068 1.0075871 0.9722852), wk = 0.0022422 k( 337) = ( -0.2866408 0.9860292 0.9722852), wk = 0.0022422 k( 338) = ( -0.2919748 0.9644713 0.9722852), wk = 0.0022422 k( 339) = ( -0.2973088 0.9429133 0.9722852), wk = 0.0022422 k( 340) = ( -0.3026427 0.9213554 0.9722852), wk = 0.0022422 k( 341) = ( -0.3079767 0.8997975 0.9722852), wk = 0.0022422 k( 342) = ( -0.3133107 0.8782396 0.9722852), wk = 0.0022422 k( 343) = ( -0.3186447 0.8566817 0.9722852), wk = 0.0022422 k( 344) = ( -0.3239786 0.8351238 0.9722852), wk = 0.0022422 k( 345) = ( -0.3293126 0.8135659 0.9722852), wk = 0.0022422 k( 346) = ( -0.3346466 0.7920080 0.9722852), wk = 0.0022422 k( 347) = ( -0.3399806 0.7704501 0.9722852), wk = 0.0022422 k( 348) = ( -0.3453146 0.7488922 0.9722852), wk = 0.0022422 k( 349) = ( -0.3506486 0.7273343 0.9722852), wk = 0.0022422 k( 350) = ( -0.3559825 0.7057764 0.9722852), wk = 0.0022422 k( 351) = ( -0.3613165 0.6842185 0.9722852), wk = 0.0022422 k( 352) = ( -0.3666505 0.6626606 0.9722852), wk = 0.0022422 k( 353) = ( -0.3719845 0.6411026 0.9722852), wk = 0.0022422 k( 354) = ( -0.3773185 0.6195447 0.9722852), wk = 0.0022422 k( 355) = ( -0.3826524 0.5979868 0.9722852), wk = 0.0022422 k( 356) = ( -0.3879864 0.5764289 0.9722852), wk = 0.0022422 k( 357) = ( -0.3933204 0.5548710 0.9722852), wk = 0.0022422 k( 358) = ( -0.3986544 0.5333131 0.9722852), wk = 0.0022422 k( 359) = ( -0.4039884 0.5117552 0.9722852), wk = 0.0022422 k( 360) = ( -0.4093223 0.4901973 0.9722852), wk = 0.0022422 k( 361) = ( -0.4146563 0.4686394 0.9722852), wk = 0.0022422 k( 362) = ( -0.4199903 0.4470814 0.9722852), wk = 0.0022422 k( 363) = ( -0.4253243 0.4255235 0.9722852), wk = 0.0022422 k( 364) = ( -0.4306583 0.4039656 0.9722852), wk = 0.0022422 k( 365) = ( -0.4359922 0.3824077 0.9722852), wk = 0.0022422 k( 366) = ( -0.4413262 0.3608498 0.9722852), wk = 0.0022422 k( 367) = ( -0.4466602 0.3392919 0.9722852), wk = 0.0022422 k( 368) = ( -0.4519942 0.3177340 0.9722852), wk = 0.0022422 k( 369) = ( -0.4573282 0.2961761 0.9722852), wk = 0.0022422 k( 370) = ( -0.4626621 0.2746182 0.9722852), wk = 0.0022422 k( 371) = ( -0.4679961 0.2530603 0.9722852), wk = 0.0022422 k( 372) = ( -0.4733301 0.2315024 0.9722852), wk = 0.0022422 k( 373) = ( -0.4786641 0.2099445 0.9722852), wk = 0.0022422 k( 374) = ( -0.4839981 0.1883866 0.9722852), wk = 0.0022422 k( 375) = ( -0.4893320 0.1668287 0.9722852), wk = 0.0022422 k( 376) = ( -0.4946660 0.1452708 0.9722852), wk = 0.0022422 k( 377) = ( -0.5000000 0.1237128 0.9722852), wk = 0.0022422 k( 378) = ( -0.5000000 0.1237128 0.9722852), wk = 0.0022422 k( 379) = ( -0.5000000 0.1237128 0.9501878), wk = 0.0022422 k( 380) = ( -0.5000000 0.1237128 0.9280904), wk = 0.0022422 k( 381) = ( -0.5000000 0.1237128 0.9059930), wk = 0.0022422 k( 382) = ( -0.5000000 0.1237128 0.8838956), wk = 0.0022422 k( 383) = ( -0.5000000 0.1237128 0.8617982), wk = 0.0022422 k( 384) = ( -0.5000000 0.1237128 0.8397008), wk = 0.0022422 k( 385) = ( -0.5000000 0.1237128 0.8176035), wk = 0.0022422 k( 386) = ( -0.5000000 0.1237128 0.7955061), wk = 0.0022422 k( 387) = ( -0.5000000 0.1237128 0.7734087), wk = 0.0022422 k( 388) = ( -0.5000000 0.1237128 0.7513113), wk = 0.0022422 k( 389) = ( -0.5000000 0.1237128 0.7292139), wk = 0.0022422 k( 390) = ( -0.5000000 0.1237128 0.7071165), wk = 0.0022422 k( 391) = ( -0.5000000 0.1237128 0.6850191), wk = 0.0022422 k( 392) = ( -0.5000000 0.1237128 0.6629217), wk = 0.0022422 k( 393) = ( -0.5000000 0.1237128 0.6408243), wk = 0.0022422 k( 394) = ( -0.5000000 0.1237128 0.6187269), wk = 0.0022422 k( 395) = ( -0.5000000 0.1237128 0.5966295), wk = 0.0022422 k( 396) = ( -0.5000000 0.1237128 0.5745322), wk = 0.0022422 k( 397) = ( -0.5000000 0.1237128 0.5524348), wk = 0.0022422 k( 398) = ( -0.5000000 0.1237128 0.5303374), wk = 0.0022422 k( 399) = ( -0.5000000 0.1237128 0.5082400), wk = 0.0022422 k( 400) = ( -0.5000000 0.1237128 0.4861426), wk = 0.0022422 k( 401) = ( -0.5000000 0.1237128 0.4640452), wk = 0.0022422 k( 402) = ( -0.5000000 0.1237128 0.4419478), wk = 0.0022422 k( 403) = ( -0.5000000 0.1237128 0.4198504), wk = 0.0022422 k( 404) = ( -0.5000000 0.1237128 0.3977530), wk = 0.0022422 k( 405) = ( -0.5000000 0.1237128 0.3756556), wk = 0.0022422 k( 406) = ( -0.5000000 0.1237128 0.3535582), wk = 0.0022422 k( 407) = ( -0.5000000 0.1237128 0.3314609), wk = 0.0022422 k( 408) = ( -0.5000000 0.1237128 0.3093635), wk = 0.0022422 k( 409) = ( -0.5000000 0.1237128 0.2872661), wk = 0.0022422 k( 410) = ( -0.5000000 0.1237128 0.2651687), wk = 0.0022422 k( 411) = ( -0.5000000 0.1237128 0.2430713), wk = 0.0022422 k( 412) = ( -0.5000000 0.1237128 0.2209739), wk = 0.0022422 k( 413) = ( -0.5000000 0.1237128 0.1988765), wk = 0.0022422 k( 414) = ( -0.5000000 0.1237128 0.1767791), wk = 0.0022422 k( 415) = ( -0.5000000 0.1237128 0.1546817), wk = 0.0022422 k( 416) = ( -0.5000000 0.1237128 0.1325843), wk = 0.0022422 k( 417) = ( -0.5000000 0.1237128 0.1104869), wk = 0.0022422 k( 418) = ( -0.5000000 0.1237128 0.0883896), wk = 0.0022422 k( 419) = ( -0.5000000 0.1237128 0.0662922), wk = 0.0022422 k( 420) = ( -0.5000000 0.1237128 0.0441948), wk = 0.0022422 k( 421) = ( -0.5000000 0.1237128 0.0220974), wk = 0.0022422 k( 422) = ( -0.5000000 0.1237128 -0.0000000), wk = 0.0022422 k( 423) = ( 0.0000000 0.0000000 0.9722852), wk = 0.0022422 k( 424) = ( -0.0217391 0.0053788 0.9722852), wk = 0.0022422 k( 425) = ( -0.0434783 0.0107576 0.9722852), wk = 0.0022422 k( 426) = ( -0.0652174 0.0161365 0.9722852), wk = 0.0022422 k( 427) = ( -0.0869565 0.0215153 0.9722852), wk = 0.0022422 k( 428) = ( -0.1086957 0.0268941 0.9722852), wk = 0.0022422 k( 429) = ( -0.1304348 0.0322729 0.9722852), wk = 0.0022422 k( 430) = ( -0.1521739 0.0376517 0.9722852), wk = 0.0022422 k( 431) = ( -0.1739130 0.0430306 0.9722852), wk = 0.0022422 k( 432) = ( -0.1956522 0.0484094 0.9722852), wk = 0.0022422 k( 433) = ( -0.2173913 0.0537882 0.9722852), wk = 0.0022422 k( 434) = ( -0.2391304 0.0591670 0.9722852), wk = 0.0022422 k( 435) = ( -0.2608696 0.0645458 0.9722852), wk = 0.0022422 k( 436) = ( -0.2826087 0.0699247 0.9722852), wk = 0.0022422 k( 437) = ( -0.3043478 0.0753035 0.9722852), wk = 0.0022422 k( 438) = ( -0.3260870 0.0806823 0.9722852), wk = 0.0022422 k( 439) = ( -0.3478261 0.0860611 0.9722852), wk = 0.0022422 k( 440) = ( -0.3695652 0.0914399 0.9722852), wk = 0.0022422 k( 441) = ( -0.3913044 0.0968187 0.9722852), wk = 0.0022422 k( 442) = ( -0.4130435 0.1021976 0.9722852), wk = 0.0022422 k( 443) = ( -0.4347826 0.1075764 0.9722852), wk = 0.0022422 k( 444) = ( -0.4565217 0.1129552 0.9722852), wk = 0.0022422 k( 445) = ( -0.4782609 0.1183340 0.9722852), wk = 0.0022422 k( 446) = ( -0.5000000 0.1237128 0.9722852), wk = 0.0022422 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 2) = ( 0.0053061 0.0053061 -0.0000000), wk = 0.0022422 k( 3) = ( 0.0106122 0.0106122 -0.0000000), wk = 0.0022422 k( 4) = ( 0.0159183 0.0159183 0.0000000), wk = 0.0022422 k( 5) = ( 0.0212244 0.0212244 -0.0000000), wk = 0.0022422 k( 6) = ( 0.0265305 0.0265305 0.0000000), wk = 0.0022422 k( 7) = ( 0.0318366 0.0318366 0.0000000), wk = 0.0022422 k( 8) = ( 0.0371427 0.0371427 0.0000000), wk = 0.0022422 k( 9) = ( 0.0424488 0.0424488 -0.0000000), wk = 0.0022422 k( 10) = ( 0.0477549 0.0477549 -0.0000000), wk = 0.0022422 k( 11) = ( 0.0530610 0.0530610 -0.0000000), wk = 0.0022422 k( 12) = ( 0.0583671 0.0583671 -0.0000000), wk = 0.0022422 k( 13) = ( 0.0636732 0.0636732 -0.0000000), wk = 0.0022422 k( 14) = ( 0.0689793 0.0689793 -0.0000000), wk = 0.0022422 k( 15) = ( 0.0742854 0.0742854 0.0000000), wk = 0.0022422 k( 16) = ( 0.0795915 0.0795915 -0.0000000), wk = 0.0022422 k( 17) = ( 0.0848976 0.0848976 -0.0000000), wk = 0.0022422 k( 18) = ( 0.0902037 0.0902037 -0.0000000), wk = 0.0022422 k( 19) = ( 0.0955098 0.0955097 0.0000000), wk = 0.0022422 k( 20) = ( 0.1008158 0.1008158 -0.0000000), wk = 0.0022422 k( 21) = ( 0.1061220 0.1061219 -0.0000000), wk = 0.0022422 k( 22) = ( 0.1114280 0.1114280 -0.0000000), wk = 0.0022422 k( 23) = ( 0.1167341 0.1167341 -0.0000000), wk = 0.0022422 k( 24) = ( 0.1220402 0.1220402 0.0000000), wk = 0.0022422 k( 25) = ( 0.1273463 0.1273463 -0.0000000), wk = 0.0022422 k( 26) = ( 0.1326524 0.1326524 -0.0000000), wk = 0.0022422 k( 27) = ( 0.1379585 0.1379585 -0.0000000), wk = 0.0022422 k( 28) = ( 0.1432646 0.1432646 -0.0000000), wk = 0.0022422 k( 29) = ( 0.1485707 0.1485707 -0.0000000), wk = 0.0022422 k( 30) = ( 0.1538768 0.1538768 0.0000000), wk = 0.0022422 k( 31) = ( 0.1591829 0.1591829 -0.0000000), wk = 0.0022422 k( 32) = ( 0.1644890 0.1644890 -0.0000000), wk = 0.0022422 k( 33) = ( 0.1697951 0.1697951 -0.0000000), wk = 0.0022422 k( 34) = ( 0.1751012 0.1751012 0.0000000), wk = 0.0022422 k( 35) = ( 0.1804073 0.1804073 -0.0000000), wk = 0.0022422 k( 36) = ( 0.1857134 0.1857134 0.0000000), wk = 0.0022422 k( 37) = ( 0.1910195 0.1910195 -0.0000000), wk = 0.0022422 k( 38) = ( 0.1963256 0.1963256 -0.0000000), wk = 0.0022422 k( 39) = ( 0.2016317 0.2016317 -0.0000000), wk = 0.0022422 k( 40) = ( 0.2069378 0.2069378 0.0000000), wk = 0.0022422 k( 41) = ( 0.2122439 0.2122439 -0.0000000), wk = 0.0022422 k( 42) = ( 0.2175500 0.2175500 -0.0000000), wk = 0.0022422 k( 43) = ( 0.2228561 0.2228561 0.0000000), wk = 0.0022422 k( 44) = ( 0.2281622 0.2281622 0.0000000), wk = 0.0022422 k( 45) = ( 0.2334683 0.2334683 -0.0000000), wk = 0.0022422 k( 46) = ( 0.2387744 0.2387744 -0.0000000), wk = 0.0022422 k( 47) = ( 0.2440805 0.2440805 0.0000000), wk = 0.0022422 k( 48) = ( 0.2493866 0.2493866 -0.0000000), wk = 0.0022422 k( 49) = ( 0.2546927 0.2546927 0.0000000), wk = 0.0022422 k( 50) = ( 0.2599988 0.2599988 0.0000000), wk = 0.0022422 k( 51) = ( 0.2653049 0.2653049 0.0000000), wk = 0.0022422 k( 52) = ( 0.2653049 0.2653049 0.0000000), wk = 0.0022422 k( 53) = ( 0.2431961 0.2848628 0.0000000), wk = 0.0022422 k( 54) = ( 0.2210874 0.3044207 0.0000000), wk = 0.0022422 k( 55) = ( 0.1989787 0.3239786 0.0000000), wk = 0.0022422 k( 56) = ( 0.1768699 0.3435366 -0.0000000), wk = 0.0022422 k( 57) = ( 0.1547612 0.3630945 -0.0000000), wk = 0.0022422 k( 58) = ( 0.1326524 0.3826524 0.0000000), wk = 0.0022422 k( 59) = ( 0.1105437 0.4022104 0.0000000), wk = 0.0022422 k( 60) = ( 0.0884350 0.4217683 -0.0000000), wk = 0.0022422 k( 61) = ( 0.0663262 0.4413262 0.0000000), wk = 0.0022422 k( 62) = ( 0.0442175 0.4608841 0.0000000), wk = 0.0022422 k( 63) = ( 0.0221087 0.4804421 0.0000000), wk = 0.0022422 k( 64) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022422 k( 65) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0022422 k( 66) = ( 0.0000000 0.5000000 0.0113636), wk = 0.0022422 k( 67) = ( 0.0000000 0.5000000 0.0227273), wk = 0.0022422 k( 68) = ( 0.0000000 0.5000000 0.0340909), wk = 0.0022422 k( 69) = ( 0.0000000 0.5000000 0.0454546), wk = 0.0022422 k( 70) = ( 0.0000000 0.5000000 0.0568182), wk = 0.0022422 k( 71) = ( 0.0000000 0.5000000 0.0681818), wk = 0.0022422 k( 72) = ( 0.0000000 0.5000000 0.0795455), wk = 0.0022422 k( 73) = ( 0.0000000 0.5000000 0.0909091), wk = 0.0022422 k( 74) = ( 0.0000000 0.5000000 0.1022727), wk = 0.0022422 k( 75) = ( 0.0000000 0.5000000 0.1136364), wk = 0.0022422 k( 76) = ( 0.0000000 0.5000000 0.1250000), wk = 0.0022422 k( 77) = ( 0.0000000 0.5000000 0.1363636), wk = 0.0022422 k( 78) = ( 0.0000000 0.5000000 0.1477273), wk = 0.0022422 k( 79) = ( 0.0000000 0.5000000 0.1590909), wk = 0.0022422 k( 80) = ( 0.0000000 0.5000000 0.1704546), wk = 0.0022422 k( 81) = ( 0.0000000 0.5000000 0.1818182), wk = 0.0022422 k( 82) = ( 0.0000000 0.5000000 0.1931818), wk = 0.0022422 k( 83) = ( 0.0000000 0.5000000 0.2045454), wk = 0.0022422 k( 84) = ( 0.0000000 0.5000000 0.2159091), wk = 0.0022422 k( 85) = ( 0.0000000 0.5000000 0.2272727), wk = 0.0022422 k( 86) = ( 0.0000000 0.5000000 0.2386364), wk = 0.0022422 k( 87) = ( 0.0000000 0.5000000 0.2500000), wk = 0.0022422 k( 88) = ( 0.0000000 0.5000000 0.2613636), wk = 0.0022422 k( 89) = ( 0.0000000 0.5000000 0.2727273), wk = 0.0022422 k( 90) = ( 0.0000000 0.5000000 0.2840909), wk = 0.0022422 k( 91) = ( 0.0000000 0.5000000 0.2954545), wk = 0.0022422 k( 92) = ( 0.0000000 0.5000000 0.3068182), wk = 0.0022422 k( 93) = ( 0.0000000 0.5000000 0.3181818), wk = 0.0022422 k( 94) = ( 0.0000000 0.5000000 0.3295455), wk = 0.0022422 k( 95) = ( 0.0000000 0.5000000 0.3409091), wk = 0.0022422 k( 96) = ( 0.0000000 0.5000000 0.3522727), wk = 0.0022422 k( 97) = ( 0.0000000 0.5000000 0.3636364), wk = 0.0022422 k( 98) = ( 0.0000000 0.5000000 0.3750000), wk = 0.0022422 k( 99) = ( 0.0000000 0.5000000 0.3863636), wk = 0.0022422 k( 100) = ( 0.0000000 0.5000000 0.3977273), wk = 0.0022422 k( 101) = ( 0.0000000 0.5000000 0.4090909), wk = 0.0022422 k( 102) = ( 0.0000000 0.5000000 0.4204545), wk = 0.0022422 k( 103) = ( 0.0000000 0.5000000 0.4318182), wk = 0.0022422 k( 104) = ( 0.0000000 0.5000000 0.4431818), wk = 0.0022422 k( 105) = ( 0.0000000 0.5000000 0.4545455), wk = 0.0022422 k( 106) = ( 0.0000000 0.5000000 0.4659091), wk = 0.0022422 k( 107) = ( 0.0000000 0.5000000 0.4772727), wk = 0.0022422 k( 108) = ( 0.0000000 0.5000000 0.4886364), wk = 0.0022422 k( 109) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022422 k( 110) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0022422 k( 111) = ( 0.0221087 0.4804421 0.5000000), wk = 0.0022422 k( 112) = ( 0.0442175 0.4608841 0.5000000), wk = 0.0022422 k( 113) = ( 0.0663262 0.4413262 0.5000000), wk = 0.0022422 k( 114) = ( 0.0884350 0.4217683 0.5000000), wk = 0.0022422 k( 115) = ( 0.1105437 0.4022104 0.5000000), wk = 0.0022422 k( 116) = ( 0.1326524 0.3826524 0.5000000), wk = 0.0022422 k( 117) = ( 0.1547612 0.3630945 0.5000000), wk = 0.0022422 k( 118) = ( 0.1768699 0.3435366 0.5000000), wk = 0.0022422 k( 119) = ( 0.1989787 0.3239786 0.5000000), wk = 0.0022422 k( 120) = ( 0.2210874 0.3044207 0.5000000), wk = 0.0022422 k( 121) = ( 0.2431961 0.2848628 0.5000000), wk = 0.0022422 k( 122) = ( 0.2653049 0.2653049 0.5000000), wk = 0.0022422 k( 123) = ( 0.2653049 0.2653049 0.5000000), wk = 0.0022422 k( 124) = ( 0.2599988 0.2599988 0.5000000), wk = 0.0022422 k( 125) = ( 0.2546927 0.2546927 0.5000000), wk = 0.0022422 k( 126) = ( 0.2493866 0.2493866 0.5000000), wk = 0.0022422 k( 127) = ( 0.2440805 0.2440805 0.5000000), wk = 0.0022422 k( 128) = ( 0.2387744 0.2387744 0.5000000), wk = 0.0022422 k( 129) = ( 0.2334683 0.2334683 0.5000000), wk = 0.0022422 k( 130) = ( 0.2281622 0.2281622 0.5000000), wk = 0.0022422 k( 131) = ( 0.2228561 0.2228561 0.5000000), wk = 0.0022422 k( 132) = ( 0.2175500 0.2175500 0.5000000), wk = 0.0022422 k( 133) = ( 0.2122439 0.2122439 0.5000000), wk = 0.0022422 k( 134) = ( 0.2069378 0.2069378 0.5000000), wk = 0.0022422 k( 135) = ( 0.2016317 0.2016317 0.5000000), wk = 0.0022422 k( 136) = ( 0.1963256 0.1963256 0.5000000), wk = 0.0022422 k( 137) = ( 0.1910195 0.1910195 0.5000000), wk = 0.0022422 k( 138) = ( 0.1857134 0.1857134 0.5000000), wk = 0.0022422 k( 139) = ( 0.1804073 0.1804073 0.5000000), wk = 0.0022422 k( 140) = ( 0.1751012 0.1751012 0.5000000), wk = 0.0022422 k( 141) = ( 0.1697951 0.1697951 0.5000000), wk = 0.0022422 k( 142) = ( 0.1644890 0.1644890 0.5000000), wk = 0.0022422 k( 143) = ( 0.1591829 0.1591829 0.5000000), wk = 0.0022422 k( 144) = ( 0.1538768 0.1538768 0.5000000), wk = 0.0022422 k( 145) = ( 0.1485707 0.1485707 0.5000000), wk = 0.0022422 k( 146) = ( 0.1432646 0.1432646 0.5000000), wk = 0.0022422 k( 147) = ( 0.1379585 0.1379585 0.5000000), wk = 0.0022422 k( 148) = ( 0.1326524 0.1326524 0.5000000), wk = 0.0022422 k( 149) = ( 0.1273463 0.1273463 0.5000000), wk = 0.0022422 k( 150) = ( 0.1220402 0.1220402 0.5000000), wk = 0.0022422 k( 151) = ( 0.1167341 0.1167341 0.5000000), wk = 0.0022422 k( 152) = ( 0.1114280 0.1114280 0.5000000), wk = 0.0022422 k( 153) = ( 0.1061220 0.1061219 0.5000000), wk = 0.0022422 k( 154) = ( 0.1008158 0.1008158 0.5000000), wk = 0.0022422 k( 155) = ( 0.0955098 0.0955097 0.5000000), wk = 0.0022422 k( 156) = ( 0.0902037 0.0902037 0.5000000), wk = 0.0022422 k( 157) = ( 0.0848976 0.0848976 0.5000000), wk = 0.0022422 k( 158) = ( 0.0795915 0.0795915 0.5000000), wk = 0.0022422 k( 159) = ( 0.0742854 0.0742854 0.5000000), wk = 0.0022422 k( 160) = ( 0.0689793 0.0689793 0.5000000), wk = 0.0022422 k( 161) = ( 0.0636732 0.0636732 0.5000000), wk = 0.0022422 k( 162) = ( 0.0583671 0.0583671 0.5000000), wk = 0.0022422 k( 163) = ( 0.0530610 0.0530610 0.5000000), wk = 0.0022422 k( 164) = ( 0.0477549 0.0477549 0.5000000), wk = 0.0022422 k( 165) = ( 0.0424488 0.0424488 0.5000000), wk = 0.0022422 k( 166) = ( 0.0371427 0.0371427 0.5000000), wk = 0.0022422 k( 167) = ( 0.0318366 0.0318366 0.5000000), wk = 0.0022422 k( 168) = ( 0.0265305 0.0265305 0.5000000), wk = 0.0022422 k( 169) = ( 0.0212244 0.0212244 0.5000000), wk = 0.0022422 k( 170) = ( 0.0159183 0.0159183 0.5000000), wk = 0.0022422 k( 171) = ( 0.0106122 0.0106122 0.5000000), wk = 0.0022422 k( 172) = ( 0.0053061 0.0053061 0.5000000), wk = 0.0022422 k( 173) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 174) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 175) = ( 0.0000000 0.0000000 0.4886364), wk = 0.0022422 k( 176) = ( 0.0000000 0.0000000 0.4772727), wk = 0.0022422 k( 177) = ( 0.0000000 0.0000000 0.4659091), wk = 0.0022422 k( 178) = ( 0.0000000 0.0000000 0.4545455), wk = 0.0022422 k( 179) = ( 0.0000000 0.0000000 0.4431818), wk = 0.0022422 k( 180) = ( 0.0000000 0.0000000 0.4318182), wk = 0.0022422 k( 181) = ( 0.0000000 0.0000000 0.4204545), wk = 0.0022422 k( 182) = ( 0.0000000 0.0000000 0.4090909), wk = 0.0022422 k( 183) = ( 0.0000000 0.0000000 0.3977273), wk = 0.0022422 k( 184) = ( 0.0000000 0.0000000 0.3863636), wk = 0.0022422 k( 185) = ( 0.0000000 0.0000000 0.3750000), wk = 0.0022422 k( 186) = ( 0.0000000 0.0000000 0.3636364), wk = 0.0022422 k( 187) = ( 0.0000000 0.0000000 0.3522727), wk = 0.0022422 k( 188) = ( 0.0000000 0.0000000 0.3409091), wk = 0.0022422 k( 189) = ( 0.0000000 0.0000000 0.3295455), wk = 0.0022422 k( 190) = ( 0.0000000 0.0000000 0.3181818), wk = 0.0022422 k( 191) = ( 0.0000000 0.0000000 0.3068182), wk = 0.0022422 k( 192) = ( 0.0000000 0.0000000 0.2954545), wk = 0.0022422 k( 193) = ( 0.0000000 0.0000000 0.2840909), wk = 0.0022422 k( 194) = ( 0.0000000 0.0000000 0.2727273), wk = 0.0022422 k( 195) = ( 0.0000000 0.0000000 0.2613636), wk = 0.0022422 k( 196) = ( 0.0000000 0.0000000 0.2500000), wk = 0.0022422 k( 197) = ( 0.0000000 0.0000000 0.2386364), wk = 0.0022422 k( 198) = ( 0.0000000 0.0000000 0.2272727), wk = 0.0022422 k( 199) = ( 0.0000000 0.0000000 0.2159091), wk = 0.0022422 k( 200) = ( 0.0000000 0.0000000 0.2045454), wk = 0.0022422 k( 201) = ( 0.0000000 0.0000000 0.1931818), wk = 0.0022422 k( 202) = ( 0.0000000 0.0000000 0.1818182), wk = 0.0022422 k( 203) = ( 0.0000000 0.0000000 0.1704546), wk = 0.0022422 k( 204) = ( 0.0000000 0.0000000 0.1590909), wk = 0.0022422 k( 205) = ( 0.0000000 0.0000000 0.1477273), wk = 0.0022422 k( 206) = ( 0.0000000 0.0000000 0.1363636), wk = 0.0022422 k( 207) = ( 0.0000000 0.0000000 0.1250000), wk = 0.0022422 k( 208) = ( 0.0000000 0.0000000 0.1136364), wk = 0.0022422 k( 209) = ( 0.0000000 0.0000000 0.1022727), wk = 0.0022422 k( 210) = ( 0.0000000 0.0000000 0.0909091), wk = 0.0022422 k( 211) = ( 0.0000000 0.0000000 0.0795455), wk = 0.0022422 k( 212) = ( 0.0000000 0.0000000 0.0681818), wk = 0.0022422 k( 213) = ( 0.0000000 0.0000000 0.0568182), wk = 0.0022422 k( 214) = ( 0.0000000 0.0000000 0.0454546), wk = 0.0022422 k( 215) = ( 0.0000000 0.0000000 0.0340909), wk = 0.0022422 k( 216) = ( 0.0000000 0.0000000 0.0227273), wk = 0.0022422 k( 217) = ( 0.0000000 0.0000000 0.0113636), wk = 0.0022422 k( 218) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 219) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0022422 k( 220) = ( -0.0217391 0.0217391 -0.0000000), wk = 0.0022422 k( 221) = ( -0.0434783 0.0434783 -0.0000000), wk = 0.0022422 k( 222) = ( -0.0652174 0.0652174 0.0000000), wk = 0.0022422 k( 223) = ( -0.0869565 0.0869565 -0.0000000), wk = 0.0022422 k( 224) = ( -0.1086957 0.1086957 0.0000000), wk = 0.0022422 k( 225) = ( -0.1304348 0.1304348 0.0000000), wk = 0.0022422 k( 226) = ( -0.1521739 0.1521739 0.0000000), wk = 0.0022422 k( 227) = ( -0.1739130 0.1739130 -0.0000000), wk = 0.0022422 k( 228) = ( -0.1956522 0.1956522 -0.0000000), wk = 0.0022422 k( 229) = ( -0.2173913 0.2173913 0.0000000), wk = 0.0022422 k( 230) = ( -0.2391304 0.2391304 -0.0000000), wk = 0.0022422 k( 231) = ( -0.2608696 0.2608696 0.0000000), wk = 0.0022422 k( 232) = ( -0.2826087 0.2826087 0.0000000), wk = 0.0022422 k( 233) = ( -0.3043478 0.3043478 0.0000000), wk = 0.0022422 k( 234) = ( -0.3260870 0.3260870 0.0000000), wk = 0.0022422 k( 235) = ( -0.3478261 0.3478261 0.0000000), wk = 0.0022422 k( 236) = ( -0.3695652 0.3695652 0.0000000), wk = 0.0022422 k( 237) = ( -0.3913044 0.3913044 -0.0000000), wk = 0.0022422 k( 238) = ( -0.4130435 0.4130435 -0.0000000), wk = 0.0022422 k( 239) = ( -0.4347826 0.4347826 0.0000000), wk = 0.0022422 k( 240) = ( -0.4565217 0.4565217 0.0000000), wk = 0.0022422 k( 241) = ( -0.4782609 0.4782609 -0.0000000), wk = 0.0022422 k( 242) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 243) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 244) = ( -0.4946660 0.5053340 -0.0000000), wk = 0.0022422 k( 245) = ( -0.4893320 0.5106680 -0.0000000), wk = 0.0022422 k( 246) = ( -0.4839981 0.5160019 0.0000000), wk = 0.0022422 k( 247) = ( -0.4786641 0.5213359 -0.0000000), wk = 0.0022422 k( 248) = ( -0.4733301 0.5266699 0.0000000), wk = 0.0022422 k( 249) = ( -0.4679961 0.5320039 0.0000000), wk = 0.0022422 k( 250) = ( -0.4626621 0.5373379 0.0000000), wk = 0.0022422 k( 251) = ( -0.4573282 0.5426718 0.0000000), wk = 0.0022422 k( 252) = ( -0.4519942 0.5480058 0.0000000), wk = 0.0022422 k( 253) = ( -0.4466602 0.5533398 -0.0000000), wk = 0.0022422 k( 254) = ( -0.4413262 0.5586738 0.0000000), wk = 0.0022422 k( 255) = ( -0.4359922 0.5640078 -0.0000000), wk = 0.0022422 k( 256) = ( -0.4306583 0.5693417 0.0000000), wk = 0.0022422 k( 257) = ( -0.4253243 0.5746757 0.0000000), wk = 0.0022422 k( 258) = ( -0.4199903 0.5800097 0.0000000), wk = 0.0022422 k( 259) = ( -0.4146563 0.5853437 -0.0000000), wk = 0.0022422 k( 260) = ( -0.4093223 0.5906777 0.0000000), wk = 0.0022422 k( 261) = ( -0.4039884 0.5960116 0.0000000), wk = 0.0022422 k( 262) = ( -0.3986544 0.6013456 0.0000000), wk = 0.0022422 k( 263) = ( -0.3933204 0.6066796 0.0000000), wk = 0.0022422 k( 264) = ( -0.3879864 0.6120136 0.0000000), wk = 0.0022422 k( 265) = ( -0.3826524 0.6173476 0.0000000), wk = 0.0022422 k( 266) = ( -0.3773185 0.6226816 -0.0000000), wk = 0.0022422 k( 267) = ( -0.3719845 0.6280155 0.0000000), wk = 0.0022422 k( 268) = ( -0.3666505 0.6333495 -0.0000000), wk = 0.0022422 k( 269) = ( -0.3613165 0.6386835 0.0000000), wk = 0.0022422 k( 270) = ( -0.3559825 0.6440175 0.0000000), wk = 0.0022422 k( 271) = ( -0.3506486 0.6493515 -0.0000000), wk = 0.0022422 k( 272) = ( -0.3453146 0.6546854 -0.0000000), wk = 0.0022422 k( 273) = ( -0.3399806 0.6600194 0.0000000), wk = 0.0022422 k( 274) = ( -0.3346466 0.6653534 -0.0000000), wk = 0.0022422 k( 275) = ( -0.3293126 0.6706874 0.0000000), wk = 0.0022422 k( 276) = ( -0.3239786 0.6760213 0.0000000), wk = 0.0022422 k( 277) = ( -0.3186447 0.6813553 -0.0000000), wk = 0.0022422 k( 278) = ( -0.3133107 0.6866893 -0.0000000), wk = 0.0022422 k( 279) = ( -0.3079767 0.6920233 0.0000000), wk = 0.0022422 k( 280) = ( -0.3026427 0.6973573 -0.0000000), wk = 0.0022422 k( 281) = ( -0.2973088 0.7026913 0.0000000), wk = 0.0022422 k( 282) = ( -0.2919748 0.7080252 0.0000000), wk = 0.0022422 k( 283) = ( -0.2866408 0.7133592 -0.0000000), wk = 0.0022422 k( 284) = ( -0.2813068 0.7186932 -0.0000000), wk = 0.0022422 k( 285) = ( -0.2759728 0.7240272 -0.0000000), wk = 0.0022422 k( 286) = ( -0.2706388 0.7293612 -0.0000000), wk = 0.0022422 k( 287) = ( -0.2653049 0.7346951 0.0000000), wk = 0.0022422 k( 288) = ( -0.2653049 0.7346951 0.0000000), wk = 0.0022422 k( 289) = ( -0.2653049 0.7346951 0.0113636), wk = 0.0022422 k( 290) = ( -0.2653049 0.7346951 0.0227273), wk = 0.0022422 k( 291) = ( -0.2653049 0.7346951 0.0340909), wk = 0.0022422 k( 292) = ( -0.2653049 0.7346951 0.0454546), wk = 0.0022422 k( 293) = ( -0.2653049 0.7346951 0.0568182), wk = 0.0022422 k( 294) = ( -0.2653049 0.7346951 0.0681818), wk = 0.0022422 k( 295) = ( -0.2653049 0.7346951 0.0795455), wk = 0.0022422 k( 296) = ( -0.2653049 0.7346951 0.0909091), wk = 0.0022422 k( 297) = ( -0.2653049 0.7346951 0.1022727), wk = 0.0022422 k( 298) = ( -0.2653049 0.7346951 0.1136364), wk = 0.0022422 k( 299) = ( -0.2653049 0.7346951 0.1250000), wk = 0.0022422 k( 300) = ( -0.2653049 0.7346951 0.1363636), wk = 0.0022422 k( 301) = ( -0.2653049 0.7346951 0.1477273), wk = 0.0022422 k( 302) = ( -0.2653049 0.7346951 0.1590909), wk = 0.0022422 k( 303) = ( -0.2653049 0.7346951 0.1704546), wk = 0.0022422 k( 304) = ( -0.2653049 0.7346951 0.1818182), wk = 0.0022422 k( 305) = ( -0.2653049 0.7346951 0.1931818), wk = 0.0022422 k( 306) = ( -0.2653049 0.7346951 0.2045454), wk = 0.0022422 k( 307) = ( -0.2653049 0.7346951 0.2159091), wk = 0.0022422 k( 308) = ( -0.2653049 0.7346951 0.2272727), wk = 0.0022422 k( 309) = ( -0.2653049 0.7346951 0.2386364), wk = 0.0022422 k( 310) = ( -0.2653049 0.7346951 0.2500000), wk = 0.0022422 k( 311) = ( -0.2653049 0.7346951 0.2613636), wk = 0.0022422 k( 312) = ( -0.2653049 0.7346951 0.2727273), wk = 0.0022422 k( 313) = ( -0.2653049 0.7346951 0.2840909), wk = 0.0022422 k( 314) = ( -0.2653049 0.7346951 0.2954545), wk = 0.0022422 k( 315) = ( -0.2653049 0.7346951 0.3068182), wk = 0.0022422 k( 316) = ( -0.2653049 0.7346951 0.3181818), wk = 0.0022422 k( 317) = ( -0.2653049 0.7346951 0.3295455), wk = 0.0022422 k( 318) = ( -0.2653049 0.7346951 0.3409091), wk = 0.0022422 k( 319) = ( -0.2653049 0.7346951 0.3522727), wk = 0.0022422 k( 320) = ( -0.2653049 0.7346951 0.3636364), wk = 0.0022422 k( 321) = ( -0.2653049 0.7346951 0.3750000), wk = 0.0022422 k( 322) = ( -0.2653049 0.7346951 0.3863636), wk = 0.0022422 k( 323) = ( -0.2653049 0.7346951 0.3977273), wk = 0.0022422 k( 324) = ( -0.2653049 0.7346951 0.4090909), wk = 0.0022422 k( 325) = ( -0.2653049 0.7346951 0.4204545), wk = 0.0022422 k( 326) = ( -0.2653049 0.7346951 0.4318182), wk = 0.0022422 k( 327) = ( -0.2653049 0.7346951 0.4431818), wk = 0.0022422 k( 328) = ( -0.2653049 0.7346951 0.4545455), wk = 0.0022422 k( 329) = ( -0.2653049 0.7346951 0.4659091), wk = 0.0022422 k( 330) = ( -0.2653049 0.7346951 0.4772727), wk = 0.0022422 k( 331) = ( -0.2653049 0.7346951 0.4886364), wk = 0.0022422 k( 332) = ( -0.2653049 0.7346951 0.5000000), wk = 0.0022422 k( 333) = ( -0.2653049 0.7346951 0.5000000), wk = 0.0022422 k( 334) = ( -0.2706388 0.7293612 0.5000000), wk = 0.0022422 k( 335) = ( -0.2759728 0.7240272 0.5000000), wk = 0.0022422 k( 336) = ( -0.2813068 0.7186932 0.5000000), wk = 0.0022422 k( 337) = ( -0.2866408 0.7133592 0.5000000), wk = 0.0022422 k( 338) = ( -0.2919748 0.7080252 0.5000000), wk = 0.0022422 k( 339) = ( -0.2973088 0.7026913 0.5000000), wk = 0.0022422 k( 340) = ( -0.3026427 0.6973573 0.5000000), wk = 0.0022422 k( 341) = ( -0.3079767 0.6920233 0.5000000), wk = 0.0022422 k( 342) = ( -0.3133107 0.6866893 0.5000000), wk = 0.0022422 k( 343) = ( -0.3186447 0.6813553 0.5000000), wk = 0.0022422 k( 344) = ( -0.3239786 0.6760213 0.5000000), wk = 0.0022422 k( 345) = ( -0.3293126 0.6706874 0.5000000), wk = 0.0022422 k( 346) = ( -0.3346466 0.6653534 0.5000000), wk = 0.0022422 k( 347) = ( -0.3399806 0.6600194 0.5000000), wk = 0.0022422 k( 348) = ( -0.3453146 0.6546854 0.5000000), wk = 0.0022422 k( 349) = ( -0.3506486 0.6493515 0.5000000), wk = 0.0022422 k( 350) = ( -0.3559825 0.6440175 0.5000000), wk = 0.0022422 k( 351) = ( -0.3613165 0.6386835 0.5000000), wk = 0.0022422 k( 352) = ( -0.3666505 0.6333495 0.5000000), wk = 0.0022422 k( 353) = ( -0.3719845 0.6280155 0.5000000), wk = 0.0022422 k( 354) = ( -0.3773185 0.6226816 0.5000000), wk = 0.0022422 k( 355) = ( -0.3826524 0.6173476 0.5000000), wk = 0.0022422 k( 356) = ( -0.3879864 0.6120136 0.5000000), wk = 0.0022422 k( 357) = ( -0.3933204 0.6066796 0.5000000), wk = 0.0022422 k( 358) = ( -0.3986544 0.6013456 0.5000000), wk = 0.0022422 k( 359) = ( -0.4039884 0.5960116 0.5000000), wk = 0.0022422 k( 360) = ( -0.4093223 0.5906777 0.5000000), wk = 0.0022422 k( 361) = ( -0.4146563 0.5853437 0.5000000), wk = 0.0022422 k( 362) = ( -0.4199903 0.5800097 0.5000000), wk = 0.0022422 k( 363) = ( -0.4253243 0.5746757 0.5000000), wk = 0.0022422 k( 364) = ( -0.4306583 0.5693417 0.5000000), wk = 0.0022422 k( 365) = ( -0.4359922 0.5640078 0.5000000), wk = 0.0022422 k( 366) = ( -0.4413262 0.5586738 0.5000000), wk = 0.0022422 k( 367) = ( -0.4466602 0.5533398 0.5000000), wk = 0.0022422 k( 368) = ( -0.4519942 0.5480058 0.5000000), wk = 0.0022422 k( 369) = ( -0.4573282 0.5426718 0.5000000), wk = 0.0022422 k( 370) = ( -0.4626621 0.5373379 0.5000000), wk = 0.0022422 k( 371) = ( -0.4679961 0.5320039 0.5000000), wk = 0.0022422 k( 372) = ( -0.4733301 0.5266699 0.5000000), wk = 0.0022422 k( 373) = ( -0.4786641 0.5213359 0.5000000), wk = 0.0022422 k( 374) = ( -0.4839981 0.5160019 0.5000000), wk = 0.0022422 k( 375) = ( -0.4893320 0.5106680 0.5000000), wk = 0.0022422 k( 376) = ( -0.4946660 0.5053340 0.5000000), wk = 0.0022422 k( 377) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 k( 378) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 k( 379) = ( -0.5000000 0.5000000 0.4886364), wk = 0.0022422 k( 380) = ( -0.5000000 0.5000000 0.4772727), wk = 0.0022422 k( 381) = ( -0.5000000 0.5000000 0.4659091), wk = 0.0022422 k( 382) = ( -0.5000000 0.5000000 0.4545455), wk = 0.0022422 k( 383) = ( -0.5000000 0.5000000 0.4431818), wk = 0.0022422 k( 384) = ( -0.5000000 0.5000000 0.4318182), wk = 0.0022422 k( 385) = ( -0.5000000 0.5000000 0.4204545), wk = 0.0022422 k( 386) = ( -0.5000000 0.5000000 0.4090909), wk = 0.0022422 k( 387) = ( -0.5000000 0.5000000 0.3977273), wk = 0.0022422 k( 388) = ( -0.5000000 0.5000000 0.3863636), wk = 0.0022422 k( 389) = ( -0.5000000 0.5000000 0.3750000), wk = 0.0022422 k( 390) = ( -0.5000000 0.5000000 0.3636364), wk = 0.0022422 k( 391) = ( -0.5000000 0.5000000 0.3522727), wk = 0.0022422 k( 392) = ( -0.5000000 0.5000000 0.3409091), wk = 0.0022422 k( 393) = ( -0.5000000 0.5000000 0.3295455), wk = 0.0022422 k( 394) = ( -0.5000000 0.5000000 0.3181818), wk = 0.0022422 k( 395) = ( -0.5000000 0.5000000 0.3068182), wk = 0.0022422 k( 396) = ( -0.5000000 0.5000000 0.2954545), wk = 0.0022422 k( 397) = ( -0.5000000 0.5000000 0.2840909), wk = 0.0022422 k( 398) = ( -0.5000000 0.5000000 0.2727273), wk = 0.0022422 k( 399) = ( -0.5000000 0.5000000 0.2613636), wk = 0.0022422 k( 400) = ( -0.5000000 0.5000000 0.2500000), wk = 0.0022422 k( 401) = ( -0.5000000 0.5000000 0.2386364), wk = 0.0022422 k( 402) = ( -0.5000000 0.5000000 0.2272727), wk = 0.0022422 k( 403) = ( -0.5000000 0.5000000 0.2159091), wk = 0.0022422 k( 404) = ( -0.5000000 0.5000000 0.2045454), wk = 0.0022422 k( 405) = ( -0.5000000 0.5000000 0.1931818), wk = 0.0022422 k( 406) = ( -0.5000000 0.5000000 0.1818182), wk = 0.0022422 k( 407) = ( -0.5000000 0.5000000 0.1704546), wk = 0.0022422 k( 408) = ( -0.5000000 0.5000000 0.1590909), wk = 0.0022422 k( 409) = ( -0.5000000 0.5000000 0.1477273), wk = 0.0022422 k( 410) = ( -0.5000000 0.5000000 0.1363636), wk = 0.0022422 k( 411) = ( -0.5000000 0.5000000 0.1250000), wk = 0.0022422 k( 412) = ( -0.5000000 0.5000000 0.1136364), wk = 0.0022422 k( 413) = ( -0.5000000 0.5000000 0.1022727), wk = 0.0022422 k( 414) = ( -0.5000000 0.5000000 0.0909091), wk = 0.0022422 k( 415) = ( -0.5000000 0.5000000 0.0795455), wk = 0.0022422 k( 416) = ( -0.5000000 0.5000000 0.0681818), wk = 0.0022422 k( 417) = ( -0.5000000 0.5000000 0.0568182), wk = 0.0022422 k( 418) = ( -0.5000000 0.5000000 0.0454546), wk = 0.0022422 k( 419) = ( -0.5000000 0.5000000 0.0340909), wk = 0.0022422 k( 420) = ( -0.5000000 0.5000000 0.0227273), wk = 0.0022422 k( 421) = ( -0.5000000 0.5000000 0.0113636), wk = 0.0022422 k( 422) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0022422 k( 423) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0022422 k( 424) = ( -0.0217391 0.0217391 0.5000000), wk = 0.0022422 k( 425) = ( -0.0434783 0.0434783 0.5000000), wk = 0.0022422 k( 426) = ( -0.0652174 0.0652174 0.5000000), wk = 0.0022422 k( 427) = ( -0.0869565 0.0869565 0.5000000), wk = 0.0022422 k( 428) = ( -0.1086957 0.1086957 0.5000000), wk = 0.0022422 k( 429) = ( -0.1304348 0.1304348 0.5000000), wk = 0.0022422 k( 430) = ( -0.1521739 0.1521739 0.5000000), wk = 0.0022422 k( 431) = ( -0.1739130 0.1739130 0.5000000), wk = 0.0022422 k( 432) = ( -0.1956522 0.1956522 0.5000000), wk = 0.0022422 k( 433) = ( -0.2173913 0.2173913 0.5000000), wk = 0.0022422 k( 434) = ( -0.2391304 0.2391304 0.5000000), wk = 0.0022422 k( 435) = ( -0.2608696 0.2608696 0.5000000), wk = 0.0022422 k( 436) = ( -0.2826087 0.2826087 0.5000000), wk = 0.0022422 k( 437) = ( -0.3043478 0.3043478 0.5000000), wk = 0.0022422 k( 438) = ( -0.3260870 0.3260870 0.5000000), wk = 0.0022422 k( 439) = ( -0.3478261 0.3478261 0.5000000), wk = 0.0022422 k( 440) = ( -0.3695652 0.3695652 0.5000000), wk = 0.0022422 k( 441) = ( -0.3913044 0.3913044 0.5000000), wk = 0.0022422 k( 442) = ( -0.4130435 0.4130435 0.5000000), wk = 0.0022422 k( 443) = ( -0.4347826 0.4347826 0.5000000), wk = 0.0022422 k( 444) = ( -0.4565217 0.4565217 0.5000000), wk = 0.0022422 k( 445) = ( -0.4782609 0.4782609 0.5000000), wk = 0.0022422 k( 446) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0022422 Dense grid: 56683 G-vectors FFT dimensions: ( 80, 80, 40) Smooth grid: 21663 G-vectors FFT dimensions: ( 60, 60, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.11 Mb ( 158, 44) NL pseudopotentials 0.15 Mb ( 79, 124) Each V/rho on FFT grid 0.20 Mb ( 12800) Each G-vector array 0.01 Mb ( 1576) G-vector shells 0.01 Mb ( 780) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.42 Mb ( 158, 176) Each subspace H/S matrix 0.03 Mb ( 44, 44) Each matrix 0.17 Mb ( 124, 2, 44) Check: negative/imaginary core charge= -0.000005 0.000000 The potential is recalculated from file : ./YBC.save/charge-density.dat Starting wfc are 84 randomized atomic wfcs Band Structure Calculation Davidson diagonalization with overlap Computing kpt #: 1 total cpu time spent up to now is 3.1 secs Computing kpt #: 2 total cpu time spent up to now is 3.4 secs Computing kpt #: 3 total cpu time spent up to now is 3.7 secs Computing kpt #: 4 total cpu time spent up to now is 4.0 secs Computing kpt #: 5 total cpu time spent up to now is 4.3 secs Computing kpt #: 6 total cpu time spent up to now is 4.6 secs Computing kpt #: 7 total cpu time spent up to now is 4.9 secs Computing kpt #: 8 total cpu time spent up to now is 5.2 secs Computing kpt #: 9 total cpu time spent up to now is 5.5 secs Computing kpt #: 10 total cpu time spent up to now is 5.8 secs Computing kpt #: 11 total cpu time spent up to now is 6.1 secs Computing kpt #: 12 total cpu time spent up to now is 6.4 secs Computing kpt #: 13 total cpu time spent up to now is 6.7 secs Computing kpt #: 14 total cpu time spent up to now is 7.0 secs Computing kpt #: 15 total cpu time spent up to now is 7.3 secs Computing kpt #: 16 total cpu time spent up to now is 7.6 secs Computing kpt #: 17 total cpu time spent up to now is 7.9 secs Computing kpt #: 18 total cpu time spent up to now is 8.2 secs Computing kpt #: 19 total cpu time spent up to now is 8.5 secs Computing kpt #: 20 total cpu time spent up to now is 8.8 secs Computing kpt #: 21 total cpu time spent up to now is 9.1 secs Computing kpt #: 22 total cpu time spent up to now is 9.4 secs Computing kpt #: 23 total cpu time spent up to now is 9.7 secs Computing kpt #: 24 total cpu time spent up to now is 10.0 secs Computing kpt #: 25 total cpu time spent up to now is 10.3 secs Computing kpt #: 26 total cpu time spent up to now is 10.6 secs Computing kpt #: 27 total cpu time spent up to now is 11.0 secs Computing kpt #: 28 total cpu time spent up to now is 11.4 secs Computing kpt #: 29 total cpu time spent up to now is 11.8 secs Computing kpt #: 30 total cpu time spent up to now is 12.2 secs Computing kpt #: 31 total cpu time spent up to now is 12.7 secs Computing kpt #: 32 total cpu time spent up to now is 13.2 secs Computing kpt #: 33 total cpu time spent up to now is 13.6 secs Computing kpt #: 34 total cpu time spent up to now is 14.0 secs Computing kpt #: 35 total cpu time spent up to now is 14.4 secs Computing kpt #: 36 total cpu time spent up to now is 14.8 secs Computing kpt #: 37 total cpu time spent up to now is 15.2 secs Computing kpt #: 38 total cpu time spent up to now is 15.6 secs Computing kpt #: 39 total cpu time spent up to now is 16.0 secs Computing kpt #: 40 total cpu time spent up to now is 16.4 secs Computing kpt #: 41 total cpu time spent up to now is 16.8 secs Computing kpt #: 42 total cpu time spent up to now is 17.2 secs Computing kpt #: 43 total cpu time spent up to now is 17.6 secs Computing kpt #: 44 total cpu time spent up to now is 18.0 secs Computing kpt #: 45 total cpu time spent up to now is 18.4 secs Computing kpt #: 46 total cpu time spent up to now is 18.8 secs Computing kpt #: 47 total cpu time spent up to now is 19.2 secs Computing kpt #: 48 total cpu time spent up to now is 19.6 secs Computing kpt #: 49 total cpu time spent up to now is 19.9 secs Computing kpt #: 50 total cpu time spent up to now is 20.2 secs Computing kpt #: 51 total cpu time spent up to now is 20.5 secs Computing kpt #: 52 total cpu time spent up to now is 20.8 secs Computing kpt #: 53 total cpu time spent up to now is 21.1 secs Computing kpt #: 54 total cpu time spent up to now is 21.5 secs Computing kpt #: 55 total cpu time spent up to now is 21.8 secs Computing kpt #: 56 total cpu time spent up to now is 22.1 secs Computing kpt #: 57 total cpu time spent up to now is 22.4 secs Computing kpt #: 58 total cpu time spent up to now is 22.7 secs Computing kpt #: 59 total cpu time spent up to now is 23.0 secs Computing kpt #: 60 total cpu time spent up to now is 23.3 secs Computing kpt #: 61 total cpu time spent up to now is 23.6 secs Computing kpt #: 62 total cpu time spent up to now is 23.9 secs Computing kpt #: 63 total cpu time spent up to now is 24.2 secs Computing kpt #: 64 total cpu time spent up to now is 24.5 secs Computing kpt #: 65 total cpu time spent up to now is 24.8 secs Computing kpt #: 66 total cpu time spent up to now is 25.1 secs Computing kpt #: 67 total cpu time spent up to now is 25.4 secs Computing kpt #: 68 total cpu time spent up to now is 25.7 secs Computing kpt #: 69 total cpu time spent up to now is 26.0 secs Computing kpt #: 70 total cpu time spent up to now is 26.3 secs Computing kpt #: 71 total cpu time spent up to now is 26.6 secs Computing kpt #: 72 total cpu time spent up to now is 27.0 secs Computing kpt #: 73 total cpu time spent up to now is 27.3 secs Computing kpt #: 74 total cpu time spent up to now is 27.6 secs Computing kpt #: 75 total cpu time spent up to now is 28.0 secs Computing kpt #: 76 total cpu time spent up to now is 28.4 secs Computing kpt #: 77 total cpu time spent up to now is 28.9 secs Computing kpt #: 78 total cpu time spent up to now is 29.6 secs Computing kpt #: 79 total cpu time spent up to now is 30.2 secs Computing kpt #: 80 total cpu time spent up to now is 30.6 secs Computing kpt #: 81 total cpu time spent up to now is 31.0 secs Computing kpt #: 82 total cpu time spent up to now is 31.5 secs Computing kpt #: 83 total cpu time spent up to now is 31.9 secs Computing kpt #: 84 total cpu time spent up to now is 32.3 secs Computing kpt #: 85 total cpu time spent up to now is 32.7 secs Computing kpt #: 86 total cpu time spent up to now is 33.0 secs Computing kpt #: 87 total cpu time spent up to now is 33.4 secs Computing kpt #: 88 total cpu time spent up to now is 33.8 secs Computing kpt #: 89 total cpu time spent up to now is 34.1 secs Computing kpt #: 90 total cpu time spent up to now is 34.5 secs Computing kpt #: 91 total cpu time spent up to now is 34.8 secs Computing kpt #: 92 total cpu time spent up to now is 35.2 secs Computing kpt #: 93 total cpu time spent up to now is 35.5 secs Computing kpt #: 94 total cpu time spent up to now is 35.8 secs Computing kpt #: 95 total cpu time spent up to now is 36.2 secs Computing kpt #: 96 total cpu time spent up to now is 36.6 secs Computing kpt #: 97 total cpu time spent up to now is 36.9 secs Computing kpt #: 98 total cpu time spent up to now is 37.3 secs Computing kpt #: 99 total cpu time spent up to now is 37.6 secs Computing kpt #: 100 total cpu time spent up to now is 38.0 secs Computing kpt #: 101 total cpu time spent up to now is 38.4 secs Computing kpt #: 102 total cpu time spent up to now is 38.9 secs Computing kpt #: 103 total cpu time spent up to now is 39.3 secs Computing kpt #: 104 total cpu time spent up to now is 39.9 secs Computing kpt #: 105 total cpu time spent up to now is 40.5 secs Computing kpt #: 106 total cpu time spent up to now is 41.1 secs Computing kpt #: 107 total cpu time spent up to now is 41.7 secs Computing kpt #: 108 total cpu time spent up to now is 42.3 secs Computing kpt #: 109 total cpu time spent up to now is 42.7 secs Computing kpt #: 110 total cpu time spent up to now is 43.2 secs Computing kpt #: 111 total cpu time spent up to now is 43.6 secs Computing kpt #: 112 total cpu time spent up to now is 44.0 secs Computing kpt #: 113 total cpu time spent up to now is 44.5 secs Computing kpt #: 114 total cpu time spent up to now is 44.9 secs Computing kpt #: 115 total cpu time spent up to now is 45.3 secs Computing kpt #: 116 total cpu time spent up to now is 45.7 secs Computing kpt #: 117 total cpu time spent up to now is 46.1 secs Computing kpt #: 118 total cpu time spent up to now is 46.5 secs Computing kpt #: 119 total cpu time spent up to now is 46.8 secs Computing kpt #: 120 total cpu time spent up to now is 47.2 secs Computing kpt #: 121 total cpu time spent up to now is 47.6 secs Computing kpt #: 122 total cpu time spent up to now is 48.0 secs Computing kpt #: 123 total cpu time spent up to now is 48.4 secs Computing kpt #: 124 total cpu time spent up to now is 48.8 secs Computing kpt #: 125 total cpu time spent up to now is 49.1 secs Computing kpt #: 126 total cpu time spent up to now is 49.5 secs Computing kpt #: 127 total cpu time spent up to now is 49.8 secs Computing kpt #: 128 total cpu time spent up to now is 50.1 secs Computing kpt #: 129 total cpu time spent up to now is 50.4 secs Computing kpt #: 130 total cpu time spent up to now is 50.7 secs Computing kpt #: 131 total cpu time spent up to now is 51.0 secs Computing kpt #: 132 total cpu time spent up to now is 51.3 secs Computing kpt #: 133 total cpu time spent up to now is 51.6 secs Computing kpt #: 134 total cpu time spent up to now is 51.9 secs Computing kpt #: 135 total cpu time spent up to now is 52.2 secs Computing kpt #: 136 total cpu time spent up to now is 52.5 secs Computing kpt #: 137 total cpu time spent up to now is 52.8 secs Computing kpt #: 138 total cpu time spent up to now is 53.1 secs Computing kpt #: 139 total cpu time spent up to now is 53.4 secs Computing kpt #: 140 total cpu time spent up to now is 53.7 secs Computing kpt #: 141 total cpu time spent up to now is 54.0 secs Computing kpt #: 142 total cpu time spent up to now is 54.3 secs Computing kpt #: 143 total cpu time spent up to now is 54.6 secs Computing kpt #: 144 total cpu time spent up to now is 54.9 secs Computing kpt #: 145 total cpu time spent up to now is 55.2 secs Computing kpt #: 146 total cpu time spent up to now is 55.5 secs Computing kpt #: 147 total cpu time spent up to now is 55.8 secs Computing kpt #: 148 total cpu time spent up to now is 56.2 secs Computing kpt #: 149 total cpu time spent up to now is 56.5 secs Computing kpt #: 150 total cpu time spent up to now is 56.8 secs Computing kpt #: 151 total cpu time spent up to now is 57.1 secs Computing kpt #: 152 total cpu time spent up to now is 57.5 secs Computing kpt #: 153 total cpu time spent up to now is 57.9 secs Computing kpt #: 154 total cpu time spent up to now is 58.3 secs Computing kpt #: 155 total cpu time spent up to now is 58.8 secs Computing kpt #: 156 total cpu time spent up to now is 59.2 secs Computing kpt #: 157 total cpu time spent up to now is 59.7 secs Computing kpt #: 158 total cpu time spent up to now is 60.1 secs Computing kpt #: 159 total cpu time spent up 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Computing kpt #: 175 total cpu time spent up to now is 67.4 secs Computing kpt #: 176 total cpu time spent up to now is 67.9 secs Computing kpt #: 177 total cpu time spent up to now is 68.3 secs Computing kpt #: 178 total cpu time spent up to now is 68.8 secs Computing kpt #: 179 total cpu time spent up to now is 69.4 secs Computing kpt #: 180 total cpu time spent up to now is 70.0 secs Computing kpt #: 181 total cpu time spent up to now is 70.8 secs Computing kpt #: 182 total cpu time spent up to now is 71.2 secs Computing kpt #: 183 total cpu time spent up to now is 71.5 secs Computing kpt #: 184 total cpu time spent up to now is 71.8 secs Computing kpt #: 185 total cpu time spent up to now is 72.1 secs Computing kpt #: 186 total cpu time spent up to now is 72.4 secs Computing kpt #: 187 total cpu time spent up to now is 72.7 secs Computing kpt #: 188 total cpu time spent up to now is 73.4 secs Computing kpt #: 189 total cpu time spent up to now is 73.7 secs Computing kpt #: 190 total cpu time spent up to now is 74.0 secs Computing kpt #: 191 total cpu time spent up to now is 74.2 secs Computing kpt #: 192 total cpu time spent up to now is 74.5 secs Computing kpt #: 193 total cpu time spent up to now is 74.8 secs Computing kpt #: 194 total cpu time spent up to now is 75.1 secs Computing kpt #: 195 total cpu time spent up to now is 75.4 secs Computing kpt #: 196 total cpu time spent up to now is 75.7 secs Computing kpt #: 197 total cpu time spent up to now is 76.0 secs Computing kpt #: 198 total cpu time spent up to now is 76.2 secs Computing kpt #: 199 total cpu time spent up to now is 76.5 secs Computing kpt #: 200 total cpu time spent up to now is 76.8 secs Computing kpt #: 201 total cpu time spent up to now is 77.1 secs Computing kpt #: 202 total cpu time spent up to now is 77.4 secs Computing kpt #: 203 total cpu time spent up to now is 77.7 secs Computing kpt #: 204 total cpu time spent up to now is 77.9 secs Computing kpt #: 205 total cpu time spent up 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Computing kpt #: 221 total cpu time spent up to now is 82.8 secs Computing kpt #: 222 total cpu time spent up to now is 83.1 secs Computing kpt #: 223 total cpu time spent up to now is 83.3 secs Computing kpt #: 224 total cpu time spent up to now is 83.6 secs Computing kpt #: 225 total cpu time spent up to now is 83.9 secs Computing kpt #: 226 total cpu time spent up to now is 84.2 secs Computing kpt #: 227 total cpu time spent up to now is 84.5 secs Computing kpt #: 228 total cpu time spent up to now is 84.8 secs Computing kpt #: 229 total cpu time spent up to now is 85.1 secs Computing kpt #: 230 total cpu time spent up to now is 85.4 secs Computing kpt #: 231 total cpu time spent up to now is 85.7 secs Computing kpt #: 232 total cpu time spent up to now is 86.0 secs Computing kpt #: 233 total cpu time spent up to now is 86.3 secs Computing kpt #: 234 total cpu time spent up to now is 86.6 secs Computing kpt #: 235 total cpu time spent up to now is 87.0 secs Computing kpt #: 236 total cpu time spent up to now is 87.3 secs Computing kpt #: 237 total cpu time spent up to now is 87.6 secs Computing kpt #: 238 total cpu time spent up to now is 87.9 secs Computing kpt #: 239 total cpu time spent up to now is 88.2 secs Computing kpt #: 240 total cpu time spent up to now is 88.5 secs Computing kpt #: 241 total cpu time spent up to now is 88.8 secs Computing kpt #: 242 total cpu time spent up to now is 89.1 secs Computing kpt #: 243 total cpu time spent up to now is 89.4 secs Computing kpt #: 244 total cpu time spent up to now is 89.8 secs Computing kpt #: 245 total cpu time spent up to now is 90.1 secs Computing kpt #: 246 total cpu time spent up to now is 90.4 secs Computing kpt #: 247 total cpu time spent up to now is 90.7 secs Computing kpt #: 248 total cpu time spent up to now is 91.0 secs Computing kpt #: 249 total cpu time spent up to now is 91.3 secs Computing kpt #: 250 total cpu time spent up to now is 91.7 secs Computing kpt #: 251 total cpu time spent up to now is 92.0 secs Computing kpt #: 252 total cpu time spent up to now is 92.3 secs Computing kpt #: 253 total cpu time spent up to now is 92.6 secs Computing kpt #: 254 total cpu time spent up to now is 92.9 secs Computing kpt #: 255 total cpu time spent up to now is 93.2 secs Computing kpt #: 256 total cpu time spent up to now is 93.5 secs Computing kpt #: 257 total cpu time spent up to now is 93.8 secs Computing kpt #: 258 total cpu time spent up to now is 94.1 secs Computing kpt #: 259 total cpu time spent up to now is 94.4 secs Computing kpt #: 260 total cpu time spent up to now is 94.7 secs Computing kpt #: 261 total cpu time spent up to now is 95.0 secs Computing kpt #: 262 total cpu time spent up to now is 95.3 secs Computing kpt #: 263 total cpu time spent up to now is 95.6 secs Computing kpt #: 264 total cpu time spent up to now is 95.9 secs Computing kpt #: 265 total cpu time spent up to now is 96.2 secs Computing kpt #: 266 total cpu time spent up to now is 96.5 secs Computing kpt #: 267 total cpu time spent up to now is 96.8 secs Computing kpt #: 268 total cpu time spent up to now is 97.1 secs Computing kpt #: 269 total cpu time spent up to now is 97.4 secs Computing kpt #: 270 total cpu time spent up to now is 97.7 secs Computing kpt #: 271 total cpu time spent up to now is 98.0 secs Computing kpt #: 272 total cpu time spent up to now is 98.3 secs Computing kpt #: 273 total cpu time spent up to now is 98.6 secs Computing kpt #: 274 total cpu time spent up to now is 99.0 secs Computing kpt #: 275 total cpu time spent up to now is 99.9 secs Computing kpt #: 276 total cpu time spent up to now is 100.4 secs Computing kpt #: 277 total cpu time spent up to now is 100.8 secs Computing kpt #: 278 total cpu time spent up to now is 101.2 secs Computing kpt #: 279 total cpu time spent up to now is 101.5 secs Computing kpt #: 280 total cpu time spent up to now is 101.8 secs Computing kpt #: 281 total cpu time spent up to now is 102.1 secs Computing kpt #: 282 total cpu time spent up to now is 102.4 secs Computing kpt #: 283 total cpu time spent up to now is 102.7 secs Computing kpt #: 284 total cpu time spent up to now is 103.0 secs Computing kpt #: 285 total cpu time spent up to now is 103.3 secs Computing kpt #: 286 total cpu time spent up to now is 103.6 secs Computing kpt #: 287 total cpu time spent up to now is 104.0 secs Computing kpt #: 288 total cpu time spent up to now is 104.3 secs Computing kpt #: 289 total cpu time spent up to now is 104.6 secs Computing kpt #: 290 total cpu time spent up to now is 104.9 secs Computing kpt #: 291 total cpu time spent up to now is 105.2 secs Computing kpt #: 292 total cpu time spent up to now is 105.6 secs Computing kpt #: 293 total cpu time spent up to now is 105.9 secs Computing kpt #: 294 total cpu time spent up to now is 106.2 secs Computing kpt #: 295 total cpu time spent up to now is 106.6 secs Computing kpt #: 296 total cpu time spent up to now is 107.0 secs Computing kpt #: 297 total cpu time spent up to now is 107.4 secs Computing kpt #: 298 total cpu time spent up to now is 107.9 secs Computing kpt #: 299 total cpu time spent up to now is 108.3 secs Computing kpt #: 300 total cpu time spent up to now is 108.7 secs Computing kpt #: 301 total cpu time spent up to now is 109.1 secs Computing kpt #: 302 total cpu time spent up to now is 109.4 secs Computing kpt #: 303 total cpu time spent up to now is 109.8 secs Computing kpt #: 304 total cpu time spent up to now is 110.2 secs Computing kpt #: 305 total cpu time spent up to now is 110.5 secs Computing kpt #: 306 total cpu time spent up to now is 110.8 secs Computing kpt #: 307 total cpu time spent up to now is 111.2 secs Computing kpt #: 308 total cpu time spent up to now is 111.6 secs Computing kpt #: 309 total cpu time spent up to now is 111.9 secs Computing kpt #: 310 total cpu time spent up to now is 112.3 secs Computing kpt #: 311 total cpu time spent up to now is 112.7 secs Computing kpt #: 312 total cpu time spent up to now is 113.1 secs Computing kpt #: 313 total cpu time spent up to now is 113.4 secs Computing kpt #: 314 total cpu time spent up to now is 113.8 secs Computing kpt #: 315 total cpu time spent up to now is 114.2 secs Computing kpt #: 316 total cpu time spent up to now is 114.6 secs Computing kpt #: 317 total cpu time spent up to now is 115.0 secs Computing kpt #: 318 total cpu time spent up to now is 115.4 secs Computing kpt #: 319 total cpu time spent up to now is 115.8 secs Computing kpt #: 320 total cpu time spent up to now is 116.2 secs Computing kpt #: 321 total cpu time spent up to now is 116.6 secs Computing kpt #: 322 total cpu time spent up to now is 117.1 secs Computing kpt #: 323 total cpu time spent up to now is 117.5 secs Computing kpt #: 324 total cpu time spent up to now is 117.9 secs Computing kpt #: 325 total cpu time spent up to now is 118.3 secs Computing kpt #: 326 total cpu time spent up to now is 118.7 secs Computing kpt #: 327 total cpu time spent up to now is 119.1 secs Computing kpt #: 328 total cpu time spent up to now is 119.5 secs Computing kpt #: 329 total cpu time spent up to now is 119.9 secs Computing kpt #: 330 total cpu time spent up to now is 120.3 secs Computing kpt #: 331 total cpu time spent up to now is 120.7 secs Computing kpt #: 332 total cpu time spent up to now is 121.1 secs Computing kpt #: 333 total cpu time spent up to now is 121.5 secs Computing kpt #: 334 total cpu time spent up to now is 121.9 secs Computing kpt #: 335 total cpu time spent up to now is 122.3 secs Computing kpt #: 336 total cpu time spent up to now is 122.8 secs Computing kpt #: 337 total cpu time spent up to now is 123.2 secs Computing kpt #: 338 total cpu time spent up to now is 123.7 secs Computing kpt #: 339 total cpu time spent up to now is 124.2 secs Computing kpt #: 340 total cpu time spent up to now is 124.8 secs Computing kpt #: 341 total cpu time spent up to now is 125.4 secs Computing kpt #: 342 total cpu time spent up to now is 126.0 secs Computing kpt #: 343 total cpu time spent up to now is 126.7 secs Computing kpt #: 344 total cpu time spent up to now is 127.3 secs Computing kpt #: 345 total cpu time spent up to now is 127.8 secs Computing kpt #: 346 total cpu time spent up to now is 128.3 secs Computing kpt #: 347 total cpu time spent up to now is 128.8 secs Computing kpt #: 348 total cpu time spent up to now is 129.3 secs Computing kpt #: 349 total cpu time spent up to now is 129.7 secs Computing kpt #: 350 total cpu time spent up to now is 130.2 secs Computing kpt #: 351 total cpu time spent up to now is 130.6 secs Computing kpt #: 352 total cpu time spent up to now is 131.0 secs Computing kpt #: 353 total cpu time spent up to now is 131.4 secs Computing kpt #: 354 total cpu time spent up to now is 131.7 secs Computing kpt #: 355 total cpu time spent up to now is 132.1 secs Computing kpt #: 356 total cpu time spent up to now is 132.5 secs Computing kpt #: 357 total cpu time spent up to now is 133.0 secs Computing kpt #: 358 total cpu time spent up to now is 133.4 secs Computing kpt #: 359 total cpu time spent up to now is 133.8 secs Computing kpt #: 360 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 135.0 secs Computing kpt #: 361 total cpu time spent up to now is 135.6 secs Computing kpt #: 362 total cpu time spent up to now is 136.1 secs Computing kpt #: 363 total cpu time spent up to now is 136.5 secs Computing kpt #: 364 total cpu time spent up to now is 137.0 secs Computing kpt #: 365 total cpu time spent up to now is 137.4 secs Computing kpt #: 366 total cpu time spent up to now is 137.8 secs Computing kpt #: 367 total cpu time spent up to now is 138.2 secs Computing kpt #: 368 total cpu time spent up to now is 138.5 secs Computing kpt #: 369 total cpu time spent up to now is 138.8 secs Computing kpt #: 370 total cpu time spent up to now is 139.1 secs Computing kpt #: 371 total cpu time spent up to now is 139.4 secs Computing kpt #: 372 total cpu time spent up to now is 139.7 secs Computing kpt #: 373 total cpu time spent up to now is 140.0 secs Computing kpt #: 374 total cpu time spent up to now is 140.3 secs Computing kpt #: 375 total cpu time spent up to now is 140.6 secs Computing kpt #: 376 total cpu time spent up to now is 140.9 secs Computing kpt #: 377 total cpu time spent up to now is 141.2 secs Computing kpt #: 378 total cpu time spent up to now is 141.4 secs Computing kpt #: 379 total cpu time spent up to now is 141.7 secs Computing kpt #: 380 total cpu time spent up to now is 142.0 secs Computing kpt #: 381 total cpu time spent up to now is 142.3 secs Computing kpt #: 382 total cpu time spent up to now is 142.6 secs Computing kpt #: 383 total cpu time spent up to now is 142.9 secs Computing kpt #: 384 total cpu time spent up to now is 143.2 secs Computing kpt #: 385 total cpu time spent up to now is 143.5 secs Computing kpt #: 386 total cpu time spent up to now is 143.9 secs Computing kpt #: 387 total cpu time spent up to now is 144.3 secs Computing kpt #: 388 total cpu time spent up to now is 144.6 secs Computing kpt #: 389 total cpu time spent up to now is 145.0 secs Computing kpt #: 390 total cpu time spent up to now is 145.3 secs Computing kpt #: 391 total cpu time spent up to now is 145.6 secs Computing kpt #: 392 total cpu time spent up to now is 145.9 secs Computing kpt #: 393 total cpu time spent up to now is 146.2 secs Computing kpt #: 394 total cpu time spent up to now is 146.5 secs Computing kpt #: 395 total cpu time spent up to now is 146.8 secs Computing kpt #: 396 total cpu time spent up to now is 147.2 secs Computing kpt #: 397 total cpu time spent up to now is 147.5 secs Computing kpt #: 398 total cpu time spent up to now is 147.8 secs Computing kpt #: 399 total cpu time spent up to now is 148.1 secs Computing kpt #: 400 total cpu time spent up to now is 148.4 secs Computing kpt #: 401 total cpu time spent up to now is 148.6 secs Computing kpt #: 402 total cpu time spent up to now is 148.9 secs Computing kpt #: 403 total cpu time spent up to now is 149.2 secs Computing kpt #: 404 total cpu time spent up to now is 149.5 secs Computing kpt #: 405 total cpu time spent up to now is 149.8 secs Computing kpt #: 406 total cpu time spent up to now is 150.1 secs Computing kpt #: 407 total cpu time spent up to now is 150.4 secs Computing kpt #: 408 total cpu time spent up to now is 150.7 secs Computing kpt #: 409 total cpu time spent up to now is 151.0 secs Computing kpt #: 410 total cpu time spent up to now is 151.3 secs Computing kpt #: 411 total cpu time spent up to now is 151.6 secs Computing kpt #: 412 total cpu time spent up to now is 151.9 secs Computing kpt #: 413 total cpu time spent up to now is 152.2 secs Computing kpt #: 414 total cpu time spent up to now is 152.5 secs Computing kpt #: 415 total cpu time spent up to now is 152.8 secs Computing kpt #: 416 total cpu time spent up to now is 153.1 secs Computing kpt #: 417 total cpu time spent up to now is 153.4 secs Computing kpt #: 418 total cpu time spent up to now is 153.8 secs Computing kpt #: 419 total cpu time spent up to now is 154.1 secs Computing kpt #: 420 total cpu time spent up to now is 154.4 secs Computing kpt #: 421 total cpu time spent up to now is 154.7 secs Computing kpt #: 422 total cpu time spent up to now is 155.0 secs Computing kpt #: 423 total cpu time spent up to now is 155.4 secs Computing kpt #: 424 total cpu time spent up to now is 155.7 secs Computing kpt #: 425 total cpu time spent up to now is 156.1 secs Computing kpt #: 426 total cpu time spent up to now is 156.5 secs Computing kpt #: 427 total cpu time spent up to now is 156.9 secs Computing kpt #: 428 total cpu time spent up to now is 157.3 secs Computing kpt #: 429 total cpu time spent up to now is 157.8 secs Computing kpt #: 430 total cpu time spent up to now is 158.2 secs Computing kpt #: 431 total cpu time spent up to now is 158.6 secs Computing kpt #: 432 total cpu time spent up to now is 159.0 secs Computing kpt #: 433 total cpu time spent up to now is 159.4 secs Computing kpt #: 434 total cpu time spent up to now is 159.7 secs Computing kpt #: 435 total cpu time spent up to now is 160.0 secs Computing kpt #: 436 total cpu time spent up to now is 160.4 secs Computing kpt #: 437 total cpu time spent up to now is 160.7 secs Computing kpt #: 438 total cpu time spent up to now is 161.0 secs Computing kpt #: 439 total cpu time spent up to now is 161.3 secs Computing kpt #: 440 total cpu time spent up to now is 161.5 secs Computing kpt #: 441 total cpu time spent up to now is 161.8 secs Computing kpt #: 442 total cpu time spent up to now is 162.1 secs Computing kpt #: 443 total cpu time spent up to now is 162.4 secs Computing kpt #: 444 total cpu time spent up to now is 162.7 secs Computing kpt #: 445 total cpu time spent up to now is 163.0 secs Computing kpt #: 446 total cpu time spent up to now is 163.3 secs ethr = 2.78E-08, avg # of iterations = 21.3 total cpu time spent up to now is 163.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 2699 PWs) bands (ev): -31.3713 -31.3713 -31.3366 -31.3366 -12.4335 -12.4335 -12.2695 -12.2695 -11.1139 -11.1139 -10.8899 -10.8899 -10.7731 -10.7731 -10.7532 -10.7532 -1.8402 -1.8402 -0.7042 -0.7042 2.8322 2.8322 6.7744 6.7744 8.1302 8.1302 8.3200 8.3200 8.8982 8.8982 9.9978 9.9978 10.0415 10.0415 10.1439 10.1439 10.1755 10.1755 10.1922 10.1922 11.5285 11.5285 13.3800 13.3800 k = 0.0053 0.0214-0.0000 ( 2695 PWs) bands (ev): -31.3712 -31.3712 -31.3365 -31.3365 -12.4336 -12.4336 -12.2697 -12.2697 -11.1140 -11.1140 -10.8899 -10.8899 -10.7735 -10.7735 -10.7538 -10.7538 -1.8388 -1.8388 -0.7029 -0.7029 2.8325 2.8325 6.7747 6.7747 8.1181 8.1181 8.3191 8.3191 8.9011 8.9011 9.9971 9.9971 10.0372 10.0372 10.1006 10.1006 10.1830 10.1830 10.2347 10.2347 11.5249 11.5249 13.3770 13.3770 k = 0.0106 0.0429-0.0000 ( 2701 PWs) bands (ev): -31.3710 -31.3710 -31.3364 -31.3364 -12.4337 -12.4337 -12.2702 -12.2702 -11.1142 -11.1142 -10.8898 -10.8898 -10.7747 -10.7747 -10.7555 -10.7555 -1.8344 -1.8344 -0.6990 -0.6990 2.8335 2.8335 6.7754 6.7754 8.0833 8.0833 8.3165 8.3165 8.9090 8.9090 9.9937 9.9937 10.0240 10.0240 10.0402 10.0402 10.2062 10.2062 10.2934 10.2934 11.5143 11.5143 13.3680 13.3680 k = 0.0159 0.0643-0.0000 ( 2701 PWs) bands (ev): -31.3707 -31.3707 -31.3362 -31.3362 -12.4340 -12.4340 -12.2710 -12.2710 -11.1145 -11.1145 -10.8897 -10.8897 -10.7767 -10.7767 -10.7583 -10.7583 -1.8270 -1.8270 -0.6926 -0.6926 2.8350 2.8350 6.7767 6.7767 8.0285 8.0285 8.3122 8.3122 8.9197 8.9197 9.9642 9.9642 10.0008 10.0008 10.0036 10.0036 10.2441 10.2441 10.3527 10.3527 11.4968 11.4968 13.3534 13.3534 k = 0.0212 0.0858-0.0000 ( 2705 PWs) bands (ev): -31.3703 -31.3703 -31.3358 -31.3358 -12.4344 -12.4344 -12.2722 -12.2722 -11.1149 -11.1149 -10.8895 -10.8895 -10.7795 -10.7795 -10.7622 -10.7622 -1.8168 -1.8168 -0.6836 -0.6836 2.8373 2.8373 6.7784 6.7784 7.9572 7.9572 8.3060 8.3060 8.9309 8.9309 9.8993 9.8993 9.9742 9.9742 9.9951 9.9951 10.2956 10.2956 10.4115 10.4115 11.4728 11.4728 13.3336 13.3336 k = 0.0265 0.1072-0.0000 ( 2701 PWs) bands (ev): -31.3697 -31.3697 -31.3354 -31.3354 -12.4349 -12.4349 -12.2737 -12.2737 -11.1156 -11.1156 -10.8893 -10.8893 -10.7830 -10.7830 -10.7670 -10.7670 -1.8037 -1.8037 -0.6721 -0.6721 2.8401 2.8401 6.7805 6.7805 7.8730 7.8730 8.2979 8.2979 8.9406 8.9406 9.8296 9.8296 9.9374 9.9374 9.9917 9.9917 10.3593 10.3593 10.4699 10.4699 11.4429 11.4429 13.3093 13.3093 k = 0.0318 0.1287-0.0000 ( 2701 PWs) bands (ev): -31.3691 -31.3691 -31.3349 -31.3349 -12.4355 -12.4355 -12.2755 -12.2755 -11.1163 -11.1163 -10.8891 -10.8891 -10.7872 -10.7872 -10.7727 -10.7727 -1.7878 -1.7878 -0.6582 -0.6582 2.8435 2.8435 6.7829 6.7829 7.7786 7.7786 8.2878 8.2878 8.9474 8.9474 9.7575 9.7575 9.8937 9.8937 9.9888 9.9888 10.4339 10.4339 10.5280 10.5280 11.4075 11.4075 13.2814 13.2814 k = 0.0371 0.1501-0.0000 ( 2699 PWs) bands (ev): -31.3683 -31.3683 -31.3343 -31.3343 -12.4362 -12.4362 -12.2777 -12.2777 -11.1173 -11.1173 -10.8889 -10.8889 -10.7923 -10.7923 -10.7792 -10.7792 -1.7691 -1.7691 -0.6419 -0.6419 2.8476 2.8476 6.7855 6.7855 7.6762 7.6762 8.2757 8.2757 8.9509 8.9509 9.6836 9.6836 9.8435 9.8435 9.9864 9.9864 10.5179 10.5179 10.5856 10.5856 11.3674 11.3674 13.2507 13.2507 k = 0.0424 0.1716-0.0000 ( 2699 PWs) bands (ev): -31.3674 -31.3674 -31.3337 -31.3337 -12.4370 -12.4370 -12.2802 -12.2802 -11.1185 -11.1185 -10.8888 -10.8888 -10.7981 -10.7981 -10.7861 -10.7861 -1.7476 -1.7476 -0.6232 -0.6232 2.8522 2.8522 6.7884 6.7884 7.5676 7.5676 8.2614 8.2614 8.9506 8.9506 9.6081 9.6081 9.7876 9.7876 9.9849 9.9849 10.6098 10.6098 10.6429 10.6429 11.3233 11.3233 13.2184 13.2184 k = 0.0478 0.1930-0.0000 ( 2699 PWs) bands (ev): -31.3664 -31.3664 -31.3329 -31.3329 -12.4380 -12.4380 -12.2831 -12.2831 -11.1200 -11.1200 -10.8888 -10.8888 -10.8049 -10.8049 -10.7932 -10.7932 -1.7235 -1.7235 -0.6022 -0.6022 2.8573 2.8573 6.7912 6.7912 7.4540 7.4540 8.2449 8.2449 8.9466 8.9466 9.5311 9.5311 9.7267 9.7267 9.9846 9.9846 10.6992 10.6992 10.7089 10.7089 11.2761 11.2761 13.1854 13.1854 k = 0.0531 0.2145-0.0000 ( 2691 PWs) bands (ev): -31.3653 -31.3653 -31.3321 -31.3321 -12.4391 -12.4391 -12.2863 -12.2863 -11.1218 -11.1218 -10.8891 -10.8891 -10.8127 -10.8127 -10.8002 -10.8002 -1.6967 -1.6967 -0.5791 -0.5791 2.8631 2.8631 6.7939 6.7939 7.3367 7.3367 8.2261 8.2261 8.9389 8.9389 9.4531 9.4531 9.6612 9.6612 9.9859 9.9859 10.7555 10.7555 10.8123 10.8123 11.2273 11.2273 13.1531 13.1531 k = 0.0584 0.2359-0.0000 ( 2687 PWs) bands (ev): -31.3641 -31.3641 -31.3312 -31.3312 -12.4404 -12.4404 -12.2899 -12.2899 -11.1239 -11.1239 -10.8898 -10.8898 -10.8213 -10.8213 -10.8069 -10.8069 -1.6674 -1.6674 -0.5538 -0.5538 2.8693 2.8693 6.7964 6.7964 7.2164 7.2164 8.2050 8.2050 8.9277 8.9277 9.3743 9.3743 9.5920 9.5920 9.9892 9.9892 10.8105 10.8105 10.9182 10.9182 11.1795 11.1795 13.1227 13.1227 k = 0.0637 0.2573-0.0000 ( 2697 PWs) bands (ev): -31.3628 -31.3628 -31.3302 -31.3302 -12.4418 -12.4418 -12.2938 -12.2938 -11.1263 -11.1263 -10.8912 -10.8912 -10.8304 -10.8304 -10.8132 -10.8132 -1.6357 -1.6357 -0.5265 -0.5265 2.8760 2.8760 6.7984 6.7984 7.0938 7.0938 8.1816 8.1816 8.9131 8.9131 9.2951 9.2951 9.5196 9.5196 9.9949 9.9949 10.8639 10.8639 11.0121 11.0121 11.1470 11.1470 13.0955 13.0955 k = 0.0690 0.2788-0.0000 ( 2689 PWs) bands (ev): -31.3614 -31.3614 -31.3292 -31.3292 -12.4434 -12.4434 -12.2980 -12.2980 -11.1292 -11.1292 -10.8936 -10.8936 -10.8393 -10.8393 -10.8192 -10.8192 -1.6015 -1.6015 -0.4974 -0.4974 2.8831 2.8831 6.7998 6.7998 6.9696 6.9696 8.1560 8.1560 8.8951 8.8951 9.2160 9.2160 9.4446 9.4446 10.0032 10.0032 10.9153 10.9153 11.0279 11.0279 11.1962 11.1962 13.0728 13.0728 k = 0.0743 0.3002-0.0000 ( 2689 PWs) bands (ev): -31.3599 -31.3599 -31.3281 -31.3281 -12.4451 -12.4451 -12.3026 -12.3026 -11.1324 -11.1324 -10.8977 -10.8977 -10.8474 -10.8474 -10.8248 -10.8248 -1.5651 -1.5651 -0.4664 -0.4664 2.8907 2.8907 6.8003 6.8003 6.8442 6.8442 8.1281 8.1281 8.8739 8.8739 9.1374 9.1374 9.3676 9.3676 10.0145 10.0145 10.9637 10.9637 10.9854 10.9854 11.3075 11.3075 13.0561 13.0561 k = 0.0796 0.3217-0.0000 ( 2689 PWs) bands (ev): -31.3583 -31.3583 -31.3270 -31.3270 -12.4471 -12.4471 -12.3076 -12.3076 -11.1361 -11.1361 -10.9038 -10.9038 -10.8542 -10.8542 -10.8299 -10.8299 -1.5264 -1.5264 -0.4338 -0.4338 2.8987 2.8987 6.7179 6.7179 6.7997 6.7997 8.0982 8.0982 8.8495 8.8495 9.0598 9.0598 9.2890 9.2890 10.0289 10.0289 10.9332 10.9332 11.0089 11.0089 11.4322 11.4322 13.0467 13.0467 k = 0.0849 0.3431-0.0000 ( 2689 PWs) bands (ev): -31.3567 -31.3567 -31.3258 -31.3258 -12.4492 -12.4492 -12.3129 -12.3129 -11.1403 -11.1403 -10.9123 -10.9123 -10.8593 -10.8593 -10.8343 -10.8343 -1.4857 -1.4857 -0.3997 -0.3997 2.9070 2.9070 6.5913 6.5913 6.7978 6.7978 8.0664 8.0664 8.8221 8.8221 8.9837 8.9837 9.2094 9.2094 10.0466 10.0466 10.8796 10.8796 11.0496 11.0496 11.5629 11.5629 13.0460 13.0460 k = 0.0902 0.3646-0.0000 ( 2693 PWs) bands (ev): -31.3550 -31.3550 -31.3246 -31.3246 -12.4514 -12.4514 -12.3185 -12.3185 -11.1449 -11.1449 -10.9228 -10.9228 -10.8631 -10.8631 -10.8381 -10.8381 -1.4429 -1.4429 -0.3641 -0.3641 2.9156 2.9156 6.4647 6.4647 6.7942 6.7942 8.0328 8.0328 8.7916 8.7916 8.9095 8.9095 9.1291 9.1291 10.0678 10.0678 10.8262 10.8262 11.0853 11.0853 11.6979 11.6979 13.0551 13.0551 k = 0.0955 0.3860-0.0000 ( 2693 PWs) bands (ev): -31.3532 -31.3532 -31.3234 -31.3234 -12.4539 -12.4539 -12.3244 -12.3244 -11.1500 -11.1500 -10.9347 -10.9347 -10.8661 -10.8661 -10.8410 -10.8410 -1.3983 -1.3983 -0.3273 -0.3273 2.9246 2.9246 6.3383 6.3383 6.7887 6.7887 7.9976 7.9976 8.7583 8.7583 8.8379 8.8379 9.0486 9.0486 10.0925 10.0925 10.7738 10.7738 11.1155 11.1155 11.8367 11.8367 13.0751 13.0751 k = 0.1008 0.4075-0.0000 ( 2689 PWs) bands (ev): -31.3514 -31.3514 -31.3221 -31.3221 -12.4565 -12.4565 -12.3307 -12.3307 -11.1555 -11.1555 -10.9476 -10.9476 -10.8685 -10.8685 -10.8431 -10.8431 -1.3518 -1.3518 -0.2893 -0.2893 2.9337 2.9337 6.2125 6.2125 6.7810 6.7810 7.9612 7.9612 8.7221 8.7221 8.7693 8.7693 8.9683 8.9683 10.1209 10.1209 10.7229 10.7229 11.1397 11.1397 11.9790 11.9790 13.1067 13.1067 k = 0.1061 0.4289-0.0000 ( 2691 PWs) bands (ev): -31.3495 -31.3495 -31.3208 -31.3208 -12.4593 -12.4593 -12.3372 -12.3372 -11.1614 -11.1614 -10.9612 -10.9612 -10.8707 -10.8707 -10.8445 -10.8445 -1.3037 -1.3037 -0.2505 -0.2505 2.9431 2.9431 6.0874 6.0874 6.7709 6.7709 7.9238 7.9238 8.6831 8.6831 8.7044 8.7044 8.8883 8.8883 10.1528 10.1528 10.6738 10.6738 11.1579 11.1579 12.1246 12.1246 13.1504 13.1504 k = 0.1114 0.4503-0.0000 ( 2691 PWs) bands (ev): -31.3476 -31.3476 -31.3195 -31.3195 -12.4623 -12.4623 -12.3440 -12.3440 -11.1677 -11.1677 -10.9751 -10.9751 -10.8727 -10.8727 -10.8451 -10.8451 -1.2541 -1.2541 -0.2108 -0.2108 2.9527 2.9527 5.9634 5.9634 6.7580 6.7580 7.8855 7.8855 8.6385 8.6385 8.6464 8.6464 8.8091 8.8091 10.1883 10.1883 10.6268 10.6268 11.1702 11.1702 12.2734 12.2734 13.2061 13.2061 k = 0.1167 0.4718-0.0000 ( 2691 PWs) bands (ev): -31.3457 -31.3457 -31.3181 -31.3181 -12.4655 -12.4655 -12.3511 -12.3511 -11.1743 -11.1743 -10.9893 -10.9893 -10.8745 -10.8745 -10.8452 -10.8452 -1.2030 -1.2030 -0.1705 -0.1705 2.9623 2.9623 5.8406 5.8406 6.7423 6.7423 7.8467 7.8467 8.5841 8.5841 8.6002 8.6002 8.7309 8.7309 10.2273 10.2273 10.5820 10.5820 11.1772 11.1772 12.4250 12.4250 13.2738 13.2738 k = 0.1220 0.4932-0.0000 ( 2691 PWs) bands (ev): -31.3438 -31.3438 -31.3168 -31.3168 -12.4688 -12.4688 -12.3584 -12.3584 -11.1810 -11.1810 -11.0035 -11.0035 -10.8759 -10.8759 -10.8449 -10.8449 -1.1507 -1.1507 -0.1298 -0.1298 2.9721 2.9721 5.7194 5.7194 6.7236 6.7236 7.8076 7.8076 8.5319 8.5319 8.5544 8.5544 8.6540 8.6540 10.2698 10.2698 10.5396 10.5396 11.1795 11.1795 12.5795 12.5795 13.3527 13.3527 k = 0.1273 0.5147-0.0000 ( 2693 PWs) bands (ev): -31.3418 -31.3418 -31.3155 -31.3155 -12.4722 -12.4722 -12.3659 -12.3659 -11.1880 -11.1880 -11.0176 -11.0176 -10.8771 -10.8771 -10.8444 -10.8444 -1.0972 -1.0972 -0.0889 -0.0889 2.9820 2.9820 5.5998 5.5998 6.7018 6.7018 7.7685 7.7685 8.4842 8.4842 8.5069 8.5069 8.5785 8.5785 10.3158 10.3158 10.4996 10.4996 11.1778 11.1778 12.7365 12.7365 13.4423 13.4423 k = 0.1327 0.5361-0.0000 ( 2693 PWs) bands (ev): -31.3398 -31.3398 -31.3142 -31.3142 -12.4758 -12.4758 -12.3736 -12.3736 -11.1950 -11.1950 -11.0315 -11.0315 -10.8779 -10.8779 -10.8436 -10.8436 -1.0427 -1.0427 -0.0480 -0.0480 2.9918 2.9918 5.4822 5.4822 6.6769 6.6769 7.7296 7.7296 8.4413 8.4413 8.4579 8.4579 8.5048 8.5048 10.3650 10.3650 10.4622 10.4622 11.1732 11.1732 12.8957 12.8957 13.5418 13.5418 k = 0.1380 0.5576-0.0000 ( 2701 PWs) bands (ev): -31.3379 -31.3379 -31.3129 -31.3129 -12.4794 -12.4794 -12.3815 -12.3815 -11.2020 -11.2020 -11.0453 -11.0453 -10.8784 -10.8784 -10.8427 -10.8427 -0.9873 -0.9873 -0.0073 -0.0073 3.0017 3.0017 5.3668 5.3668 6.6491 6.6491 7.6912 7.6912 8.4030 8.4030 8.4075 8.4075 8.4332 8.4332 10.4138 10.4138 10.4309 10.4309 11.1666 11.1666 13.0568 13.0568 13.6502 13.6502 k = 0.1433 0.5790-0.0000 ( 2707 PWs) bands (ev): -31.3359 -31.3359 -31.3117 -31.3117 -12.4832 -12.4832 -12.3894 -12.3894 -11.2090 -11.2090 -11.0587 -11.0587 -10.8786 -10.8786 -10.8417 -10.8417 -0.9313 -0.9313 0.0331 0.0331 3.0116 3.0116 5.2537 5.2537 6.6187 6.6187 7.6534 7.6534 8.3560 8.3560 8.3606 8.3606 8.3729 8.3729 10.3927 10.3927 10.4751 10.4751 11.1587 11.1587 13.2192 13.2192 13.7667 13.7667 k = 0.1486 0.6005-0.0000 ( 2707 PWs) bands (ev): -31.3339 -31.3339 -31.3104 -31.3104 -12.4870 -12.4870 -12.3975 -12.3975 -11.2158 -11.2158 -11.0719 -11.0719 -10.8785 -10.8785 -10.8407 -10.8407 -0.8747 -0.8747 0.0727 0.0727 3.0215 3.0215 5.1432 5.1432 6.5858 6.5858 7.6166 7.6166 8.2940 8.2940 8.3043 8.3043 8.3429 8.3429 10.3624 10.3624 10.5339 10.5339 11.1505 11.1505 13.3821 13.3821 13.8903 13.8903 k = 0.1539 0.6219-0.0000 ( 2707 PWs) bands (ev): -31.3320 -31.3320 -31.3093 -31.3093 -12.4909 -12.4909 -12.4055 -12.4055 -11.2223 -11.2223 -11.0846 -11.0846 -10.8781 -10.8781 -10.8396 -10.8396 -0.8178 -0.8178 0.1114 0.1114 3.0314 3.0314 5.0355 5.0355 6.5509 6.5509 7.5809 7.5809 8.2287 8.2287 8.2517 8.2517 8.3188 8.3188 10.3341 10.3341 10.5962 10.5962 11.1426 11.1426 13.5445 13.5445 14.0200 14.0200 k = 0.1592 0.6434-0.0000 ( 2707 PWs) bands (ev): -31.3301 -31.3301 -31.3081 -31.3081 -12.4947 -12.4947 -12.4136 -12.4136 -11.2287 -11.2287 -11.0969 -11.0969 -10.8775 -10.8775 -10.8386 -10.8386 -0.7608 -0.7608 0.1490 0.1490 3.0413 3.0413 4.9308 4.9308 6.5144 6.5144 7.5466 7.5466 8.1657 8.1657 8.1990 8.1990 8.2990 8.2990 10.3079 10.3079 10.6615 10.6615 11.1358 11.1358 13.7046 13.7046 14.1538 14.1538 k = 0.1645 0.6648-0.0000 ( 2705 PWs) bands (ev): -31.3282 -31.3282 -31.3071 -31.3071 -12.4985 -12.4985 -12.4216 -12.4216 -11.2346 -11.2346 -11.1087 -11.1087 -10.8767 -10.8767 -10.8375 -10.8375 -0.7038 -0.7038 0.1851 0.1851 3.0512 3.0512 4.8294 4.8294 6.4768 6.4768 7.5137 7.5137 8.1051 8.1051 8.1464 8.1464 8.2829 8.2829 10.2837 10.2837 10.7299 10.7299 11.1305 11.1305 13.8596 13.8596 14.2341 14.2341 k = 0.1698 0.6862-0.0000 ( 2701 PWs) bands (ev): -31.3264 -31.3264 -31.3060 -31.3060 -12.5023 -12.5023 -12.4295 -12.4295 -11.2402 -11.2402 -11.1201 -11.1201 -10.8757 -10.8757 -10.8366 -10.8366 -0.6470 -0.6470 0.2195 0.2195 3.0613 3.0613 4.7314 4.7314 6.4386 6.4386 7.4825 7.4825 8.0471 8.0471 8.0942 8.0942 8.2703 8.2703 10.2614 10.2614 10.8012 10.8012 11.1273 11.1273 14.0045 14.0045 14.2165 14.2165 k = 0.1751 0.7077-0.0000 ( 2701 PWs) bands (ev): -31.3246 -31.3246 -31.3051 -31.3051 -12.5059 -12.5059 -12.4372 -12.4372 -11.2454 -11.2454 -11.1310 -11.1310 -10.8746 -10.8746 -10.8357 -10.8357 -0.5907 -0.5907 0.2518 0.2518 3.0715 3.0715 4.6371 4.6371 6.4002 6.4002 7.4530 7.4530 7.9918 7.9918 8.0428 8.0428 8.2606 8.2606 10.2410 10.2410 10.8754 10.8754 11.1267 11.1267 14.1299 14.1299 14.1972 14.1972 k = 0.1804 0.7291-0.0000 ( 2699 PWs) bands (ev): -31.3229 -31.3229 -31.3042 -31.3042 -12.5094 -12.5094 -12.4448 -12.4448 -11.2501 -11.2501 -11.1413 -11.1413 -10.8734 -10.8734 -10.8349 -10.8349 -0.5352 -0.5352 0.2819 0.2819 3.0820 3.0820 4.5467 4.5467 6.3622 6.3622 7.4256 7.4256 7.9392 7.9392 7.9923 7.9923 8.2537 8.2537 10.2223 10.2223 10.9523 10.9523 11.1289 11.1289 14.1186 14.1186 14.1717 14.1717 k = 0.1857 0.7506-0.0000 ( 2705 PWs) bands (ev): -31.3212 -31.3212 -31.3034 -31.3034 -12.5127 -12.5127 -12.4521 -12.4521 -11.2543 -11.2543 -11.1511 -11.1511 -10.8721 -10.8721 -10.8342 -10.8342 -0.4806 -0.4806 0.3092 0.3092 3.0929 3.0929 4.4604 4.4604 6.3249 6.3249 7.4003 7.4003 7.8895 7.8895 7.9431 7.9431 8.2490 8.2490 10.2054 10.2054 11.0319 11.0319 11.1343 11.1343 13.9937 13.9937 14.1531 14.1531 k = 0.1910 0.7720-0.0000 ( 2699 PWs) bands (ev): -31.3196 -31.3196 -31.3027 -31.3027 -12.5159 -12.5159 -12.4592 -12.4592 -11.2580 -11.2580 -11.1604 -11.1604 -10.8707 -10.8707 -10.8336 -10.8336 -0.4273 -0.4273 0.3337 0.3337 3.1044 3.1044 4.3784 4.3784 6.2888 6.2888 7.3771 7.3771 7.8426 7.8426 7.8954 7.8954 8.2463 8.2463 10.1901 10.1901 11.1133 11.1133 11.1439 11.1439 13.8692 13.8692 14.1342 14.1342 k = 0.1963 0.7935-0.0000 ( 2703 PWs) bands (ev): -31.3181 -31.3181 -31.3020 -31.3020 -12.5187 -12.5187 -12.4659 -12.4659 -11.2612 -11.2612 -11.1691 -11.1691 -10.8694 -10.8694 -10.8331 -10.8331 -0.3754 -0.3754 0.3550 0.3550 3.1166 3.1166 4.3010 4.3010 6.2541 6.2541 7.3563 7.3563 7.7988 7.7988 7.8495 7.8495 8.2454 8.2454 10.1765 10.1765 11.1537 11.1537 11.2007 11.2007 13.7457 13.7457 14.1162 14.1162 k = 0.2016 0.8149-0.0000 ( 2703 PWs) bands (ev): -31.3167 -31.3167 -31.3015 -31.3015 -12.5213 -12.5213 -12.4723 -12.4723 -11.2638 -11.2638 -11.1772 -11.1772 -10.8680 -10.8680 -10.8328 -10.8328 -0.3254 -0.3254 0.3727 0.3727 3.1297 3.1297 4.2283 4.2283 6.2213 6.2213 7.3380 7.3380 7.7579 7.7579 7.8055 7.8055 8.2460 8.2460 10.1643 10.1643 11.1700 11.1700 11.2878 11.2878 13.6234 13.6234 14.0993 14.0993 k = 0.2069 0.8364-0.0000 ( 2703 PWs) bands (ev): -31.3153 -31.3153 -31.3010 -31.3010 -12.5235 -12.5235 -12.4783 -12.4783 -11.2658 -11.2658 -11.1848 -11.1848 -10.8666 -10.8666 -10.8325 -10.8325 -0.2774 -0.2774 0.3867 0.3867 3.1440 3.1440 4.1604 4.1604 6.1905 6.1905 7.3221 7.3221 7.7200 7.7200 7.7638 7.7638 8.2479 8.2479 10.1537 10.1537 11.1895 11.1895 11.3778 11.3778 13.5024 13.5024 14.0836 14.0836 k = 0.2122 0.8578-0.0000 ( 2693 PWs) bands (ev): -31.3141 -31.3141 -31.3007 -31.3007 -12.5254 -12.5254 -12.4838 -12.4838 -11.2673 -11.2673 -11.1918 -11.1918 -10.8653 -10.8653 -10.8324 -10.8324 -0.2319 -0.2319 0.3966 0.3966 3.1597 3.1597 4.0975 4.0975 6.1620 6.1620 7.3089 7.3089 7.6852 7.6852 7.7246 7.7246 8.2511 8.2511 10.1445 10.1445 11.2128 11.2128 11.4704 11.4704 13.3829 13.3829 14.0692 14.0692 k = 0.2175 0.8793-0.0000 ( 2695 PWs) bands (ev): -31.3129 -31.3129 -31.3004 -31.3004 -12.5269 -12.5269 -12.4889 -12.4889 -11.2682 -11.2682 -11.1983 -11.1983 -10.8640 -10.8640 -10.8325 -10.8325 -0.1891 -0.1891 0.4024 0.4024 3.1772 3.1772 4.0397 4.0397 6.1359 6.1359 7.2983 7.2983 7.6535 7.6535 7.6881 7.6881 8.2554 8.2554 10.1367 10.1367 11.2398 11.2398 11.5655 11.5655 13.2649 13.2649 14.0555 14.0555 k = 0.2229 0.9007-0.0000 ( 2695 PWs) bands (ev): -31.3119 -31.3119 -31.3003 -31.3003 -12.5279 -12.5279 -12.4935 -12.4935 -11.2686 -11.2686 -11.2041 -11.2041 -10.8628 -10.8628 -10.8327 -10.8327 -0.1492 -0.1492 0.4037 0.4037 3.1967 3.1967 3.9870 3.9870 6.1124 6.1124 7.2905 7.2905 7.6248 7.6248 7.6545 7.6545 8.2608 8.2608 10.1303 10.1303 11.2704 11.2704 11.6629 11.6629 13.1486 13.1486 14.0308 14.0308 k = 0.2282 0.9221-0.0000 ( 2695 PWs) bands (ev): -31.3109 -31.3109 -31.3002 -31.3002 -12.5285 -12.5285 -12.4976 -12.4976 -11.2683 -11.2683 -11.2094 -11.2094 -10.8616 -10.8616 -10.8331 -10.8331 -0.1127 -0.1127 0.4005 0.4005 3.2185 3.2185 3.9393 3.9393 6.0914 6.0914 7.2854 7.2854 7.5992 7.5992 7.6241 7.6241 8.2673 8.2673 10.1253 10.1253 11.3046 11.3046 11.7627 11.7627 13.0341 13.0341 13.9745 13.9745 k = 0.2335 0.9436-0.0000 ( 2701 PWs) bands (ev): -31.3101 -31.3101 -31.3003 -31.3003 -12.5287 -12.5287 -12.5012 -12.5012 -11.2675 -11.2675 -11.2142 -11.2142 -10.8606 -10.8606 -10.8336 -10.8336 -0.0798 -0.0798 0.3927 0.3927 3.2430 3.2430 3.8967 3.8967 6.0731 6.0731 7.2833 7.2833 7.5768 7.5768 7.5970 7.5970 8.2749 8.2749 10.1216 10.1216 11.3424 11.3424 11.8647 11.8647 12.9214 12.9214 13.9124 13.9124 k = 0.2388 0.9650-0.0000 ( 2699 PWs) bands (ev): -31.3093 -31.3093 -31.3005 -31.3005 -12.5284 -12.5284 -12.5042 -12.5042 -11.2661 -11.2661 -11.2183 -11.2183 -10.8597 -10.8597 -10.8342 -10.8342 -0.0507 -0.0507 0.3803 0.3803 3.2704 3.2704 3.8589 3.8589 6.0573 6.0573 7.2840 7.2840 7.5574 7.5574 7.5734 7.5734 8.2837 8.2837 10.1192 10.1192 11.3835 11.3835 11.9690 11.9690 12.8106 12.8106 13.8491 13.8491 k = 0.2441 0.9865-0.0000 ( 2703 PWs) bands (ev): -31.3087 -31.3087 -31.3008 -31.3008 -12.5276 -12.5276 -12.5067 -12.5067 -11.2641 -11.2641 -11.2219 -11.2219 -10.8589 -10.8589 -10.8350 -10.8350 -0.0257 -0.0257 0.3634 0.3634 3.3011 3.3011 3.8258 3.8258 6.0441 6.0441 7.2876 7.2876 7.5411 7.5411 7.5536 7.5536 8.2938 8.2938 10.1181 10.1181 11.4277 11.4277 12.0754 12.0754 12.7019 12.7019 13.7854 13.7854 k = 0.2494 1.0079-0.0000 ( 2701 PWs) bands (ev): -31.3081 -31.3081 -31.3012 -31.3012 -12.5262 -12.5262 -12.5086 -12.5086 -11.2615 -11.2615 -11.2249 -11.2249 -10.8582 -10.8582 -10.8360 -10.8360 -0.0049 -0.0049 0.3420 0.3420 3.3352 3.3352 3.7972 3.7972 6.0334 6.0334 7.2942 7.2942 7.5279 7.5279 7.5377 7.5377 8.3052 8.3052 10.1182 10.1182 11.4751 11.4751 12.1839 12.1839 12.5952 12.5952 13.7217 13.7217 k = 0.2547 1.0294-0.0000 ( 2707 PWs) bands (ev): -31.3077 -31.3077 -31.3017 -31.3017 -12.5244 -12.5244 -12.5099 -12.5099 -11.2584 -11.2584 -11.2274 -11.2274 -10.8576 -10.8576 -10.8371 -10.8371 0.0116 0.0116 0.3162 0.3162 3.3731 3.3731 3.7727 3.7727 6.0250 6.0250 7.3038 7.3038 7.5178 7.5178 7.5258 7.5258 8.3181 8.3181 10.1196 10.1196 11.5252 11.5252 12.2945 12.2945 12.4907 12.4907 13.6580 13.6580 k = 0.2600 1.0508-0.0000 ( 2705 PWs) bands (ev): -31.3074 -31.3074 -31.3023 -31.3023 -12.5221 -12.5221 -12.5107 -12.5107 -11.2547 -11.2547 -11.2292 -11.2292 -10.8572 -10.8572 -10.8383 -10.8383 0.0235 0.0235 0.2864 0.2864 3.4149 3.4149 3.7521 3.7521 6.0189 6.0189 7.3164 7.3164 7.5108 7.5108 7.5181 7.5181 8.3327 8.3327 10.1222 10.1222 11.5779 11.5779 12.3884 12.3884 12.4071 12.4071 13.5946 13.5946 k = 0.2653 1.0723-0.0000 ( 2705 PWs) bands (ev): -31.3072 -31.3072 -31.3030 -31.3030 -12.5193 -12.5193 -12.5109 -12.5109 -11.2505 -11.2505 -11.2305 -11.2305 -10.8569 -10.8569 -10.8397 -10.8397 0.0309 0.0309 0.2526 0.2526 3.4607 3.4607 3.7350 3.7350 6.0150 6.0150 7.3320 7.3320 7.5068 7.5068 7.5148 7.5148 8.3490 8.3490 10.1259 10.1259 11.6330 11.6330 12.2885 12.2885 12.5215 12.5215 13.5315 13.5315 k = 0.2653 1.0723-0.0000 ( 2705 PWs) bands (ev): -31.3072 -31.3072 -31.3030 -31.3030 -12.5193 -12.5193 -12.5109 -12.5109 -11.2505 -11.2505 -11.2305 -11.2305 -10.8569 -10.8569 -10.8397 -10.8397 0.0309 0.0309 0.2526 0.2526 3.4607 3.4607 3.7350 3.7350 6.0150 6.0150 7.3320 7.3320 7.5068 7.5068 7.5148 7.5148 8.3490 8.3490 10.1259 10.1259 11.6330 11.6330 12.2885 12.2885 12.5215 12.5215 13.5315 13.5315 k = 0.2432 1.0723-0.0000 ( 2703 PWs) bands (ev): -31.3073 -31.3073 -31.3028 -31.3028 -12.5200 -12.5200 -12.5108 -12.5108 -11.2517 -11.2517 -11.2301 -11.2301 -10.8569 -10.8569 -10.8393 -10.8393 0.0290 0.0290 0.2618 0.2618 3.4495 3.4495 3.7380 3.7380 6.0183 6.0183 7.3277 7.3277 7.5061 7.5061 7.5091 7.5091 8.3537 8.3537 10.1197 10.1197 11.6226 11.6226 12.3097 12.3097 12.4958 12.4958 13.5327 13.5327 k = 0.2211 1.0723-0.0000 ( 2705 PWs) bands (ev): -31.3073 -31.3073 -31.3026 -31.3026 -12.5209 -12.5209 -12.5106 -12.5106 -11.2529 -11.2529 -11.2296 -11.2296 -10.8570 -10.8570 -10.8390 -10.8390 0.0259 0.0259 0.2718 0.2718 3.4391 3.4391 3.7393 3.7393 6.0268 6.0268 7.3233 7.3233 7.4851 7.4851 7.5097 7.5097 8.3751 8.3751 10.1036 10.1036 11.6186 11.6186 12.3253 12.3253 12.4750 12.4750 13.5091 13.5091 k = 0.1990 1.0723-0.0000 ( 2703 PWs) bands (ev): -31.3074 -31.3074 -31.3024 -31.3024 -12.5217 -12.5217 -12.5104 -12.5104 -11.2543 -11.2543 -11.2290 -11.2290 -10.8571 -10.8571 -10.8386 -10.8386 0.0222 0.0222 0.2821 0.2821 3.4297 3.4297 3.7391 3.7391 6.0399 6.0399 7.3189 7.3189 7.4514 7.4514 7.5117 7.5117 8.4106 8.4106 10.0781 10.0781 11.6208 11.6208 12.3345 12.3345 12.4599 12.4599 13.4694 13.4694 k = 0.1769 1.0723-0.0000 ( 2708 PWs) bands (ev): -31.3075 -31.3075 -31.3022 -31.3022 -12.5225 -12.5225 -12.5102 -12.5102 -11.2555 -11.2555 -11.2284 -11.2284 -10.8571 -10.8571 -10.8383 -10.8383 0.0181 0.0181 0.2922 0.2922 3.4217 3.4217 3.7372 3.7372 6.0572 6.0572 7.3146 7.3146 7.4094 7.4094 7.5139 7.5139 8.4567 8.4567 10.0446 10.0446 11.6283 11.6283 12.3369 12.3369 12.4513 12.4513 13.4218 13.4218 k = 0.1548 1.0723-0.0000 ( 2702 PWs) bands (ev): -31.3077 -31.3077 -31.3019 -31.3019 -12.5232 -12.5232 -12.5099 -12.5099 -11.2567 -11.2567 -11.2278 -11.2278 -10.8572 -10.8572 -10.8379 -10.8379 0.0141 0.0141 0.3019 0.3019 3.4149 3.4149 3.7342 3.7342 6.0778 6.0778 7.3106 7.3106 7.3625 7.3625 7.5162 7.5162 8.5095 8.5095 10.0048 10.0048 11.6399 11.6399 12.3336 12.3336 12.4482 12.4482 13.3721 13.3721 k = 0.1327 1.0723-0.0000 ( 2703 PWs) bands (ev): -31.3078 -31.3078 -31.3018 -31.3018 -12.5239 -12.5239 -12.5097 -12.5097 -11.2578 -11.2578 -11.2272 -11.2272 -10.8573 -10.8573 -10.8376 -10.8376 0.0102 0.0102 0.3107 0.3107 3.4094 3.4094 3.7302 3.7302 6.1007 6.1007 7.3067 7.3067 7.3144 7.3144 7.5184 7.5184 8.5657 8.5657 9.9608 9.9608 11.6543 11.6543 12.3268 12.3268 12.4486 12.4486 13.3239 13.3239 k = 0.1105 1.0723-0.0000 ( 2703 PWs) bands (ev): -31.3079 -31.3079 -31.3016 -31.3016 -12.5245 -12.5245 -12.5095 -12.5095 -11.2588 -11.2588 -11.2267 -11.2267 -10.8573 -10.8573 -10.8374 -10.8374 0.0068 0.0068 0.3186 0.3186 3.4051 3.4051 3.7258 3.7258 6.1245 6.1245 7.2669 7.2669 7.3039 7.3039 7.5205 7.5205 8.6222 8.6222 9.9151 9.9151 11.6699 11.6699 12.3189 12.3189 12.4506 12.4506 13.2796 13.2796 k = 0.0884 1.0723-0.0000 ( 2698 PWs) bands (ev): -31.3079 -31.3079 -31.3014 -31.3014 -12.5249 -12.5249 -12.5093 -12.5093 -11.2596 -11.2596 -11.2262 -11.2262 -10.8573 -10.8573 -10.8372 -10.8372 0.0038 0.0038 0.3253 0.3253 3.4019 3.4019 3.7214 3.7214 6.1477 6.1477 7.2236 7.2236 7.3012 7.3012 7.5223 7.5223 8.6756 8.6756 9.8705 9.8705 11.6853 11.6853 12.3112 12.3112 12.4530 12.4530 13.2409 13.2409 k = 0.0663 1.0723-0.0000 ( 2698 PWs) bands (ev): -31.3080 -31.3080 -31.3013 -31.3013 -12.5253 -12.5253 -12.5092 -12.5092 -11.2602 -11.2602 -11.2259 -11.2259 -10.8574 -10.8574 -10.8370 -10.8370 0.0014 0.0014 0.3306 0.3306 3.3995 3.3995 3.7175 3.7175 6.1685 6.1685 7.1865 7.1865 7.2991 7.2991 7.5237 7.5237 8.7227 8.7227 9.8302 9.8302 11.6989 11.6989 12.3047 12.3047 12.4551 12.4551 13.2093 13.2093 k = 0.0442 1.0723-0.0000 ( 2694 PWs) bands (ev): -31.3080 -31.3080 -31.3013 -31.3013 -12.5256 -12.5256 -12.5091 -12.5091 -11.2607 -11.2607 -11.2256 -11.2256 -10.8574 -10.8574 -10.8369 -10.8369 -0.0004 -0.0004 0.3344 0.3344 3.3980 3.3980 3.7144 3.7144 6.1852 6.1852 7.1580 7.1580 7.2975 7.2975 7.5248 7.5248 8.7601 8.7601 9.7977 9.7977 11.7096 11.7096 12.2998 12.2998 12.4567 12.4567 13.1858 13.1858 k = 0.0221 1.0723-0.0000 ( 2696 PWs) bands (ev): -31.3081 -31.3081 -31.3012 -31.3012 -12.5257 -12.5257 -12.5090 -12.5090 -11.2609 -11.2609 -11.2255 -11.2255 -10.8574 -10.8574 -10.8368 -10.8368 -0.0014 -0.0014 0.3368 0.3368 3.3971 3.3971 3.7124 3.7124 6.1961 6.1961 7.1400 7.1400 7.2966 7.2966 7.5255 7.5255 8.7842 8.7842 9.7764 9.7764 11.7165 11.7165 12.2968 12.2968 12.4576 12.4576 13.1714 13.1714 k = 0.0000 1.0723-0.0000 ( 2692 PWs) bands (ev): -31.3081 -31.3081 -31.3012 -31.3012 -12.5258 -12.5258 -12.5090 -12.5090 -11.2610 -11.2610 -11.2254 -11.2254 -10.8574 -10.8574 -10.8368 -10.8368 -0.0018 -0.0018 0.3376 0.3376 3.3969 3.3969 3.7117 3.7117 6.1999 6.1999 7.1338 7.1338 7.2963 7.2963 7.5257 7.5257 8.7926 8.7926 9.7690 9.7690 11.7189 11.7189 12.2958 12.2958 12.4580 12.4580 13.1665 13.1665 k = 0.0000 1.0723-0.0000 ( 2692 PWs) bands (ev): -31.3081 -31.3081 -31.3012 -31.3012 -12.5258 -12.5258 -12.5090 -12.5090 -11.2610 -11.2610 -11.2254 -11.2254 -10.8574 -10.8574 -10.8368 -10.8368 -0.0018 -0.0018 0.3376 0.3376 3.3969 3.3969 3.7117 3.7117 6.1999 6.1999 7.1338 7.1338 7.2963 7.2963 7.5257 7.5257 8.7926 8.7926 9.7690 9.7690 11.7189 11.7189 12.2958 12.2958 12.4580 12.4580 13.1665 13.1665 k = 0.0000 1.0723 0.0221 ( 2692 PWs) bands (ev): -31.3080 -31.3080 -31.3012 -31.3012 -12.5258 -12.5258 -12.5090 -12.5090 -11.2610 -11.2610 -11.2254 -11.2254 -10.8577 -10.8577 -10.8371 -10.8371 -0.0030 -0.0030 0.3363 0.3363 3.3979 3.3979 3.7129 3.7129 6.2009 6.2009 7.1351 7.1351 7.2976 7.2976 7.5271 7.5271 8.7931 8.7931 9.7673 9.7673 11.7145 11.7145 12.2715 12.2715 12.4623 12.4623 13.1922 13.1922 k = 0.0000 1.0723 0.0442 ( 2692 PWs) bands (ev): -31.3079 -31.3079 -31.3011 -31.3011 -12.5258 -12.5258 -12.5090 -12.5090 -11.2607 -11.2607 -11.2252 -11.2252 -10.8588 -10.8588 -10.8380 -10.8380 -0.0065 -0.0065 0.3325 0.3325 3.4011 3.4011 3.7164 3.7164 6.2038 6.2038 7.1387 7.1387 7.3016 7.3016 7.5312 7.5312 8.7946 8.7946 9.7621 9.7621 11.7019 11.7019 12.2057 12.2057 12.4747 12.4747 13.2621 13.2621 k = 0.0000 1.0723 0.0663 ( 2696 PWs) bands (ev): -31.3078 -31.3078 -31.3009 -31.3009 -12.5258 -12.5258 -12.5090 -12.5090 -11.2603 -11.2603 -11.2250 -11.2250 -10.8606 -10.8606 -10.8396 -10.8396 -0.0125 -0.0125 0.3262 0.3262 3.4064 3.4064 3.7223 3.7223 6.2088 6.2088 7.1447 7.1447 7.3083 7.3083 7.5380 7.5380 8.7970 8.7970 9.7536 9.7536 11.6820 11.6820 12.1123 12.1123 12.4942 12.4942 13.3623 13.3623 k = 0.0000 1.0723 0.0884 ( 2706 PWs) bands (ev): -31.3076 -31.3076 -31.3008 -31.3008 -12.5259 -12.5259 -12.5090 -12.5090 -11.2597 -11.2597 -11.2246 -11.2246 -10.8630 -10.8630 -10.8417 -10.8417 -0.0207 -0.0207 0.3175 0.3175 3.4138 3.4138 3.7305 3.7305 6.2157 6.2157 7.1531 7.1531 7.3175 7.3175 7.5473 7.5473 8.8004 8.8004 9.7417 9.7417 11.6562 11.6562 12.0029 12.0029 12.5191 12.5191 13.4813 13.4813 k = 0.0000 1.0723 0.1105 ( 2706 PWs) bands (ev): -31.3074 -31.3074 -31.3005 -31.3005 -12.5259 -12.5259 -12.5090 -12.5090 -11.2590 -11.2590 -11.2242 -11.2242 -10.8662 -10.8662 -10.8445 -10.8445 -0.0311 -0.0311 0.3064 0.3064 3.4232 3.4232 3.7410 3.7410 6.2245 6.2245 7.1639 7.1639 7.3293 7.3293 7.5592 7.5592 8.8047 8.8047 9.7268 9.7268 11.6258 11.6258 11.8845 11.8845 12.5478 12.5478 13.6119 13.6119 k = 0.0000 1.0723 0.1326 ( 2706 PWs) bands (ev): -31.3071 -31.3071 -31.3002 -31.3002 -12.5259 -12.5259 -12.5090 -12.5090 -11.2581 -11.2581 -11.2236 -11.2236 -10.8699 -10.8699 -10.8478 -10.8478 -0.0437 -0.0437 0.2929 0.2929 3.4347 3.4347 3.7537 3.7537 6.2353 6.2353 7.1769 7.1769 7.3433 7.3433 7.5735 7.5735 8.8099 8.8099 9.7090 9.7090 11.5920 11.5920 11.7614 11.7614 12.5788 12.5788 13.7500 13.7500 k = 0.0000 1.0723 0.1547 ( 2708 PWs) bands (ev): -31.3067 -31.3067 -31.2999 -31.2999 -12.5260 -12.5260 -12.5090 -12.5090 -11.2571 -11.2571 -11.2230 -11.2230 -10.8743 -10.8743 -10.8516 -10.8516 -0.0585 -0.0585 0.2772 0.2772 3.4481 3.4481 3.7686 3.7686 6.2481 6.2481 7.1923 7.1923 7.3597 7.3597 7.5900 7.5900 8.8161 8.8161 9.6884 9.6884 11.5555 11.5555 11.6362 11.6362 12.6109 12.6109 13.8930 13.8930 k = 0.0000 1.0723 0.1768 ( 2712 PWs) bands (ev): -31.3063 -31.3063 -31.2995 -31.2995 -12.5261 -12.5261 -12.5090 -12.5090 -11.2560 -11.2560 -11.2223 -11.2223 -10.8792 -10.8792 -10.8559 -10.8559 -0.0752 -0.0752 0.2594 0.2594 3.4634 3.4634 3.7856 3.7856 6.2627 6.2627 7.2099 7.2099 7.3781 7.3781 7.6085 7.6085 8.8232 8.8232 9.6655 9.6655 11.5021 11.5021 11.5252 11.5252 12.6431 12.6431 14.0394 14.0394 k = 0.0000 1.0723 0.1989 ( 2714 PWs) bands (ev): -31.3059 -31.3059 -31.2990 -31.2990 -12.5262 -12.5262 -12.5090 -12.5090 -11.2547 -11.2547 -11.2216 -11.2216 -10.8847 -10.8847 -10.8608 -10.8608 -0.0938 -0.0938 0.2397 0.2397 3.4805 3.4805 3.8046 3.8046 6.2793 6.2793 7.2296 7.2296 7.3984 7.3984 7.6289 7.6289 8.8311 8.8311 9.6405 9.6405 11.3799 11.3799 11.4819 11.4819 12.6746 12.6746 14.1881 14.1881 k = 0.0000 1.0723 0.2210 ( 2716 PWs) bands (ev): -31.3054 -31.3054 -31.2985 -31.2985 -12.5263 -12.5263 -12.5090 -12.5090 -11.2533 -11.2533 -11.2208 -11.2208 -10.8907 -10.8907 -10.8660 -10.8660 -0.1142 -0.1142 0.2180 0.2180 3.4994 3.4994 3.8256 3.8256 6.2976 6.2976 7.2514 7.2514 7.4204 7.4204 7.6508 7.6508 8.8399 8.8399 9.6139 9.6139 11.2537 11.2537 11.4423 11.4423 12.7050 12.7050 14.3382 14.3382 k = 0.0000 1.0723 0.2431 ( 2712 PWs) bands (ev): -31.3048 -31.3048 -31.2980 -31.2980 -12.5265 -12.5265 -12.5091 -12.5091 -11.2518 -11.2518 -11.2199 -11.2199 -10.8971 -10.8971 -10.8716 -10.8716 -0.1362 -0.1362 0.1946 0.1946 3.5200 3.5200 3.8484 3.8484 6.3178 6.3178 7.2752 7.2752 7.4440 7.4440 7.6741 7.6741 8.8496 8.8496 9.5859 9.5859 11.1282 11.1282 11.4023 11.4023 12.7340 12.7340 14.4891 14.4891 k = 0.0000 1.0723 0.2652 ( 2708 PWs) bands (ev): -31.3042 -31.3042 -31.2974 -31.2974 -12.5267 -12.5267 -12.5092 -12.5092 -11.2502 -11.2502 -11.2191 -11.2191 -10.9039 -10.9039 -10.8776 -10.8776 -0.1597 -0.1597 0.1696 0.1696 3.5421 3.5421 3.8729 3.8729 6.3397 6.3397 7.3009 7.3009 7.4689 7.4689 7.6985 7.6985 8.8602 8.8602 9.5571 9.5571 11.0038 11.0038 11.3618 11.3618 12.7615 12.7615 14.6399 14.6399 k = 0.0000 1.0723 0.2873 ( 2704 PWs) bands (ev): -31.3036 -31.3036 -31.2968 -31.2968 -12.5269 -12.5269 -12.5094 -12.5094 -11.2486 -11.2486 -11.2182 -11.2182 -10.9110 -10.9110 -10.8839 -10.8839 -0.1846 -0.1846 0.1433 0.1433 3.5658 3.5658 3.8990 3.8990 6.3632 6.3632 7.3284 7.3284 7.4949 7.4949 7.7236 7.7236 8.8716 8.8716 9.5279 9.5279 10.8809 10.8809 11.3207 11.3207 12.7878 12.7878 14.7882 14.7882 k = 0.0000 1.0723 0.3094 ( 2704 PWs) bands (ev): -31.3030 -31.3030 -31.2961 -31.2961 -12.5272 -12.5272 -12.5095 -12.5095 -11.2468 -11.2468 -11.2173 -11.2173 -10.9184 -10.9184 -10.8904 -10.8904 -0.2106 -0.2106 0.1156 0.1156 3.5908 3.5908 3.9265 3.9265 6.3883 6.3883 7.3575 7.3575 7.5217 7.5217 7.7493 7.7493 8.8839 8.8839 9.4989 9.4989 10.7596 10.7596 11.2789 11.2789 12.8129 12.8129 14.8034 14.8034 k = 0.0000 1.0723 0.3315 ( 2702 PWs) bands (ev): -31.3023 -31.3023 -31.2954 -31.2954 -12.5275 -12.5275 -12.5098 -12.5098 -11.2450 -11.2450 -11.2165 -11.2165 -10.9261 -10.9261 -10.8971 -10.8971 -0.2378 -0.2378 0.0868 0.0868 3.6171 3.6171 3.9554 3.9554 6.4149 6.4149 7.3881 7.3881 7.5491 7.5491 7.7752 7.7752 8.8971 8.8971 9.4704 9.4704 10.6400 10.6400 11.2364 11.2364 12.8372 12.8372 14.7724 14.7724 k = 0.0000 1.0723 0.3536 ( 2700 PWs) bands (ev): -31.3016 -31.3016 -31.2947 -31.2947 -12.5278 -12.5278 -12.5101 -12.5101 -11.2432 -11.2432 -11.2157 -11.2157 -10.9339 -10.9339 -10.9039 -10.9039 -0.2658 -0.2658 0.0571 0.0571 3.6446 3.6446 3.9854 3.9854 6.4428 6.4428 7.4201 7.4201 7.5770 7.5770 7.8009 7.8009 8.9113 8.9113 9.4429 9.4429 10.5224 10.5224 11.1929 11.1929 12.8610 12.8610 14.7452 14.7452 k = 0.0000 1.0723 0.3757 ( 2702 PWs) bands (ev): -31.3008 -31.3008 -31.2940 -31.2940 -12.5282 -12.5282 -12.5104 -12.5104 -11.2414 -11.2414 -11.2150 -11.2150 -10.9418 -10.9418 -10.9108 -10.9108 -0.2946 -0.2946 0.0267 0.0267 3.6732 3.6732 4.0165 4.0165 6.4720 6.4720 7.4531 7.4531 7.6050 7.6050 7.8263 7.8263 8.9264 8.9264 9.4170 9.4170 10.4067 10.4067 11.1484 11.1484 12.8847 12.8847 14.7225 14.7225 k = 0.0000 1.0723 0.3978 ( 2702 PWs) bands (ev): -31.3001 -31.3001 -31.2932 -31.2932 -12.5287 -12.5287 -12.5108 -12.5108 -11.2396 -11.2396 -11.2143 -11.2143 -10.9498 -10.9498 -10.9177 -10.9177 -0.3240 -0.3240 -0.0043 -0.0043 3.7026 3.7026 4.0484 4.0484 6.5023 6.5023 7.4871 7.4871 7.6330 7.6330 7.8509 7.8509 8.9425 8.9425 9.3931 9.3931 10.2932 10.2932 11.1028 11.1028 12.9087 12.9087 14.7045 14.7045 k = 0.0000 1.0723 0.4199 ( 2702 PWs) bands (ev): -31.2993 -31.2993 -31.2925 -31.2925 -12.5291 -12.5291 -12.5113 -12.5113 -11.2378 -11.2378 -11.2138 -11.2138 -10.9578 -10.9578 -10.9246 -10.9246 -0.3537 -0.3537 -0.0358 -0.0358 3.7329 3.7329 4.0811 4.0811 6.5336 6.5336 7.5218 7.5218 7.6607 7.6607 7.8746 7.8746 8.9597 8.9597 9.3717 9.3717 10.1819 10.1819 11.0560 11.0560 12.9331 12.9331 14.6913 14.6913 k = 0.0000 1.0723 0.4419 ( 2702 PWs) bands (ev): -31.2985 -31.2985 -31.2917 -31.2917 -12.5297 -12.5297 -12.5118 -12.5118 -11.2360 -11.2360 -11.2133 -11.2133 -10.9657 -10.9657 -10.9313 -10.9313 -0.3838 -0.3838 -0.0675 -0.0675 3.7639 3.7639 4.1142 4.1142 6.5657 6.5657 7.5568 7.5568 7.6879 7.6879 7.8970 7.8970 8.9780 8.9780 9.3531 9.3531 10.0729 10.0729 11.0082 11.0082 12.9584 12.9584 14.6831 14.6831 k = 0.0000 1.0723 0.4640 ( 2704 PWs) bands (ev): -31.2977 -31.2977 -31.2909 -31.2909 -12.5303 -12.5303 -12.5124 -12.5124 -11.2343 -11.2343 -11.2130 -11.2130 -10.9736 -10.9736 -10.9379 -10.9379 -0.4139 -0.4139 -0.0993 -0.0993 3.7954 3.7954 4.1477 4.1477 6.5986 6.5986 7.5920 7.5920 7.7145 7.7145 7.9181 7.9181 8.9975 8.9975 9.3378 9.3378 9.9663 9.9663 10.9594 10.9594 12.9845 12.9845 14.6798 14.6798 k = 0.0000 1.0723 0.4861 ( 2702 PWs) bands (ev): -31.2969 -31.2969 -31.2901 -31.2901 -12.5309 -12.5309 -12.5131 -12.5131 -11.2327 -11.2327 -11.2129 -11.2129 -10.9812 -10.9812 -10.9444 -10.9444 -0.4440 -0.4440 -0.1310 -0.1310 3.8273 3.8273 4.1814 4.1814 6.6320 6.6320 7.6269 7.6269 7.7403 7.7403 7.9376 7.9376 9.0180 9.0180 9.3260 9.3260 9.8622 9.8622 10.9096 10.9096 13.0117 13.0117 14.6816 14.6816 k = 0.0000 1.0723 0.5082 ( 2706 PWs) bands (ev): -31.2961 -31.2961 -31.2893 -31.2893 -12.5316 -12.5316 -12.5138 -12.5138 -11.2311 -11.2311 -11.2128 -11.2128 -10.9887 -10.9887 -10.9505 -10.9505 -0.4739 -0.4739 -0.1625 -0.1625 3.8595 3.8595 4.2151 4.2151 6.6659 6.6659 7.6611 7.6611 7.7653 7.7653 7.9556 7.9556 9.0396 9.0396 9.3180 9.3180 9.7607 9.7607 10.8589 10.8589 13.0399 13.0399 14.6882 14.6882 k = 0.0000 1.0723 0.5303 ( 2702 PWs) bands (ev): -31.2953 -31.2953 -31.2885 -31.2885 -12.5323 -12.5323 -12.5146 -12.5146 -11.2297 -11.2297 -11.2130 -11.2130 -10.9959 -10.9959 -10.9564 -10.9564 -0.5035 -0.5035 -0.1935 -0.1935 3.8918 3.8918 4.2486 4.2486 6.7001 6.7001 7.6941 7.6941 7.7892 7.7892 7.9720 7.9720 9.0623 9.0623 9.3139 9.3139 9.6620 9.6620 10.8076 10.8076 13.0691 13.0691 14.6998 14.6998 k = 0.0000 1.0723 0.5524 ( 2700 PWs) bands (ev): -31.2945 -31.2945 -31.2878 -31.2878 -12.5330 -12.5330 -12.5154 -12.5154 -11.2285 -11.2285 -11.2133 -11.2133 -11.0028 -11.0028 -10.9620 -10.9620 -0.5326 -0.5326 -0.2241 -0.2241 3.9240 3.9240 4.2818 4.2818 6.7344 6.7344 7.7255 7.7255 7.8122 7.8122 7.9871 7.9871 9.0859 9.0859 9.3139 9.3139 9.5663 9.5663 10.7558 10.7558 13.0991 13.0991 14.7162 14.7162 k = 0.0000 1.0723 0.5745 ( 2692 PWs) bands (ev): -31.2937 -31.2937 -31.2870 -31.2870 -12.5338 -12.5338 -12.5163 -12.5163 -11.2273 -11.2273 -11.2138 -11.2138 -11.0093 -11.0093 -10.9672 -10.9672 -0.5610 -0.5610 -0.2539 -0.2539 3.9561 3.9561 4.3145 4.3145 6.7687 6.7687 7.7547 7.7547 7.8342 7.8342 8.0011 8.0011 9.1100 9.1100 9.3178 9.3178 9.4739 9.4739 10.7037 10.7037 13.1297 13.1297 14.7372 14.7372 k = 0.0000 1.0723 0.5966 ( 2692 PWs) bands (ev): -31.2930 -31.2930 -31.2862 -31.2862 -12.5346 -12.5346 -12.5172 -12.5172 -11.2263 -11.2263 -11.2144 -11.2144 -11.0155 -11.0155 -10.9721 -10.9721 -0.5887 -0.5887 -0.2830 -0.2830 3.9878 3.9878 4.3465 4.3465 6.8028 6.8028 7.7811 7.7811 7.8551 7.8551 8.0144 8.0144 9.1340 9.1340 9.3253 9.3253 9.3857 9.3857 10.6514 10.6514 13.1607 13.1607 14.7628 14.7628 k = 0.0000 1.0723 0.6187 ( 2692 PWs) bands (ev): -31.2923 -31.2923 -31.2855 -31.2855 -12.5354 -12.5354 -12.5182 -12.5182 -11.2255 -11.2255 -11.2152 -11.2152 -11.0214 -11.0214 -10.9766 -10.9766 -0.6155 -0.6155 -0.3111 -0.3111 4.0190 4.0190 4.3776 4.3776 6.8367 6.8367 7.8045 7.8045 7.8746 7.8746 8.0274 8.0274 9.1555 9.1555 9.3020 9.3020 9.3386 9.3386 10.5992 10.5992 13.1918 13.1918 14.7927 14.7927 k = 0.0000 1.0723 0.6408 ( 2694 PWs) bands (ev): -31.2915 -31.2915 -31.2848 -31.2848 -12.5362 -12.5362 -12.5192 -12.5192 -11.2249 -11.2249 -11.2161 -11.2161 -11.0268 -11.0268 -10.9807 -10.9807 -0.6413 -0.6413 -0.3381 -0.3381 4.0495 4.0495 4.4077 4.4077 6.8701 6.8701 7.8249 7.8249 7.8923 7.8923 8.0408 8.0408 9.1600 9.1600 9.2412 9.2412 9.3533 9.3533 10.5473 10.5473 13.2226 13.2226 14.8268 14.8268 k = 0.0000 1.0723 0.6629 ( 2694 PWs) bands (ev): -31.2908 -31.2908 -31.2841 -31.2841 -12.5371 -12.5371 -12.5202 -12.5202 -11.2244 -11.2244 -11.2171 -11.2171 -11.0317 -11.0317 -10.9844 -10.9844 -0.6659 -0.6659 -0.3639 -0.3639 4.0791 4.0791 4.4366 4.4366 6.9029 6.9029 7.8422 7.8422 7.9078 7.9078 8.0549 8.0549 9.1111 9.1111 9.2369 9.2369 9.3718 9.3718 10.4958 10.4958 13.2528 13.2528 14.8648 14.8648 k = 0.0000 1.0723 0.6850 ( 2698 PWs) bands (ev): -31.2902 -31.2902 -31.2835 -31.2835 -12.5379 -12.5379 -12.5212 -12.5212 -11.2241 -11.2241 -11.2182 -11.2182 -11.0363 -11.0363 -10.9877 -10.9877 -0.6894 -0.6894 -0.3884 -0.3884 4.1077 4.1077 4.4642 4.4642 6.9350 6.9350 7.8569 7.8569 7.9206 7.9206 8.0698 8.0698 9.0407 9.0407 9.2577 9.2577 9.3935 9.3935 10.4450 10.4450 13.2822 13.2822 14.9064 14.9064 k = 0.0000 1.0723 0.7071 ( 2698 PWs) bands (ev): -31.2896 -31.2896 -31.2828 -31.2828 -12.5387 -12.5387 -12.5222 -12.5222 -11.2240 -11.2240 -11.2194 -11.2194 -11.0404 -11.0404 -10.9907 -10.9907 -0.7115 -0.7115 -0.4116 -0.4116 4.1351 4.1351 4.4904 4.4904 6.9662 6.9662 7.8692 7.8692 7.9306 7.9306 8.0854 8.0854 8.9697 8.9697 9.2826 9.2826 9.4179 9.4179 10.3948 10.3948 13.3102 13.3102 14.9515 14.9515 k = 0.0000 1.0723 0.7292 ( 2702 PWs) bands (ev): -31.2890 -31.2890 -31.2823 -31.2823 -12.5395 -12.5395 -12.5231 -12.5231 -11.2239 -11.2239 -11.2206 -11.2206 -11.0440 -11.0440 -10.9933 -10.9933 -0.7322 -0.7322 -0.4332 -0.4332 4.1611 4.1611 4.5149 4.5149 6.9964 6.9964 7.8797 7.8797 7.9382 7.9382 8.1013 8.1013 8.9015 8.9015 9.3082 9.3082 9.4446 9.4446 10.3455 10.3455 13.3367 13.3367 14.9996 14.9996 k = 0.0000 1.0723 0.7513 ( 2704 PWs) bands (ev): -31.2884 -31.2884 -31.2817 -31.2817 -12.5402 -12.5402 -12.5241 -12.5241 -11.2241 -11.2241 -11.2219 -11.2219 -11.0473 -11.0473 -10.9956 -10.9956 -0.7514 -0.7514 -0.4532 -0.4532 4.1856 4.1856 4.5378 4.5378 7.0253 7.0253 7.8885 7.8885 7.9436 7.9436 8.1170 8.1170 8.8371 8.8371 9.3334 9.3334 9.4734 9.4734 10.2972 10.2972 13.3613 13.3613 15.0504 15.0504 k = 0.0000 1.0723 0.7734 ( 2704 PWs) bands (ev): -31.2879 -31.2879 -31.2812 -31.2812 -12.5409 -12.5409 -12.5250 -12.5250 -11.2243 -11.2243 -11.2230 -11.2230 -11.0501 -11.0501 -10.9975 -10.9975 -0.7691 -0.7691 -0.4716 -0.4716 4.2084 4.2084 4.5588 4.5588 7.0527 7.0527 7.8959 7.8959 7.9474 7.9474 8.1320 8.1320 8.7770 8.7770 9.3577 9.3577 9.5039 9.5039 10.2500 10.2500 13.3838 13.3838 15.1034 15.1034 k = 0.0000 1.0723 0.7955 ( 2702 PWs) bands (ev): -31.2875 -31.2875 -31.2808 -31.2808 -12.5416 -12.5416 -12.5258 -12.5258 -11.2247 -11.2247 -11.2241 -11.2241 -11.0526 -11.0526 -10.9992 -10.9992 -0.7850 -0.7850 -0.4883 -0.4883 4.2292 4.2292 4.5779 4.5779 7.0785 7.0785 7.9021 7.9021 7.9500 7.9500 8.1459 8.1459 8.7217 8.7217 9.3806 9.3806 9.5358 9.5358 10.2039 10.2039 13.4041 13.4041 15.1574 15.1574 k = 0.0000 1.0723 0.8176 ( 2704 PWs) bands (ev): -31.2871 -31.2871 -31.2804 -31.2804 -12.5422 -12.5422 -12.5266 -12.5266 -11.2255 -11.2255 -11.2247 -11.2247 -11.0547 -11.0547 -11.0006 -11.0006 -0.7992 -0.7992 -0.5031 -0.5031 4.2481 4.2481 4.5950 4.5950 7.1023 7.1023 7.9073 7.9073 7.9516 7.9516 8.1584 8.1584 8.6715 8.6715 9.4019 9.4019 9.5688 9.5688 10.1590 10.1590 13.4220 13.4220 15.2086 15.2086 k = 0.0000 1.0723 0.8397 ( 2702 PWs) bands (ev): -31.2867 -31.2867 -31.2800 -31.2800 -12.5427 -12.5427 -12.5273 -12.5273 -11.2265 -11.2265 -11.2251 -11.2251 -11.0564 -11.0564 -11.0018 -11.0018 -0.8117 -0.8117 -0.5161 -0.5161 4.2647 4.2647 4.6099 4.6099 7.1239 7.1239 7.9117 7.9117 7.9525 7.9525 8.1693 8.1693 8.6269 8.6269 9.4210 9.4210 9.6025 9.6025 10.1155 10.1155 13.4374 13.4374 15.2460 15.2460 k = 0.0000 1.0723 0.8618 ( 2702 PWs) bands (ev): -31.2864 -31.2864 -31.2797 -31.2797 -12.5432 -12.5432 -12.5279 -12.5279 -11.2274 -11.2274 -11.2255 -11.2255 -11.0579 -11.0579 -11.0027 -11.0027 -0.8223 -0.8223 -0.5271 -0.5271 4.2791 4.2791 4.6227 4.6227 7.1429 7.1429 7.9153 7.9153 7.9529 7.9529 8.1786 8.1786 8.5883 8.5883 9.4378 9.4378 9.6365 9.6365 10.0736 10.0736 13.4504 13.4504 15.2700 15.2700 k = 0.0000 1.0723 0.8839 ( 2702 PWs) bands (ev): -31.2861 -31.2861 -31.2794 -31.2794 -12.5436 -12.5436 -12.5284 -12.5284 -11.2281 -11.2281 -11.2258 -11.2258 -11.0590 -11.0590 -11.0035 -11.0035 -0.8310 -0.8310 -0.5363 -0.5363 4.2910 4.2910 4.6332 4.6332 7.1591 7.1591 7.9183 7.9183 7.9531 7.9531 8.1861 8.1861 8.5560 8.5560 9.4519 9.4519 9.6704 9.6704 10.0335 10.0335 13.4609 13.4609 15.2889 15.2889 k = 0.0000 1.0723 0.9060 ( 2708 PWs) bands (ev): -31.2860 -31.2860 -31.2793 -31.2793 -12.5439 -12.5439 -12.5288 -12.5288 -11.2287 -11.2287 -11.2261 -11.2261 -11.0599 -11.0599 -11.0041 -11.0041 -0.8379 -0.8379 -0.5434 -0.5434 4.3003 4.3003 4.6415 4.6415 7.1721 7.1721 7.9205 7.9205 7.9530 7.9530 8.1918 8.1918 8.5305 8.5305 9.4631 9.4631 9.7031 9.7031 9.9961 9.9961 13.4690 13.4690 15.3044 15.3044 k = 0.0000 1.0723 0.9281 ( 2706 PWs) bands (ev): -31.2858 -31.2858 -31.2791 -31.2791 -12.5441 -12.5441 -12.5291 -12.5291 -11.2291 -11.2291 -11.2263 -11.2263 -11.0605 -11.0605 -11.0045 -11.0045 -0.8428 -0.8428 -0.5485 -0.5485 4.3071 4.3071 4.6474 4.6474 7.1816 7.1816 7.9221 7.9221 7.9529 7.9529 8.1959 8.1959 8.5120 8.5120 9.4713 9.4713 9.7329 9.7329 9.9632 9.9632 13.4747 13.4747 15.3160 15.3160 k = 0.0000 1.0723 0.9502 ( 2706 PWs) bands (ev): -31.2857 -31.2857 -31.2790 -31.2790 -12.5443 -12.5443 -12.5293 -12.5293 -11.2294 -11.2294 -11.2264 -11.2264 -11.0609 -11.0609 -11.0047 -11.0047 -0.8457 -0.8457 -0.5516 -0.5516 4.3112 4.3112 4.6509 4.6509 7.1874 7.1874 7.9231 7.9231 7.9529 7.9529 8.1983 8.1983 8.5008 8.5008 9.4762 9.4762 9.7558 9.7558 9.9384 9.9384 13.4782 13.4782 15.3233 15.3233 k = 0.0000 1.0723 0.9723 ( 2708 PWs) bands (ev): -31.2857 -31.2857 -31.2790 -31.2790 -12.5443 -12.5443 -12.5294 -12.5294 -11.2295 -11.2295 -11.2264 -11.2264 -11.0610 -11.0610 -11.0048 -11.0048 -0.8467 -0.8467 -0.5526 -0.5526 4.3125 4.3125 4.6521 4.6521 7.1893 7.1893 7.9234 7.9234 7.9528 7.9528 8.1992 8.1992 8.4971 8.4971 9.4779 9.4779 9.7650 9.7650 9.9286 9.9286 13.4793 13.4793 15.3258 15.3258 k = 0.0000 1.0723 0.9723 ( 2708 PWs) bands (ev): -31.2857 -31.2857 -31.2790 -31.2790 -12.5443 -12.5443 -12.5294 -12.5294 -11.2295 -11.2295 -11.2264 -11.2264 -11.0610 -11.0610 -11.0048 -11.0048 -0.8467 -0.8467 -0.5526 -0.5526 4.3125 4.3125 4.6521 4.6521 7.1893 7.1893 7.9234 7.9234 7.9528 7.9528 8.1992 8.1992 8.4971 8.4971 9.4779 9.4779 9.7650 9.7650 9.9286 9.9286 13.4793 13.4793 15.3258 15.3258 k = 0.0221 1.0723 0.9723 ( 2708 PWs) bands (ev): -31.2857 -31.2857 -31.2790 -31.2790 -12.5443 -12.5443 -12.5294 -12.5294 -11.2297 -11.2297 -11.2262 -11.2262 -11.0610 -11.0610 -11.0048 -11.0048 -0.8465 -0.8465 -0.5528 -0.5528 4.3140 4.3140 4.6509 4.6509 7.1886 7.1886 7.9227 7.9227 7.9536 7.9536 8.2001 8.2001 8.4965 8.4965 9.4708 9.4708 9.7653 9.7653 9.9362 9.9362 13.4783 13.4783 15.3194 15.3194 k = 0.0442 1.0723 0.9723 ( 2704 PWs) bands (ev): -31.2857 -31.2857 -31.2791 -31.2791 -12.5442 -12.5442 -12.5294 -12.5294 -11.2301 -11.2301 -11.2256 -11.2256 -11.0609 -11.0609 -11.0050 -11.0050 -0.8458 -0.8458 -0.5534 -0.5534 4.3184 4.3184 4.6473 4.6473 7.1863 7.1863 7.9208 7.9208 7.9557 7.9557 8.2031 8.2031 8.4950 8.4950 9.4509 9.4509 9.7665 9.7665 9.9573 9.9573 13.4753 13.4753 15.3020 15.3020 k = 0.0663 1.0723 0.9723 ( 2706 PWs) bands (ev): -31.2856 -31.2856 -31.2791 -31.2791 -12.5440 -12.5440 -12.5295 -12.5295 -11.2307 -11.2307 -11.2248 -11.2248 -11.0607 -11.0607 -11.0054 -11.0054 -0.8447 -0.8447 -0.5544 -0.5544 4.3256 4.3256 4.6412 4.6412 7.1826 7.1826 7.9178 7.9178 7.9589 7.9589 8.2078 8.2078 8.4926 8.4926 9.4219 9.4219 9.7685 9.7685 9.9882 9.9882 13.4708 13.4708 15.2780 15.2780 k = 0.0884 1.0723 0.9723 ( 2706 PWs) bands (ev): -31.2856 -31.2856 -31.2792 -31.2792 -12.5437 -12.5437 -12.5296 -12.5296 -11.2311 -11.2311 -11.2240 -11.2240 -11.0605 -11.0605 -11.0058 -11.0058 -0.8432 -0.8432 -0.5558 -0.5558 4.3358 4.3358 4.6327 4.6327 7.1776 7.1776 7.9139 7.9139 7.9629 7.9629 8.2140 8.2140 8.4895 8.4895 9.3877 9.3877 9.7714 9.7714 10.0248 10.0248 13.4650 13.4650 15.2511 15.2511 k = 0.1105 1.0723 0.9723 ( 2714 PWs) bands (ev): -31.2855 -31.2855 -31.2794 -31.2794 -12.5434 -12.5434 -12.5298 -12.5298 -11.2316 -11.2316 -11.2232 -11.2232 -11.0602 -11.0602 -11.0064 -11.0064 -0.8413 -0.8413 -0.5575 -0.5575 4.3486 4.3486 4.6219 4.6219 7.1716 7.1716 7.9092 7.9092 7.9675 7.9675 8.2214 8.2214 8.4860 8.4860 9.3513 9.3513 9.7749 9.7749 10.0641 10.0641 13.4587 13.4587 15.2241 15.2241 k = 0.1327 1.0723 0.9723 ( 2710 PWs) bands (ev): -31.2854 -31.2854 -31.2795 -31.2795 -12.5430 -12.5430 -12.5299 -12.5299 -11.2319 -11.2319 -11.2223 -11.2223 -11.0599 -11.0599 -11.0071 -11.0071 -0.8391 -0.8391 -0.5594 -0.5594 4.3641 4.3641 4.6087 4.6087 7.1648 7.1648 7.9036 7.9036 7.9726 7.9726 8.2297 8.2297 8.4823 8.4823 9.3151 9.3151 9.7787 9.7787 10.1036 10.1036 13.4523 13.4523 15.1990 15.1990 k = 0.1548 1.0723 0.9723 ( 2718 PWs) bands (ev): -31.2853 -31.2853 -31.2797 -31.2797 -12.5426 -12.5426 -12.5301 -12.5301 -11.2321 -11.2321 -11.2216 -11.2216 -11.0595 -11.0595 -11.0078 -11.0078 -0.8367 -0.8367 -0.5614 -0.5614 4.3821 4.3821 4.5933 4.5933 7.1574 7.1574 7.8970 7.8970 7.9780 7.9780 8.2382 8.2382 8.4788 8.4788 9.2809 9.2809 9.7825 9.7825 10.1417 10.1417 13.4467 13.4467 15.1772 15.1772 k = 0.1769 1.0723 0.9723 ( 2716 PWs) bands (ev): -31.2852 -31.2852 -31.2799 -31.2799 -12.5421 -12.5421 -12.5303 -12.5303 -11.2322 -11.2322 -11.2209 -11.2209 -11.0590 -11.0590 -11.0087 -11.0087 -0.8340 -0.8340 -0.5635 -0.5635 4.4024 4.4024 4.5758 4.5758 7.1497 7.1497 7.8892 7.8892 7.9839 7.9839 8.2465 8.2465 8.4759 8.4759 9.2500 9.2500 9.7861 9.7861 10.1771 10.1771 13.4423 13.4423 15.1598 15.1598 k = 0.1990 1.0723 0.9723 ( 2718 PWs) bands (ev): -31.2851 -31.2851 -31.2801 -31.2801 -12.5416 -12.5416 -12.5305 -12.5305 -11.2321 -11.2321 -11.2203 -11.2203 -11.0585 -11.0585 -11.0095 -11.0095 -0.8312 -0.8312 -0.5656 -0.5656 4.4245 4.4245 4.5565 4.5565 7.1421 7.1421 7.8802 7.8802 7.9900 7.9900 8.2542 8.2542 8.4737 8.4737 9.2235 9.2235 9.7892 9.7892 10.2086 10.2086 13.4396 13.4396 15.1476 15.1476 k = 0.2211 1.0723 0.9723 ( 2718 PWs) bands (ev): -31.2850 -31.2850 -31.2803 -31.2803 -12.5411 -12.5411 -12.5306 -12.5306 -11.2320 -11.2320 -11.2197 -11.2197 -11.0580 -11.0580 -11.0104 -11.0104 -0.8283 -0.8283 -0.5676 -0.5676 4.4473 4.4473 4.5366 4.5366 7.1347 7.1347 7.8697 7.8697 7.9965 7.9965 8.2606 8.2606 8.4727 8.4727 9.2022 9.2022 9.7916 9.7916 10.2355 10.2355 13.4391 13.4391 15.1412 15.1412 k = 0.2432 1.0723 0.9723 ( 2722 PWs) bands (ev): -31.2849 -31.2849 -31.2805 -31.2805 -12.5406 -12.5406 -12.5308 -12.5308 -11.2317 -11.2317 -11.2193 -11.2193 -11.0575 -11.0575 -11.0113 -11.0113 -0.8256 -0.8256 -0.5692 -0.5692 4.4661 4.4661 4.5206 4.5206 7.1277 7.1277 7.8577 7.8577 8.0033 8.0033 8.2656 8.2656 8.4731 8.4731 9.1867 9.1867 9.7930 9.7930 10.2570 10.2570 13.4408 13.4408 15.1411 15.1411 k = 0.2653 1.0723 0.9723 ( 2724 PWs) bands (ev): -31.2849 -31.2849 -31.2807 -31.2807 -12.5401 -12.5401 -12.5308 -12.5308 -11.2312 -11.2312 -11.2190 -11.2190 -11.0570 -11.0570 -11.0121 -11.0121 -0.8229 -0.8229 -0.5705 -0.5705 4.4640 4.4640 4.5253 4.5253 7.1215 7.1215 7.8441 7.8441 8.0105 8.0105 8.2688 8.2688 8.4749 8.4749 9.1773 9.1773 9.7934 9.7934 10.2729 10.2729 13.4449 13.4449 15.1475 15.1475 k = 0.2653 1.0723 0.9723 ( 2724 PWs) bands (ev): -31.2849 -31.2849 -31.2807 -31.2807 -12.5401 -12.5401 -12.5308 -12.5308 -11.2312 -11.2312 -11.2190 -11.2190 -11.0570 -11.0570 -11.0121 -11.0121 -0.8229 -0.8229 -0.5705 -0.5705 4.4640 4.4640 4.5253 4.5253 7.1215 7.1215 7.8441 7.8441 8.0105 8.0105 8.2688 8.2688 8.4749 8.4749 9.1773 9.1773 9.7934 9.7934 10.2729 10.2729 13.4449 13.4449 15.1475 15.1475 k = 0.2600 1.0508 0.9723 ( 2724 PWs) bands (ev): -31.2851 -31.2851 -31.2800 -31.2800 -12.5419 -12.5419 -12.5306 -12.5306 -11.2331 -11.2331 -11.2197 -11.2197 -11.0589 -11.0589 -11.0090 -11.0090 -0.8326 -0.8326 -0.5657 -0.5657 4.4503 4.4503 4.5292 4.5292 7.1440 7.1440 7.9027 7.9027 7.9760 7.9760 8.2620 8.2620 8.4672 8.4672 9.2039 9.2039 9.7936 9.7936 10.2191 10.2191 13.4225 13.4225 15.1061 15.1061 k = 0.2547 1.0294 0.9723 ( 2716 PWs) bands (ev): -31.2854 -31.2854 -31.2794 -31.2794 -12.5434 -12.5434 -12.5300 -12.5300 -11.2347 -11.2347 -11.2198 -11.2198 -11.0610 -11.0610 -11.0061 -11.0061 -0.8408 -0.8408 -0.5593 -0.5593 4.3755 4.3755 4.5956 4.5956 7.1631 7.1631 7.9277 7.9277 7.9653 7.9653 8.2611 8.2611 8.4648 8.4648 9.2314 9.2314 9.7931 9.7931 10.1646 10.1646 13.3986 13.3986 15.0633 15.0633 k = 0.2494 1.0079 0.9723 ( 2708 PWs) bands (ev): -31.2858 -31.2858 -31.2789 -31.2789 -12.5446 -12.5446 -12.5291 -12.5291 -11.2359 -11.2359 -11.2193 -11.2193 -11.0632 -11.0632 -11.0033 -11.0033 -0.8475 -0.8475 -0.5515 -0.5515 4.3012 4.3012 4.6633 4.6633 7.1786 7.1786 7.8806 7.8806 8.0180 8.0180 8.2664 8.2664 8.4662 8.4662 9.2596 9.2596 9.7922 9.7922 10.1094 10.1094 13.3731 13.3731 15.0195 15.0195 k = 0.2441 0.9865 0.9723 ( 2712 PWs) bands (ev): -31.2863 -31.2863 -31.2786 -31.2786 -12.5455 -12.5455 -12.5279 -12.5279 -11.2366 -11.2366 -11.2183 -11.2183 -11.0656 -11.0656 -11.0006 -11.0006 -0.8527 -0.8527 -0.5421 -0.5421 4.2273 4.2273 4.7320 4.7320 7.1904 7.1904 7.8261 7.8261 8.0705 8.0705 8.2777 8.2777 8.4703 8.4703 9.2886 9.2886 9.7910 9.7910 10.0539 10.0539 13.3461 13.3461 14.9749 14.9749 k = 0.2388 0.9650 0.9723 ( 2712 PWs) bands (ev): -31.2869 -31.2869 -31.2783 -31.2783 -12.5461 -12.5461 -12.5264 -12.5264 -11.2370 -11.2370 -11.2167 -11.2167 -11.0681 -11.0681 -10.9979 -10.9979 -0.8565 -0.8565 -0.5311 -0.5311 4.1541 4.1541 4.8018 4.8018 7.1988 7.1988 7.7672 7.7672 8.1204 8.1204 8.2946 8.2946 8.4763 8.4763 9.3183 9.3183 9.7900 9.7900 9.9981 9.9981 13.3174 13.3174 14.9300 14.9300 k = 0.2335 0.9436 0.9723 ( 2712 PWs) bands (ev): -31.2876 -31.2876 -31.2781 -31.2781 -12.5465 -12.5465 -12.5246 -12.5246 -11.2369 -11.2369 -11.2146 -11.2146 -11.0708 -11.0708 -10.9954 -10.9954 -0.8587 -0.8587 -0.5186 -0.5186 4.0817 4.0817 4.8725 4.8725 7.2040 7.2040 7.7048 7.7048 8.1670 8.1670 8.3167 8.3167 8.4839 8.4839 9.3488 9.3488 9.7893 9.7893 9.9425 9.9425 13.2871 13.2871 14.8852 14.8852 k = 0.2282 0.9221 0.9723 ( 2712 PWs) bands (ev): -31.2884 -31.2884 -31.2781 -31.2781 -12.5465 -12.5465 -12.5225 -12.5225 -11.2364 -11.2364 -11.2120 -11.2120 -11.0737 -11.0737 -10.9930 -10.9930 -0.8596 -0.8596 -0.5046 -0.5046 4.0101 4.0101 4.9441 4.9441 7.2062 7.2062 7.6395 7.6395 8.2098 8.2098 8.3433 8.3433 8.4927 8.4927 9.3798 9.3798 9.7896 9.7896 9.8872 9.8872 13.2551 13.2551 14.8407 14.8407 k = 0.2229 0.9007 0.9723 ( 2708 PWs) bands (ev): -31.2894 -31.2894 -31.2781 -31.2781 -12.5463 -12.5463 -12.5201 -12.5201 -11.2355 -11.2355 -11.2088 -11.2088 -11.0768 -11.0768 -10.9906 -10.9906 -0.8590 -0.8590 -0.4890 -0.4890 3.9395 3.9395 5.0164 5.0164 7.2060 7.2060 7.5717 7.5717 8.2482 8.2482 8.3735 8.3735 8.5027 8.5027 9.4114 9.4114 9.7906 9.7906 9.8334 9.8334 13.2214 13.2214 14.7971 14.7971 k = 0.2175 0.8793 0.9723 ( 2712 PWs) bands (ev): -31.2904 -31.2904 -31.2782 -31.2782 -12.5459 -12.5459 -12.5175 -12.5175 -11.2342 -11.2342 -11.2051 -11.2051 -11.0799 -11.0799 -10.9882 -10.9882 -0.8570 -0.8570 -0.4720 -0.4720 3.8699 3.8699 5.0894 5.0894 7.2036 7.2036 7.5018 7.5018 8.2816 8.2816 8.4068 8.4068 8.5138 8.5138 9.4431 9.4431 9.7735 9.7735 9.8013 9.8013 13.1861 13.1861 14.7545 14.7545 k = 0.2122 0.8578 0.9723 ( 2712 PWs) bands (ev): -31.2915 -31.2915 -31.2785 -31.2785 -12.5452 -12.5452 -12.5146 -12.5146 -11.2325 -11.2325 -11.2010 -11.2010 -11.0832 -11.0832 -10.9859 -10.9859 -0.8537 -0.8537 -0.4535 -0.4535 3.8015 3.8015 5.1630 5.1630 7.1994 7.1994 7.4304 7.4304 8.3092 8.3092 8.4421 8.4421 8.5262 8.5262 9.4743 9.4743 9.7240 9.7240 9.8068 9.8068 13.1491 13.1491 14.7134 14.7134 k = 0.2069 0.8364 0.9723 ( 2708 PWs) bands (ev): -31.2928 -31.2928 -31.2788 -31.2788 -12.5443 -12.5443 -12.5115 -12.5115 -11.2304 -11.2304 -11.1963 -11.1963 -11.0866 -11.0866 -10.9835 -10.9835 -0.8491 -0.8491 -0.4335 -0.4335 3.7342 3.7342 5.2370 5.2370 7.1931 7.1931 7.3580 7.3580 8.3303 8.3303 8.4787 8.4787 8.5401 8.5401 9.5024 9.5024 9.6770 9.6770 9.8185 9.8185 13.1106 13.1106 14.6741 14.6741 k = 0.2016 0.8149 0.9723 ( 2708 PWs) bands (ev): -31.2941 -31.2941 -31.2792 -31.2792 -12.5432 -12.5432 -12.5083 -12.5083 -11.2280 -11.2280 -11.1912 -11.1912 -11.0901 -11.0901 -10.9810 -10.9810 -0.8433 -0.8433 -0.4122 -0.4122 3.6682 3.6682 5.3113 5.3113 7.1833 7.1833 7.2870 7.2870 8.3443 8.3443 8.5148 8.5148 8.5566 8.5566 9.5193 9.5193 9.6426 9.6426 9.8356 9.8356 13.0706 13.0706 14.6369 14.6369 k = 0.1963 0.7935 0.9723 ( 2708 PWs) bands (ev): -31.2955 -31.2955 -31.2798 -31.2798 -12.5419 -12.5419 -12.5048 -12.5048 -11.2253 -11.2253 -11.1857 -11.1857 -11.0935 -11.0935 -10.9785 -10.9785 -0.8363 -0.8363 -0.3895 -0.3895 3.6036 3.6036 5.3858 5.3858 7.1605 7.1605 7.2273 7.2273 8.3507 8.3507 8.5467 8.5467 8.5789 8.5789 9.5080 9.5080 9.6381 9.6381 9.8585 9.8585 13.0291 13.0291 14.6022 14.6022 k = 0.1910 0.7720 0.9723 ( 2700 PWs) bands (ev): -31.2969 -31.2969 -31.2804 -31.2804 -12.5405 -12.5405 -12.5012 -12.5012 -11.2224 -11.2224 -11.1798 -11.1798 -11.0969 -11.0969 -10.9758 -10.9758 -0.8281 -0.8281 -0.3655 -0.3655 3.5403 3.5403 5.4604 5.4604 7.1049 7.1049 7.1993 7.1993 8.3492 8.3492 8.5705 8.5705 8.6102 8.6102 9.4712 9.4712 9.6611 9.6611 9.8878 9.8878 12.9864 12.9864 14.5702 14.5702 k = 0.1857 0.7506 0.9723 ( 2700 PWs) bands (ev): -31.2984 -31.2984 -31.2811 -31.2811 -12.5389 -12.5389 -12.4975 -12.4975 -11.2193 -11.2193 -11.1736 -11.1736 -11.1001 -11.1001 -10.9730 -10.9730 -0.8189 -0.8189 -0.3404 -0.3404 3.4786 3.4786 5.5350 5.5350 7.0314 7.0314 7.1884 7.1884 8.3395 8.3395 8.5899 8.5899 8.6465 8.6465 9.4253 9.4253 9.6952 9.6952 9.9238 9.9238 12.9425 12.9425 14.5413 14.5413 k = 0.1804 0.7291 0.9723 ( 2704 PWs) bands (ev): -31.3000 -31.3000 -31.2819 -31.2819 -12.5372 -12.5372 -12.4937 -12.4937 -11.2162 -11.2162 -11.1672 -11.1672 -11.1030 -11.1030 -10.9699 -10.9699 -0.8088 -0.8088 -0.3141 -0.3141 3.4183 3.4183 5.6094 5.6094 6.9531 6.9531 7.1821 7.1821 8.3218 8.3218 8.6085 8.6085 8.6837 8.6837 9.3769 9.3769 9.7342 9.7342 9.9668 9.9668 12.8976 12.8976 14.5157 14.5157 k = 0.1751 0.7077 0.9723 ( 2704 PWs) bands (ev): -31.3017 -31.3017 -31.2827 -31.2827 -12.5355 -12.5355 -12.4899 -12.4899 -11.2130 -11.2130 -11.1609 -11.1609 -11.1052 -11.1052 -10.9665 -10.9665 -0.7977 -0.7977 -0.2867 -0.2867 3.3595 3.3595 5.6834 5.6834 6.8729 6.8729 7.1777 7.1777 8.2963 8.2963 8.6275 8.6275 8.7202 8.7202 9.3281 9.3281 9.7760 9.7760 10.0166 10.0166 12.8519 12.8519 14.4938 14.4938 k = 0.1698 0.6862 0.9723 ( 2704 PWs) bands (ev): -31.3034 -31.3034 -31.2836 -31.2836 -12.5337 -12.5337 -12.4860 -12.4860 -11.2099 -11.2099 -11.1550 -11.1550 -11.1065 -11.1065 -10.9627 -10.9627 -0.7858 -0.7858 -0.2583 -0.2583 3.3024 3.3024 5.7571 5.7571 6.7918 6.7918 7.1749 7.1749 8.2636 8.2636 8.6472 8.6472 8.7553 8.7553 9.2795 9.2795 9.8202 9.8202 10.0731 10.0731 12.8055 12.8055 14.4756 14.4756 k = 0.1645 0.6648 0.9723 ( 2700 PWs) bands (ev): -31.3052 -31.3052 -31.2846 -31.2846 -12.5318 -12.5318 -12.4822 -12.4822 -11.2070 -11.2070 -11.1501 -11.1501 -11.1062 -11.1062 -10.9586 -10.9586 -0.7731 -0.7731 -0.2291 -0.2291 3.2469 3.2469 5.8301 5.8301 6.7101 6.7101 7.1735 7.1735 8.2243 8.2243 8.6678 8.6678 8.7885 8.7885 9.2316 9.2316 9.8666 9.8666 10.1359 10.1359 12.7586 12.7586 14.4615 14.4615 k = 0.1592 0.6434 0.9723 ( 2700 PWs) bands (ev): -31.3070 -31.3070 -31.2857 -31.2857 -12.5300 -12.5300 -12.4784 -12.4784 -11.2045 -11.2045 -11.1465 -11.1465 -11.1037 -11.1037 -10.9540 -10.9540 -0.7598 -0.7598 -0.1990 -0.1990 3.1930 3.1930 5.9023 5.9023 6.6282 6.6282 7.1736 7.1736 8.1790 8.1790 8.6892 8.6892 8.8194 8.8194 9.1847 9.1847 9.9150 9.9150 10.2047 10.2047 12.7115 12.7115 14.4517 14.4517 k = 0.1539 0.6219 0.9723 ( 2696 PWs) bands (ev): -31.3089 -31.3089 -31.2868 -31.2868 -12.5281 -12.5281 -12.4746 -12.4746 -11.2024 -11.2024 -11.1446 -11.1446 -11.0988 -11.0988 -10.9490 -10.9490 -0.7459 -0.7459 -0.1683 -0.1683 3.1409 3.1409 5.9736 5.9736 6.5464 6.5464 7.1751 7.1751 8.1285 8.1285 8.7114 8.7114 8.8477 8.8477 9.1387 9.1387 9.9655 9.9655 10.2792 10.2792 12.6642 12.6642 14.4463 14.4463 k = 0.1486 0.6005 0.9723 ( 2688 PWs) bands (ev): -31.3107 -31.3107 -31.2879 -31.2879 -12.5263 -12.5263 -12.4710 -12.4710 -11.2011 -11.2011 -11.1438 -11.1438 -11.0918 -11.0918 -10.9434 -10.9434 -0.7315 -0.7315 -0.1369 -0.1369 3.0905 3.0905 6.0439 6.0439 6.4649 6.4649 7.1783 7.1783 8.0737 8.0737 8.7344 8.7344 8.8730 8.8730 9.0939 9.0939 10.0183 10.0183 10.3588 10.3588 12.6170 12.6170 14.4455 14.4455 k = 0.1433 0.5790 0.9723 ( 2692 PWs) bands (ev): -31.3126 -31.3126 -31.2891 -31.2891 -12.5245 -12.5245 -12.4675 -12.4675 -11.2004 -11.2004 -11.1437 -11.1437 -11.0833 -11.0833 -10.9372 -10.9372 -0.7167 -0.7167 -0.1051 -0.1051 3.0418 3.0418 6.1128 6.1128 6.3839 6.3839 7.1831 7.1831 8.0151 8.0151 8.7580 8.7580 8.8952 8.8952 9.0503 9.0503 10.0733 10.0733 10.4432 10.4432 12.5702 12.5702 14.4493 14.4493 k = 0.1380 0.5576 0.9723 ( 2696 PWs) bands (ev): -31.3145 -31.3145 -31.2903 -31.2903 -12.5228 -12.5228 -12.4640 -12.4640 -11.2006 -11.2006 -11.1437 -11.1437 -11.0736 -11.0736 -10.9305 -10.9305 -0.7016 -0.7016 -0.0729 -0.0729 2.9949 2.9949 6.1797 6.1797 6.3043 6.3043 7.1896 7.1896 7.9534 7.9534 8.7822 8.7822 8.9140 8.9140 9.0079 9.0079 10.1307 10.1307 10.5322 10.5322 12.5238 12.5238 14.4579 14.4579 k = 0.1327 0.5361 0.9723 ( 2698 PWs) bands (ev): -31.3165 -31.3165 -31.2915 -31.2915 -12.5212 -12.5212 -12.4608 -12.4608 -11.2017 -11.2017 -11.1437 -11.1437 -11.0631 -11.0631 -10.9233 -10.9233 -0.6863 -0.6863 -0.0405 -0.0405 2.9498 2.9498 6.2169 6.2169 6.2539 6.2539 7.1978 7.1978 7.8894 7.8894 8.8068 8.8068 8.9293 8.9293 8.9669 8.9669 10.1905 10.1905 10.6254 10.6254 12.4782 12.4782 14.4712 14.4712 k = 0.1273 0.5147 0.9723 ( 2696 PWs) bands (ev): -31.3184 -31.3184 -31.2928 -31.2928 -12.5196 -12.5196 -12.4577 -12.4577 -11.2035 -11.2035 -11.1434 -11.1434 -11.0521 -11.0521 -10.9154 -10.9154 -0.6708 -0.6708 -0.0079 -0.0079 2.9064 2.9064 6.1435 6.1435 6.3135 6.3135 7.2078 7.2078 7.8235 7.8235 8.8317 8.8317 8.9272 8.9272 8.9411 8.9411 10.2529 10.2529 10.7225 10.7225 12.4334 12.4334 14.4893 14.4893 k = 0.1220 0.4932 0.9723 ( 2692 PWs) bands (ev): -31.3203 -31.3203 -31.2941 -31.2941 -12.5181 -12.5181 -12.4547 -12.4547 -11.2060 -11.2060 -11.1430 -11.1430 -11.0406 -11.0406 -10.9071 -10.9071 -0.6553 -0.6553 0.0246 0.0246 2.8649 2.8649 6.0669 6.0669 6.3760 6.3760 7.2196 7.2196 7.7565 7.7565 8.8568 8.8568 8.8891 8.8891 8.9492 8.9492 10.3179 10.3179 10.8234 10.8234 12.3897 12.3897 14.5122 14.5122 k = 0.1167 0.4718 0.9723 ( 2696 PWs) bands (ev): -31.3222 -31.3222 -31.2954 -31.2954 -12.5168 -12.5168 -12.4520 -12.4520 -11.2090 -11.2090 -11.1424 -11.1424 -11.0288 -11.0288 -10.8982 -10.8982 -0.6398 -0.6398 0.0571 0.0571 2.8252 2.8252 5.9915 5.9915 6.4369 6.4369 7.2332 7.2332 7.6888 7.6888 8.8519 8.8519 8.8823 8.8823 8.9536 8.9536 10.3855 10.3855 10.9278 10.9278 12.3472 12.3472 14.5396 14.5396 k = 0.1114 0.4503 0.9723 ( 2700 PWs) bands (ev): -31.3240 -31.3240 -31.2967 -31.2967 -12.5155 -12.5155 -12.4494 -12.4494 -11.2124 -11.2124 -11.1418 -11.1418 -11.0167 -11.0167 -10.8889 -10.8889 -0.6244 -0.6244 0.0893 0.0893 2.7874 2.7874 5.9177 5.9177 6.4958 6.4958 7.2485 7.2485 7.6209 7.6209 8.8166 8.8166 8.9070 8.9070 8.9546 8.9546 10.4558 10.4558 11.0355 11.0355 12.3061 12.3061 14.5714 14.5714 k = 0.1061 0.4289 0.9723 ( 2692 PWs) bands (ev): -31.3259 -31.3259 -31.2979 -31.2979 -12.5144 -12.5144 -12.4470 -12.4470 -11.2161 -11.2161 -11.1412 -11.1412 -11.0045 -11.0045 -10.8792 -10.8792 -0.6092 -0.6092 0.1211 0.1211 2.7514 2.7514 5.8458 5.8458 6.5527 6.5527 7.2656 7.2656 7.5534 7.5534 8.7828 8.7828 8.9306 8.9306 8.9531 8.9531 10.5290 10.5290 11.1463 11.1463 12.2666 12.2666 14.6075 14.6075 k = 0.1008 0.4075 0.9723 ( 2696 PWs) bands (ev): -31.3277 -31.3277 -31.2992 -31.2992 -12.5133 -12.5133 -12.4448 -12.4448 -11.2200 -11.2200 -11.1406 -11.1406 -10.9923 -10.9923 -10.8693 -10.8693 -0.5943 -0.5943 0.1524 0.1524 2.7172 2.7172 5.7760 5.7760 6.6073 6.6073 7.2845 7.2845 7.4865 7.4865 8.7504 8.7504 8.9411 8.9411 8.9609 8.9609 10.6049 10.6049 11.2601 11.2601 12.2287 12.2287 14.6476 14.6476 k = 0.0955 0.3860 0.9723 ( 2692 PWs) bands (ev): -31.3294 -31.3294 -31.3004 -31.3004 -12.5124 -12.5124 -12.4428 -12.4428 -11.2240 -11.2240 -11.1401 -11.1401 -10.9801 -10.9801 -10.8591 -10.8591 -0.5797 -0.5797 0.1831 0.1831 2.6849 2.6849 5.7084 5.7084 6.6597 6.6597 7.3049 7.3049 7.4208 7.4208 8.7196 8.7196 8.9332 8.9332 8.9832 8.9832 10.6836 10.6836 11.3767 11.3767 12.1926 12.1926 14.6913 14.6913 k = 0.0902 0.3646 0.9723 ( 2700 PWs) bands (ev): -31.3312 -31.3312 -31.3016 -31.3016 -12.5116 -12.5116 -12.4410 -12.4410 -11.2281 -11.2281 -11.1397 -11.1397 -10.9680 -10.9680 -10.8488 -10.8488 -0.5656 -0.5656 0.2130 0.2130 2.6544 2.6544 5.6433 5.6433 6.7095 6.7095 7.3266 7.3266 7.3570 7.3570 8.6903 8.6903 8.9206 8.9206 9.0065 9.0065 10.7652 10.7652 11.4960 11.4960 12.1584 12.1584 14.7383 14.7383 k = 0.0849 0.3431 0.9723 ( 2698 PWs) bands (ev): -31.3328 -31.3328 -31.3028 -31.3028 -12.5108 -12.5108 -12.4394 -12.4394 -11.2321 -11.2321 -11.1394 -11.1394 -10.9560 -10.9560 -10.8384 -10.8384 -0.5519 -0.5519 0.2420 0.2420 2.6257 2.6257 5.5809 5.5809 6.7569 6.7569 7.2937 7.2937 7.3511 7.3511 8.6626 8.6626 8.9047 8.9047 9.0293 9.0293 10.8494 10.8494 11.6178 11.6178 12.1262 12.1262 14.7881 14.7881 k = 0.0796 0.3217 0.9723 ( 2694 PWs) bands (ev): -31.3344 -31.3344 -31.3039 -31.3039 -12.5102 -12.5102 -12.4379 -12.4379 -11.2360 -11.2360 -11.1392 -11.1392 -10.9443 -10.9443 -10.8281 -10.8281 -0.5388 -0.5388 0.2699 0.2699 2.5989 2.5989 5.5214 5.5214 6.8016 6.8016 7.2337 7.2337 7.3759 7.3759 8.6365 8.6365 8.8860 8.8860 9.0514 9.0514 10.9363 10.9363 11.7418 11.7418 12.0960 12.0960 14.8395 14.8395 k = 0.0743 0.3002 0.9723 ( 2698 PWs) bands (ev): -31.3359 -31.3359 -31.3050 -31.3050 -12.5096 -12.5096 -12.4366 -12.4366 -11.2399 -11.2399 -11.1391 -11.1391 -10.9330 -10.9330 -10.8180 -10.8180 -0.5262 -0.5262 0.2968 0.2968 2.5739 2.5739 5.4648 5.4648 6.8437 6.8437 7.1760 7.1760 7.4021 7.4021 8.6119 8.6119 8.8648 8.8648 9.0726 9.0726 11.0257 11.0257 11.8679 11.8679 12.0682 12.0682 14.8811 14.8811 k = 0.0690 0.2788 0.9723 ( 2698 PWs) bands (ev): -31.3373 -31.3373 -31.3061 -31.3061 -12.5092 -12.5092 -12.4354 -12.4354 -11.2436 -11.2436 -11.1391 -11.1391 -10.9220 -10.9220 -10.8081 -10.8081 -0.5144 -0.5144 0.3223 0.3223 2.5506 2.5506 5.4114 5.4114 6.8830 6.8830 7.1212 7.1212 7.4293 7.4293 8.5890 8.5890 8.8414 8.8414 9.0927 9.0927 11.1175 11.1175 11.9937 11.9937 12.0448 12.0448 14.8618 14.8618 k = 0.0637 0.2573 0.9723 ( 2694 PWs) bands (ev): -31.3387 -31.3387 -31.3071 -31.3071 -12.5088 -12.5088 -12.4344 -12.4344 -11.2471 -11.2471 -11.1391 -11.1391 -10.9116 -10.9116 -10.7985 -10.7985 -0.5032 -0.5032 0.3465 0.3465 2.5292 2.5292 5.3612 5.3612 6.9194 6.9194 7.0695 7.0695 7.4574 7.4574 8.5678 8.5678 8.8163 8.8163 9.1117 9.1117 11.2113 11.2113 12.0159 12.0159 12.1290 12.1290 14.8294 14.8294 k = 0.0584 0.2359 0.9723 ( 2694 PWs) bands (ev): -31.3400 -31.3400 -31.3080 -31.3080 -12.5085 -12.5085 -12.4336 -12.4336 -11.2504 -11.2504 -11.1392 -11.1392 -10.9016 -10.9016 -10.7894 -10.7894 -0.4927 -0.4927 0.3692 0.3692 2.5095 2.5095 5.3146 5.3146 6.9523 6.9523 7.0218 7.0218 7.4860 7.4860 8.5481 8.5481 8.7897 8.7897 9.1295 9.1295 11.3069 11.3069 11.9949 11.9949 12.2601 12.2601 14.7601 14.7601 k = 0.0531 0.2145 0.9723 ( 2694 PWs) bands (ev): -31.3411 -31.3411 -31.3089 -31.3089 -12.5082 -12.5082 -12.4328 -12.4328 -11.2535 -11.2535 -11.1394 -11.1394 -10.8923 -10.8923 -10.7808 -10.7808 -0.4831 -0.4831 0.3903 0.3903 2.4916 2.4916 5.2715 5.2715 6.9679 6.9679 6.9921 6.9921 7.5150 7.5150 8.5301 8.5301 8.7621 8.7621 9.1459 9.1459 11.4038 11.4038 11.9754 11.9754 12.3932 12.3932 14.6129 14.6129 k = 0.0478 0.1930 0.9723 ( 2690 PWs) bands (ev): -31.3422 -31.3422 -31.3097 -31.3097 -12.5080 -12.5080 -12.4321 -12.4321 -11.2564 -11.2564 -11.1395 -11.1395 -10.8837 -10.8837 -10.7727 -10.7727 -0.4742 -0.4742 0.4098 0.4098 2.4755 2.4755 5.2321 5.2321 6.9319 6.9319 7.0148 7.0148 7.5438 7.5438 8.5138 8.5138 8.7341 8.7341 9.1610 9.1610 11.5015 11.5015 11.9579 11.9579 12.5276 12.5276 14.4662 14.4662 k = 0.0424 0.1716 0.9723 ( 2690 PWs) bands (ev): -31.3432 -31.3432 -31.3104 -31.3104 -12.5078 -12.5078 -12.4316 -12.4316 -11.2590 -11.2590 -11.1397 -11.1397 -10.8758 -10.8758 -10.7653 -10.7653 -0.4662 -0.4662 0.4274 0.4274 2.4611 2.4611 5.1966 5.1966 6.8949 6.8949 7.0394 7.0394 7.5722 7.5722 8.4992 8.4992 8.7061 8.7061 9.1746 9.1746 11.5992 11.5992 11.9423 11.9423 12.6628 12.6628 14.3237 14.3237 k = 0.0371 0.1501 0.9723 ( 2698 PWs) bands (ev): -31.3441 -31.3441 -31.3110 -31.3110 -12.5077 -12.5077 -12.4311 -12.4311 -11.2613 -11.2613 -11.1399 -11.1399 -10.8687 -10.8687 -10.7585 -10.7585 -0.4591 -0.4591 0.4432 0.4432 2.4484 2.4484 5.1650 5.1650 6.8616 6.8616 7.0615 7.0615 7.5996 7.5996 8.4863 8.4863 8.6788 8.6788 9.1867 9.1867 11.6958 11.6958 11.9287 11.9287 12.7983 12.7983 14.1869 14.1869 k = 0.0318 0.1287 0.9723 ( 2698 PWs) bands (ev): -31.3448 -31.3448 -31.3116 -31.3116 -12.5076 -12.5076 -12.4308 -12.4308 -11.2633 -11.2633 -11.1401 -11.1401 -10.8625 -10.8625 -10.7526 -10.7526 -0.4529 -0.4529 0.4570 0.4570 2.4374 2.4374 5.1374 5.1374 6.8323 6.8323 7.0808 7.0808 7.6255 7.6255 8.4750 8.4750 8.6528 8.6528 9.1973 9.1973 11.7898 11.7898 11.9171 11.9171 12.9336 12.9336 14.0576 14.0576 k = 0.0265 0.1072 0.9723 ( 2694 PWs) bands (ev): -31.3455 -31.3455 -31.3121 -31.3121 -12.5075 -12.5075 -12.4304 -12.4304 -11.2651 -11.2651 -11.1402 -11.1402 -10.8571 -10.8571 -10.7475 -10.7475 -0.4476 -0.4476 0.4688 0.4688 2.4282 2.4282 5.1139 5.1139 6.8073 6.8073 7.0972 7.0972 7.6492 7.6492 8.4655 8.4655 8.6289 8.6289 9.2063 9.2063 11.8793 11.8793 11.9075 11.9075 13.0676 13.0676 13.9380 13.9380 k = 0.0212 0.0858 0.9723 ( 2706 PWs) bands (ev): -31.3460 -31.3460 -31.3125 -31.3125 -12.5075 -12.5075 -12.4302 -12.4302 -11.2665 -11.2665 -11.1404 -11.1404 -10.8527 -10.8527 -10.7432 -10.7432 -0.4433 -0.4433 0.4785 0.4785 2.4206 2.4206 5.0946 5.0946 6.7867 6.7867 7.1106 7.1106 7.6700 7.6700 8.4577 8.4577 8.6077 8.6077 9.2136 9.2136 11.8994 11.8994 11.9618 11.9618 13.1989 13.1989 13.8308 13.8308 k = 0.0159 0.0643 0.9723 ( 2698 PWs) bands (ev): -31.3464 -31.3464 -31.3128 -31.3128 -12.5074 -12.5074 -12.4300 -12.4300 -11.2676 -11.2676 -11.1405 -11.1405 -10.8492 -10.8492 -10.7399 -10.7399 -0.4399 -0.4399 0.4862 0.4862 2.4148 2.4148 5.0795 5.0795 6.7706 6.7706 7.1211 7.1211 7.6872 7.6872 8.4516 8.4516 8.5902 8.5902 9.2194 9.2194 11.8934 11.8934 12.0334 12.0334 13.3247 13.3247 13.7398 13.7398 k = 0.0106 0.0429 0.9723 ( 2698 PWs) bands (ev): -31.3467 -31.3467 -31.3130 -31.3130 -12.5074 -12.5074 -12.4299 -12.4299 -11.2685 -11.2685 -11.1406 -11.1406 -10.8467 -10.8467 -10.7375 -10.7375 -0.4375 -0.4375 0.4916 0.4916 2.4106 2.4106 5.0687 5.0687 6.7590 6.7590 7.1285 7.1285 7.7001 7.7001 8.4472 8.4472 8.5770 8.5770 9.2235 9.2235 11.8890 11.8890 12.0898 12.0898 13.4391 13.4391 13.6694 13.6694 k = 0.0053 0.0214 0.9723 ( 2694 PWs) bands (ev): -31.3469 -31.3469 -31.3132 -31.3132 -12.5074 -12.5074 -12.4298 -12.4298 -11.2689 -11.2689 -11.1406 -11.1406 -10.8452 -10.8452 -10.7360 -10.7360 -0.4360 -0.4360 0.4949 0.4949 2.4081 2.4081 5.0622 5.0622 6.7521 6.7521 7.1330 7.1330 7.7081 7.7081 8.4446 8.4446 8.5688 8.5688 9.2260 9.2260 11.8865 11.8865 12.1263 12.1263 13.5286 13.5286 13.6245 13.6245 k = 0.0000 0.0000 0.9723 ( 2694 PWs) bands (ev): -31.3470 -31.3470 -31.3132 -31.3132 -12.5074 -12.5074 -12.4298 -12.4298 -11.2691 -11.2691 -11.1407 -11.1407 -10.8447 -10.8447 -10.7355 -10.7355 -0.4355 -0.4355 0.4960 0.4960 2.4072 2.4072 5.0600 5.0600 6.7497 6.7497 7.1345 7.1345 7.7108 7.7108 8.4438 8.4438 8.5661 8.5661 9.2268 9.2268 11.8856 11.8856 12.1389 12.1389 13.5656 13.5656 13.6087 13.6087 k = 0.0000 0.0000 0.9723 ( 2694 PWs) bands (ev): -31.3470 -31.3470 -31.3132 -31.3132 -12.5074 -12.5074 -12.4298 -12.4298 -11.2691 -11.2691 -11.1407 -11.1407 -10.8447 -10.8447 -10.7355 -10.7355 -0.4355 -0.4355 0.4960 0.4960 2.4072 2.4072 5.0600 5.0600 6.7497 6.7497 7.1345 7.1345 7.7108 7.7108 8.4438 8.4438 8.5661 8.5661 9.2268 9.2268 11.8856 11.8856 12.1389 12.1389 13.5656 13.5656 13.6087 13.6087 k = 0.0000 0.0000 0.9502 ( 2694 PWs) bands (ev): -31.3470 -31.3470 -31.3132 -31.3132 -12.5073 -12.5073 -12.4296 -12.4296 -11.2689 -11.2689 -11.1404 -11.1404 -10.8447 -10.8447 -10.7356 -10.7356 -0.4377 -0.4377 0.4943 0.4943 2.4078 2.4078 5.0633 5.0633 6.7528 6.7528 7.1357 7.1357 7.7095 7.7095 8.4445 8.4445 8.5676 8.5676 9.2275 9.2275 11.8877 11.8877 12.1358 12.1358 13.4986 13.4986 13.6759 13.6759 k = 0.0000 0.0000 0.9281 ( 2706 PWs) bands (ev): -31.3471 -31.3471 -31.3134 -31.3134 -12.5069 -12.5069 -12.4288 -12.4288 -11.2682 -11.2682 -11.1396 -11.1396 -10.8447 -10.8447 -10.7358 -10.7358 -0.4442 -0.4442 0.4889 0.4889 2.4094 2.4094 5.0732 5.0732 6.7618 6.7618 7.1392 7.1392 7.7054 7.7054 8.4466 8.4466 8.5722 8.5722 9.2296 9.2296 11.8939 11.8939 12.1264 12.1264 13.4141 13.4141 13.7609 13.7609 k = 0.0000 0.0000 0.9060 ( 2706 PWs) bands (ev): -31.3472 -31.3472 -31.3135 -31.3135 -12.5063 -12.5063 -12.4276 -12.4276 -11.2671 -11.2671 -11.1383 -11.1383 -10.8447 -10.8447 -10.7360 -10.7360 -0.4550 -0.4550 0.4801 0.4801 2.4121 2.4121 5.0897 5.0897 6.7768 6.7768 7.1451 7.1451 7.6987 7.6987 8.4501 8.4501 8.5798 8.5798 9.2330 9.2330 11.9041 11.9041 12.1112 12.1112 13.3290 13.3290 13.8468 13.8468 k = 0.0000 0.0000 0.8839 ( 2702 PWs) bands (ev): -31.3475 -31.3475 -31.3137 -31.3137 -12.5054 -12.5054 -12.4259 -12.4259 -11.2655 -11.2655 -11.1364 -11.1364 -10.8447 -10.8447 -10.7364 -10.7364 -0.4700 -0.4700 0.4679 0.4679 2.4159 2.4159 5.1126 5.1126 6.7977 6.7977 7.1534 7.1534 7.6895 7.6895 8.4550 8.4550 8.5904 8.5904 9.2377 9.2377 11.9183 11.9183 12.0907 12.0907 13.2439 13.2439 13.9331 13.9331 k = 0.0000 0.0000 0.8618 ( 2702 PWs) bands (ev): -31.3477 -31.3477 -31.3140 -31.3140 -12.5043 -12.5043 -12.4237 -12.4237 -11.2635 -11.2635 -11.1340 -11.1340 -10.8448 -10.8448 -10.7368 -10.7368 -0.4890 -0.4890 0.4524 0.4524 2.4207 2.4207 5.1417 5.1417 6.8244 6.8244 7.1639 7.1639 7.6779 7.6779 8.4613 8.4613 8.6041 8.6041 9.2436 9.2436 11.9364 11.9364 12.0656 12.0656 13.1587 13.1587 14.0193 14.0193 k = 0.0000 0.0000 0.8397 ( 2702 PWs) bands (ev): -31.3481 -31.3481 -31.3143 -31.3143 -12.5029 -12.5029 -12.4210 -12.4210 -11.2611 -11.2611 -11.1311 -11.1311 -10.8448 -10.8448 -10.7373 -10.7373 -0.5119 -0.5119 0.4337 0.4337 2.4265 2.4265 5.1770 5.1770 6.8568 6.8568 7.1766 7.1766 7.6640 7.6640 8.4689 8.4689 8.6207 8.6207 9.2508 9.2508 11.9580 11.9580 12.0366 12.0366 13.0736 13.0736 14.1053 14.1053 k = 0.0000 0.0000 0.8176 ( 2702 PWs) bands (ev): -31.3485 -31.3485 -31.3147 -31.3147 -12.5014 -12.5014 -12.4180 -12.4180 -11.2582 -11.2582 -11.1277 -11.1277 -10.8448 -10.8448 -10.7380 -10.7380 -0.5384 -0.5384 0.4119 0.4119 2.4333 2.4333 5.2180 5.2180 6.8947 6.8947 7.1916 7.1916 7.6481 7.6481 8.4778 8.4778 8.6402 8.6402 9.2591 9.2591 11.9819 11.9819 12.0054 12.0054 12.9885 12.9885 14.1895 14.1895 k = 0.0000 0.0000 0.7955 ( 2702 PWs) bands (ev): -31.3489 -31.3489 -31.3151 -31.3151 -12.4996 -12.4996 -12.4145 -12.4145 -11.2550 -11.2550 -11.1238 -11.1238 -10.8448 -10.8448 -10.7387 -10.7387 -0.5683 -0.5683 0.3873 0.3873 2.4411 2.4411 5.2647 5.2647 6.9379 6.9379 7.2088 7.2088 7.6305 7.6305 8.4880 8.4880 8.6627 8.6627 9.2684 9.2684 11.9679 11.9679 12.0130 12.0130 12.9034 12.9034 14.1125 14.1125 k = 0.0000 0.0000 0.7734 ( 2696 PWs) bands (ev): -31.3494 -31.3494 -31.3156 -31.3156 -12.4977 -12.4977 -12.4107 -12.4107 -11.2514 -11.2514 -11.1193 -11.1193 -10.8448 -10.8448 -10.7395 -10.7395 -0.6014 -0.6014 0.3600 0.3600 2.4497 2.4497 5.3167 5.3167 6.9863 6.9863 7.2280 7.2280 7.6112 7.6112 8.4994 8.4994 8.6880 8.6880 9.2788 9.2788 11.9317 11.9317 12.0439 12.0439 12.8182 12.8182 14.0016 14.0016 k = 0.0000 0.0000 0.7513 ( 2696 PWs) bands (ev): -31.3499 -31.3499 -31.3161 -31.3161 -12.4956 -12.4956 -12.4064 -12.4064 -11.2474 -11.2474 -11.1144 -11.1144 -10.8447 -10.8447 -10.7403 -10.7403 -0.6374 -0.6374 0.3301 0.3301 2.4593 2.4593 5.3737 5.3737 7.0396 7.0396 7.2492 7.2492 7.5906 7.5906 8.5120 8.5120 8.7161 8.7161 9.2901 9.2901 11.8940 11.8940 12.0776 12.0776 12.7330 12.7330 13.8862 13.8862 k = 0.0000 0.0000 0.7292 ( 2704 PWs) bands (ev): -31.3505 -31.3505 -31.3167 -31.3167 -12.4933 -12.4933 -12.4019 -12.4019 -11.2430 -11.2430 -11.1090 -11.1090 -10.8445 -10.8445 -10.7412 -10.7412 -0.6761 -0.6761 0.2980 0.2980 2.4697 2.4697 5.4355 5.4355 7.0976 7.0976 7.2724 7.2724 7.5689 7.5689 8.5256 8.5256 8.7469 8.7469 9.3022 9.3022 11.8555 11.8555 12.1136 12.1136 12.6478 12.6478 13.7679 13.7679 k = 0.0000 0.0000 0.7071 ( 2712 PWs) bands (ev): -31.3512 -31.3512 -31.3173 -31.3173 -12.4909 -12.4909 -12.3971 -12.3971 -11.2383 -11.2383 -11.1031 -11.1031 -10.8442 -10.8442 -10.7422 -10.7422 -0.7171 -0.7171 0.2639 0.2639 2.4808 2.4808 5.5015 5.5015 7.1600 7.1600 7.2974 7.2974 7.5463 7.5463 8.5403 8.5403 8.7803 8.7803 9.3152 9.3152 11.8170 11.8170 12.1512 12.1512 12.5624 12.5624 13.6476 13.6476 k = 0.0000 0.0000 0.6850 ( 2706 PWs) bands (ev): -31.3518 -31.3518 -31.3179 -31.3179 -12.4884 -12.4884 -12.3920 -12.3920 -11.2334 -11.2334 -11.0967 -11.0967 -10.8439 -10.8439 -10.7433 -10.7433 -0.7601 -0.7601 0.2278 0.2278 2.4927 2.4927 5.5716 5.5716 7.2266 7.2266 7.3241 7.3241 7.5233 7.5233 8.5560 8.5560 8.8163 8.8163 9.3290 9.3290 11.7787 11.7787 12.1897 12.1897 12.4771 12.4771 13.5266 13.5266 k = 0.0000 0.0000 0.6629 ( 2710 PWs) bands (ev): -31.3526 -31.3526 -31.3186 -31.3186 -12.4858 -12.4858 -12.3868 -12.3868 -11.2281 -11.2281 -11.0899 -11.0899 -10.8434 -10.8434 -10.7443 -10.7443 -0.8050 -0.8050 0.1902 0.1902 2.5052 2.5052 5.6453 5.6453 7.2971 7.2971 7.3525 7.3525 7.5000 7.5000 8.5725 8.5725 8.8548 8.8548 9.3435 9.3435 11.7412 11.7412 12.2282 12.2282 12.3917 12.3917 13.4062 13.4062 k = 0.0000 0.0000 0.6408 ( 2712 PWs) bands (ev): -31.3533 -31.3533 -31.3193 -31.3193 -12.4832 -12.4832 -12.3813 -12.3813 -11.2226 -11.2226 -11.0827 -11.0827 -10.8428 -10.8428 -10.7455 -10.7455 -0.8513 -0.8513 0.1512 0.1512 2.5183 2.5183 5.7222 5.7222 7.3705 7.3705 7.3831 7.3831 7.4767 7.4767 8.5900 8.5900 8.8957 8.8957 9.3587 9.3587 11.7048 11.7048 12.2652 12.2652 12.3065 12.3065 13.2878 13.2878 k = 0.0000 0.0000 0.6187 ( 2716 PWs) bands (ev): -31.3541 -31.3541 -31.3201 -31.3201 -12.4804 -12.4804 -12.3757 -12.3757 -11.2170 -11.2170 -11.0751 -11.0751 -10.8420 -10.8420 -10.7466 -10.7466 -0.8988 -0.8988 0.1110 0.1110 2.5319 2.5319 5.8018 5.8018 7.4129 7.4129 7.4495 7.4495 7.4538 7.4538 8.6082 8.6082 8.9388 8.9388 9.3746 9.3746 11.6697 11.6697 12.2209 12.2209 12.2993 12.2993 13.1737 13.1737 k = 0.0000 0.0000 0.5966 ( 2712 PWs) bands (ev): -31.3549 -31.3549 -31.3208 -31.3208 -12.4777 -12.4777 -12.3699 -12.3699 -11.2111 -11.2111 -11.0672 -11.0672 -10.8411 -10.8411 -10.7477 -10.7477 -0.9472 -0.9472 0.0700 0.0700 2.5460 2.5460 5.8838 5.8838 7.4314 7.4314 7.4455 7.4455 7.5300 7.5300 8.6272 8.6272 8.9841 8.9841 9.3912 9.3912 11.6364 11.6364 12.1359 12.1359 12.3263 12.3263 13.0673 13.0673 k = 0.0000 0.0000 0.5745 ( 2712 PWs) bands (ev): -31.3557 -31.3557 -31.3216 -31.3216 -12.4749 -12.4749 -12.3641 -12.3641 -11.2052 -11.2052 -11.0589 -11.0589 -10.8399 -10.8399 -10.7489 -10.7489 -0.9964 -0.9964 0.0282 0.0282 2.5605 2.5605 5.9677 5.9677 7.4103 7.4103 7.4790 7.4790 7.6135 7.6135 8.6468 8.6468 9.0313 9.0313 9.4084 9.4084 11.6049 11.6049 12.0511 12.0511 12.3415 12.3415 12.9739 12.9739 k = 0.0000 0.0000 0.5524 ( 2712 PWs) bands (ev): -31.3566 -31.3566 -31.3224 -31.3224 -12.4722 -12.4722 -12.3583 -12.3583 -11.1992 -11.1992 -11.0503 -11.0503 -10.8386 -10.8386 -10.7500 -10.7500 -1.0459 -1.0459 -0.0141 -0.0141 2.5752 2.5752 6.0527 6.0527 7.3906 7.3906 7.5133 7.5133 7.6994 7.6994 8.6671 8.6671 9.0804 9.0804 9.4262 9.4262 11.5755 11.5755 11.9667 11.9667 12.3370 12.3370 12.9013 12.9013 k = 0.0000 0.0000 0.5303 ( 2710 PWs) bands (ev): -31.3574 -31.3574 -31.3233 -31.3233 -12.4694 -12.4694 -12.3524 -12.3524 -11.1931 -11.1931 -11.0415 -11.0415 -10.8370 -10.8370 -10.7511 -10.7511 -1.0956 -1.0956 -0.0566 -0.0566 2.5902 2.5902 6.1383 6.1383 7.3730 7.3730 7.5483 7.5483 7.7875 7.7875 8.6880 8.6880 9.1312 9.1312 9.4445 9.4445 11.5484 11.5484 11.8828 11.8828 12.3053 12.3053 12.8570 12.8570 k = 0.0000 0.0000 0.5082 ( 2704 PWs) bands (ev): -31.3583 -31.3583 -31.3241 -31.3241 -12.4667 -12.4667 -12.3466 -12.3466 -11.1871 -11.1871 -11.0324 -11.0324 -10.8352 -10.8352 -10.7522 -10.7522 -1.1452 -1.1452 -0.0991 -0.0991 2.6054 2.6054 6.2237 6.2237 7.3580 7.3580 7.5839 7.5839 7.8773 7.8773 8.7095 8.7095 9.1835 9.1835 9.4635 9.4635 11.5238 11.5238 11.7996 11.7996 12.2449 12.2449 12.8423 12.8423 k = 0.0000 0.0000 0.4861 ( 2700 PWs) bands (ev): -31.3591 -31.3591 -31.3249 -31.3249 -12.4640 -12.4640 -12.3409 -12.3409 -11.1811 -11.1811 -11.0232 -11.0232 -10.8332 -10.8332 -10.7532 -10.7532 -1.1945 -1.1945 -0.1415 -0.1415 2.6206 2.6206 6.3078 6.3078 7.3466 7.3466 7.6198 7.6198 7.9684 7.9684 8.7317 8.7317 9.2371 9.2371 9.4830 9.4830 11.5017 11.5017 11.7171 11.7171 12.1622 12.1622 12.8508 12.8508 k = 0.0000 0.0000 0.4640 ( 2700 PWs) bands (ev): -31.3600 -31.3600 -31.3258 -31.3258 -12.4615 -12.4615 -12.3352 -12.3352 -11.1752 -11.1752 -11.0138 -11.0138 -10.8309 -10.8309 -10.7542 -10.7542 -1.2433 -1.2433 -0.1835 -0.1835 2.6357 2.6357 6.3895 6.3895 7.3397 7.3397 7.6559 7.6559 8.0603 8.0603 8.7548 8.7548 9.2918 9.2918 9.5030 9.5030 11.4822 11.4822 11.6356 11.6356 12.0655 12.0655 12.8741 12.8741 k = 0.0000 0.0000 0.4419 ( 2694 PWs) bands (ev): -31.3609 -31.3609 -31.3266 -31.3266 -12.4589 -12.4589 -12.3296 -12.3296 -11.1695 -11.1695 -11.0045 -11.0045 -10.8284 -10.8284 -10.7551 -10.7551 -1.2913 -1.2913 -0.2250 -0.2250 2.6509 2.6509 6.4673 6.4673 7.3385 7.3385 7.6919 7.6919 8.1524 8.1524 8.7789 8.7789 9.3474 9.3474 9.5235 9.5235 11.4653 11.4653 11.5553 11.5553 11.9609 11.9609 12.9058 12.9058 k = 0.0000 0.0000 0.4199 ( 2694 PWs) bands (ev): -31.3617 -31.3617 -31.3274 -31.3274 -12.4565 -12.4565 -12.3242 -12.3242 -11.1640 -11.1640 -10.9951 -10.9951 -10.8256 -10.8256 -10.7559 -10.7559 -1.3384 -1.3384 -0.2657 -0.2657 2.6658 2.6658 6.5393 6.5393 7.3448 7.3448 7.7277 7.7277 8.2439 8.2439 8.8044 8.8044 9.4036 9.4036 9.5444 9.5444 11.4491 11.4491 11.4781 11.4781 11.8522 11.8522 12.9421 12.9421 k = 0.0000 0.0000 0.3978 ( 2694 PWs) bands (ev): -31.3626 -31.3626 -31.3282 -31.3282 -12.4542 -12.4542 -12.3190 -12.3190 -11.1587 -11.1587 -10.9858 -10.9858 -10.8226 -10.8226 -10.7566 -10.7566 -1.3843 -1.3843 -0.3055 -0.3055 2.6805 2.6805 6.6038 6.6038 7.3600 7.3600 7.7631 7.7631 8.3339 8.3339 8.8320 8.8320 9.4602 9.4602 9.5657 9.5657 11.3943 11.3943 11.4437 11.4437 11.7417 11.7417 12.9805 12.9805 k = 0.0000 0.0000 0.3757 ( 2688 PWs) bands (ev): -31.3634 -31.3634 -31.3290 -31.3290 -12.4520 -12.4520 -12.3139 -12.3139 -11.1536 -11.1536 -10.9766 -10.9766 -10.8194 -10.8194 -10.7572 -10.7572 -1.4288 -1.4288 -0.3442 -0.3442 2.6949 2.6949 6.6589 6.6589 7.3859 7.3859 7.7978 7.7978 8.4210 8.4210 8.8627 8.8627 9.5168 9.5168 9.5875 9.5875 11.3182 11.3182 11.4346 11.4346 11.6308 11.6308 13.0195 13.0195 k = 0.0000 0.0000 0.3536 ( 2692 PWs) bands (ev): -31.3642 -31.3642 -31.3298 -31.3298 -12.4499 -12.4499 -12.3091 -12.3091 -11.1488 -11.1488 -10.9676 -10.9676 -10.8160 -10.8160 -10.7577 -10.7577 -1.4718 -1.4718 -0.3816 -0.3816 2.7089 2.7089 6.7035 6.7035 7.4231 7.4231 7.8316 7.8316 8.5031 8.5031 8.8980 8.8980 9.5730 9.5730 9.6096 9.6096 11.2424 11.2424 11.4292 11.4292 11.5203 11.5203 13.0582 13.0582 k = 0.0000 0.0000 0.3315 ( 2694 PWs) bands (ev): -31.3650 -31.3650 -31.3305 -31.3305 -12.4479 -12.4479 -12.3045 -12.3045 -11.1443 -11.1443 -10.9589 -10.9589 -10.8124 -10.8124 -10.7581 -10.7581 -1.5131 -1.5131 -0.4176 -0.4176 2.7224 2.7224 6.7373 6.7373 7.4717 7.4717 7.8644 7.8644 8.5781 8.5781 8.9400 8.9400 9.6265 9.6265 9.6343 9.6343 11.1678 11.1678 11.4103 11.4103 11.4271 11.4271 13.0958 13.0958 k = 0.0000 0.0000 0.3094 ( 2692 PWs) bands (ev): -31.3657 -31.3657 -31.3312 -31.3312 -12.4460 -12.4460 -12.3001 -12.3001 -11.1402 -11.1402 -10.9505 -10.9505 -10.8088 -10.8088 -10.7583 -10.7583 -1.5526 -1.5526 -0.4521 -0.4521 2.7354 2.7354 6.7613 6.7613 7.5303 7.5303 7.8960 7.8960 8.6433 8.6433 8.9907 8.9907 9.6536 9.6536 9.6847 9.6847 11.0944 11.0944 11.3025 11.3025 11.4269 11.4269 13.1318 13.1318 k = 0.0000 0.0000 0.2873 ( 2697 PWs) bands (ev): -31.3664 -31.3664 -31.3319 -31.3319 -12.4443 -12.4443 -12.2960 -12.2960 -11.1363 -11.1363 -10.9425 -10.9425 -10.8050 -10.8050 -10.7584 -10.7584 -1.5900 -1.5900 -0.4848 -0.4848 2.7478 2.7478 6.7772 6.7772 7.5968 7.5968 7.9261 7.9261 8.6973 8.6973 9.0514 9.0514 9.6766 9.6766 9.7381 9.7381 11.0221 11.0221 11.1962 11.1962 11.4295 11.4295 13.1659 13.1659 k = 0.0000 0.0000 0.2652 ( 2693 PWs) bands (ev): -31.3671 -31.3671 -31.3326 -31.3326 -12.4427 -12.4427 -12.2922 -12.2922 -11.1328 -11.1328 -10.9349 -10.9349 -10.8013 -10.8013 -10.7583 -10.7583 -1.6253 -1.6253 -0.5156 -0.5156 2.7595 2.7595 6.7867 6.7867 7.6690 7.6690 7.9547 7.9547 8.7404 8.7404 9.1213 9.1213 9.6996 9.6996 9.7901 9.7901 10.9509 10.9509 11.0919 11.0919 11.4344 11.4344 13.1978 13.1978 k = 0.0000 0.0000 0.2431 ( 2695 PWs) bands (ev): -31.3677 -31.3677 -31.3332 -31.3332 -12.4412 -12.4412 -12.2886 -12.2886 -11.1296 -11.1296 -10.9278 -10.9278 -10.7976 -10.7976 -10.7581 -10.7581 -1.6583 -1.6583 -0.5445 -0.5445 2.7706 2.7706 6.7916 6.7916 7.7447 7.7447 7.9815 7.9815 8.7744 8.7744 9.1984 9.1984 9.7229 9.7229 9.8400 9.8400 10.8808 10.8808 10.9900 10.9900 11.4412 11.4412 13.2273 13.2273 k = 0.0000 0.0000 0.2210 ( 2697 PWs) bands (ev): -31.3683 -31.3683 -31.3337 -31.3337 -12.4399 -12.4399 -12.2853 -12.2853 -11.1268 -11.1268 -10.9213 -10.9213 -10.7939 -10.7939 -10.7577 -10.7577 -1.6888 -1.6888 -0.5712 -0.5712 2.7808 2.7808 6.7932 6.7932 7.8217 7.8217 8.0064 8.0064 8.8013 8.8013 9.2803 9.2803 9.7465 9.7465 9.8875 9.8875 10.8114 10.8114 10.8907 10.8907 11.4496 11.4496 13.2543 13.2543 k = 0.0000 0.0000 0.1989 ( 2705 PWs) bands (ev): -31.3689 -31.3689 -31.3343 -31.3343 -12.4387 -12.4387 -12.2824 -12.2824 -11.1242 -11.1242 -10.9153 -10.9153 -10.7904 -10.7904 -10.7573 -10.7573 -1.7169 -1.7169 -0.5958 -0.5958 2.7903 2.7903 6.7927 6.7927 7.8984 7.8984 8.0294 8.0294 8.8230 8.8230 9.3648 9.3648 9.7705 9.7705 9.9321 9.9321 10.7428 10.7428 10.7945 10.7945 11.4592 11.4592 13.2786 13.2786 k = 0.0000 0.0000 0.1768 ( 2705 PWs) bands (ev): -31.3694 -31.3694 -31.3347 -31.3347 -12.4376 -12.4376 -12.2797 -12.2797 -11.1220 -11.1220 -10.9100 -10.9100 -10.7871 -10.7871 -10.7568 -10.7568 -1.7422 -1.7422 -0.6181 -0.6181 2.7988 2.7988 6.7909 6.7909 7.9730 7.9730 8.0502 8.0502 8.8407 8.8407 9.4504 9.4504 9.7951 9.7951 9.9735 9.9735 10.6746 10.6746 10.7016 10.7016 11.4697 11.4697 13.3003 13.3003 k = 0.0000 0.0000 0.1547 ( 2709 PWs) bands (ev): -31.3698 -31.3698 -31.3352 -31.3352 -12.4366 -12.4366 -12.2773 -12.2773 -11.1200 -11.1200 -10.9052 -10.9052 -10.7841 -10.7841 -10.7562 -10.7562 -1.7648 -1.7648 -0.6379 -0.6379 2.8065 2.8065 6.7882 6.7882 8.0435 8.0435 8.0694 8.0694 8.8553 8.8553 9.5361 9.5361 9.8205 9.8205 10.0111 10.0111 10.6064 10.6064 10.6129 10.6129 11.4805 11.4805 13.3193 13.3193 k = 0.0000 0.0000 0.1326 ( 2707 PWs) bands (ev): -31.3702 -31.3702 -31.3355 -31.3355 -12.4358 -12.4358 -12.2753 -12.2753 -11.1184 -11.1184 -10.9011 -10.9011 -10.7813 -10.7813 -10.7556 -10.7556 -1.7846 -1.7846 -0.6553 -0.6553 2.8132 2.8132 6.7853 6.7853 8.0838 8.0838 8.1114 8.1114 8.8673 8.8673 9.6210 9.6210 9.8469 9.8469 10.0446 10.0446 10.5273 10.5273 10.5396 10.5396 11.4913 11.4913 13.3356 13.3356 k = 0.0000 0.0000 0.1105 ( 2701 PWs) bands (ev): -31.3705 -31.3705 -31.3359 -31.3359 -12.4351 -12.4351 -12.2735 -12.2735 -11.1170 -11.1170 -10.8977 -10.8977 -10.7789 -10.7789 -10.7549 -10.7549 -1.8015 -1.8015 -0.6701 -0.6701 2.8190 2.8190 6.7824 6.7824 8.0982 8.0982 8.1703 8.1703 8.8771 8.8771 9.7045 9.7045 9.8746 9.8746 10.0737 10.0737 10.4478 10.4478 10.4717 10.4717 11.5014 11.5014 13.3493 13.3493 k = 0.0000 0.0000 0.0884 ( 2697 PWs) bands (ev): -31.3708 -31.3708 -31.3361 -31.3361 -12.4345 -12.4345 -12.2721 -12.2721 -11.1159 -11.1159 -10.8949 -10.8949 -10.7769 -10.7769 -10.7544 -10.7544 -1.8153 -1.8153 -0.6823 -0.6823 2.8237 2.8237 6.7797 6.7797 8.1097 8.1097 8.2216 8.2216 8.8848 8.8848 9.7860 9.7860 9.9036 9.9036 10.0981 10.0981 10.3741 10.3741 10.4038 10.4038 11.5105 11.5105 13.3605 13.3605 k = 0.0000 0.0000 0.0663 ( 2697 PWs) bands (ev): -31.3710 -31.3710 -31.3363 -31.3363 -12.4341 -12.4341 -12.2710 -12.2710 -11.1150 -11.1150 -10.8927 -10.8927 -10.7752 -10.7752 -10.7539 -10.7539 -1.8262 -1.8262 -0.6918 -0.6918 2.8274 2.8274 6.7775 6.7775 8.1186 8.1186 8.2635 8.2635 8.8907 8.8907 9.8648 9.8648 9.9338 9.9338 10.1174 10.1174 10.3076 10.3076 10.3360 10.3360 11.5181 11.5181 13.3690 13.3690 k = 0.0000 0.0000 0.0442 ( 2695 PWs) bands (ev): -31.3711 -31.3711 -31.3365 -31.3365 -12.4338 -12.4338 -12.2702 -12.2702 -11.1144 -11.1144 -10.8912 -10.8912 -10.7741 -10.7741 -10.7535 -10.7535 -1.8340 -1.8340 -0.6987 -0.6987 2.8301 2.8301 6.7758 6.7758 8.1250 8.1250 8.2945 8.2945 8.8949 8.8949 9.9393 9.9393 9.9639 9.9639 10.1316 10.1316 10.2509 10.2509 10.2693 10.2693 11.5238 11.5238 13.3751 13.3751 k = 0.0000 0.0000 0.0221 ( 2695 PWs) bands (ev): -31.3712 -31.3712 -31.3366 -31.3366 -12.4336 -12.4336 -12.2697 -12.2697 -11.1140 -11.1140 -10.8902 -10.8902 -10.7733 -10.7733 -10.7533 -10.7533 -1.8387 -1.8387 -0.7028 -0.7028 2.8317 2.8317 6.7748 6.7748 8.1289 8.1289 8.3135 8.3135 8.8973 8.8973 9.9867 9.9867 10.0077 10.0077 10.1406 10.1406 10.2080 10.2080 10.2090 10.2090 11.5273 11.5273 13.3788 13.3788 k = 0.0000 0.0000 0.0000 ( 2699 PWs) bands (ev): -31.3713 -31.3713 -31.3366 -31.3366 -12.4335 -12.4335 -12.2695 -12.2695 -11.1139 -11.1139 -10.8899 -10.8899 -10.7731 -10.7731 -10.7532 -10.7532 -1.8402 -1.8402 -0.7042 -0.7042 2.8322 2.8322 6.7744 6.7744 8.1302 8.1302 8.3200 8.3200 8.8982 8.8982 9.9978 9.9978 10.0415 10.0415 10.1439 10.1439 10.1755 10.1755 10.1922 10.1922 11.5285 11.5285 13.3800 13.3800 k = 0.0000 0.0000 0.0000 ( 2699 PWs) bands (ev): -31.3713 -31.3713 -31.3366 -31.3366 -12.4335 -12.4335 -12.2695 -12.2695 -11.1139 -11.1139 -10.8899 -10.8899 -10.7731 -10.7731 -10.7532 -10.7532 -1.8402 -1.8402 -0.7042 -0.7042 2.8322 2.8322 6.7744 6.7744 8.1302 8.1302 8.3200 8.3200 8.8982 8.8982 9.9978 9.9978 10.0415 10.0415 10.1439 10.1439 10.1755 10.1755 10.1922 10.1922 11.5285 11.5285 13.3800 13.3800 k =-0.0217 0.0054-0.0000 ( 2695 PWs) bands (ev): -31.3712 -31.3712 -31.3366 -31.3366 -12.4334 -12.4334 -12.2696 -12.2696 -11.1138 -11.1138 -10.8901 -10.8901 -10.7732 -10.7732 -10.7532 -10.7532 -1.8394 -1.8394 -0.7058 -0.7058 2.8347 2.8347 6.7673 6.7673 8.1300 8.1300 8.3201 8.3201 8.9057 8.9057 9.9705 9.9705 10.0696 10.0696 10.1455 10.1455 10.1722 10.1722 10.1959 10.1959 11.5262 11.5262 13.3807 13.3807 k =-0.0435 0.0108-0.0000 ( 2701 PWs) bands (ev): -31.3712 -31.3712 -31.3367 -31.3367 -12.4329 -12.4329 -12.2700 -12.2700 -11.1132 -11.1132 -10.8908 -10.8908 -10.7733 -10.7733 -10.7532 -10.7532 -1.8368 -1.8368 -0.7106 -0.7106 2.8424 2.8424 6.7463 6.7463 8.1294 8.1294 8.3206 8.3206 8.9279 8.9279 9.9298 9.9298 10.1114 10.1114 10.1510 10.1510 10.1659 10.1659 10.2035 10.2035 11.5192 11.5192 13.3829 13.3829 k =-0.0652 0.0161-0.0000 ( 2707 PWs) bands (ev): -31.3710 -31.3710 -31.3368 -31.3368 -12.4321 -12.4321 -12.2706 -12.2706 -11.1124 -11.1124 -10.8918 -10.8918 -10.7736 -10.7736 -10.7532 -10.7532 -1.8324 -1.8324 -0.7185 -0.7185 2.8550 2.8550 6.7124 6.7124 8.1284 8.1284 8.3214 8.3214 8.9638 8.9638 9.8887 9.8887 10.1442 10.1442 10.1598 10.1598 10.1696 10.1696 10.2126 10.2126 11.5077 11.5077 13.3863 13.3863 k =-0.0870 0.0215-0.0000 ( 2707 PWs) bands (ev): -31.3709 -31.3709 -31.3370 -31.3370 -12.4309 -12.4309 -12.2714 -12.2714 -11.1112 -11.1112 -10.8932 -10.8932 -10.7740 -10.7740 -10.7532 -10.7532 -1.8264 -1.8264 -0.7295 -0.7295 2.8724 2.8724 6.6670 6.6670 8.1271 8.1271 8.3225 8.3225 9.0119 9.0119 9.8486 9.8486 10.1480 10.1480 10.1630 10.1630 10.2098 10.2098 10.2240 10.2240 11.4919 11.4919 13.3907 13.3907 k =-0.1087 0.0269-0.0000 ( 2711 PWs) bands (ev): -31.3706 -31.3706 -31.3372 -31.3372 -12.4295 -12.4295 -12.2724 -12.2724 -11.1097 -11.1097 -10.8950 -10.8950 -10.7745 -10.7745 -10.7532 -10.7532 -1.8187 -1.8187 -0.7434 -0.7434 2.8944 2.8944 6.6118 6.6118 8.1255 8.1255 8.3239 8.3239 9.0704 9.0704 9.8097 9.8097 10.1412 10.1412 10.1749 10.1749 10.2318 10.2318 10.2594 10.2594 11.4720 11.4720 13.3957 13.3957 k =-0.1304 0.0323-0.0000 ( 2713 PWs) bands (ev): -31.3704 -31.3704 -31.3375 -31.3375 -12.4277 -12.4277 -12.2737 -12.2737 -11.1078 -11.1078 -10.8972 -10.8972 -10.7750 -10.7750 -10.7531 -10.7531 -1.8094 -1.8094 -0.7599 -0.7599 2.9208 2.9208 6.5487 6.5487 8.1236 8.1236 8.3254 8.3254 9.1376 9.1376 9.7722 9.7722 10.1334 10.1334 10.1894 10.1894 10.2439 10.2439 10.3065 10.3065 11.4481 11.4481 13.4009 13.4009 k =-0.1522 0.0377-0.0000 ( 2707 PWs) bands (ev): -31.3700 -31.3700 -31.3378 -31.3378 -12.4257 -12.4257 -12.2751 -12.2751 -11.1057 -11.1057 -10.8998 -10.8998 -10.7756 -10.7756 -10.7531 -10.7531 -1.7984 -1.7984 -0.7789 -0.7789 2.9512 2.9512 6.4794 6.4794 8.1215 8.1215 8.3272 8.3272 9.2117 9.2117 9.7364 9.7364 10.1253 10.1253 10.2064 10.2064 10.2564 10.2564 10.3543 10.3543 11.4208 11.4208 13.4058 13.4058 k =-0.1739 0.0430-0.0000 ( 2703 PWs) bands (ev): -31.3697 -31.3697 -31.3382 -31.3382 -12.4235 -12.4235 -12.2768 -12.2768 -11.1032 -11.1032 -10.9027 -10.9027 -10.7763 -10.7763 -10.7530 -10.7530 -1.7860 -1.7860 -0.8001 -0.8001 2.9852 2.9852 6.4054 6.4054 8.1191 8.1191 8.3292 8.3292 9.2908 9.2908 9.7022 9.7022 10.1171 10.1171 10.2257 10.2257 10.2695 10.2695 10.4020 10.4020 11.3901 11.3901 13.4096 13.4096 k =-0.1957 0.0484-0.0000 ( 2703 PWs) bands (ev): -31.3693 -31.3693 -31.3386 -31.3386 -12.4210 -12.4210 -12.2786 -12.2786 -11.1005 -11.1005 -10.9059 -10.9059 -10.7770 -10.7770 -10.7530 -10.7530 -1.7721 -1.7721 -0.8233 -0.8233 3.0224 3.0224 6.3281 6.3281 8.1166 8.1166 8.3313 8.3313 9.3734 9.3734 9.6698 9.6698 10.1089 10.1089 10.2474 10.2474 10.2833 10.2833 10.4493 10.4493 11.3566 11.3566 13.4118 13.4118 k =-0.2174 0.0538-0.0000 ( 2703 PWs) bands (ev): -31.3688 -31.3688 -31.3390 -31.3390 -12.4183 -12.4183 -12.2806 -12.2806 -11.0975 -11.0975 -10.9095 -10.9095 -10.7777 -10.7777 -10.7529 -10.7529 -1.7569 -1.7569 -0.8482 -0.8482 3.0623 3.0623 6.2490 6.2490 8.1140 8.1140 8.3336 8.3336 9.4581 9.4581 9.6392 9.6392 10.1007 10.1007 10.2712 10.2712 10.2976 10.2976 10.4958 10.4958 11.3205 11.3205 13.4116 13.4116 k =-0.2391 0.0592-0.0000 ( 2709 PWs) bands (ev): -31.3684 -31.3684 -31.3395 -31.3395 -12.4155 -12.4155 -12.2828 -12.2828 -11.0943 -11.0943 -10.9133 -10.9133 -10.7784 -10.7784 -10.7529 -10.7529 -1.7405 -1.7405 -0.8744 -0.8744 3.1043 3.1043 6.1691 6.1691 8.1113 8.1113 8.3359 8.3359 9.5431 9.5431 9.6109 9.6109 10.0929 10.0929 10.2971 10.2971 10.3125 10.3125 10.5413 10.5413 11.2821 11.2821 13.4084 13.4084 k =-0.2609 0.0645-0.0000 ( 2711 PWs) bands (ev): -31.3679 -31.3679 -31.3400 -31.3400 -12.4125 -12.4125 -12.2850 -12.2850 -11.0910 -11.0910 -10.9173 -10.9173 -10.7790 -10.7790 -10.7528 -10.7528 -1.7230 -1.7230 -0.9017 -0.9017 3.1479 3.1479 6.0896 6.0896 8.1086 8.1086 8.3382 8.3382 9.5828 9.5828 9.6291 9.6291 10.0855 10.0855 10.3233 10.3233 10.3294 10.3294 10.5852 10.5852 11.2418 11.2418 13.4017 13.4017 k =-0.2826 0.0699-0.0000 ( 2707 PWs) bands (ev): -31.3674 -31.3674 -31.3404 -31.3404 -12.4095 -12.4095 -12.2874 -12.2874 -11.0874 -11.0874 -10.9215 -10.9215 -10.7797 -10.7797 -10.7528 -10.7528 -1.7046 -1.7046 -0.9297 -0.9297 3.1925 3.1925 6.0116 6.0116 8.1060 8.1060 8.3406 8.3406 9.5588 9.5588 9.7110 9.7110 10.0788 10.0788 10.3412 10.3412 10.3566 10.3566 10.6274 10.6274 11.1999 11.1999 13.3911 13.3911 k =-0.3043 0.0753-0.0000 ( 2711 PWs) bands (ev): -31.3670 -31.3670 -31.3410 -31.3410 -12.4064 -12.4064 -12.2898 -12.2898 -11.0838 -11.0838 -10.9258 -10.9258 -10.7803 -10.7803 -10.7527 -10.7527 -1.6855 -1.6855 -0.9579 -0.9579 3.2371 3.2371 5.9361 5.9361 8.1034 8.1034 8.3429 8.3429 9.5364 9.5364 9.7896 9.7896 10.0734 10.0734 10.3565 10.3565 10.3883 10.3883 10.6673 10.6673 11.1567 11.1567 13.3766 13.3766 k =-0.3261 0.0807-0.0000 ( 2699 PWs) bands (ev): -31.3665 -31.3665 -31.3414 -31.3414 -12.4033 -12.4033 -12.2922 -12.2922 -11.0802 -11.0802 -10.9301 -10.9301 -10.7808 -10.7808 -10.7526 -10.7526 -1.6659 -1.6659 -0.9861 -0.9861 3.2811 3.2811 5.8641 5.8641 8.1010 8.1010 8.3451 8.3451 9.5161 9.5161 9.8624 9.8624 10.0701 10.0701 10.3713 10.3713 10.4220 10.4220 10.7046 10.7046 11.1125 11.1125 13.3587 13.3587 k =-0.3478 0.0861-0.0000 ( 2705 PWs) bands (ev): -31.3660 -31.3660 -31.3419 -31.3419 -12.4003 -12.4003 -12.2946 -12.2946 -11.0765 -11.0765 -10.9343 -10.9343 -10.7814 -10.7814 -10.7526 -10.7526 -1.6463 -1.6463 -1.0137 -1.0137 3.3236 3.3236 5.7967 5.7967 8.0988 8.0988 8.3472 8.3472 9.4981 9.4981 9.9260 9.9260 10.0711 10.0711 10.3857 10.3857 10.4573 10.4573 10.7388 10.7388 11.0676 11.0676 13.3379 13.3379 k =-0.3696 0.0914-0.0000 ( 2711 PWs) bands (ev): -31.3656 -31.3656 -31.3424 -31.3424 -12.3975 -12.3975 -12.2969 -12.2969 -11.0731 -11.0731 -10.9384 -10.9384 -10.7818 -10.7818 -10.7526 -10.7526 -1.6270 -1.6270 -1.0401 -1.0401 3.3634 3.3634 5.7350 5.7350 8.0967 8.0967 8.3491 8.3491 9.4823 9.4823 9.9743 9.9743 10.0813 10.0813 10.3995 10.3995 10.4942 10.4942 10.7696 10.7696 11.0221 11.0221 13.3155 13.3155 k =-0.3913 0.0968-0.0000 ( 2713 PWs) bands (ev): -31.3652 -31.3652 -31.3428 -31.3428 -12.3949 -12.3949 -12.2990 -12.2990 -11.0698 -11.0698 -10.9422 -10.9422 -10.7822 -10.7822 -10.7525 -10.7525 -1.6085 -1.6085 -1.0648 -1.0648 3.3998 3.3998 5.6801 5.6801 8.0950 8.0950 8.3508 8.3508 9.4688 9.4688 10.0006 10.0006 10.1062 10.1062 10.4125 10.4125 10.5325 10.5325 10.7963 10.7963 10.9765 10.9765 13.2928 13.2928 k =-0.4130 0.1022-0.0000 ( 2717 PWs) bands (ev): -31.3648 -31.3648 -31.3431 -31.3431 -12.3926 -12.3926 -12.3009 -12.3009 -11.0669 -11.0669 -10.9456 -10.9456 -10.7825 -10.7825 -10.7525 -10.7525 -1.5917 -1.5917 -1.0869 -1.0869 3.4314 3.4314 5.6332 5.6332 8.0935 8.0935 8.3522 8.3522 9.4578 9.4578 10.0102 10.0102 10.1395 10.1395 10.4244 10.4244 10.5720 10.5720 10.8187 10.8187 10.9311 10.9311 13.2714 13.2714 k =-0.4348 0.1076-0.0000 ( 2723 PWs) bands (ev): -31.3645 -31.3645 -31.3434 -31.3434 -12.3907 -12.3907 -12.3024 -12.3024 -11.0644 -11.0644 -10.9484 -10.9484 -10.7828 -10.7828 -10.7525 -10.7525 -1.5771 -1.5771 -1.1056 -1.1056 3.4574 3.4574 5.5953 5.5953 8.0923 8.0923 8.3533 8.3533 9.4491 9.4491 10.0130 10.0130 10.1706 10.1706 10.4347 10.4347 10.6124 10.6124 10.8355 10.8355 10.8869 10.8869 13.2527 13.2527 k =-0.4565 0.1130-0.0000 ( 2715 PWs) bands (ev): -31.3643 -31.3643 -31.3436 -31.3436 -12.3892 -12.3892 -12.3036 -12.3036 -11.0625 -11.0625 -10.9505 -10.9505 -10.7830 -10.7830 -10.7524 -10.7524 -1.5658 -1.5658 -1.1199 -1.1199 3.4768 3.4768 5.5674 5.5674 8.0914 8.0914 8.3542 8.3542 9.4429 9.4429 10.0135 10.0135 10.1944 10.1944 10.4428 10.4428 10.6533 10.6533 10.8342 10.8342 10.8570 10.8570 13.2383 13.2383 k =-0.4783 0.1183-0.0000 ( 2713 PWs) bands (ev): -31.3642 -31.3642 -31.3438 -31.3438 -12.3883 -12.3883 -12.3044 -12.3044 -11.0613 -11.0613 -10.9518 -10.9518 -10.7831 -10.7831 -10.7524 -10.7524 -1.5586 -1.5586 -1.1289 -1.1289 3.4887 3.4887 5.5503 5.5503 8.0909 8.0909 8.3547 8.3547 9.4392 9.4392 10.0134 10.0134 10.2090 10.2090 10.4481 10.4481 10.6927 10.6927 10.7971 10.7971 10.8605 10.8605 13.2292 13.2292 k =-0.5000 0.1237-0.0000 ( 2718 PWs) bands (ev): -31.3641 -31.3641 -31.3438 -31.3438 -12.3880 -12.3880 -12.3046 -12.3046 -11.0609 -11.0609 -10.9523 -10.9523 -10.7831 -10.7831 -10.7524 -10.7524 -1.5561 -1.5561 -1.1320 -1.1320 3.4928 3.4928 5.5446 5.5446 8.0907 8.0907 8.3549 8.3549 9.4380 9.4380 10.0134 10.0134 10.2139 10.2139 10.4499 10.4499 10.7167 10.7167 10.7728 10.7728 10.8628 10.8628 13.2261 13.2261 k =-0.5000 0.1237-0.0000 ( 2718 PWs) bands (ev): -31.3641 -31.3641 -31.3438 -31.3438 -12.3880 -12.3880 -12.3046 -12.3046 -11.0609 -11.0609 -10.9523 -10.9523 -10.7831 -10.7831 -10.7524 -10.7524 -1.5561 -1.5561 -1.1320 -1.1320 3.4928 3.4928 5.5446 5.5446 8.0907 8.0907 8.3549 8.3549 9.4380 9.4380 10.0134 10.0134 10.2139 10.2139 10.4499 10.4499 10.7167 10.7167 10.7728 10.7728 10.8628 10.8628 13.2261 13.2261 k =-0.4947 0.1453-0.0000 ( 2718 PWs) bands (ev): -31.3641 -31.3641 -31.3438 -31.3438 -12.3881 -12.3881 -12.3048 -12.3048 -11.0610 -11.0610 -10.9523 -10.9523 -10.7835 -10.7835 -10.7530 -10.7530 -1.5546 -1.5546 -1.1307 -1.1307 3.4931 3.4931 5.5443 5.5443 8.0817 8.0817 8.3542 8.3542 9.4348 9.4348 10.0221 10.0221 10.2094 10.2094 10.4408 10.4408 10.7288 10.7288 10.7684 10.7684 10.8616 10.8616 13.2261 13.2261 k =-0.4893 0.1668-0.0000 ( 2716 PWs) bands (ev): -31.3639 -31.3639 -31.3436 -31.3436 -12.3884 -12.3884 -12.3052 -12.3052 -11.0611 -11.0611 -10.9523 -10.9523 -10.7847 -10.7847 -10.7546 -10.7546 -1.5502 -1.5502 -1.1268 -1.1268 3.4941 3.4941 5.5437 5.5437 8.0550 8.0550 8.3523 8.3523 9.4252 9.4252 10.0477 10.0477 10.1948 10.1948 10.4194 10.4194 10.7544 10.7544 10.7612 10.7612 10.8581 10.8581 13.2260 13.2260 k =-0.4840 0.1884-0.0000 ( 2708 PWs) bands (ev): -31.3636 -31.3636 -31.3434 -31.3434 -12.3888 -12.3888 -12.3060 -12.3060 -11.0614 -11.0614 -10.9524 -10.9524 -10.7867 -10.7867 -10.7572 -10.7572 -1.5429 -1.5429 -1.1203 -1.1203 3.4957 3.4957 5.5425 5.5425 8.0122 8.0122 8.3490 8.3490 9.4095 9.4095 10.0887 10.0887 10.1679 10.1679 10.3960 10.3960 10.7336 10.7336 10.8022 10.8022 10.8537 10.8537 13.2259 13.2259 k =-0.4787 0.2099-0.0000 ( 2708 PWs) bands (ev): -31.3631 -31.3631 -31.3430 -31.3430 -12.3893 -12.3893 -12.3071 -12.3071 -11.0618 -11.0618 -10.9525 -10.9525 -10.7894 -10.7894 -10.7608 -10.7608 -1.5328 -1.5328 -1.1113 -1.1113 3.4979 3.4979 5.5408 5.5408 7.9551 7.9551 8.3443 8.3443 9.3876 9.3876 10.1271 10.1271 10.1433 10.1433 10.3775 10.3775 10.7045 10.7045 10.8322 10.8322 10.8653 10.8653 13.2256 13.2256 k =-0.4733 0.2315-0.0000 ( 2708 PWs) bands (ev): -31.3626 -31.3626 -31.3426 -31.3426 -12.3901 -12.3901 -12.3084 -12.3084 -11.0623 -11.0623 -10.9526 -10.9526 -10.7928 -10.7928 -10.7654 -10.7654 -1.5197 -1.5197 -1.0997 -1.0997 3.5008 3.5008 5.5384 5.5384 7.8860 7.8860 8.3382 8.3382 9.3599 9.3599 10.0740 10.0740 10.2082 10.2082 10.3656 10.3656 10.6690 10.6690 10.8273 10.8273 10.9138 10.9138 13.2249 13.2249 k =-0.4680 0.2531-0.0000 ( 2706 PWs) bands (ev): -31.3619 -31.3619 -31.3421 -31.3421 -12.3910 -12.3910 -12.3101 -12.3101 -11.0630 -11.0630 -10.9528 -10.9528 -10.7969 -10.7969 -10.7709 -10.7709 -1.5039 -1.5039 -1.0856 -1.0856 3.5042 3.5042 5.5353 5.5353 7.8071 7.8071 8.3306 8.3306 9.3266 9.3266 10.0107 10.0107 10.2800 10.2800 10.3591 10.3591 10.6297 10.6297 10.8162 10.8162 10.9697 10.9697 13.2236 13.2236 k =-0.4627 0.2746-0.0000 ( 2710 PWs) bands (ev): -31.3611 -31.3611 -31.3415 -31.3415 -12.3920 -12.3920 -12.3121 -12.3121 -11.0639 -11.0639 -10.9532 -10.9532 -10.8015 -10.8015 -10.7772 -10.7772 -1.4853 -1.4853 -1.0691 -1.0691 3.5083 3.5083 5.5313 5.5313 7.7205 7.7205 8.3214 8.3214 9.2881 9.2881 9.9400 9.9400 10.3505 10.3505 10.3564 10.3564 10.5935 10.5935 10.8036 10.8036 11.0283 11.0283 13.2217 13.2217 k =-0.4573 0.2962-0.0000 ( 2718 PWs) bands (ev): -31.3602 -31.3602 -31.3408 -31.3408 -12.3933 -12.3933 -12.3144 -12.3144 -11.0650 -11.0650 -10.9538 -10.9538 -10.8066 -10.8066 -10.7842 -10.7842 -1.4639 -1.4639 -1.0503 -1.0503 3.5128 3.5128 5.5263 5.5263 7.6279 7.6279 8.3106 8.3106 9.2448 9.2448 9.8637 9.8637 10.3557 10.3557 10.3955 10.3955 10.5844 10.5844 10.7903 10.7903 11.0891 11.0891 13.2188 13.2188 k =-0.4520 0.3177-0.0000 ( 2714 PWs) bands (ev): -31.3592 -31.3592 -31.3401 -31.3401 -12.3947 -12.3947 -12.3170 -12.3170 -11.0664 -11.0664 -10.9546 -10.9546 -10.8121 -10.8121 -10.7918 -10.7918 -1.4399 -1.4399 -1.0291 -1.0291 3.5180 3.5180 5.5201 5.5201 7.5309 7.5309 8.2981 8.2981 9.1970 9.1970 9.7830 9.7830 10.3564 10.3564 10.3821 10.3821 10.6348 10.6348 10.7771 10.7771 11.1520 11.1520 13.2148 13.2148 k =-0.4467 0.3393-0.0000 ( 2708 PWs) bands (ev): -31.3581 -31.3581 -31.3392 -31.3392 -12.3964 -12.3964 -12.3199 -12.3199 -11.0681 -11.0681 -10.9557 -10.9557 -10.8178 -10.8178 -10.7998 -10.7998 -1.4133 -1.4133 -1.0057 -1.0057 3.5235 3.5235 5.5123 5.5123 7.4309 7.4309 8.2838 8.2838 9.1452 9.1452 9.6989 9.6989 10.3301 10.3301 10.3589 10.3589 10.7231 10.7231 10.7650 10.7650 11.2168 11.2168 13.2095 13.2095 k =-0.4413 0.3608-0.0000 ( 2704 PWs) bands (ev): -31.3569 -31.3569 -31.3383 -31.3383 -12.3982 -12.3982 -12.3232 -12.3232 -11.0702 -11.0702 -10.9573 -10.9573 -10.8237 -10.8237 -10.8080 -10.8080 -1.3841 -1.3841 -0.9802 -0.9802 3.5296 3.5296 5.5027 5.5027 7.3292 7.3292 8.2678 8.2678 9.0897 9.0897 9.6119 9.6119 10.2651 10.2651 10.3605 10.3605 10.7528 10.7528 10.8277 10.8277 11.2835 11.2835 13.2026 13.2026 k =-0.4360 0.3824-0.0000 ( 2704 PWs) bands (ev): -31.3556 -31.3556 -31.3373 -31.3373 -12.4002 -12.4002 -12.3268 -12.3268 -11.0728 -11.0728 -10.9594 -10.9594 -10.8297 -10.8297 -10.8164 -10.8164 -1.3524 -1.3524 -0.9527 -0.9527 3.5360 3.5360 5.4910 5.4910 7.2268 7.2268 8.2498 8.2498 9.0311 9.0311 9.5227 9.5227 10.1931 10.1931 10.3624 10.3624 10.7434 10.7434 10.9392 10.9392 11.3523 11.3523 13.1940 13.1940 k =-0.4307 0.4040-0.0000 ( 2702 PWs) bands (ev): -31.3542 -31.3542 -31.3363 -31.3363 -12.4025 -12.4025 -12.3307 -12.3307 -11.0758 -11.0758 -10.9623 -10.9623 -10.8356 -10.8356 -10.8246 -10.8246 -1.3184 -1.3184 -0.9232 -0.9232 3.5428 3.5428 5.4766 5.4766 7.1248 7.1248 8.2300 8.2300 8.9697 8.9697 9.4317 9.4317 10.1169 10.1169 10.3640 10.3640 10.7360 10.7360 11.0564 11.0564 11.4231 11.4231 13.1835 13.1835 k =-0.4253 0.4255-0.0000 ( 2704 PWs) bands (ev): -31.3527 -31.3527 -31.3352 -31.3352 -12.4049 -12.4049 -12.3349 -12.3349 -11.0793 -11.0793 -10.9659 -10.9659 -10.8412 -10.8412 -10.8325 -10.8325 -1.2820 -1.2820 -0.8919 -0.8919 3.5499 3.5499 5.4591 5.4591 7.0242 7.0242 8.2084 8.2084 8.9061 8.9061 9.3394 9.3394 10.0380 10.0380 10.3651 10.3651 10.7312 10.7312 11.1781 11.1781 11.4957 11.4957 13.1710 13.1710 k =-0.4200 0.4471-0.0000 ( 2704 PWs) bands (ev): -31.3511 -31.3511 -31.3341 -31.3341 -12.4076 -12.4076 -12.3394 -12.3394 -11.0834 -11.0834 -10.9706 -10.9706 -10.8466 -10.8466 -10.8397 -10.8397 -1.2434 -1.2434 -0.8589 -0.8589 3.5573 3.5573 5.4380 5.4380 6.9260 6.9260 8.1849 8.1849 8.8405 8.8405 9.2461 9.2461 9.9573 9.9573 10.3656 10.3656 10.7295 10.7295 11.3036 11.3036 11.5700 11.5700 13.1563 13.1563 k =-0.4147 0.4686-0.0000 ( 2708 PWs) bands (ev): -31.3495 -31.3495 -31.3329 -31.3329 -12.4105 -12.4105 -12.3443 -12.3443 -11.0881 -11.0881 -10.9764 -10.9764 -10.8517 -10.8517 -10.8462 -10.8462 -1.2027 -1.2027 -0.8243 -0.8243 3.5648 3.5648 5.4126 5.4126 6.8313 6.8313 8.1597 8.1597 8.7735 8.7735 9.1522 9.1522 9.8756 9.8756 10.3653 10.3653 10.7310 10.7310 11.4326 11.4326 11.6458 11.6458 13.1393 13.1393 k =-0.4093 0.4902-0.0000 ( 2700 PWs) bands (ev): -31.3478 -31.3478 -31.3316 -31.3316 -12.4136 -12.4136 -12.3494 -12.3494 -11.0933 -11.0933 -10.9834 -10.9834 -10.8562 -10.8562 -10.8517 -10.8517 -1.1600 -1.1600 -0.7882 -0.7882 3.5725 3.5725 5.3823 5.3823 6.7409 6.7409 8.1328 8.1328 8.7053 8.7053 9.0582 9.0582 9.7933 9.7933 10.3642 10.3642 10.7362 10.7362 11.5647 11.5647 11.7229 11.7229 13.1202 13.1202 k =-0.4040 0.5118-0.0000 ( 2708 PWs) bands (ev): -31.3460 -31.3460 -31.3304 -31.3304 -12.4169 -12.4169 -12.3549 -12.3549 -11.0991 -11.0991 -10.9916 -10.9916 -10.8603 -10.8603 -10.8562 -10.8562 -1.1153 -1.1153 -0.7509 -0.7509 3.5803 3.5803 5.3465 5.3465 6.6558 6.6558 8.1045 8.1045 8.6364 8.6364 8.9643 8.9643 9.7110 9.7110 10.3620 10.3620 10.7451 10.7451 11.6996 11.6996 11.8009 11.8009 13.0989 13.0989 k =-0.3987 0.5333-0.0000 ( 2706 PWs) bands (ev): -31.3442 -31.3442 -31.3291 -31.3291 -12.4204 -12.4204 -12.3606 -12.3606 -11.1054 -11.1054 -11.0009 -11.0009 -10.8637 -10.8637 -10.8599 -10.8599 -1.0688 -1.0688 -0.7124 -0.7124 3.5880 3.5880 5.3046 5.3046 6.5768 6.5768 8.0748 8.0748 8.5671 8.5671 8.8710 8.8710 9.6292 9.6292 10.3589 10.3589 10.7580 10.7580 11.8366 11.8366 11.8797 11.8797 13.0757 13.0757 k =-0.3933 0.5549-0.0000 ( 2706 PWs) bands (ev): -31.3423 -31.3423 -31.3277 -31.3277 -12.4241 -12.4241 -12.3667 -12.3667 -11.1122 -11.1122 -11.0112 -11.0112 -10.8664 -10.8664 -10.8627 -10.8627 -1.0205 -1.0205 -0.6729 -0.6729 3.5957 3.5957 5.2561 5.2561 6.5045 6.5045 8.0439 8.0439 8.4977 8.4977 8.7786 8.7786 9.5482 9.5482 10.3547 10.3547 10.7750 10.7750 11.9561 11.9561 11.9778 11.9778 13.0512 13.0512 k =-0.3880 0.5764-0.0000 ( 2712 PWs) bands (ev): -31.3404 -31.3404 -31.3264 -31.3264 -12.4281 -12.4281 -12.3730 -12.3730 -11.1194 -11.1194 -11.0223 -11.0223 -10.8684 -10.8684 -10.8647 -10.8647 -0.9707 -0.9707 -0.6325 -0.6325 3.6033 3.6033 5.2010 5.2010 6.4394 6.4394 8.0121 8.0121 8.4285 8.4285 8.6874 8.6874 9.4684 9.4684 10.3495 10.3495 10.7961 10.7961 12.0353 12.0353 12.1164 12.1164 13.0264 13.0264 k =-0.3827 0.5980-0.0000 ( 2704 PWs) bands (ev): -31.3385 -31.3385 -31.3251 -31.3251 -12.4322 -12.4322 -12.3795 -12.3795 -11.1269 -11.1269 -11.0340 -11.0340 -10.8699 -10.8699 -10.8661 -10.8661 -0.9193 -0.9193 -0.5914 -0.5914 3.6108 3.6108 5.1394 5.1394 6.3814 6.3814 7.9796 7.9796 8.3598 8.3598 8.5977 8.5977 9.3901 9.3901 10.3432 10.3432 10.8213 10.8213 12.1129 12.1129 12.2543 12.2543 13.0034 13.0034 k =-0.3773 0.6195-0.0000 ( 2704 PWs) bands (ev): -31.3365 -31.3365 -31.3237 -31.3237 -12.4364 -12.4364 -12.3862 -12.3862 -11.1347 -11.1347 -11.0462 -11.0462 -10.8708 -10.8708 -10.8670 -10.8670 -0.8666 -0.8666 -0.5498 -0.5498 3.6179 3.6179 5.0715 5.0715 6.3304 6.3304 7.9465 7.9465 8.2919 8.2919 8.5099 8.5099 9.3136 9.3136 10.3359 10.3359 10.8506 10.8506 12.1892 12.1892 12.3861 12.3861 12.9865 12.9865 k =-0.3720 0.6411-0.0000 ( 2708 PWs) bands (ev): -31.3345 -31.3345 -31.3224 -31.3224 -12.4409 -12.4409 -12.3932 -12.3932 -11.1426 -11.1426 -11.0586 -11.0586 -10.8712 -10.8712 -10.8673 -10.8673 -0.8127 -0.8127 -0.5080 -0.5080 3.6248 3.6248 4.9981 4.9981 6.2860 6.2860 7.9132 7.9132 8.2250 8.2250 8.4242 8.4242 9.2391 9.2391 10.3276 10.3276 10.8840 10.8840 12.2640 12.2640 12.5020 12.5020 12.9857 12.9857 k =-0.3667 0.6627-0.0000 ( 2708 PWs) bands (ev): -31.3326 -31.3326 -31.3211 -31.3211 -12.4454 -12.4454 -12.4003 -12.4003 -11.1505 -11.1505 -11.0713 -11.0713 -10.8712 -10.8712 -10.8673 -10.8673 -0.7577 -0.7577 -0.4659 -0.4659 3.6313 3.6313 4.9198 4.9198 6.2476 6.2476 7.8798 7.8798 8.1593 8.1593 8.3410 8.3410 9.1670 9.1670 10.3185 10.3185 10.9215 10.9215 12.3371 12.3371 12.5841 12.5841 13.0187 13.0187 k =-0.3613 0.6842-0.0000 ( 2704 PWs) bands (ev): -31.3306 -31.3306 -31.3198 -31.3198 -12.4501 -12.4501 -12.4076 -12.4076 -11.1584 -11.1584 -11.0839 -11.0839 -10.8707 -10.8707 -10.8670 -10.8670 -0.7017 -0.7017 -0.4240 -0.4240 3.6374 3.6374 4.8377 4.8377 6.2144 6.2144 7.8467 7.8467 8.0950 8.0950 8.2606 8.2606 9.0973 9.0973 10.3086 10.3086 10.9629 10.9629 12.4083 12.4083 12.6176 12.6176 13.1001 13.1001 k =-0.3560 0.7058-0.0000 ( 2700 PWs) bands (ev): -31.3286 -31.3286 -31.3185 -31.3185 -12.4548 -12.4548 -12.4149 -12.4149 -11.1661 -11.1661 -11.0965 -11.0965 -10.8700 -10.8700 -10.8665 -10.8665 -0.6448 -0.6448 -0.3824 -0.3824 3.6430 3.6430 4.7525 4.7525 6.1857 6.1857 7.8140 7.8140 8.0323 8.0323 8.1832 8.1832 9.0303 9.0303 10.2980 10.2980 11.0082 11.0082 12.4775 12.4775 12.6110 12.6110 13.2214 13.2214 k =-0.3506 0.7273-0.0000 ( 2688 PWs) bands (ev): -31.3266 -31.3266 -31.3173 -31.3173 -12.4596 -12.4596 -12.4224 -12.4224 -11.1737 -11.1737 -11.1089 -11.1089 -10.8689 -10.8689 -10.8658 -10.8658 -0.5873 -0.5873 -0.3413 -0.3413 3.6482 3.6482 4.6653 4.6653 6.1608 6.1608 7.7820 7.7820 7.9714 7.9714 8.1090 8.1090 8.9662 8.9662 10.2868 10.2868 11.0574 11.0574 12.5446 12.5446 12.5818 12.5818 13.3652 13.3652 k =-0.3453 0.7489-0.0000 ( 2686 PWs) bands (ev): -31.3247 -31.3247 -31.3161 -31.3161 -12.4644 -12.4644 -12.4298 -12.4298 -11.1809 -11.1809 -11.1211 -11.1211 -10.8676 -10.8676 -10.8650 -10.8650 -0.5293 -0.5293 -0.3009 -0.3009 3.6528 3.6528 4.5768 4.5768 6.1391 6.1391 7.7508 7.7508 7.9125 7.9125 8.0384 8.0384 8.9049 8.9049 10.2751 10.2751 11.1102 11.1102 12.5392 12.5392 12.6108 12.6108 13.5206 13.5206 k =-0.3400 0.7705-0.0000 ( 2687 PWs) bands (ev): -31.3228 -31.3228 -31.3149 -31.3149 -12.4691 -12.4691 -12.4373 -12.4373 -11.1879 -11.1879 -11.1330 -11.1330 -10.8661 -10.8661 -10.8641 -10.8641 -0.4710 -0.4710 -0.2616 -0.2616 3.6570 3.6570 4.4877 4.4877 6.1201 6.1201 7.7208 7.7208 7.8556 7.8556 7.9716 7.9716 8.8467 8.8467 10.2631 10.2631 11.1667 11.1667 12.4900 12.4900 12.6747 12.6747 13.6817 13.6817 k =-0.3346 0.7920-0.0000 ( 2699 PWs) bands (ev): -31.3209 -31.3209 -31.3139 -31.3139 -12.4738 -12.4738 -12.4447 -12.4447 -11.1944 -11.1944 -11.1446 -11.1446 -10.8646 -10.8646 -10.8630 -10.8630 -0.4125 -0.4125 -0.2235 -0.2235 3.6608 3.6608 4.3988 4.3988 6.1033 6.1033 7.6921 7.6921 7.8009 7.8009 7.9087 7.9087 8.7916 8.7916 10.2509 10.2509 11.2267 11.2267 12.4358 12.4358 12.7374 12.7374 13.8437 13.8437 k =-0.3293 0.8136-0.0000 ( 2701 PWs) bands (ev): -31.3191 -31.3191 -31.3128 -31.3128 -12.4784 -12.4784 -12.4521 -12.4521 -11.2005 -11.2005 -11.1557 -11.1557 -10.8630 -10.8630 -10.8618 -10.8618 -0.3542 -0.3542 -0.1869 -0.1869 3.6641 3.6641 4.3106 4.3106 6.0884 6.0884 7.6648 7.6648 7.7486 7.7486 7.8501 7.8501 8.7397 8.7397 10.2386 10.2386 11.2901 11.2901 12.3783 12.3783 12.7991 12.7991 13.9959 13.9959 k =-0.3240 0.8351-0.0000 ( 2697 PWs) bands (ev): -31.3173 -31.3173 -31.3119 -31.3119 -12.4829 -12.4829 -12.4593 -12.4593 -11.2061 -11.2061 -11.1664 -11.1664 -10.8618 -10.8618 -10.8602 -10.8602 -0.2960 -0.2960 -0.1521 -0.1521 3.6671 3.6671 4.2238 4.2238 6.0751 6.0751 7.6392 7.6392 7.6987 7.6987 7.7958 7.7958 8.6909 8.6909 10.2263 10.2263 11.3569 11.3569 12.3182 12.3182 12.8599 12.8599 13.8828 13.8828 k =-0.3186 0.8567-0.0000 ( 2701 PWs) bands (ev): -31.3156 -31.3156 -31.3110 -31.3110 -12.4872 -12.4872 -12.4663 -12.4663 -11.2112 -11.2112 -11.1766 -11.1766 -10.8608 -10.8608 -10.8583 -10.8583 -0.2384 -0.2384 -0.1195 -0.1195 3.6699 3.6699 4.1387 4.1387 6.0632 6.0632 7.6155 7.6155 7.6514 7.6514 7.7460 7.7460 8.6454 8.6454 10.2142 10.2142 11.4270 11.4270 12.2564 12.2564 12.9203 12.9203 13.7562 13.7562 k =-0.3133 0.8782-0.0000 ( 2693 PWs) bands (ev): -31.3140 -31.3140 -31.3102 -31.3102 -12.4912 -12.4912 -12.4732 -12.4732 -11.2158 -11.2158 -11.1864 -11.1864 -10.8599 -10.8599 -10.8563 -10.8563 -0.1815 -0.1815 -0.0891 -0.0891 3.6726 3.6726 4.0559 4.0559 6.0526 6.0526 7.5937 7.5937 7.6066 7.6066 7.7009 7.7009 8.6030 8.6030 10.2024 10.2024 11.5001 11.5001 12.1933 12.1933 12.9803 12.9803 13.6285 13.6285 k =-0.3080 0.8998-0.0000 ( 2695 PWs) bands (ev): -31.3124 -31.3124 -31.3095 -31.3095 -12.4950 -12.4950 -12.4797 -12.4797 -11.2198 -11.2198 -11.1956 -11.1956 -10.8591 -10.8591 -10.8543 -10.8543 -0.1257 -0.1257 -0.0614 -0.0614 3.6753 3.6753 3.9757 3.9757 6.0432 6.0432 7.5646 7.5646 7.5741 7.5741 7.6606 7.6606 8.5636 8.5636 10.1910 10.1910 11.5764 11.5764 12.1294 12.1294 13.0401 13.0401 13.5010 13.5010 k =-0.3026 0.9214-0.0000 ( 2693 PWs) bands (ev): -31.3109 -31.3109 -31.3088 -31.3088 -12.4985 -12.4985 -12.4860 -12.4860 -11.2233 -11.2233 -11.2043 -11.2043 -10.8584 -10.8584 -10.8522 -10.8522 -0.0712 -0.0712 -0.0365 -0.0365 3.6784 3.6784 3.8985 3.8985 6.0349 6.0349 7.5254 7.5254 7.5567 7.5567 7.6252 7.6252 8.5274 8.5274 10.1801 10.1801 11.6556 11.6556 12.0652 12.0652 13.1000 13.1000 13.3742 13.3742 k =-0.2973 0.9429-0.0000 ( 2697 PWs) bands (ev): -31.3095 -31.3095 -31.3083 -31.3083 -12.5016 -12.5016 -12.4920 -12.4920 -11.2262 -11.2262 -11.2125 -11.2125 -10.8578 -10.8578 -10.8502 -10.8502 -0.0209 -0.0209 -0.0123 -0.0123 3.6820 3.6820 3.8246 3.8246 6.0278 6.0278 7.4889 7.4889 7.5417 7.5417 7.5946 7.5946 8.4941 8.4941 10.1698 10.1698 11.7377 11.7377 12.0010 12.0010 13.1593 13.1593 13.2492 13.2492 k =-0.2920 0.9645-0.0000 ( 2689 PWs) bands (ev): -31.3082 -31.3082 -31.3078 -31.3078 -12.5043 -12.5043 -12.4976 -12.4976 -11.2286 -11.2286 -11.2200 -11.2200 -10.8574 -10.8574 -10.8482 -10.8482 0.0017 0.0017 0.0344 0.0344 3.6861 3.6861 3.7546 3.7546 6.0220 6.0220 7.4554 7.4554 7.5292 7.5292 7.5690 7.5690 8.4636 8.4636 10.1602 10.1602 11.8222 11.8222 11.9375 11.9375 13.1217 13.1217 13.2227 13.2227 k =-0.2866 0.9860-0.0000 ( 2689 PWs) bands (ev): -31.3075 -31.3075 -31.3069 -31.3069 -12.5067 -12.5067 -12.5027 -12.5027 -11.2308 -11.2308 -11.2266 -11.2266 -10.8570 -10.8570 -10.8463 -10.8463 0.0161 0.0161 0.0834 0.0834 3.6818 3.6818 3.6979 3.6979 6.0174 6.0174 7.4247 7.4247 7.5192 7.5192 7.5484 7.5484 8.4358 8.4358 10.1515 10.1515 11.8708 11.8708 11.9135 11.9135 12.9991 12.9991 13.2829 13.2829 k =-0.2813 1.0076-0.0000 ( 2689 PWs) bands (ev): -31.3073 -31.3073 -31.3058 -31.3058 -12.5089 -12.5089 -12.5071 -12.5071 -11.2348 -11.2348 -11.2302 -11.2302 -10.8568 -10.8568 -10.8445 -10.8445 0.0263 0.0263 0.1301 0.1301 3.6236 3.6236 3.7007 3.7007 6.0143 6.0143 7.3970 7.3970 7.5120 7.5120 7.5327 7.5327 8.4106 8.4106 10.1436 10.1436 11.8105 11.8105 12.0020 12.0020 12.8773 12.8773 13.3442 13.3442 k =-0.2760 1.0291-0.0000 ( 2695 PWs) bands (ev): -31.3071 -31.3071 -31.3048 -31.3048 -12.5122 -12.5122 -12.5095 -12.5095 -11.2404 -11.2404 -11.2311 -11.2311 -10.8567 -10.8567 -10.8428 -10.8428 0.0323 0.0323 0.1741 0.1741 3.5653 3.5653 3.7095 3.7095 6.0128 6.0128 7.3723 7.3723 7.5074 7.5074 7.5219 7.5219 8.3879 8.3879 10.1367 10.1367 11.7498 11.7498 12.0948 12.0948 12.7570 12.7570 13.4061 13.4061 k =-0.2706 1.0507-0.0000 ( 2697 PWs) bands (ev): -31.3071 -31.3071 -31.3038 -31.3038 -12.5159 -12.5159 -12.5105 -12.5105 -11.2457 -11.2457 -11.2311 -11.2311 -10.8567 -10.8567 -10.8412 -10.8412 0.0339 0.0339 0.2150 0.2150 3.5109 3.5109 3.7208 3.7208 6.0130 6.0130 7.3506 7.3506 7.5057 7.5057 7.5160 7.5160 8.3674 8.3674 10.1307 10.1307 11.6904 11.6904 12.1904 12.1904 12.6383 12.6383 13.4686 13.4686 k =-0.2653 1.0723-0.0000 ( 2705 PWs) bands (ev): -31.3072 -31.3072 -31.3030 -31.3030 -12.5193 -12.5193 -12.5109 -12.5109 -11.2505 -11.2505 -11.2305 -11.2305 -10.8569 -10.8569 -10.8397 -10.8397 0.0309 0.0309 0.2526 0.2526 3.4607 3.4607 3.7350 3.7350 6.0150 6.0150 7.3320 7.3320 7.5068 7.5068 7.5148 7.5148 8.3490 8.3490 10.1259 10.1259 11.6330 11.6330 12.2885 12.2885 12.5215 12.5215 13.5315 13.5315 k =-0.2653 1.0723-0.0000 ( 2705 PWs) bands (ev): -31.3072 -31.3072 -31.3030 -31.3030 -12.5193 -12.5193 -12.5109 -12.5109 -11.2505 -11.2505 -11.2305 -11.2305 -10.8569 -10.8569 -10.8397 -10.8397 0.0309 0.0309 0.2526 0.2526 3.4607 3.4607 3.7350 3.7350 6.0150 6.0150 7.3320 7.3320 7.5068 7.5068 7.5148 7.5148 8.3490 8.3490 10.1259 10.1259 11.6330 11.6330 12.2885 12.2885 12.5215 12.5215 13.5315 13.5315 k =-0.2653 1.0723 0.0221 ( 2701 PWs) bands (ev): -31.3072 -31.3072 -31.3030 -31.3030 -12.5193 -12.5193 -12.5108 -12.5108 -11.2504 -11.2504 -11.2304 -11.2304 -10.8572 -10.8572 -10.8400 -10.8400 0.0297 0.0297 0.2515 0.2515 3.4620 3.4620 3.7358 3.7358 6.0162 6.0162 7.3331 7.3331 7.5064 7.5064 7.5181 7.5181 8.3485 8.3485 10.1251 10.1251 11.6254 11.6254 12.2768 12.2768 12.5232 12.5232 13.5460 13.5460 k =-0.2653 1.0723 0.0442 ( 2696 PWs) bands (ev): -31.3071 -31.3071 -31.3029 -31.3029 -12.5193 -12.5193 -12.5108 -12.5108 -11.2502 -11.2502 -11.2302 -11.2302 -10.8583 -10.8583 -10.8409 -10.8409 0.0261 0.0261 0.2481 0.2481 3.4656 3.4656 3.7383 3.7383 6.0200 6.0200 7.3365 7.3365 7.5071 7.5071 7.5260 7.5260 8.3470 8.3470 10.1228 10.1228 11.6030 11.6030 12.2434 12.2434 12.5281 12.5281 13.5879 13.5879 k =-0.2653 1.0723 0.0663 ( 2702 PWs) bands (ev): -31.3069 -31.3069 -31.3027 -31.3027 -12.5193 -12.5193 -12.5108 -12.5108 -11.2498 -11.2498 -11.2299 -11.2299 -10.8601 -10.8601 -10.8425 -10.8425 0.0201 0.0201 0.2425 0.2425 3.4717 3.4717 3.7425 3.7425 6.0263 6.0263 7.3422 7.3422 7.5103 7.5103 7.5371 7.5371 8.3444 8.3444 10.1189 10.1189 11.5669 11.5669 12.1922 12.1922 12.5356 12.5356 13.6530 13.6530 k =-0.2653 1.0723 0.0884 ( 2706 PWs) bands (ev): -31.3068 -31.3068 -31.3026 -31.3026 -12.5194 -12.5194 -12.5108 -12.5108 -11.2493 -11.2493 -11.2295 -11.2295 -10.8626 -10.8626 -10.8446 -10.8446 0.0118 0.0118 0.2347 0.2347 3.4801 3.4801 3.7484 3.7484 6.0351 6.0351 7.3500 7.3500 7.5162 7.5162 7.5512 7.5512 8.3407 8.3407 10.1134 10.1134 11.5187 11.5187 12.1281 12.1281 12.5452 12.5452 13.7368 13.7368 k =-0.2653 1.0723 0.1105 ( 2700 PWs) bands (ev): -31.3065 -31.3065 -31.3023 -31.3023 -12.5195 -12.5195 -12.5107 -12.5107 -11.2486 -11.2486 -11.2290 -11.2290 -10.8657 -10.8657 -10.8474 -10.8474 0.0012 0.0012 0.2248 0.2248 3.4910 3.4910 3.7558 3.7558 6.0464 6.0464 7.3600 7.3600 7.5249 7.5249 7.5681 7.5681 8.3361 8.3361 10.1063 10.1063 11.4600 11.4600 12.0553 12.0553 12.5560 12.5560 13.8348 13.8348 k =-0.2653 1.0723 0.1326 ( 2694 PWs) bands (ev): -31.3062 -31.3062 -31.3020 -31.3020 -12.5196 -12.5196 -12.5107 -12.5107 -11.2477 -11.2477 -11.2284 -11.2284 -10.8695 -10.8695 -10.8507 -10.8507 -0.0116 -0.0116 0.2128 0.2128 3.5041 3.5041 3.7650 3.7650 6.0601 6.0601 7.3720 7.3720 7.5361 7.5361 7.5876 7.5876 8.3305 8.3305 10.0976 10.0976 11.3926 11.3926 11.9772 11.9772 12.5677 12.5677 13.9434 13.9434 k =-0.2653 1.0723 0.1547 ( 2694 PWs) bands (ev): -31.3058 -31.3058 -31.3016 -31.3016 -12.5197 -12.5197 -12.5106 -12.5106 -11.2468 -11.2468 -11.2277 -11.2277 -10.8739 -10.8739 -10.8546 -10.8546 -0.0265 -0.0265 0.1987 0.1987 3.5195 3.5195 3.7757 3.7757 6.0763 6.0763 7.3860 7.3860 7.5499 7.5499 7.6098 7.6098 8.3239 8.3239 10.0872 10.0872 11.3180 11.3180 11.8965 11.8965 12.5800 12.5800 14.0601 14.0601 k =-0.2653 1.0723 0.1768 ( 2690 PWs) bands (ev): -31.3054 -31.3054 -31.3012 -31.3012 -12.5199 -12.5199 -12.5106 -12.5106 -11.2457 -11.2457 -11.2269 -11.2269 -10.8788 -10.8788 -10.8589 -10.8589 -0.0435 -0.0435 0.1828 0.1828 3.5370 3.5370 3.7879 3.7879 6.0948 6.0948 7.4019 7.4019 7.5661 7.5661 7.6345 7.6345 8.3163 8.3163 10.0751 10.0751 11.2375 11.2375 11.8149 11.8149 12.5929 12.5929 14.1827 14.1827 k =-0.2653 1.0723 0.1989 ( 2688 PWs) bands (ev): -31.3050 -31.3050 -31.3008 -31.3008 -12.5200 -12.5200 -12.5106 -12.5106 -11.2445 -11.2445 -11.2260 -11.2260 -10.8843 -10.8843 -10.8638 -10.8638 -0.0623 -0.0623 0.1650 0.1650 3.5567 3.5567 3.8017 3.8017 6.1156 6.1156 7.4195 7.4195 7.5844 7.5844 7.6616 7.6616 8.3078 8.3078 10.0613 10.0613 11.1521 11.1521 11.7339 11.7339 12.6063 12.6063 14.3096 14.3096 k =-0.2653 1.0723 0.2210 ( 2686 PWs) bands (ev): -31.3045 -31.3045 -31.3003 -31.3003 -12.5203 -12.5203 -12.5106 -12.5106 -11.2432 -11.2432 -11.2251 -11.2251 -10.8903 -10.8903 -10.8691 -10.8691 -0.0830 -0.0830 0.1455 0.1455 3.5784 3.5784 3.8169 3.8169 6.1386 6.1386 7.4387 7.4387 7.6047 7.6047 7.6912 7.6912 8.2985 8.2985 10.0457 10.0457 11.0629 11.0629 11.6543 11.6543 12.6205 12.6205 14.4378 14.4378 k =-0.2653 1.0723 0.2431 ( 2686 PWs) bands (ev): -31.3039 -31.3039 -31.2997 -31.2997 -12.5205 -12.5205 -12.5106 -12.5106 -11.2418 -11.2418 -11.2241 -11.2241 -10.8967 -10.8967 -10.8748 -10.8748 -0.1053 -0.1053 0.1244 0.1244 3.6020 3.6020 3.8336 3.8336 6.1638 6.1638 7.4594 7.4594 7.6266 7.6266 7.7231 7.7231 8.2884 8.2884 10.0286 10.0286 10.9706 10.9706 11.5770 11.5770 12.6356 12.6356 14.5359 14.5359 k =-0.2653 1.0723 0.2652 ( 2683 PWs) bands (ev): -31.3033 -31.3033 -31.2991 -31.2991 -12.5208 -12.5208 -12.5107 -12.5107 -11.2403 -11.2403 -11.2231 -11.2231 -10.9035 -10.9035 -10.8808 -10.8808 -0.1291 -0.1291 0.1018 0.1018 3.6275 3.6275 3.8516 3.8516 6.1910 6.1910 7.4814 7.4814 7.6498 7.6498 7.7573 7.7573 8.2775 8.2775 10.0099 10.0099 10.8758 10.8758 11.5023 11.5023 12.6520 12.6520 14.5877 14.5877 k =-0.2653 1.0723 0.2873 ( 2681 PWs) bands (ev): -31.3027 -31.3027 -31.2985 -31.2985 -12.5211 -12.5211 -12.5108 -12.5108 -11.2388 -11.2388 -11.2220 -11.2220 -10.9106 -10.9106 -10.8872 -10.8872 -0.1542 -0.1542 0.0778 0.0778 3.6547 3.6547 3.8709 3.8709 6.2203 6.2203 7.5046 7.5046 7.6740 7.6740 7.7939 7.7939 8.2660 8.2660 9.9897 9.9897 10.7791 10.7791 11.4306 11.4306 12.6697 12.6697 14.6284 14.6284 k =-0.2653 1.0723 0.3094 ( 2681 PWs) bands (ev): -31.3021 -31.3021 -31.2979 -31.2979 -12.5214 -12.5214 -12.5110 -12.5110 -11.2372 -11.2372 -11.2210 -11.2210 -10.9181 -10.9181 -10.8938 -10.8938 -0.1807 -0.1807 0.0526 0.0526 3.6835 3.6835 3.8913 3.8913 6.2513 6.2513 7.5288 7.5288 7.6988 7.6988 7.8327 7.8327 8.2540 8.2540 9.9684 9.9684 10.6809 10.6809 11.3622 11.3622 12.6891 12.6891 14.6603 14.6603 k =-0.2653 1.0723 0.3315 ( 2685 PWs) bands (ev): -31.3014 -31.3014 -31.2972 -31.2972 -12.5218 -12.5218 -12.5112 -12.5112 -11.2356 -11.2356 -11.2199 -11.2199 -10.9257 -10.9257 -10.9006 -10.9006 -0.2081 -0.2081 0.0264 0.0264 3.7138 3.7138 3.9129 3.9129 6.2840 6.2840 7.5538 7.5538 7.7238 7.7238 7.8737 7.8737 8.2416 8.2416 9.9460 9.9460 10.5816 10.5816 11.2970 11.2970 12.7102 12.7102 14.6847 14.6847 k =-0.2653 1.0723 0.3536 ( 2689 PWs) bands (ev): -31.3007 -31.3007 -31.2965 -31.2965 -12.5223 -12.5223 -12.5114 -12.5114 -11.2339 -11.2339 -11.2189 -11.2189 -10.9335 -10.9335 -10.9075 -10.9075 -0.2365 -0.2365 -0.0007 -0.0007 3.7454 3.7454 3.9354 3.9354 6.3183 6.3183 7.5796 7.5796 7.7486 7.7486 7.9170 7.9170 8.2290 8.2290 9.9229 9.9229 10.4817 10.4817 11.2351 11.2351 12.7332 12.7332 14.7033 14.7033 k =-0.2653 1.0723 0.3757 ( 2693 PWs) bands (ev): -31.2999 -31.2999 -31.2958 -31.2958 -12.5228 -12.5228 -12.5118 -12.5118 -11.2323 -11.2323 -11.2179 -11.2179 -10.9414 -10.9414 -10.9145 -10.9145 -0.2656 -0.2656 -0.0287 -0.0287 3.7783 3.7783 3.9589 3.9589 6.3540 6.3540 7.6060 7.6060 7.7728 7.7728 7.9624 7.9624 8.2164 8.2164 9.8995 9.8995 10.3813 10.3813 11.1764 11.1764 12.7583 12.7583 14.7175 14.7175 k =-0.2653 1.0723 0.3978 ( 2691 PWs) bands (ev): -31.2992 -31.2992 -31.2950 -31.2950 -12.5233 -12.5233 -12.5121 -12.5121 -11.2307 -11.2307 -11.2170 -11.2170 -10.9493 -10.9493 -10.9216 -10.9216 -0.2953 -0.2953 -0.0572 -0.0572 3.8123 3.8123 3.9831 3.9831 6.3908 6.3908 7.6327 7.6327 7.7961 7.7961 8.0097 8.0097 8.2039 8.2039 9.8761 9.8761 10.2808 10.2808 11.1208 11.1208 12.7853 12.7853 14.7286 14.7286 k =-0.2653 1.0723 0.4199 ( 2693 PWs) bands (ev): -31.2984 -31.2984 -31.2942 -31.2942 -12.5239 -12.5239 -12.5126 -12.5126 -11.2291 -11.2291 -11.2161 -11.2161 -10.9573 -10.9573 -10.9286 -10.9286 -0.3254 -0.3254 -0.0862 -0.0862 3.8473 3.8473 4.0080 4.0080 6.4287 6.4287 7.6596 7.6596 7.8180 7.8180 8.0589 8.0589 8.1919 8.1919 9.8531 9.8531 10.1804 10.1804 11.0679 11.0679 12.8143 12.8143 14.7378 14.7378 k =-0.2653 1.0723 0.4419 ( 2693 PWs) bands (ev): -31.2976 -31.2976 -31.2935 -31.2935 -12.5245 -12.5245 -12.5131 -12.5131 -11.2276 -11.2276 -11.2153 -11.2153 -10.9651 -10.9651 -10.9355 -10.9355 -0.3558 -0.3558 -0.1154 -0.1154 3.8830 3.8830 4.0335 4.0335 6.4673 6.4673 7.6865 7.6865 7.8383 7.8383 8.1093 8.1093 8.1810 8.1810 9.8309 9.8309 10.0805 10.0805 11.0177 11.0177 12.8452 12.8452 14.7457 14.7457 k =-0.2653 1.0723 0.4640 ( 2691 PWs) bands (ev): -31.2968 -31.2968 -31.2927 -31.2927 -12.5252 -12.5252 -12.5137 -12.5137 -11.2262 -11.2262 -11.2147 -11.2147 -10.9729 -10.9729 -10.9423 -10.9423 -0.3863 -0.3863 -0.1449 -0.1449 3.9194 3.9194 4.0593 4.0593 6.5066 6.5066 7.7133 7.7133 7.8568 7.8568 8.1544 8.1544 8.1778 8.1778 9.8099 9.8099 9.9811 9.9811 10.9697 10.9697 12.8778 12.8778 14.7531 14.7531 k =-0.2653 1.0723 0.4861 ( 2693 PWs) bands (ev): -31.2960 -31.2960 -31.2919 -31.2919 -12.5259 -12.5259 -12.5143 -12.5143 -11.2250 -11.2250 -11.2141 -11.2141 -10.9805 -10.9805 -10.9489 -10.9489 -0.4167 -0.4167 -0.1743 -0.1743 3.9563 3.9563 4.0855 4.0855 6.5462 6.5462 7.7397 7.7397 7.8730 7.8730 8.1558 8.1558 8.2207 8.2207 9.7906 9.7906 9.8826 9.8826 10.9238 10.9238 12.9120 12.9120 14.7603 14.7603 k =-0.2653 1.0723 0.5082 ( 2690 PWs) bands (ev): -31.2952 -31.2952 -31.2911 -31.2911 -12.5266 -12.5266 -12.5150 -12.5150 -11.2238 -11.2238 -11.2136 -11.2136 -10.9878 -10.9878 -10.9553 -10.9553 -0.4469 -0.4469 -0.2035 -0.2035 3.9935 3.9935 4.1118 4.1118 6.5860 6.5860 7.7656 7.7656 7.8870 7.8870 8.1480 8.1480 8.2753 8.2753 9.7729 9.7729 9.7854 9.7854 10.8798 10.8798 12.9476 12.9476 14.7678 14.7678 k =-0.2653 1.0723 0.5303 ( 2692 PWs) bands (ev): -31.2945 -31.2945 -31.2903 -31.2903 -12.5274 -12.5274 -12.5158 -12.5158 -11.2229 -11.2229 -11.2132 -11.2132 -10.9949 -10.9949 -10.9614 -10.9614 -0.4767 -0.4767 -0.2325 -0.2325 4.0309 4.0309 4.1382 4.1382 6.6256 6.6256 7.7907 7.7907 7.8985 7.8985 8.1409 8.1409 8.3317 8.3317 9.6890 9.6890 9.7581 9.7581 10.8373 10.8373 12.9842 12.9842 14.7758 14.7758 k =-0.2653 1.0723 0.5524 ( 2700 PWs) bands (ev): -31.2937 -31.2937 -31.2895 -31.2895 -12.5282 -12.5282 -12.5166 -12.5166 -11.2221 -11.2221 -11.2130 -11.2130 -11.0016 -11.0016 -10.9672 -10.9672 -0.5061 -0.5061 -0.2610 -0.2610 4.0682 4.0682 4.1644 4.1644 6.6649 6.6649 7.8147 7.8147 7.9076 7.9076 8.1354 8.1354 8.3890 8.3890 9.5944 9.5944 9.7453 9.7453 10.7961 10.7961 13.0215 13.0215 14.7846 14.7846 k =-0.2653 1.0723 0.5745 ( 2704 PWs) bands (ev): -31.2929 -31.2929 -31.2887 -31.2887 -12.5291 -12.5291 -12.5175 -12.5175 -11.2216 -11.2216 -11.2128 -11.2128 -11.0081 -11.0081 -10.9726 -10.9726 -0.5348 -0.5348 -0.2889 -0.2889 4.1052 4.1052 4.1904 4.1904 6.7037 6.7037 7.8374 7.8374 7.9143 7.9143 8.1318 8.1318 8.4469 8.4469 9.5015 9.5015 9.7351 9.7351 10.7561 10.7561 13.0592 13.0592 14.7946 14.7946 k =-0.2653 1.0723 0.5966 ( 2702 PWs) bands (ev): -31.2921 -31.2921 -31.2880 -31.2880 -12.5299 -12.5299 -12.5185 -12.5185 -11.2213 -11.2213 -11.2128 -11.2128 -11.0141 -11.0141 -10.9777 -10.9777 -0.5627 -0.5627 -0.3161 -0.3161 4.1419 4.1419 4.2161 4.2161 6.7417 6.7417 7.8585 7.8585 7.9187 7.9187 8.1303 8.1303 8.5051 8.5051 9.4106 9.4106 9.7274 9.7274 10.7172 10.7172 13.0968 13.0968 14.8059 14.8059 k =-0.2653 1.0723 0.6187 ( 2700 PWs) bands (ev): -31.2914 -31.2914 -31.2872 -31.2872 -12.5308 -12.5308 -12.5194 -12.5194 -11.2213 -11.2213 -11.2128 -11.2128 -11.0197 -11.0197 -10.9823 -10.9823 -0.5898 -0.5898 -0.3424 -0.3424 4.1779 4.1779 4.2413 4.2413 6.7787 6.7787 7.8777 7.8777 7.9211 7.9211 8.1312 8.1312 8.5633 8.5633 9.3220 9.3220 9.7223 9.7223 10.6791 10.6791 13.1340 13.1340 14.8188 14.8188 k =-0.2653 1.0723 0.6408 ( 2694 PWs) bands (ev): -31.2907 -31.2907 -31.2865 -31.2865 -12.5317 -12.5317 -12.5204 -12.5204 -11.2214 -11.2214 -11.2129 -11.2129 -11.0249 -11.0249 -10.9866 -10.9866 -0.6158 -0.6158 -0.3678 -0.3678 4.2130 4.2130 4.2659 4.2659 6.8146 6.8146 7.8942 7.8942 7.9223 7.9223 8.1345 8.1345 8.6211 8.6211 9.2359 9.2359 9.7197 9.7197 10.6420 10.6420 13.1704 13.1704 14.8336 14.8336 k =-0.2653 1.0723 0.6629 ( 2694 PWs) bands (ev): -31.2900 -31.2900 -31.2858 -31.2858 -12.5326 -12.5326 -12.5214 -12.5214 -11.2218 -11.2218 -11.2131 -11.2131 -11.0297 -11.0297 -10.9905 -10.9905 -0.6407 -0.6407 -0.3921 -0.3921 4.2469 4.2469 4.2900 4.2900 6.8492 6.8492 7.9056 7.9056 7.9247 7.9247 8.1401 8.1401 8.6782 8.6782 9.1525 9.1525 9.7193 9.7193 10.6056 10.6056 13.2055 13.2055 14.8504 14.8504 k =-0.2653 1.0723 0.6850 ( 2698 PWs) bands (ev): -31.2893 -31.2893 -31.2852 -31.2852 -12.5335 -12.5335 -12.5224 -12.5224 -11.2224 -11.2224 -11.2134 -11.2134 -11.0340 -11.0340 -10.9940 -10.9940 -0.6643 -0.6643 -0.4152 -0.4152 4.2793 4.2793 4.3134 4.3134 6.8823 6.8823 7.9081 7.9081 7.9328 7.9328 8.1479 8.1479 8.7342 8.7342 9.0722 9.0722 9.7210 9.7210 10.5700 10.5700 13.2389 13.2389 14.8694 14.8694 k =-0.2653 1.0723 0.7071 ( 2702 PWs) bands (ev): -31.2887 -31.2887 -31.2846 -31.2846 -12.5343 -12.5343 -12.5234 -12.5234 -11.2231 -11.2231 -11.2138 -11.2138 -11.0379 -11.0379 -10.9971 -10.9971 -0.6866 -0.6866 -0.4370 -0.4370 4.3096 4.3096 4.3365 4.3365 6.9138 6.9138 7.9049 7.9049 7.9434 7.9434 8.1576 8.1576 8.7888 8.7888 8.9954 8.9954 9.7245 9.7245 10.5353 10.5353 13.2702 13.2702 14.8906 14.8906 k =-0.2653 1.0723 0.7292 ( 2700 PWs) bands (ev): -31.2881 -31.2881 -31.2840 -31.2840 -12.5351 -12.5351 -12.5244 -12.5244 -11.2240 -11.2240 -11.2142 -11.2142 -11.0413 -11.0413 -10.9999 -10.9999 -0.7075 -0.7075 -0.4574 -0.4574 4.3371 4.3371 4.3597 4.3597 6.9436 6.9436 7.8995 7.8995 7.9538 7.9538 8.1687 8.1687 8.8410 8.8410 8.9227 8.9227 9.7295 9.7295 10.5015 10.5015 13.2993 13.2993 14.9139 14.9139 k =-0.2653 1.0723 0.7513 ( 2699 PWs) bands (ev): -31.2876 -31.2876 -31.2835 -31.2835 -12.5359 -12.5359 -12.5254 -12.5254 -11.2249 -11.2249 -11.2147 -11.2147 -11.0444 -11.0444 -11.0023 -11.0023 -0.7269 -0.7269 -0.4763 -0.4763 4.3609 4.3609 4.3834 4.3834 6.9716 6.9716 7.8931 7.8931 7.9632 7.9632 8.1807 8.1807 8.8504 8.8504 8.8948 8.8948 9.7357 9.7357 10.4689 10.4689 13.3258 13.3258 14.9392 14.9392 k =-0.2653 1.0723 0.7734 ( 2703 PWs) bands (ev): -31.2871 -31.2871 -31.2830 -31.2830 -12.5366 -12.5366 -12.5263 -12.5263 -11.2258 -11.2258 -11.2153 -11.2153 -11.0470 -11.0470 -11.0044 -11.0044 -0.7446 -0.7446 -0.4937 -0.4937 4.3813 4.3813 4.4072 4.4072 6.9977 6.9977 7.8861 7.8861 7.9718 7.9718 8.1933 8.1933 8.7869 8.7869 8.9415 8.9415 9.7428 9.7428 10.4375 10.4375 13.3496 13.3496 14.9661 14.9661 k =-0.2653 1.0723 0.7955 ( 2707 PWs) bands (ev): -31.2866 -31.2866 -31.2825 -31.2825 -12.5373 -12.5373 -12.5272 -12.5272 -11.2268 -11.2268 -11.2159 -11.2159 -11.0493 -11.0493 -11.0061 -11.0061 -0.7607 -0.7607 -0.5095 -0.5095 4.3988 4.3988 4.4301 4.4301 7.0218 7.0218 7.8789 7.8789 7.9795 7.9795 8.2058 8.2058 8.7270 8.7270 8.9863 8.9863 9.7504 9.7504 10.4077 10.4077 13.3707 13.3707 14.9940 14.9940 k =-0.2653 1.0723 0.8176 ( 2707 PWs) bands (ev): -31.2862 -31.2862 -31.2821 -31.2821 -12.5379 -12.5379 -12.5280 -12.5280 -11.2277 -11.2277 -11.2165 -11.2165 -11.0513 -11.0513 -11.0077 -11.0077 -0.7751 -0.7751 -0.5235 -0.5235 4.4140 4.4140 4.4512 4.4512 7.0437 7.0437 7.8719 7.8719 7.9864 7.9864 8.2181 8.2181 8.6722 8.6722 9.0277 9.0277 9.7582 9.7582 10.3797 10.3797 13.3889 13.3889 15.0222 15.0222 k =-0.2653 1.0723 0.8397 ( 2709 PWs) bands (ev): -31.2859 -31.2859 -31.2817 -31.2817 -12.5385 -12.5385 -12.5287 -12.5287 -11.2285 -11.2285 -11.2171 -11.2171 -11.0529 -11.0529 -11.0089 -11.0089 -0.7876 -0.7876 -0.5358 -0.5358 4.4272 4.4272 4.4702 4.4702 7.0633 7.0633 7.8652 7.8652 7.9926 7.9926 8.2297 8.2297 8.6230 8.6230 9.0651 9.0651 9.7660 9.7660 10.3540 10.3540 13.4043 13.4043 15.0500 15.0500 k =-0.2653 1.0723 0.8618 ( 2709 PWs) bands (ev): -31.2856 -31.2856 -31.2814 -31.2814 -12.5390 -12.5390 -12.5293 -12.5293 -11.2293 -11.2293 -11.2176 -11.2176 -11.0542 -11.0542 -11.0099 -11.0099 -0.7983 -0.7983 -0.5463 -0.5463 4.4384 4.4384 4.4866 4.4866 7.0804 7.0804 7.8592 7.8592 7.9979 7.9979 8.2403 8.2403 8.5799 8.5799 9.0979 9.0979 9.7734 9.7734 10.3309 10.3309 13.4171 13.4171 15.0762 15.0762 k =-0.2653 1.0723 0.8839 ( 2707 PWs) bands (ev): -31.2853 -31.2853 -31.2812 -31.2812 -12.5394 -12.5394 -12.5298 -12.5298 -11.2300 -11.2300 -11.2181 -11.2181 -11.0552 -11.0552 -11.0107 -11.0107 -0.8071 -0.8071 -0.5550 -0.5550 4.4475 4.4475 4.5004 4.5004 7.0948 7.0948 7.8540 7.8540 8.0023 8.0023 8.2497 8.2497 8.5435 8.5435 9.1257 9.1257 9.7800 9.7800 10.3110 10.3110 13.4273 13.4273 15.0999 15.0999 k =-0.2653 1.0723 0.9060 ( 2717 PWs) bands (ev): -31.2851 -31.2851 -31.2810 -31.2810 -12.5397 -12.5397 -12.5303 -12.5303 -11.2305 -11.2305 -11.2185 -11.2185 -11.0560 -11.0560 -11.0113 -11.0113 -0.8140 -0.8140 -0.5617 -0.5617 4.4547 4.4547 4.5112 4.5112 7.1063 7.1063 7.8498 7.8498 8.0059 8.0059 8.2576 8.2576 8.5142 8.5142 9.1479 9.1479 9.7856 9.7856 10.2948 10.2948 13.4351 13.4351 15.1198 15.1198 k =-0.2653 1.0723 0.9281 ( 2717 PWs) bands (ev): -31.2850 -31.2850 -31.2809 -31.2809 -12.5399 -12.5399 -12.5306 -12.5306 -11.2309 -11.2309 -11.2188 -11.2188 -11.0566 -11.0566 -11.0118 -11.0118 -0.8190 -0.8190 -0.5666 -0.5666 4.4599 4.4599 4.5190 4.5190 7.1147 7.1147 7.8467 7.8467 8.0084 8.0084 8.2637 8.2637 8.4927 8.4927 9.1641 9.1641 9.7899 9.7899 10.2828 10.2828 13.4406 13.4406 15.1349 15.1349 k =-0.2653 1.0723 0.9502 ( 2722 PWs) bands (ev): -31.2849 -31.2849 -31.2808 -31.2808 -12.5400 -12.5400 -12.5308 -12.5308 -11.2311 -11.2311 -11.2190 -11.2190 -11.0569 -11.0569 -11.0120 -11.0120 -0.8219 -0.8219 -0.5695 -0.5695 4.4630 4.4630 4.5237 4.5237 7.1198 7.1198 7.8448 7.8448 8.0100 8.0100 8.2675 8.2675 8.4794 8.4794 9.1740 9.1740 9.7925 9.7925 10.2754 10.2754 13.4439 13.4439 15.1443 15.1443 k =-0.2653 1.0723 0.9723 ( 2724 PWs) bands (ev): -31.2849 -31.2849 -31.2807 -31.2807 -12.5401 -12.5401 -12.5308 -12.5308 -11.2312 -11.2312 -11.2190 -11.2190 -11.0570 -11.0570 -11.0121 -11.0121 -0.8229 -0.8229 -0.5705 -0.5705 4.4640 4.4640 4.5253 4.5253 7.1215 7.1215 7.8441 7.8441 8.0105 8.0105 8.2688 8.2688 8.4749 8.4749 9.1773 9.1773 9.7934 9.7934 10.2729 10.2729 13.4449 13.4449 15.1475 15.1475 k =-0.2653 1.0723 0.9723 ( 2724 PWs) bands (ev): -31.2849 -31.2849 -31.2807 -31.2807 -12.5401 -12.5401 -12.5308 -12.5308 -11.2312 -11.2312 -11.2190 -11.2190 -11.0570 -11.0570 -11.0121 -11.0121 -0.8229 -0.8229 -0.5705 -0.5705 4.4640 4.4640 4.5253 4.5253 7.1215 7.1215 7.8441 7.8441 8.0105 8.0105 8.2688 8.2688 8.4749 8.4749 9.1773 9.1773 9.7934 9.7934 10.2729 10.2729 13.4449 13.4449 15.1475 15.1475 k =-0.2706 1.0507 0.9723 ( 2718 PWs) bands (ev): -31.2848 -31.2848 -31.2816 -31.2816 -12.5380 -12.5380 -12.5308 -12.5308 -11.2290 -11.2290 -11.2177 -11.2177 -11.0552 -11.0552 -11.0152 -11.0152 -0.8117 -0.8117 -0.5738 -0.5738 4.3998 4.3998 4.6008 4.6008 7.0958 7.0958 7.7829 7.7829 8.0368 8.0368 8.2812 8.2812 8.4897 8.4897 9.1513 9.1513 9.7926 9.7926 10.3259 10.3259 13.4660 13.4660 15.1874 15.1874 k =-0.2760 1.0291 0.9723 ( 2718 PWs) bands (ev): -31.2848 -31.2848 -31.2825 -31.2825 -12.5357 -12.5357 -12.5304 -12.5304 -11.2264 -11.2264 -11.2159 -11.2159 -11.0535 -11.0535 -11.0185 -11.0185 -0.7990 -0.7990 -0.5757 -0.5757 4.3371 4.3371 4.6762 4.6762 7.0673 7.0673 7.7199 7.7199 8.0532 8.0532 8.2983 8.2983 8.5125 8.5125 9.1261 9.1261 9.7911 9.7911 10.3777 10.3777 13.4856 13.4856 15.2253 15.2253 k =-0.2813 1.0076 0.9723 ( 2718 PWs) bands (ev): -31.2849 -31.2849 -31.2835 -31.2835 -12.5331 -12.5331 -12.5298 -12.5298 -11.2236 -11.2236 -11.2134 -11.2134 -11.0519 -11.0519 -11.0218 -11.0218 -0.7849 -0.7849 -0.5761 -0.5761 4.2758 4.2758 4.7514 4.7514 7.0367 7.0367 7.6554 7.6554 8.0595 8.0595 8.3198 8.3198 8.5438 8.5438 9.1017 9.1017 9.7890 9.7890 10.4281 10.4281 13.5037 13.5037 15.2608 15.2608 k =-0.2866 0.9860 0.9723 ( 2714 PWs) bands (ev): -31.2852 -31.2852 -31.2846 -31.2846 -12.5303 -12.5303 -12.5289 -12.5289 -11.2204 -11.2204 -11.2103 -11.2103 -11.0503 -11.0503 -11.0250 -11.0250 -0.7694 -0.7694 -0.5751 -0.5751 4.2160 4.2160 4.8261 4.8261 7.0043 7.0043 7.5896 7.5896 8.0561 8.0561 8.3458 8.3458 8.5827 8.5827 9.0782 9.0782 9.7862 9.7862 10.4769 10.4769 13.5203 13.5203 15.2938 15.2938 k =-0.2920 0.9645 0.9723 ( 2718 PWs) bands (ev): -31.2858 -31.2858 -31.2855 -31.2855 -12.5277 -12.5277 -12.5273 -12.5273 -11.2171 -11.2171 -11.2068 -11.2068 -11.0489 -11.0489 -11.0282 -11.0282 -0.7525 -0.7525 -0.5728 -0.5728 4.1579 4.1579 4.9001 4.9001 6.9707 6.9707 7.5225 7.5225 8.0437 8.0437 8.3765 8.3765 8.6279 8.6279 9.0556 9.0556 9.7828 9.7828 10.5239 10.5239 13.5355 13.5355 15.3241 15.3241 k =-0.2973 0.9429 0.9723 ( 2718 PWs) bands (ev): -31.2871 -31.2871 -31.2859 -31.2859 -12.5264 -12.5264 -12.5241 -12.5241 -11.2135 -11.2135 -11.2027 -11.2027 -11.0476 -11.0476 -11.0312 -11.0312 -0.7343 -0.7343 -0.5693 -0.5693 4.1014 4.1014 4.9733 4.9733 6.9364 6.9364 7.4543 7.4543 8.0235 8.0235 8.4117 8.4117 8.6781 8.6781 9.0339 9.0339 9.7791 9.7791 10.5688 10.5688 13.5492 13.5492 15.3514 15.3514 k =-0.3026 0.9214 0.9723 ( 2718 PWs) bands (ev): -31.2885 -31.2885 -31.2864 -31.2864 -12.5248 -12.5248 -12.5208 -12.5208 -11.2097 -11.2097 -11.1984 -11.1984 -11.0467 -11.0467 -11.0335 -11.0335 -0.7148 -0.7148 -0.5645 -0.5645 4.0466 4.0466 5.0452 5.0452 6.9021 6.9021 7.3851 7.3851 7.9965 7.9965 8.4515 8.4515 8.7323 8.7323 9.0131 9.0131 9.7749 9.7749 10.6115 10.6115 13.5613 13.5613 15.3756 15.3756 k =-0.3080 0.8998 0.9723 ( 2714 PWs) bands (ev): -31.2899 -31.2899 -31.2870 -31.2870 -12.5230 -12.5230 -12.5173 -12.5173 -11.2056 -11.2056 -11.1936 -11.1936 -11.0467 -11.0467 -11.0347 -11.0347 -0.6942 -0.6942 -0.5586 -0.5586 3.9935 3.9935 5.1158 5.1158 6.8680 6.8680 7.3149 7.3149 7.9636 7.9636 8.4955 8.4955 8.7897 8.7897 8.9932 8.9932 9.7705 9.7705 10.6517 10.6517 13.5719 13.5719 15.3964 15.3964 k =-0.3133 0.8782 0.9723 ( 2714 PWs) bands (ev): -31.2914 -31.2914 -31.2877 -31.2877 -12.5211 -12.5211 -12.5137 -12.5137 -11.2015 -11.2015 -11.1887 -11.1887 -11.0479 -11.0479 -11.0342 -11.0342 -0.6723 -0.6723 -0.5516 -0.5516 3.9422 3.9422 5.1845 5.1845 6.8348 6.8348 7.2438 7.2438 7.9255 7.9255 8.5436 8.5436 8.8497 8.8497 8.9744 8.9744 9.7660 9.7660 10.6892 10.6892 13.5808 13.5808 15.4132 15.4132 k =-0.3186 0.8567 0.9723 ( 2710 PWs) bands (ev): -31.2930 -31.2930 -31.2885 -31.2885 -12.5191 -12.5191 -12.5100 -12.5100 -11.1973 -11.1973 -11.1837 -11.1837 -11.0498 -11.0498 -11.0323 -11.0323 -0.6495 -0.6495 -0.5436 -0.5436 3.8927 3.8927 5.2512 5.2512 6.8028 6.8028 7.1720 7.1720 7.8829 7.8829 8.5956 8.5956 8.9119 8.9119 8.9567 8.9567 9.7614 9.7614 10.7239 10.7239 13.5881 13.5881 15.4239 15.4239 k =-0.3240 0.8351 0.9723 ( 2706 PWs) bands (ev): -31.2947 -31.2947 -31.2894 -31.2894 -12.5169 -12.5169 -12.5063 -12.5063 -11.1931 -11.1931 -11.1786 -11.1786 -11.0518 -11.0518 -11.0294 -11.0294 -0.6256 -0.6256 -0.5347 -0.5347 3.8450 3.8450 5.3155 5.3155 6.7725 6.7725 7.0995 7.0995 7.8361 7.8361 8.6514 8.6514 8.9392 8.9392 8.9768 8.9768 9.7568 9.7568 10.7555 10.7555 13.5938 13.5938 15.4190 15.4190 k =-0.3293 0.8136 0.9723 ( 2706 PWs) bands (ev): -31.2964 -31.2964 -31.2903 -31.2903 -12.5147 -12.5147 -12.5025 -12.5025 -11.1890 -11.1890 -11.1737 -11.1737 -11.0537 -11.0537 -11.0257 -11.0257 -0.6009 -0.6009 -0.5249 -0.5249 3.7992 3.7992 5.3769 5.3769 6.7444 6.7444 7.0265 7.0265 7.7857 7.7857 8.7108 8.7108 8.9236 8.9236 9.0428 9.0428 9.7523 9.7523 10.7840 10.7840 13.5978 13.5978 15.3931 15.3931 k =-0.3346 0.7920 0.9723 ( 2704 PWs) bands (ev): -31.2982 -31.2982 -31.2913 -31.2913 -12.5125 -12.5125 -12.4987 -12.4987 -11.1852 -11.1852 -11.1690 -11.1690 -11.0549 -11.0549 -11.0212 -11.0212 -0.5753 -0.5753 -0.5144 -0.5144 3.7553 3.7553 5.4351 5.4351 6.7188 6.7188 6.9532 6.9532 7.7320 7.7320 8.7738 8.7738 8.9089 8.9089 9.1106 9.1106 9.7479 9.7479 10.8093 10.8093 13.6002 13.6002 15.3615 15.3615 k =-0.3400 0.7705 0.9723 ( 2700 PWs) bands (ev): -31.3000 -31.3000 -31.2923 -31.2923 -12.5102 -12.5102 -12.4950 -12.4950 -11.1817 -11.1817 -11.1647 -11.1647 -11.0554 -11.0554 -11.0158 -11.0158 -0.5490 -0.5490 -0.5033 -0.5033 3.7133 3.7133 5.4895 5.4895 6.6962 6.6962 6.8797 6.8797 7.6755 7.6755 8.8403 8.8403 8.8954 8.8954 9.1801 9.1801 9.7437 9.7437 10.8311 10.8311 13.6010 13.6010 15.3300 15.3300 k =-0.3453 0.7489 0.9723 ( 2688 PWs) bands (ev): -31.3018 -31.3018 -31.2934 -31.2934 -12.5079 -12.5079 -12.4914 -12.4914 -11.1787 -11.1787 -11.1610 -11.1610 -11.0548 -11.0548 -11.0097 -11.0097 -0.5221 -0.5221 -0.4915 -0.4915 3.6732 3.6732 5.5399 5.5399 6.6768 6.6768 6.8064 6.8064 7.6164 7.6164 8.8827 8.8827 8.9104 8.9104 9.2511 9.2511 9.7397 9.7397 10.8495 10.8495 13.6004 13.6004 15.2998 15.2998 k =-0.3506 0.7273 0.9723 ( 2688 PWs) bands (ev): -31.3036 -31.3036 -31.2946 -31.2946 -12.5057 -12.5057 -12.4878 -12.4878 -11.1763 -11.1763 -11.1581 -11.1581 -11.0530 -11.0530 -11.0027 -11.0027 -0.4947 -0.4947 -0.4793 -0.4793 3.6349 3.6349 5.5857 5.5857 6.6602 6.6602 6.7342 6.7342 7.5552 7.5552 8.8714 8.8714 8.9837 8.9837 9.3235 9.3235 9.7360 9.7360 10.8644 10.8644 13.5985 13.5985 15.2714 15.2714 k =-0.3560 0.7058 0.9723 ( 2692 PWs) bands (ev): -31.3056 -31.3056 -31.2958 -31.2958 -12.5035 -12.5035 -12.4843 -12.4843 -11.1744 -11.1744 -11.1560 -11.1560 -11.0497 -11.0497 -10.9950 -10.9950 -0.4669 -0.4669 -0.4668 -0.4668 3.5986 3.5986 5.6265 5.6265 6.6385 6.6385 6.6715 6.6715 7.4921 7.4921 8.8613 8.8613 9.0603 9.0603 9.3971 9.3971 9.7326 9.7326 10.8759 10.8759 13.5954 13.5954 15.2451 15.2451 k =-0.3613 0.6842 0.9723 ( 2696 PWs) bands (ev): -31.3075 -31.3075 -31.2970 -31.2970 -12.5013 -12.5013 -12.4809 -12.4809 -11.1732 -11.1732 -11.1549 -11.1549 -11.0451 -11.0451 -10.9864 -10.9864 -0.4539 -0.4539 -0.4388 -0.4388 3.5643 3.5643 5.6621 5.6621 6.5793 6.5793 6.6513 6.6513 7.4277 7.4277 8.8523 8.8523 9.1404 9.1404 9.4719 9.4719 9.7294 9.7294 10.8838 10.8838 13.5913 13.5913 15.2207 15.2207 k =-0.3667 0.6627 0.9723 ( 2696 PWs) bands (ev): -31.3094 -31.3094 -31.2983 -31.2983 -12.4992 -12.4992 -12.4777 -12.4777 -11.1727 -11.1727 -11.1545 -11.1545 -11.0390 -11.0390 -10.9772 -10.9772 -0.4408 -0.4408 -0.4105 -0.4105 3.5318 3.5318 5.6923 5.6923 6.5085 6.5085 6.6478 6.6478 7.3621 7.3621 8.8445 8.8445 9.2237 9.2237 9.5477 9.5477 9.7265 9.7265 10.8884 10.8884 13.5864 13.5864 15.1984 15.1984 k =-0.3720 0.6411 0.9723 ( 2700 PWs) bands (ev): -31.3113 -31.3113 -31.2995 -31.2995 -12.4973 -12.4973 -12.4746 -12.4746 -11.1728 -11.1728 -11.1548 -11.1548 -11.0316 -11.0316 -10.9672 -10.9672 -0.4276 -0.4276 -0.3821 -0.3821 3.5011 3.5011 5.7171 5.7171 6.4371 6.4371 6.6503 6.6503 7.2959 7.2959 8.8379 8.8379 9.3104 9.3104 9.6242 9.6242 9.7241 9.7241 10.8898 10.8898 13.5809 13.5809 15.1779 15.1779 k =-0.3773 0.6195 0.9723 ( 2700 PWs) bands (ev): -31.3132 -31.3132 -31.3008 -31.3008 -12.4954 -12.4954 -12.4717 -12.4717 -11.1737 -11.1737 -11.1556 -11.1556 -11.0232 -11.0232 -10.9567 -10.9567 -0.4143 -0.4143 -0.3537 -0.3537 3.4724 3.4724 5.7366 5.7366 6.3663 6.3663 6.6576 6.6576 7.2293 7.2293 8.8325 8.8325 9.4002 9.4002 9.6995 9.6995 9.7238 9.7238 10.8880 10.8880 13.5750 13.5750 15.1590 15.1590 k =-0.3827 0.5980 0.9723 ( 2700 PWs) bands (ev): -31.3151 -31.3151 -31.3021 -31.3021 -12.4936 -12.4936 -12.4690 -12.4690 -11.1752 -11.1752 -11.1566 -11.1566 -11.0139 -11.0139 -10.9457 -10.9457 -0.4010 -0.4010 -0.3255 -0.3255 3.4454 3.4454 5.7512 5.7512 6.2965 6.2965 6.6690 6.6690 7.1627 7.1627 8.8282 8.8282 9.4931 9.4931 9.7177 9.7177 9.7814 9.7814 10.8832 10.8832 13.5691 13.5691 15.1412 15.1412 k =-0.3880 0.5764 0.9723 ( 2700 PWs) bands (ev): -31.3170 -31.3170 -31.3034 -31.3034 -12.4920 -12.4920 -12.4664 -12.4664 -11.1773 -11.1773 -11.1578 -11.1578 -11.0039 -11.0039 -10.9343 -10.9343 -0.3879 -0.3879 -0.2976 -0.2976 3.4203 3.4203 5.7613 5.7613 6.2279 6.2279 6.6840 6.6840 7.0965 7.0965 8.8251 8.8251 9.5891 9.5891 9.7163 9.7163 9.8592 9.8592 10.8756 10.8756 13.5633 13.5633 15.1238 15.1238 k =-0.3933 0.5549 0.9723 ( 2700 PWs) bands (ev): -31.3188 -31.3188 -31.3047 -31.3047 -12.4905 -12.4905 -12.4640 -12.4640 -11.1799 -11.1799 -11.1591 -11.1591 -10.9934 -10.9934 -10.9226 -10.9226 -0.3750 -0.3750 -0.2700 -0.2700 3.3969 3.3969 5.7676 5.7676 6.1609 6.1609 6.7019 6.7019 7.0310 7.0310 8.8232 8.8232 9.6870 9.6870 9.7156 9.7156 9.9374 9.9374 10.8655 10.8655 13.5580 13.5580 15.1059 15.1059 k =-0.3987 0.5333 0.9723 ( 2706 PWs) bands (ev): -31.3206 -31.3206 -31.3060 -31.3060 -12.4891 -12.4891 -12.4618 -12.4618 -11.1829 -11.1829 -11.1604 -11.1604 -10.9825 -10.9825 -10.9107 -10.9107 -0.3623 -0.3623 -0.2430 -0.2430 3.3752 3.3752 5.7707 5.7707 6.0955 6.0955 6.7219 6.7219 6.9667 6.9667 8.8223 8.8223 9.7119 9.7119 9.7909 9.7909 10.0155 10.0155 10.8531 10.8531 13.5533 13.5533 15.0865 15.0865 k =-0.4040 0.5118 0.9723 ( 2708 PWs) bands (ev): -31.3224 -31.3224 -31.3072 -31.3072 -12.4878 -12.4878 -12.4598 -12.4598 -11.1861 -11.1861 -11.1618 -11.1618 -10.9714 -10.9714 -10.8987 -10.8987 -0.3500 -0.3500 -0.2166 -0.2166 3.3552 3.3552 5.7711 5.7711 6.0321 6.0321 6.7431 6.7431 6.9041 6.9041 8.8225 8.8225 9.7105 9.7105 9.8953 9.8953 10.0932 10.0932 10.8386 10.8386 13.5495 13.5495 15.0648 15.0648 k =-0.4093 0.4902 0.9723 ( 2712 PWs) bands (ev): -31.3241 -31.3241 -31.3085 -31.3085 -12.4866 -12.4866 -12.4580 -12.4580 -11.1896 -11.1896 -11.1632 -11.1632 -10.9601 -10.9601 -10.8867 -10.8867 -0.3380 -0.3380 -0.1909 -0.1909 3.3368 3.3368 5.7694 5.7694 5.9707 5.9707 6.7636 6.7636 6.8450 6.8450 8.8237 8.8237 9.7091 9.7091 10.0026 10.0026 10.1700 10.1700 10.8224 10.8224 13.5468 13.5468 15.0260 15.0263 k =-0.4147 0.4686 0.9723 ( 2712 PWs) bands (ev): -31.3258 -31.3258 -31.3097 -31.3097 -12.4856 -12.4856 -12.4563 -12.4563 -11.1931 -11.1931 -11.1645 -11.1645 -10.9489 -10.9489 -10.8748 -10.8748 -0.3265 -0.3265 -0.1660 -0.1660 3.3199 3.3199 5.7662 5.7662 5.9117 5.9117 6.7654 6.7654 6.8070 6.8070 8.8258 8.8258 9.7076 9.7076 10.1123 10.1123 10.2457 10.2457 10.8046 10.8046 13.5455 13.5455 14.9253 14.9253 k =-0.4200 0.4471 0.9723 ( 2712 PWs) bands (ev): -31.3274 -31.3274 -31.3108 -31.3108 -12.4847 -12.4847 -12.4548 -12.4548 -11.1966 -11.1966 -11.1659 -11.1659 -10.9378 -10.9378 -10.8630 -10.8630 -0.3155 -0.3155 -0.1420 -0.1420 3.3045 3.3045 5.7619 5.7619 5.8552 5.8552 6.7181 6.7181 6.8202 6.8202 8.8287 8.8287 9.7062 9.7062 10.2242 10.2242 10.3198 10.3198 10.7857 10.7857 13.5458 13.5458 14.8133 14.8133 k =-0.4253 0.4255 0.9723 ( 2708 PWs) bands (ev): -31.3289 -31.3289 -31.3120 -31.3120 -12.4839 -12.4839 -12.4534 -12.4534 -11.2001 -11.2001 -11.1673 -11.1673 -10.9270 -10.9270 -10.8516 -10.8516 -0.3051 -0.3051 -0.1191 -0.1191 3.2905 3.2905 5.7568 5.7568 5.8014 5.8014 6.6646 6.6646 6.8419 6.8419 8.8324 8.8324 9.7049 9.7049 10.3382 10.3382 10.3920 10.3920 10.7660 10.7660 13.5479 13.5479 14.6926 14.6926 k =-0.4307 0.4040 0.9723 ( 2712 PWs) bands (ev): -31.3303 -31.3303 -31.3130 -31.3130 -12.4832 -12.4832 -12.4522 -12.4522 -11.2035 -11.2035 -11.1686 -11.1686 -10.9164 -10.9164 -10.8405 -10.8405 -0.2952 -0.2952 -0.0973 -0.0973 3.2779 3.2779 5.7503 5.7503 5.7513 5.7513 6.6126 6.6126 6.8640 6.8640 8.8367 8.8367 9.7036 9.7036 10.4538 10.4538 10.4618 10.4618 10.7457 10.7457 13.5517 13.5517 14.5651 14.5651 k =-0.4360 0.3824 0.9723 ( 2720 PWs) bands (ev): -31.3317 -31.3317 -31.3140 -31.3140 -12.4825 -12.4825 -12.4512 -12.4512 -11.2068 -11.2068 -11.1699 -11.1699 -10.9062 -10.9062 -10.8298 -10.8298 -0.2859 -0.2859 -0.0767 -0.0767 3.2666 3.2666 5.7025 5.7025 5.7454 5.7454 6.5633 6.5633 6.8856 6.8856 8.8416 8.8416 9.7024 9.7024 10.5287 10.5287 10.5709 10.5709 10.7252 10.7252 13.5575 13.5575 14.4327 14.4327 k =-0.4413 0.3608 0.9723 ( 2720 PWs) bands (ev): -31.3330 -31.3330 -31.3150 -31.3150 -12.4820 -12.4820 -12.4502 -12.4502 -11.2099 -11.2099 -11.1712 -11.1712 -10.8966 -10.8966 -10.8197 -10.8197 -0.2773 -0.2773 -0.0575 -0.0575 3.2565 3.2565 5.6578 5.6578 5.7397 5.7397 6.5169 6.5169 6.9061 6.9061 8.8469 8.8469 9.7012 9.7012 10.5923 10.5923 10.6886 10.6886 10.7052 10.7052 13.5652 13.5652 14.2971 14.2971 k =-0.4467 0.3393 0.9723 ( 2724 PWs) bands (ev): -31.3341 -31.3341 -31.3159 -31.3159 -12.4816 -12.4816 -12.4494 -12.4494 -11.2129 -11.2129 -11.1724 -11.1724 -10.8875 -10.8875 -10.8102 -10.8102 -0.2694 -0.2694 -0.0396 -0.0396 3.2475 3.2475 5.6165 5.6165 5.7340 5.7340 6.4739 6.4739 6.9253 6.9253 8.8524 8.8524 9.7002 9.7002 10.6513 10.6513 10.6860 10.6860 10.8075 10.8075 13.5747 13.5747 14.1600 14.1600 k =-0.4520 0.3177 0.9723 ( 2732 PWs) bands (ev): -31.3352 -31.3352 -31.3167 -31.3167 -12.4812 -12.4812 -12.4487 -12.4487 -11.2156 -11.2156 -11.1735 -11.1735 -10.8790 -10.8790 -10.8014 -10.8014 -0.2621 -0.2621 -0.0232 -0.0232 3.2396 3.2396 5.5786 5.5786 5.7287 5.7287 6.4343 6.4343 6.9432 6.9432 8.8581 8.8581 9.6991 9.6991 10.6637 10.6637 10.7101 10.7101 10.9258 10.9258 13.5858 13.5858 14.0230 14.0230 k =-0.4573 0.2962 0.9723 ( 2736 PWs) bands (ev): -31.3362 -31.3362 -31.3175 -31.3175 -12.4809 -12.4809 -12.4481 -12.4481 -11.2181 -11.2181 -11.1745 -11.1745 -10.8712 -10.8712 -10.7933 -10.7933 -0.2556 -0.2556 -0.0084 -0.0084 3.2327 3.2327 5.5444 5.5444 5.7237 5.7237 6.3984 6.3984 6.9594 6.9594 8.8637 8.8637 9.6982 9.6982 10.6462 10.6462 10.7608 10.7608 11.0430 11.0430 13.5982 13.5982 13.8877 13.8877 k =-0.4627 0.2746 0.9723 ( 2748 PWs) bands (ev): -31.3371 -31.3371 -31.3181 -31.3181 -12.4806 -12.4806 -12.4476 -12.4476 -11.2203 -11.2203 -11.1754 -11.1754 -10.8642 -10.8642 -10.7860 -10.7860 -0.2498 -0.2498 0.0049 0.0049 3.2268 3.2268 5.5139 5.5139 5.7192 5.7192 6.3664 6.3664 6.9739 6.9739 8.8691 8.8691 9.6973 9.6973 10.6294 10.6294 10.8070 10.8070 11.1580 11.1580 13.6110 13.6110 13.7562 13.7562 k =-0.4680 0.2531 0.9723 ( 2752 PWs) bands (ev): -31.3379 -31.3379 -31.3187 -31.3187 -12.4804 -12.4804 -12.4472 -12.4472 -11.2223 -11.2223 -11.1762 -11.1762 -10.8580 -10.8580 -10.7795 -10.7795 -0.2448 -0.2448 0.0165 0.0165 3.2218 3.2218 5.4872 5.4872 5.7152 5.7152 6.3383 6.3383 6.9867 6.9867 8.8742 8.8742 9.6965 9.6965 10.6141 10.6141 10.8479 10.8479 11.2692 11.2692 13.6128 13.6128 13.6414 13.6414 k =-0.4733 0.2315 0.9723 ( 2748 PWs) bands (ev): -31.3385 -31.3385 -31.3192 -31.3192 -12.4802 -12.4802 -12.4469 -12.4469 -11.2239 -11.2239 -11.1769 -11.1769 -10.8527 -10.8527 -10.7740 -10.7740 -0.2405 -0.2405 0.0264 0.0264 3.2177 3.2177 5.4645 5.4645 5.7118 5.7118 6.3144 6.3144 6.9976 6.9976 8.8788 8.8788 9.6959 9.6959 10.6007 10.6007 10.8832 10.8832 11.3746 11.3746 13.5073 13.5073 13.6417 13.6417 k =-0.4787 0.2099 0.9723 ( 2748 PWs) bands (ev): -31.3391 -31.3391 -31.3196 -31.3196 -12.4801 -12.4801 -12.4466 -12.4466 -11.2253 -11.2253 -11.1775 -11.1775 -10.8483 -10.8483 -10.7694 -10.7694 -0.2370 -0.2370 0.0346 0.0346 3.2143 3.2143 5.4458 5.4458 5.7089 5.7089 6.2947 6.2947 7.0066 7.0066 8.8827 8.8827 9.6953 9.6953 10.5894 10.5894 10.9125 10.9125 11.4712 11.4712 13.3999 13.3999 13.6537 13.6537 k =-0.4840 0.1884 0.9723 ( 2744 PWs) bands (ev): -31.3395 -31.3395 -31.3199 -31.3199 -12.4800 -12.4800 -12.4464 -12.4464 -11.2264 -11.2264 -11.1779 -11.1779 -10.8448 -10.8448 -10.7658 -10.7658 -0.2342 -0.2342 0.0409 0.0409 3.2118 3.2118 5.4312 5.4312 5.7067 5.7067 6.2792 6.2792 7.0136 7.0136 8.8860 8.8860 9.6949 9.6949 10.5804 10.5804 10.9355 10.9355 11.5549 11.5549 13.3073 13.3073 13.6645 13.6645 k =-0.4893 0.1668 0.9723 ( 2744 PWs) bands (ev): -31.3398 -31.3398 -31.3201 -31.3201 -12.4799 -12.4799 -12.4463 -12.4463 -11.2272 -11.2272 -11.1783 -11.1783 -10.8423 -10.8423 -10.7632 -10.7632 -0.2323 -0.2323 0.0455 0.0455 3.2100 3.2100 5.4207 5.4207 5.7051 5.7051 6.2682 6.2682 7.0187 7.0187 8.8883 8.8883 9.6945 9.6945 10.5738 10.5738 10.9521 10.9521 11.6209 11.6209 13.2348 13.2348 13.6728 13.6728 k =-0.4947 0.1453 0.9723 ( 2752 PWs) bands (ev): -31.3400 -31.3400 -31.3203 -31.3203 -12.4799 -12.4799 -12.4462 -12.4462 -11.2277 -11.2277 -11.1785 -11.1785 -10.8408 -10.8408 -10.7617 -10.7617 -0.2311 -0.2311 0.0483 0.0483 3.2089 3.2089 5.4144 5.4144 5.7041 5.7041 6.2615 6.2615 7.0217 7.0217 8.8898 8.8898 9.6943 9.6943 10.5698 10.5698 10.9622 10.9622 11.6636 11.6636 13.1881 13.1881 13.6782 13.6782 k =-0.5000 0.1237 0.9723 ( 2752 PWs) bands (ev): -31.3400 -31.3400 -31.3203 -31.3203 -12.4799 -12.4799 -12.4462 -12.4462 -11.2278 -11.2278 -11.1785 -11.1785 -10.8403 -10.8403 -10.7612 -10.7612 -0.2307 -0.2307 0.0492 0.0492 3.2086 3.2086 5.4123 5.4123 5.7038 5.7038 6.2593 6.2593 7.0227 7.0227 8.8903 8.8903 9.6943 9.6943 10.5684 10.5684 10.9655 10.9655 11.6785 11.6785 13.1719 13.1719 13.6800 13.6800 k =-0.5000 0.1237 0.9723 ( 2752 PWs) bands (ev): -31.3400 -31.3400 -31.3203 -31.3203 -12.4799 -12.4799 -12.4462 -12.4462 -11.2278 -11.2278 -11.1785 -11.1785 -10.8403 -10.8403 -10.7612 -10.7612 -0.2307 -0.2307 0.0492 0.0492 3.2086 3.2086 5.4123 5.4123 5.7038 5.7038 6.2593 6.2593 7.0227 7.0227 8.8903 8.8903 9.6943 9.6943 10.5684 10.5684 10.9655 10.9655 11.6785 11.6785 13.1719 13.1719 13.6800 13.6800 k =-0.5000 0.1237 0.9502 ( 2754 PWs) bands (ev): -31.3401 -31.3401 -31.3204 -31.3204 -12.4798 -12.4798 -12.4459 -12.4459 -11.2276 -11.2276 -11.1783 -11.1783 -10.8404 -10.8404 -10.7612 -10.7612 -0.2327 -0.2327 0.0474 0.0474 3.2089 3.2089 5.4155 5.4155 5.7035 5.7035 6.2624 6.2624 7.0240 7.0240 8.8919 8.8919 9.6946 9.6946 10.5687 10.5687 10.9658 10.9658 11.6751 11.6751 13.1729 13.1729 13.6852 13.6852 k =-0.5000 0.1237 0.9281 ( 2754 PWs) bands (ev): -31.3402 -31.3402 -31.3205 -31.3205 -12.4793 -12.4793 -12.4453 -12.4453 -11.2269 -11.2269 -11.1775 -11.1775 -10.8404 -10.8404 -10.7613 -10.7613 -0.2387 -0.2387 0.0422 0.0422 3.2100 3.2100 5.4248 5.4248 5.7027 5.7027 6.2719 6.2719 7.0277 7.0277 8.8969 8.8969 9.6956 9.6956 10.5697 10.5697 10.9665 10.9665 11.6650 11.6650 13.1757 13.1757 13.7006 13.7006 k =-0.5000 0.1237 0.9060 ( 2752 PWs) bands (ev): -31.3403 -31.3403 -31.3206 -31.3206 -12.4786 -12.4786 -12.4441 -12.4441 -11.2257 -11.2257 -11.1761 -11.1761 -10.8406 -10.8406 -10.7615 -10.7615 -0.2486 -0.2486 0.0336 0.0336 3.2118 3.2118 5.4403 5.4403 5.7013 5.7013 6.2876 6.2876 7.0338 7.0338 8.9051 8.9051 9.6972 9.6972 10.5712 10.5712 10.9678 10.9678 11.6485 11.6485 13.1802 13.1802 13.7260 13.7260 k =-0.5000 0.1237 0.8839 ( 2740 PWs) bands (ev): -31.3405 -31.3405 -31.3208 -31.3208 -12.4775 -12.4775 -12.4426 -12.4426 -11.2241 -11.2241 -11.1743 -11.1743 -10.8407 -10.8407 -10.7618 -10.7618 -0.2623 -0.2623 0.0217 0.0217 3.2143 3.2143 5.4620 5.4620 5.6995 5.6995 6.3094 6.3094 7.0424 7.0424 8.9167 8.9167 9.6995 9.6995 10.5733 10.5733 10.9696 10.9696 11.6263 11.6263 13.1859 13.1859 13.7607 13.7607 k =-0.5000 0.1237 0.8618 ( 2736 PWs) bands (ev): -31.3408 -31.3408 -31.3210 -31.3210 -12.4762 -12.4762 -12.4406 -12.4406 -11.2221 -11.2221 -11.1719 -11.1719 -10.8409 -10.8409 -10.7622 -10.7622 -0.2798 -0.2798 0.0064 0.0064 3.2175 3.2175 5.4895 5.4895 5.6972 5.6972 6.3372 6.3372 7.0533 7.0533 8.9314 8.9314 9.7025 9.7025 10.5759 10.5759 10.9719 10.9719 11.5990 11.5990 13.1922 13.1922 13.8041 13.8041 k =-0.5000 0.1237 0.8397 ( 2730 PWs) bands (ev): -31.3411 -31.3411 -31.3214 -31.3214 -12.4746 -12.4746 -12.4382 -12.4382 -11.2195 -11.2195 -11.1690 -11.1690 -10.8411 -10.8411 -10.7626 -10.7626 -0.3008 -0.3008 -0.0119 -0.0119 3.2214 3.2214 5.5229 5.5229 5.6945 5.6945 6.3708 6.3708 7.0667 7.0667 8.9494 8.9494 9.7063 9.7063 10.5791 10.5791 10.9747 10.9747 11.5672 11.5672 13.1986 13.1986 13.8553 13.8553 k =-0.5000 0.1237 0.8176 ( 2722 PWs) bands (ev): -31.3415 -31.3415 -31.3217 -31.3217 -12.4728 -12.4728 -12.4354 -12.4354 -11.2166 -11.2166 -11.1656 -11.1656 -10.8414 -10.8414 -10.7631 -10.7631 -0.3253 -0.3253 -0.0332 -0.0332 3.2259 3.2259 5.5619 5.5619 5.6915 5.6915 6.4100 6.4100 7.0823 7.0823 8.9706 8.9706 9.7109 9.7109 10.5827 10.5827 10.9780 10.9780 11.5319 11.5319 13.2039 13.2039 13.9137 13.9137 k =-0.5000 0.1237 0.7955 ( 2718 PWs) bands (ev): -31.3419 -31.3419 -31.3222 -31.3222 -12.4707 -12.4707 -12.4322 -12.4322 -11.2132 -11.2132 -11.1617 -11.1617 -10.8416 -10.8416 -10.7636 -10.7636 -0.3529 -0.3529 -0.0574 -0.0574 3.2311 3.2311 5.6062 5.6062 5.6882 5.6882 6.4546 6.4546 7.1002 7.1002 8.9950 8.9950 9.7163 9.7163 10.5866 10.5866 10.9818 10.9818 11.4936 11.4936 13.2071 13.2071 13.9783 13.9783 k =-0.5000 0.1237 0.7734 ( 2718 PWs) bands (ev): -31.3424 -31.3424 -31.3226 -31.3226 -12.4684 -12.4684 -12.4288 -12.4288 -11.2094 -11.2094 -11.1573 -11.1573 -10.8419 -10.8419 -10.7643 -10.7643 -0.3835 -0.3835 -0.0842 -0.0842 3.2370 3.2370 5.6558 5.6558 5.6847 5.6847 6.5044 6.5044 7.1203 7.1203 9.0225 9.0225 9.7226 9.7226 10.5909 10.5909 10.9860 10.9860 11.4532 11.4532 13.2070 13.2070 14.0482 14.0482 k =-0.5000 0.1237 0.7513 ( 2716 PWs) bands (ev): -31.3429 -31.3429 -31.3232 -31.3232 -12.4659 -12.4659 -12.4250 -12.4250 -11.2053 -11.2053 -11.1524 -11.1524 -10.8421 -10.8421 -10.7649 -10.7649 -0.4169 -0.4169 -0.1135 -0.1135 3.2434 3.2434 5.6808 5.6808 5.7103 5.7103 6.5591 6.5591 7.1425 7.1425 9.0531 9.0531 9.7298 9.7298 10.5954 10.5954 10.9905 10.9905 11.4112 11.4112 13.2021 13.2021 14.0512 14.0512 k =-0.5000 0.1237 0.7292 ( 2716 PWs) bands (ev): -31.3435 -31.3435 -31.3237 -31.3237 -12.4632 -12.4632 -12.4209 -12.4209 -11.2007 -11.2007 -11.1470 -11.1470 -10.8423 -10.8423 -10.7656 -10.7656 -0.4527 -0.4527 -0.1450 -0.1450 3.2504 3.2504 5.6768 5.6768 5.7695 5.7695 6.6187 6.6187 7.1667 7.1667 9.0867 9.0867 9.7379 9.7379 10.6002 10.6002 10.9953 10.9953 11.3683 11.3683 13.1912 13.1912 13.9322 13.9322 k =-0.5000 0.1237 0.7071 ( 2716 PWs) bands (ev): -31.3442 -31.3442 -31.3243 -31.3243 -12.4603 -12.4603 -12.4166 -12.4166 -11.1958 -11.1958 -11.1413 -11.1413 -10.8425 -10.8425 -10.7663 -10.7663 -0.4909 -0.4909 -0.1785 -0.1785 3.2580 3.2580 5.6726 5.6726 5.8331 5.8331 6.6827 6.6827 7.1929 7.1929 9.1232 9.1232 9.7471 9.7471 10.6050 10.6050 11.0001 11.0001 11.3249 11.3249 13.1733 13.1733 13.8085 13.8085 k =-0.5000 0.1237 0.6850 ( 2716 PWs) bands (ev): -31.3449 -31.3449 -31.3250 -31.3250 -12.4573 -12.4573 -12.4120 -12.4120 -11.1905 -11.1905 -11.1350 -11.1350 -10.8426 -10.8426 -10.7670 -10.7670 -0.5310 -0.5310 -0.2139 -0.2139 3.2660 3.2660 5.6682 5.6682 5.9009 5.9009 6.7510 6.7510 7.2210 7.2210 9.1626 9.1626 9.7573 9.7573 10.6100 10.6100 11.0049 11.0049 11.2815 11.2815 13.1481 13.1481 13.6817 13.6817 k =-0.5000 0.1237 0.6629 ( 2712 PWs) bands (ev): -31.3456 -31.3456 -31.3257 -31.3257 -12.4542 -12.4542 -12.4073 -12.4073 -11.1850 -11.1850 -11.1284 -11.1284 -10.8426 -10.8426 -10.7678 -10.7678 -0.5728 -0.5728 -0.2508 -0.2508 3.2745 3.2745 5.6637 5.6637 5.9726 5.9726 6.8234 6.8234 7.2508 7.2508 9.2048 9.2048 9.7686 9.7686 10.6149 10.6149 11.0092 11.0092 11.2385 11.2385 13.1157 13.1157 13.5526 13.5526 k =-0.5000 0.1237 0.6408 ( 2704 PWs) bands (ev): -31.3463 -31.3463 -31.3264 -31.3264 -12.4509 -12.4509 -12.4024 -12.4024 -11.1792 -11.1792 -11.1214 -11.1214 -10.8425 -10.8425 -10.7685 -10.7685 -0.6161 -0.6161 -0.2891 -0.2891 3.2834 3.2834 5.6590 5.6590 6.0480 6.0480 6.8996 6.8996 7.2822 7.2822 9.2498 9.2498 9.7809 9.7809 10.6198 10.6198 11.0128 11.0128 11.1962 11.1962 13.0770 13.0770 13.4219 13.4219 k =-0.5000 0.1237 0.6187 ( 2700 PWs) bands (ev): -31.3471 -31.3471 -31.3272 -31.3272 -12.4476 -12.4476 -12.3974 -12.3974 -11.1731 -11.1731 -11.1141 -11.1141 -10.8423 -10.8423 -10.7692 -10.7692 -0.6607 -0.6607 -0.3286 -0.3286 3.2926 3.2926 5.6541 5.6541 6.1267 6.1267 6.9793 6.9793 7.3151 7.3151 9.2973 9.2973 9.7944 9.7944 10.6246 10.6246 11.0154 11.0154 11.1549 11.1549 13.0335 13.0335 13.2903 13.2903 k =-0.5000 0.1237 0.5966 ( 2700 PWs) bands (ev): -31.3479 -31.3479 -31.3279 -31.3279 -12.4443 -12.4443 -12.3923 -12.3923 -11.1668 -11.1668 -11.1065 -11.1065 -10.8420 -10.8420 -10.7699 -10.7699 -0.7061 -0.7061 -0.3690 -0.3690 3.3022 3.3022 5.6492 5.6492 6.2085 6.2085 7.0624 7.0624 7.3494 7.3494 9.3473 9.3473 9.8089 9.8089 10.6293 10.6293 11.0164 11.0164 11.1151 11.1151 12.9870 12.9870 13.1582 13.1582 k =-0.5000 0.1237 0.5745 ( 2700 PWs) bands (ev): -31.3487 -31.3487 -31.3287 -31.3287 -12.4409 -12.4409 -12.3871 -12.3871 -11.1604 -11.1604 -11.0986 -11.0986 -10.8415 -10.8415 -10.7705 -10.7705 -0.7524 -0.7524 -0.4101 -0.4101 3.3120 3.3120 5.6441 5.6441 6.2932 6.2932 7.1486 7.1486 7.3848 7.3848 9.3998 9.3998 9.8245 9.8245 10.6338 10.6338 11.0153 11.0153 11.0768 11.0768 12.9395 12.9395 13.0263 13.0263 k =-0.5000 0.1237 0.5524 ( 2694 PWs) bands (ev): -31.3495 -31.3495 -31.3295 -31.3295 -12.4375 -12.4375 -12.3819 -12.3819 -11.1539 -11.1539 -11.0904 -11.0904 -10.8408 -10.8408 -10.7710 -10.7710 -0.7990 -0.7990 -0.4516 -0.4516 3.3220 3.3220 5.6389 5.6389 6.3805 6.3805 7.2375 7.2375 7.4214 7.4214 9.4544 9.4544 9.8412 9.8412 10.6380 10.6380 11.0112 11.0112 11.0409 11.0409 12.8928 12.8928 12.8949 12.8949 k =-0.5000 0.1237 0.5303 ( 2690 PWs) bands (ev): -31.3503 -31.3503 -31.3304 -31.3304 -12.4341 -12.4341 -12.3768 -12.3768 -11.1473 -11.1473 -11.0821 -11.0821 -10.8399 -10.8399 -10.7715 -10.7715 -0.8459 -0.8459 -0.4934 -0.4934 3.3322 3.3322 5.6336 5.6336 6.4701 6.4701 7.3290 7.3290 7.4588 7.4588 9.5112 9.5112 9.8589 9.8589 10.6420 10.6420 10.9990 10.9990 11.0119 11.0119 12.7641 12.7641 12.8490 12.8490 k =-0.5000 0.1237 0.5082 ( 2692 PWs) bands (ev): -31.3512 -31.3512 -31.3312 -31.3312 -12.4307 -12.4307 -12.3716 -12.3716 -11.1407 -11.1407 -11.0737 -11.0737 -10.8387 -10.8387 -10.7719 -10.7719 -0.8928 -0.8928 -0.5353 -0.5353 3.3424 3.3424 5.6282 5.6282 6.5618 6.5618 7.4225 7.4225 7.4973 7.4973 9.5699 9.5699 9.8774 9.8774 10.6458 10.6458 10.9703 10.9703 10.9979 10.9979 12.6345 12.6345 12.8093 12.8093 k =-0.5000 0.1237 0.4861 ( 2682 PWs) bands (ev): -31.3520 -31.3520 -31.3320 -31.3320 -12.4274 -12.4274 -12.3666 -12.3666 -11.1342 -11.1342 -11.0652 -11.0652 -10.8374 -10.8374 -10.7721 -10.7721 -0.9395 -0.9395 -0.5770 -0.5770 3.3527 3.3527 5.6228 5.6228 6.6553 6.6553 7.5152 7.5152 7.5392 7.5392 9.6303 9.6303 9.8969 9.8969 10.6493 10.6493 10.9403 10.9403 10.9833 10.9833 12.5063 12.5063 12.7751 12.7751 k =-0.5000 0.1237 0.4640 ( 2686 PWs) bands (ev): -31.3529 -31.3529 -31.3329 -31.3329 -12.4241 -12.4241 -12.3616 -12.3616 -11.1277 -11.1277 -11.0566 -11.0566 -10.8357 -10.8357 -10.7723 -10.7723 -0.9857 -0.9857 -0.6184 -0.6184 3.3630 3.3630 5.6174 5.6174 6.7503 6.7503 7.5712 7.5712 7.6198 7.6198 9.6923 9.6923 9.9171 9.9171 10.6526 10.6526 10.9122 10.9122 10.9647 10.9647 12.3798 12.3798 12.7475 12.7475 k =-0.5000 0.1237 0.4419 ( 2686 PWs) bands (ev): -31.3538 -31.3538 -31.3337 -31.3337 -12.4210 -12.4210 -12.3567 -12.3567 -11.1214 -11.1214 -11.0481 -11.0481 -10.8339 -10.8339 -10.7723 -10.7723 -1.0313 -1.0313 -0.6593 -0.6593 3.3731 3.3731 5.6120 5.6120 6.8466 6.8466 7.6110 7.6110 7.7183 7.7183 9.7556 9.7556 9.9379 9.9379 10.6556 10.6556 10.8863 10.8863 10.9416 10.9416 12.2551 12.2551 12.7272 12.7272 k =-0.5000 0.1237 0.4199 ( 2686 PWs) bands (ev): -31.3546 -31.3546 -31.3345 -31.3345 -12.4179 -12.4179 -12.3520 -12.3520 -11.1153 -11.1153 -11.0397 -11.0397 -10.8317 -10.8317 -10.7721 -10.7721 -1.0760 -1.0760 -0.6994 -0.6994 3.3832 3.3832 5.6066 5.6066 6.9439 6.9439 7.6499 7.6499 7.8189 7.8189 9.8200 9.8200 9.9592 9.9592 10.6583 10.6583 10.8629 10.8629 10.9138 10.9138 12.1325 12.1325 12.7147 12.7147 k =-0.5000 0.1237 0.3978 ( 2690 PWs) bands (ev): -31.3554 -31.3554 -31.3354 -31.3354 -12.4150 -12.4150 -12.3474 -12.3474 -11.1095 -11.1095 -11.0314 -11.0314 -10.8293 -10.8293 -10.7718 -10.7718 -1.1197 -1.1197 -0.7386 -0.7386 3.3930 3.3930 5.6013 5.6013 7.0420 7.0420 7.6882 7.6882 7.9207 7.9207 9.8852 9.8852 9.9808 9.9808 10.6607 10.6607 10.8416 10.8416 10.8816 10.8816 12.0121 12.0121 12.7100 12.7100 k =-0.5000 0.1237 0.3757 ( 2690 PWs) bands (ev): -31.3563 -31.3563 -31.3362 -31.3362 -12.4122 -12.4122 -12.3430 -12.3430 -11.1039 -11.1039 -11.0233 -11.0233 -10.8266 -10.8266 -10.7713 -10.7713 -1.1622 -1.1622 -0.7767 -0.7767 3.4026 3.4026 5.5961 5.5961 7.1405 7.1405 7.7258 7.7258 8.0233 8.0233 9.9508 9.9508 10.0026 10.0026 10.6628 10.6628 10.8221 10.8221 10.8457 10.8457 11.8944 11.8944 12.7130 12.7130 k =-0.5000 0.1237 0.3536 ( 2694 PWs) bands (ev): -31.3571 -31.3571 -31.3369 -31.3369 -12.4095 -12.4095 -12.3388 -12.3388 -11.0986 -11.0986 -11.0155 -11.0155 -10.8237 -10.8237 -10.7706 -10.7706 -1.2032 -1.2032 -0.8136 -0.8136 3.4119 3.4119 5.5910 5.5910 7.2391 7.2391 7.7626 7.7626 8.1265 8.1265 10.0153 10.0153 10.0257 10.0257 10.6646 10.6646 10.7972 10.7972 10.8135 10.8135 11.7794 11.7794 12.7234 12.7234 k =-0.5000 0.1237 0.3315 ( 2694 PWs) bands (ev): -31.3578 -31.3578 -31.3377 -31.3377 -12.4069 -12.4069 -12.3348 -12.3348 -11.0937 -11.0937 -11.0080 -11.0080 -10.8206 -10.8206 -10.7698 -10.7698 -1.2426 -1.2426 -0.8491 -0.8491 3.4209 3.4209 5.5860 5.5860 7.3374 7.3374 7.7984 7.7984 8.2298 8.2298 10.0450 10.0450 10.0831 10.0831 10.6659 10.6659 10.7556 10.7556 10.7968 10.7968 11.6676 11.6676 12.7407 12.7407 k =-0.5000 0.1237 0.3094 ( 2694 PWs) bands (ev): -31.3586 -31.3586 -31.3384 -31.3384 -12.4045 -12.4045 -12.3310 -12.3310 -11.0891 -11.0891 -11.0009 -11.0009 -10.8173 -10.8173 -10.7687 -10.7687 -1.2803 -1.2803 -0.8831 -0.8831 3.4295 3.4295 5.5812 5.5812 7.4352 7.4352 7.8329 7.8329 8.3330 8.3330 10.0660 10.0660 10.1481 10.1481 10.6667 10.6667 10.7080 10.7080 10.7852 10.7852 11.5594 11.5594 12.7642 12.7642 k =-0.5000 0.1237 0.2873 ( 2696 PWs) bands (ev): -31.3593 -31.3593 -31.3391 -31.3391 -12.4023 -12.4023 -12.3274 -12.3274 -11.0849 -11.0849 -10.9942 -10.9942 -10.8139 -10.8139 -10.7675 -10.7675 -1.3161 -1.3161 -0.9154 -0.9154 3.4377 3.4377 5.5766 5.5766 7.5319 7.5319 7.8659 7.8659 8.4358 8.4358 10.0863 10.0863 10.2123 10.2123 10.6572 10.6572 10.6667 10.6667 10.7763 10.7763 11.4552 11.4552 12.7932 12.7932 k =-0.5000 0.1237 0.2652 ( 2698 PWs) bands (ev): -31.3599 -31.3599 -31.3398 -31.3398 -12.4002 -12.4002 -12.3241 -12.3241 -11.0810 -11.0810 -10.9879 -10.9879 -10.8105 -10.8105 -10.7662 -10.7662 -1.3499 -1.3499 -0.9458 -0.9458 3.4454 3.4454 5.5722 5.5722 7.6271 7.6271 7.8972 7.8972 8.5379 8.5379 10.1055 10.1055 10.2751 10.2751 10.6041 10.6041 10.6654 10.6654 10.7697 10.7697 11.3558 11.3558 12.8268 12.8268 k =-0.5000 0.1237 0.2431 ( 2710 PWs) bands (ev): -31.3606 -31.3606 -31.3404 -31.3404 -12.3982 -12.3982 -12.3211 -12.3211 -11.0776 -11.0776 -10.9821 -10.9821 -10.8070 -10.8070 -10.7648 -10.7648 -1.3815 -1.3815 -0.9743 -0.9743 3.4527 3.4527 5.5681 5.5681 7.7203 7.7203 7.9267 7.9267 8.6387 8.6387 10.1236 10.1236 10.3359 10.3359 10.5489 10.5489 10.6623 10.6623 10.7651 10.7651 11.2622 11.2622 12.8643 12.8643 k =-0.5000 0.1237 0.2210 ( 2710 PWs) bands (ev): -31.3612 -31.3612 -31.3410 -31.3410 -12.3965 -12.3965 -12.3182 -12.3182 -11.0745 -11.0745 -10.9769 -10.9769 -10.8035 -10.8035 -10.7633 -10.7633 -1.4108 -1.4108 -1.0008 -1.0008 3.4594 3.4594 5.5642 5.5642 7.8107 7.8107 7.9541 7.9541 8.7380 8.7380 10.1404 10.1404 10.3942 10.3942 10.4922 10.4922 10.6566 10.6566 10.7623 10.7623 11.1756 11.1756 12.9047 12.9047 k =-0.5000 0.1237 0.1989 ( 2704 PWs) bands (ev): -31.3617 -31.3617 -31.3415 -31.3415 -12.3949 -12.3949 -12.3157 -12.3157 -11.0717 -11.0717 -10.9721 -10.9721 -10.8002 -10.8002 -10.7617 -10.7617 -1.4376 -1.4376 -1.0250 -1.0250 3.4656 3.4656 5.5606 5.5606 7.8977 7.8977 7.9796 7.9796 8.8353 8.8353 10.1557 10.1557 10.4343 10.4343 10.4495 10.4495 10.6471 10.6471 10.7611 10.7611 11.0978 11.0978 12.9471 12.9471 k =-0.5000 0.1237 0.1768 ( 2706 PWs) bands (ev): -31.3622 -31.3622 -31.3419 -31.3419 -12.3934 -12.3934 -12.3134 -12.3134 -11.0694 -11.0694 -10.9679 -10.9679 -10.7970 -10.7970 -10.7601 -10.7601 -1.4619 -1.4619 -1.0470 -1.0470 3.4712 3.4712 5.5574 5.5574 7.9795 7.9795 8.0037 8.0037 8.9302 8.9302 10.1693 10.1693 10.3756 10.3756 10.5011 10.5011 10.6325 10.6325 10.7611 10.7611 11.0306 11.0306 12.9906 12.9906 k =-0.5000 0.1237 0.1547 ( 2708 PWs) bands (ev): -31.3626 -31.3626 -31.3424 -31.3424 -12.3922 -12.3922 -12.3113 -12.3113 -11.0673 -11.0673 -10.9641 -10.9641 -10.7940 -10.7940 -10.7586 -10.7586 -1.4836 -1.4836 -1.0666 -1.0666 3.4761 3.4761 5.5544 5.5544 8.0215 8.0215 8.0599 8.0599 9.0218 9.0218 10.1811 10.1811 10.3166 10.3166 10.5486 10.5486 10.6115 10.6115 10.7621 10.7621 10.9760 10.9760 13.0341 13.0341 k =-0.5000 0.1237 0.1326 ( 2714 PWs) bands (ev): -31.3630 -31.3630 -31.3428 -31.3428 -12.3911 -12.3911 -12.3096 -12.3096 -11.0656 -11.0656 -10.9610 -10.9610 -10.7913 -10.7913 -10.7571 -10.7571 -1.5026 -1.5026 -1.0837 -1.0837 3.4805 3.4805 5.5519 5.5519 8.0400 8.0400 8.1308 8.1308 9.1095 9.1095 10.1909 10.1909 10.2580 10.2580 10.5843 10.5843 10.5912 10.5912 10.7637 10.7637 10.9347 10.9347 13.0763 13.0763 k =-0.5000 0.1237 0.1105 ( 2706 PWs) bands (ev): -31.3633 -31.3633 -31.3431 -31.3431 -12.3901 -12.3901 -12.3080 -12.3080 -11.0641 -11.0641 -10.9583 -10.9583 -10.7889 -10.7889 -10.7558 -10.7558 -1.5188 -1.5188 -1.0983 -1.0983 3.4842 3.4842 5.5497 5.5497 8.0554 8.0554 8.1947 8.1947 9.1922 9.1922 10.1965 10.1965 10.2028 10.2028 10.5531 10.5531 10.6283 10.6283 10.7658 10.7658 10.9057 10.9057 13.1162 13.1162 k =-0.5000 0.1237 0.0884 ( 2716 PWs) bands (ev): -31.3636 -31.3636 -31.3433 -31.3433 -12.3894 -12.3894 -12.3068 -12.3068 -11.0630 -11.0630 -10.9561 -10.9561 -10.7868 -10.7868 -10.7546 -10.7546 -1.5322 -1.5322 -1.1104 -1.1104 3.4873 3.4873 5.5478 5.5478 8.0681 8.0681 8.2497 8.2497 9.2681 9.2681 10.1450 10.1450 10.2054 10.2054 10.5210 10.5210 10.6595 10.6595 10.7679 10.7679 10.8865 10.8865 13.1522 13.1522 k =-0.5000 0.1237 0.0663 ( 2708 PWs) bands (ev): -31.3638 -31.3638 -31.3435 -31.3435 -12.3888 -12.3888 -12.3059 -12.3059 -11.0621 -11.0621 -10.9544 -10.9544 -10.7852 -10.7852 -10.7537 -10.7537 -1.5426 -1.5426 -1.1198 -1.1198 3.4897 3.4897 5.5464 5.5464 8.0780 8.0780 8.2944 8.2944 9.3350 9.3350 10.0947 10.0947 10.2096 10.2096 10.4920 10.4920 10.6842 10.6842 10.7699 10.7699 10.8746 10.8746 13.1827 13.1827 k =-0.5000 0.1237 0.0442 ( 2714 PWs) bands (ev): -31.3640 -31.3640 -31.3437 -31.3437 -12.3884 -12.3884 -12.3052 -12.3052 -11.0614 -11.0614 -10.9532 -10.9532 -10.7841 -10.7841 -10.7530 -10.7530 -1.5501 -1.5501 -1.1266 -1.1266 3.4914 3.4914 5.5454 5.5454 8.0850 8.0850 8.3276 8.3276 9.3890 9.3890 10.0526 10.0526 10.2122 10.2122 10.4692 10.4692 10.7022 10.7022 10.7714 10.7714 10.8675 10.8675 13.2061 13.2061 k =-0.5000 0.1237 0.0221 ( 2718 PWs) bands (ev): -31.3641 -31.3641 -31.3438 -31.3438 -12.3881 -12.3881 -12.3048 -12.3048 -11.0611 -11.0611 -10.9525 -10.9525 -10.7833 -10.7833 -10.7526 -10.7526 -1.5546 -1.5546 -1.1307 -1.1307 3.4924 3.4924 5.5448 5.5448 8.0893 8.0893 8.3480 8.3480 9.4251 9.4251 10.0238 10.0238 10.2136 10.2136 10.4548 10.4548 10.7130 10.7130 10.7724 10.7724 10.8639 10.8639 13.2210 13.2210 k =-0.5000 0.1237-0.0000 ( 2718 PWs) bands (ev): -31.3641 -31.3641 -31.3438 -31.3438 -12.3880 -12.3880 -12.3046 -12.3046 -11.0609 -11.0609 -10.9523 -10.9523 -10.7831 -10.7831 -10.7524 -10.7524 -1.5561 -1.5561 -1.1320 -1.1320 3.4928 3.4928 5.5446 5.5446 8.0907 8.0907 8.3549 8.3549 9.4380 9.4380 10.0134 10.0134 10.2139 10.2139 10.4499 10.4499 10.7167 10.7167 10.7728 10.7728 10.8628 10.8628 13.2261 13.2261 k = 0.0000 0.0000 0.9723 ( 2694 PWs) bands (ev): -31.3470 -31.3470 -31.3132 -31.3132 -12.5074 -12.5074 -12.4298 -12.4298 -11.2691 -11.2691 -11.1407 -11.1407 -10.8447 -10.8447 -10.7355 -10.7355 -0.4355 -0.4355 0.4960 0.4960 2.4072 2.4072 5.0600 5.0600 6.7497 6.7497 7.1345 7.1345 7.7108 7.7108 8.4438 8.4438 8.5661 8.5661 9.2268 9.2268 11.8856 11.8856 12.1389 12.1389 13.5656 13.5656 13.6087 13.6087 k =-0.0217 0.0054 0.9723 ( 2706 PWs) bands (ev): -31.3469 -31.3469 -31.3133 -31.3133 -12.5073 -12.5073 -12.4299 -12.4299 -11.2690 -11.2690 -11.1408 -11.1408 -10.8446 -10.8446 -10.7357 -10.7357 -0.4350 -0.4350 0.4940 0.4940 2.4106 2.4106 5.0612 5.0612 6.7477 6.7477 7.1339 7.1339 7.6831 7.6831 8.4720 8.4720 8.5675 8.5675 9.2289 9.2289 11.8793 11.8793 12.1368 12.1368 13.5735 13.5735 13.6070 13.6070 k =-0.0435 0.0108 0.9723 ( 2702 PWs) bands (ev): -31.3469 -31.3469 -31.3133 -31.3133 -12.5070 -12.5070 -12.4300 -12.4300 -11.2686 -11.2686 -11.1411 -11.1411 -10.8446 -10.8446 -10.7360 -10.7360 -0.4333 -0.4333 0.4881 0.4881 2.4207 2.4207 5.0649 5.0649 6.7418 6.7418 7.1321 7.1321 7.6102 7.6102 8.5465 8.5465 8.5721 8.5721 9.2349 9.2349 11.8606 11.8606 12.1304 12.1304 13.5968 13.5968 13.6021 13.6021 k =-0.0652 0.0161 0.9723 ( 2698 PWs) bands (ev): -31.3467 -31.3467 -31.3135 -31.3135 -12.5065 -12.5065 -12.4302 -12.4302 -11.2679 -11.2679 -11.1417 -11.1417 -10.8445 -10.8445 -10.7366 -10.7366 -0.4304 -0.4304 0.4783 0.4783 2.4373 2.4373 5.0709 5.0709 6.7320 6.7320 7.1292 7.1292 7.5100 7.5100 8.5791 8.5791 8.6496 8.6496 9.2449 9.2449 11.8309 11.8309 12.1199 12.1199 13.5940 13.5940 13.6342 13.6342 k =-0.0870 0.0215 0.9723 ( 2698 PWs) bands (ev): -31.3465 -31.3465 -31.3136 -31.3136 -12.5058 -12.5058 -12.4306 -12.4306 -11.2670 -11.2670 -11.1425 -11.1425 -10.8444 -10.8444 -10.7373 -10.7373 -0.4265 -0.4265 0.4650 0.4650 2.4601 2.4601 5.0794 5.0794 6.7185 6.7185 7.1253 7.1253 7.3955 7.3955 8.5890 8.5890 8.7679 8.7679 9.2586 9.2586 11.7917 11.7917 12.1055 12.1055 13.5828 13.5828 13.6842 13.6842 k =-0.1087 0.0269 0.9723 ( 2698 PWs) bands (ev): -31.3463 -31.3463 -31.3139 -31.3139 -12.5049 -12.5049 -12.4310 -12.4310 -11.2659 -11.2659 -11.1435 -11.1435 -10.8443 -10.8443 -10.7383 -10.7383 -0.4214 -0.4214 0.4485 0.4485 2.4887 2.4887 5.0901 5.0901 6.7015 6.7015 7.1204 7.1204 7.2738 7.2738 8.6015 8.6015 8.8944 8.8944 9.2758 9.2758 11.7449 11.7449 12.0874 12.0874 13.5687 13.5687 13.7445 13.7445 k =-0.1304 0.0323 0.9723 ( 2694 PWs) bands (ev): -31.3460 -31.3460 -31.3141 -31.3141 -12.5039 -12.5039 -12.4315 -12.4315 -11.2645 -11.2645 -11.1447 -11.1447 -10.8441 -10.8441 -10.7395 -10.7395 -0.4152 -0.4152 0.4291 0.4291 2.5226 2.5226 5.1030 5.1030 6.6813 6.6813 7.1146 7.1146 7.1488 7.1488 8.6163 8.6163 9.0249 9.0249 9.2962 9.2962 11.6923 11.6923 12.0660 12.0660 13.5518 13.5518 13.8132 13.8132 k =-0.1522 0.0377 0.9723 ( 2702 PWs) bands (ev): -31.3457 -31.3457 -31.3145 -31.3145 -12.5027 -12.5027 -12.4321 -12.4321 -11.2629 -11.2629 -11.1461 -11.1461 -10.8439 -10.8439 -10.7408 -10.7408 -0.4080 -0.4080 0.4072 0.4072 2.5612 2.5612 5.1180 5.1180 6.6582 6.6582 7.0230 7.0230 7.1082 7.1082 8.6330 8.6330 9.1572 9.1572 9.3195 9.3195 11.6357 11.6357 12.0418 12.0418 13.5323 13.5323 13.8873 13.8873 k =-0.1739 0.0430 0.9723 ( 2702 PWs) bands (ev): -31.3454 -31.3454 -31.3148 -31.3148 -12.5014 -12.5014 -12.4328 -12.4328 -11.2611 -11.2611 -11.1478 -11.1478 -10.8437 -10.8437 -10.7423 -10.7423 -0.3997 -0.3997 0.3833 0.3833 2.6041 2.6041 5.1349 5.1349 6.6324 6.6324 6.8978 6.8978 7.1013 7.1013 8.6516 8.6516 9.2894 9.2894 9.3453 9.3453 11.5764 11.5764 12.0151 12.0151 13.5104 13.5104 13.9228 13.9228 k =-0.1957 0.0484 0.9723 ( 2706 PWs) bands (ev): -31.3450 -31.3450 -31.3152 -31.3152 -12.4999 -12.4999 -12.4336 -12.4336 -11.2590 -11.2590 -11.1496 -11.1496 -10.8434 -10.8434 -10.7438 -10.7438 -0.3904 -0.3904 0.3577 0.3577 2.6504 2.6504 5.1537 5.1537 6.6045 6.6045 6.7743 6.7743 7.0939 7.0939 8.6715 8.6715 9.3727 9.3727 9.4209 9.4209 11.5159 11.5159 11.9865 11.9865 13.4865 13.4865 13.8995 13.8995 k =-0.2174 0.0538 0.9723 ( 2708 PWs) bands (ev): -31.3446 -31.3446 -31.3156 -31.3156 -12.4983 -12.4983 -12.4345 -12.4345 -11.2568 -11.2568 -11.1516 -11.1516 -10.8432 -10.8432 -10.7455 -10.7455 -0.3801 -0.3801 0.3308 0.3308 2.6997 2.6997 5.1740 5.1740 6.5747 6.5747 6.6534 6.6534 7.0864 7.0864 8.6925 8.6925 9.4022 9.4022 9.5497 9.5497 11.4552 11.4552 11.9564 11.9564 13.4607 13.4607 13.8742 13.8742 k =-0.2391 0.0592 0.9723 ( 2710 PWs) bands (ev): -31.3442 -31.3442 -31.3161 -31.3161 -12.4966 -12.4966 -12.4355 -12.4355 -11.2544 -11.2544 -11.1538 -11.1538 -10.8429 -10.8429 -10.7472 -10.7472 -0.3688 -0.3688 0.3030 0.3030 2.7511 2.7511 5.1957 5.1957 6.5354 6.5354 6.5439 6.5439 7.0787 7.0787 8.7142 8.7142 9.4327 9.4327 9.6755 9.6755 11.3952 11.3952 11.9255 11.9255 13.4334 13.4334 13.8490 13.8490 k =-0.2609 0.0645 0.9723 ( 2710 PWs) bands (ev): -31.3437 -31.3437 -31.3165 -31.3165 -12.4948 -12.4948 -12.4365 -12.4365 -11.2518 -11.2518 -11.1561 -11.1561 -10.8426 -10.8426 -10.7490 -10.7490 -0.3567 -0.3567 0.2747 0.2747 2.8039 2.8039 5.2186 5.2186 6.4223 6.4223 6.5114 6.5114 7.0711 7.0711 8.7361 8.7361 9.4638 9.4638 9.7972 9.7972 11.3366 11.3366 11.8942 11.8942 13.4049 13.4049 13.8246 13.8246 k =-0.2826 0.0699 0.9723 ( 2714 PWs) bands (ev): -31.3432 -31.3432 -31.3170 -31.3170 -12.4930 -12.4930 -12.4375 -12.4375 -11.2491 -11.2491 -11.1586 -11.1586 -10.8423 -10.8423 -10.7507 -10.7507 -0.3438 -0.3438 0.2462 0.2462 2.8574 2.8574 5.2422 5.2422 6.3138 6.3138 6.4787 6.4787 7.0638 7.0638 8.7580 8.7580 9.4952 9.4952 9.9139 9.9139 11.2803 11.2803 11.8632 11.8632 13.3756 13.3756 13.8014 13.8014 k =-0.3043 0.0753 0.9723 ( 2714 PWs) bands (ev): -31.3427 -31.3427 -31.3175 -31.3175 -12.4911 -12.4911 -12.4387 -12.4387 -11.2463 -11.2463 -11.1611 -11.1611 -10.8420 -10.8420 -10.7524 -10.7524 -0.3302 -0.3302 0.2179 0.2179 2.9106 2.9106 5.2663 5.2663 6.2110 6.2110 6.4461 6.4461 7.0567 7.0567 8.7794 8.7794 9.5261 9.5261 10.0245 10.0245 11.2268 11.2268 11.8329 11.8329 13.3461 13.3461 13.7797 13.7797 k =-0.3261 0.0807 0.9723 ( 2722 PWs) bands (ev): -31.3423 -31.3423 -31.3180 -31.3180 -12.4893 -12.4893 -12.4398 -12.4398 -11.2435 -11.2435 -11.1638 -11.1638 -10.8417 -10.8417 -10.7540 -10.7540 -0.3161 -0.3161 0.1901 0.1901 2.9626 2.9626 5.2904 5.2904 6.1147 6.1147 6.4140 6.4140 7.0501 7.0501 8.7999 8.7999 9.5561 9.5561 10.1282 10.1282 11.1768 11.1768 11.8041 11.8041 13.3167 13.3167 13.7597 13.7597 k =-0.3478 0.0861 0.9723 ( 2718 PWs) bands (ev): -31.3418 -31.3418 -31.3184 -31.3184 -12.4875 -12.4875 -12.4409 -12.4409 -11.2407 -11.2407 -11.1664 -11.1664 -10.8414 -10.8414 -10.7555 -10.7555 -0.3017 -0.3017 0.1633 0.1633 3.0125 3.0125 5.3139 5.3139 6.0259 6.0259 6.3832 6.3832 7.0441 7.0441 8.8192 8.8192 9.5846 9.5846 10.2237 10.2237 11.1307 11.1307 11.7771 11.7771 13.2881 13.2881 13.7416 13.7416 k =-0.3696 0.0914 0.9723 ( 2728 PWs) bands (ev): -31.3414 -31.3414 -31.3189 -31.3189 -12.4858 -12.4858 -12.4421 -12.4421 -11.2379 -11.2379 -11.1690 -11.1690 -10.8412 -10.8412 -10.7569 -10.7569 -0.2873 -0.2873 0.1377 0.1377 3.0591 3.0591 5.3365 5.3365 5.9457 5.9457 6.3541 6.3541 7.0386 7.0386 8.8368 8.8368 9.6110 9.6110 10.3099 10.3099 11.0893 11.0893 11.7526 11.7526 13.2611 13.2611 13.7257 13.7257 k =-0.3913 0.0968 0.9723 ( 2736 PWs) bands (ev): -31.3410 -31.3410 -31.3193 -31.3193 -12.4842 -12.4842 -12.4432 -12.4432 -11.2353 -11.2353 -11.1714 -11.1714 -10.8409 -10.8409 -10.7582 -10.7582 -0.2732 -0.2732 0.1141 0.1141 3.1013 3.1013 5.3573 5.3573 5.8752 5.8752 6.3276 6.3276 7.0339 7.0339 8.8524 8.8524 9.6348 9.6348 10.3855 10.3855 11.0530 11.0530 11.7309 11.7309 13.2362 13.2362 13.7119 13.7119 k =-0.4130 0.1022 0.9723 ( 2740 PWs) bands (ev): -31.3407 -31.3407 -31.3196 -31.3196 -12.4827 -12.4827 -12.4441 -12.4441 -11.2329 -11.2329 -11.1737 -11.1737 -10.8407 -10.8407 -10.7592 -10.7592 -0.2599 -0.2599 0.0929 0.0929 3.1379 3.1379 5.3758 5.3758 5.8154 5.8154 6.3044 6.3044 7.0300 7.0300 8.8656 8.8656 9.6552 9.6552 10.4495 10.4495 11.0223 11.0223 11.7126 11.7126 13.2144 13.2144 13.7005 13.7005 k =-0.4348 0.1076 0.9723 ( 2744 PWs) bands (ev): -31.3404 -31.3404 -31.3199 -31.3199 -12.4816 -12.4816 -12.4450 -12.4450 -11.2308 -11.2308 -11.1757 -11.1757 -10.8406 -10.8406 -10.7601 -10.7601 -0.2482 -0.2482 0.0749 0.0749 3.1679 3.1679 5.3911 5.3911 5.7675 5.7675 6.2854 6.2854 7.0268 7.0268 8.8762 8.8762 9.6719 9.6719 10.5007 10.5007 10.9978 10.9978 11.6979 11.6979 13.1965 13.1965 13.6916 13.6916 k =-0.4565 0.1130 0.9723 ( 2752 PWs) bands (ev): -31.3402 -31.3402 -31.3202 -31.3202 -12.4807 -12.4807 -12.4456 -12.4456 -11.2292 -11.2292 -11.1772 -11.1772 -10.8404 -10.8404 -10.7607 -10.7607 -0.2389 -0.2389 0.0610 0.0610 3.1902 3.1902 5.4027 5.4027 5.7324 5.7324 6.2711 6.2711 7.0246 7.0246 8.8840 8.8840 9.6842 9.6842 10.5380 10.5380 10.9800 10.9800 11.6872 11.6872 13.1830 13.1830 13.6852 13.6852 k =-0.4783 0.1183 0.9723 ( 2754 PWs) bands (ev): -31.3401 -31.3401 -31.3203 -31.3203 -12.4801 -12.4801 -12.4460 -12.4460 -11.2282 -11.2282 -11.1782 -11.1782 -10.8404 -10.8404 -10.7610 -10.7610 -0.2328 -0.2328 0.0522 0.0522 3.2039 3.2039 5.4099 5.4099 5.7110 5.7110 6.2623 6.2623 7.0232 7.0232 8.8887 8.8887 9.6917 9.6917 10.5608 10.5608 10.9691 10.9691 11.6807 11.6807 13.1747 13.1747 13.6813 13.6813 k =-0.5000 0.1237 0.9723 ( 2752 PWs) bands (ev): -31.3400 -31.3400 -31.3203 -31.3203 -12.4799 -12.4799 -12.4462 -12.4462 -11.2278 -11.2278 -11.1785 -11.1785 -10.8403 -10.8403 -10.7612 -10.7612 -0.2307 -0.2307 0.0492 0.0492 3.2086 3.2086 5.4123 5.4123 5.7038 5.7038 6.2593 6.2593 7.0227 7.0227 8.8903 8.8903 9.6943 9.6943 10.5684 10.5684 10.9655 10.9655 11.6785 11.6785 13.1719 13.1719 13.6800 13.6800 Writing output data file YBC.save init_run : 0.27s CPU 0.55s WALL ( 1 calls) electrons : 156.66s CPU 160.43s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.06s WALL ( 1 calls) potinit : 0.02s CPU 0.05s WALL ( 1 calls) Called by electrons: c_bands : 156.65s CPU 160.42s WALL ( 1 calls) v_of_rho : 0.01s CPU 0.01s WALL ( 1 calls) v_h : 0.00s CPU 0.00s WALL ( 1 calls) v_xc : 0.01s CPU 0.01s WALL ( 1 calls) newd : 0.04s CPU 0.06s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.05s CPU 0.07s WALL ( 446 calls) cegterg : 137.16s CPU 139.23s WALL ( 652 calls) Called by sum_band: Called by *egterg: h_psi : 88.27s CPU 90.41s WALL ( 10592 calls) s_psi : 3.82s CPU 3.78s WALL ( 10592 calls) g_psi : 0.15s CPU 0.16s WALL ( 9494 calls) cdiaghg : 51.09s CPU 51.15s WALL ( 9940 calls) cegterg:over : 3.68s CPU 3.95s WALL ( 9494 calls) cegterg:upda : 3.04s CPU 3.00s WALL ( 9494 calls) cegterg:last : 1.71s CPU 1.84s WALL ( 1544 calls) cdiaghg:chol : 2.86s CPU 2.74s WALL ( 9940 calls) cdiaghg:inve : 1.58s CPU 1.59s WALL ( 9940 calls) cdiaghg:para : 2.96s CPU 2.86s WALL ( 19880 calls) Called by h_psi: h_psi:vloc : 78.96s CPU 80.91s WALL ( 10592 calls) h_psi:vnl : 9.21s CPU 9.34s WALL ( 10592 calls) add_vuspsi : 4.56s CPU 4.54s WALL ( 10592 calls) General routines calbec : 4.64s CPU 4.77s WALL ( 10592 calls) fft : 0.00s CPU 0.01s WALL ( 19 calls) ffts : 0.00s CPU 0.00s WALL ( 4 calls) fftw : 71.02s CPU 72.68s WALL ( 883116 calls) interpolate : 0.00s CPU 0.00s WALL ( 4 calls) davcio : 0.17s CPU 0.17s WALL ( 892 calls) Parallel routines fft_scatter : 21.15s CPU 21.96s WALL ( 883139 calls) PWSCF : 2m52.18s CPU 3m25.33s WALL This run was terminated on: 16:57: 9 5Jan2017 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=