Program PWSCF v.5.1.1 starts on 23Jul2015 at 12:38:13 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 48 processors R & G space division: proc/nbgrp/npool/nimage = 48 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: ./ZrSi2.save/ file Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF: wavefunction(s) 4S renormalized Subspace diagonalization in iterative solution of the eigenvalue problem: a serial algorithm will be used Parallelization info -------------------- sticks: dense smooth PW G-vecs: dense smooth PW Min 43 30 9 1047 592 97 Max 44 31 10 1052 602 101 Sum 2103 1443 433 50371 28611 4749 bravais-lattice index = 14 lattice parameter (alat) = 14.3823 a.u. unit-cell volume = 679.9264 (a.u.)^3 number of atoms/cell = 6 number of atomic types = 2 number of electrons = 40.00 number of Kohn-Sham states= 48 kinetic-energy cutoff = 46.0000 Ry charge density cutoff = 268.0000 Ry Exchange-correlation = PBE ( 1 4 3 4 0 0) Non magnetic calculation with spin-orbit celldm(1)= 14.382292 celldm(2)= 1.000000 celldm(3)= 0.482211 celldm(4)= 0.000000 celldm(5)= 0.000000 celldm(6)= -0.880547 crystal axes: (cart. coord. in units of alat) a(1) = ( 1.000000 0.000000 0.000000 ) a(2) = ( -0.880547 0.473959 0.000000 ) a(3) = ( 0.000000 0.000000 0.482211 ) reciprocal axes: (cart. coord. in units 2 pi/alat) b(1) = ( 1.000000 1.857855 -0.000000 ) b(2) = ( 0.000000 2.109887 -0.000000 ) b(3) = ( 0.000000 0.000000 2.073783 ) PseudoPot. # 1 for Zr read from file: /home/autes/Pseudo/Zr.rel-pbe-spn-rrkjus_psl.1.0.0.UPF MD5 check sum: 8b6e13b1b49db219b5566974d4b37ab4 Pseudo is Ultrasoft + core correction, Zval = 12.0 Generated using "atomic" code by A. Dal Corso v.5.0.2 svn rev. 9656 Using radial grid of 1225 points, 10 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 l(7) = 2 l(8) = 2 l(9) = 2 l(10) = 2 Q(r) pseudized with 0 coefficients PseudoPot. # 2 for Si read from file: /home/autes/Pseudo/Si.rel-pbe-nl-rrkjus_psl.1.0.0.UPF MD5 check sum: fdd4f0c14d34ff7e95251eb8672b2767 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 1141 points, 6 beta functions with: l(1) = 0 l(2) = 0 l(3) = 1 l(4) = 1 l(5) = 1 l(6) = 1 Q(r) pseudized with 0 coefficients atomic species valence mass pseudopotential Zr 12.00 91.22400 Zr( 1.00) Si 4.00 28.08550 Si( 1.00) 4 Sym. Ops., with inversion, found ( 2 have fractional translation) s frac. trans. isym = 1 identity cryst. s( 1) = ( 1 0 0 ) ( 0 1 0 ) ( 0 0 1 ) cart. s( 1) = ( 1.0000000 0.0000000 0.0000000 ) ( 0.0000000 1.0000000 0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) isym = 2 180 deg rotation - cart. axis [0,0,1] cryst. s( 2) = ( -1 0 0 ) f =( 0.0000000 ) ( 0 -1 0 ) ( 0.0000000 ) ( 0 0 1 ) ( -0.5000000 ) cart. s( 2) = ( -1.0000000 0.0000000 0.0000000 ) f =( -0.0000000 ) ( 0.0000000 -1.0000000 0.0000000 ) ( -0.0000000 ) ( 0.0000000 0.0000000 1.0000000 ) ( -0.2411053 ) isym = 3 inversion cryst. s( 3) = ( -1 0 0 ) ( 0 -1 0 ) ( 0 0 -1 ) cart. s( 3) = ( -1.0000000 0.0000000 -0.0000000 ) ( 0.0000000 -1.0000000 -0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) isym = 4 inv. 180 deg rotation - cart. axis [0,0,1] cryst. s( 4) = ( 1 0 0 ) f =( 0.0000000 ) ( 0 1 0 ) ( 0.0000000 ) ( 0 0 -1 ) ( 0.5000000 ) cart. s( 4) = ( 1.0000000 0.0000000 -0.0000000 ) f =( 0.0000000 ) ( 0.0000000 1.0000000 -0.0000000 ) ( 0.0000000 ) ( 0.0000000 0.0000000 -1.0000000 ) ( 0.2411053 ) double point group C_2h (2/m) there are 8 classes and 4 irreducible representations the character table: E -E C2 -C2 s_h -s_h i -i G_3+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_4+ 1.00 -1.00 0.00 0.00 0.00 0.00 1.00 -1.00 G_3- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 G_4- 1.00 -1.00 0.00 0.00 0.00 0.00 -1.00 1.00 imaginary part E -E C2 -C2 s_h -s_h i -i G_3+ 0.00 0.00 1.00 -1.00 1.00 -1.00 0.00 0.00 G_4+ 0.00 0.00 -1.00 1.00 -1.00 1.00 0.00 0.00 G_3- 0.00 0.00 1.00 -1.00 -1.00 1.00 0.00 0.00 G_4- 0.00 0.00 -1.00 1.00 1.00 -1.00 0.00 0.00 the symmetry operations in each class: E 1 C2 2 i 3 s_h 4 -E -1 -C2 -2 -i -3 -s_h -4 Cartesian axes number of k points= 420 Fermi-Dirac smearing, width (Ry)= 0.0010 cart. coord. in units 2pi/alat k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0059084 0.0234432 -0.0000000), wk = 0.0023810 k( 3) = ( 0.0118169 0.0468864 -0.0000000), wk = 0.0023810 k( 4) = ( 0.0177253 0.0703296 -0.0000000), wk = 0.0023810 k( 5) = ( 0.0236338 0.0937728 -0.0000000), wk = 0.0023810 k( 6) = ( 0.0295422 0.1172159 -0.0000000), wk = 0.0023810 k( 7) = ( 0.0354507 0.1406591 -0.0000000), wk = 0.0023810 k( 8) = ( 0.0413591 0.1641024 -0.0000000), wk = 0.0023810 k( 9) = ( 0.0472676 0.1875455 -0.0000000), wk = 0.0023810 k( 10) = ( 0.0531760 0.2109887 -0.0000000), wk = 0.0023810 k( 11) = ( 0.0590845 0.2344319 -0.0000000), wk = 0.0023810 k( 12) = ( 0.0649929 0.2578751 -0.0000000), wk = 0.0023810 k( 13) = ( 0.0709014 0.2813183 -0.0000000), wk = 0.0023810 k( 14) = ( 0.0768098 0.3047615 -0.0000000), wk = 0.0023810 k( 15) = ( 0.0827182 0.3282047 -0.0000000), wk = 0.0023810 k( 16) = ( 0.0886267 0.3516479 -0.0000000), wk = 0.0023810 k( 17) = ( 0.0945351 0.3750911 -0.0000000), wk = 0.0023810 k( 18) = ( 0.1004436 0.3985342 -0.0000000), wk = 0.0023810 k( 19) = ( 0.1063520 0.4219774 -0.0000000), wk = 0.0023810 k( 20) = ( 0.1122605 0.4454207 -0.0000000), wk = 0.0023810 k( 21) = ( 0.1181689 0.4688638 -0.0000000), wk = 0.0023810 k( 22) = ( 0.1240774 0.4923070 -0.0000000), wk = 0.0023810 k( 23) = ( 0.1299858 0.5157502 -0.0000000), wk = 0.0023810 k( 24) = ( 0.1358943 0.5391934 -0.0000000), wk = 0.0023810 k( 25) = ( 0.1418027 0.5626366 -0.0000000), wk = 0.0023810 k( 26) = ( 0.1477112 0.5860798 -0.0000000), wk = 0.0023810 k( 27) = ( 0.1536196 0.6095230 -0.0000000), wk = 0.0023810 k( 28) = ( 0.1595281 0.6329662 -0.0000000), wk = 0.0023810 k( 29) = ( 0.1654365 0.6564094 -0.0000000), wk = 0.0023810 k( 30) = ( 0.1713449 0.6798525 -0.0000000), wk = 0.0023810 k( 31) = ( 0.1772534 0.7032957 -0.0000000), wk = 0.0023810 k( 32) = ( 0.1831618 0.7267390 -0.0000000), wk = 0.0023810 k( 33) = ( 0.1890703 0.7501821 -0.0000000), wk = 0.0023810 k( 34) = ( 0.1949787 0.7736253 -0.0000000), wk = 0.0023810 k( 35) = ( 0.2008872 0.7970685 -0.0000000), wk = 0.0023810 k( 36) = ( 0.2067956 0.8205117 -0.0000000), wk = 0.0023810 k( 37) = ( 0.2127041 0.8439549 -0.0000000), wk = 0.0023810 k( 38) = ( 0.2186125 0.8673981 -0.0000000), wk = 0.0023810 k( 39) = ( 0.2245210 0.8908413 -0.0000000), wk = 0.0023810 k( 40) = ( 0.2304294 0.9142845 -0.0000000), wk = 0.0023810 k( 41) = ( 0.2363379 0.9377276 -0.0000000), wk = 0.0023810 k( 42) = ( 0.2422463 0.9611708 -0.0000000), wk = 0.0023810 k( 43) = ( 0.2481548 0.9846140 -0.0000000), wk = 0.0023810 k( 44) = ( 0.2540632 1.0080572 -0.0000000), wk = 0.0023810 k( 45) = ( 0.2599716 1.0315004 -0.0000000), wk = 0.0023810 k( 46) = ( 0.2658801 1.0549436 -0.0000000), wk = 0.0023810 k( 47) = ( 0.2658801 1.0549436 -0.0000000), wk = 0.0023810 k( 48) = ( 0.2417092 1.0549436 -0.0000000), wk = 0.0023810 k( 49) = ( 0.2175383 1.0549436 -0.0000000), wk = 0.0023810 k( 50) = ( 0.1933673 1.0549436 -0.0000000), wk = 0.0023810 k( 51) = ( 0.1691964 1.0549436 -0.0000000), wk = 0.0023810 k( 52) = ( 0.1450255 1.0549436 -0.0000000), wk = 0.0023810 k( 53) = ( 0.1208546 1.0549436 -0.0000000), wk = 0.0023810 k( 54) = ( 0.0966837 1.0549436 -0.0000000), wk = 0.0023810 k( 55) = ( 0.0725128 1.0549436 -0.0000000), wk = 0.0023810 k( 56) = ( 0.0483418 1.0549436 -0.0000000), wk = 0.0023810 k( 57) = ( 0.0241709 1.0549436 -0.0000000), wk = 0.0023810 k( 58) = ( 0.0000000 1.0549436 -0.0000000), wk = 0.0023810 k( 59) = ( 0.0000000 1.0549436 -0.0000000), wk = 0.0023810 k( 60) = ( 0.0000000 1.0549436 0.0241138), wk = 0.0023810 k( 61) = ( 0.0000000 1.0549436 0.0482275), wk = 0.0023810 k( 62) = ( 0.0000000 1.0549436 0.0723412), wk = 0.0023810 k( 63) = ( 0.0000000 1.0549436 0.0964550), wk = 0.0023810 k( 64) = ( 0.0000000 1.0549436 0.1205687), wk = 0.0023810 k( 65) = ( 0.0000000 1.0549436 0.1446825), wk = 0.0023810 k( 66) = ( 0.0000000 1.0549436 0.1687963), wk = 0.0023810 k( 67) = ( 0.0000000 1.0549436 0.1929100), wk = 0.0023810 k( 68) = ( 0.0000000 1.0549436 0.2170237), wk = 0.0023810 k( 69) = ( 0.0000000 1.0549436 0.2411375), wk = 0.0023810 k( 70) = ( 0.0000000 1.0549436 0.2652513), wk = 0.0023810 k( 71) = ( 0.0000000 1.0549436 0.2893650), wk = 0.0023810 k( 72) = ( 0.0000000 1.0549436 0.3134788), wk = 0.0023810 k( 73) = ( 0.0000000 1.0549436 0.3375925), wk = 0.0023810 k( 74) = ( 0.0000000 1.0549436 0.3617062), wk = 0.0023810 k( 75) = ( 0.0000000 1.0549436 0.3858200), wk = 0.0023810 k( 76) = ( 0.0000000 1.0549436 0.4099338), wk = 0.0023810 k( 77) = ( 0.0000000 1.0549436 0.4340475), wk = 0.0023810 k( 78) = ( 0.0000000 1.0549436 0.4581612), wk = 0.0023810 k( 79) = ( 0.0000000 1.0549436 0.4822750), wk = 0.0023810 k( 80) = ( 0.0000000 1.0549436 0.5063888), wk = 0.0023810 k( 81) = ( 0.0000000 1.0549436 0.5305025), wk = 0.0023810 k( 82) = ( 0.0000000 1.0549436 0.5546163), wk = 0.0023810 k( 83) = ( 0.0000000 1.0549436 0.5787300), wk = 0.0023810 k( 84) = ( 0.0000000 1.0549436 0.6028437), wk = 0.0023810 k( 85) = ( 0.0000000 1.0549436 0.6269575), wk = 0.0023810 k( 86) = ( 0.0000000 1.0549436 0.6510713), wk = 0.0023810 k( 87) = ( 0.0000000 1.0549436 0.6751850), wk = 0.0023810 k( 88) = ( 0.0000000 1.0549436 0.6992987), wk = 0.0023810 k( 89) = ( 0.0000000 1.0549436 0.7234125), wk = 0.0023810 k( 90) = ( 0.0000000 1.0549436 0.7475263), wk = 0.0023810 k( 91) = ( 0.0000000 1.0549436 0.7716400), wk = 0.0023810 k( 92) = ( 0.0000000 1.0549436 0.7957538), wk = 0.0023810 k( 93) = ( 0.0000000 1.0549436 0.8198675), wk = 0.0023810 k( 94) = ( 0.0000000 1.0549436 0.8439812), wk = 0.0023810 k( 95) = ( 0.0000000 1.0549436 0.8680950), wk = 0.0023810 k( 96) = ( 0.0000000 1.0549436 0.8922088), wk = 0.0023810 k( 97) = ( 0.0000000 1.0549436 0.9163225), wk = 0.0023810 k( 98) = ( 0.0000000 1.0549436 0.9404363), wk = 0.0023810 k( 99) = ( 0.0000000 1.0549436 0.9645500), wk = 0.0023810 k( 100) = ( 0.0000000 1.0549436 0.9886638), wk = 0.0023810 k( 101) = ( 0.0000000 1.0549436 1.0127775), wk = 0.0023810 k( 102) = ( 0.0000000 1.0549436 1.0368913), wk = 0.0023810 k( 103) = ( 0.0000000 1.0549436 1.0368913), wk = 0.0023810 k( 104) = ( 0.0241709 1.0549436 1.0368913), wk = 0.0023810 k( 105) = ( 0.0483418 1.0549436 1.0368913), wk = 0.0023810 k( 106) = ( 0.0725128 1.0549436 1.0368913), wk = 0.0023810 k( 107) = ( 0.0966837 1.0549436 1.0368913), wk = 0.0023810 k( 108) = ( 0.1208546 1.0549436 1.0368913), wk = 0.0023810 k( 109) = ( 0.1450255 1.0549436 1.0368913), wk = 0.0023810 k( 110) = ( 0.1691964 1.0549436 1.0368913), wk = 0.0023810 k( 111) = ( 0.1933673 1.0549436 1.0368913), wk = 0.0023810 k( 112) = ( 0.2175383 1.0549436 1.0368913), wk = 0.0023810 k( 113) = ( 0.2417092 1.0549436 1.0368913), wk = 0.0023810 k( 114) = ( 0.2658801 1.0549436 1.0368913), wk = 0.0023810 k( 115) = ( 0.2658801 1.0549436 1.0368913), wk = 0.0023810 k( 116) = ( 0.2599716 1.0315004 1.0368913), wk = 0.0023810 k( 117) = ( 0.2540632 1.0080572 1.0368913), wk = 0.0023810 k( 118) = ( 0.2481548 0.9846140 1.0368913), wk = 0.0023810 k( 119) = ( 0.2422463 0.9611708 1.0368913), wk = 0.0023810 k( 120) = ( 0.2363379 0.9377276 1.0368913), wk = 0.0023810 k( 121) = ( 0.2304294 0.9142845 1.0368913), wk = 0.0023810 k( 122) = ( 0.2245210 0.8908413 1.0368913), wk = 0.0023810 k( 123) = ( 0.2186125 0.8673981 1.0368913), wk = 0.0023810 k( 124) = ( 0.2127041 0.8439549 1.0368913), wk = 0.0023810 k( 125) = ( 0.2067956 0.8205117 1.0368913), wk = 0.0023810 k( 126) = ( 0.2008872 0.7970685 1.0368913), wk = 0.0023810 k( 127) = ( 0.1949787 0.7736253 1.0368913), wk = 0.0023810 k( 128) = ( 0.1890703 0.7501821 1.0368913), wk = 0.0023810 k( 129) = ( 0.1831618 0.7267390 1.0368913), wk = 0.0023810 k( 130) = ( 0.1772534 0.7032957 1.0368913), wk = 0.0023810 k( 131) = ( 0.1713449 0.6798525 1.0368913), wk = 0.0023810 k( 132) = ( 0.1654365 0.6564094 1.0368913), wk = 0.0023810 k( 133) = ( 0.1595281 0.6329662 1.0368913), wk = 0.0023810 k( 134) = ( 0.1536196 0.6095230 1.0368913), wk = 0.0023810 k( 135) = ( 0.1477112 0.5860798 1.0368913), wk = 0.0023810 k( 136) = ( 0.1418027 0.5626366 1.0368913), wk = 0.0023810 k( 137) = ( 0.1358943 0.5391934 1.0368913), wk = 0.0023810 k( 138) = ( 0.1299858 0.5157502 1.0368913), wk = 0.0023810 k( 139) = ( 0.1240774 0.4923070 1.0368913), wk = 0.0023810 k( 140) = ( 0.1181689 0.4688638 1.0368913), wk = 0.0023810 k( 141) = ( 0.1122605 0.4454207 1.0368913), wk = 0.0023810 k( 142) = ( 0.1063520 0.4219774 1.0368913), wk = 0.0023810 k( 143) = ( 0.1004436 0.3985342 1.0368913), wk = 0.0023810 k( 144) = ( 0.0945351 0.3750911 1.0368913), wk = 0.0023810 k( 145) = ( 0.0886267 0.3516479 1.0368913), wk = 0.0023810 k( 146) = ( 0.0827182 0.3282047 1.0368913), wk = 0.0023810 k( 147) = ( 0.0768098 0.3047615 1.0368913), wk = 0.0023810 k( 148) = ( 0.0709014 0.2813183 1.0368913), wk = 0.0023810 k( 149) = ( 0.0649929 0.2578751 1.0368913), wk = 0.0023810 k( 150) = ( 0.0590845 0.2344319 1.0368913), wk = 0.0023810 k( 151) = ( 0.0531760 0.2109887 1.0368913), wk = 0.0023810 k( 152) = ( 0.0472676 0.1875455 1.0368913), wk = 0.0023810 k( 153) = ( 0.0413591 0.1641024 1.0368913), wk = 0.0023810 k( 154) = ( 0.0354507 0.1406591 1.0368913), wk = 0.0023810 k( 155) = ( 0.0295422 0.1172159 1.0368913), wk = 0.0023810 k( 156) = ( 0.0236338 0.0937728 1.0368913), wk = 0.0023810 k( 157) = ( 0.0177253 0.0703296 1.0368913), wk = 0.0023810 k( 158) = ( 0.0118169 0.0468864 1.0368913), wk = 0.0023810 k( 159) = ( 0.0059084 0.0234432 1.0368913), wk = 0.0023810 k( 160) = ( 0.0000000 0.0000000 1.0368913), wk = 0.0023810 k( 161) = ( 0.0000000 0.0000000 1.0368913), wk = 0.0023810 k( 162) = ( 0.0000000 0.0000000 1.0127775), wk = 0.0023810 k( 163) = ( 0.0000000 0.0000000 0.9886638), wk = 0.0023810 k( 164) = ( 0.0000000 0.0000000 0.9645500), wk = 0.0023810 k( 165) = ( 0.0000000 0.0000000 0.9404363), wk = 0.0023810 k( 166) = ( 0.0000000 0.0000000 0.9163225), wk = 0.0023810 k( 167) = ( 0.0000000 0.0000000 0.8922088), wk = 0.0023810 k( 168) = ( 0.0000000 0.0000000 0.8680950), wk = 0.0023810 k( 169) = ( 0.0000000 0.0000000 0.8439812), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.8198675), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.7957538), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.7716400), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.7475263), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.7234125), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.6992987), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.6751850), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.6510713), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.6269575), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.6028437), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.5787300), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.5546163), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.5305025), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.5063888), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.4822750), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.4581612), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.4340475), wk = 0.0023810 k( 187) = ( 0.0000000 0.0000000 0.4099338), wk = 0.0023810 k( 188) = ( 0.0000000 0.0000000 0.3858200), wk = 0.0023810 k( 189) = ( 0.0000000 0.0000000 0.3617062), wk = 0.0023810 k( 190) = ( 0.0000000 0.0000000 0.3375925), wk = 0.0023810 k( 191) = ( 0.0000000 0.0000000 0.3134788), wk = 0.0023810 k( 192) = ( 0.0000000 0.0000000 0.2893650), wk = 0.0023810 k( 193) = ( 0.0000000 0.0000000 0.2652513), wk = 0.0023810 k( 194) = ( 0.0000000 0.0000000 0.2411375), wk = 0.0023810 k( 195) = ( 0.0000000 0.0000000 0.2170237), wk = 0.0023810 k( 196) = ( 0.0000000 0.0000000 0.1929100), wk = 0.0023810 k( 197) = ( 0.0000000 0.0000000 0.1687963), wk = 0.0023810 k( 198) = ( 0.0000000 0.0000000 0.1446825), wk = 0.0023810 k( 199) = ( 0.0000000 0.0000000 0.1205687), wk = 0.0023810 k( 200) = ( 0.0000000 0.0000000 0.0964550), wk = 0.0023810 k( 201) = ( 0.0000000 0.0000000 0.0723412), wk = 0.0023810 k( 202) = ( 0.0000000 0.0000000 0.0482275), wk = 0.0023810 k( 203) = ( 0.0000000 0.0000000 0.0241138), wk = 0.0023810 k( 204) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 205) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 206) = ( -0.0227273 0.0057280 0.0000000), wk = 0.0023810 k( 207) = ( -0.0454546 0.0114560 -0.0000000), wk = 0.0023810 k( 208) = ( -0.0681818 0.0171840 -0.0000000), wk = 0.0023810 k( 209) = ( -0.0909091 0.0229120 -0.0000000), wk = 0.0023810 k( 210) = ( -0.1136364 0.0286401 0.0000000), wk = 0.0023810 k( 211) = ( -0.1363636 0.0343681 -0.0000000), wk = 0.0023810 k( 212) = ( -0.1590909 0.0400961 -0.0000000), wk = 0.0023810 k( 213) = ( -0.1818182 0.0458241 -0.0000000), wk = 0.0023810 k( 214) = ( -0.2045454 0.0515521 -0.0000000), wk = 0.0023810 k( 215) = ( -0.2272727 0.0572801 -0.0000000), wk = 0.0023810 k( 216) = ( -0.2500000 0.0630081 -0.0000000), wk = 0.0023810 k( 217) = ( -0.2727273 0.0687361 -0.0000000), wk = 0.0023810 k( 218) = ( -0.2954545 0.0744642 -0.0000000), wk = 0.0023810 k( 219) = ( -0.3181818 0.0801922 -0.0000000), wk = 0.0023810 k( 220) = ( -0.3409091 0.0859202 -0.0000000), wk = 0.0023810 k( 221) = ( -0.3636364 0.0916482 -0.0000000), wk = 0.0023810 k( 222) = ( -0.3863636 0.0973762 0.0000000), wk = 0.0023810 k( 223) = ( -0.4090909 0.1031042 0.0000000), wk = 0.0023810 k( 224) = ( -0.4318182 0.1088322 -0.0000000), wk = 0.0023810 k( 225) = ( -0.4545455 0.1145602 -0.0000000), wk = 0.0023810 k( 226) = ( -0.4772727 0.1202882 -0.0000000), wk = 0.0023810 k( 227) = ( -0.5000000 0.1260163 -0.0000000), wk = 0.0023810 k( 228) = ( -0.5000000 0.1260163 -0.0000000), wk = 0.0023810 k( 229) = ( -0.4941470 0.1492395 -0.0000000), wk = 0.0023810 k( 230) = ( -0.4882940 0.1724626 -0.0000000), wk = 0.0023810 k( 231) = ( -0.4824410 0.1956858 -0.0000000), wk = 0.0023810 k( 232) = ( -0.4765880 0.2189090 -0.0000000), wk = 0.0023810 k( 233) = ( -0.4707350 0.2421322 -0.0000000), wk = 0.0023810 k( 234) = ( -0.4648820 0.2653554 -0.0000000), wk = 0.0023810 k( 235) = ( -0.4590290 0.2885785 -0.0000000), wk = 0.0023810 k( 236) = ( -0.4531760 0.3118017 -0.0000000), wk = 0.0023810 k( 237) = ( -0.4473230 0.3350249 -0.0000000), wk = 0.0023810 k( 238) = ( -0.4414700 0.3582481 -0.0000000), wk = 0.0023810 k( 239) = ( -0.4356170 0.3814713 -0.0000000), wk = 0.0023810 k( 240) = ( -0.4297640 0.4046945 -0.0000000), wk = 0.0023810 k( 241) = ( -0.4239110 0.4279177 -0.0000000), wk = 0.0023810 k( 242) = ( -0.4180580 0.4511409 -0.0000000), wk = 0.0023810 k( 243) = ( -0.4122050 0.4743640 -0.0000000), wk = 0.0023810 k( 244) = ( -0.4063520 0.4975872 -0.0000000), wk = 0.0023810 k( 245) = ( -0.4004990 0.5208104 -0.0000000), wk = 0.0023810 k( 246) = ( -0.3946460 0.5440336 -0.0000000), wk = 0.0023810 k( 247) = ( -0.3887930 0.5672567 -0.0000000), wk = 0.0023810 k( 248) = ( -0.3829400 0.5904799 -0.0000000), wk = 0.0023810 k( 249) = ( -0.3770870 0.6137031 -0.0000000), wk = 0.0023810 k( 250) = ( -0.3712340 0.6369263 -0.0000000), wk = 0.0023810 k( 251) = ( -0.3653811 0.6601495 -0.0000000), wk = 0.0023810 k( 252) = ( -0.3595281 0.6833727 -0.0000000), wk = 0.0023810 k( 253) = ( -0.3536751 0.7065959 -0.0000000), wk = 0.0023810 k( 254) = ( -0.3478221 0.7298191 -0.0000000), wk = 0.0023810 k( 255) = ( -0.3419691 0.7530422 -0.0000000), wk = 0.0023810 k( 256) = ( -0.3361161 0.7762654 -0.0000000), wk = 0.0023810 k( 257) = ( -0.3302631 0.7994886 -0.0000000), wk = 0.0023810 k( 258) = ( -0.3244101 0.8227118 -0.0000000), wk = 0.0023810 k( 259) = ( -0.3185571 0.8459349 -0.0000000), wk = 0.0023810 k( 260) = ( -0.3127041 0.8691581 -0.0000000), wk = 0.0023810 k( 261) = ( -0.3068511 0.8923813 -0.0000000), wk = 0.0023810 k( 262) = ( -0.3009981 0.9156045 -0.0000000), wk = 0.0023810 k( 263) = ( -0.2951451 0.9388277 -0.0000000), wk = 0.0023810 k( 264) = ( -0.2892921 0.9620509 -0.0000000), wk = 0.0023810 k( 265) = ( -0.2834391 0.9852741 -0.0000000), wk = 0.0023810 k( 266) = ( -0.2775861 1.0084973 -0.0000000), wk = 0.0023810 k( 267) = ( -0.2717331 1.0317204 -0.0000000), wk = 0.0023810 k( 268) = ( -0.2658801 1.0549436 -0.0000000), wk = 0.0023810 k( 269) = ( -0.2658801 1.0549436 -0.0000000), wk = 0.0023810 k( 270) = ( -0.2658801 1.0549436 0.0241138), wk = 0.0023810 k( 271) = ( -0.2658801 1.0549436 0.0482275), wk = 0.0023810 k( 272) = ( -0.2658801 1.0549436 0.0723412), wk = 0.0023810 k( 273) = ( -0.2658801 1.0549436 0.0964550), wk = 0.0023810 k( 274) = ( -0.2658801 1.0549436 0.1205687), wk = 0.0023810 k( 275) = ( -0.2658801 1.0549436 0.1446825), wk = 0.0023810 k( 276) = ( -0.2658801 1.0549436 0.1687963), wk = 0.0023810 k( 277) = ( -0.2658801 1.0549436 0.1929100), wk = 0.0023810 k( 278) = ( -0.2658801 1.0549436 0.2170237), wk = 0.0023810 k( 279) = ( -0.2658801 1.0549436 0.2411375), wk = 0.0023810 k( 280) = ( -0.2658801 1.0549436 0.2652513), wk = 0.0023810 k( 281) = ( -0.2658801 1.0549436 0.2893650), wk = 0.0023810 k( 282) = ( -0.2658801 1.0549436 0.3134788), wk = 0.0023810 k( 283) = ( -0.2658801 1.0549436 0.3375925), wk = 0.0023810 k( 284) = ( -0.2658801 1.0549436 0.3617062), wk = 0.0023810 k( 285) = ( -0.2658801 1.0549436 0.3858200), wk = 0.0023810 k( 286) = ( -0.2658801 1.0549436 0.4099338), wk = 0.0023810 k( 287) = ( -0.2658801 1.0549436 0.4340475), wk = 0.0023810 k( 288) = ( -0.2658801 1.0549436 0.4581612), wk = 0.0023810 k( 289) = ( -0.2658801 1.0549436 0.4822750), wk = 0.0023810 k( 290) = ( -0.2658801 1.0549436 0.5063888), wk = 0.0023810 k( 291) = ( -0.2658801 1.0549436 0.5305025), wk = 0.0023810 k( 292) = ( -0.2658801 1.0549436 0.5546163), wk = 0.0023810 k( 293) = ( -0.2658801 1.0549436 0.5787300), wk = 0.0023810 k( 294) = ( -0.2658801 1.0549436 0.6028437), wk = 0.0023810 k( 295) = ( -0.2658801 1.0549436 0.6269575), wk = 0.0023810 k( 296) = ( -0.2658801 1.0549436 0.6510713), wk = 0.0023810 k( 297) = ( -0.2658801 1.0549436 0.6751850), wk = 0.0023810 k( 298) = ( -0.2658801 1.0549436 0.6992987), wk = 0.0023810 k( 299) = ( -0.2658801 1.0549436 0.7234125), wk = 0.0023810 k( 300) = ( -0.2658801 1.0549436 0.7475263), wk = 0.0023810 k( 301) = ( -0.2658801 1.0549436 0.7716400), wk = 0.0023810 k( 302) = ( -0.2658801 1.0549436 0.7957538), wk = 0.0023810 k( 303) = ( -0.2658801 1.0549436 0.8198675), wk = 0.0023810 k( 304) = ( -0.2658801 1.0549436 0.8439812), wk = 0.0023810 k( 305) = ( -0.2658801 1.0549436 0.8680950), wk = 0.0023810 k( 306) = ( -0.2658801 1.0549436 0.8922088), wk = 0.0023810 k( 307) = ( -0.2658801 1.0549436 0.9163225), wk = 0.0023810 k( 308) = ( -0.2658801 1.0549436 0.9404363), wk = 0.0023810 k( 309) = ( -0.2658801 1.0549436 0.9645500), wk = 0.0023810 k( 310) = ( -0.2658801 1.0549436 0.9886638), wk = 0.0023810 k( 311) = ( -0.2658801 1.0549436 1.0127775), wk = 0.0023810 k( 312) = ( -0.2658801 1.0549436 1.0368913), wk = 0.0023810 k( 313) = ( -0.2658801 1.0549436 1.0368913), wk = 0.0023810 k( 314) = ( -0.2717331 1.0317204 1.0368913), wk = 0.0023810 k( 315) = ( -0.2775861 1.0084973 1.0368913), wk = 0.0023810 k( 316) = ( -0.2834391 0.9852741 1.0368913), wk = 0.0023810 k( 317) = ( -0.2892921 0.9620509 1.0368913), wk = 0.0023810 k( 318) = ( -0.2951451 0.9388277 1.0368913), wk = 0.0023810 k( 319) = ( -0.3009981 0.9156045 1.0368913), wk = 0.0023810 k( 320) = ( -0.3068511 0.8923813 1.0368913), wk = 0.0023810 k( 321) = ( -0.3127041 0.8691581 1.0368913), wk = 0.0023810 k( 322) = ( -0.3185571 0.8459349 1.0368913), wk = 0.0023810 k( 323) = ( -0.3244101 0.8227118 1.0368913), wk = 0.0023810 k( 324) = ( -0.3302631 0.7994886 1.0368913), wk = 0.0023810 k( 325) = ( -0.3361161 0.7762654 1.0368913), wk = 0.0023810 k( 326) = ( -0.3419691 0.7530422 1.0368913), wk = 0.0023810 k( 327) = ( -0.3478221 0.7298191 1.0368913), wk = 0.0023810 k( 328) = ( -0.3536751 0.7065959 1.0368913), wk = 0.0023810 k( 329) = ( -0.3595281 0.6833727 1.0368913), wk = 0.0023810 k( 330) = ( -0.3653811 0.6601495 1.0368913), wk = 0.0023810 k( 331) = ( -0.3712340 0.6369263 1.0368913), wk = 0.0023810 k( 332) = ( -0.3770870 0.6137031 1.0368913), wk = 0.0023810 k( 333) = ( -0.3829400 0.5904799 1.0368913), wk = 0.0023810 k( 334) = ( -0.3887930 0.5672567 1.0368913), wk = 0.0023810 k( 335) = ( -0.3946460 0.5440336 1.0368913), wk = 0.0023810 k( 336) = ( -0.4004990 0.5208104 1.0368913), wk = 0.0023810 k( 337) = ( -0.4063520 0.4975872 1.0368913), wk = 0.0023810 k( 338) = ( -0.4122050 0.4743640 1.0368913), wk = 0.0023810 k( 339) = ( -0.4180580 0.4511409 1.0368913), wk = 0.0023810 k( 340) = ( -0.4239110 0.4279177 1.0368913), wk = 0.0023810 k( 341) = ( -0.4297640 0.4046945 1.0368913), wk = 0.0023810 k( 342) = ( -0.4356170 0.3814713 1.0368913), wk = 0.0023810 k( 343) = ( -0.4414700 0.3582481 1.0368913), wk = 0.0023810 k( 344) = ( -0.4473230 0.3350249 1.0368913), wk = 0.0023810 k( 345) = ( -0.4531760 0.3118017 1.0368913), wk = 0.0023810 k( 346) = ( -0.4590290 0.2885785 1.0368913), wk = 0.0023810 k( 347) = ( -0.4648820 0.2653554 1.0368913), wk = 0.0023810 k( 348) = ( -0.4707350 0.2421322 1.0368913), wk = 0.0023810 k( 349) = ( -0.4765880 0.2189090 1.0368913), wk = 0.0023810 k( 350) = ( -0.4824410 0.1956858 1.0368913), wk = 0.0023810 k( 351) = ( -0.4882940 0.1724626 1.0368913), wk = 0.0023810 k( 352) = ( -0.4941470 0.1492395 1.0368913), wk = 0.0023810 k( 353) = ( -0.5000000 0.1260163 1.0368913), wk = 0.0023810 k( 354) = ( -0.5000000 0.1260163 1.0368913), wk = 0.0023810 k( 355) = ( -0.5000000 0.1260163 1.0127775), wk = 0.0023810 k( 356) = ( -0.5000000 0.1260163 0.9886638), wk = 0.0023810 k( 357) = ( -0.5000000 0.1260163 0.9645500), wk = 0.0023810 k( 358) = ( -0.5000000 0.1260163 0.9404363), wk = 0.0023810 k( 359) = ( -0.5000000 0.1260163 0.9163225), wk = 0.0023810 k( 360) = ( -0.5000000 0.1260163 0.8922088), wk = 0.0023810 k( 361) = ( -0.5000000 0.1260163 0.8680950), wk = 0.0023810 k( 362) = ( -0.5000000 0.1260163 0.8439812), wk = 0.0023810 k( 363) = ( -0.5000000 0.1260163 0.8198675), wk = 0.0023810 k( 364) = ( -0.5000000 0.1260163 0.7957538), wk = 0.0023810 k( 365) = ( -0.5000000 0.1260163 0.7716400), wk = 0.0023810 k( 366) = ( -0.5000000 0.1260163 0.7475263), wk = 0.0023810 k( 367) = ( -0.5000000 0.1260163 0.7234125), wk = 0.0023810 k( 368) = ( -0.5000000 0.1260163 0.6992987), wk = 0.0023810 k( 369) = ( -0.5000000 0.1260163 0.6751850), wk = 0.0023810 k( 370) = ( -0.5000000 0.1260163 0.6510713), wk = 0.0023810 k( 371) = ( -0.5000000 0.1260163 0.6269575), wk = 0.0023810 k( 372) = ( -0.5000000 0.1260163 0.6028437), wk = 0.0023810 k( 373) = ( -0.5000000 0.1260163 0.5787300), wk = 0.0023810 k( 374) = ( -0.5000000 0.1260163 0.5546163), wk = 0.0023810 k( 375) = ( -0.5000000 0.1260163 0.5305025), wk = 0.0023810 k( 376) = ( -0.5000000 0.1260163 0.5063888), wk = 0.0023810 k( 377) = ( -0.5000000 0.1260163 0.4822750), wk = 0.0023810 k( 378) = ( -0.5000000 0.1260163 0.4581612), wk = 0.0023810 k( 379) = ( -0.5000000 0.1260163 0.4340475), wk = 0.0023810 k( 380) = ( -0.5000000 0.1260163 0.4099338), wk = 0.0023810 k( 381) = ( -0.5000000 0.1260163 0.3858200), wk = 0.0023810 k( 382) = ( -0.5000000 0.1260163 0.3617062), wk = 0.0023810 k( 383) = ( -0.5000000 0.1260163 0.3375925), wk = 0.0023810 k( 384) = ( -0.5000000 0.1260163 0.3134788), wk = 0.0023810 k( 385) = ( -0.5000000 0.1260163 0.2893650), wk = 0.0023810 k( 386) = ( -0.5000000 0.1260163 0.2652513), wk = 0.0023810 k( 387) = ( -0.5000000 0.1260163 0.2411375), wk = 0.0023810 k( 388) = ( -0.5000000 0.1260163 0.2170237), wk = 0.0023810 k( 389) = ( -0.5000000 0.1260163 0.1929100), wk = 0.0023810 k( 390) = ( -0.5000000 0.1260163 0.1687963), wk = 0.0023810 k( 391) = ( -0.5000000 0.1260163 0.1446825), wk = 0.0023810 k( 392) = ( -0.5000000 0.1260163 0.1205687), wk = 0.0023810 k( 393) = ( -0.5000000 0.1260163 0.0964550), wk = 0.0023810 k( 394) = ( -0.5000000 0.1260163 0.0723412), wk = 0.0023810 k( 395) = ( -0.5000000 0.1260163 0.0482275), wk = 0.0023810 k( 396) = ( -0.5000000 0.1260163 0.0241138), wk = 0.0023810 k( 397) = ( -0.5000000 0.1260163 -0.0000000), wk = 0.0023810 k( 398) = ( 0.0000000 0.0000000 1.0368913), wk = 0.0023810 k( 399) = ( -0.0227273 0.0057280 1.0368913), wk = 0.0023810 k( 400) = ( -0.0454546 0.0114560 1.0368913), wk = 0.0023810 k( 401) = ( -0.0681818 0.0171840 1.0368913), wk = 0.0023810 k( 402) = ( -0.0909091 0.0229120 1.0368913), wk = 0.0023810 k( 403) = ( -0.1136364 0.0286401 1.0368913), wk = 0.0023810 k( 404) = ( -0.1363636 0.0343681 1.0368913), wk = 0.0023810 k( 405) = ( -0.1590909 0.0400961 1.0368913), wk = 0.0023810 k( 406) = ( -0.1818182 0.0458241 1.0368913), wk = 0.0023810 k( 407) = ( -0.2045454 0.0515521 1.0368913), wk = 0.0023810 k( 408) = ( -0.2272727 0.0572801 1.0368913), wk = 0.0023810 k( 409) = ( -0.2500000 0.0630081 1.0368913), wk = 0.0023810 k( 410) = ( -0.2727273 0.0687361 1.0368913), wk = 0.0023810 k( 411) = ( -0.2954545 0.0744642 1.0368913), wk = 0.0023810 k( 412) = ( -0.3181818 0.0801922 1.0368913), wk = 0.0023810 k( 413) = ( -0.3409091 0.0859202 1.0368913), wk = 0.0023810 k( 414) = ( -0.3636364 0.0916482 1.0368913), wk = 0.0023810 k( 415) = ( -0.3863636 0.0973762 1.0368913), wk = 0.0023810 k( 416) = ( -0.4090909 0.1031042 1.0368913), wk = 0.0023810 k( 417) = ( -0.4318182 0.1088322 1.0368913), wk = 0.0023810 k( 418) = ( -0.4545455 0.1145602 1.0368913), wk = 0.0023810 k( 419) = ( -0.4772727 0.1202882 1.0368913), wk = 0.0023810 k( 420) = ( -0.5000000 0.1260163 1.0368913), wk = 0.0023810 cryst. coord. k( 1) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 2) = ( 0.0059084 0.0059084 0.0000000), wk = 0.0023810 k( 3) = ( 0.0118169 0.0118169 0.0000000), wk = 0.0023810 k( 4) = ( 0.0177253 0.0177253 0.0000000), wk = 0.0023810 k( 5) = ( 0.0236338 0.0236338 0.0000000), wk = 0.0023810 k( 6) = ( 0.0295422 0.0295422 0.0000000), wk = 0.0023810 k( 7) = ( 0.0354507 0.0354507 0.0000000), wk = 0.0023810 k( 8) = ( 0.0413591 0.0413591 0.0000000), wk = 0.0023810 k( 9) = ( 0.0472676 0.0472676 0.0000000), wk = 0.0023810 k( 10) = ( 0.0531760 0.0531760 0.0000000), wk = 0.0023810 k( 11) = ( 0.0590845 0.0590845 0.0000000), wk = 0.0023810 k( 12) = ( 0.0649929 0.0649929 0.0000000), wk = 0.0023810 k( 13) = ( 0.0709014 0.0709014 0.0000000), wk = 0.0023810 k( 14) = ( 0.0768098 0.0768098 0.0000000), wk = 0.0023810 k( 15) = ( 0.0827182 0.0827182 0.0000000), wk = 0.0023810 k( 16) = ( 0.0886267 0.0886267 0.0000000), wk = 0.0023810 k( 17) = ( 0.0945351 0.0945352 0.0000000), wk = 0.0023810 k( 18) = ( 0.1004436 0.1004436 -0.0000000), wk = 0.0023810 k( 19) = ( 0.1063520 0.1063520 0.0000000), wk = 0.0023810 k( 20) = ( 0.1122605 0.1122605 0.0000000), wk = 0.0023810 k( 21) = ( 0.1181689 0.1181689 0.0000000), wk = 0.0023810 k( 22) = ( 0.1240774 0.1240774 0.0000000), wk = 0.0023810 k( 23) = ( 0.1299858 0.1299858 0.0000000), wk = 0.0023810 k( 24) = ( 0.1358943 0.1358943 0.0000000), wk = 0.0023810 k( 25) = ( 0.1418027 0.1418027 0.0000000), wk = 0.0023810 k( 26) = ( 0.1477112 0.1477112 0.0000000), wk = 0.0023810 k( 27) = ( 0.1536196 0.1536196 0.0000000), wk = 0.0023810 k( 28) = ( 0.1595281 0.1595281 0.0000000), wk = 0.0023810 k( 29) = ( 0.1654365 0.1654365 -0.0000000), wk = 0.0023810 k( 30) = ( 0.1713449 0.1713449 0.0000000), wk = 0.0023810 k( 31) = ( 0.1772534 0.1772534 0.0000000), wk = 0.0023810 k( 32) = ( 0.1831618 0.1831618 -0.0000000), wk = 0.0023810 k( 33) = ( 0.1890703 0.1890703 0.0000000), wk = 0.0023810 k( 34) = ( 0.1949787 0.1949787 0.0000000), wk = 0.0023810 k( 35) = ( 0.2008872 0.2008872 0.0000000), wk = 0.0023810 k( 36) = ( 0.2067956 0.2067956 0.0000000), wk = 0.0023810 k( 37) = ( 0.2127041 0.2127041 0.0000000), wk = 0.0023810 k( 38) = ( 0.2186125 0.2186125 0.0000000), wk = 0.0023810 k( 39) = ( 0.2245210 0.2245210 0.0000000), wk = 0.0023810 k( 40) = ( 0.2304294 0.2304294 0.0000000), wk = 0.0023810 k( 41) = ( 0.2363379 0.2363379 0.0000000), wk = 0.0023810 k( 42) = ( 0.2422463 0.2422463 0.0000000), wk = 0.0023810 k( 43) = ( 0.2481548 0.2481548 0.0000000), wk = 0.0023810 k( 44) = ( 0.2540632 0.2540632 0.0000000), wk = 0.0023810 k( 45) = ( 0.2599716 0.2599716 0.0000000), wk = 0.0023810 k( 46) = ( 0.2658801 0.2658801 0.0000000), wk = 0.0023810 k( 47) = ( 0.2658801 0.2658801 0.0000000), wk = 0.0023810 k( 48) = ( 0.2417092 0.2871637 0.0000000), wk = 0.0023810 k( 49) = ( 0.2175383 0.3084473 0.0000000), wk = 0.0023810 k( 50) = ( 0.1933673 0.3297310 0.0000000), wk = 0.0023810 k( 51) = ( 0.1691964 0.3510146 0.0000000), wk = 0.0023810 k( 52) = ( 0.1450255 0.3722982 0.0000000), wk = 0.0023810 k( 53) = ( 0.1208546 0.3935819 0.0000000), wk = 0.0023810 k( 54) = ( 0.0966837 0.4148655 -0.0000000), wk = 0.0023810 k( 55) = ( 0.0725128 0.4361491 -0.0000000), wk = 0.0023810 k( 56) = ( 0.0483418 0.4574327 -0.0000000), wk = 0.0023810 k( 57) = ( 0.0241709 0.4787164 0.0000000), wk = 0.0023810 k( 58) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 59) = ( 0.0000000 0.5000000 0.0000000), wk = 0.0023810 k( 60) = ( 0.0000000 0.5000000 0.0116279), wk = 0.0023810 k( 61) = ( 0.0000000 0.5000000 0.0232558), wk = 0.0023810 k( 62) = ( 0.0000000 0.5000000 0.0348837), wk = 0.0023810 k( 63) = ( 0.0000000 0.5000000 0.0465116), wk = 0.0023810 k( 64) = ( 0.0000000 0.5000000 0.0581395), wk = 0.0023810 k( 65) = ( 0.0000000 0.5000000 0.0697674), wk = 0.0023810 k( 66) = ( 0.0000000 0.5000000 0.0813954), wk = 0.0023810 k( 67) = ( 0.0000000 0.5000000 0.0930233), wk = 0.0023810 k( 68) = ( 0.0000000 0.5000000 0.1046512), wk = 0.0023810 k( 69) = ( 0.0000000 0.5000000 0.1162791), wk = 0.0023810 k( 70) = ( 0.0000000 0.5000000 0.1279070), wk = 0.0023810 k( 71) = ( 0.0000000 0.5000000 0.1395349), wk = 0.0023810 k( 72) = ( 0.0000000 0.5000000 0.1511628), wk = 0.0023810 k( 73) = ( 0.0000000 0.5000000 0.1627907), wk = 0.0023810 k( 74) = ( 0.0000000 0.5000000 0.1744186), wk = 0.0023810 k( 75) = ( 0.0000000 0.5000000 0.1860465), wk = 0.0023810 k( 76) = ( 0.0000000 0.5000000 0.1976744), wk = 0.0023810 k( 77) = ( 0.0000000 0.5000000 0.2093023), wk = 0.0023810 k( 78) = ( 0.0000000 0.5000000 0.2209302), wk = 0.0023810 k( 79) = ( 0.0000000 0.5000000 0.2325581), wk = 0.0023810 k( 80) = ( 0.0000000 0.5000000 0.2441860), wk = 0.0023810 k( 81) = ( 0.0000000 0.5000000 0.2558140), wk = 0.0023810 k( 82) = ( 0.0000000 0.5000000 0.2674419), wk = 0.0023810 k( 83) = ( 0.0000000 0.5000000 0.2790698), wk = 0.0023810 k( 84) = ( 0.0000000 0.5000000 0.2906977), wk = 0.0023810 k( 85) = ( 0.0000000 0.5000000 0.3023256), wk = 0.0023810 k( 86) = ( 0.0000000 0.5000000 0.3139535), wk = 0.0023810 k( 87) = ( 0.0000000 0.5000000 0.3255814), wk = 0.0023810 k( 88) = ( 0.0000000 0.5000000 0.3372093), wk = 0.0023810 k( 89) = ( 0.0000000 0.5000000 0.3488372), wk = 0.0023810 k( 90) = ( 0.0000000 0.5000000 0.3604651), wk = 0.0023810 k( 91) = ( 0.0000000 0.5000000 0.3720930), wk = 0.0023810 k( 92) = ( 0.0000000 0.5000000 0.3837209), wk = 0.0023810 k( 93) = ( 0.0000000 0.5000000 0.3953488), wk = 0.0023810 k( 94) = ( 0.0000000 0.5000000 0.4069767), wk = 0.0023810 k( 95) = ( 0.0000000 0.5000000 0.4186047), wk = 0.0023810 k( 96) = ( 0.0000000 0.5000000 0.4302326), wk = 0.0023810 k( 97) = ( 0.0000000 0.5000000 0.4418605), wk = 0.0023810 k( 98) = ( 0.0000000 0.5000000 0.4534884), wk = 0.0023810 k( 99) = ( 0.0000000 0.5000000 0.4651163), wk = 0.0023810 k( 100) = ( 0.0000000 0.5000000 0.4767442), wk = 0.0023810 k( 101) = ( 0.0000000 0.5000000 0.4883721), wk = 0.0023810 k( 102) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 103) = ( 0.0000000 0.5000000 0.5000000), wk = 0.0023810 k( 104) = ( 0.0241709 0.4787164 0.5000000), wk = 0.0023810 k( 105) = ( 0.0483418 0.4574327 0.5000000), wk = 0.0023810 k( 106) = ( 0.0725128 0.4361491 0.5000000), wk = 0.0023810 k( 107) = ( 0.0966837 0.4148655 0.5000000), wk = 0.0023810 k( 108) = ( 0.1208546 0.3935819 0.5000000), wk = 0.0023810 k( 109) = ( 0.1450255 0.3722982 0.5000000), wk = 0.0023810 k( 110) = ( 0.1691964 0.3510146 0.5000000), wk = 0.0023810 k( 111) = ( 0.1933673 0.3297310 0.5000000), wk = 0.0023810 k( 112) = ( 0.2175383 0.3084473 0.5000000), wk = 0.0023810 k( 113) = ( 0.2417092 0.2871637 0.5000000), wk = 0.0023810 k( 114) = ( 0.2658801 0.2658801 0.5000000), wk = 0.0023810 k( 115) = ( 0.2658801 0.2658801 0.5000000), wk = 0.0023810 k( 116) = ( 0.2599716 0.2599716 0.5000000), wk = 0.0023810 k( 117) = ( 0.2540632 0.2540632 0.5000000), wk = 0.0023810 k( 118) = ( 0.2481548 0.2481548 0.5000000), wk = 0.0023810 k( 119) = ( 0.2422463 0.2422463 0.5000000), wk = 0.0023810 k( 120) = ( 0.2363379 0.2363379 0.5000000), wk = 0.0023810 k( 121) = ( 0.2304294 0.2304294 0.5000000), wk = 0.0023810 k( 122) = ( 0.2245210 0.2245210 0.5000000), wk = 0.0023810 k( 123) = ( 0.2186125 0.2186125 0.5000000), wk = 0.0023810 k( 124) = ( 0.2127041 0.2127041 0.5000000), wk = 0.0023810 k( 125) = ( 0.2067956 0.2067956 0.5000000), wk = 0.0023810 k( 126) = ( 0.2008872 0.2008872 0.5000000), wk = 0.0023810 k( 127) = ( 0.1949787 0.1949787 0.5000000), wk = 0.0023810 k( 128) = ( 0.1890703 0.1890703 0.5000000), wk = 0.0023810 k( 129) = ( 0.1831618 0.1831618 0.5000000), wk = 0.0023810 k( 130) = ( 0.1772534 0.1772534 0.5000000), wk = 0.0023810 k( 131) = ( 0.1713449 0.1713449 0.5000000), wk = 0.0023810 k( 132) = ( 0.1654365 0.1654365 0.5000000), wk = 0.0023810 k( 133) = ( 0.1595281 0.1595281 0.5000000), wk = 0.0023810 k( 134) = ( 0.1536196 0.1536196 0.5000000), wk = 0.0023810 k( 135) = ( 0.1477112 0.1477112 0.5000000), wk = 0.0023810 k( 136) = ( 0.1418027 0.1418027 0.5000000), wk = 0.0023810 k( 137) = ( 0.1358943 0.1358943 0.5000000), wk = 0.0023810 k( 138) = ( 0.1299858 0.1299858 0.5000000), wk = 0.0023810 k( 139) = ( 0.1240774 0.1240774 0.5000000), wk = 0.0023810 k( 140) = ( 0.1181689 0.1181689 0.5000000), wk = 0.0023810 k( 141) = ( 0.1122605 0.1122605 0.5000000), wk = 0.0023810 k( 142) = ( 0.1063520 0.1063520 0.5000000), wk = 0.0023810 k( 143) = ( 0.1004436 0.1004436 0.5000000), wk = 0.0023810 k( 144) = ( 0.0945351 0.0945352 0.5000000), wk = 0.0023810 k( 145) = ( 0.0886267 0.0886267 0.5000000), wk = 0.0023810 k( 146) = ( 0.0827182 0.0827182 0.5000000), wk = 0.0023810 k( 147) = ( 0.0768098 0.0768098 0.5000000), wk = 0.0023810 k( 148) = ( 0.0709014 0.0709014 0.5000000), wk = 0.0023810 k( 149) = ( 0.0649929 0.0649929 0.5000000), wk = 0.0023810 k( 150) = ( 0.0590845 0.0590845 0.5000000), wk = 0.0023810 k( 151) = ( 0.0531760 0.0531760 0.5000000), wk = 0.0023810 k( 152) = ( 0.0472676 0.0472676 0.5000000), wk = 0.0023810 k( 153) = ( 0.0413591 0.0413591 0.5000000), wk = 0.0023810 k( 154) = ( 0.0354507 0.0354507 0.5000000), wk = 0.0023810 k( 155) = ( 0.0295422 0.0295422 0.5000000), wk = 0.0023810 k( 156) = ( 0.0236338 0.0236338 0.5000000), wk = 0.0023810 k( 157) = ( 0.0177253 0.0177253 0.5000000), wk = 0.0023810 k( 158) = ( 0.0118169 0.0118169 0.5000000), wk = 0.0023810 k( 159) = ( 0.0059084 0.0059084 0.5000000), wk = 0.0023810 k( 160) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 161) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 162) = ( 0.0000000 0.0000000 0.4883721), wk = 0.0023810 k( 163) = ( 0.0000000 0.0000000 0.4767442), wk = 0.0023810 k( 164) = ( 0.0000000 0.0000000 0.4651163), wk = 0.0023810 k( 165) = ( 0.0000000 0.0000000 0.4534884), wk = 0.0023810 k( 166) = ( 0.0000000 0.0000000 0.4418605), wk = 0.0023810 k( 167) = ( 0.0000000 0.0000000 0.4302326), wk = 0.0023810 k( 168) = ( 0.0000000 0.0000000 0.4186047), wk = 0.0023810 k( 169) = ( 0.0000000 0.0000000 0.4069767), wk = 0.0023810 k( 170) = ( 0.0000000 0.0000000 0.3953488), wk = 0.0023810 k( 171) = ( 0.0000000 0.0000000 0.3837209), wk = 0.0023810 k( 172) = ( 0.0000000 0.0000000 0.3720930), wk = 0.0023810 k( 173) = ( 0.0000000 0.0000000 0.3604651), wk = 0.0023810 k( 174) = ( 0.0000000 0.0000000 0.3488372), wk = 0.0023810 k( 175) = ( 0.0000000 0.0000000 0.3372093), wk = 0.0023810 k( 176) = ( 0.0000000 0.0000000 0.3255814), wk = 0.0023810 k( 177) = ( 0.0000000 0.0000000 0.3139535), wk = 0.0023810 k( 178) = ( 0.0000000 0.0000000 0.3023256), wk = 0.0023810 k( 179) = ( 0.0000000 0.0000000 0.2906977), wk = 0.0023810 k( 180) = ( 0.0000000 0.0000000 0.2790698), wk = 0.0023810 k( 181) = ( 0.0000000 0.0000000 0.2674419), wk = 0.0023810 k( 182) = ( 0.0000000 0.0000000 0.2558140), wk = 0.0023810 k( 183) = ( 0.0000000 0.0000000 0.2441860), wk = 0.0023810 k( 184) = ( 0.0000000 0.0000000 0.2325581), wk = 0.0023810 k( 185) = ( 0.0000000 0.0000000 0.2209302), wk = 0.0023810 k( 186) = ( 0.0000000 0.0000000 0.2093023), wk = 0.0023810 k( 187) = ( 0.0000000 0.0000000 0.1976744), wk = 0.0023810 k( 188) = ( 0.0000000 0.0000000 0.1860465), wk = 0.0023810 k( 189) = ( 0.0000000 0.0000000 0.1744186), wk = 0.0023810 k( 190) = ( 0.0000000 0.0000000 0.1627907), wk = 0.0023810 k( 191) = ( 0.0000000 0.0000000 0.1511628), wk = 0.0023810 k( 192) = ( 0.0000000 0.0000000 0.1395349), wk = 0.0023810 k( 193) = ( 0.0000000 0.0000000 0.1279070), wk = 0.0023810 k( 194) = ( 0.0000000 0.0000000 0.1162791), wk = 0.0023810 k( 195) = ( 0.0000000 0.0000000 0.1046512), wk = 0.0023810 k( 196) = ( 0.0000000 0.0000000 0.0930233), wk = 0.0023810 k( 197) = ( 0.0000000 0.0000000 0.0813954), wk = 0.0023810 k( 198) = ( 0.0000000 0.0000000 0.0697674), wk = 0.0023810 k( 199) = ( 0.0000000 0.0000000 0.0581395), wk = 0.0023810 k( 200) = ( 0.0000000 0.0000000 0.0465116), wk = 0.0023810 k( 201) = ( 0.0000000 0.0000000 0.0348837), wk = 0.0023810 k( 202) = ( 0.0000000 0.0000000 0.0232558), wk = 0.0023810 k( 203) = ( 0.0000000 0.0000000 0.0116279), wk = 0.0023810 k( 204) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 205) = ( 0.0000000 0.0000000 0.0000000), wk = 0.0023810 k( 206) = ( -0.0227273 0.0227273 0.0000000), wk = 0.0023810 k( 207) = ( -0.0454546 0.0454545 -0.0000000), wk = 0.0023810 k( 208) = ( -0.0681818 0.0681818 -0.0000000), wk = 0.0023810 k( 209) = ( -0.0909091 0.0909091 0.0000000), wk = 0.0023810 k( 210) = ( -0.1136364 0.1136364 0.0000000), wk = 0.0023810 k( 211) = ( -0.1363636 0.1363636 -0.0000000), wk = 0.0023810 k( 212) = ( -0.1590909 0.1590909 -0.0000000), wk = 0.0023810 k( 213) = ( -0.1818182 0.1818182 0.0000000), wk = 0.0023810 k( 214) = ( -0.2045454 0.2045454 0.0000000), wk = 0.0023810 k( 215) = ( -0.2272727 0.2272727 0.0000000), wk = 0.0023810 k( 216) = ( -0.2500000 0.2500000 0.0000000), wk = 0.0023810 k( 217) = ( -0.2727273 0.2727273 -0.0000000), wk = 0.0023810 k( 218) = ( -0.2954545 0.2954546 0.0000000), wk = 0.0023810 k( 219) = ( -0.3181818 0.3181818 -0.0000000), wk = 0.0023810 k( 220) = ( -0.3409091 0.3409091 0.0000000), wk = 0.0023810 k( 221) = ( -0.3636364 0.3636364 0.0000000), wk = 0.0023810 k( 222) = ( -0.3863636 0.3863636 0.0000000), wk = 0.0023810 k( 223) = ( -0.4090909 0.4090909 0.0000000), wk = 0.0023810 k( 224) = ( -0.4318182 0.4318182 -0.0000000), wk = 0.0023810 k( 225) = ( -0.4545455 0.4545455 -0.0000000), wk = 0.0023810 k( 226) = ( -0.4772727 0.4772727 -0.0000000), wk = 0.0023810 k( 227) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0023810 k( 228) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0023810 k( 229) = ( -0.4941470 0.5058530 0.0000000), wk = 0.0023810 k( 230) = ( -0.4882940 0.5117060 0.0000000), wk = 0.0023810 k( 231) = ( -0.4824410 0.5175590 0.0000000), wk = 0.0023810 k( 232) = ( -0.4765880 0.5234120 -0.0000000), wk = 0.0023810 k( 233) = ( -0.4707350 0.5292650 0.0000000), wk = 0.0023810 k( 234) = ( -0.4648820 0.5351180 -0.0000000), wk = 0.0023810 k( 235) = ( -0.4590290 0.5409710 -0.0000000), wk = 0.0023810 k( 236) = ( -0.4531760 0.5468240 0.0000000), wk = 0.0023810 k( 237) = ( -0.4473230 0.5526770 0.0000000), wk = 0.0023810 k( 238) = ( -0.4414700 0.5585300 -0.0000000), wk = 0.0023810 k( 239) = ( -0.4356170 0.5643830 0.0000000), wk = 0.0023810 k( 240) = ( -0.4297640 0.5702360 0.0000000), wk = 0.0023810 k( 241) = ( -0.4239110 0.5760890 0.0000000), wk = 0.0023810 k( 242) = ( -0.4180580 0.5819420 -0.0000000), wk = 0.0023810 k( 243) = ( -0.4122050 0.5877950 -0.0000000), wk = 0.0023810 k( 244) = ( -0.4063520 0.5936480 0.0000000), wk = 0.0023810 k( 245) = ( -0.4004990 0.5995010 0.0000000), wk = 0.0023810 k( 246) = ( -0.3946460 0.6053540 0.0000000), wk = 0.0023810 k( 247) = ( -0.3887930 0.6112070 -0.0000000), wk = 0.0023810 k( 248) = ( -0.3829400 0.6170600 0.0000000), wk = 0.0023810 k( 249) = ( -0.3770870 0.6229129 -0.0000000), wk = 0.0023810 k( 250) = ( -0.3712340 0.6287660 0.0000000), wk = 0.0023810 k( 251) = ( -0.3653811 0.6346189 0.0000000), wk = 0.0023810 k( 252) = ( -0.3595281 0.6404719 -0.0000000), wk = 0.0023810 k( 253) = ( -0.3536751 0.6463249 0.0000000), wk = 0.0023810 k( 254) = ( -0.3478221 0.6521779 0.0000000), wk = 0.0023810 k( 255) = ( -0.3419691 0.6580309 0.0000000), wk = 0.0023810 k( 256) = ( -0.3361161 0.6638839 0.0000000), wk = 0.0023810 k( 257) = ( -0.3302631 0.6697369 0.0000000), wk = 0.0023810 k( 258) = ( -0.3244101 0.6755899 -0.0000000), wk = 0.0023810 k( 259) = ( -0.3185571 0.6814429 0.0000000), wk = 0.0023810 k( 260) = ( -0.3127041 0.6872959 0.0000000), wk = 0.0023810 k( 261) = ( -0.3068511 0.6931489 -0.0000000), wk = 0.0023810 k( 262) = ( -0.3009981 0.6990019 0.0000000), wk = 0.0023810 k( 263) = ( -0.2951451 0.7048549 -0.0000000), wk = 0.0023810 k( 264) = ( -0.2892921 0.7107079 0.0000000), wk = 0.0023810 k( 265) = ( -0.2834391 0.7165609 0.0000000), wk = 0.0023810 k( 266) = ( -0.2775861 0.7224139 -0.0000000), wk = 0.0023810 k( 267) = ( -0.2717331 0.7282669 0.0000000), wk = 0.0023810 k( 268) = ( -0.2658801 0.7341199 0.0000000), wk = 0.0023810 k( 269) = ( -0.2658801 0.7341199 0.0000000), wk = 0.0023810 k( 270) = ( -0.2658801 0.7341199 0.0116279), wk = 0.0023810 k( 271) = ( -0.2658801 0.7341199 0.0232558), wk = 0.0023810 k( 272) = ( -0.2658801 0.7341199 0.0348837), wk = 0.0023810 k( 273) = ( -0.2658801 0.7341199 0.0465116), wk = 0.0023810 k( 274) = ( -0.2658801 0.7341199 0.0581395), wk = 0.0023810 k( 275) = ( -0.2658801 0.7341199 0.0697674), wk = 0.0023810 k( 276) = ( -0.2658801 0.7341199 0.0813954), wk = 0.0023810 k( 277) = ( -0.2658801 0.7341199 0.0930233), wk = 0.0023810 k( 278) = ( -0.2658801 0.7341199 0.1046512), wk = 0.0023810 k( 279) = ( -0.2658801 0.7341199 0.1162791), wk = 0.0023810 k( 280) = ( -0.2658801 0.7341199 0.1279070), wk = 0.0023810 k( 281) = ( -0.2658801 0.7341199 0.1395349), wk = 0.0023810 k( 282) = ( -0.2658801 0.7341199 0.1511628), wk = 0.0023810 k( 283) = ( -0.2658801 0.7341199 0.1627907), wk = 0.0023810 k( 284) = ( -0.2658801 0.7341199 0.1744186), wk = 0.0023810 k( 285) = ( -0.2658801 0.7341199 0.1860465), wk = 0.0023810 k( 286) = ( -0.2658801 0.7341199 0.1976744), wk = 0.0023810 k( 287) = ( -0.2658801 0.7341199 0.2093023), wk = 0.0023810 k( 288) = ( -0.2658801 0.7341199 0.2209302), wk = 0.0023810 k( 289) = ( -0.2658801 0.7341199 0.2325581), wk = 0.0023810 k( 290) = ( -0.2658801 0.7341199 0.2441860), wk = 0.0023810 k( 291) = ( -0.2658801 0.7341199 0.2558140), wk = 0.0023810 k( 292) = ( -0.2658801 0.7341199 0.2674419), wk = 0.0023810 k( 293) = ( -0.2658801 0.7341199 0.2790698), wk = 0.0023810 k( 294) = ( -0.2658801 0.7341199 0.2906977), wk = 0.0023810 k( 295) = ( -0.2658801 0.7341199 0.3023256), wk = 0.0023810 k( 296) = ( -0.2658801 0.7341199 0.3139535), wk = 0.0023810 k( 297) = ( -0.2658801 0.7341199 0.3255814), wk = 0.0023810 k( 298) = ( -0.2658801 0.7341199 0.3372093), wk = 0.0023810 k( 299) = ( -0.2658801 0.7341199 0.3488372), wk = 0.0023810 k( 300) = ( -0.2658801 0.7341199 0.3604651), wk = 0.0023810 k( 301) = ( -0.2658801 0.7341199 0.3720930), wk = 0.0023810 k( 302) = ( -0.2658801 0.7341199 0.3837209), wk = 0.0023810 k( 303) = ( -0.2658801 0.7341199 0.3953488), wk = 0.0023810 k( 304) = ( -0.2658801 0.7341199 0.4069767), wk = 0.0023810 k( 305) = ( -0.2658801 0.7341199 0.4186047), wk = 0.0023810 k( 306) = ( -0.2658801 0.7341199 0.4302326), wk = 0.0023810 k( 307) = ( -0.2658801 0.7341199 0.4418605), wk = 0.0023810 k( 308) = ( -0.2658801 0.7341199 0.4534884), wk = 0.0023810 k( 309) = ( -0.2658801 0.7341199 0.4651163), wk = 0.0023810 k( 310) = ( -0.2658801 0.7341199 0.4767442), wk = 0.0023810 k( 311) = ( -0.2658801 0.7341199 0.4883721), wk = 0.0023810 k( 312) = ( -0.2658801 0.7341199 0.5000000), wk = 0.0023810 k( 313) = ( -0.2658801 0.7341199 0.5000000), wk = 0.0023810 k( 314) = ( -0.2717331 0.7282669 0.5000000), wk = 0.0023810 k( 315) = ( -0.2775861 0.7224139 0.5000000), wk = 0.0023810 k( 316) = ( -0.2834391 0.7165609 0.5000000), wk = 0.0023810 k( 317) = ( -0.2892921 0.7107079 0.5000000), wk = 0.0023810 k( 318) = ( -0.2951451 0.7048549 0.5000000), wk = 0.0023810 k( 319) = ( -0.3009981 0.6990019 0.5000000), wk = 0.0023810 k( 320) = ( -0.3068511 0.6931489 0.5000000), wk = 0.0023810 k( 321) = ( -0.3127041 0.6872959 0.5000000), wk = 0.0023810 k( 322) = ( -0.3185571 0.6814429 0.5000000), wk = 0.0023810 k( 323) = ( -0.3244101 0.6755899 0.5000000), wk = 0.0023810 k( 324) = ( -0.3302631 0.6697369 0.5000000), wk = 0.0023810 k( 325) = ( -0.3361161 0.6638839 0.5000000), wk = 0.0023810 k( 326) = ( -0.3419691 0.6580309 0.5000000), wk = 0.0023810 k( 327) = ( -0.3478221 0.6521779 0.5000000), wk = 0.0023810 k( 328) = ( -0.3536751 0.6463249 0.5000000), wk = 0.0023810 k( 329) = ( -0.3595281 0.6404719 0.5000000), wk = 0.0023810 k( 330) = ( -0.3653811 0.6346189 0.5000000), wk = 0.0023810 k( 331) = ( -0.3712340 0.6287660 0.5000000), wk = 0.0023810 k( 332) = ( -0.3770870 0.6229129 0.5000000), wk = 0.0023810 k( 333) = ( -0.3829400 0.6170600 0.5000000), wk = 0.0023810 k( 334) = ( -0.3887930 0.6112070 0.5000000), wk = 0.0023810 k( 335) = ( -0.3946460 0.6053540 0.5000000), wk = 0.0023810 k( 336) = ( -0.4004990 0.5995010 0.5000000), wk = 0.0023810 k( 337) = ( -0.4063520 0.5936480 0.5000000), wk = 0.0023810 k( 338) = ( -0.4122050 0.5877950 0.5000000), wk = 0.0023810 k( 339) = ( -0.4180580 0.5819420 0.5000000), wk = 0.0023810 k( 340) = ( -0.4239110 0.5760890 0.5000000), wk = 0.0023810 k( 341) = ( -0.4297640 0.5702360 0.5000000), wk = 0.0023810 k( 342) = ( -0.4356170 0.5643830 0.5000000), wk = 0.0023810 k( 343) = ( -0.4414700 0.5585300 0.5000000), wk = 0.0023810 k( 344) = ( -0.4473230 0.5526770 0.5000000), wk = 0.0023810 k( 345) = ( -0.4531760 0.5468240 0.5000000), wk = 0.0023810 k( 346) = ( -0.4590290 0.5409710 0.5000000), wk = 0.0023810 k( 347) = ( -0.4648820 0.5351180 0.5000000), wk = 0.0023810 k( 348) = ( -0.4707350 0.5292650 0.5000000), wk = 0.0023810 k( 349) = ( -0.4765880 0.5234120 0.5000000), wk = 0.0023810 k( 350) = ( -0.4824410 0.5175590 0.5000000), wk = 0.0023810 k( 351) = ( -0.4882940 0.5117060 0.5000000), wk = 0.0023810 k( 352) = ( -0.4941470 0.5058530 0.5000000), wk = 0.0023810 k( 353) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 354) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0023810 k( 355) = ( -0.5000000 0.5000000 0.4883721), wk = 0.0023810 k( 356) = ( -0.5000000 0.5000000 0.4767442), wk = 0.0023810 k( 357) = ( -0.5000000 0.5000000 0.4651163), wk = 0.0023810 k( 358) = ( -0.5000000 0.5000000 0.4534884), wk = 0.0023810 k( 359) = ( -0.5000000 0.5000000 0.4418605), wk = 0.0023810 k( 360) = ( -0.5000000 0.5000000 0.4302326), wk = 0.0023810 k( 361) = ( -0.5000000 0.5000000 0.4186047), wk = 0.0023810 k( 362) = ( -0.5000000 0.5000000 0.4069767), wk = 0.0023810 k( 363) = ( -0.5000000 0.5000000 0.3953488), wk = 0.0023810 k( 364) = ( -0.5000000 0.5000000 0.3837209), wk = 0.0023810 k( 365) = ( -0.5000000 0.5000000 0.3720930), wk = 0.0023810 k( 366) = ( -0.5000000 0.5000000 0.3604651), wk = 0.0023810 k( 367) = ( -0.5000000 0.5000000 0.3488372), wk = 0.0023810 k( 368) = ( -0.5000000 0.5000000 0.3372093), wk = 0.0023810 k( 369) = ( -0.5000000 0.5000000 0.3255814), wk = 0.0023810 k( 370) = ( -0.5000000 0.5000000 0.3139535), wk = 0.0023810 k( 371) = ( -0.5000000 0.5000000 0.3023256), wk = 0.0023810 k( 372) = ( -0.5000000 0.5000000 0.2906977), wk = 0.0023810 k( 373) = ( -0.5000000 0.5000000 0.2790698), wk = 0.0023810 k( 374) = ( -0.5000000 0.5000000 0.2674419), wk = 0.0023810 k( 375) = ( -0.5000000 0.5000000 0.2558140), wk = 0.0023810 k( 376) = ( -0.5000000 0.5000000 0.2441860), wk = 0.0023810 k( 377) = ( -0.5000000 0.5000000 0.2325581), wk = 0.0023810 k( 378) = ( -0.5000000 0.5000000 0.2209302), wk = 0.0023810 k( 379) = ( -0.5000000 0.5000000 0.2093023), wk = 0.0023810 k( 380) = ( -0.5000000 0.5000000 0.1976744), wk = 0.0023810 k( 381) = ( -0.5000000 0.5000000 0.1860465), wk = 0.0023810 k( 382) = ( -0.5000000 0.5000000 0.1744186), wk = 0.0023810 k( 383) = ( -0.5000000 0.5000000 0.1627907), wk = 0.0023810 k( 384) = ( -0.5000000 0.5000000 0.1511628), wk = 0.0023810 k( 385) = ( -0.5000000 0.5000000 0.1395349), wk = 0.0023810 k( 386) = ( -0.5000000 0.5000000 0.1279070), wk = 0.0023810 k( 387) = ( -0.5000000 0.5000000 0.1162791), wk = 0.0023810 k( 388) = ( -0.5000000 0.5000000 0.1046512), wk = 0.0023810 k( 389) = ( -0.5000000 0.5000000 0.0930233), wk = 0.0023810 k( 390) = ( -0.5000000 0.5000000 0.0813954), wk = 0.0023810 k( 391) = ( -0.5000000 0.5000000 0.0697674), wk = 0.0023810 k( 392) = ( -0.5000000 0.5000000 0.0581395), wk = 0.0023810 k( 393) = ( -0.5000000 0.5000000 0.0465116), wk = 0.0023810 k( 394) = ( -0.5000000 0.5000000 0.0348837), wk = 0.0023810 k( 395) = ( -0.5000000 0.5000000 0.0232558), wk = 0.0023810 k( 396) = ( -0.5000000 0.5000000 0.0116279), wk = 0.0023810 k( 397) = ( -0.5000000 0.5000000 0.0000000), wk = 0.0023810 k( 398) = ( 0.0000000 0.0000000 0.5000000), wk = 0.0023810 k( 399) = ( -0.0227273 0.0227273 0.5000000), wk = 0.0023810 k( 400) = ( -0.0454546 0.0454545 0.5000000), wk = 0.0023810 k( 401) = ( -0.0681818 0.0681818 0.5000000), wk = 0.0023810 k( 402) = ( -0.0909091 0.0909091 0.5000000), wk = 0.0023810 k( 403) = ( -0.1136364 0.1136364 0.5000000), wk = 0.0023810 k( 404) = ( -0.1363636 0.1363636 0.5000000), wk = 0.0023810 k( 405) = ( -0.1590909 0.1590909 0.5000000), wk = 0.0023810 k( 406) = ( -0.1818182 0.1818182 0.5000000), wk = 0.0023810 k( 407) = ( -0.2045454 0.2045454 0.5000000), wk = 0.0023810 k( 408) = ( -0.2272727 0.2272727 0.5000000), wk = 0.0023810 k( 409) = ( -0.2500000 0.2500000 0.5000000), wk = 0.0023810 k( 410) = ( -0.2727273 0.2727273 0.5000000), wk = 0.0023810 k( 411) = ( -0.2954545 0.2954546 0.5000000), wk = 0.0023810 k( 412) = ( -0.3181818 0.3181818 0.5000000), wk = 0.0023810 k( 413) = ( -0.3409091 0.3409091 0.5000000), wk = 0.0023810 k( 414) = ( -0.3636364 0.3636364 0.5000000), wk = 0.0023810 k( 415) = ( -0.3863636 0.3863636 0.5000000), wk = 0.0023810 k( 416) = ( -0.4090909 0.4090909 0.5000000), wk = 0.0023810 k( 417) = ( -0.4318182 0.4318182 0.5000000), wk = 0.0023810 k( 418) = ( -0.4545455 0.4545455 0.5000000), wk = 0.0023810 k( 419) = ( -0.4772727 0.4772727 0.5000000), wk = 0.0023810 k( 420) = ( -0.5000000 0.5000000 0.5000000), wk = 0.0023810 Dense grid: 50371 G-vectors FFT dimensions: ( 75, 75, 40) Smooth grid: 28611 G-vectors FFT dimensions: ( 64, 64, 30) Largest allocated arrays est. size (Mb) dimensions Kohn-Sham Wavefunctions 0.12 Mb ( 162, 48) NL pseudopotentials 0.15 Mb ( 81, 124) Each V/rho on FFT grid 0.09 Mb ( 5625) Each G-vector array 0.01 Mb ( 1052) G-vector shells 0.00 Mb ( 548) Largest temporary arrays est. size (Mb) dimensions Auxiliary wavefunctions 0.47 Mb ( 162, 192) Each subspace H/S matrix 0.56 Mb ( 192, 192) Each matrix 0.18 Mb ( 124, 2, 48) Check: negative/imaginary core charge= -0.000001 0.000000 The potential is recalculated from file : ./ZrSi2.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 42.8 secs Computing kpt #: 2 total cpu time spent up to now is 45.0 secs Computing kpt #: 3 total cpu time spent up to now is 46.7 secs Computing kpt #: 4 total cpu time spent up to now is 49.1 secs Computing kpt #: 5 total cpu time spent up to now is 50.8 secs Computing kpt #: 6 total cpu time spent up to now is 53.2 secs Computing kpt #: 7 total cpu time spent up to now is 55.6 secs Computing kpt #: 8 total cpu time spent up to now is 57.5 secs Computing kpt #: 9 total cpu time spent up to now is 59.3 secs Computing kpt #: 10 total cpu time spent up to now is 61.1 secs Computing kpt #: 11 total cpu time spent up to now is 63.2 secs Computing kpt #: 12 total cpu time spent up to now is 66.1 secs Computing kpt #: 13 total cpu time spent up to now is 68.3 secs Computing kpt #: 14 total cpu time spent up to now is 70.4 secs Computing kpt #: 15 total cpu time spent up to now is 72.5 secs Computing kpt #: 16 total cpu time spent up to now is 74.5 secs Computing kpt #: 17 total cpu time spent up to now is 76.6 secs Computing kpt #: 18 total cpu time spent up to now is 78.6 secs Computing kpt #: 19 total cpu time spent up to now is 80.7 secs Computing kpt #: 20 total cpu time spent up to now is 83.3 secs Computing kpt #: 21 total cpu time spent up to now is 85.2 secs Computing kpt #: 22 total cpu time spent up to now is 87.1 secs Computing kpt #: 23 total cpu time spent up to now is 89.1 secs Computing kpt #: 24 total cpu time spent up to now is 91.0 secs Computing kpt #: 25 total cpu time spent up to now is 92.9 secs Computing kpt #: 26 total cpu time spent up to now is 95.2 secs Computing kpt #: 27 total cpu time spent up to now is 97.0 secs Computing kpt #: 28 total cpu time spent up to now is 98.9 secs Computing kpt #: 29 total cpu time spent up to now is 100.7 secs Computing kpt #: 30 total cpu time spent up to now is 102.3 secs Computing kpt #: 31 total cpu time spent up to now is 104.0 secs Computing kpt #: 32 total cpu time spent up to now is 105.8 secs Computing kpt #: 33 total cpu time spent up to now is 108.1 secs Computing kpt #: 34 total cpu time spent up to now is 110.0 secs Computing kpt #: 35 total cpu time spent up to now is 112.9 secs Computing kpt #: 36 total cpu time spent up to now is 116.8 secs Computing kpt #: 37 total cpu time spent up to now is 119.3 secs Computing kpt #: 38 total cpu time spent up to now is 121.5 secs Computing kpt #: 39 total cpu time spent up to now is 123.3 secs Computing kpt #: 40 total cpu time spent up to now is 125.5 secs Computing kpt #: 41 total cpu time spent up to now is 128.6 secs Computing kpt #: 42 total cpu time spent up to now is 130.7 secs Computing kpt #: 43 total cpu time spent up to now is 132.7 secs Computing kpt #: 44 total cpu time spent up to now is 134.4 secs Computing kpt #: 45 total cpu time spent up to now is 136.1 secs Computing kpt #: 46 total cpu time spent up to now is 137.8 secs Computing kpt #: 47 total cpu time spent up to now is 140.1 secs Computing kpt #: 48 total cpu time spent up to now is 141.8 secs Computing kpt #: 49 total cpu time spent up to now is 143.5 secs Computing kpt #: 50 total cpu time spent up to now is 147.0 secs Computing kpt #: 51 total cpu time spent up to now is 148.7 secs Computing kpt #: 52 total cpu time spent up to now is 150.5 secs Computing kpt #: 53 total cpu time spent up to now is 153.6 secs Computing kpt #: 54 total cpu time spent up to now is 156.0 secs Computing kpt #: 55 total cpu time spent up to now is 158.3 secs Computing kpt #: 56 total cpu time spent up to now is 160.8 secs Computing kpt #: 57 total cpu time spent up to now is 163.3 secs Computing kpt #: 58 total cpu time spent up to now is 165.7 secs Computing kpt #: 59 total cpu time spent up to now is 168.1 secs Computing kpt #: 60 total cpu time spent up to now is 170.5 secs Computing kpt #: 61 total cpu time spent up to now is 172.8 secs Computing kpt #: 62 total cpu time spent up to now is 174.8 secs Computing kpt #: 63 total cpu time spent up to now is 176.9 secs Computing kpt #: 64 total cpu time spent up to now is 179.0 secs Computing kpt #: 65 total cpu time spent up to now is 181.0 secs Computing kpt #: 66 total cpu time spent up to now is 183.1 secs Computing kpt #: 67 total cpu time spent up to now is 185.1 secs Computing kpt #: 68 total cpu time spent up to now is 187.3 secs Computing kpt #: 69 total cpu time spent up to now is 190.6 secs Computing kpt #: 70 total cpu time spent up to now is 193.1 secs Computing kpt #: 71 total cpu time spent up to now is 195.6 secs Computing kpt #: 72 total cpu time spent up to now is 198.9 secs Computing kpt #: 73 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 203.4 secs Computing kpt #: 74 total cpu time spent up to now is 206.4 secs Computing kpt #: 75 total cpu time spent up to now is 208.5 secs Computing kpt #: 76 total cpu time spent up to now is 211.1 secs Computing kpt #: 77 total cpu time spent up to now is 213.3 secs Computing kpt #: 78 total cpu time spent up to now is 215.5 secs Computing kpt #: 79 total cpu time spent up to now is 217.9 secs Computing kpt #: 80 total cpu time spent up to now is 219.7 secs Computing kpt #: 81 total cpu time spent up to now is 221.5 secs Computing kpt #: 82 total cpu time spent up to now is 223.8 secs Computing kpt #: 83 total cpu time spent up to now is 226.0 secs Computing kpt #: 84 total cpu time spent up to now is 228.3 secs Computing kpt #: 85 total cpu time spent up to now is 230.8 secs Computing kpt #: 86 total cpu time spent up to now is 232.9 secs Computing kpt #: 87 total cpu time spent up to now is 235.5 secs Computing kpt #: 88 total cpu time spent up to now is 237.9 secs Computing kpt #: 89 c_bands: 1 eigenvalues not converged total cpu time spent up to now is 241.4 secs Computing kpt #: 90 total cpu time spent up to now is 243.7 secs Computing kpt #: 91 total cpu time spent up to now is 245.9 secs Computing kpt #: 92 total cpu time spent up to now is 248.7 secs Computing kpt #: 93 total cpu time spent up to now is 251.1 secs Computing kpt #: 94 total cpu time spent up to now is 253.1 secs Computing kpt #: 95 total cpu time spent up to now is 255.3 secs Computing kpt #: 96 total cpu time spent up to now is 257.5 secs Computing kpt #: 97 total cpu time spent up to now is 259.5 secs Computing kpt #: 98 total cpu time spent up to now is 261.5 secs Computing kpt #: 99 total cpu time spent up to now is 263.8 secs Computing kpt #: 100 total cpu time spent up to now is 266.1 secs Computing kpt #: 101 total cpu time spent up to now is 268.2 secs Computing kpt #: 102 total cpu time spent up to now is 270.7 secs Computing kpt #: 103 total cpu time spent up to now is 272.9 secs Computing kpt #: 104 total cpu time spent up to now is 275.0 secs Computing kpt #: 105 total cpu time spent up to now is 277.6 secs Computing kpt #: 106 total cpu time spent up to now is 280.5 secs Computing kpt #: 107 total cpu time spent up to now is 282.6 secs Computing kpt #: 108 total cpu time spent up to now is 284.7 secs Computing kpt #: 109 total cpu time spent up to now is 286.8 secs Computing kpt #: 110 total cpu time spent up to now is 288.9 secs Computing kpt #: 111 total cpu time spent up to now is 290.9 secs Computing kpt #: 112 total cpu time spent up to now is 293.0 secs Computing kpt #: 113 total cpu time spent up to now is 296.4 secs Computing kpt #: 114 total cpu time spent up to now is 298.5 secs Computing kpt #: 115 total cpu time spent up to now is 300.6 secs Computing kpt #: 116 total cpu time spent up to now is 303.0 secs Computing kpt #: 117 total cpu time spent up to now is 305.2 secs Computing kpt #: 118 total cpu time spent up to now is 307.4 secs Computing kpt #: 119 total cpu time spent up to now is 310.3 secs Computing kpt #: 120 total cpu time spent up to now is 314.4 secs Computing kpt #: 121 total cpu time spent up to now is 316.6 secs Computing kpt #: 122 total cpu time spent up to now is 318.9 secs Computing kpt #: 123 total cpu time spent up to now is 321.4 secs Computing kpt #: 124 total cpu time spent up to now is 323.6 secs Computing kpt #: 125 total cpu time spent up to now is 325.6 secs Computing kpt #: 126 total cpu time spent up to now is 327.6 secs Computing kpt #: 127 total cpu time spent up to now is 329.5 secs Computing kpt #: 128 total cpu time spent up to now is 331.5 secs Computing kpt #: 129 total cpu time spent up to now is 333.9 secs Computing kpt #: 130 total cpu time spent up to now is 336.0 secs Computing kpt #: 131 total cpu time spent up to now is 338.9 secs Computing kpt #: 132 total cpu time spent up to now is 340.9 secs Computing kpt #: 133 total cpu time spent up to now is 342.7 secs Computing kpt #: 134 total cpu time spent up to now is 344.3 secs Computing kpt #: 135 total cpu time spent up to now is 346.0 secs Computing kpt #: 136 total cpu time spent up to now is 348.2 secs Computing kpt #: 137 total cpu time spent up to now is 351.2 secs Computing kpt #: 138 total cpu time spent up to now is 353.5 secs Computing kpt #: 139 total cpu time spent up to now is 358.0 secs Computing kpt #: 140 total cpu time spent up to now is 359.9 secs Computing kpt #: 141 total cpu time spent up to now is 361.9 secs Computing kpt #: 142 total cpu time spent up to now is 364.0 secs Computing kpt #: 143 total cpu time spent up to now is 366.1 secs Computing kpt #: 144 total cpu time spent up to now is 368.2 secs Computing kpt #: 145 total cpu time spent up to now is 370.4 secs Computing kpt #: 146 total cpu time spent up to now is 372.4 secs Computing kpt #: 147 total cpu time spent up to now is 374.6 secs Computing kpt #: 148 total cpu time spent up to now is 376.5 secs Computing kpt #: 149 total cpu time spent up to now is 378.3 secs Computing kpt #: 150 total cpu time spent up to now is 380.1 secs Computing kpt #: 151 total cpu time spent up to now is 381.8 secs Computing kpt #: 152 total cpu time spent up to now is 383.5 secs Computing kpt #: 153 total cpu time spent up to now is 385.2 secs Computing kpt #: 154 total cpu time spent up to now is 386.8 secs Computing kpt #: 155 total cpu time spent up to now is 388.3 secs Computing kpt #: 156 total cpu time spent up to now is 390.0 secs Computing kpt #: 157 total cpu time spent up to now is 391.9 secs Computing kpt #: 158 total cpu time spent up to now is 394.3 secs Computing kpt #: 159 total cpu time spent up to now is 396.1 secs Computing kpt #: 160 total cpu time spent up to now is 397.9 secs Computing kpt #: 161 total cpu time spent up to now is 400.0 secs Computing kpt #: 162 total cpu time spent up to now is 402.1 secs Computing kpt #: 163 total cpu time spent up to now is 404.2 secs Computing kpt #: 164 total cpu time spent up to now is 406.2 secs Computing kpt #: 165 total cpu time spent up to now is 408.4 secs Computing kpt #: 166 total cpu time spent up to now is 410.2 secs Computing kpt #: 167 total cpu time spent up to now is 412.0 secs Computing kpt #: 168 total cpu time spent up to now is 413.6 secs Computing kpt #: 169 total cpu time spent up to now is 415.2 secs Computing kpt #: 170 total cpu time spent up to now is 417.0 secs Computing kpt #: 171 total cpu time spent up to now is 418.9 secs Computing kpt #: 172 total cpu time spent up to now is 420.9 secs Computing kpt #: 173 total cpu time spent up to now is 423.0 secs Computing kpt #: 174 total cpu time spent up to now is 425.5 secs Computing kpt #: 175 total cpu time spent up to now is 427.2 secs Computing kpt #: 176 total cpu time spent up to now is 429.2 secs Computing kpt #: 177 total cpu time spent up to now is 431.6 secs Computing kpt #: 178 total cpu time spent up to now is 434.0 secs Computing kpt #: 179 total cpu time spent up to now is 436.4 secs Computing kpt #: 180 total cpu time spent up to now is 438.2 secs Computing kpt #: 181 total cpu time spent up to now is 439.8 secs Computing kpt #: 182 total cpu time spent up to now is 441.4 secs Computing kpt #: 183 total cpu time spent up to now is 443.0 secs Computing kpt #: 184 total cpu time spent up to now is 444.6 secs Computing kpt #: 185 total cpu time spent up to now is 446.1 secs Computing kpt #: 186 total cpu time spent up to now is 447.7 secs Computing kpt #: 187 total cpu time spent up to now is 449.3 secs Computing kpt #: 188 total cpu time spent up to now is 451.0 secs Computing kpt #: 189 total cpu time spent up to now is 452.5 secs Computing kpt #: 190 total cpu time spent up to now is 454.1 secs Computing kpt #: 191 total cpu time spent up to now is 455.8 secs Computing kpt #: 192 total cpu time spent up to now is 458.0 secs Computing kpt #: 193 total cpu time spent up to now is 460.0 secs Computing kpt #: 194 total cpu time spent up to now is 462.6 secs Computing kpt #: 195 total cpu time spent up to now is 464.9 secs Computing kpt #: 196 total cpu time spent up to now is 467.1 secs Computing kpt #: 197 total cpu time spent up to now is 469.6 secs Computing kpt #: 198 total cpu time spent up to now is 471.6 secs Computing kpt #: 199 total cpu time spent up to now is 473.6 secs Computing kpt #: 200 total cpu time spent up to now is 475.4 secs Computing kpt #: 201 total cpu time spent up to now is 477.1 secs Computing kpt #: 202 total cpu time spent up to now is 478.9 secs Computing kpt #: 203 total cpu time spent up to now is 480.6 secs Computing kpt #: 204 total cpu time spent up to now is 482.4 secs Computing kpt #: 205 total cpu time spent up to now is 485.1 secs Computing kpt #: 206 total cpu time spent up to now is 487.0 secs Computing kpt #: 207 total cpu time spent up to now is 488.9 secs Computing kpt #: 208 total cpu time spent up to now is 490.7 secs Computing kpt #: 209 total cpu time spent up to now is 492.7 secs Computing kpt #: 210 total cpu time spent up to now is 494.5 secs Computing kpt #: 211 total cpu time spent up to now is 496.4 secs Computing kpt #: 212 total cpu time spent up to now is 498.5 secs Computing kpt #: 213 total cpu time spent up to now is 500.6 secs Computing kpt #: 214 total cpu time spent up to now is 502.6 secs Computing kpt #: 215 total cpu time spent up to now is 504.7 secs Computing kpt #: 216 total cpu time spent up to now is 506.5 secs Computing kpt #: 217 total cpu time spent up to now is 508.0 secs Computing kpt #: 218 total cpu time spent up to now is 509.6 secs Computing kpt #: 219 total cpu time spent up to now is 511.1 secs Computing kpt #: 220 total cpu time spent up to now is 512.6 secs Computing kpt #: 221 total cpu time spent up to now is 514.1 secs Computing kpt #: 222 total cpu time spent up to now is 515.6 secs Computing kpt #: 223 total cpu time spent up to now is 517.8 secs Computing kpt #: 224 total cpu time spent up to now is 520.5 secs Computing kpt #: 225 total cpu time spent up to now is 522.1 secs Computing kpt #: 226 total cpu time spent up to now is 523.7 secs Computing kpt #: 227 total cpu time spent up to now is 525.4 secs Computing kpt #: 228 total cpu time spent up to now is 526.8 secs Computing kpt #: 229 total cpu time spent up to now is 528.3 secs Computing kpt #: 230 total cpu time spent up to now is 529.7 secs Computing kpt #: 231 total cpu time spent up to now is 531.2 secs Computing kpt #: 232 total cpu time spent up to now is 533.2 secs Computing kpt #: 233 total cpu time spent up to now is 535.5 secs Computing kpt #: 234 total cpu time spent up to now is 537.6 secs Computing kpt #: 235 total cpu time spent up to now is 539.4 secs Computing kpt #: 236 total cpu time spent up to now is 541.0 secs Computing kpt #: 237 total cpu time spent up to now is 542.7 secs Computing kpt #: 238 total cpu time spent up to now is 544.4 secs Computing kpt #: 239 total cpu time spent up to now is 546.5 secs Computing kpt #: 240 total cpu time spent up to now is 549.6 secs Computing kpt #: 241 total cpu time spent up to now is 551.6 secs Computing kpt #: 242 total cpu time spent up to now is 553.1 secs Computing kpt #: 243 total cpu time spent up to now is 554.4 secs Computing kpt #: 244 total cpu time spent up to now is 555.8 secs Computing kpt #: 245 total cpu time spent up to now is 557.2 secs Computing kpt #: 246 total cpu time spent up to now is 558.7 secs Computing kpt #: 247 total cpu time spent up to now is 560.1 secs Computing kpt #: 248 total cpu time spent up to now is 561.7 secs Computing kpt #: 249 total cpu time spent up to now is 563.4 secs Computing kpt #: 250 total cpu time spent up to now is 566.1 secs Computing kpt #: 251 c_bands: 2 eigenvalues not converged total cpu time spent up to now is 569.7 secs Computing kpt #: 252 total cpu time spent up to now is 572.5 secs Computing kpt #: 253 total cpu time spent up to now is 575.3 secs Computing kpt #: 254 total cpu time spent up to now is 578.0 secs Computing kpt #: 255 total cpu time spent up to now is 580.7 secs Computing kpt #: 256 total cpu time spent up to now is 584.2 secs Computing kpt #: 257 total cpu time spent up to now is 586.2 secs Computing kpt #: 258 total cpu time spent up to now is 588.1 secs Computing kpt #: 259 total cpu time spent up to now is 589.8 secs Computing kpt #: 260 total cpu time spent up to now is 591.6 secs Computing kpt #: 261 total cpu time spent up to now is 593.4 secs Computing kpt #: 262 total cpu time spent up to now is 595.3 secs Computing kpt #: 263 total cpu time spent up to now is 597.6 secs Computing kpt #: 264 total cpu time spent up to now is 599.7 secs Computing kpt #: 265 total cpu time spent up to now is 602.0 secs Computing kpt #: 266 total cpu time spent up to now is 603.8 secs Computing kpt #: 267 total cpu time spent up to now is 605.5 secs Computing kpt #: 268 total cpu time spent up to now is 607.2 secs Computing kpt #: 269 total cpu time spent up to now is 608.9 secs Computing kpt #: 270 total cpu time spent up to now is 610.7 secs Computing kpt #: 271 total cpu time spent up to now is 612.7 secs Computing kpt #: 272 total cpu time spent up to now is 614.5 secs Computing kpt #: 273 total cpu time spent up to now is 616.3 secs Computing kpt #: 274 total cpu time spent up to now is 618.1 secs Computing kpt #: 275 total cpu time spent up to now is 619.8 secs Computing kpt #: 276 total cpu time spent up to now is 621.5 secs Computing kpt #: 277 total cpu time spent up to now is 623.9 secs Computing kpt #: 278 total cpu time spent up to now is 626.2 secs Computing kpt #: 279 total cpu time spent up to now is 628.0 secs Computing kpt #: 280 total cpu time spent up to now is 629.8 secs Computing kpt #: 281 total cpu time spent up to now is 631.6 secs Computing kpt #: 282 total cpu time spent up to now is 633.3 secs Computing kpt #: 283 total cpu time spent up to now is 635.1 secs Computing kpt #: 284 total cpu time spent up to now is 637.3 secs Computing kpt #: 285 total cpu time spent up to now is 640.3 secs Computing kpt #: 286 total cpu time spent up to now is 642.0 secs Computing kpt #: 287 total cpu time spent up to now is 643.6 secs Computing kpt #: 288 total cpu time spent up to now is 645.1 secs Computing kpt #: 289 total cpu time spent up to now is 647.1 secs Computing kpt #: 290 total cpu time spent up to now is 649.3 secs Computing kpt #: 291 total cpu time spent up to now is 651.2 secs Computing kpt #: 292 total cpu time spent up to now is 652.9 secs Computing kpt #: 293 total cpu time spent up to now is 655.8 secs Computing kpt #: 294 total cpu time spent up to now is 657.5 secs Computing kpt #: 295 total cpu time spent up to now is 659.2 secs Computing kpt #: 296 total cpu time spent up to now is 660.9 secs Computing kpt #: 297 total cpu time spent up to now is 662.7 secs Computing kpt #: 298 total cpu time spent up to now is 664.5 secs Computing kpt #: 299 total cpu time spent up to now is 666.8 secs Computing kpt #: 300 total cpu time spent up to now is 669.2 secs Computing kpt #: 301 total cpu time spent up to now is 671.6 secs Computing kpt #: 302 total cpu time spent up to now is 674.1 secs Computing kpt #: 303 total cpu time spent up to now is 676.1 secs Computing kpt #: 304 total cpu time spent up to now is 678.1 secs Computing kpt #: 305 total cpu time spent up to now is 680.0 secs Computing kpt #: 306 total cpu time spent up to now is 681.9 secs Computing kpt #: 307 total cpu time spent up to now is 683.9 secs Computing kpt #: 308 total cpu time spent up to now is 687.0 secs Computing kpt #: 309 total cpu time spent up to now is 689.0 secs Computing kpt #: 310 total cpu time spent up to now is 691.0 secs Computing kpt #: 311 total cpu time spent up to now is 693.0 secs Computing kpt #: 312 total cpu time spent up to now is 694.9 secs Computing kpt #: 313 total cpu time spent up to now is 697.0 secs Computing kpt #: 314 total cpu time spent up to now is 699.0 secs Computing kpt #: 315 total cpu time spent up to now is 701.6 secs Computing kpt #: 316 total cpu time spent up to now is 705.8 secs Computing kpt #: 317 total cpu time spent up to now is 707.6 secs Computing kpt #: 318 total cpu time spent up to now is 709.6 secs Computing kpt #: 319 total cpu time spent up to now is 711.4 secs Computing kpt #: 320 total cpu time spent up to now is 713.3 secs Computing kpt #: 321 total cpu time spent up to now is 715.3 secs Computing kpt #: 322 total cpu time spent up to now is 717.2 secs Computing kpt #: 323 total cpu time spent up to now is 719.1 secs Computing kpt #: 324 total cpu time spent up to now is 721.2 secs Computing kpt #: 325 total cpu time spent up to now is 723.1 secs Computing kpt #: 326 total cpu time spent up to now is 725.0 secs Computing kpt #: 327 total cpu time spent up to now is 726.9 secs Computing kpt #: 328 total cpu time spent up to now is 728.8 secs Computing kpt #: 329 total cpu time spent up to now is 731.1 secs Computing kpt #: 330 total cpu time spent up to now is 733.7 secs Computing kpt #: 331 total cpu time spent up to now is 735.4 secs Computing kpt #: 332 total cpu time spent up to now is 737.3 secs Computing kpt #: 333 total cpu time spent up to now is 739.0 secs Computing kpt #: 334 total cpu time spent up to now is 740.9 secs Computing kpt #: 335 total cpu time spent up to now is 743.1 secs Computing kpt #: 336 total cpu time spent up to now is 745.6 secs Computing kpt #: 337 total cpu time spent up to now is 747.4 secs Computing kpt #: 338 total cpu time spent up to now is 749.2 secs Computing kpt #: 339 total cpu time spent up to now is 751.6 secs Computing kpt #: 340 total cpu time spent up to now is 753.5 secs Computing kpt #: 341 total cpu time spent up to now is 755.6 secs Computing kpt #: 342 total cpu time spent up to now is 758.6 secs Computing kpt #: 343 total cpu time spent up to now is 761.5 secs Computing kpt #: 344 total cpu time spent up to now is 763.7 secs Computing kpt #: 345 total cpu time spent up to now is 765.8 secs Computing kpt #: 346 total cpu time spent up to now is 767.8 secs Computing kpt #: 347 total cpu time spent up to now is 769.7 secs Computing kpt #: 348 total cpu time spent up to now is 771.6 secs Computing kpt #: 349 total cpu time spent up to now is 773.5 secs Computing kpt #: 350 total cpu time spent up to now is 775.5 secs Computing kpt #: 351 total cpu time spent up to now is 777.9 secs Computing kpt #: 352 total cpu time spent up to now is 781.1 secs Computing kpt #: 353 total cpu time spent up to now is 782.9 secs Computing kpt #: 354 total cpu time spent up to now is 784.7 secs Computing kpt #: 355 total cpu time spent up to now is 786.5 secs Computing kpt #: 356 total cpu time spent up to now is 788.4 secs Computing kpt #: 357 total cpu time spent up to now is 790.2 secs Computing kpt #: 358 total cpu time spent up to now is 792.4 secs Computing kpt #: 359 total cpu time spent up to now is 794.6 secs Computing kpt #: 360 total cpu time spent up to now is 798.2 secs Computing kpt #: 361 total cpu time spent up to now is 800.0 secs Computing kpt #: 362 total cpu time spent up to now is 801.7 secs Computing kpt #: 363 total cpu time spent up to now is 803.4 secs Computing kpt #: 364 total cpu time spent up to now is 805.1 secs Computing kpt #: 365 total cpu time spent up to now is 806.7 secs Computing kpt #: 366 total cpu time spent up to now is 808.2 secs Computing kpt #: 367 total cpu time spent up to now is 810.0 secs Computing kpt #: 368 total cpu time spent up to now is 813.0 secs Computing kpt #: 369 total cpu time spent up to now is 815.0 secs Computing kpt #: 370 total cpu time spent up to now is 816.7 secs Computing kpt #: 371 total cpu time spent up to now is 818.5 secs Computing kpt #: 372 total cpu time spent up to now is 820.9 secs Computing kpt #: 373 total cpu time spent up to now is 823.3 secs Computing kpt #: 374 total cpu time spent up to now is 825.3 secs Computing kpt #: 375 total cpu time spent up to now is 826.9 secs Computing kpt #: 376 total cpu time spent up to now is 828.5 secs Computing kpt #: 377 total cpu time spent up to now is 830.1 secs Computing kpt #: 378 total cpu time spent up to now is 831.7 secs Computing kpt #: 379 total cpu time spent up to now is 833.3 secs Computing kpt #: 380 total cpu time spent up to now is 834.8 secs Computing kpt #: 381 total cpu time spent up to now is 836.5 secs Computing kpt #: 382 total cpu time spent up to now is 839.1 secs Computing kpt #: 383 total cpu time spent up to now is 840.7 secs Computing kpt #: 384 total cpu time spent up to now is 842.1 secs Computing kpt #: 385 total cpu time spent up to now is 843.6 secs Computing kpt #: 386 total cpu time spent up to now is 845.1 secs Computing kpt #: 387 total cpu time spent up to now is 846.5 secs Computing kpt #: 388 total cpu time spent up to now is 848.0 secs Computing kpt #: 389 total cpu time spent up to now is 849.9 secs Computing kpt #: 390 total cpu time spent up to now is 851.3 secs Computing kpt #: 391 total cpu time spent up to now is 853.1 secs Computing kpt #: 392 total cpu time spent up to now is 854.7 secs Computing kpt #: 393 total cpu time spent up to now is 856.2 secs Computing kpt #: 394 total cpu time spent up to now is 857.7 secs Computing kpt #: 395 total cpu time spent up to now is 859.5 secs Computing kpt #: 396 total cpu time spent up to now is 861.1 secs Computing kpt #: 397 total cpu time spent up to now is 863.0 secs Computing kpt #: 398 total cpu time spent up to now is 864.8 secs Computing kpt #: 399 total cpu time spent up to now is 866.6 secs Computing kpt #: 400 total cpu time spent up to now is 868.4 secs Computing kpt #: 401 total cpu time spent up to now is 870.2 secs Computing kpt #: 402 total cpu time spent up to now is 872.2 secs Computing kpt #: 403 total cpu time spent up to now is 874.1 secs Computing kpt #: 404 total cpu time spent up to now is 876.4 secs Computing kpt #: 405 total cpu time spent up to now is 878.5 secs Computing kpt #: 406 total cpu time spent up to now is 880.8 secs Computing kpt #: 407 total cpu time spent up to now is 883.4 secs Computing kpt #: 408 total cpu time spent up to now is 885.5 secs Computing kpt #: 409 total cpu time spent up to now is 887.7 secs Computing kpt #: 410 total cpu time spent up to now is 890.0 secs Computing kpt #: 411 total cpu time spent up to now is 892.1 secs Computing kpt #: 412 total cpu time spent up to now is 894.0 secs Computing kpt #: 413 total cpu time spent up to now is 896.2 secs Computing kpt #: 414 total cpu time spent up to now is 898.2 secs Computing kpt #: 415 total cpu time spent up to now is 900.2 secs Computing kpt #: 416 total cpu time spent up to now is 902.3 secs Computing kpt #: 417 total cpu time spent up to now is 904.1 secs Computing kpt #: 418 total cpu time spent up to now is 905.9 secs Computing kpt #: 419 total cpu time spent up to now is 908.3 secs Computing kpt #: 420 total cpu time spent up to now is 910.1 secs ethr = 2.50E-11, avg # of iterations = 38.2 total cpu time spent up to now is 910.3 secs End of band structure calculation k = 0.0000 0.0000 0.0000 ( 3595 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3849 -15.3849 -15.3297 -15.3297 -13.7048 -13.7048 -13.6086 -13.6086 -13.5912 -13.5912 -13.5558 -13.5558 0.5925 0.5925 2.5309 2.5309 4.4958 4.4958 9.0480 9.0480 9.6913 9.6913 9.7887 9.7887 9.8580 9.8580 10.1376 10.1376 10.2539 10.2539 10.6577 10.6577 10.7714 10.7714 12.7900 12.7900 13.6704 13.6704 14.0345 14.0345 14.0959 14.0959 14.1547 14.1547 k = 0.0059 0.0234-0.0000 ( 3611 PWs) bands (ev): -36.0664 -36.0664 -36.0530 -36.0530 -15.3849 -15.3849 -15.3298 -15.3298 -13.7048 -13.7048 -13.6088 -13.6088 -13.5913 -13.5913 -13.5558 -13.5558 0.5942 0.5942 2.5316 2.5316 4.4976 4.4976 9.0345 9.0345 9.6906 9.6906 9.7867 9.7867 9.8592 9.8592 10.1467 10.1467 10.2460 10.2460 10.6639 10.6639 10.7690 10.7690 12.7945 12.7945 13.6724 13.6724 14.0388 14.0388 14.0755 14.0755 14.1562 14.1562 k = 0.0118 0.0469-0.0000 ( 3611 PWs) bands (ev): -36.0663 -36.0663 -36.0529 -36.0529 -15.3851 -15.3851 -15.3299 -15.3299 -13.7049 -13.7049 -13.6092 -13.6092 -13.5916 -13.5916 -13.5557 -13.5557 0.5991 0.5991 2.5337 2.5337 4.5029 4.5029 8.9951 8.9951 9.6882 9.6882 9.7823 9.7823 9.8629 9.8629 10.1714 10.1714 10.2240 10.2240 10.6812 10.6812 10.7617 10.7617 12.8077 12.8077 13.6782 13.6782 14.0211 14.0211 14.0516 14.0516 14.1584 14.1584 k = 0.0177 0.0703-0.0000 ( 3615 PWs) bands (ev): -36.0663 -36.0663 -36.0529 -36.0529 -15.3853 -15.3853 -15.3303 -15.3303 -13.7050 -13.7050 -13.6100 -13.6100 -13.5921 -13.5921 -13.5557 -13.5557 0.6072 0.6072 2.5371 2.5371 4.5118 4.5118 8.9322 8.9322 9.6839 9.6839 9.7784 9.7784 9.8691 9.8691 10.1886 10.1886 10.2097 10.2097 10.7065 10.7065 10.7497 10.7497 12.8285 12.8285 13.6879 13.6879 13.9427 13.9427 14.0723 14.0723 14.1601 14.1601 k = 0.0236 0.0938-0.0000 ( 3611 PWs) bands (ev): -36.0662 -36.0662 -36.0527 -36.0527 -15.3856 -15.3856 -15.3307 -15.3307 -13.7052 -13.7052 -13.6112 -13.6112 -13.5928 -13.5928 -13.5556 -13.5556 0.6186 0.6186 2.5420 2.5420 4.5242 4.5242 8.8492 8.8492 9.6767 9.6767 9.7775 9.7775 9.8778 9.8778 10.1500 10.1500 10.2502 10.2502 10.7320 10.7320 10.7380 10.7380 12.8555 12.8555 13.7012 13.7012 13.8486 13.8486 14.0992 14.0992 14.1625 14.1625 k = 0.0295 0.1172-0.0000 ( 3619 PWs) bands (ev): -36.0662 -36.0662 -36.0527 -36.0527 -15.3860 -15.3860 -15.3313 -15.3313 -13.7054 -13.7054 -13.6126 -13.6126 -13.5936 -13.5936 -13.5555 -13.5555 0.6333 0.6333 2.5481 2.5481 4.5401 4.5401 8.7497 8.7497 9.6655 9.6655 9.7805 9.7805 9.8890 9.8890 10.1072 10.1072 10.2938 10.2938 10.7120 10.7120 10.7700 10.7700 12.8867 12.8867 13.7181 13.7181 13.7451 13.7451 14.1265 14.1265 14.1693 14.1693 k = 0.0355 0.1407-0.0000 ( 3617 PWs) bands (ev): -36.0660 -36.0660 -36.0525 -36.0525 -15.3864 -15.3864 -15.3320 -15.3320 -13.7057 -13.7057 -13.6143 -13.6143 -13.5947 -13.5947 -13.5554 -13.5554 0.6512 0.6512 2.5557 2.5557 4.5594 4.5594 8.6372 8.6372 9.6484 9.6484 9.7875 9.7875 9.9028 9.9028 10.0644 10.0644 10.3372 10.3372 10.6871 10.6871 10.8042 10.8042 12.9201 12.9201 13.6362 13.6362 13.7382 13.7382 14.1418 14.1418 14.1880 14.1880 k = 0.0414 0.1641-0.0000 ( 3617 PWs) bands (ev): -36.0659 -36.0659 -36.0524 -36.0524 -15.3869 -15.3869 -15.3328 -15.3328 -13.7060 -13.7060 -13.6164 -13.6164 -13.5958 -13.5958 -13.5553 -13.5553 0.6723 0.6723 2.5645 2.5645 4.5822 4.5822 8.5144 8.5144 9.6236 9.6236 9.7983 9.7983 9.9190 9.9190 10.0251 10.0251 10.3788 10.3788 10.6584 10.6584 10.8388 10.8388 12.9534 12.9534 13.5246 13.5246 13.7614 13.7614 14.1451 14.1451 14.2094 14.2094 k = 0.0473 0.1875-0.0000 ( 3619 PWs) bands (ev): -36.0657 -36.0657 -36.0522 -36.0522 -15.3876 -15.3876 -15.3337 -15.3337 -13.7064 -13.7064 -13.6187 -13.6187 -13.5971 -13.5971 -13.5551 -13.5551 0.6966 0.6966 2.5746 2.5746 4.6084 4.6084 8.3837 8.3837 9.5889 9.5889 9.8126 9.8126 9.9376 9.9376 9.9919 9.9919 10.4176 10.4176 10.6263 10.6263 10.8733 10.8733 12.9849 12.9849 13.4120 13.4120 13.7875 13.7875 14.1437 14.1437 14.2144 14.2144 k = 0.0532 0.2110-0.0000 ( 3617 PWs) bands (ev): -36.0656 -36.0656 -36.0520 -36.0520 -15.3882 -15.3882 -15.3347 -15.3347 -13.7069 -13.7069 -13.6213 -13.6213 -13.5985 -13.5985 -13.5549 -13.5549 0.7241 0.7241 2.5860 2.5860 4.6379 4.6379 8.2467 8.2467 9.5435 9.5435 9.8299 9.8299 9.9580 9.9580 9.9671 9.9671 10.4533 10.4533 10.5913 10.5913 10.9072 10.9072 13.0128 13.0128 13.2995 13.2995 13.8161 13.8161 14.1386 14.1386 14.1967 14.1967 k = 0.0591 0.2344-0.0000 ( 3609 PWs) bands (ev): -36.0653 -36.0653 -36.0517 -36.0517 -15.3890 -15.3890 -15.3359 -15.3359 -13.7075 -13.7075 -13.6242 -13.6242 -13.6000 -13.6000 -13.5546 -13.5546 0.7547 0.7547 2.5986 2.5986 4.6707 4.6707 8.1051 8.1051 9.4877 9.4877 9.8498 9.8498 9.9481 9.9481 9.9829 9.9829 10.4855 10.4855 10.5536 10.5536 10.9404 10.9404 13.0358 13.0358 13.1883 13.1883 13.8469 13.8469 14.1238 14.1238 14.1671 14.1671 k = 0.0650 0.2579-0.0000 ( 3609 PWs) bands (ev): -36.0651 -36.0651 -36.0515 -36.0515 -15.3898 -15.3898 -15.3371 -15.3371 -13.7082 -13.7082 -13.6273 -13.6273 -13.6016 -13.6016 -13.5543 -13.5543 0.7884 0.7884 2.6123 2.6123 4.7066 4.7066 7.9598 7.9598 9.4227 9.4227 9.8719 9.8719 9.9373 9.9373 10.0089 10.0089 10.5135 10.5135 10.5142 10.5142 10.9727 10.9727 13.0503 13.0503 13.0812 13.0812 13.8798 13.8798 14.0854 14.0854 14.1480 14.1480 k = 0.0709 0.2813-0.0000 ( 3601 PWs) bands (ev): -36.0648 -36.0648 -36.0513 -36.0513 -15.3907 -15.3907 -15.3385 -15.3385 -13.7090 -13.7090 -13.6306 -13.6306 -13.6032 -13.6032 -13.5540 -13.5540 0.8252 0.8252 2.6271 2.6271 4.7456 4.7456 7.8120 7.8120 9.3504 9.3504 9.8954 9.8954 9.9325 9.9325 10.0375 10.0375 10.4718 10.4718 10.5387 10.5387 11.0041 11.0041 12.9681 12.9681 13.0665 13.0665 13.9144 13.9144 14.0323 14.0323 14.1371 14.1371 k = 0.0768 0.3048-0.0000 ( 3601 PWs) bands (ev): -36.0645 -36.0645 -36.0510 -36.0510 -15.3917 -15.3917 -15.3399 -15.3399 -13.7099 -13.7099 -13.6342 -13.6342 -13.6049 -13.6049 -13.5536 -13.5536 0.8650 0.8650 2.6430 2.6430 4.7877 4.7877 7.6625 7.6625 9.2725 9.2725 9.9156 9.9156 9.9366 9.9366 10.0686 10.0686 10.4285 10.4285 10.5592 10.5592 11.0346 11.0346 12.8625 12.8625 13.0706 13.0706 13.9504 13.9504 13.9772 13.9772 14.1267 14.1267 k = 0.0827 0.3282-0.0000 ( 3607 PWs) bands (ev): -36.0642 -36.0642 -36.0508 -36.0508 -15.3927 -15.3927 -15.3414 -15.3414 -13.7109 -13.7109 -13.6379 -13.6379 -13.6065 -13.6065 -13.5533 -13.5533 0.9079 0.9079 2.6600 2.6600 4.8325 4.8325 7.5118 7.5118 9.1902 9.1902 9.9230 9.9230 9.9577 9.9577 10.1021 10.1021 10.3840 10.3840 10.5753 10.5753 11.0642 11.0642 12.7590 12.7590 13.0683 13.0683 13.9252 13.9252 13.9874 13.9874 14.1150 14.1150 k = 0.0886 0.3516-0.0000 ( 3601 PWs) bands (ev): -36.0639 -36.0639 -36.0505 -36.0505 -15.3937 -15.3937 -15.3430 -15.3430 -13.7121 -13.7121 -13.6418 -13.6418 -13.6081 -13.6081 -13.5528 -13.5528 0.9537 0.9537 2.6778 2.6778 4.8801 4.8801 7.3606 7.3606 9.1046 9.1046 9.9262 9.9262 9.9863 9.9863 10.1380 10.1380 10.3386 10.3386 10.5865 10.5865 11.0929 11.0929 12.6579 12.6579 13.0596 13.0596 13.8795 13.8795 14.0247 14.0247 14.1024 14.1024 k = 0.0945 0.3751-0.0000 ( 3597 PWs) bands (ev): -36.0636 -36.0636 -36.0502 -36.0502 -15.3948 -15.3948 -15.3447 -15.3447 -13.7134 -13.7134 -13.6459 -13.6459 -13.6096 -13.6096 -13.5524 -13.5524 1.0024 1.0024 2.6965 2.6965 4.9302 4.9302 7.2096 7.2096 9.0165 9.0165 9.9292 9.9292 10.0172 10.0172 10.1763 10.1763 10.2928 10.2928 10.5923 10.5923 11.1207 11.1207 12.5594 12.5594 13.0455 13.0455 13.8415 13.8415 14.0600 14.0600 14.0903 14.0903 k = 0.1004 0.3985-0.0000 ( 3593 PWs) bands (ev): -36.0633 -36.0633 -36.0499 -36.0499 -15.3960 -15.3960 -15.3464 -15.3464 -13.7149 -13.7149 -13.6500 -13.6500 -13.6111 -13.6111 -13.5520 -13.5520 1.0540 1.0540 2.7161 2.7161 4.9825 4.9825 7.0592 7.0592 8.9265 8.9265 9.9322 9.9322 10.0495 10.0495 10.2168 10.2168 10.2469 10.2469 10.5921 10.5921 11.1478 11.1478 12.4638 12.4638 13.0274 13.0274 13.8120 13.8120 14.0740 14.0740 14.0913 14.0913 k = 0.1064 0.4220-0.0000 ( 3585 PWs) bands (ev): -36.0629 -36.0629 -36.0496 -36.0496 -15.3972 -15.3972 -15.3482 -15.3482 -13.7164 -13.7164 -13.6543 -13.6543 -13.6124 -13.6124 -13.5515 -13.5515 1.1084 1.1084 2.7364 2.7364 5.0367 5.0367 6.9100 6.9100 8.8352 8.8352 9.9351 9.9351 10.0827 10.0827 10.2003 10.2003 10.2604 10.2604 10.5855 10.5855 11.1743 11.1743 12.3710 12.3710 13.0075 13.0075 13.7908 13.7908 14.0602 14.0602 14.1005 14.1005 k = 0.1123 0.4454-0.0000 ( 3589 PWs) bands (ev): -36.0626 -36.0626 -36.0493 -36.0493 -15.3984 -15.3984 -15.3500 -15.3500 -13.7181 -13.7181 -13.6586 -13.6586 -13.6137 -13.6137 -13.5510 -13.5510 1.1655 1.1655 2.7573 2.7573 5.0924 5.0924 6.7627 6.7627 8.7430 8.7430 9.9373 9.9373 10.1166 10.1166 10.1546 10.1546 10.3058 10.3058 10.5717 10.5717 11.2004 11.2004 12.2813 12.2813 12.9881 12.9881 13.7774 13.7774 14.0415 14.0415 14.1057 14.1057 k = 0.1182 0.4689-0.0000 ( 3597 PWs) bands (ev): -36.0623 -36.0623 -36.0490 -36.0490 -15.3996 -15.3996 -15.3518 -15.3518 -13.7200 -13.7200 -13.6629 -13.6629 -13.6149 -13.6149 -13.5505 -13.5505 1.2254 1.2254 2.7788 2.7788 5.1487 5.1487 6.6182 6.6182 8.6504 8.6504 9.9388 9.9388 10.1093 10.1093 10.1508 10.1508 10.3536 10.3536 10.5506 10.5506 11.2263 11.2263 12.1945 12.1945 12.9716 12.9716 13.7708 13.7708 14.0184 14.0184 14.1145 14.1145 k = 0.1241 0.4923-0.0000 ( 3595 PWs) bands (ev): -36.0619 -36.0619 -36.0487 -36.0487 -15.4008 -15.4008 -15.3537 -15.3537 -13.7219 -13.7219 -13.6673 -13.6673 -13.6159 -13.6159 -13.5500 -13.5500 1.2879 1.2879 2.8008 2.8008 5.2046 5.2046 6.4777 6.4777 8.5577 8.5577 9.9391 9.9391 10.0648 10.0648 10.1846 10.1846 10.4037 10.4037 10.5220 10.5220 11.2521 11.2521 12.1108 12.1108 12.9603 12.9603 13.7701 13.7701 13.9909 13.9909 14.1282 14.1282 k = 0.1300 0.5158-0.0000 ( 3599 PWs) bands (ev): -36.0616 -36.0616 -36.0484 -36.0484 -15.4021 -15.4021 -15.3556 -15.3556 -13.7240 -13.7240 -13.6716 -13.6716 -13.6169 -13.6169 -13.5495 -13.5495 1.3530 1.3530 2.8232 2.8232 5.2583 5.2583 6.3432 6.3432 8.4651 8.4651 9.9382 9.9382 10.0213 10.0213 10.2171 10.2171 10.4561 10.4561 10.4867 10.4867 11.2782 11.2782 12.0302 12.0302 12.9558 12.9558 13.7746 13.7746 13.9591 13.9591 14.1463 14.1463 k = 0.1359 0.5392-0.0000 ( 3599 PWs) bands (ev): -36.0613 -36.0613 -36.0481 -36.0481 -15.4033 -15.4033 -15.3575 -15.3575 -13.7261 -13.7261 -13.6760 -13.6760 -13.6177 -13.6177 -13.5490 -13.5490 1.4206 1.4206 2.8459 2.8459 5.3065 5.3065 6.2178 6.2178 8.3732 8.3732 9.9358 9.9358 9.9789 9.9789 10.2456 10.2456 10.4472 10.4472 10.5108 10.5108 11.3048 11.3048 11.9528 11.9528 12.9595 12.9595 13.7835 13.7835 13.9229 13.9229 14.1677 14.1677 k = 0.1418 0.5626-0.0000 ( 3595 PWs) bands (ev): -36.0609 -36.0609 -36.0477 -36.0477 -15.4046 -15.4046 -15.3594 -15.3594 -13.7283 -13.7283 -13.6802 -13.6802 -13.6184 -13.6184 -13.5485 -13.5485 1.4905 1.4905 2.8689 2.8689 5.3435 5.3435 6.1074 6.1074 8.2820 8.2820 9.9311 9.9311 9.9385 9.9385 10.2621 10.2621 10.4116 10.4116 10.5677 10.5677 11.3320 11.3320 11.8785 11.8785 12.9722 12.9722 13.7962 13.7962 13.8824 13.8824 14.1911 14.1911 k = 0.1477 0.5861-0.0000 ( 3595 PWs) bands (ev): -36.0606 -36.0606 -36.0474 -36.0474 -15.4058 -15.4058 -15.3613 -15.3613 -13.7305 -13.7305 -13.6844 -13.6844 -13.6189 -13.6189 -13.5480 -13.5480 1.5627 1.5627 2.8920 2.8920 5.3599 5.3599 6.0214 6.0214 8.1919 8.1919 9.8976 9.8976 9.9269 9.9269 10.2481 10.2481 10.3988 10.3988 10.6268 10.6268 11.3600 11.3600 11.8074 11.8074 12.9941 12.9941 13.8113 13.8113 13.8387 13.8387 14.2144 14.2144 k = 0.1536 0.6095-0.0000 ( 3595 PWs) bands (ev): -36.0603 -36.0603 -36.0471 -36.0471 -15.4070 -15.4070 -15.3631 -15.3631 -13.7327 -13.7327 -13.6885 -13.6885 -13.6194 -13.6194 -13.5475 -13.5475 1.6371 1.6371 2.9152 2.9152 5.3439 5.3439 5.9716 5.9716 8.1032 8.1032 9.8596 9.8596 9.9198 9.9198 10.1988 10.1988 10.4143 10.4143 10.6881 10.6881 11.3890 11.3890 11.7396 11.7396 13.0252 13.0252 13.7859 13.7859 13.8345 13.8345 14.2349 14.2349 k = 0.1595 0.6330-0.0000 ( 3591 PWs) bands (ev): -36.0600 -36.0600 -36.0468 -36.0468 -15.4082 -15.4082 -15.3649 -15.3649 -13.7350 -13.7350 -13.6925 -13.6925 -13.6198 -13.6198 -13.5470 -13.5470 1.7135 1.7135 2.9384 2.9384 5.2900 5.2900 5.9634 5.9634 8.0161 8.0161 9.8232 9.8232 9.9112 9.9112 10.1301 10.1301 10.4430 10.4430 10.7514 10.7514 11.4190 11.4190 11.6750 11.6750 13.0651 13.0651 13.7328 13.7328 13.8571 13.8571 14.2490 14.2490 k = 0.1654 0.6564-0.0000 ( 3597 PWs) bands (ev): -36.0597 -36.0597 -36.0466 -36.0466 -15.4093 -15.4093 -15.3667 -15.3667 -13.7372 -13.7372 -13.6963 -13.6963 -13.6200 -13.6200 -13.5466 -13.5466 1.7918 1.7918 2.9617 2.9617 5.2048 5.2048 5.9902 5.9902 7.9310 7.9310 9.7887 9.7887 9.9012 9.9012 10.0510 10.0510 10.4765 10.4765 10.8168 10.8168 11.4497 11.4497 11.6138 11.6138 13.1134 13.1134 13.6750 13.6750 13.8835 13.8835 14.2529 14.2529 k = 0.1713 0.6799-0.0000 ( 3593 PWs) bands (ev): -36.0593 -36.0593 -36.0463 -36.0463 -15.4104 -15.4104 -15.3684 -15.3684 -13.7393 -13.7393 -13.7000 -13.7000 -13.6202 -13.6202 -13.5462 -13.5462 1.8717 1.8717 2.9850 2.9850 5.1000 5.1000 6.0403 6.0403 7.8480 7.8480 9.7561 9.7561 9.8895 9.8895 9.9656 9.9656 10.5121 10.5121 10.8842 10.8842 11.4805 11.4805 11.5569 11.5569 13.1693 13.1693 13.6134 13.6134 13.9132 13.9132 14.2435 14.2435 k = 0.1773 0.7033-0.0000 ( 3595 PWs) bands (ev): -36.0591 -36.0591 -36.0461 -36.0461 -15.4115 -15.4115 -15.3700 -15.3700 -13.7414 -13.7414 -13.7035 -13.7035 -13.6204 -13.6204 -13.5458 -13.5458 1.9529 1.9529 3.0083 3.0083 4.9844 4.9844 6.1047 6.1047 7.7675 7.7675 9.7256 9.7256 9.8669 9.8669 9.8851 9.8851 10.5488 10.5488 10.9535 10.9535 11.4909 11.4909 11.5243 11.5243 13.2318 13.2318 13.5483 13.5483 13.9462 13.9462 14.2198 14.2198 k = 0.1832 0.7267-0.0000 ( 3589 PWs) bands (ev): -36.0588 -36.0588 -36.0458 -36.0458 -15.4125 -15.4125 -15.3716 -15.3716 -13.7434 -13.7434 -13.7068 -13.7068 -13.6204 -13.6204 -13.5455 -13.5455 2.0352 2.0352 3.0319 3.0319 4.8633 4.8633 6.1780 6.1780 7.6897 7.6897 9.6971 9.6971 9.7787 9.7787 9.8658 9.8658 10.5862 10.5862 11.0246 11.0246 11.4447 11.4447 11.5520 11.5520 13.3001 13.3001 13.4803 13.4803 13.9827 13.9827 14.1832 14.1832 k = 0.1891 0.7502-0.0000 ( 3593 PWs) bands (ev): -36.0585 -36.0585 -36.0456 -36.0456 -15.4134 -15.4134 -15.3730 -15.3730 -13.7453 -13.7453 -13.7098 -13.7098 -13.6204 -13.6204 -13.5451 -13.5451 2.1180 2.1180 3.0558 3.0558 4.7395 4.7395 6.2573 6.2573 7.6150 7.6150 9.6701 9.6701 9.6830 9.6830 9.8513 9.8513 10.6241 10.6241 11.0975 11.0975 11.3965 11.3965 11.5852 11.5852 13.3729 13.3729 13.4097 13.4097 14.0224 14.0224 14.1375 14.1375 k = 0.1950 0.7736-0.0000 ( 3591 PWs) bands (ev): -36.0583 -36.0583 -36.0454 -36.0454 -15.4142 -15.4142 -15.3744 -15.3744 -13.7471 -13.7471 -13.7127 -13.7127 -13.6204 -13.6204 -13.5448 -13.5448 2.2008 2.2008 3.0806 3.0806 4.6147 4.6147 6.3407 6.3407 7.5434 7.5434 9.5834 9.5834 9.6474 9.6474 9.8364 9.8364 10.6625 10.6625 11.1719 11.1719 11.3508 11.3508 11.6189 11.6189 13.3368 13.3368 13.4495 13.4495 14.0592 14.0592 14.0929 14.0929 k = 0.2009 0.7971-0.0000 ( 3591 PWs) bands (ev): -36.0581 -36.0581 -36.0452 -36.0452 -15.4150 -15.4150 -15.3756 -15.3756 -13.7487 -13.7487 -13.7153 -13.7153 -13.6204 -13.6204 -13.5446 -13.5446 2.2827 2.2827 3.1066 3.1066 4.4900 4.4900 6.4269 6.4269 7.4754 7.4754 9.4841 9.4841 9.6258 9.6258 9.8212 9.8212 10.7013 10.7013 11.2469 11.2469 11.3088 11.3088 11.6523 11.6523 13.2626 13.2626 13.5277 13.5277 14.0248 14.0248 14.1216 14.1216 k = 0.2068 0.8205-0.0000 ( 3584 PWs) bands (ev): -36.0579 -36.0579 -36.0450 -36.0450 -15.4157 -15.4157 -15.3768 -15.3768 -13.7501 -13.7501 -13.7176 -13.7176 -13.6203 -13.6203 -13.5444 -13.5444 2.3628 2.3628 3.1349 3.1349 4.3659 4.3659 6.5151 6.5151 7.4112 7.4112 9.3847 9.3847 9.6066 9.6066 9.8057 9.8057 10.7407 10.7407 11.2653 11.2653 11.3278 11.3278 11.6846 11.6846 13.1872 13.1872 13.6063 13.6063 13.9708 13.9708 14.1753 14.1753 k = 0.2127 0.8440-0.0000 ( 3580 PWs) bands (ev): -36.0577 -36.0577 -36.0448 -36.0448 -15.4163 -15.4163 -15.3778 -15.3778 -13.7514 -13.7514 -13.7197 -13.7197 -13.6202 -13.6202 -13.5442 -13.5442 2.4396 2.4396 3.1665 3.1665 4.2430 4.2430 6.6043 6.6043 7.3510 7.3510 9.2858 9.2858 9.5899 9.5899 9.7902 9.7902 10.7806 10.7806 11.2288 11.2288 11.4055 11.4055 11.7154 11.7154 13.1113 13.1113 13.6833 13.6833 13.9182 13.9182 14.2362 14.2362 k = 0.2186 0.8674-0.0000 ( 3584 PWs) bands (ev): -36.0576 -36.0576 -36.0447 -36.0447 -15.4168 -15.4168 -15.3787 -15.3787 -13.7525 -13.7525 -13.7215 -13.7215 -13.6201 -13.6201 -13.5441 -13.5441 2.5114 2.5114 3.2029 3.2029 4.1214 4.1214 6.6939 6.6939 7.2951 7.2951 9.1884 9.1884 9.5758 9.5758 9.7747 9.7747 10.8211 10.8211 11.1940 11.1940 11.4852 11.4852 11.7438 11.7438 13.0353 13.0353 13.7566 13.7566 13.8694 13.8694 14.3045 14.3045 k = 0.2245 0.8908-0.0000 ( 3582 PWs) bands (ev): -36.0575 -36.0575 -36.0446 -36.0446 -15.4172 -15.4172 -15.3795 -15.3795 -13.7534 -13.7534 -13.7230 -13.7230 -13.6199 -13.6199 -13.5440 -13.5440 2.5763 2.5763 3.2460 3.2460 4.0014 4.0014 6.7830 6.7830 7.2437 7.2437 9.0933 9.0933 9.5641 9.5641 9.7594 9.7594 10.8624 10.8624 11.1617 11.1617 11.5657 11.5657 11.7693 11.7693 12.9597 12.9597 13.8209 13.8209 13.8295 13.8295 14.3808 14.3808 k = 0.2304 0.9143-0.0000 ( 3582 PWs) bands (ev): -36.0574 -36.0574 -36.0445 -36.0445 -15.4175 -15.4175 -15.3801 -15.3801 -13.7540 -13.7540 -13.7243 -13.7243 -13.6198 -13.6198 -13.5440 -13.5440 2.6323 2.6323 3.2974 3.2974 3.8831 3.8831 6.8707 6.8707 7.1971 7.1971 9.0016 9.0016 9.5550 9.5550 9.7443 9.7443 10.9044 10.9044 11.1317 11.1317 11.6467 11.6467 11.7913 11.7913 12.8849 12.8849 13.7888 13.7888 13.8854 13.8854 14.4653 14.4653 k = 0.2363 0.9377-0.0000 ( 3586 PWs) bands (ev): -36.0573 -36.0573 -36.0445 -36.0445 -15.4178 -15.4178 -15.3806 -15.3806 -13.7545 -13.7545 -13.7252 -13.7252 -13.6197 -13.6197 -13.5440 -13.5440 2.6779 2.6779 3.3586 3.3586 3.7668 3.7668 6.9554 6.9554 7.1558 7.1558 8.9143 8.9143 9.5484 9.5484 9.7297 9.7297 10.9474 10.9474 11.1038 11.1038 11.7269 11.7269 11.8099 11.8099 12.8116 12.8116 13.7600 13.7600 13.9371 13.9371 14.5495 14.5495 k = 0.2422 0.9612-0.0000 ( 3576 PWs) bands (ev): -36.0572 -36.0572 -36.0444 -36.0444 -15.4179 -15.4179 -15.3809 -15.3809 -13.7548 -13.7548 -13.7259 -13.7259 -13.6196 -13.6196 -13.5441 -13.5441 2.7123 2.7123 3.4300 3.4300 3.6524 3.6524 7.0343 7.0343 7.1214 7.1214 8.8330 8.8330 9.5445 9.5445 9.7156 9.7156 10.9913 10.9913 11.0779 11.0779 11.7968 11.7968 11.8336 11.8336 12.7402 12.7402 13.7398 13.7398 13.9791 13.9791 14.5318 14.5318 k = 0.2482 0.9846-0.0000 ( 3576 PWs) bands (ev): -36.0572 -36.0572 -36.0443 -36.0443 -15.4179 -15.4179 -15.3811 -15.3811 -13.7548 -13.7548 -13.7262 -13.7262 -13.6195 -13.6195 -13.5442 -13.5442 2.7360 2.7360 3.5109 3.5109 3.5406 3.5406 7.0746 7.0746 7.1250 7.1250 8.7595 8.7595 9.5431 9.5431 9.7021 9.7021 11.0363 11.0363 11.0537 11.0537 11.8185 11.8185 11.8998 11.8998 12.6710 12.6710 13.7289 13.7289 14.0105 14.0105 14.5114 14.5114 k = 0.2541 1.0081-0.0000 ( 3580 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4178 -15.4178 -15.3812 -15.3812 -13.7546 -13.7546 -13.7262 -13.7262 -13.6194 -13.6194 -13.5444 -13.5444 2.7497 2.7497 3.4296 3.4296 3.6020 3.6020 7.0543 7.0543 7.1864 7.1864 8.6961 8.6961 9.5442 9.5442 9.6892 9.6892 11.0310 11.0310 11.0824 11.0824 11.8204 11.8204 11.9790 11.9790 12.6048 12.6048 13.7276 13.7276 14.0309 14.0309 14.4911 14.4911 k = 0.2600 1.0315-0.0000 ( 3568 PWs) bands (ev): -36.0573 -36.0573 -36.0443 -36.0443 -15.4175 -15.4175 -15.3811 -15.3811 -13.7542 -13.7542 -13.7260 -13.7260 -13.6193 -13.6193 -13.5446 -13.5446 2.7546 2.7546 3.3215 3.3215 3.7000 3.7000 7.0336 7.0336 7.2428 7.2428 8.6453 8.6453 9.5480 9.5480 9.6770 9.6770 11.0094 11.0094 11.1298 11.1298 11.8148 11.8148 12.0587 12.0587 12.5418 12.5418 13.7359 13.7359 14.0396 14.0396 14.4717 14.4717 k = 0.2659 1.0549-0.0000 ( 3568 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4172 -15.4172 -15.3809 -15.3809 -13.7536 -13.7536 -13.7254 -13.7254 -13.6192 -13.6192 -13.5449 -13.5449 2.7519 2.7519 3.2156 3.2156 3.8046 3.8046 7.0173 7.0173 7.2863 7.2863 8.6102 8.6102 9.5542 9.5542 9.6656 9.6656 10.9887 10.9887 11.1785 11.1785 11.8029 11.8029 12.1371 12.1371 12.4827 12.4827 13.7535 13.7535 14.0365 14.0365 14.4543 14.4543 k = 0.2659 1.0549-0.0000 ( 3568 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4172 -15.4172 -15.3809 -15.3809 -13.7536 -13.7536 -13.7254 -13.7254 -13.6192 -13.6192 -13.5449 -13.5449 2.7519 2.7519 3.2156 3.2156 3.8046 3.8046 7.0173 7.0173 7.2863 7.2863 8.6102 8.6102 9.5542 9.5542 9.6656 9.6656 10.9887 10.9887 11.1785 11.1785 11.8029 11.8029 12.1371 12.1371 12.4827 12.4827 13.7535 13.7535 14.0365 14.0365 14.4543 14.4543 k = 0.2417 1.0549-0.0000 ( 3567 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4173 -15.4173 -15.3809 -15.3809 -13.7538 -13.7538 -13.7256 -13.7256 -13.6193 -13.6193 -13.5448 -13.5448 2.7528 2.7528 3.2417 3.2417 3.7787 3.7787 7.0082 7.0082 7.2933 7.2933 8.6097 8.6097 9.5525 9.5525 9.6736 9.6736 10.9936 10.9936 11.1645 11.1645 11.8077 11.8077 12.1210 12.1210 12.4923 12.4923 13.7454 13.7454 14.0384 14.0384 14.4639 14.4639 k = 0.2175 1.0549-0.0000 ( 3573 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4174 -15.4174 -15.3810 -15.3810 -13.7539 -13.7539 -13.7257 -13.7257 -13.6193 -13.6193 -13.5447 -13.5447 2.7526 2.7526 3.2685 3.2685 3.7538 3.7538 6.9794 6.9794 7.3263 7.3263 8.5956 8.5956 9.5509 9.5509 9.6917 9.6917 10.9982 10.9982 11.1471 11.1471 11.8144 11.8144 12.1107 12.1107 12.4932 12.4932 13.7322 13.7322 14.0398 14.0398 14.4844 14.4844 k = 0.1934 1.0549-0.0000 ( 3571 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4175 -15.4175 -15.3810 -15.3810 -13.7541 -13.7541 -13.7258 -13.7258 -13.6193 -13.6193 -13.5447 -13.5447 2.7517 2.7517 3.2953 3.2953 3.7299 3.7299 6.9419 6.9419 7.3748 7.3748 8.5689 8.5689 9.5495 9.5495 9.7182 9.7182 11.0022 11.0022 11.1272 11.1272 11.8228 11.8228 12.1063 12.1063 12.4859 12.4859 13.7144 13.7144 14.0410 14.0410 14.5152 14.5152 k = 0.1692 1.0549-0.0000 ( 3571 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4176 -15.4176 -15.3811 -15.3811 -13.7543 -13.7543 -13.7259 -13.7259 -13.6193 -13.6193 -13.5446 -13.5446 2.7504 2.7504 3.3218 3.3218 3.7070 3.7070 6.9027 6.9027 7.4315 7.4315 8.5316 8.5316 9.5482 9.5482 9.7506 9.7506 11.0056 11.0056 11.1059 11.1059 11.8321 11.8321 12.1076 12.1076 12.4715 12.4715 13.6934 13.6934 14.0422 14.0422 14.5547 14.5547 k = 0.1450 1.0549-0.0000 ( 3576 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4176 -15.4176 -15.3811 -15.3811 -13.7544 -13.7544 -13.7260 -13.7260 -13.6194 -13.6194 -13.5445 -13.5445 2.7488 2.7488 3.3475 3.3475 3.6852 3.6852 6.8655 6.8655 7.4924 7.4924 8.4861 8.4861 9.5472 9.5472 9.7862 9.7862 11.0082 11.0082 11.0843 11.0843 11.8417 11.8417 12.1145 12.1145 12.4509 12.4509 13.6705 13.6705 14.0433 14.0433 14.6010 14.6010 k = 0.1209 1.0549-0.0000 ( 3584 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4177 -15.4177 -15.3811 -15.3811 -13.7545 -13.7545 -13.7261 -13.7261 -13.6194 -13.6194 -13.5444 -13.5444 2.7473 2.7473 3.3719 3.3719 3.6646 3.6646 6.8322 6.8322 7.5549 7.5549 8.4352 8.4352 9.5463 9.5463 9.8221 9.8221 11.0101 11.0101 11.0635 11.0635 11.8510 11.8510 12.1265 12.1265 12.4255 12.4255 13.6475 13.6475 14.0445 14.0445 14.6515 14.6515 k = 0.0967 1.0549-0.0000 ( 3582 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4177 -15.4177 -15.3811 -15.3811 -13.7546 -13.7546 -13.7262 -13.7262 -13.6194 -13.6194 -13.5444 -13.5444 2.7459 2.7459 3.3945 3.3945 3.6456 3.6456 6.8040 6.8040 7.6167 7.6167 8.3817 8.3817 9.5455 9.5455 9.8557 9.8557 11.0110 11.0110 11.0448 11.0448 11.8594 11.8594 12.1431 12.1431 12.3967 12.3967 13.6260 13.6260 14.0457 14.0457 14.7031 14.7031 k = 0.0725 1.0549-0.0000 ( 3582 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4178 -15.4178 -15.3812 -15.3812 -13.7547 -13.7547 -13.7262 -13.7262 -13.6194 -13.6194 -13.5443 -13.5443 2.7447 2.7447 3.4145 3.4145 3.6286 3.6286 6.7815 6.7815 7.6747 7.6747 8.3294 8.3294 9.5450 9.5450 9.8846 9.8846 11.0104 11.0104 11.0300 11.0300 11.8665 11.8665 12.1635 12.1635 12.3661 12.3661 13.6075 13.6075 14.0468 14.0468 14.7516 14.7516 k = 0.0483 1.0549-0.0000 ( 3580 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4178 -15.4178 -15.3812 -15.3812 -13.7547 -13.7547 -13.7262 -13.7262 -13.6194 -13.6194 -13.5443 -13.5443 2.7438 2.7438 3.4308 3.4308 3.6146 3.6146 6.7652 6.7652 7.7245 7.7245 8.2832 8.2832 9.5446 9.5446 9.9068 9.9068 11.0067 11.0067 11.0217 11.0217 11.8719 11.8719 12.1862 12.1862 12.3357 12.3357 13.5933 13.5933 14.0477 14.0477 14.7922 14.7922 k = 0.0242 1.0549-0.0000 ( 3571 PWs) bands (ev): -36.0572 -36.0572 -36.0443 -36.0443 -15.4178 -15.4178 -15.3812 -15.3812 -13.7548 -13.7548 -13.7262 -13.7262 -13.6195 -13.6195 -13.5443 -13.5443 2.7433 2.7433 3.4418 3.4418 3.6050 3.6050 6.7552 6.7552 7.7598 7.7598 8.2499 8.2499 9.5443 9.5443 9.9208 9.9208 11.0017 11.0017 11.0191 11.0191 11.8752 11.8752 12.2079 12.2079 12.3092 12.3092 13.5844 13.5844 14.0483 14.0483 14.8196 14.8196 k = 0.0000 1.0549-0.0000 ( 3574 PWs) bands (ev): -36.0572 -36.0572 -36.0443 -36.0443 -15.4178 -15.4178 -15.3812 -15.3812 -13.7548 -13.7548 -13.7262 -13.7262 -13.6195 -13.6195 -13.5443 -13.5443 2.7431 2.7431 3.4457 3.4457 3.6016 3.6016 6.7519 6.7519 7.7728 7.7728 8.2376 8.2376 9.5443 9.5443 9.9256 9.9256 10.9996 10.9996 11.0186 11.0186 11.8763 11.8763 12.2188 12.2188 12.2967 12.2967 13.5814 13.5814 14.0485 14.0485 14.8293 14.8293 k = 0.0000 1.0549-0.0000 ( 3574 PWs) bands (ev): -36.0572 -36.0572 -36.0443 -36.0443 -15.4178 -15.4178 -15.3812 -15.3812 -13.7548 -13.7548 -13.7262 -13.7262 -13.6195 -13.6195 -13.5443 -13.5443 2.7431 2.7431 3.4457 3.4457 3.6016 3.6016 6.7519 6.7519 7.7728 7.7728 8.2376 8.2376 9.5443 9.5443 9.9256 9.9256 10.9996 10.9996 11.0186 11.0186 11.8763 11.8763 12.2188 12.2188 12.2967 12.2967 13.5814 13.5814 14.0485 14.0485 14.8293 14.8293 k = 0.0000 1.0549 0.0241 ( 3576 PWs) bands (ev): -36.0572 -36.0572 -36.0444 -36.0444 -15.4179 -15.4179 -15.3812 -15.3812 -13.7547 -13.7547 -13.7263 -13.7263 -13.6196 -13.6196 -13.5444 -13.5444 2.7439 2.7439 3.4470 3.4470 3.6028 3.6028 6.7520 6.7520 7.7709 7.7709 8.2392 8.2392 9.5436 9.5436 9.9249 9.9249 10.9972 10.9972 11.0137 11.0137 11.8508 11.8508 12.2108 12.2108 12.3183 12.3183 13.5841 13.5841 14.0517 14.0517 14.8181 14.8181 k = 0.0000 1.0549 0.0482 ( 3576 PWs) bands (ev): -36.0571 -36.0571 -36.0443 -36.0443 -15.4179 -15.4179 -15.3814 -15.3814 -13.7546 -13.7546 -13.7263 -13.7263 -13.6200 -13.6200 -13.5449 -13.5449 2.7464 2.7464 3.4508 3.4508 3.6067 3.6067 6.7523 6.7523 7.7652 7.7652 8.2442 8.2442 9.5418 9.5418 9.9226 9.9226 10.9848 10.9848 11.0045 11.0045 11.7852 11.7852 12.1887 12.1887 12.3708 12.3708 13.5920 13.5920 14.0611 14.0611 14.8006 14.8006 k = 0.0000 1.0549 0.0723 ( 3570 PWs) bands (ev): -36.0570 -36.0570 -36.0443 -36.0443 -15.4181 -15.4181 -15.3816 -15.3816 -13.7544 -13.7544 -13.7264 -13.7264 -13.6207 -13.6207 -13.5456 -13.5456 2.7506 2.7506 3.4571 3.4571 3.6132 3.6132 6.7526 6.7526 7.7560 7.7560 8.2525 8.2525 9.5388 9.5388 9.9187 9.9187 10.9556 10.9556 10.9979 10.9979 11.6964 11.6964 12.1539 12.1539 12.4372 12.4372 13.6044 13.6044 14.0767 14.0767 14.7891 14.7891 k = 0.0000 1.0549 0.0965 ( 3572 PWs) bands (ev): -36.0569 -36.0569 -36.0442 -36.0442 -15.4182 -15.4182 -15.3819 -15.3819 -13.7541 -13.7541 -13.7265 -13.7265 -13.6216 -13.6216 -13.5467 -13.5467 2.7565 2.7565 3.4660 3.4660 3.6222 3.6222 6.7524 6.7524 7.7439 7.7439 8.2640 8.2640 9.5347 9.5347 9.9132 9.9132 10.9132 10.9132 10.9912 10.9912 11.5944 11.5944 12.1076 12.1076 12.5080 12.5080 13.6203 13.6203 14.0978 14.0978 14.7864 14.7864 k = 0.0000 1.0549 0.1206 ( 3578 PWs) bands (ev): -36.0568 -36.0568 -36.0442 -36.0442 -15.4184 -15.4184 -15.3824 -15.3824 -13.7538 -13.7538 -13.7266 -13.7266 -13.6228 -13.6228 -13.5480 -13.5480 2.7641 2.7641 3.4773 3.4773 3.6338 3.6338 6.7515 6.7515 7.7294 7.7294 8.2785 8.2785 9.5296 9.5296 9.9060 9.9060 10.8601 10.8601 10.9824 10.9824 11.4844 11.4844 12.0512 12.0512 12.5792 12.5792 13.6385 13.6385 14.1241 14.1241 14.7933 14.7933 k = 0.0000 1.0549 0.1447 ( 3576 PWs) bands (ev): -36.0566 -36.0566 -36.0441 -36.0441 -15.4187 -15.4187 -15.3829 -15.3829 -13.7534 -13.7534 -13.7267 -13.7267 -13.6242 -13.6242 -13.5496 -13.5496 2.7733 2.7733 3.4911 3.4911 3.6480 3.6480 6.7490 6.7490 7.7134 7.7134 8.2960 8.2960 9.5236 9.5236 9.8971 9.8971 10.7977 10.7977 10.9707 10.9707 11.3697 11.3697 11.9866 11.9866 12.6487 12.6487 13.6577 13.6577 14.1549 14.1549 14.8098 14.8098 k = 0.0000 1.0549 0.1688 ( 3574 PWs) bands (ev): -36.0564 -36.0564 -36.0440 -36.0440 -15.4190 -15.4190 -15.3835 -15.3835 -13.7529 -13.7529 -13.7269 -13.7269 -13.6258 -13.6258 -13.5514 -13.5514 2.7842 2.7842 3.5075 3.5075 3.6647 3.6647 6.7444 6.7444 7.6970 7.6970 8.3162 8.3162 9.5169 9.5169 9.8863 9.8863 10.7274 10.7274 10.9540 10.9540 11.2535 11.2535 11.9154 11.9154 12.7159 12.7159 13.6769 13.6769 14.1894 14.1894 14.8358 14.8358 k = 0.0000 1.0549 0.1929 ( 3574 PWs) bands (ev): -36.0561 -36.0561 -36.0439 -36.0439 -15.4194 -15.4194 -15.3842 -15.3842 -13.7524 -13.7524 -13.7271 -13.7271 -13.6276 -13.6276 -13.5535 -13.5535 2.7968 2.7968 3.5262 3.5262 3.6839 3.6839 6.7366 6.7366 7.6814 7.6814 8.3389 8.3389 9.5095 9.5095 9.8735 9.8735 10.6507 10.6507 10.9272 10.9272 11.1420 11.1420 11.8393 11.8393 12.7804 12.7804 13.6950 13.6950 14.2269 14.2269 14.8709 14.8709 k = 0.0000 1.0549 0.2170 ( 3580 PWs) bands (ev): -36.0559 -36.0559 -36.0437 -36.0437 -15.4198 -15.4198 -15.3850 -15.3850 -13.7518 -13.7518 -13.7274 -13.7274 -13.6297 -13.6297 -13.5559 -13.5559 2.8110 2.8110 3.5474 3.5474 3.7056 3.7056 6.7247 6.7247 7.6678 7.6678 8.3637 8.3637 9.5015 9.5015 9.8585 9.8585 10.5690 10.5690 10.8760 10.8760 11.0500 11.0500 11.7596 11.7596 12.8424 12.8424 13.7117 13.7117 14.2664 14.2664 14.9144 14.9144 k = 0.0000 1.0549 0.2411 ( 3578 PWs) bands (ev): -36.0556 -36.0556 -36.0436 -36.0436 -15.4202 -15.4202 -15.3859 -15.3859 -13.7511 -13.7511 -13.7277 -13.7277 -13.6319 -13.6319 -13.5584 -13.5584 2.8269 2.8269 3.5709 3.5709 3.7299 3.7299 6.7078 6.7078 7.6575 7.6575 8.3903 8.3903 9.4931 9.4931 9.8409 9.8409 10.4838 10.4838 10.7858 10.7858 10.9931 10.9931 11.6776 11.6776 12.9021 12.9021 13.7266 13.7266 14.3072 14.3072 14.9654 14.9654 k = 0.0000 1.0549 0.2653 ( 3574 PWs) bands (ev): -36.0552 -36.0552 -36.0434 -36.0434 -15.4207 -15.4207 -15.3869 -15.3869 -13.7505 -13.7505 -13.7280 -13.7280 -13.6342 -13.6342 -13.5611 -13.5611 2.8444 2.8444 3.5968 3.5968 3.7566 3.7566 6.6851 6.6851 7.6516 7.6516 8.4181 8.4181 9.4841 9.4841 9.8204 9.8204 10.3967 10.3967 10.6687 10.6687 10.9595 10.9595 11.5943 11.5943 12.9597 12.9597 13.7398 13.7398 14.3485 14.3485 15.0229 15.0229 k = 0.0000 1.0549 0.2894 ( 3578 PWs) bands (ev): -36.0549 -36.0549 -36.0433 -36.0433 -15.4212 -15.4212 -15.3879 -15.3879 -13.7498 -13.7498 -13.7284 -13.7284 -13.6367 -13.6367 -13.5640 -13.5640 2.8636 2.8636 3.6250 3.6250 3.7858 3.7858 6.6560 6.6560 7.6511 7.6511 8.4464 8.4464 9.4747 9.4747 9.7966 9.7966 10.3095 10.3095 10.5406 10.5406 10.9340 10.9340 11.5106 11.5106 13.0156 13.0156 13.7517 13.7517 14.3896 14.3896 15.0853 15.0853 k = 0.0000 1.0549 0.3135 ( 3576 PWs) bands (ev): -36.0545 -36.0545 -36.0431 -36.0431 -15.4217 -15.4217 -15.3890 -15.3890 -13.7491 -13.7491 -13.7289 -13.7289 -13.6393 -13.6393 -13.5671 -13.5671 2.8845 2.8845 3.6554 3.6554 3.8175 3.8175 6.6201 6.6201 7.6565 7.6565 8.4746 8.4746 9.4647 9.4647 9.7688 9.7688 10.2241 10.2241 10.4080 10.4080 10.9109 10.9109 11.4272 11.4272 13.0703 13.0703 13.7628 13.7628 14.4300 14.4300 15.1511 15.1511 k = 0.0000 1.0549 0.3376 ( 3576 PWs) bands (ev): -36.0541 -36.0541 -36.0429 -36.0429 -15.4223 -15.4223 -15.3902 -15.3902 -13.7485 -13.7485 -13.7293 -13.7293 -13.6420 -13.6420 -13.5703 -13.5703 2.9069 2.9069 3.6881 3.6881 3.8515 3.8515 6.5776 6.5776 7.6680 7.6680 8.5014 8.5014 9.4541 9.4541 9.7363 9.7363 10.1426 10.1426 10.2738 10.2738 10.8882 10.8882 11.3446 11.3446 13.1240 13.1240 13.7736 13.7736 14.4692 14.4692 15.2162 15.2162 k = 0.0000 1.0549 0.3617 ( 3572 PWs) bands (ev): -36.0537 -36.0537 -36.0427 -36.0427 -15.4228 -15.4228 -15.3915 -15.3915 -13.7479 -13.7479 -13.7299 -13.7299 -13.6447 -13.6447 -13.5736 -13.5736 2.9311 2.9311 3.7229 3.7229 3.8879 3.8879 6.5288 6.5288 7.6857 7.6857 8.5255 8.5255 9.4423 9.4423 9.6987 9.6987 10.0665 10.0665 10.1405 10.1405 10.8652 10.8652 11.2634 11.2634 13.1773 13.1773 13.7846 13.7846 14.5069 14.5069 15.2491 15.2491 k = 0.0000 1.0549 0.3858 ( 3574 PWs) bands (ev): -36.0532 -36.0532 -36.0425 -36.0425 -15.4235 -15.4235 -15.3928 -15.3928 -13.7473 -13.7473 -13.7305 -13.7305 -13.6474 -13.6474 -13.5770 -13.5770 2.9568 2.9568 3.7597 3.7597 3.9266 3.9266 6.4742 6.4742 7.7090 7.7090 8.5451 8.5451 9.4288 9.4288 9.6564 9.6564 9.9875 9.9875 10.0195 10.0195 10.8416 10.8416 11.1838 11.1838 13.2305 13.2305 13.7966 13.7966 14.5430 14.5430 15.2714 15.2714 k = 0.0000 1.0549 0.4099 ( 3580 PWs) bands (ev): -36.0528 -36.0528 -36.0423 -36.0423 -15.4241 -15.4241 -15.3942 -15.3942 -13.7468 -13.7468 -13.7311 -13.7311 -13.6500 -13.6500 -13.5805 -13.5805 2.9841 2.9841 3.7985 3.7985 3.9677 3.9677 6.4145 6.4145 7.7375 7.7375 8.5581 8.5581 9.4122 9.4122 9.6111 9.6111 9.8695 9.8695 9.9498 9.9498 10.8174 10.8174 11.1062 11.1062 13.2839 13.2839 13.8100 13.8100 14.5773 14.5773 15.2934 15.2934 k = 0.0000 1.0549 0.4340 ( 3582 PWs) bands (ev): -36.0523 -36.0523 -36.0421 -36.0421 -15.4247 -15.4247 -15.3957 -15.3957 -13.7463 -13.7463 -13.7318 -13.7318 -13.6527 -13.6527 -13.5840 -13.5840 3.0131 3.0131 3.8392 3.8392 4.0109 4.0109 6.3504 6.3504 7.7705 7.7705 8.5617 8.5617 9.3896 9.3896 9.5657 9.5657 9.7479 9.7479 9.8993 9.8993 10.7926 10.7926 11.0308 11.0308 13.3378 13.3378 13.8254 13.8254 14.6099 14.6099 15.3153 15.3153 k = 0.0000 1.0549 0.4582 ( 3578 PWs) bands (ev): -36.0518 -36.0518 -36.0419 -36.0419 -15.4254 -15.4254 -15.3971 -15.3971 -13.7460 -13.7460 -13.7325 -13.7325 -13.6552 -13.6552 -13.5875 -13.5875 3.0436 3.0436 3.8817 3.8817 4.0564 4.0564 6.2828 6.2828 7.8072 7.8072 8.5534 8.5534 9.3544 9.3544 9.5236 9.5236 9.6400 9.6400 9.8573 9.8573 10.7674 10.7674 10.9577 10.9577 13.3924 13.3924 13.8432 13.8432 14.6409 14.6409 15.3370 15.3370 k = 0.0000 1.0549 0.4823 ( 3574 PWs) bands (ev): -36.0513 -36.0513 -36.0417 -36.0417 -15.4261 -15.4261 -15.3987 -15.3987 -13.7458 -13.7458 -13.7333 -13.7333 -13.6576 -13.6576 -13.5910 -13.5910 3.0757 3.0757 3.9258 3.9258 4.1041 4.1041 6.2123 6.2123 7.8469 7.8469 8.5308 8.5308 9.2957 9.2957 9.4873 9.4873 9.5594 9.5594 9.8216 9.8216 10.7419 10.7419 10.8871 10.8871 13.4479 13.4479 13.8639 13.8639 14.6704 14.6704 15.3584 15.3584 k = 0.0000 1.0549 0.5064 ( 3572 PWs) bands (ev): -36.0508 -36.0508 -36.0415 -36.0415 -15.4267 -15.4267 -15.4003 -15.4003 -13.7458 -13.7458 -13.7341 -13.7341 -13.6598 -13.6598 -13.5945 -13.5945 3.1094 3.1094 3.9715 3.9715 4.1538 4.1538 6.1396 6.1396 7.8885 7.8885 8.4930 8.4930 9.2082 9.2082 9.4592 9.4592 9.5121 9.5121 9.7913 9.7913 10.7162 10.7162 10.8192 10.8192 13.5045 13.5045 13.8878 13.8878 14.6985 14.6985 15.3796 15.3796 k = 0.0000 1.0549 0.5305 ( 3574 PWs) bands (ev): -36.0503 -36.0503 -36.0414 -36.0414 -15.4274 -15.4274 -15.4019 -15.4019 -13.7459 -13.7459 -13.7350 -13.7350 -13.6618 -13.6618 -13.5980 -13.5980 3.1447 3.1447 4.0184 4.0184 4.2055 4.2055 6.0653 6.0653 7.9310 7.9310 8.4402 8.4402 9.1020 9.1020 9.4409 9.4409 9.4870 9.4870 9.7661 9.7661 10.6905 10.6905 10.7540 10.7540 13.5623 13.5623 13.9151 13.9151 14.7253 14.7253 15.4005 15.4005 k = 0.0000 1.0549 0.5546 ( 3572 PWs) bands (ev): -36.0497 -36.0497 -36.0412 -36.0412 -15.4280 -15.4280 -15.4035 -15.4035 -13.7462 -13.7462 -13.7360 -13.7360 -13.6636 -13.6636 -13.6014 -13.6014 3.1815 3.1815 4.0665 4.0665 4.2591 4.2591 5.9900 5.9900 7.9727 7.9727 8.3744 8.3744 8.9892 8.9892 9.4302 9.4302 9.4733 9.4733 9.7466 9.7466 10.6647 10.6647 10.6919 10.6919 13.6212 13.6212 13.9461 13.9461 14.7511 14.7511 15.4213 15.4213 k = 0.0000 1.0549 0.5787 ( 3576 PWs) bands (ev): -36.0492 -36.0492 -36.0410 -36.0410 -15.4287 -15.4287 -15.4051 -15.4051 -13.7467 -13.7467 -13.7370 -13.7370 -13.6651 -13.6651 -13.6048 -13.6048 3.2199 3.2199 4.1155 4.1155 4.3146 4.3146 5.9143 5.9143 8.0113 8.0113 8.2979 8.2979 8.8778 8.8778 9.4237 9.4237 9.4652 9.4652 9.7337 9.7337 10.6300 10.6300 10.6420 10.6420 13.6812 13.6812 13.9811 13.9811 14.7760 14.7760 15.4420 15.4420 k = 0.0000 1.0549 0.6028 ( 3574 PWs) bands (ev): -36.0487 -36.0487 -36.0408 -36.0408 -15.4293 -15.4293 -15.4068 -15.4068 -13.7473 -13.7473 -13.7380 -13.7380 -13.6664 -13.6664 -13.6081 -13.6081 3.2598 3.2598 4.1650 4.1650 4.3718 4.3718 5.8387 5.8387 8.0432 8.0432 8.2136 8.2136 8.7735 8.7735 9.4188 9.4188 9.4589 9.4589 9.7286 9.7286 10.5746 10.5746 10.6163 10.6163 13.7424 13.7424 14.0201 14.0201 14.8004 14.8004 15.4625 15.4625 k = 0.0000 1.0549 0.6270 ( 3568 PWs) bands (ev): -36.0481 -36.0481 -36.0407 -36.0407 -15.4298 -15.4298 -15.4084 -15.4084 -13.7481 -13.7481 -13.7392 -13.7392 -13.6673 -13.6673 -13.6113 -13.6113 3.3011 3.3011 4.2146 4.2146 4.4305 4.4305 5.7639 5.7639 8.0616 8.0616 8.1245 8.1245 8.6833 8.6833 9.4148 9.4148 9.4511 9.4511 9.7319 9.7319 10.5215 10.5215 10.5924 10.5924 13.8044 13.8044 14.0631 14.0631 14.8244 14.8244 15.4829 15.4829 k = 0.0000 1.0549 0.6511 ( 3570 PWs) bands (ev): -36.0476 -36.0476 -36.0405 -36.0405 -15.4304 -15.4304 -15.4101 -15.4101 -13.7489 -13.7489 -13.7404 -13.7404 -13.6680 -13.6680 -13.6144 -13.6144 3.3440 3.3440 4.2639 4.2639 4.4907 4.4907 5.6904 5.6904 8.0255 8.0255 8.0654 8.0654 8.6161 8.6161 9.4114 9.4114 9.4401 9.4401 9.7428 9.7428 10.4716 10.4716 10.5695 10.5695 13.8672 13.8672 14.1102 14.1102 14.8484 14.8484 15.5033 15.5033 k = 0.0000 1.0549 0.6752 ( 3568 PWs) bands (ev): -36.0471 -36.0471 -36.0404 -36.0404 -15.4309 -15.4309 -15.4117 -15.4117 -13.7499 -13.7499 -13.7417 -13.7417 -13.6684 -13.6684 -13.6174 -13.6174 3.3883 3.3883 4.3121 4.3121 4.5521 4.5521 5.6190 5.6190 7.9313 7.9313 8.0336 8.0336 8.5796 8.5796 9.4077 9.4077 9.4266 9.4266 9.7593 9.7593 10.4256 10.4256 10.5476 10.5476 13.9303 13.9303 14.1611 14.1611 14.8727 14.8727 15.5235 15.5235 k = 0.0000 1.0549 0.6993 ( 3568 PWs) bands (ev): -36.0466 -36.0466 -36.0403 -36.0403 -15.4314 -15.4314 -15.4134 -15.4134 -13.7509 -13.7509 -13.7431 -13.7431 -13.6685 -13.6685 -13.6203 -13.6203 3.4341 3.4341 4.3585 4.3585 4.6146 4.6146 5.5505 5.5505 7.8346 7.8346 7.9748 7.9748 8.5741 8.5741 9.3991 9.3991 9.4161 9.4161 9.7786 9.7786 10.3839 10.3839 10.5267 10.5267 13.9935 13.9935 14.2156 14.2156 14.8978 14.8978 15.5435 15.5435 k = 0.0000 1.0549 0.7234 ( 3566 PWs) bands (ev): -36.0461 -36.0461 -36.0402 -36.0402 -15.4318 -15.4318 -15.4150 -15.4150 -13.7520 -13.7520 -13.7446 -13.7446 -13.6684 -13.6684 -13.6232 -13.6232 3.4813 3.4813 4.4019 4.4019 4.6778 4.6778 5.4860 5.4860 7.7380 7.7380 7.8956 7.8956 8.5916 8.5916 9.3815 9.3815 9.4138 9.4138 9.7979 9.7979 10.3473 10.3473 10.5071 10.5071 14.0563 14.0563 14.2733 14.2733 14.9242 14.9242 15.5623 15.5623 k = 0.0000 1.0549 0.7475 ( 3574 PWs) bands (ev): -36.0456 -36.0456 -36.0402 -36.0402 -15.4321 -15.4321 -15.4165 -15.4165 -13.7530 -13.7530 -13.7460 -13.7460 -13.6680 -13.6680 -13.6259 -13.6259 3.5298 3.5298 4.4409 4.4409 4.7414 4.7414 5.4268 5.4268 7.6425 7.6425 7.8046 7.8046 8.6231 8.6231 9.3602 9.3602 9.4153 9.4153 9.8148 9.8148 10.3165 10.3165 10.4886 10.4886 14.1182 14.1182 14.3334 14.3334 14.9523 14.9523 15.5293 15.5293 k = 0.0000 1.0549 0.7716 ( 3574 PWs) bands (ev): -36.0451 -36.0451 -36.0401 -36.0401 -15.4324 -15.4324 -15.4180 -15.4180 -13.7541 -13.7541 -13.7475 -13.7475 -13.6674 -13.6674 -13.6285 -13.6285 3.5797 3.5797 4.4737 4.4737 4.8052 4.8052 5.3744 5.3744 7.5491 7.5491 7.7085 7.7085 8.6622 8.6622 9.3377 9.3377 9.4191 9.4191 9.8268 9.8268 10.2924 10.2924 10.4714 10.4714 14.1786 14.1786 14.3949 14.3949 14.9828 14.9828 15.4787 15.4787 k = 0.0000 1.0549 0.7958 ( 3572 PWs) bands (ev): -36.0447 -36.0447 -36.0401 -36.0401 -15.4327 -15.4327 -15.4195 -15.4195 -13.7551 -13.7551 -13.7490 -13.7490 -13.6667 -13.6667 -13.6311 -13.6311 3.6309 3.6309 4.4982 4.4982 4.8685 4.8685 5.3307 5.3307 7.4587 7.4587 7.6110 7.6110 8.7051 8.7051 9.3145 9.3145 9.4250 9.4250 9.8323 9.8323 10.2759 10.2759 10.4555 10.4555 14.2368 14.2368 14.4564 14.4564 15.0163 15.0163 15.4344 15.4344 k = 0.0000 1.0549 0.8199 ( 3570 PWs) bands (ev): -36.0442 -36.0442 -36.0401 -36.0401 -15.4328 -15.4328 -15.4209 -15.4209 -13.7560 -13.7560 -13.7505 -13.7505 -13.6657 -13.6657 -13.6335 -13.6335 3.6833 3.6833 4.5122 4.5122 4.9308 4.9308 5.2973 5.2973 7.3723 7.3723 7.5149 7.5149 8.7494 8.7494 9.2912 9.2912 9.4331 9.4331 9.8303 9.8303 10.2669 10.2669 10.4408 10.4408 14.2922 14.2922 14.5157 14.5157 15.0534 15.0534 15.3991 15.3991 k = 0.0000 1.0549 0.8440 ( 3570 PWs) bands (ev): -36.0438 -36.0438 -36.0401 -36.0401 -15.4329 -15.4329 -15.4223 -15.4223 -13.7568 -13.7568 -13.7519 -13.7519 -13.6646 -13.6646 -13.6359 -13.6359 3.7370 3.7370 4.5140 4.5140 4.9916 4.9916 5.2755 5.2755 7.2907 7.2907 7.4219 7.4219 8.7936 8.7936 9.2678 9.2678 9.4435 9.4435 9.8209 9.8209 10.2649 10.2649 10.4272 10.4272 14.3443 14.3443 14.5701 14.5701 15.0943 15.0943 15.3756 15.3756 k = 0.0000 1.0549 0.8681 ( 3570 PWs) bands (ev): -36.0434 -36.0434 -36.0401 -36.0401 -15.4329 -15.4329 -15.4236 -15.4236 -13.7576 -13.7576 -13.7532 -13.7532 -13.6634 -13.6634 -13.6382 -13.6382 3.7917 3.7917 4.5031 4.5031 5.0499 5.0499 5.2653 5.2653 7.2151 7.2151 7.3335 7.3335 8.8366 8.8366 9.2445 9.2445 9.4565 9.4565 9.8050 9.8050 10.2685 10.2685 10.4147 10.4147 14.3926 14.3926 14.6162 14.6162 15.1393 15.1393 15.3669 15.3669 k = 0.0000 1.0549 0.8922 ( 3574 PWs) bands (ev): -36.0430 -36.0430 -36.0402 -36.0402 -15.4328 -15.4328 -15.4248 -15.4248 -13.7582 -13.7582 -13.7544 -13.7544 -13.6621 -13.6621 -13.6404 -13.6404 3.8474 3.8474 4.4799 4.4799 5.1048 5.1048 5.2650 5.2650 7.1467 7.1467 7.2511 7.2511 8.8778 8.8778 9.2212 9.2212 9.4720 9.4720 9.7840 9.7840 10.2760 10.2760 10.4032 10.4032 14.4370 14.4370 14.6509 14.6509 15.1882 15.1882 15.3752 15.3752 k = 0.0000 1.0549 0.9163 ( 3574 PWs) bands (ev): -36.0427 -36.0427 -36.0403 -36.0403 -15.4327 -15.4327 -15.4260 -15.4260 -13.7588 -13.7588 -13.7555 -13.7555 -13.6607 -13.6607 -13.6425 -13.6425 3.9040 3.9040 4.4464 4.4464 5.1552 5.1552 5.2720 5.2720 7.0868 7.0868 7.1761 7.1761 8.9167 8.9167 9.1980 9.1980 9.4902 9.4902 9.7593 9.7593 10.2860 10.2860 10.3923 10.3923 14.4774 14.4774 14.6723 14.6723 15.2403 15.2403 15.4005 15.4005 k = 0.0000 1.0549 0.9404 ( 3570 PWs) bands (ev): -36.0423 -36.0423 -36.0404 -36.0404 -15.4324 -15.4324 -15.4271 -15.4271 -13.7591 -13.7591 -13.7565 -13.7565 -13.6591 -13.6591 -13.6446 -13.6446 3.9614 3.9614 4.4047 4.4047 5.2000 5.2000 5.2828 5.2828 7.0368 7.0368 7.1100 7.1100 8.9532 8.9532 9.1746 9.1746 9.5109 9.5109 9.7320 9.7320 10.2972 10.2972 10.3820 10.3820 14.5141 14.5141 14.6808 14.6808 15.2944 15.2944 15.4389 15.4389 k = 0.0000 1.0549 0.9646 ( 3570 PWs) bands (ev): -36.0420 -36.0420 -36.0406 -36.0406 -15.4321 -15.4321 -15.4280 -15.4280 -13.7594 -13.7594 -13.7574 -13.7574 -13.6575 -13.6575 -13.6466 -13.6466 4.0193 4.0193 4.3569 4.3569 5.2379 5.2379 5.2940 5.2940 6.9981 6.9981 7.0542 7.0542 8.9871 8.9871 9.1510 9.1510 9.5340 9.5340 9.7032 9.7032 10.3088 10.3088 10.3721 10.3721 14.5474 14.5474 14.6782 14.6782 15.3490 15.3490 15.4807 15.4807 k = 0.0000 1.0549 0.9887 ( 3570 PWs) bands (ev): -36.0417 -36.0417 -36.0407 -36.0407 -15.4316 -15.4316 -15.4289 -15.4289 -13.7594 -13.7594 -13.7581 -13.7581 -13.6559 -13.6559 -13.6486 -13.6486 4.0775 4.0775 4.3049 4.3049 5.2680 5.2680 5.3026 5.3026 6.9721 6.9721 7.0101 7.0101 9.0187 9.0187 9.1269 9.1269 9.5592 9.5592 9.6736 9.6736 10.3203 10.3203 10.3623 10.3623 14.5777 14.5777 14.6674 14.6674 15.4018 15.4018 15.5095 15.5095 k = 0.0000 1.0549 1.0128 ( 3570 PWs) bands (ev): -36.0414 -36.0414 -36.0409 -36.0409 -15.4311 -15.4311 -15.4298 -15.4298 -13.7593 -13.7593 -13.7587 -13.7587 -13.6541 -13.6541 -13.6505 -13.6505 4.1356 4.1356 4.2500 4.2500 5.2893 5.2893 5.3058 5.3058 6.9600 6.9600 6.9792 6.9792 9.0482 9.0482 9.1019 9.1019 9.5862 9.5862 9.6439 9.6439 10.3315 10.3315 10.3523 10.3523 14.6050 14.6050 14.6506 14.6506 15.4497 15.4497 15.5113 15.5113 k = 0.0000 1.0549 1.0369 ( 3576 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4305 -15.4305 -13.7591 -13.7591 -13.7591 -13.7591 -13.6523 -13.6523 -13.6523 -13.6523 4.1933 4.1933 4.1933 4.1933 5.3018 5.3018 5.3018 5.3018 6.9623 6.9623 6.9623 6.9623 9.0758 9.0758 9.0758 9.0758 9.6146 9.6146 9.6146 9.6146 10.3421 10.3421 10.3421 10.3421 14.6294 14.6294 14.6294 14.6294 15.4884 15.4884 15.4884 15.4884 k = 0.0000 1.0549 1.0369 ( 3576 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4305 -15.4305 -13.7591 -13.7591 -13.7591 -13.7591 -13.6523 -13.6523 -13.6523 -13.6523 4.1933 4.1933 4.1933 4.1933 5.3018 5.3018 5.3018 5.3018 6.9623 6.9623 6.9623 6.9623 9.0758 9.0758 9.0758 9.0758 9.6146 9.6146 9.6146 9.6146 10.3421 10.3421 10.3421 10.3421 14.6294 14.6294 14.6294 14.6294 15.4884 15.4884 15.4884 15.4884 k = 0.0242 1.0549 1.0369 ( 3572 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4305 -15.4305 -13.7592 -13.7592 -13.7590 -13.7590 -13.6524 -13.6524 -13.6523 -13.6523 4.1930 4.1930 4.1937 4.1937 5.3015 5.3015 5.3019 5.3019 6.9609 6.9609 6.9630 6.9630 9.0770 9.0770 9.0770 9.0770 9.6123 9.6123 9.6166 9.6166 10.3415 10.3415 10.3426 10.3426 14.6253 14.6253 14.6285 14.6285 15.4841 15.4841 15.4928 15.4928 k = 0.0483 1.0549 1.0369 ( 3578 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4304 -15.4304 -13.7592 -13.7592 -13.7589 -13.7589 -13.6525 -13.6525 -13.6522 -13.6522 4.1926 4.1926 4.1939 4.1939 5.3010 5.3010 5.3018 5.3018 6.9589 6.9589 6.9629 6.9629 9.0804 9.0804 9.0804 9.0804 9.6097 9.6097 9.6182 9.6182 10.3408 10.3408 10.3430 10.3430 14.6165 14.6165 14.6228 14.6228 15.4803 15.4803 15.4970 15.4970 k = 0.0725 1.0549 1.0369 ( 3572 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4304 -15.4304 -13.7593 -13.7593 -13.7588 -13.7588 -13.6526 -13.6526 -13.6521 -13.6521 4.1921 4.1921 4.1941 4.1941 5.3003 5.3003 5.3015 5.3015 6.9563 6.9563 6.9622 6.9622 9.0859 9.0859 9.0860 9.0860 9.6069 9.6069 9.6195 9.6195 10.3400 10.3400 10.3433 10.3433 14.6038 14.6038 14.6129 14.6129 15.4774 15.4774 15.5006 15.5006 k = 0.0967 1.0549 1.0369 ( 3576 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4304 -15.4304 -13.7593 -13.7593 -13.7588 -13.7588 -13.6526 -13.6526 -13.6520 -13.6520 4.1916 4.1916 4.1943 4.1943 5.2993 5.2993 5.3009 5.3009 6.9534 6.9534 6.9611 6.9611 9.0933 9.0933 9.0936 9.0936 9.6039 9.6039 9.6204 9.6204 10.3392 10.3392 10.3435 10.3435 14.5884 14.5884 14.5999 14.5999 15.4755 15.4755 15.5037 15.5037 k = 0.1209 1.0549 1.0369 ( 3568 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4305 -15.4305 -15.4303 -15.4303 -13.7593 -13.7593 -13.7587 -13.7587 -13.6527 -13.6527 -13.6519 -13.6519 4.1911 4.1911 4.1944 4.1944 5.2980 5.2980 5.3000 5.3000 6.9505 6.9505 6.9596 6.9596 9.1022 9.1022 9.1028 9.1028 9.6007 9.6007 9.6210 9.6210 10.3381 10.3381 10.3435 10.3435 14.5714 14.5714 14.5850 14.5850 15.4745 15.4745 15.5063 15.5063 k = 0.1450 1.0549 1.0369 ( 3568 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4304 -15.4304 -15.4303 -15.4303 -13.7593 -13.7593 -13.7586 -13.7586 -13.6527 -13.6527 -13.6518 -13.6518 4.1906 4.1906 4.1944 4.1944 5.2962 5.2962 5.2986 5.2986 6.9478 6.9478 6.9581 6.9581 9.1124 9.1124 9.1132 9.1132 9.5976 9.5976 9.6212 9.6212 10.3370 10.3370 10.3434 10.3434 14.5543 14.5543 14.5695 14.5695 15.4737 15.4737 15.5083 15.5083 k = 0.1692 1.0549 1.0369 ( 3564 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4304 -15.4304 -15.4303 -15.4303 -13.7593 -13.7593 -13.7585 -13.7585 -13.6528 -13.6528 -13.6517 -13.6517 4.1901 4.1901 4.1944 4.1944 5.2940 5.2940 5.2968 5.2968 6.9457 6.9457 6.9569 6.9569 9.1233 9.1233 9.1244 9.1244 9.5946 9.5946 9.6211 9.6211 10.3356 10.3356 10.3429 10.3429 14.5382 14.5382 14.5546 14.5546 15.4727 15.4727 15.5095 15.5095 k = 0.1934 1.0549 1.0369 ( 3566 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4304 -15.4304 -15.4302 -15.4302 -13.7592 -13.7592 -13.7584 -13.7584 -13.6528 -13.6528 -13.6517 -13.6517 4.1896 4.1896 4.1943 4.1943 5.2911 5.2911 5.2944 5.2944 6.9445 6.9445 6.9562 6.9562 9.1345 9.1345 9.1359 9.1359 9.5918 9.5918 9.6208 9.6208 10.3341 10.3341 10.3423 10.3423 14.5242 14.5242 14.5415 14.5415 15.4706 15.4706 15.5094 15.5094 k = 0.2175 1.0549 1.0369 ( 3560 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4304 -15.4304 -15.4301 -15.4301 -13.7592 -13.7592 -13.7583 -13.7583 -13.6528 -13.6528 -13.6516 -13.6516 4.1891 4.1891 4.1941 4.1941 5.2876 5.2876 5.2914 5.2914 6.9445 6.9445 6.9565 6.9565 9.1454 9.1454 9.1470 9.1470 9.5895 9.5895 9.6203 9.6203 10.3324 10.3324 10.3414 10.3414 14.5131 14.5131 14.5310 14.5310 15.4665 15.4665 15.5071 15.5071 k = 0.2417 1.0549 1.0369 ( 3566 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4303 -15.4303 -15.4301 -15.4301 -13.7591 -13.7591 -13.7582 -13.7582 -13.6528 -13.6528 -13.6516 -13.6516 4.1886 4.1886 4.1939 4.1939 5.2833 5.2833 5.2877 5.2877 6.9461 6.9461 6.9579 6.9579 9.1557 9.1557 9.1571 9.1571 9.5879 9.5879 9.6196 9.6196 10.3306 10.3306 10.3402 10.3402 14.5056 14.5056 14.5237 14.5237 15.4594 15.4594 15.5015 15.5015 k = 0.2659 1.0549 1.0369 ( 3556 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4303 -15.4303 -15.4300 -15.4300 -13.7589 -13.7589 -13.7581 -13.7581 -13.6528 -13.6528 -13.6516 -13.6516 4.1881 4.1881 4.1936 4.1936 5.2783 5.2783 5.2831 5.2831 6.9495 6.9495 6.9609 6.9609 9.1646 9.1646 9.1657 9.1657 9.5872 9.5872 9.6190 9.6190 10.3286 10.3286 10.3389 10.3389 14.5019 14.5019 14.5201 14.5201 15.4480 15.4480 15.4916 15.4916 k = 0.2659 1.0549 1.0369 ( 3556 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4303 -15.4303 -15.4300 -15.4300 -13.7589 -13.7589 -13.7581 -13.7581 -13.6528 -13.6528 -13.6516 -13.6516 4.1881 4.1881 4.1936 4.1936 5.2783 5.2783 5.2831 5.2831 6.9495 6.9495 6.9609 6.9609 9.1646 9.1646 9.1657 9.1657 9.5872 9.5872 9.6190 9.6190 10.3286 10.3286 10.3389 10.3389 14.5019 14.5019 14.5201 14.5201 15.4480 15.4480 15.4916 15.4916 k = 0.2600 1.0315 1.0369 ( 3556 PWs) bands (ev): -36.0411 -36.0411 -36.0411 -36.0411 -15.4304 -15.4304 -15.4303 -15.4303 -13.7594 -13.7594 -13.7584 -13.7584 -13.6529 -13.6529 -13.6516 -13.6516 4.1899 4.1899 4.1947 4.1947 5.2958 5.2958 5.2985 5.2985 6.9383 6.9383 6.9524 6.9524 9.1309 9.1309 9.1343 9.1343 9.5889 9.5889 9.6223 9.6223 10.3361 10.3361 10.3443 10.3443 14.5042 14.5042 14.5228 14.5228 15.5080 15.5080 15.5460 15.5460 k = 0.2541 1.0081 1.0369 ( 3560 PWs) bands (ev): -36.0411 -36.0411 -36.0411 -36.0411 -15.4305 -15.4305 -15.4304 -15.4304 -13.7597 -13.7597 -13.7585 -13.7585 -13.6529 -13.6529 -13.6517 -13.6517 4.1910 4.1910 4.1952 4.1952 5.3035 5.3035 5.3039 5.3039 6.9413 6.9413 6.9582 6.9582 9.0962 9.0962 9.1016 9.1016 9.5925 9.5925 9.6274 9.6274 10.3427 10.3427 10.3488 10.3488 14.4953 14.4953 14.5145 14.5145 15.5757 15.5757 15.6070 15.6070 k = 0.2482 0.9846 1.0369 ( 3560 PWs) bands (ev): -36.0411 -36.0411 -36.0411 -36.0411 -15.4305 -15.4305 -15.4304 -15.4304 -13.7597 -13.7597 -13.7584 -13.7584 -13.6530 -13.6530 -13.6517 -13.6517 4.1913 4.1913 4.1949 4.1949 5.2996 5.2996 5.3014 5.3014 6.9584 6.9584 6.9781 6.9781 9.0609 9.0609 9.0677 9.0677 9.5980 9.5980 9.6339 9.6339 10.3488 10.3488 10.3530 10.3530 14.4734 14.4734 14.4932 14.4932 15.6517 15.6517 15.6746 15.6746 k = 0.2422 0.9612 1.0369 ( 3560 PWs) bands (ev): -36.0411 -36.0411 -36.0411 -36.0411 -15.4305 -15.4305 -15.4303 -15.4303 -13.7596 -13.7596 -13.7581 -13.7581 -13.6531 -13.6531 -13.6518 -13.6518 4.1908 4.1908 4.1938 4.1938 5.2863 5.2863 5.2901 5.2901 6.9889 6.9889 7.0113 7.0113 9.0251 9.0251 9.0330 9.0330 9.6050 9.6050 9.6418 9.6418 10.3548 10.3548 10.3573 10.3573 14.4374 14.4374 14.4582 14.4582 15.7364 15.7364 15.7467 15.7467 k = 0.2363 0.9377 1.0369 ( 3560 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4304 -15.4304 -15.4301 -15.4301 -13.7593 -13.7593 -13.7576 -13.7576 -13.6531 -13.6531 -13.6518 -13.6518 4.1892 4.1892 4.1916 4.1916 5.2652 5.2652 5.2708 5.2708 7.0317 7.0317 7.0567 7.0567 8.9891 8.9891 8.9977 8.9977 9.6133 9.6133 9.6508 9.6508 10.3614 10.3614 10.3622 10.3622 14.3879 14.3879 14.4096 14.4096 15.8055 15.8055 15.8286 15.8286 k = 0.2304 0.9143 1.0369 ( 3560 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4302 -15.4302 -15.4297 -15.4297 -13.7588 -13.7588 -13.7569 -13.7569 -13.6532 -13.6532 -13.6518 -13.6518 4.1864 4.1864 4.1883 4.1883 5.2378 5.2378 5.2447 5.2447 7.0855 7.0855 7.1127 7.1127 8.9532 8.9532 8.9622 8.9622 9.6227 9.6227 9.6605 9.6605 10.3682 10.3682 10.3688 10.3688 14.3263 14.3263 14.3490 14.3490 15.8237 15.8237 15.8460 15.8460 k = 0.2245 0.8908 1.0369 ( 3560 PWs) bands (ev): -36.0413 -36.0413 -36.0413 -36.0413 -15.4299 -15.4299 -15.4293 -15.4293 -13.7581 -13.7581 -13.7561 -13.7561 -13.6532 -13.6532 -13.6519 -13.6519 4.1822 4.1822 4.1835 4.1835 5.2056 5.2056 5.2136 5.2136 7.1485 7.1485 7.1777 7.1777 8.9179 8.9179 8.9268 8.9268 9.6328 9.6328 9.6709 9.6709 10.3757 10.3757 10.3777 10.3777 14.2546 14.2546 14.2782 14.2782 15.8292 15.8292 15.8432 15.8432 k = 0.2186 0.8674 1.0369 ( 3552 PWs) bands (ev): -36.0414 -36.0414 -36.0414 -36.0414 -15.4295 -15.4295 -15.4288 -15.4288 -13.7572 -13.7572 -13.7550 -13.7550 -13.6532 -13.6532 -13.6519 -13.6519 4.1763 4.1763 4.1773 4.1773 5.1701 5.1701 5.1787 5.1787 7.2191 7.2191 7.2502 7.2502 8.8835 8.8835 8.8921 8.8921 9.6436 9.6436 9.6818 9.6818 10.3851 10.3851 10.3883 10.3883 14.1751 14.1751 14.1994 14.1994 15.8333 15.8333 15.8427 15.8427 k = 0.2127 0.8440 1.0369 ( 3566 PWs) bands (ev): -36.0416 -36.0416 -36.0416 -36.0416 -15.4290 -15.4290 -15.4283 -15.4283 -13.7562 -13.7562 -13.7538 -13.7538 -13.6532 -13.6532 -13.6519 -13.6519 4.1686 4.1686 4.1692 4.1692 5.1326 5.1326 5.1416 5.1416 7.2956 7.2956 7.3285 7.3285 8.8506 8.8506 8.8586 8.8586 9.6548 9.6548 9.6928 9.6928 10.3969 10.3969 10.4012 10.4012 14.0898 14.0898 14.1147 14.1147 15.8370 15.8370 15.8434 15.8434 k = 0.2068 0.8205 1.0369 ( 3570 PWs) bands (ev): -36.0417 -36.0417 -36.0417 -36.0417 -15.4285 -15.4285 -15.4276 -15.4276 -13.7550 -13.7550 -13.7525 -13.7525 -13.6532 -13.6532 -13.6518 -13.6518 4.1587 4.1587 4.1591 4.1591 5.0943 5.0943 5.1035 5.1035 7.3765 7.3765 7.4109 7.4109 8.8198 8.8198 8.8270 8.8270 9.6663 9.6663 9.7039 9.7039 10.4114 10.4114 10.4167 10.4167 14.0006 14.0006 14.0260 14.0260 15.8401 15.8401 15.8446 15.8446 k = 0.2009 0.7971 1.0369 ( 3566 PWs) bands (ev): -36.0419 -36.0419 -36.0419 -36.0419 -15.4278 -15.4278 -15.4269 -15.4269 -13.7537 -13.7537 -13.7510 -13.7510 -13.6531 -13.6531 -13.6518 -13.6518 4.1465 4.1465 4.1467 4.1467 5.0564 5.0564 5.0654 5.0654 7.4601 7.4601 7.4958 7.4958 8.7922 8.7922 8.7983 8.7983 9.6778 9.6778 9.7149 9.7149 10.4288 10.4288 10.4352 10.4352 13.9092 13.9092 13.9349 13.9349 15.8422 15.8422 15.8454 15.8454 k = 0.1950 0.7736 1.0369 ( 3582 PWs) bands (ev): -36.0421 -36.0421 -36.0421 -36.0421 -15.4271 -15.4271 -15.4261 -15.4261 -13.7522 -13.7522 -13.7494 -13.7494 -13.6530 -13.6530 -13.6517 -13.6517 4.1318 4.1318 4.1320 4.1320 5.0196 5.0196 5.0281 5.0281 7.5444 7.5444 7.5814 7.5814 8.7687 8.7687 8.7737 8.7737 9.6893 9.6893 9.7258 9.7258 10.4495 10.4495 10.4567 10.4567 13.8169 13.8169 13.8426 13.8426 15.8430 15.8430 15.8454 15.8454 k = 0.1891 0.7502 1.0369 ( 3582 PWs) bands (ev): -36.0424 -36.0424 -36.0424 -36.0424 -15.4263 -15.4263 -15.4252 -15.4252 -13.7506 -13.7506 -13.7477 -13.7477 -13.6529 -13.6529 -13.6515 -13.6515 4.1143 4.1143 4.1147 4.1147 4.9846 4.9846 4.9925 4.9925 7.6275 7.6275 7.6654 7.6654 8.7511 8.7511 8.7549 8.7549 9.7007 9.7007 9.7364 9.7364 10.4736 10.4736 10.4816 10.4816 13.7246 13.7246 13.7504 13.7504 15.8424 15.8424 15.8443 15.8443 k = 0.1832 0.7267 1.0369 ( 3582 PWs) bands (ev): -36.0426 -36.0426 -36.0426 -36.0426 -15.4255 -15.4255 -15.4243 -15.4243 -13.7489 -13.7489 -13.7459 -13.7459 -13.6526 -13.6526 -13.6513 -13.6513 4.0941 4.0941 4.0947 4.0947 4.9520 4.9520 4.9590 4.9590 7.7069 7.7069 7.7455 7.7455 8.7411 8.7411 8.7439 8.7439 9.7121 9.7121 9.7468 9.7468 10.5011 10.5011 10.5099 10.5099 13.6335 13.6335 13.6592 13.6592 15.8403 15.8403 15.8419 15.8419 k = 0.1773 0.7033 1.0369 ( 3590 PWs) bands (ev): -36.0428 -36.0428 -36.0428 -36.0428 -15.4246 -15.4246 -15.4233 -15.4233 -13.7472 -13.7472 -13.7441 -13.7441 -13.6523 -13.6523 -13.6509 -13.6509 4.0711 4.0711 4.0720 4.0720 4.9220 4.9220 4.9280 4.9280 7.7798 7.7798 7.8184 7.8184 8.7412 8.7412 8.7434 8.7434 9.7235 9.7235 9.7570 9.7570 10.5321 10.5321 10.5418 10.5418 13.5441 13.5441 13.5698 13.5698 15.8367 15.8367 15.8382 15.8382 k = 0.1713 0.6799 1.0369 ( 3582 PWs) bands (ev): -36.0431 -36.0431 -36.0431 -36.0431 -15.4236 -15.4236 -15.4223 -15.4223 -13.7454 -13.7454 -13.7422 -13.7422 -13.6519 -13.6519 -13.6505 -13.6505 4.0454 4.0454 4.0467 4.0467 4.8950 4.8950 4.8998 4.8998 7.8432 7.8432 7.8810 7.8810 8.7540 8.7540 8.7563 8.7563 9.7349 9.7349 9.7672 9.7672 10.5666 10.5666 10.5771 10.5771 13.4572 13.4572 13.4827 13.4827 15.8317 15.8317 15.8332 15.8332 k = 0.1654 0.6564 1.0369 ( 3582 PWs) bands (ev): -36.0433 -36.0433 -36.0433 -36.0433 -15.4226 -15.4226 -15.4212 -15.4212 -13.7436 -13.7436 -13.7404 -13.7404 -13.6513 -13.6513 -13.6500 -13.6500 4.0171 4.0171 4.0190 4.0190 4.8708 4.8708 4.8744 4.8744 7.8945 7.8945 7.9305 7.9305 8.7820 8.7820 8.7853 8.7853 9.7466 9.7466 9.7776 9.7776 10.6046 10.6046 10.6158 10.6158 13.3733 13.3733 13.3987 13.3987 15.8253 15.8253 15.8268 15.8268 k = 0.1595 0.6330 1.0369 ( 3594 PWs) bands (ev): -36.0437 -36.0437 -36.0437 -36.0437 -15.4216 -15.4216 -15.4201 -15.4201 -13.7417 -13.7417 -13.7385 -13.7385 -13.6507 -13.6507 -13.6494 -13.6494 3.9867 3.9867 3.9891 3.9891 4.8494 4.8494 4.8518 4.8518 7.9320 7.9320 7.9651 7.9651 8.8262 8.8262 8.8314 8.8314 9.7588 9.7588 9.7883 9.7883 10.6458 10.6458 10.6579 10.6579 13.2928 13.2928 13.3181 13.3181 15.8176 15.8176 15.8192 15.8192 k = 0.1536 0.6095 1.0369 ( 3598 PWs) bands (ev): -36.0440 -36.0440 -36.0440 -36.0440 -15.4205 -15.4205 -15.4190 -15.4190 -13.7399 -13.7399 -13.7367 -13.7367 -13.6499 -13.6499 -13.6487 -13.6487 3.9543 3.9543 3.9572 3.9572 4.8307 4.8307 4.8317 4.8317 7.9557 7.9557 7.9853 7.9853 8.8865 8.8865 8.8942 8.8942 9.7716 9.7716 9.7995 9.7995 10.6902 10.6902 10.7031 10.7031 13.2163 13.2163 13.2414 13.2414 15.8085 15.8085 15.8103 15.8103 k = 0.1477 0.5861 1.0369 ( 3590 PWs) bands (ev): -36.0442 -36.0442 -36.0442 -36.0442 -15.4194 -15.4194 -15.4179 -15.4179 -13.7381 -13.7381 -13.7349 -13.7349 -13.6489 -13.6489 -13.6478 -13.6478 3.9204 3.9204 3.9238 3.9238 4.8141 4.8141 4.8144 4.8144 7.9670 7.9670 7.9928 7.9928 8.9608 8.9608 8.9712 8.9712 9.7854 9.7854 9.8117 9.8117 10.7375 10.7375 10.7513 10.7513 13.1441 13.1441 13.1692 13.1692 15.7982 15.7982 15.8001 15.8001 k = 0.1418 0.5626 1.0369 ( 3586 PWs) bands (ev): -36.0445 -36.0445 -36.0445 -36.0445 -15.4183 -15.4183 -15.4167 -15.4167 -13.7364 -13.7364 -13.7333 -13.7333 -13.6478 -13.6478 -13.6468 -13.6468 3.8854 3.8854 3.8892 3.8892 4.7987 4.7987 4.8002 4.8002 7.9684 7.9684 7.9904 7.9904 9.0463 9.0463 9.0593 9.0593 9.8007 9.8007 9.8251 9.8251 10.7876 10.7876 10.8022 10.8022 13.0767 13.0767 13.1018 13.1018 15.7864 15.7864 15.7886 15.7886 k = 0.1359 0.5392 1.0369 ( 3582 PWs) bands (ev): -36.0448 -36.0448 -36.0448 -36.0448 -15.4172 -15.4172 -15.4156 -15.4156 -13.7348 -13.7348 -13.7317 -13.7317 -13.6465 -13.6465 -13.6456 -13.6456 3.8496 3.8496 3.8538 3.8538 4.7851 4.7851 4.7878 4.7878 7.9622 7.9622 7.9808 7.9808 9.1400 9.1400 9.1552 9.1552 9.8177 9.8177 9.8402 9.8402 10.8401 10.8401 10.8558 10.8558 13.0144 13.0144 13.0396 13.0396 15.7732 15.7732 15.7755 15.7755 k = 0.1300 0.5158 1.0369 ( 3578 PWs) bands (ev): -36.0451 -36.0451 -36.0451 -36.0451 -15.4160 -15.4160 -15.4144 -15.4144 -13.7333 -13.7333 -13.7303 -13.7303 -13.6451 -13.6451 -13.6443 -13.6443 3.8133 3.8133 3.8179 3.8179 4.7732 4.7732 4.7769 4.7769 7.9506 7.9506 7.9660 7.9660 9.2388 9.2388 9.2556 9.2556 9.8374 9.8374 9.8576 9.8576 10.8950 10.8950 10.9117 10.9117 12.9577 12.9577 12.9831 12.9831 15.7580 15.7580 15.7605 15.7605 k = 0.1241 0.4923 1.0369 ( 3570 PWs) bands (ev): -36.0454 -36.0454 -36.0454 -36.0454 -15.4149 -15.4149 -15.4133 -15.4133 -13.7319 -13.7319 -13.7290 -13.7290 -13.6435 -13.6435 -13.6428 -13.6428 3.7770 3.7770 3.7819 3.7819 4.7627 4.7627 4.7673 4.7673 7.9353 7.9353 7.9479 7.9479 9.3398 9.3398 9.3576 9.3576 9.8606 9.8606 9.8782 9.8782 10.9518 10.9518 10.9697 10.9697 12.9070 12.9070 12.9327 12.9327 15.7401 15.7401 15.7428 15.7428 k = 0.1182 0.4689 1.0369 ( 3578 PWs) bands (ev): -36.0457 -36.0457 -36.0457 -36.0457 -15.4137 -15.4137 -15.4121 -15.4121 -13.7306 -13.7306 -13.7278 -13.7278 -13.6418 -13.6418 -13.6411 -13.6411 3.7410 3.7410 3.7461 3.7461 4.7533 4.7533 4.7588 4.7588 7.9176 7.9176 7.9277 7.9277 9.4402 9.4402 9.4578 9.4578 9.8888 9.8888 9.9031 9.9031 11.0106 11.0106 11.0297 11.0297 12.8627 12.8627 12.8890 12.8890 15.7180 15.7180 15.7205 15.7205 k = 0.1123 0.4454 1.0369 ( 3572 PWs) bands (ev): -36.0460 -36.0460 -36.0460 -36.0460 -15.4126 -15.4126 -15.4110 -15.4110 -13.7295 -13.7295 -13.7268 -13.7268 -13.6399 -13.6399 -13.6394 -13.6394 3.7054 3.7054 3.7107 3.7107 4.7449 4.7449 4.7511 4.7511 7.8983 7.8983 7.9062 7.9062 9.5364 9.5364 9.5526 9.5526 9.9244 9.9244 9.9342 9.9342 11.0710 11.0710 11.0914 11.0914 12.8255 12.8255 12.8524 12.8524 15.6882 15.6882 15.6895 15.6895 k = 0.1064 0.4220 1.0369 ( 3588 PWs) bands (ev): -36.0464 -36.0464 -36.0464 -36.0464 -15.4115 -15.4115 -15.4099 -15.4099 -13.7284 -13.7284 -13.7259 -13.7259 -13.6379 -13.6379 -13.6375 -13.6375 3.6706 3.6706 3.6760 3.6760 4.7372 4.7372 4.7440 4.7440 7.8783 7.8783 7.8843 7.8843 9.6247 9.6247 9.6376 9.6376 9.9700 9.9700 9.9740 9.9740 11.1330 11.1330 11.1548 11.1548 12.7957 12.7957 12.8234 12.8234 15.6414 15.6414 15.6441 15.6441 k = 0.1004 0.3985 1.0369 ( 3584 PWs) bands (ev): -36.0466 -36.0466 -36.0466 -36.0466 -15.4104 -15.4104 -15.4089 -15.4089 -13.7275 -13.7275 -13.7252 -13.7252 -13.6358 -13.6358 -13.6355 -13.6355 3.6368 3.6368 3.6422 3.6422 4.7303 4.7303 4.7375 4.7375 7.8580 7.8580 7.8623 7.8623 9.7011 9.7011 9.7094 9.7094 10.0250 10.0250 10.0280 10.0280 11.1967 11.1967 11.2199 11.2199 12.7738 12.7738 12.8026 12.8026 15.5666 15.5666 15.5767 15.5767 k = 0.0945 0.3751 1.0369 ( 3584 PWs) bands (ev): -36.0469 -36.0469 -36.0469 -36.0469 -15.4093 -15.4093 -15.4079 -15.4079 -13.7268 -13.7268 -13.7246 -13.7246 -13.6336 -13.6336 -13.6334 -13.6334 3.6042 3.6042 3.6095 3.6095 4.7239 4.7239 4.7315 4.7315 7.8378 7.8378 7.8407 7.8407 9.7638 9.7638 9.7671 9.7671 10.0875 10.0875 10.0976 10.0976 11.2621 11.2621 11.2868 11.2868 12.7604 12.7604 12.7904 12.7904 15.4680 15.4680 15.4848 15.4848 k = 0.0886 0.3516 1.0369 ( 3576 PWs) bands (ev): -36.0472 -36.0472 -36.0472 -36.0472 -15.4083 -15.4083 -15.4069 -15.4069 -13.7261 -13.7261 -13.7241 -13.7241 -13.6314 -13.6314 -13.6313 -13.6313 3.5729 3.5729 3.5782 3.5782 4.7179 4.7179 4.7257 4.7257 7.8181 7.8181 7.8197 7.8197 9.8133 9.8133 9.8138 9.8138 10.1590 10.1590 10.1747 10.1747 11.3296 11.3296 11.3556 11.3556 12.7556 12.7556 12.7870 12.7870 15.3564 15.3564 15.3772 15.3772 k = 0.0827 0.3282 1.0369 ( 3576 PWs) bands (ev): -36.0475 -36.0475 -36.0475 -36.0475 -15.4073 -15.4073 -15.4060 -15.4060 -13.7256 -13.7256 -13.7237 -13.7237 -13.6292 -13.6292 -13.6291 -13.6291 3.5432 3.5432 3.5482 3.5482 4.7124 4.7124 4.7203 4.7203 7.7990 7.7990 7.7996 7.7996 9.8517 9.8517 9.8547 9.8547 10.2346 10.2346 10.2538 10.2538 11.3997 11.3997 11.4269 11.4269 12.7597 12.7597 12.7926 12.7926 15.2397 15.2397 15.2625 15.2625 k = 0.0768 0.3048 1.0369 ( 3576 PWs) bands (ev): -36.0477 -36.0477 -36.0477 -36.0477 -15.4064 -15.4064 -15.4051 -15.4051 -13.7252 -13.7252 -13.7234 -13.7234 -13.6270 -13.6270 -13.6269 -13.6269 3.5150 3.5150 3.5199 3.5199 4.7073 4.7073 4.7152 4.7152 7.7805 7.7805 7.7807 7.7807 9.8853 9.8853 9.8896 9.8896 10.3093 10.3093 10.3306 10.3306 11.4730 11.4730 11.5010 11.5010 12.7725 12.7725 12.8070 12.8070 15.1218 15.1218 15.1455 15.1455 k = 0.0709 0.2813 1.0369 ( 3576 PWs) bands (ev): -36.0480 -36.0480 -36.0480 -36.0480 -15.4055 -15.4055 -15.4043 -15.4043 -13.7248 -13.7248 -13.7232 -13.7232 -13.6249 -13.6249 -13.6248 -13.6248 3.4885 3.4885 3.4932 3.4932 4.7025 4.7025 4.7102 4.7102 7.7625 7.7625 7.7634 7.7634 9.9160 9.9160 9.9208 9.9208 10.3796 10.3796 10.4017 10.4017 11.5502 11.5502 11.5786 11.5786 12.7935 12.7935 12.8297 12.8297 15.0051 15.0051 15.0292 15.0292 k = 0.0650 0.2579 1.0369 ( 3580 PWs) bands (ev): -36.0482 -36.0482 -36.0482 -36.0482 -15.4047 -15.4047 -15.4035 -15.4035 -13.7245 -13.7245 -13.7231 -13.7231 -13.6228 -13.6228 -13.6226 -13.6226 3.4639 3.4639 3.4683 3.4683 4.6980 4.6980 4.7055 4.7055 7.7458 7.7458 7.7472 7.7472 9.9447 9.9447 9.9496 9.9496 10.4431 10.4431 10.4649 10.4649 11.6317 11.6317 11.6601 11.6601 12.8219 12.8219 12.8597 12.8597 14.8915 14.8915 14.9156 14.9156 k = 0.0591 0.2344 1.0369 ( 3572 PWs) bands (ev): -36.0484 -36.0484 -36.0484 -36.0484 -15.4039 -15.4039 -15.4028 -15.4028 -13.7243 -13.7243 -13.7230 -13.7230 -13.6208 -13.6208 -13.6206 -13.6206 3.4412 3.4412 3.4453 3.4453 4.6939 4.6939 4.7011 4.7011 7.7304 7.7304 7.7321 7.7321 9.9721 9.9721 9.9768 9.9768 10.4982 10.4982 10.5190 10.5190 11.7178 11.7178 11.7457 11.7457 12.8563 12.8563 12.8956 12.8956 14.7827 14.7827 14.8066 14.8066 k = 0.0532 0.2110 1.0369 ( 3572 PWs) bands (ev): -36.0486 -36.0486 -36.0486 -36.0486 -15.4031 -15.4031 -15.4022 -15.4022 -13.7241 -13.7241 -13.7230 -13.7230 -13.6189 -13.6189 -13.6187 -13.6187 3.4205 3.4205 3.4242 3.4242 4.6902 4.6902 4.6969 4.6969 7.7163 7.7163 7.7183 7.7183 9.9982 9.9982 10.0027 10.0027 10.5444 10.5444 10.5636 10.5636 11.8082 11.8082 11.8353 11.8353 12.8946 12.8946 12.9351 12.9351 14.6808 14.6808 14.7042 14.7042 k = 0.0473 0.1875 1.0369 ( 3572 PWs) bands (ev): -36.0488 -36.0488 -36.0488 -36.0488 -15.4025 -15.4025 -15.4016 -15.4016 -13.7240 -13.7240 -13.7230 -13.7230 -13.6171 -13.6171 -13.6169 -13.6169 3.4018 3.4018 3.4052 3.4052 4.6868 4.6868 4.6930 4.6930 7.7037 7.7037 7.7058 7.7058 10.0230 10.0230 10.0271 10.0271 10.5817 10.5817 10.5990 10.5990 11.9024 11.9024 11.9283 11.9283 12.9341 12.9341 12.9754 12.9754 14.5883 14.5883 14.6109 14.6109 k = 0.0414 0.1641 1.0369 ( 3572 PWs) bands (ev): -36.0489 -36.0489 -36.0489 -36.0489 -15.4019 -15.4019 -15.4011 -15.4011 -13.7239 -13.7239 -13.7231 -13.7231 -13.6155 -13.6155 -13.6153 -13.6153 3.3852 3.3852 3.3882 3.3882 4.6838 4.6838 4.6894 4.6894 7.6926 7.6926 7.6946 7.6946 10.0464 10.0464 10.0501 10.0501 10.6109 10.6109 10.6260 10.6260 11.9992 11.9992 12.0237 12.0237 12.9716 12.9716 13.0131 13.0131 14.5083 14.5083 14.5295 14.5295 k = 0.0355 0.1407 1.0369 ( 3576 PWs) bands (ev): -36.0491 -36.0491 -36.0491 -36.0491 -15.4013 -15.4013 -15.4007 -15.4007 -13.7239 -13.7239 -13.7231 -13.7231 -13.6141 -13.6141 -13.6139 -13.6139 3.3708 3.3708 3.3734 3.3734 4.6812 4.6812 4.6861 4.6861 7.6829 7.6829 7.6848 7.6848 10.0680 10.0680 10.0712 10.0712 10.6328 10.6328 10.6457 10.6457 12.0971 12.0971 12.1202 12.1202 13.0032 13.0032 13.0439 13.0439 14.4442 14.4442 14.4634 14.4634 k = 0.0295 0.1172 1.0369 ( 3578 PWs) bands (ev): -36.0492 -36.0492 -36.0492 -36.0492 -15.4009 -15.4009 -15.4003 -15.4003 -13.7238 -13.7238 -13.7232 -13.7232 -13.6128 -13.6128 -13.6126 -13.6126 3.3585 3.3585 3.3608 3.3608 4.6790 4.6790 4.6832 4.6832 7.6747 7.6747 7.6764 7.6764 10.0875 10.0875 10.0902 10.0902 10.6488 10.6488 10.6594 10.6594 12.1941 12.1941 12.2156 12.2156 13.0251 13.0251 13.0638 13.0638 14.3998 14.3998 14.4161 14.4161 k = 0.0236 0.0938 1.0369 ( 3578 PWs) bands (ev): -36.0493 -36.0493 -36.0493 -36.0493 -15.4005 -15.4005 -15.4000 -15.4000 -13.7238 -13.7238 -13.7233 -13.7233 -13.6118 -13.6118 -13.6116 -13.6116 3.3485 3.3485 3.3503 3.3503 4.6773 4.6773 4.6807 4.6807 7.6680 7.6680 7.6695 7.6695 10.1043 10.1043 10.1065 10.1065 10.6599 10.6599 10.6683 10.6683 12.2877 12.2877 12.3074 12.3074 13.0345 13.0345 13.0696 13.0696 14.3773 14.3773 14.3899 14.3899 k = 0.0177 0.0703 1.0369 ( 3586 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.4002 -15.4002 -15.3998 -15.3998 -13.7237 -13.7237 -13.7234 -13.7234 -13.6109 -13.6109 -13.6108 -13.6108 3.3408 3.3408 3.3421 3.3421 4.6761 4.6761 4.6787 4.6787 7.6629 7.6629 7.6640 7.6640 10.1181 10.1181 10.1198 10.1198 10.6674 10.6674 10.6736 10.6736 12.3741 12.3741 12.3914 12.3914 13.0314 13.0314 13.0611 13.0611 14.3764 14.3764 14.3847 14.3847 k = 0.0118 0.0469 1.0369 ( 3590 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3999 -15.3999 -15.3997 -15.3997 -13.7237 -13.7237 -13.7234 -13.7234 -13.6103 -13.6103 -13.6102 -13.6102 3.3353 3.3353 3.3362 3.3362 4.6753 4.6753 4.6770 4.6770 7.6593 7.6593 7.6601 7.6601 10.1285 10.1285 10.1296 10.1296 10.6723 10.6723 10.6764 10.6764 12.4479 12.4479 12.4616 12.4616 13.0196 13.0196 13.0419 13.0419 14.3920 14.3920 14.3964 14.3964 k = 0.0059 0.0234 1.0369 ( 3582 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3996 -15.3996 -13.7236 -13.7236 -13.7235 -13.7235 -13.6099 -13.6099 -13.6099 -13.6099 3.3321 3.3321 3.3325 3.3325 4.6750 4.6750 4.6759 4.6759 7.6572 7.6572 7.6576 7.6576 10.1349 10.1349 10.1355 10.1355 10.6752 10.6752 10.6773 10.6773 12.5009 12.5009 12.5089 12.5089 13.0079 13.0079 13.0202 13.0202 14.4131 14.4131 14.4146 14.4146 k = 0.0000 0.0000 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3996 -15.3996 -15.3996 -15.3996 -13.7236 -13.7236 -13.7236 -13.7236 -13.6098 -13.6098 -13.6098 -13.6098 3.3312 3.3312 3.3312 3.3312 4.6752 4.6752 4.6752 4.6752 7.6566 7.6566 7.6566 7.6566 10.1373 10.1373 10.1373 10.1373 10.6769 10.6769 10.6769 10.6769 12.5233 12.5233 12.5233 12.5233 13.0067 13.0067 13.0067 13.0067 14.4235 14.4235 14.4235 14.4235 k = 0.0000 0.0000 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3996 -15.3996 -15.3996 -15.3996 -13.7236 -13.7236 -13.7236 -13.7236 -13.6098 -13.6098 -13.6098 -13.6098 3.3312 3.3312 3.3312 3.3312 4.6752 4.6752 4.6752 4.6752 7.6566 7.6566 7.6566 7.6566 10.1373 10.1373 10.1373 10.1373 10.6769 10.6769 10.6769 10.6769 12.5233 12.5233 12.5233 12.5233 13.0067 13.0067 13.0067 13.0067 14.4235 14.4235 14.4235 14.4235 k = 0.0000 0.0000 1.0128 ( 3578 PWs) bands (ev): -36.0498 -36.0498 -36.0493 -36.0493 -15.4005 -15.4005 -15.3986 -15.3986 -13.7248 -13.7248 -13.7221 -13.7221 -13.6108 -13.6108 -13.6088 -13.6088 3.2148 3.2148 3.4493 3.4493 4.5815 4.5815 4.7702 4.7702 7.5514 7.5514 7.7637 7.7637 10.1353 10.1353 10.1409 10.1409 10.6733 10.6733 10.6795 10.6795 12.4503 12.4503 12.5966 12.5966 12.9548 12.9548 13.0588 13.0588 14.3819 14.3819 14.4691 14.4691 k = 0.0000 0.0000 0.9887 ( 3581 PWs) bands (ev): -36.0501 -36.0501 -36.0491 -36.0491 -15.4013 -15.4013 -15.3975 -15.3975 -13.7257 -13.7257 -13.7203 -13.7203 -13.6119 -13.6119 -13.6078 -13.6078 3.1002 3.1002 3.5692 3.5692 4.4894 4.4894 4.8663 4.8663 7.4485 7.4485 7.8722 7.8722 10.1348 10.1348 10.1458 10.1458 10.6687 10.6687 10.6814 10.6814 12.3784 12.3784 12.6692 12.6692 12.9045 12.9045 13.1093 13.1093 14.3451 14.3451 14.5175 14.5175 k = 0.0000 0.0000 0.9646 ( 3591 PWs) bands (ev): -36.0504 -36.0504 -36.0489 -36.0489 -15.4020 -15.4020 -15.3962 -15.3962 -13.7264 -13.7264 -13.7183 -13.7183 -13.6129 -13.6129 -13.6068 -13.6068 2.9877 2.9877 3.6906 3.6906 4.3989 4.3989 4.9634 4.9634 7.3483 7.3483 7.9819 7.9819 10.1361 10.1361 10.1520 10.1520 10.6629 10.6629 10.6826 10.6826 12.3083 12.3083 12.7402 12.7402 12.8567 12.8567 13.1559 13.1559 14.3141 14.3141 14.4951 14.4951 k = 0.0000 0.0000 0.9404 ( 3591 PWs) bands (ev): -36.0508 -36.0508 -36.0488 -36.0488 -15.4025 -15.4025 -15.3948 -15.3948 -13.7269 -13.7269 -13.7160 -13.7160 -13.6140 -13.6140 -13.6059 -13.6059 2.8771 2.8771 3.8132 3.8132 4.3103 4.3103 5.0610 5.0610 7.2513 7.2513 8.0924 8.0924 10.1390 10.1390 10.1592 10.1592 10.6557 10.6557 10.6833 10.6833 12.2407 12.2407 12.8082 12.8082 12.8126 12.8126 13.1953 13.1953 14.2898 14.2898 14.4097 14.4097 k = 0.0000 0.0000 0.9163 ( 3587 PWs) bands (ev): -36.0511 -36.0511 -36.0486 -36.0486 -15.4029 -15.4029 -15.3933 -15.3933 -13.7270 -13.7270 -13.7134 -13.7134 -13.6150 -13.6150 -13.6050 -13.6050 2.7687 2.7687 3.9368 3.9368 4.2239 4.2239 5.1587 5.1587 7.1582 7.1582 8.2034 8.2034 10.1438 10.1438 10.1673 10.1673 10.6470 10.6470 10.6835 10.6835 12.1761 12.1761 12.7720 12.7720 12.8723 12.8723 13.2235 13.2235 14.2724 14.2724 14.3410 14.3410 k = 0.0000 0.0000 0.8922 ( 3587 PWs) bands (ev): -36.0515 -36.0515 -36.0485 -36.0485 -15.4032 -15.4032 -15.3917 -15.3917 -13.7270 -13.7270 -13.7106 -13.7106 -13.6160 -13.6160 -13.6041 -13.6041 2.6624 2.6624 4.0578 4.0578 4.1428 4.1428 5.2560 5.2560 7.0699 7.0699 8.3147 8.3147 10.1503 10.1503 10.1758 10.1758 10.6367 10.6367 10.6833 10.6833 12.1151 12.1151 12.7363 12.7363 12.9307 12.9307 13.2358 13.2358 14.2585 14.2585 14.2986 14.2986 k = 0.0000 0.0000 0.8681 ( 3589 PWs) bands (ev): -36.0519 -36.0519 -36.0485 -36.0485 -15.4034 -15.4034 -15.3900 -15.3900 -13.7267 -13.7267 -13.7075 -13.7075 -13.6170 -13.6170 -13.6033 -13.6033 2.5583 2.5583 4.0505 4.0505 4.1927 4.1927 5.3520 5.3520 6.9876 6.9876 8.4258 8.4258 10.1585 10.1585 10.1846 10.1846 10.6245 10.6245 10.6828 10.6828 12.0582 12.0582 12.7056 12.7056 12.9823 12.9823 13.2285 13.2285 14.2449 14.2449 14.2908 14.2908 k = 0.0000 0.0000 0.8440 ( 3591 PWs) bands (ev): -36.0524 -36.0524 -36.0484 -36.0484 -15.4035 -15.4035 -15.3882 -15.3882 -13.7262 -13.7262 -13.7042 -13.7042 -13.6180 -13.6180 -13.6025 -13.6025 2.4565 2.4565 3.9711 3.9711 4.3170 4.3170 5.4457 5.4457 6.9126 6.9126 8.5364 8.5364 10.1684 10.1684 10.1932 10.1932 10.6105 10.6105 10.6820 10.6820 12.0061 12.0061 12.6801 12.6801 13.0259 13.0259 13.1999 13.1999 14.2456 14.2456 14.3059 14.3059 k = 0.0000 0.0000 0.8199 ( 3589 PWs) bands (ev): -36.0528 -36.0528 -36.0484 -36.0484 -15.4034 -15.4034 -15.3863 -15.3863 -13.7255 -13.7255 -13.7007 -13.7007 -13.6189 -13.6189 -13.6017 -13.6017 2.3569 2.3569 3.8922 3.8922 4.4424 4.4424 5.5357 5.5357 6.8472 6.8472 8.6462 8.6462 10.1800 10.1800 10.2012 10.2012 10.5946 10.5946 10.6809 10.6809 11.9593 11.9593 12.6603 12.6603 13.0609 13.0609 13.1515 13.1515 14.2672 14.2672 14.3362 14.3362 k = 0.0000 0.0000 0.7958 ( 3581 PWs) bands (ev): -36.0533 -36.0533 -36.0483 -36.0483 -15.4033 -15.4033 -15.3843 -15.3843 -13.7246 -13.7246 -13.6970 -13.6970 -13.6197 -13.6197 -13.6010 -13.6010 2.2597 2.2597 3.8151 3.8151 4.5670 4.5670 5.6201 5.6201 6.7938 6.7938 8.7548 8.7548 10.1932 10.1932 10.2084 10.2084 10.5769 10.5769 10.6796 10.6796 11.9183 11.9183 12.6461 12.6461 13.0842 13.0842 13.0903 13.0903 14.3075 14.3075 14.3798 14.3798 k = 0.0000 0.0000 0.7716 ( 3575 PWs) bands (ev): -36.0537 -36.0537 -36.0483 -36.0483 -15.4030 -15.4030 -15.3822 -15.3822 -13.7235 -13.7235 -13.6931 -13.6931 -13.6205 -13.6205 -13.6003 -13.6003 2.1649 2.1649 3.7401 3.7401 4.6895 4.6895 5.6966 5.6966 6.7559 6.7559 8.8616 8.8616 10.2078 10.2078 10.2141 10.2141 10.5572 10.5572 10.6779 10.6779 11.8837 11.8837 12.6377 12.6377 13.0104 13.0104 13.1063 13.1063 14.3623 14.3623 14.4355 14.4355 k = 0.0000 0.0000 0.7475 ( 3575 PWs) bands (ev): -36.0543 -36.0543 -36.0484 -36.0484 -15.4027 -15.4027 -15.3801 -15.3801 -13.7223 -13.7223 -13.6890 -13.6890 -13.6211 -13.6211 -13.5996 -13.5996 2.0724 2.0724 3.6671 3.6671 4.8080 4.8080 5.7633 5.7633 6.7373 6.7373 8.9664 8.9664 10.2180 10.2180 10.2238 10.2238 10.5359 10.5359 10.6759 10.6759 11.8560 11.8560 12.6351 12.6351 12.9260 12.9260 13.1181 13.1181 14.4276 14.4276 14.5014 14.5014 k = 0.0000 0.0000 0.7234 ( 3579 PWs) bands (ev): -36.0548 -36.0548 -36.0484 -36.0484 -15.4023 -15.4023 -15.3779 -15.3779 -13.7210 -13.7210 -13.6847 -13.6847 -13.6217 -13.6217 -13.5989 -13.5989 1.9825 1.9825 3.5962 3.5962 4.9201 4.9201 5.8194 5.8194 6.7410 6.7410 9.0686 9.0686 10.2197 10.2197 10.2410 10.2410 10.5131 10.5131 10.6736 10.6736 11.8357 11.8357 12.6381 12.6381 12.8365 12.8365 13.1244 13.1244 14.4992 14.4992 14.5748 14.5748 k = 0.0000 0.0000 0.6993 ( 3581 PWs) bands (ev): -36.0553 -36.0553 -36.0486 -36.0486 -15.4018 -15.4018 -15.3756 -15.3756 -13.7196 -13.7196 -13.6803 -13.6803 -13.6221 -13.6221 -13.5983 -13.5983 1.8950 1.8950 3.5274 3.5274 5.0219 5.0219 5.8673 5.8673 6.7686 6.7686 9.1675 9.1675 10.2188 10.2188 10.2594 10.2594 10.4889 10.4889 10.6709 10.6709 11.8231 11.8231 12.6458 12.6458 12.7447 12.7447 13.1268 13.1268 14.5133 14.5133 14.5770 14.5770 k = 0.0000 0.0000 0.6752 ( 3587 PWs) bands (ev): -36.0559 -36.0559 -36.0487 -36.0487 -15.4013 -15.4013 -15.3734 -15.3734 -13.7181 -13.7181 -13.6758 -13.6758 -13.6223 -13.6223 -13.5977 -13.5977 1.8101 1.8101 3.4608 3.4608 5.1084 5.1084 5.9130 5.9130 6.8190 6.8190 9.2627 9.2627 10.2152 10.2152 10.2787 10.2787 10.4637 10.4637 10.6677 10.6677 11.8186 11.8186 12.6387 12.6387 12.6718 12.6718 13.1265 13.1265 14.4353 14.4353 14.6467 14.6467 k = 0.0000 0.0000 0.6511 ( 3591 PWs) bands (ev): -36.0564 -36.0564 -36.0488 -36.0488 -15.4007 -15.4007 -15.3711 -15.3711 -13.7166 -13.7166 -13.6713 -13.6713 -13.6224 -13.6224 -13.5971 -13.5971 1.7277 1.7277 3.3964 3.3964 5.1739 5.1739 5.9652 5.9652 6.8890 6.8890 9.3535 9.3535 10.2087 10.2087 10.2989 10.2989 10.4379 10.4379 10.6640 10.6640 11.8222 11.8222 12.5514 12.5514 12.6839 12.6839 13.1249 13.1249 14.3645 14.3645 14.6891 14.6891 k = 0.0000 0.0000 0.6270 ( 3599 PWs) bands (ev): -36.0569 -36.0569 -36.0490 -36.0490 -15.4000 -15.4000 -15.3687 -15.3687 -13.7151 -13.7151 -13.6667 -13.6667 -13.6223 -13.6223 -13.5965 -13.5965 1.6479 1.6479 3.3343 3.3343 5.2145 5.2145 6.0319 6.0319 6.9746 6.9746 9.4393 9.4393 10.1994 10.1994 10.3197 10.3197 10.4118 10.4118 10.6598 10.6598 11.8340 11.8340 12.4576 12.4576 12.7078 12.7078 13.1230 13.1230 14.3024 14.3024 14.6603 14.6603 k = 0.0000 0.0000 0.6028 ( 3599 PWs) bands (ev): -36.0575 -36.0575 -36.0492 -36.0492 -15.3993 -15.3993 -15.3664 -15.3664 -13.7136 -13.7136 -13.6620 -13.6620 -13.6220 -13.6220 -13.5959 -13.5959 1.5708 1.5708 3.2743 3.2743 5.2299 5.2299 6.1168 6.1168 7.0721 7.0721 9.5191 9.5191 10.1872 10.1872 10.3410 10.3410 10.3860 10.3860 10.6548 10.6548 11.8539 11.8539 12.3643 12.3643 12.7369 12.7369 13.1217 13.1217 14.2500 14.2500 14.5911 14.5911 k = 0.0000 0.0000 0.5787 ( 3595 PWs) bands (ev): -36.0580 -36.0580 -36.0493 -36.0493 -15.3986 -15.3986 -15.3641 -15.3641 -13.7122 -13.7122 -13.6574 -13.6574 -13.6214 -13.6214 -13.5953 -13.5953 1.4964 1.4964 3.2166 3.2166 5.2241 5.2241 6.2188 6.2188 7.1786 7.1786 9.5924 9.5924 10.1724 10.1724 10.3601 10.3601 10.3635 10.3635 10.6492 10.6492 11.8817 11.8817 12.2722 12.2722 12.7708 12.7708 13.1219 13.1219 14.2078 14.2078 14.5121 14.5121 k = 0.0000 0.0000 0.5546 ( 3595 PWs) bands (ev): -36.0586 -36.0586 -36.0495 -36.0495 -15.3978 -15.3978 -15.3617 -15.3617 -13.7109 -13.7109 -13.6529 -13.6529 -13.6206 -13.6206 -13.5946 -13.5946 1.4246 1.4246 3.1612 3.1612 5.2024 5.2024 6.3345 6.3345 7.2920 7.2920 9.6582 9.6582 10.1554 10.1554 10.3372 10.3372 10.3845 10.3845 10.6428 10.6428 11.9168 11.9168 12.1820 12.1820 12.8089 12.8089 13.1241 13.1241 14.1763 14.1763 14.4302 14.4302 k = 0.0000 0.0000 0.5305 ( 3595 PWs) bands (ev): -36.0591 -36.0591 -36.0497 -36.0497 -15.3970 -15.3970 -15.3594 -15.3594 -13.7096 -13.7096 -13.6485 -13.6485 -13.6196 -13.6196 -13.5939 -13.5939 1.3556 1.3556 3.1080 3.1080 5.1698 5.1698 6.4604 6.4604 7.4105 7.4105 9.7156 9.7156 10.1363 10.1363 10.3158 10.3158 10.4061 10.4061 10.6355 10.6355 11.9582 11.9582 12.0946 12.0946 12.8511 12.8511 13.1290 13.1290 14.1557 14.1557 14.3475 14.3475 k = 0.0000 0.0000 0.5064 ( 3593 PWs) bands (ev): -36.0597 -36.0597 -36.0499 -36.0499 -15.3962 -15.3962 -15.3572 -15.3572 -13.7085 -13.7085 -13.6443 -13.6443 -13.6182 -13.6182 -13.5930 -13.5930 1.2894 1.2894 3.0571 3.0571 5.1303 5.1303 6.5936 6.5936 7.5330 7.5330 9.7637 9.7637 10.1157 10.1157 10.2973 10.2973 10.4275 10.4275 10.6272 10.6272 11.9880 11.9880 12.0278 12.0278 12.8972 12.8972 13.1371 13.1371 14.1464 14.1464 14.2644 14.2644 k = 0.0000 0.0000 0.4823 ( 3593 PWs) bands (ev): -36.0602 -36.0602 -36.0501 -36.0501 -15.3953 -15.3953 -15.3549 -15.3549 -13.7074 -13.7074 -13.6402 -13.6402 -13.6167 -13.6167 -13.5921 -13.5921 1.2260 1.2260 3.0085 3.0085 5.0865 5.0865 6.7319 6.7319 7.6587 7.6587 9.8019 9.8019 10.0939 10.0939 10.2826 10.2826 10.4485 10.4485 10.6179 10.6179 11.9177 11.9177 12.0697 12.0697 12.9470 12.9470 13.1486 13.1486 14.1478 14.1478 14.1817 14.1817 k = 0.0000 0.0000 0.4582 ( 3589 PWs) bands (ev): -36.0607 -36.0607 -36.0503 -36.0503 -15.3945 -15.3945 -15.3527 -15.3527 -13.7066 -13.7066 -13.6364 -13.6364 -13.6149 -13.6149 -13.5910 -13.5910 1.1655 1.1655 2.9623 2.9623 5.0404 5.0404 6.8738 6.8738 7.7868 7.7868 9.8297 9.8297 10.0713 10.0713 10.2721 10.2721 10.4689 10.4689 10.6074 10.6074 11.8367 11.8367 12.1306 12.1306 13.0003 13.0003 13.1640 13.1640 14.0975 14.0975 14.1618 14.1618 k = 0.0000 0.0000 0.4340 ( 3599 PWs) bands (ev): -36.0613 -36.0613 -36.0505 -36.0505 -15.3937 -15.3937 -15.3506 -15.3506 -13.7058 -13.7058 -13.6329 -13.6329 -13.6130 -13.6130 -13.5897 -13.5897 1.1078 1.1078 2.9183 2.9183 4.9933 4.9933 7.0183 7.0183 7.9168 7.9168 9.8472 9.8472 10.0482 10.0482 10.2660 10.2660 10.4885 10.4885 10.5957 10.5957 11.7572 11.7572 12.1979 12.1979 13.0568 13.0568 13.1836 13.1836 14.0145 14.0145 14.1851 14.1851 k = 0.0000 0.0000 0.4099 ( 3603 PWs) bands (ev): -36.0618 -36.0618 -36.0507 -36.0507 -15.3929 -15.3929 -15.3486 -15.3486 -13.7052 -13.7052 -13.6297 -13.6297 -13.6110 -13.6110 -13.5881 -13.5881 1.0530 1.0530 2.8766 2.8766 4.9463 4.9463 7.1643 7.1643 8.0482 8.0482 9.8554 9.8554 10.0249 10.0249 10.2638 10.2638 10.5070 10.5070 10.5827 10.5827 11.6798 11.6798 12.2706 12.2706 13.1164 13.1164 13.2078 13.2078 13.9314 13.9314 14.2186 14.2186 k = 0.0000 0.0000 0.3858 ( 3603 PWs) bands (ev): -36.0623 -36.0623 -36.0509 -36.0509 -15.3921 -15.3921 -15.3466 -15.3466 -13.7047 -13.7047 -13.6267 -13.6267 -13.6091 -13.6091 -13.5863 -13.5863 1.0012 1.0012 2.8373 2.8373 4.9000 4.9000 7.3111 7.3111 8.1805 8.1805 9.8557 9.8557 10.0017 10.0017 10.2644 10.2644 10.5242 10.5242 10.5687 10.5687 11.6047 11.6047 12.3482 12.3482 13.1785 13.1785 13.2370 13.2370 13.8481 13.8481 14.2614 14.2614 k = 0.0000 0.0000 0.3617 ( 3603 PWs) bands (ev): -36.0628 -36.0628 -36.0511 -36.0511 -15.3913 -15.3913 -15.3447 -15.3447 -13.7044 -13.7044 -13.6239 -13.6239 -13.6072 -13.6072 -13.5842 -13.5842 0.9523 0.9523 2.8004 2.8004 4.8551 4.8551 7.4581 7.4581 8.3133 8.3133 9.8499 9.8499 9.9790 9.9790 10.2666 10.2666 10.5370 10.5370 10.5563 10.5563 11.5318 11.5318 12.4302 12.4302 13.2409 13.2409 13.2733 13.2733 13.7647 13.7647 14.3125 14.3125 k = 0.0000 0.0000 0.3376 ( 3599 PWs) bands (ev): -36.0632 -36.0632 -36.0513 -36.0513 -15.3905 -15.3905 -15.3428 -15.3428 -13.7042 -13.7042 -13.6215 -13.6215 -13.6055 -13.6055 -13.5818 -13.5818 0.9065 0.9065 2.7657 2.7657 4.8118 4.8118 7.6047 7.6047 8.4462 8.4462 9.8397 9.8397 9.9569 9.9569 10.2692 10.2692 10.5296 10.5296 10.5612 10.5612 11.4612 11.4612 12.5162 12.5162 13.2951 13.2951 13.3249 13.3249 13.6812 13.6812 14.3710 14.3710 k = 0.0000 0.0000 0.3135 ( 3607 PWs) bands (ev): -36.0636 -36.0636 -36.0515 -36.0515 -15.3898 -15.3898 -15.3411 -15.3411 -13.7040 -13.7040 -13.6192 -13.6192 -13.6038 -13.6038 -13.5793 -13.5793 0.8637 0.8637 2.7335 2.7335 4.7706 4.7706 7.7502 7.7502 8.5788 8.5788 9.8267 9.8267 9.9356 9.9356 10.2716 10.2716 10.5110 10.5110 10.5743 10.5743 11.3927 11.3927 12.6058 12.6058 13.3411 13.3411 13.3914 13.3914 13.5978 13.5978 14.4356 14.4356 k = 0.0000 0.0000 0.2894 ( 3599 PWs) bands (ev): -36.0640 -36.0640 -36.0517 -36.0517 -15.3891 -15.3891 -15.3395 -15.3395 -13.7039 -13.7039 -13.6172 -13.6172 -13.6023 -13.6023 -13.5766 -13.5766 0.8239 0.8239 2.7036 2.7036 4.7317 4.7317 7.8940 7.8940 8.7106 8.7106 9.8120 9.8120 9.9153 9.9153 10.2731 10.2731 10.4894 10.4894 10.5871 10.5871 11.3262 11.3262 12.6986 12.6986 13.3884 13.3884 13.4600 13.4600 13.5173 13.5173 14.5050 14.5050 k = 0.0000 0.0000 0.2653 ( 3597 PWs) bands (ev): -36.0643 -36.0643 -36.0518 -36.0518 -15.3885 -15.3885 -15.3380 -15.3380 -13.7039 -13.7039 -13.6155 -13.6155 -13.6009 -13.6009 -13.5738 -13.5738 0.7872 0.7872 2.6761 2.6761 4.6954 4.6954 8.0353 8.0353 8.8410 8.8410 9.7965 9.7965 9.8962 9.8962 10.2736 10.2736 10.4654 10.4654 10.5989 10.5989 11.2618 11.2618 12.7940 12.7940 13.4228 13.4228 13.4434 13.4434 13.5409 13.5409 14.5777 14.5777 k = 0.0000 0.0000 0.2411 ( 3593 PWs) bands (ev): -36.0647 -36.0647 -36.0520 -36.0520 -15.3879 -15.3879 -15.3366 -15.3366 -13.7040 -13.7040 -13.6140 -13.6140 -13.5995 -13.5995 -13.5711 -13.5711 0.7536 0.7536 2.6509 2.6509 4.6617 4.6617 8.1733 8.1733 8.9694 8.9694 9.7809 9.7809 9.8784 9.8784 10.2731 10.2731 10.4390 10.4390 10.6096 10.6096 11.1993 11.1993 12.8915 12.8915 13.3435 13.3435 13.4957 13.4957 13.6150 13.6150 14.5879 14.5879 k = 0.0000 0.0000 0.2170 ( 3599 PWs) bands (ev): -36.0650 -36.0650 -36.0522 -36.0522 -15.3873 -15.3873 -15.3353 -15.3353 -13.7040 -13.7040 -13.6127 -13.6127 -13.5982 -13.5982 -13.5685 -13.5685 0.7231 0.7231 2.6281 2.6281 4.6309 4.6309 8.3070 8.3070 9.0953 9.0953 9.7657 9.7657 9.8620 9.8620 10.2716 10.2716 10.4102 10.4102 10.6191 10.6191 11.1388 11.1388 12.9901 12.9901 13.2619 13.2619 13.5546 13.5546 13.6904 13.6904 14.4936 14.4936 k = 0.0000 0.0000 0.1929 ( 3599 PWs) bands (ev): -36.0653 -36.0653 -36.0523 -36.0523 -15.3868 -15.3868 -15.3341 -15.3341 -13.7041 -13.7041 -13.6117 -13.6117 -13.5969 -13.5969 -13.5660 -13.5660 0.6958 0.6958 2.6077 2.6077 4.6030 4.6030 8.4355 8.4355 9.2176 9.2176 9.7514 9.7514 9.8471 9.8471 10.2695 10.2695 10.3791 10.3791 10.6275 10.6275 11.0802 11.0802 13.0868 13.0868 13.1847 13.1847 13.6173 13.6173 13.7653 13.7653 14.4043 14.4043 k = 0.0000 0.0000 0.1688 ( 3595 PWs) bands (ev): -36.0655 -36.0655 -36.0524 -36.0524 -15.3864 -15.3864 -15.3331 -15.3331 -13.7043 -13.7043 -13.6109 -13.6109 -13.5957 -13.5957 -13.5638 -13.5638 0.6717 0.6717 2.5897 2.5897 4.5782 4.5782 8.5574 8.5574 9.3353 9.3353 9.7381 9.7381 9.8337 9.8337 10.2668 10.2668 10.3458 10.3458 10.6347 10.6347 11.0238 11.0238 13.0966 13.0966 13.1972 13.1972 13.6833 13.6833 13.8384 13.8384 14.3223 14.3223 k = 0.0000 0.0000 0.1447 ( 3595 PWs) bands (ev): -36.0657 -36.0657 -36.0526 -36.0526 -15.3860 -15.3860 -15.3322 -15.3322 -13.7044 -13.7044 -13.6102 -13.6102 -13.5946 -13.5946 -13.5617 -13.5617 0.6507 0.6507 2.5741 2.5741 4.5565 4.5565 8.6711 8.6711 9.4472 9.4472 9.7263 9.7263 9.8221 9.8221 10.2638 10.2638 10.3106 10.3106 10.6409 10.6409 10.9699 10.9699 13.0268 13.0268 13.2921 13.2921 13.7520 13.7520 13.9085 13.9085 14.2493 14.2493 k = 0.0000 0.0000 0.1206 ( 3605 PWs) bands (ev): -36.0660 -36.0660 -36.0527 -36.0527 -15.3857 -15.3857 -15.3315 -15.3315 -13.7045 -13.7045 -13.6096 -13.6096 -13.5936 -13.5936 -13.5600 -13.5600 0.6330 0.6330 2.5609 2.5609 4.5381 4.5381 8.7747 8.7747 9.5516 9.5516 9.7160 9.7160 9.8121 9.8121 10.2598 10.2598 10.2752 10.2752 10.6461 10.6461 10.9191 10.9191 12.9609 12.9609 13.3859 13.3859 13.8226 13.8226 13.9735 13.9735 14.1865 14.1865 k = 0.0000 0.0000 0.0965 ( 3605 PWs) bands (ev): -36.0661 -36.0661 -36.0528 -36.0528 -15.3854 -15.3854 -15.3308 -15.3308 -13.7046 -13.7046 -13.6092 -13.6092 -13.5928 -13.5928 -13.5585 -13.5585 0.6184 0.6184 2.5501 2.5501 4.5229 4.5229 8.8659 8.8659 9.6462 9.6462 9.7077 9.7077 9.8040 9.8040 10.2356 10.2356 10.2600 10.2600 10.6503 10.6503 10.8725 10.8725 12.9030 12.9030 13.4739 13.4739 13.8938 13.8938 14.0309 14.0309 14.1354 14.1354 k = 0.0000 0.0000 0.0723 ( 3605 PWs) bands (ev): -36.0662 -36.0662 -36.0529 -36.0529 -15.3852 -15.3852 -15.3303 -15.3303 -13.7047 -13.7047 -13.6090 -13.6090 -13.5921 -13.5921 -13.5573 -13.5573 0.6071 0.6071 2.5417 2.5417 4.5111 4.5111 8.9418 8.9418 9.6994 9.6994 9.7303 9.7303 9.7977 9.7977 10.2008 10.2008 10.2572 10.2572 10.6535 10.6535 10.8320 10.8320 12.8552 12.8552 13.5519 13.5519 13.9631 13.9631 14.0709 14.0709 14.1041 14.1041 k = 0.0000 0.0000 0.0482 ( 3605 PWs) bands (ev): -36.0663 -36.0663 -36.0529 -36.0529 -15.3850 -15.3850 -15.3300 -15.3300 -13.7047 -13.7047 -13.6088 -13.6088 -13.5916 -13.5916 -13.5565 -13.5565 0.5990 0.5990 2.5357 2.5357 4.5026 4.5026 8.9995 8.9995 9.6952 9.6952 9.7894 9.7894 9.7999 9.7999 10.1695 10.1695 10.2554 10.2554 10.6558 10.6558 10.7998 10.7998 12.8195 12.8195 13.6146 13.6146 14.0250 14.0250 14.0596 14.0596 14.1250 14.1250 k = 0.0000 0.0000 0.0241 ( 3597 PWs) bands (ev): -36.0663 -36.0663 -36.0529 -36.0529 -15.3849 -15.3849 -15.3298 -15.3298 -13.7048 -13.7048 -13.6086 -13.6086 -13.5913 -13.5913 -13.5560 -13.5560 0.5941 0.5941 2.5321 2.5321 4.4975 4.4975 9.0356 9.0356 9.6923 9.6923 9.7895 9.7895 9.8418 9.8418 10.1464 10.1464 10.2543 10.2543 10.6572 10.6572 10.7788 10.7788 12.7975 12.7975 13.6559 13.6559 14.0394 14.0394 14.0774 14.0774 14.1471 14.1471 k = 0.0000 0.0000 0.0000 ( 3595 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3849 -15.3849 -15.3297 -15.3297 -13.7048 -13.7048 -13.6086 -13.6086 -13.5912 -13.5912 -13.5558 -13.5558 0.5925 0.5925 2.5309 2.5309 4.4958 4.4958 9.0480 9.0480 9.6913 9.6913 9.7887 9.7887 9.8580 9.8580 10.1376 10.1376 10.2539 10.2539 10.6577 10.6577 10.7714 10.7714 12.7900 12.7900 13.6704 13.6704 14.0345 14.0345 14.0959 14.0959 14.1547 14.1547 k = 0.0000 0.0000 0.0000 ( 3595 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3849 -15.3849 -15.3297 -15.3297 -13.7048 -13.7048 -13.6086 -13.6086 -13.5912 -13.5912 -13.5558 -13.5558 0.5925 0.5925 2.5309 2.5309 4.4958 4.4958 9.0480 9.0480 9.6913 9.6913 9.7887 9.7887 9.8580 9.8580 10.1376 10.1376 10.2539 10.2539 10.6577 10.6577 10.7714 10.7714 12.7900 12.7900 13.6704 13.6704 14.0345 14.0345 14.0959 14.0959 14.1547 14.1547 k =-0.0227 0.0057 0.0000 ( 3601 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3849 -15.3849 -15.3297 -15.3297 -13.7047 -13.7047 -13.6086 -13.6086 -13.5912 -13.5912 -13.5558 -13.5558 0.5939 0.5939 2.5258 2.5258 4.5020 4.5020 9.0483 9.0483 9.6616 9.6616 9.7878 9.7878 9.8586 9.8586 10.1595 10.1595 10.2589 10.2589 10.6594 10.6594 10.7706 10.7706 12.7882 12.7882 13.6699 13.6699 14.0390 14.0390 14.0965 14.0965 14.1545 14.1545 k =-0.0455 0.0115-0.0000 ( 3605 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3848 -15.3848 -15.3298 -15.3298 -13.7046 -13.7046 -13.6087 -13.6087 -13.5912 -13.5912 -13.5559 -13.5559 0.5981 0.5981 2.5107 2.5107 4.5203 4.5203 9.0490 9.0490 9.5878 9.5878 9.7851 9.7851 9.8605 9.8605 10.1965 10.1965 10.2875 10.2875 10.6645 10.6645 10.7680 10.7680 12.7827 12.7827 13.6683 13.6683 14.0527 14.0527 14.0983 14.0983 14.1541 14.1541 k =-0.0682 0.0172-0.0000 ( 3620 PWs) bands (ev): -36.0664 -36.0664 -36.0530 -36.0530 -15.3847 -15.3847 -15.3299 -15.3299 -13.7043 -13.7043 -13.6089 -13.6089 -13.5911 -13.5911 -13.5561 -13.5561 0.6050 0.6050 2.4863 2.4863 4.5500 4.5500 9.0498 9.0498 9.4918 9.4918 9.7806 9.7806 9.8638 9.8638 10.2093 10.2093 10.3571 10.3571 10.6728 10.6728 10.7637 10.7637 12.7740 12.7740 13.6658 13.6658 14.0754 14.0754 14.1014 14.1014 14.1538 14.1538 k =-0.0909 0.0229-0.0000 ( 3606 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3845 -15.3845 -15.3300 -15.3300 -13.7040 -13.7040 -13.6091 -13.6091 -13.5911 -13.5911 -13.5563 -13.5563 0.6146 0.6146 2.4534 2.4534 4.5903 4.5903 9.0498 9.0498 9.3866 9.3866 9.7747 9.7747 9.8684 9.8684 10.2079 10.2079 10.4460 10.4460 10.6842 10.6842 10.7577 10.7577 12.7626 12.7626 13.6624 13.6624 14.1026 14.1026 14.1088 14.1088 14.1552 14.1552 k =-0.1136 0.0286 0.0000 ( 3606 PWs) bands (ev): -36.0664 -36.0664 -36.0529 -36.0529 -15.3843 -15.3843 -15.3302 -15.3302 -13.7035 -13.7035 -13.6094 -13.6094 -13.5910 -13.5910 -13.5565 -13.5565 0.6270 0.6270 2.4132 2.4132 4.6399 4.6399 9.0463 9.0463 9.2801 9.2801 9.7674 9.7674 9.8742 9.8742 10.2016 10.2016 10.5392 10.5392 10.6983 10.6983 10.7503 10.7503 12.7495 12.7495 13.6583 13.6583 14.1090 14.1090 14.1342 14.1342 14.1702 14.1702 k =-0.1364 0.0344-0.0000 ( 3610 PWs) bands (ev): -36.0664 -36.0664 -36.0530 -36.0530 -15.3841 -15.3841 -15.3304 -15.3304 -13.7030 -13.7030 -13.6098 -13.6098 -13.5910 -13.5910 -13.5569 -13.5569 0.6420 0.6420 2.3668 2.3668 4.6976 4.6976 9.0294 9.0294 9.1850 9.1850 9.7590 9.7590 9.8812 9.8812 10.1928 10.1928 10.6312 10.6312 10.7147 10.7147 10.7416 10.7416 12.7357 12.7357 13.6535 13.6535 14.1139 14.1139 14.1398 14.1398 14.2170 14.2170 k =-0.1591 0.0401-0.0000 ( 3602 PWs) bands (ev): -36.0663 -36.0663 -36.0530 -36.0530 -15.3838 -15.3838 -15.3307 -15.3307 -13.7024 -13.7024 -13.6102 -13.6102 -13.5909 -13.5909 -13.5572 -13.5572 0.6596 0.6596 2.3153 2.3153 4.7622 4.7622 8.9723 8.9723 9.1295 9.1295 9.7498 9.7498 9.8893 9.8893 10.1827 10.1827 10.7172 10.7172 10.7290 10.7290 10.7381 10.7381 12.7228 12.7228 13.6482 13.6482 14.1180 14.1180 14.1395 14.1395 14.2799 14.2799 k =-0.1818 0.0458-0.0000 ( 3600 PWs) bands (ev): -36.0663 -36.0663 -36.0530 -36.0530 -15.3835 -15.3835 -15.3310 -15.3310 -13.7017 -13.7017 -13.6106 -13.6106 -13.5908 -13.5908 -13.5576 -13.5576 0.6797 0.6797 2.2599 2.2599 4.8322 4.8322 8.8752 8.8752 9.1143 9.1143 9.7400 9.7400 9.8984 9.8984 10.1717 10.1717 10.7181 10.7181 10.7535 10.7535 10.8042 10.8042 12.7123 12.7123 13.6426 13.6426 14.1200 14.1200 14.1394 14.1394 14.2795 14.2795 k =-0.2045 0.0516-0.0000 ( 3598 PWs) bands (ev): -36.0663 -36.0663 -36.0530 -36.0530 -15.3832 -15.3832 -15.3313 -15.3313 -13.7010 -13.7010 -13.6111 -13.6111 -13.5907 -13.5907 -13.5580 -13.5580 0.7023 0.7023 2.2016 2.2016 4.9067 4.9067 8.7649 8.7649 9.1136 9.1136 9.7299 9.7299 9.9085 9.9085 10.1604 10.1604 10.7057 10.7057 10.7749 10.7749 10.8799 10.8799 12.7058 12.7058 13.6368 13.6368 14.1182 14.1182 14.1407 14.1407 14.2378 14.2378 k =-0.2273 0.0573-0.0000 ( 3596 PWs) bands (ev): -36.0663 -36.0663 -36.0530 -36.0530 -15.3828 -15.3828 -15.3316 -15.3316 -13.7002 -13.7002 -13.6116 -13.6116 -13.5906 -13.5906 -13.5585 -13.5585 0.7272 0.7272 2.1413 2.1413 4.9844 4.9844 8.6516 8.6516 9.1175 9.1175 9.7197 9.7197 9.9193 9.9193 10.1491 10.1491 10.6922 10.6922 10.7970 10.7970 10.9477 10.9477 12.7049 12.7049 13.6309 13.6309 14.1125 14.1125 14.1400 14.1400 14.2008 14.2008 k =-0.2500 0.0630-0.0000 ( 3596 PWs) bands (ev): -36.0662 -36.0662 -36.0530 -36.0530 -15.3825 -15.3825 -15.3319 -15.3319 -13.6994 -13.6994 -13.6122 -13.6122 -13.5905 -13.5905 -13.5589 -13.5589 0.7543 0.7543 2.0797 2.0797 5.0641 5.0641 8.5388 8.5388 9.1233 9.1233 9.7096 9.7096 9.9308 9.9308 10.1381 10.1381 10.6779 10.6779 10.8194 10.8194 11.0065 11.0065 12.7108 12.7108 13.6251 13.6251 14.1003 14.1003 14.1296 14.1296 14.1802 14.1802 k =-0.2727 0.0687-0.0000 ( 3596 PWs) bands (ev): -36.0662 -36.0662 -36.0531 -36.0531 -15.3821 -15.3821 -15.3323 -15.3323 -13.6985 -13.6985 -13.6127 -13.6127 -13.5904 -13.5904 -13.5593 -13.5593 0.7834 0.7834 2.0177 2.0177 5.1449 5.1449 8.4280 8.4280 9.1300 9.1300 9.6998 9.6998 9.9427 9.9427 10.1277 10.1277 10.6632 10.6632 10.8417 10.8417 11.0559 11.0559 12.7241 12.7241 13.6195 13.6195 14.0739 14.0739 14.1159 14.1159 14.1776 14.1776 k =-0.2955 0.0745-0.0000 ( 3586 PWs) bands (ev): -36.0662 -36.0662 -36.0530 -36.0530 -15.3818 -15.3818 -15.3326 -15.3326 -13.6977 -13.6977 -13.6133 -13.6133 -13.5903 -13.5903 -13.5598 -13.5598 0.8142 0.8142 1.9559 1.9559 5.2255 5.2255 8.3207 8.3207 9.1369 9.1369 9.6905 9.6905 9.9548 9.9548 10.1182 10.1182 10.6483 10.6483 10.8635 10.8635 11.0957 11.0957 12.7451 12.7451 13.6141 13.6141 14.0383 14.0383 14.1068 14.1068 14.1812 14.1812 k =-0.3182 0.0802-0.0000 ( 3588 PWs) bands (ev): -36.0662 -36.0662 -36.0531 -36.0531 -15.3814 -15.3814 -15.3329 -15.3329 -13.6969 -13.6969 -13.6139 -13.6139 -13.5902 -13.5902 -13.5602 -13.5602 0.8465 0.8465 1.8950 1.8950 5.3046 5.3046 8.2179 8.2179 9.1438 9.1438 9.6818 9.6818 9.9669 9.9669 10.1095 10.1095 10.6335 10.6335 10.8843 10.8843 11.1264 11.1264 12.7731 12.7731 13.6090 13.6090 14.0015 14.0015 14.0996 14.0996 14.1864 14.1864 k =-0.3409 0.0859-0.0000 ( 3584 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3811 -15.3811 -15.3332 -15.3332 -13.6962 -13.6962 -13.6144 -13.6144 -13.5901 -13.5901 -13.5606 -13.5606 0.8798 0.8798 1.8359 1.8359 5.3810 5.3810 8.1209 8.1209 9.1505 9.1505 9.6739 9.6739 9.9788 9.9788 10.1020 10.1020 10.6191 10.6191 10.9038 10.9038 11.1489 11.1489 12.8068 12.8068 13.6044 13.6044 13.9665 13.9665 14.0931 14.0931 14.1918 14.1918 k =-0.3636 0.0916-0.0000 ( 3588 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3808 -15.3808 -15.3335 -15.3335 -13.6955 -13.6955 -13.6149 -13.6149 -13.5901 -13.5901 -13.5609 -13.5609 0.9136 0.9136 1.7793 1.7793 5.4530 5.4530 8.0312 8.0312 9.1566 9.1566 9.6668 9.6668 9.9901 9.9901 10.0956 10.0956 10.6055 10.6055 10.9216 10.9216 11.1644 11.1644 12.8442 12.8442 13.6003 13.6003 13.9346 13.9346 14.0872 14.0872 14.1969 14.1969 k =-0.3864 0.0974 0.0000 ( 3588 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3805 -15.3805 -15.3338 -15.3338 -13.6948 -13.6948 -13.6154 -13.6154 -13.5900 -13.5900 -13.5612 -13.5612 0.9469 0.9469 1.7263 1.7263 5.5190 5.5190 7.9504 7.9504 9.1620 9.1620 9.6607 9.6607 10.0006 10.0006 10.0903 10.0903 10.5931 10.5931 10.9374 10.9374 11.1745 11.1745 12.8830 12.8830 13.5967 13.5967 13.9066 13.9066 14.0820 14.0820 14.2015 14.2015 k =-0.4091 0.1031 0.0000 ( 3588 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3803 -15.3803 -15.3340 -15.3340 -13.6943 -13.6943 -13.6157 -13.6157 -13.5899 -13.5899 -13.5615 -13.5615 0.9787 0.9787 1.6782 1.6782 5.5771 5.5771 7.8804 7.8804 9.1666 9.1666 9.6556 9.6556 10.0097 10.0097 10.0861 10.0861 10.5822 10.5822 10.9508 10.9508 11.1804 11.1804 12.9203 12.9203 13.5937 13.5937 13.8829 13.8829 14.0775 14.0775 14.2055 14.2055 k =-0.4318 0.1088-0.0000 ( 3590 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3801 -15.3801 -15.3342 -15.3342 -13.6938 -13.6938 -13.6161 -13.6161 -13.5899 -13.5899 -13.5617 -13.5617 1.0072 1.0072 1.6369 1.6369 5.6252 5.6252 7.8230 7.8230 9.1703 9.1703 9.6515 9.6515 10.0173 10.0173 10.0829 10.0829 10.5732 10.5732 10.9615 10.9615 11.1835 11.1835 12.9533 12.9533 13.5913 13.5913 13.8641 13.8641 14.0739 14.0739 14.2086 14.2086 k =-0.4545 0.1146-0.0000 ( 3590 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3800 -15.3800 -15.3343 -15.3343 -13.6935 -13.6935 -13.6163 -13.6163 -13.5898 -13.5898 -13.5619 -13.5619 1.0305 1.0305 1.6044 1.6044 5.6614 5.6614 7.7802 7.7802 9.1730 9.1730 9.6486 9.6486 10.0230 10.0230 10.0807 10.0807 10.5665 10.5665 10.9693 10.9693 11.1850 11.1850 12.9793 12.9793 13.5896 13.5896 13.8505 13.8505 14.0713 14.0713 14.2110 14.2110 k =-0.4773 0.1203-0.0000 ( 3586 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3799 -15.3799 -15.3344 -15.3344 -13.6933 -13.6933 -13.6165 -13.6165 -13.5898 -13.5898 -13.5619 -13.5619 1.0459 1.0459 1.5835 1.5835 5.6839 5.6839 7.7537 7.7537 9.1747 9.1747 9.6469 9.6469 10.0266 10.0266 10.0795 10.0795 10.5624 10.5624 10.9740 10.9740 11.1855 11.1855 12.9960 12.9960 13.5886 13.5886 13.8422 13.8422 14.0697 14.0697 14.2124 14.2124 k =-0.5000 0.1260-0.0000 ( 3582 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3798 -15.3798 -15.3344 -15.3344 -13.6932 -13.6932 -13.6165 -13.6165 -13.5898 -13.5898 -13.5620 -13.5620 1.0513 1.0513 1.5762 1.5762 5.6916 5.6916 7.7448 7.7448 9.1752 9.1752 9.6463 9.6463 10.0277 10.0277 10.0790 10.0790 10.5610 10.5610 10.9757 10.9757 11.1856 11.1856 13.0017 13.0017 13.5883 13.5883 13.8394 13.8394 14.0691 14.0691 14.2129 14.2129 k =-0.5000 0.1260-0.0000 ( 3582 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3798 -15.3798 -15.3344 -15.3344 -13.6932 -13.6932 -13.6165 -13.6165 -13.5898 -13.5898 -13.5620 -13.5620 1.0513 1.0513 1.5762 1.5762 5.6916 5.6916 7.7448 7.7448 9.1752 9.1752 9.6463 9.6463 10.0277 10.0277 10.0790 10.0790 10.5610 10.5610 10.9757 10.9757 11.1856 11.1856 13.0017 13.0017 13.5883 13.5883 13.8394 13.8394 14.0691 14.0691 14.2129 14.2129 k =-0.4941 0.1492-0.0000 ( 3586 PWs) bands (ev): -36.0661 -36.0661 -36.0530 -36.0530 -15.3799 -15.3799 -15.3345 -15.3345 -13.6933 -13.6933 -13.6166 -13.6166 -13.5899 -13.5899 -13.5620 -13.5620 1.0527 1.0527 1.5775 1.5775 5.6932 5.6932 7.7437 7.7437 9.1491 9.1491 9.6648 9.6648 10.0288 10.0288 10.0795 10.0795 10.5597 10.5597 10.9585 10.9585 11.2059 11.2059 13.0078 13.0078 13.5738 13.5738 13.8305 13.8305 14.0849 14.0849 14.1953 14.1953 k =-0.4883 0.1725-0.0000 ( 3590 PWs) bands (ev): -36.0661 -36.0661 -36.0530 -36.0530 -15.3800 -15.3800 -15.3347 -15.3347 -13.6934 -13.6934 -13.6171 -13.6171 -13.5902 -13.5902 -13.5620 -13.5620 1.0570 1.0570 1.5815 1.5815 5.6980 5.6980 7.7406 7.7406 9.0808 9.0808 9.7104 9.7104 10.0319 10.0319 10.0809 10.0809 10.5558 10.5558 10.9197 10.9197 11.2546 11.2546 13.0261 13.0261 13.5356 13.5356 13.8038 13.8038 14.1167 14.1167 14.1581 14.1581 k =-0.4824 0.1957-0.0000 ( 3586 PWs) bands (ev): -36.0660 -36.0660 -36.0530 -36.0530 -15.3803 -15.3803 -15.3350 -15.3350 -13.6935 -13.6935 -13.6178 -13.6178 -13.5907 -13.5907 -13.5620 -13.5620 1.0641 1.0641 1.5881 1.5881 5.7059 5.7059 7.7353 7.7353 8.9866 8.9866 9.7666 9.7666 10.0370 10.0370 10.0832 10.0832 10.5494 10.5494 10.8747 10.8747 11.3165 11.3165 13.0562 13.0562 13.4836 13.4836 13.7606 13.7606 14.0646 14.0646 14.2021 14.2021 k =-0.4766 0.2189-0.0000 ( 3586 PWs) bands (ev): -36.0659 -36.0659 -36.0529 -36.0529 -15.3806 -15.3806 -15.3354 -15.3354 -13.6937 -13.6937 -13.6188 -13.6188 -13.5913 -13.5913 -13.5619 -13.5619 1.0740 1.0740 1.5973 1.5973 5.7171 5.7171 7.7276 7.7276 8.8770 8.8770 9.8227 9.8227 10.0442 10.0442 10.0862 10.0862 10.5404 10.5404 10.8309 10.8309 11.3853 11.3853 13.0976 13.0976 13.4253 13.4253 13.7037 13.7037 13.9801 13.9801 14.2768 14.2768 k =-0.4707 0.2421-0.0000 ( 3584 PWs) bands (ev): -36.0658 -36.0658 -36.0528 -36.0528 -15.3810 -15.3810 -15.3359 -15.3359 -13.6940 -13.6940 -13.6200 -13.6200 -13.5922 -13.5922 -13.5619 -13.5619 1.0868 1.0868 1.6090 1.6090 5.7314 5.7314 7.7175 7.7175 8.7578 8.7578 9.8725 9.8725 10.0534 10.0534 10.0897 10.0897 10.5288 10.5288 10.7919 10.7919 11.4585 11.4585 13.1496 13.1496 13.3652 13.3652 13.6358 13.6358 13.8870 13.8870 14.3591 14.3591 k =-0.4649 0.2654-0.0000 ( 3596 PWs) bands (ev): -36.0658 -36.0658 -36.0527 -36.0527 -15.3815 -15.3815 -15.3365 -15.3365 -13.6944 -13.6944 -13.6216 -13.6216 -13.5932 -13.5932 -13.5618 -13.5618 1.1023 1.1023 1.6234 1.6234 5.7488 5.7488 7.7046 7.7046 8.6323 8.6323 9.9125 9.9125 10.0646 10.0646 10.0935 10.0935 10.5147 10.5147 10.7603 10.7603 11.5348 11.5348 13.2105 13.2105 13.3067 13.3067 13.5597 13.5597 13.7898 13.7898 14.4393 14.4393 k =-0.4590 0.2886-0.0000 ( 3592 PWs) bands (ev): -36.0656 -36.0656 -36.0526 -36.0526 -15.3821 -15.3821 -15.3373 -15.3373 -13.6949 -13.6949 -13.6234 -13.6234 -13.5943 -13.5943 -13.5617 -13.5617 1.1207 1.1207 1.6402 1.6402 5.7694 5.7694 7.6883 7.6883 8.5026 8.5026 9.9408 9.9408 10.0778 10.0778 10.0973 10.0973 10.4980 10.4980 10.7379 10.7379 11.6138 11.6138 13.2420 13.2420 13.2887 13.2887 13.4778 13.4778 13.6910 13.6910 14.3870 14.3870 k =-0.4532 0.3118-0.0000 ( 3588 PWs) bands (ev): -36.0654 -36.0654 -36.0524 -36.0524 -15.3827 -15.3827 -15.3381 -15.3381 -13.6954 -13.6954 -13.6255 -13.6255 -13.5956 -13.5956 -13.5616 -13.5616 1.1419 1.1419 1.6595 1.6595 5.7930 5.7930 7.6680 7.6680 8.3708 8.3708 9.9564 9.9564 10.0926 10.0926 10.1009 10.1009 10.4789 10.4789 10.7259 10.7259 11.6950 11.6950 13.1910 13.1910 13.3626 13.3626 13.3933 13.3933 13.5924 13.5924 14.2973 14.2973 k =-0.4473 0.3350-0.0000 ( 3584 PWs) bands (ev): -36.0652 -36.0652 -36.0522 -36.0522 -15.3835 -15.3835 -15.3391 -15.3391 -13.6961 -13.6961 -13.6278 -13.6278 -13.5970 -13.5970 -13.5614 -13.5614 1.1659 1.1659 1.6811 1.6811 5.8197 5.8197 7.6424 7.6424 8.2389 8.2389 9.9597 9.9597 10.1019 10.1019 10.1109 10.1109 10.4573 10.4573 10.7245 10.7245 11.7781 11.7781 13.1402 13.1402 13.3030 13.3030 13.4438 13.4438 13.5011 13.5011 14.2043 14.2043 k =-0.4415 0.3582-0.0000 ( 3590 PWs) bands (ev): -36.0650 -36.0650 -36.0520 -36.0520 -15.3843 -15.3843 -15.3401 -15.3401 -13.6969 -13.6969 -13.6304 -13.6304 -13.5984 -13.5984 -13.5612 -13.5612 1.1927 1.1927 1.7051 1.7051 5.8495 5.8495 7.6093 7.6093 8.1098 8.1098 9.9521 9.9521 10.1031 10.1031 10.1294 10.1294 10.4334 10.4334 10.7327 10.7327 11.8629 11.8629 13.0929 13.0929 13.2140 13.2140 13.3913 13.3913 13.5495 13.5495 14.1100 14.1100 k =-0.4356 0.3815-0.0000 ( 3594 PWs) bands (ev): -36.0648 -36.0648 -36.0518 -36.0518 -15.3852 -15.3852 -15.3413 -15.3413 -13.6978 -13.6978 -13.6332 -13.6332 -13.5999 -13.5999 -13.5609 -13.5609 1.2223 1.2223 1.7313 1.7313 5.8822 5.8822 7.5651 7.5651 7.9877 7.9877 9.9359 9.9359 10.1020 10.1020 10.1500 10.1500 10.4072 10.4072 10.7491 10.7491 11.9492 11.9492 13.0488 13.0488 13.1257 13.1257 13.2975 13.2975 13.6469 13.6469 14.0159 14.0159 k =-0.4298 0.4047-0.0000 ( 3594 PWs) bands (ev): -36.0646 -36.0646 -36.0515 -36.0515 -15.3861 -15.3861 -15.3425 -15.3425 -13.6988 -13.6988 -13.6363 -13.6363 -13.6015 -13.6015 -13.5606 -13.5606 1.2546 1.2546 1.7597 1.7597 5.9178 5.9178 7.5041 7.5041 7.8786 7.8786 9.9134 9.9134 10.0980 10.0980 10.1724 10.1724 10.3788 10.3788 10.7719 10.7719 12.0367 12.0367 13.0052 13.0052 13.0419 13.0419 13.2048 13.2048 13.7498 13.7498 13.9237 13.9237 k =-0.4239 0.4279-0.0000 ( 3598 PWs) bands (ev): -36.0643 -36.0643 -36.0513 -36.0513 -15.3872 -15.3872 -15.3438 -15.3438 -13.6999 -13.6999 -13.6396 -13.6396 -13.6031 -13.6031 -13.5603 -13.5603 1.2896 1.2896 1.7901 1.7901 5.9563 5.9563 7.4209 7.4209 7.7884 7.7884 9.8868 9.8868 10.0907 10.0907 10.1966 10.1966 10.3485 10.3485 10.7995 10.7995 12.1255 12.1255 12.9412 12.9412 12.9842 12.9842 13.1147 13.1147 13.8262 13.8262 13.8651 13.8651 k =-0.4181 0.4511-0.0000 ( 3596 PWs) bands (ev): -36.0640 -36.0640 -36.0510 -36.0510 -15.3883 -15.3883 -15.3452 -15.3452 -13.7012 -13.7012 -13.6430 -13.6430 -13.6046 -13.6046 -13.5599 -13.5599 1.3274 1.3274 1.8225 1.8225 5.9977 5.9977 7.3151 7.3151 7.7179 7.7179 9.8581 9.8581 10.0792 10.0792 10.2225 10.2225 10.3164 10.3164 10.8305 10.8305 12.2155 12.2155 12.8602 12.8602 12.9495 12.9495 13.0279 13.0279 13.7453 13.7453 13.9709 13.9709 k =-0.4122 0.4744-0.0000 ( 3596 PWs) bands (ev): -36.0637 -36.0637 -36.0507 -36.0507 -15.3894 -15.3894 -15.3467 -15.3467 -13.7027 -13.7027 -13.6466 -13.6466 -13.6061 -13.6061 -13.5594 -13.5594 1.3680 1.3680 1.8567 1.8567 6.0418 6.0418 7.1922 7.1922 7.6621 7.6621 9.8287 9.8287 10.0629 10.0629 10.2499 10.2499 10.2828 10.2828 10.8641 10.8641 12.3063 12.3063 12.7795 12.7795 12.9174 12.9174 12.9479 12.9479 13.6646 13.6646 14.0842 14.0842 k =-0.4064 0.4976-0.0000 ( 3586 PWs) bands (ev): -36.0634 -36.0634 -36.0504 -36.0504 -15.3906 -15.3906 -15.3482 -15.3482 -13.7043 -13.7043 -13.6504 -13.6504 -13.6076 -13.6076 -13.5589 -13.5589 1.4112 1.4112 1.8926 1.8926 6.0886 6.0886 7.0585 7.0585 7.6148 7.6148 9.7995 9.7995 10.0411 10.0411 10.2475 10.2475 10.2791 10.2791 10.8995 10.8995 12.3977 12.3977 12.7017 12.7017 12.8567 12.8567 12.9044 12.9044 13.5900 13.5900 14.1997 14.1997 k =-0.4005 0.5208-0.0000 ( 3582 PWs) bands (ev): -36.0631 -36.0631 -36.0501 -36.0501 -15.3918 -15.3918 -15.3498 -15.3498 -13.7060 -13.7060 -13.6543 -13.6543 -13.6090 -13.6090 -13.5584 -13.5584 1.4571 1.4571 1.9301 1.9301 6.1380 6.1380 6.9185 6.9185 7.5720 7.5720 9.7714 9.7714 10.0133 10.0133 10.2113 10.2113 10.3094 10.3094 10.9364 10.9364 12.4873 12.4873 12.6293 12.6293 12.7814 12.7814 12.8828 12.8828 13.5227 13.5227 14.3165 14.3165 k =-0.3946 0.5440-0.0000 ( 3588 PWs) bands (ev): -36.0628 -36.0628 -36.0498 -36.0498 -15.3931 -15.3931 -15.3515 -15.3515 -13.7079 -13.7079 -13.6583 -13.6583 -13.6103 -13.6103 -13.5578 -13.5578 1.5057 1.5057 1.9691 1.9691 6.1900 6.1900 6.7750 6.7750 7.5314 7.5314 9.7450 9.7450 9.9790 9.9790 10.1742 10.1742 10.3411 10.3411 10.9743 10.9743 12.5315 12.5315 12.6046 12.6046 12.7096 12.7096 12.8658 12.8658 13.4640 13.4640 14.4340 14.4340 k =-0.3888 0.5673-0.0000 ( 3600 PWs) bands (ev): -36.0625 -36.0625 -36.0495 -36.0495 -15.3944 -15.3944 -15.3531 -15.3531 -13.7100 -13.7100 -13.6623 -13.6623 -13.6115 -13.6115 -13.5572 -13.5572 1.5569 1.5569 2.0093 2.0093 6.2444 6.2444 6.6295 6.6295 7.4918 7.4918 9.7205 9.7205 9.9379 9.9379 10.1365 10.1365 10.3739 10.3739 11.0132 11.0132 12.4720 12.4720 12.6324 12.6324 12.6960 12.6960 12.8520 12.8520 13.4151 13.4151 14.5515 14.5515 k =-0.3829 0.5905-0.0000 ( 3602 PWs) bands (ev): -36.0622 -36.0622 -36.0492 -36.0492 -15.3958 -15.3958 -15.3548 -15.3548 -13.7122 -13.7122 -13.6664 -13.6664 -13.6126 -13.6126 -13.5566 -13.5566 1.6108 1.6108 2.0507 2.0507 6.3009 6.3009 6.4832 6.4832 7.4527 7.4527 9.6982 9.6982 9.8899 9.8899 10.0983 10.0983 10.4076 10.4076 11.0527 11.0527 12.4040 12.4040 12.5704 12.5704 12.7866 12.7866 12.8418 12.8418 13.3768 13.3768 14.6682 14.6682 k =-0.3771 0.6137-0.0000 ( 3590 PWs) bands (ev): -36.0618 -36.0618 -36.0489 -36.0489 -15.3972 -15.3972 -15.3566 -15.3566 -13.7144 -13.7144 -13.6705 -13.6705 -13.6136 -13.6136 -13.5559 -13.5559 1.6673 1.6673 2.0930 2.0930 6.3337 6.3337 6.3625 6.3625 7.4138 7.4138 9.6779 9.6779 9.8353 9.8353 10.0600 10.0600 10.4423 10.4423 11.0930 11.0930 12.3359 12.3359 12.5098 12.5098 12.8270 12.8270 12.8890 12.8890 13.3499 13.3499 14.7829 14.7829 k =-0.3712 0.6369-0.0000 ( 3590 PWs) bands (ev): -36.0615 -36.0615 -36.0486 -36.0486 -15.3985 -15.3985 -15.3583 -15.3583 -13.7168 -13.7168 -13.6747 -13.6747 -13.6145 -13.6145 -13.5552 -13.5552 1.7264 1.7264 2.1361 2.1361 6.1889 6.1889 6.4216 6.4216 7.3751 7.3751 9.6595 9.6595 9.7747 9.7747 10.0217 10.0217 10.4775 10.4775 11.1338 11.1338 12.2683 12.2683 12.4535 12.4535 12.8195 12.8195 12.9872 12.9872 13.3346 13.3346 14.8922 14.8922 k =-0.3654 0.6601-0.0000 ( 3576 PWs) bands (ev): -36.0611 -36.0611 -36.0482 -36.0482 -15.3999 -15.3999 -15.3600 -15.3600 -13.7193 -13.7193 -13.6788 -13.6788 -13.6153 -13.6153 -13.5545 -13.5545 1.7881 1.7881 2.1797 2.1797 6.0426 6.0426 6.4845 6.4845 7.3368 7.3368 9.6411 9.6411 9.7102 9.7102 9.9838 9.9838 10.5132 10.5132 11.1752 11.1752 12.2010 12.2010 12.4020 12.4020 12.8114 12.8114 13.0878 13.0878 13.3310 13.3310 14.9740 14.9740 k =-0.3595 0.6834-0.0000 ( 3572 PWs) bands (ev): -36.0608 -36.0608 -36.0479 -36.0479 -15.4013 -15.4013 -15.3618 -15.3618 -13.7218 -13.7218 -13.6828 -13.6828 -13.6160 -13.6160 -13.5538 -13.5538 1.8523 1.8523 2.2238 2.2238 5.8970 5.8970 6.5492 6.5492 7.2991 7.2991 9.6101 9.6101 9.6550 9.6550 9.9464 9.9464 10.5491 10.5491 11.2170 11.2170 12.1339 12.1339 12.3557 12.3557 12.8029 12.8029 13.1897 13.1897 13.3386 13.3386 14.9234 14.9234 k =-0.3537 0.7066-0.0000 ( 3574 PWs) bands (ev): -36.0604 -36.0604 -36.0476 -36.0476 -15.4027 -15.4027 -15.3635 -15.3635 -13.7244 -13.7244 -13.6868 -13.6868 -13.6166 -13.6166 -13.5531 -13.5531 1.9191 1.9191 2.2679 2.2679 5.7523 5.7523 6.6155 6.6155 7.2622 7.2622 9.5439 9.5439 9.6323 9.6323 9.9097 9.9097 10.5849 10.5849 11.2592 11.2592 12.0670 12.0670 12.3148 12.3148 12.7933 12.7933 13.2925 13.2925 13.3569 13.3569 14.8568 14.8568 k =-0.3478 0.7298-0.0000 ( 3566 PWs) bands (ev): -36.0601 -36.0601 -36.0472 -36.0472 -15.4040 -15.4040 -15.3652 -15.3652 -13.7270 -13.7270 -13.6907 -13.6907 -13.6171 -13.6171 -13.5524 -13.5524 1.9884 1.9884 2.3120 2.3120 5.6086 5.6086 6.6830 6.6830 7.2264 7.2264 9.4639 9.4639 9.6215 9.6215 9.8741 9.8741 10.6203 10.6203 11.3017 11.3017 12.0004 12.0004 12.2798 12.2798 12.7820 12.7820 13.3846 13.3846 13.3962 13.3962 14.7862 14.7862 k =-0.3420 0.7530-0.0000 ( 3564 PWs) bands (ev): -36.0598 -36.0598 -36.0470 -36.0470 -15.4053 -15.4053 -15.3669 -15.3669 -13.7296 -13.7296 -13.6945 -13.6945 -13.6175 -13.6175 -13.5517 -13.5517 2.0603 2.0603 2.3558 2.3558 5.4662 5.4662 6.7516 6.7516 7.1920 7.1920 9.3788 9.3788 9.6144 9.6144 9.8395 9.8395 10.6552 10.6552 11.3444 11.3444 11.9343 11.9343 12.2508 12.2508 12.7681 12.7681 13.4215 13.4215 13.4992 13.4992 14.7104 14.7104 k =-0.3361 0.7763-0.0000 ( 3568 PWs) bands (ev): -36.0595 -36.0595 -36.0467 -36.0467 -15.4066 -15.4066 -15.3685 -15.3685 -13.7321 -13.7321 -13.6981 -13.6981 -13.6179 -13.6179 -13.5511 -13.5511 2.1346 2.1346 2.3990 2.3990 5.3252 5.3252 6.8207 6.8207 7.1594 7.1594 9.2909 9.2909 9.6097 9.6097 9.8063 9.8063 10.6891 10.6891 11.3872 11.3872 11.8688 11.8688 12.2281 12.2281 12.7507 12.7507 13.4657 13.4657 13.6016 13.6016 14.6299 14.6299 k =-0.3303 0.7995-0.0000 ( 3568 PWs) bands (ev): -36.0592 -36.0592 -36.0464 -36.0464 -15.4079 -15.4079 -15.3700 -15.3700 -13.7346 -13.7346 -13.7016 -13.7016 -13.6181 -13.6181 -13.5504 -13.5504 2.2113 2.2113 2.4413 2.4413 5.1858 5.1858 6.8899 6.8899 7.1290 7.1290 9.2015 9.2015 9.6069 9.6069 9.7745 9.7745 10.7219 10.7219 11.4300 11.4300 11.8041 11.8041 12.2122 12.2122 12.7291 12.7291 13.5160 13.5160 13.7017 13.7017 14.5501 14.5501 k =-0.3244 0.8227-0.0000 ( 3576 PWs) bands (ev): -36.0590 -36.0590 -36.0462 -36.0462 -15.4091 -15.4091 -15.3715 -15.3715 -13.7370 -13.7370 -13.7049 -13.7049 -13.6183 -13.6183 -13.5497 -13.5497 2.2905 2.2905 2.4825 2.4825 5.0481 5.0481 6.9586 6.9586 7.1009 7.1009 9.1118 9.1118 9.6059 9.6059 9.7443 9.7443 10.7533 10.7533 11.4725 11.4725 11.7404 11.7404 12.2031 12.2031 12.7025 12.7025 13.5712 13.5712 13.7970 13.7970 14.4765 14.4765 k =-0.3186 0.8459-0.0000 ( 3582 PWs) bands (ev): -36.0587 -36.0587 -36.0460 -36.0460 -15.4103 -15.4103 -15.3729 -15.3729 -13.7394 -13.7394 -13.7080 -13.7080 -13.6185 -13.6185 -13.5491 -13.5491 2.3720 2.3720 2.5224 2.5224 4.9122 4.9122 7.0257 7.0257 7.0758 7.0758 9.0230 9.0230 9.6064 9.6064 9.7159 9.7159 10.7831 10.7831 11.5145 11.5145 11.6779 11.6779 12.2010 12.2010 12.6705 12.6705 13.6297 13.6297 13.8824 13.8824 14.4155 14.4155 k =-0.3127 0.8692-0.0000 ( 3570 PWs) bands (ev): -36.0585 -36.0585 -36.0457 -36.0457 -15.4113 -15.4113 -15.3742 -15.3742 -13.7416 -13.7416 -13.7110 -13.7110 -13.6187 -13.6187 -13.5485 -13.5485 2.4557 2.4557 2.5608 2.5608 4.7782 4.7782 7.0526 7.0526 7.0916 7.0916 8.9367 8.9367 9.6084 9.6084 9.6893 9.6893 10.8112 10.8112 11.5557 11.5557 11.6167 11.6167 12.2060 12.2060 12.6325 12.6325 13.6901 13.6901 13.9476 13.9476 14.3779 14.3779 k =-0.3069 0.8924-0.0000 ( 3562 PWs) bands (ev): -36.0582 -36.0582 -36.0454 -36.0454 -15.4124 -15.4124 -15.3755 -15.3755 -13.7437 -13.7437 -13.7137 -13.7137 -13.6188 -13.6188 -13.5479 -13.5479 2.5408 2.5408 2.5980 2.5980 4.6465 4.6465 7.0341 7.0341 7.1524 7.1524 8.8547 8.8547 9.6117 9.6117 9.6648 9.6648 10.8376 10.8376 11.5565 11.5565 11.5960 11.5960 12.2181 12.2181 12.5885 12.5885 13.7507 13.7507 13.9781 13.9781 14.3780 14.3780 k =-0.3010 0.9156-0.0000 ( 3562 PWs) bands (ev): -36.0580 -36.0580 -36.0452 -36.0452 -15.4133 -15.4133 -15.3766 -15.3766 -13.7456 -13.7456 -13.7161 -13.7161 -13.6189 -13.6189 -13.5474 -13.5474 2.6175 2.6175 2.6436 2.6436 4.5170 4.5170 7.0189 7.0189 7.2079 7.2079 8.7791 8.7791 9.6162 9.6162 9.6423 9.6423 10.8624 10.8624 11.4982 11.4982 11.6345 11.6345 12.2372 12.2372 12.5385 12.5385 13.8097 13.8097 13.9702 13.9702 14.4163 14.4163 k =-0.2951 0.9388-0.0000 ( 3570 PWs) bands (ev): -36.0579 -36.0579 -36.0450 -36.0450 -15.4142 -15.4142 -15.3776 -15.3776 -13.7474 -13.7474 -13.7183 -13.7183 -13.6189 -13.6189 -13.5469 -13.5469 2.6563 2.6563 2.7266 2.7266 4.3900 4.3900 7.0076 7.0076 7.2556 7.2556 8.7124 8.7124 9.6196 9.6196 9.6242 9.6242 10.8856 10.8856 11.4412 11.4412 11.6710 11.6710 12.2631 12.2631 12.4828 12.4828 13.8650 13.8650 13.9383 13.9383 14.4267 14.4267 k =-0.2893 0.9621-0.0000 ( 3574 PWs) bands (ev): -36.0577 -36.0577 -36.0449 -36.0449 -15.4150 -15.4150 -15.3785 -15.3785 -13.7491 -13.7491 -13.7203 -13.7203 -13.6190 -13.6190 -13.5464 -13.5464 2.6847 2.6847 2.8190 2.8190 4.2659 4.2659 7.0004 7.0004 7.2927 7.2927 8.6576 8.6576 9.6033 9.6033 9.6291 9.6291 10.9075 10.9075 11.3857 11.3857 11.7050 11.7050 12.2954 12.2954 12.4219 12.4219 13.8922 13.8922 13.9200 13.9200 14.4222 14.4222 k =-0.2834 0.9853-0.0000 ( 3570 PWs) bands (ev): -36.0576 -36.0576 -36.0447 -36.0447 -15.4157 -15.4157 -15.3793 -15.3793 -13.7505 -13.7505 -13.7220 -13.7220 -13.6190 -13.6190 -13.5459 -13.5459 2.7087 2.7087 2.9146 2.9146 4.1448 4.1448 6.9977 6.9977 7.3163 7.3163 8.6179 8.6179 9.5876 9.5876 9.6368 9.6368 10.9284 10.9284 11.3317 11.3317 11.7358 11.7358 12.3323 12.3323 12.3579 12.3579 13.8519 13.8519 13.9615 13.9615 14.4230 14.4230 k =-0.2776 1.0085-0.0000 ( 3564 PWs) bands (ev): -36.0575 -36.0575 -36.0446 -36.0446 -15.4163 -15.4163 -15.3800 -15.3800 -13.7517 -13.7517 -13.7234 -13.7234 -13.6191 -13.6191 -13.5455 -13.5455 2.7283 2.7283 3.0126 3.0126 4.0272 4.0272 6.9995 6.9995 7.3238 7.3238 8.5959 8.5959 9.5741 9.5741 9.6455 9.6455 10.9487 10.9487 11.2792 11.2792 11.7628 11.7628 12.2855 12.2855 12.3793 12.3793 13.8128 13.8128 13.9966 13.9966 14.4291 14.4291 k =-0.2717 1.0317-0.0000 ( 3566 PWs) bands (ev): -36.0574 -36.0574 -36.0445 -36.0445 -15.4168 -15.4168 -15.3805 -15.3805 -13.7528 -13.7528 -13.7246 -13.7246 -13.6192 -13.6192 -13.5452 -13.5452 2.7429 2.7429 3.1130 3.1130 3.9136 3.9136 7.0060 7.0060 7.3138 7.3138 8.5933 8.5933 9.5629 9.5629 9.6551 9.6551 10.9686 10.9686 11.2281 11.2281 11.7854 11.7854 12.2127 12.2127 12.4285 12.4285 13.7795 13.7795 14.0220 14.0220 14.4399 14.4399 k =-0.2659 1.0549-0.0000 ( 3568 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4172 -15.4172 -15.3809 -15.3809 -13.7536 -13.7536 -13.7254 -13.7254 -13.6192 -13.6192 -13.5449 -13.5449 2.7519 2.7519 3.2156 3.2156 3.8046 3.8046 7.0173 7.0173 7.2863 7.2863 8.6102 8.6102 9.5542 9.5542 9.6656 9.6656 10.9887 10.9887 11.1785 11.1785 11.8029 11.8029 12.1371 12.1371 12.4827 12.4827 13.7535 13.7535 14.0365 14.0365 14.4543 14.4543 k =-0.2659 1.0549-0.0000 ( 3568 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4172 -15.4172 -15.3809 -15.3809 -13.7536 -13.7536 -13.7254 -13.7254 -13.6192 -13.6192 -13.5449 -13.5449 2.7519 2.7519 3.2156 3.2156 3.8046 3.8046 7.0173 7.0173 7.2863 7.2863 8.6102 8.6102 9.5542 9.5542 9.6656 9.6656 10.9887 10.9887 11.1785 11.1785 11.8029 11.8029 12.1371 12.1371 12.4827 12.4827 13.7535 13.7535 14.0365 14.0365 14.4543 14.4543 k =-0.2659 1.0549 0.0241 ( 3563 PWs) bands (ev): -36.0573 -36.0573 -36.0444 -36.0444 -15.4173 -15.4173 -15.3809 -15.3809 -13.7536 -13.7536 -13.7254 -13.7254 -13.6194 -13.6194 -13.5450 -13.5450 2.7528 2.7528 3.2169 3.2169 3.8059 3.8059 7.0192 7.0192 7.2833 7.2833 8.6119 8.6119 9.5535 9.5535 9.6638 9.6638 10.9803 10.9803 11.1770 11.1770 11.7961 11.7961 12.1274 12.1274 12.4915 12.4915 13.7580 13.7580 14.0389 14.0389 14.4463 14.4463 k =-0.2659 1.0549 0.0482 ( 3571 PWs) bands (ev): -36.0572 -36.0572 -36.0444 -36.0444 -15.4173 -15.4173 -15.3810 -15.3810 -13.7534 -13.7534 -13.7255 -13.7255 -13.6198 -13.6198 -13.5455 -13.5455 2.7553 2.7553 3.2205 3.2205 3.8100 3.8100 7.0247 7.0247 7.2741 7.2741 8.6170 8.6170 9.5511 9.5511 9.6582 9.6582 10.9556 10.9556 11.1722 11.1722 11.7764 11.7764 12.0989 12.0989 12.5165 12.5165 13.7714 13.7714 14.0456 14.0456 14.4249 14.4249 k =-0.2659 1.0549 0.0723 ( 3581 PWs) bands (ev): -36.0572 -36.0572 -36.0444 -36.0444 -15.4175 -15.4175 -15.3813 -15.3813 -13.7532 -13.7532 -13.7255 -13.7255 -13.6204 -13.6204 -13.5462 -13.5462 2.7596 2.7596 3.2266 3.2266 3.8168 3.8168 7.0340 7.0340 7.2589 7.2589 8.6255 8.6255 9.5473 9.5473 9.6488 9.6488 10.9162 10.9162 11.1641 11.1641 11.7458 11.7458 12.0526 12.0526 12.5550 12.5550 13.7933 13.7933 14.0558 14.0558 14.3963 14.3963 k =-0.2659 1.0549 0.0965 ( 3575 PWs) bands (ev): -36.0570 -36.0570 -36.0443 -36.0443 -15.4176 -15.4176 -15.3816 -15.3816 -13.7530 -13.7530 -13.7256 -13.7256 -13.6214 -13.6214 -13.5473 -13.5473 2.7655 2.7655 3.2350 3.2350 3.8264 3.8264 7.0468 7.0468 7.2377 7.2377 8.6374 8.6374 9.5420 9.5420 9.6353 9.6353 10.8644 10.8644 11.1525 11.1525 11.7064 11.7064 11.9902 11.9902 12.6034 12.6034 13.8230 13.8230 14.0678 14.0678 14.3674 14.3674 k =-0.2659 1.0549 0.1206 ( 3578 PWs) bands (ev): -36.0569 -36.0569 -36.0443 -36.0443 -15.4178 -15.4178 -15.3821 -15.3821 -13.7526 -13.7526 -13.7257 -13.7257 -13.6225 -13.6225 -13.5486 -13.5486 2.7732 2.7732 3.2459 3.2459 3.8386 3.8386 7.0631 7.0631 7.2108 7.2108 8.6528 8.6528 9.5354 9.5354 9.6173 9.6173 10.8028 10.8028 11.1370 11.1370 11.6600 11.6600 11.9138 11.9138 12.6588 12.6588 13.8597 13.8597 14.0787 14.0787 14.3442 14.3442 k =-0.2659 1.0549 0.1447 ( 3578 PWs) bands (ev): -36.0567 -36.0567 -36.0442 -36.0442 -15.4181 -15.4181 -15.3826 -15.3826 -13.7522 -13.7522 -13.7259 -13.7259 -13.6239 -13.6239 -13.5502 -13.5502 2.7825 2.7825 3.2592 3.2592 3.8535 3.8535 7.0825 7.0825 7.1786 7.1786 8.6716 8.6716 9.5273 9.5273 9.5946 9.5946 10.7342 10.7342 11.1171 11.1171 11.6082 11.6082 11.8258 11.8258 12.7184 12.7184 13.9025 13.9025 14.0851 14.0851 14.3319 14.3319 k =-0.2659 1.0549 0.1688 ( 3576 PWs) bands (ev): -36.0565 -36.0565 -36.0441 -36.0441 -15.4184 -15.4184 -15.3832 -15.3832 -13.7517 -13.7517 -13.7261 -13.7261 -13.6256 -13.6256 -13.5520 -13.5520 2.7935 2.7935 3.2749 3.2749 3.8711 3.8711 7.1023 7.1023 7.1440 7.1440 8.6939 8.6939 9.5174 9.5174 9.5671 9.5671 10.6612 10.6612 11.0920 11.0920 11.5522 11.5522 11.7289 11.7289 12.7804 12.7804 13.9505 13.9505 14.0843 14.0843 14.3336 14.3336 k =-0.2659 1.0549 0.1929 ( 3576 PWs) bands (ev): -36.0562 -36.0562 -36.0440 -36.0440 -15.4188 -15.4188 -15.3839 -15.3839 -13.7512 -13.7512 -13.7263 -13.7263 -13.6274 -13.6274 -13.5541 -13.5541 2.8062 2.8062 3.2929 3.2929 3.8914 3.8914 7.0885 7.0885 7.1412 7.1412 8.7194 8.7194 9.5029 9.5029 9.5371 9.5371 10.5862 10.5862 11.0605 11.0605 11.4929 11.4929 11.6262 11.6262 12.8434 12.8434 14.0023 14.0023 14.0771 14.0771 14.3491 14.3491 k =-0.2659 1.0549 0.2170 ( 3580 PWs) bands (ev): -36.0560 -36.0560 -36.0438 -36.0438 -15.4192 -15.4192 -15.3847 -15.3847 -13.7506 -13.7506 -13.7266 -13.7266 -13.6295 -13.6295 -13.5564 -13.5564 2.8206 2.8206 3.3133 3.3133 3.9143 3.9143 7.0424 7.0424 7.1692 7.1692 8.7482 8.7482 9.4738 9.4738 9.5140 9.5140 10.5114 10.5114 11.0209 11.0209 11.4310 11.4310 11.5212 11.5212 12.9063 12.9063 14.0501 14.0501 14.0732 14.0732 14.3748 14.3748 k =-0.2659 1.0549 0.2411 ( 3584 PWs) bands (ev): -36.0557 -36.0557 -36.0437 -36.0437 -15.4196 -15.4196 -15.3856 -15.3856 -13.7500 -13.7500 -13.7269 -13.7269 -13.6317 -13.6317 -13.5590 -13.5590 2.8366 2.8366 3.3361 3.3361 3.9398 3.9398 6.9893 6.9893 7.2027 7.2027 8.7801 8.7801 9.4274 9.4274 9.5001 9.5001 10.4388 10.4388 10.9703 10.9703 11.3673 11.3673 11.4183 11.4183 12.9686 12.9686 14.0476 14.0476 14.1211 14.1211 14.4069 14.4069 k =-0.2659 1.0549 0.2653 ( 3584 PWs) bands (ev): -36.0553 -36.0553 -36.0436 -36.0436 -15.4201 -15.4201 -15.3866 -15.3866 -13.7494 -13.7494 -13.7272 -13.7272 -13.6340 -13.6340 -13.5617 -13.5617 2.8543 2.8543 3.3611 3.3611 3.9679 3.9679 6.9313 6.9313 7.2401 7.2401 8.8147 8.8147 9.3698 9.3698 9.4890 9.4890 10.3698 10.3698 10.9055 10.9055 11.3020 11.3020 11.3227 11.3227 13.0299 13.0299 14.0361 14.0361 14.1813 14.1813 14.4420 14.4420 k =-0.2659 1.0549 0.2894 ( 3582 PWs) bands (ev): -36.0550 -36.0550 -36.0434 -36.0434 -15.4206 -15.4206 -15.3876 -15.3876 -13.7487 -13.7487 -13.7276 -13.7276 -13.6365 -13.6365 -13.5646 -13.5646 2.8737 2.8737 3.3884 3.3884 3.9986 3.9986 6.8692 6.8692 7.2808 7.2808 8.8519 8.8519 9.3028 9.3028 9.4787 9.4787 10.3053 10.3053 10.8239 10.8239 11.2322 11.2322 11.2417 11.2417 13.0901 13.0901 14.0264 14.0264 14.2434 14.2434 14.4777 14.4777 k =-0.2659 1.0549 0.3135 ( 3580 PWs) bands (ev): -36.0546 -36.0546 -36.0432 -36.0432 -15.4211 -15.4211 -15.3887 -15.3887 -13.7481 -13.7481 -13.7280 -13.7280 -13.6391 -13.6391 -13.5677 -13.5677 2.8947 2.8947 3.4179 3.4179 4.0318 4.0318 6.8032 6.8032 7.3247 7.3247 8.8912 8.8912 9.2271 9.2271 9.4691 9.4691 10.2460 10.2460 10.7253 10.7253 11.1606 11.1606 11.1744 11.1744 13.1491 13.1491 14.0198 14.0198 14.3066 14.3066 14.5119 14.5119 k =-0.2659 1.0549 0.3376 ( 3580 PWs) bands (ev): -36.0542 -36.0542 -36.0430 -36.0430 -15.4217 -15.4217 -15.3899 -15.3899 -13.7474 -13.7474 -13.7285 -13.7285 -13.6418 -13.6418 -13.5709 -13.5709 2.9174 2.9174 3.4497 3.4497 4.0675 4.0675 6.7339 6.7339 7.3717 7.3717 8.9320 8.9320 9.1435 9.1435 9.4600 9.4600 10.1919 10.1919 10.6126 10.6126 11.0974 11.0974 11.1096 11.1096 13.2072 13.2072 14.0169 14.0169 14.3703 14.3703 14.5430 14.5430 k =-0.2659 1.0549 0.3617 ( 3578 PWs) bands (ev): -36.0538 -36.0538 -36.0428 -36.0428 -15.4223 -15.4223 -15.3912 -15.3912 -13.7468 -13.7468 -13.7290 -13.7290 -13.6444 -13.6444 -13.5742 -13.5742 2.9416 2.9416 3.4836 3.4836 4.1056 4.1056 6.6617 6.6617 7.4216 7.4216 8.9732 8.9732 9.0532 9.0532 9.4518 9.4518 10.1426 10.1426 10.4901 10.4901 11.0402 11.0402 11.0468 11.0468 13.2644 13.2644 14.0182 14.0182 14.4338 14.4338 14.5696 14.5696 k =-0.2659 1.0549 0.3858 ( 3582 PWs) bands (ev): -36.0533 -36.0533 -36.0426 -36.0426 -15.4229 -15.4229 -15.3925 -15.3925 -13.7462 -13.7462 -13.7296 -13.7296 -13.6471 -13.6471 -13.5776 -13.5776 2.9675 2.9675 3.5197 3.5197 4.1461 4.1461 6.5869 6.5869 7.4742 7.4742 8.9547 8.9547 9.0164 9.0164 9.4446 9.4446 10.0976 10.0976 10.3618 10.3618 10.9816 10.9816 10.9913 10.9913 13.3211 13.3211 14.0236 14.0236 14.4969 14.4969 14.5907 14.5907 k =-0.2659 1.0549 0.4099 ( 3582 PWs) bands (ev): -36.0529 -36.0529 -36.0424 -36.0424 -15.4236 -15.4236 -15.3939 -15.3939 -13.7457 -13.7457 -13.7302 -13.7302 -13.6498 -13.6498 -13.5810 -13.5810 2.9950 2.9950 3.5578 3.5578 4.1890 4.1890 6.5100 6.5100 7.5295 7.5295 8.8537 8.8537 9.0555 9.0555 9.4390 9.4390 10.0563 10.0563 10.2311 10.2311 10.9213 10.9213 10.9417 10.9417 13.3776 13.3776 14.0335 14.0335 14.5590 14.5590 14.6058 14.6058 k =-0.2659 1.0549 0.4340 ( 3586 PWs) bands (ev): -36.0524 -36.0524 -36.0423 -36.0423 -15.4242 -15.4242 -15.3954 -15.3954 -13.7453 -13.7453 -13.7309 -13.7309 -13.6524 -13.6524 -13.5845 -13.5845 3.0241 3.0241 3.5979 3.5979 4.2342 4.2342 6.4313 6.4313 7.5871 7.5871 8.7484 8.7484 9.0913 9.0913 9.4354 9.4354 10.0177 10.0177 10.1013 10.1013 10.8626 10.8626 10.8940 10.8940 13.4340 13.4340 14.0478 14.0478 14.6108 14.6108 14.6234 14.6234 k =-0.2659 1.0549 0.4582 ( 3590 PWs) bands (ev): -36.0519 -36.0519 -36.0421 -36.0421 -15.4249 -15.4249 -15.3968 -15.3968 -13.7451 -13.7451 -13.7316 -13.7316 -13.6549 -13.6549 -13.5880 -13.5880 3.0548 3.0548 3.6399 3.6399 4.2815 4.2815 6.3512 6.3512 7.6468 7.6468 8.6403 8.6403 9.1203 9.1203 9.4342 9.4342 9.9678 9.9678 9.9891 9.9891 10.8061 10.8061 10.8475 10.8475 13.4907 13.4907 14.0664 14.0664 14.6145 14.6145 14.6813 14.6813 k =-0.2659 1.0549 0.4823 ( 3592 PWs) bands (ev): -36.0515 -36.0515 -36.0419 -36.0419 -15.4256 -15.4256 -15.3984 -15.3984 -13.7449 -13.7449 -13.7324 -13.7324 -13.6573 -13.6573 -13.5915 -13.5915 3.0871 3.0871 3.6839 3.6839 4.3310 4.3310 6.2700 6.2700 7.7083 7.7083 8.5305 8.5305 9.1382 9.1382 9.4350 9.4350 9.8555 9.8555 9.9505 9.9505 10.7520 10.7520 10.8018 10.8018 13.5479 13.5479 14.0893 14.0893 14.6100 14.6100 14.7396 14.7396 k =-0.2659 1.0549 0.5064 ( 3592 PWs) bands (ev): -36.0509 -36.0509 -36.0417 -36.0417 -15.4262 -15.4262 -15.4000 -15.4000 -13.7449 -13.7449 -13.7333 -13.7333 -13.6595 -13.6595 -13.5950 -13.5950 3.1209 3.1209 3.7295 3.7295 4.3826 4.3826 6.1881 6.1881 7.7708 7.7708 8.4204 8.4204 9.1395 9.1395 9.4343 9.4343 9.7569 9.7569 9.9180 9.9180 10.7006 10.7006 10.7568 10.7568 13.6058 13.6058 14.1164 14.1164 14.5998 14.5998 14.7963 14.7963 k =-0.2659 1.0549 0.5305 ( 3586 PWs) bands (ev): -36.0504 -36.0504 -36.0415 -36.0415 -15.4269 -15.4269 -15.4016 -15.4016 -13.7451 -13.7451 -13.7341 -13.7341 -13.6615 -13.6615 -13.5985 -13.5985 3.1563 3.1563 3.7769 3.7769 4.4361 4.4361 6.1057 6.1057 7.8332 7.8332 8.3116 8.3116 9.1176 9.1176 9.4244 9.4244 9.6903 9.6903 9.8870 9.8870 10.6520 10.6520 10.7128 10.7128 13.6645 13.6645 14.1474 14.1474 14.5852 14.5852 14.8512 14.8512 k =-0.2659 1.0549 0.5546 ( 3588 PWs) bands (ev): -36.0499 -36.0499 -36.0413 -36.0413 -15.4275 -15.4275 -15.4032 -15.4032 -13.7454 -13.7454 -13.7351 -13.7351 -13.6633 -13.6633 -13.6019 -13.6019 3.1932 3.1932 3.8257 3.8257 4.4914 4.4914 6.0233 6.0233 7.8916 7.8916 8.2083 8.2083 9.0667 9.0667 9.4017 9.4017 9.6652 9.6652 9.8573 9.8573 10.6064 10.6064 10.6699 10.6699 13.7242 13.7242 14.1819 14.1819 14.5673 14.5673 14.9040 14.9040 k =-0.2659 1.0549 0.5787 ( 3584 PWs) bands (ev): -36.0493 -36.0493 -36.0411 -36.0411 -15.4282 -15.4282 -15.4048 -15.4048 -13.7459 -13.7459 -13.7361 -13.7361 -13.6648 -13.6648 -13.6052 -13.6052 3.2317 3.2317 3.8759 3.8759 4.5483 4.5483 5.9411 5.9411 7.9305 7.9305 8.1264 8.1264 8.9866 8.9866 9.3753 9.3753 9.6722 9.6722 9.8285 9.8285 10.5640 10.5640 10.6284 10.6284 13.7848 13.7848 14.2194 14.2194 14.5479 14.5479 14.9546 14.9546 k =-0.2659 1.0549 0.6028 ( 3586 PWs) bands (ev): -36.0488 -36.0488 -36.0410 -36.0410 -15.4288 -15.4288 -15.4065 -15.4065 -13.7465 -13.7465 -13.7372 -13.7372 -13.6661 -13.6661 -13.6085 -13.6085 3.2716 3.2716 3.9273 3.9273 4.6068 4.6068 5.8594 5.8594 7.9030 7.9030 8.1132 8.1132 8.8847 8.8847 9.3534 9.3534 9.6950 9.6950 9.8010 9.8010 10.5248 10.5248 10.5888 10.5888 13.8463 13.8463 14.2588 14.2588 14.5290 14.5290 15.0029 15.0029 k =-0.2659 1.0549 0.6270 ( 3582 PWs) bands (ev): -36.0483 -36.0483 -36.0408 -36.0408 -15.4294 -15.4294 -15.4081 -15.4081 -13.7473 -13.7473 -13.7384 -13.7384 -13.6670 -13.6670 -13.6117 -13.6117 3.3130 3.3130 3.9795 3.9795 4.6665 4.6665 5.7787 5.7787 7.8175 7.8175 8.1604 8.1604 8.7696 8.7696 9.3366 9.3366 9.7225 9.7225 9.7760 9.7760 10.4888 10.4888 10.5515 10.5515 13.9088 13.9088 14.2975 14.2975 14.5141 14.5141 15.0489 15.0489 k =-0.2659 1.0549 0.6511 ( 3580 PWs) bands (ev): -36.0477 -36.0477 -36.0407 -36.0407 -15.4300 -15.4300 -15.4098 -15.4098 -13.7482 -13.7482 -13.7396 -13.7396 -13.6677 -13.6677 -13.6147 -13.6147 3.3559 3.3559 4.0324 4.0324 4.7273 4.7273 5.6994 5.6994 7.7174 7.7174 8.2248 8.2248 8.6476 8.6476 9.3232 9.3232 9.7351 9.7351 9.7676 9.7676 10.4561 10.4561 10.5170 10.5170 13.9719 13.9719 14.3305 14.3305 14.5093 14.5093 15.0926 15.0926 k =-0.2659 1.0549 0.6752 ( 3582 PWs) bands (ev): -36.0472 -36.0472 -36.0406 -36.0406 -15.4305 -15.4305 -15.4114 -15.4114 -13.7492 -13.7492 -13.7410 -13.7410 -13.6681 -13.6681 -13.6177 -13.6177 3.4002 3.4002 4.0855 4.0855 4.7888 4.7888 5.6218 5.6218 7.6152 7.6152 8.2941 8.2941 8.5225 8.5225 9.3120 9.3120 9.7160 9.7160 9.7897 9.7897 10.4268 10.4268 10.4859 10.4859 14.0354 14.0354 14.3503 14.3503 14.5230 14.5230 15.1338 15.1338 k =-0.2659 1.0549 0.6993 ( 3573 PWs) bands (ev): -36.0467 -36.0467 -36.0404 -36.0404 -15.4309 -15.4309 -15.4131 -15.4131 -13.7502 -13.7502 -13.7424 -13.7424 -13.6682 -13.6682 -13.6206 -13.6206 3.4459 3.4459 4.1383 4.1383 4.8507 4.8507 5.5465 5.5465 7.5141 7.5141 8.3613 8.3613 8.4004 8.4004 9.3022 9.3022 9.6926 9.6926 9.8126 9.8126 10.4008 10.4008 10.4588 10.4588 14.0990 14.0990 14.3546 14.3546 14.5584 14.5584 15.1726 15.1726 k =-0.2659 1.0549 0.7234 ( 3565 PWs) bands (ev): -36.0462 -36.0462 -36.0403 -36.0403 -15.4314 -15.4314 -15.4147 -15.4147 -13.7513 -13.7513 -13.7438 -13.7438 -13.6681 -13.6681 -13.6234 -13.6234 3.4930 3.4930 4.1901 4.1901 4.9124 4.9124 5.4742 5.4742 7.4159 7.4159 8.2679 8.2679 8.4400 8.4400 9.2934 9.2934 9.6696 9.6696 9.8302 9.8302 10.3780 10.3780 10.4362 10.4362 14.1621 14.1621 14.3498 14.3498 14.6097 14.6097 15.2090 15.2090 k =-0.2659 1.0549 0.7475 ( 3565 PWs) bands (ev): -36.0457 -36.0457 -36.0402 -36.0402 -15.4317 -15.4317 -15.4162 -15.4162 -13.7524 -13.7524 -13.7453 -13.7453 -13.6677 -13.6677 -13.6261 -13.6261 3.5414 3.5414 4.2400 4.2400 4.9734 4.9734 5.4058 5.4058 7.3215 7.3215 8.1432 8.1432 8.5119 8.5119 9.2853 9.2853 9.6478 9.6478 9.8409 9.8409 10.3585 10.3585 10.4182 10.4182 14.2240 14.2240 14.3427 14.3427 14.6706 14.6706 15.2432 15.2432 k =-0.2659 1.0549 0.7716 ( 3561 PWs) bands (ev): -36.0452 -36.0452 -36.0402 -36.0402 -15.4320 -15.4320 -15.4178 -15.4178 -13.7534 -13.7534 -13.7468 -13.7468 -13.6671 -13.6671 -13.6287 -13.6287 3.5912 3.5912 4.2868 4.2868 5.0330 5.0330 5.3424 5.3424 7.2321 7.2321 8.0200 8.0200 8.5836 8.5836 9.2777 9.2777 9.6274 9.6274 9.8441 9.8441 10.3422 10.3422 10.4048 10.4048 14.2836 14.2836 14.3374 14.3374 14.7379 14.7379 15.2751 15.2751 k =-0.2659 1.0549 0.7958 ( 3565 PWs) bands (ev): -36.0447 -36.0447 -36.0401 -36.0401 -15.4323 -15.4323 -15.4192 -15.4192 -13.7544 -13.7544 -13.7483 -13.7483 -13.6663 -13.6663 -13.6312 -13.6312 3.6421 3.6421 4.3289 4.3289 5.0903 5.0903 5.2854 5.2854 7.1488 7.1488 7.8991 7.8991 8.6542 8.6542 9.2705 9.2705 9.6088 9.6088 9.8400 9.8400 10.3289 10.3289 10.3952 10.3952 14.3298 14.3298 14.3459 14.3459 14.8098 14.8098 15.3049 15.3049 k =-0.2659 1.0549 0.8199 ( 3569 PWs) bands (ev): -36.0443 -36.0443 -36.0402 -36.0402 -15.4324 -15.4324 -15.4206 -15.4206 -13.7554 -13.7554 -13.7498 -13.7498 -13.6654 -13.6654 -13.6336 -13.6336 3.6942 3.6942 4.3642 4.3642 5.1442 5.1442 5.2369 5.2369 7.0729 7.0729 7.7811 7.7811 8.7231 8.7231 9.2636 9.2636 9.5923 9.5923 9.8291 9.8291 10.3187 10.3187 10.3886 10.3886 14.3346 14.3346 14.3957 14.3957 14.8853 14.8853 15.3329 15.3329 k =-0.2659 1.0549 0.8440 ( 3563 PWs) bands (ev): -36.0439 -36.0439 -36.0401 -36.0401 -15.4325 -15.4325 -15.4220 -15.4220 -13.7563 -13.7563 -13.7512 -13.7512 -13.6643 -13.6643 -13.6359 -13.6359 3.7474 3.7474 4.3903 4.3903 5.1915 5.1915 5.2008 5.2008 7.0058 7.0058 7.6664 7.6664 8.7898 8.7898 9.2569 9.2569 9.5781 9.5781 9.8125 9.8125 10.3114 10.3114 10.3837 10.3837 14.3411 14.3411 14.4429 14.4429 14.9634 14.9634 15.3592 15.3592 k =-0.2659 1.0549 0.8681 ( 3569 PWs) bands (ev): -36.0435 -36.0435 -36.0402 -36.0402 -15.4326 -15.4326 -15.4233 -15.4233 -13.7570 -13.7570 -13.7525 -13.7525 -13.6631 -13.6631 -13.6382 -13.6382 3.8016 3.8016 4.4047 4.4047 5.1728 5.1728 5.2372 5.2372 6.9492 6.9492 7.5556 7.5556 8.8537 8.8537 9.2501 9.2501 9.5667 9.5667 9.7913 9.7913 10.3068 10.3068 10.3797 10.3797 14.3521 14.3521 14.4833 14.4833 15.0431 15.0431 15.3841 15.3841 k =-0.2659 1.0549 0.8922 ( 3571 PWs) bands (ev): -36.0431 -36.0431 -36.0403 -36.0403 -15.4325 -15.4325 -15.4245 -15.4245 -13.7577 -13.7577 -13.7538 -13.7538 -13.6618 -13.6618 -13.6404 -13.6404 3.8566 3.8566 4.4059 4.4059 5.1613 5.1613 5.2727 5.2727 6.9047 6.9047 7.4493 7.4493 8.9140 8.9140 9.2430 9.2430 9.5585 9.5585 9.7667 9.7667 10.3048 10.3048 10.3755 10.3755 14.3676 14.3676 14.5152 14.5152 15.1232 15.1232 15.4080 15.4080 k =-0.2659 1.0549 0.9163 ( 3569 PWs) bands (ev): -36.0427 -36.0427 -36.0404 -36.0404 -15.4323 -15.4323 -15.4257 -15.4257 -13.7582 -13.7582 -13.7549 -13.7549 -13.6604 -13.6604 -13.6425 -13.6425 3.9124 3.9124 4.3934 4.3934 5.1633 5.1633 5.2993 5.2993 6.8741 6.8741 7.3482 7.3482 8.9701 8.9701 9.2353 9.2353 9.5539 9.5539 9.7398 9.7398 10.3051 10.3051 10.3707 10.3707 14.3870 14.3870 14.5376 14.5376 15.2019 15.2019 15.4306 15.4306 k =-0.2659 1.0549 0.9404 ( 3571 PWs) bands (ev): -36.0424 -36.0424 -36.0405 -36.0405 -15.4321 -15.4321 -15.4267 -15.4267 -13.7586 -13.7586 -13.7559 -13.7559 -13.6589 -13.6589 -13.6445 -13.6445 3.9686 3.9686 4.3685 4.3685 5.1769 5.1769 5.3156 5.3156 6.8587 6.8587 7.2531 7.2531 9.0212 9.0212 9.2264 9.2264 9.5534 9.5534 9.7116 9.7116 10.3077 10.3077 10.3650 10.3650 14.4097 14.4097 14.5500 14.5500 15.2765 15.2765 15.4515 15.4515 k =-0.2659 1.0549 0.9646 ( 3567 PWs) bands (ev): -36.0420 -36.0420 -36.0406 -36.0406 -15.4317 -15.4317 -15.4277 -15.4277 -13.7589 -13.7589 -13.7567 -13.7567 -13.6573 -13.6573 -13.6465 -13.6465 4.0249 4.0249 4.3335 4.3335 5.1990 5.1990 5.3212 5.3212 6.8593 6.8593 7.1650 7.1650 9.0666 9.0666 9.2159 9.2159 9.5575 9.5575 9.6831 9.6831 10.3120 10.3120 10.3583 10.3583 14.4346 14.4346 14.5524 14.5524 15.3433 15.3433 15.4695 15.4695 k =-0.2659 1.0549 0.9887 ( 3558 PWs) bands (ev): -36.0417 -36.0417 -36.0408 -36.0408 -15.4313 -15.4313 -15.4286 -15.4286 -13.7590 -13.7590 -13.7574 -13.7574 -13.6557 -13.6557 -13.6484 -13.6484 4.0812 4.0812 4.2908 4.2908 5.2260 5.2260 5.3164 5.3164 6.8761 6.8761 7.0851 7.0851 9.1058 9.1058 9.2028 9.2028 9.5662 9.5662 9.6558 9.6558 10.3178 10.3178 10.3509 10.3509 14.4604 14.4604 14.5461 14.5461 15.3978 15.3978 15.4827 15.4827 k =-0.2659 1.0549 1.0128 ( 3556 PWs) bands (ev): -36.0414 -36.0414 -36.0409 -36.0409 -15.4308 -15.4308 -15.4294 -15.4294 -13.7590 -13.7590 -13.7579 -13.7579 -13.6540 -13.6540 -13.6503 -13.6503 4.1366 4.1366 4.2427 4.2427 5.2542 5.2542 5.3023 5.3023 6.9083 6.9083 7.0148 7.0148 9.1385 9.1385 9.1862 9.1862 9.5785 9.5785 9.6318 9.6318 10.3243 10.3243 10.3435 10.3435 14.4854 14.4854 14.5327 14.5327 15.4345 15.4345 15.4899 15.4899 k =-0.2659 1.0549 1.0369 ( 3556 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4303 -15.4303 -15.4300 -15.4300 -13.7589 -13.7589 -13.7581 -13.7581 -13.6528 -13.6528 -13.6516 -13.6516 4.1881 4.1881 4.1936 4.1936 5.2783 5.2783 5.2831 5.2831 6.9495 6.9495 6.9609 6.9609 9.1646 9.1646 9.1657 9.1657 9.5872 9.5872 9.6190 9.6190 10.3286 10.3286 10.3389 10.3389 14.5019 14.5019 14.5201 14.5201 15.4480 15.4480 15.4916 15.4916 k =-0.2659 1.0549 1.0369 ( 3556 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4303 -15.4303 -15.4300 -15.4300 -13.7589 -13.7589 -13.7581 -13.7581 -13.6528 -13.6528 -13.6516 -13.6516 4.1881 4.1881 4.1936 4.1936 5.2783 5.2783 5.2831 5.2831 6.9495 6.9495 6.9609 6.9609 9.1646 9.1646 9.1657 9.1657 9.5872 9.5872 9.6190 9.6190 10.3286 10.3286 10.3389 10.3389 14.5019 14.5019 14.5201 14.5201 15.4480 15.4480 15.4916 15.4916 k =-0.2717 1.0317 1.0369 ( 3548 PWs) bands (ev): -36.0412 -36.0412 -36.0412 -36.0412 -15.4300 -15.4300 -15.4297 -15.4297 -13.7583 -13.7583 -13.7576 -13.7576 -13.6527 -13.6527 -13.6515 -13.6515 4.1858 4.1858 4.1919 4.1919 5.2517 5.2517 5.2585 5.2585 6.9740 6.9740 6.9828 6.9828 9.1951 9.1951 9.1969 9.1969 9.5879 9.5879 9.6177 9.6177 10.3198 10.3198 10.3323 10.3323 14.4913 14.4913 14.5092 14.5092 15.3954 15.3954 15.4434 15.4434 k =-0.2776 1.0085 1.0369 ( 3540 PWs) bands (ev): -36.0413 -36.0413 -36.0413 -36.0413 -15.4297 -15.4297 -15.4292 -15.4292 -13.7575 -13.7575 -13.7570 -13.7570 -13.6526 -13.6526 -13.6514 -13.6514 4.1831 4.1831 4.1897 4.1897 5.2168 5.2168 5.2255 5.2255 7.0109 7.0109 7.0175 7.0175 9.2228 9.2228 9.2278 9.2278 9.5911 9.5911 9.6185 9.6185 10.3093 10.3093 10.3240 10.3240 14.4755 14.4755 14.4930 14.4930 15.3487 15.3487 15.4001 15.4001 k =-0.2834 0.9853 1.0369 ( 3546 PWs) bands (ev): -36.0414 -36.0414 -36.0414 -36.0414 -15.4293 -15.4293 -15.4287 -15.4287 -13.7565 -13.7565 -13.7562 -13.7562 -13.6525 -13.6525 -13.6513 -13.6513 4.1799 4.1799 4.1870 4.1870 5.1749 5.1749 5.1850 5.1850 7.0589 7.0589 7.0637 7.0637 9.2485 9.2485 9.2573 9.2573 9.5969 9.5969 9.6217 9.6217 10.2967 10.2967 10.3137 10.3137 14.4572 14.4572 14.4744 14.4744 15.3071 15.3071 15.3611 15.3611 k =-0.2893 0.9621 1.0369 ( 3542 PWs) bands (ev): -36.0416 -36.0416 -36.0415 -36.0415 -15.4288 -15.4288 -15.4281 -15.4281 -13.7554 -13.7554 -13.7552 -13.7552 -13.6524 -13.6524 -13.6512 -13.6512 4.1763 4.1763 4.1838 4.1838 5.1272 5.1272 5.1385 5.1385 7.1168 7.1168 7.1200 7.1200 9.2722 9.2722 9.2850 9.2850 9.6056 9.6056 9.6274 9.6274 10.2819 10.2819 10.3012 10.3012 14.4389 14.4389 14.4557 14.4557 15.2701 15.2701 15.3260 15.3260 k =-0.2951 0.9388 1.0369 ( 3550 PWs) bands (ev): -36.0417 -36.0417 -36.0417 -36.0417 -15.4283 -15.4283 -15.4274 -15.4274 -13.7541 -13.7541 -13.7541 -13.7541 -13.6522 -13.6522 -13.6510 -13.6510 4.1723 4.1723 4.1802 4.1802 5.0751 5.0751 5.0872 5.0872 7.1832 7.1832 7.1852 7.1852 9.2937 9.2937 9.3108 9.3108 9.6172 9.6172 9.6359 9.6359 10.2648 10.2648 10.2862 10.2862 14.4225 14.4225 14.4390 14.4390 15.2372 15.2372 15.2946 15.2946 k =-0.3010 0.9156 1.0369 ( 3554 PWs) bands (ev): -36.0419 -36.0419 -36.0419 -36.0419 -15.4276 -15.4276 -15.4267 -15.4267 -13.7528 -13.7528 -13.7527 -13.7527 -13.6520 -13.6520 -13.6508 -13.6508 4.1678 4.1678 4.1762 4.1762 5.0197 5.0197 5.0324 5.0324 7.2569 7.2569 7.2579 7.2579 9.3132 9.3132 9.3346 9.3346 9.6315 9.6315 9.6472 9.6472 10.2452 10.2452 10.2688 10.2688 14.4094 14.4094 14.4257 14.4257 15.2084 15.2084 15.2667 15.2667 k =-0.3069 0.8924 1.0369 ( 3554 PWs) bands (ev): -36.0421 -36.0421 -36.0421 -36.0421 -15.4269 -15.4269 -15.4259 -15.4259 -13.7514 -13.7514 -13.7512 -13.7512 -13.6518 -13.6518 -13.6506 -13.6506 4.1630 4.1630 4.1715 4.1715 4.9621 4.9621 4.9750 4.9750 7.3367 7.3367 7.3371 7.3371 9.3306 9.3306 9.3562 9.3562 9.6485 9.6485 9.6613 9.6613 10.2233 10.2233 10.2490 10.2490 14.4007 14.4007 14.4169 14.4169 15.1833 15.1833 15.2423 15.2423 k =-0.3127 0.8692 1.0369 ( 3550 PWs) bands (ev): -36.0423 -36.0423 -36.0423 -36.0423 -15.4261 -15.4261 -15.4250 -15.4250 -13.7499 -13.7499 -13.7496 -13.7496 -13.6515 -13.6515 -13.6503 -13.6503 4.1576 4.1576 4.1663 4.1663 4.9032 4.9032 4.9162 4.9162 7.4218 7.4218 7.4219 7.4219 9.3463 9.3463 9.3757 9.3757 9.6679 9.6679 9.6781 9.6781 10.1995 10.1995 10.2271 10.2271 14.3971 14.3971 14.4133 14.4133 15.1619 15.1619 15.2212 15.2212 k =-0.3186 0.8459 1.0369 ( 3554 PWs) bands (ev): -36.0426 -36.0426 -36.0426 -36.0426 -15.4253 -15.4253 -15.4241 -15.4241 -13.7483 -13.7483 -13.7479 -13.7479 -13.6511 -13.6511 -13.6499 -13.6499 4.1517 4.1517 4.1604 4.1604 4.8438 4.8438 4.8566 4.8566 7.5111 7.5111 7.5114 7.5114 9.3603 9.3603 9.3931 9.3931 9.6891 9.6891 9.6972 9.6972 10.1743 10.1743 10.2035 10.2035 14.3988 14.3988 14.4150 14.4150 15.1442 15.1442 15.2033 15.2033 k =-0.3244 0.8227 1.0369 ( 3562 PWs) bands (ev): -36.0428 -36.0428 -36.0428 -36.0428 -15.4244 -15.4244 -15.4231 -15.4231 -13.7467 -13.7467 -13.7462 -13.7462 -13.6506 -13.6506 -13.6494 -13.6494 4.1450 4.1450 4.1537 4.1537 4.7847 4.7847 4.7970 4.7970 7.6042 7.6042 7.6045 7.6045 9.3728 9.3728 9.4085 9.4085 9.7118 9.7118 9.7181 9.7181 10.1483 10.1483 10.1789 10.1789 14.4059 14.4059 14.4222 14.4222 15.1298 15.1298 15.1881 15.1881 k =-0.3303 0.7995 1.0369 ( 3562 PWs) bands (ev): -36.0431 -36.0431 -36.0431 -36.0431 -15.4234 -15.4234 -15.4221 -15.4221 -13.7450 -13.7450 -13.7445 -13.7445 -13.6501 -13.6501 -13.6489 -13.6489 4.1376 4.1376 4.1459 4.1459 4.7264 4.7264 4.7381 4.7381 7.7005 7.7005 7.7007 7.7007 9.3840 9.3840 9.4218 9.4218 9.7351 9.7351 9.7401 9.7401 10.1229 10.1229 10.1544 10.1544 14.4181 14.4181 14.4345 14.4345 15.1183 15.1183 15.1747 15.1747 k =-0.3361 0.7763 1.0369 ( 3566 PWs) bands (ev): -36.0433 -36.0433 -36.0433 -36.0433 -15.4224 -15.4224 -15.4211 -15.4211 -13.7433 -13.7433 -13.7427 -13.7427 -13.6494 -13.6494 -13.6482 -13.6482 4.1291 4.1291 4.1369 4.1369 4.6698 4.6698 4.6804 4.6804 7.7992 7.7992 7.7992 7.7992 9.3938 9.3938 9.4331 9.4331 9.7580 9.7580 9.7621 9.7621 10.0995 10.0995 10.1314 10.1314 14.4351 14.4351 14.4516 14.4516 15.1087 15.1087 15.1609 15.1609 k =-0.3420 0.7530 1.0369 ( 3566 PWs) bands (ev): -36.0436 -36.0436 -36.0436 -36.0436 -15.4214 -15.4214 -15.4200 -15.4200 -13.7416 -13.7416 -13.7410 -13.7410 -13.6486 -13.6486 -13.6474 -13.6474 4.1193 4.1193 4.1264 4.1264 4.6152 4.6152 4.6247 4.6247 7.8994 7.8994 7.8998 7.8998 9.4023 9.4023 9.4423 9.4423 9.7794 9.7794 9.7823 9.7823 10.0806 10.0806 10.1119 10.1119 14.4564 14.4564 14.4728 14.4728 15.0987 15.0987 15.1425 15.1425 k =-0.3478 0.7298 1.0369 ( 3558 PWs) bands (ev): -36.0439 -36.0439 -36.0439 -36.0439 -15.4203 -15.4203 -15.4189 -15.4189 -13.7400 -13.7400 -13.7393 -13.7393 -13.6477 -13.6477 -13.6465 -13.6465 4.1080 4.1080 4.1141 4.1141 4.5635 4.5635 4.5714 4.5714 8.0008 8.0008 8.0016 8.0016 9.4091 9.4091 9.4489 9.4489 9.7973 9.7973 9.7986 9.7986 10.0692 10.0692 10.0985 10.0985 14.4812 14.4812 14.4974 14.4974 15.0839 15.0839 15.1129 15.1129 k =-0.3537 0.7066 1.0369 ( 3562 PWs) bands (ev): -36.0442 -36.0442 -36.0442 -36.0442 -15.4192 -15.4192 -15.4177 -15.4177 -13.7384 -13.7384 -13.7376 -13.7376 -13.6467 -13.6467 -13.6454 -13.6454 4.0948 4.0948 4.0995 4.0995 4.5151 4.5151 4.5212 4.5212 8.1027 8.1027 8.1040 8.1040 9.4140 9.4140 9.4527 9.4527 9.8092 9.8092 9.8099 9.8099 10.0685 10.0685 10.0940 10.0940 14.5088 14.5088 14.5243 14.5243 15.0580 15.0580 15.0673 15.0673 k =-0.3595 0.6834 1.0369 ( 3564 PWs) bands (ev): -36.0445 -36.0445 -36.0445 -36.0445 -15.4181 -15.4181 -15.4166 -15.4166 -13.7368 -13.7368 -13.7360 -13.7360 -13.6455 -13.6455 -13.6442 -13.6442 4.0792 4.0792 4.0823 4.0823 4.4707 4.4707 4.4746 4.4746 8.2045 8.2045 8.2063 8.2063 9.4166 9.4166 9.4531 9.4531 9.8134 9.8134 9.8162 9.8162 10.0802 10.0802 10.1008 10.1008 14.5380 14.5380 14.5524 14.5524 15.0075 15.0075 15.0161 15.0161 k =-0.3654 0.6601 1.0369 ( 3560 PWs) bands (ev): -36.0448 -36.0448 -36.0448 -36.0448 -15.4170 -15.4170 -15.4155 -15.4155 -13.7353 -13.7353 -13.7346 -13.7346 -13.6442 -13.6442 -13.6428 -13.6428 4.0610 4.0610 4.0622 4.0622 4.4307 4.4307 4.4323 4.4323 8.3053 8.3053 8.3077 8.3077 9.4166 9.4166 9.4496 9.4496 9.8131 9.8131 9.8171 9.8171 10.1038 10.1038 10.1191 10.1191 14.5674 14.5674 14.5800 14.5800 14.9389 14.9389 14.9602 14.9602 k =-0.3712 0.6369 1.0369 ( 3556 PWs) bands (ev): -36.0451 -36.0451 -36.0451 -36.0451 -15.4159 -15.4159 -15.4143 -15.4143 -13.7340 -13.7340 -13.7332 -13.7332 -13.6427 -13.6427 -13.6413 -13.6413 4.0390 4.0390 4.0397 4.0397 4.3946 4.3946 4.3954 4.3954 8.4044 8.4044 8.4072 8.4072 9.4136 9.4136 9.4418 9.4418 9.8117 9.8117 9.8151 9.8151 10.1373 10.1373 10.1479 10.1479 14.5935 14.5935 14.6036 14.6036 14.8682 14.8682 14.8978 14.8978 k =-0.3771 0.6137 1.0369 ( 3556 PWs) bands (ev): -36.0454 -36.0454 -36.0454 -36.0454 -15.4148 -15.4148 -15.4132 -15.4132 -13.7327 -13.7327 -13.7320 -13.7320 -13.6411 -13.6411 -13.6397 -13.6397 4.0128 4.0128 4.0155 4.0155 4.3618 4.3618 4.3650 4.3650 8.5005 8.5005 8.5038 8.5038 9.4077 9.4077 9.4302 9.4302 9.8120 9.8120 9.8132 9.8132 10.1787 10.1787 10.1851 10.1851 14.6070 14.6070 14.6151 14.6151 14.8065 14.8065 14.8411 14.8411 k =-0.3829 0.5905 1.0369 ( 3556 PWs) bands (ev): -36.0457 -36.0457 -36.0457 -36.0457 -15.4136 -15.4136 -15.4121 -15.4121 -13.7316 -13.7316 -13.7309 -13.7309 -13.6393 -13.6393 -13.6379 -13.6379 3.9839 3.9839 3.9883 3.9883 4.3338 4.3338 4.3392 4.3392 8.5925 8.5925 8.5959 8.5959 9.3994 9.3994 9.4155 9.4155 9.8139 9.8139 9.8158 9.8158 10.2266 10.2266 10.2294 10.2294 14.5864 14.5864 14.5975 14.5975 14.7767 14.7767 14.8092 14.8092 k =-0.3888 0.5673 1.0369 ( 3556 PWs) bands (ev): -36.0460 -36.0460 -36.0460 -36.0460 -15.4125 -15.4125 -15.4110 -15.4110 -13.7306 -13.7306 -13.7299 -13.7299 -13.6374 -13.6374 -13.6360 -13.6360 3.9529 3.9529 3.9588 3.9588 4.3103 4.3103 4.3175 4.3175 8.6786 8.6786 8.6819 8.6819 9.3900 9.3900 9.3993 9.3993 9.8186 9.8186 9.8241 9.8241 10.2798 10.2798 10.2802 10.2802 14.5243 14.5243 14.5424 14.5424 14.7865 14.7865 14.8120 14.8120 k =-0.3946 0.5440 1.0369 ( 3552 PWs) bands (ev): -36.0463 -36.0463 -36.0463 -36.0463 -15.4114 -15.4114 -15.4099 -15.4099 -13.7297 -13.7297 -13.7290 -13.7290 -13.6354 -13.6354 -13.6340 -13.6340 3.9204 3.9204 3.9274 3.9274 4.2907 4.2907 4.2993 4.2993 8.7569 8.7569 8.7596 8.7596 9.3812 9.3812 9.3838 9.3838 9.8282 9.8282 9.8371 9.8371 10.3356 10.3356 10.3391 10.3391 14.4409 14.4409 14.4640 14.4640 14.8163 14.8163 14.8362 14.8362 k =-0.4005 0.5208 1.0369 ( 3552 PWs) bands (ev): -36.0466 -36.0466 -36.0466 -36.0466 -15.4104 -15.4104 -15.4089 -15.4089 -13.7289 -13.7289 -13.7282 -13.7282 -13.6334 -13.6334 -13.6320 -13.6320 3.8873 3.8873 3.8950 3.8950 4.2744 4.2744 4.2840 4.2840 8.8248 8.8248 8.8263 8.8263 9.3716 9.3716 9.3754 9.3754 9.8430 9.8430 9.8547 9.8547 10.3968 10.3968 10.4031 10.4031 14.3483 14.3483 14.3745 14.3745 14.8544 14.8544 14.8704 14.8704 k =-0.4064 0.4976 1.0369 ( 3556 PWs) bands (ev): -36.0469 -36.0469 -36.0469 -36.0469 -15.4093 -15.4093 -15.4079 -15.4079 -13.7282 -13.7282 -13.7276 -13.7276 -13.6312 -13.6312 -13.6298 -13.6298 3.8541 3.8541 3.8622 3.8622 4.2609 4.2609 4.2711 4.2711 8.8794 8.8794 8.8796 8.8796 9.3655 9.3655 9.3753 9.3753 9.8632 9.8632 9.8767 9.8767 10.4632 10.4632 10.4722 10.4722 14.2508 14.2508 14.2788 14.2788 14.8968 14.8968 14.9100 14.9100 k =-0.4122 0.4744 1.0369 ( 3560 PWs) bands (ev): -36.0472 -36.0472 -36.0472 -36.0472 -15.4083 -15.4083 -15.4070 -15.4070 -13.7277 -13.7277 -13.7271 -13.7271 -13.6290 -13.6290 -13.6277 -13.6277 3.8213 3.8213 3.8297 3.8297 4.2495 4.2495 4.2601 4.2601 8.9169 8.9169 8.9188 8.9188 9.3679 9.3679 9.3825 9.3825 9.8885 9.8885 9.9030 9.9030 10.5348 10.5348 10.5464 10.5464 14.1499 14.1499 14.1792 14.1792 14.9422 14.9422 14.9532 14.9532 k =-0.4181 0.4511 1.0369 ( 3564 PWs) bands (ev): -36.0474 -36.0474 -36.0474 -36.0474 -15.4074 -15.4074 -15.4060 -15.4060 -13.7272 -13.7272 -13.7267 -13.7267 -13.6268 -13.6268 -13.6255 -13.6255 3.7895 3.7895 3.7978 3.7978 4.2398 4.2398 4.2505 4.2505 8.9388 8.9388 8.9419 8.9419 9.3794 9.3794 9.3973 9.3973 9.9186 9.9186 9.9331 9.9331 10.6117 10.6117 10.6258 10.6258 14.0465 14.0465 14.0767 14.0767 14.9899 14.9899 14.9993 14.9993 k =-0.4239 0.4279 1.0369 ( 3574 PWs) bands (ev): -36.0477 -36.0477 -36.0477 -36.0477 -15.4064 -15.4064 -15.4052 -15.4052 -13.7268 -13.7268 -13.7264 -13.7264 -13.6246 -13.6246 -13.6234 -13.6234 3.7590 3.7590 3.7671 3.7671 4.2316 4.2316 4.2422 4.2422 8.9470 8.9470 8.9506 8.9506 9.3985 9.3985 9.4178 9.4178 9.9528 9.9528 9.9667 9.9667 10.6938 10.6938 10.7102 10.7102 13.9410 13.9410 13.9718 13.9718 15.0393 15.0393 15.0478 15.0478 k =-0.4298 0.4047 1.0369 ( 3568 PWs) bands (ev): -36.0479 -36.0479 -36.0479 -36.0479 -15.4056 -15.4056 -15.4044 -15.4044 -13.7265 -13.7265 -13.7261 -13.7261 -13.6225 -13.6225 -13.6213 -13.6213 3.7300 3.7300 3.7378 3.7378 4.2246 4.2246 4.2348 4.2348 8.9451 8.9451 8.9484 8.9484 9.4220 9.4220 9.4412 9.4412 9.9905 9.9905 10.0029 10.0029 10.7811 10.7811 10.7995 10.7995 13.8338 13.8338 13.8651 13.8651 15.0895 15.0895 15.0982 15.0982 k =-0.4356 0.3815 1.0369 ( 3564 PWs) bands (ev): -36.0482 -36.0482 -36.0482 -36.0482 -15.4047 -15.4047 -15.4036 -15.4036 -13.7263 -13.7263 -13.7259 -13.7259 -13.6204 -13.6204 -13.6192 -13.6192 3.7028 3.7028 3.7101 3.7101 4.2186 4.2186 4.2283 4.2283 8.9363 8.9363 8.9391 8.9391 9.4469 9.4469 9.4649 9.4649 10.0303 10.0303 10.0410 10.0410 10.8731 10.8731 10.8933 10.8933 13.7253 13.7253 13.7568 13.7568 15.1387 15.1387 15.1497 15.1497 k =-0.4415 0.3582 1.0369 ( 3572 PWs) bands (ev): -36.0484 -36.0484 -36.0484 -36.0484 -15.4040 -15.4040 -15.4029 -15.4029 -13.7261 -13.7261 -13.7258 -13.7258 -13.6184 -13.6184 -13.6173 -13.6173 3.6776 3.6776 3.6844 3.6844 4.2134 4.2134 4.2226 4.2226 8.9235 8.9235 8.9257 8.9257 9.4710 9.4710 9.4872 9.4872 10.0711 10.0711 10.0799 10.0799 10.9694 10.9694 10.9911 10.9911 13.6159 13.6159 13.6474 13.6474 15.1813 15.1813 15.1985 15.1985 k =-0.4473 0.3350 1.0369 ( 3572 PWs) bands (ev): -36.0486 -36.0486 -36.0486 -36.0486 -15.4033 -15.4033 -15.4023 -15.4023 -13.7260 -13.7260 -13.7257 -13.7257 -13.6164 -13.6164 -13.6155 -13.6155 3.6545 3.6545 3.6608 3.6608 4.2089 4.2089 4.2174 4.2174 8.9087 8.9087 8.9102 8.9102 9.4930 9.4930 9.5072 9.5072 10.1116 10.1116 10.1185 10.1185 11.0694 11.0694 11.0922 11.0922 13.5059 13.5059 13.5373 13.5373 15.2000 15.2000 15.2195 15.2195 k =-0.4532 0.3118 1.0369 ( 3568 PWs) bands (ev): -36.0488 -36.0488 -36.0488 -36.0488 -15.4026 -15.4026 -15.4018 -15.4018 -13.7259 -13.7259 -13.7256 -13.7256 -13.6147 -13.6147 -13.6138 -13.6138 3.6336 3.6336 3.6393 3.6393 4.2051 4.2051 4.2129 4.2129 8.8933 8.8933 8.8943 8.8943 9.5125 9.5125 9.5246 9.5246 10.1507 10.1507 10.1558 10.1558 11.1721 11.1721 11.1958 11.1958 13.3960 13.3960 13.4270 13.4270 15.1827 15.1827 15.1905 15.1905 k =-0.4590 0.2886 1.0369 ( 3568 PWs) bands (ev): -36.0489 -36.0489 -36.0489 -36.0489 -15.4020 -15.4020 -15.4013 -15.4013 -13.7259 -13.7259 -13.7256 -13.7256 -13.6131 -13.6131 -13.6123 -13.6123 3.6151 3.6151 3.6201 3.6201 4.2019 4.2019 4.2089 4.2089 8.8783 8.8783 8.8788 8.8788 9.5292 9.5292 9.5394 9.5394 10.1873 10.1873 10.1910 10.1910 11.2765 11.2765 11.3005 11.3005 13.2869 13.2869 13.3172 13.3172 15.1489 15.1489 15.1507 15.1507 k =-0.4649 0.2654 1.0369 ( 3580 PWs) bands (ev): -36.0491 -36.0491 -36.0491 -36.0491 -15.4015 -15.4015 -15.4009 -15.4009 -13.7258 -13.7258 -13.7256 -13.7256 -13.6116 -13.6116 -13.6109 -13.6109 3.5989 3.5989 3.6032 3.6032 4.1993 4.1993 4.2053 4.2053 8.8642 8.8642 8.8644 8.8644 9.5433 9.5433 9.5517 9.5517 10.2205 10.2205 10.2231 10.2231 11.3808 11.3808 11.4048 11.4048 13.1799 13.1799 13.2092 13.2092 15.1111 15.1111 15.1118 15.1118 k =-0.4707 0.2421 1.0369 ( 3568 PWs) bands (ev): -36.0492 -36.0492 -36.0492 -36.0492 -15.4011 -15.4011 -15.4005 -15.4005 -13.7258 -13.7258 -13.7256 -13.7256 -13.6103 -13.6103 -13.6097 -13.6097 3.5852 3.5852 3.5888 3.5888 4.1971 4.1971 4.2023 4.2023 8.8517 8.8517 8.8517 8.8517 9.5550 9.5550 9.5616 9.5616 10.2498 10.2498 10.2515 10.2515 11.4834 11.4834 11.5067 11.5067 13.0766 13.0766 13.1043 13.1043 15.0746 15.0746 15.0764 15.0764 k =-0.4766 0.2189 1.0369 ( 3564 PWs) bands (ev): -36.0493 -36.0493 -36.0493 -36.0493 -15.4007 -15.4007 -15.4002 -15.4002 -13.7258 -13.7258 -13.7256 -13.7256 -13.6093 -13.6093 -13.6088 -13.6088 3.5740 3.5740 3.5769 3.5769 4.1955 4.1955 4.1997 4.1997 8.8410 8.8410 8.8411 8.8411 9.5643 9.5643 9.5695 9.5695 10.2745 10.2745 10.2755 10.2755 11.5812 11.5812 11.6030 11.6030 12.9797 12.9797 13.0050 13.0050 15.0429 15.0429 15.0449 15.0449 k =-0.4824 0.1957 1.0369 ( 3568 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.4004 -15.4004 -15.4000 -15.4000 -13.7258 -13.7258 -13.7257 -13.7257 -13.6084 -13.6084 -13.6080 -13.6080 3.5653 3.5653 3.5675 3.5675 4.1944 4.1944 4.1976 4.1976 8.8325 8.8325 8.8326 8.8326 9.5716 9.5716 9.5753 9.5753 10.2941 10.2941 10.2947 10.2947 11.6703 11.6703 11.6894 11.6894 12.8933 12.8933 12.9150 12.9150 15.0171 15.0171 15.0190 15.0190 k =-0.4883 0.1725 1.0369 ( 3560 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.4001 -15.4001 -15.3999 -15.3999 -13.7258 -13.7258 -13.7257 -13.7257 -13.6078 -13.6078 -13.6075 -13.6075 3.5592 3.5592 3.5607 3.5607 4.1938 4.1938 4.1959 4.1959 8.8263 8.8263 8.8264 8.8264 9.5768 9.5768 9.5792 9.5792 10.3084 10.3084 10.3087 10.3087 11.7448 11.7448 11.7595 11.7595 12.8235 12.8235 12.8399 12.8399 14.9982 14.9982 14.9996 14.9996 k =-0.4941 0.1492 1.0369 ( 3564 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.4000 -15.4000 -15.3998 -15.3998 -13.7258 -13.7258 -13.7257 -13.7257 -13.6074 -13.6074 -13.6072 -13.6072 3.5557 3.5557 3.5564 3.5564 4.1936 4.1936 4.1947 4.1947 8.8225 8.8225 8.8226 8.8226 9.5801 9.5801 9.5813 9.5813 10.3170 10.3170 10.3172 10.3172 11.7970 11.7970 11.8052 11.8052 12.7782 12.7782 12.7872 12.7872 14.9868 14.9868 14.9875 14.9875 k =-0.5000 0.1260 1.0369 ( 3556 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3999 -15.3999 -15.3999 -15.3999 -13.7257 -13.7257 -13.7257 -13.7257 -13.6072 -13.6072 -13.6072 -13.6072 3.5548 3.5548 3.5548 3.5548 4.1939 4.1939 4.1939 4.1939 8.8213 8.8213 8.8213 8.8213 9.5816 9.5816 9.5816 9.5816 10.3200 10.3200 10.3200 10.3200 11.8186 11.8186 11.8186 11.8186 12.7653 12.7653 12.7653 12.7653 14.9832 14.9832 14.9832 14.9832 k =-0.5000 0.1260 1.0369 ( 3556 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3999 -15.3999 -15.3999 -15.3999 -13.7257 -13.7257 -13.7257 -13.7257 -13.6072 -13.6072 -13.6072 -13.6072 3.5548 3.5548 3.5548 3.5548 4.1939 4.1939 4.1939 4.1939 8.8213 8.8213 8.8213 8.8213 9.5816 9.5816 9.5816 9.5816 10.3200 10.3200 10.3200 10.3200 11.8186 11.8186 11.8186 11.8186 12.7653 12.7653 12.7653 12.7653 14.9832 14.9832 14.9832 14.9832 k =-0.5000 0.1260 1.0128 ( 3554 PWs) bands (ev): -36.0497 -36.0497 -36.0492 -36.0492 -15.4006 -15.4006 -15.3990 -15.3990 -13.7268 -13.7268 -13.7244 -13.7244 -13.6080 -13.6080 -13.6064 -13.6064 3.4457 3.4457 3.6642 3.6642 4.0917 4.0917 4.2988 4.2988 8.7410 8.7410 8.8976 8.8976 9.5342 9.5342 9.6351 9.6351 10.3035 10.3035 10.3394 10.3394 11.7275 11.7275 11.9105 11.9105 12.6743 12.6743 12.8585 12.8585 14.9672 14.9672 14.9921 14.9921 k =-0.5000 0.1260 0.9887 ( 3556 PWs) bands (ev): -36.0499 -36.0499 -36.0490 -36.0490 -15.4012 -15.4012 -15.3980 -15.3980 -13.7275 -13.7275 -13.7229 -13.7229 -13.6088 -13.6088 -13.6057 -13.6057 3.3382 3.3382 3.7690 3.7690 3.9975 3.9975 4.4052 4.4052 8.6591 8.6591 8.9658 8.9658 9.4968 9.4968 9.6926 9.6926 10.2901 10.2901 10.3620 10.3620 11.6374 11.6374 12.0031 12.0031 12.5858 12.5858 12.9538 12.9538 14.9457 14.9457 14.9919 14.9919 k =-0.5000 0.1260 0.9646 ( 3564 PWs) bands (ev): -36.0503 -36.0503 -36.0489 -36.0489 -15.4017 -15.4017 -15.3969 -15.3969 -13.7280 -13.7280 -13.7210 -13.7210 -13.6096 -13.6096 -13.6050 -13.6050 3.2326 3.2326 3.8223 3.8223 3.9581 3.9581 4.5124 4.5124 8.5770 8.5770 9.0193 9.0193 9.4754 9.4754 9.7529 9.7529 10.2796 10.2796 10.3876 10.3876 11.5484 11.5484 12.0960 12.0960 12.5000 12.5000 13.0512 13.0512 14.9193 14.9193 14.9808 14.9808 k =-0.5000 0.1260 0.9404 ( 3568 PWs) bands (ev): -36.0506 -36.0506 -36.0488 -36.0488 -15.4021 -15.4021 -15.3956 -15.3956 -13.7282 -13.7282 -13.7189 -13.7189 -13.6104 -13.6104 -13.6043 -13.6043 3.1291 3.1291 3.7552 3.7552 4.0426 4.0426 4.6201 4.6201 8.4959 8.4959 9.0499 9.0499 9.4781 9.4781 9.8152 9.8152 10.2720 10.2720 10.4164 10.4164 11.4607 11.4607 12.1887 12.1887 12.4172 12.4172 13.1505 13.1505 14.8881 14.8881 14.9568 14.9568 k =-0.5000 0.1260 0.9163 ( 3566 PWs) bands (ev): -36.0509 -36.0509 -36.0486 -36.0486 -15.4023 -15.4023 -15.3943 -15.3943 -13.7281 -13.7281 -13.7166 -13.7166 -13.6113 -13.6113 -13.6037 -13.6037 3.0278 3.0278 3.6617 3.6617 4.1571 4.1571 4.7279 4.7279 8.4165 8.4165 9.0536 9.0536 9.5085 9.5085 9.8791 9.8791 10.2673 10.2673 10.4484 10.4484 11.3744 11.3744 12.2770 12.2770 12.3417 12.3417 13.2517 13.2517 14.8510 14.8510 14.9192 14.9192 k =-0.5000 0.1260 0.8922 ( 3562 PWs) bands (ev): -36.0513 -36.0513 -36.0485 -36.0485 -15.4025 -15.4025 -15.3928 -15.3928 -13.7278 -13.7278 -13.7139 -13.7139 -13.6121 -13.6121 -13.6031 -13.6031 2.9287 2.9287 3.5654 3.5654 4.2780 4.2780 4.8355 4.8355 8.3396 8.3396 9.0349 9.0349 9.5616 9.5616 9.9441 9.9441 10.2653 10.2653 10.4836 10.4836 11.2896 11.2896 12.2540 12.2540 12.3805 12.3805 13.3546 13.3546 14.8061 14.8061 14.8685 14.8685 k =-0.5000 0.1260 0.8681 ( 3568 PWs) bands (ev): -36.0517 -36.0517 -36.0485 -36.0485 -15.4025 -15.4025 -15.3913 -15.3913 -13.7272 -13.7272 -13.7110 -13.7110 -13.6129 -13.6129 -13.6026 -13.6026 2.8319 2.8319 3.4694 3.4694 4.4022 4.4022 4.9423 4.9423 8.2658 8.2658 9.0021 9.0021 9.6287 9.6287 10.0099 10.0099 10.2660 10.2660 10.5219 10.5219 11.2064 11.2064 12.1816 12.1816 12.4714 12.4714 13.4592 13.4592 14.7506 14.7506 14.8060 14.8060 k =-0.5000 0.1260 0.8440 ( 3588 PWs) bands (ev): -36.0522 -36.0522 -36.0485 -36.0485 -15.4024 -15.4024 -15.3896 -15.3896 -13.7265 -13.7265 -13.7079 -13.7079 -13.6137 -13.6137 -13.6020 -13.6020 2.7375 2.7375 3.3746 3.3746 4.5290 4.5290 5.0481 5.0481 8.1957 8.1957 8.9615 8.9615 9.7030 9.7030 10.0764 10.0764 10.2693 10.2693 10.5635 10.5635 11.1249 11.1249 12.1115 12.1115 12.5629 12.5629 13.5652 13.5652 14.6829 14.6829 14.7342 14.7342 k =-0.5000 0.1260 0.8199 ( 3596 PWs) bands (ev): -36.0527 -36.0527 -36.0485 -36.0485 -15.4022 -15.4022 -15.3879 -15.3879 -13.7255 -13.7255 -13.7046 -13.7046 -13.6145 -13.6145 -13.6015 -13.6015 2.6454 2.6454 3.2814 3.2814 4.6580 4.6580 5.1521 5.1521 8.1301 8.1301 8.9168 8.9168 9.7801 9.7801 10.1431 10.1431 10.2753 10.2753 10.6084 10.6084 11.0452 11.0452 12.0452 12.0452 12.6536 12.6536 13.6725 13.6725 14.6037 14.6037 14.6550 14.6550 k =-0.5000 0.1260 0.7958 ( 3588 PWs) bands (ev): -36.0532 -36.0532 -36.0484 -36.0484 -15.4019 -15.4019 -15.3860 -15.3860 -13.7243 -13.7243 -13.7010 -13.7010 -13.6153 -13.6153 -13.6011 -13.6011 2.5557 2.5557 3.1899 3.1899 4.7891 4.7891 5.2537 5.2537 8.0697 8.0697 8.8700 8.8700 9.8573 9.8573 10.2097 10.2097 10.2840 10.2840 10.6565 10.6565 10.9673 10.9673 11.9834 11.9834 12.7430 12.7430 13.7810 13.7810 14.5158 14.5158 14.5707 14.5707 k =-0.5000 0.1260 0.7716 ( 3590 PWs) bands (ev): -36.0537 -36.0537 -36.0485 -36.0485 -15.4015 -15.4015 -15.3841 -15.3841 -13.7229 -13.7229 -13.6972 -13.6972 -13.6159 -13.6159 -13.6007 -13.6007 2.4684 2.4684 3.1003 3.1003 4.9220 4.9220 5.3523 5.3523 8.0153 8.0153 8.8224 8.8224 9.9326 9.9326 10.2738 10.2738 10.2974 10.2974 10.7077 10.7077 10.8914 10.8914 11.9266 11.9266 12.8306 12.8306 13.8901 13.8901 14.4226 14.4226 14.4833 14.4833 k =-0.5000 0.1260 0.7475 ( 3586 PWs) bands (ev): -36.0542 -36.0542 -36.0485 -36.0485 -15.4010 -15.4010 -15.3821 -15.3821 -13.7214 -13.7214 -13.6933 -13.6933 -13.6166 -13.6166 -13.6003 -13.6003 2.3835 2.3835 3.0126 3.0126 5.0568 5.0568 5.4468 5.4468 7.9679 7.9679 8.7747 8.7747 10.0044 10.0044 10.3047 10.3047 10.3458 10.3458 10.7615 10.7615 10.8183 10.8183 11.8754 11.8754 12.9162 12.9162 13.9991 13.9991 14.3270 14.3270 14.3955 14.3955 k =-0.5000 0.1260 0.7234 ( 3590 PWs) bands (ev): -36.0547 -36.0547 -36.0486 -36.0486 -15.4004 -15.4004 -15.3801 -15.3801 -13.7197 -13.7197 -13.6892 -13.6892 -13.6171 -13.6171 -13.5999 -13.5999 2.3011 2.3011 2.9270 2.9270 5.1933 5.1933 5.5364 5.5364 7.9285 7.9285 8.7274 8.7274 10.0714 10.0714 10.3207 10.3207 10.4105 10.4105 10.7441 10.7441 10.8216 10.8216 11.8306 11.8306 12.9992 12.9992 14.1039 14.1039 14.2311 14.2311 14.3126 14.3126 k =-0.5000 0.1260 0.6993 ( 3594 PWs) bands (ev): -36.0552 -36.0552 -36.0487 -36.0487 -15.3998 -15.3998 -15.3780 -15.3780 -13.7179 -13.7179 -13.6849 -13.6849 -13.6176 -13.6176 -13.5995 -13.5995 2.2211 2.2211 2.8435 2.8435 5.3315 5.3315 5.6200 5.6200 7.8982 7.8982 8.6807 8.6807 10.1321 10.1321 10.3379 10.3379 10.4748 10.4748 10.6749 10.6749 10.8823 10.8823 11.7928 11.7928 13.0793 13.0793 14.1352 14.1352 14.1668 14.1668 14.2748 14.2748 k =-0.5000 0.1260 0.6752 ( 3590 PWs) bands (ev): -36.0557 -36.0557 -36.0488 -36.0488 -15.3990 -15.3990 -15.3759 -15.3759 -13.7161 -13.7161 -13.6806 -13.6806 -13.6179 -13.6179 -13.5992 -13.5992 2.1436 2.1436 2.7623 2.7623 5.4711 5.4711 5.6964 5.6964 7.8781 7.8781 8.6350 8.6350 10.1854 10.1854 10.3567 10.3567 10.5378 10.5378 10.6076 10.6076 10.9467 10.9467 11.7626 11.7626 13.1562 13.1562 14.0430 14.0430 14.1113 14.1113 14.3571 14.3571 k =-0.5000 0.1260 0.6511 ( 3582 PWs) bands (ev): -36.0562 -36.0562 -36.0489 -36.0489 -15.3983 -15.3983 -15.3737 -15.3737 -13.7142 -13.7142 -13.6761 -13.6761 -13.6181 -13.6181 -13.5988 -13.5988 2.0687 2.0687 2.6832 2.6832 5.6121 5.6121 5.7646 5.7646 7.8694 7.8694 8.5904 8.5904 10.2303 10.2303 10.3768 10.3768 10.5423 10.5423 10.5995 10.5995 11.0143 11.0143 11.7406 11.7406 13.2296 13.2296 13.9534 13.9534 14.0344 14.0344 14.4650 14.4650 k =-0.5000 0.1260 0.6270 ( 3584 PWs) bands (ev): -36.0568 -36.0568 -36.0491 -36.0491 -15.3974 -15.3974 -15.3715 -15.3715 -13.7122 -13.7122 -13.6716 -13.6716 -13.6182 -13.6182 -13.5984 -13.5984 1.9962 1.9962 2.6065 2.6065 5.7541 5.7541 5.8237 5.8237 7.8730 7.8730 8.5471 8.5471 10.2659 10.2659 10.3967 10.3967 10.4815 10.4815 10.6583 10.6583 11.0853 11.0853 11.7269 11.7269 13.2990 13.2990 13.8675 13.8675 13.9588 13.9588 14.5759 14.5759 k =-0.5000 0.1260 0.6028 ( 3584 PWs) bands (ev): -36.0573 -36.0573 -36.0492 -36.0492 -15.3966 -15.3966 -15.3693 -15.3693 -13.7102 -13.7102 -13.6670 -13.6670 -13.6181 -13.6181 -13.5980 -13.5980 1.9263 1.9263 2.5322 2.5322 5.8709 5.8709 5.8992 5.8992 7.8896 7.8896 8.5054 8.5054 10.2919 10.2919 10.3990 10.3990 10.4419 10.4419 10.7145 10.7145 11.1595 11.1595 11.7212 11.7212 13.3643 13.3643 13.7859 13.7859 13.8878 13.8878 14.6834 14.6834 k =-0.5000 0.1260 0.5787 ( 3578 PWs) bands (ev): -36.0579 -36.0579 -36.0494 -36.0494 -15.3957 -15.3957 -15.3671 -15.3671 -13.7083 -13.7083 -13.6625 -13.6625 -13.6179 -13.6179 -13.5976 -13.5976 1.8589 1.8589 2.4603 2.4603 5.9104 5.9104 6.0425 6.0425 7.9196 7.9196 8.4653 8.4653 10.3081 10.3081 10.3516 10.3516 10.4557 10.4557 10.7673 10.7673 11.2369 11.2369 11.7229 11.7229 13.4251 13.4251 13.7093 13.7093 13.8228 13.8228 14.6776 14.6776 k =-0.5000 0.1260 0.5546 ( 3586 PWs) bands (ev): -36.0584 -36.0584 -36.0496 -36.0496 -15.3947 -15.3947 -15.3649 -15.3649 -13.7064 -13.7064 -13.6580 -13.6580 -13.6174 -13.6174 -13.5972 -13.5972 1.7941 1.7941 2.3908 2.3908 5.9388 5.9388 6.1873 6.1873 7.9628 7.9628 8.4272 8.4272 10.2947 10.2947 10.3174 10.3174 10.4803 10.4803 10.8162 10.8162 11.3174 11.3174 11.7308 11.7308 13.4809 13.4809 13.6384 13.6384 13.7646 13.7646 14.6366 14.6366 k =-0.5000 0.1260 0.5305 ( 3590 PWs) bands (ev): -36.0590 -36.0590 -36.0498 -36.0498 -15.3938 -15.3938 -15.3627 -15.3627 -13.7047 -13.7047 -13.6536 -13.6536 -13.6168 -13.6168 -13.5966 -13.5966 1.7319 1.7319 2.3239 2.3239 5.9573 5.9573 6.3325 6.3325 8.0186 8.0186 8.3912 8.3912 10.2416 10.2416 10.3159 10.3159 10.5072 10.5072 10.8607 10.8607 11.4011 11.4011 11.7431 11.7431 13.5272 13.5272 13.5780 13.5780 13.7142 13.7142 14.5967 14.5967 k =-0.5000 0.1260 0.5064 ( 3584 PWs) bands (ev): -36.0595 -36.0595 -36.0500 -36.0500 -15.3928 -15.3928 -15.3606 -15.3606 -13.7030 -13.7030 -13.6493 -13.6493 -13.6159 -13.6159 -13.5960 -13.5960 1.6723 1.6723 2.2596 2.2596 5.9670 5.9670 6.4777 6.4777 8.0860 8.0860 8.3578 8.3578 10.1896 10.1896 10.3082 10.3082 10.5352 10.5352 10.9001 10.9001 11.4879 11.4879 11.7580 11.7580 13.5049 13.5049 13.5873 13.5873 13.6722 13.6722 14.5586 14.5586 k =-0.5000 0.1260 0.4823 ( 3592 PWs) bands (ev): -36.0601 -36.0601 -36.0502 -36.0502 -15.3919 -15.3919 -15.3584 -15.3584 -13.7014 -13.7014 -13.6452 -13.6452 -13.6148 -13.6148 -13.5952 -13.5952 1.6154 1.6154 2.1979 2.1979 5.9689 5.9689 6.6224 6.6224 8.1637 8.1637 8.3273 8.3273 10.1398 10.1398 10.2947 10.2947 10.5641 10.5641 10.9339 10.9339 11.5776 11.5776 11.7734 11.7734 13.4529 13.4529 13.6244 13.6244 13.6424 13.6424 14.5225 14.5225 k =-0.5000 0.1260 0.4582 ( 3584 PWs) bands (ev): -36.0606 -36.0606 -36.0504 -36.0504 -15.3909 -15.3909 -15.3564 -15.3564 -13.7000 -13.7000 -13.6413 -13.6413 -13.6136 -13.6136 -13.5943 -13.5943 1.5610 1.5610 2.1389 2.1389 5.9642 5.9642 6.7658 6.7658 8.2488 8.2488 8.3019 8.3019 10.0922 10.0922 10.2766 10.2766 10.5936 10.5936 10.9618 10.9618 11.6701 11.6701 11.7877 11.7877 13.4054 13.4054 13.6120 13.6120 13.6687 13.6687 14.4885 14.4885 k =-0.5000 0.1260 0.4340 ( 3588 PWs) bands (ev): -36.0611 -36.0611 -36.0506 -36.0506 -15.3899 -15.3899 -15.3543 -15.3543 -13.6988 -13.6988 -13.6377 -13.6377 -13.6121 -13.6121 -13.5931 -13.5931 1.5094 1.5094 2.0826 2.0826 5.9543 5.9543 6.9072 6.9072 8.2735 8.2735 8.3486 8.3486 10.0469 10.0469 10.2553 10.2553 10.6234 10.6234 10.9833 10.9833 11.7625 11.7625 11.8014 11.8014 13.3636 13.3636 13.5971 13.5971 13.7029 13.7029 14.4565 14.4565 k =-0.5000 0.1260 0.4099 ( 3584 PWs) bands (ev): -36.0615 -36.0615 -36.0508 -36.0508 -15.3890 -15.3890 -15.3524 -15.3524 -13.6976 -13.6976 -13.6344 -13.6344 -13.6106 -13.6106 -13.5918 -13.5918 1.4604 1.4604 2.0291 2.0291 5.9403 5.9403 7.0453 7.0453 8.2565 8.2565 8.4486 8.4486 10.0040 10.0040 10.2317 10.2317 10.6533 10.6533 10.9983 10.9983 11.7993 11.7993 11.8688 11.8688 13.3276 13.3276 13.5909 13.5909 13.7337 13.7337 14.4267 14.4267 k =-0.5000 0.1260 0.3858 ( 3582 PWs) bands (ev): -36.0620 -36.0620 -36.0510 -36.0510 -15.3881 -15.3881 -15.3505 -15.3505 -13.6967 -13.6967 -13.6315 -13.6315 -13.6089 -13.6089 -13.5902 -13.5902 1.4141 1.4141 1.9784 1.9784 5.9232 5.9232 7.1784 7.1784 8.2450 8.2450 8.5546 8.5546 9.9634 9.9634 10.2067 10.2067 10.6831 10.6831 11.0067 11.0067 11.7999 11.7999 11.9690 11.9690 13.2967 13.2967 13.5935 13.5935 13.7610 13.7610 14.3990 14.3990 k =-0.5000 0.1260 0.3617 ( 3592 PWs) bands (ev): -36.0625 -36.0625 -36.0513 -36.0513 -15.3872 -15.3872 -15.3487 -15.3487 -13.6959 -13.6959 -13.6288 -13.6288 -13.6073 -13.6073 -13.5883 -13.5883 1.3705 1.3705 1.9305 1.9305 5.9039 5.9039 7.3039 7.3039 8.2421 8.2421 8.6648 8.6648 9.9252 9.9252 10.1811 10.1811 10.7126 10.7126 11.0085 11.0085 11.7925 11.7925 12.0729 12.0729 13.2702 13.2702 13.6044 13.6044 13.7849 13.7849 14.3734 14.3734 k =-0.5000 0.1260 0.3376 ( 3596 PWs) bands (ev): -36.0630 -36.0630 -36.0515 -36.0515 -15.3863 -15.3863 -15.3469 -15.3469 -13.6952 -13.6952 -13.6265 -13.6265 -13.6056 -13.6056 -13.5862 -13.5862 1.3297 1.3297 1.8855 1.8855 5.8833 5.8833 7.4186 7.4186 8.2508 8.2508 8.7780 8.7780 9.8895 9.8895 10.1556 10.1556 10.7415 10.7415 11.0040 11.0040 11.7774 11.7774 12.1797 12.1797 13.2470 13.2470 13.6230 13.6230 13.8057 13.8057 14.3500 14.3500 k =-0.5000 0.1260 0.3135 ( 3596 PWs) bands (ev): -36.0634 -36.0634 -36.0517 -36.0517 -15.3855 -15.3855 -15.3453 -15.3453 -13.6947 -13.6947 -13.6246 -13.6246 -13.6039 -13.6039 -13.5839 -13.5839 1.2916 1.2916 1.8434 1.8434 5.8621 5.8621 7.5182 7.5182 8.2750 8.2750 8.8931 8.8931 9.8561 9.8561 10.1308 10.1308 10.7696 10.7696 10.9934 10.9934 11.7545 11.7545 12.2890 12.2890 13.2259 13.2259 13.6485 13.6485 13.8237 13.8237 14.3287 14.3287 k =-0.5000 0.1260 0.2894 ( 3594 PWs) bands (ev): -36.0638 -36.0638 -36.0519 -36.0519 -15.3847 -15.3847 -15.3438 -15.3438 -13.6942 -13.6942 -13.6229 -13.6229 -13.6022 -13.6022 -13.5815 -13.5815 1.2562 1.2562 1.8044 1.8044 5.8408 5.8408 7.5988 7.5988 8.3180 8.3180 9.0093 9.0093 9.8252 9.8252 10.1073 10.1073 10.7968 10.7968 10.9770 10.9770 11.7242 11.7242 12.4006 12.4006 13.2058 13.2058 13.6797 13.6797 13.8390 13.8390 14.3094 14.3094 k =-0.5000 0.1260 0.2653 ( 3590 PWs) bands (ev): -36.0641 -36.0641 -36.0520 -36.0520 -15.3840 -15.3840 -15.3423 -15.3423 -13.6939 -13.6939 -13.6215 -13.6215 -13.6006 -13.6006 -13.5789 -13.5789 1.2237 1.2237 1.7683 1.7683 5.8198 5.8198 7.6585 7.6585 8.3810 8.3810 9.1257 9.1257 9.7967 9.7967 10.0856 10.0856 10.8227 10.8227 10.9553 10.9553 11.6868 11.6868 12.5142 12.5142 13.1857 13.1857 13.7155 13.7155 13.8520 13.8520 14.2921 14.2921 k =-0.5000 0.1260 0.2411 ( 3592 PWs) bands (ev): -36.0645 -36.0645 -36.0522 -36.0522 -15.3833 -15.3833 -15.3410 -15.3410 -13.6937 -13.6937 -13.6204 -13.6204 -13.5990 -13.5990 -13.5764 -13.5764 1.1939 1.1939 1.7352 1.7352 5.7997 5.7997 7.6988 7.6988 8.4616 8.4616 9.2414 9.2414 9.7707 9.7707 10.0660 10.0660 10.8471 10.8471 10.9287 10.9287 11.6429 11.6429 12.6296 12.6296 13.1650 13.1650 13.7547 13.7547 13.8631 13.8631 14.2768 14.2768 k =-0.5000 0.1260 0.2170 ( 3594 PWs) bands (ev): -36.0648 -36.0648 -36.0524 -36.0524 -15.3826 -15.3826 -15.3398 -15.3398 -13.6935 -13.6935 -13.6194 -13.6194 -13.5975 -13.5975 -13.5740 -13.5740 1.1669 1.1669 1.7052 1.7052 5.7806 5.7806 7.7238 7.7238 8.5548 8.5548 9.3556 9.3556 9.7471 9.7471 10.0490 10.0490 10.8696 10.8696 10.8978 10.8978 11.5932 11.5932 12.7462 12.7462 13.1434 13.1434 13.7956 13.7956 13.8726 13.8726 14.2633 14.2633 k =-0.5000 0.1260 0.1929 ( 3598 PWs) bands (ev): -36.0651 -36.0651 -36.0525 -36.0525 -15.3821 -15.3821 -15.3387 -15.3387 -13.6934 -13.6934 -13.6187 -13.6187 -13.5960 -13.5960 -13.5717 -13.5717 1.1427 1.1427 1.6782 1.6782 5.7629 5.7629 7.7380 7.7380 8.6545 8.6545 9.4674 9.4674 9.7260 9.7260 10.0351 10.0351 10.8612 10.8612 10.8917 10.8917 11.5389 11.5389 12.8635 12.8635 13.1211 13.1211 13.8352 13.8352 13.8823 13.8823 14.2517 14.2517 k =-0.5000 0.1260 0.1688 ( 3598 PWs) bands (ev): -36.0653 -36.0653 -36.0527 -36.0527 -15.3816 -15.3816 -15.3377 -15.3377 -13.6933 -13.6933 -13.6181 -13.6181 -13.5947 -13.5947 -13.5696 -13.5696 1.1213 1.1213 1.6544 1.6544 5.7469 5.7469 7.7453 7.7453 8.7555 8.7555 9.5759 9.5759 9.7074 9.7074 10.0246 10.0246 10.8223 10.8223 10.9104 10.9104 11.4811 11.4811 12.9807 12.9807 13.0987 13.0987 13.8645 13.8645 13.9002 13.9002 14.2417 14.2417 k =-0.5000 0.1260 0.1447 ( 3590 PWs) bands (ev): -36.0655 -36.0655 -36.0528 -36.0528 -15.3811 -15.3811 -15.3368 -15.3368 -13.6933 -13.6933 -13.6176 -13.6176 -13.5934 -13.5934 -13.5676 -13.5676 1.1028 1.1028 1.6337 1.6337 5.7326 5.7326 7.7483 7.7483 8.8530 8.8530 9.6792 9.6792 9.6921 9.6921 10.0177 10.0177 10.7799 10.7799 10.9272 10.9272 11.4217 11.4217 13.0742 13.0742 13.0994 13.0994 13.8748 13.8748 13.9333 13.9333 14.2334 14.2334 k =-0.5000 0.1260 0.1206 ( 3590 PWs) bands (ev): -36.0657 -36.0657 -36.0529 -36.0529 -15.3807 -15.3807 -15.3361 -15.3361 -13.6932 -13.6932 -13.6172 -13.6172 -13.5924 -13.5924 -13.5660 -13.5660 1.0871 1.0871 1.6162 1.6162 5.7203 5.7203 7.7489 7.7489 8.9432 8.9432 9.6773 9.6773 9.7788 9.7788 10.0146 10.0146 10.7348 10.7348 10.9417 10.9417 11.3628 11.3628 13.0553 13.0553 13.2113 13.2113 13.8765 13.8765 13.9694 13.9694 14.2267 14.2267 k =-0.5000 0.1260 0.0965 ( 3594 PWs) bands (ev): -36.0659 -36.0659 -36.0530 -36.0530 -15.3804 -15.3804 -15.3355 -15.3355 -13.6932 -13.6932 -13.6170 -13.6170 -13.5915 -13.5915 -13.5646 -13.5646 1.0742 1.0742 1.6018 1.6018 5.7101 5.7101 7.7482 7.7482 9.0223 9.0223 9.6662 9.6662 9.8697 9.8697 10.0151 10.0151 10.6885 10.6885 10.9537 10.9537 11.3072 11.3072 13.0372 13.0372 13.3196 13.3196 13.8739 13.8739 14.0026 14.0026 14.2214 14.2214 k =-0.5000 0.1260 0.0723 ( 3590 PWs) bands (ev): -36.0660 -36.0660 -36.0530 -36.0530 -15.3802 -15.3802 -15.3350 -15.3350 -13.6932 -13.6932 -13.6167 -13.6167 -13.5908 -13.5908 -13.5634 -13.5634 1.0642 1.0642 1.5906 1.5906 5.7020 5.7020 7.7470 7.7470 9.0873 9.0873 9.6575 9.6575 9.9506 9.9506 10.0182 10.0182 10.6430 10.6430 10.9633 10.9633 11.2581 11.2581 13.0222 13.0222 13.4193 13.4193 13.8673 13.8673 14.0305 14.0305 14.2175 14.2175 k =-0.5000 0.1260 0.0482 ( 3588 PWs) bands (ev): -36.0660 -36.0660 -36.0531 -36.0531 -15.3800 -15.3800 -15.3347 -15.3347 -13.6932 -13.6932 -13.6166 -13.6166 -13.5902 -13.5902 -13.5626 -13.5626 1.0570 1.0570 1.5826 1.5826 5.6962 5.6962 7.7459 7.7459 9.1356 9.1356 9.6513 9.6513 10.0167 10.0167 10.0230 10.0230 10.6022 10.6022 10.9701 10.9701 11.2193 11.2193 13.0110 13.0110 13.5044 13.5044 13.8568 13.8568 14.0516 14.0516 14.2148 14.2148 k =-0.5000 0.1260 0.0241 ( 3590 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3799 -15.3799 -15.3345 -15.3345 -13.6932 -13.6932 -13.6165 -13.6165 -13.5899 -13.5899 -13.5621 -13.5621 1.0527 1.0527 1.5778 1.5778 5.6927 5.6927 7.7450 7.7450 9.1652 9.1652 9.6475 9.6475 10.0262 10.0262 10.0626 10.0626 10.5723 10.5723 10.9743 10.9743 11.1943 11.1943 13.0040 13.0040 13.5652 13.5652 13.8452 13.8452 14.0647 14.0647 14.2134 14.2134 k =-0.5000 0.1260-0.0000 ( 3582 PWs) bands (ev): -36.0661 -36.0661 -36.0531 -36.0531 -15.3798 -15.3798 -15.3344 -15.3344 -13.6932 -13.6932 -13.6165 -13.6165 -13.5898 -13.5898 -13.5620 -13.5620 1.0513 1.0513 1.5762 1.5762 5.6916 5.6916 7.7448 7.7448 9.1752 9.1752 9.6463 9.6463 10.0277 10.0277 10.0790 10.0790 10.5610 10.5610 10.9757 10.9757 11.1856 11.1856 13.0017 13.0017 13.5883 13.5883 13.8394 13.8394 14.0691 14.0691 14.2129 14.2129 k = 0.0000 0.0000 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3996 -15.3996 -15.3996 -15.3996 -13.7236 -13.7236 -13.7236 -13.7236 -13.6098 -13.6098 -13.6098 -13.6098 3.3312 3.3312 3.3312 3.3312 4.6752 4.6752 4.6752 4.6752 7.6566 7.6566 7.6566 7.6566 10.1373 10.1373 10.1373 10.1373 10.6769 10.6769 10.6769 10.6769 12.5233 12.5233 12.5233 12.5233 13.0067 13.0067 13.0067 13.0067 14.4235 14.4235 14.4235 14.4235 k =-0.0227 0.0057 1.0369 ( 3576 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3996 -15.3996 -15.3996 -15.3996 -13.7236 -13.7236 -13.7236 -13.7236 -13.6098 -13.6098 -13.6098 -13.6098 3.3320 3.3320 3.3320 3.3320 4.6728 4.6728 4.6728 4.6728 7.6608 7.6608 7.6608 7.6608 10.1381 10.1381 10.1381 10.1381 10.6734 10.6734 10.6734 10.6734 12.5186 12.5186 12.5186 12.5186 13.0043 13.0043 13.0043 13.0043 14.4302 14.4302 14.4302 14.4302 k =-0.0455 0.0115 1.0369 ( 3574 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3996 -15.3996 -15.3996 -15.3996 -13.7236 -13.7236 -13.7236 -13.7236 -13.6097 -13.6097 -13.6097 -13.6097 3.3343 3.3343 3.3343 3.3343 4.6658 4.6658 4.6658 4.6658 7.6734 7.6734 7.6734 7.6734 10.1404 10.1404 10.1404 10.1404 10.6631 10.6631 10.6631 10.6631 12.5046 12.5046 12.5046 12.5046 12.9973 12.9973 12.9973 12.9973 14.4501 14.4501 14.4501 14.4501 k =-0.0682 0.0172 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7237 -13.7237 -13.7237 -13.7237 -13.6097 -13.6097 -13.6097 -13.6097 3.3383 3.3383 3.3383 3.3383 4.6544 4.6544 4.6544 4.6544 7.6942 7.6942 7.6942 7.6942 10.1441 10.1441 10.1441 10.1441 10.6459 10.6459 10.6459 10.6459 12.4820 12.4820 12.4820 12.4820 12.9861 12.9861 12.9861 12.9861 14.4825 14.4825 14.4825 14.4825 k =-0.0909 0.0229 1.0369 ( 3582 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7237 -13.7237 -13.7237 -13.7237 -13.6096 -13.6096 -13.6096 -13.6096 3.3439 3.3439 3.3439 3.3439 4.6386 4.6386 4.6386 4.6386 7.7229 7.7229 7.7229 7.7229 10.1493 10.1493 10.1493 10.1493 10.6219 10.6219 10.6219 10.6219 12.4520 12.4520 12.4520 12.4520 12.9715 12.9715 12.9715 12.9715 14.5262 14.5262 14.5262 14.5262 k =-0.1136 0.0286 1.0369 ( 3582 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7238 -13.7238 -13.7238 -13.7238 -13.6095 -13.6095 -13.6095 -13.6095 3.3509 3.3509 3.3509 3.3509 4.6190 4.6190 4.6190 4.6190 7.7592 7.7592 7.7592 7.7592 10.1560 10.1560 10.1560 10.1560 10.5911 10.5911 10.5911 10.5911 12.4156 12.4156 12.4156 12.4156 12.9543 12.9543 12.9543 12.9543 14.5800 14.5800 14.5800 14.5800 k =-0.1364 0.0344 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7239 -13.7239 -13.7239 -13.7239 -13.6093 -13.6093 -13.6093 -13.6093 3.3594 3.3594 3.3594 3.3594 4.5960 4.5960 4.5960 4.5960 7.8025 7.8025 7.8025 7.8025 10.1639 10.1639 10.1639 10.1639 10.5538 10.5538 10.5538 10.5538 12.3743 12.3743 12.3743 12.3743 12.9353 12.9353 12.9353 12.9353 14.6425 14.6425 14.6425 14.6425 k =-0.1591 0.0401 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7241 -13.7241 -13.7241 -13.7241 -13.6092 -13.6092 -13.6092 -13.6092 3.3694 3.3694 3.3694 3.3694 4.5699 4.5699 4.5699 4.5699 7.8525 7.8525 7.8525 7.8525 10.1730 10.1730 10.1730 10.1730 10.5102 10.5102 10.5102 10.5102 12.3293 12.3293 12.3293 12.3293 12.9155 12.9155 12.9155 12.9155 14.7121 14.7121 14.7121 14.7121 k =-0.1818 0.0458 1.0369 ( 3574 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7242 -13.7242 -13.7242 -13.7242 -13.6090 -13.6090 -13.6090 -13.6090 3.3806 3.3806 3.3806 3.3806 4.5414 4.5414 4.5414 4.5414 7.9085 7.9085 7.9085 7.9085 10.1833 10.1833 10.1833 10.1833 10.4604 10.4604 10.4604 10.4604 12.2818 12.2818 12.2818 12.2818 12.8956 12.8956 12.8956 12.8956 14.7875 14.7875 14.7875 14.7875 k =-0.2045 0.0516 1.0369 ( 3576 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7244 -13.7244 -13.7244 -13.7244 -13.6088 -13.6088 -13.6088 -13.6088 3.3931 3.3931 3.3931 3.3931 4.5108 4.5108 4.5108 4.5108 7.9700 7.9700 7.9700 7.9700 10.1944 10.1944 10.1944 10.1944 10.4049 10.4049 10.4049 10.4049 12.2330 12.2330 12.2330 12.2330 12.8762 12.8762 12.8762 12.8762 14.8669 14.8669 14.8669 14.8669 k =-0.2273 0.0573 1.0369 ( 3570 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3997 -15.3997 -15.3997 -15.3997 -13.7245 -13.7245 -13.7245 -13.7245 -13.6087 -13.6087 -13.6087 -13.6087 3.4068 3.4068 3.4068 3.4068 4.4788 4.4788 4.4788 4.4788 8.0364 8.0364 8.0364 8.0364 10.2063 10.2063 10.2063 10.2063 10.3441 10.3441 10.3441 10.3441 12.1837 12.1837 12.1837 12.1837 12.8581 12.8581 12.8581 12.8581 14.9465 14.9465 14.9465 14.9465 k =-0.2500 0.0630 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7247 -13.7247 -13.7247 -13.7247 -13.6085 -13.6085 -13.6085 -13.6085 3.4213 3.4213 3.4213 3.4213 4.4459 4.4459 4.4459 4.4459 8.1070 8.1070 8.1070 8.1070 10.2184 10.2184 10.2184 10.2184 10.2788 10.2788 10.2788 10.2788 12.1349 12.1349 12.1349 12.1349 12.8413 12.8413 12.8413 12.8413 14.9859 14.9859 14.9859 14.9859 k =-0.2727 0.0687 1.0369 ( 3584 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7248 -13.7248 -13.7248 -13.7248 -13.6083 -13.6083 -13.6083 -13.6083 3.4367 3.4367 3.4367 3.4367 4.4126 4.4126 4.4126 4.4126 8.1812 8.1812 8.1812 8.1812 10.2062 10.2062 10.2062 10.2062 10.2340 10.2340 10.2340 10.2340 12.0875 12.0875 12.0875 12.0875 12.8263 12.8263 12.8263 12.8263 14.9959 14.9959 14.9959 14.9959 k =-0.2955 0.0745 1.0369 ( 3588 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7250 -13.7250 -13.7250 -13.7250 -13.6081 -13.6081 -13.6081 -13.6081 3.4525 3.4525 3.4525 3.4525 4.3795 4.3795 4.3795 4.3795 8.2582 8.2582 8.2582 8.2582 10.1341 10.1341 10.1341 10.1341 10.2457 10.2457 10.2457 10.2457 12.0420 12.0420 12.0420 12.0420 12.8132 12.8132 12.8132 12.8132 15.0011 15.0011 15.0011 15.0011 k =-0.3182 0.0802 1.0369 ( 3594 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7251 -13.7251 -13.7251 -13.7251 -13.6079 -13.6079 -13.6079 -13.6079 3.4687 3.4687 3.4687 3.4687 4.3472 4.3472 4.3472 4.3472 8.3372 8.3372 8.3372 8.3372 10.0581 10.0581 10.0581 10.0581 10.2584 10.2584 10.2584 10.2584 11.9993 11.9993 11.9993 11.9993 12.8018 12.8018 12.8018 12.8018 15.0029 15.0029 15.0029 15.0029 k =-0.3409 0.0859 1.0369 ( 3590 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7252 -13.7252 -13.7252 -13.7252 -13.6078 -13.6078 -13.6078 -13.6078 3.4848 3.4848 3.4848 3.4848 4.3163 4.3163 4.3163 4.3163 8.4173 8.4173 8.4173 8.4173 9.9803 9.9803 9.9803 9.9803 10.2708 10.2708 10.2708 10.2708 11.9598 11.9598 11.9598 11.9598 12.7923 12.7923 12.7923 12.7923 15.0022 15.0022 15.0022 15.0022 k =-0.3636 0.0916 1.0369 ( 3594 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7254 -13.7254 -13.7254 -13.7254 -13.6076 -13.6076 -13.6076 -13.6076 3.5004 3.5004 3.5004 3.5004 4.2873 4.2873 4.2873 4.2873 8.4972 8.4972 8.4972 8.4972 9.9022 9.9022 9.9022 9.9022 10.2825 10.2825 10.2825 10.2825 11.9243 11.9243 11.9243 11.9243 12.7845 12.7845 12.7845 12.7845 14.9998 14.9998 14.9998 14.9998 k =-0.3864 0.0974 1.0369 ( 3586 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7255 -13.7255 -13.7255 -13.7255 -13.6075 -13.6075 -13.6075 -13.6075 3.5150 3.5150 3.5150 3.5150 4.2611 4.2611 4.2611 4.2611 8.5753 8.5753 8.5753 8.5753 9.8254 9.8254 9.8254 9.8254 10.2931 10.2931 10.2931 10.2931 11.8932 11.8932 11.8932 11.8932 12.7782 12.7782 12.7782 12.7782 14.9963 14.9963 14.9963 14.9963 k =-0.4091 0.1031 1.0369 ( 3578 PWs) bands (ev): -36.0495 -36.0495 -36.0495 -36.0495 -15.3998 -15.3998 -15.3998 -15.3998 -13.7256 -13.7256 -13.7256 -13.7256 -13.6074 -13.6074 -13.6074 -13.6074 3.5281 3.5281 3.5281 3.5281 4.2383 4.2383 4.2383 4.2383 8.6494 8.6494 8.6494 8.6494 9.7522 9.7522 9.7522 9.7522 10.3023 10.3023 10.3023 10.3023 11.8670 11.8670 11.8670 11.8670 12.7733 12.7733 12.7733 12.7733 14.9924 14.9924 14.9924 14.9924 k =-0.4318 0.1088 1.0369 ( 3562 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3998 -15.3998 -15.3998 -15.3998 -13.7256 -13.7256 -13.7256 -13.7256 -13.6073 -13.6073 -13.6073 -13.6073 3.5392 3.5392 3.5392 3.5392 4.2195 4.2195 4.2195 4.2195 8.7162 8.7162 8.7162 8.7162 9.6860 9.6860 9.6860 9.6860 10.3098 10.3098 10.3098 10.3098 11.8461 11.8461 11.8461 11.8461 12.7697 12.7697 12.7697 12.7697 14.9888 14.9888 14.9888 14.9888 k =-0.4545 0.1146 1.0369 ( 3562 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3999 -15.3999 -15.3999 -15.3999 -13.7257 -13.7257 -13.7257 -13.7257 -13.6072 -13.6072 -13.6072 -13.6072 3.5477 3.5477 3.5477 3.5477 4.2055 4.2055 4.2055 4.2055 8.7711 8.7711 8.7711 8.7711 9.6315 9.6315 9.6315 9.6315 10.3154 10.3154 10.3154 10.3154 11.8309 11.8309 11.8309 11.8309 12.7672 12.7672 12.7672 12.7672 14.9858 14.9858 14.9858 14.9858 k =-0.4773 0.1203 1.0369 ( 3556 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3999 -15.3999 -15.3999 -15.3999 -13.7257 -13.7257 -13.7257 -13.7257 -13.6072 -13.6072 -13.6072 -13.6072 3.5530 3.5530 3.5530 3.5530 4.1969 4.1969 4.1969 4.1969 8.8081 8.8081 8.8081 8.8081 9.5947 9.5947 9.5947 9.5947 10.3188 10.3188 10.3188 10.3188 11.8217 11.8217 11.8217 11.8217 12.7657 12.7657 12.7657 12.7657 14.9839 14.9839 14.9839 14.9839 k =-0.5000 0.1260 1.0369 ( 3556 PWs) bands (ev): -36.0494 -36.0494 -36.0494 -36.0494 -15.3999 -15.3999 -15.3999 -15.3999 -13.7257 -13.7257 -13.7257 -13.7257 -13.6072 -13.6072 -13.6072 -13.6072 3.5548 3.5548 3.5548 3.5548 4.1939 4.1939 4.1939 4.1939 8.8213 8.8213 8.8213 8.8213 9.5816 9.5816 9.5816 9.5816 10.3200 10.3200 10.3200 10.3200 11.8186 11.8186 11.8186 11.8186 12.7653 12.7653 12.7653 12.7653 14.9832 14.9832 14.9832 14.9832 Writing output data file ZrSi2.save init_run : 3.77s CPU 13.16s WALL ( 1 calls) electrons : 860.96s CPU 872.17s WALL ( 1 calls) Called by init_run: wfcinit : 0.00s CPU 0.00s WALL ( 1 calls) potinit : 0.47s CPU 1.44s WALL ( 1 calls) Called by electrons: c_bands : 860.94s CPU 871.88s WALL ( 1 calls) v_of_rho : 0.21s CPU 0.81s WALL ( 1 calls) v_h : 0.00s CPU 0.02s WALL ( 1 calls) v_xc : 0.21s CPU 0.45s WALL ( 1 calls) newd : 0.23s CPU 0.44s WALL ( 1 calls) Called by c_bands: init_us_2 : 0.01s CPU 0.07s WALL ( 420 calls) cegterg : 728.21s CPU 732.87s WALL ( 984 calls) Called by sum_band: Called by *egterg: h_psi : 376.74s CPU 385.98s WALL ( 17447 calls) s_psi : 27.25s CPU 28.10s WALL ( 17447 calls) g_psi : 0.75s CPU 0.76s WALL ( 16043 calls) cdiaghg : 248.62s CPU 245.39s WALL ( 16463 calls) cegterg:over : 58.16s CPU 53.48s WALL ( 16043 calls) cegterg:upda : 10.43s CPU 14.84s WALL ( 16043 calls) cegterg:last : 9.79s CPU 10.88s WALL ( 2699 calls) Called by h_psi: h_psi:vloc : 315.94s CPU 324.17s WALL ( 17447 calls) h_psi:vnl : 60.49s CPU 61.04s WALL ( 17447 calls) add_vuspsi : 17.61s CPU 22.64s WALL ( 17447 calls) General routines calbec : 42.84s CPU 38.26s WALL ( 17447 calls) fft : 0.35s CPU 1.23s WALL ( 19 calls) ffts : 0.03s CPU 0.07s WALL ( 4 calls) fftw : 300.33s CPU 304.36s WALL ( 1536504 calls) interpolate : 0.06s CPU 0.14s WALL ( 4 calls) davcio : 0.04s CPU 6.46s WALL ( 840 calls) Parallel routines fft_scatter : 162.43s CPU 163.26s WALL ( 1536527 calls) PWSCF : 15m36.80s CPU 18m42.49s WALL This run was terminated on: 12:56:54 23Jul2015 =------------------------------------------------------------------------------= JOB DONE. =------------------------------------------------------------------------------=